A0A3Q0KSW8_SCHMA Loading...

Putative dead box ATP-dependent RNA helicase

AlphaFold DB , UniProt , Accession A0A3Q0KSW8, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,251 aa.

						>A0A3Q0KSW8_SCHMA|A0A3Q0KSW8
MSGIVGSTRGLGSKYGLGVSSLGSSSDVVQIRLQGDSYPSSDSLGLSGMDMFGGLSGYGVSSGVPYYVDSVGGSVSLGGGMLGFDDELGHSGLDNSELVQLLGGSQAIAQLSDSQLEELGRAQFTIVDPRTDSELANCPLSLSVEEDDRPLDEDEILCVTKAKCLDRVCVLSVPASGYTSINTSDLAKCINLRELDLSENALRVFPRRLHLPQLTKLSITGNRFIHLPLFEQFPKLVRLNLDDKLKQLLNPQMLVYFCPKLKYINGIYFEEMLTDFTVRIIQEARSIMEPIIRSKWETDFADQYPFVKSREERMSLIENMMEHIKERNLLIGEALNKYKDLLLFRCIDEFLRSLIYDATDRELLHAVNSLDTPKPITDAENSTNVTNTTTTTTDVTNELFVKSGESTANENHTLTETITNKMTDNYLTKSVDDDTAANDNDGDITGGATITTTTATITSQHENIDSLQLRTKLSACDLESDDIQDDDDDEAEEKEAAARAANECALFDAADELLGTHLPDLQLLAQSANQLQTTFFVDSMGRLHQQQVLLTPNGACQLGLQTNGLSNYQLHLGRSLRQGRSIVMTVVRPRGISGRPVAEFLPGELRNKDYVKGYMASEIYKKAVKDTLGQKTTPKKRTGTGKIRKSDQINTSAGERSWPGSTTSSTIPLGELNTEVGNTGAPTKRVTCTSNQMASSRTGSNRPSKVDFDVGEDAGGATGGLPPRPKKRKSMGMHRSLRDLCSDAPFSSDAYNNTTANTVVGGGPRSDATPIDYDPLHFIRCHAKDNDAGDSETKVWRCLFEPNPMRPDETTHVVATCGGECVCLINCETGKVMKRFKHMEEEFYTIAWTTVEVEGSKRTNILAAAGRMHEIRLLHPEQLVCYAEMKGHTEDVTAMIFHQTQSTILFSGDSKASVIVWDIGIPSVPDYKTRYQLLMRLRCPRLDVNPVLNLVFLPHYAYLIAGCEDGLFAWKITDLRLEKREREPDMELKLDFNHEVCIDALAQLSDNALVLKVVESGEIMVFDFASILERRKGLQRVVPIEMRGHLLWQKTDEIYINVSVRQNLGAVLCGDNEGSIWIYDLDPYLDDLHSSSRKRFHVKPIKILEWPECSVQGNRDEDQQLKESITSGFRNPVVNSVEMSSDGYYLAAVTDNNLVCIWRYAPPQQQQYSQIIQQTTTPSLHQTTTMQHNNNQLTAINNSMVTVPNVASIVDDDTSSSTIACMELLNNTNNSSIALKSSAIELVTTGQHLLE
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	30.1	Very low	28	Very low	241 Å²	241	142.2 Å²	142.2	100%	1.187	86%	0.862	S	S	*	*				0	-177.1	0	-74.1	-178.8	172.9	0	0	108.8
2	S	23.7	Very low	27.8	Very low	117 Å²	117	136.4 Å²	136.4	82%	0.818	85%	0.853	S	S	*	*			trans	-37.9	144.5	168.3	45.5	0	0	0	0	113.8
3	G	30.5	Very low	27.6	Very low	70 Å²	70	132.2 Å²	132.2	72%	0.722	83%	0.832	S	S	*	*			cis	104.8	97.2	12.3	0	0	0	0	0	111.7
4	I	28.2	Very low	27.6	Very low	161 Å²	161	137.8 Å²	137.8	83%	0.826	84%	0.838	S	S	*	*			trans	-171.7	116	171	-94.7	146.7	0	0	0	102.8
5	V	26.5	Very low	27.5	Very low	145 Å²	145	142.7 Å²	142.7	88%	0.879	84%	0.837	S	S	*	*				68.4	98.7	68.5	-179.1	0	0	0	0	112.8
6	G	29.1	Very low	27.3	Very low	80 Å²	80	138.1 Å²	138.1	83%	0.825	83%	0.83	S	S	*	*			trans	-170.1	129.7	171.1	0	0	0	0	0	110.2
7	S	26.8	Very low	27.4	Very low	111 Å²	111	139.2 Å²	139.2	78%	0.776	83%	0.829	S	S	*	*			trans	-136.1	120.8	-168.8	178.9	0	0	0	0	113.5
8	T	31.6	Very low	27.3	Very low	134 Å²	134	135.4 Å²	135.4	82%	0.822	82%	0.824	S	S	*	*			trans	-151.9	103	164.4	46.2	0	0	0	0	107.6
9	R	25.1	Very low	27.3	Very low	247 Å²	247	134.6 Å²	134.6	93%	0.932	82%	0.819	S	S	*	*				55.4	109.8	82.5	-77.5	-170.8	165.5	-167.1	-3.4	114.6
10	G	25.1	Very low	27.3	Very low	69 Å²	69	130.8 Å²	130.8	71%	0.711	80%	0.798	S	S	*	*			trans	144.3	128.4	157.6	0	0	0	0	0	113.9
11	L	31.6	Very low	27.3	Very low	189 Å²	189	130.1 Å²	130.1	99%	0.99	80%	0.799	S	S	*	*			trans	65.4	136.5	175.3	-48.3	172.7	0	0	0	115.6
12	G	25.7	Very low	27.3	Very low	73 Å²	73	121.5 Å²	121.5	75%	0.753	76%	0.757	S	S	*	*			cis	164.8	82.4	-6.8	0	0	0	0	0	113.2
13	S	24.6	Very low	27.4	Very low	82 Å²	82	118.4 Å²	118.4	57%	0.573	75%	0.745	S	S	*	*			trans	19	110	172.2	-153.7	0	0	0	0	119.5
14	K	28.2	Very low	27.4	Very low	210 Å²	210	117.6 Å²	117.6	91%	0.913	73%	0.727	S	S	*	*			trans	-160.7	83.7	145	-113.4	173.4	-175.3	-176	0	111
15	Y	25.4	Very low	27.6	Very low	211 Å²	211	110.7 Å²	110.7	83%	0.827	69%	0.693	S	S	*	*			trans	-109.7	124.3	157.2	-80.1	-87	0	0	0	106.4
16	G	25.2	Very low	27.7	Very low	70 Å²	70	104.8 Å²	104.8	72%	0.722	66%	0.659	S	S	*	*			trans	169.6	156.7	179.2	0	0	0	0	0	111.9
17	L	27.6	Very low	27.8	Very low	156 Å²	156	105 Å²	105	82%	0.817	64%	0.641	S	S	*	*			trans	63.9	60.1	176.2	-55.6	175.4	0	0	0	115.9	V19	L17-V19 HydrophobicContact CB-CG2 4.08Å; L17-V19 PolarHBondContact O-N 3.19Å
18	G	25.8	Very low	28.2	Very low	72 Å²	72	100.1 Å²	100.1	74%	0.742	61%	0.607	S	S	*	*			trans	-72	104.1	141	0	0	0	0	0	107.6	S20	G18-S20 PolarHBondContact O-N 3.48Å
19	V	28.6	Very low	28.2	Very low	119 Å²	119	96.3 Å²	96.3	72%	0.721	58%	0.583	S	S	*	*			trans	-84.1	110.3	-168.9	-178.4	0	0	0	0	110.4	L17	L17-V19 HydrophobicContact CB-CG2 4.08Å; L17-V19 PolarHBondContact O-N 3.19Å
20	S	27.3	Very low	28.7	Very low	58 Å²	58	87.3 Å²	87.3	41%	0.406	55%	0.552	S	S	.	*			trans	-68.3	132	165	-0.9	0	0	0	0	109	G18 L22	G18-S20 PolarHBondContact O-N 3.48Å; S20-L22 PolarHBondContact O-N 3.37Å
21	S	27.4	Very low	29.2	Very low	117 Å²	117	84.5 Å²	84.5	82%	0.818	52%	0.52	S	S	*	.			trans	-78.2	88.8	179.1	54.2	0	0	0	0	111	G23	S21-G23 PolarHBondContact O-N 2.91Å
22	L	28.3	Very low	29.3	Very low	60 Å²	60	83.7 Å²	83.7	31%	0.314	50%	0.504	S	S	.	.			trans	-85.4	104.2	171.9	-69.4	116.8	0	0	0	110.3	S20 F836 L879	S20-L22 PolarHBondContact O-N 3.37Å; L22-F836 HydrophobicContact CD2-CD1 3.88Å; L22-F836 HydrophobicContact CD2-CE1 3.76Å; L22-F836 HydrophobicContact CD2-CZ 4.45Å; L22-L879 HydrophobicContact CD1-CB 4.08Å; L22-L879 WeakPolarHBondContact CD1-O 3.29Å; L22-L879 HydrophobicContact CD2-CB 4.11Å; L22-L879 HydrophobicContact CD2-CD2 4.17Å
23	G	27.4	Very low	29.6	Very low	53 Å²	53	81.8 Å²	81.8	55%	0.546	48%	0.476	S	S	.	.			trans	-69.3	151.4	167.7	0	0	0	0	0	111.6	S21	S21-G23 PolarHBondContact O-N 2.91Å
24	S	30.4	Very low	29.9	Very low	52 Å²	52	84.7 Å²	84.7	36%	0.364	48%	0.481	S	S	.	.			trans	-62.5	151.5	168	-158.2	0	0	0	0	110.8	Q100	S24-Q100 WeakPolarHBondContact CB-O 3.11Å; S24-Q100 PolarHBondContact OG-O 2.85Å
25	S	32	Very low	29.9	Very low	16 Å²	16	77.8 Å²	77.8	11%	0.112	47%	0.469	C	S	.	.	S	Bend	trans	-100.4	97	-174.9	-167.8	0	0	0	0	110.9	K831 V832	S25-K831 WeakPolarHBondContact O-CE 3.26Å; S25-K831 PolarHBondContact O-NZ 3.46Å; S25-V832 WeakPolarHBondContact CB-O 3.46Å; S25-V832 PolarHBondContact OG-O 2.93Å
26	S	29.2	Very low	29.9	Very low	21 Å²	21	75.4 Å²	75.4	15%	0.147	47%	0.471	C	S	.	.			trans	-123.2	-36.8	174.4	46.5	0	0	0	0	112.3	V28	S26-V28 PolarHBondContact O-N 2.64Å
27	D	31.3	Very low	30.1	Very low	84 Å²	84	77 Å²	77	45%	0.449	47%	0.471	S	S	.	.			trans	-87.9	74.2	-164.4	-53.6	-3.5	0	0	0	111.2	N786 R835	D27-N786 HydrophobicContact CB-CB 4.45Å; D27-N786 VanDerWaalsContact CB-ND2 3.35Å; D27-N786 WeakPolarHBondContact CB-ND2 3.48Å; D27-N786 PolarHBondContact OD2-ND2 3.41Å; D27-R835 PolarHBondContact O-NH2 2.64Å
28	V	33.9	Very low	29.9	Very low	10 Å²	10	78.2 Å²	78.2	6%	0.061	47%	0.466	C	S	.	.			trans	-137.4	111.6	-174.1	178.1	0	0	0	0	110.3	S26 Q30 I779 C781 V832	S26-V28 PolarHBondContact O-N 2.64Å; V28-Q30 PolarHBondContact O-N 2.97Å; V28-Q30 VanDerWaalsContact O-N 3.12Å; V28-I779 HydrophobicContact CG1-CG2 3.28Å; V28-C781 HydrophobicContact CG1-CB 4.25Å; V28-V832 HydrophobicContact CB-CG2 4.41Å; V28-V832 HydrophobicContact CG1-CG2 3.79Å; V28-V832 HydrophobicContact CG2-CB 3.92Å; V28-V832 HydrophobicContact CG2-CG2 3.72Å
29	V	33.2	Very low	29.9	Very low	53 Å²	53	81.3 Å²	81.3	32%	0.321	47%	0.473	S	S	.	.			trans	-73	106.5	175.4	-176.3	0	0	0	0	109.7	I31 I779 R780 A788	V29-I31 HydrophobicContact CG1-CG1 4.29Å; V29-I779 WeakPolarHBondContact O-CA 3.21Å; V29-R780 PolarHBondContact O-N 3.15Å; V29-R780 VanDerWaalsContact O-N 3.11Å; V29-A788 HydrophobicContact CG2-CB 3.72Å
30	Q	34.3	Very low	29.9	Very low	59 Å²	59	80.2 Å²	80.2	28%	0.276	47%	0.471	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	114.6	173.8	-174	174.2	4.1	0	0	108.9	V28 N137 H777 T829	V28-Q30 PolarHBondContact O-N 2.97Å; V28-Q30 VanDerWaalsContact O-N 3.12Å; Q30-N137 PolarHBondContact OE1-ND2 2.85Å; Q30-H777 PolarHBondContact NE2-CE1 2.74Å; Q30-H777 VanDerWaalsContact NE2-CE1 3.33Å; Q30-H777 PolarHBondContact NE2-ND1 2.95Å; Q30-T829 PolarHBondContact NE2-O 2.84Å
31	I	36.7	Very low	29.8	Very low	9 Å²	9	82.7 Å²	82.7	5%	0.046	49%	0.488	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	125.3	-174.1	-60	142.6	0	0	0	108.5	V29 F778 R780 C1109 F1129 L1154	V29-I31 HydrophobicContact CG1-CG1 4.29Å; I31-F778 HydrophobicContact CB-CB 4.08Å; I31-F778 WeakPolarHBondContact CB-O 3.4Å; I31-F778 HydrophobicContact CD1-CB 4.37Å; I31-F778 PolarHBondContact N-O 3.04Å; I31-R780 HydrophobicContact CD1-CG 4.34Å; I31-C1109 HydrophobicContact CG2-CB 4.49Å; I31-F1129 HydrophobicContact CB-CZ 4.48Å; I31-F1129 HydrophobicContact CD1-CE1 3.48Å; I31-F1129 VanDerWaalsContact CD1-CE1 3.48Å; I31-F1129 HydrophobicContact CD1-CZ 3.56Å; I31-F1129 HydrophobicContact CG1-CE1 4.3Å; I31-F1129 HydrophobicContact CG1-CZ 3.87Å; I31-F1129 HydrophobicContact CG2-CE2 4.22Å; I31-F1129 HydrophobicContact CG2-CZ 3.84Å; I31-L1154 HydrophobicContact CD1-CD2 4Å
32	R	33.4	Very low	29.9	Very low	172 Å²	172	82.5 Å²	82.5	65%	0.649	48%	0.478	S	S	*	.	P	Polyproline II helix	trans	-88.5	131.7	-178.4	-155.3	171.5	-164.6	111.5	14.4	110.5	E134	R32-E134 IonicContact CZ-OE1 3.81Å; R32-E134 IonicContact CZ-OE2 2.7Å; R32-E134 IonicContact NH1-OE2 3.8Å; R32-E134 PolarHBondContact NH1-OE2 3.37Å; R32-E134 VanDerWaalsContact NH2-CD 3.28Å; R32-E134 IonicContact NH2-OE1 2.71Å; R32-E134 PolarHBondContact NH2-OE1 2.9Å; R32-E134 IonicContact NH2-OE2 2.89Å; R32-E134 PolarHBondContact NH2-OE2 3.15Å
33	L	32.3	Very low	29.7	Very low	33 Å²	33	84.5 Å²	84.5	17%	0.173	50%	0.496	C	S	.	.	B	Isolated β-bridge	trans	-90.9	149.4	-178.5	-62.6	136.5	0	0	0	111	P775 F778 P1107	L33-P775 VanDerWaalsContact CD1-C 3.49Å; L33-P775 HydrophobicContact CD1-CB 3.69Å; L33-P775 HydrophobicContact CD1-CG 4.19Å; L33-P775 HydrophobicContact CD2-CB 3.98Å; L33-P775 HydrophobicContact CD2-CG 4.21Å; L33-P775 HydrophobicContact CG-CB 4.4Å; L33-F778 HydrophobicContact CD1-CD2 3.78Å; L33-F778 HydrophobicContact CD1-CE2 4.12Å; L33-F778 HydrophobicContact CD2-CD2 3.92Å; L33-F778 HydrophobicContact CD2-CE2 3.96Å; L33-F778 HydrophobicContact CD2-CG 4.31Å; L33-F778 HydrophobicContact CD2-CZ 4.34Å; L33-F778 HydrophobicContact CG-CD2 4.23Å; L33-P1107 HydrophobicContact CD2-CB 3.79Å; L33-P1107 HydrophobicContact CD2-CG 3.58Å
34	Q	29.3	Very low	29.8	Very low	143 Å²	143	90.4 Å²	90.4	67%	0.668	52%	0.515	S	S	*	.	P	Polyproline II helix	trans	-98.4	133	160.8	-72.6	-171.6	-36.4	0	0	109.5
35	G	28.5	Very low	29.7	Very low	65 Å²	65	91.1 Å²	91.1	67%	0.67	53%	0.53	S	S	*	.			trans	-144.2	124.7	176.9	0	0	0	0	0	110.6	S37	G35-S37 PolarHBondContact O-N 2.94Å
36	D	25.4	Very low	29.6	Very low	161 Å²	161	97.9 Å²	97.9	86%	0.861	56%	0.564	S	S	*	*			trans	-68	120	179.9	-87.9	-37.1	0	0	0	111.3
37	S	29	Very low	29.6	Very low	104 Å²	104	102.4 Å²	102.4	73%	0.727	60%	0.596	S	S	*	*			trans	-119.7	111.8	173.6	-73.7	0	0	0	0	110.7	G35	G35-S37 PolarHBondContact O-N 2.94Å
38	Y	25.1	Very low	29.6	Very low	182 Å²	182	101.5 Å²	101.5	71%	0.714	61%	0.607	S	S	*	*			trans	-65.2	131.7	-175.2	-66.9	-99.9	0	0	0	112.4	S40	Y38-S40 PolarHBondContact O-N 2.87Å; Y38-S40 VanDerWaalsContact O-N 3.1Å
39	P	25.2	Very low	29.3	Very low	137 Å²	137	109.4 Å²	109.4	89%	0.89	65%	0.645	S	S	*	*			trans	-80.8	87.2	170.8	32.2	-33.2	0	0	0	110.7
40	S	27.5	Very low	29.2	Very low	96 Å²	96	112.6 Å²	112.6	67%	0.671	66%	0.66	S	S	*	*			trans	-97.3	118.3	168.3	46	0	0	0	0	110.9	Y38	Y38-S40 PolarHBondContact O-N 2.87Å; Y38-S40 VanDerWaalsContact O-N 3.1Å
41	S	26	Very low	29	Very low	110 Å²	110	116.1 Å²	116.1	77%	0.769	68%	0.679	S	S	*	*			trans	-88	130.2	-178.5	56.2	0	0	0	0	111.9
42	D	28.6	Very low	28.6	Very low	113 Å²	113	125.2 Å²	125.2	60%	0.604	72%	0.718	S	S	*	*			trans	-146.5	123.9	157.3	-98.2	-51.7	0	0	0	114.5	Q1167	D42-Q1167 PolarHBondContact OD1-NE2 3.35Å; D42-Q1167 WeakPolarHBondContact OD2-CG 3.37Å; D42-Q1167 PolarHBondContact OD2-NE2 3.47Å
43	S	25.5	Very low	28.3	Very low	101 Å²	101	120.6 Å²	120.6	71%	0.706	72%	0.724	S	S	*	*			trans	-127.9	136.3	163.9	61.9	0	0	0	0	107.1
44	L	28.8	Very low	28.3	Very low	177 Å²	177	122.2 Å²	122.2	93%	0.927	75%	0.749	S	S	*	*			trans	176.2	119.1	140.1	-98.5	161.2	0	0	0	114.2
45	G	29.3	Very low	28.3	Very low	67 Å²	67	123.5 Å²	123.5	69%	0.691	76%	0.759	S	S	*	*			trans	88	161.9	148.4	0	0	0	0	0	119
46	L	29.5	Very low	28.2	Very low	158 Å²	158	125.5 Å²	125.5	83%	0.827	76%	0.763	S	S	*	*			cis	-164.8	134.1	-4.9	-121	165.8	0	0	0	113.5
47	S	28.7	Very low	28.5	Very low	116 Å²	116	120.8 Å²	120.8	81%	0.811	75%	0.753	S	S	*	*			trans	64.7	144.5	149.4	60.8	0	0	0	0	123.3
48	G	30.4	Very low	28.4	Very low	66 Å²	66	127.4 Å²	127.4	68%	0.68	76%	0.763	S	S	*	*			trans	115.7	107.7	172.8	0	0	0	0	0	112.5
49	M	28	Very low	28.6	Very low	175 Å²	175	121.8 Å²	121.8	86%	0.862	76%	0.761	S	S	*	*			cis	54.4	127	39.3	-64.3	168.6	147.6	0	0	112.3
50	D	30.9	Very low	28.7	Very low	120 Å²	120	122.3 Å²	122.3	64%	0.642	76%	0.761	S	S	*	*			cis	-169.4	170.1	0.8	-108	-27	0	0	0	108.4
51	M	30	Very low	28.7	Very low	134 Å²	134	122 Å²	122	66%	0.66	76%	0.759	S	S	*	*			cis	-165.5	148.6	7.6	-134	-177.1	-75	0	0	110.9
52	F	30	Very low	28.7	Very low	199 Å²	199	122.2 Å²	122.2	87%	0.873	76%	0.76	S	S	*	*			trans	59.5	163	169.7	-69.6	-99.5	0	0	0	117.6
53	G	26.7	Very low	28.7	Very low	76 Å²	76	120.7 Å²	120.7	78%	0.784	77%	0.772	S	S	*	*			cis	140.7	104.3	-6.2	0	0	0	0	0	113.7
54	G	31	Very low	29	Very low	67 Å²	67	122.5 Å²	122.5	69%	0.691	78%	0.778	S	S	*	*			trans	167.7	117.9	175.3	0	0	0	0	0	111.6
55	L	29.6	Very low	29.2	Very low	169 Å²	169	118.1 Å²	118.1	89%	0.885	76%	0.761	S	S	*	*				63.7	93.8	80.8	-65.3	172.2	0	0	0	112.2
56	S	26.7	Very low	29.3	Very low	108 Å²	108	124.6 Å²	124.6	76%	0.755	77%	0.766	S	S	*	*				84.6	112.4	68.7	72	0	0	0	0	114.9
57	G	31.1	Very low	29.4	Very low	62 Å²	62	124.6 Å²	124.6	64%	0.639	76%	0.755	S	S	*	*			trans	170.8	114.8	172.2	0	0	0	0	0	108.7
58	Y	28.2	Very low	29.5	Very low	242 Å²	242	125.2 Å²	125.2	95%	0.949	75%	0.754	S	S	*	*				46.2	113.4	75.2	-61.3	-67.6	0	0	0	111.9
59	G	27.8	Very low	29.6	Very low	64 Å²	64	125.6 Å²	125.6	66%	0.66	74%	0.741	S	S	*	*			cis	153.5	-178.1	1.3	0	0	0	0	0	109.6
60	V	28.9	Very low	29.9	Very low	149 Å²	149	119.4 Å²	119.4	90%	0.903	72%	0.715	S	S	*	*			trans	69.2	144.2	166.4	-173.8	0	0	0	0	115.2
61	S	26.9	Very low	29.9	Very low	90 Å²	90	118.4 Å²	118.4	63%	0.629	71%	0.713	S	S	*	*			cis	-163.6	168	-31.7	61.9	0	0	0	0	110
62	S	26	Very low	30	Very low	113 Å²	113	113.6 Å²	113.6	79%	0.79	70%	0.697	S	S	*	*			trans	51.3	117.5	148.5	59.5	0	0	0	0	121.3
63	G	29.6	Very low	30	Very low	82 Å²	82	108.1 Å²	108.1	85%	0.845	70%	0.697	S	S	*	*			trans	-168.9	65.7	174.8	0	0	0	0	0	118
64	V	30.2	Very low	30.2	Very low	139 Å²	139	107.6 Å²	107.6	84%	0.842	68%	0.681	S	S	*	*			trans	-67.6	165	169	177.3	0	0	0	0	110.9
65	P	34.6	Very low	30.2	Very low	85 Å²	85	111.1 Å²	111.1	55%	0.552	69%	0.69	S	S	*	*			cis	-123.8	-163.8	8.6	13.7	16.3	0	0	0	114
66	Y	31.3	Very low	30.1	Very low	203 Å²	203	107.2 Å²	107.2	80%	0.796	68%	0.676	S	S	*	*			cis	-143.5	145.9	21.9	-71.1	-98	0	0	0	110.4
67	Y	31.5	Very low	30.2	Very low	157 Å²	157	110.2 Å²	110.2	62%	0.616	68%	0.683	S	S	*	*				59.1	122	68.9	-104.8	-92.5	0	0	0	114.4	L1249	Y67-L1249 HydrophobicContact CE1-CD2 4.45Å
68	V	31	Very low	30.2	Very low	130 Å²	130	110.9 Å²	110.9	79%	0.788	69%	0.689	S	S	*	*				177.9	140.6	85.3	155.9	0	0	0	0	106.4
69	D	31.4	Very low	30.3	Very low	73 Å²	73	103.6 Å²	103.6	39%	0.39	69%	0.688	S	S	.	*			cis	-167.2	163.5	-5.7	-145.5	74.3	0	0	0	110.9	H1248 L1249	D69-H1248 IonicContact OD2-ND1 3.61Å; D69-L1249 HydrophobicContact CB-CD2 4.46Å; D69-L1249 WeakPolarHBondContact OD2-CD2 3.27Å; D69-L1249 WeakPolarHBondContact OD2-CG 3.49Å
70	S	33.7	Very low	30.3	Very low	46 Å²	46	104.3 Å²	104.3	32%	0.322	70%	0.696	S	S	.	*			trans	58.7	133.3	148	-77.9	0	0	0	0	122.1	L1249	S70-L1249 VanDerWaalsContact N-CD2 3.32Å; S70-L1249 PolarHBondContact OG-N 3.03Å
71	V	32.3	Very low	30.2	Very low	98 Å²	98	105.6 Å²	105.6	59%	0.594	69%	0.694	S	S	*	*			cis	-152.1	151.1	15.5	178.5	0	0	0	0	107.7
72	G	30.9	Very low	30.3	Very low	33 Å²	33	109.4 Å²	109.4	34%	0.34	71%	0.706	S	S	.	*			cis	125.2	113.6	4.1	0	0	0	0	0	114.2	L1249	G72-L1249 VanDerWaalsContact CA-O 3.29Å; G72-L1249 WeakPolarHBondContact CA-O 3.32Å
73	G	30.7	Very low	30.4	Very low	85 Å²	85	107 Å²	107	88%	0.876	70%	0.7	S	S	*	*			trans	173.5	49.2	-179.3	0	0	0	0	0	118.2
74	S	30.1	Very low	30.3	Very low	64 Å²	64	113.3 Å²	113.3	45%	0.448	70%	0.704	S	S	.	*			trans	-103.1	143.9	-166.5	-175.9	0	0	0	0	115.6	E1251	S74-E1251 WeakPolarHBondContact CB-OE2 3.32Å; S74-E1251 PolarHBondContact OG-OE2 3.48Å
75	V	30.8	Very low	30.3	Very low	142 Å²	142	113.7 Å²	113.7	86%	0.861	70%	0.702	S	S	*	*			trans	-154.3	114.2	148.7	-156	0	0	0	0	106.7
76	S	27.9	Very low	30	Very low	86 Å²	86	117.1 Å²	117.1	60%	0.601	72%	0.715	S	S	*	*			cis	102.7	148.7	12.8	-156.4	0	0	0	0	115.8
77	L	30	Very low	29.9	Very low	172 Å²	172	116.8 Å²	116.8	90%	0.901	72%	0.721	S	S	*	*			trans	79.3	128.3	-177	-52.9	167.5	0	0	0	117
78	G	30.2	Very low	29.7	Very low	75 Å²	75	117 Å²	117	77%	0.773	73%	0.732	S	S	*	*			cis	161.3	153.8	-12.1	0	0	0	0	0	115.5
79	G	29.6	Very low	29.4	Very low	90 Å²	90	114 Å²	114	93%	0.928	73%	0.727	S	S	*	*			trans	86.3	153.1	173.2	0	0	0	0	0	115
80	G	28.7	Very low	29.3	Very low	79 Å²	79	119.4 Å²	119.4	81%	0.814	75%	0.75	S	S	*	*			cis	-167.3	157.7	-1.7	0	0	0	0	0	112.7
81	M	27.2	Very low	29	Very low	176 Å²	176	123.5 Å²	123.5	87%	0.867	78%	0.779	S	S	*	*			trans	-71.3	138.5	-174.4	174.4	178	66.5	0	0	113.9
82	L	28.5	Very low	29.2	Very low	170 Å²	170	121.2 Å²	121.2	89%	0.89	77%	0.774	S	S	*	*			trans	157.4	150.7	141.9	-86.7	166.7	0	0	0	110.7
83	G	27.8	Very low	29.8	Very low	63 Å²	63	120.8 Å²	120.8	65%	0.649	76%	0.764	S	S	*	*			trans	128.4	118.7	170.1	0	0	0	0	0	114.5
84	F	27.2	Very low	31	Very low	213 Å²	213	121 Å²	121	93%	0.934	75%	0.745	S	S	*	*			trans	-125.2	98.2	162.5	-116.3	-88.8	0	0	0	104.6
85	D	31.4	Very low	32.4	Very low	148 Å²	148	119.7 Å²	119.7	79%	0.791	73%	0.733	S	S	*	*			trans	-139.9	116.2	170.1	-60	-78.4	0	0	0	103.5
86	D	27	Very low	34	Very low	157 Å²	157	115.8 Å²	115.8	84%	0.84	71%	0.712	S	S	*	*				71.2	74.8	69.3	-142.3	35.7	0	0	0	112.2
87	E	30.7	Very low	35.6	Very low	196 Å²	196	116.5 Å²	116.5	92%	0.916	71%	0.706	S	S	*	*			trans	-149.3	133.7	152.7	-138.1	166.4	-153.3	0	0	111.8
88	L	26.2	Very low	37.3	Very low	162 Å²	162	108.6 Å²	108.6	85%	0.848	67%	0.665	S	S	*	*			trans	-108.7	130.1	-176.5	-88.3	153.6	0	0	0	110.2
89	G	25.3	Very low	39	Very low	67 Å²	67	106.2 Å²	106.2	69%	0.691	64%	0.635	S	S	*	*			trans	94.1	90	151.3	0	0	0	0	0	117.8
90	H	28.4	Very low	40.7	Very low	185 Å²	185	108.6 Å²	108.6	86%	0.856	62%	0.622	S	S	*	*			trans	-136.5	106.1	148.1	-79.5	-29.9	0	0	0	109.7	G92	H90-G92 PolarHBondContact O-N 2.88Å
91	S	27.5	Very low	42.2	Very low	133 Å²	133	108.3 Å²	108.3	93%	0.93	60%	0.602	S	S	*	*			trans	-94.9	80.9	177.4	52	0	0	0	0	110.6
92	G	38.2	Very low	44.1	Very low	49 Å²	49	101.7 Å²	101.7	51%	0.505	57%	0.57	S	S	.	*	S	Bend	trans	-157.8	154.3	175.1	0	0	0	0	0	111.1	H90	H90-G92 PolarHBondContact O-N 2.88Å
93	L	43.5	Very low	45.8	Very low	25 Å²	25	94.5 Å²	94.5	13%	0.131	54%	0.536	C	S	.	.			trans	-60.1	145.7	175.4	-68.9	159.7	0	0	0	110.4	E97 L98 L101 F124 I126	L93-E97 HydrophobicContact CD2-CB 3.71Å; L93-L98 HydrophobicContact CB-CB 3.84Å; L93-L98 HydrophobicContact CB-CD1 4.35Å; L93-L98 HydrophobicContact CB-CG 4.4Å; L93-L98 HydrophobicContact CD1-CB 3.71Å; L93-L98 HydrophobicContact CD1-CD1 4.21Å; L93-L98 HydrophobicContact CD1-CG 3.72Å; L93-L98 HydrophobicContact CG-CB 4.35Å; L93-L101 HydrophobicContact CD1-CD1 4.03Å; L93-L101 HydrophobicContact CD2-CD1 4.08Å; L93-F124 HydrophobicContact CD1-CB 3.72Å; L93-F124 HydrophobicContact CD1-CD1 4.32Å; L93-F124 HydrophobicContact CD1-CG 4.36Å; L93-I126 HydrophobicContact CB-CD1 4.35Å; L93-I126 HydrophobicContact CD1-CG1 4.46Å; L93-I126 HydrophobicContact CD2-CD1 3.45Å; L93-I126 VanDerWaalsContact CD2-CD1 3.45Å; L93-I126 HydrophobicContact CD2-CG1 3.61Å; L93-I126 HydrophobicContact CG-CD1 3.66Å; L93-I126 HydrophobicContact CG-CG1 3.58Å
94	D	55.1	Low	47.7	Very low	88 Å²	88	92.5 Å²	92.5	47%	0.471	52%	0.515	S	S	.	.			trans	-62.3	140.8	150.7	178.1	8.4	0	0	0	107.5	S96 E97 L98	D94-S96 PolarHBondContact O-N 3.37Å; D94-S96 PolarHBondContact OD1-N 2.78Å; D94-S96 VanDerWaalsContact OD1-N 3.16Å; D94-S96 WeakPolarHBondContact OD2-CB 3.43Å; D94-S96 PolarHBondContact OD2-OG 3.48Å; D94-E97 HydrophobicContact CB-CG 4.47Å; D94-E97 PolarHBondContact O-N 2.75Å; D94-L98 PolarHBondContact O-N 3.14Å
95	N	59.5	Low	49.5	Very low	37 Å²	37	85 Å²	85	20%	0.198	49%	0.49	C	S	.	.	H	α-helix	trans	-49.7	-28.7	170.8	-64.4	-18.6	0	0	0	111.6	V99 R223	N95-V99 WeakPolarHBondContact O-CB 3.38Å; N95-V99 WeakPolarHBondContact O-CG2 3.14Å; N95-V99 PolarHBondContact O-N 2.77Å; N95-R223 WeakPolarHBondContact ND2-CA 3.33Å; N95-R223 WeakPolarHBondContact ND2-CB 3.35Å; N95-R223 PolarHBondContact ND2-O 2.86Å
96	S	63.4	Low	51.2	Low	60 Å²	60	82.5 Å²	82.5	42%	0.42	47%	0.473	S	S	.	.	H	α-helix	trans	-63.6	-45.7	174	72	0	0	0	0	113.8	D94 Q100	D94-S96 PolarHBondContact O-N 3.37Å; D94-S96 PolarHBondContact OD1-N 2.78Å; D94-S96 VanDerWaalsContact OD1-N 3.16Å; D94-S96 WeakPolarHBondContact OD2-CB 3.43Å; D94-S96 PolarHBondContact OD2-OG 3.48Å; S96-Q100 PolarHBondContact O-N 3.18Å; S96-Q100 VanDerWaalsContact O-N 3.1Å
97	E	61.9	Low	53.1	Low	102 Å²	102	76.7 Å²	76.7	48%	0.477	45%	0.447	S	S	.	.	H	α-helix	trans	-69.4	-44.9	178	-60.2	179.5	135	0	0	110.7	L93 D94 V99 Q100 L101	L93-E97 HydrophobicContact CD2-CB 3.71Å; D94-E97 HydrophobicContact CB-CG 4.47Å; D94-E97 PolarHBondContact O-N 2.75Å; E97-V99 PolarHBondContact O-N 3.36Å; E97-Q100 PolarHBondContact O-N 2.69Å; E97-Q100 VanDerWaalsContact O-N 3.08Å; E97-L101 WeakPolarHBondContact O-CG 3Å; E97-L101 PolarHBondContact O-N 3.31Å
98	L	65.4	Low	54.9	Low	5 Å²	5	67.4 Å²	67.4	3%	0.026	40%	0.404	C	S	.	.	H	α-helix	trans	-57.2	-47	175.9	-162	169.3	0	0	0	111.5	L93 D94 Q100 L101 L102 F124 I225	L93-L98 HydrophobicContact CB-CB 3.84Å; L93-L98 HydrophobicContact CB-CD1 4.35Å; L93-L98 HydrophobicContact CB-CG 4.4Å; L93-L98 HydrophobicContact CD1-CB 3.71Å; L93-L98 HydrophobicContact CD1-CD1 4.21Å; L93-L98 HydrophobicContact CD1-CG 3.72Å; L93-L98 HydrophobicContact CG-CB 4.35Å; D94-L98 PolarHBondContact O-N 3.14Å; L98-Q100 VanDerWaalsContact C-N 3.31Å; L98-Q100 PolarHBondContact O-N 3.28Å; L98-L101 PolarHBondContact O-N 3.42Å; L98-L102 HydrophobicContact CD2-CD1 3.34Å; L98-L102 HydrophobicContact CD2-CG 4.1Å; L98-L102 PolarHBondContact O-N 3.06Å; L98-F124 HydrophobicContact CD1-CB 4.37Å; L98-F124 HydrophobicContact CD1-CD1 4.01Å; L98-F124 HydrophobicContact CD1-CD2 3.84Å; L98-F124 HydrophobicContact CD1-CE1 4.22Å; L98-F124 HydrophobicContact CD1-CE2 4.05Å; L98-F124 HydrophobicContact CD1-CG 3.81Å; L98-F124 HydrophobicContact CD1-CZ 4.23Å; L98-F124 HydrophobicContact CD2-CD1 3.91Å; L98-F124 HydrophobicContact CD2-CE1 3.48Å; L98-F124 VanDerWaalsContact CD2-CE1 3.48Å; L98-F124 HydrophobicContact CD2-CE2 4.37Å; L98-F124 HydrophobicContact CD2-CZ 3.74Å; L98-F124 HydrophobicContact CG-CD1 3.68Å; L98-F124 HydrophobicContact CG-CD2 4.42Å; L98-F124 HydrophobicContact CG-CE1 3.82Å; L98-F124 HydrophobicContact CG-CG 4.01Å; L98-F124 HydrophobicContact CG-CZ 4.24Å; L98-I225 HydrophobicContact CD1-CG2 4.33Å; L98-I225 HydrophobicContact CD2-CB 4.44Å; L98-I225 HydrophobicContact CD2-CD1 4.04Å; L98-I225 HydrophobicContact CD2-CG2 3.94Å
99	V	67.6	Low	56.8	Low	26 Å²	26	60.9 Å²	60.9	16%	0.158	37%	0.373	C	S	.	.	H	α-helix	trans	-61.6	-38.3	174.7	163.9	0	0	0	0	112	N95 E97 G104 I108 I225	N95-V99 WeakPolarHBondContact O-CB 3.38Å; N95-V99 WeakPolarHBondContact O-CG2 3.14Å; N95-V99 PolarHBondContact O-N 2.77Å; E97-V99 PolarHBondContact O-N 3.36Å; V99-G104 WeakPolarHBondContact O-CA 3.47Å; V99-G104 PolarHBondContact O-N 3.49Å; V99-I108 HydrophobicContact CB-CD1 4.41Å; V99-I108 HydrophobicContact CG1-CD1 4.49Å; V99-I108 HydrophobicContact CG2-CD1 3.92Å; V99-I225 HydrophobicContact CG2-CB 3.75Å; V99-I225 HydrophobicContact CG2-CG2 4.43Å; V99-I225 WeakPolarHBondContact CG2-O 3.18Å
100	Q	64.7	Low	58.8	Low	139 Å²	139	65.1 Å²	65.1	65%	0.65	38%	0.375	S	S	*	.	H	α-helix	trans	-73.9	-27.3	179.6	-170.8	165.6	-0.4	0	0	113.1	S24 S96 E97 L98	S24-Q100 WeakPolarHBondContact CB-O 3.11Å; S24-Q100 PolarHBondContact OG-O 2.85Å; S96-Q100 PolarHBondContact O-N 3.18Å; S96-Q100 VanDerWaalsContact O-N 3.1Å; E97-Q100 PolarHBondContact O-N 2.69Å; E97-Q100 VanDerWaalsContact O-N 3.08Å; L98-Q100 VanDerWaalsContact C-N 3.31Å; L98-Q100 PolarHBondContact O-N 3.28Å
101	L	60.8	Low	60.7	Low	74 Å²	74	58.7 Å²	58.7	39%	0.387	35%	0.347	S	S	.	.	H	α-helix	trans	-70.7	-46	170.6	-69.5	167.9	0	0	0	111.4	L93 E97 L98 G103 L140	L93-L101 HydrophobicContact CD1-CD1 4.03Å; L93-L101 HydrophobicContact CD2-CD1 4.08Å; E97-L101 WeakPolarHBondContact O-CG 3Å; E97-L101 PolarHBondContact O-N 3.31Å; L98-L101 PolarHBondContact O-N 3.42Å; L101-G103 PolarHBondContact O-N 3.01Å; L101-L140 HydrophobicContact CB-CD1 3.95Å
102	L	66.1	Low	62.6	Low	37 Å²	37	54.3 Å²	54.3	19%	0.194	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.8	39.5	-179.5	-66.8	174.3	0	0	0	114.8	L98 G104 I108 L119 F124 L140 I225	L98-L102 HydrophobicContact CD2-CD1 3.34Å; L98-L102 HydrophobicContact CD2-CG 4.1Å; L98-L102 PolarHBondContact O-N 3.06Å; L102-G104 PolarHBondContact O-N 3.18Å; L102-G104 VanDerWaalsContact O-N 3.08Å; L102-I108 HydrophobicContact CB-CD1 3.84Å; L102-I108 HydrophobicContact CB-CG1 3.62Å; L102-I108 HydrophobicContact CD1-CD1 3.88Å; L102-I108 HydrophobicContact CD1-CG1 3.97Å; L102-I108 HydrophobicContact CG-CG1 4.49Å; L102-L119 HydrophobicContact CD1-CD1 3.8Å; L102-L119 HydrophobicContact CD1-CD2 4Å; L102-L119 HydrophobicContact CD1-CG 4.3Å; L102-L119 HydrophobicContact CD2-CD1 3.89Å; L102-F124 HydrophobicContact CD1-CE1 3.88Å; L102-F124 HydrophobicContact CD1-CZ 4.16Å; L102-F124 HydrophobicContact CD2-CE1 4.26Å; L102-F124 HydrophobicContact CG-CE1 4.23Å; L102-L140 HydrophobicContact CD2-CD1 3.58Å; L102-L140 HydrophobicContact CG-CD1 3.95Å; L102-I225 HydrophobicContact CD1-CD1 3.78Å
103	G	63.7	Low	63.9	Low	18 Å²	18	52.6 Å²	52.6	19%	0.186	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	71.3	1.2	177.2	0	0	0	0	0	115.9	L101 A107	L101-G103 PolarHBondContact O-N 3.01Å; G103-A107 WeakPolarHBondContact O-CB 3.4Å
104	G	68.2	Low	65	Low	21 Å²	21	54.6 Å²	54.6	22%	0.216	31%	0.312	C	S	.	.			trans	91.4	159.9	-173.9	0	0	0	0	0	113.6	V99 L102 Q106 A107 I108	V99-G104 WeakPolarHBondContact O-CA 3.47Å; V99-G104 PolarHBondContact O-N 3.49Å; L102-G104 PolarHBondContact O-N 3.18Å; L102-G104 VanDerWaalsContact O-N 3.08Å; G104-Q106 PolarHBondContact O-N 3.11Å; G104-A107 PolarHBondContact O-N 3.13Å; G104-I108 PolarHBondContact O-N 2.78Å
105	S	65.8	Low	65.9	Low	57 Å²	57	54.5 Å²	54.5	40%	0.399	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.2	8	-175.8	56.8	0	0	0	0	114.8	A109	S105-A109 VanDerWaalsContact O-CB 3.28Å; S105-A109 WeakPolarHBondContact O-CB 3.14Å
106	Q	65.7	Low	66.6	Low	94 Å²	94	52.8 Å²	52.8	44%	0.439	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.6	-30.5	161.6	-69.8	-61.3	-96.1	0	0	113.3	G104 A109 Q110	G104-Q106 PolarHBondContact O-N 3.11Å; Q106-A109 CarbonylContact O-C 3.58Å; Q106-A109 PolarHBondContact O-N 3.49Å; Q106-Q110 WeakPolarHBondContact O-CG 3Å; Q106-Q110 PolarHBondContact O-N 2.8Å
107	A	66.8	Low	66.9	Low	36 Å²	36	51.7 Å²	51.7	30%	0.298	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-47.8	174.7	0	0	0	0	0	111	G103 G104 A109 Q110	G103-A107 WeakPolarHBondContact O-CB 3.4Å; G104-A107 PolarHBondContact O-N 3.13Å; A107-A109 PolarHBondContact O-N 3.38Å; A107-A109 VanDerWaalsContact O-N 3.16Å; A107-Q110 PolarHBondContact O-N 3.22Å
108	I	69.4	Low	67.4	Low	1 Å²	1	51.6 Å²	51.6	1%	0.005	29%	0.287	C	S	.	.	G	3₁₀ helix	trans	-53.4	-38.6	168.8	-53.9	161.1	0	0	0	110.2	V99 L102 G104 Q110 L111 L116 L119 I225 H226	V99-I108 HydrophobicContact CB-CD1 4.41Å; V99-I108 HydrophobicContact CG1-CD1 4.49Å; V99-I108 HydrophobicContact CG2-CD1 3.92Å; L102-I108 HydrophobicContact CB-CD1 3.84Å; L102-I108 HydrophobicContact CB-CG1 3.62Å; L102-I108 HydrophobicContact CD1-CD1 3.88Å; L102-I108 HydrophobicContact CD1-CG1 3.97Å; L102-I108 HydrophobicContact CG-CG1 4.49Å; G104-I108 PolarHBondContact O-N 2.78Å; I108-Q110 PolarHBondContact O-N 3.24Å; I108-Q110 VanDerWaalsContact O-N 3.14Å; I108-L111 HydrophobicContact CG2-CD1 4.25Å; I108-L111 WeakPolarHBondContact O-CB 3.3Å; I108-L111 PolarHBondContact O-N 3.43Å; I108-L116 HydrophobicContact CG2-CD2 3.96Å; I108-L119 HydrophobicContact CG2-CD2 3.8Å; I108-I225 HydrophobicContact CD1-CB 4.18Å; I108-I225 HydrophobicContact CD1-CD1 4.18Å; I108-I225 HydrophobicContact CD1-CG1 4.04Å; I108-I225 HydrophobicContact CG2-CD1 4.22Å; I108-I225 HydrophobicContact CG2-CG1 4.14Å; I108-H226 HydrophobicContact CB-CB 4.39Å; I108-H226 HydrophobicContact CG2-CB 3.95Å
109	A	66	Low	67.8	Low	24 Å²	24	51.6 Å²	51.6	20%	0.198	29%	0.287	C	S	.	.	G	3₁₀ helix	trans	-75.1	7.4	178.7	0	0	0	0	0	114.8	S105 Q106 A107 R207	S105-A109 VanDerWaalsContact O-CB 3.28Å; S105-A109 WeakPolarHBondContact O-CB 3.14Å; Q106-A109 CarbonylContact O-C 3.58Å; Q106-A109 PolarHBondContact O-N 3.49Å; A107-A109 PolarHBondContact O-N 3.38Å; A107-A109 VanDerWaalsContact O-N 3.16Å; A109-R207 VanDerWaalsContact C-NH1 3.33Å; A109-R207 VanDerWaalsContact C-NH2 3.27Å; A109-R207 VanDerWaalsContact O-CZ 3.27Å; A109-R207 PolarHBondContact O-NH1 2.77Å; A109-R207 PolarHBondContact O-NH2 3.42Å
110	Q	66.5	Low	67.7	Low	156 Å²	156	50.5 Å²	50.5	73%	0.729	28%	0.281	S	S	*	.	G	3₁₀ helix	trans	-110.5	-9.6	170.8	-71.6	172.4	11.4	0	0	113.5	Q106 A107 I108	Q106-Q110 WeakPolarHBondContact O-CG 3Å; Q106-Q110 PolarHBondContact O-N 2.8Å; A107-Q110 PolarHBondContact O-N 3.22Å; I108-Q110 PolarHBondContact O-N 3.24Å; I108-Q110 VanDerWaalsContact O-N 3.14Å
111	L	68.1	Low	67.9	Low	50 Å²	50	46.3 Å²	46.3	26%	0.262	26%	0.259	S	S	.	.	S	Bend	trans	-63.1	151.8	176.8	-62.4	176.8	0	0	0	112.7	I108 Q115 L116 L119 R207	I108-L111 HydrophobicContact CG2-CD1 4.25Å; I108-L111 WeakPolarHBondContact O-CB 3.3Å; I108-L111 PolarHBondContact O-N 3.43Å; L111-Q115 HydrophobicContact CB-CB 4Å; L111-Q115 HydrophobicContact CD2-CB 4.3Å; L111-L116 HydrophobicContact CB-CD1 4.48Å; L111-L116 HydrophobicContact CB-CD2 4.14Å; L111-L116 HydrophobicContact CB-CG 3.87Å; L111-L116 HydrophobicContact CD1-CD2 4.28Å; L111-L119 HydrophobicContact CD1-CD2 3.64Å; L111-R207 PolarHBondContact O-NH1 3.01Å
112	S	67.6	Low	67.9	Low	41 Å²	41	42.8 Å²	42.8	29%	0.287	24%	0.241	S	C	.	.			trans	-68.1	163.3	171.2	78.9	0	0	0	0	111.5	S114 Q115 L116	S112-S114 VanDerWaalsContact C-N 3.26Å; S112-S114 PolarHBondContact O-N 3.05Å; S112-S114 PolarHBondContact OG-N 3.13Å; S112-S114 PolarHBondContact OG-OG 3.33Å; S112-Q115 PolarHBondContact O-N 3.17Å; S112-Q115 WeakPolarHBondContact OG-CG 3.34Å; S112-Q115 PolarHBondContact OG-N 3.32Å; S112-Q115 VanDerWaalsContact OG-N 3.1Å; S112-Q115 PolarHBondContact OG-OE1 3.42Å; S112-L116 VanDerWaalsContact O-CB 3.26Å; S112-L116 WeakPolarHBondContact O-CB 3.37Å; S112-L116 WeakPolarHBondContact O-CD1 3.23Å; S112-L116 WeakPolarHBondContact O-CG 3.15Å; S112-L116 PolarHBondContact O-N 2.99Å
113	D	65.4	Low	67.2	Low	13 Å²	13	44.8 Å²	44.8	7%	0.07	25%	0.249	C	C	.	.	H	α-helix	trans	-63.6	-29.3	174.8	-63.6	-80.9	0	0	0	113.2	L116 E117 R207 R208	D113-L116 PolarHBondContact O-N 2.69Å; D113-E117 WeakPolarHBondContact O-CB 3.49Å; D113-E117 PolarHBondContact O-N 2.91Å; D113-R207 WeakPolarHBondContact OD1-CA 3.32Å; D113-R207 VanDerWaalsContact OD1-CB 3.3Å; D113-R207 WeakPolarHBondContact OD1-CB 3.18Å; D113-R207 PolarHBondContact OD1-N 2.93Å; D113-R208 PolarHBondContact OD1-N 2.76Å; D113-R208 IonicContact OD2-CZ 2.65Å; D113-R208 IonicContact OD2-NE 3.72Å; D113-R208 PolarHBondContact OD2-NE 3.19Å; D113-R208 IonicContact OD2-NH2 2.84Å; D113-R208 PolarHBondContact OD2-NH2 3.03Å
114	S	68.2	Low	66.7	Low	68 Å²	68	44.8 Å²	44.8	48%	0.476	24%	0.244	S	C	.	.	H	α-helix	trans	-70.3	-46.9	175.5	62.7	0	0	0	0	111.3	S112 L116 E117 E118	S112-S114 VanDerWaalsContact C-N 3.26Å; S112-S114 PolarHBondContact O-N 3.05Å; S112-S114 PolarHBondContact OG-N 3.13Å; S112-S114 PolarHBondContact OG-OG 3.33Å; S114-L116 PolarHBondContact O-N 2.71Å; S114-E117 PolarHBondContact O-N 2.99Å; S114-E117 VanDerWaalsContact O-N 3.14Å; S114-E118 WeakPolarHBondContact O-CB 3.45Å; S114-E118 VanDerWaalsContact O-CG 3.3Å; S114-E118 WeakPolarHBondContact O-CG 3.38Å; S114-E118 PolarHBondContact O-N 3.02Å
115	Q	73	Confident	65.3	Low	86 Å²	86	48.5 Å²	48.5	40%	0.402	26%	0.262	S	S	.	.	H	α-helix	trans	-61.2	-34	173.8	-70.8	172.8	-37.9	0	0	111.8	L111 S112 L119	L111-Q115 HydrophobicContact CB-CB 4Å; L111-Q115 HydrophobicContact CD2-CB 4.3Å; S112-Q115 PolarHBondContact O-N 3.17Å; S112-Q115 WeakPolarHBondContact OG-CG 3.34Å; S112-Q115 PolarHBondContact OG-N 3.32Å; S112-Q115 VanDerWaalsContact OG-N 3.1Å; S112-Q115 PolarHBondContact OG-OE1 3.42Å; Q115-L119 WeakPolarHBondContact O-CB 3.3Å; Q115-L119 PolarHBondContact O-N 3.33Å
116	L	73.3	Confident	63.9	Low	1 Å²	1	49.4 Å²	49.4	1%	0.005	26%	0.262	C	S	.	.	H	α-helix	trans	-71.4	-39.9	174.5	-78.7	169.5	0	0	0	112	I108 L111 S112 D113 S114 L119 G120 V204 R207	I108-L116 HydrophobicContact CG2-CD2 3.96Å; L111-L116 HydrophobicContact CB-CD1 4.48Å; L111-L116 HydrophobicContact CB-CD2 4.14Å; L111-L116 HydrophobicContact CB-CG 3.87Å; L111-L116 HydrophobicContact CD1-CD2 4.28Å; S112-L116 VanDerWaalsContact O-CB 3.26Å; S112-L116 WeakPolarHBondContact O-CB 3.37Å; S112-L116 WeakPolarHBondContact O-CD1 3.23Å; S112-L116 WeakPolarHBondContact O-CG 3.15Å; S112-L116 PolarHBondContact O-N 2.99Å; D113-L116 PolarHBondContact O-N 2.69Å; S114-L116 PolarHBondContact O-N 2.71Å; L116-L119 HydrophobicContact CD2-CD2 4.46Å; L116-L119 PolarHBondContact O-N 3.31Å; L116-G120 PolarHBondContact O-N 2.95Å; L116-V204 HydrophobicContact CB-CG1 3.61Å; L116-V204 HydrophobicContact CD2-CG1 3.75Å; L116-V204 HydrophobicContact CG-CG1 4.21Å; L116-V204 VanDerWaalsContact O-CG1 3.22Å; L116-V204 WeakPolarHBondContact O-CG1 3.44Å; L116-R207 VanDerWaalsContact CD1-CD 3.41Å; L116-R207 HydrophobicContact CD1-CG 4.27Å; L116-R207 VanDerWaalsContact CD1-NE 3.34Å
117	E	69.9	Low	62.5	Low	36 Å²	36	46.9 Å²	46.9	17%	0.168	25%	0.253	C	S	.	.	H	α-helix	trans	-66.3	-46	174.9	-167.1	171.5	139.6	0	0	111.2	D113 S114 L119 G120 R121 I181 T183	D113-E117 WeakPolarHBondContact O-CB 3.49Å; D113-E117 PolarHBondContact O-N 2.91Å; S114-E117 PolarHBondContact O-N 2.99Å; S114-E117 VanDerWaalsContact O-N 3.14Å; E117-L119 VanDerWaalsContact C-N 3.34Å; E117-L119 PolarHBondContact O-N 2.96Å; E117-G120 PolarHBondContact O-N 3.03Å; E117-G120 VanDerWaalsContact O-N 3.09Å; E117-R121 VanDerWaalsContact O-CG 3.31Å; E117-R121 WeakPolarHBondContact O-CG 3.42Å; E117-R121 PolarHBondContact O-N 3.02Å; E117-R121 IonicContact OE1-CZ 3.97Å; E117-R121 IonicContact OE1-NE 3.21Å; E117-R121 PolarHBondContact OE1-NE 3.41Å; E117-R121 IonicContact OE1-NH2 2.71Å; E117-R121 PolarHBondContact OE1-NH2 2.73Å; E117-I181 WeakPolarHBondContact CG-O 3.35Å; E117-T183 WeakPolarHBondContact OE2-CB 3.47Å; E117-T183 PolarHBondContact OE2-N 3.45Å; E117-T183 PolarHBondContact OE2-OG1 3.11Å
118	E	72.3	Confident	60.8	Low	101 Å²	101	48.8 Å²	48.8	47%	0.472	26%	0.258	S	S	.	.	H	α-helix	trans	-52.9	-48.5	170	-71.9	160.2	-159	0	0	111.6	S114 G120 R121 A122	S114-E118 WeakPolarHBondContact O-CB 3.45Å; S114-E118 VanDerWaalsContact O-CG 3.3Å; S114-E118 WeakPolarHBondContact O-CG 3.38Å; S114-E118 PolarHBondContact O-N 3.02Å; E118-G120 VanDerWaalsContact C-N 3.28Å; E118-G120 PolarHBondContact O-N 2.71Å; E118-R121 PolarHBondContact O-N 2.99Å; E118-A122 WeakPolarHBondContact O-CB 3.4Å; E118-A122 PolarHBondContact O-N 2.85Å
119	L	73.7	Confident	59	Low	4 Å²	4	54 Å²	54	2%	0.021	29%	0.292	C	S	.	.	H	α-helix	trans	-67.8	-24.1	178.4	-171.1	69.7	0	0	0	113.7	L102 I108 L111 Q115 L116 E117 F124 L142 V204 I225	L102-L119 HydrophobicContact CD1-CD1 3.8Å; L102-L119 HydrophobicContact CD1-CD2 4Å; L102-L119 HydrophobicContact CD1-CG 4.3Å; L102-L119 HydrophobicContact CD2-CD1 3.89Å; I108-L119 HydrophobicContact CG2-CD2 3.8Å; L111-L119 HydrophobicContact CD1-CD2 3.64Å; Q115-L119 WeakPolarHBondContact O-CB 3.3Å; Q115-L119 PolarHBondContact O-N 3.33Å; L116-L119 HydrophobicContact CD2-CD2 4.46Å; L116-L119 PolarHBondContact O-N 3.31Å; E117-L119 VanDerWaalsContact C-N 3.34Å; E117-L119 PolarHBondContact O-N 2.96Å; L119-F124 HydrophobicContact CD1-CE1 4.14Å; L119-F124 HydrophobicContact CD1-CZ 3.63Å; L119-F124 HydrophobicContact CG-CZ 4.26Å; L119-L142 HydrophobicContact CD1-CD2 3.82Å; L119-V204 HydrophobicContact CB-CG2 4.43Å; L119-V204 HydrophobicContact CD2-CG2 4.41Å; L119-V204 HydrophobicContact CG-CG2 4.37Å; L119-I225 HydrophobicContact CD2-CD1 3.75Å; L119-I225 HydrophobicContact CG-CD1 4.04Å
120	G	67.3	Low	57.6	Low	3 Å²	3	63.8 Å²	63.8	3%	0.031	32%	0.324	C	S	.	.	H	α-helix	trans	-74.6	-37.1	172.1	0	0	0	0	0	112.6	L116 E117 E118	L116-G120 PolarHBondContact O-N 2.95Å; E117-G120 PolarHBondContact O-N 3.03Å; E117-G120 VanDerWaalsContact O-N 3.09Å; E118-G120 VanDerWaalsContact C-N 3.28Å; E118-G120 PolarHBondContact O-N 2.71Å
121	R	68.3	Low	56.5	Low	51 Å²	51	59.6 Å²	59.6	19%	0.192	31%	0.309	C	S	.	.	H	α-helix	trans	-78.1	-25	176.5	-62.9	172.9	-178.3	-85.1	5.7	113.3	E117 E118 V144 E145 D148 S180	E117-R121 VanDerWaalsContact O-CG 3.31Å; E117-R121 WeakPolarHBondContact O-CG 3.42Å; E117-R121 PolarHBondContact O-N 3.02Å; E117-R121 IonicContact OE1-CZ 3.97Å; E117-R121 IonicContact OE1-NE 3.21Å; E117-R121 PolarHBondContact OE1-NE 3.41Å; E117-R121 IonicContact OE1-NH2 2.71Å; E117-R121 PolarHBondContact OE1-NH2 2.73Å; E118-R121 PolarHBondContact O-N 2.99Å; R121-V144 HydrophobicContact CB-CG1 4.25Å; R121-V144 HydrophobicContact CB-CG2 4.11Å; R121-E145 PolarHBondContact O-N 3.43Å; R121-D148 WeakPolarHBondContact CG-OD2 2.98Å; R121-D148 IonicContact CZ-OD2 3.98Å; R121-D148 IonicContact NH1-OD2 3.87Å; R121-D148 PolarHBondContact NH1-OD2 3.46Å; R121-S180 VanDerWaalsContact CG-CB 3.49Å
122	A	60.1	Low	55	Low	1 Å²	1	60.9 Å²	60.9	1%	0.008	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	133.8	-173.6	0	0	0	0	0	114	E118 F124 L142 S143 R203	E118-A122 WeakPolarHBondContact O-CB 3.4Å; E118-A122 PolarHBondContact O-N 2.85Å; A122-F124 HydrophobicContact CB-CE2 4.45Å; A122-F124 VanDerWaalsContact O-CD2 3.26Å; A122-F124 WeakPolarHBondContact O-CD2 3.21Å; A122-F124 WeakPolarHBondContact O-CE2 3.41Å; A122-L142 HydrophobicContact CB-CB 3.82Å; A122-L142 HydrophobicContact CB-CD2 3.5Å; A122-L142 HydrophobicContact CB-CG 4.19Å; A122-S143 CarbonylContact C-O 3.58Å; A122-S143 WeakPolarHBondContact CA-O 3.27Å; A122-R203 PolarHBondContact O-NH1 2.94Å
123	Q	52.2	Low	53.7	Low	79 Å²	79	63.9 Å²	63.9	37%	0.369	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	147.3	168	-148.2	159.3	72.2	0	0	111.3	S143 E145	Q123-S143 PolarHBondContact N-O 3.2Å; Q123-E145 HydrophobicContact CB-CG 3.88Å; Q123-E145 HydrophobicContact CG-CG 3.98Å; Q123-E145 WeakPolarHBondContact CG-OE1 3.16Å
124	F	52	Low	52.6	Low	18 Å²	18	67.7 Å²	67.7	8%	0.079	36%	0.355	C	S	.	.			trans	-120.5	81	-178.7	-64.8	-100.1	0	0	0	111	L93 L98 L102 L119 A122 I126 L140	L93-F124 HydrophobicContact CD1-CB 3.72Å; L93-F124 HydrophobicContact CD1-CD1 4.32Å; L93-F124 HydrophobicContact CD1-CG 4.36Å; L98-F124 HydrophobicContact CD1-CB 4.37Å; L98-F124 HydrophobicContact CD1-CD1 4.01Å; L98-F124 HydrophobicContact CD1-CD2 3.84Å; L98-F124 HydrophobicContact CD1-CE1 4.22Å; L98-F124 HydrophobicContact CD1-CE2 4.05Å; L98-F124 HydrophobicContact CD1-CG 3.81Å; L98-F124 HydrophobicContact CD1-CZ 4.23Å; L98-F124 HydrophobicContact CD2-CD1 3.91Å; L98-F124 HydrophobicContact CD2-CE1 3.48Å; L98-F124 VanDerWaalsContact CD2-CE1 3.48Å; L98-F124 HydrophobicContact CD2-CE2 4.37Å; L98-F124 HydrophobicContact CD2-CZ 3.74Å; L98-F124 HydrophobicContact CG-CD1 3.68Å; L98-F124 HydrophobicContact CG-CD2 4.42Å; L98-F124 HydrophobicContact CG-CE1 3.82Å; L98-F124 HydrophobicContact CG-CG 4.01Å; L98-F124 HydrophobicContact CG-CZ 4.24Å; L102-F124 HydrophobicContact CD1-CE1 3.88Å; L102-F124 HydrophobicContact CD1-CZ 4.16Å; L102-F124 HydrophobicContact CD2-CE1 4.26Å; L102-F124 HydrophobicContact CG-CE1 4.23Å; L119-F124 HydrophobicContact CD1-CE1 4.14Å; L119-F124 HydrophobicContact CD1-CZ 3.63Å; L119-F124 HydrophobicContact CG-CZ 4.26Å; A122-F124 HydrophobicContact CB-CE2 4.45Å; A122-F124 VanDerWaalsContact O-CD2 3.26Å; A122-F124 WeakPolarHBondContact O-CD2 3.21Å; A122-F124 WeakPolarHBondContact O-CE2 3.41Å; F124-I126 PolarHBondContact O-N 3.06Å; F124-L140 HydrophobicContact CD1-CD1 3.97Å; F124-L140 HydrophobicContact CD1-CD2 4.02Å; F124-L140 HydrophobicContact CE1-CD1 4.02Å
125	T	40.2	Very low	51.2	Low	98 Å²	98	67.3 Å²	67.3	60%	0.601	35%	0.347	S	S	*	.			trans	-77.8	99.6	-173.9	-31.6	0	0	0	0	111.5	V127	T125-V127 PolarHBondContact O-N 2.97Å
126	I	36.1	Very low	49.5	Very low	76 Å²	76	65.6 Å²	65.6	39%	0.39	35%	0.348	S	S	.	.			trans	-70.6	125.6	170.7	-30.8	175.6	0	0	0	109.4	L93 F124	L93-I126 HydrophobicContact CB-CD1 4.35Å; L93-I126 HydrophobicContact CD1-CG1 4.46Å; L93-I126 HydrophobicContact CD2-CD1 3.45Å; L93-I126 VanDerWaalsContact CD2-CD1 3.45Å; L93-I126 HydrophobicContact CD2-CG1 3.61Å; L93-I126 HydrophobicContact CG-CD1 3.66Å; L93-I126 HydrophobicContact CG-CG1 3.58Å; F124-I126 PolarHBondContact O-N 3.06Å
127	V	35.1	Very low	48	Very low	42 Å²	42	66 Å²	66	26%	0.255	35%	0.35	S	S	.	.			trans	-86.6	123.6	158.9	-167.1	0	0	0	0	107.4	T125 L135	T125-V127 PolarHBondContact O-N 2.97Å; V127-L135 HydrophobicContact CB-CD1 3.62Å; V127-L135 HydrophobicContact CB-CD2 3.9Å; V127-L135 HydrophobicContact CB-CG 4.37Å; V127-L135 HydrophobicContact CG1-CD1 3.56Å; V127-L135 HydrophobicContact CG2-CD1 3.94Å; V127-L135 HydrophobicContact CG2-CD2 3.76Å
128	D	31.5	Very low	46.4	Very low	76 Å²	76	67.8 Å²	67.8	41%	0.406	37%	0.365	S	S	.	.			trans	-44.2	113.6	-171.2	175	-2	0	0	0	112.3	R130 T131	D128-R130 PolarHBondContact O-N 3.08Å; D128-R130 WeakPolarHBondContact OD1-CB 3.48Å; D128-R130 PolarHBondContact OD1-N 2.7Å; D128-T131 PolarHBondContact O-N 2.74Å; D128-T131 PolarHBondContact O-OG1 3.15Å
129	P	33.1	Very low	44.7	Very low	109 Å²	109	67.6 Å²	67.6	71%	0.708	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.4	1.4	-172.5	29.6	-36.6	0	0	0	113.9
130	R	34.9	Very low	43	Very low	230 Å²	230	70.2 Å²	70.2	87%	0.868	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.6	-5.5	169.6	-59.7	-179	179.7	130.1	2.6	113.6	D128	D128-R130 PolarHBondContact O-N 3.08Å; D128-R130 WeakPolarHBondContact OD1-CB 3.48Å; D128-R130 PolarHBondContact OD1-N 2.7Å
131	T	43.1	Very low	41.6	Very low	69 Å²	69	74.4 Å²	74.4	42%	0.423	42%	0.415	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.7	-22	-177.6	47.7	0	0	0	0	116.1	D128	D128-T131 PolarHBondContact O-N 2.74Å; D128-T131 PolarHBondContact O-OG1 3.15Å
132	D	37.9	Very low	40.3	Very low	77 Å²	77	75.8 Å²	75.8	41%	0.412	43%	0.426	S	S	.	.			trans	-136.4	116.4	178.4	-86.4	-60.6	0	0	0	112.6	E134 L135	D132-E134 VanDerWaalsContact C-N 3.27Å; D132-E134 PolarHBondContact O-N 3.25Å; D132-L135 HydrophobicContact CB-CB 4.18Å; D132-L135 HydrophobicContact CB-CD1 3.66Å
133	S	40.9	Very low	39.4	Very low	103 Å²	103	78.1 Å²	78.1	72%	0.72	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77	-11	176.3	-51.5	0	0	0	0	113.9
134	E	41.8	Very low	39.3	Very low	94 Å²	94	78.5 Å²	78.5	44%	0.439	45%	0.45	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.3	-19.5	-179.9	-62.5	-172.7	169.9	0	0	113.4	R32 D132 A136	R32-E134 IonicContact CZ-OE1 3.81Å; R32-E134 IonicContact CZ-OE2 2.7Å; R32-E134 IonicContact NH1-OE2 3.8Å; R32-E134 PolarHBondContact NH1-OE2 3.37Å; R32-E134 VanDerWaalsContact NH2-CD 3.28Å; R32-E134 IonicContact NH2-OE1 2.71Å; R32-E134 PolarHBondContact NH2-OE1 2.9Å; R32-E134 IonicContact NH2-OE2 2.89Å; R32-E134 PolarHBondContact NH2-OE2 3.15Å; D132-E134 VanDerWaalsContact C-N 3.27Å; D132-E134 PolarHBondContact O-N 3.25Å; E134-A136 PolarHBondContact O-N 3.3Å; E134-A136 VanDerWaalsContact O-N 3.13Å
135	L	39	Very low	39.2	Very low	59 Å²	59	78.9 Å²	78.9	31%	0.309	45%	0.452	S	S	.	.	G	3₁₀ helix	trans	-77.2	-1.3	-167.1	-117.3	138.7	0	0	0	115	V127 D132 N137 C138	V127-L135 HydrophobicContact CB-CD1 3.62Å; V127-L135 HydrophobicContact CB-CD2 3.9Å; V127-L135 HydrophobicContact CB-CG 4.37Å; V127-L135 HydrophobicContact CG1-CD1 3.56Å; V127-L135 HydrophobicContact CG2-CD1 3.94Å; V127-L135 HydrophobicContact CG2-CD2 3.76Å; D132-L135 HydrophobicContact CB-CB 4.18Å; D132-L135 HydrophobicContact CB-CD1 3.66Å; L135-N137 PolarHBondContact O-N 2.81Å; L135-N137 VanDerWaalsContact O-N 3.16Å; L135-C138 HydrophobicContact CD2-CB 3.96Å; L135-C138 VanDerWaalsContact CD2-SG 3.56Å; L135-C138 PolarHBondContact O-N 3.31Å
136	A	36.8	Very low	39.5	Very low	51 Å²	51	84.1 Å²	84.1	42%	0.421	47%	0.469	S	S	.	.	G	3₁₀ helix	trans	-71.7	-4.8	-178.2	0	0	0	0	0	114.3	E134 K831	E134-A136 PolarHBondContact O-N 3.3Å; E134-A136 VanDerWaalsContact O-N 3.13Å; A136-K831 HydrophobicContact CB-CD 3.61Å; A136-K831 WeakPolarHBondContact O-CD 3.47Å; A136-K831 PolarHBondContact O-NZ 3.03Å
137	N	42.2	Very low	40.6	Very low	10 Å²	10	87.1 Å²	87.1	5%	0.053	49%	0.486	C	S	.	.	G	3₁₀ helix	trans	-117.4	9.4	176.8	-74.8	-15.2	0	0	0	113.3	Q30 L135 P139 G830 K831	Q30-N137 PolarHBondContact OE1-ND2 2.85Å; L135-N137 PolarHBondContact O-N 2.81Å; L135-N137 VanDerWaalsContact O-N 3.16Å; N137-P139 WeakPolarHBondContact O-CD 3.18Å; N137-G830 PolarHBondContact ND2-O 2.9Å; N137-G830 VanDerWaalsContact ND2-O 3.09Å; N137-K831 WeakPolarHBondContact OD1-CA 3.4Å; N137-K831 WeakPolarHBondContact OD1-CG 3.48Å
138	C	36.1	Very low	42.3	Very low	72 Å²	72	86.5 Å²	86.5	49%	0.486	48%	0.482	S	S	.	.			trans	-72.1	124.1	176.9	-72.9	0	0	0	0	111	L135	L135-C138 HydrophobicContact CD2-CB 3.96Å; L135-C138 VanDerWaalsContact CD2-SG 3.56Å; L135-C138 PolarHBondContact O-N 3.31Å
139	P	35.9	Very low	44.6	Very low	97 Å²	97	87.5 Å²	87.5	63%	0.63	48%	0.48	S	S	*	.			trans	-65.9	143.8	169.7	28.9	-34	0	0	0	109.7	N137 S141	N137-P139 WeakPolarHBondContact O-CD 3.18Å; P139-S141 PolarHBondContact O-N 2.71Å
140	L	38.5	Very low	47.2	Very low	59 Å²	59	83.3 Å²	83.3	31%	0.309	45%	0.453	S	S	.	.			trans	-68.4	105.2	177.8	-77.8	166.8	0	0	0	109.9	L101 L102 F124 L142	L101-L140 HydrophobicContact CB-CD1 3.95Å; L102-L140 HydrophobicContact CD2-CD1 3.58Å; L102-L140 HydrophobicContact CG-CD1 3.95Å; F124-L140 HydrophobicContact CD1-CD1 3.97Å; F124-L140 HydrophobicContact CD1-CD2 4.02Å; F124-L140 HydrophobicContact CE1-CD1 4.02Å; L140-L142 PolarHBondContact O-N 2.92Å; L140-L142 VanDerWaalsContact O-N 3.13Å
141	S	38.3	Very low	49.9	Very low	92 Å²	92	72.4 Å²	72.4	64%	0.643	41%	0.411	S	S	*	.			trans	-68.3	107.4	173.2	-173.1	0	0	0	0	109.4	P139 S143	P139-S141 PolarHBondContact O-N 2.71Å; S141-S143 PolarHBondContact O-N 3.48Å
142	L	40.7	Very low	52.1	Low	79 Å²	79	71.2 Å²	71.2	41%	0.414	40%	0.402	S	S	.	.			trans	-72.9	74.7	176.1	-55.9	-177.3	0	0	0	110.1	L119 A122 L140	L119-L142 HydrophobicContact CD1-CD2 3.82Å; A122-L142 HydrophobicContact CB-CB 3.82Å; A122-L142 HydrophobicContact CB-CD2 3.5Å; A122-L142 HydrophobicContact CB-CG 4.19Å; L140-L142 PolarHBondContact O-N 2.92Å; L140-L142 VanDerWaalsContact O-N 3.13Å
143	S	42	Very low	54.8	Low	50 Å²	50	70.5 Å²	70.5	35%	0.35	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	126.4	168.5	50	0	0	0	0	109.1	A122 Q123 S141	A122-S143 CarbonylContact C-O 3.58Å; A122-S143 WeakPolarHBondContact CA-O 3.27Å; Q123-S143 PolarHBondContact N-O 3.2Å; S141-S143 PolarHBondContact O-N 3.48Å
144	V	48.4	Very low	57.2	Low	87 Å²	87	71.8 Å²	71.8	53%	0.527	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68	138.6	172.4	179.2	0	0	0	0	108.5	R121 D148	R121-V144 HydrophobicContact CB-CG1 4.25Å; R121-V144 HydrophobicContact CB-CG2 4.11Å; V144-D148 HydrophobicContact CG1-CB 3.57Å
145	E	50.3	Low	59.6	Low	27 Å²	27	69.3 Å²	69.3	13%	0.126	38%	0.384	C	S	.	.	P	Polyproline II helix	trans	-64.9	140.6	177.4	-43.4	-163.2	157.7	0	0	110	R121 Q123 D147 D148 R203	R121-E145 PolarHBondContact O-N 3.43Å; Q123-E145 HydrophobicContact CB-CG 3.88Å; Q123-E145 HydrophobicContact CG-CG 3.98Å; Q123-E145 WeakPolarHBondContact CG-OE1 3.16Å; E145-D147 PolarHBondContact O-N 3.32Å; E145-D147 VanDerWaalsContact O-N 3.16Å; E145-D148 HydrophobicContact CB-CB 4.36Å; E145-D148 WeakPolarHBondContact O-CB 3.3Å; E145-D148 PolarHBondContact O-N 3.41Å; E145-R203 IonicContact OE1-CZ 3.91Å; E145-R203 VanDerWaalsContact OE1-CZ 3.24Å; E145-R203 IonicContact OE1-NH1 2.95Å; E145-R203 PolarHBondContact OE1-NH1 3.09Å; E145-R203 IonicContact OE1-NH2 2.8Å; E145-R203 PolarHBondContact OE1-NH2 3.34Å; E145-R203 IonicContact OE2-NH2 3.5Å
146	E	47.5	Very low	62.2	Low	207 Å²	207	66.5 Å²	66.5	97%	0.967	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-20.5	168	-66.7	-171.8	150.3	0	0	111.6
147	D	58.2	Low	64.9	Low	140 Å²	140	65.9 Å²	65.9	75%	0.749	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.2	15.4	172.4	-67.5	-57.7	0	0	0	113.8	E145 R149	E145-D147 PolarHBondContact O-N 3.32Å; E145-D147 VanDerWaalsContact O-N 3.16Å; D147-R149 PolarHBondContact O-N 3.05Å
148	D	70.4	Confident	67.2	Low	28 Å²	28	69.6 Å²	69.6	15%	0.15	38%	0.384	C	S	.	.			trans	-61.3	112.7	176.6	178.3	45.2	0	0	0	109.5	R121 V144 E145 P150 T179 S180	R121-D148 WeakPolarHBondContact CG-OD2 2.98Å; R121-D148 IonicContact CZ-OD2 3.98Å; R121-D148 IonicContact NH1-OD2 3.87Å; R121-D148 PolarHBondContact NH1-OD2 3.46Å; V144-D148 HydrophobicContact CG1-CB 3.57Å; E145-D148 HydrophobicContact CB-CB 4.36Å; E145-D148 WeakPolarHBondContact O-CB 3.3Å; E145-D148 PolarHBondContact O-N 3.41Å; D148-P150 VanDerWaalsContact C-CD 3.49Å; D148-P150 WeakPolarHBondContact O-CD 3.44Å; D148-T179 PolarHBondContact OD1-OG1 3.04Å; D148-S180 PolarHBondContact OD1-OG 3.24Å; D148-S180 PolarHBondContact OD2-OG 3.16Å
149	R	81.3	Confident	69.7	Low	98 Å²	98	69 Å²	69	37%	0.37	38%	0.378	S	S	.	.			trans	-105.5	88.8	174.9	-165.2	177.7	-176.5	-162.7	1.2	109.1	D147 E155 S176 Y178 T179	D147-R149 PolarHBondContact O-N 3.05Å; R149-E155 IonicContact CZ-OE1 3.92Å; R149-E155 IonicContact NE-OE1 2.76Å; R149-E155 PolarHBondContact NE-OE1 2.96Å; R149-E155 IonicContact NH2-OE1 2.73Å; R149-E155 PolarHBondContact NH2-OE1 3.5Å; R149-E155 IonicContact NH2-OE2 3.18Å; R149-E155 PolarHBondContact NH2-OE2 3.5Å; R149-S176 PolarHBondContact NH1-O 2.85Å; R149-Y178 HydrophobicContact CG-CD1 3.94Å; R149-Y178 HydrophobicContact CG-CE1 4.05Å; R149-Y178 WeakPolarHBondContact O-CA 3.2Å; R149-Y178 WeakPolarHBondContact O-CD1 3.42Å; R149-T179 PolarHBondContact N-OG1 3.29Å; R149-T179 PolarHBondContact O-N 2.8Å; R149-T179 VanDerWaalsContact O-N 3.1Å; R149-T179 PolarHBondContact O-OG1 2.76Å
150	P	86.3	Confident	72.4	Confident	21 Å²	21	66.2 Å²	66.2	14%	0.136	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	149.1	171.9	28.7	-35	0	0	0	111.7	D148 D152 S180	D148-P150 VanDerWaalsContact C-CD 3.49Å; D148-P150 WeakPolarHBondContact O-CD 3.44Å; P150-D152 PolarHBondContact O-N 3.17Å; P150-S180 VanDerWaalsContact CA-OG 3.28Å; P150-S180 WeakPolarHBondContact CA-OG 3.18Å; P150-S180 WeakPolarHBondContact CB-OG 3.46Å
151	L	91.2	Very high	74.8	Confident	0 Å²	0	72.1 Å²	72.1	0%	0	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	97.8	160.5	-176.4	65	0	0	0	108.8	E155 I156 L171 V173 Y178 S180 I181 N182 L186 L197	L151-E155 HydrophobicContact CD1-CB 4.48Å; L151-I156 HydrophobicContact CD1-CG1 3.67Å; L151-I156 HydrophobicContact CG-CD1 4.21Å; L151-I156 HydrophobicContact CG-CG1 3.88Å; L151-L171 HydrophobicContact CD2-CD2 4.16Å; L151-V173 HydrophobicContact CD2-CG2 4.42Å; L151-Y178 HydrophobicContact CB-CD1 3.9Å; L151-Y178 HydrophobicContact CB-CE1 4.23Å; L151-Y178 HydrophobicContact CB-CG 4.2Å; L151-Y178 HydrophobicContact CD1-CD1 4.35Å; L151-Y178 HydrophobicContact CD1-CD2 4.48Å; L151-Y178 HydrophobicContact CD1-CE1 3.95Å; L151-Y178 HydrophobicContact CD1-CE2 4.08Å; L151-S180 PolarHBondContact N-O 3.21Å; L151-I181 HydrophobicContact CB-CG1 4.44Å; L151-N182 PolarHBondContact O-N 2.98Å; L151-L186 HydrophobicContact CD2-CD2 4.43Å; L151-L197 HydrophobicContact CD2-CD2 3.52Å
152	D	91.3	Very high	77.2	Confident	44 Å²	44	69 Å²	69	24%	0.235	36%	0.363	C	S	.	.			trans	-117.4	-176.9	-175.2	64.1	22	0	0	0	113.4	P150 D154 E155 I156 N182	P150-D152 PolarHBondContact O-N 3.17Å; D152-D154 VanDerWaalsContact C-N 3.3Å; D152-D154 PolarHBondContact O-N 3.24Å; D152-D154 PolarHBondContact OD1-N 3.33Å; D152-D154 VanDerWaalsContact OD1-N 3.13Å; D152-E155 PolarHBondContact OD1-N 2.67Å; D152-I156 VanDerWaalsContact O-CB 3.3Å; D152-I156 WeakPolarHBondContact O-CB 3.5Å; D152-I156 WeakPolarHBondContact O-CD1 3.39Å; D152-I156 WeakPolarHBondContact O-CG1 3.24Å; D152-I156 PolarHBondContact O-N 2.97Å; D152-N182 HydrophobicContact CB-CB 4.14Å
153	E	92.9	Very high	79.4	Confident	63 Å²	63	73.8 Å²	73.8	29%	0.294	38%	0.38	S	S	.	.	H	α-helix	trans	-56.7	-40.3	179.6	178.4	146.5	-164.6	0	0	112.8	L157 L165 D185 K188	E153-L157 HydrophobicContact CG-CD1 3.71Å; E153-L157 HydrophobicContact CG-CG 4.32Å; E153-L157 VanDerWaalsContact O-CB 3.3Å; E153-L157 WeakPolarHBondContact O-CB 3.49Å; E153-L157 WeakPolarHBondContact O-CG 3.29Å; E153-L157 PolarHBondContact O-N 3.5Å; E153-L165 HydrophobicContact CB-CD1 3.83Å; E153-L165 HydrophobicContact CG-CD1 3.54Å; E153-L165 HydrophobicContact CG-CD2 4.26Å; E153-L165 HydrophobicContact CG-CG 3.95Å; E153-D185 HydrophobicContact CB-CB 4.11Å; E153-D185 WeakPolarHBondContact CB-OD2 3.12Å; E153-D185 PolarHBondContact N-OD2 3.31Å; E153-K188 IonicContact OE2-NZ 2.8Å; E153-K188 PolarHBondContact OE2-NZ 3.17Å
154	D	91.2	Very high	81.7	Confident	130 Å²	130	73.1 Å²	73.1	70%	0.695	38%	0.375	S	S	*	.	H	α-helix	trans	-72.2	-45.3	-177.5	-85.4	-28	0	0	0	112	D152 L157 C158	D152-D154 VanDerWaalsContact C-N 3.3Å; D152-D154 PolarHBondContact O-N 3.24Å; D152-D154 PolarHBondContact OD1-N 3.33Å; D152-D154 VanDerWaalsContact OD1-N 3.13Å; D154-L157 PolarHBondContact O-N 3.39Å; D154-C158 WeakPolarHBondContact O-CB 3.37Å; D154-C158 PolarHBondContact O-N 3.09Å
155	E	92.2	Very high	83.6	Confident	42 Å²	42	69.1 Å²	69.1	20%	0.196	35%	0.351	C	S	.	.	H	α-helix	trans	-64.9	-42	175	-79.5	-81.5	-151.9	0	0	111.9	R149 L151 D152 L157 C158 V159 Y178	R149-E155 IonicContact CZ-OE1 3.92Å; R149-E155 IonicContact NE-OE1 2.76Å; R149-E155 PolarHBondContact NE-OE1 2.96Å; R149-E155 IonicContact NH2-OE1 2.73Å; R149-E155 PolarHBondContact NH2-OE1 3.5Å; R149-E155 IonicContact NH2-OE2 3.18Å; R149-E155 PolarHBondContact NH2-OE2 3.5Å; L151-E155 HydrophobicContact CD1-CB 4.48Å; D152-E155 PolarHBondContact OD1-N 2.67Å; E155-L157 PolarHBondContact O-N 2.83Å; E155-C158 PolarHBondContact O-N 3.45Å; E155-V159 WeakPolarHBondContact O-CG2 3.24Å; E155-V159 PolarHBondContact O-N 3.01Å; E155-Y178 HydrophobicContact CB-CE1 4.1Å; E155-Y178 HydrophobicContact CG-CE1 4.04Å; E155-Y178 PolarHBondContact OE2-OH 3.48Å
156	I	93.8	Very high	85.4	Confident	0 Å²	0	71.6 Å²	71.6	0%	0	37%	0.365	C	S	.	.	H	α-helix	trans	-61.7	-45.8	176.7	-66.2	165.5	0	0	0	110.4	L151 D152 T160 L165 V168 L171 L186	L151-I156 HydrophobicContact CD1-CG1 3.67Å; L151-I156 HydrophobicContact CG-CD1 4.21Å; L151-I156 HydrophobicContact CG-CG1 3.88Å; D152-I156 VanDerWaalsContact O-CB 3.3Å; D152-I156 WeakPolarHBondContact O-CB 3.5Å; D152-I156 WeakPolarHBondContact O-CD1 3.39Å; D152-I156 WeakPolarHBondContact O-CG1 3.24Å; D152-I156 PolarHBondContact O-N 2.97Å; I156-T160 HydrophobicContact CG2-CG2 4.23Å; I156-T160 VanDerWaalsContact O-CB 3.27Å; I156-T160 WeakPolarHBondContact O-CB 3.33Å; I156-T160 WeakPolarHBondContact O-CG2 3.49Å; I156-T160 PolarHBondContact O-N 3.23Å; I156-T160 PolarHBondContact O-OG1 2.82Å; I156-L165 HydrophobicContact CB-CD2 3.82Å; I156-L165 HydrophobicContact CD1-CD2 4.47Å; I156-L165 HydrophobicContact CG2-CD2 3.43Å; I156-L165 VanDerWaalsContact CG2-CD2 3.43Å; I156-V168 HydrophobicContact CG2-CG1 4.49Å; I156-V168 HydrophobicContact CG2-CG2 4Å; I156-L171 HydrophobicContact CD1-CD2 4.41Å; I156-L171 HydrophobicContact CG1-CD2 3.96Å; I156-L171 HydrophobicContact CG2-CD1 4.46Å; I156-L171 HydrophobicContact CG2-CD2 4.22Å; I156-L186 HydrophobicContact CD1-CB 4.18Å; I156-L186 HydrophobicContact CD1-CD1 3.97Å
157	L	93.4	Very high	87.4	Confident	37 Å²	37	69.8 Å²	69.8	19%	0.194	35%	0.349	C	S	.	.	H	α-helix	trans	-68	-36.8	178	-69.5	175.1	0	0	0	112	E153 D154 E155 K161 A162 L165	E153-L157 HydrophobicContact CG-CD1 3.71Å; E153-L157 HydrophobicContact CG-CG 4.32Å; E153-L157 VanDerWaalsContact O-CB 3.3Å; E153-L157 WeakPolarHBondContact O-CB 3.49Å; E153-L157 WeakPolarHBondContact O-CG 3.29Å; E153-L157 PolarHBondContact O-N 3.5Å; D154-L157 PolarHBondContact O-N 3.39Å; E155-L157 PolarHBondContact O-N 2.83Å; L157-K161 VanDerWaalsContact O-CA 3.28Å; L157-K161 WeakPolarHBondContact O-CA 3.38Å; L157-K161 PolarHBondContact O-N 2.98Å; L157-A162 HydrophobicContact CD2-CB 4.02Å; L157-L165 HydrophobicContact CD2-CD2 3.94Å; L157-L165 HydrophobicContact CD2-CG 4.33Å; L157-L165 HydrophobicContact CG-CD2 3.91Å; L157-L165 HydrophobicContact CG-CG 4.44Å
158	C	90.6	Very high	89	Confident	88 Å²	88	63.3 Å²	63.3	60%	0.595	31%	0.314	S	S	*	.	H	α-helix	trans	-61.7	-51.9	176.6	-175	0	0	0	0	112.1	D154 E155	D154-C158 WeakPolarHBondContact O-CB 3.37Å; D154-C158 PolarHBondContact O-N 3.09Å; E155-C158 PolarHBondContact O-N 3.45Å
159	V	90	Very high	90.1	Very high	60 Å²	60	64.6 Å²	64.6	36%	0.364	33%	0.325	S	S	.	.	H	α-helix	trans	-65.3	-50	179.8	172.9	0	0	0	0	111.1	E155 L171 V173	E155-V159 WeakPolarHBondContact O-CG2 3.24Å; E155-V159 PolarHBondContact O-N 3.01Å; V159-L171 HydrophobicContact CG1-CD1 4.38Å; V159-V173 HydrophobicContact CB-CG1 4.34Å; V159-V173 HydrophobicContact CG1-CG1 3.78Å; V159-V173 HydrophobicContact CG2-CG1 4.03Å
160	T	91.5	Very high	90.7	Very high	38 Å²	38	63.5 Å²	63.5	23%	0.233	33%	0.329	C	S	.	.	H	α-helix	trans	-79.2	-22.4	-171.5	64.3	0	0	0	0	113.6	I156 A162 V168 L171	I156-T160 HydrophobicContact CG2-CG2 4.23Å; I156-T160 VanDerWaalsContact O-CB 3.27Å; I156-T160 WeakPolarHBondContact O-CB 3.33Å; I156-T160 WeakPolarHBondContact O-CG2 3.49Å; I156-T160 PolarHBondContact O-N 3.23Å; I156-T160 PolarHBondContact O-OG1 2.82Å; T160-A162 PolarHBondContact O-N 3.12Å; T160-A162 WeakPolarHBondContact OG1-CB 3.41Å; T160-A162 PolarHBondContact OG1-N 3.45Å; T160-V168 HydrophobicContact CG2-CG1 3.68Å; T160-V168 HydrophobicContact CG2-CG2 4.06Å; T160-L171 HydrophobicContact CG2-CD1 3.7Å
161	K	89.3	Confident	91.1	Very high	183 Å²	183	62.6 Å²	62.6	80%	0.796	32%	0.323	S	S	*	.			trans	57.9	26.3	-173.7	-58.5	164.9	-170.9	165.7	0	112.6	L157	L157-K161 VanDerWaalsContact O-CA 3.28Å; L157-K161 WeakPolarHBondContact O-CA 3.38Å; L157-K161 PolarHBondContact O-N 2.98Å
162	A	88.3	Confident	91.1	Very high	27 Å²	27	65.5 Å²	65.5	22%	0.223	34%	0.344	C	S	.	.			trans	-69.3	162.2	171.1	0	0	0	0	0	111	L157 T160 R167 V168	L157-A162 HydrophobicContact CD2-CB 4.02Å; T160-A162 PolarHBondContact O-N 3.12Å; T160-A162 WeakPolarHBondContact OG1-CB 3.41Å; T160-A162 PolarHBondContact OG1-N 3.45Å; A162-R167 HydrophobicContact CB-CB 4.28Å; A162-V168 HydrophobicContact CB-CG2 3.73Å
163	K	87	Confident	91.1	Very high	179 Å²	179	63.5 Å²	63.5	78%	0.778	33%	0.333	S	S	*	.	S	Bend	trans	-92.3	-12.8	175.4	-65.8	-163.4	174.9	-163.5	0	114.1
164	C	89.9	Confident	90.9	Very high	37 Å²	37	63 Å²	63	25%	0.25	34%	0.335	C	S	.	.	S	Bend	trans	-170.2	156.8	177.8	56.5	0	0	0	0	107.2	D166 R167	C164-D166 VanDerWaalsContact C-N 3.27Å; C164-D166 PolarHBondContact O-N 2.98Å; C164-R167 PolarHBondContact O-N 2.85Å; C164-R167 VanDerWaalsContact O-N 3.12Å
165	L	89.6	Confident	90.6	Very high	2 Å²	2	60.4 Å²	60.4	1%	0.01	33%	0.332	C	S	.	.	G	3₁₀ helix	trans	-62.1	-31.9	-173.8	-65.3	174.6	0	0	0	113.2	E153 I156 L157 R167 V168 D185 K188	E153-L165 HydrophobicContact CB-CD1 3.83Å; E153-L165 HydrophobicContact CG-CD1 3.54Å; E153-L165 HydrophobicContact CG-CD2 4.26Å; E153-L165 HydrophobicContact CG-CG 3.95Å; I156-L165 HydrophobicContact CB-CD2 3.82Å; I156-L165 HydrophobicContact CD1-CD2 4.47Å; I156-L165 HydrophobicContact CG2-CD2 3.43Å; I156-L165 VanDerWaalsContact CG2-CD2 3.43Å; L157-L165 HydrophobicContact CD2-CD2 3.94Å; L157-L165 HydrophobicContact CD2-CG 4.33Å; L157-L165 HydrophobicContact CG-CD2 3.91Å; L157-L165 HydrophobicContact CG-CG 4.44Å; L165-R167 PolarHBondContact O-N 2.92Å; L165-V168 HydrophobicContact CD2-CG2 4.5Å; L165-V168 WeakPolarHBondContact O-CB 3.47Å; L165-V168 WeakPolarHBondContact O-CG2 3.39Å; L165-V168 PolarHBondContact O-N 3.22Å; L165-D185 HydrophobicContact CD1-CB 4.41Å; L165-D185 WeakPolarHBondContact CD1-O 3.09Å; L165-K188 HydrophobicContact CB-CB 3.89Å; L165-K188 HydrophobicContact CD1-CB 3.79Å; L165-K188 HydrophobicContact CD1-CD 3.52Å; L165-K188 HydrophobicContact CD1-CG 4.31Å
166	D	86.4	Confident	90.3	Very high	80 Å²	80	60.2 Å²	60.2	43%	0.428	34%	0.335	S	S	.	.	G	3₁₀ helix	trans	-53.9	-26.5	175.1	-38.1	-26.9	0	0	0	113.9	C164 I190 N191	C164-D166 VanDerWaalsContact C-N 3.27Å; C164-D166 PolarHBondContact O-N 2.98Å; D166-I190 HydrophobicContact CB-CG1 4.33Å; D166-N191 WeakPolarHBondContact O-CB 3.2Å; D166-N191 PolarHBondContact O-ND2 3.15Å
167	R	89.4	Confident	89.7	Confident	169 Å²	169	62.2 Å²	62.2	64%	0.638	36%	0.356	S	S	*	.	G	3₁₀ helix	trans	-87.9	-8.5	-177.4	-67.8	173.8	-177.7	-116	-3.7	113.1	A162 C164 L165 C169	A162-R167 HydrophobicContact CB-CB 4.28Å; C164-R167 PolarHBondContact O-N 2.85Å; C164-R167 VanDerWaalsContact O-N 3.12Å; L165-R167 PolarHBondContact O-N 2.92Å; R167-C169 PolarHBondContact O-N 2.87Å; R167-C169 VanDerWaalsContact O-N 3.16Å
168	V	91.9	Very high	89.5	Confident	3 Å²	3	60.5 Å²	60.5	2%	0.018	35%	0.347	C	S	.	.			trans	-72.1	107.2	178.5	-178.7	0	0	0	0	109	I156 T160 A162 L165 L171 C189 N191 L192	I156-V168 HydrophobicContact CG2-CG1 4.49Å; I156-V168 HydrophobicContact CG2-CG2 4Å; T160-V168 HydrophobicContact CG2-CG1 3.68Å; T160-V168 HydrophobicContact CG2-CG2 4.06Å; A162-V168 HydrophobicContact CB-CG2 3.73Å; L165-V168 HydrophobicContact CD2-CG2 4.5Å; L165-V168 WeakPolarHBondContact O-CB 3.47Å; L165-V168 WeakPolarHBondContact O-CG2 3.39Å; L165-V168 PolarHBondContact O-N 3.22Å; V168-L171 HydrophobicContact CG1-CB 4.14Å; V168-C189 HydrophobicContact CB-CB 4.38Å; V168-N191 CarbonylContact O-C 3.6Å; V168-L192 HydrophobicContact CG1-CD1 4.22Å; V168-L192 VanDerWaalsContact O-CA 3.29Å; V168-L192 WeakPolarHBondContact O-CA 3.16Å; V168-L192 PolarHBondContact O-N 3.04Å; V168-L192 VanDerWaalsContact O-N 3.09Å
169	C	93.5	Very high	89	Confident	55 Å²	55	56.9 Å²	56.9	37%	0.372	32%	0.322	S	S	.	.			trans	-100.2	-21.4	177	-69.7	0	0	0	0	113	R167 R193	R167-C169 PolarHBondContact O-N 2.87Å; R167-C169 VanDerWaalsContact O-N 3.16Å; C169-R193 WeakPolarHBondContact O-CB 3.46Å; C169-R193 PolarHBondContact O-N 2.76Å
170	V	93.9	Very high	88.8	Confident	76 Å²	76	54.2 Å²	54.2	46%	0.461	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	130	178.1	176	0	0	0	0	107.1	E194	V170-E194 WeakPolarHBondContact CA-O 3.5Å; V170-E194 HydrophobicContact CG1-CB 4.26Å; V170-E194 HydrophobicContact CG2-CB 4.21Å; V170-E194 HydrophobicContact CG2-CG 4.33Å
171	L	95	Very high	88.7	Confident	1 Å²	1	52.7 Å²	52.7	1%	0.005	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	105.8	171.5	177.1	60	0	0	0	107.2	L151 I156 V159 T160 V168 V173 L186 L192 E194 L195 D196	L151-L171 HydrophobicContact CD2-CD2 4.16Å; I156-L171 HydrophobicContact CD1-CD2 4.41Å; I156-L171 HydrophobicContact CG1-CD2 3.96Å; I156-L171 HydrophobicContact CG2-CD1 4.46Å; I156-L171 HydrophobicContact CG2-CD2 4.22Å; V159-L171 HydrophobicContact CG1-CD1 4.38Å; T160-L171 HydrophobicContact CG2-CD1 3.7Å; V168-L171 HydrophobicContact CG1-CB 4.14Å; L171-V173 HydrophobicContact CD1-CG1 3.94Å; L171-L186 HydrophobicContact CD2-CD1 3.73Å; L171-L192 HydrophobicContact CB-CD1 3.81Å; L171-L192 HydrophobicContact CB-CD2 4.49Å; L171-E194 PolarHBondContact N-O 3.48Å; L171-L195 HydrophobicContact CB-CD1 4.13Å; L171-L195 HydrophobicContact CD2-CD1 3.93Å; L171-L195 HydrophobicContact CG-CD1 4.07Å; L171-L195 CarbonylContact O-C 3.5Å; L171-L195 WeakPolarHBondContact O-CA 3.41Å; L171-D196 PolarHBondContact O-N 3.43Å
172	S	92.2	Very high	88.7	Confident	62 Å²	62	45.4 Å²	45.4	43%	0.434	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	110.2	177.3	177.2	0	0	0	0	107.4	P174 D196	S172-P174 WeakPolarHBondContact OG-CD 3.42Å; S172-D196 PolarHBondContact OG-OD2 2.85Å
173	V	91.6	Very high	88.5	Confident	2 Å²	2	44.9 Å²	44.9	1%	0.012	26%	0.26	C	S	.	.			trans	-130.4	50.7	179.5	-73.4	0	0	0	0	110.7	L151 V159 L171 S176 Y178 D196 L197 N200	L151-V173 HydrophobicContact CD2-CG2 4.42Å; V159-V173 HydrophobicContact CB-CG1 4.34Å; V159-V173 HydrophobicContact CG1-CG1 3.78Å; V159-V173 HydrophobicContact CG2-CG1 4.03Å; L171-V173 HydrophobicContact CD1-CG1 3.94Å; V173-S176 WeakPolarHBondContact O-CB 3.44Å; V173-S176 PolarHBondContact O-OG 2.92Å; V173-Y178 HydrophobicContact CB-CD2 4.28Å; V173-Y178 HydrophobicContact CB-CE2 3.79Å; V173-Y178 HydrophobicContact CG1-CE2 3.99Å; V173-Y178 HydrophobicContact CG2-CD2 4.25Å; V173-Y178 HydrophobicContact CG2-CE2 4.11Å; V173-D196 CarbonylContact C-O 3.52Å; V173-D196 WeakPolarHBondContact CG2-O 3.49Å; V173-D196 PolarHBondContact N-O 2.85Å; V173-L197 HydrophobicContact CG2-CD2 3.81Å; V173-N200 PolarHBondContact O-ND2 3.22Å
174	P	89.1	Confident	88.4	Confident	51 Å²	51	40.4 Å²	40.4	33%	0.331	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	149.9	174.7	31.1	-36.8	0	0	0	110.3	S172 S176 S198	S172-P174 WeakPolarHBondContact OG-CD 3.42Å; P174-S176 PolarHBondContact O-N 2.99Å; P174-S176 PolarHBondContact O-OG 3.05Å; P174-S198 CarbonylContact C-O 3.57Å; P174-S198 WeakPolarHBondContact CA-O 3.48Å; P174-S198 WeakPolarHBondContact CB-OG 3.43Å
175	A	85	Confident	88.4	Confident	76 Å²	76	39.6 Å²	39.6	63%	0.628	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	49.5	31.6	174.7	0	0	0	0	0	114.8	S198 E199	A175-S198 PolarHBondContact N-O 3.18Å; A175-E199 WeakPolarHBondContact CA-O 3.45Å; A175-E199 HydrophobicContact CB-CB 4.1Å
176	S	85.7	Confident	88.4	Confident	38 Å²	38	39.5 Å²	39.5	27%	0.266	24%	0.244	S	C	.	.	S	Bend	trans	-95.7	-5.5	-172.3	-65.2	0	0	0	0	113.7	R149 V173 P174 N200	R149-S176 PolarHBondContact NH1-O 2.85Å; V173-S176 WeakPolarHBondContact O-CB 3.44Å; V173-S176 PolarHBondContact O-OG 2.92Å; P174-S176 PolarHBondContact O-N 2.99Å; P174-S176 PolarHBondContact O-OG 3.05Å; S176-N200 WeakPolarHBondContact CA-OD1 3.41Å; S176-N200 PolarHBondContact N-OD1 2.76Å
177	G	81.2	Confident	88.4	Confident	42 Å²	42	36.9 Å²	36.9	43%	0.433	23%	0.233	S	C	.	.			trans	82.2	13.3	174.1	0	0	0	0	0	115.3	T179 N200	G177-T179 PolarHBondContact O-N 3.48Å; G177-N200 PolarHBondContact N-OD1 2.8Å
178	Y	87.4	Confident	88.3	Confident	2 Å²	2	32.8 Å²	32.8	1%	0.008	22%	0.22	C	C	.	.			trans	-64.7	130.2	178.3	-65.5	-75	0	0	0	111.3	R149 L151 E155 V173 N200 A201 L202	R149-Y178 HydrophobicContact CG-CD1 3.94Å; R149-Y178 HydrophobicContact CG-CE1 4.05Å; R149-Y178 WeakPolarHBondContact O-CA 3.2Å; R149-Y178 WeakPolarHBondContact O-CD1 3.42Å; L151-Y178 HydrophobicContact CB-CD1 3.9Å; L151-Y178 HydrophobicContact CB-CE1 4.23Å; L151-Y178 HydrophobicContact CB-CG 4.2Å; L151-Y178 HydrophobicContact CD1-CD1 4.35Å; L151-Y178 HydrophobicContact CD1-CD2 4.48Å; L151-Y178 HydrophobicContact CD1-CE1 3.95Å; L151-Y178 HydrophobicContact CD1-CE2 4.08Å; E155-Y178 HydrophobicContact CB-CE1 4.1Å; E155-Y178 HydrophobicContact CG-CE1 4.04Å; E155-Y178 PolarHBondContact OE2-OH 3.48Å; V173-Y178 HydrophobicContact CB-CD2 4.28Å; V173-Y178 HydrophobicContact CB-CE2 3.79Å; V173-Y178 HydrophobicContact CG1-CE2 3.99Å; V173-Y178 HydrophobicContact CG2-CD2 4.25Å; V173-Y178 HydrophobicContact CG2-CE2 4.11Å; Y178-N200 PolarHBondContact N-OD1 2.75Å; Y178-N200 VanDerWaalsContact N-OD1 3.15Å; Y178-A201 PolarHBondContact O-N 2.95Å; Y178-L202 PolarHBondContact O-N 2.67Å
179	T	82.1	Confident	88.2	Confident	12 Å²	12	32.7 Å²	32.7	7%	0.074	22%	0.219	C	C	.	.			trans	-91.3	-39.9	179.4	41.6	0	0	0	0	111.6	D148 R149 G177 A201	D148-T179 PolarHBondContact OD1-OG1 3.04Å; R149-T179 PolarHBondContact N-OG1 3.29Å; R149-T179 PolarHBondContact O-N 2.8Å; R149-T179 VanDerWaalsContact O-N 3.1Å; R149-T179 PolarHBondContact O-OG1 2.76Å; G177-T179 PolarHBondContact O-N 3.48Å; T179-A201 HydrophobicContact CG2-CB 4.2Å
180	S	85.9	Confident	87.9	Confident	3 Å²	3	31.9 Å²	31.9	2%	0.021	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	168.4	-174.2	61	0	0	0	0	111.8	R121 D148 P150 L151	R121-S180 VanDerWaalsContact CG-CB 3.49Å; D148-S180 PolarHBondContact OD1-OG 3.24Å; D148-S180 PolarHBondContact OD2-OG 3.16Å; P150-S180 VanDerWaalsContact CA-OG 3.28Å; P150-S180 WeakPolarHBondContact CA-OG 3.18Å; P150-S180 WeakPolarHBondContact CB-OG 3.46Å; L151-S180 PolarHBondContact N-O 3.21Å
181	I	88.8	Confident	87.6	Confident	6 Å²	6	31 Å²	31	3%	0.031	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	127.9	176.5	-65.6	172.8	0	0	0	107.3	E117 L151 T183 L186 L197 L202 P206	E117-I181 WeakPolarHBondContact CG-O 3.35Å; L151-I181 HydrophobicContact CB-CG1 4.44Å; I181-T183 PolarHBondContact O-N 3.37Å; I181-L186 HydrophobicContact CG2-CB 4.12Å; I181-L186 HydrophobicContact CG2-CD2 3.65Å; I181-L197 HydrophobicContact CD1-CD1 3.92Å; I181-L202 HydrophobicContact CD1-CD1 3.87Å; I181-L202 HydrophobicContact CD1-CD2 4.27Å; I181-L202 HydrophobicContact CG1-CD1 4.38Å; I181-L202 HydrophobicContact CG1-CD2 3.9Å; I181-P206 HydrophobicContact CB-CG 4.37Å; I181-P206 HydrophobicContact CG2-CG 4.27Å
182	N	87.8	Confident	87.5	Confident	31 Å²	31	31 Å²	31	17%	0.166	20%	0.204	C	C	.	.			trans	-72.3	110.2	166.8	-177.6	-35.5	0	0	0	108.9	L151 D152 S184 D185 L186	L151-N182 PolarHBondContact O-N 2.98Å; D152-N182 HydrophobicContact CB-CB 4.14Å; N182-S184 VanDerWaalsContact C-N 3.32Å; N182-S184 PolarHBondContact O-N 3.06Å; N182-S184 WeakPolarHBondContact OD1-CB 3.3Å; N182-S184 PolarHBondContact OD1-N 3.03Å; N182-D185 HydrophobicContact CB-CB 4.06Å; N182-D185 VanDerWaalsContact CG-CG 3.45Å; N182-D185 VanDerWaalsContact ND2-CG 3.31Å; N182-D185 PolarHBondContact ND2-OD2 2.7Å; N182-D185 PolarHBondContact O-N 3.4Å; N182-D185 PolarHBondContact OD1-N 3.49Å; N182-L186 PolarHBondContact O-N 2.79Å; N182-L186 VanDerWaalsContact O-N 3.11Å
183	T	86.2	Confident	87.7	Confident	16 Å²	16	34.4 Å²	34.4	10%	0.098	21%	0.207	C	C	.	.	H	α-helix	trans	-62.8	-40.6	-174.9	-54.7	0	0	0	0	111.6	E117 I181 A187 P206	E117-T183 WeakPolarHBondContact OE2-CB 3.47Å; E117-T183 PolarHBondContact OE2-N 3.45Å; E117-T183 PolarHBondContact OE2-OG1 3.11Å; I181-T183 PolarHBondContact O-N 3.37Å; T183-A187 WeakPolarHBondContact O-CB 3.17Å; T183-A187 PolarHBondContact O-N 2.9Å; T183-P206 HydrophobicContact CG2-CB 3.73Å; T183-P206 HydrophobicContact CG2-CG 4.29Å; T183-P206 WeakPolarHBondContact OG1-CG 3.32Å
184	S	83	Confident	87.9	Confident	84 Å²	84	37.6 Å²	37.6	59%	0.587	22%	0.222	S	C	*	.	H	α-helix	trans	-69.3	-42.2	-178.5	-62.5	0	0	0	0	111.7	N182 K188	N182-S184 VanDerWaalsContact C-N 3.32Å; N182-S184 PolarHBondContact O-N 3.06Å; N182-S184 WeakPolarHBondContact OD1-CB 3.3Å; N182-S184 PolarHBondContact OD1-N 3.03Å; S184-K188 WeakPolarHBondContact O-CG 3.46Å; S184-K188 PolarHBondContact O-N 3.1Å
185	D	89.9	Confident	88.2	Confident	20 Å²	20	35.2 Å²	35.2	11%	0.107	21%	0.207	C	C	.	.	H	α-helix	trans	-72.3	-48.7	-176.8	-67.9	-13	0	0	0	111.8	E153 L165 N182 A187 K188	E153-D185 HydrophobicContact CB-CB 4.11Å; E153-D185 WeakPolarHBondContact CB-OD2 3.12Å; E153-D185 PolarHBondContact N-OD2 3.31Å; L165-D185 HydrophobicContact CD1-CB 4.41Å; L165-D185 WeakPolarHBondContact CD1-O 3.09Å; N182-D185 HydrophobicContact CB-CB 4.06Å; N182-D185 VanDerWaalsContact CG-CG 3.45Å; N182-D185 VanDerWaalsContact ND2-CG 3.31Å; N182-D185 PolarHBondContact ND2-OD2 2.7Å; N182-D185 PolarHBondContact O-N 3.4Å; N182-D185 PolarHBondContact OD1-N 3.49Å; D185-A187 PolarHBondContact O-N 2.85Å; D185-K188 WeakPolarHBondContact O-CB 3.04Å; D185-K188 PolarHBondContact O-N 3.33Å; D185-K188 IonicContact OD1-NZ 3.62Å; D185-K188 PolarHBondContact OD1-NZ 2.85Å
186	L	90.7	Very high	88.7	Confident	0 Å²	0	33.3 Å²	33.3	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-64.7	-29.8	178.6	-176	59.5	0	0	0	111.5	L151 I156 L171 I181 N182 K188 C189 L192 L195 L209 L211	L151-L186 HydrophobicContact CD2-CD2 4.43Å; I156-L186 HydrophobicContact CD1-CB 4.18Å; I156-L186 HydrophobicContact CD1-CD1 3.97Å; L171-L186 HydrophobicContact CD2-CD1 3.73Å; I181-L186 HydrophobicContact CG2-CB 4.12Å; I181-L186 HydrophobicContact CG2-CD2 3.65Å; N182-L186 PolarHBondContact O-N 2.79Å; N182-L186 VanDerWaalsContact O-N 3.11Å; L186-K188 VanDerWaalsContact C-N 3.31Å; L186-K188 PolarHBondContact O-N 3.1Å; L186-C189 VanDerWaalsContact O-CB 3.31Å; L186-C189 WeakPolarHBondContact O-CB 3.25Å; L186-C189 PolarHBondContact O-N 2.96Å; L186-C189 VanDerWaalsContact O-N 3.14Å; L186-L192 HydrophobicContact CD1-CD2 3.93Å; L186-L195 HydrophobicContact CD2-CD2 4.18Å; L186-L209 HydrophobicContact CB-CD1 3.96Å; L186-L209 HydrophobicContact CD2-CD1 4.06Å; L186-L209 HydrophobicContact CD2-CD2 3.82Å; L186-L209 HydrophobicContact CG-CD1 3.97Å; L186-L209 HydrophobicContact CG-CD2 4.26Å; L186-L211 WeakPolarHBondContact O-CD2 3.46Å
187	A	86.8	Confident	89.1	Confident	26 Å²	26	31.5 Å²	31.5	22%	0.215	17%	0.173	C	C	.	.	H	α-helix	trans	-65.7	-26.4	172.8	0	0	0	0	0	114.4	T183 D185 C189	T183-A187 WeakPolarHBondContact O-CB 3.17Å; T183-A187 PolarHBondContact O-N 2.9Å; D185-A187 PolarHBondContact O-N 2.85Å; A187-C189 PolarHBondContact O-N 2.85Å
188	K	86.4	Confident	89.6	Confident	83 Å²	83	30.1 Å²	30.1	36%	0.361	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-15.9	172.4	-61.2	160.7	-173.4	165	0	112.7	E153 L165 S184 D185 L186 I190	E153-K188 IonicContact OE2-NZ 2.8Å; E153-K188 PolarHBondContact OE2-NZ 3.17Å; L165-K188 HydrophobicContact CB-CB 3.89Å; L165-K188 HydrophobicContact CD1-CB 3.79Å; L165-K188 HydrophobicContact CD1-CD 3.52Å; L165-K188 HydrophobicContact CD1-CG 4.31Å; S184-K188 WeakPolarHBondContact O-CG 3.46Å; S184-K188 PolarHBondContact O-N 3.1Å; D185-K188 WeakPolarHBondContact O-CB 3.04Å; D185-K188 PolarHBondContact O-N 3.33Å; D185-K188 IonicContact OD1-NZ 3.62Å; D185-K188 PolarHBondContact OD1-NZ 2.85Å; L186-K188 VanDerWaalsContact C-N 3.31Å; L186-K188 PolarHBondContact O-N 3.1Å; K188-I190 PolarHBondContact O-N 3.33Å
