A0A077ZMG7_TRITR Loading...

Lon protease homolog, mitochondrial

ATP-dependent serine protease that mediates the selective degradation of misfolded, unassembled or oxidatively damaged polypeptides as well as certain short-lived regulatory proteins in the mitochondrial matrix. May also have a chaperone function in the assembly of inner membrane protein complexes. Participates in the regulation of mitochondrial gene expression and in the maintenance of the integrity of the mitochondrial genome. Binds to mitochondrial DNA in a site-specific manner.

AlphaFold DB , UniProt , Accession A0A077ZMG7, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 865 aa.

						>A0A077ZMG7_TRITR|A0A077ZMG7
MQRALFGSTKDDGYHSESGDELSSLSSSDASDPSALAPVQVPDFFPVVPLLPLLRYPLFPKLATVVVVTHPSLMNIIRRKIKLGQPYAGAFLKKNDNNEKEVVDSLDELYHVGTFVQIREVQDYGDRMRMILDGHRRIRLIKSVDDKTALPEGKEAAGSDDKRKDSILLVETENVEMPEYEYTDELKAMTQEVVKTIRDIVSFNPLIRHTIMQTLKPSQRVVDNPVYLSDLGCALTGADSQDMQAILEETSVPERLMKSLALLKKELEFSKLQAKIGKQVEEKVKQQHRKYMLQEQLKAIKKELGLEKDDKDAVAEKFRDRLKDLAVPAHIQEAIDEEFNKLAFLDPHSSEFSVSRNYLDWLTSMPWGKQTEENFDLERARKILDADHYGMEDVKNRVLEFIAVSKLKGNVQGKILCFYGPPGVGKTSIAKSISSALNRQYFRFSVGGMTDVAEIKGHRRTYVGSMPGKIIQCLKKVKCENPLILIDEVDKIGRAGFHGDPASALLELLDPEQNHNFLDHYLDVTVDLSKVLFICTANVTDTIPDPLRDRMEMIEVSGYVAEEKLRIAENYLIPQTKAECGIATDMVNIGPDALKLLIKKYCRESGVRNLKKQIEKVSPFILLCDRHVYRKAALKIASQETDAITVTDKNLSDFVGKPVFTHDRLYTITPPGVVMGLAWTSMGGSTLFVESSLRQRYDDTAKEEGKEGTLLLTGNMGDVMKESAKIAHTYARQFLANHVPDNSFLEKAHLHVHVPEGATPKDGPSAGCTIVTSLISLALHLPVRQNIAMTGEVSLTGKILPVGGIKEKVIAARRANVDCILLPEENRKDFSDLPKFITEGIEVHFIEKYEDLFRISFPDFALASA
					