189	C	90.3	Very high	89.7	Confident	0 Å²	0	35 Å²	35	0%	0	18%	0.179	C	C	.	.			trans	-74.3	55	177.6	-63	0	0	0	0	112.6	V168 L186 A187 N191 L192 L211	V168-C189 HydrophobicContact CB-CB 4.38Å; L186-C189 VanDerWaalsContact O-CB 3.31Å; L186-C189 WeakPolarHBondContact O-CB 3.25Å; L186-C189 PolarHBondContact O-N 2.96Å; L186-C189 VanDerWaalsContact O-N 3.14Å; A187-C189 PolarHBondContact O-N 2.85Å; C189-N191 PolarHBondContact O-N 3.16Å; C189-L192 HydrophobicContact CB-CB 3.99Å; C189-L192 HydrophobicContact CB-CD2 4.08Å; C189-L192 WeakPolarHBondContact O-CB 3.28Å; C189-L192 PolarHBondContact O-N 3.18Å; C189-L211 HydrophobicContact CB-CD2 4.31Å; C189-L211 WeakPolarHBondContact O-CD2 3.49Å
190	I	85.9	Confident	90	Very high	39 Å²	39	34.8 Å²	34.8	20%	0.2	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-19.7	-168.6	59.6	167.4	0	0	0	115.1	D166 K188 P212 Q213	D166-I190 HydrophobicContact CB-CG1 4.33Å; K188-I190 PolarHBondContact O-N 3.33Å; I190-P212 WeakPolarHBondContact O-CD 3.36Å; I190-P212 WeakPolarHBondContact O-CG 3.36Å; I190-Q213 WeakPolarHBondContact O-CG 3.13Å
191	N	88.9	Confident	89.9	Confident	57 Å²	57	36.1 Å²	36.1	31%	0.305	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100	2	178	-73.4	-62	0	0	0	114.4	D166 V168 C189 R193	D166-N191 WeakPolarHBondContact O-CB 3.2Å; D166-N191 PolarHBondContact O-ND2 3.15Å; V168-N191 CarbonylContact O-C 3.6Å; C189-N191 PolarHBondContact O-N 3.16Å; N191-R193 VanDerWaalsContact O-CG 3.24Å; N191-R193 WeakPolarHBondContact O-CG 3.4Å; N191-R193 PolarHBondContact O-N 3.29Å
192	L	93.4	Very high	89.8	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	19%	0.187	C	C	.	.			trans	-60.7	119.9	-178	-178.9	55.6	0	0	0	111.3	V168 L171 L186 C189 E194 L195 L211 Q213 L214	V168-L192 HydrophobicContact CG1-CD1 4.22Å; V168-L192 VanDerWaalsContact O-CA 3.29Å; V168-L192 WeakPolarHBondContact O-CA 3.16Å; V168-L192 PolarHBondContact O-N 3.04Å; V168-L192 VanDerWaalsContact O-N 3.09Å; L171-L192 HydrophobicContact CB-CD1 3.81Å; L171-L192 HydrophobicContact CB-CD2 4.49Å; L186-L192 HydrophobicContact CD1-CD2 3.93Å; C189-L192 HydrophobicContact CB-CB 3.99Å; C189-L192 HydrophobicContact CB-CD2 4.08Å; C189-L192 WeakPolarHBondContact O-CB 3.28Å; C189-L192 PolarHBondContact O-N 3.18Å; L192-E194 VanDerWaalsContact CD1-O 3.23Å; L192-E194 WeakPolarHBondContact CD1-O 3.34Å; L192-L195 HydrophobicContact CD2-CB 4.21Å; L192-L195 HydrophobicContact CD2-CD1 4.27Å; L192-L195 HydrophobicContact CD2-CD2 4.31Å; L192-L195 HydrophobicContact CG-CB 4.45Å; L192-L211 HydrophobicContact CB-CD2 4.31Å; L192-L211 HydrophobicContact CD2-CD1 3.93Å; L192-L211 HydrophobicContact CD2-CD2 4.17Å; L192-Q213 CarbonylContact O-C 3Å; L192-L214 HydrophobicContact CG-CD1 4.1Å; L192-L214 VanDerWaalsContact O-CA 3.31Å; L192-L214 WeakPolarHBondContact O-CA 3.26Å; L192-L214 PolarHBondContact O-N 3.01Å; L192-L214 VanDerWaalsContact O-N 3.13Å
193	R	94.6	Very high	89.6	Confident	135 Å²	135	36.5 Å²	36.5	51%	0.509	19%	0.188	S	C	.	.			trans	-107.1	-27.2	-177	-51.8	-170.1	-178.2	-170.9	-2.1	113.1	C169 N191 Q213 T215 K216	C169-R193 WeakPolarHBondContact O-CB 3.46Å; C169-R193 PolarHBondContact O-N 2.76Å; N191-R193 VanDerWaalsContact O-CG 3.24Å; N191-R193 WeakPolarHBondContact O-CG 3.4Å; N191-R193 PolarHBondContact O-N 3.29Å; R193-Q213 WeakPolarHBondContact CA-O 3.44Å; R193-Q213 HydrophobicContact CG-CB 4.37Å; R193-T215 WeakPolarHBondContact O-CA 3.46Å; R193-T215 PolarHBondContact O-N 2.97Å; R193-T215 PolarHBondContact O-OG1 2.5Å; R193-K216 PolarHBondContact O-N 3.44Å
194	E	96.2	Very high	89.5	Confident	68 Å²	68	36.2 Å²	36.2	32%	0.318	19%	0.186	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	113.3	-176.2	-50.2	-168.2	-172.8	0	0	108.4	V170 L171 L192 K216	V170-E194 WeakPolarHBondContact CA-O 3.5Å; V170-E194 HydrophobicContact CG1-CB 4.26Å; V170-E194 HydrophobicContact CG2-CB 4.21Å; V170-E194 HydrophobicContact CG2-CG 4.33Å; L171-E194 PolarHBondContact N-O 3.48Å; L192-E194 VanDerWaalsContact CD1-O 3.23Å; L192-E194 WeakPolarHBondContact CD1-O 3.34Å; E194-K216 WeakPolarHBondContact CA-O 3.19Å; E194-K216 HydrophobicContact CB-CB 4.26Å; E194-K216 HydrophobicContact CG-CB 4.21Å; E194-K216 HydrophobicContact CG-CD 3.93Å; E194-K216 HydrophobicContact CG-CG 4.08Å; E194-K216 WeakPolarHBondContact OE1-CE 3.15Å; E194-K216 IonicContact OE1-NZ 2.7Å; E194-K216 PolarHBondContact OE1-NZ 3.19Å; E194-K216 WeakPolarHBondContact OE2-CD 3.01Å; E194-K216 WeakPolarHBondContact OE2-CE 3.47Å; E194-K216 IonicContact OE2-NZ 2.63Å; E194-K216 PolarHBondContact OE2-NZ 3.38Å
195	L	96.1	Very high	89.7	Confident	2 Å²	2	32.2 Å²	32.2	1%	0.01	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	121.2	177.7	178.5	54.9	0	0	0	108.6	L171 L186 L192 L197 L211 L214 K216 L217 S218	L171-L195 HydrophobicContact CB-CD1 4.13Å; L171-L195 HydrophobicContact CD2-CD1 3.93Å; L171-L195 HydrophobicContact CG-CD1 4.07Å; L171-L195 CarbonylContact O-C 3.5Å; L171-L195 WeakPolarHBondContact O-CA 3.41Å; L186-L195 HydrophobicContact CD2-CD2 4.18Å; L192-L195 HydrophobicContact CD2-CB 4.21Å; L192-L195 HydrophobicContact CD2-CD1 4.27Å; L192-L195 HydrophobicContact CD2-CD2 4.31Å; L192-L195 HydrophobicContact CG-CB 4.45Å; L195-L197 HydrophobicContact CD1-CD1 4.07Å; L195-L197 HydrophobicContact CD1-CD2 4.05Å; L195-L197 HydrophobicContact CD1-CG 3.79Å; L195-L197 HydrophobicContact CD2-CD1 3.93Å; L195-L197 HydrophobicContact CG-CD1 3.92Å; L195-L197 HydrophobicContact CG-CG 3.99Å; L195-L211 HydrophobicContact CD2-CD1 4.06Å; L195-L214 HydrophobicContact CB-CD1 3.61Å; L195-K216 PolarHBondContact N-O 3.26Å; L195-L217 HydrophobicContact CB-CD1 4.05Å; L195-L217 HydrophobicContact CD2-CD1 3.96Å; L195-L217 HydrophobicContact CG-CD1 3.94Å; L195-L217 CarbonylContact O-C 3.54Å; L195-L217 WeakPolarHBondContact O-CA 3.36Å; L195-S218 PolarHBondContact O-N 2.99Å
196	D	95.5	Very high	89.5	Confident	35 Å²	35	31.6 Å²	31.6	19%	0.187	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	110	176.8	-179.3	22.9	0	0	0	109.8	L171 S172 V173 S198 S218	L171-D196 PolarHBondContact O-N 3.43Å; S172-D196 PolarHBondContact OG-OD2 2.85Å; V173-D196 CarbonylContact C-O 3.52Å; V173-D196 WeakPolarHBondContact CG2-O 3.49Å; V173-D196 PolarHBondContact N-O 2.85Å; D196-S198 WeakPolarHBondContact OD1-CB 3.26Å; D196-S198 PolarHBondContact OD1-N 3.29Å; D196-S198 PolarHBondContact OD1-OG 2.99Å; D196-S218 WeakPolarHBondContact OD1-CB 3.35Å; D196-S218 PolarHBondContact OD1-OG 3.21Å
197	L	94.4	Very high	88.8	Confident	1 Å²	1	34 Å²	34	1%	0.005	16%	0.164	C	C	.	.			trans	-115.8	16.5	-178.2	-63.5	164.2	0	0	0	110.4	L151 V173 I181 L195 N200 L202 F205 S218 I219 N222	L151-L197 HydrophobicContact CD2-CD2 3.52Å; V173-L197 HydrophobicContact CG2-CD2 3.81Å; I181-L197 HydrophobicContact CD1-CD1 3.92Å; L195-L197 HydrophobicContact CD1-CD1 4.07Å; L195-L197 HydrophobicContact CD1-CD2 4.05Å; L195-L197 HydrophobicContact CD1-CG 3.79Å; L195-L197 HydrophobicContact CD2-CD1 3.93Å; L195-L197 HydrophobicContact CG-CD1 3.92Å; L195-L197 HydrophobicContact CG-CG 3.99Å; L197-N200 PolarHBondContact O-ND2 3.1Å; L197-L202 HydrophobicContact CB-CD1 4.09Å; L197-L202 HydrophobicContact CD1-CD1 4.33Å; L197-F205 HydrophobicContact CD1-CE2 3.96Å; L197-S218 PolarHBondContact N-O 3.44Å; L197-I219 HydrophobicContact CB-CG2 4.41Å; L197-I219 HydrophobicContact CD1-CG2 4.48Å; L197-N222 PolarHBondContact O-ND2 3.02Å
198	S	91.7	Very high	88.2	Confident	12 Å²	12	37 Å²	37	8%	0.084	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.7	153	-175.7	52.1	0	0	0	0	113.6	P174 A175 D196 N200 T220	P174-S198 CarbonylContact C-O 3.57Å; P174-S198 WeakPolarHBondContact CA-O 3.48Å; P174-S198 WeakPolarHBondContact CB-OG 3.43Å; A175-S198 PolarHBondContact N-O 3.18Å; D196-S198 WeakPolarHBondContact OD1-CB 3.26Å; D196-S198 PolarHBondContact OD1-N 3.29Å; D196-S198 PolarHBondContact OD1-OG 2.99Å; S198-N200 PolarHBondContact O-N 3.29Å; S198-N200 VanDerWaalsContact O-N 3.14Å; S198-N200 PolarHBondContact O-ND2 2.68Å; S198-T220 CarbonylContact C-O 3.59Å; S198-T220 VanDerWaalsContact CA-O 3.24Å; S198-T220 WeakPolarHBondContact CA-O 3.26Å; S198-T220 VanDerWaalsContact CB-OG1 3.25Å; S198-T220 WeakPolarHBondContact CB-OG1 3.48Å
199	E	89.5	Confident	87.9	Confident	105 Å²	105	33 Å²	33	49%	0.491	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.9	27.6	176.4	-40	-50.3	122.9	0	0	114.8	A175 T220	A175-E199 WeakPolarHBondContact CA-O 3.45Å; A175-E199 HydrophobicContact CB-CB 4.1Å; E199-T220 PolarHBondContact N-O 3.13Å; E199-T220 PolarHBondContact OE1-OG1 3.49Å
200	N	87.9	Confident	87.2	Confident	7 Å²	7	34.3 Å²	34.3	4%	0.037	16%	0.159	C	C	.	.	S	Bend	trans	-96.2	177.5	173.2	-73.8	-72.2	0	0	0	111.7	V173 S176 G177 Y178 L197 S198 L202 N222	V173-N200 PolarHBondContact O-ND2 3.22Å; S176-N200 WeakPolarHBondContact CA-OD1 3.41Å; S176-N200 PolarHBondContact N-OD1 2.76Å; G177-N200 PolarHBondContact N-OD1 2.8Å; Y178-N200 PolarHBondContact N-OD1 2.75Å; Y178-N200 VanDerWaalsContact N-OD1 3.15Å; L197-N200 PolarHBondContact O-ND2 3.1Å; S198-N200 PolarHBondContact O-N 3.29Å; S198-N200 VanDerWaalsContact O-N 3.14Å; S198-N200 PolarHBondContact O-ND2 2.68Å; N200-L202 VanDerWaalsContact C-N 3.3Å; N200-L202 HydrophobicContact CB-CG 4.12Å; N200-L202 PolarHBondContact O-N 2.8Å; N200-N222 VanDerWaalsContact C-OD1 3.28Å; N200-N222 WeakPolarHBondContact CB-OD1 3.5Å; N200-N222 PolarHBondContact O-OD1 3.22Å; N200-N222 VanDerWaalsContact O-OD1 3.13Å
201	A	84.2	Confident	87.3	Confident	31 Å²	31	32.6 Å²	32.6	26%	0.256	15%	0.15	S	C	.	.			trans	-87.9	8.1	-177.3	0	0	0	0	0	113.7	Y178 T179 R203	Y178-A201 PolarHBondContact O-N 2.95Å; T179-A201 HydrophobicContact CG2-CB 4.2Å; A201-R203 PolarHBondContact O-N 3.44Å; A201-R203 VanDerWaalsContact O-N 3.15Å
202	L	86.8	Confident	86.9	Confident	0 Å²	0	31.4 Å²	31.4	0%	0	15%	0.145	C	C	.	.			trans	-58	117.5	-167.1	-56.9	174.1	0	0	0	112.2	Y178 I181 L197 N200 N222 R223 F224	Y178-L202 PolarHBondContact O-N 2.67Å; I181-L202 HydrophobicContact CD1-CD1 3.87Å; I181-L202 HydrophobicContact CD1-CD2 4.27Å; I181-L202 HydrophobicContact CG1-CD1 4.38Å; I181-L202 HydrophobicContact CG1-CD2 3.9Å; L197-L202 HydrophobicContact CB-CD1 4.09Å; L197-L202 HydrophobicContact CD1-CD1 4.33Å; N200-L202 VanDerWaalsContact C-N 3.3Å; N200-L202 HydrophobicContact CB-CG 4.12Å; N200-L202 PolarHBondContact O-N 2.8Å; L202-N222 HydrophobicContact CB-CB 4.36Å; L202-N222 VanDerWaalsContact CB-OD1 3.22Å; L202-N222 WeakPolarHBondContact CB-OD1 3.37Å; L202-N222 VanDerWaalsContact CG-OD1 3.29Å; L202-N222 WeakPolarHBondContact CG-OD1 3.38Å; L202-N222 PolarHBondContact N-OD1 3.04Å; L202-R223 CarbonylContact O-C 3.47Å; L202-R223 VanDerWaalsContact O-C 3.32Å; L202-R223 WeakPolarHBondContact O-CA 3.43Å; L202-R223 PolarHBondContact O-N 3.37Å; L202-F224 HydrophobicContact CB-CE1 3.75Å; L202-F224 HydrophobicContact CB-CZ 4Å; L202-F224 HydrophobicContact CD1-CZ 4.22Å
203	R	82.3	Confident	86.7	Confident	45 Å²	45	33.2 Å²	33.2	17%	0.17	15%	0.154	C	C	.	.	S	Bend	trans	-83.2	-27.9	173.7	-61.2	173.3	-170.9	145.6	12.2	111.4	A122 E145 A201 F224 I225	A122-R203 PolarHBondContact O-NH1 2.94Å; E145-R203 IonicContact OE1-CZ 3.91Å; E145-R203 VanDerWaalsContact OE1-CZ 3.24Å; E145-R203 IonicContact OE1-NH1 2.95Å; E145-R203 PolarHBondContact OE1-NH1 3.09Å; E145-R203 IonicContact OE1-NH2 2.8Å; E145-R203 PolarHBondContact OE1-NH2 3.34Å; E145-R203 IonicContact OE2-NH2 3.5Å; A201-R203 PolarHBondContact O-N 3.44Å; A201-R203 VanDerWaalsContact O-N 3.15Å; R203-F224 WeakPolarHBondContact O-CA 3.39Å; R203-I225 WeakPolarHBondContact O-CG1 3.3Å; R203-I225 PolarHBondContact O-N 2.89Å
204	V	84.9	Confident	86.7	Confident	10 Å²	10	26.9 Å²	26.9	6%	0.061	13%	0.13	C	C	.	.			trans	-138	149.4	-168.8	175.2	0	0	0	0	111.3	L116 L119 I225	L116-V204 HydrophobicContact CB-CG1 3.61Å; L116-V204 HydrophobicContact CD2-CG1 3.75Å; L116-V204 HydrophobicContact CG-CG1 4.21Å; L116-V204 VanDerWaalsContact O-CG1 3.22Å; L116-V204 WeakPolarHBondContact O-CG1 3.44Å; L119-V204 HydrophobicContact CB-CG2 4.43Å; L119-V204 HydrophobicContact CD2-CG2 4.41Å; L119-V204 HydrophobicContact CG-CG2 4.37Å; V204-I225 HydrophobicContact CG2-CD1 3.92Å; V204-I225 HydrophobicContact CG2-CG1 4.17Å
205	F	87.8	Confident	86.7	Confident	0 Å²	0	25.6 Å²	25.6	0%	0	13%	0.126	C	C	.	.			trans	-129	123.7	177.7	-166	-89.4	0	0	0	111.5	L197 L209 L217 I219 F224 H226 P228 F233	L197-F205 HydrophobicContact CD1-CE2 3.96Å; F205-L209 HydrophobicContact CZ-CD2 4.26Å; F205-L217 HydrophobicContact CZ-CD1 4.47Å; F205-L217 HydrophobicContact CZ-CD2 4.2Å; F205-I219 HydrophobicContact CE2-CG2 4.03Å; F205-F224 HydrophobicContact CB-CD1 4.11Å; F205-F224 HydrophobicContact CB-CE1 3.67Å; F205-F224 HydrophobicContact CB-CZ 4.29Å; F205-F224 HydrophobicContact CD2-CE1 4.18Å; F205-F224 HydrophobicContact CD2-CZ 4.04Å; F205-F224 HydrophobicContact CG-CE1 4.41Å; F205-H226 PolarHBondContact N-NE2 2.91Å; F205-H226 PolarHBondContact O-CE1 3.47Å; F205-H226 VanDerWaalsContact O-CE1 3.3Å; F205-P228 HydrophobicContact CB-CB 3.81Å; F205-P228 HydrophobicContact CB-CG 4.01Å; F205-P228 HydrophobicContact CD1-CB 3.89Å; F205-P228 HydrophobicContact CG-CB 3.93Å; F205-P228 HydrophobicContact CG-CG 4.45Å; F205-F233 AromaticContact CE1-CE2 3.9Å; F205-F233 HydrophobicContact CE1-CE2 3.9Å; F205-F233 AromaticContact CE1-CZ 3.84Å; F205-F233 HydrophobicContact CE1-CZ 3.84Å; F205-F233 HydrophobicContact CZ-CE2 4.09Å; F205-F233 AromaticContact CZ-CZ 3.96Å; F205-F233 HydrophobicContact CZ-CZ 3.96Å
206	P	84.5	Confident	86.7	Confident	7 Å²	7	29 Å²	29	5%	0.045	14%	0.142	C	C	.	.			trans	-61.2	153.2	-177.9	-24.3	34.1	0	0	0	114.8	I181 T183 L209 Q232	I181-P206 HydrophobicContact CB-CG 4.37Å; I181-P206 HydrophobicContact CG2-CG 4.27Å; T183-P206 HydrophobicContact CG2-CB 3.73Å; T183-P206 HydrophobicContact CG2-CG 4.29Å; T183-P206 WeakPolarHBondContact OG1-CG 3.32Å; P206-L209 HydrophobicContact CB-CB 4.36Å; P206-L209 HydrophobicContact CB-CD1 4.45Å; P206-Q232 PolarHBondContact O-NE2 2.83Å
207	R	77.3	Confident	86.8	Confident	52 Å²	52	27.5 Å²	27.5	20%	0.196	13%	0.133	C	C	.	.	S	Bend	trans	-110.9	-20.8	-169.8	-60.3	160.2	158.3	-147.1	-39.3	113.9	A109 L111 D113 L116 L229 Q232	A109-R207 VanDerWaalsContact C-NH1 3.33Å; A109-R207 VanDerWaalsContact C-NH2 3.27Å; A109-R207 VanDerWaalsContact O-CZ 3.27Å; A109-R207 PolarHBondContact O-NH1 2.77Å; A109-R207 PolarHBondContact O-NH2 3.42Å; L111-R207 PolarHBondContact O-NH1 3.01Å; D113-R207 WeakPolarHBondContact OD1-CA 3.32Å; D113-R207 VanDerWaalsContact OD1-CB 3.3Å; D113-R207 WeakPolarHBondContact OD1-CB 3.18Å; D113-R207 PolarHBondContact OD1-N 2.93Å; L116-R207 VanDerWaalsContact CD1-CD 3.41Å; L116-R207 HydrophobicContact CD1-CG 4.27Å; L116-R207 VanDerWaalsContact CD1-NE 3.34Å; R207-L229 HydrophobicContact CB-CD2 4.39Å; R207-L229 HydrophobicContact CG-CB 4.47Å; R207-Q232 PolarHBondContact O-OE1 2.9Å; R207-Q232 VanDerWaalsContact O-OE1 3.1Å
208	R	74.3	Confident	86.8	Confident	88 Å²	88	28.1 Å²	28.1	33%	0.332	14%	0.138	S	C	.	.			trans	-108.1	34.5	172.4	-77.8	-179.2	-71.2	164.3	7	111.8	D113 H210	D113-R208 PolarHBondContact OD1-N 2.76Å; D113-R208 IonicContact OD2-CZ 2.65Å; D113-R208 IonicContact OD2-NE 3.72Å; D113-R208 PolarHBondContact OD2-NE 3.19Å; D113-R208 IonicContact OD2-NH2 2.84Å; D113-R208 PolarHBondContact OD2-NH2 3.03Å; R208-H210 VanDerWaalsContact C-N 3.27Å; R208-H210 PolarHBondContact O-N 3.18Å; R208-H210 PolarHBondContact O-ND1 2.9Å
209	L	79.3	Confident	86.9	Confident	0 Å²	0	27.6 Å²	27.6	0%	0	13%	0.134	C	C	.	.			trans	-79.3	74.2	176.9	-160	74.6	0	0	0	110.2	L186 F205 P206 L211 F233	L186-L209 HydrophobicContact CB-CD1 3.96Å; L186-L209 HydrophobicContact CD2-CD1 4.06Å; L186-L209 HydrophobicContact CD2-CD2 3.82Å; L186-L209 HydrophobicContact CG-CD1 3.97Å; L186-L209 HydrophobicContact CG-CD2 4.26Å; F205-L209 HydrophobicContact CZ-CD2 4.26Å; P206-L209 HydrophobicContact CB-CB 4.36Å; P206-L209 HydrophobicContact CB-CD1 4.45Å; L209-L211 VanDerWaalsContact C-N 3.26Å; L209-L211 HydrophobicContact CD2-CD1 3.77Å; L209-L211 HydrophobicContact CD2-CG 4.44Å; L209-L211 HydrophobicContact CG-CD1 4.03Å; L209-L211 HydrophobicContact CG-CG 4.15Å; L209-L211 PolarHBondContact O-N 3.18Å; L209-F233 HydrophobicContact CB-CE1 4.42Å; L209-F233 HydrophobicContact CB-CZ 4.41Å; L209-F233 HydrophobicContact CD2-CE1 4.38Å; L209-F233 HydrophobicContact CD2-CZ 4.14Å; L209-F233 VanDerWaalsContact O-CE1 3.32Å; L209-F233 WeakPolarHBondContact O-CE1 3.22Å
210	H	75.4	Confident	87	Confident	27 Å²	27	24.2 Å²	24.2	13%	0.125	12%	0.121	C	C	.	.			trans	-72.7	63.2	-167	-65.1	116.1	0	0	0	115.1	R208 P212 R310 M314 E318 F344	R208-H210 VanDerWaalsContact C-N 3.27Å; R208-H210 PolarHBondContact O-N 3.18Å; R208-H210 PolarHBondContact O-ND1 2.9Å; H210-P212 WeakPolarHBondContact O-CD 3.41Å; H210-R310 PolarHBondContact O-NH2 2.99Å; H210-M314 HydrophobicContact CB-CE 3.72Å; H210-M314 HydrophobicContact CB-SD 4.49Å; H210-M314 WeakPolarHBondContact ND1-CE 3.37Å; H210-E318 IonicContact CE1-OE1 2.69Å; H210-E318 IonicContact ND1-OE1 2.82Å; H210-F344 AromaticContact CD2-CE1 3.93Å; H210-F344 AromaticContact CD2-CE2 3.73Å; H210-F344 AromaticContact CD2-CZ 3.57Å; H210-F344 AromaticContact CE1-CE2 3.69Å; H210-F344 AromaticContact NE2-CD2 3.42Å; H210-F344 WeakPolarHBondContact NE2-CD2 3.38Å; H210-F344 AromaticContact NE2-CE2 3.24Å; H210-F344 WeakPolarHBondContact NE2-CE2 3.39Å; H210-F344 AromaticContact NE2-CG 3.92Å; H210-F344 AromaticContact NE2-CZ 3.59Å
211	L	87.5	Confident	86.9	Confident	3 Å²	3	25.4 Å²	25.4	2%	0.016	14%	0.135	C	C	.	.			trans	-86.6	96	-179.5	-63.3	174.7	0	0	0	111.9	L186 C189 L192 L195 L209 Q213 L214 F233	L186-L211 WeakPolarHBondContact O-CD2 3.46Å; C189-L211 HydrophobicContact CB-CD2 4.31Å; C189-L211 WeakPolarHBondContact O-CD2 3.49Å; L192-L211 HydrophobicContact CB-CD2 4.31Å; L192-L211 HydrophobicContact CD2-CD1 3.93Å; L192-L211 HydrophobicContact CD2-CD2 4.17Å; L195-L211 HydrophobicContact CD2-CD1 4.06Å; L209-L211 VanDerWaalsContact C-N 3.26Å; L209-L211 HydrophobicContact CD2-CD1 3.77Å; L209-L211 HydrophobicContact CD2-CG 4.44Å; L209-L211 HydrophobicContact CG-CD1 4.03Å; L209-L211 HydrophobicContact CG-CG 4.15Å; L209-L211 PolarHBondContact O-N 3.18Å; L211-Q213 VanDerWaalsContact C-N 3.29Å; L211-Q213 PolarHBondContact O-N 2.92Å; L211-L214 HydrophobicContact CB-CB 4.08Å; L211-L214 HydrophobicContact CD1-CD2 4.2Å; L211-L214 PolarHBondContact O-N 3.44Å; L211-F233 HydrophobicContact CB-CD1 4.26Å; L211-F233 HydrophobicContact CB-CE1 4.14Å; L211-F233 HydrophobicContact CD1-CE1 4.05Å; L211-F233 HydrophobicContact CG-CE1 4.37Å
212	P	82	Confident	87.1	Confident	31 Å²	31	24.7 Å²	24.7	20%	0.201	13%	0.126	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.7	-4.3	-165.6	37.6	-37.5	0	0	0	113.6	I190 H210 K235	I190-P212 WeakPolarHBondContact O-CD 3.36Å; I190-P212 WeakPolarHBondContact O-CG 3.36Å; H210-P212 WeakPolarHBondContact O-CD 3.41Å; P212-K235 WeakPolarHBondContact O-CD 3.39Å; P212-K235 WeakPolarHBondContact O-CE 3.13Å; P212-K235 PolarHBondContact O-NZ 3.11Å
213	Q	88.8	Confident	86.8	Confident	39 Å²	39	31.4 Å²	31.4	18%	0.182	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	-114	0.7	179.2	-55.3	-62.6	-3.3	0	0	113.1	I190 L192 R193 L211 T215	I190-Q213 WeakPolarHBondContact O-CG 3.13Å; L192-Q213 CarbonylContact O-C 3Å; R193-Q213 WeakPolarHBondContact CA-O 3.44Å; R193-Q213 HydrophobicContact CG-CB 4.37Å; L211-Q213 VanDerWaalsContact C-N 3.29Å; L211-Q213 PolarHBondContact O-N 2.92Å; Q213-T215 WeakPolarHBondContact O-CG2 3.31Å; Q213-T215 PolarHBondContact O-N 2.86Å
214	L	94.1	Very high	87	Confident	1 Å²	1	30.2 Å²	30.2	1%	0.005	15%	0.148	C	C	.	.			trans	-65.6	123.9	-172.5	-165	69.9	0	0	0	111.3	L192 L195 L211 K216 L217 F233 K235 L236	L192-L214 HydrophobicContact CG-CD1 4.1Å; L192-L214 VanDerWaalsContact O-CA 3.31Å; L192-L214 WeakPolarHBondContact O-CA 3.26Å; L192-L214 PolarHBondContact O-N 3.01Å; L192-L214 VanDerWaalsContact O-N 3.13Å; L195-L214 HydrophobicContact CB-CD1 3.61Å; L211-L214 HydrophobicContact CB-CB 4.08Å; L211-L214 HydrophobicContact CD1-CD2 4.2Å; L211-L214 PolarHBondContact O-N 3.44Å; L214-K216 WeakPolarHBondContact CD1-O 3.43Å; L214-L217 HydrophobicContact CD2-CB 4.18Å; L214-L217 HydrophobicContact CD2-CD1 4.4Å; L214-F233 HydrophobicContact CB-CD1 4.3Å; L214-F233 HydrophobicContact CD2-CB 4.44Å; L214-F233 HydrophobicContact CD2-CD1 3.57Å; L214-F233 HydrophobicContact CD2-CD2 4.19Å; L214-F233 HydrophobicContact CD2-CE1 3.77Å; L214-F233 HydrophobicContact CD2-CE2 4.37Å; L214-F233 HydrophobicContact CD2-CG 3.81Å; L214-F233 HydrophobicContact CD2-CZ 4.17Å; L214-K235 CarbonylContact O-C 3.37Å; L214-L236 WeakPolarHBondContact O-CA 3.38Å; L214-L236 PolarHBondContact O-N 3.23Å; L214-L236 VanDerWaalsContact O-N 3.08Å
215	T	96.1	Very high	86.7	Confident	41 Å²	41	30 Å²	30	25%	0.252	15%	0.146	S	C	.	.			trans	-120.2	-24.3	-178	65.9	0	0	0	0	113.5	R193 Q213 V237 R238	R193-T215 WeakPolarHBondContact O-CA 3.46Å; R193-T215 PolarHBondContact O-N 2.97Å; R193-T215 PolarHBondContact O-OG1 2.5Å; Q213-T215 WeakPolarHBondContact O-CG2 3.31Å; Q213-T215 PolarHBondContact O-N 2.86Å; T215-V237 HydrophobicContact CG2-CG2 4.39Å; T215-V237 WeakPolarHBondContact O-CA 3.27Å; T215-V237 WeakPolarHBondContact O-CB 3.25Å; T215-V237 PolarHBondContact O-N 2.85Å; T215-R238 PolarHBondContact O-N 2.84Å
216	K	96.7	Very high	86.3	Confident	75 Å²	75	30.2 Å²	30.2	33%	0.326	15%	0.147	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	131.2	171	-52.3	-176.9	-159	160.7	0	109	R193 E194 L195 L214 R238	R193-K216 PolarHBondContact O-N 3.44Å; E194-K216 WeakPolarHBondContact CA-O 3.19Å; E194-K216 HydrophobicContact CB-CB 4.26Å; E194-K216 HydrophobicContact CG-CB 4.21Å; E194-K216 HydrophobicContact CG-CD 3.93Å; E194-K216 HydrophobicContact CG-CG 4.08Å; E194-K216 WeakPolarHBondContact OE1-CE 3.15Å; E194-K216 IonicContact OE1-NZ 2.7Å; E194-K216 PolarHBondContact OE1-NZ 3.19Å; E194-K216 WeakPolarHBondContact OE2-CD 3.01Å; E194-K216 WeakPolarHBondContact OE2-CE 3.47Å; E194-K216 IonicContact OE2-NZ 2.63Å; E194-K216 PolarHBondContact OE2-NZ 3.38Å; L195-K216 PolarHBondContact N-O 3.26Å; L214-K216 WeakPolarHBondContact CD1-O 3.43Å; K216-R238 WeakPolarHBondContact CA-O 3.14Å; K216-R238 HydrophobicContact CG-CB 4.38Å
217	L	96.3	Very high	86.2	Confident	2 Å²	2	32.5 Å²	32.5	1%	0.01	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	132.7	169.8	-179.8	58.7	0	0	0	108.9	L195 F205 L214 I219 F230 F233 L236 R238 L239 N240	L195-L217 HydrophobicContact CB-CD1 4.05Å; L195-L217 HydrophobicContact CD2-CD1 3.96Å; L195-L217 HydrophobicContact CG-CD1 3.94Å; L195-L217 CarbonylContact O-C 3.54Å; L195-L217 WeakPolarHBondContact O-CA 3.36Å; F205-L217 HydrophobicContact CZ-CD1 4.47Å; F205-L217 HydrophobicContact CZ-CD2 4.2Å; L214-L217 HydrophobicContact CD2-CB 4.18Å; L214-L217 HydrophobicContact CD2-CD1 4.4Å; L217-I219 HydrophobicContact CD1-CG2 3.75Å; L217-I219 HydrophobicContact CD2-CG2 4.46Å; L217-I219 HydrophobicContact CG-CG2 3.97Å; L217-F230 HydrophobicContact CD2-CD1 4.02Å; L217-F230 HydrophobicContact CD2-CE1 4.45Å; L217-F233 HydrophobicContact CD2-CD2 3.89Å; L217-F233 HydrophobicContact CD2-CE2 3.56Å; L217-F233 HydrophobicContact CD2-CZ 4.4Å; L217-L236 HydrophobicContact CB-CD1 3.67Å; L217-R238 PolarHBondContact N-O 3.18Å; L217-L239 HydrophobicContact CB-CD1 4.01Å; L217-L239 HydrophobicContact CD2-CD1 3.99Å; L217-L239 HydrophobicContact CG-CD1 4.04Å; L217-L239 CarbonylContact O-C 3.56Å; L217-L239 WeakPolarHBondContact O-CA 3.45Å; L217-N240 PolarHBondContact O-N 2.87Å
218	S	95.3	Very high	86.7	Confident	15 Å²	15	30.1 Å²	30.1	11%	0.105	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	123.9	176.8	176.7	0	0	0	0	109.3	L195 D196 L197	L195-S218 PolarHBondContact O-N 2.99Å; D196-S218 WeakPolarHBondContact OD1-CB 3.35Å; D196-S218 PolarHBondContact OD1-OG 3.21Å; L197-S218 PolarHBondContact N-O 3.44Å
219	I	94.1	Very high	87.2	Confident	0 Å²	0	27.4 Å²	27.4	0%	0	14%	0.142	C	C	.	.			trans	-144	18.4	-171.9	61.3	128.7	0	0	0	112.8	L197 F205 L217 N222 F224 P228 F230 N240 L241 L245	L197-I219 HydrophobicContact CB-CG2 4.41Å; L197-I219 HydrophobicContact CD1-CG2 4.48Å; F205-I219 HydrophobicContact CE2-CG2 4.03Å; L217-I219 HydrophobicContact CD1-CG2 3.75Å; L217-I219 HydrophobicContact CD2-CG2 4.46Å; L217-I219 HydrophobicContact CG-CG2 3.97Å; I219-N222 PolarHBondContact O-ND2 2.9Å; I219-F224 HydrophobicContact CB-CE2 4.04Å; I219-F224 HydrophobicContact CB-CZ 4.45Å; I219-F224 HydrophobicContact CD1-CD2 4.07Å; I219-F224 HydrophobicContact CD1-CE2 3.56Å; I219-F224 HydrophobicContact CD1-CZ 4.44Å; I219-F224 HydrophobicContact CG1-CE2 4.42Å; I219-P228 HydrophobicContact CD1-CG 4.42Å; I219-F230 HydrophobicContact CD1-CE1 3.51Å; I219-F230 HydrophobicContact CD1-CZ 3.58Å; I219-F230 HydrophobicContact CG1-CE1 4.02Å; I219-F230 HydrophobicContact CG1-CZ 4.49Å; I219-N240 WeakPolarHBondContact CG1-O 3.37Å; I219-N240 PolarHBondContact N-O 2.85Å; I219-L241 HydrophobicContact CD1-CB 3.79Å; I219-L241 HydrophobicContact CG1-CB 3.87Å; I219-L245 HydrophobicContact CD1-CD1 4.21Å
220	T	92.3	Very high	87.7	Confident	35 Å²	35	27.4 Å²	27.4	22%	0.215	14%	0.142	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.3	160.6	177	55.7	0	0	0	0	112	S198 E199 N222 N240 D242	S198-T220 CarbonylContact C-O 3.59Å; S198-T220 VanDerWaalsContact CA-O 3.24Å; S198-T220 WeakPolarHBondContact CA-O 3.26Å; S198-T220 VanDerWaalsContact CB-OG1 3.25Å; S198-T220 WeakPolarHBondContact CB-OG1 3.48Å; E199-T220 PolarHBondContact N-O 3.13Å; E199-T220 PolarHBondContact OE1-OG1 3.49Å; T220-N222 PolarHBondContact O-N 2.83Å; T220-N222 VanDerWaalsContact O-N 3.1Å; T220-N222 PolarHBondContact O-ND2 2.85Å; T220-N240 HydrophobicContact CG2-CB 4.27Å; T220-D242 WeakPolarHBondContact CA-OD1 3.43Å
221	G	84.9	Confident	88.3	Confident	32 Å²	32	26.3 Å²	26.3	33%	0.33	14%	0.137	S	C	.	.	T	Hydrogen-bonded Turn	trans	68.3	10.6	171.7	0	0	0	0	0	115.5	D242	G221-D242 PolarHBondContact N-OD1 3.29Å; G221-D242 PolarHBondContact N-OD2 2.9Å
222	N	87.4	Confident	88.2	Confident	15 Å²	15	26.7 Å²	26.7	8%	0.08	14%	0.139	C	C	.	.			trans	-94	168.3	177.4	-76.9	-85.8	0	0	0	111.7	L197 N200 L202 I219 T220 F224	L197-N222 PolarHBondContact O-ND2 3.02Å; N200-N222 VanDerWaalsContact C-OD1 3.28Å; N200-N222 WeakPolarHBondContact CB-OD1 3.5Å; N200-N222 PolarHBondContact O-OD1 3.22Å; N200-N222 VanDerWaalsContact O-OD1 3.13Å; L202-N222 HydrophobicContact CB-CB 4.36Å; L202-N222 VanDerWaalsContact CB-OD1 3.22Å; L202-N222 WeakPolarHBondContact CB-OD1 3.37Å; L202-N222 VanDerWaalsContact CG-OD1 3.29Å; L202-N222 WeakPolarHBondContact CG-OD1 3.38Å; L202-N222 PolarHBondContact N-OD1 3.04Å; I219-N222 PolarHBondContact O-ND2 2.9Å; T220-N222 PolarHBondContact O-N 2.83Å; T220-N222 VanDerWaalsContact O-N 3.1Å; T220-N222 PolarHBondContact O-ND2 2.85Å; N222-F224 HydrophobicContact CB-CD2 3.76Å; N222-F224 HydrophobicContact CB-CE1 4.46Å; N222-F224 HydrophobicContact CB-CE2 3.3Å; N222-F224 HydrophobicContact CB-CZ 3.7Å
223	R	82.4	Confident	88.7	Confident	142 Å²	142	25.2 Å²	25.2	54%	0.536	13%	0.129	S	C	.	.			trans	-107.1	40.8	-169.9	-62.5	-170.8	-174.1	-166.9	3.8	112.9	N95 L202 I225	N95-R223 WeakPolarHBondContact ND2-CA 3.33Å; N95-R223 WeakPolarHBondContact ND2-CB 3.35Å; N95-R223 PolarHBondContact ND2-O 2.86Å; L202-R223 CarbonylContact O-C 3.47Å; L202-R223 VanDerWaalsContact O-C 3.32Å; L202-R223 WeakPolarHBondContact O-CA 3.43Å; L202-R223 PolarHBondContact O-N 3.37Å; R223-I225 PolarHBondContact O-N 3.22Å
224	F	85.3	Confident	88.6	Confident	20 Å²	20	26.3 Å²	26.3	9%	0.088	14%	0.139	C	C	.	.			trans	-61	123.2	-171.6	-64.4	-61.8	0	0	0	114.3	L202 R203 F205 I219 N222 P228 L245	L202-F224 HydrophobicContact CB-CE1 3.75Å; L202-F224 HydrophobicContact CB-CZ 4Å; L202-F224 HydrophobicContact CD1-CZ 4.22Å; R203-F224 WeakPolarHBondContact O-CA 3.39Å; F205-F224 HydrophobicContact CB-CD1 4.11Å; F205-F224 HydrophobicContact CB-CE1 3.67Å; F205-F224 HydrophobicContact CB-CZ 4.29Å; F205-F224 HydrophobicContact CD2-CE1 4.18Å; F205-F224 HydrophobicContact CD2-CZ 4.04Å; F205-F224 HydrophobicContact CG-CE1 4.41Å; I219-F224 HydrophobicContact CB-CE2 4.04Å; I219-F224 HydrophobicContact CB-CZ 4.45Å; I219-F224 HydrophobicContact CD1-CD2 4.07Å; I219-F224 HydrophobicContact CD1-CE2 3.56Å; I219-F224 HydrophobicContact CD1-CZ 4.44Å; I219-F224 HydrophobicContact CG1-CE2 4.42Å; N222-F224 HydrophobicContact CB-CD2 3.76Å; N222-F224 HydrophobicContact CB-CE1 4.46Å; N222-F224 HydrophobicContact CB-CE2 3.3Å; N222-F224 HydrophobicContact CB-CZ 3.7Å; F224-P228 HydrophobicContact CB-CG 4.46Å; F224-P228 HydrophobicContact CD1-CG 4.32Å; F224-P228 HydrophobicContact CD2-CG 4.12Å; F224-P228 HydrophobicContact CE2-CG 4.47Å; F224-P228 HydrophobicContact CG-CG 4.03Å; F224-L245 HydrophobicContact CD2-CD1 3.97Å
225	I	78.6	Confident	88.5	Confident	5 Å²	5	29.4 Å²	29.4	3%	0.026	15%	0.153	C	C	.	.	S	Bend	trans	-90	-16.6	-179.2	68.3	-179.7	0	0	0	112.7	L98 V99 L102 I108 L119 R203 V204 R223	L98-I225 HydrophobicContact CD1-CG2 4.33Å; L98-I225 HydrophobicContact CD2-CB 4.44Å; L98-I225 HydrophobicContact CD2-CD1 4.04Å; L98-I225 HydrophobicContact CD2-CG2 3.94Å; V99-I225 HydrophobicContact CG2-CB 3.75Å; V99-I225 HydrophobicContact CG2-CG2 4.43Å; V99-I225 WeakPolarHBondContact CG2-O 3.18Å; L102-I225 HydrophobicContact CD1-CD1 3.78Å; I108-I225 HydrophobicContact CD1-CB 4.18Å; I108-I225 HydrophobicContact CD1-CD1 4.18Å; I108-I225 HydrophobicContact CD1-CG1 4.04Å; I108-I225 HydrophobicContact CG2-CD1 4.22Å; I108-I225 HydrophobicContact CG2-CG1 4.14Å; L119-I225 HydrophobicContact CD2-CD1 3.75Å; L119-I225 HydrophobicContact CG-CD1 4.04Å; R203-I225 WeakPolarHBondContact O-CG1 3.3Å; R203-I225 PolarHBondContact O-N 2.89Å; V204-I225 HydrophobicContact CG2-CD1 3.92Å; V204-I225 HydrophobicContact CG2-CG1 4.17Å; R223-I225 PolarHBondContact O-N 3.22Å
226	H	79.2	Confident	88.4	Confident	4 Å²	4	27.5 Å²	27.5	2%	0.019	14%	0.141	C	C	.	.	S	Bend	trans	-123.4	164.8	169.1	69.4	88.5	0	0	0	109.9	I108 F205 P228	I108-H226 HydrophobicContact CB-CB 4.39Å; I108-H226 HydrophobicContact CG2-CB 3.95Å; F205-H226 PolarHBondContact N-NE2 2.91Å; F205-H226 PolarHBondContact O-CE1 3.47Å; F205-H226 VanDerWaalsContact O-CE1 3.3Å; H226-P228 WeakPolarHBondContact O-CD 3.35Å
227	L	83.5	Confident	88.4	Confident	56 Å²	56	26 Å²	26	29%	0.293	14%	0.138	S	C	.	.			trans	-71.7	123.6	168.9	-172.1	63.9	0	0	0	109.2	F230 L245 L248 L249	L227-F230 HydrophobicContact CD1-CE2 4.41Å; L227-L245 HydrophobicContact CD1-CB 4.46Å; L227-L245 HydrophobicContact CD1-CD2 4.06Å; L227-L248 HydrophobicContact CD1-CB 3.9Å; L227-L248 HydrophobicContact CD2-CB 4.1Å; L227-L248 WeakPolarHBondContact CD2-O 3.38Å; L227-L249 HydrophobicContact CD1-CD2 4.13Å
228	P	86.5	Confident	88.4	Confident	1 Å²	1	31.8 Å²	31.8	1%	0.006	16%	0.16	C	C	.	.			trans	-66.2	145.3	173.5	-21.7	34.9	0	0	0	111.4	F205 I219 F224 H226 F230	F205-P228 HydrophobicContact CB-CB 3.81Å; F205-P228 HydrophobicContact CB-CG 4.01Å; F205-P228 HydrophobicContact CD1-CB 3.89Å; F205-P228 HydrophobicContact CG-CB 3.93Å; F205-P228 HydrophobicContact CG-CG 4.45Å; I219-P228 HydrophobicContact CD1-CG 4.42Å; F224-P228 HydrophobicContact CB-CG 4.46Å; F224-P228 HydrophobicContact CD1-CG 4.32Å; F224-P228 HydrophobicContact CD2-CG 4.12Å; F224-P228 HydrophobicContact CE2-CG 4.47Å; F224-P228 HydrophobicContact CG-CG 4.03Å; H226-P228 WeakPolarHBondContact O-CD 3.35Å; P228-F230 HydrophobicContact CB-CD1 4.41Å; P228-F230 HydrophobicContact CB-CD2 4.47Å; P228-F230 HydrophobicContact CB-CE1 3.81Å; P228-F230 HydrophobicContact CB-CE2 3.87Å; P228-F230 HydrophobicContact CB-CZ 3.52Å; P228-F230 HydrophobicContact CG-CE1 4.25Å; P228-F230 HydrophobicContact CG-CE2 4.18Å; P228-F230 HydrophobicContact CG-CZ 3.65Å; P228-F230 WeakPolarHBondContact O-CD2 3.41Å; P228-F230 VanDerWaalsContact O-CE2 3.29Å; P228-F230 WeakPolarHBondContact O-CE2 3.22Å; P228-F230 PolarHBondContact O-N 2.9Å; P228-F230 VanDerWaalsContact O-N 3.12Å
229	L	85.1	Confident	88.5	Confident	31 Å²	31	31.1 Å²	31.1	16%	0.162	16%	0.155	C	C	.	.			trans	-87	74.9	-179.3	-172.2	66.5	0	0	0	110.3	R207 E231 Q232 Y338 L341	R207-L229 HydrophobicContact CB-CD2 4.39Å; R207-L229 HydrophobicContact CG-CB 4.47Å; L229-E231 HydrophobicContact CD1-CB 4.34Å; L229-E231 PolarHBondContact O-N 2.81Å; L229-Q232 VanDerWaalsContact O-CG 3.25Å; L229-Q232 WeakPolarHBondContact O-CG 3.42Å; L229-Q232 PolarHBondContact O-N 3.05Å; L229-Q232 PolarHBondContact O-NE2 3.04Å; L229-Y338 HydrophobicContact CD1-CD1 4.1Å; L229-Y338 HydrophobicContact CD1-CE1 4.01Å; L229-L341 HydrophobicContact CD2-CB 4.47Å
230	F	89.3	Confident	88.5	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	17%	0.171	C	C	.	.	G	3₁₀ helix	trans	-62.2	-25.8	-177.9	-54.4	-76.2	0	0	0	113.1	L217 I219 L227 P228 Q232 F233 L239 L241 L249 C258	L217-F230 HydrophobicContact CD2-CD1 4.02Å; L217-F230 HydrophobicContact CD2-CE1 4.45Å; I219-F230 HydrophobicContact CD1-CE1 3.51Å; I219-F230 HydrophobicContact CD1-CZ 3.58Å; I219-F230 HydrophobicContact CG1-CE1 4.02Å; I219-F230 HydrophobicContact CG1-CZ 4.49Å; L227-F230 HydrophobicContact CD1-CE2 4.41Å; P228-F230 HydrophobicContact CB-CD1 4.41Å; P228-F230 HydrophobicContact CB-CD2 4.47Å; P228-F230 HydrophobicContact CB-CE1 3.81Å; P228-F230 HydrophobicContact CB-CE2 3.87Å; P228-F230 HydrophobicContact CB-CZ 3.52Å; P228-F230 HydrophobicContact CG-CE1 4.25Å; P228-F230 HydrophobicContact CG-CE2 4.18Å; P228-F230 HydrophobicContact CG-CZ 3.65Å; P228-F230 WeakPolarHBondContact O-CD2 3.41Å; P228-F230 VanDerWaalsContact O-CE2 3.29Å; P228-F230 WeakPolarHBondContact O-CE2 3.22Å; P228-F230 PolarHBondContact O-N 2.9Å; P228-F230 VanDerWaalsContact O-N 3.12Å; F230-Q232 PolarHBondContact O-N 3.37Å; F230-F233 VanDerWaalsContact O-CD2 3.32Å; F230-F233 WeakPolarHBondContact O-CD2 3.43Å; F230-F233 PolarHBondContact O-N 2.86Å; F230-L239 HydrophobicContact CB-CD2 4.21Å; F230-L239 HydrophobicContact CD1-CD1 3.65Å; F230-L239 HydrophobicContact CD1-CD2 3.97Å; F230-L239 HydrophobicContact CD1-CG 4.47Å; F230-L239 HydrophobicContact CD2-CD2 4.4Å; F230-L239 HydrophobicContact CE1-CD1 3.93Å; F230-L239 HydrophobicContact CE1-CD2 4.46Å; F230-L239 HydrophobicContact CG-CD1 4.42Å; F230-L239 HydrophobicContact CG-CD2 3.92Å; F230-L241 HydrophobicContact CD2-CD1 4.43Å; F230-L241 HydrophobicContact CE1-CD1 4.33Å; F230-L241 HydrophobicContact CE2-CD1 3.63Å; F230-L241 HydrophobicContact CZ-CB 4.47Å; F230-L241 HydrophobicContact CZ-CD1 3.55Å; F230-L249 HydrophobicContact CD2-CD2 3.49Å; F230-L249 VanDerWaalsContact CD2-CD2 3.49Å; F230-L249 HydrophobicContact CE2-CD2 3.63Å; F230-C258 PolarHBondContact O-SG 2.88Å
231	E	88.4	Confident	88.6	Confident	5 Å²	5	32.6 Å²	32.6	2%	0.023	16%	0.161	C	C	.	.	G	3₁₀ helix	trans	-55.4	-19.8	176.2	-68.1	89	154.6	0	0	113	L229 F233 M253 L254 F257 Y338 L341	L229-E231 HydrophobicContact CD1-CB 4.34Å; L229-E231 PolarHBondContact O-N 2.81Å; E231-F233 PolarHBondContact O-N 3.07Å; E231-F233 VanDerWaalsContact O-N 3.11Å; E231-M253 HydrophobicContact CG-CB 4.49Å; E231-L254 HydrophobicContact CG-CD2 4.22Å; E231-F257 HydrophobicContact CB-CB 3.74Å; E231-F257 HydrophobicContact CB-CD2 3.78Å; E231-F257 HydrophobicContact CB-CG 3.98Å; E231-F257 HydrophobicContact CG-CB 4.19Å; E231-F257 HydrophobicContact CG-CD2 3.91Å; E231-F257 HydrophobicContact CG-CG 4.45Å; E231-F257 WeakPolarHBondContact O-CB 3.39Å; E231-Y338 HydrophobicContact CB-CE1 4.47Å; E231-Y338 HydrophobicContact CG-CD1 4.45Å; E231-Y338 HydrophobicContact CG-CE1 3.86Å; E231-Y338 WeakPolarHBondContact OE1-CE1 3.47Å; E231-Y338 PolarHBondContact OE1-OH 2.87Å; E231-L341 VanDerWaalsContact C-CD2 3.49Å; E231-L341 HydrophobicContact CB-CD2 3.43Å; E231-L341 VanDerWaalsContact CB-CD2 3.43Å
232	Q	86.8	Confident	88.9	Confident	11 Å²	11	33.3 Å²	33.3	5%	0.051	16%	0.158	C	C	.	.	G	3₁₀ helix	trans	-65.9	-8.7	176.8	78.5	-168.8	-77.1	0	0	115	P206 R207 L229 F230 P234 L341	P206-Q232 PolarHBondContact O-NE2 2.83Å; R207-Q232 PolarHBondContact O-OE1 2.9Å; R207-Q232 VanDerWaalsContact O-OE1 3.1Å; L229-Q232 VanDerWaalsContact O-CG 3.25Å; L229-Q232 WeakPolarHBondContact O-CG 3.42Å; L229-Q232 PolarHBondContact O-N 3.05Å; L229-Q232 PolarHBondContact O-NE2 3.04Å; F230-Q232 PolarHBondContact O-N 3.37Å; Q232-P234 WeakPolarHBondContact O-CD 3.27Å; Q232-L341 HydrophobicContact CB-CD1 4.27Å
233	F	91.2	Very high	88.9	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	18%	0.179	C	C	.	.			trans	-109	84.1	-173.7	-55.6	-61.7	0	0	0	113.4	F205 L209 L211 L214 L217 F230 E231 K235 L236 C258	F205-F233 AromaticContact CE1-CE2 3.9Å; F205-F233 HydrophobicContact CE1-CE2 3.9Å; F205-F233 AromaticContact CE1-CZ 3.84Å; F205-F233 HydrophobicContact CE1-CZ 3.84Å; F205-F233 HydrophobicContact CZ-CE2 4.09Å; F205-F233 AromaticContact CZ-CZ 3.96Å; F205-F233 HydrophobicContact CZ-CZ 3.96Å; L209-F233 HydrophobicContact CB-CE1 4.42Å; L209-F233 HydrophobicContact CB-CZ 4.41Å; L209-F233 HydrophobicContact CD2-CE1 4.38Å; L209-F233 HydrophobicContact CD2-CZ 4.14Å; L209-F233 VanDerWaalsContact O-CE1 3.32Å; L209-F233 WeakPolarHBondContact O-CE1 3.22Å; L211-F233 HydrophobicContact CB-CD1 4.26Å; L211-F233 HydrophobicContact CB-CE1 4.14Å; L211-F233 HydrophobicContact CD1-CE1 4.05Å; L211-F233 HydrophobicContact CG-CE1 4.37Å; L214-F233 HydrophobicContact CB-CD1 4.3Å; L214-F233 HydrophobicContact CD2-CB 4.44Å; L214-F233 HydrophobicContact CD2-CD1 3.57Å; L214-F233 HydrophobicContact CD2-CD2 4.19Å; L214-F233 HydrophobicContact CD2-CE1 3.77Å; L214-F233 HydrophobicContact CD2-CE2 4.37Å; L214-F233 HydrophobicContact CD2-CG 3.81Å; L214-F233 HydrophobicContact CD2-CZ 4.17Å; L217-F233 HydrophobicContact CD2-CD2 3.89Å; L217-F233 HydrophobicContact CD2-CE2 3.56Å; L217-F233 HydrophobicContact CD2-CZ 4.4Å; F230-F233 VanDerWaalsContact O-CD2 3.32Å; F230-F233 WeakPolarHBondContact O-CD2 3.43Å; F230-F233 PolarHBondContact O-N 2.86Å; E231-F233 PolarHBondContact O-N 3.07Å; E231-F233 VanDerWaalsContact O-N 3.11Å; F233-K235 PolarHBondContact O-N 2.85Å; F233-L236 HydrophobicContact CB-CB 3.97Å; F233-L236 HydrophobicContact CB-CD2 4.4Å; F233-L236 VanDerWaalsContact O-CB 3.27Å; F233-L236 WeakPolarHBondContact O-CB 3.26Å; F233-L236 PolarHBondContact O-N 3.46Å; F233-L236 VanDerWaalsContact O-N 3.09Å; F233-C258 PolarHBondContact O-SG 2.93Å
234	P	87.1	Confident	89	Confident	61 Å²	61	37.8 Å²	37.8	40%	0.396	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-8.2	-169	28.1	-37.6	0	0	0	116.1	Q232 F257	Q232-P234 WeakPolarHBondContact O-CD 3.27Å; P234-F257 WeakPolarHBondContact CA-O 3.43Å
235	K	92.1	Very high	89.1	Confident	66 Å²	66	37.7 Å²	37.7	29%	0.287	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-108.1	4.4	174.5	-62.6	-169.1	-163.8	153.9	0	113.9	P212 L214 F233 V237 K260	P212-K235 WeakPolarHBondContact O-CD 3.39Å; P212-K235 WeakPolarHBondContact O-CE 3.13Å; P212-K235 PolarHBondContact O-NZ 3.11Å; L214-K235 CarbonylContact O-C 3.37Å; F233-K235 PolarHBondContact O-N 2.85Å; K235-V237 WeakPolarHBondContact O-CG2 3.29Å; K235-V237 PolarHBondContact O-N 2.85Å; K235-K260 HydrophobicContact CB-CD 4.48Å
236	L	94.7	Very high	89.6	Confident	1 Å²	1	40 Å²	40	1%	0.005	20%	0.196	C	C	.	.			trans	-58.5	129.9	-177.8	-168	64.4	0	0	0	110.5	L214 L217 F233 R238 L239 K260 L261	L214-L236 WeakPolarHBondContact O-CA 3.38Å; L214-L236 PolarHBondContact O-N 3.23Å; L214-L236 VanDerWaalsContact O-N 3.08Å; L217-L236 HydrophobicContact CB-CD1 3.67Å; F233-L236 HydrophobicContact CB-CB 3.97Å; F233-L236 HydrophobicContact CB-CD2 4.4Å; F233-L236 VanDerWaalsContact O-CB 3.27Å; F233-L236 WeakPolarHBondContact O-CB 3.26Å; F233-L236 PolarHBondContact O-N 3.46Å; F233-L236 VanDerWaalsContact O-N 3.09Å; L236-R238 WeakPolarHBondContact CD1-O 3.46Å; L236-L239 HydrophobicContact CD2-CB 4.15Å; L236-L239 HydrophobicContact CD2-CD1 4.3Å; L236-K260 CarbonylContact O-C 3.35Å; L236-L261 HydrophobicContact CD2-CD1 4.36Å; L236-L261 HydrophobicContact CG-CD1 4.22Å; L236-L261 WeakPolarHBondContact O-CA 3.34Å; L236-L261 PolarHBondContact O-N 3.02Å
237	V	96.3	Very high	89.9	Confident	44 Å²	44	47.5 Å²	47.5	27%	0.267	23%	0.23	S	C	.	.			trans	-114.3	-33.6	-178.7	-173.8	0	0	0	0	111.3	T215 K235 K260 K262 Y263	T215-V237 HydrophobicContact CG2-CG2 4.39Å; T215-V237 WeakPolarHBondContact O-CA 3.27Å; T215-V237 WeakPolarHBondContact O-CB 3.25Å; T215-V237 PolarHBondContact O-N 2.85Å; K235-V237 WeakPolarHBondContact O-CG2 3.29Å; K235-V237 PolarHBondContact O-N 2.85Å; V237-K260 WeakPolarHBondContact CA-O 3.29Å; V237-K260 HydrophobicContact CG2-CB 4.27Å; V237-K262 HydrophobicContact CG1-CB 4.31Å; V237-K262 PolarHBondContact O-N 2.89Å; V237-Y263 PolarHBondContact O-N 2.68Å; V237-Y263 VanDerWaalsContact O-N 3.16Å
238	R	96.6	Very high	89.9	Confident	124 Å²	124	50 Å²	50	47%	0.468	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	132.7	176.2	-56.8	-169.2	173.9	178.2	-1.5	110.5	T215 K216 L217 L236 Y263	T215-R238 PolarHBondContact O-N 2.84Å; K216-R238 WeakPolarHBondContact CA-O 3.14Å; K216-R238 HydrophobicContact CG-CB 4.38Å; L217-R238 PolarHBondContact N-O 3.18Å; L236-R238 WeakPolarHBondContact CD1-O 3.46Å; R238-Y263 WeakPolarHBondContact CA-O 3.43Å; R238-Y263 HydrophobicContact CG-CD2 4.07Å; R238-Y263 HydrophobicContact CG-CG 4.48Å
239	L	96.2	Very high	90	Very high	0 Å²	0	51 Å²	51	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	127.4	171.7	-179.5	61.7	0	0	0	109.4	L217 F230 L236 L241 L249 L261 Y263 I264 N265	L217-L239 HydrophobicContact CB-CD1 4.01Å; L217-L239 HydrophobicContact CD2-CD1 3.99Å; L217-L239 HydrophobicContact CG-CD1 4.04Å; L217-L239 CarbonylContact O-C 3.56Å; L217-L239 WeakPolarHBondContact O-CA 3.45Å; F230-L239 HydrophobicContact CB-CD2 4.21Å; F230-L239 HydrophobicContact CD1-CD1 3.65Å; F230-L239 HydrophobicContact CD1-CD2 3.97Å; F230-L239 HydrophobicContact CD1-CG 4.47Å; F230-L239 HydrophobicContact CD2-CD2 4.4Å; F230-L239 HydrophobicContact CE1-CD1 3.93Å; F230-L239 HydrophobicContact CE1-CD2 4.46Å; F230-L239 HydrophobicContact CG-CD1 4.42Å; F230-L239 HydrophobicContact CG-CD2 3.92Å; L236-L239 HydrophobicContact CD2-CB 4.15Å; L236-L239 HydrophobicContact CD2-CD1 4.3Å; L239-L241 HydrophobicContact CD2-CD1 4.31Å; L239-L241 HydrophobicContact CD2-CD2 4.18Å; L239-L241 HydrophobicContact CG-CD2 4.17Å; L239-L249 HydrophobicContact CD2-CD1 4.39Å; L239-L261 HydrophobicContact CB-CD1 4.1Å; L239-Y263 PolarHBondContact N-O 3.1Å; L239-I264 CarbonylContact O-C 3.43Å; L239-I264 VanDerWaalsContact O-CA 3.3Å; L239-I264 WeakPolarHBondContact O-CA 3.43Å; L239-N265 PolarHBondContact O-N 2.98Å
240	N	95.4	Very high	90.2	Very high	65 Å²	65	52.3 Å²	52.3	35%	0.348	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	121.5	167.5	-63.9	-17.2	0	0	0	108.6	L217 I219 T220 N265	L217-N240 PolarHBondContact O-N 2.87Å; I219-N240 WeakPolarHBondContact CG1-O 3.37Å; I219-N240 PolarHBondContact N-O 2.85Å; T220-N240 HydrophobicContact CG2-CB 4.27Å; N240-N265 WeakPolarHBondContact CA-OD1 3.39Å
241	L	94.6	Very high	90.3	Very high	1 Å²	1	54.9 Å²	54.9	1%	0.005	27%	0.273	C	S	.	.			trans	-150	161.9	178.3	81.5	174.8	0	0	0	110.7	I219 F230 L239 L245 K246 L249 I264 N265	I219-L241 HydrophobicContact CD1-CB 3.79Å; I219-L241 HydrophobicContact CG1-CB 3.87Å; F230-L241 HydrophobicContact CD2-CD1 4.43Å; F230-L241 HydrophobicContact CE1-CD1 4.33Å; F230-L241 HydrophobicContact CE2-CD1 3.63Å; F230-L241 HydrophobicContact CZ-CB 4.47Å; F230-L241 HydrophobicContact CZ-CD1 3.55Å; L239-L241 HydrophobicContact CD2-CD1 4.31Å; L239-L241 HydrophobicContact CD2-CD2 4.18Å; L239-L241 HydrophobicContact CG-CD2 4.17Å; L241-L245 HydrophobicContact CD1-CB 3.66Å; L241-L245 HydrophobicContact CG-CB 4.1Å; L241-K246 HydrophobicContact CD2-CB 3.91Å; L241-K246 HydrophobicContact CD2-CG 4.3Å; L241-K246 HydrophobicContact CG-CB 4.29Å; L241-L249 HydrophobicContact CD1-CD1 3.97Å; L241-L249 HydrophobicContact CD1-CD2 4.31Å; L241-L249 HydrophobicContact CD1-CG 4.42Å; L241-I264 HydrophobicContact CD2-CG2 3.68Å; L241-N265 PolarHBondContact N-OD1 3.26Å; L241-N265 VanDerWaalsContact O-CG 3.24Å; L241-N265 PolarHBondContact O-ND2 3.06Å; L241-N265 PolarHBondContact O-OD1 3.23Å
242	D	90	Very high	90.4	Very high	48 Å²	48	55.9 Å²	55.9	26%	0.257	28%	0.277	S	S	.	.			trans	-63.9	142.2	-178.8	-50.1	-61.7	0	0	0	112	T220 G221 K244 L245 K246	T220-D242 WeakPolarHBondContact CA-OD1 3.43Å; G221-D242 PolarHBondContact N-OD1 3.29Å; G221-D242 PolarHBondContact N-OD2 2.9Å; D242-K244 PolarHBondContact O-N 2.73Å; D242-L245 WeakPolarHBondContact O-CA 3.3Å; D242-L245 WeakPolarHBondContact O-CB 3.08Å; D242-L245 PolarHBondContact O-N 3.29Å; D242-K246 PolarHBondContact O-N 3.21Å
243	D	87.2	Confident	90.6	Very high	98 Å²	98	55.6 Å²	55.6	52%	0.524	28%	0.276	S	S	.	.	H	α-helix	trans	-62.4	-19.5	-174.5	-75	-41.2	0	0	0	113.2	K246 Q247 N265	D243-K246 WeakPolarHBondContact OD1-CD 3.43Å; D243-Q247 WeakPolarHBondContact O-CG 3.48Å; D243-Q247 PolarHBondContact O-N 2.84Å; D243-Q247 PolarHBondContact O-NE2 3.11Å; D243-N265 PolarHBondContact OD1-ND2 3.22Å
244	K	85.4	Confident	90.6	Very high	153 Å²	153	55.7 Å²	55.7	67%	0.665	28%	0.277	S	S	*	.	H	α-helix	trans	-65.4	-41.7	169.1	-176.7	-179.5	178.5	-177.4	0	112.2	D242	D242-K244 PolarHBondContact O-N 2.73Å
245	L	87.1	Confident	90.8	Very high	18 Å²	18	54.1 Å²	54.1	9%	0.094	27%	0.265	C	S	.	.	H	α-helix	trans	-74.9	-38.9	176.1	-64.7	172.2	0	0	0	111	I219 F224 L227 L241 D242 Q247 L248	I219-L245 HydrophobicContact CD1-CD1 4.21Å; F224-L245 HydrophobicContact CD2-CD1 3.97Å; L227-L245 HydrophobicContact CD1-CB 4.46Å; L227-L245 HydrophobicContact CD1-CD2 4.06Å; L241-L245 HydrophobicContact CD1-CB 3.66Å; L241-L245 HydrophobicContact CG-CB 4.1Å; D242-L245 WeakPolarHBondContact O-CA 3.3Å; D242-L245 WeakPolarHBondContact O-CB 3.08Å; D242-L245 PolarHBondContact O-N 3.29Å; L245-Q247 PolarHBondContact O-N 2.76Å; L245-L248 WeakPolarHBondContact O-CB 3.44Å; L245-L248 PolarHBondContact O-N 3Å
246	K	89.2	Confident	90.8	Very high	54 Å²	54	52.5 Å²	52.5	24%	0.235	26%	0.258	C	S	.	.	H	α-helix	trans	-54.6	-37.2	176.7	-174.3	172.5	173.3	174.1	0	113.2	L241 D242 D243 L248 I264	L241-K246 HydrophobicContact CD2-CB 3.91Å; L241-K246 HydrophobicContact CD2-CG 4.3Å; L241-K246 HydrophobicContact CG-CB 4.29Å; D242-K246 PolarHBondContact O-N 3.21Å; D243-K246 WeakPolarHBondContact OD1-CD 3.43Å; K246-L248 VanDerWaalsContact C-N 3.26Å; K246-L248 PolarHBondContact O-N 2.86Å; K246-I264 HydrophobicContact CD-CG2 3.85Å; K246-I264 HydrophobicContact CG-CG2 4.01Å; K246-I264 PolarHBondContact NZ-O 3.12Å
247	Q	85.2	Confident	90.5	Very high	160 Å²	160	52.7 Å²	52.7	75%	0.748	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71	-15.1	177.1	-75	168.7	72.6	0	0	114.4	D243 L245	D243-Q247 WeakPolarHBondContact O-CG 3.48Å; D243-Q247 PolarHBondContact O-N 2.84Å; D243-Q247 PolarHBondContact O-NE2 3.11Å; L245-Q247 PolarHBondContact O-N 2.76Å
248	L	84.6	Confident	90.2	Very high	110 Å²	110	50.6 Å²	50.6	58%	0.576	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-98.7	-6.2	-178.6	-61.2	173.8	0	0	0	113.3	L227 L245 K246	L227-L248 HydrophobicContact CD1-CB 3.9Å; L227-L248 HydrophobicContact CD2-CB 4.1Å; L227-L248 WeakPolarHBondContact CD2-O 3.38Å; L245-L248 WeakPolarHBondContact O-CB 3.44Å; L245-L248 PolarHBondContact O-N 3Å; K246-L248 VanDerWaalsContact C-N 3.26Å; K246-L248 PolarHBondContact O-N 2.86Å
249	L	86.8	Confident	89.9	Confident	21 Å²	21	48.8 Å²	48.8	11%	0.11	25%	0.25	C	S	.	.			trans	-71.8	152.5	178.8	-55.5	-178.7	0	0	0	111.7	L227 F230 L239 L241 P251 L254	L227-L249 HydrophobicContact CD1-CD2 4.13Å; F230-L249 HydrophobicContact CD2-CD2 3.49Å; F230-L249 VanDerWaalsContact CD2-CD2 3.49Å; F230-L249 HydrophobicContact CE2-CD2 3.63Å; L239-L249 HydrophobicContact CD2-CD1 4.39Å; L241-L249 HydrophobicContact CD1-CD1 3.97Å; L241-L249 HydrophobicContact CD1-CD2 4.31Å; L241-L249 HydrophobicContact CD1-CG 4.42Å; L249-P251 WeakPolarHBondContact O-CD 3.36Å; L249-L254 HydrophobicContact CB-CD1 4.01Å; L249-L254 HydrophobicContact CD1-CD1 3.95Å
250	N	89.5	Confident	89.7	Confident	59 Å²	59	54.1 Å²	54.1	32%	0.316	27%	0.274	S	S	.	.			trans	-101.6	105.9	171.9	-174.7	-21.8	0	0	0	110.2	Q252 M253 L254 Y338	N250-Q252 VanDerWaalsContact C-N 3.29Å; N250-Q252 PolarHBondContact O-N 3.34Å; N250-Q252 PolarHBondContact OD1-N 3.37Å; N250-M253 HydrophobicContact CB-CB 4.2Å; N250-M253 HydrophobicContact CB-CG 4.1Å; N250-M253 WeakPolarHBondContact ND2-CG 3.23Å; N250-M253 PolarHBondContact O-N 2.92Å; N250-M253 VanDerWaalsContact O-N 3.09Å; N250-L254 PolarHBondContact O-N 3Å; N250-Y338 WeakPolarHBondContact CB-OH 3.49Å
251	P	91.2	Very high	89.7	Confident	54 Å²	54	51.6 Å²	51.6	35%	0.351	26%	0.26	S	S	.	.	H	α-helix	trans	-56.9	-39.7	-175.8	-26.7	36.1	0	0	0	113.5	L249 M253 L254 V255 F269 E271	L249-P251 WeakPolarHBondContact O-CD 3.36Å; P251-M253 VanDerWaalsContact C-N 3.29Å; P251-M253 PolarHBondContact O-N 2.93Å; P251-L254 PolarHBondContact O-N 3.35Å; P251-V255 WeakPolarHBondContact O-CG2 3.14Å; P251-V255 PolarHBondContact O-N 2.91Å; P251-F269 HydrophobicContact CB-CE2 4.2Å; P251-F269 HydrophobicContact CB-CZ 4.23Å; P251-E271 HydrophobicContact CB-CB 4.46Å; P251-E271 HydrophobicContact CB-CG 3.74Å
252	Q	92	Very high	89.6	Confident	25 Å²	25	56.5 Å²	56.5	12%	0.117	28%	0.281	C	S	.	.	H	α-helix	trans	-63.7	-35.1	-179.7	-69.2	-72.5	-62.7	0	0	112.2	N250 Y256 E271 M272 L273 T274 T277	N250-Q252 VanDerWaalsContact C-N 3.29Å; N250-Q252 PolarHBondContact O-N 3.34Å; N250-Q252 PolarHBondContact OD1-N 3.37Å; Q252-Y256 PolarHBondContact O-N 3.46Å; Q252-E271 PolarHBondContact NE2-OE1 3Å; Q252-M272 PolarHBondContact NE2-O 2.99Å; Q252-L273 WeakPolarHBondContact O-CD2 3.4Å; Q252-T274 PolarHBondContact OE1-OG1 2.71Å; Q252-T277 HydrophobicContact CB-CG2 4.11Å; Q252-T277 PolarHBondContact OE1-OG1 2.84Å
253	M	91	Very high	89.9	Confident	5 Å²	5	58 Å²	58	3%	0.025	28%	0.284	C	S	.	.	H	α-helix	trans	-81.2	-34.5	178.5	-56.9	-52.4	-57.5	0	0	112.1	E231 N250 P251 V255 Y256 F257 T277 I281 L335 Y338	E231-M253 HydrophobicContact CG-CB 4.49Å; N250-M253 HydrophobicContact CB-CB 4.2Å; N250-M253 HydrophobicContact CB-CG 4.1Å; N250-M253 WeakPolarHBondContact ND2-CG 3.23Å; N250-M253 PolarHBondContact O-N 2.92Å; N250-M253 VanDerWaalsContact O-N 3.09Å; P251-M253 VanDerWaalsContact C-N 3.29Å; P251-M253 PolarHBondContact O-N 2.93Å; M253-V255 VanDerWaalsContact C-N 3.34Å; M253-V255 PolarHBondContact O-N 2.84Å; M253-Y256 PolarHBondContact O-N 2.75Å; M253-F257 HydrophobicContact CB-CD2 4.37Å; M253-F257 HydrophobicContact CE-CD2 4.03Å; M253-F257 HydrophobicContact CE-CE2 3.42Å; M253-F257 VanDerWaalsContact CE-CE2 3.42Å; M253-F257 HydrophobicContact CE-CZ 4.25Å; M253-F257 WeakPolarHBondContact O-CD2 3.35Å; M253-F257 PolarHBondContact O-N 3.27Å; M253-T277 HydrophobicContact SD-CG2 4.37Å; M253-I281 HydrophobicContact CE-CD1 4.11Å; M253-I281 HydrophobicContact SD-CD1 4.42Å; M253-L335 HydrophobicContact CE-CD2 3.46Å; M253-L335 VanDerWaalsContact CE-CD2 3.46Å; M253-L335 HydrophobicContact SD-CD2 3.82Å; M253-Y338 HydrophobicContact CB-CE1 4.15Å; M253-Y338 HydrophobicContact CB-CE2 4.08Å; M253-Y338 HydrophobicContact CE-CD2 4.09Å; M253-Y338 HydrophobicContact CE-CG 4.12Å; M253-Y338 HydrophobicContact CG-CD2 4Å; M253-Y338 HydrophobicContact CG-CE2 3.59Å
254	L	91.2	Very high	90.2	Very high	3 Å²	3	53.8 Å²	53.8	2%	0.016	26%	0.261	C	S	.	.	H	α-helix	trans	-57.7	-44.5	169.2	-71.1	175.1	0	0	0	111.8	E231 L249 N250 P251 Y256 C258 L261 I264 F269	E231-L254 HydrophobicContact CG-CD2 4.22Å; L249-L254 HydrophobicContact CB-CD1 4.01Å; L249-L254 HydrophobicContact CD1-CD1 3.95Å; N250-L254 PolarHBondContact O-N 3Å; P251-L254 PolarHBondContact O-N 3.35Å; L254-Y256 VanDerWaalsContact C-N 3.32Å; L254-Y256 PolarHBondContact O-N 3.31Å; L254-C258 CarbonylContact O-C 3.18Å; L254-C258 VanDerWaalsContact O-CA 3.27Å; L254-C258 WeakPolarHBondContact O-CA 3.22Å; L254-C258 WeakPolarHBondContact O-CB 3.48Å; L254-C258 PolarHBondContact O-N 2.81Å; L254-L261 HydrophobicContact CB-CD2 4.36Å; L254-L261 HydrophobicContact CD1-CD2 4.31Å; L254-L261 HydrophobicContact CD2-CD2 4.32Å; L254-I264 HydrophobicContact CD1-CD1 4.06Å; L254-F269 HydrophobicContact CB-CE1 4.26Å; L254-F269 HydrophobicContact CB-CZ 4.02Å; L254-F269 HydrophobicContact CD1-CE2 4.41Å; L254-F269 HydrophobicContact CD1-CZ 4.13Å
255	V	91.1	Very high	90.6	Very high	27 Å²	27	48.7 Å²	48.7	16%	0.164	24%	0.241	C	C	.	.	H	α-helix	trans	-64.6	-36.7	177.7	178.4	0	0	0	0	111.7	P251 M253 P259 F269 E271 L273	P251-V255 WeakPolarHBondContact O-CG2 3.14Å; P251-V255 PolarHBondContact O-N 2.91Å; M253-V255 VanDerWaalsContact C-N 3.34Å; M253-V255 PolarHBondContact O-N 2.84Å; V255-P259 WeakPolarHBondContact O-CA 3.45Å; V255-F269 HydrophobicContact CG2-CE1 3.76Å; V255-F269 HydrophobicContact CG2-CZ 3.96Å; V255-E271 HydrophobicContact CG2-CB 3.6Å; V255-E271 HydrophobicContact CG2-CG 3.68Å; V255-E271 VanDerWaalsContact CG2-O 3.28Å; V255-E271 WeakPolarHBondContact CG2-O 3.26Å; V255-L273 HydrophobicContact CB-CD2 3.96Å; V255-L273 HydrophobicContact CB-CG 4.37Å; V255-L273 HydrophobicContact CG1-CD2 3.92Å; V255-L273 HydrophobicContact CG1-CG 3.77Å
256	Y	90.7	Very high	90.7	Very high	32 Å²	32	50.5 Å²	50.5	13%	0.125	26%	0.264	C	S	.	.	H	α-helix	trans	-71.3	-45.9	179.8	-179.7	-104.7	0	0	0	113.3	Q252 M253 L254 L273 I281 L342 R345	Q252-Y256 PolarHBondContact O-N 3.46Å; M253-Y256 PolarHBondContact O-N 2.75Å; L254-Y256 VanDerWaalsContact C-N 3.32Å; L254-Y256 PolarHBondContact O-N 3.31Å; Y256-L273 HydrophobicContact CD2-CD1 4.25Å; Y256-I281 HydrophobicContact CD1-CD1 3.82Å; Y256-I281 HydrophobicContact CD2-CD1 3.69Å; Y256-I281 HydrophobicContact CD2-CG2 4.42Å; Y256-I281 HydrophobicContact CE1-CD1 4.19Å; Y256-I281 HydrophobicContact CE1-CG2 4.1Å; Y256-I281 HydrophobicContact CE2-CD1 4.08Å; Y256-I281 HydrophobicContact CE2-CG2 3.74Å; Y256-I281 HydrophobicContact CG-CD1 3.55Å; Y256-L342 HydrophobicContact CE1-CD1 3.92Å; Y256-R345 PolarHBondContact O-NH1 3.12Å
257	F	89.1	Confident	90.8	Very high	5 Å²	5	53.2 Å²	53.2	2%	0.022	28%	0.28	C	S	.	.	H	α-helix	trans	-90.5	-36.2	-173.9	-73	-65.3	0	0	0	113.5	E231 P234 M253 P259 Y338 L341 L342	E231-F257 HydrophobicContact CB-CB 3.74Å; E231-F257 HydrophobicContact CB-CD2 3.78Å; E231-F257 HydrophobicContact CB-CG 3.98Å; E231-F257 HydrophobicContact CG-CB 4.19Å; E231-F257 HydrophobicContact CG-CD2 3.91Å; E231-F257 HydrophobicContact CG-CG 4.45Å; E231-F257 WeakPolarHBondContact O-CB 3.39Å; P234-F257 WeakPolarHBondContact CA-O 3.43Å; M253-F257 HydrophobicContact CB-CD2 4.37Å; M253-F257 HydrophobicContact CE-CD2 4.03Å; M253-F257 HydrophobicContact CE-CE2 3.42Å; M253-F257 VanDerWaalsContact CE-CE2 3.42Å; M253-F257 HydrophobicContact CE-CZ 4.25Å; M253-F257 WeakPolarHBondContact O-CD2 3.35Å; M253-F257 PolarHBondContact O-N 3.27Å; F257-P259 WeakPolarHBondContact O-CD 3.29Å; F257-Y338 HydrophobicContact CD2-CD1 4.45Å; F257-Y338 AromaticContact CE2-CD1 3.87Å; F257-Y338 HydrophobicContact CE2-CD1 3.87Å; F257-Y338 HydrophobicContact CE2-CG 4.06Å; F257-L341 HydrophobicContact CB-CD2 4.37Å; F257-L341 HydrophobicContact CD1-CD2 3.66Å; F257-L341 HydrophobicContact CD1-CG 3.85Å; F257-L341 HydrophobicContact CD2-CD2 3.9Å; F257-L341 HydrophobicContact CE1-CB 4.35Å; F257-L341 HydrophobicContact CE1-CD2 3.76Å; F257-L341 HydrophobicContact CE1-CG 3.61Å; F257-L341 HydrophobicContact CE2-CD2 3.96Å; F257-L341 HydrophobicContact CG-CD2 3.74Å; F257-L341 HydrophobicContact CG-CG 4.44Å; F257-L341 HydrophobicContact CZ-CB 4.32Å; F257-L341 HydrophobicContact CZ-CD2 3.9Å; F257-L341 HydrophobicContact CZ-CG 3.97Å; F257-L342 HydrophobicContact CE1-CD1 4.5Å; F257-L342 HydrophobicContact CZ-CB 4.18Å; F257-L342 HydrophobicContact CZ-CD1 4.48Å
258	C	90.9	Very high	91.1	Very high	1 Å²	1	51.2 Å²	51.2	1%	0.007	27%	0.267	C	S	.	.			trans	-112.2	60.1	177.5	-59.7	0	0	0	0	111.8	F230 F233 L254 K260 L261	F230-C258 PolarHBondContact O-SG 2.88Å; F233-C258 PolarHBondContact O-SG 2.93Å; L254-C258 CarbonylContact O-C 3.18Å; L254-C258 VanDerWaalsContact O-CA 3.27Å; L254-C258 WeakPolarHBondContact O-CA 3.22Å; L254-C258 WeakPolarHBondContact O-CB 3.48Å; L254-C258 PolarHBondContact O-N 2.81Å; C258-K260 PolarHBondContact O-N 2.88Å; C258-L261 HydrophobicContact CB-CB 4.12Å; C258-L261 VanDerWaalsContact O-CB 3.26Å; C258-L261 WeakPolarHBondContact O-CB 3.21Å; C258-L261 PolarHBondContact O-N 2.63Å
259	P	90.1	Very high	91.4	Very high	85 Å²	85	47.7 Å²	47.7	55%	0.552	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.7	4.6	-173	31.3	-39.2	0	0	0	114.9	V255 F257	V255-P259 WeakPolarHBondContact O-CA 3.45Å; F257-P259 WeakPolarHBondContact O-CD 3.29Å
260	K	92.5	Very high	91.2	Very high	113 Å²	113	54 Å²	54	49%	0.491	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.3	-3.2	172.5	-58	-160.5	-178.4	-169.7	0	113.3	K235 L236 V237 C258 K262	K235-K260 HydrophobicContact CB-CD 4.48Å; L236-K260 CarbonylContact O-C 3.35Å; V237-K260 WeakPolarHBondContact CA-O 3.29Å; V237-K260 HydrophobicContact CG2-CB 4.27Å; C258-K260 PolarHBondContact O-N 2.88Å; K260-K262 PolarHBondContact O-N 3.21Å
261	L	94	Very high	91.2	Very high	11 Å²	11	55 Å²	55	6%	0.058	28%	0.278	C	S	.	.			trans	-67.9	121.9	-175.7	-175.1	60.9	0	0	0	109.6	L236 L239 L254 C258 I264 F269	L236-L261 HydrophobicContact CD2-CD1 4.36Å; L236-L261 HydrophobicContact CG-CD1 4.22Å; L236-L261 WeakPolarHBondContact O-CA 3.34Å; L236-L261 PolarHBondContact O-N 3.02Å; L239-L261 HydrophobicContact CB-CD1 4.1Å; L254-L261 HydrophobicContact CB-CD2 4.36Å; L254-L261 HydrophobicContact CD1-CD2 4.31Å; L254-L261 HydrophobicContact CD2-CD2 4.32Å; C258-L261 HydrophobicContact CB-CB 4.12Å; C258-L261 VanDerWaalsContact O-CB 3.26Å; C258-L261 WeakPolarHBondContact O-CB 3.21Å; C258-L261 PolarHBondContact O-N 2.63Å; L261-I264 HydrophobicContact CD1-CG1 4.36Å; L261-I264 HydrophobicContact CD2-CD1 3.89Å; L261-I264 HydrophobicContact CD2-CG1 4.05Å; L261-I264 HydrophobicContact CG-CG1 4.29Å; L261-F269 HydrophobicContact CB-CD1 4.33Å; L261-F269 HydrophobicContact CD2-CD1 4.05Å; L261-F269 HydrophobicContact CD2-CE1 4.17Å; L261-F269 HydrophobicContact CG-CD1 4.01Å
262	K	93.3	Very high	90.9	Very high	104 Å²	104	58.4 Å²	58.4	45%	0.452	29%	0.291	S	S	.	.			trans	-123.5	-16.5	-177.3	-71.3	-173.8	-179.2	-163.7	0	113.7	V237 K260 Y268 F269	V237-K262 HydrophobicContact CG1-CB 4.31Å; V237-K262 PolarHBondContact O-N 2.89Å; K260-K262 PolarHBondContact O-N 3.21Å; K262-Y268 HydrophobicContact CB-CD2 4.47Å; K262-Y268 HydrophobicContact CB-CE2 4.1Å; K262-Y268 HydrophobicContact CG-CE2 4.42Å; K262-Y268 CarbonylContact O-C 3.03Å; K262-Y268 VanDerWaalsContact O-CA 3.31Å; K262-Y268 WeakPolarHBondContact O-CA 3.42Å; K262-Y268 WeakPolarHBondContact O-CD2 3.47Å; K262-F269 PolarHBondContact O-N 2.83Å
263	Y	95.9	Very high	90.8	Very high	81 Å²	81	60 Å²	60	32%	0.318	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	132.3	-178.3	-57.7	-91.4	0	0	0	111.7	V237 R238 L239 G266 I267 Y268	V237-Y263 PolarHBondContact O-N 2.68Å; V237-Y263 VanDerWaalsContact O-N 3.16Å; R238-Y263 WeakPolarHBondContact CA-O 3.43Å; R238-Y263 HydrophobicContact CG-CD2 4.07Å; R238-Y263 HydrophobicContact CG-CG 4.48Å; L239-Y263 PolarHBondContact N-O 3.1Å; Y263-G266 WeakPolarHBondContact CD1-O 3.04Å; Y263-I267 CarbonylContact C-O 3.55Å; Y263-I267 VanDerWaalsContact CA-O 3.23Å; Y263-I267 WeakPolarHBondContact CA-O 3.38Å; Y263-Y268 HydrophobicContact CD1-CD2 4.36Å; Y263-Y268 AromaticContact CE1-CD2 3.9Å; Y263-Y268 HydrophobicContact CE1-CD2 3.9Å; Y263-Y268 HydrophobicContact CE2-CD2 4.48Å; Y263-Y268 AromaticContact CZ-CD2 3.95Å
264	I	94.4	Very high	90.7	Very high	9 Å²	9	62.9 Å²	62.9	5%	0.046	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	112.2	172.5	-54.5	177.6	0	0	0	109.3	L239 L241 K246 L254 L261 G266 I267 F269	L239-I264 CarbonylContact O-C 3.43Å; L239-I264 VanDerWaalsContact O-CA 3.3Å; L239-I264 WeakPolarHBondContact O-CA 3.43Å; L241-I264 HydrophobicContact CD2-CG2 3.68Å; K246-I264 HydrophobicContact CD-CG2 3.85Å; K246-I264 HydrophobicContact CG-CG2 4.01Å; K246-I264 PolarHBondContact NZ-O 3.12Å; L254-I264 HydrophobicContact CD1-CD1 4.06Å; L261-I264 HydrophobicContact CD1-CG1 4.36Å; L261-I264 HydrophobicContact CD2-CD1 3.89Å; L261-I264 HydrophobicContact CD2-CG1 4.05Å; L261-I264 HydrophobicContact CG-CG1 4.29Å; I264-G266 VanDerWaalsContact C-N 3.33Å; I264-I267 PolarHBondContact N-O 3.2Å; I264-I267 PolarHBondContact O-N 2.85Å; I264-F269 HydrophobicContact CD1-CB 4.16Å; I264-F269 HydrophobicContact CD1-CD1 4.41Å; I264-F269 HydrophobicContact CD1-CD2 3.48Å; I264-F269 VanDerWaalsContact CD1-CD2 3.48Å; I264-F269 HydrophobicContact CD1-CE2 3.91Å; I264-F269 HydrophobicContact CD1-CG 3.76Å; I264-F269 HydrophobicContact CG1-CB 4.04Å; I264-F269 HydrophobicContact CG1-CD2 4.3Å; I264-F269 HydrophobicContact CG1-CG 4.19Å
265	N	93.3	Very high	90.5	Very high	45 Å²	45	68.1 Å²	68.1	24%	0.241	35%	0.346	C	S	.	.	T	Hydrogen-bonded Turn	trans	54.9	46.5	-169.2	-58.2	-5.8	0	0	0	111.9	L239 N240 L241 D243 I267	L239-N265 PolarHBondContact O-N 2.98Å; N240-N265 WeakPolarHBondContact CA-OD1 3.39Å; L241-N265 PolarHBondContact N-OD1 3.26Å; L241-N265 VanDerWaalsContact O-CG 3.24Å; L241-N265 PolarHBondContact O-ND2 3.06Å; L241-N265 PolarHBondContact O-OD1 3.23Å; D243-N265 PolarHBondContact OD1-ND2 3.22Å; N265-I267 PolarHBondContact O-N 2.89Å
266	G	88.4	Confident	90.4	Very high	56 Å²	56	73.4 Å²	73.4	58%	0.577	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	71	-17.4	-177.5	0	0	0	0	0	116.1	Y263 I264	Y263-G266 WeakPolarHBondContact CD1-O 3.04Å; I264-G266 VanDerWaalsContact C-N 3.33Å
267	I	91.2	Very high	90.2	Very high	111 Å²	111	72.3 Å²	72.3	57%	0.569	36%	0.364	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.9	135.3	175.3	-53.8	-176.3	0	0	0	109.4	Y263 I264 N265 F269	Y263-I267 CarbonylContact C-O 3.55Å; Y263-I267 VanDerWaalsContact CA-O 3.23Å; Y263-I267 WeakPolarHBondContact CA-O 3.38Å; I264-I267 PolarHBondContact N-O 3.2Å; I264-I267 PolarHBondContact O-N 2.85Å; N265-I267 PolarHBondContact O-N 2.89Å; I267-F269 PolarHBondContact O-N 2.6Å
268	Y	91.6	Very high	90.2	Very high	119 Å²	119	74.4 Å²	74.4	47%	0.467	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.8	132.8	176.9	-168.8	-115	0	0	0	110.9	K262 Y263 E270	K262-Y268 HydrophobicContact CB-CD2 4.47Å; K262-Y268 HydrophobicContact CB-CE2 4.1Å; K262-Y268 HydrophobicContact CG-CE2 4.42Å; K262-Y268 CarbonylContact O-C 3.03Å; K262-Y268 VanDerWaalsContact O-CA 3.31Å; K262-Y268 WeakPolarHBondContact O-CA 3.42Å; K262-Y268 WeakPolarHBondContact O-CD2 3.47Å; Y263-Y268 HydrophobicContact CD1-CD2 4.36Å; Y263-Y268 AromaticContact CE1-CD2 3.9Å; Y263-Y268 HydrophobicContact CE1-CD2 3.9Å; Y263-Y268 HydrophobicContact CE2-CD2 4.48Å; Y263-Y268 AromaticContact CZ-CD2 3.95Å; Y268-E270 HydrophobicContact CD1-CB 3.98Å; Y268-E270 HydrophobicContact CE1-CB 3.77Å; Y268-E270 HydrophobicContact CE1-CG 4.27Å
269	F	90.5	Very high	90.1	Very high	36 Å²	36	81.2 Å²	81.2	16%	0.158	40%	0.402	C	S	.	.			trans	-107.1	112.4	179.9	178.6	-105.5	0	0	0	109.2	P251 L254 V255 L261 K262 I264 I267 E271	P251-F269 HydrophobicContact CB-CE2 4.2Å; P251-F269 HydrophobicContact CB-CZ 4.23Å; L254-F269 HydrophobicContact CB-CE1 4.26Å; L254-F269 HydrophobicContact CB-CZ 4.02Å; L254-F269 HydrophobicContact CD1-CE2 4.41Å; L254-F269 HydrophobicContact CD1-CZ 4.13Å; V255-F269 HydrophobicContact CG2-CE1 3.76Å; V255-F269 HydrophobicContact CG2-CZ 3.96Å; L261-F269 HydrophobicContact CB-CD1 4.33Å; L261-F269 HydrophobicContact CD2-CD1 4.05Å; L261-F269 HydrophobicContact CD2-CE1 4.17Å; L261-F269 HydrophobicContact CG-CD1 4.01Å; K262-F269 PolarHBondContact O-N 2.83Å; I264-F269 HydrophobicContact CD1-CB 4.16Å; I264-F269 HydrophobicContact CD1-CD1 4.41Å; I264-F269 HydrophobicContact CD1-CD2 3.48Å; I264-F269 VanDerWaalsContact CD1-CD2 3.48Å; I264-F269 HydrophobicContact CD1-CE2 3.91Å; I264-F269 HydrophobicContact CD1-CG 3.76Å; I264-F269 HydrophobicContact CG1-CB 4.04Å; I264-F269 HydrophobicContact CG1-CD2 4.3Å; I264-F269 HydrophobicContact CG1-CG 4.19Å; I267-F269 PolarHBondContact O-N 2.6Å; F269-E271 HydrophobicContact CE1-CB 4.34Å; F269-E271 HydrophobicContact CE2-CB 4.15Å; F269-E271 HydrophobicContact CZ-CB 3.85Å; F269-E271 HydrophobicContact CZ-CG 4.49Å
270	E	84.5	Confident	90.1	Very high	153 Å²	153	78.6 Å²	78.6	72%	0.715	38%	0.383	S	S	*	.			trans	-136.7	96.2	-178	-174.4	158	-125.2	0	0	109.1	Y268	Y268-E270 HydrophobicContact CD1-CB 3.98Å; Y268-E270 HydrophobicContact CE1-CB 3.77Å; Y268-E270 HydrophobicContact CE1-CG 4.27Å
271	E	87.9	Confident	90	Very high	80 Å²	80	73.4 Å²	73.4	37%	0.374	36%	0.361	S	S	.	.			trans	-132.1	141.8	-179.3	173.7	77.4	169.5	0	0	106.8	P251 Q252 V255 F269	P251-E271 HydrophobicContact CB-CB 4.46Å; P251-E271 HydrophobicContact CB-CG 3.74Å; Q252-E271 PolarHBondContact NE2-OE1 3Å; V255-E271 HydrophobicContact CG2-CB 3.6Å; V255-E271 HydrophobicContact CG2-CG 3.68Å; V255-E271 VanDerWaalsContact CG2-O 3.28Å; V255-E271 WeakPolarHBondContact CG2-O 3.26Å; F269-E271 HydrophobicContact CE1-CB 4.34Å; F269-E271 HydrophobicContact CE2-CB 4.15Å; F269-E271 HydrophobicContact CZ-CB 3.85Å; F269-E271 HydrophobicContact CZ-CG 4.49Å
272	M	86.3	Confident	89.8	Confident	126 Å²	126	78.7 Å²	78.7	62%	0.621	39%	0.385	S	S	*	.			trans	-112.9	142.3	177.9	-72.2	-167.3	-70.5	0	0	111.2	Q252 T274	Q252-M272 PolarHBondContact NE2-O 2.99Å; M272-T274 PolarHBondContact O-N 2.63Å
273	L	88.2	Confident	89.6	Confident	57 Å²	57	79.2 Å²	79.2	30%	0.298	39%	0.389	S	S	.	.			trans	-59.8	125	172.4	-64.9	177.3	0	0	0	110.3	Q252 V255 Y256 T277 V278	Q252-L273 WeakPolarHBondContact O-CD2 3.4Å; V255-L273 HydrophobicContact CB-CD2 3.96Å; V255-L273 HydrophobicContact CB-CG 4.37Å; V255-L273 HydrophobicContact CG1-CD2 3.92Å; V255-L273 HydrophobicContact CG1-CG 3.77Å; Y256-L273 HydrophobicContact CD2-CD1 4.25Å; L273-T277 HydrophobicContact CD2-CG2 3.95Å; L273-V278 HydrophobicContact CB-CG2 3.96Å; L273-V278 HydrophobicContact CD1-CG2 4.44Å
274	T	89.5	Confident	89.3	Confident	67 Å²	67	75.5 Å²	75.5	41%	0.411	38%	0.375	S	S	.	.			trans	-76	150.5	171.2	61.5	0	0	0	0	110.8	Q252 M272 F276 T277 V278	Q252-T274 PolarHBondContact OE1-OG1 2.71Å; M272-T274 PolarHBondContact O-N 2.63Å; T274-F276 PolarHBondContact O-N 3.4Å; T274-T277 PolarHBondContact O-N 2.89Å; T274-T277 PolarHBondContact OG1-N 3.11Å; T274-T277 PolarHBondContact OG1-OG1 2.83Å; T274-T277 VanDerWaalsContact OG1-OG1 3.05Å; T274-V278 WeakPolarHBondContact O-CG2 3.28Å; T274-V278 PolarHBondContact O-N 2.86Å
275	D	87.9	Confident	89.1	Confident	113 Å²	113	77.7 Å²	77.7	60%	0.604	38%	0.383	S	S	*	.	H	α-helix	trans	-49.1	-32.4	171.7	-73.9	19.2	0	0	0	113	R279	D275-R279 WeakPolarHBondContact O-CB 3.39Å; D275-R279 WeakPolarHBondContact O-CD 3.29Å; D275-R279 WeakPolarHBondContact O-CG 3.3Å; D275-R279 PolarHBondContact O-N 3.49Å; D275-R279 IonicContact OD2-NH2 3.66Å
276	F	87.5	Confident	88.9	Confident	138 Å²	138	79.1 Å²	79.1	61%	0.605	40%	0.397	S	S	*	.	H	α-helix	trans	-67.7	-51.8	176.7	178.7	-101.4	0	0	0	111.6	T274 V278 R279 I280	T274-F276 PolarHBondContact O-N 3.4Å; F276-V278 VanDerWaalsContact C-N 3.28Å; F276-V278 PolarHBondContact O-N 2.87Å; F276-R279 PolarHBondContact O-N 2.7Å; F276-R279 VanDerWaalsContact O-N 3.15Å; F276-I280 HydrophobicContact CD1-CD1 4.42Å; F276-I280 HydrophobicContact CD2-CG2 4.46Å; F276-I280 HydrophobicContact CE1-CD1 3.99Å; F276-I280 HydrophobicContact CE1-CG2 4.18Å; F276-I280 HydrophobicContact CE2-CG2 3.98Å; F276-I280 HydrophobicContact CZ-CG2 3.83Å; F276-I280 PolarHBondContact O-N 2.86Å
277	T	87.7	Confident	88.9	Confident	8 Å²	8	79.6 Å²	79.6	5%	0.049	39%	0.386	C	S	.	.	H	α-helix	trans	-57.2	-42.3	175.4	-56.5	0	0	0	0	111.4	Q252 M253 L273 T274 R279 I280 I281	Q252-T277 HydrophobicContact CB-CG2 4.11Å; Q252-T277 PolarHBondContact OE1-OG1 2.84Å; M253-T277 HydrophobicContact SD-CG2 4.37Å; L273-T277 HydrophobicContact CD2-CG2 3.95Å; T274-T277 PolarHBondContact O-N 2.89Å; T274-T277 PolarHBondContact OG1-N 3.11Å; T274-T277 PolarHBondContact OG1-OG1 2.83Å; T274-T277 VanDerWaalsContact OG1-OG1 3.05Å; T277-R279 PolarHBondContact O-N 3.37Å; T277-I280 WeakPolarHBondContact O-CG1 3.29Å; T277-I281 HydrophobicContact CG2-CD1 3.79Å; T277-I281 WeakPolarHBondContact O-CB 3.27Å; T277-I281 VanDerWaalsContact O-CG1 3.26Å; T277-I281 WeakPolarHBondContact O-CG1 3.26Å; T277-I281 PolarHBondContact O-N 2.83Å
278	V	89	Confident	88.8	Confident	50 Å²	50	74.4 Å²	74.4	30%	0.303	36%	0.359	S	S	.	.	H	α-helix	trans	-60.9	-44.7	176.7	175.2	0	0	0	0	111.2	L273 T274 F276 Q282	L273-V278 HydrophobicContact CB-CG2 3.96Å; L273-V278 HydrophobicContact CD1-CG2 4.44Å; T274-V278 WeakPolarHBondContact O-CG2 3.28Å; T274-V278 PolarHBondContact O-N 2.86Å; F276-V278 VanDerWaalsContact C-N 3.28Å; F276-V278 PolarHBondContact O-N 2.87Å; V278-Q282 HydrophobicContact CG1-CG 4.43Å; V278-Q282 WeakPolarHBondContact O-CB 3.39Å; V278-Q282 VanDerWaalsContact O-CG 3.24Å; V278-Q282 WeakPolarHBondContact O-CG 3.42Å; V278-Q282 PolarHBondContact O-N 2.9Å
279	R	89.2	Confident	88.7	Confident	143 Å²	143	71.9 Å²	71.9	54%	0.54	35%	0.351	S	S	.	.	H	α-helix	trans	-65.3	-50.8	179.3	-72.9	169.4	-156.4	-169.4	7.8	112.9	D275 F276 T277 I281 Q282 E283	D275-R279 WeakPolarHBondContact O-CB 3.39Å; D275-R279 WeakPolarHBondContact O-CD 3.29Å; D275-R279 WeakPolarHBondContact O-CG 3.3Å; D275-R279 PolarHBondContact O-N 3.49Å; D275-R279 IonicContact OD2-NH2 3.66Å; F276-R279 PolarHBondContact O-N 2.7Å; F276-R279 VanDerWaalsContact O-N 3.15Å; T277-R279 PolarHBondContact O-N 3.37Å; R279-I281 PolarHBondContact O-N 2.79Å; R279-Q282 PolarHBondContact O-N 3.32Å; R279-E283 WeakPolarHBondContact O-CB 3.29Å; R279-E283 WeakPolarHBondContact O-CG 3.39Å; R279-E283 PolarHBondContact O-N 2.91Å
280	I	89.9	Confident	88.7	Confident	30 Å²	30	73.7 Å²	73.7	15%	0.154	37%	0.367	C	S	.	.	H	α-helix	trans	-62.4	-31.9	-178	63.9	177.6	0	0	0	112.1	F276 T277 A284 A334 L335	F276-I280 HydrophobicContact CD1-CD1 4.42Å; F276-I280 HydrophobicContact CD2-CG2 4.46Å; F276-I280 HydrophobicContact CE1-CD1 3.99Å; F276-I280 HydrophobicContact CE1-CG2 4.18Å; F276-I280 HydrophobicContact CE2-CG2 3.98Å; F276-I280 HydrophobicContact CZ-CG2 3.83Å; F276-I280 PolarHBondContact O-N 2.86Å; T277-I280 WeakPolarHBondContact O-CG1 3.29Å; I280-A284 WeakPolarHBondContact O-CB 3.22Å; I280-A284 PolarHBondContact O-N 2.8Å; I280-A334 HydrophobicContact CD1-CB 4.37Å; I280-L335 HydrophobicContact CB-CD1 4.23Å; I280-L335 HydrophobicContact CD1-CD1 4.45Å; I280-L335 HydrophobicContact CD1-CD2 4.34Å; I280-L335 HydrophobicContact CD1-CG 4.16Å; I280-L335 HydrophobicContact CG1-CD1 4.1Å; I280-L335 HydrophobicContact CG1-CG 4.35Å; I280-L335 VanDerWaalsContact O-CD1 3.31Å; I280-L335 WeakPolarHBondContact O-CD1 3.46Å
281	I	89.6	Confident	88.8	Confident	5 Å²	5	68.2 Å²	68.2	3%	0.026	34%	0.342	C	S	.	.	H	α-helix	trans	-73.6	-41.1	174.6	-68.4	174.8	0	0	0	111.1	M253 Y256 T277 R279 A284 R285 L335 L342	M253-I281 HydrophobicContact CE-CD1 4.11Å; M253-I281 HydrophobicContact SD-CD1 4.42Å; Y256-I281 HydrophobicContact CD1-CD1 3.82Å; Y256-I281 HydrophobicContact CD2-CD1 3.69Å; Y256-I281 HydrophobicContact CD2-CG2 4.42Å; Y256-I281 HydrophobicContact CE1-CD1 4.19Å; Y256-I281 HydrophobicContact CE1-CG2 4.1Å; Y256-I281 HydrophobicContact CE2-CD1 4.08Å; Y256-I281 HydrophobicContact CE2-CG2 3.74Å; Y256-I281 HydrophobicContact CG-CD1 3.55Å; T277-I281 HydrophobicContact CG2-CD1 3.79Å; T277-I281 WeakPolarHBondContact O-CB 3.27Å; T277-I281 VanDerWaalsContact O-CG1 3.26Å; T277-I281 WeakPolarHBondContact O-CG1 3.26Å; T277-I281 PolarHBondContact O-N 2.83Å; R279-I281 PolarHBondContact O-N 2.79Å; I281-A284 PolarHBondContact O-N 2.85Å; I281-R285 WeakPolarHBondContact O-CB 3.47Å; I281-R285 WeakPolarHBondContact O-CG 3.49Å; I281-R285 PolarHBondContact O-N 2.79Å; I281-L335 HydrophobicContact CG1-CD1 4.12Å; I281-L335 HydrophobicContact CG1-CD2 4.05Å; I281-L342 HydrophobicContact CG2-CD1 4.37Å
282	Q	90.5	Very high	89	Confident	121 Å²	121	64.5 Å²	64.5	57%	0.565	32%	0.324	S	S	*	.	H	α-helix	trans	-62.7	-41.2	174.2	-76.1	171.5	-11.5	0	0	112	V278 R279 R285 S286	V278-Q282 HydrophobicContact CG1-CG 4.43Å; V278-Q282 WeakPolarHBondContact O-CB 3.39Å; V278-Q282 VanDerWaalsContact O-CG 3.24Å; V278-Q282 WeakPolarHBondContact O-CG 3.42Å; V278-Q282 PolarHBondContact O-N 2.9Å; R279-Q282 PolarHBondContact O-N 3.32Å; Q282-R285 PolarHBondContact O-N 2.92Å; Q282-S286 WeakPolarHBondContact O-CB 3.43Å; Q282-S286 PolarHBondContact O-N 2.78Å
283	E	88	Confident	89.1	Confident	115 Å²	115	64.5 Å²	64.5	54%	0.537	32%	0.318	S	S	.	.	H	α-helix	trans	-60.5	-51.3	173.3	-73	167.4	-165.4	0	0	110.9	R279 R285 S286 I287	R279-E283 WeakPolarHBondContact O-CB 3.29Å; R279-E283 WeakPolarHBondContact O-CG 3.39Å; R279-E283 PolarHBondContact O-N 2.91Å; E283-R285 PolarHBondContact O-N 2.68Å; E283-S286 PolarHBondContact O-N 2.97Å; E283-S286 PolarHBondContact O-OG 3.23Å; E283-I287 WeakPolarHBondContact O-CG1 3.42Å; E283-I287 PolarHBondContact O-N 3.29Å
284	A	89.2	Confident	89.1	Confident	3 Å²	3	64.1 Å²	64.1	3%	0.025	32%	0.32	C	S	.	.	H	α-helix	trans	-59.2	-42.1	175.8	0	0	0	0	0	113.1	I280 I281 I287 M288 I331 L335 L342	I280-A284 WeakPolarHBondContact O-CB 3.22Å; I280-A284 PolarHBondContact O-N 2.8Å; I281-A284 PolarHBondContact O-N 2.85Å; A284-I287 PolarHBondContact O-N 2.93Å; A284-M288 WeakPolarHBondContact O-CG 3.43Å; A284-M288 PolarHBondContact O-N 2.87Å; A284-I331 HydrophobicContact CB-CG2 4.17Å; A284-L335 HydrophobicContact CB-CD1 3.77Å; A284-L342 HydrophobicContact CB-CD2 3.68Å
285	R	90.6	Very high	89	Confident	55 Å²	55	62 Å²	62	21%	0.208	31%	0.305	C	S	.	.	H	α-helix	trans	-61.3	-43.4	174.1	-76.1	-174.4	70	125.3	2	112.3	I281 Q282 E283 I287 M288 E289 E349	I281-R285 WeakPolarHBondContact O-CB 3.47Å; I281-R285 WeakPolarHBondContact O-CG 3.49Å; I281-R285 PolarHBondContact O-N 2.79Å; Q282-R285 PolarHBondContact O-N 2.92Å; E283-R285 PolarHBondContact O-N 2.68Å; R285-I287 PolarHBondContact O-N 3.09Å; R285-M288 PolarHBondContact O-N 2.93Å; R285-M288 VanDerWaalsContact O-N 3.09Å; R285-E289 IonicContact CZ-OE1 2.66Å; R285-E289 IonicContact NE-OE1 3.55Å; R285-E289 PolarHBondContact NE-OE1 2.93Å; R285-E289 IonicContact NH2-OE1 3.4Å; R285-E289 PolarHBondContact NH2-OE1 2.85Å; R285-E289 WeakPolarHBondContact O-CB 3.33Å; R285-E289 WeakPolarHBondContact O-CG 3.44Å; R285-E289 PolarHBondContact O-N 3.11Å; R285-E349 IonicContact CZ-OE2 3.33Å; R285-E349 IonicContact NH1-OE1 3.96Å; R285-E349 IonicContact NH1-OE2 3.56Å; R285-E349 PolarHBondContact NH1-OE2 2.87Å; R285-E349 IonicContact NH2-OE2 3.22Å; R285-E349 PolarHBondContact NH2-OE2 2.81Å
286	S	89.1	Confident	89.1	Confident	75 Å²	75	57.7 Å²	57.7	52%	0.524	28%	0.28	S	S	.	.	H	α-helix	trans	-63	-22.2	177.9	74.7	0	0	0	0	114	Q282 E283 P290	Q282-S286 WeakPolarHBondContact O-CB 3.43Å; Q282-S286 PolarHBondContact O-N 2.78Å; E283-S286 PolarHBondContact O-N 2.97Å; E283-S286 PolarHBondContact O-OG 3.23Å; S286-P290 WeakPolarHBondContact O-CD 3.48Å; S286-P290 WeakPolarHBondContact O-CG 3.5Å
287	I	88.3	Confident	89.1	Confident	67 Å²	67	57.2 Å²	57.2	34%	0.344	28%	0.28	S	S	.	.	H	α-helix	trans	-83.8	-42.9	172.2	-63.5	167	0	0	0	110.3	E283 A284 R285 I291	E283-I287 WeakPolarHBondContact O-CG1 3.42Å; E283-I287 PolarHBondContact O-N 3.29Å; A284-I287 PolarHBondContact O-N 2.93Å; R285-I287 PolarHBondContact O-N 3.09Å; I287-I291 HydrophobicContact CG2-CD1 4.42Å; I287-I291 WeakPolarHBondContact O-CD1 3.37Å; I287-I291 WeakPolarHBondContact O-CG1 3.42Å
288	M	89.7	Confident	89	Confident	1 Å²	1	61.7 Å²	61.7	1%	0.005	31%	0.308	C	S	.	.	H	α-helix	trans	-70.9	-49.3	-177.8	-72.1	-177.9	177.2	0	0	113.7	A284 R285 I291 I292 I331 L342 L343	A284-M288 WeakPolarHBondContact O-CG 3.43Å; A284-M288 PolarHBondContact O-N 2.87Å; R285-M288 PolarHBondContact O-N 2.93Å; R285-M288 VanDerWaalsContact O-N 3.09Å; M288-I291 PolarHBondContact O-N 2.82Å; M288-I292 HydrophobicContact CB-CD1 4.07Å; M288-I292 WeakPolarHBondContact O-CG1 3.31Å; M288-I292 PolarHBondContact O-N 3.07Å; M288-I331 HydrophobicContact CE-CD1 3.44Å; M288-I331 VanDerWaalsContact CE-CD1 3.44Å; M288-I331 HydrophobicContact CE-CG1 4.42Å; M288-L342 HydrophobicContact CE-CB 4.05Å; M288-L342 HydrophobicContact CE-CD2 3.95Å; M288-L342 HydrophobicContact CE-CG 4Å; M288-L342 HydrophobicContact SD-CB 4.38Å; M288-L342 HydrophobicContact SD-CD2 4.16Å; M288-L342 HydrophobicContact SD-CG 3.89Å; M288-L343 HydrophobicContact CE-CB 4.06Å; M288-L343 HydrophobicContact SD-CB 4.21Å; M288-L343 HydrophobicContact SD-CD1 4.39Å
289	E	89.8	Confident	88.8	Confident	66 Å²	66	62.1 Å²	62.1	31%	0.308	31%	0.308	S	S	.	.	H	α-helix	trans	-58.7	-40.4	-170	-71.2	175.5	-169.3	0	0	114	R285 R293	R285-E289 IonicContact CZ-OE1 2.66Å; R285-E289 IonicContact NE-OE1 3.55Å; R285-E289 PolarHBondContact NE-OE1 2.93Å; R285-E289 IonicContact NH2-OE1 3.4Å; R285-E289 PolarHBondContact NH2-OE1 2.85Å; R285-E289 WeakPolarHBondContact O-CB 3.33Å; R285-E289 WeakPolarHBondContact O-CG 3.44Å; R285-E289 PolarHBondContact O-N 3.11Å; E289-R293 WeakPolarHBondContact O-CB 3.28Å; E289-R293 PolarHBondContact O-N 3.28Å; E289-R293 VanDerWaalsContact O-N 3.07Å
290	P	89.4	Confident	88.7	Confident	75 Å²	75	55.7 Å²	55.7	49%	0.487	28%	0.284	S	S	.	.	H	α-helix	trans	-66.2	-34.1	173	-21.8	34.4	0	0	0	113.6	S286 S294	S286-P290 WeakPolarHBondContact O-CD 3.48Å; S286-P290 WeakPolarHBondContact O-CG 3.5Å; P290-S294 VanDerWaalsContact O-CB 3.32Å; P290-S294 WeakPolarHBondContact O-CB 3.32Å; P290-S294 PolarHBondContact O-N 3.07Å
291	I	88.6	Confident	88.4	Confident	38 Å²	38	55.8 Å²	55.8	20%	0.195	29%	0.289	C	S	.	.	H	α-helix	trans	-73.7	-45	-179.2	-66	172	0	0	0	110.1	I287 M288 R293 S294 K295 I324 L329	I287-I291 HydrophobicContact CG2-CD1 4.42Å; I287-I291 WeakPolarHBondContact O-CD1 3.37Å; I287-I291 WeakPolarHBondContact O-CG1 3.42Å; M288-I291 PolarHBondContact O-N 2.82Å; I291-R293 VanDerWaalsContact C-N 3.32Å; I291-R293 PolarHBondContact O-N 3.48Å; I291-S294 PolarHBondContact O-N 3.27Å; I291-K295 VanDerWaalsContact O-CB 3.29Å; I291-K295 WeakPolarHBondContact O-CB 3.35Å; I291-K295 PolarHBondContact O-N 2.7Å; I291-I324 HydrophobicContact CG2-CG2 4.26Å; I291-L329 HydrophobicContact CD1-CD2 3.44Å; I291-L329 VanDerWaalsContact CD1-CD2 3.44Å; I291-L329 HydrophobicContact CG2-CD2 4.47Å
292	I	90.1	Very high	88	Confident	1 Å²	1	63.2 Å²	63.2	1%	0.005	33%	0.329	C	S	.	.	H	α-helix	trans	-56.4	-48.5	173.8	-66	163.7	0	0	0	109.9	M288 K295 W296 M320 I324 L343 C346 I347 F350	M288-I292 HydrophobicContact CB-CD1 4.07Å; M288-I292 WeakPolarHBondContact O-CG1 3.31Å; M288-I292 PolarHBondContact O-N 3.07Å; I292-K295 PolarHBondContact O-N 2.66Å; I292-W296 WeakPolarHBondContact O-CB 3.33Å; I292-W296 PolarHBondContact O-N 3.47Å; I292-M320 HydrophobicContact CG2-CE 3.92Å; I292-I324 HydrophobicContact CB-CD1 4.44Å; I292-I324 HydrophobicContact CG1-CD1 3.88Å; I292-L343 HydrophobicContact CD1-CD1 4.03Å; I292-L343 HydrophobicContact CG1-CD1 4.06Å; I292-C346 HydrophobicContact CD1-CB 3.44Å; I292-C346 VanDerWaalsContact CD1-CB 3.44Å; I292-I347 HydrophobicContact CD1-CG1 3.86Å; I292-I347 HydrophobicContact CG1-CG1 3.91Å; I292-I347 HydrophobicContact CG2-CG1 4.04Å; I292-F350 HydrophobicContact CG2-CB 4.12Å; I292-F350 HydrophobicContact CG2-CD1 3.51Å; I292-F350 HydrophobicContact CG2-CD2 4.48Å; I292-F350 HydrophobicContact CG2-CE1 3.98Å; I292-F350 HydrophobicContact CG2-CG 3.79Å
293	R	89.7	Confident	87.6	Confident	126 Å²	126	63.9 Å²	63.9	48%	0.475	33%	0.332	S	S	.	.	H	α-helix	trans	-61.7	-50.9	178.9	-173.9	-177.6	-52.9	164.4	7	112.5	E289 I291 K295 W296 E297 F350	E289-R293 WeakPolarHBondContact O-CB 3.28Å; E289-R293 PolarHBondContact O-N 3.28Å; E289-R293 VanDerWaalsContact O-N 3.07Å; I291-R293 VanDerWaalsContact C-N 3.32Å; I291-R293 PolarHBondContact O-N 3.48Å; R293-K295 VanDerWaalsContact C-N 3.3Å; R293-K295 PolarHBondContact O-N 3.22Å; R293-W296 WeakPolarHBondContact O-CB 3.46Å; R293-W296 PolarHBondContact O-N 3.01Å; R293-E297 WeakPolarHBondContact CD-OE1 3.42Å; R293-E297 HydrophobicContact CG-CG 4.28Å; R293-E297 WeakPolarHBondContact CG-OE1 3.32Å; R293-E297 WeakPolarHBondContact O-CB 3.47Å; R293-E297 VanDerWaalsContact O-CG 3.3Å; R293-E297 WeakPolarHBondContact O-CG 3.37Å; R293-E297 PolarHBondContact O-N 2.77Å; R293-F350 HydrophobicContact CB-CE2 3.89Å; R293-F350 HydrophobicContact CB-CZ 3.97Å; R293-F350 HydrophobicContact CG-CE2 4.03Å; R293-F350 HydrophobicContact CG-CZ 4.04Å
294	S	87.9	Confident	87	Confident	50 Å²	50	60.7 Å²	60.7	35%	0.35	32%	0.315	S	S	.	.	H	α-helix	trans	-60.1	-39.7	179	170.8	0	0	0	0	112.2	P290 I291 T298	P290-S294 VanDerWaalsContact O-CB 3.32Å; P290-S294 WeakPolarHBondContact O-CB 3.32Å; P290-S294 PolarHBondContact O-N 3.07Å; I291-S294 PolarHBondContact O-N 3.27Å; S294-T298 WeakPolarHBondContact O-CB 3.37Å; S294-T298 PolarHBondContact O-N 3Å; S294-T298 VanDerWaalsContact O-N 3.08Å; S294-T298 PolarHBondContact O-OG1 2.97Å
295	K	87.2	Confident	86	Confident	22 Å²	22	65.2 Å²	65.2	10%	0.096	35%	0.345	C	S	.	.	H	α-helix	trans	-69.7	-41.8	179.1	-165.6	67.5	171.3	165.4	0	111.5	I291 I292 R293 T298 D299 F300 H323 I324 E326	I291-K295 VanDerWaalsContact O-CB 3.29Å; I291-K295 WeakPolarHBondContact O-CB 3.35Å; I291-K295 PolarHBondContact O-N 2.7Å; I292-K295 PolarHBondContact O-N 2.66Å; R293-K295 VanDerWaalsContact C-N 3.3Å; R293-K295 PolarHBondContact O-N 3.22Å; K295-T298 PolarHBondContact O-N 2.98Å; K295-D299 WeakPolarHBondContact CD-OD2 3.3Å; K295-D299 WeakPolarHBondContact CE-OD2 3.21Å; K295-D299 IonicContact NZ-OD2 2.86Å; K295-D299 PolarHBondContact NZ-OD2 2.85Å; K295-D299 PolarHBondContact O-N 2.84Å; K295-F300 HydrophobicContact CG-CE2 4.18Å; K295-H323 VanDerWaalsContact CE-CB 3.5Å; K295-H323 VanDerWaalsContact CE-O 3.22Å; K295-H323 WeakPolarHBondContact CE-O 2.91Å; K295-I324 HydrophobicContact CB-CD1 4.4Å; K295-I324 HydrophobicContact CB-CG1 4.29Å; K295-I324 HydrophobicContact CG-CG1 4.05Å; K295-E326 IonicContact NZ-OE2 3.21Å
296	W	89.5	Confident	85	Confident	23 Å²	23	68.5 Å²	68.5	9%	0.087	36%	0.36	C	S	.	.	I	π-helix	trans	-57.1	-53	171.1	170.3	-97.5	0	0	0	112.3	I292 R293 T298 F300 A301 Y304 L316 M320 F350 L351 L354 I355	I292-W296 WeakPolarHBondContact O-CB 3.33Å; I292-W296 PolarHBondContact O-N 3.47Å; R293-W296 WeakPolarHBondContact O-CB 3.46Å; R293-W296 PolarHBondContact O-N 3.01Å; W296-T298 PolarHBondContact O-N 3.13Å; W296-F300 HydrophobicContact CD2-CB 4.24Å; W296-F300 HydrophobicContact CE3-CB 3.47Å; W296-F300 VanDerWaalsContact CE3-CB 3.47Å; W296-F300 HydrophobicContact CE3-CG 4.4Å; W296-F300 HydrophobicContact CZ3-CB 3.7Å; W296-F300 PolarHBondContact O-N 3Å; W296-F300 VanDerWaalsContact O-N 3.1Å; W296-A301 HydrophobicContact CZ2-CB 4.24Å; W296-A301 WeakPolarHBondContact O-CB 3.34Å; W296-A301 PolarHBondContact O-N 2.88Å; W296-Y304 WeakPolarHBondContact CH2-O 3.3Å; W296-L316 HydrophobicContact CZ3-CD1 4.2Å; W296-L316 HydrophobicContact CZ3-CD2 3.98Å; W296-M320 HydrophobicContact CB-CE 3.91Å; W296-M320 HydrophobicContact CE3-CE 4.47Å; W296-M320 HydrophobicContact CE3-SD 3.99Å; W296-F350 HydrophobicContact CB-CE1 3.65Å; W296-F350 HydrophobicContact CB-CZ 4.08Å; W296-F350 HydrophobicContact CD2-CE1 4.32Å; W296-F350 AromaticContact CG-CE1 3.68Å; W296-F350 HydrophobicContact CG-CE1 3.68Å; W296-F350 HydrophobicContact CG-CZ 4.09Å; W296-L351 HydrophobicContact CD2-CD2 4.4Å; W296-L351 HydrophobicContact CE3-CD2 3.75Å; W296-L351 HydrophobicContact CH2-CD2 4.43Å; W296-L351 HydrophobicContact CZ3-CD2 3.79Å; W296-L354 HydrophobicContact CG-CD1 4.34Å; W296-I355 HydrophobicContact CH2-CD1 3.54Å; W296-I355 HydrophobicContact CH2-CG1 4.2Å; W296-I355 HydrophobicContact CZ2-CD1 4.22Å; W296-I355 HydrophobicContact CZ2-CG1 4.41Å; W296-I355 HydrophobicContact CZ3-CD1 4.06Å
297	E	87.5	Confident	84	Confident	127 Å²	127	65.2 Å²	65.2	59%	0.593	34%	0.337	S	S	*	.	I	π-helix	trans	-63.1	-25.8	-178.4	-73.2	169.8	176.5	0	0	113.6	R293	R293-E297 WeakPolarHBondContact CD-OE1 3.42Å; R293-E297 HydrophobicContact CG-CG 4.28Å; R293-E297 WeakPolarHBondContact CG-OE1 3.32Å; R293-E297 WeakPolarHBondContact O-CB 3.47Å; R293-E297 VanDerWaalsContact O-CG 3.3Å; R293-E297 WeakPolarHBondContact O-CG 3.37Å; R293-E297 PolarHBondContact O-N 2.77Å
298	T	86.1	Confident	82.9	Confident	103 Å²	103	67.9 Å²	67.9	63%	0.632	35%	0.346	S	S	*	.	I	π-helix	trans	-91.9	-43.2	-178.7	-46.6	0	0	0	0	112.6	S294 K295 W296	S294-T298 WeakPolarHBondContact O-CB 3.37Å; S294-T298 PolarHBondContact O-N 3Å; S294-T298 VanDerWaalsContact O-N 3.08Å; S294-T298 PolarHBondContact O-OG1 2.97Å; K295-T298 PolarHBondContact O-N 2.98Å; W296-T298 PolarHBondContact O-N 3.13Å
299	D	85.7	Confident	81.8	Confident	58 Å²	58	69.6 Å²	69.6	31%	0.31	36%	0.359	S	S	.	.	I	π-helix	trans	-115.8	-27.2	-163.3	-58.7	-15.1	0	0	0	113.8	K295 Q303	K295-D299 WeakPolarHBondContact CD-OD2 3.3Å; K295-D299 WeakPolarHBondContact CE-OD2 3.21Å; K295-D299 IonicContact NZ-OD2 2.86Å; K295-D299 PolarHBondContact NZ-OD2 2.85Å; K295-D299 PolarHBondContact O-N 2.84Å; D299-Q303 PolarHBondContact O-NE2 3.38Å
300	F	86.3	Confident	80.8	Confident	9 Å²	9	68.6 Å²	68.6	4%	0.039	35%	0.352	C	S	.	.	I	π-helix	trans	-115.2	-29.9	-168	-66.2	-92	0	0	0	114.8	K295 W296 D302 Q303 Y304 L316 N319 M320 H323	K295-F300 HydrophobicContact CG-CE2 4.18Å; W296-F300 HydrophobicContact CD2-CB 4.24Å; W296-F300 HydrophobicContact CE3-CB 3.47Å; W296-F300 VanDerWaalsContact CE3-CB 3.47Å; W296-F300 HydrophobicContact CE3-CG 4.4Å; W296-F300 HydrophobicContact CZ3-CB 3.7Å; W296-F300 PolarHBondContact O-N 3Å; W296-F300 VanDerWaalsContact O-N 3.1Å; F300-D302 VanDerWaalsContact C-N 3.34Å; F300-D302 PolarHBondContact O-N 2.84Å; F300-Q303 PolarHBondContact O-N 2.97Å; F300-Y304 HydrophobicContact CB-CD2 4.36Å; F300-Y304 HydrophobicContact CD1-CD2 4.14Å; F300-Y304 HydrophobicContact CD1-CE2 4.01Å; F300-Y304 PolarHBondContact O-N 3.32Å; F300-L316 HydrophobicContact CD1-CD1 3.51Å; F300-L316 HydrophobicContact CE1-CD1 4.03Å; F300-L316 HydrophobicContact CG-CD1 4.3Å; F300-N319 HydrophobicContact CE1-CB 4Å; F300-N319 HydrophobicContact CZ-CB 4.4Å; F300-M320 HydrophobicContact CD1-CG 4.03Å; F300-M320 HydrophobicContact CD2-CG 3.93Å; F300-M320 HydrophobicContact CE1-CG 3.78Å; F300-M320 HydrophobicContact CE2-CG 3.69Å; F300-M320 HydrophobicContact CG-CG 4.1Å; F300-M320 HydrophobicContact CZ-CB 4.31Å; F300-M320 HydrophobicContact CZ-CG 3.59Å; F300-H323 HydrophobicContact CZ-CB 4.45Å; F300-H323 AromaticContact CZ-CD2 3.85Å
301	A	83.7	Confident	79.8	Confident	31 Å²	31	70.2 Å²	70.2	26%	0.256	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-40	-171.2	0	0	0	0	0	113.9	W296 Q303	W296-A301 HydrophobicContact CZ2-CB 4.24Å; W296-A301 WeakPolarHBondContact O-CB 3.34Å; W296-A301 PolarHBondContact O-N 2.88Å; A301-Q303 VanDerWaalsContact C-N 3.33Å
302	D	82.2	Confident	79.2	Confident	161 Å²	161	71 Å²	71	86%	0.861	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.6	-24.7	176.9	-74.1	-14.8	0	0	0	113	F300	F300-D302 VanDerWaalsContact C-N 3.34Å; F300-D302 PolarHBondContact O-N 2.84Å
303	Q	80.5	Confident	78.6	Confident	135 Å²	135	71.6 Å²	71.6	63%	0.631	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.4	-33.4	-178	-60.5	-169.1	61	0	0	112.5	D299 F300 A301 P305	D299-Q303 PolarHBondContact O-NE2 3.38Å; F300-Q303 PolarHBondContact O-N 2.97Å; A301-Q303 VanDerWaalsContact C-N 3.33Å; Q303-P305 VanDerWaalsContact O-CD 3.29Å; Q303-P305 WeakPolarHBondContact O-CD 3.46Å
304	Y	76.5	Confident	78.1	Confident	49 Å²	49	66.7 Å²	66.7	19%	0.192	34%	0.341	C	S	.	.			trans	-120.9	57.3	-173.7	-63.5	-88.5	0	0	0	113.1	W296 F300 F306 E312 L316	W296-Y304 WeakPolarHBondContact CH2-O 3.3Å; F300-Y304 HydrophobicContact CB-CD2 4.36Å; F300-Y304 HydrophobicContact CD1-CD2 4.14Å; F300-Y304 HydrophobicContact CD1-CE2 4.01Å; F300-Y304 PolarHBondContact O-N 3.32Å; Y304-F306 PolarHBondContact O-N 2.73Å; Y304-F306 VanDerWaalsContact O-N 3.14Å; Y304-E312 HydrophobicContact CE1-CG 4.47Å; Y304-L316 HydrophobicContact CD1-CD1 4.29Å; Y304-L316 HydrophobicContact CD1-CD2 4.24Å; Y304-L316 HydrophobicContact CD2-CD1 3.74Å; Y304-L316 HydrophobicContact CE1-CD1 4.42Å; Y304-L316 HydrophobicContact CE2-CD1 3.92Å; Y304-L316 HydrophobicContact CG-CD1 3.95Å; Y304-L316 HydrophobicContact CG-CD2 4.17Å
305	P	67.4	Low	77.7	Confident	98 Å²	98	66.9 Å²	66.9	64%	0.636	34%	0.342	S	S	*	.	S	Bend	trans	-65.3	-16.4	178.6	28.1	-35.6	0	0	0	113.5	Q303	Q303-P305 VanDerWaalsContact O-CD 3.29Å; Q303-P305 WeakPolarHBondContact O-CD 3.46Å
306	F	70	Confident	77.6	Confident	123 Å²	123	65.9 Å²	65.9	54%	0.539	34%	0.338	S	S	.	.	S	Bend	trans	-154.9	147.2	167.5	60.7	-79.7	0	0	0	110	Y304 K308	Y304-F306 PolarHBondContact O-N 2.73Å; Y304-F306 VanDerWaalsContact O-N 3.14Å; F306-K308 HydrophobicContact CD2-CG 3.84Å; F306-K308 HydrophobicContact CE2-CD 4.09Å; F306-K308 HydrophobicContact CE2-CG 3.65Å
307	V	68.1	Low	77.4	Confident	6 Å²	6	64.8 Å²	64.8	4%	0.036	33%	0.333	C	S	.	.			trans	-106.6	129.3	173.6	169.4	0	0	0	0	108.8	S309 E312 R313 L316 I355	V307-S309 WeakPolarHBondContact CG1-O 3.48Å; V307-E312 WeakPolarHBondContact CA-OE2 3.22Å; V307-E312 HydrophobicContact CG1-CB 4.09Å; V307-E312 HydrophobicContact CG1-CG 4.19Å; V307-R313 HydrophobicContact CG1-CB 3.78Å; V307-R313 HydrophobicContact CG1-CG 4.17Å; V307-L316 HydrophobicContact CG2-CD2 3.86Å; V307-I355 HydrophobicContact CB-CG2 3.84Å; V307-I355 HydrophobicContact CG2-CD1 3.78Å; V307-I355 HydrophobicContact CG2-CG2 3.94Å
308	K	65.4	Low	77.1	Confident	123 Å²	123	61.9 Å²	61.9	54%	0.535	32%	0.32	S	S	.	.			trans	-92.1	-29.6	-168.8	-58.6	167.5	-147.9	68.7	0	112.7	F306 E312	F306-K308 HydrophobicContact CD2-CG 3.84Å; F306-K308 HydrophobicContact CE2-CD 4.09Å; F306-K308 HydrophobicContact CE2-CG 3.65Å; K308-E312 WeakPolarHBondContact CB-OE2 3.46Å; K308-E312 WeakPolarHBondContact CG-OE2 3.34Å; K308-E312 PolarHBondContact N-OE2 2.7Å; K308-E312 IonicContact NZ-OE1 3.76Å; K308-E312 PolarHBondContact NZ-OE1 2.86Å; K308-E312 IonicContact NZ-OE2 3.97Å; K308-E312 PolarHBondContact NZ-OE2 3.22Å
309	S	67.4	Low	77	Confident	38 Å²	38	59.5 Å²	59.5	27%	0.266	30%	0.303	S	S	.	.	S	Bend	trans	-146.5	166.3	-175.6	89	0	0	0	0	112.1	V307 E311 E312 R313	V307-S309 WeakPolarHBondContact CG1-O 3.48Å; S309-E311 WeakPolarHBondContact CB-OE2 3.41Å; S309-E311 PolarHBondContact O-N 3.31Å; S309-E311 PolarHBondContact OG-N 3.31Å; S309-E311 PolarHBondContact OG-OE2 3.08Å; S309-E312 PolarHBondContact O-N 2.9Å; S309-E312 PolarHBondContact OG-N 3.13Å; S309-R313 PolarHBondContact O-N 2.68Å; S309-R313 VanDerWaalsContact O-N 3.12Å
310	R	68.2	Low	77.2	Confident	44 Å²	44	56.7 Å²	56.7	17%	0.166	29%	0.289	C	S	.	.	H	α-helix	trans	-62.7	-34.2	177.8	164.8	176.8	174.8	68.6	9.2	111.5	H210 R313 M314	H210-R310 PolarHBondContact O-NH2 2.99Å; R310-R313 CarbonylContact O-C 3.6Å; R310-R313 WeakPolarHBondContact O-CB 3.31Å; R310-R313 PolarHBondContact O-N 3.37Å; R310-M314 HydrophobicContact CG-CG 4.43Å; R310-M314 WeakPolarHBondContact O-CG 3.41Å; R310-M314 PolarHBondContact O-N 3.33Å
311	E	67.8	Low	77.1	Confident	110 Å²	110	56.7 Å²	56.7	51%	0.514	29%	0.289	S	S	.	.	H	α-helix	trans	-71.7	-43.4	-176.1	-55.5	63.6	-126.2	0	0	110	S309 R313 M314 S315	S309-E311 WeakPolarHBondContact CB-OE2 3.41Å; S309-E311 PolarHBondContact O-N 3.31Å; S309-E311 PolarHBondContact OG-N 3.31Å; S309-E311 PolarHBondContact OG-OE2 3.08Å; E311-R313 VanDerWaalsContact C-N 3.26Å; E311-R313 PolarHBondContact O-N 2.79Å; E311-M314 PolarHBondContact O-N 2.92Å; E311-S315 PolarHBondContact O-N 3.07Å
312	E	75.5	Confident	77	Confident	53 Å²	53	61.7 Å²	61.7	25%	0.248	31%	0.307	C	S	.	.	H	α-helix	trans	-61.5	-35	170.2	-174.9	171	-117	0	0	111.1	Y304 V307 K308 S309 L316	Y304-E312 HydrophobicContact CE1-CG 4.47Å; V307-E312 WeakPolarHBondContact CA-OE2 3.22Å; V307-E312 HydrophobicContact CG1-CB 4.09Å; V307-E312 HydrophobicContact CG1-CG 4.19Å; K308-E312 WeakPolarHBondContact CB-OE2 3.46Å; K308-E312 WeakPolarHBondContact CG-OE2 3.34Å; K308-E312 PolarHBondContact N-OE2 2.7Å; K308-E312 IonicContact NZ-OE1 3.76Å; K308-E312 PolarHBondContact NZ-OE1 2.86Å; K308-E312 IonicContact NZ-OE2 3.97Å; K308-E312 PolarHBondContact NZ-OE2 3.22Å; S309-E312 PolarHBondContact O-N 2.9Å; S309-E312 PolarHBondContact OG-N 3.13Å; E312-L316 WeakPolarHBondContact O-CB 3.47Å; E312-L316 PolarHBondContact O-N 3.21Å
313	R	79.2	Confident	76.9	Confident	15 Å²	15	57.8 Å²	57.8	6%	0.057	28%	0.283	C	S	.	.	H	α-helix	trans	-67.4	-42	172.5	-147.1	177.3	86.7	-141.1	1.8	112.9	V307 S309 R310 E311 L316 I317 D348 D357	V307-R313 HydrophobicContact CG1-CB 3.78Å; V307-R313 HydrophobicContact CG1-CG 4.17Å; S309-R313 PolarHBondContact O-N 2.68Å; S309-R313 VanDerWaalsContact O-N 3.12Å; R310-R313 CarbonylContact O-C 3.6Å; R310-R313 WeakPolarHBondContact O-CB 3.31Å; R310-R313 PolarHBondContact O-N 3.37Å; E311-R313 VanDerWaalsContact C-N 3.26Å; E311-R313 PolarHBondContact O-N 2.79Å; R313-L316 PolarHBondContact O-N 2.84Å; R313-I317 WeakPolarHBondContact O-CD1 3.33Å; R313-I317 VanDerWaalsContact O-CG1 3.24Å; R313-I317 WeakPolarHBondContact O-CG1 3.47Å; R313-I317 PolarHBondContact O-N 3.37Å; R313-D348 IonicContact CZ-OD1 3.1Å; R313-D348 VanDerWaalsContact CZ-OD1 3.29Å; R313-D348 IonicContact NE-OD1 3.75Å; R313-D348 PolarHBondContact NE-OD1 2.97Å; R313-D348 VanDerWaalsContact NE-OD1 3.1Å; R313-D348 IonicContact NH2-OD1 3.29Å; R313-D348 PolarHBondContact NH2-OD1 2.99Å; R313-D348 IonicContact NH2-OD2 3.28Å; R313-D357 IonicContact CZ-OD2 2.7Å; R313-D357 IonicContact NH1-OD2 3.63Å; R313-D357 PolarHBondContact NH1-OD2 3.21Å
314	M	77.5	Confident	77	Confident	23 Å²	23	51.5 Å²	51.5	11%	0.113	25%	0.254	C	S	.	.	H	α-helix	trans	-65.4	-49.4	179	-71.7	-54.9	-49.2	0	0	111.2	H210 R310 E311 L316 I317 E318 F344	H210-M314 HydrophobicContact CB-CE 3.72Å; H210-M314 HydrophobicContact CB-SD 4.49Å; H210-M314 WeakPolarHBondContact ND1-CE 3.37Å; R310-M314 HydrophobicContact CG-CG 4.43Å; R310-M314 WeakPolarHBondContact O-CG 3.41Å; R310-M314 PolarHBondContact O-N 3.33Å; E311-M314 PolarHBondContact O-N 2.92Å; M314-L316 VanDerWaalsContact C-N 3.31Å; M314-L316 PolarHBondContact O-N 3.36Å; M314-I317 PolarHBondContact O-N 3.04Å; M314-I317 VanDerWaalsContact O-N 3.1Å; M314-I317 HydrophobicContact SD-CD1 4.43Å; M314-E318 WeakPolarHBondContact O-CG 3.4Å; M314-E318 PolarHBondContact O-N 2.98Å; M314-F344 HydrophobicContact CE-CE2 3.6Å; M314-F344 HydrophobicContact CE-CZ 3.7Å; M314-F344 HydrophobicContact SD-CZ 4.16Å
315	S	79.2	Confident	76.8	Confident	54 Å²	54	53.4 Å²	53.4	38%	0.378	26%	0.263	S	S	.	.	H	α-helix	trans	-59.9	-40.4	175.9	177.8	0	0	0	0	111.8	E311 I317 E318 N319	E311-S315 PolarHBondContact O-N 3.07Å; S315-I317 PolarHBondContact O-N 2.81Å; S315-E318 PolarHBondContact O-N 3.16Å; S315-N319 WeakPolarHBondContact O-CB 3.49Å; S315-N319 PolarHBondContact O-N 3.49Å; S315-N319 PolarHBondContact O-ND2 3.07Å; S315-N319 PolarHBondContact OG-ND2 3.5Å
316	L	85.3	Confident	76.4	Confident	0 Å²	0	55 Å²	55	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-60.4	-42.8	173.3	175.2	60	0	0	0	112.5	W296 F300 Y304 V307 E312 R313 M314 M320 L351 I355	W296-L316 HydrophobicContact CZ3-CD1 4.2Å; W296-L316 HydrophobicContact CZ3-CD2 3.98Å; F300-L316 HydrophobicContact CD1-CD1 3.51Å; F300-L316 HydrophobicContact CE1-CD1 4.03Å; F300-L316 HydrophobicContact CG-CD1 4.3Å; Y304-L316 HydrophobicContact CD1-CD1 4.29Å; Y304-L316 HydrophobicContact CD1-CD2 4.24Å; Y304-L316 HydrophobicContact CD2-CD1 3.74Å; Y304-L316 HydrophobicContact CE1-CD1 4.42Å; Y304-L316 HydrophobicContact CE2-CD1 3.92Å; Y304-L316 HydrophobicContact CG-CD1 3.95Å; Y304-L316 HydrophobicContact CG-CD2 4.17Å; V307-L316 HydrophobicContact CG2-CD2 3.86Å; E312-L316 WeakPolarHBondContact O-CB 3.47Å; E312-L316 PolarHBondContact O-N 3.21Å; R313-L316 PolarHBondContact O-N 2.84Å; M314-L316 VanDerWaalsContact C-N 3.31Å; M314-L316 PolarHBondContact O-N 3.36Å; L316-M320 HydrophobicContact CD1-CG 4.21Å; L316-M320 HydrophobicContact CD1-SD 4.32Å; L316-M320 WeakPolarHBondContact O-CB 3.19Å; L316-M320 VanDerWaalsContact O-CG 3.3Å; L316-M320 WeakPolarHBondContact O-CG 3.42Å; L316-M320 PolarHBondContact O-N 3.08Å; L316-L351 HydrophobicContact CD2-CD1 3.91Å; L316-L351 HydrophobicContact CD2-CD2 4.14Å; L316-L351 HydrophobicContact CG-CD1 3.97Å; L316-I355 HydrophobicContact CD2-CD1 3.89Å
317	I	85.2	Confident	75.9	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-63.9	-43	176	-63.1	157.3	0	0	0	110.6	R313 M314 S315 M320 M321 F344 I347 D348 L351	R313-I317 WeakPolarHBondContact O-CD1 3.33Å; R313-I317 VanDerWaalsContact O-CG1 3.24Å; R313-I317 WeakPolarHBondContact O-CG1 3.47Å; R313-I317 PolarHBondContact O-N 3.37Å; M314-I317 PolarHBondContact O-N 3.04Å; M314-I317 VanDerWaalsContact O-N 3.1Å; M314-I317 HydrophobicContact SD-CD1 4.43Å; S315-I317 PolarHBondContact O-N 2.81Å; I317-M320 PolarHBondContact O-N 2.89Å; I317-M321 HydrophobicContact CG2-CG 4.31Å; I317-M321 HydrophobicContact CG2-SD 4.24Å; I317-M321 WeakPolarHBondContact O-CB 3.42Å; I317-M321 WeakPolarHBondContact O-CG 3.09Å; I317-M321 PolarHBondContact O-N 2.98Å; I317-F344 HydrophobicContact CB-CD2 4.46Å; I317-F344 HydrophobicContact CB-CE2 4.09Å; I317-F344 HydrophobicContact CD1-CE2 4.03Å; I317-F344 HydrophobicContact CD1-CZ 4.01Å; I317-F344 HydrophobicContact CG2-CD2 3.34Å; I317-F344 HydrophobicContact CG2-CE2 3.41Å; I317-F344 VanDerWaalsContact CG2-CE2 3.41Å; I317-F344 HydrophobicContact CG2-CG 4.2Å; I317-F344 HydrophobicContact CG2-CZ 4.32Å; I317-I347 HydrophobicContact CB-CG2 4.26Å; I317-I347 HydrophobicContact CG1-CG2 3.99Å; I317-I347 HydrophobicContact CG2-CB 4.09Å; I317-I347 HydrophobicContact CG2-CG2 3.95Å; I317-D348 HydrophobicContact CD1-CB 4.07Å; I317-L351 HydrophobicContact CG1-CD1 3.63Å
318	E	81.9	Confident	75.6	Confident	66 Å²	66	62.3 Å²	62.3	31%	0.308	30%	0.297	S	S	.	.	H	α-helix	trans	-66	-46.1	-179.1	-71.3	173.9	154.3	0	0	111.8	H210 M314 S315 M320 M321 E322	H210-E318 IonicContact CE1-OE1 2.69Å; H210-E318 IonicContact ND1-OE1 2.82Å; M314-E318 WeakPolarHBondContact O-CG 3.4Å; M314-E318 PolarHBondContact O-N 2.98Å; S315-E318 PolarHBondContact O-N 3.16Å; E318-M320 VanDerWaalsContact C-N 3.32Å; E318-M320 PolarHBondContact O-N 2.97Å; E318-M321 WeakPolarHBondContact O-CB 3.5Å; E318-M321 PolarHBondContact O-N 3.08Å; E318-M321 VanDerWaalsContact O-N 3.13Å; E318-E322 PolarHBondContact O-N 3.21Å
319	N	84.9	Confident	75.9	Confident	53 Å²	53	57 Å²	57	28%	0.283	27%	0.274	S	S	.	.	H	α-helix	trans	-58.2	-42.9	172.5	-65.1	-22	0	0	0	111.4	F300 S315 H323	F300-N319 HydrophobicContact CE1-CB 4Å; F300-N319 HydrophobicContact CZ-CB 4.4Å; S315-N319 WeakPolarHBondContact O-CB 3.49Å; S315-N319 PolarHBondContact O-N 3.49Å; S315-N319 PolarHBondContact O-ND2 3.07Å; S315-N319 PolarHBondContact OG-ND2 3.5Å; N319-H323 WeakPolarHBondContact O-CB 3.29Å; N319-H323 PolarHBondContact O-CD2 2.89Å; N319-H323 PolarHBondContact O-N 3.33Å; N319-H323 VanDerWaalsContact O-N 3.11Å
320	M	88.1	Confident	75.9	Confident	0 Å²	0	62.4 Å²	62.4	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-66.8	-36.3	175.3	-77.5	-170.9	74.4	0	0	112.6	I292 W296 F300 L316 I317 E318 I324 I347 L351	I292-M320 HydrophobicContact CG2-CE 3.92Å; W296-M320 HydrophobicContact CB-CE 3.91Å; W296-M320 HydrophobicContact CE3-CE 4.47Å; W296-M320 HydrophobicContact CE3-SD 3.99Å; F300-M320 HydrophobicContact CD1-CG 4.03Å; F300-M320 HydrophobicContact CD2-CG 3.93Å; F300-M320 HydrophobicContact CE1-CG 3.78Å; F300-M320 HydrophobicContact CE2-CG 3.69Å; F300-M320 HydrophobicContact CG-CG 4.1Å; F300-M320 HydrophobicContact CZ-CB 4.31Å; F300-M320 HydrophobicContact CZ-CG 3.59Å; L316-M320 HydrophobicContact CD1-CG 4.21Å; L316-M320 HydrophobicContact CD1-SD 4.32Å; L316-M320 WeakPolarHBondContact O-CB 3.19Å; L316-M320 VanDerWaalsContact O-CG 3.3Å; L316-M320 WeakPolarHBondContact O-CG 3.42Å; L316-M320 PolarHBondContact O-N 3.08Å; I317-M320 PolarHBondContact O-N 2.89Å; E318-M320 VanDerWaalsContact C-N 3.32Å; E318-M320 PolarHBondContact O-N 2.97Å; M320-I324 WeakPolarHBondContact O-CB 3.32Å; M320-I324 WeakPolarHBondContact O-CD1 3.41Å; M320-I324 WeakPolarHBondContact O-CG1 3.32Å; M320-I324 PolarHBondContact O-N 3.34Å; M320-I324 VanDerWaalsContact O-N 3.1Å; M320-I347 HydrophobicContact CB-CD1 4.11Å; M320-I347 HydrophobicContact CB-CG2 4.21Å; M320-I347 HydrophobicContact CE-CG2 4.32Å; M320-I347 HydrophobicContact SD-CG2 3.88Å; M320-L351 HydrophobicContact SD-CD1 4.32Å; M320-L351 HydrophobicContact SD-CD2 3.97Å; M320-L351 HydrophobicContact SD-CG 4.45Å
321	M	85.3	Confident	76.2	Confident	9 Å²	9	61.3 Å²	61.3	4%	0.044	30%	0.297	C	S	.	.	H	α-helix	trans	-66.1	-47.3	176.2	-77.9	-177.1	70.7	0	0	111.6	I317 E318 I324 K325 D340 L343 F344 I347	I317-M321 HydrophobicContact CG2-CG 4.31Å; I317-M321 HydrophobicContact CG2-SD 4.24Å; I317-M321 WeakPolarHBondContact O-CB 3.42Å; I317-M321 WeakPolarHBondContact O-CG 3.09Å; I317-M321 PolarHBondContact O-N 2.98Å; E318-M321 WeakPolarHBondContact O-CB 3.5Å; E318-M321 PolarHBondContact O-N 3.08Å; E318-M321 VanDerWaalsContact O-N 3.13Å; M321-I324 PolarHBondContact O-N 2.83Å; M321-I324 VanDerWaalsContact O-N 3.13Å; M321-K325 WeakPolarHBondContact O-CG 3.37Å; M321-K325 PolarHBondContact O-N 2.92Å; M321-D340 HydrophobicContact CE-CB 3.92Å; M321-D340 WeakPolarHBondContact CE-O 3.32Å; M321-L343 HydrophobicContact CG-CD2 4.27Å; M321-L343 HydrophobicContact CG-CG 4.23Å; M321-F344 HydrophobicContact CE-CB 4.17Å; M321-F344 HydrophobicContact SD-CB 3.67Å; M321-F344 HydrophobicContact SD-CD2 3.75Å; M321-F344 HydrophobicContact SD-CG 4.22Å; M321-I347 HydrophobicContact CB-CD1 4.47Å; M321-I347 HydrophobicContact CG-CD1 3.56Å
322	E	80.9	Confident	76.3	Confident	136 Å²	136	58.7 Å²	58.7	64%	0.636	30%	0.299	S	S	*	.	H	α-helix	trans	-58.9	-52.1	178.9	-175.2	157.7	-130.1	0	0	111.1	E318 I324 K325 E326	E318-E322 PolarHBondContact O-N 3.21Å; E322-I324 PolarHBondContact O-N 3.34Å; E322-I324 VanDerWaalsContact O-N 3.13Å; E322-K325 WeakPolarHBondContact O-CB 3.38Å; E322-K325 PolarHBondContact O-N 2.92Å; E322-E326 PolarHBondContact O-N 2.86Å
323	H	80.5	Confident	76.2	Confident	79 Å²	79	64.2 Å²	64.2	37%	0.366	33%	0.325	S	S	.	.	H	α-helix	trans	-66.7	-10.7	175.5	-86	-51.3	0	0	0	115.4	K295 F300 N319 E326	K295-H323 VanDerWaalsContact CE-CB 3.5Å; K295-H323 VanDerWaalsContact CE-O 3.22Å; K295-H323 WeakPolarHBondContact CE-O 2.91Å; F300-H323 HydrophobicContact CZ-CB 4.45Å; F300-H323 AromaticContact CZ-CD2 3.85Å; N319-H323 WeakPolarHBondContact O-CB 3.29Å; N319-H323 PolarHBondContact O-CD2 2.89Å; N319-H323 PolarHBondContact O-N 3.33Å; N319-H323 VanDerWaalsContact O-N 3.11Å; H323-E326 IonicContact CE1-OE1 3.23Å; H323-E326 IonicContact ND1-OE1 2.85Å; H323-E326 PolarHBondContact ND1-OE1 2.67Å; H323-E326 IonicContact ND1-OE2 3.21Å
324	I	83.7	Confident	76.1	Confident	2 Å²	2	66.6 Å²	66.6	1%	0.01	35%	0.348	C	S	.	.	H	α-helix	trans	-96.8	-26.4	170.6	-70.9	169.9	0	0	0	111.4	I291 I292 K295 M320 M321 E322 E326 R327 L329 L343 I347	I291-I324 HydrophobicContact CG2-CG2 4.26Å; I292-I324 HydrophobicContact CB-CD1 4.44Å; I292-I324 HydrophobicContact CG1-CD1 3.88Å; K295-I324 HydrophobicContact CB-CD1 4.4Å; K295-I324 HydrophobicContact CB-CG1 4.29Å; K295-I324 HydrophobicContact CG-CG1 4.05Å; M320-I324 WeakPolarHBondContact O-CB 3.32Å; M320-I324 WeakPolarHBondContact O-CD1 3.41Å; M320-I324 WeakPolarHBondContact O-CG1 3.32Å; M320-I324 PolarHBondContact O-N 3.34Å; M320-I324 VanDerWaalsContact O-N 3.1Å; M321-I324 PolarHBondContact O-N 2.83Å; M321-I324 VanDerWaalsContact O-N 3.13Å; E322-I324 PolarHBondContact O-N 3.34Å; E322-I324 VanDerWaalsContact O-N 3.13Å; I324-E326 PolarHBondContact O-N 2.73Å; I324-R327 PolarHBondContact O-N 2.8Å; I324-L329 HydrophobicContact CG2-CD1 3.89Å; I324-L329 HydrophobicContact CG2-CG 4.43Å; I324-L343 HydrophobicContact CB-CD2 4.3Å; I324-L343 HydrophobicContact CD1-CD1 4.38Å; I324-L343 HydrophobicContact CG2-CD1 3.95Å; I324-L343 HydrophobicContact CG2-CD2 3.88Å; I324-I347 HydrophobicContact CD1-CD1 4.31Å
325	K	70.5	Confident	76.2	Confident	90 Å²	90	65.8 Å²	65.8	39%	0.391	34%	0.344	S	S	.	.	H	α-helix	trans	-62.2	-27.3	173.8	-78.9	176.8	173.2	-167.5	0	113.1	M321 E322 R327 D340	M321-K325 WeakPolarHBondContact O-CG 3.37Å; M321-K325 PolarHBondContact O-N 2.92Å; E322-K325 WeakPolarHBondContact O-CB 3.38Å; E322-K325 PolarHBondContact O-N 2.92Å; K325-R327 PolarHBondContact O-N 2.87Å; K325-D340 WeakPolarHBondContact CE-OD1 3.3Å; K325-D340 WeakPolarHBondContact CE-OD2 3.49Å; K325-D340 IonicContact NZ-OD1 2.86Å; K325-D340 IonicContact NZ-OD2 3.69Å; K325-D340 PolarHBondContact NZ-OD2 2.81Å
326	E	59.9	Low	76.2	Confident	132 Å²	132	68 Å²	68	62%	0.617	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.5	-22.9	167.9	-64.7	173.3	-178.8	0	0	113.7	K295 E322 H323 I324	K295-E326 IonicContact NZ-OE2 3.21Å; E322-E326 PolarHBondContact O-N 2.86Å; H323-E326 IonicContact CE1-OE1 3.23Å; H323-E326 IonicContact ND1-OE1 2.85Å; H323-E326 PolarHBondContact ND1-OE1 2.67Å; H323-E326 IonicContact ND1-OE2 3.21Å; I324-E326 PolarHBondContact O-N 2.73Å
327	R	60.4	Low	75.7	Confident	128 Å²	128	74.7 Å²	74.7	48%	0.483	38%	0.381	S	S	.	.	S	Bend	trans	-104	131.6	177.3	-68.1	-175.4	174.6	173.4	1.2	111.3	I324 K325 L329	I324-R327 PolarHBondContact O-N 2.8Å; K325-R327 PolarHBondContact O-N 2.87Å; R327-L329 VanDerWaalsContact C-N 3.26Å; R327-L329 PolarHBondContact O-N 3.07Å
328	N	61.6	Low	75.5	Confident	153 Å²	153	75.6 Å²	75.6	82%	0.818	38%	0.384	S	S	*	.			trans	-66.4	81.3	170.7	-81	-27.4	0	0	0	111.4	L330	N328-L330 PolarHBondContact O-N 2.94Å
329	L	71.4	Confident	75.6	Confident	12 Å²	12	74.2 Å²	74.2	6%	0.063	38%	0.377	C	S	.	.			trans	-61.3	99.4	168.5	-66.6	176.8	0	0	0	109.6	I291 I324 R327 I331 L343	I291-L329 HydrophobicContact CD1-CD2 3.44Å; I291-L329 VanDerWaalsContact CD1-CD2 3.44Å; I291-L329 HydrophobicContact CG2-CD2 4.47Å; I324-L329 HydrophobicContact CG2-CD1 3.89Å; I324-L329 HydrophobicContact CG2-CG 4.43Å; R327-L329 VanDerWaalsContact C-N 3.26Å; R327-L329 PolarHBondContact O-N 3.07Å; L329-I331 VanDerWaalsContact C-N 3.32Å; L329-I331 HydrophobicContact CB-CD1 3.78Å; L329-I331 HydrophobicContact CB-CG1 4.25Å; L329-I331 HydrophobicContact CD1-CD1 4.37Å; L329-I331 PolarHBondContact O-N 3.4Å; L329-L343 HydrophobicContact CD1-CD1 4.48Å; L329-L343 HydrophobicContact CD1-CD2 4.31Å
330	L	67.9	Low	75.4	Confident	152 Å²	152	74.8 Å²	74.8	80%	0.796	38%	0.38	S	S	*	.			trans	-71.4	83.9	176.4	-71.3	168.8	0	0	0	110.5	N328	N328-L330 PolarHBondContact O-N 2.94Å
331	I	72.7	Confident	75.2	Confident	21 Å²	21	75.8 Å²	75.8	11%	0.108	39%	0.385	C	S	.	.			trans	-104.7	139.9	177.2	-62.9	153.5	0	0	0	108.1	A284 M288 L329 L335 K339	A284-I331 HydrophobicContact CB-CG2 4.17Å; M288-I331 HydrophobicContact CE-CD1 3.44Å; M288-I331 VanDerWaalsContact CE-CD1 3.44Å; M288-I331 HydrophobicContact CE-CG1 4.42Å; L329-I331 VanDerWaalsContact C-N 3.32Å; L329-I331 HydrophobicContact CB-CD1 3.78Å; L329-I331 HydrophobicContact CB-CG1 4.25Å; L329-I331 HydrophobicContact CD1-CD1 4.37Å; L329-I331 PolarHBondContact O-N 3.4Å; I331-L335 HydrophobicContact CG2-CB 3.66Å; I331-L335 HydrophobicContact CG2-CD1 4.41Å; I331-K339 HydrophobicContact CD1-CB 4.23Å; I331-K339 HydrophobicContact CD1-CD 4.09Å; I331-K339 HydrophobicContact CD1-CG 3.74Å
332	G	70.4	Confident	75.3	Confident	55 Å²	55	75.5 Å²	75.5	57%	0.567	38%	0.384	S	S	*	.			trans	-58.4	142.2	-179.9	0	0	0	0	0	113	A334 L335	G332-A334 PolarHBondContact O-N 2.95Å; G332-L335 PolarHBondContact O-N 3.34Å
333	E	74.6	Confident	75.6	Confident	168 Å²	168	69 Å²	69	79%	0.785	35%	0.354	S	S	*	.	H	α-helix	trans	-47.6	-39.7	-170	-61.2	177.3	162.5	0	0	114.2	L335 N336	E333-L335 PolarHBondContact O-N 3.21Å; E333-L335 VanDerWaalsContact O-N 3.16Å; E333-N336 WeakPolarHBondContact O-CB 3.35Å; E333-N336 PolarHBondContact O-N 2.87Å
334	A	75.3	Confident	75.9	Confident	66 Å²	66	66.6 Å²	66.6	55%	0.545	34%	0.342	S	S	.	.	H	α-helix	trans	-57.9	-26.9	179.3	0	0	0	0	0	114.4	I280 G332	I280-A334 HydrophobicContact CD1-CB 4.37Å; G332-A334 PolarHBondContact O-N 2.95Å
335	L	81.7	Confident	76	Confident	5 Å²	5	69.9 Å²	69.9	3%	0.026	36%	0.355	C	S	.	.	H	α-helix	trans	-102.5	-4	178.3	-69.2	178.4	0	0	0	113.4	M253 I280 I281 A284 I331 G332 E333 K337 Y338 K339	M253-L335 HydrophobicContact CE-CD2 3.46Å; M253-L335 VanDerWaalsContact CE-CD2 3.46Å; M253-L335 HydrophobicContact SD-CD2 3.82Å; I280-L335 HydrophobicContact CB-CD1 4.23Å; I280-L335 HydrophobicContact CD1-CD1 4.45Å; I280-L335 HydrophobicContact CD1-CD2 4.34Å; I280-L335 HydrophobicContact CD1-CG 4.16Å; I280-L335 HydrophobicContact CG1-CD1 4.1Å; I280-L335 HydrophobicContact CG1-CG 4.35Å; I280-L335 VanDerWaalsContact O-CD1 3.31Å; I280-L335 WeakPolarHBondContact O-CD1 3.46Å; I281-L335 HydrophobicContact CG1-CD1 4.12Å; I281-L335 HydrophobicContact CG1-CD2 4.05Å; A284-L335 HydrophobicContact CB-CD1 3.77Å; I331-L335 HydrophobicContact CG2-CB 3.66Å; I331-L335 HydrophobicContact CG2-CD1 4.41Å; G332-L335 PolarHBondContact O-N 3.34Å; E333-L335 PolarHBondContact O-N 3.21Å; E333-L335 VanDerWaalsContact O-N 3.16Å; L335-K337 VanDerWaalsContact C-N 3.3Å; L335-K337 PolarHBondContact O-N 2.89Å; L335-Y338 CarbonylContact O-C 3.59Å; L335-Y338 WeakPolarHBondContact O-CA 3.39Å; L335-Y338 WeakPolarHBondContact O-CB 3.31Å; L335-Y338 PolarHBondContact O-N 2.92Å; L335-K339 PolarHBondContact O-N 3.42Å; L335-K339 VanDerWaalsContact O-N 3.1Å
336	N	77.7	Confident	76.8	Confident	100 Å²	100	65.7 Å²	65.7	54%	0.535	34%	0.337	S	S	.	.	H	α-helix	trans	-61	-37.9	-172.5	-166.8	31.6	0	0	0	112.6	E333 Y338 K339	E333-N336 WeakPolarHBondContact O-CB 3.35Å; E333-N336 PolarHBondContact O-N 2.87Å; N336-Y338 PolarHBondContact O-N 3.43Å; N336-Y338 VanDerWaalsContact O-N 3.12Å; N336-K339 WeakPolarHBondContact O-CB 3.35Å; N336-K339 PolarHBondContact O-N 3.24Å
337	K	75.3	Confident	78.2	Confident	141 Å²	141	59.4 Å²	59.4	61%	0.613	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-15.3	174.2	-55.5	-167.9	-170.9	-163	0	114.2	L335	L335-K337 VanDerWaalsContact C-N 3.3Å; L335-K337 PolarHBondContact O-N 2.89Å
338	Y	81.6	Confident	79.4	Confident	20 Å²	20	54.3 Å²	54.3	8%	0.078	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-115.6	3.2	-175.7	-59.5	-71.6	0	0	0	112.9	L229 E231 N250 M253 F257 L335 N336 D340 L341 L342	L229-Y338 HydrophobicContact CD1-CD1 4.1Å; L229-Y338 HydrophobicContact CD1-CE1 4.01Å; E231-Y338 HydrophobicContact CB-CE1 4.47Å; E231-Y338 HydrophobicContact CG-CD1 4.45Å; E231-Y338 HydrophobicContact CG-CE1 3.86Å; E231-Y338 WeakPolarHBondContact OE1-CE1 3.47Å; E231-Y338 PolarHBondContact OE1-OH 2.87Å; N250-Y338 WeakPolarHBondContact CB-OH 3.49Å; M253-Y338 HydrophobicContact CB-CE1 4.15Å; M253-Y338 HydrophobicContact CB-CE2 4.08Å; M253-Y338 HydrophobicContact CE-CD2 4.09Å; M253-Y338 HydrophobicContact CE-CG 4.12Å; M253-Y338 HydrophobicContact CG-CD2 4Å; M253-Y338 HydrophobicContact CG-CE2 3.59Å; F257-Y338 HydrophobicContact CD2-CD1 4.45Å; F257-Y338 AromaticContact CE2-CD1 3.87Å; F257-Y338 HydrophobicContact CE2-CD1 3.87Å; F257-Y338 HydrophobicContact CE2-CG 4.06Å; L335-Y338 CarbonylContact O-C 3.59Å; L335-Y338 WeakPolarHBondContact O-CA 3.39Å; L335-Y338 WeakPolarHBondContact O-CB 3.31Å; L335-Y338 PolarHBondContact O-N 2.92Å; N336-Y338 PolarHBondContact O-N 3.43Å; N336-Y338 VanDerWaalsContact O-N 3.12Å; Y338-D340 PolarHBondContact O-N 3.09Å; Y338-L341 PolarHBondContact O-N 3.04Å; Y338-L342 WeakPolarHBondContact O-CB 3.45Å; Y338-L342 PolarHBondContact O-N 2.9Å
339	K	83.1	Confident	80.6	Confident	37 Å²	37	50.4 Å²	50.4	16%	0.161	27%	0.266	C	S	.	.	H	α-helix	trans	-49.8	-52	-177.1	168.5	176.3	170.2	179.9	0	112.2	I331 L335 N336 L342 L343	I331-K339 HydrophobicContact CD1-CB 4.23Å; I331-K339 HydrophobicContact CD1-CD 4.09Å; I331-K339 HydrophobicContact CD1-CG 3.74Å; L335-K339 PolarHBondContact O-N 3.42Å; L335-K339 VanDerWaalsContact O-N 3.1Å; N336-K339 WeakPolarHBondContact O-CB 3.35Å; N336-K339 PolarHBondContact O-N 3.24Å; K339-L342 PolarHBondContact O-N 3.2Å; K339-L343 VanDerWaalsContact O-CB 3.24Å; K339-L343 WeakPolarHBondContact O-CB 3.03Å; K339-L343 PolarHBondContact O-N 2.85Å
340	D	80.4	Confident	81.3	Confident	64 Å²	64	51 Å²	51	34%	0.342	27%	0.269	S	S	.	.	H	α-helix	trans	-66.7	-41.4	-176.6	-78.5	9.7	0	0	0	112.5	M321 K325 Y338 L343 F344	M321-D340 HydrophobicContact CE-CB 3.92Å; M321-D340 WeakPolarHBondContact CE-O 3.32Å; K325-D340 WeakPolarHBondContact CE-OD1 3.3Å; K325-D340 WeakPolarHBondContact CE-OD2 3.49Å; K325-D340 IonicContact NZ-OD1 2.86Å; K325-D340 IonicContact NZ-OD2 3.69Å; K325-D340 PolarHBondContact NZ-OD2 2.81Å; Y338-D340 PolarHBondContact O-N 3.09Å; D340-L343 PolarHBondContact O-N 3.06Å; D340-F344 WeakPolarHBondContact O-CB 3.4Å; D340-F344 PolarHBondContact O-N 3.28Å
341	L	83.6	Confident	82.2	Confident	21 Å²	21	43.9 Å²	43.9	11%	0.11	23%	0.231	C	C	.	.	H	α-helix	trans	-70.1	-37.6	178.7	-179.9	63.4	0	0	0	112.2	L229 E231 Q232 F257 Y338 R345	L229-L341 HydrophobicContact CD2-CB 4.47Å; E231-L341 VanDerWaalsContact C-CD2 3.49Å; E231-L341 HydrophobicContact CB-CD2 3.43Å; E231-L341 VanDerWaalsContact CB-CD2 3.43Å; Q232-L341 HydrophobicContact CB-CD1 4.27Å; F257-L341 HydrophobicContact CB-CD2 4.37Å; F257-L341 HydrophobicContact CD1-CD2 3.66Å; F257-L341 HydrophobicContact CD1-CG 3.85Å; F257-L341 HydrophobicContact CD2-CD2 3.9Å; F257-L341 HydrophobicContact CE1-CB 4.35Å; F257-L341 HydrophobicContact CE1-CD2 3.76Å; F257-L341 HydrophobicContact CE1-CG 3.61Å; F257-L341 HydrophobicContact CE2-CD2 3.96Å; F257-L341 HydrophobicContact CG-CD2 3.74Å; F257-L341 HydrophobicContact CG-CG 4.44Å; F257-L341 HydrophobicContact CZ-CB 4.32Å; F257-L341 HydrophobicContact CZ-CD2 3.9Å; F257-L341 HydrophobicContact CZ-CG 3.97Å; Y338-L341 PolarHBondContact O-N 3.04Å; L341-R345 WeakPolarHBondContact O-CB 3.45Å; L341-R345 PolarHBondContact O-N 3.08Å
342	L	87.4	Confident	82.4	Confident	3 Å²	3	48.2 Å²	48.2	2%	0.016	25%	0.246	C	C	.	.	H	α-helix	trans	-67.2	-40.6	173.6	-173.6	64.2	0	0	0	110.9	Y256 F257 I281 A284 M288 Y338 K339 R345 C346	Y256-L342 HydrophobicContact CE1-CD1 3.92Å; F257-L342 HydrophobicContact CE1-CD1 4.5Å; F257-L342 HydrophobicContact CZ-CB 4.18Å; F257-L342 HydrophobicContact CZ-CD1 4.48Å; I281-L342 HydrophobicContact CG2-CD1 4.37Å; A284-L342 HydrophobicContact CB-CD2 3.68Å; M288-L342 HydrophobicContact CE-CB 4.05Å; M288-L342 HydrophobicContact CE-CD2 3.95Å; M288-L342 HydrophobicContact CE-CG 4Å; M288-L342 HydrophobicContact SD-CB 4.38Å; M288-L342 HydrophobicContact SD-CD2 4.16Å; M288-L342 HydrophobicContact SD-CG 3.89Å; Y338-L342 WeakPolarHBondContact O-CB 3.45Å; Y338-L342 PolarHBondContact O-N 2.9Å; K339-L342 PolarHBondContact O-N 3.2Å; L342-R345 PolarHBondContact O-N 2.82Å; L342-C346 WeakPolarHBondContact O-CB 3.49Å; L342-C346 PolarHBondContact O-N 3.35Å; L342-C346 PolarHBondContact O-SG 2.74Å
343	L	87.7	Confident	82.8	Confident	1 Å²	1	49.7 Å²	49.7	1%	0.005	25%	0.248	C	C	.	.	H	α-helix	trans	-63.6	-49.4	175.3	179	61.4	0	0	0	111.4	M288 I292 M321 I324 L329 K339 D340 R345 C346 I347	M288-L343 HydrophobicContact CE-CB 4.06Å; M288-L343 HydrophobicContact SD-CB 4.21Å; M288-L343 HydrophobicContact SD-CD1 4.39Å; I292-L343 HydrophobicContact CD1-CD1 4.03Å; I292-L343 HydrophobicContact CG1-CD1 4.06Å; M321-L343 HydrophobicContact CG-CD2 4.27Å; M321-L343 HydrophobicContact CG-CG 4.23Å; I324-L343 HydrophobicContact CB-CD2 4.3Å; I324-L343 HydrophobicContact CD1-CD1 4.38Å; I324-L343 HydrophobicContact CG2-CD1 3.95Å; I324-L343 HydrophobicContact CG2-CD2 3.88Å; L329-L343 HydrophobicContact CD1-CD1 4.48Å; L329-L343 HydrophobicContact CD1-CD2 4.31Å; K339-L343 VanDerWaalsContact O-CB 3.24Å; K339-L343 WeakPolarHBondContact O-CB 3.03Å; K339-L343 PolarHBondContact O-N 2.85Å; D340-L343 PolarHBondContact O-N 3.06Å; L343-R345 VanDerWaalsContact C-N 3.3Å; L343-R345 PolarHBondContact O-N 2.89Å; L343-C346 PolarHBondContact O-N 2.92Å; L343-I347 HydrophobicContact CD1-CD1 3.86Å; L343-I347 HydrophobicContact CD1-CG1 4.22Å; L343-I347 HydrophobicContact CG-CD1 3.85Å; L343-I347 VanDerWaalsContact O-CG1 3.31Å; L343-I347 WeakPolarHBondContact O-CG1 3.41Å; L343-I347 PolarHBondContact O-N 2.65Å
344	F	86.7	Confident	82.7	Confident	27 Å²	27	46.2 Å²	46.2	12%	0.118	23%	0.234	C	C	.	.	H	α-helix	trans	-51.5	-50.7	173.8	178.5	-87.8	0	0	0	111	H210 M314 I317 M321 D340 C346 I347 D348	H210-F344 AromaticContact CD2-CE1 3.93Å; H210-F344 AromaticContact CD2-CE2 3.73Å; H210-F344 AromaticContact CD2-CZ 3.57Å; H210-F344 AromaticContact CE1-CE2 3.69Å; H210-F344 AromaticContact NE2-CD2 3.42Å; H210-F344 WeakPolarHBondContact NE2-CD2 3.38Å; H210-F344 AromaticContact NE2-CE2 3.24Å; H210-F344 WeakPolarHBondContact NE2-CE2 3.39Å; H210-F344 AromaticContact NE2-CG 3.92Å; H210-F344 AromaticContact NE2-CZ 3.59Å; M314-F344 HydrophobicContact CE-CE2 3.6Å; M314-F344 HydrophobicContact CE-CZ 3.7Å; M314-F344 HydrophobicContact SD-CZ 4.16Å; I317-F344 HydrophobicContact CB-CD2 4.46Å; I317-F344 HydrophobicContact CB-CE2 4.09Å; I317-F344 HydrophobicContact CD1-CE2 4.03Å; I317-F344 HydrophobicContact CD1-CZ 4.01Å; I317-F344 HydrophobicContact CG2-CD2 3.34Å; I317-F344 HydrophobicContact CG2-CE2 3.41Å; I317-F344 VanDerWaalsContact CG2-CE2 3.41Å; I317-F344 HydrophobicContact CG2-CG 4.2Å; I317-F344 HydrophobicContact CG2-CZ 4.32Å; M321-F344 HydrophobicContact CE-CB 4.17Å; M321-F344 HydrophobicContact SD-CB 3.67Å; M321-F344 HydrophobicContact SD-CD2 3.75Å; M321-F344 HydrophobicContact SD-CG 4.22Å; D340-F344 WeakPolarHBondContact O-CB 3.4Å; D340-F344 PolarHBondContact O-N 3.28Å; F344-C346 PolarHBondContact O-N 3.01Å; F344-I347 PolarHBondContact O-N 2.85Å; F344-D348 HydrophobicContact CE1-CB 4.37Å; F344-D348 PolarHBondContact O-N 2.94Å
345	R	86.2	Confident	82.2	Confident	71 Å²	71	44 Å²	44	27%	0.268	21%	0.213	S	C	.	.	H	α-helix	trans	-63.2	-41.2	-179.7	-178	174	178.4	166.9	2	112.4	Y256 L341 L342 L343 I347 D348 E349	Y256-R345 PolarHBondContact O-NH1 3.12Å; L341-R345 WeakPolarHBondContact O-CB 3.45Å; L341-R345 PolarHBondContact O-N 3.08Å; L342-R345 PolarHBondContact O-N 2.82Å; L343-R345 VanDerWaalsContact C-N 3.3Å; L343-R345 PolarHBondContact O-N 2.89Å; R345-I347 VanDerWaalsContact C-N 3.31Å; R345-I347 PolarHBondContact O-N 2.93Å; R345-D348 PolarHBondContact O-N 2.99Å; R345-E349 HydrophobicContact CG-CG 4.39Å; R345-E349 WeakPolarHBondContact CG-OE1 3.37Å; R345-E349 IonicContact CZ-OE1 3.63Å; R345-E349 IonicContact NE-OE1 3.6Å; R345-E349 PolarHBondContact NE-OE1 2.73Å; R345-E349 IonicContact NH2-OE1 3.48Å; R345-E349 VanDerWaalsContact O-CB 3.31Å; R345-E349 WeakPolarHBondContact O-CB 3.46Å; R345-E349 VanDerWaalsContact O-CG 3.3Å; R345-E349 WeakPolarHBondContact O-CG 3.2Å; R345-E349 PolarHBondContact O-N 2.93Å
346	C	88	Confident	80.8	Confident	3 Å²	3	54 Å²	54	2%	0.02	25%	0.252	C	S	.	.	H	α-helix	trans	-66	-33.9	176	-67.3	0	0	0	0	112	I292 L342 L343 F344 F350	I292-C346 HydrophobicContact CD1-CB 3.44Å; I292-C346 VanDerWaalsContact CD1-CB 3.44Å; L342-C346 WeakPolarHBondContact O-CB 3.49Å; L342-C346 PolarHBondContact O-N 3.35Å; L342-C346 PolarHBondContact O-SG 2.74Å; L343-C346 PolarHBondContact O-N 2.92Å; F344-C346 PolarHBondContact O-N 3.01Å; C346-F350 WeakPolarHBondContact O-CB 3.49Å; C346-F350 PolarHBondContact O-N 2.91Å
347	I	89.1	Confident	79.4	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-73	-44.9	175.3	-60.7	162.5	0	0	0	110.8	I292 I317 M320 M321 I324 L343 F344 R345 E349 F350 L351	I292-I347 HydrophobicContact CD1-CG1 3.86Å; I292-I347 HydrophobicContact CG1-CG1 3.91Å; I292-I347 HydrophobicContact CG2-CG1 4.04Å; I317-I347 HydrophobicContact CB-CG2 4.26Å; I317-I347 HydrophobicContact CG1-CG2 3.99Å; I317-I347 HydrophobicContact CG2-CB 4.09Å; I317-I347 HydrophobicContact CG2-CG2 3.95Å; M320-I347 HydrophobicContact CB-CD1 4.11Å; M320-I347 HydrophobicContact CB-CG2 4.21Å; M320-I347 HydrophobicContact CE-CG2 4.32Å; M320-I347 HydrophobicContact SD-CG2 3.88Å; M321-I347 HydrophobicContact CB-CD1 4.47Å; M321-I347 HydrophobicContact CG-CD1 3.56Å; I324-I347 HydrophobicContact CD1-CD1 4.31Å; L343-I347 HydrophobicContact CD1-CD1 3.86Å; L343-I347 HydrophobicContact CD1-CG1 4.22Å; L343-I347 HydrophobicContact CG-CD1 3.85Å; L343-I347 VanDerWaalsContact O-CG1 3.31Å; L343-I347 WeakPolarHBondContact O-CG1 3.41Å; L343-I347 PolarHBondContact O-N 2.65Å; F344-I347 PolarHBondContact O-N 2.85Å; R345-I347 VanDerWaalsContact C-N 3.31Å; R345-I347 PolarHBondContact O-N 2.93Å; I347-E349 PolarHBondContact O-N 2.87Å; I347-F350 PolarHBondContact O-N 2.87Å; I347-L351 HydrophobicContact CG2-CD1 3.71Å; I347-L351 HydrophobicContact CG2-CG 3.97Å; I347-L351 WeakPolarHBondContact O-CB 3.34Å; I347-L351 VanDerWaalsContact O-CG 3.31Å; I347-L351 WeakPolarHBondContact O-CG 3.5Å; I347-L351 PolarHBondContact O-N 2.87Å
348	D	85.6	Confident	78	Confident	21 Å²	21	47 Å²	47	11%	0.112	23%	0.231	C	C	.	.	H	α-helix	trans	-63.3	-41.6	176.1	-168.3	60.4	0	0	0	111.9	R313 I317 F344 R345 R352	R313-D348 IonicContact CZ-OD1 3.1Å; R313-D348 VanDerWaalsContact CZ-OD1 3.29Å; R313-D348 IonicContact NE-OD1 3.75Å; R313-D348 PolarHBondContact NE-OD1 2.97Å; R313-D348 VanDerWaalsContact NE-OD1 3.1Å; R313-D348 IonicContact NH2-OD1 3.29Å; R313-D348 PolarHBondContact NH2-OD1 2.99Å; R313-D348 IonicContact NH2-OD2 3.28Å; I317-D348 HydrophobicContact CD1-CB 4.07Å; F344-D348 HydrophobicContact CE1-CB 4.37Å; F344-D348 PolarHBondContact O-N 2.94Å; R345-D348 PolarHBondContact O-N 2.99Å; D348-R352 WeakPolarHBondContact O-CB 3.49Å; D348-R352 WeakPolarHBondContact O-CD 3.41Å; D348-R352 WeakPolarHBondContact O-CG 3.49Å; D348-R352 PolarHBondContact O-N 3.27Å; D348-R352 VanDerWaalsContact O-N 3.09Å; D348-R352 IonicContact OD1-NE 2.61Å; D348-R352 IonicContact OD1-NH2 2.68Å; D348-R352 IonicContact OD2-CZ 2.78Å; D348-R352 VanDerWaalsContact OD2-CZ 3.28Å; D348-R352 IonicContact OD2-NE 2.68Å; D348-R352 PolarHBondContact OD2-NE 2.69Å; D348-R352 IonicContact OD2-NH2 3.47Å; D348-R352 PolarHBondContact OD2-NH2 2.81Å
349	E	86.1	Confident	76.3	Confident	70 Å²	70	48.9 Å²	48.9	33%	0.327	25%	0.245	S	C	.	.	H	α-helix	trans	-63.7	-38.4	174	-73.4	179	-161.8	0	0	112	R285 R345 I347 S353	R285-E349 IonicContact CZ-OE2 3.33Å; R285-E349 IonicContact NH1-OE1 3.96Å; R285-E349 IonicContact NH1-OE2 3.56Å; R285-E349 PolarHBondContact NH1-OE2 2.87Å; R285-E349 IonicContact NH2-OE2 3.22Å; R285-E349 PolarHBondContact NH2-OE2 2.81Å; R345-E349 HydrophobicContact CG-CG 4.39Å; R345-E349 WeakPolarHBondContact CG-OE1 3.37Å; R345-E349 IonicContact CZ-OE1 3.63Å; R345-E349 IonicContact NE-OE1 3.6Å; R345-E349 PolarHBondContact NE-OE1 2.73Å; R345-E349 IonicContact NH2-OE1 3.48Å; R345-E349 VanDerWaalsContact O-CB 3.31Å; R345-E349 WeakPolarHBondContact O-CB 3.46Å; R345-E349 VanDerWaalsContact O-CG 3.3Å; R345-E349 WeakPolarHBondContact O-CG 3.2Å; R345-E349 PolarHBondContact O-N 2.93Å; I347-E349 PolarHBondContact O-N 2.87Å; E349-S353 PolarHBondContact O-N 2.76Å
350	F	87	Confident	74.6	Confident	25 Å²	25	49.3 Å²	49.3	11%	0.11	25%	0.249	C	C	.	.	H	α-helix	trans	-71.5	-47.4	177.5	174.8	-100.5	0	0	0	112.8	I292 R293 W296 C346 I347 R352 S353 L354	I292-F350 HydrophobicContact CG2-CB 4.12Å; I292-F350 HydrophobicContact CG2-CD1 3.51Å; I292-F350 HydrophobicContact CG2-CD2 4.48Å; I292-F350 HydrophobicContact CG2-CE1 3.98Å; I292-F350 HydrophobicContact CG2-CG 3.79Å; R293-F350 HydrophobicContact CB-CE2 3.89Å; R293-F350 HydrophobicContact CB-CZ 3.97Å; R293-F350 HydrophobicContact CG-CE2 4.03Å; R293-F350 HydrophobicContact CG-CZ 4.04Å; W296-F350 HydrophobicContact CB-CE1 3.65Å; W296-F350 HydrophobicContact CB-CZ 4.08Å; W296-F350 HydrophobicContact CD2-CE1 4.32Å; W296-F350 AromaticContact CG-CE1 3.68Å; W296-F350 HydrophobicContact CG-CE1 3.68Å; W296-F350 HydrophobicContact CG-CZ 4.09Å; C346-F350 WeakPolarHBondContact O-CB 3.49Å; C346-F350 PolarHBondContact O-N 2.91Å; I347-F350 PolarHBondContact O-N 2.87Å; F350-R352 VanDerWaalsContact C-N 3.34Å; F350-R352 PolarHBondContact O-N 3.03Å; F350-S353 WeakPolarHBondContact O-CA 3.26Å; F350-S353 WeakPolarHBondContact O-CB 3.49Å; F350-S353 PolarHBondContact O-N 2.87Å; F350-S353 PolarHBondContact O-OG 2.8Å; F350-L354 HydrophobicContact CD1-CD1 4.29Å; F350-L354 HydrophobicContact CE1-CD1 3.55Å; F350-L354 HydrophobicContact CE2-CD1 3.92Å; F350-L354 HydrophobicContact CZ-CD1 3.33Å; F350-L354 HydrophobicContact CZ-CG 4.38Å; F350-L354 PolarHBondContact O-N 2.8Å
351	L	85.7	Confident	72.7	Confident	2 Å²	2	55.1 Å²	55.1	1%	0.01	27%	0.266	C	S	.	.	H	α-helix	trans	-63.4	-38.8	179.4	-68.4	178	0	0	0	111.4	W296 L316 I317 M320 I347 S353 L354 I355	W296-L351 HydrophobicContact CD2-CD2 4.4Å; W296-L351 HydrophobicContact CE3-CD2 3.75Å; W296-L351 HydrophobicContact CH2-CD2 4.43Å; W296-L351 HydrophobicContact CZ3-CD2 3.79Å; L316-L351 HydrophobicContact CD2-CD1 3.91Å; L316-L351 HydrophobicContact CD2-CD2 4.14Å; L316-L351 HydrophobicContact CG-CD1 3.97Å; I317-L351 HydrophobicContact CG1-CD1 3.63Å; M320-L351 HydrophobicContact SD-CD1 4.32Å; M320-L351 HydrophobicContact SD-CD2 3.97Å; M320-L351 HydrophobicContact SD-CG 4.45Å; I347-L351 HydrophobicContact CG2-CD1 3.71Å; I347-L351 HydrophobicContact CG2-CG 3.97Å; I347-L351 WeakPolarHBondContact O-CB 3.34Å; I347-L351 VanDerWaalsContact O-CG 3.31Å; I347-L351 WeakPolarHBondContact O-CG 3.5Å; I347-L351 PolarHBondContact O-N 2.87Å; L351-S353 PolarHBondContact O-N 3.17Å; L351-L354 PolarHBondContact O-N 3.31Å; L351-L354 VanDerWaalsContact O-N 3.1Å; L351-I355 HydrophobicContact CD2-CD1 3.91Å; L351-I355 PolarHBondContact O-N 2.97Å
352	R	78	Confident	70.6	Confident	113 Å²	113	61.9 Å²	61.9	43%	0.426	30%	0.297	S	S	.	.	H	α-helix	trans	-60.4	-23.1	171.2	-74.6	173.7	-167.7	-89.7	6.3	114.2	D348 F350 D360	D348-R352 WeakPolarHBondContact O-CB 3.49Å; D348-R352 WeakPolarHBondContact O-CD 3.41Å; D348-R352 WeakPolarHBondContact O-CG 3.49Å; D348-R352 PolarHBondContact O-N 3.27Å; D348-R352 VanDerWaalsContact O-N 3.09Å; D348-R352 IonicContact OD1-NE 2.61Å; D348-R352 IonicContact OD1-NH2 2.68Å; D348-R352 IonicContact OD2-CZ 2.78Å; D348-R352 VanDerWaalsContact OD2-CZ 3.28Å; D348-R352 IonicContact OD2-NE 2.68Å; D348-R352 PolarHBondContact OD2-NE 2.69Å; D348-R352 IonicContact OD2-NH2 3.47Å; D348-R352 PolarHBondContact OD2-NH2 2.81Å; F350-R352 VanDerWaalsContact C-N 3.34Å; F350-R352 PolarHBondContact O-N 3.03Å; R352-D360 IonicContact NH1-OD1 2.87Å; R352-D360 IonicContact NH1-OD2 2.9Å; R352-D360 PolarHBondContact NH1-OD2 3.27Å
353	S	78.2	Confident	68.1	Low	85 Å²	85	65.6 Å²	65.6	59%	0.594	32%	0.317	S	S	*	.	H	α-helix	trans	-83.4	-15	177.8	81	0	0	0	0	113.6	E349 F350 L351	E349-S353 PolarHBondContact O-N 2.76Å; F350-S353 WeakPolarHBondContact O-CA 3.26Å; F350-S353 WeakPolarHBondContact O-CB 3.49Å; F350-S353 PolarHBondContact O-N 2.87Å; F350-S353 PolarHBondContact O-OG 2.8Å; L351-S353 PolarHBondContact O-N 3.17Å
354	L	72.4	Confident	65.6	Low	95 Å²	95	70.7 Å²	70.7	50%	0.497	34%	0.343	S	S	.	.	H	α-helix	trans	-115.7	-43	-176.5	-66.1	-178	0	0	0	113.3	W296 F350 L351	W296-L354 HydrophobicContact CG-CD1 4.34Å; F350-L354 HydrophobicContact CD1-CD1 4.29Å; F350-L354 HydrophobicContact CE1-CD1 3.55Å; F350-L354 HydrophobicContact CE2-CD1 3.92Å; F350-L354 HydrophobicContact CZ-CD1 3.33Å; F350-L354 HydrophobicContact CZ-CG 4.38Å; F350-L354 PolarHBondContact O-N 2.8Å; L351-L354 PolarHBondContact O-N 3.31Å; L351-L354 VanDerWaalsContact O-N 3.1Å
355	I	64.9	Low	63.1	Low	19 Å²	19	76.4 Å²	76.4	10%	0.097	37%	0.37	C	S	.	.	S	Bend	trans	-103.1	124	-169.8	-47.3	-177.2	0	0	0	109.8	W296 V307 L316 L351 D357	W296-I355 HydrophobicContact CH2-CD1 3.54Å; W296-I355 HydrophobicContact CH2-CG1 4.2Å; W296-I355 HydrophobicContact CZ2-CD1 4.22Å; W296-I355 HydrophobicContact CZ2-CG1 4.41Å; W296-I355 HydrophobicContact CZ3-CD1 4.06Å; V307-I355 HydrophobicContact CB-CG2 3.84Å; V307-I355 HydrophobicContact CG2-CD1 3.78Å; V307-I355 HydrophobicContact CG2-CG2 3.94Å; L316-I355 HydrophobicContact CD2-CD1 3.89Å; L351-I355 HydrophobicContact CD2-CD1 3.91Å; L351-I355 PolarHBondContact O-N 2.97Å; I355-D357 PolarHBondContact O-N 3.39Å; I355-D357 VanDerWaalsContact O-N 3.1Å
356	Y	51.5	Low	60.6	Low	217 Å²	217	75.9 Å²	75.9	85%	0.851	38%	0.381	S	S	*	.			trans	-75.2	98	177.8	-127.2	-88.3	0	0	0	110.4	A358	Y356-A358 PolarHBondContact O-N 3.2Å
357	D	50	Low	58.1	Low	19 Å²	19	80.8 Å²	80.8	10%	0.102	41%	0.41	C	S	.	.			trans	-73.7	121.5	173.9	-166.1	-41.5	0	0	0	110.1	R313 I355 T359	R313-D357 IonicContact CZ-OD2 2.7Å; R313-D357 IonicContact NH1-OD2 3.63Å; R313-D357 PolarHBondContact NH1-OD2 3.21Å; I355-D357 PolarHBondContact O-N 3.39Å; I355-D357 VanDerWaalsContact O-N 3.1Å; D357-T359 PolarHBondContact O-N 2.91Å; D357-T359 WeakPolarHBondContact OD1-CB 3.45Å; D357-T359 PolarHBondContact OD1-N 2.97Å; D357-T359 PolarHBondContact OD1-OG1 3.45Å
358	A	44	Very low	55.3	Low	74 Å²	74	87.5 Å²	87.5	61%	0.612	45%	0.446	S	S	*	.	S	Bend	trans	-67	-25.6	179.8	0	0	0	0	0	112.9	Y356	Y356-A358 PolarHBondContact O-N 3.2Å
359	T	46.6	Very low	52.9	Low	59 Å²	59	90.9 Å²	90.9	36%	0.362	47%	0.472	S	S	.	.	S	Bend	trans	-83.2	-30.5	-173.1	69.5	0	0	0	0	113.5	D357 R361 E362	D357-T359 PolarHBondContact O-N 2.91Å; D357-T359 WeakPolarHBondContact OD1-CB 3.45Å; D357-T359 PolarHBondContact OD1-N 2.97Å; D357-T359 PolarHBondContact OD1-OG1 3.45Å; T359-R361 PolarHBondContact O-N 3.15Å; T359-E362 PolarHBondContact O-N 3.48Å; T359-E362 VanDerWaalsContact O-N 3.16Å
360	D	47.9	Very low	50.2	Low	46 Å²	46	94.6 Å²	94.6	25%	0.246	49%	0.493	C	S	.	.	H	α-helix	trans	-61.5	-20.6	177.5	-99.9	-15.1	0	0	0	111.6	R352 E362 L363 L364	R352-D360 IonicContact NH1-OD1 2.87Å; R352-D360 IonicContact NH1-OD2 2.9Å; R352-D360 PolarHBondContact NH1-OD2 3.27Å; D360-E362 PolarHBondContact O-N 2.97Å; D360-L363 PolarHBondContact O-N 3.35Å; D360-L364 WeakPolarHBondContact O-CB 3.38Å; D360-L364 WeakPolarHBondContact O-CD1 3.38Å; D360-L364 VanDerWaalsContact O-CG 3.27Å; D360-L364 WeakPolarHBondContact O-CG 3.47Å; D360-L364 PolarHBondContact O-N 2.78Å
361	R	39.8	Very low	47.4	Very low	187 Å²	187	101.5 Å²	101.5	71%	0.706	53%	0.531	S	S	*	.	H	α-helix	trans	-67.7	-32.6	177.7	-148.2	179.7	-161	-166.6	6.6	113.7	T359 H365	T359-R361 PolarHBondContact O-N 3.15Å; R361-H365 PolarHBondContact O-CD2 2.92Å; R361-H365 PolarHBondContact O-N 3.07Å
362	E	39.2	Very low	44.6	Very low	163 Å²	163	107.5 Å²	107.5	76%	0.762	57%	0.568	S	S	*	*	H	α-helix	trans	-79	-38.3	175.5	-62.2	-164	141.4	0	0	111.2	T359 D360 H365 A366	T359-E362 PolarHBondContact O-N 3.48Å; T359-E362 VanDerWaalsContact O-N 3.16Å; D360-E362 PolarHBondContact O-N 2.97Å; E362-H365 PolarHBondContact O-N 2.87Å; E362-A366 PolarHBondContact O-N 3.08Å
363	L	35.6	Very low	42.2	Very low	81 Å²	81	108.1 Å²	108.1	42%	0.424	59%	0.587	S	S	.	*	H	α-helix	trans	-65.8	-41.1	175.8	-73.4	170.1	0	0	0	112.5	D360 H365 A366 V367	D360-L363 PolarHBondContact O-N 3.35Å; L363-H365 VanDerWaalsContact C-N 3.31Å; L363-H365 PolarHBondContact O-N 3.21Å; L363-A366 PolarHBondContact O-N 3.32Å; L363-V367 VanDerWaalsContact O-CG2 3.32Å; L363-V367 WeakPolarHBondContact O-CG2 3.49Å; L363-V367 PolarHBondContact O-N 3.34Å
364	L	34.4	Very low	39.9	Very low	108 Å²	108	113.7 Å²	113.7	57%	0.565	60%	0.6	S	S	*	*	H	α-helix	trans	-64.8	-33.1	175.9	-76.5	165.7	0	0	0	112.7	D360 N368	D360-L364 WeakPolarHBondContact O-CB 3.38Å; D360-L364 WeakPolarHBondContact O-CD1 3.38Å; D360-L364 VanDerWaalsContact O-CG 3.27Å; D360-L364 WeakPolarHBondContact O-CG 3.47Å; D360-L364 PolarHBondContact O-N 2.78Å; L364-N368 PolarHBondContact O-ND2 2.82Å
365	H	34.6	Very low	37.9	Very low	146 Å²	146	114.5 Å²	114.5	68%	0.676	61%	0.611	S	S	*	*	H	α-helix	trans	-73.7	-33.4	172.7	-93.9	-79.2	0	0	0	113.1	R361 E362 L363	R361-H365 PolarHBondContact O-CD2 2.92Å; R361-H365 PolarHBondContact O-N 3.07Å; E362-H365 PolarHBondContact O-N 2.87Å; L363-H365 VanDerWaalsContact C-N 3.31Å; L363-H365 PolarHBondContact O-N 3.21Å
366	A	34.5	Very low	36.1	Very low	60 Å²	60	120.5 Å²	120.5	50%	0.496	64%	0.642	S	S	.	*	H	α-helix	trans	-71.4	-39.1	175.6	0	0	0	0	0	113.1	E362 L363 N368 S369	E362-A366 PolarHBondContact O-N 3.08Å; L363-A366 PolarHBondContact O-N 3.32Å; A366-N368 PolarHBondContact O-N 2.75Å; A366-S369 PolarHBondContact O-N 2.74Å
367	V	35.3	Very low	35.1	Very low	106 Å²	106	116.8 Å²	116.8	64%	0.642	64%	0.642	S	S	*	*	H	α-helix	trans	-66.7	-36.5	-178.3	168.4	0	0	0	0	112.2	L363 S369	L363-V367 VanDerWaalsContact O-CG2 3.32Å; L363-V367 WeakPolarHBondContact O-CG2 3.49Å; L363-V367 PolarHBondContact O-N 3.34Å; V367-S369 PolarHBondContact O-N 2.82Å; V367-S369 VanDerWaalsContact O-N 3.09Å
368	N	30.8	Very low	34	Very low	141 Å²	141	123.3 Å²	123.3	75%	0.754	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73	5.5	178.2	-71.5	-34.7	0	0	0	114.5	L364 A366	L364-N368 PolarHBondContact O-ND2 2.82Å; A366-N368 PolarHBondContact O-N 2.75Å
369	S	33.3	Very low	33.4	Very low	93 Å²	93	124.7 Å²	124.7	65%	0.65	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.9	1.3	-174.6	-170.2	0	0	0	0	114.9	A366 V367	A366-S369 PolarHBondContact O-N 2.74Å; V367-S369 PolarHBondContact O-N 2.82Å; V367-S369 VanDerWaalsContact O-N 3.09Å
370	L	30.4	Very low	32.5	Very low	148 Å²	148	130.3 Å²	130.3	78%	0.775	71%	0.71	S	S	*	*			trans	-122.9	18.8	-166.8	-128.2	75.7	0	0	0	116.8	T372	L370-T372 VanDerWaalsContact C-N 3.27Å; L370-T372 PolarHBondContact O-N 2.79Å
371	D	28.4	Very low	31.7	Very low	170 Å²	170	134.7 Å²	134.7	91%	0.909	73%	0.734	S	S	*	*			trans	-74.6	74.7	167.3	-93.1	-34.3	0	0	0	111.7
372	T	27.4	Very low	31.1	Very low	128 Å²	128	129.7 Å²	129.7	79%	0.785	73%	0.727	S	S	*	*			trans	-170.1	117.9	153.4	6.2	0	0	0	0	112.1	L370	L370-T372 VanDerWaalsContact C-N 3.27Å; L370-T372 PolarHBondContact O-N 2.79Å
373	P	27.6	Very low	30.6	Very low	125 Å²	125	128.1 Å²	128.1	81%	0.812	73%	0.729	S	S	*	*			trans	-87.5	138.6	177.7	32.9	-33.3	0	0	0	112.9
374	K	29.2	Very low	30.3	Very low	203 Å²	203	130.9 Å²	130.9	88%	0.883	74%	0.744	S	S	*	*			trans	-141	144.9	160	-79	-172	176.9	176.3	0	111.2
375	P	29.3	Very low	30.1	Very low	111 Å²	111	130.9 Å²	130.9	72%	0.721	75%	0.749	S	S	*	*			trans	-111.5	151.4	-167.3	8.6	15.7	0	0	0	115.2
376	I	27.6	Very low	29.8	Very low	146 Å²	146	129.1 Å²	129.1	75%	0.749	75%	0.748	S	S	*	*			trans	59.1	117.3	143.5	-53.4	161.3	0	0	0	118.6
377	T	30.8	Very low	29.5	Very low	138 Å²	138	133.1 Å²	133.1	85%	0.847	76%	0.762	S	S	*	*				-170.8	149.8	115.3	25.7	0	0	0	0	111.8
378	D	26.4	Very low	29.2	Very low	156 Å²	156	134.5 Å²	134.5	83%	0.834	77%	0.77	S	S	*	*			trans	-93.6	151.4	-173.6	-40.3	-92.3	0	0	0	113.1
379	A	31.7	Very low	29	Very low	104 Å²	104	133.2 Å²	133.2	86%	0.86	77%	0.768	S	S	*	*			trans	-159.3	147	160.6	0	0	0	0	0	110.9
380	E	27.1	Very low	28.6	Very low	176 Å²	176	134.8 Å²	134.8	82%	0.822	77%	0.773	S	S	*	*			trans	-94.5	-177.9	-170.5	-54.3	171.3	123.6	0	0	113.8
381	N	31.7	Very low	28.6	Very low	138 Å²	138	133.8 Å²	133.8	74%	0.738	77%	0.774	S	S	*	*			trans	81.7	148.8	164.5	-69.4	-68.5	0	0	0	118.6
382	S	28	Very low	28.4	Very low	82 Å²	82	131.6 Å²	131.6	57%	0.573	77%	0.767	S	S	*	*			cis	173.5	136	-27.5	-101.6	0	0	0	0	107.1
383	T	29	Very low	28.6	Very low	131 Å²	131	132.2 Å²	132.2	80%	0.804	77%	0.771	S	S	*	*			trans	64.7	157.5	168.3	75.9	0	0	0	0	115.5
384	N	28.8	Very low	28.5	Very low	138 Å²	138	133.8 Å²	133.8	74%	0.738	77%	0.772	S	S	*	*			cis	-160.2	170.4	-4.8	-129.7	-15.2	0	0	0	113
385	V	29.7	Very low	28.7	Very low	109 Å²	109	131 Å²	131	66%	0.661	77%	0.772	S	S	*	*			trans	76.7	106.3	142.2	165	0	0	0	0	121.2
386	T	28.6	Very low	28.6	Very low	108 Å²	108	131.2 Å²	131.2	66%	0.663	77%	0.771	S	S	*	*			trans	63.1	121.4	138.9	65	0	0	0	0	124.2
387	N	27.4	Very low	28.6	Very low	145 Å²	145	130.2 Å²	130.2	78%	0.775	77%	0.767	S	S	*	*				38.4	129.3	116.3	-48.5	10.7	0	0	0	120.4
388	T	30.4	Very low	28.6	Very low	135 Å²	135	130.7 Å²	130.7	83%	0.828	76%	0.76	S	S	*	*				-164.6	150.1	111.9	-70.2	0	0	0	0	109.6
389	T	25.8	Very low	28.6	Very low	114 Å²	114	129.8 Å²	129.8	70%	0.699	76%	0.755	S	S	*	*			trans	-89.8	165.4	-168.5	-27.3	0	0	0	0	113.9
390	T	26.2	Very low	28.5	Very low	125 Å²	125	134.3 Å²	134.3	77%	0.767	76%	0.755	S	S	*	*			trans	64.5	156.3	161.8	39.5	0	0	0	0	117.2
391	T	29.3	Very low	28.7	Very low	127 Å²	127	131 Å²	131	78%	0.779	75%	0.746	S	S	*	*			cis	-144	167.2	6.5	-16.5	0	0	0	0	111.3
392	T	25.1	Very low	28.7	Very low	125 Å²	125	133.2 Å²	133.2	77%	0.767	75%	0.75	S	S	*	*			trans	-74.1	151.3	172.6	44.3	0	0	0	0	114.1
393	T	30.4	Very low	28.8	Very low	141 Å²	141	134.7 Å²	134.7	87%	0.865	76%	0.76	S	S	*	*			trans	-176.2	136	137.5	32.7	0	0	0	0	110.9
394	D	26.9	Very low	28.9	Very low	157 Å²	157	132.3 Å²	132.3	84%	0.84	76%	0.762	S	S	*	*			trans	-76.5	148.3	174.8	-55.5	-81.5	0	0	0	113.8
395	V	32	Very low	28.9	Very low	144 Å²	144	135 Å²	135	87%	0.873	77%	0.77	S	S	*	*			trans	-143.4	116.6	151.4	-173.3	0	0	0	0	110
396	T	27.1	Very low	29	Very low	116 Å²	116	135.8 Å²	135.8	71%	0.712	78%	0.78	S	S	*	*			trans	-86.4	141.2	166.4	55	0	0	0	0	110.7
397	N	29.2	Very low	29	Very low	125 Å²	125	137 Å²	137	67%	0.668	79%	0.787	S	S	*	*				179.6	145.4	123.8	-98.5	20.4	0	0	0	116.3
398	E	30.8	Very low	29.2	Very low	148 Å²	148	134.2 Å²	134.2	69%	0.692	79%	0.785	S	S	*	*			trans	71.5	111.3	138.9	-70.8	177.9	-130.6	0	0	124
399	L	26.2	Very low	29.1	Very low	138 Å²	138	133.9 Å²	133.9	72%	0.723	78%	0.778	S	S	*	*				59.7	121.4	119.9	-62.2	168.7	0	0	0	121
400	F	29.4	Very low	29.4	Very low	198 Å²	198	135.4 Å²	135.4	87%	0.868	78%	0.777	S	S	*	*				-153.1	168.2	110.7	-135	-99.9	0	0	0	113.5
401	V	30	Very low	29.5	Very low	106 Å²	106	135.7 Å²	135.7	64%	0.642	77%	0.774	S	S	*	*			trans	-127.3	143.2	-165.2	174.1	0	0	0	0	112.7
402	K	33	Very low	29.6	Very low	186 Å²	186	138 Å²	138	81%	0.809	78%	0.775	S	S	*	*			trans	169.1	120.3	143.8	-91.8	155.5	-177.2	-178.2	0	109.2
403	S	28.6	Very low	29.7	Very low	112 Å²	112	137.5 Å²	137.5	78%	0.783	77%	0.772	S	S	*	*			cis	90.1	119.1	49.4	75.7	0	0	0	0	114
404	G	32	Very low	29.5	Very low	82 Å²	82	138.5 Å²	138.5	85%	0.845	77%	0.772	S	S	*	*			trans	175	119.6	171.3	0	0	0	0	0	111.6
405	E	28.4	Very low	29.4	Very low	195 Å²	195	136.9 Å²	136.9	91%	0.911	77%	0.768	S	S	*	*			trans	-104.6	148.7	-173.7	-58.8	158.2	102.8	0	0	112.5
406	S	32.8	Very low	29.2	Very low	124 Å²	124	139.2 Å²	139.2	87%	0.867	77%	0.769	S	S	*	*			trans	-160.4	152	135.2	62.7	0	0	0	0	110.6
407	T	27.9	Very low	29.1	Very low	134 Å²	134	139.4 Å²	139.4	82%	0.822	77%	0.77	S	S	*	*			trans	-127.3	174.4	-170.2	49.1	0	0	0	0	112.3
408	A	31.2	Very low	29	Very low	87 Å²	87	141.5 Å²	141.5	72%	0.719	78%	0.779	S	S	*	*			trans	76.1	144.4	165.6	0	0	0	0	0	117.1
409	N	29.2	Very low	28.8	Very low	128 Å²	128	140.1 Å²	140.1	68%	0.684	78%	0.781	S	S	*	*			cis	-160.2	169.1	-19.3	-123.5	21.5	0	0	0	111.1
410	E	32.4	Very low	28.8	Very low	146 Å²	146	138.9 Å²	138.9	68%	0.682	78%	0.776	S	S	*	*			trans	62	114.2	149.8	-71.1	159.2	-119.1	0	0	120.5
411	N	27.9	Very low	28.7	Very low	131 Å²	131	138.7 Å²	138.7	70%	0.701	77%	0.774	S	S	*	*				42.4	125.6	122.7	-49.5	-24.4	0	0	0	118.2
412	H	31.7	Very low	28.6	Very low	174 Å²	174	143 Å²	143	81%	0.806	79%	0.79	S	S	*	*				-156	154.1	68.2	-103.5	-84.3	0	0	0	115.4
413	T	25.8	Very low	28.4	Very low	115 Å²	115	140.2 Å²	140.2	71%	0.706	79%	0.789	S	S	*	*			trans	-56.7	147	162	50.3	0	0	0	0	113.2
414	L	26.4	Very low	28.4	Very low	163 Å²	163	141.7 Å²	141.7	85%	0.853	79%	0.788	S	S	*	*				-164.5	153.6	107.7	-103	165	0	0	0	112.4
415	T	25.7	Very low	28.4	Very low	123 Å²	123	144.4 Å²	144.4	76%	0.755	78%	0.783	S	S	*	*			trans	-71.4	146.7	173	44.3	0	0	0	0	111.9
416	E	27.3	Very low	28.4	Very low	193 Å²	193	145.5 Å²	145.5	90%	0.902	78%	0.78	S	S	*	*			trans	-150.4	144.3	135.4	-134.2	163.1	-143.6	0	0	114.1
417	T	25.2	Very low	28.2	Very low	119 Å²	119	146.5 Å²	146.5	73%	0.73	78%	0.775	S	S	*	*			trans	-71.5	152.1	175.1	-47.5	0	0	0	0	111
418	I	27.3	Very low	28.3	Very low	169 Å²	169	145 Å²	145	87%	0.867	77%	0.766	S	S	*	*			trans	-150.8	147.6	148.2	-107.4	145.7	0	0	0	111.3
419	T	26.4	Very low	28.3	Very low	120 Å²	120	150 Å²	150	74%	0.736	77%	0.772	S	S	*	*			trans	-97.2	163.7	-168.8	47.1	0	0	0	0	114	K421	T419-K421 PolarHBondContact O-N 3.37Å
420	N	25.6	Very low	28.4	Very low	112 Å²	112	148.7 Å²	148.7	60%	0.599	77%	0.772	S	S	*	*			trans	-47	131	164.9	-66.1	-23.7	0	0	0	112.6
421	K	27.1	Very low	28.6	Very low	194 Å²	194	147 Å²	147	84%	0.843	77%	0.771	S	S	*	*				171.6	123.8	128.2	-96.8	166.7	-178.2	-179.6	0	112	T419	T419-K421 PolarHBondContact O-N 3.37Å
422	M	28.8	Very low	29	Very low	196 Å²	196	147 Å²	147	97%	0.966	77%	0.771	S	S	*	*			trans	-133.9	134.4	141.6	-77.7	-166.7	171.8	0	0	108.3
423	T	28.6	Very low	29.2	Very low	128 Å²	128	145.1 Å²	145.1	79%	0.785	77%	0.767	S	S	*	*			trans	-137.1	156.2	172	42.9	0	0	0	0	107.6
424	D	28.6	Very low	29.7	Very low	142 Å²	142	145.4 Å²	145.4	76%	0.759	76%	0.764	S	S	*	*			trans	-71	175.8	-157	-56.1	-84.8	0	0	0	117.7
425	N	31.4	Very low	30.1	Very low	140 Å²	140	143.8 Å²	143.8	75%	0.749	76%	0.762	S	S	*	*			trans	81.1	96.4	151.3	-63.8	-46.5	0	0	0	119.1
426	Y	28.6	Very low	30.5	Very low	218 Å²	218	142.3 Å²	142.3	86%	0.855	76%	0.762	S	S	*	*				29.1	118.6	115.2	-80.7	-81.9	0	0	0	119.4
427	L	28.3	Very low	30.9	Very low	144 Å²	144	137.2 Å²	137.2	75%	0.754	75%	0.753	S	S	*	*				113.8	104.3	127.1	-141.5	74.8	0	0	0	118.9
428	T	30.2	Very low	31.3	Very low	103 Å²	103	138.2 Å²	138.2	63%	0.632	75%	0.754	S	S	*	*			trans	68.7	114.6	147.7	46.2	0	0	0	0	122.8
429	K	32.4	Very low	31.9	Very low	193 Å²	193	135.9 Å²	135.9	84%	0.839	74%	0.743	S	S	*	*			trans	71.6	145.7	130.5	-67	179.7	179.2	-177.2	0	119.3
430	S	31.8	Very low	32.4	Very low	99 Å²	99	136.7 Å²	136.7	69%	0.692	74%	0.743	S	S	*	*			cis	-178.3	164.6	-16.4	52	0	0	0	0	110.2
431	V	35	Very low	33	Very low	111 Å²	111	139.1 Å²	139.1	67%	0.673	76%	0.756	S	S	*	*			trans	83.1	101.1	160.7	174.9	0	0	0	0	117.5
432	D	37.3	Very low	33.5	Very low	131 Å²	131	133.2 Å²	133.2	70%	0.701	75%	0.75	S	S	*	*				52.7	146	114.7	-32.5	-25.5	0	0	0	120
433	D	35.9	Very low	33.9	Very low	134 Å²	134	131 Å²	131	72%	0.717	74%	0.742	S	S	*	*			cis	-163.1	171.2	0.4	-134.2	-24.5	0	0	0	115.8
434	D	35.1	Very low	34.4	Very low	121 Å²	121	131.6 Å²	131.6	65%	0.647	74%	0.739	S	S	*	*			trans	54.9	125.7	145.6	-93.3	-19.8	0	0	0	126.5
435	T	34.9	Very low	34.7	Very low	130 Å²	130	131 Å²	131	80%	0.798	74%	0.741	S	S	*	*			trans	67.2	166.2	136.7	65.8	0	0	0	0	120.7
436	A	34.5	Very low	34.8	Very low	92 Å²	92	128.3 Å²	128.3	76%	0.76	75%	0.746	S	S	*	*			cis	-176.6	170.2	-27.4	0	0	0	0	0	108.2
437	A	35.2	Very low	35	Very low	86 Å²	86	121.7 Å²	121.7	71%	0.711	74%	0.744	S	S	*	*			cis	-174.3	-166.6	-31.6	0	0	0	0	0	108.8
438	N	35.1	Very low	35.3	Very low	140 Å²	140	119.3 Å²	119.3	75%	0.749	75%	0.745	S	S	*	*			trans	85.2	143.4	154.2	-103	47.4	0	0	0	124.2
439	D	39.3	Very low	35.3	Very low	119 Å²	119	120.2 Å²	120.2	64%	0.636	75%	0.751	S	S	*	*			trans	77.1	103.7	148.3	-58.4	-36.5	0	0	0	124.2
440	N	36.3	Very low	35.4	Very low	137 Å²	137	118.3 Å²	118.3	73%	0.733	75%	0.748	S	S	*	*				44.5	147.9	105.7	-55.9	-8.1	0	0	0	119.7
441	D	39.6	Very low	35.2	Very low	163 Å²	163	118.8 Å²	118.8	87%	0.872	75%	0.747	S	S	*	*			cis	-162.1	-179.9	31.1	-111.8	-40	0	0	0	110.2
442	G	37.6	Very low	34.8	Very low	70 Å²	70	119.8 Å²	119.8	72%	0.722	75%	0.754	S	S	*	*			trans	174.5	-40.8	161.2	0	0	0	0	0	124.9
443	D	36.5	Very low	34.5	Very low	151 Å²	151	119.9 Å²	119.9	81%	0.807	76%	0.759	S	S	*	*			trans	48.5	175.7	168.2	-156.9	22.8	0	0	0	122.9
444	I	38.1	Very low	34	Very low	140 Å²	140	119.8 Å²	119.8	72%	0.718	76%	0.763	S	S	*	*			trans	96.8	65.4	162.2	-42.6	-172.4	0	0	0	118.9
445	T	34.8	Very low	33.7	Very low	129 Å²	129	118.5 Å²	118.5	79%	0.791	77%	0.77	S	S	*	*				36.3	138.1	122.3	65.1	0	0	0	0	124.8
446	G	35.3	Very low	33.3	Very low	84 Å²	84	118.5 Å²	118.5	87%	0.866	77%	0.77	S	S	*	*			trans	139.2	119.4	146.9	0	0	0	0	0	115.3
447	G	32.9	Very low	33	Very low	78 Å²	78	121.3 Å²	121.3	80%	0.804	77%	0.77	S	S	*	*			cis	179.1	-179.1	-5	0	0	0	0	0	112.2
448	A	34.1	Very low	32.6	Very low	95 Å²	95	123.6 Å²	123.6	79%	0.785	78%	0.776	S	S	*	*			trans	79.6	84.4	174.9	0	0	0	0	0	119.7
449	T	30.7	Very low	32.5	Very low	121 Å²	121	122.2 Å²	122.2	74%	0.742	78%	0.777	S	S	*	*				16.9	139.5	113.7	-12.5	0	0	0	0	117.5
450	I	32.7	Very low	31.8	Very low	153 Å²	153	125.6 Å²	125.6	79%	0.785	79%	0.789	S	S	*	*				-159.7	118	62.2	-74	173.9	0	0	0	108.8
451	T	28.4	Very low	31.6	Very low	110 Å²	110	128.2 Å²	128.2	68%	0.675	80%	0.797	S	S	*	*				83.7	120.2	84.3	-45.7	0	0	0	0	115.9
452	T	27.1	Very low	31.1	Very low	132 Å²	132	128.2 Å²	128.2	81%	0.81	79%	0.791	S	S	*	*			trans	-82.5	147.4	172.2	-46.7	0	0	0	0	112.2
453	T	30.1	Very low	30.6	Very low	132 Å²	132	131.7 Å²	131.7	81%	0.81	79%	0.793	S	S	*	*			trans	-137.6	121	168.1	-44.1	0	0	0	0	111.5
454	T	26.3	Very low	30.4	Very low	132 Å²	132	132.4 Å²	132.4	81%	0.81	80%	0.795	S	S	*	*			trans	-81.1	151.4	166.7	26.6	0	0	0	0	111.2
455	A	29.2	Very low	29.9	Very low	94 Å²	94	132.6 Å²	132.6	78%	0.777	80%	0.798	S	S	*	*			trans	-137.9	101.4	173.6	0	0	0	0	0	110.9
456	T	25	Very low	29.7	Very low	131 Å²	131	131.6 Å²	131.6	80%	0.804	80%	0.796	S	S	*	*			trans	-88	131.6	167.6	-45.4	0	0	0	0	108.4
457	I	29.9	Very low	29.3	Very low	150 Å²	150	135 Å²	135	77%	0.769	79%	0.793	S	S	*	*			trans	-120.4	115.1	172	-61.5	180	0	0	0	108.8
458	T	25.7	Very low	29.1	Very low	134 Å²	134	139.4 Å²	139.4	82%	0.822	79%	0.793	S	S	*	*			trans	-111.4	134.6	164.5	44.1	0	0	0	0	108.6
459	S	32.3	Very low	28.9	Very low	112 Å²	112	142.4 Å²	142.4	78%	0.783	80%	0.795	S	S	*	*			trans	-143.9	116.5	172.4	56.3	0	0	0	0	109.8
460	Q	26.2	Very low	28.7	Very low	189 Å²	189	147.3 Å²	147.3	88%	0.883	80%	0.8	S	S	*	*			trans	-76.5	149.9	172.7	-63.4	165.1	-35.2	0	0	109.9
461	H	31.8	Very low	28.4	Very low	193 Å²	193	145.4 Å²	145.4	89%	0.894	80%	0.796	S	S	*	*			trans	-149.6	152.6	152.1	-127.5	-87.2	0	0	0	110.7
462	E	27.6	Very low	28.5	Very low	163 Å²	163	149.7 Å²	149.7	76%	0.762	81%	0.805	S	S	*	*			trans	-101.4	157.3	-161.5	-56.1	176.8	114	0	0	114.4
463	N	27.5	Very low	28.4	Very low	142 Å²	142	150.1 Å²	150.1	76%	0.759	80%	0.802	S	S	*	*			trans	27.5	132	148.9	-74.6	-42.6	0	0	0	121.3
464	I	31.8	Very low	28.1	Very low	166 Å²	166	148.8 Å²	148.8	85%	0.851	80%	0.798	S	S	*	*				-162.6	139.5	120.3	-101.8	151.5	0	0	0	110.6
465	D	29.2	Very low	28.2	Very low	145 Å²	145	146.8 Å²	146.8	78%	0.775	80%	0.795	S	S	*	*			trans	-80.2	137.8	177	-75.6	-67.1	0	0	0	113.6
466	S	30.1	Very low	28	Very low	108 Å²	108	147.2 Å²	147.2	76%	0.755	79%	0.791	S	S	*	*			trans	-178.7	120.4	137.6	22.7	0	0	0	0	109
467	L	26.2	Very low	28.2	Very low	154 Å²	154	147.5 Å²	147.5	81%	0.806	79%	0.787	S	S	*	*				52.1	100.6	53.4	-73.1	171.2	0	0	0	114.5
468	Q	28.8	Very low	28.1	Very low	172 Å²	172	148 Å²	148	80%	0.804	79%	0.791	S	S	*	*				163.1	155.5	129.3	-86.1	-66.5	-11.5	0	0	111.2
469	L	30.7	Very low	28.4	Very low	157 Å²	157	151.3 Å²	151.3	82%	0.822	80%	0.797	S	S	*	*			trans	58.4	115.5	172.1	-53.9	166.6	0	0	0	116.6
470	R	25.5	Very low	28.3	Very low	225 Å²	225	150.6 Å²	150.6	85%	0.849	79%	0.792	S	S	*	*			cis	76.1	109.9	0.9	-129	-176.2	-166.6	-163.7	3.8	120.1
471	T	26.4	Very low	28.7	Very low	113 Å²	113	148.5 Å²	148.5	69%	0.693	79%	0.787	S	S	*	*			trans	64.5	114	146.7	43.1	0	0	0	0	121.7
472	K	30.5	Very low	28.9	Very low	199 Å²	199	146 Å²	146	87%	0.865	78%	0.78	S	S	*	*				175.7	161.8	113.7	-92.3	168.9	179.6	-174.4	0	108.8
473	L	25.2	Very low	29.4	Very low	141 Å²	141	144.4 Å²	144.4	74%	0.738	78%	0.776	S	S	*	*			cis	156.4	117.5	-29.9	-109.7	166.6	0	0	0	106.8
474	S	24.8	Very low	29.8	Very low	104 Å²	104	143.8 Å²	143.8	73%	0.727	77%	0.768	S	S	*	*			trans	59.7	141.8	144.5	65.3	0	0	0	0	123.1
475	A	27.1	Very low	30	Very low	91 Å²	91	144.2 Å²	144.2	75%	0.752	77%	0.772	S	S	*	*			trans	72.9	153.9	149.5	0	0	0	0	0	117.8
476	C	25.3	Very low	30.2	Very low	103 Å²	103	142.5 Å²	142.5	70%	0.696	76%	0.763	S	S	*	*			cis	-171.6	-178.5	-26.9	-102.4	0	0	0	0	106.3
477	D	28.8	Very low	30.7	Very low	136 Å²	136	144.8 Å²	144.8	73%	0.727	77%	0.767	S	S	*	*			trans	71.1	118.8	162.1	-45.3	-40.2	0	0	0	114.7
478	L	28.8	Very low	31.5	Very low	161 Å²	161	144.4 Å²	144.4	84%	0.843	77%	0.765	S	S	*	*				71.9	107.2	58.3	-68.4	170.7	0	0	0	113.7
479	E	32	Very low	32.1	Very low	203 Å²	203	142.5 Å²	142.5	95%	0.949	76%	0.761	S	S	*	*			trans	-156.4	155.4	142.7	-112.8	164.7	-158.6	0	0	108.4
480	S	30.7	Very low	32.9	Very low	98 Å²	98	141.3 Å²	141.3	69%	0.685	75%	0.751	S	S	*	*			trans	-126.6	-151.7	-163.3	52.6	0	0	0	0	112.4
481	D	34	Very low	34	Very low	145 Å²	145	133.6 Å²	133.6	78%	0.775	74%	0.736	S	S	*	*			trans	78.1	150.7	168.4	-37.6	-13.8	0	0	0	113.2
482	D	37.2	Very low	35.1	Very low	139 Å²	139	134.8 Å²	134.8	74%	0.743	73%	0.733	S	S	*	*			cis	-161.2	142.7	11.2	-153.9	40.6	0	0	0	106.6
483	I	36.7	Very low	36	Very low	131 Å²	131	132.1 Å²	132.1	67%	0.672	72%	0.724	S	S	*	*			cis	-158	-169.1	-0.9	-146.2	174.5	0	0	0	110.9
484	Q	36.6	Very low	37.6	Very low	129 Å²	129	131 Å²	131	60%	0.603	71%	0.713	S	S	*	*			trans	-46.5	159.1	179.3	-61.1	164.6	-93.8	0	0	121.1	D486	Q484-D486 WeakPolarHBondContact CG-OD2 3.41Å; Q484-D486 PolarHBondContact NE2-OD2 2.93Å
485	D	35.5	Very low	39.1	Very low	175 Å²	175	131.8 Å²	131.8	94%	0.936	71%	0.705	S	S	*	*				-150.2	106.2	119.9	-106.6	-23.2	0	0	0	108.3
486	D	33.9	Very low	40.4	Very low	109 Å²	109	129.4 Å²	129.4	58%	0.583	69%	0.686	S	S	*	*			trans	-101.6	145.6	-176.2	-40.9	-90	0	0	0	111.9	Q484	Q484-D486 WeakPolarHBondContact CG-OD2 3.41Å; Q484-D486 PolarHBondContact NE2-OD2 2.93Å
487	D	40.6	Very low	41.8	Very low	156 Å²	156	127.3 Å²	127.3	83%	0.834	68%	0.676	S	S	*	*	S	Bend	trans	171.9	-29.1	139.2	-98.5	-18.4	0	0	0	114.1
488	D	42.1	Very low	43	Very low	145 Å²	145	123.2 Å²	123.2	78%	0.775	66%	0.661	S	S	*	*	S	Bend	trans	-80.8	-34.3	-171	-82.5	-43.7	0	0	0	114.5	E490 A491	D488-E490 VanDerWaalsContact C-N 3.31Å; D488-E490 PolarHBondContact O-N 2.98Å; D488-A491 WeakPolarHBondContact O-CB 3.45Å; D488-A491 PolarHBondContact O-N 3.22Å; D488-A491 VanDerWaalsContact O-N 3.14Å
489	D	42.7	Very low	43.9	Very low	132 Å²	132	121 Å²	121	71%	0.706	64%	0.641	S	S	*	*	H	α-helix	trans	-62.1	-32.6	-173.6	-65.5	-43.7	0	0	0	113.5	A491 E492 E493	D489-A491 PolarHBondContact O-N 3.4Å; D489-A491 VanDerWaalsContact O-N 3.16Å; D489-E492 PolarHBondContact O-N 3.13Å; D489-E492 VanDerWaalsContact O-N 3.15Å; D489-E493 PolarHBondContact O-N 3.29Å
490	E	45.8	Very low	44.6	Very low	132 Å²	132	113.6 Å²	113.6	62%	0.617	62%	0.615	S	S	*	*	H	α-helix	trans	-69.8	-12.6	-178.6	-139.1	-146.9	-116.9	0	0	113	D488 K494	D488-E490 VanDerWaalsContact C-N 3.31Å; D488-E490 PolarHBondContact O-N 2.98Å; E490-K494 WeakPolarHBondContact O-CB 3.43Å; E490-K494 PolarHBondContact O-NZ 2.76Å; E490-K494 IonicContact OE2-NZ 3.57Å; E490-K494 PolarHBondContact OE2-NZ 3.09Å
491	A	49.2	Very low	45.5	Very low	64 Å²	64	111.7 Å²	111.7	53%	0.529	61%	0.605	S	S	.	*	H	α-helix	trans	-85.6	-43.3	170.6	0	0	0	0	0	111.5	D488 D489 K494 E495	D488-A491 WeakPolarHBondContact O-CB 3.45Å; D488-A491 PolarHBondContact O-N 3.22Å; D488-A491 VanDerWaalsContact O-N 3.14Å; D489-A491 PolarHBondContact O-N 3.4Å; D489-A491 VanDerWaalsContact O-N 3.16Å; A491-K494 PolarHBondContact O-N 2.85Å; A491-E495 PolarHBondContact O-N 3.46Å
492	E	49.5	Very low	45.9	Very low	138 Å²	138	110.4 Å²	110.4	65%	0.645	60%	0.598	S	S	*	*	H	α-helix	trans	-72.2	-39.7	179.6	-173.6	151.1	-143.4	0	0	111.9	D489 K494 E495 A496	D489-E492 PolarHBondContact O-N 3.13Å; D489-E492 VanDerWaalsContact O-N 3.15Å; E492-K494 VanDerWaalsContact C-N 3.27Å; E492-K494 PolarHBondContact O-N 3.26Å; E492-E495 PolarHBondContact O-N 2.85Å; E492-A496 VanDerWaalsContact O-CB 3.29Å; E492-A496 WeakPolarHBondContact O-CB 3.07Å; E492-A496 PolarHBondContact O-N 2.87Å
493	E	50.8	Low	46	Very low	142 Å²	142	109 Å²	109	66%	0.664	59%	0.587	S	S	*	*	H	α-helix	trans	-61.3	-37.5	171	-171.4	-177.3	-150.5	0	0	111.2	D489 A496 A497	D489-E493 PolarHBondContact O-N 3.29Å; E493-A496 PolarHBondContact O-N 3.01Å; E493-A497 VanDerWaalsContact O-CB 3.3Å; E493-A497 WeakPolarHBondContact O-CB 3.2Å; E493-A497 PolarHBondContact O-N 3.44Å
494	K	58.4	Low	46.2	Very low	119 Å²	119	106.2 Å²	106.2	52%	0.517	58%	0.579	S	S	.	*	H	α-helix	trans	-74.2	-31.7	179.2	-168.7	173.1	-66.1	91.2	0	112.7	E490 A491 E492 A498	E490-K494 WeakPolarHBondContact O-CB 3.43Å; E490-K494 PolarHBondContact O-NZ 2.76Å; E490-K494 IonicContact OE2-NZ 3.57Å; E490-K494 PolarHBondContact OE2-NZ 3.09Å; A491-K494 PolarHBondContact O-N 2.85Å; E492-K494 VanDerWaalsContact C-N 3.27Å; E492-K494 PolarHBondContact O-N 3.26Å; K494-A498 WeakPolarHBondContact O-CB 3.29Å; K494-A498 PolarHBondContact O-N 2.93Å; K494-A498 VanDerWaalsContact O-N 3.08Å
495	E	56.6	Low	46.4	Very low	120 Å²	120	102.5 Å²	102.5	56%	0.561	57%	0.57	S	S	*	*	H	α-helix	trans	-74.7	-36.9	169.3	-158.3	-176.4	125.4	0	0	111.6	A491 E492 A498 R499	A491-E495 PolarHBondContact O-N 3.46Å; E492-E495 PolarHBondContact O-N 2.85Å; E495-A498 CarbonylContact O-C 3.5Å; E495-A498 PolarHBondContact O-N 3.46Å; E495-R499 WeakPolarHBondContact O-CB 3.33Å; E495-R499 PolarHBondContact O-N 2.79Å; E495-R499 IonicContact OE1-CZ 3.98Å; E495-R499 IonicContact OE1-NH2 2.68Å; E495-R499 PolarHBondContact OE1-NH2 2.78Å
496	A	52.5	Low	46.5	Very low	41 Å²	41	100.4 Å²	100.4	34%	0.339	56%	0.558	S	S	.	*	H	α-helix	trans	-61.5	-44.2	172.5	0	0	0	0	0	111.6	E492 E493 A498 R499 A500	E492-A496 VanDerWaalsContact O-CB 3.29Å; E492-A496 WeakPolarHBondContact O-CB 3.07Å; E492-A496 PolarHBondContact O-N 2.87Å; E493-A496 PolarHBondContact O-N 3.01Å; A496-A498 VanDerWaalsContact C-N 3.34Å; A496-A498 PolarHBondContact O-N 3.37Å; A496-R499 WeakPolarHBondContact O-CB 3.32Å; A496-R499 PolarHBondContact O-N 3.13Å; A496-R499 VanDerWaalsContact O-N 3.16Å; A496-A500 WeakPolarHBondContact O-CB 3.47Å; A496-A500 PolarHBondContact O-N 3.38Å
497	A	54.7	Low	46.7	Very low	59 Å²	59	102.4 Å²	102.4	49%	0.488	56%	0.562	S	S	.	*	H	α-helix	trans	-63.2	-37.1	173.1	0	0	0	0	0	112.3	E493 A501	E493-A497 VanDerWaalsContact O-CB 3.3Å; E493-A497 WeakPolarHBondContact O-CB 3.2Å; E493-A497 PolarHBondContact O-N 3.44Å; A497-A501 WeakPolarHBondContact O-CB 3.11Å; A497-A501 PolarHBondContact O-N 3.07Å
498	A	55.2	Low	46.7	Very low	50 Å²	50	100.5 Å²	100.5	41%	0.413	55%	0.552	S	S	.	*	H	α-helix	trans	-70.9	-29.6	173.6	0	0	0	0	0	113.1	K494 E495 A496 N502	K494-A498 WeakPolarHBondContact O-CB 3.29Å; K494-A498 PolarHBondContact O-N 2.93Å; K494-A498 VanDerWaalsContact O-N 3.08Å; E495-A498 CarbonylContact O-C 3.5Å; E495-A498 PolarHBondContact O-N 3.46Å; A496-A498 VanDerWaalsContact C-N 3.34Å; A496-A498 PolarHBondContact O-N 3.37Å; A498-N502 WeakPolarHBondContact O-CB 3.4Å; A498-N502 PolarHBondContact O-N 3.06Å; A498-N502 PolarHBondContact O-ND2 2.85Å; A498-N502 VanDerWaalsContact O-ND2 3.15Å
499	R	48.1	Very low	46.5	Very low	113 Å²	113	96 Å²	96	43%	0.426	53%	0.534	S	S	.	.	H	α-helix	trans	-72.3	-50.9	175.2	-160.3	173.9	-58.1	118.8	-0.2	110.3	E495 A496 A501 N502 E503	E495-R499 WeakPolarHBondContact O-CB 3.33Å; E495-R499 PolarHBondContact O-N 2.79Å; E495-R499 IonicContact OE1-CZ 3.98Å; E495-R499 IonicContact OE1-NH2 2.68Å; E495-R499 PolarHBondContact OE1-NH2 2.78Å; A496-R499 WeakPolarHBondContact O-CB 3.32Å; A496-R499 PolarHBondContact O-N 3.13Å; A496-R499 VanDerWaalsContact O-N 3.16Å; R499-A501 VanDerWaalsContact C-N 3.32Å; R499-A501 PolarHBondContact O-N 3.34Å; R499-N502 PolarHBondContact O-N 2.74Å; R499-N502 VanDerWaalsContact O-N 3.1Å; R499-E503 WeakPolarHBondContact O-CG 3.25Å; R499-E503 PolarHBondContact O-N 2.91Å
500	A	46.7	Very low	46.3	Very low	48 Å²	48	91.5 Å²	91.5	40%	0.397	52%	0.516	S	S	.	.	H	α-helix	trans	-57.7	-41.5	171.8	0	0	0	0	0	112	A496 N502 E503 C504	A496-A500 WeakPolarHBondContact O-CB 3.47Å; A496-A500 PolarHBondContact O-N 3.38Å; A500-N502 PolarHBondContact O-N 2.86Å; A500-E503 PolarHBondContact O-N 3.32Å; A500-C504 WeakPolarHBondContact O-CB 3.43Å; A500-C504 PolarHBondContact O-N 2.64Å; A500-C504 PolarHBondContact O-SG 3.26Å; A500-C504 VanDerWaalsContact O-SG 3.32Å
501	A	48.3	Very low	46	Very low	58 Å²	58	90.6 Å²	90.6	48%	0.479	52%	0.515	S	S	.	.	H	α-helix	trans	-65.9	-35.3	175.4	0	0	0	0	0	113.2	A497 R499 A505	A497-A501 WeakPolarHBondContact O-CB 3.11Å; A497-A501 PolarHBondContact O-N 3.07Å; R499-A501 VanDerWaalsContact C-N 3.32Å; R499-A501 PolarHBondContact O-N 3.34Å; A501-A505 VanDerWaalsContact O-CB 3.26Å; A501-A505 WeakPolarHBondContact O-CB 3.4Å; A501-A505 PolarHBondContact O-N 2.98Å
502	N	42.8	Very low	45.7	Very low	118 Å²	118	95 Å²	95	63%	0.631	52%	0.524	S	S	*	.	H	α-helix	trans	-71.6	-34.3	172.3	-83.7	-41.8	0	0	0	112.3	A498 R499 A500 A505 L506	A498-N502 WeakPolarHBondContact O-CB 3.4Å; A498-N502 PolarHBondContact O-N 3.06Å; A498-N502 PolarHBondContact O-ND2 2.85Å; A498-N502 VanDerWaalsContact O-ND2 3.15Å; R499-N502 PolarHBondContact O-N 2.74Å; R499-N502 VanDerWaalsContact O-N 3.1Å; A500-N502 PolarHBondContact O-N 2.86Å; N502-A505 PolarHBondContact O-N 3.31Å; N502-L506 WeakPolarHBondContact O-CB 3.3Å; N502-L506 PolarHBondContact O-N 3.43Å
503	E	39.2	Very low	45.2	Very low	109 Å²	109	93.6 Å²	93.6	51%	0.509	52%	0.521	S	S	.	.	H	α-helix	trans	-69.1	-47.6	174.7	-74.2	168.8	178.2	0	0	110.8	R499 A500 A505 L506 F507	R499-E503 WeakPolarHBondContact O-CG 3.25Å; R499-E503 PolarHBondContact O-N 2.91Å; A500-E503 PolarHBondContact O-N 3.32Å; E503-A505 VanDerWaalsContact C-N 3.32Å; E503-A505 PolarHBondContact O-N 3.25Å; E503-L506 CarbonylContact O-C 3.58Å; E503-L506 WeakPolarHBondContact O-CA 3.37Å; E503-L506 VanDerWaalsContact O-CB 3.27Å; E503-L506 WeakPolarHBondContact O-CB 3.24Å; E503-L506 PolarHBondContact O-N 2.97Å; E503-F507 WeakPolarHBondContact O-CD2 3.39Å; E503-F507 PolarHBondContact O-N 3.28Å
504	C	40.4	Very low	44.6	Very low	74 Å²	74	90.7 Å²	90.7	50%	0.5	51%	0.509	S	S	.	.	H	α-helix	trans	-56	-43.4	169.8	-69.6	0	0	0	0	111.9	A500 L506 F507 D508	A500-C504 WeakPolarHBondContact O-CB 3.43Å; A500-C504 PolarHBondContact O-N 2.64Å; A500-C504 PolarHBondContact O-SG 3.26Å; A500-C504 VanDerWaalsContact O-SG 3.32Å; C504-L506 PolarHBondContact O-N 2.82Å; C504-F507 CarbonylContact O-C 3.49Å; C504-F507 PolarHBondContact O-N 2.93Å; C504-F507 VanDerWaalsContact O-N 3.15Å; C504-D508 WeakPolarHBondContact O-CB 3.37Å; C504-D508 PolarHBondContact O-N 2.7Å
505	A	41.1	Very low	43.5	Very low	50 Å²	50	88.1 Å²	88.1	41%	0.413	52%	0.517	S	S	.	.	H	α-helix	trans	-66.2	-25.1	174.6	0	0	0	0	0	113.4	A501 N502 E503 A509	A501-A505 VanDerWaalsContact O-CB 3.26Å; A501-A505 WeakPolarHBondContact O-CB 3.4Å; A501-A505 PolarHBondContact O-N 2.98Å; N502-A505 PolarHBondContact O-N 3.31Å; E503-A505 VanDerWaalsContact C-N 3.32Å; E503-A505 PolarHBondContact O-N 3.25Å; A505-A509 WeakPolarHBondContact O-CB 3.3Å; A505-A509 PolarHBondContact O-N 2.66Å; A505-A509 VanDerWaalsContact O-N 3.13Å
506	L	37.2	Very low	42.5	Very low	132 Å²	132	86.2 Å²	86.2	69%	0.691	51%	0.514	S	S	*	.	H	α-helix	trans	-76.1	-36.1	172.1	-152.6	79.3	0	0	0	111.5	N502 E503 C504 A510	N502-L506 WeakPolarHBondContact O-CB 3.3Å; N502-L506 PolarHBondContact O-N 3.43Å; E503-L506 CarbonylContact O-C 3.58Å; E503-L506 WeakPolarHBondContact O-CA 3.37Å; E503-L506 VanDerWaalsContact O-CB 3.27Å; E503-L506 WeakPolarHBondContact O-CB 3.24Å; E503-L506 PolarHBondContact O-N 2.97Å; C504-L506 PolarHBondContact O-N 2.82Å; L506-A510 WeakPolarHBondContact O-CB 3.5Å; L506-A510 PolarHBondContact O-N 2.79Å
507	F	39	Very low	41.4	Very low	151 Å²	151	93.7 Å²	93.7	66%	0.662	54%	0.541	S	S	*	.	H	α-helix	trans	-70	-47	172.4	-73.8	-67.7	0	0	0	111.7	E503 C504 A509 A510 D511	E503-F507 WeakPolarHBondContact O-CD2 3.39Å; E503-F507 PolarHBondContact O-N 3.28Å; C504-F507 CarbonylContact O-C 3.49Å; C504-F507 PolarHBondContact O-N 2.93Å; C504-F507 VanDerWaalsContact O-N 3.15Å; F507-A509 VanDerWaalsContact C-N 3.27Å; F507-A509 PolarHBondContact O-N 2.81Å; F507-A510 CarbonylContact O-C 3.54Å; F507-A510 WeakPolarHBondContact O-CA 3.48Å; F507-A510 WeakPolarHBondContact O-CB 3.43Å; F507-A510 PolarHBondContact O-N 3.17Å; F507-D511 PolarHBondContact O-N 2.88Å
508	D	40.6	Very low	40.3	Very low	116 Å²	116	95.3 Å²	95.3	62%	0.62	54%	0.541	S	S	*	.	H	α-helix	trans	-55.9	-41.9	172.9	-74.1	-23.3	0	0	0	111.3	C504 A510 D511 E512	C504-D508 WeakPolarHBondContact O-CB 3.37Å; C504-D508 PolarHBondContact O-N 2.7Å; D508-A510 VanDerWaalsContact C-N 3.35Å; D508-D511 PolarHBondContact O-N 2.94Å; D508-E512 PolarHBondContact O-N 2.92Å
509	A	38.5	Very low	39.1	Very low	49 Å²	49	95.4 Å²	95.4	41%	0.405	54%	0.538	S	S	.	.	H	α-helix	trans	-71.2	-27.4	175.8	0	0	0	0	0	113.3	A505 F507 L513	A505-A509 WeakPolarHBondContact O-CB 3.3Å; A505-A509 PolarHBondContact O-N 2.66Å; A505-A509 VanDerWaalsContact O-N 3.13Å; F507-A509 VanDerWaalsContact C-N 3.27Å; F507-A509 PolarHBondContact O-N 2.81Å; A509-L513 WeakPolarHBondContact O-CB 3.47Å; A509-L513 PolarHBondContact O-N 3.42Å
510	A	38.6	Very low	38.4	Very low	39 Å²	39	93.8 Å²	93.8	32%	0.322	54%	0.537	S	S	.	.	H	α-helix	trans	-72.7	-39	170.3	0	0	0	0	0	111.1	L506 F507 D508 L513 L514	L506-A510 WeakPolarHBondContact O-CB 3.5Å; L506-A510 PolarHBondContact O-N 2.79Å; F507-A510 CarbonylContact O-C 3.54Å; F507-A510 WeakPolarHBondContact O-CA 3.48Å; F507-A510 WeakPolarHBondContact O-CB 3.43Å; F507-A510 PolarHBondContact O-N 3.17Å; D508-A510 VanDerWaalsContact C-N 3.35Å; A510-L513 CarbonylContact O-C 3.53Å; A510-L513 WeakPolarHBondContact O-CA 3.47Å; A510-L513 VanDerWaalsContact O-CB 3.25Å; A510-L513 WeakPolarHBondContact O-CB 3.42Å; A510-L513 PolarHBondContact O-N 2.95Å; A510-L513 VanDerWaalsContact O-N 3.15Å; A510-L514 VanDerWaalsContact O-CG 3.28Å; A510-L514 WeakPolarHBondContact O-CG 3.34Å; A510-L514 PolarHBondContact O-N 3.21Å
511	D	39.2	Very low	37.9	Very low	112 Å²	112	97 Å²	97	60%	0.599	55%	0.547	S	S	*	.	H	α-helix	trans	-68.1	-37.2	176	-112.1	29.9	0	0	0	112.1	F507 D508 L513 L514 G515	F507-D511 PolarHBondContact O-N 2.88Å; D508-D511 PolarHBondContact O-N 2.94Å; D511-L513 VanDerWaalsContact C-N 3.25Å; D511-L513 PolarHBondContact O-N 2.81Å; D511-L514 PolarHBondContact O-N 3.17Å; D511-G515 PolarHBondContact O-N 3.37Å
512	E	42.2	Very low	37.6	Very low	156 Å²	156	100.9 Å²	100.9	73%	0.729	56%	0.555	S	S	*	*	H	α-helix	trans	-65.7	-29.9	170.7	-162.9	174.7	-140.5	0	0	111.9	D508 T516	D508-E512 PolarHBondContact O-N 2.92Å; E512-T516 PolarHBondContact O-OG1 3.22Å
513	L	39.1	Very low	37.6	Very low	110 Å²	110	100.1 Å²	100.1	58%	0.576	55%	0.551	S	S	*	*	H	α-helix	trans	-74.9	-29.1	171.8	-102.6	160.8	0	0	0	113.8	A509 A510 D511	A509-L513 WeakPolarHBondContact O-CB 3.47Å; A509-L513 PolarHBondContact O-N 3.42Å; A510-L513 CarbonylContact O-C 3.53Å; A510-L513 WeakPolarHBondContact O-CA 3.47Å; A510-L513 VanDerWaalsContact O-CB 3.25Å; A510-L513 WeakPolarHBondContact O-CB 3.42Å; A510-L513 PolarHBondContact O-N 2.95Å; A510-L513 VanDerWaalsContact O-N 3.15Å; D511-L513 VanDerWaalsContact C-N 3.25Å; D511-L513 PolarHBondContact O-N 2.81Å
514	L	38.1	Very low	37.5	Very low	80 Å²	80	96.7 Å²	96.7	42%	0.419	54%	0.536	S	S	.	.	H	α-helix	trans	-85.9	-36.5	177.7	-71.4	166	0	0	0	112.1	A510 D511 T516	A510-L514 VanDerWaalsContact O-CG 3.28Å; A510-L514 WeakPolarHBondContact O-CG 3.34Å; A510-L514 PolarHBondContact O-N 3.21Å; D511-L514 PolarHBondContact O-N 3.17Å; L514-T516 VanDerWaalsContact C-N 3.29Å; L514-T516 PolarHBondContact O-N 3.28Å
515	G	36.1	Very low	37.4	Very low	66 Å²	66	97.5 Å²	97.5	68%	0.68	55%	0.548	S	S	*	.	S	Bend	trans	-76.5	0.3	-173.6	0	0	0	0	0	116.1	D511	D511-G515 PolarHBondContact O-N 3.37Å
516	T	34.9	Very low	37.5	Very low	80 Å²	80	103.3 Å²	103.3	49%	0.491	57%	0.567	S	S	.	*	S	Bend	trans	-107.8	129.9	178.6	52.2	0	0	0	0	112.8	E512 L514 L518	E512-T516 PolarHBondContact O-OG1 3.22Å; L514-T516 VanDerWaalsContact C-N 3.29Å; L514-T516 PolarHBondContact O-N 3.28Å; T516-L518 PolarHBondContact O-N 2.85Å
517	H	29.3	Very low	37.6	Very low	197 Å²	197	99.4 Å²	99.4	91%	0.912	55%	0.551	S	S	*	*			trans	-59.4	102	-172.8	-81.1	-82.2	0	0	0	113.8
518	L	31.3	Very low	37.4	Very low	93 Å²	93	95 Å²	95	49%	0.487	54%	0.541	S	S	.	.	P	Polyproline II helix	trans	-103	118.6	156.2	-84.3	162.2	0	0	0	108.2	T516 T534	T516-L518 PolarHBondContact O-N 2.85Å; L518-T534 HydrophobicContact CD2-CG2 4.39Å
519	P	30.5	Very low	37.7	Very low	53 Å²	53	95.6 Å²	95.6	34%	0.344	55%	0.545	S	S	.	.	P	Polyproline II helix	trans	-76.2	154.5	-175.3	34.5	-38.6	0	0	0	111.7	L521 L524	P519-L521 PolarHBondContact O-N 2.69Å; P519-L524 HydrophobicContact CB-CD1 3.65Å; P519-L524 HydrophobicContact CG-CD1 3.57Å; P519-L524 HydrophobicContact CG-CD2 4.3Å
520	D	33.1	Very low	37.9	Very low	78 Å²	78	99.7 Å²	99.7	42%	0.417	56%	0.556	S	S	.	*	P	Polyproline II helix	trans	-64.4	128	173.3	170.7	37.5	0	0	0	111.3	Q522 L523 L524	D520-Q522 PolarHBondContact O-N 2.92Å; D520-Q522 PolarHBondContact OD1-N 3Å; D520-Q522 VanDerWaalsContact OD1-N 3.08Å; D520-Q522 PolarHBondContact OD2-N 2.97Å; D520-L523 HydrophobicContact CB-CB 4.3Å; D520-L523 HydrophobicContact CB-CD1 4.26Å; D520-L523 PolarHBondContact O-N 2.86Å; D520-L523 PolarHBondContact OD2-N 2.77Å; D520-L524 PolarHBondContact O-N 2.87Å
521	L	36.6	Very low	38	Very low	115 Å²	115	103.6 Å²	103.6	60%	0.602	57%	0.571	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.6	-16.8	-178.1	-110.8	162.2	0	0	0	113.1	P519 L524 L550	P519-L521 PolarHBondContact O-N 2.69Å; L521-L524 HydrophobicContact CD2-CB 4.43Å; L521-L524 HydrophobicContact CD2-CD2 4.18Å; L521-L524 HydrophobicContact CG-CD2 4.45Å; L521-L550 HydrophobicContact CD2-CD2 4.08Å
522	Q	40.7	Very low	37.9	Very low	140 Å²	140	101.5 Å²	101.5	65%	0.654	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.4	-33.4	173.3	-70.5	176	-121.9	0	0	112.1	D520 A525	D520-Q522 PolarHBondContact O-N 2.92Å; D520-Q522 PolarHBondContact OD1-N 3Å; D520-Q522 VanDerWaalsContact OD1-N 3.08Å; D520-Q522 PolarHBondContact OD2-N 2.97Å; Q522-A525 WeakPolarHBondContact O-CB 3.44Å
523	L	43.7	Very low	37.8	Very low	103 Å²	103	97.1 Å²	97.1	54%	0.539	54%	0.541	S	S	.	.	G	3₁₀ helix	trans	-67.6	-32	165.3	-89.1	155.5	0	0	0	113.5	D520 A525 Q526	D520-L523 HydrophobicContact CB-CB 4.3Å; D520-L523 HydrophobicContact CB-CD1 4.26Å; D520-L523 PolarHBondContact O-N 2.86Å; D520-L523 PolarHBondContact OD2-N 2.77Å; L523-A525 PolarHBondContact O-N 3.49Å; L523-A525 VanDerWaalsContact O-N 3.12Å; L523-Q526 PolarHBondContact O-N 2.8Å
524	L	36.7	Very low	37.9	Very low	36 Å²	36	93.4 Å²	93.4	19%	0.188	52%	0.523	C	S	.	.	G	3₁₀ helix	trans	-62.1	-15.9	175.9	-113.7	63.2	0	0	0	114.6	P519 D520 L521 Q526 S527 L550	P519-L524 HydrophobicContact CB-CD1 3.65Å; P519-L524 HydrophobicContact CG-CD1 3.57Å; P519-L524 HydrophobicContact CG-CD2 4.3Å; D520-L524 PolarHBondContact O-N 2.87Å; L521-L524 HydrophobicContact CD2-CB 4.43Å; L521-L524 HydrophobicContact CD2-CD2 4.18Å; L521-L524 HydrophobicContact CG-CD2 4.45Å; L524-Q526 PolarHBondContact O-N 3.01Å; L524-Q526 VanDerWaalsContact O-N 3.1Å; L524-S527 PolarHBondContact O-N 3Å; L524-S527 PolarHBondContact O-OG 2.89Å; L524-L550 HydrophobicContact CD2-CD1 3.73Å; L524-L550 HydrophobicContact CD2-CD2 4.09Å
525	A	39.5	Very low	38.2	Very low	92 Å²	92	94.6 Å²	94.6	76%	0.76	53%	0.525	S	S	*	.	G	3₁₀ helix	trans	-61.2	-16.3	174	0	0	0	0	0	113.4	Q522 L523	Q522-A525 WeakPolarHBondContact O-CB 3.44Å; L523-A525 PolarHBondContact O-N 3.49Å; L523-A525 VanDerWaalsContact O-N 3.12Å
526	Q	43.2	Very low	38.4	Very low	172 Å²	172	95.2 Å²	95.2	80%	0.804	51%	0.509	S	S	*	.	G	3₁₀ helix	trans	-97.8	-4.3	-179.7	-56	-172.3	8	0	0	114.1	L523 L524	L523-Q526 PolarHBondContact O-N 2.8Å; L524-Q526 PolarHBondContact O-N 3.01Å; L524-Q526 VanDerWaalsContact O-N 3.1Å
527	S	37.8	Very low	38.5	Very low	50 Å²	50	94.4 Å²	94.4	35%	0.35	50%	0.504	S	S	.	.			trans	-126.4	60.6	-169.3	52.6	0	0	0	0	114.6	L524	L524-S527 PolarHBondContact O-N 3Å; L524-S527 PolarHBondContact O-OG 2.89Å
528	A	36.1	Very low	39.6	Very low	57 Å²	57	87.1 Å²	87.1	47%	0.471	47%	0.472	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.6	149.8	176.2	0	0	0	0	0	114.2	P552	A528-P552 HydrophobicContact CB-CG 4.08Å
529	N	46.9	Very low	39.8	Very low	130 Å²	130	88.9 Å²	88.9	70%	0.695	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.2	26.4	173	-59.6	-32.1	0	0	0	117.6
530	Q	41.9	Very low	40.4	Very low	135 Å²	135	92.3 Å²	92.3	63%	0.631	51%	0.505	S	S	*	.			trans	-94.1	139.5	165.4	-64.7	-159	9.2	0	0	112.8
531	L	40.4	Very low	40.2	Very low	121 Å²	121	91.4 Å²	91.4	63%	0.634	51%	0.514	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.6	125.4	167.2	-99.3	161.5	0	0	0	108.4	Q547	L531-Q547 HydrophobicContact CD2-CB 4.19Å
532	Q	37.3	Very low	40.5	Very low	68 Å²	68	93 Å²	93	32%	0.318	51%	0.512	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	139.1	178.7	-163.7	158.7	36.2	0	0	111.5	Q547 V548	Q532-Q547 CarbonylContact O-C 3.44Å; Q532-Q547 WeakPolarHBondContact O-CA 3.45Å; Q532-V548 PolarHBondContact N-O 3.15Å; Q532-V548 PolarHBondContact O-N 3.39Å
533	T	40.9	Very low	40.2	Very low	63 Å²	63	91.5 Å²	91.5	39%	0.387	51%	0.508	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	128.4	174.3	-51.7	0	0	0	0	108.8	Q545	T533-Q545 HydrophobicContact CG2-CG 3.44Å; T533-Q545 VanDerWaalsContact CG2-CG 3.44Å
534	T	40.7	Very low	40.5	Very low	33 Å²	33	91.4 Å²	91.4	20%	0.202	50%	0.504	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	150.6	-178.9	-54	0	0	0	0	109.4	L518 F536 Q546	L518-T534 HydrophobicContact CD2-CG2 4.39Å; T534-F536 HydrophobicContact CG2-CE1 3.87Å; T534-F536 HydrophobicContact CG2-CE2 4.08Å; T534-F536 HydrophobicContact CG2-CZ 3.62Å; T534-F536 VanDerWaalsContact O-CE2 3.27Å; T534-F536 WeakPolarHBondContact O-CE2 3.19Å; T534-Q546 PolarHBondContact N-O 2.86Å; T534-Q546 PolarHBondContact O-N 3.19Å
535	F	44.3	Very low	41.4	Very low	104 Å²	104	96 Å²	96	46%	0.456	53%	0.525	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	147.4	172.8	-64.3	-86.3	0	0	0	111.1	L543 H544 Q545	F535-L543 HydrophobicContact CB-CD1 3.89Å; F535-L543 HydrophobicContact CB-CG 4.2Å; F535-L543 HydrophobicContact CD1-CD2 3.84Å; F535-L543 HydrophobicContact CD1-CG 4Å; F535-L543 HydrophobicContact CE1-CD2 4.32Å; F535-L543 HydrophobicContact CG-CD2 4.36Å; F535-L543 HydrophobicContact CG-CG 4.46Å; F535-H544 CarbonylContact C-O 3.56Å; F535-H544 WeakPolarHBondContact CA-O 3.27Å; F535-Q545 HydrophobicContact CD1-CB 3.82Å; F535-Q545 HydrophobicContact CD1-CG 3.99Å; F535-Q545 HydrophobicContact CE1-CB 3.72Å; F535-Q545 HydrophobicContact CE1-CG 3.62Å; F535-Q545 HydrophobicContact CZ-CG 4.1Å; F535-Q545 VanDerWaalsContact CZ-NE2 3.26Å
536	F	39.9	Very low	41.8	Very low	80 Å²	80	96.3 Å²	96.3	35%	0.351	51%	0.511	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	144.1	-175.1	-47.6	-94.1	0	0	0	109.1	T534 L543 H544 Q546 V548	T534-F536 HydrophobicContact CG2-CE1 3.87Å; T534-F536 HydrophobicContact CG2-CE2 4.08Å; T534-F536 HydrophobicContact CG2-CZ 3.62Å; T534-F536 VanDerWaalsContact O-CE2 3.27Å; T534-F536 WeakPolarHBondContact O-CE2 3.19Å; F536-L543 CarbonylContact O-C 3.46Å; F536-L543 WeakPolarHBondContact O-CA 3.47Å; F536-H544 PolarHBondContact N-O 3.24Å; F536-H544 PolarHBondContact O-N 3.31Å; F536-Q546 HydrophobicContact CD2-CB 4.27Å; F536-Q546 HydrophobicContact CE2-CB 3.58Å; F536-Q546 HydrophobicContact CZ-CB 4.41Å; F536-V548 HydrophobicContact CZ-CG2 4.23Å
537	V	38.1	Very low	42	Very low	63 Å²	63	94.3 Å²	94.3	38%	0.382	50%	0.501	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	123.8	176.9	-177.9	0	0	0	0	109.3	L543	V537-L543 HydrophobicContact CG2-CD1 3.83Å
538	D	51.5	Low	42.4	Very low	43 Å²	43	93 Å²	93	23%	0.23	49%	0.491	C	S	.	.			trans	-74.1	172.1	177.6	80.8	4.2	0	0	0	112.7	M540 G541 R542 H544	D538-M540 PolarHBondContact O-N 3.26Å; D538-M540 VanDerWaalsContact OD1-C 3.29Å; D538-M540 VanDerWaalsContact OD1-CA 3.29Å; D538-M540 WeakPolarHBondContact OD1-CA 3.24Å; D538-M540 WeakPolarHBondContact OD1-CB 3.39Å; D538-M540 PolarHBondContact OD1-N 2.97Å; D538-G541 PolarHBondContact O-N 3.25Å; D538-G541 PolarHBondContact OD1-N 2.78Å; D538-G541 VanDerWaalsContact OD1-N 3.13Å; D538-R542 PolarHBondContact N-O 3.25Å; D538-R542 WeakPolarHBondContact OD1-CB 3.44Å; D538-R542 PolarHBondContact OD1-N 2.85Å; D538-H544 IonicContact OD2-CE1 3.09Å; D538-H544 PolarHBondContact OD2-CE1 3.27Å
539	S	35.4	Very low	42.6	Very low	131 Å²	131	95 Å²	95	92%	0.916	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.5	5.9	179.2	58.5	0	0	0	0	114.9
540	M	43.5	Very low	42.1	Very low	125 Å²	125	90.9 Å²	90.9	62%	0.616	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.2	10.5	170	-59	-176.7	-70.3	0	0	112.2	D538 R542	D538-M540 PolarHBondContact O-N 3.26Å; D538-M540 VanDerWaalsContact OD1-C 3.29Å; D538-M540 VanDerWaalsContact OD1-CA 3.29Å; D538-M540 WeakPolarHBondContact OD1-CA 3.24Å; D538-M540 WeakPolarHBondContact OD1-CB 3.39Å; D538-M540 PolarHBondContact OD1-N 2.97Å; M540-R542 HydrophobicContact CB-CG 4.34Å
541	G	29.5	Very low	42	Very low	59 Å²	59	87.8 Å²	87.8	61%	0.608	46%	0.462	S	S	*	.	S	Bend	trans	81.5	14.9	-179.9	0	0	0	0	0	115	D538	D538-G541 PolarHBondContact O-N 3.25Å; D538-G541 PolarHBondContact OD1-N 2.78Å; D538-G541 VanDerWaalsContact OD1-N 3.13Å
542	R	41.8	Very low	41.8	Very low	149 Å²	149	86.8 Å²	86.8	56%	0.562	46%	0.462	S	S	*	.			trans	-94.8	123	-174.9	-51.6	180	178.8	-162.3	-0.8	112.7	D538 M540 H544	D538-R542 PolarHBondContact N-O 3.25Å; D538-R542 WeakPolarHBondContact OD1-CB 3.44Å; D538-R542 PolarHBondContact OD1-N 2.85Å; M540-R542 HydrophobicContact CB-CG 4.34Å; R542-H544 PolarHBondContact O-ND1 3.48Å
543	L	35.1	Very low	41.7	Very low	107 Å²	107	90.5 Å²	90.5	56%	0.56	48%	0.484	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.5	128.4	173.7	-158.4	73.3	0	0	0	111.5	F535 F536 V537	F535-L543 HydrophobicContact CB-CD1 3.89Å; F535-L543 HydrophobicContact CB-CG 4.2Å; F535-L543 HydrophobicContact CD1-CD2 3.84Å; F535-L543 HydrophobicContact CD1-CG 4Å; F535-L543 HydrophobicContact CE1-CD2 4.32Å; F535-L543 HydrophobicContact CG-CD2 4.36Å; F535-L543 HydrophobicContact CG-CG 4.46Å; F536-L543 CarbonylContact O-C 3.46Å; F536-L543 WeakPolarHBondContact O-CA 3.47Å; V537-L543 HydrophobicContact CG2-CD1 3.83Å
544	H	49.1	Very low	41.3	Very low	102 Å²	102	91.3 Å²	91.3	47%	0.472	51%	0.505	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	147.2	175	-73.7	76.8	0	0	0	109.6	F535 F536 D538 R542	F535-H544 CarbonylContact C-O 3.56Å; F535-H544 WeakPolarHBondContact CA-O 3.27Å; F536-H544 PolarHBondContact N-O 3.24Å; F536-H544 PolarHBondContact O-N 3.31Å; D538-H544 IonicContact OD2-CE1 3.09Å; D538-H544 PolarHBondContact OD2-CE1 3.27Å; R542-H544 PolarHBondContact O-ND1 3.48Å
545	Q	57.4	Low	40.8	Very low	132 Å²	132	92.6 Å²	92.6	62%	0.617	52%	0.519	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116	130.2	-179.4	-171.1	-177.9	50.1	0	0	110.4	T533 F535	T533-Q545 HydrophobicContact CG2-CG 3.44Å; T533-Q545 VanDerWaalsContact CG2-CG 3.44Å; F535-Q545 HydrophobicContact CD1-CB 3.82Å; F535-Q545 HydrophobicContact CD1-CG 3.99Å; F535-Q545 HydrophobicContact CE1-CB 3.72Å; F535-Q545 HydrophobicContact CE1-CG 3.62Å; F535-Q545 HydrophobicContact CZ-CG 4.1Å; F535-Q545 VanDerWaalsContact CZ-NE2 3.26Å
546	Q	47.8	Very low	40.1	Very low	99 Å²	99	91 Å²	91	46%	0.463	52%	0.52	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	153.2	178.6	-147	174.3	8.7	0	0	112	T534 F536	T534-Q546 PolarHBondContact N-O 2.86Å; T534-Q546 PolarHBondContact O-N 3.19Å; F536-Q546 HydrophobicContact CD2-CB 4.27Å; F536-Q546 HydrophobicContact CE2-CB 3.58Å; F536-Q546 HydrophobicContact CZ-CB 4.41Å
547	Q	46.2	Very low	39.6	Very low	129 Å²	129	96.4 Å²	96.4	60%	0.603	55%	0.546	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.1	138.2	175.1	-72.3	-178.2	-25.7	0	0	111.5	L531 Q532	L531-Q547 HydrophobicContact CD2-CB 4.19Å; Q532-Q547 CarbonylContact O-C 3.44Å; Q532-Q547 WeakPolarHBondContact O-CA 3.45Å
548	V	46	Very low	39.3	Very low	22 Å²	22	98.1 Å²	98.1	13%	0.133	55%	0.553	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-127.3	149.6	-179.5	-171.6	0	0	0	0	109.8	Q532 F536 L558	Q532-V548 PolarHBondContact N-O 3.15Å; Q532-V548 PolarHBondContact O-N 3.39Å; F536-V548 HydrophobicContact CZ-CG2 4.23Å; V548-L558 HydrophobicContact CG1-CD1 4.23Å
549	L	40.7	Very low	38.2	Very low	99 Å²	99	99.9 Å²	99.9	52%	0.518	58%	0.581	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-121.5	122.2	175.4	178.4	70.3	0	0	0	108.8
550	L	37.8	Very low	37.9	Very low	45 Å²	45	99.9 Å²	99.9	24%	0.236	57%	0.57	C	S	.	*			trans	-89.7	144.2	179.2	-66.1	116.2	0	0	0	111.8	L521 L524	L521-L550 HydrophobicContact CD2-CD2 4.08Å; L524-L550 HydrophobicContact CD2-CD1 3.73Å; L524-L550 HydrophobicContact CD2-CD2 4.09Å
551	T	37.8	Very low	37.2	Very low	70 Å²	70	102.8 Å²	102.8	43%	0.429	58%	0.582	S	S	.	*			trans	-116	152.6	178.1	81.1	0	0	0	0	111.6	N553 A555	T551-N553 PolarHBondContact O-N 3.36Å; T551-A555 PolarHBondContact OG1-O 3.44Å
552	P	36.6	Very low	37.1	Very low	100 Å²	100	105.8 Å²	105.8	65%	0.649	59%	0.589	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.5	-10.4	-167.1	-22.9	34.9	0	0	0	116.6	A528	A528-P552 HydrophobicContact CB-CG 4.08Å
553	N	36.3	Very low	36.4	Very low	146 Å²	146	106.2 Å²	106.2	78%	0.781	60%	0.603	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.2	16.1	-168.7	-67.7	6.7	0	0	0	113.6	T551 A555	T551-N553 PolarHBondContact O-N 3.36Å; N553-A555 PolarHBondContact O-N 3.08Å
554	G	32.2	Very low	36.1	Very low	79 Å²	79	104.9 Å²	104.9	81%	0.814	61%	0.614	S	S	*	*	S	Bend	trans	68.5	-10.6	-175.9	0	0	0	0	0	115.4	C556	G554-C556 PolarHBondContact O-N 3.34Å
555	A	29.5	Very low	35.2	Very low	60 Å²	60	107 Å²	107	50%	0.496	63%	0.628	S	S	.	*			trans	-89.6	98	178.8	0	0	0	0	0	111.5	T551 N553 Q557	T551-A555 PolarHBondContact OG1-O 3.44Å; N553-A555 PolarHBondContact O-N 3.08Å; A555-Q557 PolarHBondContact O-N 3.31Å
556	C	30.3	Very low	34	Very low	71 Å²	71	103.7 Å²	103.7	48%	0.48	62%	0.62	S	S	.	*			trans	-74.6	103.2	167.1	-84.5	0	0	0	0	110.8	G554 L558	G554-C556 PolarHBondContact O-N 3.34Å; C556-L558 VanDerWaalsContact C-N 3.29Å; C556-L558 PolarHBondContact O-N 3.41Å
557	Q	28.5	Very low	33.3	Very low	193 Å²	193	105.4 Å²	105.4	90%	0.902	63%	0.632	S	S	*	*			trans	-73.5	80.6	166.3	-75.1	-169.5	-18.8	0	0	110.9	A555	A555-Q557 PolarHBondContact O-N 3.31Å
558	L	31.8	Very low	32.6	Very low	99 Å²	99	108 Å²	108	52%	0.518	64%	0.638	S	S	.	*			trans	-94.4	96.2	164.8	-94.3	166	0	0	0	110	V548 C556 L560	V548-L558 HydrophobicContact CG1-CD1 4.23Å; C556-L558 VanDerWaalsContact C-N 3.29Å; C556-L558 PolarHBondContact O-N 3.41Å; L558-L560 VanDerWaalsContact C-N 3.3Å; L558-L560 PolarHBondContact O-N 3.42Å
559	G	28.1	Very low	31.9	Very low	81 Å²	81	111.9 Å²	111.9	84%	0.835	66%	0.655	S	S	*	*			trans	-76.2	73.1	177.8	0	0	0	0	0	113
560	L	30.7	Very low	31.6	Very low	131 Å²	131	113.5 Å²	113.5	69%	0.686	66%	0.663	S	S	*	*			trans	-121.9	148.8	168	-74.9	174.7	0	0	0	111	L558	L558-L560 VanDerWaalsContact C-N 3.3Å; L558-L560 PolarHBondContact O-N 3.42Å
561	Q	29	Very low	31.6	Very low	186 Å²	186	116.2 Å²	116.2	87%	0.869	67%	0.674	S	S	*	*			trans	-86.4	128.7	-168.6	-67.1	173.3	-21.5	0	0	111.6	N563	Q561-N563 PolarHBondContact O-N 3.09Å
562	T	26	Very low	31.7	Very low	122 Å²	122	116.3 Å²	116.3	75%	0.748	67%	0.672	S	S	*	*	S	Bend	trans	25	94.4	150.9	55.4	0	0	0	0	117.1
563	N	28.5	Very low	31.6	Very low	158 Å²	158	113.2 Å²	113.2	85%	0.845	66%	0.658	S	S	*	*				175.5	140.1	125.9	-86.6	-19.9	0	0	0	112.4	Q561 L565	Q561-N563 PolarHBondContact O-N 3.09Å; N563-L565 PolarHBondContact O-N 2.91Å
564	G	28.4	Very low	31.8	Very low	78 Å²	78	113.1 Å²	113.1	80%	0.804	65%	0.647	S	S	*	*			trans	82.7	-10.4	144.3	0	0	0	0	0	121	S566	G564-S566 PolarHBondContact O-N 3.02Å; G564-S566 VanDerWaalsContact O-N 3.11Å
565	L	30.4	Very low	32.2	Very low	146 Å²	146	110 Å²	110	76%	0.764	61%	0.613	S	S	*	*			trans	-81.6	89.7	174.9	-77.1	172.3	0	0	0	111.6	N563	N563-L565 PolarHBondContact O-N 2.91Å
566	S	32.4	Very low	32.6	Very low	64 Å²	64	111.7 Å²	111.7	45%	0.448	61%	0.613	S	S	.	*			trans	-87.8	161.8	172	64.8	0	0	0	0	111.7	G564 Y568 Q569	G564-S566 PolarHBondContact O-N 3.02Å; G564-S566 VanDerWaalsContact O-N 3.11Å; S566-Y568 PolarHBondContact O-N 3.45Å; S566-Y568 WeakPolarHBondContact OG-CD2 3.43Å; S566-Q569 PolarHBondContact O-N 2.59Å
567	N	32.4	Very low	33	Very low	134 Å²	134	114.6 Å²	114.6	72%	0.717	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55	-19	179.5	-72.9	-19.7	0	0	0	113.9	Q569 L570 H571	N567-Q569 PolarHBondContact O-N 3.34Å; N567-L570 PolarHBondContact O-N 3.17Å; N567-H571 PolarHBondContact O-N 3.12Å
568	Y	30.6	Very low	33.6	Very low	184 Å²	184	110.7 Å²	110.7	72%	0.722	60%	0.596	S	S	*	*	H	α-helix	trans	-58.8	-35.2	179.6	-69.8	-94.5	0	0	0	114.1	S566 H571 L572	S566-Y568 PolarHBondContact O-N 3.45Å; S566-Y568 WeakPolarHBondContact OG-CD2 3.43Å; Y568-H571 CarbonylContact O-C 3.59Å; Y568-H571 WeakPolarHBondContact O-CB 3.17Å; Y568-H571 PolarHBondContact O-N 2.69Å; Y568-L572 WeakPolarHBondContact O-CB 3.14Å; Y568-L572 PolarHBondContact O-N 2.77Å
569	Q	32.3	Very low	33.5	Very low	104 Å²	104	109.4 Å²	109.4	49%	0.486	61%	0.606	S	S	.	*	H	α-helix	trans	-71	-38.7	179.1	-86.2	-164	-14.8	0	0	112.9	S566 N567 H571 L572 G573	S566-Q569 PolarHBondContact O-N 2.59Å; N567-Q569 PolarHBondContact O-N 3.34Å; Q569-H571 VanDerWaalsContact C-N 3.3Å; Q569-L572 PolarHBondContact O-N 3.4Å; Q569-G573 PolarHBondContact O-N 3.02Å; Q569-G573 VanDerWaalsContact O-N 3.13Å
570	L	33.2	Very low	33.7	Very low	133 Å²	133	108.4 Å²	108.4	70%	0.696	58%	0.577	S	S	*	*	H	α-helix	trans	-69.3	-30.7	172.1	-73.1	171	0	0	0	111.6	N567 R574	N567-L570 PolarHBondContact O-N 3.17Å; L570-R574 PolarHBondContact O-N 3.32Å
571	H	39.8	Very low	33.6	Very low	101 Å²	101	108 Å²	108	47%	0.468	59%	0.585	S	S	.	*	H	α-helix	trans	-66.8	-42.5	169.4	-113.8	84.6	0	0	0	112.2	N567 Y568 Q569 G573 R574 S575	N567-H571 PolarHBondContact O-N 3.12Å; Y568-H571 CarbonylContact O-C 3.59Å; Y568-H571 WeakPolarHBondContact O-CB 3.17Å; Y568-H571 PolarHBondContact O-N 2.69Å; Q569-H571 VanDerWaalsContact C-N 3.3Å; H571-G573 PolarHBondContact O-N 3.32Å; H571-R574 PolarHBondContact O-N 3.12Å; H571-R574 VanDerWaalsContact O-N 3.15Å; H571-S575 WeakPolarHBondContact O-CB 3.42Å; H571-S575 PolarHBondContact O-N 2.86Å; H571-S575 PolarHBondContact O-OG 3.17Å
572	L	38.7	Very low	33.7	Very low	73 Å²	73	102.2 Å²	102.2	38%	0.382	56%	0.56	S	S	.	*	H	α-helix	trans	-59.1	-49.9	178.4	-146.1	82.6	0	0	0	110.7	Y568 Q569 R574 S575 L576 I582	Y568-L572 WeakPolarHBondContact O-CB 3.14Å; Y568-L572 PolarHBondContact O-N 2.77Å; Q569-L572 PolarHBondContact O-N 3.4Å; L572-R574 PolarHBondContact O-N 3.11Å; L572-S575 PolarHBondContact O-N 3.4Å; L572-L576 HydrophobicContact CG-CD1 4.43Å; L572-L576 WeakPolarHBondContact O-CB 3.25Å; L572-L576 VanDerWaalsContact O-CG 3.31Å; L572-L576 WeakPolarHBondContact O-CG 3.42Å; L572-L576 PolarHBondContact O-N 3.16Å; L572-I582 HydrophobicContact CD1-CD1 3.65Å; L572-I582 HydrophobicContact CD1-CG2 4.25Å; L572-I582 HydrophobicContact CG-CD1 3.91Å
573	G	35.1	Very low	33.7	Very low	35 Å²	35	101.8 Å²	101.8	36%	0.361	56%	0.557	S	S	.	*	H	α-helix	trans	-68.4	-15.2	177.9	0	0	0	0	0	115.2	Q569 H571 R577	Q569-G573 PolarHBondContact O-N 3.02Å; Q569-G573 VanDerWaalsContact O-N 3.13Å; H571-G573 PolarHBondContact O-N 3.32Å; G573-R577 WeakPolarHBondContact O-CD 3.34Å; G573-R577 WeakPolarHBondContact O-CG 3.34Å; G573-R577 PolarHBondContact O-NE 2.7Å
574	R	39.3	Very low	33.6	Very low	143 Å²	143	101.1 Å²	101.1	54%	0.54	55%	0.55	S	S	.	*	H	α-helix	trans	-88.8	-47.8	168.5	-85.7	-174	162.8	-167.7	-7.8	111.8	L570 H571 L572 L576 R577 Q578	L570-R574 PolarHBondContact O-N 3.32Å; H571-R574 PolarHBondContact O-N 3.12Å; H571-R574 VanDerWaalsContact O-N 3.15Å; L572-R574 PolarHBondContact O-N 3.11Å; R574-L576 VanDerWaalsContact C-N 3.35Å; R574-L576 PolarHBondContact O-N 2.9Å; R574-R577 CarbonylContact O-C 3.51Å; R574-R577 WeakPolarHBondContact O-CA 3.44Å; R574-R577 PolarHBondContact O-N 3.36Å; R574-R577 VanDerWaalsContact O-N 3.08Å; R574-Q578 VanDerWaalsContact O-CG 3.3Å; R574-Q578 WeakPolarHBondContact O-CG 3.48Å; R574-Q578 PolarHBondContact O-N 3.33Å; R574-Q578 VanDerWaalsContact O-N 3.08Å
575	S	40.5	Very low	33.4	Very low	15 Å²	15	103.1 Å²	103.1	11%	0.105	55%	0.547	C	S	.	.	H	α-helix	trans	-60.3	-40.8	179.7	-74.3	0	0	0	0	112.6	H571 L572 R577 Q578 G579 R580	H571-S575 WeakPolarHBondContact O-CB 3.42Å; H571-S575 PolarHBondContact O-N 2.86Å; H571-S575 PolarHBondContact O-OG 3.17Å; L572-S575 PolarHBondContact O-N 3.4Å; S575-R577 VanDerWaalsContact C-N 3.33Å; S575-R577 PolarHBondContact O-N 2.88Å; S575-Q578 CarbonylContact O-C 3.46Å; S575-Q578 WeakPolarHBondContact O-CA 3.4Å; S575-Q578 PolarHBondContact O-N 3.44Å; S575-G579 PolarHBondContact O-N 3.14Å; S575-R580 WeakPolarHBondContact O-CB 3.31Å; S575-R580 PolarHBondContact O-N 3.33Å; S575-R580 VanDerWaalsContact O-N 3.12Å; S575-R580 WeakPolarHBondContact OG-CD 3.29Å; S575-R580 PolarHBondContact OG-NH1 3.1Å
576	L	38.7	Very low	33.2	Very low	95 Å²	95	101.9 Å²	101.9	50%	0.497	55%	0.545	S	S	.	.	G	3₁₀ helix	trans	-62.4	-37.9	173.9	-69.5	169.1	0	0	0	112.2	L572 R574 Q578 I582	L572-L576 HydrophobicContact CG-CD1 4.43Å; L572-L576 WeakPolarHBondContact O-CB 3.25Å; L572-L576 VanDerWaalsContact O-CG 3.31Å; L572-L576 WeakPolarHBondContact O-CG 3.42Å; L572-L576 PolarHBondContact O-N 3.16Å; R574-L576 VanDerWaalsContact C-N 3.35Å; R574-L576 PolarHBondContact O-N 2.9Å; L576-Q578 PolarHBondContact O-N 2.93Å; L576-I582 HydrophobicContact CD2-CD1 3.88Å; L576-I582 HydrophobicContact CD2-CG1 4.27Å; L576-I582 HydrophobicContact CG-CD1 3.87Å
577	R	38.7	Very low	32.9	Very low	132 Å²	132	104.8 Å²	104.8	50%	0.498	56%	0.56	S	S	.	*	G	3₁₀ helix	trans	-75.4	-5.3	173.4	-65.8	178.3	-167.8	-88.3	-9.7	113.9	G573 R574 S575	G573-R577 WeakPolarHBondContact O-CD 3.34Å; G573-R577 WeakPolarHBondContact O-CG 3.34Å; G573-R577 PolarHBondContact O-NE 2.7Å; R574-R577 CarbonylContact O-C 3.51Å; R574-R577 WeakPolarHBondContact O-CA 3.44Å; R574-R577 PolarHBondContact O-N 3.36Å; R574-R577 VanDerWaalsContact O-N 3.08Å; S575-R577 VanDerWaalsContact C-N 3.33Å; S575-R577 PolarHBondContact O-N 2.88Å
578	Q	40.7	Very low	32.6	Very low	111 Å²	111	109 Å²	109	52%	0.519	57%	0.566	S	S	.	*	G	3₁₀ helix	trans	-109.1	14.9	179.3	-72.7	175.3	-30.5	0	0	112.1	R574 S575 L576 R580	R574-Q578 VanDerWaalsContact O-CG 3.3Å; R574-Q578 WeakPolarHBondContact O-CG 3.48Å; R574-Q578 PolarHBondContact O-N 3.33Å; R574-Q578 VanDerWaalsContact O-N 3.08Å; S575-Q578 CarbonylContact O-C 3.46Å; S575-Q578 WeakPolarHBondContact O-CA 3.4Å; S575-Q578 PolarHBondContact O-N 3.44Å; L576-Q578 PolarHBondContact O-N 2.93Å; Q578-R580 HydrophobicContact CB-CG 4.29Å; Q578-R580 PolarHBondContact O-N 3.44Å
579	G	29.9	Very low	32.5	Very low	71 Å²	71	105.4 Å²	105.4	73%	0.732	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	64.9	16.8	180	0	0	0	0	0	114.4	S575 S581	S575-G579 PolarHBondContact O-N 3.14Å; G579-S581 PolarHBondContact O-N 2.85Å
580	R	31.6	Very low	32.5	Very low	60 Å²	60	112.2 Å²	112.2	23%	0.226	59%	0.586	C	S	.	*			trans	-82.2	113.6	-178.5	-67.7	174.8	167.4	175.7	-10.4	110.3	S575 Q578 I582	S575-R580 WeakPolarHBondContact O-CB 3.31Å; S575-R580 PolarHBondContact O-N 3.33Å; S575-R580 VanDerWaalsContact O-N 3.12Å; S575-R580 WeakPolarHBondContact OG-CD 3.29Å; S575-R580 PolarHBondContact OG-NH1 3.1Å; Q578-R580 HydrophobicContact CB-CG 4.29Å; Q578-R580 PolarHBondContact O-N 3.44Å; R580-I582 WeakPolarHBondContact O-CG1 3.32Å; R580-I582 PolarHBondContact O-N 3.31Å
581	S	29.1	Very low	32.4	Very low	123 Å²	123	109.4 Å²	109.4	86%	0.86	59%	0.589	S	S	*	*			trans	-57.5	122.3	169.6	-56.1	0	0	0	0	111.3	G579	G579-S581 PolarHBondContact O-N 2.85Å
582	I	30.6	Very low	31.9	Very low	65 Å²	65	113 Å²	113	33%	0.333	61%	0.61	S	S	.	*			trans	-107	103.8	-178.9	-51.2	-171.6	0	0	0	110.2	L572 L576 R580 M584	L572-I582 HydrophobicContact CD1-CD1 3.65Å; L572-I582 HydrophobicContact CD1-CG2 4.25Å; L572-I582 HydrophobicContact CG-CD1 3.91Å; L576-I582 HydrophobicContact CD2-CD1 3.88Å; L576-I582 HydrophobicContact CD2-CG1 4.27Å; L576-I582 HydrophobicContact CG-CD1 3.87Å; R580-I582 WeakPolarHBondContact O-CG1 3.32Å; R580-I582 PolarHBondContact O-N 3.31Å; I582-M584 HydrophobicContact CG2-CG 4.02Å; I582-M584 PolarHBondContact O-N 2.87Å
583	V	27.7	Very low	31.4	Very low	113 Å²	113	115.2 Å²	115.2	69%	0.685	63%	0.631	S	S	*	*			trans	-77.7	111.2	169.5	-179.2	0	0	0	0	109.1
584	M	25.4	Very low	31.1	Very low	144 Å²	144	117.3 Å²	117.3	71%	0.709	65%	0.653	S	S	*	*			trans	-96.8	105.2	176.9	-73.3	-166.1	-74.6	0	0	112	I582 V586	I582-M584 HydrophobicContact CG2-CG 4.02Å; I582-M584 PolarHBondContact O-N 2.87Å; M584-V586 PolarHBondContact O-N 3.11Å
585	T	25.4	Very low	30.4	Very low	119 Å²	119	121.9 Å²	121.9	73%	0.73	67%	0.67	S	S	*	*			trans	-74.5	104.1	174.8	-54.2	0	0	0	0	111.6	V587	T585-V587 HydrophobicContact CG2-CG2 4.15Å; T585-V587 PolarHBondContact O-N 3.45Å
586	V	24.5	Very low	29.7	Very low	120 Å²	120	127.2 Å²	127.2	73%	0.727	71%	0.705	S	S	*	*			trans	-82.7	93.1	177.6	-177.2	0	0	0	0	111.1	M584 R588	M584-V586 PolarHBondContact O-N 3.11Å; V586-R588 PolarHBondContact O-N 3.48Å
587	V	26.6	Very low	29.2	Very low	126 Å²	126	129.5 Å²	129.5	76%	0.764	72%	0.722	S	S	*	*			trans	-77	114.5	176.9	-177.5	0	0	0	0	110.9	T585	T585-V587 HydrophobicContact CG2-CG2 4.15Å; T585-V587 PolarHBondContact O-N 3.45Å
588	R	27.2	Very low	28.5	Very low	222 Å²	222	127.2 Å²	127.2	84%	0.838	73%	0.731	S	S	*	*			trans	-86.5	133.3	173.6	-63.3	-172.3	-176.4	104.9	-3.4	111.1	V586	V586-R588 PolarHBondContact O-N 3.48Å
589	P	27.5	Very low	27.7	Very low	109 Å²	109	130.2 Å²	130.2	71%	0.708	75%	0.745	S	S	*	*			trans	-88.1	139.6	-178.1	32.9	-34.3	0	0	0	113.9
590	R	32.9	Very low	27.7	Very low	247 Å²	247	136.5 Å²	136.5	93%	0.932	75%	0.753	S	S	*	*			trans	74.8	141.3	175.6	-48.1	165.8	-178.4	144.5	1.3	114.5
591	G	30.7	Very low	27.3	Very low	73 Å²	73	141.3 Å²	141.3	75%	0.753	78%	0.782	S	S	*	*			cis	137.2	106.8	-7.1	0	0	0	0	0	113.4
592	I	29.8	Very low	27.3	Very low	176 Å²	176	141.6 Å²	141.6	90%	0.903	78%	0.781	S	S	*	*			trans	-141.2	139.3	172.6	-57.3	-179.5	0	0	0	108.9
593	S	28	Very low	27.1	Very low	120 Å²	120	141.7 Å²	141.7	84%	0.839	80%	0.798	S	S	*	*			trans	-95.4	138.8	-178.8	58.1	0	0	0	0	113.5
594	G	28	Very low	27.1	Very low	79 Å²	79	145.3 Å²	145.3	81%	0.814	81%	0.807	S	S	*	*			trans	-146.7	149.1	170	0	0	0	0	0	112.1
595	R	25.3	Very low	27.3	Very low	240 Å²	240	146.6 Å²	146.6	91%	0.906	82%	0.817	S	S	*	*			trans	-98.6	153.2	175.4	-88.1	-174.4	172.9	-172	-2.2	111
596	P	26.4	Very low	27.3	Very low	127 Å²	127	152.4 Å²	152.4	83%	0.825	83%	0.825	S	S	*	*			trans	-72.2	144.5	-172.9	29.6	-36.4	0	0	0	113.1
597	V	27.1	Very low	27.6	Very low	143 Å²	143	153.8 Å²	153.8	87%	0.867	83%	0.828	S	S	*	*			trans	-141.5	142.9	168.9	-177.6	0	0	0	0	107.5
598	A	23.7	Very low	27.7	Very low	83 Å²	83	156.7 Å²	156.7	69%	0.686	83%	0.831	S	S	*	*			trans	-92.7	177.8	-178.3	0	0	0	0	0	112.8
599	E	24.9	Very low	27.7	Very low	174 Å²	174	152.9 Å²	152.9	81%	0.813	83%	0.827	S	S	*	*			trans	70.8	111.2	174.4	-53	-174.8	161.5	0	0	116
600	F	28.8	Very low	27.8	Very low	203 Å²	203	159 Å²	159	89%	0.89	84%	0.838	S	S	*	*				-165.2	132.2	104.2	-105.5	-75	0	0	0	110.6
601	L	24.4	Very low	27.6	Very low	162 Å²	162	152 Å²	152	85%	0.848	82%	0.822	S	S	*	*			trans	-98.2	149.2	171.9	-74.3	169.3	0	0	0	110.3
602	P	27.8	Very low	27.4	Very low	128 Å²	128	157.7 Å²	157.7	83%	0.831	83%	0.826	S	S	*	*				-122.3	161.8	111.8	36.1	-33.2	0	0	0	111.7
603	G	27	Very low	27.4	Very low	67 Å²	67	151.6 Å²	151.6	69%	0.691	81%	0.807	S	S	*	*			cis	173.3	-20.2	-1.5	0	0	0	0	0	115.1
604	E	27.8	Very low	27.3	Very low	189 Å²	189	153.5 Å²	153.5	88%	0.883	80%	0.797	S	S	*	*			trans	-121.8	178.9	-172.1	-77.3	168.9	-179.9	0	0	113
605	L	28.6	Very low	27.4	Very low	172 Å²	172	156.1 Å²	156.1	90%	0.901	79%	0.789	S	S	*	*			trans	56.9	42.6	-171.3	-68.8	173.8	0	0	0	116.1	N607	L605-N607 PolarHBondContact O-N 2.85Å
606	R	26.1	Very low	27.7	Very low	241 Å²	241	148.4 Å²	148.4	91%	0.909	78%	0.777	S	S	*	*			trans	-68.9	77.6	155.4	-80.2	-175.7	167.9	179.6	-0.1	111.5
607	N	31.6	Very low	28	Very low	149 Å²	149	144.2 Å²	144.2	80%	0.797	75%	0.751	S	S	*	*			trans	-100	100.3	163.6	-117.8	7.7	0	0	0	110.6	L605	L605-N607 PolarHBondContact O-N 2.85Å
608	K	27.2	Very low	28.3	Very low	186 Å²	186	140.9 Å²	140.9	81%	0.809	73%	0.726	S	S	*	*			trans	-66.5	140.7	149.2	-67.8	174.4	176.8	177.2	0	106.6
609	D	27.8	Very low	29.1	Very low	142 Å²	142	142.3 Å²	142.3	76%	0.759	72%	0.72	S	S	*	*			trans	109.5	49.3	173.8	-54	-16.5	0	0	0	115.9
610	Y	29.7	Very low	29.5	Very low	239 Å²	239	139.1 Å²	139.1	94%	0.937	70%	0.702	S	S	*	*	S	Bend	trans	-113.2	132.5	142	-113.2	-105.8	0	0	0	109.7
611	V	28.7	Very low	29.8	Very low	99 Å²	99	134.5 Å²	134.5	60%	0.6	68%	0.681	S	S	*	*			trans	-100.6	123.9	-142.8	-176.2	0	0	0	0	113.7	G613 Y614	V611-G613 PolarHBondContact O-N 2.91Å; V611-Y614 HydrophobicContact CB-CE2 4.38Å; V611-Y614 HydrophobicContact CG1-CD2 4.06Å; V611-Y614 HydrophobicContact CG1-CE2 3.61Å
612	K	26.3	Very low	30.4	Very low	192 Å²	192	133.7 Å²	133.7	84%	0.835	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-32.4	124.9	167.6	-59.1	178.5	174.9	-168.4	0	114.9	Y614	K612-Y614 PolarHBondContact O-N 2.69Å
613	G	29.7	Very low	30.8	Very low	49 Å²	49	129.8 Å²	129.8	51%	0.505	65%	0.65	S	S	.	*	T	Hydrogen-bonded Turn	trans	62.6	37	146.7	0	0	0	0	0	117.1	V611 S617	V611-G613 PolarHBondContact O-N 2.91Å; G613-S617 WeakPolarHBondContact O-CB 3.47Å; G613-S617 PolarHBondContact O-N 2.84Å; G613-S617 PolarHBondContact O-OG 3.13Å
614	Y	26.5	Very low	31.3	Very low	160 Å²	160	129.9 Å²	129.9	63%	0.627	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.1	125.2	157.7	-78	-127.4	0	0	0	106.6	V611 K612 E618	V611-Y614 HydrophobicContact CB-CE2 4.38Å; V611-Y614 HydrophobicContact CG1-CD2 4.06Å; V611-Y614 HydrophobicContact CG1-CE2 3.61Å; K612-Y614 PolarHBondContact O-N 2.69Å; Y614-E618 HydrophobicContact CD2-CG 4.3Å; Y614-E618 HydrophobicContact CE1-CG 4.38Å; Y614-E618 HydrophobicContact CE2-CG 3.94Å
615	M	29.2	Very low	31.7	Very low	133 Å²	133	129 Å²	129	66%	0.655	63%	0.629	S	S	*	*	T	Hydrogen-bonded Turn	cis	-112	-14.4	21.5	-63.1	-170.6	-80.4	0	0	116	S617	M615-S617 PolarHBondContact O-N 2.91Å
616	A	32.9	Very low	32.3	Very low	78 Å²	78	125.8 Å²	125.8	65%	0.645	61%	0.614	S	S	*	*	H	α-helix	trans	-60.3	-38.7	-173.1	0	0	0	0	0	114
617	S	32.7	Very low	33	Very low	39 Å²	39	119.8 Å²	119.8	27%	0.273	60%	0.604	S	S	.	*	H	α-helix	trans	-88.6	-16.7	-167.5	79.8	0	0	0	0	115.8	G613 M615 K621	G613-S617 WeakPolarHBondContact O-CB 3.47Å; G613-S617 PolarHBondContact O-N 2.84Å; G613-S617 PolarHBondContact O-OG 3.13Å; M615-S617 PolarHBondContact O-N 2.91Å; S617-K621 WeakPolarHBondContact O-CG 3.45Å; S617-K621 PolarHBondContact O-N 3.32Å; S617-K621 VanDerWaalsContact O-N 3.1Å; S617-K621 PolarHBondContact O-NZ 2.89Å; S617-K621 VanDerWaalsContact O-NZ 3.09Å; S617-K621 PolarHBondContact OG-NZ 2.95Å
618	E	34	Very low	33	Very low	74 Å²	74	120 Å²	120	35%	0.346	60%	0.604	S	S	.	*	H	α-helix	trans	-86	-29.9	-177.7	-79.1	-57	118.4	0	0	113.2	Y614 Y620 K621 K622	Y614-E618 HydrophobicContact CD2-CG 4.3Å; Y614-E618 HydrophobicContact CE1-CG 4.38Å; Y614-E618 HydrophobicContact CE2-CG 3.94Å; E618-Y620 VanDerWaalsContact C-N 3.28Å; E618-Y620 PolarHBondContact O-N 3.16Å; E618-K621 PolarHBondContact O-N 3.41Å; E618-K621 WeakPolarHBondContact OE1-CD 3.39Å; E618-K621 WeakPolarHBondContact OE1-CE 3.17Å; E618-K621 IonicContact OE1-NZ 2.75Å; E618-K621 PolarHBondContact OE1-NZ 3.38Å; E618-K622 VanDerWaalsContact O-CB 3.24Å; E618-K622 WeakPolarHBondContact O-CB 3.49Å; E618-K622 PolarHBondContact O-N 3.16Å
619	I	40	Very low	33.2	Very low	112 Å²	112	113.8 Å²	113.8	57%	0.574	59%	0.593	S	S	*	*	H	α-helix	trans	-60.1	-44.2	168.9	-62.6	178.7	0	0	0	109.3	K622 A623	I619-K622 PolarHBondContact O-N 3.33Å; I619-A623 WeakPolarHBondContact O-CB 3.4Å; I619-A623 PolarHBondContact O-N 3.16Å
620	Y	33.3	Very low	33.3	Very low	107 Å²	107	115.8 Å²	115.8	42%	0.42	60%	0.598	S	S	.	*	H	α-helix	trans	-67.6	-47.2	178.6	-154.8	-120.3	0	0	0	112.5	E618 K622 A623 V624 D943 V944	E618-Y620 VanDerWaalsContact C-N 3.28Å; E618-Y620 PolarHBondContact O-N 3.16Å; Y620-K622 VanDerWaalsContact C-N 3.26Å; Y620-K622 PolarHBondContact O-N 2.89Å; Y620-A623 PolarHBondContact O-N 3.01Å; Y620-V624 HydrophobicContact CD1-CG2 4.11Å; Y620-V624 HydrophobicContact CD2-CG2 4.03Å; Y620-V624 HydrophobicContact CE1-CG2 4.04Å; Y620-V624 HydrophobicContact CE2-CG2 3.91Å; Y620-V624 HydrophobicContact CG-CG2 4.11Å; Y620-V624 VanDerWaalsContact O-CB 3.28Å; Y620-V624 WeakPolarHBondContact O-CB 3.31Å; Y620-V624 VanDerWaalsContact O-CG2 3.26Å; Y620-V624 WeakPolarHBondContact O-CG2 3.5Å; Y620-V624 PolarHBondContact O-N 2.85Å; Y620-D943 WeakPolarHBondContact CD2-O 3.36Å; Y620-D943 WeakPolarHBondContact CE2-O 3.35Å; Y620-V944 HydrophobicContact CE2-CB 4.47Å; Y620-V944 HydrophobicContact CE2-CG1 4.13Å; Y620-V944 HydrophobicContact CE2-CG2 4.1Å
621	K	35.5	Very low	33.5	Very low	107 Å²	107	114.5 Å²	114.5	47%	0.465	60%	0.597	S	S	.	*	H	α-helix	trans	-62.6	-29.6	177.4	-74.3	-171.3	-134.5	76.4	0	113.7	S617 E618 K625	S617-K621 WeakPolarHBondContact O-CG 3.45Å; S617-K621 PolarHBondContact O-N 3.32Å; S617-K621 VanDerWaalsContact O-N 3.1Å; S617-K621 PolarHBondContact O-NZ 2.89Å; S617-K621 VanDerWaalsContact O-NZ 3.09Å; S617-K621 PolarHBondContact OG-NZ 2.95Å; E618-K621 PolarHBondContact O-N 3.41Å; E618-K621 WeakPolarHBondContact OE1-CD 3.39Å; E618-K621 WeakPolarHBondContact OE1-CE 3.17Å; E618-K621 IonicContact OE1-NZ 2.75Å; E618-K621 PolarHBondContact OE1-NZ 3.38Å; K621-K625 VanDerWaalsContact O-CB 3.24Å; K621-K625 WeakPolarHBondContact O-CB 3.44Å
622	K	35.3	Very low	33.8	Very low	145 Å²	145	116.4 Å²	116.4	63%	0.63	61%	0.609	S	S	*	*	H	α-helix	trans	-80.3	-51.6	175.9	-159.6	169.2	-175.1	177.9	0	111.2	E618 I619 Y620 V624 K625 D626	E618-K622 VanDerWaalsContact O-CB 3.24Å; E618-K622 WeakPolarHBondContact O-CB 3.49Å; E618-K622 PolarHBondContact O-N 3.16Å; I619-K622 PolarHBondContact O-N 3.33Å; Y620-K622 VanDerWaalsContact C-N 3.26Å; Y620-K622 PolarHBondContact O-N 2.89Å; K622-V624 PolarHBondContact O-N 3.01Å; K622-K625 PolarHBondContact O-N 3.4Å; K622-D626 PolarHBondContact O-N 2.73Å
623	A	36.7	Very low	33.9	Very low	46 Å²	46	113.3 Å²	113.3	38%	0.38	61%	0.606	S	S	.	*	H	α-helix	trans	-60.9	-44.8	179.7	0	0	0	0	0	113.2	I619 Y620 K625 D626 T627	I619-A623 WeakPolarHBondContact O-CB 3.4Å; I619-A623 PolarHBondContact O-N 3.16Å; Y620-A623 PolarHBondContact O-N 3.01Å; A623-K625 VanDerWaalsContact C-N 3.26Å; A623-K625 PolarHBondContact O-N 3.49Å; A623-D626 PolarHBondContact O-N 3.47Å; A623-T627 WeakPolarHBondContact O-CB 3.15Å; A623-T627 PolarHBondContact O-N 3.16Å; A623-T627 PolarHBondContact O-OG1 2.99Å
624	V	37	Very low	34	Very low	68 Å²	68	116.1 Å²	116.1	41%	0.412	62%	0.616	S	S	.	*	H	α-helix	trans	-66.3	-29.8	178.9	174.1	0	0	0	0	111.9	Y620 K622	Y620-V624 HydrophobicContact CD1-CG2 4.11Å; Y620-V624 HydrophobicContact CD2-CG2 4.03Å; Y620-V624 HydrophobicContact CE1-CG2 4.04Å; Y620-V624 HydrophobicContact CE2-CG2 3.91Å; Y620-V624 HydrophobicContact CG-CG2 4.11Å; Y620-V624 VanDerWaalsContact O-CB 3.28Å; Y620-V624 WeakPolarHBondContact O-CB 3.31Å; Y620-V624 VanDerWaalsContact O-CG2 3.26Å; Y620-V624 WeakPolarHBondContact O-CG2 3.5Å; Y620-V624 PolarHBondContact O-N 2.85Å; K622-V624 PolarHBondContact O-N 3.01Å
625	K	37.5	Very low	34.2	Very low	170 Å²	170	117.6 Å²	117.6	74%	0.739	63%	0.625	S	S	*	*	H	α-helix	trans	-80.9	-36.6	179.4	-165	174.4	-174.2	179.4	0	112.9	K621 K622 A623	K621-K625 VanDerWaalsContact O-CB 3.24Å; K621-K625 WeakPolarHBondContact O-CB 3.44Å; K622-K625 PolarHBondContact O-N 3.4Å; A623-K625 VanDerWaalsContact C-N 3.26Å; A623-K625 PolarHBondContact O-N 3.49Å
626	D	40.4	Very low	34.1	Very low	106 Å²	106	121.3 Å²	121.3	57%	0.567	64%	0.638	S	S	*	*	H	α-helix	trans	-82.8	-29.5	178.6	-67.1	-24.7	0	0	0	112.2	K622 A623 G629	K622-D626 PolarHBondContact O-N 2.73Å; A623-D626 PolarHBondContact O-N 3.47Å; D626-G629 PolarHBondContact O-N 2.6Å
627	T	40.3	Very low	34.1	Very low	115 Å²	115	128.8 Å²	128.8	71%	0.706	65%	0.649	S	S	*	*	H	α-helix	trans	-79.3	-24.4	-179.6	-52.7	0	0	0	0	113.2	A623 G629	A623-T627 WeakPolarHBondContact O-CB 3.15Å; A623-T627 PolarHBondContact O-N 3.16Å; A623-T627 PolarHBondContact O-OG1 2.99Å; T627-G629 PolarHBondContact O-N 3.06Å
628	L	33.5	Very low	34	Very low	154 Å²	154	133.2 Å²	133.2	81%	0.806	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.1	15.5	165.9	-95.1	74.7	0	0	0	113.3
629	G	30.3	Very low	33.9	Very low	55 Å²	55	133.3 Å²	133.3	57%	0.567	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.7	-7.8	-171.6	0	0	0	0	0	117.9	D626 T627	D626-G629 PolarHBondContact O-N 2.6Å; T627-G629 PolarHBondContact O-N 3.06Å
630	Q	30.3	Very low	33.5	Very low	184 Å²	184	135.4 Å²	135.4	86%	0.86	71%	0.714	S	S	*	*			trans	-127.4	104	-170.6	-61.6	-165.5	19	0	0	115.4
631	K	33.4	Very low	33.4	Very low	211 Å²	211	134 Å²	134	92%	0.917	73%	0.732	S	S	*	*			trans	-122.3	136	153	-93.8	-178	177	171.9	0	110.3
632	T	35.1	Very low	33.1	Very low	140 Å²	140	138.6 Å²	138.6	86%	0.859	75%	0.752	S	S	*	*			trans	-77	146.6	-164.5	43.5	0	0	0	0	114
633	T	27.8	Very low	32.9	Very low	127 Å²	127	139.4 Å²	139.4	78%	0.779	76%	0.762	S	S	*	*			trans	-73.8	161.2	175.3	78.2	0	0	0	0	111.5
634	P	31.8	Very low	32.5	Very low	108 Å²	108	147.7 Å²	147.7	70%	0.701	78%	0.783	S	S	*	*				-151.7	145.9	84.9	36.7	-17.2	0	0	0	118.7
635	K	30.9	Very low	32.3	Very low	191 Å²	191	153.1 Å²	153.1	83%	0.83	80%	0.801	S	S	*	*			trans	62	118	142.8	-66.7	172.4	179.3	171	0	121.7
636	K	28	Very low	32.1	Very low	210 Å²	210	149.4 Å²	149.4	91%	0.913	80%	0.797	S	S	*	*			trans	38.3	124.7	141.4	-71.1	-177.8	172.6	179.4	0	117.9
637	R	32.3	Very low	31.8	Very low	236 Å²	236	152.4 Å²	152.4	89%	0.891	81%	0.813	S	S	*	*				-174.6	142.2	68.2	177.6	172.2	176.2	178.1	-3.2	112.9
638	T	31.3	Very low	31.4	Very low	131 Å²	131	155.3 Å²	155.3	80%	0.804	82%	0.819	S	S	*	*			trans	-24.1	141	167.4	56.7	0	0	0	0	119.1
639	G	31.5	Very low	31.5	Very low	77 Å²	77	156.3 Å²	156.3	79%	0.794	82%	0.823	S	S	*	*			trans	164	99.3	155.5	0	0	0	0	0	116.6
640	T	31.9	Very low	31.6	Very low	156 Å²	156	159.7 Å²	159.7	96%	0.957	83%	0.828	S	S	*	*			trans	-65.3	132.1	172.7	48.4	0	0	0	0	113.3
641	G	31	Very low	31.6	Very low	78 Å²	78	156.8 Å²	156.8	80%	0.804	82%	0.823	S	S	*	*			trans	-158.1	121.5	173.3	0	0	0	0	0	113.3
642	K	28.8	Very low	31.6	Very low	202 Å²	202	152.2 Å²	152.2	88%	0.878	82%	0.817	S	S	*	*			trans	-78.4	153.7	-177.5	-58.8	168.2	-179.6	171.6	0	112
643	I	32.2	Very low	31.6	Very low	162 Å²	162	150.1 Å²	150.1	83%	0.831	81%	0.814	S	S	*	*			trans	148.4	153.6	135.7	-80.9	156.1	0	0	0	110.9
644	R	28.5	Very low	31.8	Very low	220 Å²	220	147.1 Å²	147.1	83%	0.83	81%	0.809	S	S	*	*			cis	175.9	141.3	-43.2	-144.6	179.8	-174.7	-177.8	1	106.6
645	K	32.7	Very low	31.8	Very low	182 Å²	182	150 Å²	150	79%	0.791	81%	0.813	S	S	*	*			trans	66.9	141.1	173.2	-62.4	-168.4	167.8	-163.7	0	115.6
646	S	31.6	Very low	31.9	Very low	93 Å²	93	151.2 Å²	151.2	65%	0.65	81%	0.812	S	S	*	*			cis	86.9	123.8	20.4	84.7	0	0	0	0	116.5
647	D	35.7	Very low	31.9	Very low	168 Å²	168	146 Å²	146	90%	0.898	80%	0.802	S	S	*	*			trans	-151	153.1	144.6	-92.9	-36.1	0	0	0	110.3
648	Q	30.4	Very low	31.7	Very low	177 Å²	177	146 Å²	146	83%	0.827	80%	0.802	S	S	*	*			trans	-126.8	136.5	-179.2	-71.6	177.8	-26.4	0	0	110.3
649	I	35.7	Very low	31.9	Very low	174 Å²	174	145.4 Å²	145.4	89%	0.892	80%	0.8	S	S	*	*			trans	-149.7	147	155.2	-53.2	-179.4	0	0	0	107.7
650	N	32.8	Very low	31.7	Very low	126 Å²	126	145.4 Å²	145.4	67%	0.674	80%	0.8	S	S	*	*			cis	-175.3	139.8	-48.2	-141.5	1.5	0	0	0	106.2
651	T	30.4	Very low	31.5	Very low	123 Å²	123	143.3 Å²	143.3	76%	0.755	79%	0.792	S	S	*	*			trans	47.6	144.2	153	55.1	0	0	0	0	121.3
652	S	33.9	Very low	31.4	Very low	115 Å²	115	145.6 Å²	145.6	80%	0.804	79%	0.791	S	S	*	*			cis	-172.9	-167.9	-6.9	52.6	0	0	0	0	105.8
653	A	33.6	Very low	31.5	Very low	96 Å²	96	141.8 Å²	141.8	79%	0.793	79%	0.785	S	S	*	*			cis	-156.6	179.5	5.1	0	0	0	0	0	109.6
654	G	34	Very low	31.2	Very low	65 Å²	65	139.6 Å²	139.6	67%	0.67	78%	0.784	S	S	*	*			trans	95.3	95	176.1	0	0	0	0	0	112
655	E	31.1	Very low	31.3	Very low	169 Å²	169	134.6 Å²	134.6	79%	0.79	78%	0.783	S	S	*	*				61.5	129.1	61.5	-56.9	-164.6	-171.6	0	0	113
656	R	31.7	Very low	31.3	Very low	216 Å²	216	131.6 Å²	131.6	82%	0.815	78%	0.78	S	S	*	*			cis	-135.9	139.1	17.4	-69.6	-178.1	177.2	175	-1	110.6
657	S	29.2	Very low	31.1	Very low	99 Å²	99	134.6 Å²	134.6	69%	0.692	79%	0.787	S	S	*	*				59.3	111.8	90.3	-65.5	0	0	0	0	116
658	W	27.2	Very low	30.9	Very low	238 Å²	238	132.2 Å²	132.2	90%	0.902	78%	0.78	S	S	*	*				70.9	146.4	65.1	-74.1	99.4	0	0	0	111.2
659	P	35.6	Very low	30.6	Very low	117 Å²	117	132.3 Å²	132.3	76%	0.76	79%	0.785	S	S	*	*			cis	-139.8	-163.1	-49.3	42.6	-25.8	0	0	0	111.7
660	G	28.7	Very low	30.4	Very low	77 Å²	77	127.2 Å²	127.2	79%	0.794	78%	0.776	S	S	*	*			trans	138	129.8	148.3	0	0	0	0	0	117.9
661	S	26.9	Very low	30.1	Very low	112 Å²	112	130.1 Å²	130.1	78%	0.783	79%	0.785	S	S	*	*			trans	-87.4	147.2	171.6	169.8	0	0	0	0	111.8
662	T	29.9	Very low	30.1	Very low	127 Å²	127	131.9 Å²	131.9	78%	0.779	79%	0.79	S	S	*	*				-170.8	129.7	126.4	22.6	0	0	0	0	115
663	T	28.9	Very low	29.6	Very low	122 Å²	122	133.8 Å²	133.8	75%	0.748	79%	0.791	S	S	*	*			trans	40.2	120.5	142.1	59.9	0	0	0	0	123.4
664	S	27.8	Very low	29.4	Very low	116 Å²	116	134.4 Å²	134.4	81%	0.811	79%	0.785	S	S	*	*			trans	45.3	117.5	131	-164.9	0	0	0	0	121.6
665	S	30.7	Very low	29.2	Very low	115 Å²	115	139.2 Å²	139.2	80%	0.804	79%	0.79	S	S	*	*			trans	-165.8	140.2	130.8	9.7	0	0	0	0	114.1
666	T	31.8	Very low	29.1	Very low	119 Å²	119	138.3 Å²	138.3	73%	0.73	80%	0.796	S	S	*	*			trans	-24.8	136.3	163.3	48.4	0	0	0	0	120.6
667	I	28.1	Very low	29	Very low	155 Å²	155	131.9 Å²	131.9	80%	0.795	80%	0.796	S	S	*	*				41.6	137.7	109.4	-63.3	168.5	0	0	0	117.4
668	P	31	Very low	29	Very low	118 Å²	118	134.2 Å²	134.2	77%	0.766	80%	0.801	S	S	*	*			cis	-139.7	-171.3	28.6	30.2	-5.1	0	0	0	117.8
669	L	24.7	Very low	29.1	Very low	179 Å²	179	129.1 Å²	129.1	94%	0.937	80%	0.796	S	S	*	*			trans	-45.3	155.2	162	-64.4	131.4	0	0	0	116.9
670	G	30.5	Very low	28.9	Very low	67 Å²	67	127.3 Å²	127.3	69%	0.691	80%	0.799	S	S	*	*			trans	-178.8	109.3	156.5	0	0	0	0	0	108.2
671	E	27.4	Very low	29	Very low	187 Å²	187	128.3 Å²	128.3	87%	0.874	80%	0.8	S	S	*	*				85.7	155.4	74.1	-84.7	-162.7	172.1	0	0	114.8
672	L	29.8	Very low	29.5	Very low	161 Å²	161	128 Å²	128	84%	0.843	80%	0.795	S	S	*	*			trans	81.9	119.3	170.5	-71.9	152	0	0	0	119.6
673	N	23.7	Very low	29.6	Very low	154 Å²	154	128 Å²	128	82%	0.824	80%	0.795	S	S	*	*			trans	-81	-164.6	174.8	-70.6	-55.6	0	0	0	112.6
674	T	28	Very low	29.8	Very low	109 Å²	109	132.1 Å²	132.1	67%	0.669	80%	0.803	S	S	*	*			trans	104.2	133.3	136.4	11.4	0	0	0	0	119.7
675	E	31	Very low	29.8	Very low	166 Å²	166	137.3 Å²	137.3	78%	0.776	81%	0.805	S	S	*	*			trans	64	112.3	157.6	-71.7	154.8	-130.9	0	0	118.7
676	V	28	Very low	29.9	Very low	151 Å²	151	138.9 Å²	138.9	92%	0.915	81%	0.809	S	S	*	*				67.1	95.7	68.3	180	0	0	0	0	112.1
677	G	31.3	Very low	29.8	Very low	80 Å²	80	137.9 Å²	137.9	83%	0.825	80%	0.803	S	S	*	*			trans	-152.9	136.2	173.6	0	0	0	0	0	110.9
678	N	27.6	Very low	30	Very low	149 Å²	149	136 Å²	136	80%	0.797	80%	0.802	S	S	*	*			trans	-116.6	166	-164.4	-170	13.3	0	0	0	113
679	T	30.7	Very low	30	Very low	130 Å²	130	136.3 Å²	136.3	80%	0.798	80%	0.802	S	S	*	*			trans	78	147.1	166.1	78	0	0	0	0	118
680	G	31.7	Very low	30.5	Very low	80 Å²	80	132.1 Å²	132.1	83%	0.825	79%	0.788	S	S	*	*			trans	143.1	53.8	165.3	0	0	0	0	0	119.9
681	A	29.7	Very low	30.7	Very low	97 Å²	97	135 Å²	135	80%	0.802	79%	0.787	S	S	*	*			trans	-83.2	175	159.2	0	0	0	0	0	110
682	P	37.7	Very low	31.1	Very low	107 Å²	107	132.5 Å²	132.5	70%	0.695	78%	0.775	S	S	*	*			cis	-149.2	173.6	13.4	42.3	-21	0	0	0	119.3
683	T	31.9	Very low	31.3	Very low	127 Å²	127	132.9 Å²	132.9	78%	0.779	78%	0.775	S	S	*	*			trans	57.4	132.1	144.6	54.1	0	0	0	0	123.3
684	K	33.8	Very low	31.8	Very low	208 Å²	208	129.9 Å²	129.9	90%	0.904	77%	0.772	S	S	*	*				-160.3	156.3	109.3	-108.5	165.4	-174.2	172.6	0	112.9
685	R	27.8	Very low	32	Very low	225 Å²	225	130.5 Å²	130.5	85%	0.849	78%	0.78	S	S	*	*			trans	-107.9	159.1	-179.5	-64.9	179.3	-179.6	162.5	-1.5	111.8
686	V	32.1	Very low	32.1	Very low	148 Å²	148	127.5 Å²	127.5	90%	0.897	78%	0.777	S	S	*	*			trans	-130.6	152	144	-178.3	0	0	0	0	107.8
687	T	30.2	Very low	32.3	Very low	98 Å²	98	131.8 Å²	131.8	60%	0.601	78%	0.777	S	S	*	*			trans	-157.7	137.1	-168.4	-55.2	0	0	0	0	113.1
688	C	32.6	Very low	32.3	Very low	115 Å²	115	134.5 Å²	134.5	78%	0.777	78%	0.778	S	S	*	*			trans	-140.9	110.3	163.3	-53.5	0	0	0	0	106.8
689	T	31	Very low	32.5	Very low	125 Å²	125	130.8 Å²	130.8	77%	0.767	78%	0.775	S	S	*	*				56.2	132.3	71	68.4	0	0	0	0	113.9
690	S	35.2	Very low	32.6	Very low	91 Å²	91	129.6 Å²	129.6	64%	0.636	77%	0.772	S	S	*	*			cis	-161	159.2	21.9	73.5	0	0	0	0	115.9
691	N	34.5	Very low	32.7	Very low	126 Å²	126	132.9 Å²	132.9	67%	0.674	77%	0.771	S	S	*	*			trans	66.3	151	141.6	-62.2	-23.7	0	0	0	120.8
692	Q	36	Very low	32.7	Very low	135 Å²	135	139.4 Å²	139.4	63%	0.631	77%	0.774	S	S	*	*			cis	-168.5	144.9	-15.8	-111.8	171.2	43.4	0	0	110.5
693	M	33.7	Very low	32.6	Very low	170 Å²	170	139 Å²	139	84%	0.837	77%	0.772	S	S	*	*			trans	51.7	166.4	150.5	-57.2	-167.8	-151.5	0	0	119.9
694	A	32.8	Very low	32.5	Very low	91 Å²	91	138.2 Å²	138.2	75%	0.752	77%	0.772	S	S	*	*			cis	-160	163.8	-36.4	0	0	0	0	0	104.6
695	S	33.7	Very low	32.4	Very low	121 Å²	121	137.7 Å²	137.7	85%	0.846	77%	0.77	S	S	*	*			cis	-173.8	177.7	44.4	-172.1	0	0	0	0	109.4
696	S	31.4	Very low	32.5	Very low	103 Å²	103	132 Å²	132	72%	0.72	76%	0.759	S	S	*	*			trans	-98.8	158.7	-174.1	61.3	0	0	0	0	115.4
697	R	33.6	Very low	32.5	Very low	241 Å²	241	132.2 Å²	132.2	91%	0.909	76%	0.756	S	S	*	*			trans	-169.1	150.3	130.7	-108.8	167.8	177.7	-168.7	-3.2	116.3
698	T	30.8	Very low	32.4	Very low	138 Å²	138	137 Å²	137	85%	0.847	77%	0.768	S	S	*	*			trans	-62.5	164.1	170.3	50	0	0	0	0	113.8
699	G	31.3	Very low	32.4	Very low	71 Å²	71	139 Å²	139	73%	0.732	77%	0.772	S	S	*	*			cis	147.2	179.9	2.5	0	0	0	0	0	112.2
700	S	32.4	Very low	32.5	Very low	105 Å²	105	139.3 Å²	139.3	73%	0.734	77%	0.773	S	S	*	*			trans	102.3	142.2	163.6	-156.2	0	0	0	0	121.1
701	N	34.3	Very low	32.5	Very low	148 Å²	148	138.5 Å²	138.5	79%	0.791	78%	0.778	S	S	*	*			trans	62.5	159.7	162.3	-68	-29.9	0	0	0	120.1
702	R	30.7	Very low	32.3	Very low	234 Å²	234	141.7 Å²	141.7	88%	0.883	79%	0.789	S	S	*	*			cis	-167.9	169.5	-44.9	-123.7	-145.6	157	-176.7	-6	106.5
703	P	35	Very low	31.9	Very low	100 Å²	100	143 Å²	143	65%	0.649	80%	0.801	S	S	*	*			trans	-115.1	-176.7	-149.5	44.1	-40.2	0	0	0	118.2
704	S	29.3	Very low	31.6	Very low	110 Å²	110	139.6 Å²	139.6	77%	0.769	80%	0.799	S	S	*	*			trans	78.5	118.1	155.2	69.7	0	0	0	0	120.3
705	K	32	Very low	31.3	Very low	197 Å²	197	138.9 Å²	138.9	86%	0.857	80%	0.801	S	S	*	*				-165.5	171.6	101.1	-123.1	-166.1	170.9	-164.8	0	113.1
706	V	29.3	Very low	30.9	Very low	104 Å²	104	137.5 Å²	137.5	63%	0.63	81%	0.806	S	S	*	*			trans	-43.9	156.1	170.1	-114.4	0	0	0	0	113.9
707	D	33.2	Very low	30.8	Very low	154 Å²	154	137.3 Å²	137.3	82%	0.824	81%	0.811	S	S	*	*				-154.4	174.4	68.7	-88.2	-53.2	0	0	0	114.9
708	F	27.3	Very low	30.7	Very low	197 Å²	197	132.7 Å²	132.7	86%	0.864	81%	0.809	S	S	*	*			trans	-83.9	143.3	172.3	-104.2	-107.4	0	0	0	111.6
709	D	33	Very low	31	Very low	159 Å²	159	130.1 Å²	130.1	85%	0.85	81%	0.811	S	S	*	*			trans	-155.8	161.9	139	-147.9	-12.3	0	0	0	111.2
710	V	33.3	Very low	32.2	Very low	131 Å²	131	129.8 Å²	129.8	79%	0.794	81%	0.807	S	S	*	*			trans	-113.2	118.7	176.1	176.1	0	0	0	0	109.1
711	G	34.5	Very low	33.9	Very low	73 Å²	73	129.5 Å²	129.5	75%	0.753	80%	0.797	S	S	*	*			trans	-137.8	138.3	177.5	0	0	0	0	0	111.4
712	E	30	Very low	36.1	Very low	193 Å²	193	124.6 Å²	124.6	90%	0.902	77%	0.773	S	S	*	*			trans	-81.2	177.8	178.2	-65.3	-179.7	105.1	0	0	112.6
713	D	29.2	Very low	38.4	Very low	163 Å²	163	118.2 Å²	118.2	87%	0.872	76%	0.762	S	S	*	*			trans	85.4	133.9	159.9	-102.2	-23.3	0	0	0	122.5
714	A	26.6	Very low	40.7	Very low	98 Å²	98	114.9 Å²	114.9	81%	0.81	74%	0.736	S	S	*	*			trans	49.4	79.1	147.6	0	0	0	0	0	120.5
715	G	27.6	Very low	42.8	Very low	77 Å²	77	110.2 Å²	110.2	79%	0.794	70%	0.704	S	S	*	*			trans	-139.3	115.3	162.7	0	0	0	0	0	113.2
716	G	25	Very low	44.2	Very low	91 Å²	91	110.1 Å²	110.1	94%	0.938	70%	0.703	S	S	*	*			trans	-77.5	125.9	-178.9	0	0	0	0	0	113.4
717	A	28.5	Very low	45.7	Very low	100 Å²	100	113.3 Å²	113.3	83%	0.826	71%	0.708	S	S	*	*			trans	-104.8	124	179.4	0	0	0	0	0	112.4	G719	A717-G719 PolarHBondContact O-N 2.91Å
718	T	30.8	Very low	47	Very low	143 Å²	143	108.9 Å²	108.9	88%	0.877	68%	0.68	S	S	*	*			trans	-70.6	125.3	171.9	45.4	0	0	0	0	110.8	G720	T718-G720 PolarHBondContact O-N 3.36Å
719	G	38.4	Very low	48.4	Very low	85 Å²	85	104.9 Å²	104.9	88%	0.876	66%	0.662	S	S	*	*			trans	-68.6	97	-170.6	0	0	0	0	0	114.9	A717	A717-G719 PolarHBondContact O-N 2.91Å
720	G	56.2	Low	48.9	Very low	63 Å²	63	102.2 Å²	102.2	65%	0.649	66%	0.656	S	S	*	*	P	Polyproline II helix	trans	-72.7	154.4	160.9	0	0	0	0	0	111.9	T718	T718-G720 PolarHBondContact O-N 3.36Å
721	L	67.9	Low	49.4	Very low	99 Å²	99	99 Å²	99	52%	0.518	63%	0.633	S	S	.	*	P	Polyproline II helix	trans	-71.3	145.6	166.2	-67.7	173.1	0	0	0	109.8	L1028	L721-L1028 HydrophobicContact CD1-CB 3.97Å; L721-L1028 WeakPolarHBondContact CD1-O 3.42Å; L721-L1028 HydrophobicContact CD2-CB 4.02Å; L721-L1028 HydrophobicContact CD2-CD1 4.37Å
722	P	79.6	Confident	49.7	Very low	46 Å²	46	97.7 Å²	97.7	30%	0.299	62%	0.62	S	S	.	*	P	Polyproline II helix	trans	-60.9	141.1	169.3	28	-33.7	0	0	0	109.2	R724 Y956	P722-R724 PolarHBondContact O-N 3.48Å; P722-Y956 HydrophobicContact CG-CD1 3.68Å; P722-Y956 HydrophobicContact CG-CE1 4.16Å
723	P	79.2	Confident	50	Low	99 Å²	99	96.1 Å²	96.1	64%	0.643	61%	0.614	S	S	*	*	P	Polyproline II helix	trans	-62.6	139.6	-177.1	26.2	-34.2	0	0	0	110.6	H955	P723-H955 PolarHBondContact O-CE1 2.92Å; P723-H955 PolarHBondContact O-NE2 2.64Å
724	R	83.8	Confident	50.9	Low	30 Å²	30	90.8 Å²	90.8	11%	0.113	58%	0.584	C	S	.	*	P	Polyproline II helix	trans	-53.9	135.7	174.2	-164	178	-153.9	-72.4	4.2	110.3	P722 K726 N1007 D1023 A1025 E1029 L1088 H1089 S1090	P722-R724 PolarHBondContact O-N 3.48Å; R724-K726 PolarHBondContact O-N 2.79Å; R724-K726 VanDerWaalsContact O-N 3.13Å; R724-N1007 PolarHBondContact NH2-ND2 2.93Å; R724-D1023 IonicContact CZ-OD1 2.74Å; R724-D1023 IonicContact CZ-OD2 3.2Å; R724-D1023 IonicContact NE-OD2 2.75Å; R724-D1023 IonicContact NH2-OD1 3.17Å; R724-D1023 PolarHBondContact NH2-OD1 2.91Å; R724-D1023 IonicContact NH2-OD2 3.77Å; R724-D1023 PolarHBondContact NH2-OD2 2.71Å; R724-A1025 HydrophobicContact CG-CB 3.86Å; R724-E1029 IonicContact NE-OE1 2.71Å; R724-L1088 PolarHBondContact NH1-O 3.24Å; R724-L1088 PolarHBondContact NH2-O 3.04Å; R724-H1089 PolarHBondContact NH1-O 3.35Å; R724-S1090 VanDerWaalsContact CZ-O 3.26Å; R724-S1090 PolarHBondContact NH1-O 3.26Å; R724-S1090 VanDerWaalsContact NH1-O 3.11Å; R724-S1090 PolarHBondContact NH2-O 3.39Å
725	P	73.3	Confident	52.3	Low	13 Å²	13	89.7 Å²	89.7	8%	0.084	56%	0.559	C	S	.	*	P	Polyproline II helix	trans	-53.3	120	174.4	-24.5	32.9	0	0	0	110.2	K727 Y956 D1006	P725-K727 VanDerWaalsContact C-N 3.33Å; P725-Y956 WeakPolarHBondContact CD-OH 3.17Å; P725-D1006 HydrophobicContact CB-CB 4.48Å; P725-D1006 HydrophobicContact CG-CB 3.72Å
726	K	61.8	Low	54	Low	194 Å²	194	86.4 Å²	86.4	84%	0.843	52%	0.524	S	S	*	.	S	Bend	trans	-84.7	-9.2	-175.7	-65.8	-173.1	179.6	178.3	0	113.8	R724	R724-K726 PolarHBondContact O-N 2.79Å; R724-K726 VanDerWaalsContact O-N 3.13Å
727	K	59.7	Low	56.3	Low	172 Å²	172	82.1 Å²	82.1	75%	0.748	48%	0.479	S	S	*	.	S	Bend	trans	-150.5	155.6	173.2	-69.2	-167.3	174.3	-168.1	0	107.2	P725	P725-K727 VanDerWaalsContact C-N 3.33Å
728	R	61.7	Low	58	Low	60 Å²	60	81.3 Å²	81.3	23%	0.226	46%	0.455	C	S	.	.			trans	-56	136.1	160.5	-165	161.2	81.6	-161.4	20.7	109	H734 D1082	R728-H734 PolarHBondContact NE-CD2 3.23Å; R728-H734 PolarHBondContact NE-NE2 2.75Å; R728-H734 PolarHBondContact NH2-CD2 2.93Å; R728-H734 VanDerWaalsContact NH2-CD2 3.3Å; R728-H734 PolarHBondContact NH2-CE1 2.62Å; R728-H734 PolarHBondContact NH2-ND1 2.97Å; R728-H734 PolarHBondContact NH2-NE2 3.24Å; R728-D1082 IonicContact CZ-OD1 3.16Å; R728-D1082 IonicContact NH1-OD1 2.76Å; R728-D1082 PolarHBondContact NH1-OD1 2.91Å; R728-D1082 IonicContact NH2-OD1 2.69Å; R728-D1082 PolarHBondContact NH2-OD1 2.68Å
729	K	56.5	Low	59.7	Low	113 Å²	113	77.8 Å²	77.8	49%	0.491	43%	0.431	S	S	.	.			trans	-66	132	164.4	-69.7	171.9	-175.5	155.6	0	107.4	M731 D1006	K729-M731 PolarHBondContact O-N 2.77Å; K729-D1006 WeakPolarHBondContact CD-OD2 3.39Å; K729-D1006 WeakPolarHBondContact CE-OD2 3.49Å; K729-D1006 VanDerWaalsContact NZ-CG 3.26Å; K729-D1006 IonicContact NZ-OD1 3.28Å; K729-D1006 PolarHBondContact NZ-OD1 2.74Å; K729-D1006 IonicContact NZ-OD2 3.38Å; K729-D1006 PolarHBondContact NZ-OD2 2.86Å; K729-D1006 VanDerWaalsContact NZ-OD2 3.09Å
730	S	42.5	Very low	61	Low	103 Å²	103	74.9 Å²	74.9	72%	0.72	40%	0.395	S	S	*	.			trans	-75.5	92.1	169.7	52.5	0	0	0	0	108.9	G732	S730-G732 PolarHBondContact O-N 3.03Å
731	M	43.9	Very low	60.9	Low	64 Å²	64	72.7 Å²	72.7	32%	0.315	37%	0.37	S	S	.	.			trans	-77	109.4	166.7	-51.9	-157.1	-47.7	0	0	107.1	K729 Q1062	K729-M731 PolarHBondContact O-N 2.77Å; M731-Q1062 HydrophobicContact CE-CB 3.68Å
732	G	40.7	Very low	60	Low	45 Å²	45	72.4 Å²	72.4	46%	0.464	38%	0.376	S	S	.	.	S	Bend	trans	53.8	-158.8	-172.3	0	0	0	0	0	115.6	S730 H734	S730-G732 PolarHBondContact O-N 3.03Å; G732-H734 PolarHBondContact O-N 3.47Å
733	M	37.6	Very low	58.3	Low	160 Å²	160	74 Å²	74	79%	0.788	38%	0.382	S	S	*	.	S	Bend	trans	-72.8	107.1	160.2	-77.7	168.5	56.4	0	0	108	R735	M733-R735 PolarHBondContact O-N 3.13Å
734	H	48.4	Very low	56.2	Low	51 Å²	51	73 Å²	73	24%	0.236	38%	0.382	C	S	.	.			trans	-63.7	104.8	174.9	-125.1	-65.2	0	0	0	109.4	R728 G732 N1063	R728-H734 PolarHBondContact NE-CD2 3.23Å; R728-H734 PolarHBondContact NE-NE2 2.75Å; R728-H734 PolarHBondContact NH2-CD2 2.93Å; R728-H734 VanDerWaalsContact NH2-CD2 3.3Å; R728-H734 PolarHBondContact NH2-CE1 2.62Å; R728-H734 PolarHBondContact NH2-ND1 2.97Å; R728-H734 PolarHBondContact NH2-NE2 3.24Å; G732-H734 PolarHBondContact O-N 3.47Å; H734-N1063 PolarHBondContact CE1-O 3.06Å; H734-N1063 PolarHBondContact ND1-O 3.08Å
735	R	55.1	Low	54	Low	75 Å²	75	76.6 Å²	76.6	28%	0.283	41%	0.409	S	S	.	.			trans	-92.1	125.1	162.7	-63.9	174.7	173.8	-84.5	15.3	106.4	M733 D739 D743 L1064	M733-R735 PolarHBondContact O-N 3.13Å; R735-D739 WeakPolarHBondContact CA-OD2 3.35Å; R735-D739 HydrophobicContact CB-CB 4.28Å; R735-D743 IonicContact CZ-OD2 2.8Å; R735-D743 VanDerWaalsContact CZ-OD2 3.28Å; R735-D743 IonicContact NH1-OD2 3.91Å; R735-D743 PolarHBondContact NH1-OD2 2.8Å; R735-D743 IonicContact NH2-OD2 2.74Å; R735-D743 PolarHBondContact NH2-OD2 3.3Å; R735-L1064 HydrophobicContact CB-CD2 4.12Å; R735-L1064 WeakPolarHBondContact O-CA 3.2Å; R735-L1064 VanDerWaalsContact O-CD2 3.3Å; R735-L1064 WeakPolarHBondContact O-CD2 3.33Å
736	S	64.3	Low	52.2	Low	8 Å²	8	83.1 Å²	83.1	6%	0.056	44%	0.437	C	S	.	.			trans	-64.6	155.9	159.1	177.1	0	0	0	0	108.7	R738 D739	S736-R738 PolarHBondContact O-N 2.89Å; S736-R738 PolarHBondContact OG-N 3.34Å; S736-D739 PolarHBondContact N-OD2 3.15Å; S736-D739 WeakPolarHBondContact O-CB 3.45Å; S736-D739 PolarHBondContact O-N 3.31Å
737	L	71.7	Confident	50.7	Low	1 Å²	1	77.8 Å²	77.8	1%	0.005	42%	0.424	C	S	.	.	T	Hydrogen-bonded Turn	trans	-45.9	-32.8	161.6	-93	179.4	0	0	0	112.6	L740 I771 L1064 A1066 I1078 D1080 I1101 M1139	L737-L740 HydrophobicContact CD2-CD1 4.21Å; L737-I771 HydrophobicContact CB-CD1 3.84Å; L737-L1064 HydrophobicContact CD2-CD1 4.31Å; L737-L1064 HydrophobicContact CG-CB 4.3Å; L737-L1064 PolarHBondContact N-O 3.28Å; L737-A1066 HydrophobicContact CD1-CB 3.53Å; L737-A1066 HydrophobicContact CG-CB 3.97Å; L737-I1078 HydrophobicContact CD1-CG2 4.12Å; L737-D1080 HydrophobicContact CD1-CB 4.4Å; L737-I1101 HydrophobicContact CD1-CD1 4Å; L737-M1139 HydrophobicContact CD2-CE 4.12Å; L737-M1139 HydrophobicContact CD2-SD 4.1Å
738	R	65.1	Low	49.5	Very low	84 Å²	84	74.7 Å²	74.7	32%	0.317	42%	0.424	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-29.6	178	-55.1	178.8	-163.8	-136.3	-5.4	113.5	S736 L740 C741 A768 D1080	S736-R738 PolarHBondContact O-N 2.89Å; S736-R738 PolarHBondContact OG-N 3.34Å; R738-L740 PolarHBondContact O-N 2.98Å; R738-C741 WeakPolarHBondContact O-CB 3.33Å; R738-C741 PolarHBondContact O-N 2.87Å; R738-C741 VanDerWaalsContact O-N 3.13Å; R738-A768 HydrophobicContact CG-CB 4.35Å; R738-D1080 IonicContact CZ-OD2 2.98Å; R738-D1080 IonicContact NE-OD2 2.76Å; R738-D1080 PolarHBondContact NE-OD2 2.98Å; R738-D1080 IonicContact NH2-OD2 2.67Å; R738-D1080 PolarHBondContact NH2-OD2 3.41Å
739	D	67	Low	48	Very low	68 Å²	68	77.9 Å²	77.9	36%	0.364	45%	0.445	S	S	.	.	G	3₁₀ helix	trans	-73.2	-24.1	-177.6	-56.9	-23.8	0	0	0	110.8	R735 S736 C741 S742	R735-D739 WeakPolarHBondContact CA-OD2 3.35Å; R735-D739 HydrophobicContact CB-CB 4.28Å; S736-D739 PolarHBondContact N-OD2 3.15Å; S736-D739 WeakPolarHBondContact O-CB 3.45Å; S736-D739 PolarHBondContact O-N 3.31Å; D739-C741 PolarHBondContact O-N 3.33Å; D739-S742 WeakPolarHBondContact O-CB 3.47Å; D739-S742 PolarHBondContact O-N 2.96Å
740	L	64	Low	46.9	Very low	24 Å²	24	74.7 Å²	74.7	13%	0.126	44%	0.44	C	S	.	.	G	3₁₀ helix	trans	-63.3	-25.7	170.4	-60.3	173.2	0	0	0	112.8	L737 R738 S742 L1064 D1142	L737-L740 HydrophobicContact CD2-CD1 4.21Å; R738-L740 PolarHBondContact O-N 2.98Å; L740-S742 PolarHBondContact O-N 2.77Å; L740-L1064 HydrophobicContact CD1-CD1 4.27Å; L740-L1064 HydrophobicContact CD1-CD2 4.46Å; L740-D1142 WeakPolarHBondContact CD1-O 3.32Å; L740-D1142 WeakPolarHBondContact CD2-O 3.19Å
741	C	54.1	Low	46.4	Very low	18 Å²	18	75.5 Å²	75.5	12%	0.122	43%	0.429	C	S	.	.	G	3₁₀ helix	trans	-79.1	-4.3	173.1	-54.4	0	0	0	0	113.7	R738 D739 T769 I771 Y1160	R738-C741 WeakPolarHBondContact O-CB 3.33Å; R738-C741 PolarHBondContact O-N 2.87Å; R738-C741 VanDerWaalsContact O-N 3.13Å; D739-C741 PolarHBondContact O-N 3.33Å; C741-T769 WeakPolarHBondContact CB-OG1 3.17Å; C741-I771 WeakPolarHBondContact SG-CG1 3.45Å; C741-Y1160 VanDerWaalsContact CA-OH 3.3Å; C741-Y1160 WeakPolarHBondContact CA-OH 3.08Å; C741-Y1160 PolarHBondContact SG-OH 3.49Å
742	S	49.7	Very low	45.7	Very low	93 Å²	93	79.5 Å²	79.5	65%	0.65	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.4	-22.9	-175.8	-55.5	0	0	0	0	113.4	D739 L740	D739-S742 WeakPolarHBondContact O-CB 3.47Å; D739-S742 PolarHBondContact O-N 2.96Å; L740-S742 PolarHBondContact O-N 2.77Å
743	D	43.9	Very low	45.1	Very low	78 Å²	78	83.9 Å²	83.9	42%	0.417	46%	0.464	S	S	.	.	S	Bend	trans	-88.8	141.5	176	-79.1	-9.5	0	0	0	110.6	R735	R735-D743 IonicContact CZ-OD2 2.8Å; R735-D743 VanDerWaalsContact CZ-OD2 3.28Å; R735-D743 IonicContact NH1-OD2 3.91Å; R735-D743 PolarHBondContact NH1-OD2 2.8Å; R735-D743 IonicContact NH2-OD2 2.74Å; R735-D743 PolarHBondContact NH2-OD2 3.3Å
744	A	34.6	Very low	44.6	Very low	79 Å²	79	82.3 Å²	82.3	65%	0.653	46%	0.463	S	S	*	.	P	Polyproline II helix	trans	-71.1	153.9	172.1	0	0	0	0	0	111.1	F746	A744-F746 PolarHBondContact O-N 3.01Å
745	P	37.9	Very low	43.7	Very low	106 Å²	106	85.7 Å²	85.7	69%	0.688	49%	0.488	S	S	*	.	P	Polyproline II helix	trans	-55.1	130.8	179.3	21.5	-33.3	0	0	0	111.8
746	F	35.1	Very low	42.4	Very low	149 Å²	149	87 Å²	87	65%	0.654	51%	0.514	S	S	*	.	P	Polyproline II helix	trans	-73.2	142.2	-169.9	-100.9	-108.5	0	0	0	113.1	A744 A750	A744-F746 PolarHBondContact O-N 3.01Å; F746-A750 HydrophobicContact CD1-CB 3.66Å; F746-A750 HydrophobicContact CE1-CB 3.76Å
747	S	31.3	Very low	40.8	Very low	83 Å²	83	94.1 Å²	94.1	58%	0.58	55%	0.552	S	S	*	*	P	Polyproline II helix	trans	-81.5	146.7	163.5	-165.4	0	0	0	0	110.4	D749	S747-D749 PolarHBondContact O-N 2.69Å
748	S	33.6	Very low	38.7	Very low	107 Å²	107	99.6 Å²	99.6	75%	0.748	59%	0.586	S	S	*	*	G	3₁₀ helix	trans	-59.3	-20.2	-173.2	48.8	0	0	0	0	115.5	A750	S748-A750 VanDerWaalsContact C-N 3.3Å; S748-A750 PolarHBondContact O-N 2.91Å
749	D	31	Very low	37	Very low	126 Å²	126	102.5 Å²	102.5	67%	0.674	61%	0.613	S	S	*	*	G	3₁₀ helix	trans	-80.8	-4.6	-170.2	-49.8	-52.3	0	0	0	114.5	S747 Y751	S747-D749 PolarHBondContact O-N 2.69Å; D749-Y751 PolarHBondContact O-N 3.15Å; D749-Y751 VanDerWaalsContact O-N 3.1Å
750	A	32.7	Very low	35.3	Very low	47 Å²	47	105.3 Å²	105.3	39%	0.388	63%	0.632	S	S	.	*	G	3₁₀ helix	trans	-65.4	-16.7	-167.8	0	0	0	0	0	115.4	F746 S748 N752	F746-A750 HydrophobicContact CD1-CB 3.66Å; F746-A750 HydrophobicContact CE1-CB 3.76Å; S748-A750 VanDerWaalsContact C-N 3.3Å; S748-A750 PolarHBondContact O-N 2.91Å; A750-N752 PolarHBondContact O-N 2.79Å; A750-N752 VanDerWaalsContact O-N 3.09Å
751	Y	32	Very low	33.6	Very low	120 Å²	120	107.4 Å²	107.4	47%	0.471	66%	0.66	S	S	.	*	G	3₁₀ helix	trans	-63.1	-17.9	-174.5	-96.8	-90.4	0	0	0	115.3	D749	D749-Y751 PolarHBondContact O-N 3.15Å; D749-Y751 VanDerWaalsContact O-N 3.1Å
752	N	30.4	Very low	32.2	Very low	148 Å²	148	110.9 Å²	110.9	79%	0.791	70%	0.698	S	S	*	*	G	3₁₀ helix	trans	-104.6	0.7	-171	-78.7	-32	0	0	0	116.3	A750	A750-N752 PolarHBondContact O-N 2.79Å; A750-N752 VanDerWaalsContact O-N 3.09Å
753	N	26.7	Very low	31.1	Very low	136 Å²	136	109.3 Å²	109.3	73%	0.727	70%	0.697	S	S	*	*			trans	-140	81.7	-179.2	-97.7	-45.9	0	0	0	113.8	T755	N753-T755 PolarHBondContact O-N 3.17Å
754	T	28.8	Very low	30.4	Very low	127 Å²	127	111.8 Å²	111.8	78%	0.779	72%	0.717	S	S	*	*			trans	-95.9	72.6	173.5	-39.5	0	0	0	0	111.4
755	T	28.9	Very low	30.5	Very low	122 Å²	122	117.7 Å²	117.7	75%	0.748	72%	0.722	S	S	*	*			trans	-113	139.3	169.1	47.8	0	0	0	0	111.1	N753	N753-T755 PolarHBondContact O-N 3.17Å
756	A	27	Very low	30.3	Very low	102 Å²	102	117.4 Å²	117.4	84%	0.843	72%	0.723	S	S	*	*			trans	-74.7	142.1	-160	0	0	0	0	0	114.4
757	N	31.1	Very low	30.7	Very low	159 Å²	159	118 Å²	118	85%	0.85	73%	0.733	S	S	*	*			trans	-126.6	100.6	163.1	-106.3	-33.2	0	0	0	111.5
758	T	29	Very low	31.4	Very low	115 Å²	115	116.5 Å²	116.5	71%	0.706	73%	0.726	S	S	*	*			trans	20	104.9	148	-43	0	0	0	0	118.6	V760	T758-V760 HydrophobicContact CG2-CG2 4.4Å; T758-V760 PolarHBondContact O-N 3.47Å
759	V	29.2	Very low	32.3	Very low	146 Å²	146	114.3 Å²	114.3	89%	0.885	71%	0.708	S	S	*	*			trans	-66.6	127.3	163.4	177.4	0	0	0	0	110.2
760	V	30.4	Very low	33.8	Very low	126 Å²	126	112.8 Å²	112.8	76%	0.764	71%	0.705	S	S	*	*			trans	-108.8	129.8	178.2	178.1	0	0	0	0	111.5	T758	T758-V760 HydrophobicContact CG2-CG2 4.4Å; T758-V760 PolarHBondContact O-N 3.47Å
761	G	27.6	Very low	36	Very low	69 Å²	69	110.9 Å²	110.9	71%	0.711	69%	0.688	S	S	*	*			trans	29	106.5	155	0	0	0	0	0	119.7	G763	G761-G763 PolarHBondContact O-N 3.46Å
762	G	25.6	Very low	38.5	Very low	91 Å²	91	108 Å²	108	94%	0.938	68%	0.681	S	S	*	*			trans	-64.7	114.1	171.7	0	0	0	0	0	113.4
763	G	27	Very low	41.4	Very low	60 Å²	60	101.3 Å²	101.3	62%	0.619	65%	0.645	S	S	*	*			trans	-79.1	172.3	159.7	0	0	0	0	0	112.2	G761 R765	G761-G763 PolarHBondContact O-N 3.46Å; G763-R765 PolarHBondContact O-N 2.73Å
764	P	29.9	Very low	44.4	Very low	129 Å²	129	97.6 Å²	97.6	84%	0.838	63%	0.625	S	S	*	*			trans	-61.7	132	168.4	28.1	-33.3	0	0	0	109.6	S766	P764-S766 PolarHBondContact O-N 3.01Å
765	R	35.2	Very low	47.4	Very low	203 Å²	203	93.7 Å²	93.7	77%	0.766	60%	0.601	S	S	*	*			trans	-61.8	98.2	177.4	-74.9	171.3	159.2	174.3	-15.9	109.6	G763 D1082	G763-R765 PolarHBondContact O-N 2.73Å; R765-D1082 IonicContact NH2-OD2 3.36Å; R765-D1082 PolarHBondContact NH2-OD2 3.05Å
766	S	35	Very low	50.3	Low	101 Å²	101	89.8 Å²	89.8	71%	0.706	58%	0.576	S	S	*	*	P	Polyproline II helix	trans	-67.7	165.2	173.7	49.7	0	0	0	0	111.5	P764 A768	P764-S766 PolarHBondContact O-N 3.01Å; S766-A768 PolarHBondContact O-N 3.26Å
767	D	42.1	Very low	53.3	Low	161 Å²	161	85.5 Å²	85.5	86%	0.861	54%	0.538	S	S	*	.	P	Polyproline II helix	trans	-54.2	138.2	-180	-62.6	-67.5	0	0	0	111.6	T769	D767-T769 PolarHBondContact O-N 3.37Å
768	A	47.1	Very low	56.1	Low	52 Å²	52	78 Å²	78	43%	0.43	50%	0.498	S	S	.	.	P	Polyproline II helix	trans	-67.6	128.8	-174.5	0	0	0	0	0	110.4	R738 S766	R738-A768 HydrophobicContact CG-CB 4.35Å; S766-A768 PolarHBondContact O-N 3.26Å
769	T	52.2	Low	59	Low	60 Å²	60	72.5 Å²	72.5	37%	0.368	46%	0.464	S	S	.	.	P	Polyproline II helix	trans	-49.6	133.2	158.4	40.2	0	0	0	0	109.2	C741 D767 I771	C741-T769 WeakPolarHBondContact CB-OG1 3.17Å; D767-T769 PolarHBondContact O-N 3.37Å; T769-I771 PolarHBondContact O-N 3.33Å
770	P	61.6	Low	61.7	Low	94 Å²	94	65.7 Å²	65.7	61%	0.61	42%	0.423	S	S	*	.	P	Polyproline II helix	trans	-61.5	126.9	179.4	25.8	-33.3	0	0	0	109.4
771	I	78.7	Confident	64.5	Low	7 Å²	7	59.7 Å²	59.7	4%	0.036	39%	0.386	C	S	.	.	P	Polyproline II helix	trans	-81.3	124.9	169.1	-73.4	153.6	0	0	0	106.8	L737 C741 T769 Y773 I1101 K1102 Y1160	L737-I771 HydrophobicContact CB-CD1 3.84Å; C741-I771 WeakPolarHBondContact SG-CG1 3.45Å; T769-I771 PolarHBondContact O-N 3.33Å; I771-Y773 HydrophobicContact CG2-CD2 4.07Å; I771-Y773 HydrophobicContact CG2-CE2 3.5Å; I771-Y773 VanDerWaalsContact CG2-CE2 3.5Å; I771-I1101 HydrophobicContact CD1-CD1 3.6Å; I771-K1102 WeakPolarHBondContact O-CG 3.37Å; I771-Y1160 HydrophobicContact CG2-CE2 4.31Å
772	D	86.2	Confident	67.5	Low	61 Å²	61	56.5 Å²	56.5	33%	0.326	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	162.7	177.3	-134.9	-43.3	0	0	0	110.7	K1102 Y1160 A1161	D772-K1102 WeakPolarHBondContact OD1-CE 3.23Å; D772-K1102 IonicContact OD1-NZ 2.73Å; D772-K1102 PolarHBondContact OD1-NZ 3.27Å; D772-K1102 IonicContact OD2-NZ 3.76Å; D772-K1102 PolarHBondContact OD2-NZ 3.18Å; D772-Y1160 WeakPolarHBondContact O-CD2 3.39Å; D772-A1161 HydrophobicContact CB-CB 4.23Å; D772-A1161 PolarHBondContact O-N 3.16Å
773	Y	91.3	Very high	70.4	Confident	7 Å²	7	52.5 Å²	52.5	3%	0.027	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	117.5	-175.8	-79.5	-92.2	0	0	0	110.2	I771 I1078 L1104 M1139 G1143 L1146 W1158 R1159	I771-Y773 HydrophobicContact CG2-CD2 4.07Å; I771-Y773 HydrophobicContact CG2-CE2 3.5Å; I771-Y773 VanDerWaalsContact CG2-CE2 3.5Å; Y773-I1078 HydrophobicContact CD2-CD1 3.84Å; Y773-I1078 HydrophobicContact CE2-CD1 3.75Å; Y773-L1104 HydrophobicContact CD2-CD1 4.46Å; Y773-L1104 HydrophobicContact CD2-CD2 4.41Å; Y773-L1104 HydrophobicContact CG-CD1 4.34Å; Y773-M1139 PolarHBondContact OH-SD 3.02Å; Y773-G1143 WeakPolarHBondContact CE1-O 3.49Å; Y773-G1143 PolarHBondContact OH-O 3.23Å; Y773-L1146 HydrophobicContact CD1-CB 4.2Å; Y773-L1146 HydrophobicContact CE1-CB 4.08Å; Y773-W1158 HydrophobicContact CD1-CB 4.24Å; Y773-R1159 CarbonylContact C-O 3.59Å; Y773-R1159 WeakPolarHBondContact CA-O 3.12Å; Y773-R1159 WeakPolarHBondContact CD1-O 3.45Å
774	D	89.8	Confident	73.2	Confident	57 Å²	57	55.4 Å²	55.4	31%	0.305	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	130.4	172.2	-63.4	-31.4	0	0	0	108.7	L776 W1158 R1159	D774-L776 PolarHBondContact O-N 2.86Å; D774-W1158 CarbonylContact O-C 3.55Å; D774-W1158 WeakPolarHBondContact O-CA 3.5Å; D774-W1158 WeakPolarHBondContact O-CB 3.15Å; D774-R1159 HydrophobicContact CB-CG 3.84Å; D774-R1159 PolarHBondContact N-O 2.82Å; D774-R1159 PolarHBondContact O-N 3.36Å; D774-R1159 IonicContact OD2-CZ 2.77Å; D774-R1159 IonicContact OD2-NE 3.63Å; D774-R1159 PolarHBondContact OD2-NE 2.74Å; D774-R1159 IonicContact OD2-NH2 3.2Å; D774-R1159 PolarHBondContact OD2-NH2 3.46Å
775	P	90.1	Very high	75.6	Confident	45 Å²	45	54.4 Å²	54.4	29%	0.292	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.7	134.7	165.8	32	-35	0	0	0	108.4	L33 F778 P1107 W1158	L33-P775 VanDerWaalsContact CD1-C 3.49Å; L33-P775 HydrophobicContact CD1-CB 3.69Å; L33-P775 HydrophobicContact CD1-CG 4.19Å; L33-P775 HydrophobicContact CD2-CB 3.98Å; L33-P775 HydrophobicContact CD2-CG 4.21Å; L33-P775 HydrophobicContact CG-CB 4.4Å; P775-F778 HydrophobicContact CB-CE2 3.85Å; P775-F778 HydrophobicContact CB-CZ 4.46Å; P775-P1107 HydrophobicContact CB-CG 4.29Å; P775-P1107 HydrophobicContact CG-CB 4.34Å; P775-W1158 HydrophobicContact CB-CG 4.47Å
776	L	90.1	Very high	77.5	Confident	40 Å²	40	48.2 Å²	48.2	21%	0.209	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	-57.2	-170	-175.5	66.2	0	0	0	112.3	D774 C827 Y1145 I1157 R1159	D774-L776 PolarHBondContact O-N 2.86Å; L776-C827 WeakPolarHBondContact CD2-O 3.46Å; L776-Y1145 HydrophobicContact CD2-CE1 3.99Å; L776-I1157 WeakPolarHBondContact CA-O 3.35Å; L776-I1157 WeakPolarHBondContact CB-O 3.34Å; L776-I1157 PolarHBondContact N-O 2.9Å; L776-R1159 HydrophobicContact CD2-CB 4.26Å
777	H	90.9	Very high	79.5	Confident	13 Å²	13	47.5 Å²	47.5	6%	0.06	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	128	-177.7	-57.5	-57.9	0	0	0	111.3	Q30 I779 C827 E828 T829 G830 C1156 I1157	Q30-H777 PolarHBondContact NE2-CE1 2.74Å; Q30-H777 VanDerWaalsContact NE2-CE1 3.33Å; Q30-H777 PolarHBondContact NE2-ND1 2.95Å; H777-I779 HydrophobicContact CB-CD1 4.04Å; H777-I779 HydrophobicContact CB-CG1 4.1Å; H777-C827 PolarHBondContact CD2-O 2.84Å; H777-E828 PolarHBondContact NE2-O 3.07Å; H777-T829 VanDerWaalsContact NE2-C 3.34Å; H777-G830 VanDerWaalsContact CD2-CA 3.42Å; H777-G830 WeakPolarHBondContact CD2-CA 3.16Å; H777-G830 PolarHBondContact CD2-N 2.94Å; H777-G830 VanDerWaalsContact CD2-N 3.34Å; H777-G830 PolarHBondContact NE2-N 3.46Å; H777-C1156 CarbonylContact O-C 3.52Å; H777-C1156 WeakPolarHBondContact O-CA 3.3Å; H777-I1157 HydrophobicContact CB-CB 4.22Å; H777-I1157 HydrophobicContact CB-CD1 4.45Å; H777-I1157 HydrophobicContact CB-CG1 4.5Å; H777-I1157 PolarHBondContact N-O 3.14Å; H777-I1157 VanDerWaalsContact N-O 3.07Å; H777-I1157 PolarHBondContact O-N 3.33Å
778	F	89.5	Confident	81	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	125.7	173.6	-83.1	-129.1	0	0	0	107.8	I31 L33 P775 W1106 P1107 C1109 V1155 C1156 W1158	I31-F778 HydrophobicContact CB-CB 4.08Å; I31-F778 WeakPolarHBondContact CB-O 3.4Å; I31-F778 HydrophobicContact CD1-CB 4.37Å; I31-F778 PolarHBondContact N-O 3.04Å; L33-F778 HydrophobicContact CD1-CD2 3.78Å; L33-F778 HydrophobicContact CD1-CE2 4.12Å; L33-F778 HydrophobicContact CD2-CD2 3.92Å; L33-F778 HydrophobicContact CD2-CE2 3.96Å; L33-F778 HydrophobicContact CD2-CG 4.31Å; L33-F778 HydrophobicContact CD2-CZ 4.34Å; L33-F778 HydrophobicContact CG-CD2 4.23Å; P775-F778 HydrophobicContact CB-CE2 3.85Å; P775-F778 HydrophobicContact CB-CZ 4.46Å; F778-W1106 HydrophobicContact CD1-CH2 4.11Å; F778-W1106 HydrophobicContact CD1-CZ2 4.17Å; F778-W1106 HydrophobicContact CE1-CD2 4.47Å; F778-W1106 HydrophobicContact CE1-CE3 4.26Å; F778-W1106 AromaticContact CE1-CH2 3.52Å; F778-W1106 HydrophobicContact CE1-CH2 3.52Å; F778-W1106 AromaticContact CE1-CZ2 3.69Å; F778-W1106 HydrophobicContact CE1-CZ2 3.69Å; F778-W1106 AromaticContact CE1-CZ3 3.81Å; F778-W1106 HydrophobicContact CE1-CZ3 3.81Å; F778-W1106 HydrophobicContact CZ-CH2 4.48Å; F778-W1106 HydrophobicContact CZ-CZ3 4.37Å; F778-P1107 HydrophobicContact CE1-CG 3.77Å; F778-P1107 HydrophobicContact CE2-CG 4.13Å; F778-P1107 HydrophobicContact CZ-CG 3.41Å; F778-P1107 VanDerWaalsContact CZ-CG 3.41Å; F778-C1109 WeakPolarHBondContact CD1-SG 3.47Å; F778-V1155 CarbonylContact C-O 3.52Å; F778-C1156 HydrophobicContact CD1-CB 4.21Å; F778-C1156 WeakPolarHBondContact CD1-SG 3.01Å; F778-C1156 HydrophobicContact CD2-CB 4.18Å; F778-C1156 HydrophobicContact CE1-CB 3.98Å; F778-C1156 WeakPolarHBondContact CE1-SG 3.14Å; F778-C1156 HydrophobicContact CE2-CB 3.92Å; F778-C1156 HydrophobicContact CG-CB 4.3Å; F778-C1156 HydrophobicContact CZ-CB 3.81Å; F778-W1158 HydrophobicContact CE2-CZ2 4.19Å; F778-W1158 HydrophobicContact CZ-CH2 4.08Å; F778-W1158 AromaticContact CZ-CZ2 3.68Å; F778-W1158 HydrophobicContact CZ-CZ2 3.68Å
779	I	89	Confident	82.4	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	124.7	-157.8	-45.1	175.6	0	0	0	111.4	V28 V29 H777 C781 I825 G830 V1155 I1157	V28-I779 HydrophobicContact CG1-CG2 3.28Å; V29-I779 WeakPolarHBondContact O-CA 3.21Å; H777-I779 HydrophobicContact CB-CD1 4.04Å; H777-I779 HydrophobicContact CB-CG1 4.1Å; I779-C781 HydrophobicContact CG2-CB 3.81Å; I779-C781 PolarHBondContact O-N 3.44Å; I779-I825 HydrophobicContact CD1-CD1 4.26Å; I779-I825 HydrophobicContact CD1-CG2 3.86Å; I779-G830 WeakPolarHBondContact CD1-O 3.46Å; I779-V1155 HydrophobicContact CB-CB 4.46Å; I779-V1155 PolarHBondContact N-O 3.18Å; I779-V1155 PolarHBondContact O-N 2.63Å; I779-I1157 HydrophobicContact CD1-CD1 4.13Å
780	R	87.5	Confident	83.9	Confident	3 Å²	3	37.1 Å²	37.1	1%	0.011	21%	0.206	C	C	.	.			trans	-90.8	61.9	171.5	-72.4	-174.6	-173.5	-74.5	-8.2	112.1	V29 I31 A783 A788 D790 I1125 G1128 F1129 N1152 N1153 L1154	V29-R780 PolarHBondContact O-N 3.15Å; V29-R780 VanDerWaalsContact O-N 3.11Å; I31-R780 HydrophobicContact CD1-CG 4.34Å; R780-A783 WeakPolarHBondContact O-CB 3.41Å; R780-A788 VanDerWaalsContact CD-O 3.25Å; R780-A788 WeakPolarHBondContact CD-O 3.28Å; R780-D790 PolarHBondContact NH1-O 3.42Å; R780-I1125 PolarHBondContact NH2-O 3.28Å; R780-G1128 PolarHBondContact NH2-O 3.1Å; R780-F1129 VanDerWaalsContact NH2-CE1 3.34Å; R780-N1152 PolarHBondContact NH1-O 3.37Å; R780-N1153 WeakPolarHBondContact CA-O 3.38Å; R780-L1154 HydrophobicContact CG-CD2 3.74Å
781	C	87.5	Confident	85	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.8	-10	-171.6	66.9	0	0	0	0	116.2	V28 I779 A783 C823 V832 R835 V1155	V28-C781 HydrophobicContact CG1-CB 4.25Å; I779-C781 HydrophobicContact CG2-CB 3.81Å; I779-C781 PolarHBondContact O-N 3.44Å; C781-A783 VanDerWaalsContact C-N 3.33Å; C781-C823 PolarHBondContact O-SG 3.25Å; C781-V832 HydrophobicContact CB-CG2 3.53Å; C781-R835 PolarHBondContact O-NE 3.21Å; C781-R835 PolarHBondContact O-NH1 3.43Å; C781-V1155 WeakPolarHBondContact SG-CG2 3.3Å
782	H	92	Very high	85.5	Confident	3 Å²	3	42.7 Å²	42.7	1%	0.014	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.5	4	173.3	-70.9	-94.6	0	0	0	112.7	K784 T793 V795 T816 G818 C821 N1153	H782-K784 PolarHBondContact O-N 2.62Å; H782-T793 HydrophobicContact CB-CG2 3.92Å; H782-V795 HydrophobicContact CB-CG2 3.78Å; H782-T816 PolarHBondContact CE1-O 3.26Å; H782-T816 WeakPolarHBondContact NE2-CB 3.37Å; H782-T816 PolarHBondContact NE2-OG1 3.38Å; H782-G818 PolarHBondContact CE1-N 3.3Å; H782-G818 PolarHBondContact ND1-N 2.8Å; H782-G818 PolarHBondContact ND1-O 2.88Å; H782-C821 PolarHBondContact CE1-O 3.45Å; H782-C821 PolarHBondContact ND1-O 3.2Å; H782-C821 VanDerWaalsContact ND1-O 3.11Å; H782-N1153 VanDerWaalsContact C-OD1 3.31Å; H782-N1153 WeakPolarHBondContact CA-OD1 3.38Å; H782-N1153 WeakPolarHBondContact CB-OD1 3.18Å; H782-N1153 PolarHBondContact N-OD1 3.2Å; H782-N1153 VanDerWaalsContact N-OD1 3.15Å
783	A	86	Confident	85.7	Confident	6 Å²	6	40.8 Å²	40.8	5%	0.05	22%	0.219	C	C	.	.			trans	-42.8	120.4	-179.4	0	0	0	0	0	113	R780 C781 D785 N786 D787 D790 N1153	R780-A783 WeakPolarHBondContact O-CB 3.41Å; C781-A783 VanDerWaalsContact C-N 3.33Å; A783-D785 PolarHBondContact O-N 2.99Å; A783-N786 PolarHBondContact O-N 2.75Å; A783-D787 VanDerWaalsContact CB-O 3.3Å; A783-D787 WeakPolarHBondContact CB-O 3.27Å; A783-D790 WeakPolarHBondContact CA-OD2 3.39Å; A783-D790 HydrophobicContact CB-CB 4.29Å; A783-N1153 VanDerWaalsContact CA-ND2 3.31Å; A783-N1153 WeakPolarHBondContact CA-ND2 3.31Å; A783-N1153 PolarHBondContact N-ND2 2.82Å; A783-N1153 PolarHBondContact N-OD1 3.1Å
784	K	84.7	Confident	85.9	Confident	121 Å²	121	44 Å²	44	53%	0.526	23%	0.234	S	C	.	.	G	3₁₀ helix	trans	-60.3	128.4	172.1	-174.1	177.8	177.4	-174.4	0	108.8	H782 N786 D787 D790	H782-K784 PolarHBondContact O-N 2.62Å; K784-N786 PolarHBondContact O-N 3.17Å; K784-D787 PolarHBondContact O-N 3.49Å; K784-D790 PolarHBondContact N-OD2 3.08Å
785	D	80.7	Confident	86.2	Confident	109 Å²	109	41.3 Å²	41.3	58%	0.583	22%	0.219	S	C	*	.	G	3₁₀ helix	trans	50.4	29.8	178.3	-51.5	-35.1	0	0	0	114.1	A783 D787 K837	A783-D785 PolarHBondContact O-N 2.99Å; D785-D787 VanDerWaalsContact C-N 3.29Å; D785-D787 PolarHBondContact O-N 3.46Å; D785-K837 IonicContact OD1-NZ 3.76Å; D785-K837 PolarHBondContact OD1-NZ 2.83Å
786	N	76.1	Confident	86.5	Confident	72 Å²	72	41.2 Å²	41.2	39%	0.385	21%	0.213	S	C	.	.	G	3₁₀ helix	trans	62.4	19.7	-176.9	-67.4	-14.1	0	0	0	115.9	D27 A783 K784 A788 R835	D27-N786 HydrophobicContact CB-CB 4.45Å; D27-N786 VanDerWaalsContact CB-ND2 3.35Å; D27-N786 WeakPolarHBondContact CB-ND2 3.48Å; D27-N786 PolarHBondContact OD2-ND2 3.41Å; A783-N786 PolarHBondContact O-N 2.75Å; K784-N786 PolarHBondContact O-N 3.17Å; N786-A788 PolarHBondContact O-N 3.24Å; N786-R835 PolarHBondContact OD1-NH1 3.27Å
787	D	77.3	Confident	86.9	Confident	87 Å²	87	41 Å²	41	47%	0.465	21%	0.209	S	C	.	.			trans	-65.1	120.5	177.1	-179.1	18.8	0	0	0	112.7	A783 K784 D785 G789 D790	A783-D787 VanDerWaalsContact CB-O 3.3Å; A783-D787 WeakPolarHBondContact CB-O 3.27Å; K784-D787 PolarHBondContact O-N 3.49Å; D785-D787 VanDerWaalsContact C-N 3.29Å; D785-D787 PolarHBondContact O-N 3.46Å; D787-G789 PolarHBondContact O-N 3.13Å; D787-G789 PolarHBondContact OD1-N 3.04Å; D787-D790 HydrophobicContact CB-CB 4.35Å; D787-D790 WeakPolarHBondContact O-CB 3.37Å; D787-D790 PolarHBondContact O-N 3.29Å; D787-D790 PolarHBondContact OD2-N 2.93Å
788	A	73.8	Confident	87.2	Confident	29 Å²	29	40.4 Å²	40.4	24%	0.24	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-27.5	173.5	0	0	0	0	0	112.9	V29 R780 N786 I1125	V29-A788 HydrophobicContact CG2-CB 3.72Å; R780-A788 VanDerWaalsContact CD-O 3.25Å; R780-A788 WeakPolarHBondContact CD-O 3.28Å; N786-A788 PolarHBondContact O-N 3.24Å; A788-I1125 HydrophobicContact CB-CD1 4.24Å
789	G	74.9	Confident	87.6	Confident	11 Å²	11	42.8 Å²	42.8	11%	0.113	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.7	-15.3	176.8	0	0	0	0	0	115	D787 S791	D787-G789 PolarHBondContact O-N 3.13Å; D787-G789 PolarHBondContact OD1-N 3.04Å; G789-S791 PolarHBondContact O-N 3.45Å
790	D	84.4	Confident	88	Confident	14 Å²	14	43.1 Å²	43.1	8%	0.075	22%	0.221	C	C	.	.			trans	-63.1	107.7	-173.2	-179.9	3.5	0	0	0	111.6	R780 A783 K784 D787 E792 T793 N1153	R780-D790 PolarHBondContact NH1-O 3.42Å; A783-D790 WeakPolarHBondContact CA-OD2 3.39Å; A783-D790 HydrophobicContact CB-CB 4.29Å; K784-D790 PolarHBondContact N-OD2 3.08Å; D787-D790 HydrophobicContact CB-CB 4.35Å; D787-D790 WeakPolarHBondContact O-CB 3.37Å; D787-D790 PolarHBondContact O-N 3.29Å; D787-D790 PolarHBondContact OD2-N 2.93Å; D790-E792 PolarHBondContact OD1-N 2.91Å; D790-T793 PolarHBondContact OD1-N 2.71Å; D790-T793 PolarHBondContact OD1-OG1 3.11Å; D790-T793 WeakPolarHBondContact OD2-CB 3.5Å; D790-T793 PolarHBondContact OD2-OG1 2.87Å; D790-N1153 WeakPolarHBondContact O-CB 3.42Å; D790-N1153 PolarHBondContact O-ND2 3.06Å
791	S	84.4	Confident	88.5	Confident	44 Å²	44	44.8 Å²	44.8	31%	0.308	23%	0.228	S	C	.	.			trans	-117.4	12.5	167.2	69.3	0	0	0	0	112.8	G789 N1152	G789-S791 PolarHBondContact O-N 3.45Å; S791-N1152 WeakPolarHBondContact O-CA 3.37Å
792	E	88.7	Confident	88.9	Confident	174 Å²	174	45.9 Å²	45.9	81%	0.813	24%	0.236	S	C	*	.	S	Bend	trans	-93.6	-34.2	176.9	-64.1	-162.9	159.3	0	0	111.8	D790 K794	D790-E792 PolarHBondContact OD1-N 2.91Å; E792-K794 PolarHBondContact O-N 3.39Å
793	T	91.9	Very high	89	Confident	21 Å²	21	46.6 Å²	46.6	13%	0.129	24%	0.24	C	C	.	.			trans	-66	116.3	-179.1	-65.4	0	0	0	0	111.5	H782 D790 N1153	H782-T793 HydrophobicContact CB-CG2 3.92Å; D790-T793 PolarHBondContact OD1-N 2.71Å; D790-T793 PolarHBondContact OD1-OG1 3.11Å; D790-T793 WeakPolarHBondContact OD2-CB 3.5Å; D790-T793 PolarHBondContact OD2-OG1 2.87Å; T793-N1153 WeakPolarHBondContact O-CA 3.24Å; T793-N1153 WeakPolarHBondContact O-CB 3.33Å; T793-N1153 PolarHBondContact O-N 3.42Å
794	K	94.3	Very high	89.2	Confident	75 Å²	75	47.7 Å²	47.7	33%	0.326	25%	0.246	S	C	.	.			trans	-85.7	133.3	179.5	-51.3	-155.7	167.9	-66.1	0	111	E792 W796 G818 G819 D1151	E792-K794 PolarHBondContact O-N 3.39Å; K794-W796 HydrophobicContact CB-CD2 4.27Å; K794-W796 HydrophobicContact CB-CH2 4.06Å; K794-W796 HydrophobicContact CB-CZ2 3.53Å; K794-W796 HydrophobicContact CD-CH2 3.71Å; K794-W796 HydrophobicContact CD-CZ2 3.85Å; K794-W796 HydrophobicContact CG-CH2 4.42Å; K794-W796 HydrophobicContact CG-CZ2 4.11Å; K794-W796 PolarHBondContact O-NE1 3.12Å; K794-G818 WeakPolarHBondContact O-CA 3.44Å; K794-G819 PolarHBondContact O-N 2.96Å; K794-D1151 HydrophobicContact CD-CB 3.99Å; K794-D1151 HydrophobicContact CG-CB 4.36Å; K794-D1151 WeakPolarHBondContact CG-O 3.34Å; K794-D1151 PolarHBondContact NZ-O 3.48Å; K794-D1151 IonicContact NZ-OD2 2.68Å; K794-D1151 PolarHBondContact NZ-OD2 2.99Å
795	V	97	Very high	89.3	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	117.6	176.7	-169.3	0	0	0	0	108.4	H782 C817 N1135 V1149 T1150 V1155	H782-V795 HydrophobicContact CB-CG2 3.78Å; V795-C817 CarbonylContact C-O 3.42Å; V795-C817 WeakPolarHBondContact CA-O 3.44Å; V795-C817 VanDerWaalsContact CG1-O 3.31Å; V795-C817 WeakPolarHBondContact CG1-O 3.26Å; V795-N1135 PolarHBondContact O-ND2 3.3Å; V795-V1149 HydrophobicContact CB-CB 3.93Å; V795-V1149 HydrophobicContact CB-CG1 4.4Å; V795-V1149 HydrophobicContact CG1-CB 3.62Å; V795-V1149 HydrophobicContact CG1-CG1 3.62Å; V795-V1149 HydrophobicContact CG1-CG2 4.24Å; V795-T1150 PolarHBondContact N-O 3.38Å; V795-V1155 HydrophobicContact CG1-CG2 4.41Å
796	W	96.8	Very high	89.6	Confident	43 Å²	43	47.7 Å²	47.7	16%	0.163	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	-36.1	-157.5	-64.3	107.5	0	0	0	114.2	K794 C817 Y844 Y1055	K794-W796 HydrophobicContact CB-CD2 4.27Å; K794-W796 HydrophobicContact CB-CH2 4.06Å; K794-W796 HydrophobicContact CB-CZ2 3.53Å; K794-W796 HydrophobicContact CD-CH2 3.71Å; K794-W796 HydrophobicContact CD-CZ2 3.85Å; K794-W796 HydrophobicContact CG-CH2 4.42Å; K794-W796 HydrophobicContact CG-CZ2 4.11Å; K794-W796 PolarHBondContact O-NE1 3.12Å; W796-C817 PolarHBondContact N-O 2.6Å; W796-Y844 WeakPolarHBondContact CB-O 3.11Å; W796-Y844 AromaticContact CD1-CD1 3.82Å; W796-Y844 HydrophobicContact CD2-CD1 4.5Å; W796-Y844 HydrophobicContact CG-CD1 4.34Å; W796-Y844 AromaticContact NE1-CD1 3.6Å; W796-Y844 AromaticContact NE1-CE1 3.97Å; W796-Y1055 AromaticContact CZ3-CD1 3.97Å; W796-Y1055 HydrophobicContact CZ3-CD1 3.97Å; W796-Y1055 HydrophobicContact CZ3-CD2 4.33Å; W796-Y1055 AromaticContact CZ3-CG 3.81Å; W796-Y1055 HydrophobicContact CZ3-CG 3.81Å
797	R	97.3	Very high	89.9	Confident	35 Å²	35	48.2 Å²	48.2	13%	0.132	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	147.6	-176.8	-63.5	-65.7	176.8	-108.8	7.8	111.4	T816 C817 Y844 I846 N1135	R797-T816 WeakPolarHBondContact O-CA 3.35Å; R797-C817 PolarHBondContact O-N 2.94Å; R797-C817 VanDerWaalsContact O-N 3.13Å; R797-Y844 WeakPolarHBondContact CG-O 3.27Å; R797-I846 HydrophobicContact CB-CG1 4.04Å; R797-N1135 PolarHBondContact NH1-O 3.03Å
798	C	97.9	Very high	90.1	Very high	1 Å²	1	49 Å²	49	1%	0.007	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	135.7	174.1	56.9	0	0	0	0	110.2	V814 A815 T816 S1136 V1149	C798-V814 HydrophobicContact CB-CG2 4.23Å; C798-A815 CarbonylContact C-O 3.45Å; C798-A815 WeakPolarHBondContact CA-O 3.27Å; C798-T816 HydrophobicContact CB-CG2 3.96Å; C798-S1136 PolarHBondContact SG-OG 2.93Å; C798-S1136 VanDerWaalsContact SG-OG 3.42Å; C798-V1149 HydrophobicContact CB-CG1 3.81Å; C798-V1149 HydrophobicContact CB-CG2 4.05Å
799	L	97.9	Very high	91	Very high	50 Å²	50	50.7 Å²	50.7	26%	0.262	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	124.8	178.3	-68.9	176.9	0	0	0	111.5	A815 I846 W848	L799-A815 PolarHBondContact N-O 3.26Å; L799-A815 WeakPolarHBondContact O-CB 3.25Å; L799-A815 PolarHBondContact O-N 3.04Å; L799-I846 HydrophobicContact CB-CD1 4.39Å; L799-I846 HydrophobicContact CD1-CG1 4.31Å; L799-I846 VanDerWaalsContact CD1-O 3.31Å; L799-I846 WeakPolarHBondContact CD1-O 3.31Å; L799-W848 PolarHBondContact O-NE1 3.42Å
800	F	97.6	Very high	91.9	Very high	8 Å²	8	50.7 Å²	50.7	4%	0.035	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.2	141.1	171.7	-80.7	-94.4	0	0	0	111.9	T810 V813 V814 C827 W848 E1138 A1147	F800-T810 HydrophobicContact CB-CG2 3.77Å; F800-V813 WeakPolarHBondContact CA-O 3.21Å; F800-V814 HydrophobicContact CD1-CB 4.38Å; F800-V814 HydrophobicContact CD2-CG2 4.36Å; F800-V814 HydrophobicContact CE1-CB 4.38Å; F800-V814 HydrophobicContact CE2-CG2 4.47Å; F800-V814 HydrophobicContact CG-CB 4.5Å; F800-V814 HydrophobicContact CZ-CB 4.49Å; F800-C827 VanDerWaalsContact CE1-SG 3.5Å; F800-W848 PolarHBondContact O-NE1 3.16Å; F800-E1138 HydrophobicContact CD2-CB 4.31Å; F800-E1138 HydrophobicContact CD2-CG 3.91Å; F800-A1147 HydrophobicContact CE2-CB 3.88Å; F800-A1147 HydrophobicContact CZ-CB 4.1Å
801	E	97.1	Very high	92.4	Very high	37 Å²	37	51.4 Å²	51.4	17%	0.173	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	128.1	178.3	176.8	-171.4	-145.5	0	0	111.2	T810 T811 V813 W848 N860	E801-T810 CarbonylContact O-C 3.56Å; E801-T810 WeakPolarHBondContact O-CA 3.3Å; E801-T810 WeakPolarHBondContact O-CB 3.39Å; E801-T810 VanDerWaalsContact O-CG2 3.3Å; E801-T810 WeakPolarHBondContact O-CG2 3.38Å; E801-T811 HydrophobicContact CG-CG2 4.36Å; E801-T811 PolarHBondContact O-N 3.35Å; E801-T811 WeakPolarHBondContact OE2-CG2 3.19Å; E801-T811 PolarHBondContact OE2-OG1 3.06Å; E801-V813 HydrophobicContact CB-CB 4.2Å; E801-V813 PolarHBondContact N-O 2.96Å; E801-W848 HydrophobicContact CB-CH2 4.09Å; E801-W848 HydrophobicContact CB-CZ2 3.62Å; E801-W848 HydrophobicContact CG-CH2 3.86Å; E801-W848 HydrophobicContact CG-CZ2 3.92Å; E801-W848 HydrophobicContact CG-CZ3 4.24Å; E801-N860 VanDerWaalsContact CD-ND2 3.33Å; E801-N860 WeakPolarHBondContact CG-ND2 3.24Å; E801-N860 PolarHBondContact OE1-ND2 3.35Å
802	P	95.7	Very high	92.8	Very high	23 Å²	23	51.8 Å²	51.8	15%	0.149	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	140.5	175	28.8	-34.2	0	0	0	111.4	P804 W848 N860	P802-P804 VanDerWaalsContact O-CD 3.26Å; P802-P804 WeakPolarHBondContact O-CD 3.4Å; P802-W848 HydrophobicContact CG-CB 4.05Å; P802-W848 HydrophobicContact CG-CG 4.45Å; P802-N860 PolarHBondContact O-ND2 3.2Å
803	N	93.8	Very high	93.2	Very high	18 Å²	18	44.2 Å²	44.2	10%	0.096	22%	0.222	C	C	.	.			trans	-73	114.5	176.9	177.5	-16.9	0	0	0	109.5	M805 R806 E809 T811	N803-M805 PolarHBondContact O-N 2.58Å; N803-M805 PolarHBondContact OD1-N 2.91Å; N803-R806 HydrophobicContact CB-CB 4.43Å; N803-R806 CarbonylContact O-C 3.54Å; N803-R806 PolarHBondContact O-N 3Å; N803-R806 PolarHBondContact OD1-N 3.1Å; N803-E809 HydrophobicContact CB-CB 4.01Å; N803-E809 WeakPolarHBondContact CB-O 3.48Å; N803-E809 PolarHBondContact N-O 2.67Å; N803-E809 PolarHBondContact ND2-OE2 2.89Å; N803-T811 HydrophobicContact CB-CG2 4.46Å
804	P	90.6	Very high	93.4	Very high	29 Å²	29	43.2 Å²	43.2	19%	0.188	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-28.7	-174.8	-23	32.5	0	0	0	113.8	P802 T850 R858	P802-P804 VanDerWaalsContact O-CD 3.26Å; P802-P804 WeakPolarHBondContact O-CD 3.4Å; P804-T850 HydrophobicContact CB-CG2 4.17Å; P804-R858 HydrophobicContact CB-CB 3.93Å; P804-R858 WeakPolarHBondContact O-CD 3.34Å
805	M	88.1	Confident	93.6	Very high	151 Å²	151	39.6 Å²	39.6	74%	0.744	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89	-18.6	-177.8	-58.7	-56.8	-68.3	0	0	112.8	N803	N803-M805 PolarHBondContact O-N 2.58Å; N803-M805 PolarHBondContact OD1-N 2.91Å
806	R	86.8	Confident	93.7	Very high	80 Å²	80	39.6 Å²	39.6	30%	0.302	20%	0.201	S	C	.	.			trans	-141.4	86.7	-178.5	-60.3	-179.7	-164.1	147.9	-1	109.7	N803 D808 E809	N803-R806 HydrophobicContact CB-CB 4.43Å; N803-R806 CarbonylContact O-C 3.54Å; N803-R806 PolarHBondContact O-N 3Å; N803-R806 PolarHBondContact OD1-N 3.1Å; R806-D808 PolarHBondContact O-N 2.88Å; R806-E809 HydrophobicContact CB-CB 4.17Å; R806-E809 HydrophobicContact CB-CG 4.29Å; R806-E809 WeakPolarHBondContact CD-OE1 3.35Å; R806-E809 WeakPolarHBondContact CD-OE2 3.31Å; R806-E809 IonicContact CZ-OE2 3.21Å; R806-E809 IonicContact NE-OE1 2.73Å; R806-E809 IonicContact NE-OE2 2.69Å; R806-E809 IonicContact NH1-OE1 3.49Å; R806-E809 IonicContact NH1-OE2 2.64Å; R806-E809 PolarHBondContact NH1-OE2 3.2Å; R806-E809 PolarHBondContact O-N 3.43Å
807	P	81.4	Confident	93.7	Very high	82 Å²	82	37.6 Å²	37.6	53%	0.532	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-15.6	-171.8	-27.3	36.6	0	0	0	116.7	E809	P807-E809 VanDerWaalsContact C-N 3.31Å
808	D	82.4	Confident	93.7	Very high	104 Å²	104	35.9 Å²	35.9	56%	0.556	19%	0.187	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.2	-6.4	173.9	-61.6	-29.1	0	0	0	112.8	R806	R806-D808 PolarHBondContact O-N 2.88Å
809	E	91.6	Very high	93.5	Very high	64 Å²	64	36.5 Å²	36.5	30%	0.299	19%	0.193	S	C	.	.			trans	-113.7	159.1	179.9	-69.7	173.1	-152.4	0	0	111.9	N803 R806 P807 S1141	N803-E809 HydrophobicContact CB-CB 4.01Å; N803-E809 WeakPolarHBondContact CB-O 3.48Å; N803-E809 PolarHBondContact N-O 2.67Å; N803-E809 PolarHBondContact ND2-OE2 2.89Å; R806-E809 HydrophobicContact CB-CB 4.17Å; R806-E809 HydrophobicContact CB-CG 4.29Å; R806-E809 WeakPolarHBondContact CD-OE1 3.35Å; R806-E809 WeakPolarHBondContact CD-OE2 3.31Å; R806-E809 IonicContact CZ-OE2 3.21Å; R806-E809 IonicContact NE-OE1 2.73Å; R806-E809 IonicContact NE-OE2 2.69Å; R806-E809 IonicContact NH1-OE1 3.49Å; R806-E809 IonicContact NH1-OE2 2.64Å; R806-E809 PolarHBondContact NH1-OE2 3.2Å; R806-E809 PolarHBondContact O-N 3.43Å; P807-E809 VanDerWaalsContact C-N 3.31Å; E809-S1141 WeakPolarHBondContact CA-OG 3.34Å
810	T	94.9	Very high	93.3	Very high	11 Å²	11	35.9 Å²	35.9	7%	0.067	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	161.1	164.8	49.4	0	0	0	0	111.5	F800 E801 R1061 S1141	F800-T810 HydrophobicContact CB-CG2 3.77Å; E801-T810 CarbonylContact O-C 3.56Å; E801-T810 WeakPolarHBondContact O-CA 3.3Å; E801-T810 WeakPolarHBondContact O-CB 3.39Å; E801-T810 VanDerWaalsContact O-CG2 3.3Å; E801-T810 WeakPolarHBondContact O-CG2 3.38Å; T810-R1061 PolarHBondContact OG1-NH2 3.21Å; T810-S1141 PolarHBondContact N-OG 2.78Å; T810-S1141 PolarHBondContact OG1-N 3.28Å; T810-S1141 PolarHBondContact OG1-OG 2.68Å
811	T	94.7	Very high	93.1	Very high	30 Å²	30	35.7 Å²	35.7	18%	0.184	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	179	166.2	76.4	0	0	0	0	110.1	E801 N803 V813	E801-T811 HydrophobicContact CG-CG2 4.36Å; E801-T811 PolarHBondContact O-N 3.35Å; E801-T811 WeakPolarHBondContact OE2-CG2 3.19Å; E801-T811 PolarHBondContact OE2-OG1 3.06Å; N803-T811 HydrophobicContact CB-CG2 4.46Å; T811-V813 PolarHBondContact O-N 2.97Å; T811-V813 WeakPolarHBondContact OG1-CB 3.41Å; T811-V813 PolarHBondContact OG1-N 3.17Å; T811-V813 VanDerWaalsContact OG1-N 3.11Å
812	H	92.8	Very high	93.1	Very high	52 Å²	52	33.9 Å²	33.9	24%	0.241	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	16.8	170.2	-50.5	-44.3	0	0	0	112.8	C827 D1142 Y1145	H812-C827 WeakPolarHBondContact O-CB 3.46Å; H812-C827 PolarHBondContact O-N 2.77Å; H812-C827 PolarHBondContact O-SG 2.78Å; H812-D1142 IonicContact CE1-OD2 2.74Å; H812-Y1145 HydrophobicContact CB-CD2 4.19Å; H812-Y1145 HydrophobicContact CB-CE2 3.94Å; H812-Y1145 AromaticContact CG-CE2 3.77Å; H812-Y1145 AromaticContact ND1-CD2 3.8Å; H812-Y1145 AromaticContact ND1-CE2 3.71Å
813	V	96.1	Very high	93.1	Very high	14 Å²	14	32.8 Å²	32.8	9%	0.085	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	130.1	177.1	-173.7	0	0	0	0	110	F800 E801 T811 L824 I825 M833	F800-V813 WeakPolarHBondContact CA-O 3.21Å; E801-V813 HydrophobicContact CB-CB 4.2Å; E801-V813 PolarHBondContact N-O 2.96Å; T811-V813 PolarHBondContact O-N 2.97Å; T811-V813 WeakPolarHBondContact OG1-CB 3.41Å; T811-V813 PolarHBondContact OG1-N 3.17Å; T811-V813 VanDerWaalsContact OG1-N 3.11Å; V813-L824 HydrophobicContact CG1-CB 4.06Å; V813-I825 CarbonylContact C-O 3.51Å; V813-I825 VanDerWaalsContact CA-O 3.3Å; V813-I825 WeakPolarHBondContact CA-O 3.27Å; V813-M833 HydrophobicContact CB-SD 4.48Å; V813-M833 HydrophobicContact CG1-SD 3.98Å; V813-M833 HydrophobicContact CG2-CE 4.38Å; V813-M833 HydrophobicContact CG2-SD 3.64Å
814	V	97.7	Very high	93.2	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	136	172	66	0	0	0	0	110.6	C798 F800 T816 L824 I825 A1147	C798-V814 HydrophobicContact CB-CG2 4.23Å; F800-V814 HydrophobicContact CD1-CB 4.38Å; F800-V814 HydrophobicContact CD2-CG2 4.36Å; F800-V814 HydrophobicContact CE1-CB 4.38Å; F800-V814 HydrophobicContact CE2-CG2 4.47Å; F800-V814 HydrophobicContact CG-CB 4.5Å; F800-V814 HydrophobicContact CZ-CB 4.49Å; V814-T816 HydrophobicContact CG2-CG2 4.48Å; V814-L824 CarbonylContact O-C 3.58Å; V814-L824 WeakPolarHBondContact O-CA 3.09Å; V814-I825 HydrophobicContact CG1-CB 3.99Å; V814-I825 PolarHBondContact N-O 3.1Å; V814-I825 PolarHBondContact O-N 3.48Å; V814-A1147 HydrophobicContact CB-CB 4.41Å; V814-A1147 HydrophobicContact CG1-CB 4.34Å; V814-A1147 HydrophobicContact CG2-CB 3.95Å
815	A	98	Very high	93.4	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	139.6	167.6	0	0	0	0	0	110.5	C798 L799 C823 L824 I846 W848 L862	C798-A815 CarbonylContact C-O 3.45Å; C798-A815 WeakPolarHBondContact CA-O 3.27Å; L799-A815 PolarHBondContact N-O 3.26Å; L799-A815 WeakPolarHBondContact O-CB 3.25Å; L799-A815 PolarHBondContact O-N 3.04Å; A815-C823 CarbonylContact C-O 3.57Å; A815-C823 WeakPolarHBondContact CA-O 3.12Å; A815-L824 HydrophobicContact CB-CD2 3.43Å; A815-L824 VanDerWaalsContact CB-CD2 3.43Å; A815-I846 HydrophobicContact CB-CD1 3.83Å; A815-W848 HydrophobicContact CB-CZ2 3.76Å; A815-L862 HydrophobicContact CB-CD2 4.11Å
816	T	98.2	Very high	93.7	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	148.6	174.2	56.8	0	0	0	0	111.1	H782 R797 C798 V814 V822 C823 V1149 V1155	H782-T816 PolarHBondContact CE1-O 3.26Å; H782-T816 WeakPolarHBondContact NE2-CB 3.37Å; H782-T816 PolarHBondContact NE2-OG1 3.38Å; R797-T816 WeakPolarHBondContact O-CA 3.35Å; C798-T816 HydrophobicContact CB-CG2 3.96Å; V814-T816 HydrophobicContact CG2-CG2 4.48Å; T816-V822 CarbonylContact O-C 3.44Å; T816-V822 WeakPolarHBondContact O-CA 3.03Å; T816-C823 PolarHBondContact N-O 2.93Å; T816-C823 PolarHBondContact O-N 3.48Å; T816-V1149 HydrophobicContact CG2-CG1 3.59Å; T816-V1155 HydrophobicContact CG2-CG1 3.79Å; T816-V1155 HydrophobicContact CG2-CG2 4.08Å
817	C	97.5	Very high	94	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	138.2	176.6	75.5	0	0	0	0	112.6	V795 W796 R797 V822 F843 I846	V795-C817 CarbonylContact C-O 3.42Å; V795-C817 WeakPolarHBondContact CA-O 3.44Å; V795-C817 VanDerWaalsContact CG1-O 3.31Å; V795-C817 WeakPolarHBondContact CG1-O 3.26Å; W796-C817 PolarHBondContact N-O 2.6Å; R797-C817 PolarHBondContact O-N 2.94Å; R797-C817 VanDerWaalsContact O-N 3.13Å; C817-V822 HydrophobicContact CB-CG2 4.13Å; C817-F843 CarbonylContact C-O 3.52Å; C817-F843 HydrophobicContact CB-CB 3.82Å; C817-F843 PolarHBondContact SG-O 2.71Å; C817-F843 VanDerWaalsContact SG-O 3.32Å; C817-I846 HydrophobicContact CB-CG1 4.38Å; C817-I846 HydrophobicContact CB-CG2 3.65Å
818	G	96.2	Very high	94.5	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	178.3	140.1	-174.2	0	0	0	0	0	111.5	H782 K794 C821	H782-G818 PolarHBondContact CE1-N 3.3Å; H782-G818 PolarHBondContact ND1-N 2.8Å; H782-G818 PolarHBondContact ND1-O 2.88Å; K794-G818 WeakPolarHBondContact O-CA 3.44Å; G818-C821 PolarHBondContact N-O 3.17Å; G818-C821 VanDerWaalsContact N-O 3.1Å; G818-C821 PolarHBondContact O-N 2.95Å; G818-C821 VanDerWaalsContact O-N 3.13Å
819	G	94.3	Very high	94.8	Very high	14 Å²	14	20.4 Å²	20.4	14%	0.144	11%	0.107	C	C	.	.	T	Hydrogen-bonded Turn	trans	49.7	-142.2	-170.7	0	0	0	0	0	112.5	K794 C821 E841 E842 F843	K794-G819 PolarHBondContact O-N 2.96Å; G819-C821 PolarHBondContact O-N 3.16Å; G819-C821 VanDerWaalsContact O-N 3.11Å; G819-E841 CarbonylContact C-O 3.32Å; G819-E842 WeakPolarHBondContact O-CA 3.15Å; G819-F843 PolarHBondContact O-N 3.15Å
820	E	94.5	Very high	94.6	Very high	36 Å²	36	17.4 Å²	17.4	17%	0.168	9%	0.093	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.4	2.8	178	-64.3	-174.2	136.9	0	0	114	K837 H838 M839 E840 E841	E820-K837 HydrophobicContact CB-CG 4.06Å; E820-K837 CarbonylContact O-C 3.38Å; E820-K837 VanDerWaalsContact O-CA 3.29Å; E820-K837 WeakPolarHBondContact O-CA 3.29Å; E820-K837 WeakPolarHBondContact OE2-CE 3.11Å; E820-K837 IonicContact OE2-NZ 2.9Å; E820-K837 PolarHBondContact OE2-NZ 3.09Å; E820-H838 WeakPolarHBondContact CB-O 3.29Å; E820-H838 PolarHBondContact O-N 2.8Å; E820-M839 WeakPolarHBondContact OE1-CA 3.45Å; E820-M839 WeakPolarHBondContact OE1-CE 3.05Å; E820-E840 PolarHBondContact OE1-N 3.13Å; E820-E841 VanDerWaalsContact CA-O 3.29Å; E820-E841 WeakPolarHBondContact CA-O 3.4Å; E820-E841 WeakPolarHBondContact CG-O 3.41Å; E820-E841 PolarHBondContact N-O 3.06Å
821	C	93.8	Very high	94.2	Very high	4 Å²	4	19.3 Å²	19.3	3%	0.027	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	143.4	-165.2	-72.3	0	0	0	0	115.3	H782 G818 G819 R835 F836	H782-C821 PolarHBondContact CE1-O 3.45Å; H782-C821 PolarHBondContact ND1-O 3.2Å; H782-C821 VanDerWaalsContact ND1-O 3.11Å; G818-C821 PolarHBondContact N-O 3.17Å; G818-C821 VanDerWaalsContact N-O 3.1Å; G818-C821 PolarHBondContact O-N 2.95Å; G818-C821 VanDerWaalsContact O-N 3.13Å; G819-C821 PolarHBondContact O-N 3.16Å; G819-C821 VanDerWaalsContact O-N 3.11Å; C821-R835 HydrophobicContact CB-CG 4.41Å; C821-F836 WeakPolarHBondContact CA-O 3.33Å
822	V	96	Very high	94	Very high	0 Å²	0	17.9 Å²	17.9	0%	0	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	123.1	160	-178.7	0	0	0	0	108.8	T816 C817 F836 F843 I846 L862 A864 L874	T816-V822 CarbonylContact O-C 3.44Å; T816-V822 WeakPolarHBondContact O-CA 3.03Å; C817-V822 HydrophobicContact CB-CG2 4.13Å; V822-F836 HydrophobicContact CB-CB 4.42Å; V822-F836 PolarHBondContact N-O 2.71Å; V822-F836 PolarHBondContact O-N 3.38Å; V822-F843 HydrophobicContact CG2-CB 4.34Å; V822-F843 HydrophobicContact CG2-CD1 3.99Å; V822-F843 HydrophobicContact CG2-CD2 3.76Å; V822-F843 HydrophobicContact CG2-CE1 4.14Å; V822-F843 HydrophobicContact CG2-CE2 3.93Å; V822-F843 HydrophobicContact CG2-CG 3.79Å; V822-F843 HydrophobicContact CG2-CZ 4.1Å; V822-I846 HydrophobicContact CG1-CG2 4.34Å; V822-L862 HydrophobicContact CG1-CD2 3.84Å; V822-A864 HydrophobicContact CG2-CB 3.81Å; V822-L874 HydrophobicContact CG1-CD1 4.5Å
823	C	95.7	Very high	93.6	Very high	0 Å²	0	19.6 Å²	19.6	0%	0	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	146.8	-178.7	-58.6	0	0	0	0	110.9	C781 A815 T816 I825 V832 K834	C781-C823 PolarHBondContact O-SG 3.25Å; A815-C823 CarbonylContact C-O 3.57Å; A815-C823 WeakPolarHBondContact CA-O 3.12Å; T816-C823 PolarHBondContact N-O 2.93Å; T816-C823 PolarHBondContact O-N 3.48Å; C823-I825 HydrophobicContact CB-CG1 4.36Å; C823-V832 HydrophobicContact CB-CG1 4.21Å; C823-K834 CarbonylContact C-O 3.52Å; C823-K834 WeakPolarHBondContact CA-O 3.44Å
824	L	95.5	Very high	93.3	Very high	7 Å²	7	21.1 Å²	21.1	4%	0.037	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	128.2	162.9	-62.8	-172.1	0	0	0	109.1	V813 V814 A815 V832 M833 K834 W848 L862 P876	V813-L824 HydrophobicContact CG1-CB 4.06Å; V814-L824 CarbonylContact O-C 3.58Å; V814-L824 WeakPolarHBondContact O-CA 3.09Å; A815-L824 HydrophobicContact CB-CD2 3.43Å; A815-L824 VanDerWaalsContact CB-CD2 3.43Å; L824-V832 CarbonylContact O-C 3.59Å; L824-V832 WeakPolarHBondContact O-CA 3.44Å; L824-M833 PolarHBondContact O-N 2.82Å; L824-K834 HydrophobicContact CB-CB 4.23Å; L824-K834 HydrophobicContact CD1-CB 4.42Å; L824-K834 HydrophobicContact CD1-CD 4.24Å; L824-K834 HydrophobicContact CG-CB 4.45Å; L824-K834 PolarHBondContact N-O 2.86Å; L824-K834 PolarHBondContact O-N 2.95Å; L824-W848 HydrophobicContact CD1-CH2 4.24Å; L824-W848 HydrophobicContact CD2-CH2 3.98Å; L824-W848 HydrophobicContact CD2-CZ2 3.71Å; L824-L862 HydrophobicContact CD2-CD2 4.12Å; L824-P876 HydrophobicContact CD1-CB 3.51Å; L824-P876 HydrophobicContact CD1-CG 4.28Å
825	I	95.2	Very high	92.9	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	131.4	-172.1	-42.7	-174.8	0	0	0	109.8	I779 V813 V814 C823 K831 V832 V1155 I1157	I779-I825 HydrophobicContact CD1-CD1 4.26Å; I779-I825 HydrophobicContact CD1-CG2 3.86Å; V813-I825 CarbonylContact C-O 3.51Å; V813-I825 VanDerWaalsContact CA-O 3.3Å; V813-I825 WeakPolarHBondContact CA-O 3.27Å; V814-I825 HydrophobicContact CG1-CB 3.99Å; V814-I825 PolarHBondContact N-O 3.1Å; V814-I825 PolarHBondContact O-N 3.48Å; C823-I825 HydrophobicContact CB-CG1 4.36Å; I825-K831 WeakPolarHBondContact CA-O 3.47Å; I825-V832 HydrophobicContact CD1-CG2 4.29Å; I825-V832 HydrophobicContact CG1-CG2 4.1Å; I825-V1155 HydrophobicContact CD1-CB 4.1Å; I825-V1155 HydrophobicContact CD1-CG1 3.76Å; I825-V1155 HydrophobicContact CD1-CG2 4.25Å; I825-I1157 HydrophobicContact CG2-CD1 4.01Å
826	N	93.3	Very high	92.5	Very high	37 Å²	37	24.2 Å²	24.2	20%	0.198	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	120.9	167.4	-180	-45.9	0	0	0	108.9	E828 T829 G830 K831 M833	N826-E828 VanDerWaalsContact C-N 3.32Å; N826-E828 PolarHBondContact O-N 2.74Å; N826-E828 WeakPolarHBondContact OD1-CA 3.41Å; N826-E828 VanDerWaalsContact OD1-CB 3.29Å; N826-E828 WeakPolarHBondContact OD1-CB 3.19Å; N826-E828 PolarHBondContact OD1-N 3.39Å; N826-T829 PolarHBondContact OD1-N 3.3Å; N826-G830 WeakPolarHBondContact O-CA 3.14Å; N826-G830 PolarHBondContact O-N 2.88Å; N826-K831 PolarHBondContact N-O 3.39Å; N826-M833 HydrophobicContact CB-CG 4.06Å; N826-M833 HydrophobicContact CB-SD 3.9Å
827	C	93.7	Very high	92.2	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-22	-174.9	-60.1	0	0	0	0	114	L776 H777 F800 H812 Y1145 I1157	L776-C827 WeakPolarHBondContact CD2-O 3.46Å; H777-C827 PolarHBondContact CD2-O 2.84Å; F800-C827 VanDerWaalsContact CE1-SG 3.5Å; H812-C827 WeakPolarHBondContact O-CB 3.46Å; H812-C827 PolarHBondContact O-N 2.77Å; H812-C827 PolarHBondContact O-SG 2.78Å; C827-Y1145 HydrophobicContact CB-CD1 3.7Å; C827-Y1145 HydrophobicContact CB-CD2 3.94Å; C827-Y1145 HydrophobicContact CB-CE1 4.06Å; C827-Y1145 HydrophobicContact CB-CE2 4.28Å; C827-Y1145 HydrophobicContact CB-CG 3.64Å; C827-I1157 HydrophobicContact CB-CD1 4.41Å; C827-I1157 HydrophobicContact CB-CG2 3.86Å
828	E	91.7	Very high	91.9	Very high	120 Å²	120	31.4 Å²	31.4	56%	0.561	15%	0.151	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.6	-49	178.8	-172.7	168.5	-142.4	0	0	111	H777 N826 Y1145	H777-E828 PolarHBondContact NE2-O 3.07Å; N826-E828 VanDerWaalsContact C-N 3.32Å; N826-E828 PolarHBondContact O-N 2.74Å; N826-E828 WeakPolarHBondContact OD1-CA 3.41Å; N826-E828 VanDerWaalsContact OD1-CB 3.29Å; N826-E828 WeakPolarHBondContact OD1-CB 3.19Å; N826-E828 PolarHBondContact OD1-N 3.39Å; E828-Y1145 WeakPolarHBondContact CA-OH 3.3Å; E828-Y1145 VanDerWaalsContact CB-OH 3.27Å; E828-Y1145 WeakPolarHBondContact CB-OH 3.36Å; E828-Y1145 WeakPolarHBondContact CG-OH 3.39Å
829	T	90.3	Very high	91.6	Very high	40 Å²	40	36.6 Å²	36.6	25%	0.245	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.4	-16.2	-176.3	60.5	0	0	0	0	114.5	Q30 H777 N826 K831	Q30-T829 PolarHBondContact NE2-O 2.84Å; H777-T829 VanDerWaalsContact NE2-C 3.34Å; N826-T829 PolarHBondContact OD1-N 3.3Å; T829-K831 PolarHBondContact O-N 3.01Å; T829-K831 PolarHBondContact OG1-N 3.41Å
830	G	87.4	Confident	91.3	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	20%	0.203	C	C	.	.			trans	72.3	5	-171.6	0	0	0	0	0	113.3	N137 H777 I779 N826 V832	N137-G830 PolarHBondContact ND2-O 2.9Å; N137-G830 VanDerWaalsContact ND2-O 3.09Å; H777-G830 VanDerWaalsContact CD2-CA 3.42Å; H777-G830 WeakPolarHBondContact CD2-CA 3.16Å; H777-G830 PolarHBondContact CD2-N 2.94Å; H777-G830 VanDerWaalsContact CD2-N 3.34Å; H777-G830 PolarHBondContact NE2-N 3.46Å; I779-G830 WeakPolarHBondContact CD1-O 3.46Å; N826-G830 WeakPolarHBondContact O-CA 3.14Å; N826-G830 PolarHBondContact O-N 2.88Å; G830-V832 PolarHBondContact O-N 3.31Å
831	K	86.5	Confident	91.2	Very high	51 Å²	51	41.5 Å²	41.5	22%	0.222	20%	0.196	C	C	.	.			trans	-73.1	121.9	178.3	178.6	144.4	-173	146.7	0	111.2	S25 A136 N137 I825 N826 T829 M833	S25-K831 WeakPolarHBondContact O-CE 3.26Å; S25-K831 PolarHBondContact O-NZ 3.46Å; A136-K831 HydrophobicContact CB-CD 3.61Å; A136-K831 WeakPolarHBondContact O-CD 3.47Å; A136-K831 PolarHBondContact O-NZ 3.03Å; N137-K831 WeakPolarHBondContact OD1-CA 3.4Å; N137-K831 WeakPolarHBondContact OD1-CG 3.48Å; I825-K831 WeakPolarHBondContact CA-O 3.47Å; N826-K831 PolarHBondContact N-O 3.39Å; T829-K831 PolarHBondContact O-N 3.01Å; T829-K831 PolarHBondContact OG1-N 3.41Å; K831-M833 PolarHBondContact O-N 3.45Å
832	V	88.7	Confident	91.3	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.1	107.6	159.4	179.6	0	0	0	0	106.9	S25 V28 C781 C823 L824 I825 G830 R835	S25-V832 WeakPolarHBondContact CB-O 3.46Å; S25-V832 PolarHBondContact OG-O 2.93Å; V28-V832 HydrophobicContact CB-CG2 4.41Å; V28-V832 HydrophobicContact CG1-CG2 3.79Å; V28-V832 HydrophobicContact CG2-CB 3.92Å; V28-V832 HydrophobicContact CG2-CG2 3.72Å; C781-V832 HydrophobicContact CB-CG2 3.53Å; C823-V832 HydrophobicContact CB-CG1 4.21Å; L824-V832 CarbonylContact O-C 3.59Å; L824-V832 WeakPolarHBondContact O-CA 3.44Å; I825-V832 HydrophobicContact CD1-CG2 4.29Å; I825-V832 HydrophobicContact CG1-CG2 4.1Å; G830-V832 PolarHBondContact O-N 3.31Å; V832-R835 HydrophobicContact CG1-CB 4.45Å
833	M	86	Confident	91.4	Very high	88 Å²	88	45 Å²	45	43%	0.433	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	-37.7	-179.6	-58.8	173.6	71.3	0	0	111.1	V813 L824 N826 K831	V813-M833 HydrophobicContact CB-SD 4.48Å; V813-M833 HydrophobicContact CG1-SD 3.98Å; V813-M833 HydrophobicContact CG2-CE 4.38Å; V813-M833 HydrophobicContact CG2-SD 3.64Å; L824-M833 PolarHBondContact O-N 2.82Å; N826-M833 HydrophobicContact CB-CG 4.06Å; N826-M833 HydrophobicContact CB-SD 3.9Å; K831-M833 PolarHBondContact O-N 3.45Å
834	K	88.1	Confident	91.4	Very high	46 Å²	46	47 Å²	47	20%	0.2	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	133.7	-169.9	-56.2	-177.3	170.2	-161.6	0	109.3	C823 L824 F836 P876 E877 L879	C823-K834 CarbonylContact C-O 3.52Å; C823-K834 WeakPolarHBondContact CA-O 3.44Å; L824-K834 HydrophobicContact CB-CB 4.23Å; L824-K834 HydrophobicContact CD1-CB 4.42Å; L824-K834 HydrophobicContact CD1-CD 4.24Å; L824-K834 HydrophobicContact CG-CB 4.45Å; L824-K834 PolarHBondContact N-O 2.86Å; L824-K834 PolarHBondContact O-N 2.95Å; K834-F836 HydrophobicContact CB-CE2 4.22Å; K834-P876 VanDerWaalsContact CD-O 3.3Å; K834-P876 WeakPolarHBondContact CD-O 3.48Å; K834-P876 PolarHBondContact NZ-O 3.31Å; K834-E877 PolarHBondContact NZ-O 3.49Å; K834-L879 HydrophobicContact CB-CD2 4.4Å; K834-L879 HydrophobicContact CD-CD2 3.46Å; K834-L879 VanDerWaalsContact CD-CD2 3.46Å; K834-L879 HydrophobicContact CG-CD2 3.87Å
835	R	89.7	Confident	91.6	Very high	45 Å²	45	46.9 Å²	46.9	17%	0.17	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	122.1	172.5	-166.8	-172.2	-59.2	-171.4	16.2	109	D27 C781 N786 C821 V832	D27-R835 PolarHBondContact O-NH2 2.64Å; C781-R835 PolarHBondContact O-NE 3.21Å; C781-R835 PolarHBondContact O-NH1 3.43Å; N786-R835 PolarHBondContact OD1-NH1 3.27Å; C821-R835 HydrophobicContact CB-CG 4.41Å; V832-R835 HydrophobicContact CG1-CB 4.45Å
836	F	90.7	Very high	91.7	Very high	20 Å²	20	47 Å²	47	9%	0.088	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	109.2	172.3	-61.1	-89.9	0	0	0	108	L22 C821 V822 K834 L874 P876 L879	L22-F836 HydrophobicContact CD2-CD1 3.88Å; L22-F836 HydrophobicContact CD2-CE1 3.76Å; L22-F836 HydrophobicContact CD2-CZ 4.45Å; C821-F836 WeakPolarHBondContact CA-O 3.33Å; V822-F836 HydrophobicContact CB-CB 4.42Å; V822-F836 PolarHBondContact N-O 2.71Å; V822-F836 PolarHBondContact O-N 3.38Å; K834-F836 HydrophobicContact CB-CE2 4.22Å; F836-L874 HydrophobicContact CB-CD1 4.3Å; F836-L874 HydrophobicContact CD1-CD1 4.32Å; F836-L874 HydrophobicContact CD1-CD2 4.22Å; F836-L874 HydrophobicContact CD2-CD1 3.9Å; F836-L874 HydrophobicContact CE2-CD1 4.29Å; F836-L874 HydrophobicContact CG-CD1 3.92Å; F836-P876 HydrophobicContact CE2-CB 4.38Å; F836-P876 HydrophobicContact CZ-CB 4.36Å; F836-L879 HydrophobicContact CZ-CD2 4.48Å
837	K	91.3	Very high	91.9	Very high	88 Å²	88	45.5 Å²	45.5	38%	0.383	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	139	174	-168.1	177.1	-174.4	-170.2	0	110.2	D785 E820 M839	D785-K837 IonicContact OD1-NZ 3.76Å; D785-K837 PolarHBondContact OD1-NZ 2.83Å; E820-K837 HydrophobicContact CB-CG 4.06Å; E820-K837 CarbonylContact O-C 3.38Å; E820-K837 VanDerWaalsContact O-CA 3.29Å; E820-K837 WeakPolarHBondContact O-CA 3.29Å; E820-K837 WeakPolarHBondContact OE2-CE 3.11Å; E820-K837 IonicContact OE2-NZ 2.9Å; E820-K837 PolarHBondContact OE2-NZ 3.09Å; K837-M839 HydrophobicContact CD-SD 4.12Å; K837-M839 VanDerWaalsContact CE-SD 3.59Å
838	H	90.5	Very high	92.1	Very high	64 Å²	64	46.8 Å²	46.8	30%	0.296	22%	0.217	S	C	.	.			trans	-134.6	120	167.4	-164.5	91.9	0	0	0	108.8	E820 E841 F843 R872	E820-H838 WeakPolarHBondContact CB-O 3.29Å; E820-H838 PolarHBondContact O-N 2.8Å; H838-E841 HydrophobicContact CB-CB 4.2Å; H838-E841 PolarHBondContact O-N 2.85Å; H838-F843 HydrophobicContact CB-CE2 4.29Å; H838-F843 HydrophobicContact CB-CZ 4.19Å; H838-R872 PolarHBondContact CD2-NH2 2.77Å; H838-R872 PolarHBondContact NE2-NH2 3.21Å
839	M	89.7	Confident	92.3	Very high	108 Å²	108	41.5 Å²	41.5	53%	0.532	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.2	148	-179.1	-55	-53.7	-57	0	0	110.9	E820 K837 E841	E820-M839 WeakPolarHBondContact OE1-CA 3.45Å; E820-M839 WeakPolarHBondContact OE1-CE 3.05Å; K837-M839 HydrophobicContact CD-SD 4.12Å; K837-M839 VanDerWaalsContact CE-SD 3.59Å; M839-E841 PolarHBondContact O-N 3.28Å; M839-E841 VanDerWaalsContact O-N 3.1Å
840	E	88.4	Confident	92.5	Very high	152 Å²	152	41 Å²	41	71%	0.71	19%	0.19	S	C	*	.	T	Hydrogen-bonded Turn	trans	66.4	-2.6	179.4	-50.9	-176.6	172.4	0	0	115.8	E820 M868	E820-E840 PolarHBondContact OE1-N 3.13Å; E840-M868 HydrophobicContact CB-SD 4.45Å
841	E	93.7	Very high	92.7	Very high	1 Å²	1	41 Å²	41	1%	0.005	19%	0.19	C	C	.	.			trans	-88.9	147.9	175.6	-178.1	63.3	-80.8	0	0	112.4	G819 E820 H838 M839 F843 R867 M868 R872	G819-E841 CarbonylContact C-O 3.32Å; E820-E841 VanDerWaalsContact CA-O 3.29Å; E820-E841 WeakPolarHBondContact CA-O 3.4Å; E820-E841 WeakPolarHBondContact CG-O 3.41Å; E820-E841 PolarHBondContact N-O 3.06Å; H838-E841 HydrophobicContact CB-CB 4.2Å; H838-E841 PolarHBondContact O-N 2.85Å; M839-E841 PolarHBondContact O-N 3.28Å; M839-E841 VanDerWaalsContact O-N 3.1Å; E841-F843 HydrophobicContact CB-CE2 4.31Å; E841-F843 HydrophobicContact CB-CZ 4.48Å; E841-F843 HydrophobicContact CG-CD1 3.84Å; E841-F843 HydrophobicContact CG-CD2 3.82Å; E841-F843 HydrophobicContact CG-CE1 3.73Å; E841-F843 HydrophobicContact CG-CE2 3.72Å; E841-F843 HydrophobicContact CG-CG 3.89Å; E841-F843 HydrophobicContact CG-CZ 3.68Å; E841-R867 PolarHBondContact OE1-N 2.93Å; E841-M868 HydrophobicContact CB-CG 4.07Å; E841-M868 HydrophobicContact CG-CG 4.42Å; E841-M868 PolarHBondContact OE1-N 3.42Å; E841-M868 VanDerWaalsContact OE2-CB 3.27Å; E841-M868 WeakPolarHBondContact OE2-CB 3.28Å; E841-M868 WeakPolarHBondContact OE2-CG 3.2Å; E841-R872 IonicContact OE2-CZ 2.67Å; E841-R872 IonicContact OE2-NH1 3.93Å; E841-R872 PolarHBondContact OE2-NH1 2.91Å; E841-R872 IonicContact OE2-NH2 3.77Å
842	E	95.4	Very high	92.8	Very high	69 Å²	69	43.3 Å²	43.3	32%	0.322	20%	0.201	S	C	.	.			trans	-127.1	100.4	166.7	-74.2	167.9	-167.3	0	0	108.2	G819 Y844 G866 R867	G819-E842 WeakPolarHBondContact O-CA 3.15Å; E842-Y844 HydrophobicContact CB-CE1 3.9Å; E842-Y844 PolarHBondContact O-N 3.1Å; E842-Y844 VanDerWaalsContact O-N 3.16Å; E842-Y844 PolarHBondContact OE2-OH 2.98Å; E842-Y844 VanDerWaalsContact OE2-OH 3.06Å; E842-G866 WeakPolarHBondContact O-CA 3.24Å; E842-R867 HydrophobicContact CB-CB 3.86Å; E842-R867 PolarHBondContact O-N 3Å; E842-R867 VanDerWaalsContact O-N 3.12Å; E842-R867 IonicContact OE1-CZ 2.69Å; E842-R867 IonicContact OE1-NH1 2.76Å; E842-R867 PolarHBondContact OE1-NH1 2.81Å; E842-R867 WeakPolarHBondContact OE2-CD 3.29Å; E842-R867 IonicContact OE2-CZ 2.68Å; E842-R867 IonicContact OE2-NE 2.67Å; E842-R867 IonicContact OE2-NH1 3.42Å; E842-R867 PolarHBondContact OE2-NH1 3.21Å
843	F	97.6	Very high	92.3	Very high	8 Å²	8	44.1 Å²	44.1	4%	0.035	21%	0.206	C	C	.	.			trans	-75.9	101.5	-173.9	-69.4	-76.3	0	0	0	112.5	C817 G819 V822 H838 E841 A864	C817-F843 CarbonylContact C-O 3.52Å; C817-F843 HydrophobicContact CB-CB 3.82Å; C817-F843 PolarHBondContact SG-O 2.71Å; C817-F843 VanDerWaalsContact SG-O 3.32Å; G819-F843 PolarHBondContact O-N 3.15Å; V822-F843 HydrophobicContact CG2-CB 4.34Å; V822-F843 HydrophobicContact CG2-CD1 3.99Å; V822-F843 HydrophobicContact CG2-CD2 3.76Å; V822-F843 HydrophobicContact CG2-CE1 4.14Å; V822-F843 HydrophobicContact CG2-CE2 3.93Å; V822-F843 HydrophobicContact CG2-CG 3.79Å; V822-F843 HydrophobicContact CG2-CZ 4.1Å; H838-F843 HydrophobicContact CB-CE2 4.29Å; H838-F843 HydrophobicContact CB-CZ 4.19Å; E841-F843 HydrophobicContact CB-CE2 4.31Å; E841-F843 HydrophobicContact CB-CZ 4.48Å; E841-F843 HydrophobicContact CG-CD1 3.84Å; E841-F843 HydrophobicContact CG-CD2 3.82Å; E841-F843 HydrophobicContact CG-CE1 3.73Å; E841-F843 HydrophobicContact CG-CE2 3.72Å; E841-F843 HydrophobicContact CG-CG 3.89Å; E841-F843 HydrophobicContact CG-CZ 3.68Å; F843-A864 HydrophobicContact CD1-CB 3.83Å; F843-A864 HydrophobicContact CE1-CB 3.75Å
844	Y	97.1	Very high	91.4	Very high	42 Å²	42	47.5 Å²	47.5	17%	0.165	22%	0.221	C	C	.	.			trans	-82.4	-25.9	177.6	-53.1	-46.3	0	0	0	113.8	W796 R797 E842 A865 R867 D891	W796-Y844 WeakPolarHBondContact CB-O 3.11Å; W796-Y844 AromaticContact CD1-CD1 3.82Å; W796-Y844 HydrophobicContact CD2-CD1 4.5Å; W796-Y844 HydrophobicContact CG-CD1 4.34Å; W796-Y844 AromaticContact NE1-CD1 3.6Å; W796-Y844 AromaticContact NE1-CE1 3.97Å; R797-Y844 WeakPolarHBondContact CG-O 3.27Å; E842-Y844 HydrophobicContact CB-CE1 3.9Å; E842-Y844 PolarHBondContact O-N 3.1Å; E842-Y844 VanDerWaalsContact O-N 3.16Å; E842-Y844 PolarHBondContact OE2-OH 2.98Å; E842-Y844 VanDerWaalsContact OE2-OH 3.06Å; Y844-A865 PolarHBondContact N-O 3.08Å; Y844-A865 VanDerWaalsContact N-O 3.16Å; Y844-R867 HydrophobicContact CE2-CB 3.86Å; Y844-D891 HydrophobicContact CD2-CB 4.31Å; Y844-D891 HydrophobicContact CE2-CB 3.88Å; Y844-D891 WeakPolarHBondContact CE2-OD2 3.4Å
845	T	97.8	Very high	90.1	Very high	5 Å²	5	48.8 Å²	48.8	3%	0.031	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	146.7	-170.4	-169.6	0	0	0	0	114.3	A865 V892 M895	T845-A865 HydrophobicContact CG2-CB 4.27Å; T845-A865 PolarHBondContact N-O 2.91Å; T845-A865 VanDerWaalsContact N-O 3.13Å; T845-A865 PolarHBondContact O-N 3.49Å; T845-V892 HydrophobicContact CG2-CG1 4.06Å; T845-V892 WeakPolarHBondContact CG2-O 3.47Å; T845-M895 HydrophobicContact CG2-CB 4.39Å; T845-M895 HydrophobicContact CG2-CE 4.17Å; T845-M895 HydrophobicContact CG2-CG 3.84Å; T845-M895 PolarHBondContact OG1-N 2.75Å
846	I	98.1	Very high	88.8	Confident	4 Å²	4	51.6 Å²	51.6	2%	0.021	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	150.4	178.8	45.7	167.2	0	0	0	110.6	R797 L799 A815 C817 V822 L862 A863 A864	R797-I846 HydrophobicContact CB-CG1 4.04Å; L799-I846 HydrophobicContact CB-CD1 4.39Å; L799-I846 HydrophobicContact CD1-CG1 4.31Å; L799-I846 VanDerWaalsContact CD1-O 3.31Å; L799-I846 WeakPolarHBondContact CD1-O 3.31Å; A815-I846 HydrophobicContact CB-CD1 3.83Å; C817-I846 HydrophobicContact CB-CG1 4.38Å; C817-I846 HydrophobicContact CB-CG2 3.65Å; V822-I846 HydrophobicContact CG1-CG2 4.34Å; I846-L862 HydrophobicContact CB-CD1 4.04Å; I846-L862 HydrophobicContact CG2-CD1 4.3Å; I846-A863 CarbonylContact C-O 3.36Å; I846-A863 VanDerWaalsContact CA-O 3.25Å; I846-A863 WeakPolarHBondContact CA-O 3.39Å; I846-A864 HydrophobicContact CG2-CB 3.89Å
847	A	98.1	Very high	88.1	Confident	4 Å²	4	55.9 Å²	55.9	3%	0.033	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	133	173	0	0	0	0	0	111.5	A863 M895 F897	A847-A863 PolarHBondContact N-O 2.68Å; A847-A863 PolarHBondContact O-N 2.75Å; A847-M895 HydrophobicContact CB-CB 3.94Å; A847-F897 HydrophobicContact CB-CD2 3.75Å; A847-F897 HydrophobicContact CB-CE2 3.99Å; A847-F897 WeakPolarHBondContact O-CE2 3.42Å
848	W	97.3	Very high	87.9	Confident	27 Å²	27	56.1 Å²	56.1	10%	0.102	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	147.7	175.4	-76.3	115.4	0	0	0	112.4	L799 F800 E801 P802 A815 L824 N860 L862 P876 F897	L799-W848 PolarHBondContact O-NE1 3.42Å; F800-W848 PolarHBondContact O-NE1 3.16Å; E801-W848 HydrophobicContact CB-CH2 4.09Å; E801-W848 HydrophobicContact CB-CZ2 3.62Å; E801-W848 HydrophobicContact CG-CH2 3.86Å; E801-W848 HydrophobicContact CG-CZ2 3.92Å; E801-W848 HydrophobicContact CG-CZ3 4.24Å; P802-W848 HydrophobicContact CG-CB 4.05Å; P802-W848 HydrophobicContact CG-CG 4.45Å; A815-W848 HydrophobicContact CB-CZ2 3.76Å; L824-W848 HydrophobicContact CD1-CH2 4.24Å; L824-W848 HydrophobicContact CD2-CH2 3.98Å; L824-W848 HydrophobicContact CD2-CZ2 3.71Å; W848-N860 HydrophobicContact CE3-CB 4.07Å; W848-N860 HydrophobicContact CZ3-CB 3.77Å; W848-L862 HydrophobicContact CD2-CB 4.46Å; W848-L862 HydrophobicContact CD2-CD1 3.84Å; W848-L862 HydrophobicContact CE3-CB 3.89Å; W848-L862 HydrophobicContact CE3-CD1 4.14Å; W848-L862 HydrophobicContact CG-CD1 4.19Å; W848-L862 HydrophobicContact CH2-CB 4.34Å; W848-L862 HydrophobicContact CH2-CD2 4.36Å; W848-L862 HydrophobicContact CZ2-CD2 4.37Å; W848-L862 HydrophobicContact CZ3-CB 3.82Å; W848-P876 HydrophobicContact CH2-CG 4.03Å; W848-P876 HydrophobicContact CZ3-CG 3.89Å; W848-F897 VanDerWaalsContact O-CD2 3.22Å; W848-F897 WeakPolarHBondContact O-CD2 3.35Å
849	T	96.2	Very high	87.9	Confident	10 Å²	10	53.4 Å²	53.4	6%	0.061	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	158.2	162.8	-167.8	0	0	0	0	111.4	V851 N860 I861 F897 S902 I919	T849-V851 HydrophobicContact CG2-CG1 4.34Å; T849-N860 WeakPolarHBondContact O-CA 3.5Å; T849-I861 HydrophobicContact CG2-CB 3.86Å; T849-I861 HydrophobicContact CG2-CG2 4.4Å; T849-I861 PolarHBondContact N-O 3.46Å; T849-I861 PolarHBondContact O-N 3.46Å; T849-F897 HydrophobicContact CG2-CD1 3.98Å; T849-F897 HydrophobicContact CG2-CD2 4.17Å; T849-F897 HydrophobicContact CG2-CE1 3.61Å; T849-F897 HydrophobicContact CG2-CE2 3.82Å; T849-F897 HydrophobicContact CG2-CG 4.25Å; T849-F897 HydrophobicContact CG2-CZ 3.53Å; T849-S902 WeakPolarHBondContact OG1-CA 3.32Å; T849-S902 WeakPolarHBondContact OG1-CB 3.48Å; T849-S902 PolarHBondContact OG1-O 3.04Å; T849-I919 HydrophobicContact CG2-CD1 4.18Å
850	T	95	Very high	88.1	Confident	28 Å²	28	48.6 Å²	48.6	17%	0.172	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	122.2	174.9	-50.9	0	0	0	0	109.5	P804 R858 T859 N860 S902	P804-T850 HydrophobicContact CB-CG2 4.17Å; T850-R858 HydrophobicContact CG2-CB 4Å; T850-R858 HydrophobicContact CG2-CG 4.46Å; T850-T859 CarbonylContact C-O 3.59Å; T850-T859 WeakPolarHBondContact CA-O 3.47Å; T850-N860 PolarHBondContact OG1-OD1 2.9Å; T850-S902 WeakPolarHBondContact O-CB 3.43Å; T850-S902 PolarHBondContact O-OG 3.28Å; T850-S902 VanDerWaalsContact O-OG 3.11Å
851	V	91.8	Very high	88.4	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	151.7	179.7	-60.8	0	0	0	0	111.1	T849 V853 R858 T859 I861 T903	T849-V851 HydrophobicContact CG2-CG1 4.34Å; V851-V853 HydrophobicContact CG2-CG2 4.22Å; V851-R858 WeakPolarHBondContact O-CA 3.44Å; V851-T859 HydrophobicContact CG2-CG2 3.88Å; V851-T859 PolarHBondContact N-O 2.87Å; V851-T859 PolarHBondContact O-N 3.45Å; V851-I861 HydrophobicContact CG2-CD1 4.42Å; V851-I861 HydrophobicContact CG2-CG1 3.77Å; V851-T903 HydrophobicContact CG1-CG2 4.44Å
852	E	88	Confident	88.6	Confident	101 Å²	101	41.3 Å²	41.3	47%	0.472	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	112.1	172	-74.5	175.6	-167.5	0	0	108.8	R858	E852-R858 HydrophobicContact CG-CG 3.53Å; E852-R858 IonicContact OE1-CZ 2.71Å; E852-R858 IonicContact OE1-NE 3.91Å; E852-R858 PolarHBondContact OE1-NE 2.99Å; E852-R858 IonicContact OE1-NH2 3.67Å; E852-R858 PolarHBondContact OE1-NH2 3.27Å
853	V	78.6	Confident	88.7	Confident	16 Å²	16	38 Å²	38	10%	0.097	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	157	175	175.6	0	0	0	0	109.4	V851 G855 S856 K857 T859 I921 V924	V851-V853 HydrophobicContact CG2-CG2 4.22Å; V853-G855 PolarHBondContact O-N 3.34Å; V853-S856 PolarHBondContact O-N 3.34Å; V853-S856 VanDerWaalsContact O-N 3.07Å; V853-K857 PolarHBondContact N-O 2.89Å; V853-K857 VanDerWaalsContact N-O 3.09Å; V853-T859 HydrophobicContact CG2-CG2 3.66Å; V853-I921 HydrophobicContact CG2-CG2 4.3Å; V853-V924 HydrophobicContact CG1-CB 4.05Å; V853-V924 HydrophobicContact CG1-CG2 3.77Å
854	E	67.1	Low	88.8	Confident	159 Å²	159	37.6 Å²	37.6	74%	0.743	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-45.5	126.5	-179.1	-61.3	-172	160.1	0	0	111.9
855	G	60.1	Low	88.8	Confident	73 Å²	73	35.6 Å²	35.6	75%	0.753	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	97.2	8.6	-170.8	0	0	0	0	0	115.4	V853 K857	V853-G855 PolarHBondContact O-N 3.34Å; G855-K857 VanDerWaalsContact C-N 3.26Å; G855-K857 PolarHBondContact O-N 2.7Å
856	S	61.7	Low	88.8	Confident	104 Å²	104	35.4 Å²	35.4	73%	0.727	20%	0.195	S	C	*	.	T	Hydrogen-bonded Turn	trans	67.1	12.2	175.2	70.2	0	0	0	0	116.5	V853 R858	V853-S856 PolarHBondContact O-N 3.34Å; V853-S856 VanDerWaalsContact O-N 3.07Å; S856-R858 PolarHBondContact O-N 3.47Å
857	K	76.4	Confident	88.8	Confident	110 Å²	110	39.8 Å²	39.8	48%	0.478	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	117.7	167.8	-168.8	-172.2	178.7	-171.3	0	108.9	V853 G855 E877	V853-K857 PolarHBondContact N-O 2.89Å; V853-K857 VanDerWaalsContact N-O 3.09Å; G855-K857 VanDerWaalsContact C-N 3.26Å; G855-K857 PolarHBondContact O-N 2.7Å; K857-E877 IonicContact NZ-OE1 2.75Å; K857-E877 PolarHBondContact NZ-OE1 2.83Å; K857-E877 IonicContact NZ-OE2 2.85Å; K857-E877 PolarHBondContact NZ-OE2 3.06Å
858	R	87.8	Confident	88.7	Confident	93 Å²	93	42.8 Å²	42.8	35%	0.351	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	135	164.8	-76	-178.1	177.3	-175.8	-2.2	110	P804 T850 V851 E852 S856	P804-R858 HydrophobicContact CB-CB 3.93Å; P804-R858 WeakPolarHBondContact O-CD 3.34Å; T850-R858 HydrophobicContact CG2-CB 4Å; T850-R858 HydrophobicContact CG2-CG 4.46Å; V851-R858 WeakPolarHBondContact O-CA 3.44Å; E852-R858 HydrophobicContact CG-CG 3.53Å; E852-R858 IonicContact OE1-CZ 2.71Å; E852-R858 IonicContact OE1-NE 3.91Å; E852-R858 PolarHBondContact OE1-NE 2.99Å; E852-R858 IonicContact OE1-NH2 3.67Å; E852-R858 PolarHBondContact OE1-NH2 3.27Å; S856-R858 PolarHBondContact O-N 3.47Å
859	T	90.4	Very high	88.6	Confident	7 Å²	7	44.6 Å²	44.6	4%	0.043	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	149.8	-179.9	-168.7	0	0	0	0	111.3	T850 V851 V853 I861 H875	T850-T859 CarbonylContact C-O 3.59Å; T850-T859 WeakPolarHBondContact CA-O 3.47Å; V851-T859 HydrophobicContact CG2-CG2 3.88Å; V851-T859 PolarHBondContact N-O 2.87Å; V851-T859 PolarHBondContact O-N 3.45Å; V853-T859 HydrophobicContact CG2-CG2 3.66Å; T859-I861 HydrophobicContact CG2-CD1 4.45Å; T859-H875 WeakPolarHBondContact CG2-NE2 3.35Å; T859-H875 PolarHBondContact OG1-CE1 3.37Å; T859-H875 PolarHBondContact OG1-NE2 2.88Å
860	N	94	Very high	88.6	Confident	7 Å²	7	46 Å²	46	4%	0.037	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	134.4	179.2	-69.5	-23.4	0	0	0	111.3	E801 P802 W848 T849 T850 P876	E801-N860 VanDerWaalsContact CD-ND2 3.33Å; E801-N860 WeakPolarHBondContact CG-ND2 3.24Å; E801-N860 PolarHBondContact OE1-ND2 3.35Å; P802-N860 PolarHBondContact O-ND2 3.2Å; W848-N860 HydrophobicContact CE3-CB 4.07Å; W848-N860 HydrophobicContact CZ3-CB 3.77Å; T849-N860 WeakPolarHBondContact O-CA 3.5Å; T850-N860 PolarHBondContact OG1-OD1 2.9Å; N860-P876 WeakPolarHBondContact O-CD 3.36Å
861	I	94.8	Very high	88.8	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	134.6	172.7	-56.9	-56.3	0	0	0	107.6	T849 V851 T859 L873 L874 H875 Y882 I919	T849-I861 HydrophobicContact CG2-CB 3.86Å; T849-I861 HydrophobicContact CG2-CG2 4.4Å; T849-I861 PolarHBondContact N-O 3.46Å; T849-I861 PolarHBondContact O-N 3.46Å; V851-I861 HydrophobicContact CG2-CD1 4.42Å; V851-I861 HydrophobicContact CG2-CG1 3.77Å; T859-I861 HydrophobicContact CG2-CD1 4.45Å; I861-L873 HydrophobicContact CG2-CB 4.38Å; I861-L874 WeakPolarHBondContact CA-O 3.16Å; I861-H875 HydrophobicContact CD1-CB 3.92Å; I861-Y882 HydrophobicContact CD1-CE1 3.89Å; I861-Y882 HydrophobicContact CG2-CE1 4.03Å; I861-Y882 WeakPolarHBondContact CG2-OH 3.26Å; I861-I919 HydrophobicContact CG2-CD1 4.4Å
862	L	97.3	Very high	89	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	115.7	176.1	-179.1	58.9	0	0	0	108.6	A815 V822 L824 I846 W848 L874 P876	A815-L862 HydrophobicContact CB-CD2 4.11Å; V822-L862 HydrophobicContact CG1-CD2 3.84Å; L824-L862 HydrophobicContact CD2-CD2 4.12Å; I846-L862 HydrophobicContact CB-CD1 4.04Å; I846-L862 HydrophobicContact CG2-CD1 4.3Å; W848-L862 HydrophobicContact CD2-CB 4.46Å; W848-L862 HydrophobicContact CD2-CD1 3.84Å; W848-L862 HydrophobicContact CE3-CB 3.89Å; W848-L862 HydrophobicContact CE3-CD1 4.14Å; W848-L862 HydrophobicContact CG-CD1 4.19Å; W848-L862 HydrophobicContact CH2-CB 4.34Å; W848-L862 HydrophobicContact CH2-CD2 4.36Å; W848-L862 HydrophobicContact CZ2-CD2 4.37Å; W848-L862 HydrophobicContact CZ3-CB 3.82Å; L862-L874 HydrophobicContact CB-CB 4.33Å; L862-L874 HydrophobicContact CD2-CD1 4.41Å; L862-L874 PolarHBondContact N-O 3.4Å; L862-L874 WeakPolarHBondContact O-CB 3.1Å; L862-L874 PolarHBondContact O-N 2.81Å; L862-P876 HydrophobicContact CB-CG 3.92Å
863	A	98.3	Very high	89.4	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83	132.9	166.5	0	0	0	0	0	108.9	I846 A847 I871 R872 L873 M895 F897 L905	I846-A863 CarbonylContact C-O 3.36Å; I846-A863 VanDerWaalsContact CA-O 3.25Å; I846-A863 WeakPolarHBondContact CA-O 3.39Å; A847-A863 PolarHBondContact N-O 2.68Å; A847-A863 PolarHBondContact O-N 2.75Å; A863-I871 HydrophobicContact CB-CG2 3.98Å; A863-R872 WeakPolarHBondContact CA-O 3.15Å; A863-L873 HydrophobicContact CB-CD2 3.83Å; A863-M895 HydrophobicContact CB-CE 3.8Å; A863-M895 HydrophobicContact CB-SD 4.32Å; A863-M895 WeakPolarHBondContact O-CE 3.17Å; A863-F897 HydrophobicContact CB-CE2 3.82Å; A863-F897 HydrophobicContact CB-CZ 4.06Å; A863-L905 HydrophobicContact CB-CD2 4.31Å
864	A	98.4	Very high	90.2	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	137.1	174.3	0	0	0	0	0	110.4	V822 F843 I846 R872 L874	V822-A864 HydrophobicContact CG2-CB 3.81Å; F843-A864 HydrophobicContact CD1-CB 3.83Å; F843-A864 HydrophobicContact CE1-CB 3.75Å; I846-A864 HydrophobicContact CG2-CB 3.89Å; A864-R872 PolarHBondContact N-O 2.87Å; A864-R872 PolarHBondContact O-N 3.44Å; A864-L874 HydrophobicContact CB-CD1 4.48Å
865	A	98.4	Very high	91.3	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	165.4	-176.5	0	0	0	0	0	112.4	Y844 T845 I871 V892 M895	Y844-A865 PolarHBondContact N-O 3.08Å; Y844-A865 VanDerWaalsContact N-O 3.16Å; T845-A865 HydrophobicContact CG2-CB 4.27Å; T845-A865 PolarHBondContact N-O 2.91Å; T845-A865 VanDerWaalsContact N-O 3.13Å; T845-A865 PolarHBondContact O-N 3.49Å; A865-I871 HydrophobicContact CB-CB 4.26Å; A865-I871 HydrophobicContact CB-CG1 3.87Å; A865-I871 HydrophobicContact CB-CG2 4.39Å; A865-V892 HydrophobicContact CB-CB 3.74Å; A865-V892 HydrophobicContact CB-CG1 3.71Å; A865-V892 HydrophobicContact CB-CG2 4.24Å; A865-M895 HydrophobicContact CB-CE 3.78Å; A865-M895 HydrophobicContact CB-SD 3.81Å
866	G	97.4	Very high	92.6	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	14%	0.14	C	C	.	.			trans	177.7	-132.5	-179.4	0	0	0	0	0	113.7	E842 M868 H869 V892	E842-G866 WeakPolarHBondContact O-CA 3.24Å; G866-M868 VanDerWaalsContact C-N 3.35Å; G866-M868 PolarHBondContact O-N 2.85Å; G866-H869 PolarHBondContact O-N 3.19Å; G866-V892 PolarHBondContact O-N 2.94Å
867	R	96.9	Very high	93.7	Very high	96 Å²	96	29.1 Å²	29.1	36%	0.362	13%	0.128	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62	-27.8	-172.3	-174.7	167.4	167.2	176.4	-12.3	115.6	E841 E842 Y844 H869	E841-R867 PolarHBondContact OE1-N 2.93Å; E842-R867 HydrophobicContact CB-CB 3.86Å; E842-R867 PolarHBondContact O-N 3Å; E842-R867 VanDerWaalsContact O-N 3.12Å; E842-R867 IonicContact OE1-CZ 2.69Å; E842-R867 IonicContact OE1-NH1 2.76Å; E842-R867 PolarHBondContact OE1-NH1 2.81Å; E842-R867 WeakPolarHBondContact OE2-CD 3.29Å; E842-R867 IonicContact OE2-CZ 2.68Å; E842-R867 IonicContact OE2-NE 2.67Å; E842-R867 IonicContact OE2-NH1 3.42Å; E842-R867 PolarHBondContact OE2-NH1 3.21Å; Y844-R867 HydrophobicContact CE2-CB 3.86Å; R867-H869 PolarHBondContact O-CE1 3.48Å; R867-H869 PolarHBondContact O-N 2.91Å; R867-H869 PolarHBondContact O-ND1 3.1Å
868	M	96.2	Very high	94	Very high	67 Å²	67	28.3 Å²	28.3	33%	0.33	13%	0.126	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.8	3.5	176.9	-61.4	-71.6	-85.5	0	0	114	E840 E841 G866 E870	E840-M868 HydrophobicContact CB-SD 4.45Å; E841-M868 HydrophobicContact CB-CG 4.07Å; E841-M868 HydrophobicContact CG-CG 4.42Å; E841-M868 PolarHBondContact OE1-N 3.42Å; E841-M868 VanDerWaalsContact OE2-CB 3.27Å; E841-M868 WeakPolarHBondContact OE2-CB 3.28Å; E841-M868 WeakPolarHBondContact OE2-CG 3.2Å; G866-M868 VanDerWaalsContact C-N 3.35Å; G866-M868 PolarHBondContact O-N 2.85Å; M868-E870 WeakPolarHBondContact O-CG 3.1Å; M868-E870 PolarHBondContact O-N 3.2Å
869	H	96.8	Very high	93.8	Very high	66 Å²	66	27.2 Å²	27.2	31%	0.306	13%	0.126	S	C	.	.	S	Bend	trans	63.9	15.7	179	-30.9	-42	0	0	0	114.7	G866 R867 H888 E890 D891	G866-H869 PolarHBondContact O-N 3.19Å; R867-H869 PolarHBondContact O-CE1 3.48Å; R867-H869 PolarHBondContact O-N 2.91Å; R867-H869 PolarHBondContact O-ND1 3.1Å; H869-H888 HydrophobicContact CB-CB 4.43Å; H869-E890 WeakPolarHBondContact ND1-CA 3.4Å; H869-D891 IonicContact CE1-OD1 3.21Å; H869-D891 PolarHBondContact CE1-OD1 3.36Å; H869-D891 VanDerWaalsContact CE1-OD1 3.26Å; H869-D891 PolarHBondContact ND1-N 3.09Å; H869-D891 VanDerWaalsContact ND1-N 3.17Å; H869-D891 IonicContact ND1-OD1 2.71Å; H869-D891 PolarHBondContact ND1-OD1 2.88Å
870	E	96.2	Very high	93.6	Very high	39 Å²	39	29.1 Å²	29.1	18%	0.182	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	141.5	-173.7	-66.7	-174.3	-175.8	0	0	111.8	M868 K886	M868-E870 WeakPolarHBondContact O-CG 3.1Å; M868-E870 PolarHBondContact O-N 3.2Å; E870-K886 HydrophobicContact CG-CB 4.27Å; E870-K886 HydrophobicContact CG-CG 3.98Å; E870-K886 WeakPolarHBondContact OE1-CD 3.34Å; E870-K886 WeakPolarHBondContact OE1-CE 3.42Å; E870-K886 WeakPolarHBondContact OE1-CG 2.76Å; E870-K886 IonicContact OE1-NZ 3.93Å; E870-K886 PolarHBondContact OE1-NZ 3.02Å; E870-K886 IonicContact OE2-NZ 3.99Å; E870-K886 PolarHBondContact OE2-NZ 3.35Å
871	I	98.1	Very high	93.4	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	118.7	178.5	-51.4	167.3	0	0	0	108.6	A863 A865 L873 M885 M895 L905 S907 W917	A863-I871 HydrophobicContact CB-CG2 3.98Å; A865-I871 HydrophobicContact CB-CB 4.26Å; A865-I871 HydrophobicContact CB-CG1 3.87Å; A865-I871 HydrophobicContact CB-CG2 4.39Å; I871-L873 HydrophobicContact CG2-CD2 4.38Å; I871-M885 HydrophobicContact CB-CB 4.19Å; I871-M885 PolarHBondContact N-O 2.88Å; I871-M885 PolarHBondContact O-N 3.34Å; I871-M895 HydrophobicContact CB-SD 4.37Å; I871-M895 HydrophobicContact CD1-SD 3.95Å; I871-M895 HydrophobicContact CG1-SD 3.9Å; I871-M895 HydrophobicContact CG2-CE 4.2Å; I871-M895 HydrophobicContact CG2-SD 3.6Å; I871-L905 HydrophobicContact CD1-CD2 4.07Å; I871-L905 HydrophobicContact CG2-CD2 4.06Å; I871-S907 WeakPolarHBondContact CD1-OG 3.49Å; I871-W917 HydrophobicContact CD1-CZ2 4.25Å
872	R	97.1	Very high	93.2	Very high	9 Å²	9	32 Å²	32	3%	0.034	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	131.4	177.5	-66.9	-176.4	-167	77.9	-13.6	110.1	H838 E841 A863 A864 A883 E884	H838-R872 PolarHBondContact CD2-NH2 2.77Å; H838-R872 PolarHBondContact NE2-NH2 3.21Å; E841-R872 IonicContact OE2-CZ 2.67Å; E841-R872 IonicContact OE2-NH1 3.93Å; E841-R872 PolarHBondContact OE2-NH1 2.91Å; E841-R872 IonicContact OE2-NH2 3.77Å; A863-R872 WeakPolarHBondContact CA-O 3.15Å; A864-R872 PolarHBondContact N-O 2.87Å; A864-R872 PolarHBondContact O-N 3.44Å; R872-A883 WeakPolarHBondContact CA-O 3.45Å; R872-E884 HydrophobicContact CG-CG 4.26Å; R872-E884 IonicContact NE-OE1 3.77Å
873	L	96.5	Very high	93	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	114.2	177.1	-56.4	-175.1	0	0	0	109.9	I861 A863 I871 C881 Y882 A883 M885 I919	I861-L873 HydrophobicContact CG2-CB 4.38Å; A863-L873 HydrophobicContact CB-CD2 3.83Å; I871-L873 HydrophobicContact CG2-CD2 4.38Å; L873-C881 WeakPolarHBondContact O-CA 3.17Å; L873-Y882 HydrophobicContact CB-CD1 4.19Å; L873-Y882 HydrophobicContact CB-CE1 3.59Å; L873-Y882 HydrophobicContact CB-CE2 4.21Å; L873-Y882 HydrophobicContact CD1-CE2 4.16Å; L873-Y882 WeakPolarHBondContact O-CD1 3.36Å; L873-Y882 WeakPolarHBondContact O-CE1 3.5Å; L873-Y882 PolarHBondContact O-N 3.46Å; L873-A883 HydrophobicContact CB-CB 4.28Å; L873-A883 HydrophobicContact CD1-CB 4.1Å; L873-A883 HydrophobicContact CG-CB 4.31Å; L873-A883 PolarHBondContact N-O 3.08Å; L873-M885 HydrophobicContact CD1-SD 3.78Å; L873-M885 HydrophobicContact CD2-SD 3.98Å; L873-M885 HydrophobicContact CG-SD 3.91Å; L873-I919 HydrophobicContact CD1-CB 3.77Å; L873-I919 HydrophobicContact CD1-CD1 4.21Å; L873-I919 HydrophobicContact CD1-CG2 4.03Å; L873-I919 HydrophobicContact CD2-CG2 4.28Å
874	L	94.1	Very high	92.8	Very high	8 Å²	8	36.1 Å²	36.1	4%	0.042	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	135.9	178.3	-48.2	177.4	0	0	0	109.1	V822 F836 I861 L862 A864 P876 V880 C881	V822-L874 HydrophobicContact CG1-CD1 4.5Å; F836-L874 HydrophobicContact CB-CD1 4.3Å; F836-L874 HydrophobicContact CD1-CD1 4.32Å; F836-L874 HydrophobicContact CD1-CD2 4.22Å; F836-L874 HydrophobicContact CD2-CD1 3.9Å; F836-L874 HydrophobicContact CE2-CD1 4.29Å; F836-L874 HydrophobicContact CG-CD1 3.92Å; I861-L874 WeakPolarHBondContact CA-O 3.16Å; L862-L874 HydrophobicContact CB-CB 4.33Å; L862-L874 HydrophobicContact CD2-CD1 4.41Å; L862-L874 PolarHBondContact N-O 3.4Å; L862-L874 WeakPolarHBondContact O-CB 3.1Å; L862-L874 PolarHBondContact O-N 2.81Å; A864-L874 HydrophobicContact CB-CD1 4.48Å; L874-P876 HydrophobicContact CB-CG 4.47Å; L874-P876 WeakPolarHBondContact O-CD 3.4Å; L874-V880 WeakPolarHBondContact CA-O 3.35Å; L874-C881 HydrophobicContact CD2-CB 3.6Å
875	H	90.8	Very high	92.7	Very high	7 Å²	7	36.1 Å²	36.1	3%	0.032	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	93.5	164.6	-174.4	-43	0	0	0	108.2	T859 I861 E877 Q878 L879 V880 Y882 Y927	T859-H875 WeakPolarHBondContact CG2-NE2 3.35Å; T859-H875 PolarHBondContact OG1-CE1 3.37Å; T859-H875 PolarHBondContact OG1-NE2 2.88Å; I861-H875 HydrophobicContact CD1-CB 3.92Å; H875-E877 IonicContact CE1-OE2 3.69Å; H875-E877 PolarHBondContact O-N 2.79Å; H875-Q878 WeakPolarHBondContact CE1-CG 3.45Å; H875-Q878 WeakPolarHBondContact ND1-CG 3.32Å; H875-Q878 PolarHBondContact O-N 2.91Å; H875-L879 PolarHBondContact O-N 3.3Å; H875-V880 PolarHBondContact N-O 2.8Å; H875-Y882 HydrophobicContact CB-CD1 4.16Å; H875-Y882 HydrophobicContact CB-CE1 4.31Å; H875-Y927 HydrophobicContact CB-CE1 4.35Å; H875-Y927 AromaticContact CD2-CE1 3.96Å
876	P	87.5	Confident	92.5	Very high	3 Å²	3	41.4 Å²	41.4	2%	0.019	20%	0.198	C	C	.	.	G	3₁₀ helix	trans	-72.3	-33.4	-159.9	-21.9	36.3	0	0	0	114.3	L824 K834 F836 W848 N860 L862 L874 Q878 L879	L824-P876 HydrophobicContact CD1-CB 3.51Å; L824-P876 HydrophobicContact CD1-CG 4.28Å; K834-P876 VanDerWaalsContact CD-O 3.3Å; K834-P876 WeakPolarHBondContact CD-O 3.48Å; K834-P876 PolarHBondContact NZ-O 3.31Å; F836-P876 HydrophobicContact CE2-CB 4.38Å; F836-P876 HydrophobicContact CZ-CB 4.36Å; W848-P876 HydrophobicContact CH2-CG 4.03Å; W848-P876 HydrophobicContact CZ3-CG 3.89Å; N860-P876 WeakPolarHBondContact O-CD 3.36Å; L862-P876 HydrophobicContact CB-CG 3.92Å; L874-P876 HydrophobicContact CB-CG 4.47Å; L874-P876 WeakPolarHBondContact O-CD 3.4Å; P876-Q878 PolarHBondContact O-N 3.19Å; P876-L879 PolarHBondContact O-N 3.32Å
877	E	84.7	Confident	92.3	Very high	99 Å²	99	42.2 Å²	42.2	46%	0.463	21%	0.207	S	C	.	.	G	3₁₀ helix	trans	-49.2	-45.5	172.7	-173.8	-168	-134.5	0	0	111.4	K834 K857 H875	K834-E877 PolarHBondContact NZ-O 3.49Å; K857-E877 IonicContact NZ-OE1 2.75Å; K857-E877 PolarHBondContact NZ-OE1 2.83Å; K857-E877 IonicContact NZ-OE2 2.85Å; K857-E877 PolarHBondContact NZ-OE2 3.06Å; H875-E877 IonicContact CE1-OE2 3.69Å; H875-E877 PolarHBondContact O-N 2.79Å
878	Q	82.9	Confident	92.2	Very high	93 Å²	93	38.2 Å²	38.2	44%	0.435	19%	0.192	S	C	.	.	G	3₁₀ helix	trans	-93.7	-3.5	-169.7	-59	-72.8	-38.2	0	0	113.6	H875 P876 V880 Y927	H875-Q878 WeakPolarHBondContact CE1-CG 3.45Å; H875-Q878 WeakPolarHBondContact ND1-CG 3.32Å; H875-Q878 PolarHBondContact O-N 2.91Å; P876-Q878 PolarHBondContact O-N 3.19Å; Q878-V880 PolarHBondContact O-N 3.16Å; Q878-Y927 VanDerWaalsContact CB-OH 3.24Å; Q878-Y927 WeakPolarHBondContact CB-OH 3.26Å; Q878-Y927 WeakPolarHBondContact CG-OH 3.48Å; Q878-Y927 PolarHBondContact OE1-OH 3Å
879	L	84	Confident	92	Very high	70 Å²	70	39.8 Å²	39.8	37%	0.366	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.1	38.3	179.9	-54.2	178	0	0	0	114.5	L22 K834 F836 H875 P876	L22-L879 HydrophobicContact CD1-CB 4.08Å; L22-L879 WeakPolarHBondContact CD1-O 3.29Å; L22-L879 HydrophobicContact CD2-CB 4.11Å; L22-L879 HydrophobicContact CD2-CD2 4.17Å; K834-L879 HydrophobicContact CB-CD2 4.4Å; K834-L879 HydrophobicContact CD-CD2 3.46Å; K834-L879 VanDerWaalsContact CD-CD2 3.46Å; K834-L879 HydrophobicContact CG-CD2 3.87Å; F836-L879 HydrophobicContact CZ-CD2 4.48Å; H875-L879 PolarHBondContact O-N 3.3Å; P876-L879 PolarHBondContact O-N 3.32Å
880	V	84.8	Confident	91.9	Very high	47 Å²	47	40 Å²	40	29%	0.285	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	127.7	-178.7	177.1	0	0	0	0	111.9	L874 H875 Q878	L874-V880 WeakPolarHBondContact CA-O 3.35Å; H875-V880 PolarHBondContact N-O 2.8Å; Q878-V880 PolarHBondContact O-N 3.16Å
881	C	90.4	Very high	91.9	Very high	38 Å²	38	40.2 Å²	40.2	26%	0.257	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	115.7	155	-177.4	0	0	0	0	108	L873 L874	L873-C881 WeakPolarHBondContact O-CA 3.17Å; L874-C881 HydrophobicContact CD2-CB 3.6Å
882	Y	90.8	Very high	91.9	Very high	31 Å²	31	40.2 Å²	40.2	12%	0.122	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	-11.5	-169.5	70.4	-86.8	0	0	0	115	I861 L873 H875 P922 Y927 T929	I861-Y882 HydrophobicContact CD1-CE1 3.89Å; I861-Y882 HydrophobicContact CG2-CE1 4.03Å; I861-Y882 WeakPolarHBondContact CG2-OH 3.26Å; L873-Y882 HydrophobicContact CB-CD1 4.19Å; L873-Y882 HydrophobicContact CB-CE1 3.59Å; L873-Y882 HydrophobicContact CB-CE2 4.21Å; L873-Y882 HydrophobicContact CD1-CE2 4.16Å; L873-Y882 WeakPolarHBondContact O-CD1 3.36Å; L873-Y882 WeakPolarHBondContact O-CE1 3.5Å; L873-Y882 PolarHBondContact O-N 3.46Å; H875-Y882 HydrophobicContact CB-CD1 4.16Å; H875-Y882 HydrophobicContact CB-CE1 4.31Å; Y882-P922 HydrophobicContact CD2-CB 3.95Å; Y882-P922 HydrophobicContact CE2-CB 3.72Å; Y882-P922 HydrophobicContact CE2-CG 3.94Å; Y882-Y927 HydrophobicContact CG-CD1 4.31Å; Y882-T929 HydrophobicContact CD2-CG2 4.02Å; Y882-T929 HydrophobicContact CE2-CG2 3.83Å
883	A	93.4	Very high	91.8	Very high	12 Å²	12	41 Å²	41	10%	0.099	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	143.1	174.9	0	0	0	0	0	111.8	R872 L873 T929 Y931	R872-A883 WeakPolarHBondContact CA-O 3.45Å; L873-A883 HydrophobicContact CB-CB 4.28Å; L873-A883 HydrophobicContact CD1-CB 4.1Å; L873-A883 HydrophobicContact CG-CB 4.31Å; L873-A883 PolarHBondContact N-O 3.08Å; A883-T929 HydrophobicContact CB-CG2 3.88Å; A883-Y931 HydrophobicContact CB-CD1 4.29Å; A883-Y931 HydrophobicContact CB-CE1 4.42Å
884	E	94.4	Very high	91.8	Very high	73 Å²	73	41.3 Å²	41.3	34%	0.341	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	113.8	170.6	-53.2	-168.7	140.3	0	0	108.9	R872 K886 Y931	R872-E884 HydrophobicContact CG-CG 4.26Å; R872-E884 IonicContact NE-OE1 3.77Å; E884-K886 PolarHBondContact O-N 2.95Å; E884-K886 IonicContact OE2-NZ 3.56Å; E884-K886 PolarHBondContact OE2-NZ 2.78Å; E884-Y931 PolarHBondContact O-OH 3.47Å
885	M	96	Very high	92	Very high	1 Å²	1	41.4 Å²	41.4	1%	0.005	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	94.6	-175.7	-61.4	169.1	52.4	0	0	110.1	I871 L873 L905 W917 I919 Y931	I871-M885 HydrophobicContact CB-CB 4.19Å; I871-M885 PolarHBondContact N-O 2.88Å; I871-M885 PolarHBondContact O-N 3.34Å; L873-M885 HydrophobicContact CD1-SD 3.78Å; L873-M885 HydrophobicContact CD2-SD 3.98Å; L873-M885 HydrophobicContact CG-SD 3.91Å; M885-L905 HydrophobicContact CE-CD2 4.42Å; M885-W917 HydrophobicContact CB-CH2 4.44Å; M885-W917 HydrophobicContact CB-CZ3 4.39Å; M885-W917 HydrophobicContact CE-CB 3.61Å; M885-W917 HydrophobicContact CE-CD2 3.35Å; M885-W917 HydrophobicContact CE-CE3 3.47Å; M885-W917 VanDerWaalsContact CE-CE3 3.47Å; M885-W917 HydrophobicContact CE-CG 3.45Å; M885-W917 VanDerWaalsContact CE-CG 3.45Å; M885-W917 HydrophobicContact CE-CZ3 4.17Å; M885-I919 HydrophobicContact CE-CG2 3.99Å; M885-I919 HydrophobicContact SD-CG2 3.8Å; M885-Y931 HydrophobicContact CB-CD2 4.33Å; M885-Y931 HydrophobicContact CB-CE2 4.27Å; M885-Y931 HydrophobicContact CG-CD1 3.89Å; M885-Y931 HydrophobicContact CG-CD2 3.83Å; M885-Y931 HydrophobicContact CG-CE1 4.17Å; M885-Y931 HydrophobicContact CG-CE2 4.1Å; M885-Y931 HydrophobicContact CG-CG 3.72Å; M885-Y931 HydrophobicContact SD-CG 4.43Å
886	K	94.2	Very high	92.3	Very high	110 Å²	110	43.2 Å²	43.2	48%	0.478	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	130.2	178.8	-40.6	-169.6	-174.8	-74.7	0	110.2	E870 E884	E870-K886 HydrophobicContact CG-CB 4.27Å; E870-K886 HydrophobicContact CG-CG 3.98Å; E870-K886 WeakPolarHBondContact OE1-CD 3.34Å; E870-K886 WeakPolarHBondContact OE1-CE 3.42Å; E870-K886 WeakPolarHBondContact OE1-CG 2.76Å; E870-K886 IonicContact OE1-NZ 3.93Å; E870-K886 PolarHBondContact OE1-NZ 3.02Å; E870-K886 IonicContact OE2-NZ 3.99Å; E870-K886 PolarHBondContact OE2-NZ 3.35Å; E884-K886 PolarHBondContact O-N 2.95Å; E884-K886 IonicContact OE2-NZ 3.56Å; E884-K886 PolarHBondContact OE2-NZ 2.78Å
887	G	91.8	Very high	92.8	Very high	18 Å²	18	44.1 Å²	44.1	19%	0.186	23%	0.231	C	C	.	.			trans	162.7	-11.4	175.6	0	0	0	0	0	118	I915 R936	G887-I915 VanDerWaalsContact O-CD1 3.3Å; G887-I915 WeakPolarHBondContact O-CD1 3.28Å; G887-R936 VanDerWaalsContact O-CZ 3.3Å; G887-R936 PolarHBondContact O-NH1 2.71Å; G887-R936 PolarHBondContact O-NH2 2.91Å
888	H	94.9	Very high	93.3	Very high	11 Å²	11	39.9 Å²	39.9	5%	0.051	21%	0.211	C	C	.	.			trans	-70	167.1	149	-74	-83.4	0	0	0	109.1	H869 V892 S907 D909 I915	H869-H888 HydrophobicContact CB-CB 4.43Å; H888-V892 HydrophobicContact CB-CG2 4Å; H888-S907 PolarHBondContact CE1-O 2.87Å; H888-S907 WeakPolarHBondContact NE2-CB 3.48Å; H888-S907 PolarHBondContact NE2-OG 2.85Å; H888-D909 IonicContact CE1-OD2 2.82Å; H888-D909 PolarHBondContact CE1-OD2 2.95Å; H888-D909 IonicContact CG-OD2 3.15Å; H888-D909 WeakPolarHBondContact ND1-CB 3.42Å; H888-D909 IonicContact ND1-OD2 3.85Å; H888-D909 PolarHBondContact ND1-OD2 3.23Å; H888-I915 HydrophobicContact CB-CD1 4.41Å
889	T	93.6	Very high	93.6	Very high	100 Å²	100	40.7 Å²	40.7	61%	0.613	22%	0.215	S	C	*	.	S	Bend	trans	-127.7	2.5	177.9	55.2	0	0	0	0	112.3
890	E	95	Very high	93.7	Very high	70 Å²	70	42.4 Å²	42.4	33%	0.327	23%	0.228	S	C	.	.	S	Bend	trans	-152.2	160.2	-169.4	-54.1	-88.5	162	0	0	106.4	H869 V892 D909 K911	H869-E890 WeakPolarHBondContact ND1-CA 3.4Å; E890-V892 PolarHBondContact O-N 3.4Å; E890-D909 HydrophobicContact CB-CB 4.41Å; E890-K911 HydrophobicContact CB-CB 4.49Å; E890-K911 HydrophobicContact CB-CG 4Å; E890-K911 HydrophobicContact CG-CB 3.95Å; E890-K911 HydrophobicContact CG-CG 3.37Å; E890-K911 WeakPolarHBondContact OE2-CE 3.08Å; E890-K911 WeakPolarHBondContact OE2-CG 3.34Å
891	D	95.5	Very high	94.1	Very high	44 Å²	44	44.1 Å²	44.1	24%	0.235	23%	0.233	C	C	.	.			trans	-49.3	127.6	-173.6	-61.1	22.4	0	0	0	113.3	Y844 H869 T893 D909 S910	Y844-D891 HydrophobicContact CD2-CB 4.31Å; Y844-D891 HydrophobicContact CE2-CB 3.88Å; Y844-D891 WeakPolarHBondContact CE2-OD2 3.4Å; H869-D891 IonicContact CE1-OD1 3.21Å; H869-D891 PolarHBondContact CE1-OD1 3.36Å; H869-D891 VanDerWaalsContact CE1-OD1 3.26Å; H869-D891 PolarHBondContact ND1-N 3.09Å; H869-D891 VanDerWaalsContact ND1-N 3.17Å; H869-D891 IonicContact ND1-OD1 2.71Å; H869-D891 PolarHBondContact ND1-OD1 2.88Å; D891-T893 PolarHBondContact O-N 3.41Å; D891-D909 CarbonylContact O-C 3.56Å; D891-D909 WeakPolarHBondContact O-CA 3.42Å; D891-D909 WeakPolarHBondContact O-CB 3.19Å; D891-S910 PolarHBondContact O-N 3.29Å
892	V	97.5	Very high	94.2	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	111.9	178.4	-175.2	0	0	0	0	109.2	T845 A865 G866 H888 E890 M895	T845-V892 HydrophobicContact CG2-CG1 4.06Å; T845-V892 WeakPolarHBondContact CG2-O 3.47Å; A865-V892 HydrophobicContact CB-CB 3.74Å; A865-V892 HydrophobicContact CB-CG1 3.71Å; A865-V892 HydrophobicContact CB-CG2 4.24Å; G866-V892 PolarHBondContact O-N 2.94Å; H888-V892 HydrophobicContact CB-CG2 4Å; E890-V892 PolarHBondContact O-N 3.4Å; V892-M895 HydrophobicContact CG1-CG 4Å; V892-M895 HydrophobicContact CG1-SD 4.4Å
893	T	95.5	Very high	94.4	Very high	26 Å²	26	44.5 Å²	44.5	16%	0.16	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	-25.3	-170.3	47.4	0	0	0	0	113.7	D891 G908 V947	D891-T893 PolarHBondContact O-N 3.41Å; T893-G908 PolarHBondContact N-O 3.2Å; T893-G908 PolarHBondContact OG1-O 2.95Å; T893-V947 WeakPolarHBondContact CB-O 3.29Å; T893-V947 PolarHBondContact OG1-O 2.83Å
894	A	96.5	Very high	94.6	Very high	6 Å²	6	44.3 Å²	44.3	5%	0.05	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	141.3	-179.6	0	0	0	0	0	112.3	S907 G908 V947 L950	A894-S907 CarbonylContact O-C 3.53Å; A894-S907 VanDerWaalsContact O-CA 3.3Å; A894-S907 WeakPolarHBondContact O-CA 3.28Å; A894-G908 PolarHBondContact N-O 2.95Å; A894-G908 PolarHBondContact O-N 3.18Å; A894-V947 HydrophobicContact CB-CG1 4.48Å; A894-L950 HydrophobicContact CB-CD1 4.21Å; A894-L950 HydrophobicContact CB-CG 4.19Å
895	M	98	Very high	94.8	Very high	11 Å²	11	40.9 Å²	40.9	5%	0.054	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	140.1	172.2	-69	-160.9	-59.4	0	0	112	T845 A847 A863 A865 I871 V892 L905 F906	T845-M895 HydrophobicContact CG2-CB 4.39Å; T845-M895 HydrophobicContact CG2-CE 4.17Å; T845-M895 HydrophobicContact CG2-CG 3.84Å; T845-M895 PolarHBondContact OG1-N 2.75Å; A847-M895 HydrophobicContact CB-CB 3.94Å; A863-M895 HydrophobicContact CB-CE 3.8Å; A863-M895 HydrophobicContact CB-SD 4.32Å; A863-M895 WeakPolarHBondContact O-CE 3.17Å; A865-M895 HydrophobicContact CB-CE 3.78Å; A865-M895 HydrophobicContact CB-SD 3.81Å; I871-M895 HydrophobicContact CB-SD 4.37Å; I871-M895 HydrophobicContact CD1-SD 3.95Å; I871-M895 HydrophobicContact CG1-SD 3.9Å; I871-M895 HydrophobicContact CG2-CE 4.2Å; I871-M895 HydrophobicContact CG2-SD 3.6Å; V892-M895 HydrophobicContact CG1-CG 4Å; V892-M895 HydrophobicContact CG1-SD 4.4Å; M895-L905 HydrophobicContact CB-CD1 4.28Å; M895-L905 HydrophobicContact SD-CD1 4.47Å; M895-L905 HydrophobicContact SD-CD2 4.31Å; M895-F906 WeakPolarHBondContact CA-O 3.32Å
896	I	97.7	Very high	94.9	Very high	44 Å²	44	40.8 Å²	40.8	23%	0.226	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	142.8	167.3	57.6	162.1	0	0	0	111.5	F906 L950 F952 L959	I896-F906 HydrophobicContact CD1-CD2 4.26Å; I896-F906 HydrophobicContact CG1-CB 4.02Å; I896-F906 HydrophobicContact CG1-CD2 4.09Å; I896-F906 HydrophobicContact CG1-CG 4.49Å; I896-F906 PolarHBondContact N-O 2.85Å; I896-F906 PolarHBondContact O-N 3.1Å; I896-L950 HydrophobicContact CD1-CB 3.96Å; I896-L950 HydrophobicContact CG1-CB 3.83Å; I896-F952 HydrophobicContact CD1-CB 3.96Å; I896-L959 HydrophobicContact CD1-CD1 4.23Å
897	F	97.1	Very high	95.1	Very high	22 Å²	22	35.6 Å²	35.6	10%	0.096	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	152.7	168.4	-80.9	-84.3	0	0	0	112	A847 W848 T849 A863 Q899 S902 I904 L905 I919	A847-F897 HydrophobicContact CB-CD2 3.75Å; A847-F897 HydrophobicContact CB-CE2 3.99Å; A847-F897 WeakPolarHBondContact O-CE2 3.42Å; W848-F897 VanDerWaalsContact O-CD2 3.22Å; W848-F897 WeakPolarHBondContact O-CD2 3.35Å; T849-F897 HydrophobicContact CG2-CD1 3.98Å; T849-F897 HydrophobicContact CG2-CD2 4.17Å; T849-F897 HydrophobicContact CG2-CE1 3.61Å; T849-F897 HydrophobicContact CG2-CE2 3.82Å; T849-F897 HydrophobicContact CG2-CG 4.25Å; T849-F897 HydrophobicContact CG2-CZ 3.53Å; A863-F897 HydrophobicContact CB-CE2 3.82Å; A863-F897 HydrophobicContact CB-CZ 4.06Å; F897-Q899 PolarHBondContact O-N 3.33Å; F897-S902 WeakPolarHBondContact CD1-O 3.37Å; F897-I904 WeakPolarHBondContact CA-O 3.44Å; F897-I904 WeakPolarHBondContact CD1-O 3.39Å; F897-L905 HydrophobicContact CD1-CB 4.03Å; F897-L905 HydrophobicContact CD1-CD1 4.22Å; F897-L905 HydrophobicContact CD2-CD1 3.96Å; F897-L905 HydrophobicContact CE1-CB 3.76Å; F897-L905 HydrophobicContact CE1-CD1 4.13Å; F897-L905 HydrophobicContact CE1-CG 4.37Å; F897-L905 HydrophobicContact CE2-CD1 3.87Å; F897-L905 HydrophobicContact CG-CD1 4.14Å; F897-L905 HydrophobicContact CZ-CB 4.26Å; F897-L905 HydrophobicContact CZ-CD1 3.96Å; F897-L905 HydrophobicContact CZ-CD2 4.27Å; F897-L905 HydrophobicContact CZ-CG 4.4Å; F897-I919 HydrophobicContact CE1-CD1 3.94Å; F897-I919 HydrophobicContact CE1-CG1 4.18Å; F897-I919 HydrophobicContact CE1-CG2 4.15Å; F897-I919 HydrophobicContact CZ-CD1 4.16Å; F897-I919 HydrophobicContact CZ-CG2 4.45Å
898	H	94.8	Very high	95.3	Very high	11 Å²	11	34.7 Å²	34.7	5%	0.051	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	112	176.5	-178.1	-64.2	0	0	0	110.8	T900 Q901 I904 F906 F952	H898-T900 PolarHBondContact CE1-OG1 3.31Å; H898-T900 VanDerWaalsContact CE1-OG1 3.29Å; H898-T900 PolarHBondContact ND1-N 2.93Å; H898-T900 PolarHBondContact O-N 3.13Å; H898-Q901 HydrophobicContact CB-CB 4.24Å; H898-Q901 PolarHBondContact CE1-NE2 3.5Å; H898-Q901 WeakPolarHBondContact ND1-CB 3.32Å; H898-Q901 PolarHBondContact ND1-N 3.15Å; H898-Q901 PolarHBondContact NE2-NE2 3.46Å; H898-Q901 CarbonylContact O-C 3.21Å; H898-Q901 PolarHBondContact O-N 2.99Å; H898-I904 HydrophobicContact CB-CB 3.77Å; H898-I904 HydrophobicContact CB-CG2 3.94Å; H898-I904 PolarHBondContact N-O 3.38Å; H898-F906 HydrophobicContact CB-CE2 3.88Å; H898-F952 AromaticContact CD2-CD1 3.77Å; H898-F952 AromaticContact CD2-CE1 3.35Å; H898-F952 WeakPolarHBondContact CD2-CE1 3.33Å; H898-F952 AromaticContact CD2-CZ 3.74Å; H898-F952 AromaticContact CE1-CE1 3.85Å; H898-F952 AromaticContact NE2-CD1 3.97Å; H898-F952 AromaticContact NE2-CE1 3.15Å; H898-F952 WeakPolarHBondContact NE2-CE1 3.07Å; H898-F952 AromaticContact NE2-CZ 3.56Å
899	Q	89.1	Confident	95.3	Very high	110 Å²	110	34.2 Å²	34.2	51%	0.514	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-44.6	-31.3	-173.4	-69.1	163.8	1	0	0	116.9	F897 P954	F897-Q899 PolarHBondContact O-N 3.33Å; Q899-P954 HydrophobicContact CB-CG 4.15Å; Q899-P954 VanDerWaalsContact OE1-CD 3.25Å; Q899-P954 VanDerWaalsContact OE1-CG 3.25Å
900	T	87.6	Confident	95.2	Very high	105 Å²	105	30.8 Å²	30.8	64%	0.644	17%	0.167	S	C	*	.	T	Hydrogen-bonded Turn	trans	-116.6	12.3	178.5	82.6	0	0	0	0	114.9	H898	H898-T900 PolarHBondContact CE1-OG1 3.31Å; H898-T900 VanDerWaalsContact CE1-OG1 3.29Å; H898-T900 PolarHBondContact ND1-N 2.93Å; H898-T900 PolarHBondContact O-N 3.13Å
901	Q	92.6	Very high	94.9	Very high	84 Å²	84	30.7 Å²	30.7	39%	0.393	17%	0.165	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	84.1	-179.6	-65.7	-176.8	79.8	0	0	108.1	H898 T903 I904	H898-Q901 HydrophobicContact CB-CB 4.24Å; H898-Q901 PolarHBondContact CE1-NE2 3.5Å; H898-Q901 WeakPolarHBondContact ND1-CB 3.32Å; H898-Q901 PolarHBondContact ND1-N 3.15Å; H898-Q901 PolarHBondContact NE2-NE2 3.46Å; H898-Q901 CarbonylContact O-C 3.21Å; H898-Q901 PolarHBondContact O-N 2.99Å; Q901-T903 PolarHBondContact O-N 3Å; Q901-I904 HydrophobicContact CB-CB 4.26Å; Q901-I904 HydrophobicContact CB-CG1 3.8Å; Q901-I904 PolarHBondContact O-N 2.89Å
902	S	93	Very high	94.7	Very high	49 Å²	49	28.6 Å²	28.6	34%	0.343	15%	0.154	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	-17.9	-163.8	44.4	0	0	0	0	115.8	T849 T850 F897	T849-S902 WeakPolarHBondContact OG1-CA 3.32Å; T849-S902 WeakPolarHBondContact OG1-CB 3.48Å; T849-S902 PolarHBondContact OG1-O 3.04Å; T850-S902 WeakPolarHBondContact O-CB 3.43Å; T850-S902 PolarHBondContact O-OG 3.28Å; T850-S902 VanDerWaalsContact O-OG 3.11Å; F897-S902 WeakPolarHBondContact CD1-O 3.37Å
903	T	94.9	Very high	94.5	Very high	28 Å²	28	29.1 Å²	29.1	17%	0.172	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	-9	173.6	72.3	0	0	0	0	113.8	V851 Q901 D918 I919 I921	V851-T903 HydrophobicContact CG1-CG2 4.44Å; Q901-T903 PolarHBondContact O-N 3Å; T903-D918 WeakPolarHBondContact CB-OD1 3.45Å; T903-D918 CarbonylContact O-C 3.54Å; T903-D918 WeakPolarHBondContact O-CA 3.33Å; T903-D918 PolarHBondContact OG1-OD1 3.14Å; T903-I919 WeakPolarHBondContact O-CG1 3.22Å; T903-I919 PolarHBondContact O-N 3.1Å; T903-I921 HydrophobicContact CG2-CG1 3.85Å
904	I	96.9	Very high	94.5	Very high	8 Å²	8	27.9 Å²	27.9	4%	0.041	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	116	-175.4	-56.3	-66.7	0	0	0	110.3	F897 H898 Q901 F906 V916 W917 D918 L934 L975	F897-I904 WeakPolarHBondContact CA-O 3.44Å; F897-I904 WeakPolarHBondContact CD1-O 3.39Å; H898-I904 HydrophobicContact CB-CB 3.77Å; H898-I904 HydrophobicContact CB-CG2 3.94Å; H898-I904 PolarHBondContact N-O 3.38Å; Q901-I904 HydrophobicContact CB-CB 4.26Å; Q901-I904 HydrophobicContact CB-CG1 3.8Å; Q901-I904 PolarHBondContact O-N 2.89Å; I904-F906 HydrophobicContact CG2-CE2 4.46Å; I904-F906 HydrophobicContact CG2-CZ 4.31Å; I904-V916 HydrophobicContact CG2-CG1 4.17Å; I904-W917 VanDerWaalsContact CA-O 3.32Å; I904-W917 WeakPolarHBondContact CA-O 3.48Å; I904-D918 HydrophobicContact CD1-CB 4.11Å; I904-L934 HydrophobicContact CD1-CD1 3.7Å; I904-L975 HydrophobicContact CD1-CD1 4.47Å; I904-L975 HydrophobicContact CG1-CD1 4.22Å; I904-L975 HydrophobicContact CG2-CD1 4.36Å; I904-L975 HydrophobicContact CG2-CD2 4.12Å
905	L	98.1	Very high	94.5	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	132.8	-178.8	177.4	62	0	0	0	110.4	A863 I871 M885 M895 F897 W917 I919	A863-L905 HydrophobicContact CB-CD2 4.31Å; I871-L905 HydrophobicContact CD1-CD2 4.07Å; I871-L905 HydrophobicContact CG2-CD2 4.06Å; M885-L905 HydrophobicContact CE-CD2 4.42Å; M895-L905 HydrophobicContact CB-CD1 4.28Å; M895-L905 HydrophobicContact SD-CD1 4.47Å; M895-L905 HydrophobicContact SD-CD2 4.31Å; F897-L905 HydrophobicContact CD1-CB 4.03Å; F897-L905 HydrophobicContact CD1-CD1 4.22Å; F897-L905 HydrophobicContact CD2-CD1 3.96Å; F897-L905 HydrophobicContact CE1-CB 3.76Å; F897-L905 HydrophobicContact CE1-CD1 4.13Å; F897-L905 HydrophobicContact CE1-CG 4.37Å; F897-L905 HydrophobicContact CE2-CD1 3.87Å; F897-L905 HydrophobicContact CG-CD1 4.14Å; F897-L905 HydrophobicContact CZ-CB 4.26Å; F897-L905 HydrophobicContact CZ-CD1 3.96Å; F897-L905 HydrophobicContact CZ-CD2 4.27Å; F897-L905 HydrophobicContact CZ-CG 4.4Å; L905-W917 HydrophobicContact CB-CB 4.35Å; L905-W917 PolarHBondContact N-O 3.16Å; L905-W917 PolarHBondContact O-N 3.35Å; L905-I919 HydrophobicContact CB-CG2 4.07Å; L905-I919 HydrophobicContact CD2-CG2 4.18Å
906	F	98.1	Very high	94.5	Very high	0 Å²	0	27 Å²	27	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	131.4	166.9	-53.5	-83	0	0	0	108.9	M895 I896 H898 I904 I915 V916 L950 F952 L959	M895-F906 WeakPolarHBondContact CA-O 3.32Å; I896-F906 HydrophobicContact CD1-CD2 4.26Å; I896-F906 HydrophobicContact CG1-CB 4.02Å; I896-F906 HydrophobicContact CG1-CD2 4.09Å; I896-F906 HydrophobicContact CG1-CG 4.49Å; I896-F906 PolarHBondContact N-O 2.85Å; I896-F906 PolarHBondContact O-N 3.1Å; H898-F906 HydrophobicContact CB-CE2 3.88Å; I904-F906 HydrophobicContact CG2-CE2 4.46Å; I904-F906 HydrophobicContact CG2-CZ 4.31Å; F906-I915 WeakPolarHBondContact CA-O 3.42Å; F906-V916 HydrophobicContact CD1-CB 4.28Å; F906-V916 HydrophobicContact CD1-CG1 3.8Å; F906-V916 HydrophobicContact CD1-CG2 3.77Å; F906-V916 HydrophobicContact CE1-CB 4.45Å; F906-V916 HydrophobicContact CE1-CG1 3.66Å; F906-V916 HydrophobicContact CE1-CG2 4Å; F906-L950 HydrophobicContact CB-CD1 4.24Å; F906-F952 HydrophobicContact CD2-CB 4.41Å; F906-F952 HydrophobicContact CE1-CD2 4.41Å; F906-F952 HydrophobicContact CE2-CB 3.89Å; F906-F952 HydrophobicContact CE2-CD1 4.43Å; F906-F952 AromaticContact CE2-CD2 3.87Å; F906-F952 HydrophobicContact CE2-CD2 3.87Å; F906-F952 AromaticContact CE2-CG 3.79Å; F906-F952 HydrophobicContact CE2-CG 3.79Å; F906-F952 HydrophobicContact CZ-CB 4.48Å; F906-F952 AromaticContact CZ-CD2 3.6Å; F906-F952 HydrophobicContact CZ-CD2 3.6Å; F906-F952 AromaticContact CZ-CE2 3.97Å; F906-F952 HydrophobicContact CZ-CE2 3.97Å; F906-F952 HydrophobicContact CZ-CG 4Å; F906-L959 HydrophobicContact CB-CD1 4.16Å; F906-L959 HydrophobicContact CB-CD2 4.47Å; F906-L959 HydrophobicContact CD1-CD1 3.78Å; F906-L959 HydrophobicContact CD1-CD2 3.55Å; F906-L959 HydrophobicContact CD1-CG 4.24Å; F906-L959 HydrophobicContact CD2-CD1 4.02Å; F906-L959 HydrophobicContact CE1-CD1 4.11Å; F906-L959 HydrophobicContact CE1-CD2 4.01Å; F906-L959 HydrophobicContact CE1-CG 4.47Å; F906-L959 HydrophobicContact CE2-CD1 4.31Å; F906-L959 HydrophobicContact CG-CD1 3.73Å; F906-L959 HydrophobicContact CG-CD2 4.19Å; F906-L959 HydrophobicContact CZ-CD1 4.36Å
907	S	98.1	Very high	94.5	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	138.9	178.2	58.2	0	0	0	0	111.3	I871 H888 A894 V914 I915 W917	I871-S907 WeakPolarHBondContact CD1-OG 3.49Å; H888-S907 PolarHBondContact CE1-O 2.87Å; H888-S907 WeakPolarHBondContact NE2-CB 3.48Å; H888-S907 PolarHBondContact NE2-OG 2.85Å; A894-S907 CarbonylContact O-C 3.53Å; A894-S907 VanDerWaalsContact O-CA 3.3Å; A894-S907 WeakPolarHBondContact O-CA 3.28Å; S907-V914 CarbonylContact O-C 3.54Å; S907-V914 VanDerWaalsContact O-CA 3.24Å; S907-V914 WeakPolarHBondContact O-CA 3.48Å; S907-I915 PolarHBondContact N-O 3.38Å; S907-I915 PolarHBondContact O-N 3.01Å; S907-W917 PolarHBondContact OG-NE1 2.82Å
908	G	96.2	Very high	94.4	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	148.9	-178.8	0	0	0	0	0	112.1	T893 A894 S913	T893-G908 PolarHBondContact N-O 3.2Å; T893-G908 PolarHBondContact OG1-O 2.95Å; A894-G908 PolarHBondContact N-O 2.95Å; A894-G908 PolarHBondContact O-N 3.18Å; G908-S913 WeakPolarHBondContact CA-O 3.45Å
909	D	94.9	Very high	94.4	Very high	1 Å²	1	25.8 Å²	25.8	1%	0.005	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	171.7	-178.7	61.7	46.9	0	0	0	115.1	H888 E890 D891 K911 A912 S913 V947	H888-D909 IonicContact CE1-OD2 2.82Å; H888-D909 PolarHBondContact CE1-OD2 2.95Å; H888-D909 IonicContact CG-OD2 3.15Å; H888-D909 WeakPolarHBondContact ND1-CB 3.42Å; H888-D909 IonicContact ND1-OD2 3.85Å; H888-D909 PolarHBondContact ND1-OD2 3.23Å; E890-D909 HydrophobicContact CB-CB 4.41Å; D891-D909 CarbonylContact O-C 3.56Å; D891-D909 WeakPolarHBondContact O-CA 3.42Å; D891-D909 WeakPolarHBondContact O-CB 3.19Å; D909-K911 PolarHBondContact O-N 2.97Å; D909-K911 VanDerWaalsContact O-N 3.16Å; D909-K911 VanDerWaalsContact OD1-C 3.25Å; D909-K911 WeakPolarHBondContact OD1-CA 3.3Å; D909-K911 PolarHBondContact OD1-N 3.4Å; D909-A912 PolarHBondContact O-N 2.74Å; D909-A912 PolarHBondContact OD1-N 2.85Å; D909-S913 PolarHBondContact N-O 3.16Å; D909-S913 WeakPolarHBondContact OD1-CA 3.39Å; D909-S913 WeakPolarHBondContact OD1-CB 3.44Å; D909-S913 PolarHBondContact OD1-N 3.15Å; D909-S913 WeakPolarHBondContact OD2-CB 3.45Å; D909-S913 PolarHBondContact OD2-OG 2.84Å; D909-V947 PolarHBondContact O-N 2.89Å
910	S	92.4	Very high	94.5	Very high	28 Å²	28	21.1 Å²	21.1	20%	0.196	12%	0.121	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-1.1	178.9	66.4	0	0	0	0	115.3	D891	D891-S910 PolarHBondContact O-N 3.29Å
911	K	89.6	Confident	94.6	Very high	68 Å²	68	20.4 Å²	20.4	30%	0.296	11%	0.112	S	C	.	.	T	Hydrogen-bonded Turn	trans	-121.9	37	173.9	-62.2	-58.9	177.7	-161.1	0	113.2	E890 D909 S913	E890-K911 HydrophobicContact CB-CB 4.49Å; E890-K911 HydrophobicContact CB-CG 4Å; E890-K911 HydrophobicContact CG-CB 3.95Å; E890-K911 HydrophobicContact CG-CG 3.37Å; E890-K911 WeakPolarHBondContact OE2-CE 3.08Å; E890-K911 WeakPolarHBondContact OE2-CG 3.34Å; D909-K911 PolarHBondContact O-N 2.97Å; D909-K911 VanDerWaalsContact O-N 3.16Å; D909-K911 VanDerWaalsContact OD1-C 3.25Å; D909-K911 WeakPolarHBondContact OD1-CA 3.3Å; D909-K911 PolarHBondContact OD1-N 3.4Å; K911-S913 PolarHBondContact O-N 3.14Å
912	A	91	Very high	94.3	Very high	0 Å²	0	16.4 Å²	16.4	0%	0	9%	0.094	C	C	.	.	S	Bend	trans	63.6	14	170.2	0	0	0	0	0	114.2	D909 C939 L942 N945	D909-A912 PolarHBondContact O-N 2.74Å; D909-A912 PolarHBondContact OD1-N 2.85Å; A912-C939 HydrophobicContact CB-CB 3.62Å; A912-C939 WeakPolarHBondContact O-CB 3.42Å; A912-C939 PolarHBondContact O-N 2.68Å; A912-C939 PolarHBondContact O-SG 2.85Å; A912-L942 HydrophobicContact CB-CD2 4.33Å; A912-N945 WeakPolarHBondContact CA-O 3.43Å; A912-N945 HydrophobicContact CB-CB 3.77Å; A912-N945 WeakPolarHBondContact CB-O 3.3Å; A912-N945 PolarHBondContact N-O 3.27Å
913	S	92.9	Very high	93.8	Very high	10 Å²	10	16 Å²	16	7%	0.07	9%	0.091	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	137.5	177	133.5	0	0	0	0	109.9	G908 D909 K911	G908-S913 WeakPolarHBondContact CA-O 3.45Å; D909-S913 PolarHBondContact N-O 3.16Å; D909-S913 WeakPolarHBondContact OD1-CA 3.39Å; D909-S913 WeakPolarHBondContact OD1-CB 3.44Å; D909-S913 PolarHBondContact OD1-N 3.15Å; D909-S913 WeakPolarHBondContact OD2-CB 3.45Å; D909-S913 PolarHBondContact OD2-OG 2.84Å; K911-S913 PolarHBondContact O-N 3.14Å
914	V	95.6	Very high	92.8	Very high	0 Å²	0	17.7 Å²	17.7	0%	0	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	120.9	177.7	177.4	0	0	0	0	108.3	S907 L937 V947 L950 L959	S907-V914 CarbonylContact O-C 3.54Å; S907-V914 VanDerWaalsContact O-CA 3.24Å; S907-V914 WeakPolarHBondContact O-CA 3.48Å; V914-L937 HydrophobicContact CB-CB 4.15Å; V914-L937 HydrophobicContact CG1-CD1 4.42Å; V914-L937 PolarHBondContact N-O 3.24Å; V914-L937 WeakPolarHBondContact O-CA 3.25Å; V914-L937 WeakPolarHBondContact O-CB 3.24Å; V914-L937 PolarHBondContact O-N 3.15Å; V914-V947 HydrophobicContact CG2-CB 4.46Å; V914-V947 HydrophobicContact CG2-CG1 4.03Å; V914-V947 HydrophobicContact CG2-CG2 3.76Å; V914-L950 HydrophobicContact CG1-CD1 4.36Å; V914-L950 HydrophobicContact CG1-CD2 4.05Å; V914-L950 HydrophobicContact CG2-CD2 4.11Å; V914-L959 HydrophobicContact CG1-CD2 3.86Å
915	I	96.3	Very high	91.7	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	141.4	-178.6	-54.5	-179.4	0	0	0	109.2	G887 H888 F906 S907 W917 L933 R936	G887-I915 VanDerWaalsContact O-CD1 3.3Å; G887-I915 WeakPolarHBondContact O-CD1 3.28Å; H888-I915 HydrophobicContact CB-CD1 4.41Å; F906-I915 WeakPolarHBondContact CA-O 3.42Å; S907-I915 PolarHBondContact N-O 3.38Å; S907-I915 PolarHBondContact O-N 3.01Å; I915-W917 HydrophobicContact CB-CZ2 4.23Å; I915-W917 HydrophobicContact CD1-CZ2 3.97Å; I915-W917 HydrophobicContact CG2-CD2 3.83Å; I915-W917 HydrophobicContact CG2-CE3 4.5Å; I915-W917 HydrophobicContact CG2-CG 4.22Å; I915-W917 HydrophobicContact CG2-CH2 4.43Å; I915-W917 HydrophobicContact CG2-CZ2 3.72Å; I915-L933 HydrophobicContact CD1-CD1 4.33Å; I915-L933 HydrophobicContact CG2-CD1 3.6Å; I915-L933 HydrophobicContact CG2-CD2 4.26Å; I915-L933 HydrophobicContact CG2-CG 3.55Å; I915-R936 VanDerWaalsContact CD1-NH1 3.27Å
916	V	97.1	Very high	90.8	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	127.4	172.2	-166.1	0	0	0	0	108.4	I904 F906 L934 M935 L937 L975	I904-V916 HydrophobicContact CG2-CG1 4.17Å; F906-V916 HydrophobicContact CD1-CB 4.28Å; F906-V916 HydrophobicContact CD1-CG1 3.8Å; F906-V916 HydrophobicContact CD1-CG2 3.77Å; F906-V916 HydrophobicContact CE1-CB 4.45Å; F906-V916 HydrophobicContact CE1-CG1 3.66Å; F906-V916 HydrophobicContact CE1-CG2 4Å; V916-L934 WeakPolarHBondContact O-CA 3.31Å; V916-L934 WeakPolarHBondContact O-CB 3.46Å; V916-L934 PolarHBondContact O-N 3.42Å; V916-M935 HydrophobicContact CB-CB 4.13Å; V916-M935 HydrophobicContact CB-CE 3.91Å; V916-M935 HydrophobicContact CG1-CE 3.88Å; V916-M935 HydrophobicContact CG2-CB 4.14Å; V916-M935 HydrophobicContact CG2-CE 3.91Å; V916-M935 PolarHBondContact N-O 2.89Å; V916-M935 PolarHBondContact O-N 2.99Å; V916-L937 HydrophobicContact CG2-CD1 3.92Å; V916-L937 HydrophobicContact CG2-CG 4.22Å; V916-L975 HydrophobicContact CG1-CD2 4.07Å
917	W	97.2	Very high	90	Very high	4 Å²	4	27.8 Å²	27.8	2%	0.015	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	154	-176.6	-47.4	86.2	0	0	0	111.3	I871 M885 I904 L905 S907 I915 Q932 L933	I871-W917 HydrophobicContact CD1-CZ2 4.25Å; M885-W917 HydrophobicContact CB-CH2 4.44Å; M885-W917 HydrophobicContact CB-CZ3 4.39Å; M885-W917 HydrophobicContact CE-CB 3.61Å; M885-W917 HydrophobicContact CE-CD2 3.35Å; M885-W917 HydrophobicContact CE-CE3 3.47Å; M885-W917 VanDerWaalsContact CE-CE3 3.47Å; M885-W917 HydrophobicContact CE-CG 3.45Å; M885-W917 VanDerWaalsContact CE-CG 3.45Å; M885-W917 HydrophobicContact CE-CZ3 4.17Å; I904-W917 VanDerWaalsContact CA-O 3.32Å; I904-W917 WeakPolarHBondContact CA-O 3.48Å; L905-W917 HydrophobicContact CB-CB 4.35Å; L905-W917 PolarHBondContact N-O 3.16Å; L905-W917 PolarHBondContact O-N 3.35Å; S907-W917 PolarHBondContact OG-NE1 2.82Å; I915-W917 HydrophobicContact CB-CZ2 4.23Å; I915-W917 HydrophobicContact CD1-CZ2 3.97Å; I915-W917 HydrophobicContact CG2-CD2 3.83Å; I915-W917 HydrophobicContact CG2-CE3 4.5Å; I915-W917 HydrophobicContact CG2-CG 4.22Å; I915-W917 HydrophobicContact CG2-CH2 4.43Å; I915-W917 HydrophobicContact CG2-CZ2 3.72Å; W917-Q932 CarbonylContact C-O 3.48Å; W917-Q932 WeakPolarHBondContact CA-O 3.37Å; W917-L933 HydrophobicContact CE3-CB 3.77Å; W917-L933 HydrophobicContact CE3-CG 4.22Å; W917-L933 HydrophobicContact CH2-CD1 4.15Å; W917-L933 HydrophobicContact CZ3-CB 3.82Å; W917-L933 HydrophobicContact CZ3-CD1 4.1Å; W917-L933 HydrophobicContact CZ3-CG 4.24Å
918	D	96.3	Very high	89.3	Confident	47 Å²	47	32.6 Å²	32.6	25%	0.251	18%	0.179	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	123	151.7	-177.6	3.2	0	0	0	107.1	T903 I904 G920 Y931 Q932 L934	T903-D918 WeakPolarHBondContact CB-OD1 3.45Å; T903-D918 CarbonylContact O-C 3.54Å; T903-D918 WeakPolarHBondContact O-CA 3.33Å; T903-D918 PolarHBondContact OG1-OD1 3.14Å; I904-D918 HydrophobicContact CD1-CB 4.11Å; D918-G920 VanDerWaalsContact C-N 3.29Å; D918-G920 PolarHBondContact OD1-N 3.2Å; D918-Y931 CarbonylContact O-C 3.55Å; D918-Y931 WeakPolarHBondContact O-CA 3.17Å; D918-Y931 WeakPolarHBondContact O-CB 3.29Å; D918-Q932 PolarHBondContact N-O 3.41Å; D918-Q932 PolarHBondContact O-N 3.38Å; D918-L934 HydrophobicContact CB-CD1 4.12Å; D918-L934 HydrophobicContact CB-CD2 4.3Å; D918-L934 HydrophobicContact CB-CG 4.22Å
919	I	95.1	Very high	88.8	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	19%	0.189	C	C	.	.			trans	-80.5	-12.2	177.3	64.9	151.3	0	0	0	112.8	T849 I861 L873 M885 F897 T903 L905 T929	T849-I919 HydrophobicContact CG2-CD1 4.18Å; I861-I919 HydrophobicContact CG2-CD1 4.4Å; L873-I919 HydrophobicContact CD1-CB 3.77Å; L873-I919 HydrophobicContact CD1-CD1 4.21Å; L873-I919 HydrophobicContact CD1-CG2 4.03Å; L873-I919 HydrophobicContact CD2-CG2 4.28Å; M885-I919 HydrophobicContact CE-CG2 3.99Å; M885-I919 HydrophobicContact SD-CG2 3.8Å; F897-I919 HydrophobicContact CE1-CD1 3.94Å; F897-I919 HydrophobicContact CE1-CG1 4.18Å; F897-I919 HydrophobicContact CE1-CG2 4.15Å; F897-I919 HydrophobicContact CZ-CD1 4.16Å; F897-I919 HydrophobicContact CZ-CG2 4.45Å; T903-I919 WeakPolarHBondContact O-CG1 3.22Å; T903-I919 PolarHBondContact O-N 3.1Å; L905-I919 HydrophobicContact CB-CG2 4.07Å; L905-I919 HydrophobicContact CD2-CG2 4.18Å; I919-T929 PolarHBondContact O-OG1 2.94Å
920	G	91.5	Very high	88.4	Confident	12 Å²	12	44.1 Å²	44.1	12%	0.124	23%	0.226	C	C	.	.			trans	66.3	-173.7	-169.9	0	0	0	0	0	113.3	D918	D918-G920 VanDerWaalsContact C-N 3.29Å; D918-G920 PolarHBondContact OD1-N 3.2Å
921	I	89.2	Confident	88.4	Confident	89 Å²	89	46.9 Å²	46.9	46%	0.456	23%	0.233	S	C	.	.			trans	-114.9	129.1	172.4	-57.7	176.9	0	0	0	107.3	V853 T903	V853-I921 HydrophobicContact CG2-CG2 4.3Å; T903-I921 HydrophobicContact CG2-CG1 3.85Å
922	P	86.8	Confident	88.6	Confident	1 Å²	1	47 Å²	47	1%	0.006	24%	0.235	C	C	.	.			trans	-73.4	127.9	178	28.4	-32.5	0	0	0	111.5	Y882 V924 Y927	Y882-P922 HydrophobicContact CD2-CB 3.95Å; Y882-P922 HydrophobicContact CE2-CB 3.72Å; Y882-P922 HydrophobicContact CE2-CG 3.94Å; P922-V924 PolarHBondContact O-N 2.9Å; P922-Y927 HydrophobicContact CB-CD1 4.38Å
923	S	82.4	Confident	88.8	Confident	40 Å²	40	49 Å²	49	28%	0.28	25%	0.246	S	C	.	.	B	Isolated β-bridge	trans	-80.8	104	172.7	69.6	0	0	0	0	110.9	D926 Y927 K928	S923-D926 PolarHBondContact O-N 3.04Å; S923-Y927 WeakPolarHBondContact O-CA 3.49Å; S923-Y927 PolarHBondContact O-N 3.32Å; S923-K928 PolarHBondContact N-O 2.77Å; S923-K928 PolarHBondContact OG-O 2.61Å
924	V	72.8	Confident	88.9	Confident	63 Å²	63	49 Å²	49	38%	0.382	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71	142.7	173.3	170.5	0	0	0	0	109.5	V853 P922 Y927	V853-V924 HydrophobicContact CG1-CB 4.05Å; V853-V924 HydrophobicContact CG1-CG2 3.77Å; P922-V924 PolarHBondContact O-N 2.9Å; V924-Y927 HydrophobicContact CG2-CD1 4.47Å; V924-Y927 HydrophobicContact CG2-CE1 4.07Å
925	P	73.2	Confident	88.9	Confident	104 Å²	104	49 Å²	49	68%	0.675	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	cis	-88.6	-9.7	5.5	36.3	-37.1	0	0	0	115.2	Y927	P925-Y927 WeakPolarHBondContact O-CD2 3.22Å; P925-Y927 PolarHBondContact O-N 3.1Å
926	D	79.4	Confident	88.8	Confident	77 Å²	77	52.3 Å²	52.3	41%	0.412	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.5	-7.5	-174.8	-74.3	-3.5	0	0	0	113.7	S923 K928	S923-D926 PolarHBondContact O-N 3.04Å; D926-K928 HydrophobicContact CB-CD 3.78Å; D926-K928 HydrophobicContact CB-CG 4.01Å; D926-K928 PolarHBondContact O-N 2.86Å; D926-K928 WeakPolarHBondContact OD2-CE 3.38Å; D926-K928 IonicContact OD2-NZ 2.81Å; D926-K928 PolarHBondContact OD2-NZ 3.14Å
927	Y	82.6	Confident	88.7	Confident	39 Å²	39	52.4 Å²	52.4	15%	0.153	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	51.7	16.5	-174.4	-70.6	-87.3	0	0	0	116.3	H875 Q878 Y882 P922 S923 V924 P925 T929	H875-Y927 HydrophobicContact CB-CE1 4.35Å; H875-Y927 AromaticContact CD2-CE1 3.96Å; Q878-Y927 VanDerWaalsContact CB-OH 3.24Å; Q878-Y927 WeakPolarHBondContact CB-OH 3.26Å; Q878-Y927 WeakPolarHBondContact CG-OH 3.48Å; Q878-Y927 PolarHBondContact OE1-OH 3Å; Y882-Y927 HydrophobicContact CG-CD1 4.31Å; P922-Y927 HydrophobicContact CB-CD1 4.38Å; S923-Y927 WeakPolarHBondContact O-CA 3.49Å; S923-Y927 PolarHBondContact O-N 3.32Å; V924-Y927 HydrophobicContact CG2-CD1 4.47Å; V924-Y927 HydrophobicContact CG2-CE1 4.07Å; P925-Y927 WeakPolarHBondContact O-CD2 3.22Å; P925-Y927 PolarHBondContact O-N 3.1Å; Y927-T929 PolarHBondContact O-N 3.38Å
928	K	83.4	Confident	88.4	Confident	101 Å²	101	55.9 Å²	55.9	44%	0.439	27%	0.27	S	S	.	.	B	Isolated β-bridge	trans	-60.5	111.4	177.2	-68.3	159.2	-178.9	162.7	0	109.4	S923 D926	S923-K928 PolarHBondContact N-O 2.77Å; S923-K928 PolarHBondContact OG-O 2.61Å; D926-K928 HydrophobicContact CB-CD 3.78Å; D926-K928 HydrophobicContact CB-CG 4.01Å; D926-K928 PolarHBondContact O-N 2.86Å; D926-K928 WeakPolarHBondContact OD2-CE 3.38Å; D926-K928 IonicContact OD2-NZ 2.81Å; D926-K928 PolarHBondContact OD2-NZ 3.14Å
929	T	84.9	Confident	88.1	Confident	35 Å²	35	53.8 Å²	53.8	22%	0.215	26%	0.259	C	S	.	.			trans	-111.3	165.5	164.9	-170.8	0	0	0	0	109.9	Y882 A883 I919 Y927 Y931	Y882-T929 HydrophobicContact CD2-CG2 4.02Å; Y882-T929 HydrophobicContact CE2-CG2 3.83Å; A883-T929 HydrophobicContact CB-CG2 3.88Å; I919-T929 PolarHBondContact O-OG1 2.94Å; Y927-T929 PolarHBondContact O-N 3.38Å; T929-Y931 HydrophobicContact CG2-CD1 4.44Å
930	R	87.7	Confident	87.4	Confident	208 Å²	208	55.8 Å²	55.8	79%	0.785	27%	0.272	S	S	*	.			trans	-131.8	83	168.7	-173.5	-171.7	176.3	-168.8	-2.6	109
931	Y	92.3	Very high	86.7	Confident	87 Å²	87	60.7 Å²	60.7	34%	0.341	29%	0.287	S	S	.	.			trans	-64.8	154.4	169.7	63.9	-95.8	0	0	0	111	A883 E884 M885 D918 T929	A883-Y931 HydrophobicContact CB-CD1 4.29Å; A883-Y931 HydrophobicContact CB-CE1 4.42Å; E884-Y931 PolarHBondContact O-OH 3.47Å; M885-Y931 HydrophobicContact CB-CD2 4.33Å; M885-Y931 HydrophobicContact CB-CE2 4.27Å; M885-Y931 HydrophobicContact CG-CD1 3.89Å; M885-Y931 HydrophobicContact CG-CD2 3.83Å; M885-Y931 HydrophobicContact CG-CE1 4.17Å; M885-Y931 HydrophobicContact CG-CE2 4.1Å; M885-Y931 HydrophobicContact CG-CG 3.72Å; M885-Y931 HydrophobicContact SD-CG 4.43Å; D918-Y931 CarbonylContact O-C 3.55Å; D918-Y931 WeakPolarHBondContact O-CA 3.17Å; D918-Y931 WeakPolarHBondContact O-CB 3.29Å; T929-Y931 HydrophobicContact CG2-CD1 4.44Å
932	Q	93.7	Very high	85.4	Confident	71 Å²	71	59.7 Å²	59.7	33%	0.332	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	126.4	179.8	179.6	167	-3.9	0	0	110.3	W917 D918 L934	W917-Q932 CarbonylContact C-O 3.48Å; W917-Q932 WeakPolarHBondContact CA-O 3.37Å; D918-Q932 PolarHBondContact N-O 3.41Å; D918-Q932 PolarHBondContact O-N 3.38Å; Q932-L934 HydrophobicContact CG-CD2 4.25Å; Q932-L934 PolarHBondContact O-N 3.44Å
933	L	95.1	Very high	84.2	Confident	42 Å²	42	66 Å²	66	22%	0.22	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	117.1	163.2	-169.1	157.2	0	0	0	108	I915 W917 R936 L977	I915-L933 HydrophobicContact CD1-CD1 4.33Å; I915-L933 HydrophobicContact CG2-CD1 3.6Å; I915-L933 HydrophobicContact CG2-CD2 4.26Å; I915-L933 HydrophobicContact CG2-CG 3.55Å; W917-L933 HydrophobicContact CE3-CB 3.77Å; W917-L933 HydrophobicContact CE3-CG 4.22Å; W917-L933 HydrophobicContact CH2-CD1 4.15Å; W917-L933 HydrophobicContact CZ3-CB 3.82Å; W917-L933 HydrophobicContact CZ3-CD1 4.1Å; W917-L933 HydrophobicContact CZ3-CG 4.24Å; L933-R936 HydrophobicContact CD2-CG 4.07Å; L933-L977 WeakPolarHBondContact O-CD1 3.31Å
934	L	94.9	Very high	83.2	Confident	9 Å²	9	66.4 Å²	66.4	5%	0.047	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	-52	179.5	-62.8	177.1	0	0	0	111.3	I904 V916 D918 Q932 L975 L977 E978	I904-L934 HydrophobicContact CD1-CD1 3.7Å; V916-L934 WeakPolarHBondContact O-CA 3.31Å; V916-L934 WeakPolarHBondContact O-CB 3.46Å; V916-L934 PolarHBondContact O-N 3.42Å; D918-L934 HydrophobicContact CB-CD1 4.12Å; D918-L934 HydrophobicContact CB-CD2 4.3Å; D918-L934 HydrophobicContact CB-CG 4.22Å; Q932-L934 HydrophobicContact CG-CD2 4.25Å; Q932-L934 PolarHBondContact O-N 3.44Å; L934-L975 HydrophobicContact CD1-CB 4.34Å; L934-L977 CarbonylContact O-C 3.59Å; L934-L977 VanDerWaalsContact O-CA 3.32Å; L934-L977 WeakPolarHBondContact O-CA 3.44Å; L934-E978 PolarHBondContact O-N 2.9Å
935	M	94.6	Very high	83	Confident	0 Å²	0	63.5 Å²	63.5	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	154.7	-172.9	-58.3	-179.6	-79.4	0	0	111.7	V916 I972 L975 E978	V916-M935 HydrophobicContact CB-CB 4.13Å; V916-M935 HydrophobicContact CB-CE 3.91Å; V916-M935 HydrophobicContact CG1-CE 3.88Å; V916-M935 HydrophobicContact CG2-CB 4.14Å; V916-M935 HydrophobicContact CG2-CE 3.91Å; V916-M935 PolarHBondContact N-O 2.89Å; V916-M935 PolarHBondContact O-N 2.99Å; M935-I972 HydrophobicContact CE-CD1 4.31Å; M935-I972 HydrophobicContact CE-CG2 3.81Å; M935-L975 HydrophobicContact CE-CD2 3.78Å; M935-E978 HydrophobicContact CG-CB 3.89Å; M935-E978 HydrophobicContact CG-CG 3.89Å; M935-E978 HydrophobicContact SD-CG 4.07Å
936	R	95	Very high	83.7	Confident	70 Å²	70	59.4 Å²	59.4	26%	0.264	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	127.7	164.4	-67.8	-170.8	-179.2	-97	-1.8	109.5	G887 I915 L933 E981 R982	G887-R936 VanDerWaalsContact O-CZ 3.3Å; G887-R936 PolarHBondContact O-NH1 2.71Å; G887-R936 PolarHBondContact O-NH2 2.91Å; I915-R936 VanDerWaalsContact CD1-NH1 3.27Å; L933-R936 HydrophobicContact CD2-CG 4.07Å; R936-E981 HydrophobicContact CB-CG 4.01Å; R936-E981 CarbonylContact O-C 3.58Å; R936-E981 VanDerWaalsContact O-CA 3.27Å; R936-E981 WeakPolarHBondContact O-CA 3.22Å; R936-R982 PolarHBondContact O-N 3.04Å
937	L	94.7	Very high	84.3	Confident	2 Å²	2	55.7 Å²	55.7	1%	0.01	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	146.3	175	-48.9	178.6	0	0	0	107.1	V914 V916 L959 W970 I972 R982	V914-L937 HydrophobicContact CB-CB 4.15Å; V914-L937 HydrophobicContact CG1-CD1 4.42Å; V914-L937 PolarHBondContact N-O 3.24Å; V914-L937 WeakPolarHBondContact O-CA 3.25Å; V914-L937 WeakPolarHBondContact O-CB 3.24Å; V914-L937 PolarHBondContact O-N 3.15Å; V916-L937 HydrophobicContact CG2-CD1 3.92Å; V916-L937 HydrophobicContact CG2-CG 4.22Å; L937-L959 HydrophobicContact CD1-CD2 3.69Å; L937-W970 HydrophobicContact CB-CD2 4.31Å; L937-W970 HydrophobicContact CB-CZ2 4.24Å; L937-W970 HydrophobicContact CD1-CB 4.33Å; L937-W970 HydrophobicContact CD1-CD2 4.1Å; L937-W970 HydrophobicContact CD1-CG 3.98Å; L937-W970 HydrophobicContact CD2-CG 4.29Å; L937-W970 HydrophobicContact CG-CG 4.5Å; L937-I972 HydrophobicContact CD1-CD1 4.09Å; L937-I972 HydrophobicContact CD2-CD1 4.25Å; L937-R982 HydrophobicContact CD2-CB 3.9Å
938	R	91	Very high	84.8	Confident	76 Å²	76	54.7 Å²	54.7	29%	0.287	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	117.4	-174.4	-175.1	177.5	-74.8	-74.5	0.9	109.7	L942 E981 R982 P984	R938-L942 HydrophobicContact CG-CD2 3.69Å; R938-L942 VanDerWaalsContact NH1-CD2 3.31Å; R938-E981 IonicContact CZ-OE1 3.58Å; R938-E981 IonicContact CZ-OE2 3.35Å; R938-E981 IonicContact NE-OE1 3.46Å; R938-E981 IonicContact NE-OE2 2.82Å; R938-E981 PolarHBondContact NE-OE2 2.98Å; R938-E981 IonicContact NH2-OE1 2.8Å; R938-E981 PolarHBondContact NH2-OE1 3.47Å; R938-E981 IonicContact NH2-OE2 2.67Å; R938-E981 PolarHBondContact NH2-OE2 2.96Å; R938-R982 PolarHBondContact N-O 2.8Å; R938-P984 WeakPolarHBondContact O-CD 3.49Å
939	C	89.7	Confident	85.4	Confident	3 Å²	3	50.4 Å²	50.4	2%	0.02	23%	0.232	C	C	.	.			trans	-66.6	154	171.3	-45.6	0	0	0	0	109.5	A912 F968	A912-C939 HydrophobicContact CB-CB 3.62Å; A912-C939 WeakPolarHBondContact O-CB 3.42Å; A912-C939 PolarHBondContact O-N 2.68Å; A912-C939 PolarHBondContact O-SG 2.85Å; C939-F968 HydrophobicContact CB-CD2 3.83Å; C939-F968 HydrophobicContact CB-CE2 4.15Å; C939-F968 HydrophobicContact CB-CG 4.43Å
940	P	81.4	Confident	86	Confident	42 Å²	42	49.2 Å²	49.2	27%	0.273	22%	0.224	S	C	.	.	S	Bend	trans	-59.3	167.3	168.5	-23.8	36.6	0	0	0	112.8	N945 F968 P984	P940-N945 PolarHBondContact O-ND2 2.9Å; P940-F968 HydrophobicContact CB-CE1 4.35Å; P940-F968 HydrophobicContact CB-CZ 4.44Å; P940-F968 HydrophobicContact CG-CD1 3.98Å; P940-F968 HydrophobicContact CG-CE1 3.64Å; P940-F968 HydrophobicContact CG-CZ 4.13Å; P940-P984 HydrophobicContact CG-CG 4.11Å
941	R	75.6	Confident	86.5	Confident	116 Å²	116	39.7 Å²	39.7	44%	0.438	19%	0.189	S	C	.	.			trans	56.4	60.5	167.8	-19.3	-169.8	-172	124.6	4.5	114.2	D943 V944 N945 D965 E987	R941-D943 PolarHBondContact O-N 3.47Å; R941-V944 HydrophobicContact CB-CG2 4.31Å; R941-V944 PolarHBondContact O-N 2.88Å; R941-V944 VanDerWaalsContact O-N 3.16Å; R941-N945 PolarHBondContact O-ND2 3.18Å; R941-D965 WeakPolarHBondContact CD-OD2 3.44Å; R941-D965 WeakPolarHBondContact CG-OD2 3.3Å; R941-D965 IonicContact CZ-OD2 2.91Å; R941-D965 IonicContact NE-OD2 3.91Å; R941-D965 PolarHBondContact NE-OD2 2.95Å; R941-D965 VanDerWaalsContact NH1-CG 3.26Å; R941-D965 PolarHBondContact NH1-O 3.16Å; R941-D965 IonicContact NH1-OD2 2.95Å; R941-D965 PolarHBondContact NH1-OD2 2.92Å; R941-E987 IonicContact CZ-OE1 3.24Å; R941-E987 IonicContact NH2-OE1 2.64Å; R941-E987 PolarHBondContact NH2-OE1 2.71Å; R941-E987 IonicContact NH2-OE2 3.5Å
942	L	62.9	Low	86.6	Confident	68 Å²	68	35.8 Å²	35.8	36%	0.356	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.2	-25.5	-174.7	-59.7	-177.7	0	0	0	116.5	A912 R938 V944	A912-L942 HydrophobicContact CB-CD2 4.33Å; R938-L942 HydrophobicContact CG-CD2 3.69Å; R938-L942 VanDerWaalsContact NH1-CD2 3.31Å; L942-V944 VanDerWaalsContact C-N 3.3Å; L942-V944 PolarHBondContact O-N 3.04Å
943	D	60.2	Low	86.7	Confident	132 Å²	132	32.4 Å²	32.4	71%	0.706	16%	0.158	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.8	-5.4	-174.5	-51.9	-61	0	0	0	113.5	Y620 R941	Y620-D943 WeakPolarHBondContact CD2-O 3.36Å; Y620-D943 WeakPolarHBondContact CE2-O 3.35Å; R941-D943 PolarHBondContact O-N 3.47Å
944	V	61.7	Low	86.5	Confident	49 Å²	49	32.1 Å²	32.1	30%	0.297	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	-133.4	-10.6	-163.4	-146.2	0	0	0	0	114.9	Y620 R941 L942	Y620-V944 HydrophobicContact CE2-CB 4.47Å; Y620-V944 HydrophobicContact CE2-CG1 4.13Å; Y620-V944 HydrophobicContact CE2-CG2 4.1Å; R941-V944 HydrophobicContact CB-CG2 4.31Å; R941-V944 PolarHBondContact O-N 2.88Å; R941-V944 VanDerWaalsContact O-N 3.16Å; L942-V944 VanDerWaalsContact C-N 3.3Å; L942-V944 PolarHBondContact O-N 3.04Å
945	N	69.5	Low	86.4	Confident	2 Å²	2	34.2 Å²	34.2	1%	0.011	17%	0.168	C	C	.	.			trans	-128.1	95.3	-156.8	-69.1	-17.7	0	0	0	114.6	A912 P940 R941 C963 D965	A912-N945 WeakPolarHBondContact CA-O 3.43Å; A912-N945 HydrophobicContact CB-CB 3.77Å; A912-N945 WeakPolarHBondContact CB-O 3.3Å; A912-N945 PolarHBondContact N-O 3.27Å; P940-N945 PolarHBondContact O-ND2 2.9Å; R941-N945 PolarHBondContact O-ND2 3.18Å; N945-C963 HydrophobicContact CB-CB 4.37Å; N945-D965 VanDerWaalsContact CG-OD1 3.32Å; N945-D965 PolarHBondContact ND2-OD1 3.01Å; N945-D965 VanDerWaalsContact ND2-OD1 3.07Å; N945-D965 PolarHBondContact ND2-OD2 3.04Å; N945-D965 VanDerWaalsContact OD1-CB 3.29Å; N945-D965 WeakPolarHBondContact OD1-CB 3.36Å; N945-D965 PolarHBondContact OD1-OD1 2.9Å; N945-D965 PolarHBondContact OD1-OD2 3.09Å
946	P	86.8	Confident	86.3	Confident	18 Å²	18	34.6 Å²	34.6	12%	0.117	17%	0.17	C	C	.	.			trans	-71	145.9	161.3	30.8	-33.6	0	0	0	111.2	L948 C963 E964	P946-L948 HydrophobicContact CB-CD2 4.11Å; P946-L948 HydrophobicContact CG-CD2 3.88Å; P946-L948 HydrophobicContact CG-CG 4.36Å; P946-L948 PolarHBondContact O-N 3.14Å; P946-C963 WeakPolarHBondContact O-CA 3.46Å; P946-E964 VanDerWaalsContact CD-CD 3.42Å; P946-E964 VanDerWaalsContact CG-CD 3.4Å; P946-E964 HydrophobicContact CG-CG 3.67Å; P946-E964 WeakPolarHBondContact CG-OE1 3.4Å
947	V	93.3	Very high	86.3	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	94	172.5	-176.7	0	0	0	0	108.8	T893 A894 D909 V914 L950 A961	T893-V947 WeakPolarHBondContact CB-O 3.29Å; T893-V947 PolarHBondContact OG1-O 2.83Å; A894-V947 HydrophobicContact CB-CG1 4.48Å; D909-V947 PolarHBondContact O-N 2.89Å; V914-V947 HydrophobicContact CG2-CB 4.46Å; V914-V947 HydrophobicContact CG2-CG1 4.03Å; V914-V947 HydrophobicContact CG2-CG2 3.76Å; V947-L950 HydrophobicContact CG1-CD2 3.91Å; V947-L950 HydrophobicContact CG1-CG 4.01Å; V947-A961 HydrophobicContact CG1-CB 4.13Å
948	L	93.2	Very high	86.3	Confident	17 Å²	17	32.8 Å²	32.8	9%	0.089	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	-36.4	-174.3	-60.6	-178.9	0	0	0	112.2	P946 G962 E964 D999	P946-L948 HydrophobicContact CB-CD2 4.11Å; P946-L948 HydrophobicContact CG-CD2 3.88Å; P946-L948 HydrophobicContact CG-CG 4.36Å; P946-L948 PolarHBondContact O-N 3.14Å; L948-G962 PolarHBondContact N-O 3.26Å; L948-E964 HydrophobicContact CD1-CG 4Å; L948-D999 HydrophobicContact CD1-CB 4.46Å
949	N	95.5	Very high	86.6	Confident	11 Å²	11	29.1 Å²	29.1	6%	0.059	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	154.1	-178.7	-66.8	-84.8	0	0	0	113.1	A961 G962 D999 A1000 L1001 N1057	N949-A961 WeakPolarHBondContact O-CA 3.16Å; N949-G962 PolarHBondContact N-O 2.79Å; N949-G962 PolarHBondContact O-N 2.85Å; N949-D999 VanDerWaalsContact ND2-C 3.29Å; N949-D999 PolarHBondContact ND2-O 3.43Å; N949-A1000 VanDerWaalsContact ND2-CA 3.34Å; N949-A1000 WeakPolarHBondContact ND2-CA 3.49Å; N949-L1001 HydrophobicContact CB-CB 3.8Å; N949-N1057 PolarHBondContact OD1-ND2 3.03Å; N949-N1057 VanDerWaalsContact OD1-ND2 3.09Å; N949-N1057 PolarHBondContact OD1-OD1 2.98Å
950	L	97.2	Very high	87	Confident	10 Å²	10	29 Å²	29	5%	0.052	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	138.4	177.1	-71.6	170.5	0	0	0	110.6	A894 I896 F906 V914 V947 I960 A961	A894-L950 HydrophobicContact CB-CD1 4.21Å; A894-L950 HydrophobicContact CB-CG 4.19Å; I896-L950 HydrophobicContact CD1-CB 3.96Å; I896-L950 HydrophobicContact CG1-CB 3.83Å; F906-L950 HydrophobicContact CB-CD1 4.24Å; V914-L950 HydrophobicContact CG1-CD1 4.36Å; V914-L950 HydrophobicContact CG1-CD2 4.05Å; V914-L950 HydrophobicContact CG2-CD2 4.11Å; V947-L950 HydrophobicContact CG1-CD2 3.91Å; V947-L950 HydrophobicContact CG1-CG 4.01Å; L950-I960 WeakPolarHBondContact CA-O 3.4Å; L950-A961 HydrophobicContact CD2-CB 3.77Å
951	V	97.4	Very high	87.7	Confident	9 Å²	9	27 Å²	27	6%	0.055	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	131.4	169.8	169.3	0	0	0	0	109.8	L953 I960 L1001 Q1003 L1009	V951-L953 HydrophobicContact CG1-CD2 3.85Å; V951-L953 HydrophobicContact CG1-CG 4.28Å; V951-I960 PolarHBondContact N-O 3.12Å; V951-I960 PolarHBondContact O-N 3.03Å; V951-L1001 HydrophobicContact CB-CD2 4.15Å; V951-L1001 HydrophobicContact CB-CG 4.37Å; V951-L1001 HydrophobicContact CG2-CD2 4.05Å; V951-L1001 HydrophobicContact CG2-CG 3.81Å; V951-L1001 WeakPolarHBondContact CG2-O 3.5Å; V951-Q1003 HydrophobicContact CG1-CB 3.87Å; V951-L1009 HydrophobicContact CB-CD2 4.19Å; V951-L1009 HydrophobicContact CG1-CD2 3.7Å
952	F	96.4	Very high	88.6	Confident	5 Å²	5	21.5 Å²	21.5	2%	0.022	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	137.2	169.8	-174.8	-100.6	0	0	0	110.7	I896 H898 F906 P954 Y958 L959 I972 Q1003	I896-F952 HydrophobicContact CD1-CB 3.96Å; H898-F952 AromaticContact CD2-CD1 3.77Å; H898-F952 AromaticContact CD2-CE1 3.35Å; H898-F952 WeakPolarHBondContact CD2-CE1 3.33Å; H898-F952 AromaticContact CD2-CZ 3.74Å; H898-F952 AromaticContact CE1-CE1 3.85Å; H898-F952 AromaticContact NE2-CD1 3.97Å; H898-F952 AromaticContact NE2-CE1 3.15Å; H898-F952 WeakPolarHBondContact NE2-CE1 3.07Å; H898-F952 AromaticContact NE2-CZ 3.56Å; F906-F952 HydrophobicContact CD2-CB 4.41Å; F906-F952 HydrophobicContact CE1-CD2 4.41Å; F906-F952 HydrophobicContact CE2-CB 3.89Å; F906-F952 HydrophobicContact CE2-CD1 4.43Å; F906-F952 AromaticContact CE2-CD2 3.87Å; F906-F952 HydrophobicContact CE2-CD2 3.87Å; F906-F952 AromaticContact CE2-CG 3.79Å; F906-F952 HydrophobicContact CE2-CG 3.79Å; F906-F952 HydrophobicContact CZ-CB 4.48Å; F906-F952 AromaticContact CZ-CD2 3.6Å; F906-F952 HydrophobicContact CZ-CD2 3.6Å; F906-F952 AromaticContact CZ-CE2 3.97Å; F906-F952 HydrophobicContact CZ-CE2 3.97Å; F906-F952 HydrophobicContact CZ-CG 4Å; F952-P954 HydrophobicContact CD1-CG 3.85Å; F952-P954 HydrophobicContact CE1-CB 4.09Å; F952-P954 HydrophobicContact CE1-CG 3.87Å; F952-P954 WeakPolarHBondContact O-CD 3.4Å; F952-Y958 VanDerWaalsContact CD2-O 3.27Å; F952-Y958 WeakPolarHBondContact CD2-O 3.38Å; F952-L959 HydrophobicContact CB-CD1 4.02Å; F952-L959 HydrophobicContact CD2-CB 4.03Å; F952-L959 HydrophobicContact CD2-CD1 4.18Å; F952-I972 HydrophobicContact CE2-CB 4.27Å; F952-Q1003 PolarHBondContact O-OE1 2.77Å
953	L	94.9	Very high	89.9	Confident	0 Å²	0	18.2 Å²	18.2	0%	0	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	93.1	-179.1	-59.8	177	0	0	0	110.3	V951 H955 Y956 A957 Y958 I960 Q1003 L1009 F1024	V951-L953 HydrophobicContact CG1-CD2 3.85Å; V951-L953 HydrophobicContact CG1-CG 4.28Å; L953-H955 VanDerWaalsContact C-N 3.3Å; L953-H955 PolarHBondContact O-N 3Å; L953-Y956 PolarHBondContact O-N 3.06Å; L953-Y956 VanDerWaalsContact O-N 3.11Å; L953-A957 PolarHBondContact O-N 3.3Å; L953-Y958 PolarHBondContact N-O 3.12Å; L953-Y958 PolarHBondContact O-N 2.76Å; L953-I960 HydrophobicContact CD1-CD1 3.71Å; L953-I960 HydrophobicContact CG-CD1 4.41Å; L953-Q1003 HydrophobicContact CD2-CG 3.82Å; L953-L1009 HydrophobicContact CD1-CD1 3.8Å; L953-L1009 HydrophobicContact CD1-CD2 4.4Å; L953-L1009 HydrophobicContact CD2-CD1 4.1Å; L953-L1009 HydrophobicContact CD2-CD2 4.28Å; L953-L1009 HydrophobicContact CD2-CG 4.29Å; L953-F1024 HydrophobicContact CD1-CB 4.08Å; L953-F1024 HydrophobicContact CD1-CD1 3.5Å; L953-F1024 VanDerWaalsContact CD1-CD1 3.5Å; L953-F1024 HydrophobicContact CD1-CD2 4.24Å; L953-F1024 HydrophobicContact CD1-CE1 3.89Å; L953-F1024 HydrophobicContact CD1-CG 3.69Å; L953-F1024 HydrophobicContact CD1-CZ 4.42Å
954	P	91.6	Very high	91.1	Very high	36 Å²	36	14.7 Å²	14.7	23%	0.234	8%	0.081	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-37.7	-175.1	-25.1	32.7	0	0	0	114.1	Q899 F952 Y956 A957	Q899-P954 HydrophobicContact CB-CG 4.15Å; Q899-P954 VanDerWaalsContact OE1-CD 3.25Å; Q899-P954 VanDerWaalsContact OE1-CG 3.25Å; F952-P954 HydrophobicContact CD1-CG 3.85Å; F952-P954 HydrophobicContact CE1-CB 4.09Å; F952-P954 HydrophobicContact CE1-CG 3.87Å; F952-P954 WeakPolarHBondContact O-CD 3.4Å; P954-Y956 PolarHBondContact O-N 3.21Å; P954-A957 PolarHBondContact O-N 2.97Å
955	H	91.3	Very high	92.1	Very high	52 Å²	52	13.6 Å²	13.6	24%	0.241	7%	0.073	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-28.1	-179.5	-172.4	81.2	0	0	0	113.6	P723 L953 D1006	P723-H955 PolarHBondContact O-CE1 2.92Å; P723-H955 PolarHBondContact O-NE2 2.64Å; L953-H955 VanDerWaalsContact C-N 3.3Å; L953-H955 PolarHBondContact O-N 3Å; H955-D1006 HydrophobicContact CB-CB 4.36Å
956	Y	93.7	Very high	93	Very high	8 Å²	8	13.8 Å²	13.8	3%	0.031	8%	0.076	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.9	-11.6	179.1	-64.4	-73	0	0	0	113.7	P722 P725 L953 P954 Y958 D1006 N1007 F1024 A1025 L1028	P722-Y956 HydrophobicContact CG-CD1 3.68Å; P722-Y956 HydrophobicContact CG-CE1 4.16Å; P725-Y956 WeakPolarHBondContact CD-OH 3.17Å; L953-Y956 PolarHBondContact O-N 3.06Å; L953-Y956 VanDerWaalsContact O-N 3.11Å; P954-Y956 PolarHBondContact O-N 3.21Å; Y956-Y958 VanDerWaalsContact O-CD2 3.25Å; Y956-Y958 WeakPolarHBondContact O-CD2 3.32Å; Y956-D1006 VanDerWaalsContact CE2-O 3.25Å; Y956-D1006 WeakPolarHBondContact CE2-O 3.15Å; Y956-N1007 HydrophobicContact CE2-CB 3.77Å; Y956-F1024 AromaticContact CD2-CD1 3.82Å; Y956-F1024 HydrophobicContact CD2-CD1 3.82Å; Y956-F1024 HydrophobicContact CD2-CE1 4.4Å; Y956-F1024 HydrophobicContact CE2-CD1 4.38Å; Y956-F1024 AromaticContact CG-CD1 3.96Å; Y956-F1024 HydrophobicContact CG-CD1 3.96Å; Y956-F1024 HydrophobicContact CG-CE1 4.15Å; Y956-A1025 VanDerWaalsContact OH-CB 3.27Å; Y956-A1025 WeakPolarHBondContact OH-CB 3.32Å; Y956-L1028 HydrophobicContact CD1-CD1 3.31Å; Y956-L1028 HydrophobicContact CE1-CD1 3.86Å; Y956-L1028 HydrophobicContact CG-CD1 3.88Å
957	A	94.3	Very high	93.4	Very high	21 Å²	21	13 Å²	13	17%	0.174	7%	0.071	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.6	49.5	-170.7	0	0	0	0	0	112.5	L953 P954 K971 I972 T973	L953-A957 PolarHBondContact O-N 3.3Å; P954-A957 PolarHBondContact O-N 2.97Å; A957-K971 CarbonylContact O-C 3.57Å; A957-K971 WeakPolarHBondContact O-CA 3.41Å; A957-K971 WeakPolarHBondContact O-CG 3.4Å; A957-I972 PolarHBondContact O-N 2.74Å; A957-T973 HydrophobicContact CB-CG2 4.01Å
958	Y	95.9	Very high	93.4	Very high	13 Å²	13	13 Å²	13	5%	0.051	7%	0.071	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	135	174.6	-81.9	-92.9	0	0	0	111.8	F952 L953 Y956 A969 W970 K971 D985 M986 F1024 L1028	F952-Y958 VanDerWaalsContact CD2-O 3.27Å; F952-Y958 WeakPolarHBondContact CD2-O 3.38Å; L953-Y958 PolarHBondContact N-O 3.12Å; L953-Y958 PolarHBondContact O-N 2.76Å; Y956-Y958 VanDerWaalsContact O-CD2 3.25Å; Y956-Y958 WeakPolarHBondContact O-CD2 3.32Å; Y958-A969 HydrophobicContact CD1-CB 4.2Å; Y958-W970 VanDerWaalsContact CA-O 3.26Å; Y958-W970 WeakPolarHBondContact CA-O 3.48Å; Y958-W970 VanDerWaalsContact CD1-C 3.49Å; Y958-W970 VanDerWaalsContact CD1-O 3.31Å; Y958-W970 WeakPolarHBondContact CD1-O 3.44Å; Y958-K971 HydrophobicContact CD1-CB 4.11Å; Y958-K971 HydrophobicContact CD1-CG 4.45Å; Y958-K971 HydrophobicContact CD2-CG 4.18Å; Y958-K971 HydrophobicContact CE1-CB 3.67Å; Y958-K971 HydrophobicContact CE1-CG 4.09Å; Y958-K971 HydrophobicContact CE2-CB 4.35Å; Y958-K971 HydrophobicContact CE2-CD 4.23Å; Y958-K971 HydrophobicContact CE2-CG 3.83Å; Y958-K971 HydrophobicContact CG-CG 4.5Å; Y958-D985 HydrophobicContact CE1-CB 4.49Å; Y958-M986 HydrophobicContact CD1-CE 4.12Å; Y958-M986 HydrophobicContact CE1-CE 3.66Å; Y958-F1024 HydrophobicContact CD1-CZ 4.08Å; Y958-F1024 AromaticContact CD2-CE1 3.72Å; Y958-F1024 HydrophobicContact CD2-CE1 3.72Å; Y958-F1024 AromaticContact CD2-CZ 3.92Å; Y958-F1024 HydrophobicContact CD2-CZ 3.92Å; Y958-F1024 HydrophobicContact CE2-CE1 4.33Å; Y958-F1024 HydrophobicContact CE2-CZ 4.45Å; Y958-F1024 AromaticContact CG-CE1 3.91Å; Y958-F1024 HydrophobicContact CG-CE1 3.91Å; Y958-F1024 AromaticContact CG-CZ 3.7Å; Y958-F1024 HydrophobicContact CG-CZ 3.7Å; Y958-L1028 HydrophobicContact CE2-CD1 4.21Å; Y958-L1028 HydrophobicContact CE2-CD2 3.83Å
959	L	96.9	Very high	93.6	Very high	0 Å²	0	12.1 Å²	12.1	0%	0	7%	0.066	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	139.8	159.7	-174.1	69	0	0	0	108.5	I896 F906 V914 L937 F952 A969 W970 I972	I896-L959 HydrophobicContact CD1-CD1 4.23Å; F906-L959 HydrophobicContact CB-CD1 4.16Å; F906-L959 HydrophobicContact CB-CD2 4.47Å; F906-L959 HydrophobicContact CD1-CD1 3.78Å; F906-L959 HydrophobicContact CD1-CD2 3.55Å; F906-L959 HydrophobicContact CD1-CG 4.24Å; F906-L959 HydrophobicContact CD2-CD1 4.02Å; F906-L959 HydrophobicContact CE1-CD1 4.11Å; F906-L959 HydrophobicContact CE1-CD2 4.01Å; F906-L959 HydrophobicContact CE1-CG 4.47Å; F906-L959 HydrophobicContact CE2-CD1 4.31Å; F906-L959 HydrophobicContact CG-CD1 3.73Å; F906-L959 HydrophobicContact CG-CD2 4.19Å; F906-L959 HydrophobicContact CZ-CD1 4.36Å; V914-L959 HydrophobicContact CG1-CD2 3.86Å; L937-L959 HydrophobicContact CD1-CD2 3.69Å; F952-L959 HydrophobicContact CB-CD1 4.02Å; F952-L959 HydrophobicContact CD2-CB 4.03Å; F952-L959 HydrophobicContact CD2-CD1 4.18Å; L959-A969 CarbonylContact O-C 3.46Å; L959-A969 VanDerWaalsContact O-CA 3.22Å; L959-A969 WeakPolarHBondContact O-CA 3.42Å; L959-W970 PolarHBondContact N-O 3.26Å; L959-W970 PolarHBondContact O-N 3.33Å; L959-I972 HydrophobicContact CB-CG1 4.17Å
960	I	97.1	Very high	93.6	Very high	0 Å²	0	11.6 Å²	11.6	0%	0	6%	0.064	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	131.5	178	-49.9	-179.1	0	0	0	108.5	L950 V951 L953 L967 F968 A969 L988 L1001 L1009 F1024	L950-I960 WeakPolarHBondContact CA-O 3.4Å; V951-I960 PolarHBondContact N-O 3.12Å; V951-I960 PolarHBondContact O-N 3.03Å; L953-I960 HydrophobicContact CD1-CD1 3.71Å; L953-I960 HydrophobicContact CG-CD1 4.41Å; I960-L967 HydrophobicContact CG2-CD2 3.59Å; I960-F968 CarbonylContact C-O 3.51Å; I960-F968 VanDerWaalsContact CA-O 3.29Å; I960-F968 WeakPolarHBondContact CA-O 3.12Å; I960-A969 HydrophobicContact CG1-CB 4.02Å; I960-L988 HydrophobicContact CG2-CD1 4.42Å; I960-L1001 HydrophobicContact CB-CD2 4.3Å; I960-L1001 HydrophobicContact CG2-CD2 3.9Å; I960-L1009 HydrophobicContact CD1-CD2 3.98Å; I960-F1024 HydrophobicContact CD1-CD2 3.78Å; I960-F1024 HydrophobicContact CD1-CE2 3.52Å; I960-F1024 HydrophobicContact CD1-CZ 4.05Å; I960-F1024 HydrophobicContact CG1-CE2 4.41Å
961	A	96.1	Very high	93.5	Very high	0 Å²	0	14.8 Å²	14.8	0%	0	8%	0.077	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	134.3	174.4	0	0	0	0	0	110.2	V947 N949 L950 L967 F968 W970	V947-A961 HydrophobicContact CG1-CB 4.13Å; N949-A961 WeakPolarHBondContact O-CA 3.16Å; L950-A961 HydrophobicContact CD2-CB 3.77Å; A961-L967 WeakPolarHBondContact O-CA 3.07Å; A961-F968 PolarHBondContact N-O 2.92Å; A961-F968 PolarHBondContact O-N 2.85Å; A961-W970 HydrophobicContact CB-CH2 4.24Å; A961-W970 HydrophobicContact CB-CZ3 3.82Å
962	G	94.4	Very high	93.2	Very high	0 Å²	0	14.7 Å²	14.7	0%	0	8%	0.076	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	128.1	167.7	0	0	0	0	0	110.3	L948 N949	L948-G962 PolarHBondContact N-O 3.26Å; N949-G962 PolarHBondContact N-O 2.79Å; N949-G962 PolarHBondContact O-N 2.85Å
963	C	91.4	Very high	92.9	Very high	0 Å²	0	19.2 Å²	19.2	0%	0	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	174.7	-176.5	-55.9	0	0	0	0	111.2	N945 P946 D965 G966 F968 I998	N945-C963 HydrophobicContact CB-CB 4.37Å; P946-C963 WeakPolarHBondContact O-CA 3.46Å; C963-D965 PolarHBondContact O-N 3.06Å; C963-D965 VanDerWaalsContact O-N 3.08Å; C963-G966 PolarHBondContact N-O 3.24Å; C963-F968 HydrophobicContact CB-CE2 4.19Å; C963-I998 WeakPolarHBondContact O-CB 3.28Å; C963-I998 PolarHBondContact O-N 2.9Å
964	E	85.3	Confident	92.4	Very high	58 Å²	58	22.3 Å²	22.3	27%	0.271	12%	0.121	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64	-7.9	178.4	-70.2	-174.2	-178.3	0	0	115.3	P946 L948 V996 C997	P946-E964 VanDerWaalsContact CD-CD 3.42Å; P946-E964 VanDerWaalsContact CG-CD 3.4Å; P946-E964 HydrophobicContact CG-CG 3.67Å; P946-E964 WeakPolarHBondContact CG-OE1 3.4Å; L948-E964 HydrophobicContact CD1-CG 4Å; E964-V996 CarbonylContact C-O 3.52Å; E964-V996 CarbonylContact O-C 3.58Å; E964-V996 VanDerWaalsContact O-O 3.09Å; E964-C997 VanDerWaalsContact O-CA 3.26Å; E964-C997 WeakPolarHBondContact O-CA 3.34Å; E964-C997 PolarHBondContact O-N 2.75Å
965	D	81.8	Confident	92.1	Very high	25 Å²	25	22.5 Å²	22.5	13%	0.134	12%	0.12	C	C	.	.	T	Hydrogen-bonded Turn	trans	-131.7	1.3	-176.7	78.6	-23.5	0	0	0	115.9	R941 N945 C963 F968 V996	R941-D965 WeakPolarHBondContact CD-OD2 3.44Å; R941-D965 WeakPolarHBondContact CG-OD2 3.3Å; R941-D965 IonicContact CZ-OD2 2.91Å; R941-D965 IonicContact NE-OD2 3.91Å; R941-D965 PolarHBondContact NE-OD2 2.95Å; R941-D965 VanDerWaalsContact NH1-CG 3.26Å; R941-D965 PolarHBondContact NH1-O 3.16Å; R941-D965 IonicContact NH1-OD2 2.95Å; R941-D965 PolarHBondContact NH1-OD2 2.92Å; N945-D965 VanDerWaalsContact CG-OD1 3.32Å; N945-D965 PolarHBondContact ND2-OD1 3.01Å; N945-D965 VanDerWaalsContact ND2-OD1 3.07Å; N945-D965 PolarHBondContact ND2-OD2 3.04Å; N945-D965 VanDerWaalsContact OD1-CB 3.29Å; N945-D965 WeakPolarHBondContact OD1-CB 3.36Å; N945-D965 PolarHBondContact OD1-OD1 2.9Å; N945-D965 PolarHBondContact OD1-OD2 3.09Å; C963-D965 PolarHBondContact O-N 3.06Å; C963-D965 VanDerWaalsContact O-N 3.08Å; D965-F968 WeakPolarHBondContact OD1-CE2 3.47Å; D965-F968 WeakPolarHBondContact OD1-CZ 3.49Å; D965-V996 CarbonylContact C-O 3.59Å; D965-V996 WeakPolarHBondContact CA-O 3.31Å
966	G	89.3	Confident	91.7	Very high	7 Å²	7	28.2 Å²	28.2	7%	0.072	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	159.8	172.9	-171.6	0	0	0	0	0	116.9	C963	C963-G966 PolarHBondContact N-O 3.24Å
967	L	94	Very high	91.1	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	124.1	174	-90.4	158.7	0	0	0	109.5	I960 A961 E987 L988 I998 L1001 L1011 I1040	I960-L967 HydrophobicContact CG2-CD2 3.59Å; A961-L967 WeakPolarHBondContact O-CA 3.07Å; L967-E987 CarbonylContact O-C 3.53Å; L967-E987 WeakPolarHBondContact O-CA 3.21Å; L967-L988 HydrophobicContact CB-CB 3.82Å; L967-L988 HydrophobicContact CB-CD1 4.36Å; L967-L988 HydrophobicContact CB-CG 4.35Å; L967-L988 PolarHBondContact O-N 2.86Å; L967-I998 HydrophobicContact CB-CD1 4.22Å; L967-I998 HydrophobicContact CD1-CD1 3.96Å; L967-I998 HydrophobicContact CG-CD1 3.61Å; L967-I998 HydrophobicContact CG-CG2 4.41Å; L967-L1001 HydrophobicContact CD2-CD1 3.84Å; L967-L1001 HydrophobicContact CD2-CD2 3.63Å; L967-L1001 HydrophobicContact CD2-CG 4.3Å; L967-L1011 HydrophobicContact CD1-CD2 3.62Å; L967-I1040 HydrophobicContact CD1-CD1 3.74Å
968	F	94.7	Very high	90.5	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	138.5	-179.3	-56.1	-67.8	0	0	0	110.7	C939 P940 I960 A961 C963 D965 W970 P984 M986 E987	C939-F968 HydrophobicContact CB-CD2 3.83Å; C939-F968 HydrophobicContact CB-CE2 4.15Å; C939-F968 HydrophobicContact CB-CG 4.43Å; P940-F968 HydrophobicContact CB-CE1 4.35Å; P940-F968 HydrophobicContact CB-CZ 4.44Å; P940-F968 HydrophobicContact CG-CD1 3.98Å; P940-F968 HydrophobicContact CG-CE1 3.64Å; P940-F968 HydrophobicContact CG-CZ 4.13Å; I960-F968 CarbonylContact C-O 3.51Å; I960-F968 VanDerWaalsContact CA-O 3.29Å; I960-F968 WeakPolarHBondContact CA-O 3.12Å; A961-F968 PolarHBondContact N-O 2.92Å; A961-F968 PolarHBondContact O-N 2.85Å; C963-F968 HydrophobicContact CB-CE2 4.19Å; D965-F968 WeakPolarHBondContact OD1-CE2 3.47Å; D965-F968 WeakPolarHBondContact OD1-CZ 3.49Å; F968-W970 HydrophobicContact CB-CH2 3.56Å; F968-W970 HydrophobicContact CB-CZ2 4.37Å; F968-W970 HydrophobicContact CB-CZ3 3.78Å; F968-W970 WeakPolarHBondContact O-CZ3 3.25Å; F968-P984 HydrophobicContact CB-CB 4.01Å; F968-P984 HydrophobicContact CB-CG 4.25Å; F968-P984 HydrophobicContact CD1-CG 4.09Å; F968-P984 HydrophobicContact CG-CG 4.47Å; F968-M986 WeakPolarHBondContact CA-O 3.38Å; F968-E987 HydrophobicContact CD1-CB 4.16Å; F968-E987 HydrophobicContact CD1-CG 4.21Å; F968-E987 HydrophobicContact CE1-CB 4.19Å; F968-E987 HydrophobicContact CE1-CG 3.81Å
969	A	95.9	Very high	89.8	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	134.8	-176.6	0	0	0	0	0	112.9	Y958 L959 I960 D985 M986	Y958-A969 HydrophobicContact CD1-CB 4.2Å; L959-A969 CarbonylContact O-C 3.46Å; L959-A969 VanDerWaalsContact O-CA 3.22Å; L959-A969 WeakPolarHBondContact O-CA 3.42Å; I960-A969 HydrophobicContact CG1-CB 4.02Å; A969-D985 WeakPolarHBondContact O-CA 3.41Å; A969-D985 WeakPolarHBondContact O-CB 3.17Å; A969-D985 PolarHBondContact O-N 3.24Å; A969-M986 HydrophobicContact CB-CB 4.38Å; A969-M986 HydrophobicContact CB-CE 4.05Å; A969-M986 PolarHBondContact N-O 2.81Å; A969-M986 PolarHBondContact O-N 3.21Å
970	W	95.6	Very high	89.3	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	138.5	176.9	-62.5	-104.9	0	0	0	109.8	L937 Y958 L959 A961 F968 I972 R982 E983 P984	L937-W970 HydrophobicContact CB-CD2 4.31Å; L937-W970 HydrophobicContact CB-CZ2 4.24Å; L937-W970 HydrophobicContact CD1-CB 4.33Å; L937-W970 HydrophobicContact CD1-CD2 4.1Å; L937-W970 HydrophobicContact CD1-CG 3.98Å; L937-W970 HydrophobicContact CD2-CG 4.29Å; L937-W970 HydrophobicContact CG-CG 4.5Å; Y958-W970 VanDerWaalsContact CA-O 3.26Å; Y958-W970 WeakPolarHBondContact CA-O 3.48Å; Y958-W970 VanDerWaalsContact CD1-C 3.49Å; Y958-W970 VanDerWaalsContact CD1-O 3.31Å; Y958-W970 WeakPolarHBondContact CD1-O 3.44Å; L959-W970 PolarHBondContact N-O 3.26Å; L959-W970 PolarHBondContact O-N 3.33Å; A961-W970 HydrophobicContact CB-CH2 4.24Å; A961-W970 HydrophobicContact CB-CZ3 3.82Å; F968-W970 HydrophobicContact CB-CH2 3.56Å; F968-W970 HydrophobicContact CB-CZ2 4.37Å; F968-W970 HydrophobicContact CB-CZ3 3.78Å; F968-W970 WeakPolarHBondContact O-CZ3 3.25Å; W970-I972 HydrophobicContact CB-CD1 3.87Å; W970-I972 HydrophobicContact CB-CG1 4.24Å; W970-R982 PolarHBondContact NE1-O 3.46Å; W970-E983 VanDerWaalsContact CD1-O 3.31Å; W970-E983 VanDerWaalsContact NE1-C 3.29Å; W970-E983 PolarHBondContact NE1-O 2.78Å; W970-P984 HydrophobicContact CD2-CB 4.17Å; W970-P984 HydrophobicContact CH2-CB 4.33Å; W970-P984 HydrophobicContact CZ2-CB 3.85Å; W970-P984 HydrophobicContact CZ2-CG 4.32Å
971	K	94.6	Very high	88.9	Confident	76 Å²	76	57.4 Å²	57.4	33%	0.33	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	115.9	170.8	-157.7	-171.3	-177.7	-165.6	0	109.5	A957 Y958 T973 R982 D985	A957-K971 CarbonylContact O-C 3.57Å; A957-K971 WeakPolarHBondContact O-CA 3.41Å; A957-K971 WeakPolarHBondContact O-CG 3.4Å; Y958-K971 HydrophobicContact CD1-CB 4.11Å; Y958-K971 HydrophobicContact CD1-CG 4.45Å; Y958-K971 HydrophobicContact CD2-CG 4.18Å; Y958-K971 HydrophobicContact CE1-CB 3.67Å; Y958-K971 HydrophobicContact CE1-CG 4.09Å; Y958-K971 HydrophobicContact CE2-CB 4.35Å; Y958-K971 HydrophobicContact CE2-CD 4.23Å; Y958-K971 HydrophobicContact CE2-CG 3.83Å; Y958-K971 HydrophobicContact CG-CG 4.5Å; K971-T973 HydrophobicContact CD-CG2 4.06Å; K971-T973 HydrophobicContact CG-CG2 4.14Å; K971-R982 PolarHBondContact O-NH2 2.99Å; K971-D985 PolarHBondContact N-OD2 3.01Å
972	I	93.1	Very high	88.7	Confident	7 Å²	7	60.4 Å²	60.4	4%	0.036	27%	0.274	C	S	.	.			trans	-114.8	83.2	-175.6	-53.6	-60.2	0	0	0	108.6	M935 L937 F952 A957 L959 W970 L975	M935-I972 HydrophobicContact CE-CD1 4.31Å; M935-I972 HydrophobicContact CE-CG2 3.81Å; L937-I972 HydrophobicContact CD1-CD1 4.09Å; L937-I972 HydrophobicContact CD2-CD1 4.25Å; F952-I972 HydrophobicContact CE2-CB 4.27Å; A957-I972 PolarHBondContact O-N 2.74Å; L959-I972 HydrophobicContact CB-CG1 4.17Å; W970-I972 HydrophobicContact CB-CD1 3.87Å; W970-I972 HydrophobicContact CB-CG1 4.24Å; I972-L975 HydrophobicContact CG2-CD2 3.61Å; I972-L975 HydrophobicContact CG2-CG 4.25Å
973	T	88.1	Confident	88.5	Confident	100 Å²	100	66 Å²	66	61%	0.613	30%	0.301	S	S	*	.			trans	-96.8	-9	179.7	46.7	0	0	0	0	114.5	A957 K971	A957-T973 HydrophobicContact CB-CG2 4.01Å; K971-T973 HydrophobicContact CD-CG2 4.06Å; K971-T973 HydrophobicContact CG-CG2 4.14Å
974	D	84.6	Confident	88.6	Confident	66 Å²	66	66.7 Å²	66.7	35%	0.353	31%	0.305	S	S	.	.			trans	-143.9	126.5	-176.4	-163.7	3.7	0	0	0	107.5	R976	D974-R976 VanDerWaalsContact OD1-CD 3.28Å; D974-R976 WeakPolarHBondContact OD1-CD 3.39Å; D974-R976 VanDerWaalsContact OD1-CG 3.3Å; D974-R976 WeakPolarHBondContact OD1-CG 3.5Å; D974-R976 IonicContact OD1-CZ 2.8Å; D974-R976 IonicContact OD1-NE 2.6Å; D974-R976 PolarHBondContact OD1-NE 3.35Å; D974-R976 IonicContact OD1-NH1 2.95Å; D974-R976 WeakPolarHBondContact OD2-CD 3.3Å; D974-R976 IonicContact OD2-CZ 3.53Å; D974-R976 IonicContact OD2-NE 3.55Å; D974-R976 IonicContact OD2-NH1 3.5Å; D974-R976 PolarHBondContact OD2-NH1 2.67Å
975	L	86.2	Confident	89	Confident	39 Å²	39	66.4 Å²	66.4	20%	0.204	31%	0.305	C	S	.	.			trans	-108.3	51.8	-173.6	-72.7	163.7	0	0	0	110	I904 V916 L934 M935 I972	I904-L975 HydrophobicContact CD1-CD1 4.47Å; I904-L975 HydrophobicContact CG1-CD1 4.22Å; I904-L975 HydrophobicContact CG2-CD1 4.36Å; I904-L975 HydrophobicContact CG2-CD2 4.12Å; V916-L975 HydrophobicContact CG1-CD2 4.07Å; L934-L975 HydrophobicContact CD1-CB 4.34Å; M935-L975 HydrophobicContact CE-CD2 3.78Å; I972-L975 HydrophobicContact CG2-CD2 3.61Å; I972-L975 HydrophobicContact CG2-CG 4.25Å
976	R	83.5	Confident	89.6	Confident	172 Å²	172	65.2 Å²	65.2	65%	0.649	30%	0.299	S	S	*	.	S	Bend	trans	-98.8	167	178.7	-72.7	173.1	-173.3	146.3	-1	111	D974 E978	D974-R976 VanDerWaalsContact OD1-CD 3.28Å; D974-R976 WeakPolarHBondContact OD1-CD 3.39Å; D974-R976 VanDerWaalsContact OD1-CG 3.3Å; D974-R976 WeakPolarHBondContact OD1-CG 3.5Å; D974-R976 IonicContact OD1-CZ 2.8Å; D974-R976 IonicContact OD1-NE 2.6Å; D974-R976 PolarHBondContact OD1-NE 3.35Å; D974-R976 IonicContact OD1-NH1 2.95Å; D974-R976 WeakPolarHBondContact OD2-CD 3.3Å; D974-R976 IonicContact OD2-CZ 3.53Å; D974-R976 IonicContact OD2-NE 3.55Å; D974-R976 IonicContact OD2-NH1 3.5Å; D974-R976 PolarHBondContact OD2-NH1 2.67Å; R976-E978 PolarHBondContact O-N 2.8Å
977	L	80.2	Confident	89.8	Confident	90 Å²	90	67.2 Å²	67.2	47%	0.471	31%	0.307	S	S	.	.			trans	-66.4	97.6	174.3	179.6	65.2	0	0	0	111.5	L933 L934	L933-L977 WeakPolarHBondContact O-CD1 3.31Å; L934-L977 CarbonylContact O-C 3.59Å; L934-L977 VanDerWaalsContact O-CA 3.32Å; L934-L977 WeakPolarHBondContact O-CA 3.44Å
978	E	83	Confident	89.8	Confident	64 Å²	64	67.3 Å²	67.3	30%	0.299	31%	0.307	S	S	.	.			trans	-93.8	115	169.2	-58.6	-170.7	163	0	0	110.5	L934 M935 R976 R980 R982	L934-E978 PolarHBondContact O-N 2.9Å; M935-E978 HydrophobicContact CG-CB 3.89Å; M935-E978 HydrophobicContact CG-CG 3.89Å; M935-E978 HydrophobicContact SD-CG 4.07Å; R976-E978 PolarHBondContact O-N 2.8Å; E978-R980 PolarHBondContact O-N 2.82Å; E978-R982 IonicContact OE1-NH1 3.72Å; E978-R982 PolarHBondContact OE1-NH1 2.83Å; E978-R982 WeakPolarHBondContact OE2-CD 3.39Å; E978-R982 IonicContact OE2-NH1 3.93Å
979	K	80.5	Confident	89.7	Confident	192 Å²	192	71.7 Å²	71.7	84%	0.835	33%	0.326	S	S	*	.			trans	-80.2	10.3	177.7	-62.3	-172.2	178.1	-175.4	0	114.5
980	R	85.4	Confident	89.5	Confident	211 Å²	211	72.3 Å²	72.3	80%	0.796	33%	0.329	S	S	*	.	S	Bend	trans	-123.9	144.1	-177.3	-72	-174.9	175.4	-176.1	-1.1	109.3	E978	E978-R980 PolarHBondContact O-N 2.82Å
981	E	88.9	Confident	89	Confident	99 Å²	99	78.1 Å²	78.1	46%	0.463	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	143.5	172.1	-54.9	-172.6	147	0	0	110.6	R936 R938	R936-E981 HydrophobicContact CB-CG 4.01Å; R936-E981 CarbonylContact O-C 3.58Å; R936-E981 VanDerWaalsContact O-CA 3.27Å; R936-E981 WeakPolarHBondContact O-CA 3.22Å; R938-E981 IonicContact CZ-OE1 3.58Å; R938-E981 IonicContact CZ-OE2 3.35Å; R938-E981 IonicContact NE-OE1 3.46Å; R938-E981 IonicContact NE-OE2 2.82Å; R938-E981 PolarHBondContact NE-OE2 2.98Å; R938-E981 IonicContact NH2-OE1 2.8Å; R938-E981 PolarHBondContact NH2-OE1 3.47Å; R938-E981 IonicContact NH2-OE2 2.67Å; R938-E981 PolarHBondContact NH2-OE2 2.96Å
982	R	92.7	Very high	88.4	Confident	62 Å²	62	77.3 Å²	77.3	23%	0.234	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	125.2	177.5	-79	175.5	57.9	-172.9	-5.9	113.2	R936 L937 R938 W970 K971 E978 D985	R936-R982 PolarHBondContact O-N 3.04Å; L937-R982 HydrophobicContact CD2-CB 3.9Å; R938-R982 PolarHBondContact N-O 2.8Å; W970-R982 PolarHBondContact NE1-O 3.46Å; K971-R982 PolarHBondContact O-NH2 2.99Å; E978-R982 IonicContact OE1-NH1 3.72Å; E978-R982 PolarHBondContact OE1-NH1 2.83Å; E978-R982 WeakPolarHBondContact OE2-CD 3.39Å; E978-R982 IonicContact OE2-NH1 3.93Å; R982-D985 IonicContact NH2-OD2 2.67Å; R982-D985 PolarHBondContact NH2-OD2 3.2Å
983	E	90.9	Very high	87.7	Confident	119 Å²	119	85.6 Å²	85.6	56%	0.556	40%	0.401	S	S	*	.			trans	-59.5	154.9	159.9	-61.3	-175.9	153.9	0	0	110.9	W970 R1036	W970-E983 VanDerWaalsContact CD1-O 3.31Å; W970-E983 VanDerWaalsContact NE1-C 3.29Å; W970-E983 PolarHBondContact NE1-O 2.78Å; E983-R1036 IonicContact OE2-CZ 3.92Å; E983-R1036 IonicContact OE2-NH1 3.79Å; E983-R1036 PolarHBondContact OE2-NH1 3.11Å; E983-R1036 IonicContact OE2-NH2 2.75Å; E983-R1036 PolarHBondContact OE2-NH2 3.35Å
984	P	93.5	Very high	87.2	Confident	14 Å²	14	84.3 Å²	84.3	9%	0.091	39%	0.388	C	S	.	.			trans	-64.5	145.1	174.7	27.2	-36	0	0	0	112.8	R938 P940 F968 W970 M986	R938-P984 WeakPolarHBondContact O-CD 3.49Å; P940-P984 HydrophobicContact CG-CG 4.11Å; F968-P984 HydrophobicContact CB-CB 4.01Å; F968-P984 HydrophobicContact CB-CG 4.25Å; F968-P984 HydrophobicContact CD1-CG 4.09Å; F968-P984 HydrophobicContact CG-CG 4.47Å; W970-P984 HydrophobicContact CD2-CB 4.17Å; W970-P984 HydrophobicContact CH2-CB 4.33Å; W970-P984 HydrophobicContact CZ2-CB 3.85Å; W970-P984 HydrophobicContact CZ2-CG 4.32Å; P984-M986 VanDerWaalsContact C-N 3.31Å
985	D	93.6	Very high	87	Confident	51 Å²	51	89.3 Å²	89.3	27%	0.273	41%	0.409	S	S	.	.	S	Bend	trans	-69.3	-30.3	170.4	-75.5	-81.6	0	0	0	111.5	Y958 A969 K971 R982 R1031	Y958-D985 HydrophobicContact CE1-CB 4.49Å; A969-D985 WeakPolarHBondContact O-CA 3.41Å; A969-D985 WeakPolarHBondContact O-CB 3.17Å; A969-D985 PolarHBondContact O-N 3.24Å; K971-D985 PolarHBondContact N-OD2 3.01Å; R982-D985 IonicContact NH2-OD2 2.67Å; R982-D985 PolarHBondContact NH2-OD2 3.2Å; D985-R1031 PolarHBondContact O-NH2 2.84Å
986	M	93.9	Very high	86.9	Confident	1 Å²	1	88.7 Å²	88.7	1%	0.005	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	146.6	176	-58.9	-177.2	-64	0	0	113.4	Y958 F968 A969 P984 L988 F1024 L1028 R1031 R1036 V1038	Y958-M986 HydrophobicContact CD1-CE 4.12Å; Y958-M986 HydrophobicContact CE1-CE 3.66Å; F968-M986 WeakPolarHBondContact CA-O 3.38Å; A969-M986 HydrophobicContact CB-CB 4.38Å; A969-M986 HydrophobicContact CB-CE 4.05Å; A969-M986 PolarHBondContact N-O 2.81Å; A969-M986 PolarHBondContact O-N 3.21Å; P984-M986 VanDerWaalsContact C-N 3.31Å; M986-L988 HydrophobicContact CB-CD2 3.97Å; M986-L988 HydrophobicContact CE-CD2 4.06Å; M986-L988 HydrophobicContact SD-CD2 4.27Å; M986-F1024 HydrophobicContact CE-CE2 3.97Å; M986-F1024 HydrophobicContact CE-CZ 3.8Å; M986-L1028 HydrophobicContact CE-CD2 3.98Å; M986-L1028 HydrophobicContact SD-CD2 4.33Å; M986-R1031 VanDerWaalsContact SD-CD 3.59Å; M986-R1031 HydrophobicContact SD-CG 4.49Å; M986-R1036 CarbonylContact C-O 3.52Å; M986-R1036 VanDerWaalsContact CA-O 3.23Å; M986-R1036 WeakPolarHBondContact CA-O 3.35Å; M986-V1038 HydrophobicContact SD-CG2 4.15Å
987	E	93.9	Very high	87.2	Confident	49 Å²	49	81.3 Å²	81.3	23%	0.229	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	121.4	158.3	176.3	178	175.1	0	0	107.2	R941 L967 F968 R1036 V1037 V1038	R941-E987 IonicContact CZ-OE1 3.24Å; R941-E987 IonicContact NH2-OE1 2.64Å; R941-E987 PolarHBondContact NH2-OE1 2.71Å; R941-E987 IonicContact NH2-OE2 3.5Å; L967-E987 CarbonylContact O-C 3.53Å; L967-E987 WeakPolarHBondContact O-CA 3.21Å; F968-E987 HydrophobicContact CD1-CB 4.16Å; F968-E987 HydrophobicContact CD1-CG 4.21Å; F968-E987 HydrophobicContact CE1-CB 4.19Å; F968-E987 HydrophobicContact CE1-CG 3.81Å; E987-R1036 PolarHBondContact N-O 3.03Å; E987-V1037 HydrophobicContact CB-CG2 4.34Å; E987-V1037 CarbonylContact O-C 3.57Å; E987-V1037 WeakPolarHBondContact O-CA 3.24Å; E987-V1038 PolarHBondContact O-N 3.2Å
988	L	94.3	Very high	87.8	Confident	2 Å²	2	77 Å²	77	1%	0.01	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	100.5	-177.6	-50.9	-178.2	0	0	0	108.9	I960 L967 M986 F1024 I1027 V1038 I1040	I960-L988 HydrophobicContact CG2-CD1 4.42Å; L967-L988 HydrophobicContact CB-CB 3.82Å; L967-L988 HydrophobicContact CB-CD1 4.36Å; L967-L988 HydrophobicContact CB-CG 4.35Å; L967-L988 PolarHBondContact O-N 2.86Å; M986-L988 HydrophobicContact CB-CD2 3.97Å; M986-L988 HydrophobicContact CE-CD2 4.06Å; M986-L988 HydrophobicContact SD-CD2 4.27Å; L988-F1024 HydrophobicContact CD1-CD2 4.49Å; L988-F1024 HydrophobicContact CD1-CE2 4.14Å; L988-I1027 HydrophobicContact CD1-CD1 4.3Å; L988-I1027 HydrophobicContact CD2-CD1 4.48Å; L988-I1027 HydrophobicContact CD2-CG2 3.79Å; L988-V1038 CarbonylContact C-O 3.45Å; L988-V1038 WeakPolarHBondContact CA-O 3.32Å; L988-I1040 HydrophobicContact CB-CD1 3.72Å; L988-I1040 HydrophobicContact CB-CG1 3.87Å
989	K	91.8	Very high	88.2	Confident	91 Å²	91	74.1 Å²	74.1	40%	0.396	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	130.5	-171.3	-177.7	175.3	-171.2	-52.3	0	111.6	D991 V1037 V1038 P1039 I1040	K989-D991 IonicContact NZ-OD1 2.62Å; K989-D991 PolarHBondContact NZ-OD1 2.83Å; K989-V1037 HydrophobicContact CB-CG1 3.8Å; K989-V1037 HydrophobicContact CD-CG1 4.35Å; K989-V1038 PolarHBondContact N-O 3.11Å; K989-P1039 WeakPolarHBondContact O-CA 3.23Å; K989-I1040 PolarHBondContact O-N 3.05Å
990	L	90.8	Very high	88.9	Confident	14 Å²	14	65 Å²	65	7%	0.073	31%	0.306	C	S	.	.			trans	-94.8	154.2	165.6	-64.4	167.5	0	0	0	110.4	F992 V996 I998 L1011 V1013 I1040 M1042	L990-F992 HydrophobicContact CB-CD2 3.84Å; L990-F992 HydrophobicContact CB-CE2 3.97Å; L990-F992 HydrophobicContact CD1-CE2 4.21Å; L990-F992 HydrophobicContact CD2-CE2 4.39Å; L990-F992 HydrophobicContact CG-CE2 4.43Å; L990-V996 HydrophobicContact CB-CG1 4.07Å; L990-V996 HydrophobicContact CD1-CG1 3.51Å; L990-V996 HydrophobicContact CG-CG1 4.39Å; L990-I998 HydrophobicContact CD1-CD1 3.51Å; L990-I998 HydrophobicContact CD1-CG1 4.09Å; L990-L1011 HydrophobicContact CD1-CD2 4.49Å; L990-L1011 HydrophobicContact CD2-CD2 4.14Å; L990-V1013 HydrophobicContact CD1-CG2 4.03Å; L990-I1040 HydrophobicContact CD2-CB 4.3Å; L990-I1040 HydrophobicContact CD2-CD1 3.7Å; L990-I1040 HydrophobicContact CD2-CG1 4.49Å; L990-I1040 HydrophobicContact CG-CD1 4.15Å; L990-M1042 HydrophobicContact CD2-CE 3.12Å
991	D	85.5	Confident	89.4	Confident	122 Å²	122	55.2 Å²	55.2	65%	0.652	27%	0.27	S	S	*	.			trans	-115.8	79.3	-179.8	-74.9	-30.6	0	0	0	110.1	K989	K989-D991 IonicContact NZ-OD1 2.62Å; K989-D991 PolarHBondContact NZ-OD1 2.83Å
992	F	83.1	Confident	89.8	Confident	58 Å²	58	51.1 Å²	51.1	25%	0.254	25%	0.253	S	S	.	.			trans	-107.3	164	173.4	-75.7	-78.7	0	0	0	112.1	L990 H994 V996 V1013 M1020	L990-F992 HydrophobicContact CB-CD2 3.84Å; L990-F992 HydrophobicContact CB-CE2 3.97Å; L990-F992 HydrophobicContact CD1-CE2 4.21Å; L990-F992 HydrophobicContact CD2-CE2 4.39Å; L990-F992 HydrophobicContact CG-CE2 4.43Å; F992-H994 AromaticContact CD1-CE1 3.53Å; F992-H994 AromaticContact CD1-ND1 3.93Å; F992-V996 HydrophobicContact CB-CG2 3.96Å; F992-V996 HydrophobicContact CD2-CG1 4.13Å; F992-V996 HydrophobicContact CD2-CG2 4.12Å; F992-V996 HydrophobicContact CG-CG2 4.44Å; F992-V1013 HydrophobicContact CD2-CG1 4.36Å; F992-V1013 HydrophobicContact CE2-CB 4.27Å; F992-V1013 HydrophobicContact CE2-CG1 4.13Å; F992-V1013 HydrophobicContact CE2-CG2 3.83Å; F992-V1013 HydrophobicContact CZ-CB 4.23Å; F992-V1013 HydrophobicContact CZ-CG1 4.31Å; F992-V1013 HydrophobicContact CZ-CG2 4.12Å; F992-M1020 HydrophobicContact CE2-CE 4.49Å; F992-M1020 HydrophobicContact CE2-SD 4.41Å; F992-M1020 HydrophobicContact CZ-CE 3.72Å; F992-M1020 HydrophobicContact CZ-SD 3.71Å
993	N	77.1	Confident	89.9	Confident	181 Å²	181	48.8 Å²	48.8	97%	0.968	24%	0.244	S	C	*	.	S	Bend	trans	-92.9	-3.1	175.4	-66.4	-32.2	0	0	0	113
994	H	78.4	Confident	90.1	Very high	74 Å²	74	43.2 Å²	43.2	34%	0.343	22%	0.218	S	C	.	.	S	Bend	trans	-126.8	178	-179.6	64.2	-74.4	0	0	0	111.1	F992 V996 V1014	F992-H994 AromaticContact CD1-CE1 3.53Å; F992-H994 AromaticContact CD1-ND1 3.93Å; H994-V996 WeakPolarHBondContact O-CG2 3.1Å; H994-V1014 PolarHBondContact NE2-O 2.9Å
995	E	79.2	Confident	90	Very high	170 Å²	170	43 Å²	43	79%	0.794	22%	0.217	S	C	*	.			trans	-70	140.2	177	-167.7	150.3	-138.8	0	0	110.6	C997	E995-C997 PolarHBondContact O-N 3.1Å
996	V	85.1	Confident	89.8	Confident	27 Å²	27	41.5 Å²	41.5	16%	0.164	21%	0.21	C	C	.	.			trans	-108	77.9	-159.5	-172	0	0	0	0	111.6	E964 D965 L990 F992 H994 I998 V1013	E964-V996 CarbonylContact C-O 3.52Å; E964-V996 CarbonylContact O-C 3.58Å; E964-V996 VanDerWaalsContact O-O 3.09Å; D965-V996 CarbonylContact C-O 3.59Å; D965-V996 WeakPolarHBondContact CA-O 3.31Å; L990-V996 HydrophobicContact CB-CG1 4.07Å; L990-V996 HydrophobicContact CD1-CG1 3.51Å; L990-V996 HydrophobicContact CG-CG1 4.39Å; F992-V996 HydrophobicContact CB-CG2 3.96Å; F992-V996 HydrophobicContact CD2-CG1 4.13Å; F992-V996 HydrophobicContact CD2-CG2 4.12Å; F992-V996 HydrophobicContact CG-CG2 4.44Å; H994-V996 WeakPolarHBondContact O-CG2 3.1Å; V996-I998 HydrophobicContact CG1-CD1 4.26Å; V996-I998 HydrophobicContact CG1-CG1 4.04Å; V996-V1013 HydrophobicContact CG1-CG1 4.21Å
997	C	89.5	Confident	89.7	Confident	17 Å²	17	41.5 Å²	41.5	12%	0.115	21%	0.209	C	C	.	.			trans	-80.8	125.1	170	176.7	0	0	0	0	111.2	E964 E995 V1013 V1014	E964-C997 VanDerWaalsContact O-CA 3.26Å; E964-C997 WeakPolarHBondContact O-CA 3.34Å; E964-C997 PolarHBondContact O-N 2.75Å; E995-C997 PolarHBondContact O-N 3.1Å; C997-V1013 VanDerWaalsContact O-CA 3.3Å; C997-V1013 WeakPolarHBondContact O-CA 3.42Å; C997-V1013 WeakPolarHBondContact O-CG1 3.22Å; C997-V1014 HydrophobicContact CB-CB 4.12Å; C997-V1014 HydrophobicContact CB-CG2 3.63Å; C997-V1014 PolarHBondContact O-N 3.04Å; C997-V1014 VanDerWaalsContact O-N 3.08Å; C997-V1014 WeakPolarHBondContact SG-CG2 3.34Å
998	I	92.8	Very high	89.6	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	20%	0.198	C	C	.	.			trans	-110.4	84.7	-174	-50.2	-178.9	0	0	0	109	C963 L967 L990 V996 V1013	C963-I998 WeakPolarHBondContact O-CB 3.28Å; C963-I998 PolarHBondContact O-N 2.9Å; L967-I998 HydrophobicContact CB-CD1 4.22Å; L967-I998 HydrophobicContact CD1-CD1 3.96Å; L967-I998 HydrophobicContact CG-CD1 3.61Å; L967-I998 HydrophobicContact CG-CG2 4.41Å; L990-I998 HydrophobicContact CD1-CD1 3.51Å; L990-I998 HydrophobicContact CD1-CG1 4.09Å; V996-I998 HydrophobicContact CG1-CD1 4.26Å; V996-I998 HydrophobicContact CG1-CG1 4.04Å; I998-V1013 HydrophobicContact CG1-CG2 4.46Å
999	D	90.6	Very high	89.8	Confident	2 Å²	2	39 Å²	39	1%	0.011	20%	0.198	C	C	.	.			trans	-82.6	-16.5	-169	56.3	5.3	0	0	0	114.6	L948 N949 K1012 V1014 I1054	L948-D999 HydrophobicContact CD1-CB 4.46Å; N949-D999 VanDerWaalsContact ND2-C 3.29Å; N949-D999 PolarHBondContact ND2-O 3.43Å; D999-K1012 VanDerWaalsContact OD1-CB 3.26Å; D999-K1012 WeakPolarHBondContact OD1-CB 3.2Å; D999-K1012 IonicContact OD1-NZ 2.76Å; D999-K1012 PolarHBondContact OD1-NZ 3.43Å; D999-K1012 IonicContact OD2-NZ 3.55Å; D999-K1012 PolarHBondContact OD2-NZ 3.21Å; D999-V1014 HydrophobicContact CB-CG2 3.94Å; D999-V1014 WeakPolarHBondContact OD2-CG2 3.37Å; D999-I1054 WeakPolarHBondContact CB-O 3.21Å
1000	A	95.2	Very high	90	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	142.4	168.6	0	0	0	0	0	112.8	N949 L1011 K1012 N1057 V1058	N949-A1000 VanDerWaalsContact ND2-CA 3.34Å; N949-A1000 WeakPolarHBondContact ND2-CA 3.49Å; A1000-L1011 VanDerWaalsContact O-CA 3.29Å; A1000-L1011 WeakPolarHBondContact O-CA 3.48Å; A1000-K1012 HydrophobicContact CB-CB 3.69Å; A1000-K1012 PolarHBondContact O-N 2.9Å; A1000-N1057 WeakPolarHBondContact CB-OD1 3.49Å; A1000-V1058 HydrophobicContact CB-CB 3.7Å; A1000-V1058 HydrophobicContact CB-CG2 3.54Å
1001	L	96.7	Very high	90.3	Very high	6 Å²	6	34 Å²	34	3%	0.031	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	121.8	171.7	-179.8	71.9	0	0	0	110	N949 V951 I960 L967 L1009 V1010 L1011 F1022	N949-L1001 HydrophobicContact CB-CB 3.8Å; V951-L1001 HydrophobicContact CB-CD2 4.15Å; V951-L1001 HydrophobicContact CB-CG 4.37Å; V951-L1001 HydrophobicContact CG2-CD2 4.05Å; V951-L1001 HydrophobicContact CG2-CG 3.81Å; V951-L1001 WeakPolarHBondContact CG2-O 3.5Å; I960-L1001 HydrophobicContact CB-CD2 4.3Å; I960-L1001 HydrophobicContact CG2-CD2 3.9Å; L967-L1001 HydrophobicContact CD2-CD1 3.84Å; L967-L1001 HydrophobicContact CD2-CD2 3.63Å; L967-L1001 HydrophobicContact CD2-CG 4.3Å; L1001-L1009 HydrophobicContact CD1-CD2 4.19Å; L1001-V1010 WeakPolarHBondContact CA-O 3.3Å; L1001-L1011 HydrophobicContact CD1-CB 4.1Å; L1001-F1022 HydrophobicContact CD1-CE1 4.33Å
1002	A	97.1	Very high	90.8	Very high	13 Å²	13	28.2 Å²	28.2	11%	0.107	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	157.3	-178.3	0	0	0	0	0	112.4	L1009 V1010 V1060	A1002-L1009 WeakPolarHBondContact O-CA 3.09Å; A1002-V1010 PolarHBondContact N-O 2.93Å; A1002-V1010 PolarHBondContact O-N 2.98Å; A1002-V1060 HydrophobicContact CB-CB 4.24Å; A1002-V1060 HydrophobicContact CB-CG2 3.49Å; A1002-V1060 VanDerWaalsContact CB-CG2 3.49Å
1003	Q	95.8	Very high	91.3	Very high	13 Å²	13	25.5 Å²	25.5	6%	0.061	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	127.5	179.6	-174.2	-173.5	3.3	0	0	111.5	V951 F952 L953 S1005 V1060 Q1062	V951-Q1003 HydrophobicContact CG1-CB 3.87Å; F952-Q1003 PolarHBondContact O-OE1 2.77Å; L953-Q1003 HydrophobicContact CD2-CG 3.82Å; Q1003-S1005 WeakPolarHBondContact CG-O 3.33Å; Q1003-S1005 PolarHBondContact NE2-O 3.06Å; Q1003-V1060 WeakPolarHBondContact O-CG1 3.41Å; Q1003-Q1062 WeakPolarHBondContact O-CG 3.2Å; Q1003-Q1062 PolarHBondContact O-NE2 2.67Å
1004	L	94.4	Very high	92	Very high	2 Å²	2	17.7 Å²	17.7	1%	0.01	9%	0.092	C	C	.	.			trans	-97.7	-30.9	176.5	179.1	64.6	0	0	0	113.3	A1008 V1010 V1021 V1060 V1067 L1081 L1085 L1088	L1004-A1008 HydrophobicContact CB-CB 4.11Å; L1004-A1008 HydrophobicContact CD2-CB 4.17Å; L1004-A1008 HydrophobicContact CG-CB 4.37Å; L1004-A1008 PolarHBondContact N-O 3.33Å; L1004-V1010 HydrophobicContact CB-CG2 3.98Å; L1004-V1010 HydrophobicContact CD2-CG2 4.42Å; L1004-V1021 HydrophobicContact CD2-CG1 3.9Å; L1004-V1060 HydrophobicContact CB-CG1 4.04Å; L1004-V1060 HydrophobicContact CD1-CG1 3.53Å; L1004-V1060 HydrophobicContact CG-CG1 4.4Å; L1004-V1067 HydrophobicContact CD1-CG2 4.38Å; L1004-L1081 HydrophobicContact CD1-CB 4.38Å; L1004-L1081 HydrophobicContact CD1-CD1 4.26Å; L1004-L1081 HydrophobicContact CD2-CB 4.39Å; L1004-L1081 HydrophobicContact CD2-CD1 3.61Å; L1004-L1085 HydrophobicContact CD1-CD2 4.03Å; L1004-L1085 HydrophobicContact CD2-CD2 3.94Å; L1004-L1085 HydrophobicContact CG-CD2 3.69Å; L1004-L1088 HydrophobicContact CD2-CD1 3.9Å
1005	S	91.8	Very high	92.5	Very high	10 Å²	10	18.6 Å²	18.6	7%	0.07	10%	0.096	C	C	.	.	S	Bend	trans	-158.9	-175.6	174	79.9	0	0	0	0	111.8	Q1003 N1007 A1008 H1089	Q1003-S1005 WeakPolarHBondContact CG-O 3.33Å; Q1003-S1005 PolarHBondContact NE2-O 3.06Å; S1005-N1007 PolarHBondContact O-N 3.38Å; S1005-N1007 PolarHBondContact OG-N 2.84Å; S1005-A1008 PolarHBondContact N-O 3.1Å; S1005-A1008 WeakPolarHBondContact OG-CB 3.33Å; S1005-A1008 PolarHBondContact OG-N 2.94Å; S1005-A1008 VanDerWaalsContact OG-N 3.1Å; S1005-H1089 VanDerWaalsContact CB-CE1 3.48Å; S1005-H1089 WeakPolarHBondContact CB-CE1 3.43Å; S1005-H1089 WeakPolarHBondContact CB-NE2 3.45Å; S1005-H1089 PolarHBondContact OG-CE1 3.29Å; S1005-H1089 PolarHBondContact OG-NE2 3.03Å
1006	D	89	Confident	93.1	Very high	20 Å²	20	12 Å²	12	11%	0.107	7%	0.068	C	C	.	.	S	Bend	trans	-47.2	-27.7	171.8	-85.3	-39.3	0	0	0	114.6	P725 K729 H955 Y956	P725-D1006 HydrophobicContact CB-CB 4.48Å; P725-D1006 HydrophobicContact CG-CB 3.72Å; K729-D1006 WeakPolarHBondContact CD-OD2 3.39Å; K729-D1006 WeakPolarHBondContact CE-OD2 3.49Å; K729-D1006 VanDerWaalsContact NZ-CG 3.26Å; K729-D1006 IonicContact NZ-OD1 3.28Å; K729-D1006 PolarHBondContact NZ-OD1 2.74Å; K729-D1006 IonicContact NZ-OD2 3.38Å; K729-D1006 PolarHBondContact NZ-OD2 2.86Å; K729-D1006 VanDerWaalsContact NZ-OD2 3.09Å; H955-D1006 HydrophobicContact CB-CB 4.36Å; Y956-D1006 VanDerWaalsContact CE2-O 3.25Å; Y956-D1006 WeakPolarHBondContact CE2-O 3.15Å
1007	N	91	Very high	93.5	Very high	0 Å²	0	11.4 Å²	11.4	0%	0	7%	0.068	C	C	.	.	S	Bend	trans	-134.3	-11.3	-177.8	70.8	-86.4	0	0	0	115.6	R724 Y956 S1005 D1023 F1024 A1025 L1088 H1089	R724-N1007 PolarHBondContact NH2-ND2 2.93Å; Y956-N1007 HydrophobicContact CE2-CB 3.77Å; S1005-N1007 PolarHBondContact O-N 3.38Å; S1005-N1007 PolarHBondContact OG-N 2.84Å; N1007-D1023 PolarHBondContact ND2-OD1 3.23Å; N1007-F1024 PolarHBondContact O-N 3.23Å; N1007-A1025 HydrophobicContact CB-CB 4.26Å; N1007-L1088 PolarHBondContact ND2-O 2.65Å; N1007-H1089 PolarHBondContact OD1-CE1 3.4Å; N1007-H1089 VanDerWaalsContact OD1-CE1 3.29Å; N1007-H1089 PolarHBondContact OD1-ND1 3.14Å
1008	A	93.5	Very high	93.8	Very high	0 Å²	0	13 Å²	13	0%	0	7%	0.074	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	137.1	178.1	0	0	0	0	0	111.6	L1004 S1005 F1022 L1088	L1004-A1008 HydrophobicContact CB-CB 4.11Å; L1004-A1008 HydrophobicContact CD2-CB 4.17Å; L1004-A1008 HydrophobicContact CG-CB 4.37Å; L1004-A1008 PolarHBondContact N-O 3.33Å; S1005-A1008 PolarHBondContact N-O 3.1Å; S1005-A1008 WeakPolarHBondContact OG-CB 3.33Å; S1005-A1008 PolarHBondContact OG-N 2.94Å; S1005-A1008 VanDerWaalsContact OG-N 3.1Å; A1008-F1022 WeakPolarHBondContact CA-O 3.32Å; A1008-L1088 HydrophobicContact CB-CB 4.37Å; A1008-L1088 HydrophobicContact CB-CD1 4.05Å; A1008-L1088 HydrophobicContact CB-CD2 4.36Å
1009	L	96.8	Very high	94	Very high	0 Å²	0	13 Å²	13	0%	0	7%	0.074	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	150.2	175.5	-67.5	91.6	0	0	0	110.1	V951 L953 I960 L1001 A1002 V1021 F1022 F1024	V951-L1009 HydrophobicContact CB-CD2 4.19Å; V951-L1009 HydrophobicContact CG1-CD2 3.7Å; L953-L1009 HydrophobicContact CD1-CD1 3.8Å; L953-L1009 HydrophobicContact CD1-CD2 4.4Å; L953-L1009 HydrophobicContact CD2-CD1 4.1Å; L953-L1009 HydrophobicContact CD2-CD2 4.28Å; L953-L1009 HydrophobicContact CD2-CG 4.29Å; I960-L1009 HydrophobicContact CD1-CD2 3.98Å; L1001-L1009 HydrophobicContact CD1-CD2 4.19Å; A1002-L1009 WeakPolarHBondContact O-CA 3.09Å; L1009-V1021 CarbonylContact O-C 3.5Å; L1009-V1021 WeakPolarHBondContact O-CA 3.19Å; L1009-F1022 HydrophobicContact CB-CD1 4.13Å; L1009-F1022 HydrophobicContact CB-CE1 3.53Å; L1009-F1022 HydrophobicContact CB-CE2 4.25Å; L1009-F1022 HydrophobicContact CB-CZ 3.62Å; L1009-F1022 HydrophobicContact CD1-CE2 4.06Å; L1009-F1022 HydrophobicContact CD1-CZ 4.08Å; L1009-F1022 HydrophobicContact CD2-CZ 4.09Å; L1009-F1022 HydrophobicContact CG-CZ 4.15Å; L1009-F1022 PolarHBondContact N-O 3.2Å; L1009-F1022 PolarHBondContact O-N 3.23Å; L1009-F1024 HydrophobicContact CD1-CB 3.79Å; L1009-F1024 HydrophobicContact CD1-CG 4.5Å
1010	V	97.6	Very high	94.3	Very high	0 Å²	0	13 Å²	13	0%	0	7%	0.073	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	137	173	-168.9	0	0	0	0	107.9	L1001 A1002 L1004 I1019 M1020 V1021 V1058 V1060 V1067	L1001-V1010 WeakPolarHBondContact CA-O 3.3Å; A1002-V1010 PolarHBondContact N-O 2.93Å; A1002-V1010 PolarHBondContact O-N 2.98Å; L1004-V1010 HydrophobicContact CB-CG2 3.98Å; L1004-V1010 HydrophobicContact CD2-CG2 4.42Å; V1010-I1019 HydrophobicContact CG1-CG2 3.2Å; V1010-M1020 CarbonylContact C-O 3.58Å; V1010-M1020 VanDerWaalsContact CA-O 3.32Å; V1010-M1020 WeakPolarHBondContact CA-O 3.42Å; V1010-V1021 HydrophobicContact CG2-CG2 4.37Å; V1010-V1058 HydrophobicContact CG1-CG1 3.95Å; V1010-V1060 HydrophobicContact CB-CG2 4.13Å; V1010-V1060 HydrophobicContact CG2-CG2 3.7Å; V1010-V1067 HydrophobicContact CG1-CG1 4.22Å; V1010-V1067 HydrophobicContact CG2-CG2 4.12Å
1011	L	96.9	Very high	94.4	Very high	0 Å²	0	13 Å²	13	0%	0	7%	0.073	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	157	170	67.8	81	0	0	0	110.6	L967 L990 A1000 L1001 V1013 M1020 F1022 I1040 M1042	L967-L1011 HydrophobicContact CD1-CD2 3.62Å; L990-L1011 HydrophobicContact CD1-CD2 4.49Å; L990-L1011 HydrophobicContact CD2-CD2 4.14Å; A1000-L1011 VanDerWaalsContact O-CA 3.29Å; A1000-L1011 WeakPolarHBondContact O-CA 3.48Å; L1001-L1011 HydrophobicContact CD1-CB 4.1Å; L1011-V1013 HydrophobicContact CD1-CG2 3.71Å; L1011-M1020 HydrophobicContact CD1-CB 3.98Å; L1011-M1020 HydrophobicContact CD1-CE 3.65Å; L1011-M1020 HydrophobicContact CD1-SD 4.08Å; L1011-M1020 HydrophobicContact CG-CB 4.27Å; L1011-M1020 PolarHBondContact N-O 3.36Å; L1011-M1020 PolarHBondContact O-N 3.47Å; L1011-F1022 HydrophobicContact CD2-CD1 3.77Å; L1011-F1022 HydrophobicContact CD2-CE1 3.68Å; L1011-F1022 HydrophobicContact CG-CD1 4.33Å; L1011-F1022 HydrophobicContact CG-CE1 4.37Å; L1011-I1040 HydrophobicContact CD2-CD1 4.48Å; L1011-M1042 HydrophobicContact CD2-CE 4.12Å
1012	K	95.5	Very high	94.3	Very high	0 Å²	0	12.7 Å²	12.7	0%	0	7%	0.072	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	153	168	-162.9	171	105.7	-67.1	0	108.5	D999 A1000 I1019 W1048 I1056 V1058	D999-K1012 VanDerWaalsContact OD1-CB 3.26Å; D999-K1012 WeakPolarHBondContact OD1-CB 3.2Å; D999-K1012 IonicContact OD1-NZ 2.76Å; D999-K1012 PolarHBondContact OD1-NZ 3.43Å; D999-K1012 IonicContact OD2-NZ 3.55Å; D999-K1012 PolarHBondContact OD2-NZ 3.21Å; A1000-K1012 HydrophobicContact CB-CB 3.69Å; A1000-K1012 PolarHBondContact O-N 2.9Å; K1012-I1019 HydrophobicContact CB-CG1 4.41Å; K1012-I1019 HydrophobicContact CD-CD1 4.36Å; K1012-I1019 HydrophobicContact CD-CG1 3.85Å; K1012-I1019 HydrophobicContact CG-CG1 3.98Å; K1012-W1048 HydrophobicContact CD-CD2 4.05Å; K1012-W1048 HydrophobicContact CD-CE3 3.59Å; K1012-W1048 HydrophobicContact CD-CH2 3.77Å; K1012-W1048 HydrophobicContact CD-CZ2 4.16Å; K1012-W1048 HydrophobicContact CD-CZ3 3.46Å; K1012-W1048 VanDerWaalsContact CD-CZ3 3.46Å; K1012-W1048 HydrophobicContact CG-CE3 4.12Å; K1012-W1048 HydrophobicContact CG-CZ3 4.06Å; K1012-I1056 PolarHBondContact NZ-O 2.69Å; K1012-V1058 HydrophobicContact CB-CG2 3.99Å; K1012-V1058 HydrophobicContact CD-CG2 3.82Å; K1012-V1058 HydrophobicContact CG-CG2 4.48Å
1013	V	93.6	Very high	94.1	Very high	0 Å²	0	12.3 Å²	12.3	0%	0	7%	0.068	C	C	.	.			trans	-132.8	133.8	176.7	177.2	0	0	0	0	107.6	L990 F992 V996 C997 I998 L1011 S1016 M1020	L990-V1013 HydrophobicContact CD1-CG2 4.03Å; F992-V1013 HydrophobicContact CD2-CG1 4.36Å; F992-V1013 HydrophobicContact CE2-CB 4.27Å; F992-V1013 HydrophobicContact CE2-CG1 4.13Å; F992-V1013 HydrophobicContact CE2-CG2 3.83Å; F992-V1013 HydrophobicContact CZ-CB 4.23Å; F992-V1013 HydrophobicContact CZ-CG1 4.31Å; F992-V1013 HydrophobicContact CZ-CG2 4.12Å; V996-V1013 HydrophobicContact CG1-CG1 4.21Å; C997-V1013 VanDerWaalsContact O-CA 3.3Å; C997-V1013 WeakPolarHBondContact O-CA 3.42Å; C997-V1013 WeakPolarHBondContact O-CG1 3.22Å; I998-V1013 HydrophobicContact CG1-CG2 4.46Å; L1011-V1013 HydrophobicContact CD1-CG2 3.71Å; V1013-S1016 VanDerWaalsContact O-CB 3.22Å; V1013-S1016 WeakPolarHBondContact O-CB 3.24Å; V1013-S1016 PolarHBondContact O-N 2.88Å; V1013-S1016 VanDerWaalsContact O-N 3.16Å; V1013-S1016 PolarHBondContact O-OG 2.96Å; V1013-M1020 HydrophobicContact CB-CE 4.11Å; V1013-M1020 HydrophobicContact CG2-CE 3.87Å
1014	V	90.8	Very high	94	Very high	18 Å²	18	11.7 Å²	11.7	11%	0.109	7%	0.065	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.4	144.2	179.1	-177.4	0	0	0	0	110.1	H994 C997 D999 S1016 I1054	H994-V1014 PolarHBondContact NE2-O 2.9Å; C997-V1014 HydrophobicContact CB-CB 4.12Å; C997-V1014 HydrophobicContact CB-CG2 3.63Å; C997-V1014 PolarHBondContact O-N 3.04Å; C997-V1014 VanDerWaalsContact O-N 3.08Å; C997-V1014 WeakPolarHBondContact SG-CG2 3.34Å; D999-V1014 HydrophobicContact CB-CG2 3.94Å; D999-V1014 WeakPolarHBondContact OD2-CG2 3.37Å; V1014-S1016 PolarHBondContact O-N 2.87Å; V1014-I1054 HydrophobicContact CG1-CG2 4.12Å; V1014-I1054 HydrophobicContact CG2-CB 4.17Å; V1014-I1054 HydrophobicContact CG2-CG2 3.68Å
1015	E	90.6	Very high	93.9	Very high	93 Å²	93	11.7 Å²	11.7	44%	0.435	7%	0.065	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.7	1	-177.4	-88.2	-155.2	-114.4	0	0	116.7	K1050 T1051 D1052	E1015-K1050 PolarHBondContact O-NZ 3.38Å; E1015-K1050 IonicContact OE2-NZ 2.67Å; E1015-K1050 PolarHBondContact OE2-NZ 2.89Å; E1015-T1051 VanDerWaalsContact CA-O 3.29Å; E1015-T1051 WeakPolarHBondContact CA-O 3.32Å; E1015-T1051 PolarHBondContact N-O 3.03Å; E1015-D1052 HydrophobicContact CG-CB 4.29Å
1016	S	91.6	Very high	93.9	Very high	30 Å²	30	11.8 Å²	11.8	21%	0.21	7%	0.066	C	C	.	.			trans	-69.9	-37.1	-175.8	61.5	0	0	0	0	114.6	V1013 V1014 E1018	V1013-S1016 VanDerWaalsContact O-CB 3.22Å; V1013-S1016 WeakPolarHBondContact O-CB 3.24Å; V1013-S1016 PolarHBondContact O-N 2.88Å; V1013-S1016 VanDerWaalsContact O-N 3.16Å; V1013-S1016 PolarHBondContact O-OG 2.96Å; V1014-S1016 PolarHBondContact O-N 2.87Å; S1016-E1018 PolarHBondContact OG-N 3.33Å; S1016-E1018 PolarHBondContact OG-O 2.94Å
1017	G	92.9	Very high	94	Very high	15 Å²	15	10.9 Å²	10.9	16%	0.155	6%	0.061	C	C	.	.	S	Bend	trans	72.6	13.3	-169	0	0	0	0	0	114.1	W1048	G1017-W1048 PolarHBondContact O-N 3.1Å
1018	E	95	Very high	94.1	Very high	51 Å²	51	11.2 Å²	11.2	24%	0.238	6%	0.063	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149	144.1	177.4	56.8	172.2	-157.7	0	0	113.2	S1016 M1020 H1045 L1046	S1016-E1018 PolarHBondContact OG-N 3.33Å; S1016-E1018 PolarHBondContact OG-O 2.94Å; E1018-M1020 HydrophobicContact CG-CE 4.32Å; E1018-M1020 HydrophobicContact CG-CG 4.31Å; E1018-H1045 IonicContact OE1-CE1 3.12Å; E1018-H1045 PolarHBondContact OE1-CE1 2.76Å; E1018-H1045 IonicContact OE1-ND1 2.7Å; E1018-H1045 PolarHBondContact OE1-ND1 2.95Å; E1018-H1045 IonicContact OE2-CE1 3.86Å; E1018-H1045 IonicContact OE2-CG 3.24Å; E1018-H1045 IonicContact OE2-ND1 3.42Å; E1018-H1045 PolarHBondContact OE2-ND1 3.23Å; E1018-L1046 CarbonylContact C-O 3.5Å; E1018-L1046 VanDerWaalsContact CA-O 3.26Å; E1018-L1046 WeakPolarHBondContact CA-O 3.39Å; E1018-L1046 WeakPolarHBondContact CB-O 3.27Å
1019	I	97.3	Very high	93.9	Very high	0 Å²	0	16.1 Å²	16.1	0%	0	9%	0.086	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	128.3	169.3	-65.3	164	0	0	0	107.3	V1010 K1012 L1046 W1048 V1058 C1069 Y1079	V1010-I1019 HydrophobicContact CG1-CG2 3.2Å; K1012-I1019 HydrophobicContact CB-CG1 4.41Å; K1012-I1019 HydrophobicContact CD-CD1 4.36Å; K1012-I1019 HydrophobicContact CD-CG1 3.85Å; K1012-I1019 HydrophobicContact CG-CG1 3.98Å; I1019-L1046 HydrophobicContact CB-CB 3.98Å; I1019-L1046 HydrophobicContact CB-CD2 4.38Å; I1019-L1046 HydrophobicContact CG2-CD2 4.12Å; I1019-L1046 PolarHBondContact N-O 2.88Å; I1019-L1046 WeakPolarHBondContact O-CB 3.4Å; I1019-L1046 PolarHBondContact O-N 2.94Å; I1019-W1048 HydrophobicContact CD1-CB 4.01Å; I1019-W1048 HydrophobicContact CD1-CD2 4.27Å; I1019-W1048 HydrophobicContact CD1-CG 3.79Å; I1019-W1048 HydrophobicContact CG1-CB 4.04Å; I1019-W1048 HydrophobicContact CG1-CD2 4.33Å; I1019-W1048 HydrophobicContact CG1-CG 4.09Å; I1019-V1058 HydrophobicContact CD1-CG2 3.89Å; I1019-V1058 HydrophobicContact CG1-CG2 4.11Å; I1019-V1058 HydrophobicContact CG2-CG1 4.29Å; I1019-V1058 HydrophobicContact CG2-CG2 4.36Å; I1019-C1069 HydrophobicContact CD1-CB 3.49Å; I1019-C1069 VanDerWaalsContact CD1-CB 3.49Å; I1019-Y1079 HydrophobicContact CD1-CE2 4.18Å
1020	M	96.6	Very high	93.3	Very high	2 Å²	2	19.7 Å²	19.7	1%	0.01	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	144.4	-171.2	-73.1	157	-87.9	0	0	112.2	F992 V1010 L1011 V1013 E1018 M1042 G1044	F992-M1020 HydrophobicContact CE2-CE 4.49Å; F992-M1020 HydrophobicContact CE2-SD 4.41Å; F992-M1020 HydrophobicContact CZ-CE 3.72Å; F992-M1020 HydrophobicContact CZ-SD 3.71Å; V1010-M1020 CarbonylContact C-O 3.58Å; V1010-M1020 VanDerWaalsContact CA-O 3.32Å; V1010-M1020 WeakPolarHBondContact CA-O 3.42Å; L1011-M1020 HydrophobicContact CD1-CB 3.98Å; L1011-M1020 HydrophobicContact CD1-CE 3.65Å; L1011-M1020 HydrophobicContact CD1-SD 4.08Å; L1011-M1020 HydrophobicContact CG-CB 4.27Å; L1011-M1020 PolarHBondContact N-O 3.36Å; L1011-M1020 PolarHBondContact O-N 3.47Å; V1013-M1020 HydrophobicContact CB-CE 4.11Å; V1013-M1020 HydrophobicContact CG2-CE 3.87Å; E1018-M1020 HydrophobicContact CG-CE 4.32Å; E1018-M1020 HydrophobicContact CG-CG 4.31Å; M1020-M1042 HydrophobicContact CB-CE 4.33Å; M1020-M1042 HydrophobicContact CB-CG 4.14Å; M1020-M1042 HydrophobicContact CB-SD 3.82Å; M1020-M1042 HydrophobicContact CG-CG 4.08Å; M1020-M1042 HydrophobicContact CG-SD 4.36Å; M1020-M1042 HydrophobicContact SD-CE 3.97Å; M1020-M1042 HydrophobicContact SD-CG 4.14Å; M1020-M1042 HydrophobicContact SD-SD 4.4Å; M1020-G1044 WeakPolarHBondContact CA-O 3.35Å
1021	V	96.9	Very high	93	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	129.5	176	-172.3	0	0	0	0	109.6	L1004 L1009 V1010 R1043 G1044 L1046 L1081 L1088 F1096	L1004-V1021 HydrophobicContact CD2-CG1 3.9Å; L1009-V1021 CarbonylContact O-C 3.5Å; L1009-V1021 WeakPolarHBondContact O-CA 3.19Å; V1010-V1021 HydrophobicContact CG2-CG2 4.37Å; V1021-R1043 WeakPolarHBondContact O-CA 3.08Å; V1021-R1043 WeakPolarHBondContact O-CB 3.37Å; V1021-R1043 PolarHBondContact O-N 3.5Å; V1021-G1044 PolarHBondContact N-O 2.91Å; V1021-G1044 PolarHBondContact O-N 3.31Å; V1021-L1046 HydrophobicContact CG2-CD1 3.79Å; V1021-L1081 HydrophobicContact CG2-CD1 3.94Å; V1021-L1088 HydrophobicContact CG1-CD1 4.16Å; V1021-L1088 HydrophobicContact CG1-CD2 4.22Å; V1021-F1096 HydrophobicContact CB-CZ 4.25Å; V1021-F1096 HydrophobicContact CG1-CZ 4.36Å; V1021-F1096 HydrophobicContact CG2-CZ 4.49Å
1022	F	95.1	Very high	92.4	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	162.3	176.7	73.3	-85.8	0	0	0	113	L1001 A1008 L1009 L1011 F1024 I1027 I1040 M1042	L1001-F1022 HydrophobicContact CD1-CE1 4.33Å; A1008-F1022 WeakPolarHBondContact CA-O 3.32Å; L1009-F1022 HydrophobicContact CB-CD1 4.13Å; L1009-F1022 HydrophobicContact CB-CE1 3.53Å; L1009-F1022 HydrophobicContact CB-CE2 4.25Å; L1009-F1022 HydrophobicContact CB-CZ 3.62Å; L1009-F1022 HydrophobicContact CD1-CE2 4.06Å; L1009-F1022 HydrophobicContact CD1-CZ 4.08Å; L1009-F1022 HydrophobicContact CD2-CZ 4.09Å; L1009-F1022 HydrophobicContact CG-CZ 4.15Å; L1009-F1022 PolarHBondContact N-O 3.2Å; L1009-F1022 PolarHBondContact O-N 3.23Å; L1011-F1022 HydrophobicContact CD2-CD1 3.77Å; L1011-F1022 HydrophobicContact CD2-CE1 3.68Å; L1011-F1022 HydrophobicContact CG-CD1 4.33Å; L1011-F1022 HydrophobicContact CG-CE1 4.37Å; F1022-F1024 HydrophobicContact CE2-CD2 4.35Å; F1022-I1027 HydrophobicContact CD2-CD1 3.62Å; F1022-I1027 HydrophobicContact CE2-CD1 3.65Å; F1022-I1040 HydrophobicContact CB-CG2 3.57Å; F1022-I1040 HydrophobicContact CD1-CG2 4.46Å; F1022-I1040 HydrophobicContact CD2-CG2 4.01Å; F1022-I1040 HydrophobicContact CG-CG2 3.78Å; F1022-M1042 HydrophobicContact CB-SD 3.88Å
1023	D	93.2	Very high	91.8	Very high	4 Å²	4	33 Å²	33	2%	0.021	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	111.8	178.8	166.1	41.1	0	0	0	111.1	R724 N1007 A1025 S1026 I1027 R1043	R724-D1023 IonicContact CZ-OD1 2.74Å; R724-D1023 IonicContact CZ-OD2 3.2Å; R724-D1023 IonicContact NE-OD2 2.75Å; R724-D1023 IonicContact NH2-OD1 3.17Å; R724-D1023 PolarHBondContact NH2-OD1 2.91Å; R724-D1023 IonicContact NH2-OD2 3.77Å; R724-D1023 PolarHBondContact NH2-OD2 2.71Å; N1007-D1023 PolarHBondContact ND2-OD1 3.23Å; D1023-A1025 VanDerWaalsContact C-N 3.29Å; D1023-A1025 PolarHBondContact O-N 3.01Å; D1023-A1025 WeakPolarHBondContact OD1-CB 3.45Å; D1023-A1025 PolarHBondContact OD1-N 3.04Å; D1023-S1026 PolarHBondContact O-N 3.49Å; D1023-S1026 PolarHBondContact O-OG 2.87Å; D1023-S1026 WeakPolarHBondContact OD2-CB 3.5Å; D1023-S1026 PolarHBondContact OD2-N 2.99Å; D1023-S1026 PolarHBondContact OD2-OG 3.37Å; D1023-I1027 PolarHBondContact O-N 3.02Å; D1023-R1043 HydrophobicContact CB-CG 3.79Å
1024	F	94.8	Very high	91.2	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-67.6	-26.1	178.4	-166.6	-108.6	0	0	0	113.1	L953 Y956 Y958 I960 M986 L988 N1007 L1009 F1022 S1026 I1027 L1028	L953-F1024 HydrophobicContact CD1-CB 4.08Å; L953-F1024 HydrophobicContact CD1-CD1 3.5Å; L953-F1024 VanDerWaalsContact CD1-CD1 3.5Å; L953-F1024 HydrophobicContact CD1-CD2 4.24Å; L953-F1024 HydrophobicContact CD1-CE1 3.89Å; L953-F1024 HydrophobicContact CD1-CG 3.69Å; L953-F1024 HydrophobicContact CD1-CZ 4.42Å; Y956-F1024 AromaticContact CD2-CD1 3.82Å; Y956-F1024 HydrophobicContact CD2-CD1 3.82Å; Y956-F1024 HydrophobicContact CD2-CE1 4.4Å; Y956-F1024 HydrophobicContact CE2-CD1 4.38Å; Y956-F1024 AromaticContact CG-CD1 3.96Å; Y956-F1024 HydrophobicContact CG-CD1 3.96Å; Y956-F1024 HydrophobicContact CG-CE1 4.15Å; Y958-F1024 HydrophobicContact CD1-CZ 4.08Å; Y958-F1024 AromaticContact CD2-CE1 3.72Å; Y958-F1024 HydrophobicContact CD2-CE1 3.72Å; Y958-F1024 AromaticContact CD2-CZ 3.92Å; Y958-F1024 HydrophobicContact CD2-CZ 3.92Å; Y958-F1024 HydrophobicContact CE2-CE1 4.33Å; Y958-F1024 HydrophobicContact CE2-CZ 4.45Å; Y958-F1024 AromaticContact CG-CE1 3.91Å; Y958-F1024 HydrophobicContact CG-CE1 3.91Å; Y958-F1024 AromaticContact CG-CZ 3.7Å; Y958-F1024 HydrophobicContact CG-CZ 3.7Å; I960-F1024 HydrophobicContact CD1-CD2 3.78Å; I960-F1024 HydrophobicContact CD1-CE2 3.52Å; I960-F1024 HydrophobicContact CD1-CZ 4.05Å; I960-F1024 HydrophobicContact CG1-CE2 4.41Å; M986-F1024 HydrophobicContact CE-CE2 3.97Å; M986-F1024 HydrophobicContact CE-CZ 3.8Å; L988-F1024 HydrophobicContact CD1-CD2 4.49Å; L988-F1024 HydrophobicContact CD1-CE2 4.14Å; N1007-F1024 PolarHBondContact O-N 3.23Å; L1009-F1024 HydrophobicContact CD1-CB 3.79Å; L1009-F1024 HydrophobicContact CD1-CG 4.5Å; F1022-F1024 HydrophobicContact CE2-CD2 4.35Å; F1024-S1026 PolarHBondContact O-N 3.01Å; F1024-I1027 HydrophobicContact CD2-CD1 4.16Å; F1024-I1027 WeakPolarHBondContact O-CB 3.33Å; F1024-I1027 PolarHBondContact O-N 3.05Å; F1024-L1028 HydrophobicContact CD1-CD1 3.94Å; F1024-L1028 HydrophobicContact CD1-CG 4.24Å; F1024-L1028 HydrophobicContact CE1-CD1 3.69Å; F1024-L1028 HydrophobicContact CE1-CD2 4.24Å; F1024-L1028 HydrophobicContact CE1-CG 3.98Å; F1024-L1028 HydrophobicContact CZ-CD2 4.3Å; F1024-L1028 HydrophobicContact CZ-CG 4.42Å; F1024-L1028 PolarHBondContact O-N 3.48Å; F1024-L1028 VanDerWaalsContact O-N 3.16Å
1025	A	92.3	Very high	91	Very high	2 Å²	2	42.7 Å²	42.7	2%	0.017	22%	0.221	C	C	.	.	H	α-helix	trans	-60.1	-49.1	173.5	0	0	0	0	0	110.5	R724 Y956 N1007 D1023 I1027 L1028 E1029	R724-A1025 HydrophobicContact CG-CB 3.86Å; Y956-A1025 VanDerWaalsContact OH-CB 3.27Å; Y956-A1025 WeakPolarHBondContact OH-CB 3.32Å; N1007-A1025 HydrophobicContact CB-CB 4.26Å; D1023-A1025 VanDerWaalsContact C-N 3.29Å; D1023-A1025 PolarHBondContact O-N 3.01Å; D1023-A1025 WeakPolarHBondContact OD1-CB 3.45Å; D1023-A1025 PolarHBondContact OD1-N 3.04Å; A1025-I1027 PolarHBondContact O-N 3.32Å; A1025-L1028 PolarHBondContact O-N 3.02Å; A1025-L1028 VanDerWaalsContact O-N 3.17Å; A1025-E1029 WeakPolarHBondContact O-CB 3.44Å; A1025-E1029 VanDerWaalsContact O-CG 3.3Å; A1025-E1029 WeakPolarHBondContact O-CG 3.32Å; A1025-E1029 PolarHBondContact O-N 3.26Å
1026	S	90.2	Very high	90.9	Very high	12 Å²	12	45.3 Å²	45.3	8%	0.084	23%	0.226	C	C	.	.	H	α-helix	trans	-62.7	-22.9	177.3	76.1	0	0	0	0	114.3	D1023 F1024 R1030	D1023-S1026 PolarHBondContact O-N 3.49Å; D1023-S1026 PolarHBondContact O-OG 2.87Å; D1023-S1026 WeakPolarHBondContact OD2-CB 3.5Å; D1023-S1026 PolarHBondContact OD2-N 2.99Å; D1023-S1026 PolarHBondContact OD2-OG 3.37Å; F1024-S1026 PolarHBondContact O-N 3.01Å; S1026-R1030 VanDerWaalsContact O-CB 3.3Å; S1026-R1030 WeakPolarHBondContact O-CB 3.47Å; S1026-R1030 WeakPolarHBondContact O-CG 3.12Å; S1026-R1030 PolarHBondContact O-N 3.04Å; S1026-R1030 PolarHBondContact O-NE 3.31Å; S1026-R1030 PolarHBondContact OG-NH2 2.94Å
1027	I	92.2	Very high	90.9	Very high	1 Å²	1	47 Å²	47	1%	0.005	24%	0.235	C	C	.	.	H	α-helix	trans	-72.1	-50.9	173.9	-65.7	177.5	0	0	0	109	L988 F1022 D1023 F1024 A1025 E1029 R1030 R1031 V1038 I1040	L988-I1027 HydrophobicContact CD1-CD1 4.3Å; L988-I1027 HydrophobicContact CD2-CD1 4.48Å; L988-I1027 HydrophobicContact CD2-CG2 3.79Å; F1022-I1027 HydrophobicContact CD2-CD1 3.62Å; F1022-I1027 HydrophobicContact CE2-CD1 3.65Å; D1023-I1027 PolarHBondContact O-N 3.02Å; F1024-I1027 HydrophobicContact CD2-CD1 4.16Å; F1024-I1027 WeakPolarHBondContact O-CB 3.33Å; F1024-I1027 PolarHBondContact O-N 3.05Å; A1025-I1027 PolarHBondContact O-N 3.32Å; I1027-E1029 PolarHBondContact O-N 2.82Å; I1027-R1030 PolarHBondContact O-N 3.23Å; I1027-R1031 PolarHBondContact O-N 3.15Å; I1027-V1038 HydrophobicContact CG2-CB 4.27Å; I1027-V1038 HydrophobicContact CG2-CG1 3.79Å; I1027-I1040 HydrophobicContact CD1-CG1 3.95Å; I1027-I1040 HydrophobicContact CD1-CG2 4.44Å
1028	L	92.4	Very high	91	Very high	7 Å²	7	46.4 Å²	46.4	4%	0.037	23%	0.228	C	C	.	.	H	α-helix	trans	-63.5	-41.4	177.6	-63.8	177.7	0	0	0	112.2	L721 Y956 Y958 M986 F1024 A1025 R1030 R1031	L721-L1028 HydrophobicContact CD1-CB 3.97Å; L721-L1028 WeakPolarHBondContact CD1-O 3.42Å; L721-L1028 HydrophobicContact CD2-CB 4.02Å; L721-L1028 HydrophobicContact CD2-CD1 4.37Å; Y956-L1028 HydrophobicContact CD1-CD1 3.31Å; Y956-L1028 HydrophobicContact CE1-CD1 3.86Å; Y956-L1028 HydrophobicContact CG-CD1 3.88Å; Y958-L1028 HydrophobicContact CE2-CD1 4.21Å; Y958-L1028 HydrophobicContact CE2-CD2 3.83Å; M986-L1028 HydrophobicContact CE-CD2 3.98Å; M986-L1028 HydrophobicContact SD-CD2 4.33Å; F1024-L1028 HydrophobicContact CD1-CD1 3.94Å; F1024-L1028 HydrophobicContact CD1-CG 4.24Å; F1024-L1028 HydrophobicContact CE1-CD1 3.69Å; F1024-L1028 HydrophobicContact CE1-CD2 4.24Å; F1024-L1028 HydrophobicContact CE1-CG 3.98Å; F1024-L1028 HydrophobicContact CZ-CD2 4.3Å; F1024-L1028 HydrophobicContact CZ-CG 4.42Å; F1024-L1028 PolarHBondContact O-N 3.48Å; F1024-L1028 VanDerWaalsContact O-N 3.16Å; A1025-L1028 PolarHBondContact O-N 3.02Å; A1025-L1028 VanDerWaalsContact O-N 3.17Å; L1028-R1030 PolarHBondContact O-N 2.95Å; L1028-R1031 PolarHBondContact O-N 2.9Å
1029	E	89.2	Confident	90.9	Very high	103 Å²	103	47 Å²	47	48%	0.481	24%	0.237	S	C	.	.	H	α-helix	trans	-61.5	-29.3	174.6	-72.5	171.5	-164.7	0	0	113	R724 A1025 I1027	R724-E1029 IonicContact NE-OE1 2.71Å; A1025-E1029 WeakPolarHBondContact O-CB 3.44Å; A1025-E1029 VanDerWaalsContact O-CG 3.3Å; A1025-E1029 WeakPolarHBondContact O-CG 3.32Å; A1025-E1029 PolarHBondContact O-N 3.26Å; I1027-E1029 PolarHBondContact O-N 2.82Å
1030	R	85.6	Confident	90.7	Very high	76 Å²	76	47.8 Å²	47.8	29%	0.287	24%	0.241	S	C	.	.	H	α-helix	trans	-88.4	-21.6	178.1	-78.5	-177.5	-82.4	-156.4	-7.1	113.9	S1026 I1027 L1028 K1032 E1041	S1026-R1030 VanDerWaalsContact O-CB 3.3Å; S1026-R1030 WeakPolarHBondContact O-CB 3.47Å; S1026-R1030 WeakPolarHBondContact O-CG 3.12Å; S1026-R1030 PolarHBondContact O-N 3.04Å; S1026-R1030 PolarHBondContact O-NE 3.31Å; S1026-R1030 PolarHBondContact OG-NH2 2.94Å; I1027-R1030 PolarHBondContact O-N 3.23Å; L1028-R1030 PolarHBondContact O-N 2.95Å; R1030-K1032 PolarHBondContact O-N 3.47Å; R1030-E1041 IonicContact CZ-OE2 3.66Å; R1030-E1041 VanDerWaalsContact NH1-CB 3.31Å; R1030-E1041 IonicContact NH1-OE2 2.65Å; R1030-E1041 PolarHBondContact NH1-OE2 3.13Å; R1030-E1041 IonicContact NH2-OE2 2.73Å
1031	R	90.2	Very high	90.4	Very high	42 Å²	42	50 Å²	50	16%	0.158	25%	0.251	C	S	.	.			trans	-64.3	116.4	-174.6	-170	-172.9	-170.3	-174.6	-4	111.5	D985 M986 I1027 L1028 G1033 Q1035 V1038	D985-R1031 PolarHBondContact O-NH2 2.84Å; M986-R1031 VanDerWaalsContact SD-CD 3.59Å; M986-R1031 HydrophobicContact SD-CG 4.49Å; I1027-R1031 PolarHBondContact O-N 3.15Å; L1028-R1031 PolarHBondContact O-N 2.9Å; R1031-G1033 WeakPolarHBondContact CG-O 3.4Å; R1031-G1033 PolarHBondContact NE-O 3.36Å; R1031-G1033 PolarHBondContact O-N 3.43Å; R1031-G1033 VanDerWaalsContact O-N 3.13Å; R1031-Q1035 HydrophobicContact CG-CB 4.13Å; R1031-Q1035 VanDerWaalsContact CZ-O 3.31Å; R1031-Q1035 PolarHBondContact NE-O 2.87Å; R1031-Q1035 PolarHBondContact NH2-O 2.98Å; R1031-V1038 HydrophobicContact CB-CG2 4.43Å; R1031-V1038 HydrophobicContact CG-CG2 3.96Å
1032	K	83.9	Confident	90.2	Very high	180 Å²	180	51 Å²	51	78%	0.783	26%	0.256	S	S	*	.			trans	-86	86.5	179	-67.4	-178.8	-177.4	174.7	0	111.2	R1030 Q1035	R1030-K1032 PolarHBondContact O-N 3.47Å; K1032-Q1035 PolarHBondContact O-N 3.13Å
1033	G	83	Confident	90.1	Very high	56 Å²	56	51.4 Å²	51.4	58%	0.577	26%	0.257	S	S	*	.	S	Bend	trans	64.8	-134.7	179.7	0	0	0	0	0	111.9	R1031 Q1035	R1031-G1033 WeakPolarHBondContact CG-O 3.4Å; R1031-G1033 PolarHBondContact NE-O 3.36Å; R1031-G1033 PolarHBondContact O-N 3.43Å; R1031-G1033 VanDerWaalsContact O-N 3.13Å; G1033-Q1035 PolarHBondContact O-N 2.88Å
1034	L	82.5	Confident	90.2	Very high	162 Å²	162	51.2 Å²	51.2	85%	0.848	26%	0.256	S	S	*	.	S	Bend	trans	-78.8	32	179.6	-59.6	178.2	0	0	0	113.7	R1036	L1034-R1036 PolarHBondContact O-N 3.43Å
1035	Q	84.9	Confident	90.2	Very high	61 Å²	61	52.6 Å²	52.6	29%	0.285	26%	0.263	S	S	.	.			trans	-57.2	118.9	172.1	177	178	-5.6	0	0	109.4	R1031 K1032 G1033 V1037 V1038	R1031-Q1035 HydrophobicContact CG-CB 4.13Å; R1031-Q1035 VanDerWaalsContact CZ-O 3.31Å; R1031-Q1035 PolarHBondContact NE-O 2.87Å; R1031-Q1035 PolarHBondContact NH2-O 2.98Å; K1032-Q1035 PolarHBondContact O-N 3.13Å; G1033-Q1035 PolarHBondContact O-N 2.88Å; Q1035-V1037 VanDerWaalsContact CG-O 3.26Å; Q1035-V1037 WeakPolarHBondContact CG-O 3.37Å; Q1035-V1037 PolarHBondContact NE2-O 3.42Å; Q1035-V1038 HydrophobicContact CG-CG2 4.07Å
1036	R	89.3	Confident	90.5	Very high	148 Å²	148	52.6 Å²	52.6	56%	0.558	26%	0.263	S	S	*	.	S	Bend	trans	-76.8	-50.6	179	-78.1	-169.9	172.3	-151.6	-4.9	112.4	E983 M986 E987 L1034	E983-R1036 IonicContact OE2-CZ 3.92Å; E983-R1036 IonicContact OE2-NH1 3.79Å; E983-R1036 PolarHBondContact OE2-NH1 3.11Å; E983-R1036 IonicContact OE2-NH2 2.75Å; E983-R1036 PolarHBondContact OE2-NH2 3.35Å; M986-R1036 CarbonylContact C-O 3.52Å; M986-R1036 VanDerWaalsContact CA-O 3.23Å; M986-R1036 WeakPolarHBondContact CA-O 3.35Å; E987-R1036 PolarHBondContact N-O 3.03Å; L1034-R1036 PolarHBondContact O-N 3.43Å
1037	V	92.3	Very high	90.7	Very high	66 Å²	66	56.4 Å²	56.4	40%	0.4	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	119.9	-179.8	-172.4	0	0	0	0	110.2	E987 K989 Q1035	E987-V1037 HydrophobicContact CB-CG2 4.34Å; E987-V1037 CarbonylContact O-C 3.57Å; E987-V1037 WeakPolarHBondContact O-CA 3.24Å; K989-V1037 HydrophobicContact CB-CG1 3.8Å; K989-V1037 HydrophobicContact CD-CG1 4.35Å; Q1035-V1037 VanDerWaalsContact CG-O 3.26Å; Q1035-V1037 WeakPolarHBondContact CG-O 3.37Å; Q1035-V1037 PolarHBondContact NE2-O 3.42Å
1038	V	94	Very high	90.9	Very high	1 Å²	1	56.8 Å²	56.8	1%	0.006	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	121.3	-178.5	-170.4	0	0	0	0	109.7	M986 E987 L988 K989 I1027 R1031 Q1035	M986-V1038 HydrophobicContact SD-CG2 4.15Å; E987-V1038 PolarHBondContact O-N 3.2Å; L988-V1038 CarbonylContact C-O 3.45Å; L988-V1038 WeakPolarHBondContact CA-O 3.32Å; K989-V1038 PolarHBondContact N-O 3.11Å; I1027-V1038 HydrophobicContact CG2-CB 4.27Å; I1027-V1038 HydrophobicContact CG2-CG1 3.79Å; R1031-V1038 HydrophobicContact CB-CG2 4.43Å; R1031-V1038 HydrophobicContact CG-CG2 3.96Å; Q1035-V1038 HydrophobicContact CG-CG2 4.07Å
1039	P	92.3	Very high	90.9	Very high	63 Å²	63	59 Å²	59	41%	0.409	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	137.5	179	29.4	-34.1	0	0	0	111.9	K989	K989-P1039 WeakPolarHBondContact O-CA 3.23Å
1040	I	93	Very high	91.1	Very high	18 Å²	18	59.7 Å²	59.7	9%	0.092	30%	0.295	C	S	.	.			trans	-79.5	149.6	172	-56.5	172.2	0	0	0	109.1	L967 L988 K989 L990 L1011 F1022 I1027 M1042	L967-I1040 HydrophobicContact CD1-CD1 3.74Å; L988-I1040 HydrophobicContact CB-CD1 3.72Å; L988-I1040 HydrophobicContact CB-CG1 3.87Å; K989-I1040 PolarHBondContact O-N 3.05Å; L990-I1040 HydrophobicContact CD2-CB 4.3Å; L990-I1040 HydrophobicContact CD2-CD1 3.7Å; L990-I1040 HydrophobicContact CD2-CG1 4.49Å; L990-I1040 HydrophobicContact CG-CD1 4.15Å; L1011-I1040 HydrophobicContact CD2-CD1 4.48Å; F1022-I1040 HydrophobicContact CB-CG2 3.57Å; F1022-I1040 HydrophobicContact CD1-CG2 4.46Å; F1022-I1040 HydrophobicContact CD2-CG2 4.01Å; F1022-I1040 HydrophobicContact CG-CG2 3.78Å; I1027-I1040 HydrophobicContact CD1-CG1 3.95Å; I1027-I1040 HydrophobicContact CD1-CG2 4.44Å; I1040-M1042 HydrophobicContact CB-CE 4.3Å; I1040-M1042 HydrophobicContact CG2-CE 3.71Å; I1040-M1042 HydrophobicContact CG2-SD 3.88Å
1041	E	90.7	Very high	91.4	Very high	47 Å²	47	56.6 Å²	56.6	22%	0.22	28%	0.284	C	S	.	.			trans	-123.6	124.2	163.7	-179	-176.4	-172.7	0	0	109.2	R1030 R1095	R1030-E1041 IonicContact CZ-OE2 3.66Å; R1030-E1041 VanDerWaalsContact NH1-CB 3.31Å; R1030-E1041 IonicContact NH1-OE2 2.65Å; R1030-E1041 PolarHBondContact NH1-OE2 3.13Å; R1030-E1041 IonicContact NH2-OE2 2.73Å; E1041-R1095 IonicContact OE1-CZ 2.99Å; E1041-R1095 IonicContact OE1-NE 3.65Å; E1041-R1095 IonicContact OE1-NH2 2.69Å; E1041-R1095 PolarHBondContact OE1-NH2 2.99Å
1042	M	93.6	Very high	91.3	Very high	22 Å²	22	60.1 Å²	60.1	11%	0.108	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	136.1	179.8	-58.8	-45.5	166.1	0	0	111.9	L990 L1011 M1020 F1022 I1040 H1045 R1095	L990-M1042 HydrophobicContact CD2-CE 3.12Å; L1011-M1042 HydrophobicContact CD2-CE 4.12Å; M1020-M1042 HydrophobicContact CB-CE 4.33Å; M1020-M1042 HydrophobicContact CB-CG 4.14Å; M1020-M1042 HydrophobicContact CB-SD 3.82Å; M1020-M1042 HydrophobicContact CG-CG 4.08Å; M1020-M1042 HydrophobicContact CG-SD 4.36Å; M1020-M1042 HydrophobicContact SD-CE 3.97Å; M1020-M1042 HydrophobicContact SD-CG 4.14Å; M1020-M1042 HydrophobicContact SD-SD 4.4Å; F1022-M1042 HydrophobicContact CB-SD 3.88Å; I1040-M1042 HydrophobicContact CB-CE 4.3Å; I1040-M1042 HydrophobicContact CG2-CE 3.71Å; I1040-M1042 HydrophobicContact CG2-SD 3.88Å; M1042-H1045 WeakPolarHBondContact CB-NE2 3.42Å; M1042-R1095 WeakPolarHBondContact O-CD 3.47Å; M1042-R1095 PolarHBondContact O-NE 2.93Å
1043	R	92.6	Very high	91.7	Very high	8 Å²	8	55.4 Å²	55.4	3%	0.03	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	-39.5	176.7	-56.3	-68.9	-59.8	88	13.3	110.4	V1021 D1023 L1088 S1092 K1094 R1095 F1096	V1021-R1043 WeakPolarHBondContact O-CA 3.08Å; V1021-R1043 WeakPolarHBondContact O-CB 3.37Å; V1021-R1043 PolarHBondContact O-N 3.5Å; D1023-R1043 HydrophobicContact CB-CG 3.79Å; R1043-L1088 HydrophobicContact CB-CD2 3.7Å; R1043-L1088 HydrophobicContact CG-CD2 4.04Å; R1043-S1092 VanDerWaalsContact CZ-O 3.29Å; R1043-S1092 PolarHBondContact NE-O 2.94Å; R1043-S1092 PolarHBondContact NH2-O 2.95Å; R1043-K1094 PolarHBondContact NH1-O 3.27Å; R1043-K1094 PolarHBondContact NH2-O 3.49Å; R1043-R1095 CarbonylContact O-C 3.49Å; R1043-R1095 VanDerWaalsContact O-CA 3.23Å; R1043-R1095 WeakPolarHBondContact O-CA 3.31Å; R1043-F1096 HydrophobicContact CB-CE1 4.26Å; R1043-F1096 WeakPolarHBondContact O-CD1 3.48Å; R1043-F1096 WeakPolarHBondContact O-CE1 3.36Å; R1043-F1096 PolarHBondContact O-N 2.95Å
1044	G	94.4	Very high	91.9	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	150	179.7	0	0	0	0	0	112.5	M1020 V1021 F1096	M1020-G1044 WeakPolarHBondContact CA-O 3.35Å; V1021-G1044 PolarHBondContact N-O 2.91Å; V1021-G1044 PolarHBondContact O-N 3.31Å; G1044-F1096 VanDerWaalsContact CA-CE2 3.43Å; G1044-F1096 WeakPolarHBondContact CA-O 3.36Å
1045	H	96.4	Very high	92.1	Very high	30 Å²	30	51.4 Å²	51.4	14%	0.139	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	123.3	172.9	-65.8	-106	0	0	0	108.5	E1018 M1042 F1096 H1097 V1098	E1018-H1045 IonicContact OE1-CE1 3.12Å; E1018-H1045 PolarHBondContact OE1-CE1 2.76Å; E1018-H1045 IonicContact OE1-ND1 2.7Å; E1018-H1045 PolarHBondContact OE1-ND1 2.95Å; E1018-H1045 IonicContact OE2-CE1 3.86Å; E1018-H1045 IonicContact OE2-CG 3.24Å; E1018-H1045 IonicContact OE2-ND1 3.42Å; E1018-H1045 PolarHBondContact OE2-ND1 3.23Å; M1042-H1045 WeakPolarHBondContact CB-NE2 3.42Å; H1045-F1096 PolarHBondContact N-O 3.04Å; H1045-H1097 CarbonylContact O-C 3.56Å; H1045-H1097 VanDerWaalsContact O-CA 3.24Å; H1045-H1097 WeakPolarHBondContact O-CA 2.99Å; H1045-V1098 PolarHBondContact O-N 2.82Å
1046	L	97.5	Very high	92.6	Very high	1 Å²	1	48.5 Å²	48.5	1%	0.005	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	120.8	-178.6	-78.8	54.9	0	0	0	107.5	E1018 I1019 V1021 W1048 V1067 Y1079 L1081 V1098	E1018-L1046 CarbonylContact C-O 3.5Å; E1018-L1046 VanDerWaalsContact CA-O 3.26Å; E1018-L1046 WeakPolarHBondContact CA-O 3.39Å; E1018-L1046 WeakPolarHBondContact CB-O 3.27Å; I1019-L1046 HydrophobicContact CB-CB 3.98Å; I1019-L1046 HydrophobicContact CB-CD2 4.38Å; I1019-L1046 HydrophobicContact CG2-CD2 4.12Å; I1019-L1046 PolarHBondContact N-O 2.88Å; I1019-L1046 WeakPolarHBondContact O-CB 3.4Å; I1019-L1046 PolarHBondContact O-N 2.94Å; V1021-L1046 HydrophobicContact CG2-CD1 3.79Å; L1046-W1048 PolarHBondContact O-N 3Å; L1046-V1067 HydrophobicContact CD2-CB 4.18Å; L1046-V1067 HydrophobicContact CD2-CG1 4.06Å; L1046-V1067 HydrophobicContact CD2-CG2 4.37Å; L1046-Y1079 HydrophobicContact CB-CD1 3.96Å; L1046-Y1079 HydrophobicContact CB-CE1 3.71Å; L1046-Y1079 HydrophobicContact CD2-CD1 3.92Å; L1046-Y1079 HydrophobicContact CD2-CD2 3.91Å; L1046-Y1079 HydrophobicContact CD2-CE1 4.31Å; L1046-Y1079 HydrophobicContact CD2-CE2 4.31Å; L1046-Y1079 HydrophobicContact CD2-CG 3.71Å; L1046-Y1079 HydrophobicContact CG-CD1 3.81Å; L1046-Y1079 HydrophobicContact CG-CE1 4.1Å; L1046-Y1079 HydrophobicContact CG-CG 4.12Å; L1046-L1081 HydrophobicContact CD1-CD1 4.44Å; L1046-L1081 HydrophobicContact CD1-CD2 4.16Å; L1046-L1081 HydrophobicContact CD2-CD1 4.32Å; L1046-L1081 HydrophobicContact CG-CD2 4.5Å; L1046-V1098 WeakPolarHBondContact CA-O 3.18Å; L1046-V1098 HydrophobicContact CD1-CB 4.17Å; L1046-V1098 HydrophobicContact CD1-CG2 4.05Å; L1046-V1098 HydrophobicContact CG-CB 4.1Å
1047	L	94.9	Very high	92.9	Very high	93 Å²	93	42.5 Å²	42.5	49%	0.487	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.6	124.5	178.1	175.3	64.8	0	0	0	110.1	W1077 Y1079 V1098 K1099	L1047-W1077 HydrophobicContact CG-CZ3 4.46Å; L1047-W1077 VanDerWaalsContact O-CZ3 3.28Å; L1047-W1077 WeakPolarHBondContact O-CZ3 3.39Å; L1047-Y1079 WeakPolarHBondContact O-CE1 3.36Å; L1047-Y1079 PolarHBondContact O-OH 3.13Å; L1047-V1098 PolarHBondContact N-O 2.83Å; L1047-K1099 HydrophobicContact CD2-CG 4.43Å
1048	W	96.1	Very high	93.1	Very high	8 Å²	8	39.5 Å²	39.5	3%	0.03	19%	0.194	C	C	.	.			trans	-139.2	174.7	-179	-178.2	61.1	0	0	0	110.5	K1012 G1017 I1019 L1046 T1051 I1056 G1070 D1071 W1077	K1012-W1048 HydrophobicContact CD-CD2 4.05Å; K1012-W1048 HydrophobicContact CD-CE3 3.59Å; K1012-W1048 HydrophobicContact CD-CH2 3.77Å; K1012-W1048 HydrophobicContact CD-CZ2 4.16Å; K1012-W1048 HydrophobicContact CD-CZ3 3.46Å; K1012-W1048 VanDerWaalsContact CD-CZ3 3.46Å; K1012-W1048 HydrophobicContact CG-CE3 4.12Å; K1012-W1048 HydrophobicContact CG-CZ3 4.06Å; G1017-W1048 PolarHBondContact O-N 3.1Å; I1019-W1048 HydrophobicContact CD1-CB 4.01Å; I1019-W1048 HydrophobicContact CD1-CD2 4.27Å; I1019-W1048 HydrophobicContact CD1-CG 3.79Å; I1019-W1048 HydrophobicContact CG1-CB 4.04Å; I1019-W1048 HydrophobicContact CG1-CD2 4.33Å; I1019-W1048 HydrophobicContact CG1-CG 4.09Å; L1046-W1048 PolarHBondContact O-N 3Å; W1048-T1051 HydrophobicContact CH2-CG2 3.45Å; W1048-T1051 VanDerWaalsContact CH2-CG2 3.45Å; W1048-T1051 HydrophobicContact CZ2-CG2 4.32Å; W1048-T1051 HydrophobicContact CZ3-CG2 4.05Å; W1048-I1056 HydrophobicContact CH2-CD1 4.26Å; W1048-I1056 HydrophobicContact CZ2-CD1 4.25Å; W1048-I1056 HydrophobicContact CZ2-CG2 3.99Å; W1048-G1070 WeakPolarHBondContact CZ2-O 3.26Å; W1048-G1070 PolarHBondContact NE1-O 2.97Å; W1048-D1071 HydrophobicContact CZ2-CB 4.14Å; W1048-W1077 AromaticContact CD1-CD1 3.84Å; W1048-W1077 AromaticContact CD1-CD2 3.77Å; W1048-W1077 AromaticContact CD1-CG 3.68Å; W1048-W1077 AromaticContact NE1-CD1 3.89Å
1049	Q	92.7	Very high	93.2	Very high	54 Å²	54	40 Å²	40	25%	0.252	20%	0.197	S	C	.	.			trans	-68.3	147.1	177.5	-174.4	59.3	-30.9	0	0	111.5	D1071 E1073 W1077	Q1049-D1071 HydrophobicContact CB-CB 4.01Å; Q1049-D1071 HydrophobicContact CG-CB 4.33Å; Q1049-E1073 PolarHBondContact NE2-OE1 2.82Å; Q1049-W1077 HydrophobicContact CB-CZ2 4.01Å
1050	K	92.8	Very high	93.4	Very high	118 Å²	118	38 Å²	38	51%	0.513	18%	0.184	S	C	.	.			trans	-95.5	117.7	172	178.9	-177.2	159.4	81.6	0	109.8	E1015	E1015-K1050 PolarHBondContact O-NZ 3.38Å; E1015-K1050 IonicContact OE2-NZ 2.67Å; E1015-K1050 PolarHBondContact OE2-NZ 2.89Å
1051	T	91.6	Very high	93.4	Very high	10 Å²	10	39 Å²	39	6%	0.061	19%	0.186	C	C	.	.			trans	-142.9	158.3	179	-170.9	0	0	0	0	112	E1015 W1048 E1053 I1056 N1072	E1015-T1051 VanDerWaalsContact CA-O 3.29Å; E1015-T1051 WeakPolarHBondContact CA-O 3.32Å; E1015-T1051 PolarHBondContact N-O 3.03Å; W1048-T1051 HydrophobicContact CH2-CG2 3.45Å; W1048-T1051 VanDerWaalsContact CH2-CG2 3.45Å; W1048-T1051 HydrophobicContact CZ2-CG2 4.32Å; W1048-T1051 HydrophobicContact CZ3-CG2 4.05Å; T1051-E1053 HydrophobicContact CG2-CB 4.28Å; T1051-E1053 PolarHBondContact OG1-N 3.25Å; T1051-I1056 HydrophobicContact CG2-CD1 3.98Å; T1051-N1072 WeakPolarHBondContact CB-OD1 3.33Å; T1051-N1072 PolarHBondContact OG1-OD1 3.37Å
1052	D	89.5	Confident	93.4	Very high	117 Å²	117	39 Å²	39	63%	0.626	19%	0.187	S	C	*	.			trans	-93.6	-2.8	168.7	54.9	-32.9	0	0	0	113.2	E1015 I1054	E1015-D1052 HydrophobicContact CG-CB 4.29Å; D1052-I1054 WeakPolarHBondContact O-CG2 3.45Å; D1052-I1054 PolarHBondContact O-N 3.46Å
1053	E	90.7	Very high	93.1	Very high	80 Å²	80	39.5 Å²	39.5	37%	0.374	19%	0.19	S	C	.	.			trans	-70.1	119.4	175.6	-75	-60.5	162.2	0	0	113.2	T1051 I1056 N1072 V1133	T1051-E1053 HydrophobicContact CG2-CB 4.28Å; T1051-E1053 PolarHBondContact OG1-N 3.25Å; E1053-I1056 HydrophobicContact CB-CD1 3.9Å; E1053-N1072 HydrophobicContact CB-CB 4.47Å; E1053-N1072 HydrophobicContact CG-CB 4.09Å; E1053-V1133 HydrophobicContact CG-CG2 4.48Å
1054	I	88.8	Confident	93	Very high	40 Å²	40	39.2 Å²	39.2	21%	0.205	19%	0.188	C	C	.	.			trans	-93	-4.8	-169	75	175.3	0	0	0	114.7	D999 V1014 D1052	D999-I1054 WeakPolarHBondContact CB-O 3.21Å; V1014-I1054 HydrophobicContact CG1-CG2 4.12Å; V1014-I1054 HydrophobicContact CG2-CB 4.17Å; V1014-I1054 HydrophobicContact CG2-CG2 3.68Å; D1052-I1054 WeakPolarHBondContact O-CG2 3.45Å; D1052-I1054 PolarHBondContact O-N 3.46Å
1055	Y	87.1	Confident	92.8	Very high	95 Å²	95	39.2 Å²	39.2	37%	0.373	19%	0.188	S	C	.	.			trans	-100.4	1.9	-170.2	-65.9	-65.2	0	0	0	115	W796 N1135	W796-Y1055 AromaticContact CZ3-CD1 3.97Å; W796-Y1055 HydrophobicContact CZ3-CD1 3.97Å; W796-Y1055 HydrophobicContact CZ3-CD2 4.33Å; W796-Y1055 AromaticContact CZ3-CG 3.81Å; W796-Y1055 HydrophobicContact CZ3-CG 3.81Å; Y1055-N1135 VanDerWaalsContact O-O 3.12Å
1056	I	94.7	Very high	92.6	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	18%	0.182	C	C	.	.			trans	-83.3	115.5	178.7	-60.6	154.1	0	0	0	110.4	K1012 W1048 T1051 E1053 G1070 N1072 V1133	K1012-I1056 PolarHBondContact NZ-O 2.69Å; W1048-I1056 HydrophobicContact CH2-CD1 4.26Å; W1048-I1056 HydrophobicContact CZ2-CD1 4.25Å; W1048-I1056 HydrophobicContact CZ2-CG2 3.99Å; T1051-I1056 HydrophobicContact CG2-CD1 3.98Å; E1053-I1056 HydrophobicContact CB-CD1 3.9Å; I1056-G1070 WeakPolarHBondContact CG2-O 3.42Å; I1056-N1072 HydrophobicContact CD1-CB 4.34Å; I1056-V1133 HydrophobicContact CD1-CG1 3.98Å; I1056-V1133 HydrophobicContact CG1-CG1 3.59Å
1057	N	94.7	Very high	92.6	Very high	21 Å²	21	37.7 Å²	37.7	11%	0.112	18%	0.182	C	C	.	.			trans	-91.4	161.6	178.7	-150.5	-4.2	0	0	0	113.7	N949 A1000 N1135	N949-N1057 PolarHBondContact OD1-ND2 3.03Å; N949-N1057 VanDerWaalsContact OD1-ND2 3.09Å; N949-N1057 PolarHBondContact OD1-OD1 2.98Å; A1000-N1057 WeakPolarHBondContact CB-OD1 3.49Å; N1057-N1135 PolarHBondContact N-O 2.76Å
1058	V	97.1	Very high	92.7	Very high	4 Å²	4	33.3 Å²	33.3	2%	0.024	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	125.7	171.8	178.1	0	0	0	0	108.8	A1000 V1010 K1012 I1019 V1067 L1068 C1069	A1000-V1058 HydrophobicContact CB-CB 3.7Å; A1000-V1058 HydrophobicContact CB-CG2 3.54Å; V1010-V1058 HydrophobicContact CG1-CG1 3.95Å; K1012-V1058 HydrophobicContact CB-CG2 3.99Å; K1012-V1058 HydrophobicContact CD-CG2 3.82Å; K1012-V1058 HydrophobicContact CG-CG2 4.48Å; I1019-V1058 HydrophobicContact CD1-CG2 3.89Å; I1019-V1058 HydrophobicContact CG1-CG2 4.11Å; I1019-V1058 HydrophobicContact CG2-CG1 4.29Å; I1019-V1058 HydrophobicContact CG2-CG2 4.36Å; V1058-V1067 HydrophobicContact CG1-CG1 3.54Å; V1058-L1068 WeakPolarHBondContact CA-O 3.09Å; V1058-C1069 HydrophobicContact CG2-CB 4.07Å
1059	S	96.6	Very high	92.8	Very high	12 Å²	12	32.9 Å²	32.9	8%	0.084	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	162.1	171.6	64.9	0	0	0	0	112.2	V1067 L1068 V1137 E1138	S1059-V1067 WeakPolarHBondContact O-CA 3.27Å; S1059-L1068 PolarHBondContact N-O 3.21Å; S1059-L1068 PolarHBondContact O-N 3.2Å; S1059-V1137 WeakPolarHBondContact CB-O 3.38Å; S1059-V1137 PolarHBondContact OG-O 3.42Å; S1059-E1138 WeakPolarHBondContact CB-OE2 3.17Å
1060	V	96.1	Very high	93	Very high	20 Å²	20	30.3 Å²	30.3	12%	0.121	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	113.9	-172.2	-176.3	0	0	0	0	110.7	A1002 Q1003 L1004 V1010 Q1062 A1066 V1067	A1002-V1060 HydrophobicContact CB-CB 4.24Å; A1002-V1060 HydrophobicContact CB-CG2 3.49Å; A1002-V1060 VanDerWaalsContact CB-CG2 3.49Å; Q1003-V1060 WeakPolarHBondContact O-CG1 3.41Å; L1004-V1060 HydrophobicContact CB-CG1 4.04Å; L1004-V1060 HydrophobicContact CD1-CG1 3.53Å; L1004-V1060 HydrophobicContact CG-CG1 4.4Å; V1010-V1060 HydrophobicContact CB-CG2 4.13Å; V1010-V1060 HydrophobicContact CG2-CG2 3.7Å; V1060-Q1062 HydrophobicContact CG1-CG 4.5Å; V1060-Q1062 PolarHBondContact O-N 2.78Å; V1060-A1066 CarbonylContact C-O 3.6Å; V1060-A1066 VanDerWaalsContact CA-O 3.3Å; V1060-A1066 WeakPolarHBondContact CA-O 3.17Å; V1060-A1066 WeakPolarHBondContact CG1-O 3.33Å; V1060-V1067 HydrophobicContact CG1-CG2 4.33Å; V1060-V1067 HydrophobicContact CG2-CG1 4.35Å; V1060-V1067 HydrophobicContact CG2-CG2 4.19Å
1061	R	93.8	Very high	93.1	Very high	38 Å²	38	24.9 Å²	24.9	14%	0.143	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	86.6	179.7	-145	72.2	-176.7	160.2	1.7	110.3	T810 N1063 L1064 G1065 A1066 E1138 M1139 S1140 S1141	T810-R1061 PolarHBondContact OG1-NH2 3.21Å; R1061-N1063 VanDerWaalsContact C-N 3.33Å; R1061-N1063 PolarHBondContact O-N 3.09Å; R1061-L1064 HydrophobicContact CG-CD1 4.3Å; R1061-L1064 PolarHBondContact O-N 3.24Å; R1061-G1065 PolarHBondContact O-N 3.14Å; R1061-A1066 HydrophobicContact CB-CB 3.99Å; R1061-A1066 PolarHBondContact N-O 3.09Å; R1061-A1066 PolarHBondContact O-N 3.23Å; R1061-E1138 IonicContact CZ-OE1 3.42Å; R1061-E1138 IonicContact NE-OE1 2.74Å; R1061-E1138 IonicContact NH1-OE1 3.26Å; R1061-E1138 PolarHBondContact NH1-OE1 2.92Å; R1061-M1139 HydrophobicContact CB-CE 3.59Å; R1061-M1139 VanDerWaalsContact CD-O 3.22Å; R1061-M1139 WeakPolarHBondContact CD-O 3.48Å; R1061-M1139 HydrophobicContact CG-CE 3.96Å; R1061-M1139 PolarHBondContact NE-O 3Å; R1061-M1139 PolarHBondContact NH1-O 2.67Å; R1061-S1140 PolarHBondContact NE-O 3.08Å; R1061-S1141 VanDerWaalsContact NH2-N 3.14Å
1062	Q	90.8	Very high	93.1	Very high	49 Å²	49	26.2 Å²	26.2	23%	0.229	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.4	-39.6	-167	-64.7	-177.9	6	0	0	114.6	M731 Q1003 V1060 L1064 G1065	M731-Q1062 HydrophobicContact CE-CB 3.68Å; Q1003-Q1062 WeakPolarHBondContact O-CG 3.2Å; Q1003-Q1062 PolarHBondContact O-NE2 2.67Å; V1060-Q1062 HydrophobicContact CG1-CG 4.5Å; V1060-Q1062 PolarHBondContact O-N 2.78Å; Q1062-L1064 VanDerWaalsContact C-N 3.32Å; Q1062-L1064 PolarHBondContact O-N 3.11Å; Q1062-G1065 PolarHBondContact O-N 3Å
1063	N	86.9	Confident	93.1	Very high	32 Å²	32	25 Å²	25	17%	0.171	12%	0.119	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-25.7	179.9	70.5	-49.5	0	0	0	113.2	H734 R1061 S1141	H734-N1063 PolarHBondContact CE1-O 3.06Å; H734-N1063 PolarHBondContact ND1-O 3.08Å; R1061-N1063 VanDerWaalsContact C-N 3.33Å; R1061-N1063 PolarHBondContact O-N 3.09Å; N1063-S1141 PolarHBondContact ND2-O 2.86Å
1064	L	88.9	Confident	93.1	Very high	1 Å²	1	21.2 Å²	21.2	1%	0.005	10%	0.101	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.5	-10.2	175.6	-58.2	-179.6	0	0	0	113.3	R735 L737 L740 R1061 Q1062 A1066 M1139	R735-L1064 HydrophobicContact CB-CD2 4.12Å; R735-L1064 WeakPolarHBondContact O-CA 3.2Å; R735-L1064 VanDerWaalsContact O-CD2 3.3Å; R735-L1064 WeakPolarHBondContact O-CD2 3.33Å; L737-L1064 HydrophobicContact CD2-CD1 4.31Å; L737-L1064 HydrophobicContact CG-CB 4.3Å; L737-L1064 PolarHBondContact N-O 3.28Å; L740-L1064 HydrophobicContact CD1-CD1 4.27Å; L740-L1064 HydrophobicContact CD1-CD2 4.46Å; R1061-L1064 HydrophobicContact CG-CD1 4.3Å; R1061-L1064 PolarHBondContact O-N 3.24Å; Q1062-L1064 VanDerWaalsContact C-N 3.32Å; Q1062-L1064 PolarHBondContact O-N 3.11Å; L1064-A1066 HydrophobicContact CB-CB 4.33Å; L1064-A1066 PolarHBondContact O-N 2.91Å; L1064-M1139 HydrophobicContact CD1-CE 3.76Å; L1064-M1139 HydrophobicContact CD1-SD 4.4Å
1065	G	90.7	Very high	93.3	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	10%	0.098	C	C	.	.	T	Hydrogen-bonded Turn	trans	69.9	15.4	-171.8	0	0	0	0	0	113.9	R1061 Q1062 L1081	R1061-G1065 PolarHBondContact O-N 3.14Å; Q1062-G1065 PolarHBondContact O-N 3Å; G1065-L1081 WeakPolarHBondContact O-CA 3.43Å; G1065-L1081 WeakPolarHBondContact O-CB 3.26Å; G1065-L1081 PolarHBondContact O-N 2.89Å
1066	A	93.6	Very high	93.7	Very high	0 Å²	0	15.8 Å²	15.8	0%	0	8%	0.08	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85	145	-171.5	0	0	0	0	0	112.9	L737 V1060 R1061 L1064 Y1079 M1139	L737-A1066 HydrophobicContact CD1-CB 3.53Å; L737-A1066 HydrophobicContact CG-CB 3.97Å; V1060-A1066 CarbonylContact C-O 3.6Å; V1060-A1066 VanDerWaalsContact CA-O 3.3Å; V1060-A1066 WeakPolarHBondContact CA-O 3.17Å; V1060-A1066 WeakPolarHBondContact CG1-O 3.33Å; R1061-A1066 HydrophobicContact CB-CB 3.99Å; R1061-A1066 PolarHBondContact N-O 3.09Å; R1061-A1066 PolarHBondContact O-N 3.23Å; L1064-A1066 HydrophobicContact CB-CB 4.33Å; L1064-A1066 PolarHBondContact O-N 2.91Å; A1066-Y1079 CarbonylContact C-O 3.59Å; A1066-Y1079 WeakPolarHBondContact CA-O 3.24Å; A1066-M1139 HydrophobicContact CB-CE 3.43Å; A1066-M1139 VanDerWaalsContact CB-CE 3.43Å
1067	V	97.1	Very high	93.8	Very high	0 Å²	0	17 Å²	17	0%	0	9%	0.085	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	140.3	164.7	-177.3	0	0	0	0	108.4	L1004 V1010 L1046 V1058 S1059 V1060 Y1079 L1081	L1004-V1067 HydrophobicContact CD1-CG2 4.38Å; V1010-V1067 HydrophobicContact CG1-CG1 4.22Å; V1010-V1067 HydrophobicContact CG2-CG2 4.12Å; L1046-V1067 HydrophobicContact CD2-CB 4.18Å; L1046-V1067 HydrophobicContact CD2-CG1 4.06Å; L1046-V1067 HydrophobicContact CD2-CG2 4.37Å; V1058-V1067 HydrophobicContact CG1-CG1 3.54Å; S1059-V1067 WeakPolarHBondContact O-CA 3.27Å; V1060-V1067 HydrophobicContact CG1-CG2 4.33Å; V1060-V1067 HydrophobicContact CG2-CG1 4.35Å; V1060-V1067 HydrophobicContact CG2-CG2 4.19Å; V1067-Y1079 HydrophobicContact CB-CD2 4.19Å; V1067-Y1079 HydrophobicContact CG1-CD2 4.32Å; V1067-Y1079 PolarHBondContact N-O 3.32Å; V1067-Y1079 WeakPolarHBondContact O-CD2 3.42Å; V1067-Y1079 PolarHBondContact O-N 2.9Å; V1067-L1081 HydrophobicContact CG2-CD1 3.46Å; V1067-L1081 VanDerWaalsContact CG2-CD1 3.46Å; V1067-L1081 HydrophobicContact CG2-CG 3.94Å
1068	L	97.3	Very high	93.9	Very high	0 Å²	0	16 Å²	16	0%	0	8%	0.08	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	141.2	-178.2	-52.6	168.1	0	0	0	109.8	V1058 S1059 W1077 I1078 V1137 M1139 L1146	V1058-L1068 WeakPolarHBondContact CA-O 3.09Å; S1059-L1068 PolarHBondContact N-O 3.21Å; S1059-L1068 PolarHBondContact O-N 3.2Å; L1068-W1077 WeakPolarHBondContact CA-O 3.48Å; L1068-I1078 HydrophobicContact CD2-CB 4.15Å; L1068-I1078 HydrophobicContact CD2-CD1 4.49Å; L1068-I1078 HydrophobicContact CD2-CG1 3.84Å; L1068-I1078 HydrophobicContact CD2-CG2 3.86Å; L1068-V1137 HydrophobicContact CB-CB 4.36Å; L1068-V1137 HydrophobicContact CB-CG1 4.13Å; L1068-V1137 HydrophobicContact CD1-CG1 4.23Å; L1068-M1139 HydrophobicContact CD1-CB 3.51Å; L1068-M1139 HydrophobicContact CD1-CE 4.26Å; L1068-L1146 HydrophobicContact CD1-CD1 4.44Å; L1068-L1146 HydrophobicContact CD2-CD1 4.13Å
1069	C	97.5	Very high	93.8	Very high	0 Å²	0	15.8 Å²	15.8	0%	0	8%	0.079	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	140.3	171.6	-167.1	0	0	0	0	110.2	I1019 V1058 W1077	I1019-C1069 HydrophobicContact CD1-CB 3.49Å; I1019-C1069 VanDerWaalsContact CD1-CB 3.49Å; V1058-C1069 HydrophobicContact CG2-CB 4.07Å; C1069-W1077 PolarHBondContact N-O 2.8Å; C1069-W1077 VanDerWaalsContact N-O 3.12Å; C1069-W1077 PolarHBondContact O-N 2.84Å
1070	G	96.1	Very high	93.6	Very high	0 Å²	0	15.4 Å²	15.4	0%	0	8%	0.075	C	C	.	.			trans	-77.7	-173.7	165.9	0	0	0	0	0	112.1	W1048 I1056 S1075	W1048-G1070 WeakPolarHBondContact CZ2-O 3.26Å; W1048-G1070 PolarHBondContact NE1-O 2.97Å; I1056-G1070 WeakPolarHBondContact CG2-O 3.42Å; G1070-S1075 CarbonylContact C-O 3.55Å; G1070-S1075 WeakPolarHBondContact CA-O 3.48Å
1071	D	94.9	Very high	93.4	Very high	3 Å²	3	14.4 Å²	14.4	2%	0.016	7%	0.07	C	C	.	.			trans	-146.4	-172.8	161.8	64.7	32.7	0	0	0	112	W1048 Q1049 E1073 G1074 S1075 W1077 V1134	W1048-D1071 HydrophobicContact CZ2-CB 4.14Å; Q1049-D1071 HydrophobicContact CB-CB 4.01Å; Q1049-D1071 HydrophobicContact CG-CB 4.33Å; D1071-E1073 VanDerWaalsContact C-N 3.33Å; D1071-E1073 WeakPolarHBondContact OD1-CA 3.46Å; D1071-E1073 PolarHBondContact OD1-N 2.9Å; D1071-G1074 PolarHBondContact OD1-N 3.16Å; D1071-S1075 PolarHBondContact N-O 2.93Å; D1071-S1075 VanDerWaalsContact N-O 3.08Å; D1071-S1075 PolarHBondContact OD1-N 2.93Å; D1071-S1075 WeakPolarHBondContact OD2-CB 3.44Å; D1071-W1077 PolarHBondContact OD2-NE1 3.44Å; D1071-V1134 PolarHBondContact O-N 2.81Å
1072	N	92.6	Very high	93.2	Very high	38 Å²	38	13.2 Å²	13.2	20%	0.203	7%	0.066	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.1	14.3	179.2	66.8	-85.7	0	0	0	114	T1051 E1053 I1056 P1132 V1133	T1051-N1072 WeakPolarHBondContact CB-OD1 3.33Å; T1051-N1072 PolarHBondContact OG1-OD1 3.37Å; E1053-N1072 HydrophobicContact CB-CB 4.47Å; E1053-N1072 HydrophobicContact CG-CB 4.09Å; I1056-N1072 HydrophobicContact CD1-CB 4.34Å; N1072-P1132 CarbonylContact C-O 3.39Å; N1072-V1133 HydrophobicContact CB-CG1 4.5Å; N1072-V1133 HydrophobicContact CB-CG2 4.1Å
1073	E	89.7	Confident	93.1	Very high	92 Å²	92	13.3 Å²	13.3	43%	0.43	7%	0.071	S	C	.	.	T	Hydrogen-bonded Turn	trans	-119.7	7.8	174.7	-70.2	171.6	-145.7	0	0	111.1	Q1049 D1071	Q1049-E1073 PolarHBondContact NE2-OE1 2.82Å; D1071-E1073 VanDerWaalsContact C-N 3.33Å; D1071-E1073 WeakPolarHBondContact OD1-CA 3.46Å; D1071-E1073 PolarHBondContact OD1-N 2.9Å
1074	G	89.9	Confident	93.3	Very high	1 Å²	1	15.1 Å²	15.1	1%	0.01	8%	0.076	C	C	.	.	S	Bend	trans	88.7	-4.4	-178.6	0	0	0	0	0	115	D1071 W1106 P1132	D1071-G1074 PolarHBondContact OD1-N 3.16Å; G1074-W1106 VanDerWaalsContact O-CE3 3.31Å; G1074-P1132 PolarHBondContact N-O 3.01Å; G1074-P1132 VanDerWaalsContact N-O 3.07Å
1075	S	93.5	Very high	93.2	Very high	20 Å²	20	15.1 Å²	15.1	14%	0.14	8%	0.076	C	C	.	.			trans	-87.5	148.8	-169.6	-58.9	0	0	0	0	113.1	G1070 D1071 L1104	G1070-S1075 CarbonylContact C-O 3.55Å; G1070-S1075 WeakPolarHBondContact CA-O 3.48Å; D1071-S1075 PolarHBondContact N-O 2.93Å; D1071-S1075 VanDerWaalsContact N-O 3.08Å; D1071-S1075 PolarHBondContact OD1-N 2.93Å; D1071-S1075 WeakPolarHBondContact OD2-CB 3.44Å; S1075-L1104 CarbonylContact C-O 3.44Å; S1075-L1104 VanDerWaalsContact CA-O 3.26Å; S1075-L1104 WeakPolarHBondContact CA-O 3.37Å; S1075-L1104 WeakPolarHBondContact CB-O 3.15Å
1076	I	95.7	Very high	92.9	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	119	-178.6	-61.3	177.6	0	0	0	110.6	I1078 I1103 L1104 V1134 V1137 L1146 A1148 W1158	I1076-I1078 HydrophobicContact CG2-CG1 4.45Å; I1076-I1103 CarbonylContact O-C 3.57Å; I1076-I1103 WeakPolarHBondContact O-CA 3.21Å; I1076-L1104 HydrophobicContact CB-CB 4.2Å; I1076-L1104 HydrophobicContact CB-CD1 4.4Å; I1076-L1104 PolarHBondContact N-O 3.49Å; I1076-L1104 PolarHBondContact O-N 2.91Å; I1076-V1134 HydrophobicContact CG1-CG1 4.36Å; I1076-V1137 HydrophobicContact CD1-CG1 4.4Å; I1076-V1137 HydrophobicContact CD1-CG2 4.16Å; I1076-V1137 HydrophobicContact CG1-CG2 4.16Å; I1076-V1137 HydrophobicContact CG2-CG1 3.94Å; I1076-V1137 HydrophobicContact CG2-CG2 4.19Å; I1076-L1146 HydrophobicContact CD1-CD2 3.91Å; I1076-L1146 HydrophobicContact CG2-CD1 4.29Å; I1076-L1146 HydrophobicContact CG2-CD2 4.4Å; I1076-A1148 HydrophobicContact CD1-CB 3.59Å; I1076-W1158 HydrophobicContact CD1-CE3 4.33Å; I1076-W1158 HydrophobicContact CD1-CH2 3.33Å; I1076-W1158 HydrophobicContact CD1-CZ2 3.82Å; I1076-W1158 HydrophobicContact CD1-CZ3 3.62Å
1077	W	96.8	Very high	92.5	Very high	26 Å²	26	22.3 Å²	22.3	10%	0.098	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	118.6	-174.4	-62.9	64.9	0	0	0	110.4	L1047 W1048 Q1049 L1068 C1069 D1071 Y1079 P1100 I1103	L1047-W1077 HydrophobicContact CG-CZ3 4.46Å; L1047-W1077 VanDerWaalsContact O-CZ3 3.28Å; L1047-W1077 WeakPolarHBondContact O-CZ3 3.39Å; W1048-W1077 AromaticContact CD1-CD1 3.84Å; W1048-W1077 AromaticContact CD1-CD2 3.77Å; W1048-W1077 AromaticContact CD1-CG 3.68Å; W1048-W1077 AromaticContact NE1-CD1 3.89Å; Q1049-W1077 HydrophobicContact CB-CZ2 4.01Å; L1068-W1077 WeakPolarHBondContact CA-O 3.48Å; C1069-W1077 PolarHBondContact N-O 2.8Å; C1069-W1077 VanDerWaalsContact N-O 3.12Å; C1069-W1077 PolarHBondContact O-N 2.84Å; D1071-W1077 PolarHBondContact OD2-NE1 3.44Å; W1077-Y1079 HydrophobicContact CB-CE2 3.77Å; W1077-P1100 HydrophobicContact CE3-CB 4.05Å; W1077-P1100 HydrophobicContact CE3-CG 3.6Å; W1077-P1100 HydrophobicContact CZ3-CG 3.84Å; W1077-I1103 HydrophobicContact CD2-CD1 4.04Å; W1077-I1103 HydrophobicContact CD2-CG1 4.09Å; W1077-I1103 HydrophobicContact CE3-CD1 3.89Å; W1077-I1103 HydrophobicContact CE3-CG1 4.1Å; W1077-I1103 HydrophobicContact CG-CG1 4.5Å; W1077-I1103 HydrophobicContact CH2-CD1 3.82Å; W1077-I1103 HydrophobicContact CZ2-CD1 3.97Å; W1077-I1103 HydrophobicContact CZ3-CD1 3.79Å; W1077-I1103 HydrophobicContact CZ3-CG1 4.48Å
1078	I	95.5	Very high	92	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	131	-177.8	-52.1	-176.6	0	0	0	109.6	L737 Y773 L1068 I1076 P1100 I1101 K1102 L1104 L1146	L737-I1078 HydrophobicContact CD1-CG2 4.12Å; Y773-I1078 HydrophobicContact CD2-CD1 3.84Å; Y773-I1078 HydrophobicContact CE2-CD1 3.75Å; L1068-I1078 HydrophobicContact CD2-CB 4.15Å; L1068-I1078 HydrophobicContact CD2-CD1 4.49Å; L1068-I1078 HydrophobicContact CD2-CG1 3.84Å; L1068-I1078 HydrophobicContact CD2-CG2 3.86Å; I1076-I1078 HydrophobicContact CG2-CG1 4.45Å; I1078-P1100 CarbonylContact O-C 3.59Å; I1078-P1100 WeakPolarHBondContact O-CA 3.23Å; I1078-P1100 WeakPolarHBondContact O-CB 3.1Å; I1078-I1101 HydrophobicContact CB-CG1 4.29Å; I1078-I1101 HydrophobicContact CG2-CD1 4Å; I1078-I1101 HydrophobicContact CG2-CG1 3.97Å; I1078-I1101 VanDerWaalsContact O-CG1 3.29Å; I1078-I1101 WeakPolarHBondContact O-CG1 3.5Å; I1078-I1101 PolarHBondContact O-N 3.27Å; I1078-K1102 HydrophobicContact CB-CB 4.47Å; I1078-K1102 HydrophobicContact CD1-CB 4.49Å; I1078-K1102 PolarHBondContact N-O 3.5Å; I1078-L1104 HydrophobicContact CD1-CD1 4.17Å; I1078-L1104 HydrophobicContact CD1-CG 4.21Å; I1078-L1146 HydrophobicContact CD1-CD1 4Å
1079	Y	95.1	Very high	91.3	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	133.2	177	-45.2	-100.9	0	0	0	111.3	I1019 L1046 L1047 A1066 V1067 W1077 V1098 P1100	I1019-Y1079 HydrophobicContact CD1-CE2 4.18Å; L1046-Y1079 HydrophobicContact CB-CD1 3.96Å; L1046-Y1079 HydrophobicContact CB-CE1 3.71Å; L1046-Y1079 HydrophobicContact CD2-CD1 3.92Å; L1046-Y1079 HydrophobicContact CD2-CD2 3.91Å; L1046-Y1079 HydrophobicContact CD2-CE1 4.31Å; L1046-Y1079 HydrophobicContact CD2-CE2 4.31Å; L1046-Y1079 HydrophobicContact CD2-CG 3.71Å; L1046-Y1079 HydrophobicContact CG-CD1 3.81Å; L1046-Y1079 HydrophobicContact CG-CE1 4.1Å; L1046-Y1079 HydrophobicContact CG-CG 4.12Å; L1047-Y1079 WeakPolarHBondContact O-CE1 3.36Å; L1047-Y1079 PolarHBondContact O-OH 3.13Å; A1066-Y1079 CarbonylContact C-O 3.59Å; A1066-Y1079 WeakPolarHBondContact CA-O 3.24Å; V1067-Y1079 HydrophobicContact CB-CD2 4.19Å; V1067-Y1079 HydrophobicContact CG1-CD2 4.32Å; V1067-Y1079 PolarHBondContact N-O 3.32Å; V1067-Y1079 WeakPolarHBondContact O-CD2 3.42Å; V1067-Y1079 PolarHBondContact O-N 2.9Å; W1077-Y1079 HydrophobicContact CB-CE2 3.77Å; Y1079-V1098 HydrophobicContact CD1-CG1 4.43Å; Y1079-P1100 HydrophobicContact CD1-CB 4.27Å; Y1079-P1100 HydrophobicContact CE1-CB 4Å
1080	D	92.1	Very high	90.6	Very high	3 Å²	3	25 Å²	25	2%	0.016	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	117.1	166.8	162.8	40	0	0	0	110.2	L737 R738 D1082 P1083 I1101	L737-D1080 HydrophobicContact CD1-CB 4.4Å; R738-D1080 IonicContact CZ-OD2 2.98Å; R738-D1080 IonicContact NE-OD2 2.76Å; R738-D1080 PolarHBondContact NE-OD2 2.98Å; R738-D1080 IonicContact NH2-OD2 2.67Å; R738-D1080 PolarHBondContact NH2-OD2 3.41Å; D1080-D1082 WeakPolarHBondContact OD1-CB 3.28Å; D1080-D1082 PolarHBondContact OD1-N 3.4Å; D1080-P1083 WeakPolarHBondContact OD1-CD 3.15Å; D1080-P1083 WeakPolarHBondContact OD2-CD 3.37Å; D1080-I1101 HydrophobicContact CB-CD1 3.98Å; D1080-I1101 HydrophobicContact CB-CG2 4.19Å
1081	L	93.3	Very high	89.8	Confident	0 Å²	0	29.3 Å²	29.3	0%	0	16%	0.162	C	C	.	.			trans	-107.3	0	175	-61	-170.6	0	0	0	114.7	L1004 V1021 L1046 G1065 V1067 P1083 Y1084 L1085 F1096 V1098	L1004-L1081 HydrophobicContact CD1-CB 4.38Å; L1004-L1081 HydrophobicContact CD1-CD1 4.26Å; L1004-L1081 HydrophobicContact CD2-CB 4.39Å; L1004-L1081 HydrophobicContact CD2-CD1 3.61Å; V1021-L1081 HydrophobicContact CG2-CD1 3.94Å; L1046-L1081 HydrophobicContact CD1-CD1 4.44Å; L1046-L1081 HydrophobicContact CD1-CD2 4.16Å; L1046-L1081 HydrophobicContact CD2-CD1 4.32Å; L1046-L1081 HydrophobicContact CG-CD2 4.5Å; G1065-L1081 WeakPolarHBondContact O-CA 3.43Å; G1065-L1081 WeakPolarHBondContact O-CB 3.26Å; G1065-L1081 PolarHBondContact O-N 2.89Å; V1067-L1081 HydrophobicContact CG2-CD1 3.46Å; V1067-L1081 VanDerWaalsContact CG2-CD1 3.46Å; V1067-L1081 HydrophobicContact CG2-CG 3.94Å; L1081-P1083 VanDerWaalsContact C-CD 3.42Å; L1081-P1083 VanDerWaalsContact C-N 3.32Å; L1081-Y1084 HydrophobicContact CD2-CD2 4.01Å; L1081-Y1084 HydrophobicContact CD2-CE2 4.33Å; L1081-Y1084 PolarHBondContact O-N 3.18Å; L1081-L1085 PolarHBondContact O-N 2.97Å; L1081-F1096 HydrophobicContact CD2-CE2 4.31Å; L1081-V1098 HydrophobicContact CD2-CB 4.37Å; L1081-V1098 HydrophobicContact CD2-CG1 4.14Å; L1081-V1098 HydrophobicContact CD2-CG2 3.79Å
1082	D	89.3	Confident	89.1	Confident	12 Å²	12	30.4 Å²	30.4	6%	0.064	17%	0.17	C	C	.	.	H	α-helix	trans	-50.3	-44.6	177.9	174.9	78.7	0	0	0	113.2	R728 R765 D1080 Y1084 L1085	R728-D1082 IonicContact CZ-OD1 3.16Å; R728-D1082 IonicContact NH1-OD1 2.76Å; R728-D1082 PolarHBondContact NH1-OD1 2.91Å; R728-D1082 IonicContact NH2-OD1 2.69Å; R728-D1082 PolarHBondContact NH2-OD1 2.68Å; R765-D1082 IonicContact NH2-OD2 3.36Å; R765-D1082 PolarHBondContact NH2-OD2 3.05Å; D1080-D1082 WeakPolarHBondContact OD1-CB 3.28Å; D1080-D1082 PolarHBondContact OD1-N 3.4Å; D1082-Y1084 PolarHBondContact O-N 3.41Å; D1082-L1085 PolarHBondContact O-N 2.83Å; D1082-L1085 VanDerWaalsContact O-N 3.11Å
1083	P	89.1	Confident	88.5	Confident	51 Å²	51	36.8 Å²	36.8	33%	0.331	19%	0.191	S	C	.	.	H	α-helix	trans	-58.4	-20.6	178.4	-26.4	35.8	0	0	0	115.2	D1080 L1081	D1080-P1083 WeakPolarHBondContact OD1-CD 3.15Å; D1080-P1083 WeakPolarHBondContact OD2-CD 3.37Å; L1081-P1083 VanDerWaalsContact C-CD 3.42Å; L1081-P1083 VanDerWaalsContact C-N 3.32Å
1084	Y	90.4	Very high	88.3	Confident	70 Å²	70	38.7 Å²	38.7	28%	0.275	20%	0.198	S	C	.	.	H	α-helix	trans	-101.9	-12.1	-178	-50.7	-83.7	0	0	0	113.2	L1081 D1082 D1086 D1087 L1088 F1096 V1098	L1081-Y1084 HydrophobicContact CD2-CD2 4.01Å; L1081-Y1084 HydrophobicContact CD2-CE2 4.33Å; L1081-Y1084 PolarHBondContact O-N 3.18Å; D1082-Y1084 PolarHBondContact O-N 3.41Å; Y1084-D1086 VanDerWaalsContact C-N 3.31Å; Y1084-D1086 PolarHBondContact O-N 3.34Å; Y1084-D1087 PolarHBondContact O-N 2.68Å; Y1084-D1087 VanDerWaalsContact O-N 3.14Å; Y1084-L1088 WeakPolarHBondContact O-CG 3.3Å; Y1084-L1088 PolarHBondContact O-N 3.07Å; Y1084-F1096 HydrophobicContact CD1-CB 3.71Å; Y1084-F1096 HydrophobicContact CD1-CD1 4Å; Y1084-F1096 AromaticContact CD1-CD2 3.72Å; Y1084-F1096 HydrophobicContact CD1-CD2 3.72Å; Y1084-F1096 HydrophobicContact CD1-CE2 4.3Å; Y1084-F1096 AromaticContact CD1-CG 3.55Å; Y1084-F1096 HydrophobicContact CD1-CG 3.55Å; Y1084-F1096 HydrophobicContact CD2-CD2 4.32Å; Y1084-F1096 HydrophobicContact CD2-CE2 4.36Å; Y1084-F1096 HydrophobicContact CE1-CB 3.69Å; Y1084-F1096 HydrophobicContact CE1-CD2 4.01Å; Y1084-F1096 AromaticContact CE1-CG 3.96Å; Y1084-F1096 HydrophobicContact CE1-CG 3.96Å; Y1084-F1096 HydrophobicContact CG-CD1 4.4Å; Y1084-F1096 AromaticContact CG-CD2 3.88Å; Y1084-F1096 HydrophobicContact CG-CD2 3.88Å; Y1084-F1096 HydrophobicContact CG-CE2 4.02Å; Y1084-F1096 HydrophobicContact CG-CG 4.09Å; Y1084-F1096 HydrophobicContact CG-CZ 4.34Å; Y1084-V1098 HydrophobicContact CD2-CG2 4.46Å; Y1084-V1098 HydrophobicContact CE2-CG1 4.43Å; Y1084-V1098 HydrophobicContact CE2-CG2 3.86Å
1085	L	86.8	Confident	88.4	Confident	2 Å²	2	45.4 Å²	45.4	1%	0.01	22%	0.223	C	C	.	.	H	α-helix	trans	-60.7	-36.4	-176.6	-69.4	-179.6	0	0	0	112.8	L1004 L1081 D1082 L1088 H1089	L1004-L1085 HydrophobicContact CD1-CD2 4.03Å; L1004-L1085 HydrophobicContact CD2-CD2 3.94Å; L1004-L1085 HydrophobicContact CG-CD2 3.69Å; L1081-L1085 PolarHBondContact O-N 2.97Å; D1082-L1085 PolarHBondContact O-N 2.83Å; D1082-L1085 VanDerWaalsContact O-N 3.11Å; L1085-L1088 HydrophobicContact CD2-CD1 4.29Å; L1085-L1088 CarbonylContact O-C 3.58Å; L1085-L1088 PolarHBondContact O-N 3.07Å; L1085-H1089 WeakPolarHBondContact O-CB 3.5Å; L1085-H1089 PolarHBondContact O-CD2 2.75Å; L1085-H1089 PolarHBondContact O-N 3.43Å
1086	D	85	Confident	88.4	Confident	111 Å²	111	45.2 Å²	45.2	59%	0.594	22%	0.22	S	C	*	.	H	α-helix	trans	-69.6	-38	175.3	-81.5	-27.2	0	0	0	112.8	Y1084 L1088 H1089 S1090	Y1084-D1086 VanDerWaalsContact C-N 3.31Å; Y1084-D1086 PolarHBondContact O-N 3.34Å; D1086-L1088 VanDerWaalsContact C-N 3.25Å; D1086-L1088 PolarHBondContact O-N 2.88Å; D1086-H1089 PolarHBondContact O-N 2.97Å; D1086-S1090 WeakPolarHBondContact O-CB 3.15Å; D1086-S1090 PolarHBondContact O-N 3.39Å; D1086-S1090 PolarHBondContact O-OG 3.1Å
1087	D	85.4	Confident	88.4	Confident	40 Å²	40	52 Å²	52	21%	0.214	25%	0.251	C	S	.	.	H	α-helix	trans	-68.6	-26.1	173.7	-113	-46.5	0	0	0	111.5	Y1084 S1090 S1092 K1094	Y1084-D1087 PolarHBondContact O-N 2.68Å; Y1084-D1087 VanDerWaalsContact O-N 3.14Å; D1087-S1090 PolarHBondContact O-OG 2.95Å; D1087-S1090 VanDerWaalsContact O-OG 3.06Å; D1087-S1092 WeakPolarHBondContact OD1-CB 3.27Å; D1087-S1092 PolarHBondContact OD1-OG 2.67Å; D1087-K1094 WeakPolarHBondContact OD1-CE 3.38Å; D1087-K1094 IonicContact OD1-NZ 2.97Å; D1087-K1094 PolarHBondContact OD1-NZ 2.96Å; D1087-K1094 IonicContact OD2-NZ 2.64Å; D1087-K1094 PolarHBondContact OD2-NZ 3.31Å
1088	L	85.8	Confident	88.2	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-78.2	-36.1	170.8	-72.3	164.7	0	0	0	113	R724 L1004 N1007 A1008 V1021 R1043 Y1084 L1085 D1086 F1096	R724-L1088 PolarHBondContact NH1-O 3.24Å; R724-L1088 PolarHBondContact NH2-O 3.04Å; L1004-L1088 HydrophobicContact CD2-CD1 3.9Å; N1007-L1088 PolarHBondContact ND2-O 2.65Å; A1008-L1088 HydrophobicContact CB-CB 4.37Å; A1008-L1088 HydrophobicContact CB-CD1 4.05Å; A1008-L1088 HydrophobicContact CB-CD2 4.36Å; V1021-L1088 HydrophobicContact CG1-CD1 4.16Å; V1021-L1088 HydrophobicContact CG1-CD2 4.22Å; R1043-L1088 HydrophobicContact CB-CD2 3.7Å; R1043-L1088 HydrophobicContact CG-CD2 4.04Å; Y1084-L1088 WeakPolarHBondContact O-CG 3.3Å; Y1084-L1088 PolarHBondContact O-N 3.07Å; L1085-L1088 HydrophobicContact CD2-CD1 4.29Å; L1085-L1088 CarbonylContact O-C 3.58Å; L1085-L1088 PolarHBondContact O-N 3.07Å; D1086-L1088 VanDerWaalsContact C-N 3.25Å; D1086-L1088 PolarHBondContact O-N 2.88Å; L1088-F1096 HydrophobicContact CD1-CE1 4.3Å; L1088-F1096 HydrophobicContact CD1-CZ 4.08Å; L1088-F1096 HydrophobicContact CD2-CE1 4.01Å; L1088-F1096 HydrophobicContact CD2-CZ 4.35Å; L1088-F1096 HydrophobicContact CG-CE1 4.1Å; L1088-F1096 HydrophobicContact CG-CZ 4.38Å
1089	H	83.2	Confident	88	Confident	10 Å²	10	59 Å²	59	5%	0.046	28%	0.283	C	S	.	.	H	α-helix	trans	-79.8	-15.2	175.3	-77.7	-57.6	0	0	0	113.7	R724 S1005 N1007 L1085 D1086	R724-H1089 PolarHBondContact NH1-O 3.35Å; S1005-H1089 VanDerWaalsContact CB-CE1 3.48Å; S1005-H1089 WeakPolarHBondContact CB-CE1 3.43Å; S1005-H1089 WeakPolarHBondContact CB-NE2 3.45Å; S1005-H1089 PolarHBondContact OG-CE1 3.29Å; S1005-H1089 PolarHBondContact OG-NE2 3.03Å; N1007-H1089 PolarHBondContact OD1-CE1 3.4Å; N1007-H1089 VanDerWaalsContact OD1-CE1 3.29Å; N1007-H1089 PolarHBondContact OD1-ND1 3.14Å; L1085-H1089 WeakPolarHBondContact O-CB 3.5Å; L1085-H1089 PolarHBondContact O-CD2 2.75Å; L1085-H1089 PolarHBondContact O-N 3.43Å; D1086-H1089 PolarHBondContact O-N 2.97Å
1090	S	82.8	Confident	87.9	Confident	47 Å²	47	60.3 Å²	60.3	33%	0.329	29%	0.292	S	S	.	.	S	Bend	trans	-84	160.7	164	80.7	0	0	0	0	112.3	R724 D1086 D1087 S1092	R724-S1090 VanDerWaalsContact CZ-O 3.26Å; R724-S1090 PolarHBondContact NH1-O 3.26Å; R724-S1090 VanDerWaalsContact NH1-O 3.11Å; R724-S1090 PolarHBondContact NH2-O 3.39Å; D1086-S1090 WeakPolarHBondContact O-CB 3.15Å; D1086-S1090 PolarHBondContact O-N 3.39Å; D1086-S1090 PolarHBondContact O-OG 3.1Å; D1087-S1090 PolarHBondContact O-OG 2.95Å; D1087-S1090 VanDerWaalsContact O-OG 3.06Å; S1090-S1092 PolarHBondContact O-N 3.13Å; S1090-S1092 WeakPolarHBondContact OG-CB 3.45Å; S1090-S1092 PolarHBondContact OG-N 2.87Å
1091	S	79.5	Confident	87.9	Confident	90 Å²	90	63.4 Å²	63.4	63%	0.629	31%	0.308	S	S	*	.	S	Bend	trans	-74	22.5	169	-55.2	0	0	0	0	113.7
1092	S	79.9	Confident	87.8	Confident	26 Å²	26	66 Å²	66	18%	0.182	32%	0.319	C	S	.	.			trans	-63.5	146.6	175.1	177.2	0	0	0	0	111.2	R1043 D1087 S1090 K1094	R1043-S1092 VanDerWaalsContact CZ-O 3.29Å; R1043-S1092 PolarHBondContact NE-O 2.94Å; R1043-S1092 PolarHBondContact NH2-O 2.95Å; D1087-S1092 WeakPolarHBondContact OD1-CB 3.27Å; D1087-S1092 PolarHBondContact OD1-OG 2.67Å; S1090-S1092 PolarHBondContact O-N 3.13Å; S1090-S1092 WeakPolarHBondContact OG-CB 3.45Å; S1090-S1092 PolarHBondContact OG-N 2.87Å; S1092-K1094 WeakPolarHBondContact OG-CG 3.34Å; S1092-K1094 PolarHBondContact OG-N 3.4Å
1093	R	79.9	Confident	88	Confident	171 Å²	171	68.3 Å²	68.3	65%	0.645	33%	0.331	S	S	*	.			trans	-114.5	13.5	172.1	-60	-170.4	-173.6	179.5	1.7	112.8	R1095	R1093-R1095 PolarHBondContact O-N 2.65Å; R1093-R1095 VanDerWaalsContact O-N 3.17Å
1094	K	86.2	Confident	88.1	Confident	132 Å²	132	66.3 Å²	66.3	57%	0.574	32%	0.317	S	S	*	.			trans	-58.2	118.6	171.2	-65.7	-178.5	-149.1	145.7	0	108.8	R1043 D1087 S1092	R1043-K1094 PolarHBondContact NH1-O 3.27Å; R1043-K1094 PolarHBondContact NH2-O 3.49Å; D1087-K1094 WeakPolarHBondContact OD1-CE 3.38Å; D1087-K1094 IonicContact OD1-NZ 2.97Å; D1087-K1094 PolarHBondContact OD1-NZ 2.96Å; D1087-K1094 IonicContact OD2-NZ 2.64Å; D1087-K1094 PolarHBondContact OD2-NZ 3.31Å; S1092-K1094 WeakPolarHBondContact OG-CG 3.34Å; S1092-K1094 PolarHBondContact OG-N 3.4Å
1095	R	91.6	Very high	88	Confident	142 Å²	142	70.7 Å²	70.7	54%	0.536	34%	0.34	S	S	.	.			trans	-81.1	148.9	169.6	-60.2	-171	-169.1	176.3	2.7	109.8	E1041 M1042 R1043 R1093	E1041-R1095 IonicContact OE1-CZ 2.99Å; E1041-R1095 IonicContact OE1-NE 3.65Å; E1041-R1095 IonicContact OE1-NH2 2.69Å; E1041-R1095 PolarHBondContact OE1-NH2 2.99Å; M1042-R1095 WeakPolarHBondContact O-CD 3.47Å; M1042-R1095 PolarHBondContact O-NE 2.93Å; R1043-R1095 CarbonylContact O-C 3.49Å; R1043-R1095 VanDerWaalsContact O-CA 3.23Å; R1043-R1095 WeakPolarHBondContact O-CA 3.31Å; R1093-R1095 PolarHBondContact O-N 2.65Å; R1093-R1095 VanDerWaalsContact O-N 3.17Å
1096	F	93.6	Very high	87.8	Confident	17 Å²	17	72.7 Å²	72.7	8%	0.075	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	153	178.1	58.6	-91.5	0	0	0	110.9	V1021 R1043 G1044 H1045 L1081 Y1084 L1088 V1098	V1021-F1096 HydrophobicContact CB-CZ 4.25Å; V1021-F1096 HydrophobicContact CG1-CZ 4.36Å; V1021-F1096 HydrophobicContact CG2-CZ 4.49Å; R1043-F1096 HydrophobicContact CB-CE1 4.26Å; R1043-F1096 WeakPolarHBondContact O-CD1 3.48Å; R1043-F1096 WeakPolarHBondContact O-CE1 3.36Å; R1043-F1096 PolarHBondContact O-N 2.95Å; G1044-F1096 VanDerWaalsContact CA-CE2 3.43Å; G1044-F1096 WeakPolarHBondContact CA-O 3.36Å; H1045-F1096 PolarHBondContact N-O 3.04Å; L1081-F1096 HydrophobicContact CD2-CE2 4.31Å; Y1084-F1096 HydrophobicContact CD1-CB 3.71Å; Y1084-F1096 HydrophobicContact CD1-CD1 4Å; Y1084-F1096 AromaticContact CD1-CD2 3.72Å; Y1084-F1096 HydrophobicContact CD1-CD2 3.72Å; Y1084-F1096 HydrophobicContact CD1-CE2 4.3Å; Y1084-F1096 AromaticContact CD1-CG 3.55Å; Y1084-F1096 HydrophobicContact CD1-CG 3.55Å; Y1084-F1096 HydrophobicContact CD2-CD2 4.32Å; Y1084-F1096 HydrophobicContact CD2-CE2 4.36Å; Y1084-F1096 HydrophobicContact CE1-CB 3.69Å; Y1084-F1096 HydrophobicContact CE1-CD2 4.01Å; Y1084-F1096 AromaticContact CE1-CG 3.96Å; Y1084-F1096 HydrophobicContact CE1-CG 3.96Å; Y1084-F1096 HydrophobicContact CG-CD1 4.4Å; Y1084-F1096 AromaticContact CG-CD2 3.88Å; Y1084-F1096 HydrophobicContact CG-CD2 3.88Å; Y1084-F1096 HydrophobicContact CG-CE2 4.02Å; Y1084-F1096 HydrophobicContact CG-CG 4.09Å; Y1084-F1096 HydrophobicContact CG-CZ 4.34Å; L1088-F1096 HydrophobicContact CD1-CE1 4.3Å; L1088-F1096 HydrophobicContact CD1-CZ 4.08Å; L1088-F1096 HydrophobicContact CD2-CE1 4.01Å; L1088-F1096 HydrophobicContact CD2-CZ 4.35Å; L1088-F1096 HydrophobicContact CG-CE1 4.1Å; L1088-F1096 HydrophobicContact CG-CZ 4.38Å; F1096-V1098 HydrophobicContact CD2-CG2 3.56Å; F1096-V1098 HydrophobicContact CE2-CG2 3.95Å
1097	H	94.2	Very high	87.5	Confident	142 Å²	142	68.7 Å²	68.7	66%	0.657	33%	0.328	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-124.9	138.4	173.2	-60.3	77.5	0	0	0	107.9	H1045	H1045-H1097 CarbonylContact O-C 3.56Å; H1045-H1097 VanDerWaalsContact O-CA 3.24Å; H1045-H1097 WeakPolarHBondContact O-CA 2.99Å
1098	V	93.2	Very high	86.8	Confident	12 Å²	12	75.3 Å²	75.3	7%	0.073	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	132.8	-172.4	-164.2	0	0	0	0	108.8	H1045 L1046 L1047 Y1079 L1081 Y1084 F1096	H1045-V1098 PolarHBondContact O-N 2.82Å; L1046-V1098 WeakPolarHBondContact CA-O 3.18Å; L1046-V1098 HydrophobicContact CD1-CB 4.17Å; L1046-V1098 HydrophobicContact CD1-CG2 4.05Å; L1046-V1098 HydrophobicContact CG-CB 4.1Å; L1047-V1098 PolarHBondContact N-O 2.83Å; Y1079-V1098 HydrophobicContact CD1-CG1 4.43Å; L1081-V1098 HydrophobicContact CD2-CB 4.37Å; L1081-V1098 HydrophobicContact CD2-CG1 4.14Å; L1081-V1098 HydrophobicContact CD2-CG2 3.79Å; Y1084-V1098 HydrophobicContact CD2-CG2 4.46Å; Y1084-V1098 HydrophobicContact CE2-CG1 4.43Å; Y1084-V1098 HydrophobicContact CE2-CG2 3.86Å; F1096-V1098 HydrophobicContact CD2-CG2 3.56Å; F1096-V1098 HydrophobicContact CE2-CG2 3.95Å
1099	K	92.2	Very high	86	Confident	160 Å²	160	75.9 Å²	75.9	70%	0.696	36%	0.361	S	S	*	.			trans	-90.8	153.7	165.2	-71	-172.3	174.7	-171.1	0	108.7	L1047 I1101	L1047-K1099 HydrophobicContact CD2-CG 4.43Å; K1099-I1101 PolarHBondContact O-N 3.13Å
1100	P	92.5	Very high	85.1	Confident	29 Å²	29	77.4 Å²	77.4	19%	0.188	37%	0.373	C	S	.	.			trans	-53.4	141	167.2	27.2	-37.1	0	0	0	110	W1077 I1078 Y1079 K1102 I1103	W1077-P1100 HydrophobicContact CE3-CB 4.05Å; W1077-P1100 HydrophobicContact CE3-CG 3.6Å; W1077-P1100 HydrophobicContact CZ3-CG 3.84Å; I1078-P1100 CarbonylContact O-C 3.59Å; I1078-P1100 WeakPolarHBondContact O-CA 3.23Å; I1078-P1100 WeakPolarHBondContact O-CB 3.1Å; Y1079-P1100 HydrophobicContact CD1-CB 4.27Å; Y1079-P1100 HydrophobicContact CE1-CB 4Å; P1100-K1102 VanDerWaalsContact C-N 3.34Å; P1100-I1103 HydrophobicContact CB-CG1 3.91Å; P1100-I1103 HydrophobicContact CG-CD1 3.9Å; P1100-I1103 HydrophobicContact CG-CG1 3.66Å
1101	I	91.2	Very high	84.3	Confident	68 Å²	68	77.3 Å²	77.3	35%	0.349	37%	0.37	S	S	.	.	S	Bend	trans	-78	-26.9	171.9	57	167.2	0	0	0	111.3	L737 I771 I1078 D1080 K1099	L737-I1101 HydrophobicContact CD1-CD1 4Å; I771-I1101 HydrophobicContact CD1-CD1 3.6Å; I1078-I1101 HydrophobicContact CB-CG1 4.29Å; I1078-I1101 HydrophobicContact CG2-CD1 4Å; I1078-I1101 HydrophobicContact CG2-CG1 3.97Å; I1078-I1101 VanDerWaalsContact O-CG1 3.29Å; I1078-I1101 WeakPolarHBondContact O-CG1 3.5Å; I1078-I1101 PolarHBondContact O-N 3.27Å; D1080-I1101 HydrophobicContact CB-CD1 3.98Å; D1080-I1101 HydrophobicContact CB-CG2 4.19Å; K1099-I1101 PolarHBondContact O-N 3.13Å
1102	K	91.6	Very high	83	Confident	55 Å²	55	79.5 Å²	79.5	24%	0.239	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.2	139.6	173.2	179.7	69	179.9	-169.2	0	107.6	I771 D772 I1078 P1100 L1104	I771-K1102 WeakPolarHBondContact O-CG 3.37Å; D772-K1102 WeakPolarHBondContact OD1-CE 3.23Å; D772-K1102 IonicContact OD1-NZ 2.73Å; D772-K1102 PolarHBondContact OD1-NZ 3.27Å; D772-K1102 IonicContact OD2-NZ 3.76Å; D772-K1102 PolarHBondContact OD2-NZ 3.18Å; I1078-K1102 HydrophobicContact CB-CB 4.47Å; I1078-K1102 HydrophobicContact CD1-CB 4.49Å; I1078-K1102 PolarHBondContact N-O 3.5Å; P1100-K1102 VanDerWaalsContact C-N 3.34Å; K1102-L1104 HydrophobicContact CD-CD2 4.26Å; K1102-L1104 VanDerWaalsContact CE-CD2 3.49Å; K1102-L1104 HydrophobicContact CG-CD2 3.65Å; K1102-L1104 HydrophobicContact CG-CG 4.42Å
1103	I	93.3	Very high	81.6	Confident	60 Å²	60	80 Å²	80	31%	0.308	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	128.3	157.4	-55.7	174.9	0	0	0	104.7	I1076 W1077 P1100	I1076-I1103 CarbonylContact O-C 3.57Å; I1076-I1103 WeakPolarHBondContact O-CA 3.21Å; W1077-I1103 HydrophobicContact CD2-CD1 4.04Å; W1077-I1103 HydrophobicContact CD2-CG1 4.09Å; W1077-I1103 HydrophobicContact CE3-CD1 3.89Å; W1077-I1103 HydrophobicContact CE3-CG1 4.1Å; W1077-I1103 HydrophobicContact CG-CG1 4.5Å; W1077-I1103 HydrophobicContact CH2-CD1 3.82Å; W1077-I1103 HydrophobicContact CZ2-CD1 3.97Å; W1077-I1103 HydrophobicContact CZ3-CD1 3.79Å; W1077-I1103 HydrophobicContact CZ3-CG1 4.48Å; P1100-I1103 HydrophobicContact CB-CG1 3.91Å; P1100-I1103 HydrophobicContact CG-CD1 3.9Å; P1100-I1103 HydrophobicContact CG-CG1 3.66Å
1104	L	92.3	Very high	80	Confident	9 Å²	9	79 Å²	79	5%	0.047	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	111.3	166.6	-51.9	178.4	0	0	0	106.3	Y773 S1075 I1076 I1078 K1102 L1146 W1158	Y773-L1104 HydrophobicContact CD2-CD1 4.46Å; Y773-L1104 HydrophobicContact CD2-CD2 4.41Å; Y773-L1104 HydrophobicContact CG-CD1 4.34Å; S1075-L1104 CarbonylContact C-O 3.44Å; S1075-L1104 VanDerWaalsContact CA-O 3.26Å; S1075-L1104 WeakPolarHBondContact CA-O 3.37Å; S1075-L1104 WeakPolarHBondContact CB-O 3.15Å; I1076-L1104 HydrophobicContact CB-CB 4.2Å; I1076-L1104 HydrophobicContact CB-CD1 4.4Å; I1076-L1104 PolarHBondContact N-O 3.49Å; I1076-L1104 PolarHBondContact O-N 2.91Å; I1078-L1104 HydrophobicContact CD1-CD1 4.17Å; I1078-L1104 HydrophobicContact CD1-CG 4.21Å; K1102-L1104 HydrophobicContact CD-CD2 4.26Å; K1102-L1104 VanDerWaalsContact CE-CD2 3.49Å; K1102-L1104 HydrophobicContact CG-CD2 3.65Å; K1102-L1104 HydrophobicContact CG-CG 4.42Å; L1104-L1146 HydrophobicContact CD1-CD1 4.39Å; L1104-W1158 HydrophobicContact CD1-CD2 4.47Å; L1104-W1158 HydrophobicContact CD1-CG 4.26Å
1105	E	87.2	Confident	78.4	Confident	162 Å²	162	80.6 Å²	80.6	76%	0.757	39%	0.39	S	S	*	.	P	Polyproline II helix	trans	-70.5	151.3	171	-65.5	175.6	-176.5	0	0	109.1
1106	W	83.8	Confident	76.5	Confident	44 Å²	44	80.5 Å²	80.5	17%	0.167	40%	0.4	C	S	.	.	P	Polyproline II helix	trans	-70.2	128.2	-179.6	-174.2	-100.9	0	0	0	111	F778 G1074 F1129 P1132 T1150 L1154 C1156	F778-W1106 HydrophobicContact CD1-CH2 4.11Å; F778-W1106 HydrophobicContact CD1-CZ2 4.17Å; F778-W1106 HydrophobicContact CE1-CD2 4.47Å; F778-W1106 HydrophobicContact CE1-CE3 4.26Å; F778-W1106 AromaticContact CE1-CH2 3.52Å; F778-W1106 HydrophobicContact CE1-CH2 3.52Å; F778-W1106 AromaticContact CE1-CZ2 3.69Å; F778-W1106 HydrophobicContact CE1-CZ2 3.69Å; F778-W1106 AromaticContact CE1-CZ3 3.81Å; F778-W1106 HydrophobicContact CE1-CZ3 3.81Å; F778-W1106 HydrophobicContact CZ-CH2 4.48Å; F778-W1106 HydrophobicContact CZ-CZ3 4.37Å; G1074-W1106 VanDerWaalsContact O-CE3 3.31Å; W1106-F1129 PolarHBondContact NE1-O 3.35Å; W1106-P1132 HydrophobicContact CD2-CG 3.83Å; W1106-P1132 VanDerWaalsContact CE2-CG 3.44Å; W1106-P1132 HydrophobicContact CE3-CG 4.04Å; W1106-P1132 HydrophobicContact CH2-CB 4.37Å; W1106-P1132 HydrophobicContact CH2-CG 3.48Å; W1106-P1132 VanDerWaalsContact CH2-CG 3.48Å; W1106-P1132 HydrophobicContact CZ2-CB 4.49Å; W1106-P1132 HydrophobicContact CZ2-CG 3.27Å; W1106-P1132 HydrophobicContact CZ3-CG 3.87Å; W1106-T1150 HydrophobicContact CH2-CG2 3.94Å; W1106-T1150 HydrophobicContact CZ3-CG2 4.21Å; W1106-L1154 HydrophobicContact CH2-CD1 3.74Å; W1106-L1154 HydrophobicContact CZ2-CD1 3.52Å; W1106-C1156 WeakPolarHBondContact CH2-SG 3.08Å
1107	P	78.9	Confident	74.4	Confident	26 Å²	26	88.4 Å²	88.4	17%	0.169	44%	0.437	C	S	.	.	P	Polyproline II helix	trans	-74	157.6	-175	29.7	-34.8	0	0	0	112.9	L33 P775 F778 C1109	L33-P1107 HydrophobicContact CD2-CB 3.79Å; L33-P1107 HydrophobicContact CD2-CG 3.58Å; P775-P1107 HydrophobicContact CB-CG 4.29Å; P775-P1107 HydrophobicContact CG-CB 4.34Å; F778-P1107 HydrophobicContact CE1-CG 3.77Å; F778-P1107 HydrophobicContact CE2-CG 4.13Å; F778-P1107 HydrophobicContact CZ-CG 3.41Å; F778-P1107 VanDerWaalsContact CZ-CG 3.41Å; P1107-C1109 VanDerWaalsContact C-N 3.33Å; P1107-C1109 PolarHBondContact O-N 3.43Å
1108	E	70	Confident	72.8	Confident	180 Å²	180	84.3 Å²	84.3	84%	0.841	42%	0.42	S	S	*	.			trans	-73	85.4	171.8	-66.6	-162.6	158	0	0	111
1109	C	68.3	Low	71.5	Confident	11 Å²	11	87.7 Å²	87.7	7%	0.074	44%	0.435	C	S	.	.	B	Isolated β-bridge	trans	-74.8	137.3	171.3	-65.4	0	0	0	0	111	I31 F778 P1107 F1129	I31-C1109 HydrophobicContact CG2-CB 4.49Å; F778-C1109 WeakPolarHBondContact CD1-SG 3.47Å; P1107-C1109 VanDerWaalsContact C-N 3.33Å; P1107-C1109 PolarHBondContact O-N 3.43Å; C1109-F1129 HydrophobicContact CB-CB 3.97Å; C1109-F1129 HydrophobicContact CB-CD1 4.19Å; C1109-F1129 HydrophobicContact CB-CD2 3.31Å; C1109-F1129 HydrophobicContact CB-CE2 3.75Å; C1109-F1129 HydrophobicContact CB-CG 3.58Å; C1109-F1129 HydrophobicContact CB-CZ 4.35Å; C1109-F1129 WeakPolarHBondContact O-CD2 3.29Å
1110	S	66	Low	70.1	Confident	42 Å²	42	88 Å²	88	29%	0.294	44%	0.439	S	S	.	.			trans	-147.5	149.2	171.6	57.5	0	0	0	0	110.5
1111	V	64.2	Low	68.8	Low	45 Å²	45	90 Å²	90	27%	0.273	45%	0.448	S	S	.	.			trans	-90.5	107.9	173.4	-176.4	0	0	0	0	109.1	K1122 I1125 F1129	V1111-K1122 HydrophobicContact CB-CG 4.34Å; V1111-K1122 HydrophobicContact CG1-CG 4.28Å; V1111-I1125 HydrophobicContact CG2-CB 3.83Å; V1111-I1125 HydrophobicContact CG2-CD1 4.36Å; V1111-I1125 HydrophobicContact CG2-CG2 3.42Å; V1111-I1125 VanDerWaalsContact CG2-CG2 3.42Å; V1111-F1129 HydrophobicContact CG2-CE2 4.03Å; V1111-F1129 HydrophobicContact CG2-CZ 4.09Å
1112	Q	53.2	Low	67.6	Low	137 Å²	137	88 Å²	88	64%	0.64	44%	0.436	S	S	*	.			trans	-83.7	129.4	173.7	-63.8	-172	-1.8	0	0	110.5
1113	G	50.8	Low	66.5	Low	37 Å²	37	90.9 Å²	90.9	38%	0.381	45%	0.451	S	S	.	.			trans	-171.1	130.8	177.2	0	0	0	0	0	111.3	R1115 K1122	G1113-R1115 VanDerWaalsContact C-N 3.27Å; G1113-R1115 PolarHBondContact O-N 2.87Å; G1113-K1122 WeakPolarHBondContact O-CE 3.31Å; G1113-K1122 PolarHBondContact O-NZ 3.47Å
1114	N	46.6	Very low	65.3	Low	148 Å²	148	90.7 Å²	90.7	79%	0.791	46%	0.455	S	S	*	.	S	Bend	trans	-85.3	13.8	-171	-66.6	9.3	0	0	0	114.2
1115	R	51	Low	64.1	Low	166 Å²	166	90.6 Å²	90.6	63%	0.626	45%	0.454	S	S	*	.			trans	-93.7	119.1	173.3	-70	-179.2	175.8	-176	-4.5	109.2	G1113 E1117 D1118 K1122	G1113-R1115 VanDerWaalsContact C-N 3.27Å; G1113-R1115 PolarHBondContact O-N 2.87Å; R1115-E1117 VanDerWaalsContact C-N 3.28Å; R1115-D1118 HydrophobicContact CB-CB 4.34Å; R1115-D1118 WeakPolarHBondContact CB-OD2 3.48Å; R1115-D1118 WeakPolarHBondContact CD-OD2 3.35Å; R1115-D1118 PolarHBondContact O-N 3.18Å; R1115-K1122 WeakPolarHBondContact O-CE 3.42Å; R1115-K1122 PolarHBondContact O-NZ 2.85Å
1116	D	52.9	Low	63.2	Low	140 Å²	140	84.5 Å²	84.5	75%	0.749	43%	0.428	S	S	*	.	G	3₁₀ helix	trans	-71	-28.9	178.1	-63.8	-43.5	0	0	0	111.8	D1118 Q1119	D1116-D1118 PolarHBondContact O-N 2.9Å; D1116-Q1119 VanDerWaalsContact O-CB 3.29Å; D1116-Q1119 WeakPolarHBondContact O-CB 3.36Å; D1116-Q1119 PolarHBondContact O-N 2.97Å
1117	E	50.1	Low	62.4	Low	183 Å²	183	85.8 Å²	85.8	86%	0.855	44%	0.444	S	S	*	.	G	3₁₀ helix	trans	-55.4	-32.3	173.7	-60.5	175.8	173.1	0	0	113	R1115 Q1119	R1115-E1117 VanDerWaalsContact C-N 3.28Å; E1117-Q1119 VanDerWaalsContact C-N 3.31Å; E1117-Q1119 PolarHBondContact O-N 2.82Å
1118	D	60	Low	61.7	Low	57 Å²	57	85 Å²	85	31%	0.305	44%	0.44	S	S	.	.	G	3₁₀ helix	trans	-83.4	6	-179.9	-74.4	-52.9	0	0	0	113.7	R1115 D1116 Q1120 L1121 K1122	R1115-D1118 HydrophobicContact CB-CB 4.34Å; R1115-D1118 WeakPolarHBondContact CB-OD2 3.48Å; R1115-D1118 WeakPolarHBondContact CD-OD2 3.35Å; R1115-D1118 PolarHBondContact O-N 3.18Å; D1116-D1118 PolarHBondContact O-N 2.9Å; D1118-Q1120 PolarHBondContact O-N 3.41Å; D1118-L1121 WeakPolarHBondContact O-CB 3.31Å; D1118-L1121 PolarHBondContact O-N 3.46Å; D1118-K1122 PolarHBondContact O-N 3Å
1119	Q	64.6	Low	61.6	Low	82 Å²	82	76.7 Å²	76.7	38%	0.383	40%	0.402	S	S	.	.	H	α-helix	trans	-60.6	-40.3	-169.7	-173.1	59.5	19.6	0	0	113.6	D1116 E1117 L1121 K1122 E1123	D1116-Q1119 VanDerWaalsContact O-CB 3.29Å; D1116-Q1119 WeakPolarHBondContact O-CB 3.36Å; D1116-Q1119 PolarHBondContact O-N 2.97Å; E1117-Q1119 VanDerWaalsContact C-N 3.31Å; E1117-Q1119 PolarHBondContact O-N 2.82Å; Q1119-L1121 VanDerWaalsContact C-N 3.33Å; Q1119-L1121 PolarHBondContact O-N 3.28Å; Q1119-K1122 PolarHBondContact O-N 2.77Å; Q1119-E1123 PolarHBondContact NE2-OE1 3.17Å; Q1119-E1123 WeakPolarHBondContact O-CB 3.49Å; Q1119-E1123 WeakPolarHBondContact O-CG 3.36Å; Q1119-E1123 PolarHBondContact O-N 2.8Å
1120	Q	63.3	Low	61.7	Low	168 Å²	168	85.3 Å²	85.3	79%	0.785	43%	0.433	S	S	*	.	H	α-helix	trans	-65.8	-34.4	174.3	-66.3	-174.3	11.5	0	0	112.6	D1118 S1124	D1118-Q1120 PolarHBondContact O-N 3.41Å; Q1120-S1124 VanDerWaalsContact O-CB 3.31Å; Q1120-S1124 WeakPolarHBondContact O-CB 3.32Å; Q1120-S1124 PolarHBondContact O-N 2.93Å
1121	L	64.6	Low	62.1	Low	71 Å²	71	88.9 Å²	88.9	37%	0.372	45%	0.448	S	S	.	.	H	α-helix	trans	-71.7	-43.6	177.4	-179.3	59.3	0	0	0	111.1	D1118 Q1119 E1123 S1124 I1125	D1118-L1121 WeakPolarHBondContact O-CB 3.31Å; D1118-L1121 PolarHBondContact O-N 3.46Å; Q1119-L1121 VanDerWaalsContact C-N 3.33Å; Q1119-L1121 PolarHBondContact O-N 3.28Å; L1121-E1123 VanDerWaalsContact C-N 3.34Å; L1121-E1123 PolarHBondContact O-N 2.69Å; L1121-S1124 PolarHBondContact O-N 2.8Å; L1121-I1125 HydrophobicContact CD1-CD1 3.86Å; L1121-I1125 HydrophobicContact CD1-CG1 4.17Å; L1121-I1125 HydrophobicContact CG-CD1 3.87Å; L1121-I1125 VanDerWaalsContact O-CG1 3.27Å; L1121-I1125 WeakPolarHBondContact O-CG1 3.3Å; L1121-I1125 PolarHBondContact O-N 2.84Å
1122	K	67.3	Low	63.3	Low	25 Å²	25	86.8 Å²	86.8	11%	0.109	44%	0.436	C	S	.	.	H	α-helix	trans	-57	-46.3	171.5	-74.2	177.4	-107.8	165.2	0	111.4	V1111 G1113 R1115 D1118 Q1119 T1126	V1111-K1122 HydrophobicContact CB-CG 4.34Å; V1111-K1122 HydrophobicContact CG1-CG 4.28Å; G1113-K1122 WeakPolarHBondContact O-CE 3.31Å; G1113-K1122 PolarHBondContact O-NZ 3.47Å; R1115-K1122 WeakPolarHBondContact O-CE 3.42Å; R1115-K1122 PolarHBondContact O-NZ 2.85Å; D1118-K1122 PolarHBondContact O-N 3Å; Q1119-K1122 PolarHBondContact O-N 2.77Å; K1122-T1126 WeakPolarHBondContact O-CB 3.38Å; K1122-T1126 PolarHBondContact O-N 2.86Å; K1122-T1126 PolarHBondContact O-OG1 2.92Å
1123	E	67.6	Low	65.2	Low	115 Å²	115	81 Å²	81	54%	0.537	41%	0.409	S	S	.	.	H	α-helix	trans	-67	-39.9	178.1	-76.4	176.2	-160.2	0	0	112.4	Q1119 L1121 T1126 S1127	Q1119-E1123 PolarHBondContact NE2-OE1 3.17Å; Q1119-E1123 WeakPolarHBondContact O-CB 3.49Å; Q1119-E1123 WeakPolarHBondContact O-CG 3.36Å; Q1119-E1123 PolarHBondContact O-N 2.8Å; L1121-E1123 VanDerWaalsContact C-N 3.34Å; L1121-E1123 PolarHBondContact O-N 2.69Å; E1123-T1126 PolarHBondContact O-N 2.82Å; E1123-S1127 VanDerWaalsContact O-CB 3.27Å; E1123-S1127 WeakPolarHBondContact O-CB 3.33Å; E1123-S1127 PolarHBondContact O-N 3.03Å; E1123-S1127 PolarHBondContact O-OG 3.49Å
1124	S	68.2	Low	67.4	Low	56 Å²	56	79.2 Å²	79.2	39%	0.392	39%	0.391	S	S	.	.	H	α-helix	trans	-57.9	-58.2	172.6	-176	0	0	0	0	111.3	Q1120 L1121 T1126 S1127 G1128	Q1120-S1124 VanDerWaalsContact O-CB 3.31Å; Q1120-S1124 WeakPolarHBondContact O-CB 3.32Å; Q1120-S1124 PolarHBondContact O-N 2.93Å; L1121-S1124 PolarHBondContact O-N 2.8Å; S1124-T1126 VanDerWaalsContact C-N 3.27Å; S1124-T1126 PolarHBondContact O-N 2.96Å; S1124-S1127 PolarHBondContact O-N 3.4Å; S1124-S1127 VanDerWaalsContact O-N 3.15Å; S1124-S1127 PolarHBondContact O-OG 3.47Å; S1124-G1128 PolarHBondContact O-N 3.12Å
1125	I	67.4	Low	69.7	Low	7 Å²	7	72.3 Å²	72.3	4%	0.036	35%	0.354	C	S	.	.	H	α-helix	trans	-60.3	-38.4	-178.7	-60.9	164.1	0	0	0	111.3	R780 A788 V1111 L1121 G1128 F1129	R780-I1125 PolarHBondContact NH2-O 3.28Å; A788-I1125 HydrophobicContact CB-CD1 4.24Å; V1111-I1125 HydrophobicContact CG2-CB 3.83Å; V1111-I1125 HydrophobicContact CG2-CD1 4.36Å; V1111-I1125 HydrophobicContact CG2-CG2 3.42Å; V1111-I1125 VanDerWaalsContact CG2-CG2 3.42Å; L1121-I1125 HydrophobicContact CD1-CD1 3.86Å; L1121-I1125 HydrophobicContact CD1-CG1 4.17Å; L1121-I1125 HydrophobicContact CG-CD1 3.87Å; L1121-I1125 VanDerWaalsContact O-CG1 3.27Å; L1121-I1125 WeakPolarHBondContact O-CG1 3.3Å; L1121-I1125 PolarHBondContact O-N 2.84Å; I1125-G1128 CarbonylContact O-C 3.51Å; I1125-G1128 PolarHBondContact O-N 2.99Å; I1125-F1129 HydrophobicContact CG2-CE1 4.08Å; I1125-F1129 HydrophobicContact CG2-CE2 4.21Å; I1125-F1129 HydrophobicContact CG2-CZ 3.61Å
1126	T	69.3	Low	72	Confident	35 Å²	35	64.7 Å²	64.7	22%	0.215	33%	0.327	C	S	.	.	H	α-helix	trans	-74.5	-33	179.7	-56.2	0	0	0	0	112.6	K1122 E1123 S1124 G1128 F1129	K1122-T1126 WeakPolarHBondContact O-CB 3.38Å; K1122-T1126 PolarHBondContact O-N 2.86Å; K1122-T1126 PolarHBondContact O-OG1 2.92Å; E1123-T1126 PolarHBondContact O-N 2.82Å; S1124-T1126 VanDerWaalsContact C-N 3.27Å; S1124-T1126 PolarHBondContact O-N 2.96Å; T1126-G1128 VanDerWaalsContact C-N 3.28Å; T1126-F1129 HydrophobicContact CG2-CD2 4.28Å; T1126-F1129 PolarHBondContact O-N 2.78Å
1127	S	66.7	Low	74.1	Confident	71 Å²	71	58.1 Å²	58.1	50%	0.497	29%	0.291	S	S	.	.	H	α-helix	trans	-63.3	-39.9	169.5	79.3	0	0	0	0	110.6	E1123 S1124 F1129 R1130	E1123-S1127 VanDerWaalsContact O-CB 3.27Å; E1123-S1127 WeakPolarHBondContact O-CB 3.33Å; E1123-S1127 PolarHBondContact O-N 3.03Å; E1123-S1127 PolarHBondContact O-OG 3.49Å; S1124-S1127 PolarHBondContact O-N 3.4Å; S1124-S1127 VanDerWaalsContact O-N 3.15Å; S1124-S1127 PolarHBondContact O-OG 3.47Å; S1127-F1129 PolarHBondContact O-N 3.19Å; S1127-R1130 PolarHBondContact O-N 3.48Å
1128	G	63.1	Low	76.3	Confident	9 Å²	9	50.2 Å²	50.2	9%	0.093	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.5	12.4	171.6	0	0	0	0	0	115.6	R780 S1124 I1125 T1126 N1152	R780-G1128 PolarHBondContact NH2-O 3.1Å; S1124-G1128 PolarHBondContact O-N 3.12Å; I1125-G1128 CarbonylContact O-C 3.51Å; I1125-G1128 PolarHBondContact O-N 2.99Å; T1126-G1128 VanDerWaalsContact C-N 3.28Å; G1128-N1152 PolarHBondContact O-ND2 2.89Å; G1128-N1152 VanDerWaalsContact O-ND2 3.09Å
1129	F	69.2	Low	78	Confident	6 Å²	6	47.5 Å²	47.5	3%	0.026	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.5	-8.3	165.6	-58.4	-38	0	0	0	113.7	I31 R780 W1106 C1109 V1111 I1125 T1126 S1127 L1154	I31-F1129 HydrophobicContact CB-CZ 4.48Å; I31-F1129 HydrophobicContact CD1-CE1 3.48Å; I31-F1129 VanDerWaalsContact CD1-CE1 3.48Å; I31-F1129 HydrophobicContact CD1-CZ 3.56Å; I31-F1129 HydrophobicContact CG1-CE1 4.3Å; I31-F1129 HydrophobicContact CG1-CZ 3.87Å; I31-F1129 HydrophobicContact CG2-CE2 4.22Å; I31-F1129 HydrophobicContact CG2-CZ 3.84Å; R780-F1129 VanDerWaalsContact NH2-CE1 3.34Å; W1106-F1129 PolarHBondContact NE1-O 3.35Å; C1109-F1129 HydrophobicContact CB-CB 3.97Å; C1109-F1129 HydrophobicContact CB-CD1 4.19Å; C1109-F1129 HydrophobicContact CB-CD2 3.31Å; C1109-F1129 HydrophobicContact CB-CE2 3.75Å; C1109-F1129 HydrophobicContact CB-CG 3.58Å; C1109-F1129 HydrophobicContact CB-CZ 4.35Å; C1109-F1129 WeakPolarHBondContact O-CD2 3.29Å; V1111-F1129 HydrophobicContact CG2-CE2 4.03Å; V1111-F1129 HydrophobicContact CG2-CZ 4.09Å; I1125-F1129 HydrophobicContact CG2-CE1 4.08Å; I1125-F1129 HydrophobicContact CG2-CE2 4.21Å; I1125-F1129 HydrophobicContact CG2-CZ 3.61Å; T1126-F1129 HydrophobicContact CG2-CD2 4.28Å; T1126-F1129 PolarHBondContact O-N 2.78Å; S1127-F1129 PolarHBondContact O-N 3.19Å; F1129-L1154 HydrophobicContact CD1-CD1 3.86Å; F1129-L1154 HydrophobicContact CD1-CD2 4.07Å; F1129-L1154 HydrophobicContact CE1-CD1 4.45Å; F1129-L1154 HydrophobicContact CE1-CD2 3.83Å
1130	R	69.8	Low	79.5	Confident	192 Å²	192	43.6 Å²	43.6	73%	0.725	22%	0.222	S	C	*	.	S	Bend	trans	-82.3	127.9	-176.2	-63.8	-176.3	-179.7	-87.1	-0.8	111.1	S1127	S1127-R1130 PolarHBondContact O-N 3.48Å
1131	N	74.9	Confident	80.9	Confident	117 Å²	117	36 Å²	36	63%	0.626	19%	0.187	S	C	*	.	S	Bend	trans	45.2	61.7	175	-57.5	26	0	0	0	114.9
1132	P	88.1	Confident	82.1	Confident	1 Å²	1	35 Å²	35	1%	0.006	18%	0.182	C	C	.	.			trans	-64.5	152.7	172.9	-0.8	11.3	0	0	0	112.4	N1072 G1074 W1106 T1150	N1072-P1132 CarbonylContact C-O 3.39Å; G1074-P1132 PolarHBondContact N-O 3.01Å; G1074-P1132 VanDerWaalsContact N-O 3.07Å; W1106-P1132 HydrophobicContact CD2-CG 3.83Å; W1106-P1132 VanDerWaalsContact CE2-CG 3.44Å; W1106-P1132 HydrophobicContact CE3-CG 4.04Å; W1106-P1132 HydrophobicContact CH2-CB 4.37Å; W1106-P1132 HydrophobicContact CH2-CG 3.48Å; W1106-P1132 VanDerWaalsContact CH2-CG 3.48Å; W1106-P1132 HydrophobicContact CZ2-CB 4.49Å; W1106-P1132 HydrophobicContact CZ2-CG 3.27Å; W1106-P1132 HydrophobicContact CZ3-CG 3.87Å; P1132-T1150 HydrophobicContact CB-CG2 3.74Å; P1132-T1150 HydrophobicContact CG-CG2 4.35Å
1133	V	93.9	Very high	83.3	Confident	15 Å²	15	33.8 Å²	33.8	9%	0.091	18%	0.177	C	C	.	.			trans	-85.3	119	159.6	-173	0	0	0	0	109.1	E1053 I1056 N1072 N1135 T1150 D1151	E1053-V1133 HydrophobicContact CG-CG2 4.48Å; I1056-V1133 HydrophobicContact CD1-CG1 3.98Å; I1056-V1133 HydrophobicContact CG1-CG1 3.59Å; N1072-V1133 HydrophobicContact CB-CG1 4.5Å; N1072-V1133 HydrophobicContact CB-CG2 4.1Å; V1133-N1135 PolarHBondContact O-N 3.16Å; V1133-T1150 CarbonylContact O-C 3.58Å; V1133-T1150 WeakPolarHBondContact O-CA 3.31Å; V1133-D1151 HydrophobicContact CB-CB 4.05Å; V1133-D1151 WeakPolarHBondContact CB-OD1 3.5Å; V1133-D1151 PolarHBondContact N-OD1 2.95Å; V1133-D1151 PolarHBondContact O-N 3.09Å
1134	V	96.2	Very high	84.4	Confident	0 Å²	0	33 Å²	33	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	89.6	179.5	-177.7	0	0	0	0	109.4	D1071 I1076 S1136 V1137 A1148 V1149 T1150	D1071-V1134 PolarHBondContact O-N 2.81Å; I1076-V1134 HydrophobicContact CG1-CG1 4.36Å; V1134-S1136 VanDerWaalsContact C-N 3.33Å; V1134-S1136 PolarHBondContact O-N 2.87Å; V1134-V1137 HydrophobicContact CG1-CG2 3.62Å; V1134-A1148 HydrophobicContact CG1-CB 3.87Å; V1134-V1149 CarbonylContact C-O 3.57Å; V1134-T1150 HydrophobicContact CG2-CG2 4.41Å
1135	N	96.6	Very high	85.7	Confident	2 Å²	2	30.7 Å²	30.7	1%	0.011	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.7	-34.1	-173.3	-64.7	-34.1	0	0	0	113.9	V795 R797 Y1055 N1057 V1133 V1149 T1150 D1151	V795-N1135 PolarHBondContact O-ND2 3.3Å; R797-N1135 PolarHBondContact NH1-O 3.03Å; Y1055-N1135 VanDerWaalsContact O-O 3.12Å; N1057-N1135 PolarHBondContact N-O 2.76Å; V1133-N1135 PolarHBondContact O-N 3.16Å; N1135-V1149 PolarHBondContact N-O 2.6Å; N1135-T1150 PolarHBondContact ND2-O 3.36Å; N1135-D1151 WeakPolarHBondContact ND2-CA 3.24Å; N1135-D1151 PolarHBondContact ND2-N 2.75Å; N1135-D1151 VanDerWaalsContact ND2-N 3.17Å
1136	S	97.4	Very high	87.1	Confident	7 Å²	7	30.4 Å²	30.4	5%	0.049	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.8	145.6	-179.2	-174.3	0	0	0	0	110.4	C798 V1134 A1148 V1149	C798-S1136 PolarHBondContact SG-OG 2.93Å; C798-S1136 VanDerWaalsContact SG-OG 3.42Å; V1134-S1136 VanDerWaalsContact C-N 3.33Å; V1134-S1136 PolarHBondContact O-N 2.87Å; S1136-A1148 CarbonylContact O-C 3.58Å; S1136-A1148 VanDerWaalsContact O-CA 3.28Å; S1136-A1148 WeakPolarHBondContact O-CA 3.43Å; S1136-V1149 PolarHBondContact N-O 3.33Å; S1136-V1149 PolarHBondContact O-N 2.92Å
1137	V	97.7	Very high	88.4	Confident	1 Å²	1	28.7 Å²	28.7	1%	0.006	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	140.2	173.2	-173.3	0	0	0	0	107.5	S1059 L1068 I1076 V1134 L1146 A1147 A1148	S1059-V1137 WeakPolarHBondContact CB-O 3.38Å; S1059-V1137 PolarHBondContact OG-O 3.42Å; L1068-V1137 HydrophobicContact CB-CB 4.36Å; L1068-V1137 HydrophobicContact CB-CG1 4.13Å; L1068-V1137 HydrophobicContact CD1-CG1 4.23Å; I1076-V1137 HydrophobicContact CD1-CG1 4.4Å; I1076-V1137 HydrophobicContact CD1-CG2 4.16Å; I1076-V1137 HydrophobicContact CG1-CG2 4.16Å; I1076-V1137 HydrophobicContact CG2-CG1 3.94Å; I1076-V1137 HydrophobicContact CG2-CG2 4.19Å; V1134-V1137 HydrophobicContact CG1-CG2 3.62Å; V1137-L1146 HydrophobicContact CG1-CD1 4.25Å; V1137-L1146 HydrophobicContact CG1-CD2 3.76Å; V1137-L1146 HydrophobicContact CG1-CG 3.98Å; V1137-A1147 CarbonylContact C-O 3.52Å; V1137-A1147 WeakPolarHBondContact CA-O 3.35Å; V1137-A1148 HydrophobicContact CB-CB 4.45Å; V1137-A1148 HydrophobicContact CG1-CB 4.38Å; V1137-A1148 HydrophobicContact CG2-CB 3.96Å
1138	E	97.2	Very high	89.9	Confident	17 Å²	17	25.4 Å²	25.4	8%	0.079	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	160.2	171.6	-171.4	61.6	-144.8	0	0	109	F800 S1059 R1061 A1147	F800-E1138 HydrophobicContact CD2-CB 4.31Å; F800-E1138 HydrophobicContact CD2-CG 3.91Å; S1059-E1138 WeakPolarHBondContact CB-OE2 3.17Å; R1061-E1138 IonicContact CZ-OE1 3.42Å; R1061-E1138 IonicContact NE-OE1 2.74Å; R1061-E1138 IonicContact NH1-OE1 3.26Å; R1061-E1138 PolarHBondContact NH1-OE1 2.92Å; E1138-A1147 PolarHBondContact N-O 3.37Å; E1138-A1147 PolarHBondContact O-N 3.4Å; E1138-A1147 VanDerWaalsContact O-O 3.08Å
1139	M	95.4	Very high	91.5	Very high	0 Å²	0	25 Å²	25	0%	0	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	153.8	-179.5	175.9	176.1	59.8	0	0	109.5	L737 Y773 R1061 L1064 A1066 L1068 Y1145	L737-M1139 HydrophobicContact CD2-CE 4.12Å; L737-M1139 HydrophobicContact CD2-SD 4.1Å; Y773-M1139 PolarHBondContact OH-SD 3.02Å; R1061-M1139 HydrophobicContact CB-CE 3.59Å; R1061-M1139 VanDerWaalsContact CD-O 3.22Å; R1061-M1139 WeakPolarHBondContact CD-O 3.48Å; R1061-M1139 HydrophobicContact CG-CE 3.96Å; R1061-M1139 PolarHBondContact NE-O 3Å; R1061-M1139 PolarHBondContact NH1-O 2.67Å; L1064-M1139 HydrophobicContact CD1-CE 3.76Å; L1064-M1139 HydrophobicContact CD1-SD 4.4Å; A1066-M1139 HydrophobicContact CB-CE 3.43Å; A1066-M1139 VanDerWaalsContact CB-CE 3.43Å; L1068-M1139 HydrophobicContact CD1-CB 3.51Å; L1068-M1139 HydrophobicContact CD1-CE 4.26Å; M1139-Y1145 CarbonylContact C-O 3.5Å; M1139-Y1145 WeakPolarHBondContact CA-O 3.22Å; M1139-Y1145 WeakPolarHBondContact CG-O 3.45Å
1140	S	95.9	Very high	92.8	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	11%	0.112	C	C	.	.			trans	-67.5	164.5	175.8	56.2	0	0	0	0	111.9	R1061 D1142 G1143 Y1144 Y1145	R1061-S1140 PolarHBondContact NE-O 3.08Å; S1140-D1142 WeakPolarHBondContact CB-OD1 3.37Å; S1140-D1142 PolarHBondContact O-N 3.1Å; S1140-D1142 PolarHBondContact OG-OD1 2.8Å; S1140-G1143 PolarHBondContact O-N 3.09Å; S1140-G1143 PolarHBondContact OG-N 3.48Å; S1140-Y1144 PolarHBondContact OG-N 3.48Å; S1140-Y1145 PolarHBondContact N-O 3.48Å; S1140-Y1145 PolarHBondContact OG-N 2.98Å; S1140-Y1145 PolarHBondContact OG-O 2.61Å
1141	S	92.8	Very high	93.9	Very high	8 Å²	8	17.1 Å²	17.1	6%	0.056	9%	0.086	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-28.6	178.2	52.7	0	0	0	0	113.5	E809 T810 R1061 N1063	E809-S1141 WeakPolarHBondContact CA-OG 3.34Å; T810-S1141 PolarHBondContact N-OG 2.78Å; T810-S1141 PolarHBondContact OG1-N 3.28Å; T810-S1141 PolarHBondContact OG1-OG 2.68Å; R1061-S1141 VanDerWaalsContact NH2-N 3.14Å; N1063-S1141 PolarHBondContact ND2-O 2.86Å
1142	D	89.7	Confident	94.6	Very high	51 Å²	51	12.2 Å²	12.2	27%	0.273	6%	0.06	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.5	-4	175.9	56.6	14.2	0	0	0	113.1	L740 H812 S1140 Y1144	L740-D1142 WeakPolarHBondContact CD1-O 3.32Å; L740-D1142 WeakPolarHBondContact CD2-O 3.19Å; H812-D1142 IonicContact CE1-OD2 2.74Å; S1140-D1142 WeakPolarHBondContact CB-OD1 3.37Å; S1140-D1142 PolarHBondContact O-N 3.1Å; S1140-D1142 PolarHBondContact OG-OD1 2.8Å; D1142-Y1144 PolarHBondContact O-N 3.07Å; D1142-Y1144 WeakPolarHBondContact OD1-CB 3.35Å; D1142-Y1144 PolarHBondContact OD1-N 2.8Å
1143	G	91.5	Very high	94.7	Very high	0 Å²	0	12.2 Å²	12.2	0%	0	6%	0.059	C	C	.	.	S	Bend	trans	68.2	3.2	-176.1	0	0	0	0	0	114.9	Y773 S1140	Y773-G1143 WeakPolarHBondContact CE1-O 3.49Å; Y773-G1143 PolarHBondContact OH-O 3.23Å; S1140-G1143 PolarHBondContact O-N 3.09Å; S1140-G1143 PolarHBondContact OG-N 3.48Å
1144	Y	92.4	Very high	94.6	Very high	98 Å²	98	11.5 Å²	11.5	38%	0.384	6%	0.055	S	C	.	.	S	Bend	trans	-74.9	-26.9	-174.3	-169.1	-105	0	0	0	113.2	S1140 D1142 R1159 Y1160	S1140-Y1144 PolarHBondContact OG-N 3.48Å; D1142-Y1144 PolarHBondContact O-N 3.07Å; D1142-Y1144 WeakPolarHBondContact OD1-CB 3.35Å; D1142-Y1144 PolarHBondContact OD1-N 2.8Å; Y1144-R1159 CarbonylContact O-C 3.59Å; Y1144-R1159 WeakPolarHBondContact O-CA 3.44Å; Y1144-Y1160 PolarHBondContact O-N 3.44Å
1145	Y	95.3	Very high	94.5	Very high	8 Å²	8	11.5 Å²	11.5	3%	0.031	6%	0.055	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	137.8	173.5	-67	-69	0	0	0	111.4	L776 H812 C827 E828 M1139 S1140 I1157 W1158 R1159	L776-Y1145 HydrophobicContact CD2-CE1 3.99Å; H812-Y1145 HydrophobicContact CB-CD2 4.19Å; H812-Y1145 HydrophobicContact CB-CE2 3.94Å; H812-Y1145 AromaticContact CG-CE2 3.77Å; H812-Y1145 AromaticContact ND1-CD2 3.8Å; H812-Y1145 AromaticContact ND1-CE2 3.71Å; C827-Y1145 HydrophobicContact CB-CD1 3.7Å; C827-Y1145 HydrophobicContact CB-CD2 3.94Å; C827-Y1145 HydrophobicContact CB-CE1 4.06Å; C827-Y1145 HydrophobicContact CB-CE2 4.28Å; C827-Y1145 HydrophobicContact CB-CG 3.64Å; E828-Y1145 WeakPolarHBondContact CA-OH 3.3Å; E828-Y1145 VanDerWaalsContact CB-OH 3.27Å; E828-Y1145 WeakPolarHBondContact CB-OH 3.36Å; E828-Y1145 WeakPolarHBondContact CG-OH 3.39Å; M1139-Y1145 CarbonylContact C-O 3.5Å; M1139-Y1145 WeakPolarHBondContact CA-O 3.22Å; M1139-Y1145 WeakPolarHBondContact CG-O 3.45Å; S1140-Y1145 PolarHBondContact N-O 3.48Å; S1140-Y1145 PolarHBondContact OG-N 2.98Å; S1140-Y1145 PolarHBondContact OG-O 2.61Å; Y1145-I1157 HydrophobicContact CD1-CG2 4.34Å; Y1145-W1158 WeakPolarHBondContact CA-O 3.2Å; Y1145-R1159 HydrophobicContact CD1-CB 4.41Å; Y1145-R1159 HydrophobicContact CE1-CB 4.28Å
1146	L	95.9	Very high	94.4	Very high	0 Å²	0	11.4 Å²	11.4	0%	0	5%	0.054	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	133.8	168.5	-178	154.5	0	0	0	108	Y773 L1068 I1076 I1078 L1104 V1137 I1157 W1158	Y773-L1146 HydrophobicContact CD1-CB 4.2Å; Y773-L1146 HydrophobicContact CE1-CB 4.08Å; L1068-L1146 HydrophobicContact CD1-CD1 4.44Å; L1068-L1146 HydrophobicContact CD2-CD1 4.13Å; I1076-L1146 HydrophobicContact CD1-CD2 3.91Å; I1076-L1146 HydrophobicContact CG2-CD1 4.29Å; I1076-L1146 HydrophobicContact CG2-CD2 4.4Å; I1078-L1146 HydrophobicContact CD1-CD1 4Å; L1104-L1146 HydrophobicContact CD1-CD1 4.39Å; V1137-L1146 HydrophobicContact CG1-CD1 4.25Å; V1137-L1146 HydrophobicContact CG1-CD2 3.76Å; V1137-L1146 HydrophobicContact CG1-CG 3.98Å; L1146-I1157 WeakPolarHBondContact O-CA 3.29Å; L1146-W1158 HydrophobicContact CB-CB 4.48Å; L1146-W1158 HydrophobicContact CD2-CD2 4.14Å; L1146-W1158 HydrophobicContact CD2-CE3 3.51Å; L1146-W1158 HydrophobicContact CD2-CZ3 3.94Å; L1146-W1158 PolarHBondContact N-O 2.81Å; L1146-W1158 PolarHBondContact O-N 2.63Å
1147	A	97.5	Very high	94.3	Very high	0 Å²	0	11 Å²	11	0%	0	5%	0.052	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	138.6	179.2	0	0	0	0	0	110.1	F800 V814 V1137 E1138 C1156	F800-A1147 HydrophobicContact CE2-CB 3.88Å; F800-A1147 HydrophobicContact CZ-CB 4.1Å; V814-A1147 HydrophobicContact CB-CB 4.41Å; V814-A1147 HydrophobicContact CG1-CB 4.34Å; V814-A1147 HydrophobicContact CG2-CB 3.95Å; V1137-A1147 CarbonylContact C-O 3.52Å; V1137-A1147 WeakPolarHBondContact CA-O 3.35Å; E1138-A1147 PolarHBondContact N-O 3.37Å; E1138-A1147 PolarHBondContact O-N 3.4Å; E1138-A1147 VanDerWaalsContact O-O 3.08Å; A1147-C1156 CarbonylContact C-O 3.53Å; A1147-C1156 VanDerWaalsContact CA-O 3.31Å; A1147-C1156 WeakPolarHBondContact CA-O 3.38Å
1148	A	97.5	Very high	94.1	Very high	1 Å²	1	11.2 Å²	11.2	1%	0.008	5%	0.053	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	156.2	175.7	0	0	0	0	0	111.3	I1076 V1134 S1136 V1137 C1156 W1158	I1076-A1148 HydrophobicContact CD1-CB 3.59Å; V1134-A1148 HydrophobicContact CG1-CB 3.87Å; S1136-A1148 CarbonylContact O-C 3.58Å; S1136-A1148 VanDerWaalsContact O-CA 3.28Å; S1136-A1148 WeakPolarHBondContact O-CA 3.43Å; V1137-A1148 HydrophobicContact CB-CB 4.45Å; V1137-A1148 HydrophobicContact CG1-CB 4.38Å; V1137-A1148 HydrophobicContact CG2-CB 3.96Å; A1148-C1156 PolarHBondContact N-O 2.95Å; A1148-C1156 PolarHBondContact O-N 2.97Å; A1148-W1158 HydrophobicContact CB-CH2 4.01Å; A1148-W1158 HydrophobicContact CB-CZ3 3.62Å
1149	V	97.3	Very high	94	Very high	0 Å²	0	15.2 Å²	15.2	0%	0	7%	0.067	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	141.6	179.8	-67.7	0	0	0	0	111.4	V795 C798 T816 V1134 N1135 S1136 L1154 V1155	V795-V1149 HydrophobicContact CB-CB 3.93Å; V795-V1149 HydrophobicContact CB-CG1 4.4Å; V795-V1149 HydrophobicContact CG1-CB 3.62Å; V795-V1149 HydrophobicContact CG1-CG1 3.62Å; V795-V1149 HydrophobicContact CG1-CG2 4.24Å; C798-V1149 HydrophobicContact CB-CG1 3.81Å; C798-V1149 HydrophobicContact CB-CG2 4.05Å; T816-V1149 HydrophobicContact CG2-CG1 3.59Å; V1134-V1149 CarbonylContact C-O 3.57Å; N1135-V1149 PolarHBondContact N-O 2.6Å; S1136-V1149 PolarHBondContact N-O 3.33Å; S1136-V1149 PolarHBondContact O-N 2.92Å; V1149-L1154 WeakPolarHBondContact CA-O 3.41Å; V1149-V1155 HydrophobicContact CG1-CB 4.38Å; V1149-V1155 HydrophobicContact CG1-CG1 4.05Å; V1149-V1155 HydrophobicContact CG1-CG2 4.04Å
1150	T	95.2	Very high	93.8	Very high	0 Å²	0	16 Å²	16	0%	0	7%	0.07	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	168.8	-170.3	70.3	0	0	0	0	114	V795 W1106 P1132 V1133 V1134 N1135 N1152 L1154	V795-T1150 PolarHBondContact N-O 3.38Å; W1106-T1150 HydrophobicContact CH2-CG2 3.94Å; W1106-T1150 HydrophobicContact CZ3-CG2 4.21Å; P1132-T1150 HydrophobicContact CB-CG2 3.74Å; P1132-T1150 HydrophobicContact CG-CG2 4.35Å; V1133-T1150 CarbonylContact O-C 3.58Å; V1133-T1150 WeakPolarHBondContact O-CA 3.31Å; V1134-T1150 HydrophobicContact CG2-CG2 4.41Å; N1135-T1150 PolarHBondContact ND2-O 3.36Å; T1150-N1152 VanDerWaalsContact CB-OD1 3.32Å; T1150-N1152 WeakPolarHBondContact CB-OD1 3.42Å; T1150-N1152 PolarHBondContact O-N 3.29Å; T1150-N1152 PolarHBondContact OG1-N 2.89Å; T1150-N1152 PolarHBondContact OG1-OD1 2.87Å; T1150-L1154 HydrophobicContact CG2-CB 4.08Å; T1150-L1154 PolarHBondContact N-O 3.44Å; T1150-L1154 VanDerWaalsContact OG1-CB 3.31Å; T1150-L1154 WeakPolarHBondContact OG1-CB 3.48Å; T1150-L1154 PolarHBondContact OG1-N 3.12Å; T1150-L1154 PolarHBondContact OG1-O 3.22Å
1151	D	92.7	Very high	93.3	Very high	34 Å²	34	16.6 Å²	16.6	18%	0.182	8%	0.075	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.2	4.2	173.7	89	-55.9	0	0	0	114.1	K794 V1133 N1135	K794-D1151 HydrophobicContact CD-CB 3.99Å; K794-D1151 HydrophobicContact CG-CB 4.36Å; K794-D1151 WeakPolarHBondContact CG-O 3.34Å; K794-D1151 PolarHBondContact NZ-O 3.48Å; K794-D1151 IonicContact NZ-OD2 2.68Å; K794-D1151 PolarHBondContact NZ-OD2 2.99Å; V1133-D1151 HydrophobicContact CB-CB 4.05Å; V1133-D1151 WeakPolarHBondContact CB-OD1 3.5Å; V1133-D1151 PolarHBondContact N-OD1 2.95Å; V1133-D1151 PolarHBondContact O-N 3.09Å; N1135-D1151 WeakPolarHBondContact ND2-CA 3.24Å; N1135-D1151 PolarHBondContact ND2-N 2.75Å; N1135-D1151 VanDerWaalsContact ND2-N 3.17Å
1152	N	90	Very high	92.4	Very high	14 Å²	14	19.6 Å²	19.6	8%	0.075	9%	0.094	C	C	.	.	T	Hydrogen-bonded Turn	trans	-128	40.1	-179	66.6	2	0	0	0	112.7	R780 S791 G1128 T1150 L1154	R780-N1152 PolarHBondContact NH1-O 3.37Å; S791-N1152 WeakPolarHBondContact O-CA 3.37Å; G1128-N1152 PolarHBondContact O-ND2 2.89Å; G1128-N1152 VanDerWaalsContact O-ND2 3.09Å; T1150-N1152 VanDerWaalsContact CB-OD1 3.32Å; T1150-N1152 WeakPolarHBondContact CB-OD1 3.42Å; T1150-N1152 PolarHBondContact O-N 3.29Å; T1150-N1152 PolarHBondContact OG1-N 2.89Å; T1150-N1152 PolarHBondContact OG1-OD1 2.87Å; N1152-L1154 VanDerWaalsContact C-N 3.31Å; N1152-L1154 PolarHBondContact O-N 2.7Å; N1152-L1154 VanDerWaalsContact OD1-CD1 3.29Å; N1152-L1154 WeakPolarHBondContact OD1-CD1 3.18Å; N1152-L1154 WeakPolarHBondContact OD1-CG 3.1Å
1153	N	90.9	Very high	91.4	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	10%	0.096	C	C	.	.	S	Bend	trans	66.4	13	175.9	-167.1	20.1	0	0	0	116.4	R780 H782 A783 D790 T793	R780-N1153 WeakPolarHBondContact CA-O 3.38Å; H782-N1153 VanDerWaalsContact C-OD1 3.31Å; H782-N1153 WeakPolarHBondContact CA-OD1 3.38Å; H782-N1153 WeakPolarHBondContact CB-OD1 3.18Å; H782-N1153 PolarHBondContact N-OD1 3.2Å; H782-N1153 VanDerWaalsContact N-OD1 3.15Å; A783-N1153 VanDerWaalsContact CA-ND2 3.31Å; A783-N1153 WeakPolarHBondContact CA-ND2 3.31Å; A783-N1153 PolarHBondContact N-ND2 2.82Å; A783-N1153 PolarHBondContact N-OD1 3.1Å; D790-N1153 WeakPolarHBondContact O-CB 3.42Å; D790-N1153 PolarHBondContact O-ND2 3.06Å; T793-N1153 WeakPolarHBondContact O-CA 3.24Å; T793-N1153 WeakPolarHBondContact O-CB 3.33Å; T793-N1153 PolarHBondContact O-N 3.42Å
1154	L	91.5	Very high	89.6	Confident	0 Å²	0	25.1 Å²	25.1	0%	0	12%	0.122	C	C	.	.			trans	-94.4	124	-178.3	-52.8	170.7	0	0	0	111.2	I31 R780 W1106 F1129 V1149 T1150 N1152	I31-L1154 HydrophobicContact CD1-CD2 4Å; R780-L1154 HydrophobicContact CG-CD2 3.74Å; W1106-L1154 HydrophobicContact CH2-CD1 3.74Å; W1106-L1154 HydrophobicContact CZ2-CD1 3.52Å; F1129-L1154 HydrophobicContact CD1-CD1 3.86Å; F1129-L1154 HydrophobicContact CD1-CD2 4.07Å; F1129-L1154 HydrophobicContact CE1-CD1 4.45Å; F1129-L1154 HydrophobicContact CE1-CD2 3.83Å; V1149-L1154 WeakPolarHBondContact CA-O 3.41Å; T1150-L1154 HydrophobicContact CG2-CB 4.08Å; T1150-L1154 PolarHBondContact N-O 3.44Å; T1150-L1154 VanDerWaalsContact OG1-CB 3.31Å; T1150-L1154 WeakPolarHBondContact OG1-CB 3.48Å; T1150-L1154 PolarHBondContact OG1-N 3.12Å; T1150-L1154 PolarHBondContact OG1-O 3.22Å; N1152-L1154 VanDerWaalsContact C-N 3.31Å; N1152-L1154 PolarHBondContact O-N 2.7Å; N1152-L1154 VanDerWaalsContact OD1-CD1 3.29Å; N1152-L1154 WeakPolarHBondContact OD1-CD1 3.18Å; N1152-L1154 WeakPolarHBondContact OD1-CG 3.1Å
1155	V	93.8	Very high	87.4	Confident	0 Å²	0	29.7 Å²	29.7	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	120.8	157.2	-171.8	0	0	0	0	107.9	F778 I779 C781 V795 T816 I825 V1149	F778-V1155 CarbonylContact C-O 3.52Å; I779-V1155 HydrophobicContact CB-CB 4.46Å; I779-V1155 PolarHBondContact N-O 3.18Å; I779-V1155 PolarHBondContact O-N 2.63Å; C781-V1155 WeakPolarHBondContact SG-CG2 3.3Å; V795-V1155 HydrophobicContact CG1-CG2 4.41Å; T816-V1155 HydrophobicContact CG2-CG1 3.79Å; T816-V1155 HydrophobicContact CG2-CG2 4.08Å; I825-V1155 HydrophobicContact CD1-CB 4.1Å; I825-V1155 HydrophobicContact CD1-CG1 3.76Å; I825-V1155 HydrophobicContact CD1-CG2 4.25Å; V1149-V1155 HydrophobicContact CG1-CB 4.38Å; V1149-V1155 HydrophobicContact CG1-CG1 4.05Å; V1149-V1155 HydrophobicContact CG1-CG2 4.04Å
1156	C	93.9	Very high	84.6	Confident	0 Å²	0	35.1 Å²	35.1	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	133.9	-172.9	-57.5	0	0	0	0	109	H777 F778 W1106 A1147 A1148 W1158	H777-C1156 CarbonylContact O-C 3.52Å; H777-C1156 WeakPolarHBondContact O-CA 3.3Å; F778-C1156 HydrophobicContact CD1-CB 4.21Å; F778-C1156 WeakPolarHBondContact CD1-SG 3.01Å; F778-C1156 HydrophobicContact CD2-CB 4.18Å; F778-C1156 HydrophobicContact CE1-CB 3.98Å; F778-C1156 WeakPolarHBondContact CE1-SG 3.14Å; F778-C1156 HydrophobicContact CE2-CB 3.92Å; F778-C1156 HydrophobicContact CG-CB 4.3Å; F778-C1156 HydrophobicContact CZ-CB 3.81Å; W1106-C1156 WeakPolarHBondContact CH2-SG 3.08Å; A1147-C1156 CarbonylContact C-O 3.53Å; A1147-C1156 VanDerWaalsContact CA-O 3.31Å; A1147-C1156 WeakPolarHBondContact CA-O 3.38Å; A1148-C1156 PolarHBondContact N-O 2.95Å; A1148-C1156 PolarHBondContact O-N 2.97Å; C1156-W1158 HydrophobicContact CB-CE3 4.22Å; C1156-W1158 HydrophobicContact CB-CH2 3.26Å; C1156-W1158 HydrophobicContact CB-CZ2 4.21Å; C1156-W1158 HydrophobicContact CB-CZ3 3.27Å; C1156-W1158 WeakPolarHBondContact O-CZ3 3.48Å
1157	I	95.2	Very high	81.4	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	130.5	-176.4	-51.2	-176.1	0	0	0	108	L776 H777 I779 I825 C827 Y1145 L1146	L776-I1157 WeakPolarHBondContact CA-O 3.35Å; L776-I1157 WeakPolarHBondContact CB-O 3.34Å; L776-I1157 PolarHBondContact N-O 2.9Å; H777-I1157 HydrophobicContact CB-CB 4.22Å; H777-I1157 HydrophobicContact CB-CD1 4.45Å; H777-I1157 HydrophobicContact CB-CG1 4.5Å; H777-I1157 PolarHBondContact N-O 3.14Å; H777-I1157 VanDerWaalsContact N-O 3.07Å; H777-I1157 PolarHBondContact O-N 3.33Å; I779-I1157 HydrophobicContact CD1-CD1 4.13Å; I825-I1157 HydrophobicContact CG2-CD1 4.01Å; C827-I1157 HydrophobicContact CB-CD1 4.41Å; C827-I1157 HydrophobicContact CB-CG2 3.86Å; Y1145-I1157 HydrophobicContact CD1-CG2 4.34Å; L1146-I1157 WeakPolarHBondContact O-CA 3.29Å
1158	W	94.6	Very high	78.3	Confident	5 Å²	5	48.6 Å²	48.6	2%	0.019	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	148.8	173.3	-62.7	-111.9	0	0	0	109.7	Y773 D774 P775 F778 I1076 L1104 Y1145 L1146 A1148 C1156	Y773-W1158 HydrophobicContact CD1-CB 4.24Å; D774-W1158 CarbonylContact O-C 3.55Å; D774-W1158 WeakPolarHBondContact O-CA 3.5Å; D774-W1158 WeakPolarHBondContact O-CB 3.15Å; P775-W1158 HydrophobicContact CB-CG 4.47Å; F778-W1158 HydrophobicContact CE2-CZ2 4.19Å; F778-W1158 HydrophobicContact CZ-CH2 4.08Å; F778-W1158 AromaticContact CZ-CZ2 3.68Å; F778-W1158 HydrophobicContact CZ-CZ2 3.68Å; I1076-W1158 HydrophobicContact CD1-CE3 4.33Å; I1076-W1158 HydrophobicContact CD1-CH2 3.33Å; I1076-W1158 HydrophobicContact CD1-CZ2 3.82Å; I1076-W1158 HydrophobicContact CD1-CZ3 3.62Å; L1104-W1158 HydrophobicContact CD1-CD2 4.47Å; L1104-W1158 HydrophobicContact CD1-CG 4.26Å; Y1145-W1158 WeakPolarHBondContact CA-O 3.2Å; L1146-W1158 HydrophobicContact CB-CB 4.48Å; L1146-W1158 HydrophobicContact CD2-CD2 4.14Å; L1146-W1158 HydrophobicContact CD2-CE3 3.51Å; L1146-W1158 HydrophobicContact CD2-CZ3 3.94Å; L1146-W1158 PolarHBondContact N-O 2.81Å; L1146-W1158 PolarHBondContact O-N 2.63Å; A1148-W1158 HydrophobicContact CB-CH2 4.01Å; A1148-W1158 HydrophobicContact CB-CZ3 3.62Å; C1156-W1158 HydrophobicContact CB-CE3 4.22Å; C1156-W1158 HydrophobicContact CB-CH2 3.26Å; C1156-W1158 HydrophobicContact CB-CZ2 4.21Å; C1156-W1158 HydrophobicContact CB-CZ3 3.27Å; C1156-W1158 WeakPolarHBondContact O-CZ3 3.48Å
1159	R	94.2	Very high	75	Confident	101 Å²	101	52.1 Å²	52.1	38%	0.381	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	150.4	168.5	62.7	173.4	-171.9	-140.6	-2.2	110.3	Y773 D774 L776 Y1144 Y1145 A1161	Y773-R1159 CarbonylContact C-O 3.59Å; Y773-R1159 WeakPolarHBondContact CA-O 3.12Å; Y773-R1159 WeakPolarHBondContact CD1-O 3.45Å; D774-R1159 HydrophobicContact CB-CG 3.84Å; D774-R1159 PolarHBondContact N-O 2.82Å; D774-R1159 PolarHBondContact O-N 3.36Å; D774-R1159 IonicContact OD2-CZ 2.77Å; D774-R1159 IonicContact OD2-NE 3.63Å; D774-R1159 PolarHBondContact OD2-NE 2.74Å; D774-R1159 IonicContact OD2-NH2 3.2Å; D774-R1159 PolarHBondContact OD2-NH2 3.46Å; L776-R1159 HydrophobicContact CD2-CB 4.26Å; Y1144-R1159 CarbonylContact O-C 3.59Å; Y1144-R1159 WeakPolarHBondContact O-CA 3.44Å; Y1145-R1159 HydrophobicContact CD1-CB 4.41Å; Y1145-R1159 HydrophobicContact CE1-CB 4.28Å; R1159-A1161 PolarHBondContact O-N 3.07Å
1160	Y	91.1	Very high	71.8	Confident	17 Å²	17	59.8 Å²	59.8	7%	0.067	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.8	127.2	170.7	172.9	-109.8	0	0	0	110.6	C741 I771 D772 Y1144 P1162 P1163	C741-Y1160 VanDerWaalsContact CA-OH 3.3Å; C741-Y1160 WeakPolarHBondContact CA-OH 3.08Å; C741-Y1160 PolarHBondContact SG-OH 3.49Å; I771-Y1160 HydrophobicContact CG2-CE2 4.31Å; D772-Y1160 WeakPolarHBondContact O-CD2 3.39Å; Y1144-Y1160 PolarHBondContact O-N 3.44Å; Y1160-P1162 HydrophobicContact CE1-CB 4.04Å; Y1160-P1162 WeakPolarHBondContact O-CD 3.36Å; Y1160-P1163 VanDerWaalsContact OH-CD 3.24Å; Y1160-P1163 WeakPolarHBondContact OH-CD 3.47Å
1161	A	86.5	Confident	68.7	Low	12 Å²	12	67.3 Å²	67.3	10%	0.099	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	109.3	176.9	0	0	0	0	0	109.4	D772 R1159	D772-A1161 HydrophobicContact CB-CB 4.23Å; D772-A1161 PolarHBondContact O-N 3.16Å; R1159-A1161 PolarHBondContact O-N 3.07Å
1162	P	74.2	Confident	65.9	Low	70 Å²	70	72.9 Å²	72.9	46%	0.455	36%	0.356	S	S	.	.	P	Polyproline II helix	trans	-66.3	142.9	-179.8	26.9	-33.9	0	0	0	111	Y1160 Q1164	Y1160-P1162 HydrophobicContact CE1-CB 4.04Å; Y1160-P1162 WeakPolarHBondContact O-CD 3.36Å; P1162-Q1164 PolarHBondContact O-N 3.1Å; P1162-Q1164 VanDerWaalsContact O-N 3.12Å
1163	P	67.3	Low	63.1	Low	48 Å²	48	80 Å²	80	31%	0.312	39%	0.389	S	S	.	.	P	Polyproline II helix	trans	-61.3	118.5	-175.9	24.3	-34.8	0	0	0	111	Y1160 Q1165	Y1160-P1163 VanDerWaalsContact OH-CD 3.24Å; Y1160-P1163 WeakPolarHBondContact OH-CD 3.47Å; P1163-Q1165 PolarHBondContact O-N 3.22Å
1164	Q	55.2	Low	60.2	Low	119 Å²	119	88.6 Å²	88.6	56%	0.556	43%	0.429	S	S	*	.	P	Polyproline II helix	trans	-57.5	123.6	176.2	-65.4	-178.7	4.2	0	0	109.9	P1162 Q1166	P1162-Q1164 PolarHBondContact O-N 3.1Å; P1162-Q1164 VanDerWaalsContact O-N 3.12Å; Q1164-Q1166 PolarHBondContact O-N 3.03Å
1165	Q	45.8	Very low	57.1	Low	194 Å²	194	94.9 Å²	94.9	91%	0.907	47%	0.468	S	S	*	.			trans	-72.3	76.1	173.5	-67	-172.5	7.6	0	0	110.1	P1163 Q1167	P1163-Q1165 PolarHBondContact O-N 3.22Å; Q1165-Q1167 PolarHBondContact O-N 3.43Å
1166	Q	35.9	Very low	54	Low	123 Å²	123	101.7 Å²	101.7	58%	0.575	51%	0.51	S	S	*	.			trans	-58.5	131.1	171.3	-72	-173.5	-9.9	0	0	109.9	Q1164 Y1168	Q1164-Q1166 PolarHBondContact O-N 3.03Å; Q1166-Y1168 HydrophobicContact CB-CD2 4.09Å; Q1166-Y1168 HydrophobicContact CB-CE2 3.94Å; Q1166-Y1168 PolarHBondContact O-N 2.94Å
1167	Q	28.9	Very low	51.1	Low	92 Å²	92	108 Å²	108	43%	0.43	55%	0.549	S	S	.	.			trans	-64.5	92.4	170.1	-105	-154.7	27.4	0	0	111.1	D42 Q1165 S1169	D42-Q1167 PolarHBondContact OD1-NE2 3.35Å; D42-Q1167 WeakPolarHBondContact OD2-CG 3.37Å; D42-Q1167 PolarHBondContact OD2-NE2 3.47Å; Q1165-Q1167 PolarHBondContact O-N 3.43Å; Q1167-S1169 WeakPolarHBondContact CB-OG 3.29Å; Q1167-S1169 WeakPolarHBondContact CG-OG 3.37Å; Q1167-S1169 PolarHBondContact O-N 3.31Å; Q1167-S1169 PolarHBondContact OE1-OG 2.88Å
1168	Y	32	Very low	48.2	Very low	191 Å²	191	114.2 Å²	114.2	75%	0.749	59%	0.589	S	S	*	*			trans	-74.7	47.9	164	-85.7	-92.6	0	0	0	111.4	Q1166	Q1166-Y1168 HydrophobicContact CB-CD2 4.09Å; Q1166-Y1168 HydrophobicContact CB-CE2 3.94Å; Q1166-Y1168 PolarHBondContact O-N 2.94Å
1169	S	28.4	Very low	45.2	Very low	74 Å²	74	119.6 Å²	119.6	52%	0.517	63%	0.627	S	S	.	*	S	Bend	trans	-139.4	24.5	-171.2	46.3	0	0	0	0	113.9	Q1167	Q1167-S1169 WeakPolarHBondContact CB-OG 3.29Å; Q1167-S1169 WeakPolarHBondContact CG-OG 3.37Å; Q1167-S1169 PolarHBondContact O-N 3.31Å; Q1167-S1169 PolarHBondContact OE1-OG 2.88Å
1170	Q	30.6	Very low	42	Very low	161 Å²	161	122.5 Å²	122.5	75%	0.752	65%	0.649	S	S	*	*	S	Bend	trans	-146.4	-6.2	168.3	-116.3	160.7	106.4	0	0	117.6
1171	I	30.7	Very low	39.5	Very low	158 Å²	158	131.2 Å²	131.2	81%	0.81	69%	0.69	S	S	*	*	S	Bend	trans	-102.9	-13.8	179.2	-64.4	179	0	0	0	113.2	Q1173	I1171-Q1173 PolarHBondContact O-N 3.09Å
1172	I	33.4	Very low	37.1	Very low	151 Å²	151	138.9 Å²	138.9	77%	0.774	72%	0.724	S	S	*	*	S	Bend	trans	-82.7	58.6	169.1	-46.8	-177.6	0	0	0	110.2
1173	Q	31.2	Very low	35.1	Very low	165 Å²	165	141.2 Å²	141.2	77%	0.771	74%	0.737	S	S	*	*	S	Bend	trans	-157	132.6	164.8	-113.3	167.4	83.4	0	0	108.9	I1171	I1171-Q1173 PolarHBondContact O-N 3.09Å
1174	Q	29	Very low	33.5	Very low	179 Å²	179	144.2 Å²	144.2	84%	0.836	75%	0.754	S	S	*	*	S	Bend	trans	70.8	57	177.9	-47.3	-175.8	32.5	0	0	117.4
1175	T	28.2	Very low	32.5	Very low	132 Å²	132	144.5 Å²	144.5	81%	0.81	77%	0.765	S	S	*	*	S	Bend	trans	-152.8	43.3	145.4	2.7	0	0	0	0	114.7
1176	T	28.3	Very low	31.7	Very low	144 Å²	144	142 Å²	142	88%	0.883	75%	0.754	S	S	*	*			trans	-159.1	66.1	162.4	10.3	0	0	0	0	112.7
1177	T	31.9	Very low	31.6	Very low	133 Å²	133	142.8 Å²	142.8	82%	0.816	76%	0.758	S	S	*	*			trans	-117.3	125.8	158.1	39.4	0	0	0	0	108.5
1178	P	33.9	Very low	31.9	Very low	130 Å²	130	145.2 Å²	145.2	84%	0.844	77%	0.769	S	S	*	*			trans	-69.9	147.9	-168.4	26.9	-34.6	0	0	0	112.5	L1180	P1178-L1180 PolarHBondContact O-N 3.49Å
1179	S	31.8	Very low	32	Very low	117 Å²	117	142 Å²	142	82%	0.818	77%	0.765	S	S	*	*			trans	-66.4	119.5	-179.2	41.2	0	0	0	0	112.7
1180	L	28.3	Very low	32.3	Very low	163 Å²	163	144.5 Å²	144.5	85%	0.853	77%	0.773	S	S	*	*			trans	-168.7	93.1	152.4	-109.2	163.7	0	0	0	109.4	P1178	P1178-L1180 PolarHBondContact O-N 3.49Å
1181	H	38.4	Very low	32.4	Very low	200 Å²	200	143.2 Å²	143.2	93%	0.926	77%	0.771	S	S	*	*			trans	-165.3	162	148.1	-108	75.4	0	0	0	109.7
1182	Q	35	Very low	32.6	Very low	173 Å²	173	143.4 Å²	143.4	81%	0.808	77%	0.768	S	S	*	*			trans	-106	149.5	-163	-64.9	176.8	-37.2	0	0	114
1183	T	33.3	Very low	32.5	Very low	118 Å²	118	142.9 Å²	142.9	72%	0.724	77%	0.767	S	S	*	*			trans	59.3	109.2	144	50.9	0	0	0	0	121.6
1184	T	34	Very low	32.5	Very low	111 Å²	111	141.2 Å²	141.2	68%	0.681	77%	0.768	S	S	*	*				84.7	113.6	110.5	-53	0	0	0	0	120.3
1185	T	34.2	Very low	32.7	Very low	126 Å²	126	136.8 Å²	136.8	77%	0.773	76%	0.761	S	S	*	*			trans	70.1	156.9	149.9	62.5	0	0	0	0	120.6
1186	M	29.1	Very low	33	Very low	140 Å²	140	137.6 Å²	137.6	69%	0.69	76%	0.759	S	S	*	*			cis	-167.2	146.4	-25.6	-100.3	-92.2	-93.3	0	0	109.6
1187	Q	32.5	Very low	33.1	Very low	140 Å²	140	137.2 Å²	137.2	65%	0.654	75%	0.752	S	S	*	*			trans	61.8	141.5	145.8	-77	175.2	-22.7	0	0	125.1
1188	H	36.1	Very low	33.2	Very low	144 Å²	144	137.7 Å²	137.7	67%	0.667	75%	0.75	S	S	*	*			trans	90.4	105.4	140	-76.5	-41.8	0	0	0	124.6
1189	N	33.9	Very low	33.3	Very low	122 Å²	122	136.2 Å²	136.2	65%	0.652	74%	0.742	S	S	*	*				71.1	122.9	118	-67.7	27.3	0	0	0	124.2
1190	N	33.6	Very low	33.1	Very low	127 Å²	127	139.2 Å²	139.2	68%	0.679	75%	0.745	S	S	*	*			trans	86.5	123.2	130.9	-67.3	10.4	0	0	0	123.1
1191	N	34.4	Very low	33.2	Very low	134 Å²	134	136.7 Å²	136.7	72%	0.717	74%	0.737	S	S	*	*			trans	92.8	116.1	132.5	-73.1	2	0	0	0	123.6
1192	Q	34.9	Very low	32.9	Very low	162 Å²	162	132.9 Å²	132.9	76%	0.757	73%	0.727	S	S	*	*			trans	86	106.1	133	-68.1	-166.2	-7.8	0	0	123.1
1193	L	30.1	Very low	33	Very low	141 Å²	141	131 Å²	131	74%	0.738	73%	0.727	S	S	*	*				74.5	128.6	124.5	-94.5	72.5	0	0	0	124.1
1194	T	32.1	Very low	33.4	Very low	130 Å²	130	130.2 Å²	130.2	80%	0.798	73%	0.725	S	S	*	*			trans	86.5	128.9	135.9	48.2	0	0	0	0	123.6
1195	A	33.8	Very low	33.5	Very low	85 Å²	85	131.7 Å²	131.7	70%	0.702	73%	0.728	S	S	*	*			trans	109.3	102	135.7	0	0	0	0	0	120.7
1196	I	33.6	Very low	33.5	Very low	149 Å²	149	132 Å²	132	76%	0.764	73%	0.73	S	S	*	*				78.1	104.5	126.3	-63.6	172	0	0	0	119.8
1197	N	30.6	Very low	33.8	Very low	137 Å²	137	129 Å²	129	73%	0.733	73%	0.728	S	S	*	*			trans	70.8	140.5	134.2	-63.8	6	0	0	0	124.9
1198	N	34.5	Very low	33.7	Very low	143 Å²	143	127.4 Å²	127.4	77%	0.765	73%	0.732	S	S	*	*			trans	95.3	117.7	141.2	-75.2	-0.3	0	0	0	122.8
1199	S	34.1	Very low	33.5	Very low	98 Å²	98	128 Å²	128	69%	0.685	74%	0.738	S	S	*	*				83	122.2	129.4	68.5	0	0	0	0	122.5
1200	M	29.5	Very low	33.5	Very low	180 Å²	180	127.8 Å²	127.8	89%	0.887	74%	0.741	S	S	*	*				67.5	157.6	126.1	-68.9	-176.3	174.4	0	0	121.9
1201	V	30.4	Very low	33.6	Very low	111 Å²	111	128.3 Å²	128.3	67%	0.673	74%	0.744	S	S	*	*			cis	-171.6	157.7	-34.1	80.9	0	0	0	0	109.4
1202	T	32.3	Very low	33.7	Very low	119 Å²	119	128.9 Å²	128.9	73%	0.73	75%	0.747	S	S	*	*			trans	63.3	173.2	170	57.5	0	0	0	0	116.5
1203	V	35.7	Very low	33.7	Very low	133 Å²	133	127.2 Å²	127.2	81%	0.806	74%	0.743	S	S	*	*			cis	-147.2	171.1	24.5	-109.5	0	0	0	0	112.5
1204	P	42.5	Very low	34	Very low	103 Å²	103	126.4 Å²	126.4	67%	0.669	74%	0.744	S	S	*	*			trans	-120.4	-164.8	-157.9	45.6	-35.5	0	0	0	115.3
1205	N	36	Very low	34.1	Very low	141 Å²	141	125 Å²	125	75%	0.754	74%	0.74	S	S	*	*			trans	170.2	139.5	130.4	-91.8	-21.9	0	0	0	118.5
1206	V	34.6	Very low	34.1	Very low	134 Å²	134	126.3 Å²	126.3	81%	0.812	74%	0.744	S	S	*	*				60.6	144.7	129.2	-179.3	0	0	0	0	119.8
1207	A	33.7	Very low	34.1	Very low	77 Å²	77	123.7 Å²	123.7	64%	0.636	74%	0.738	S	S	*	*			cis	-149	151.5	9.4	0	0	0	0	0	108.7
1208	S	30.7	Very low	34.1	Very low	106 Å²	106	123.3 Å²	123.3	74%	0.741	74%	0.741	S	S	*	*			cis	83.5	116.9	48.3	85	0	0	0	0	117.1
1209	I	33.2	Very low	34	Very low	156 Å²	156	123.8 Å²	123.8	80%	0.8	74%	0.742	S	S	*	*			trans	177.1	112.3	141.4	-90.3	149.1	0	0	0	108.9
1210	V	33.9	Very low	33.8	Very low	117 Å²	117	123 Å²	123	71%	0.709	74%	0.742	S	S	*	*				76.2	145.8	80.9	-124.9	0	0	0	0	118.6
1211	D	35	Very low	33.8	Very low	139 Å²	139	120 Å²	120	74%	0.743	74%	0.737	S	S	*	*			trans	79.8	144.8	160.7	-48.2	-33.4	0	0	0	120.5
1212	D	36.5	Very low	33.7	Very low	146 Å²	146	122.5 Å²	122.5	78%	0.781	74%	0.743	S	S	*	*			cis	-165.6	-178.7	-37.5	-148.7	-15.2	0	0	0	111.5
1213	D	35.8	Very low	33.6	Very low	127 Å²	127	125 Å²	125	68%	0.679	75%	0.747	S	S	*	*			trans	79.8	116.9	149.1	-98.5	-20.7	0	0	0	125
1214	T	34.9	Very low	33.3	Very low	123 Å²	123	125 Å²	125	76%	0.755	74%	0.742	S	S	*	*			trans	67.9	154.9	141	65.7	0	0	0	0	123.2
1215	S	34.3	Very low	32.5	Very low	102 Å²	102	127.1 Å²	127.1	71%	0.713	75%	0.746	S	S	*	*			cis	-172.2	157.8	-26.1	60.8	0	0	0	0	112.6
1216	S	33.8	Very low	32.2	Very low	112 Å²	112	126.7 Å²	126.7	78%	0.783	74%	0.744	S	S	*	*			trans	63.6	146.3	158.9	-153.9	0	0	0	0	118.9
1217	S	35.1	Very low	32.1	Very low	93 Å²	93	126.6 Å²	126.6	65%	0.65	74%	0.739	S	S	*	*			cis	-160	140.1	-8.7	29	0	0	0	0	107.4
1218	T	30.3	Very low	31.8	Very low	130 Å²	130	128.2 Å²	128.2	80%	0.798	74%	0.741	S	S	*	*				86.4	146.1	53.5	-45.9	0	0	0	0	114.4
1219	I	32.6	Very low	31.7	Very low	153 Å²	153	129.5 Å²	129.5	79%	0.785	74%	0.74	S	S	*	*			trans	82.8	107.5	179.6	-48.7	177.8	0	0	0	112.7
1220	A	29.4	Very low	31.5	Very low	81 Å²	81	128.8 Å²	128.8	67%	0.669	74%	0.737	S	S	*	*				78.1	153.1	50.6	0	0	0	0	0	113.6
1221	C	29.7	Very low	31.4	Very low	117 Å²	117	128.7 Å²	128.7	79%	0.791	74%	0.742	S	S	*	*			cis	-129.6	160.9	-0.6	-51.5	0	0	0	0	108.8
1222	M	27.3	Very low	31.3	Very low	164 Å²	164	126.3 Å²	126.3	81%	0.808	74%	0.737	S	S	*	*			cis	75.7	81	8.8	-163	-105.6	-68.8	0	0	117.5
1223	E	29.8	Very low	31	Very low	172 Å²	172	127.2 Å²	127.2	80%	0.804	74%	0.74	S	S	*	*			trans	-169.6	153.6	151.2	-116.4	-176.5	178.9	0	0	115
1224	L	29.6	Very low	30.9	Very low	133 Å²	133	124.6 Å²	124.6	70%	0.696	74%	0.736	S	S	*	*			trans	51.7	122	156.8	-56.1	167.2	0	0	0	119.7
1225	L	26.7	Very low	30.8	Very low	146 Å²	146	125.8 Å²	125.8	76%	0.764	74%	0.737	S	S	*	*				76.2	135.4	52.2	-75.5	170.8	0	0	0	117.1
1226	N	30	Very low	30.6	Very low	133 Å²	133	129.7 Å²	129.7	71%	0.711	74%	0.741	S	S	*	*			trans	81.7	126.9	157.3	-64.5	-15.4	0	0	0	121.7
1227	N	30.9	Very low	30.6	Very low	131 Å²	131	129.3 Å²	129.3	70%	0.701	74%	0.738	S	S	*	*			trans	77.9	97.5	133.8	-69.9	-1.6	0	0	0	122.4
1228	T	28.3	Very low	30.6	Very low	111 Å²	111	129.5 Å²	129.5	68%	0.681	74%	0.739	S	S	*	*				63.3	134.5	118.9	62.4	0	0	0	0	122.1
1229	N	29.7	Very low	30.6	Very low	133 Å²	133	127.8 Å²	127.8	71%	0.711	74%	0.738	S	S	*	*			trans	84.1	116.9	141.5	-65.8	-11.8	0	0	0	120.9
1230	N	28.9	Very low	30.6	Very low	141 Å²	141	127.2 Å²	127.2	75%	0.754	74%	0.735	S	S	*	*			trans	79.8	143.7	137.6	-65.1	-22.2	0	0	0	120.8
1231	S	31.8	Very low	30.5	Very low	115 Å²	115	131.2 Å²	131.2	80%	0.804	74%	0.74	S	S	*	*			trans	70.7	142.3	162	73	0	0	0	0	117.3
1232	S	30.9	Very low	30.5	Very low	90 Å²	90	131.9 Å²	131.9	63%	0.629	74%	0.735	S	S	*	*			cis	-175.8	162.8	-15.2	49.9	0	0	0	0	110.8
1233	I	32.1	Very low	30.6	Very low	165 Å²	165	129.5 Å²	129.5	85%	0.846	73%	0.729	S	S	*	*			trans	71.6	140.4	150.7	-73.9	157.7	0	0	0	117.1
1234	A	31.9	Very low	30.6	Very low	72 Å²	72	126.6 Å²	126.6	60%	0.595	72%	0.724	S	S	*	*			cis	-173.6	-176.9	-24	0	0	0	0	0	109.6
1235	L	32.5	Very low	30.6	Very low	148 Å²	148	126.3 Å²	126.3	78%	0.775	73%	0.728	S	S	*	*			trans	85	135.3	157.2	-48.7	-173.3	0	0	0	117.9
1236	K	32.1	Very low	30.8	Very low	184 Å²	184	122.4 Å²	122.4	80%	0.8	72%	0.723	S	S	*	*			cis	-171.2	153.4	-20	-132.2	-176.1	-164.6	177.4	0	112.9
1237	S	33.2	Very low	30.8	Very low	104 Å²	104	122.6 Å²	122.6	73%	0.727	72%	0.719	S	S	*	*			trans	69	145.8	151.4	-128.7	0	0	0	0	118.1
1238	S	34.4	Very low	30.8	Very low	97 Å²	97	121.7 Å²	121.7	68%	0.678	71%	0.711	S	S	*	*			cis	-141.7	134.1	2.6	-53.6	0	0	0	0	107.9
1239	A	30.3	Very low	30.8	Very low	93 Å²	93	118.6 Å²	118.6	77%	0.769	69%	0.69	S	S	*	*				54.1	126.4	78.3	0	0	0	0	0	112.7
1240	I	32.1	Very low	30.8	Very low	141 Å²	141	117.3 Å²	117.3	72%	0.723	68%	0.682	S	S	*	*				-142.9	130.8	50.5	-77.8	161.2	0	0	0	108.7
1241	E	28.4	Very low	30.8	Very low	165 Å²	165	120 Å²	120	77%	0.771	69%	0.69	S	S	*	*				63.4	138.7	85.8	-103.9	178.8	-164.8	0	0	113.2
1242	L	29.5	Very low	30.7	Very low	131 Å²	131	120.3 Å²	120.3	69%	0.686	69%	0.685	S	S	*	*			cis	-151.9	134.2	31.9	-96.9	120	0	0	0	109.7
1243	V	29.3	Very low	30.7	Very low	114 Å²	114	121.8 Å²	121.8	69%	0.691	69%	0.688	S	S	*	*				74.4	132.1	99.4	163.3	0	0	0	0	115.4
1244	T	30	Very low	30.6	Very low	111 Å²	111	119.4 Å²	119.4	68%	0.681	68%	0.679	S	S	*	*			cis	-164.8	157.5	-6.4	26.9	0	0	0	0	111.7
1245	T	29.7	Very low	30.5	Very low	128 Å²	128	122.2 Å²	122.2	79%	0.785	68%	0.684	S	S	*	*			trans	31.2	136	145.7	64.2	0	0	0	0	121.7
1246	G	30.5	Very low	30.4	Very low	64 Å²	64	120.6 Å²	120.6	66%	0.66	68%	0.678	S	S	*	*			cis	150.4	-178.1	-1.1	0	0	0	0	0	112.7
1247	Q	30	Very low	30.3	Very low	137 Å²	137	116.4 Å²	116.4	64%	0.64	67%	0.67	S	S	*	*			trans	60.7	143.1	158.4	-73.9	171.5	-36.5	0	0	118.5
1248	H	31.5	Very low	30.1	Very low	111 Å²	111	117.3 Å²	117.3	51%	0.514	67%	0.666	S	S	.	*			cis	-148.2	131.8	16.6	-118	-52.1	0	0	0	113.4	D69	D69-H1248 IonicContact OD2-ND1 3.61Å
1249	L	29	Very low	29.8	Very low	47 Å²	47	118.8 Å²	118.8	25%	0.246	67%	0.665	C	S	.	*			trans	43.8	139.2	140.7	-73.7	172.5	0	0	0	124.1	Y67 D69 S70 G72	Y67-L1249 HydrophobicContact CE1-CD2 4.45Å; D69-L1249 HydrophobicContact CB-CD2 4.46Å; D69-L1249 WeakPolarHBondContact OD2-CD2 3.27Å; D69-L1249 WeakPolarHBondContact OD2-CG 3.49Å; S70-L1249 VanDerWaalsContact N-CD2 3.32Å; S70-L1249 PolarHBondContact OG-N 3.03Å; G72-L1249 VanDerWaalsContact CA-O 3.29Å; G72-L1249 WeakPolarHBondContact CA-O 3.32Å
1250	L	28	Very low	29.7	Very low	106 Å²	106	121 Å²	121	56%	0.555	66%	0.656	S	S	*	*				126.6	28.5	112.4	-48.1	-178.4	0	0	0	121.2
1251	E	28.6	Very low	29.5	Very low	197 Å²	197	119.2 Å²	119.2	92%	0.921	65%	0.65	S	S	*	*			trans	-150.5	0	146	-125.9	157.6	-165.2	0	0	110.3	S74	S74-E1251 WeakPolarHBondContact CB-OE2 3.32Å; S74-E1251 PolarHBondContact OG-OE2 3.48Å

Retrieved 1,251 of 1,251 residues in 1438.9 ms (Link to these results)

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