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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	46.1	Very low	43.1	Very low	74 Å²	74	98.8 Å²	98.8	37%	0.365	52%	0.516	S	S	.	.				0	-54.6	0	-152.2	-149.1	-75.1	0	0	112.3	R3 A4 L5 L215 Q219 V221	M1-R3 VanDerWaalsContact C-N 3.3Å; M1-R3 PolarHBondContact O-N 3.05Å; M1-A4 PolarHBondContact O-N 2.96Å; M1-L5 HydrophobicContact CG-CD1 4.49Å; M1-L5 PolarHBondContact O-N 3.19Å; M1-L5 VanDerWaalsContact O-N 3.07Å; M1-L215 HydrophobicContact CE-CD2 4.42Å; M1-L215 HydrophobicContact SD-CB 4.3Å; M1-L215 HydrophobicContact SD-CD1 3.6Å; M1-L215 VanDerWaalsContact SD-CD1 3.6Å; M1-L215 HydrophobicContact SD-CD2 4.21Å; M1-L215 HydrophobicContact SD-CG 4.27Å; M1-Q219 HydrophobicContact CE-CB 4.43Å; M1-Q219 WeakPolarHBondContact CE-O 3.29Å; M1-V221 HydrophobicContact CE-CG2 3.66Å; M1-V221 HydrophobicContact CG-CG2 4.12Å; M1-V221 HydrophobicContact SD-CG2 3.56Å; M1-V221 VanDerWaalsContact SD-CG2 3.56Å
2	Q	43.3	Very low	42	Very low	133 Å²	133	101.6 Å²	101.6	62%	0.621	53%	0.532	S	S	*	.	H	α-helix	trans	-52.1	-44.6	173.9	-87	178.2	-11.2	0	0	113.1	A4 F6 M212	Q2-A4 VanDerWaalsContact C-N 3.32Å; Q2-A4 PolarHBondContact O-N 3.05Å; Q2-F6 HydrophobicContact CG-CD2 4.48Å; Q2-F6 WeakPolarHBondContact O-CA 3.5Å; Q2-F6 WeakPolarHBondContact O-CB 3.34Å; Q2-F6 PolarHBondContact O-N 3.21Å; Q2-M212 HydrophobicContact CG-CE 4.04Å
3	R	47.7	Very low	40.7	Very low	209 Å²	209	99.2 Å²	99.2	79%	0.789	55%	0.546	S	S	*	.	H	α-helix	trans	-61.2	-34.1	173.8	-111.9	-177.9	-179.2	177.7	0.4	114.5	M1 G7	M1-R3 VanDerWaalsContact C-N 3.3Å; M1-R3 PolarHBondContact O-N 3.05Å; R3-G7 WeakPolarHBondContact O-CA 3.31Å; R3-G7 PolarHBondContact O-N 3.4Å
4	A	51.7	Low	39.8	Very low	41 Å²	41	107.5 Å²	107.5	34%	0.339	57%	0.568	S	S	.	*	H	α-helix	trans	-79.2	-37.8	-175.6	0	0	0	0	0	112.1	M1 Q2 R198 V222	M1-A4 PolarHBondContact O-N 2.96Å; Q2-A4 VanDerWaalsContact C-N 3.32Å; Q2-A4 PolarHBondContact O-N 3.05Å; A4-R198 WeakPolarHBondContact O-CD 3.25Å; A4-V222 HydrophobicContact CB-CG2 4.28Å
5	L	52	Low	39	Very low	14 Å²	14	112.5 Å²	112.5	7%	0.073	59%	0.586	C	S	.	*	H	α-helix	trans	-91.1	-37.8	179.1	-77.4	166.3	0	0	0	113.1	M1 V194 I197 R198 I211 L215	M1-L5 HydrophobicContact CG-CD1 4.49Å; M1-L5 PolarHBondContact O-N 3.19Å; M1-L5 VanDerWaalsContact O-N 3.07Å; L5-V194 HydrophobicContact CD2-CG1 4.31Å; L5-I197 HydrophobicContact CD2-CG2 4.21Å; L5-R198 HydrophobicContact CD2-CG 4.23Å; L5-R198 VanDerWaalsContact O-CD 3.24Å; L5-R198 WeakPolarHBondContact O-CD 3.38Å; L5-R198 WeakPolarHBondContact O-CG 3.26Å; L5-I211 HydrophobicContact CD1-CG2 4.49Å; L5-L215 HydrophobicContact CD1-CD1 4.09Å
6	F	56.4	Low	38.3	Very low	39 Å²	39	112.8 Å²	112.8	17%	0.171	60%	0.6	C	S	.	*	H	α-helix	trans	-114.6	2.2	-169	-51.5	-76.2	0	0	0	114	Q2 V201 R208 I211 M212	Q2-F6 HydrophobicContact CG-CD2 4.48Å; Q2-F6 WeakPolarHBondContact O-CA 3.5Å; Q2-F6 WeakPolarHBondContact O-CB 3.34Å; Q2-F6 PolarHBondContact O-N 3.21Å; F6-V201 HydrophobicContact CD1-CG1 4.41Å; F6-V201 HydrophobicContact CE1-CG1 4.1Å; F6-R208 HydrophobicContact CD1-CG 3.9Å; F6-R208 HydrophobicContact CE1-CB 4.31Å; F6-R208 HydrophobicContact CE1-CG 3.57Å; F6-R208 HydrophobicContact CZ-CG 4.39Å; F6-I211 HydrophobicContact CZ-CB 4.49Å; F6-I211 HydrophobicContact CZ-CG2 3.89Å; F6-M212 HydrophobicContact CD2-CE 3.38Å; F6-M212 HydrophobicContact CE1-CE 4.22Å; F6-M212 HydrophobicContact CE2-CE 2.87Å; F6-M212 HydrophobicContact CG-CE 4.25Å; F6-M212 HydrophobicContact CZ-CE 3.35Å
7	G	43.4	Very low	37.7	Very low	36 Å²	36	117.4 Å²	117.4	37%	0.371	62%	0.618	S	S	.	*			trans	69.2	-179.9	-177.6	0	0	0	0	0	113	R3 T9	R3-G7 WeakPolarHBondContact O-CA 3.31Å; R3-G7 PolarHBondContact O-N 3.4Å; G7-T9 PolarHBondContact O-N 2.96Å
8	S	35.3	Very low	37.1	Very low	89 Å²	89	116.9 Å²	116.9	62%	0.622	63%	0.626	S	S	*	*			trans	-68.5	118.8	174.8	146.5	0	0	0	0	109.5	K10	S8-K10 PolarHBondContact O-N 2.82Å; S8-K10 VanDerWaalsContact O-N 3.1Å
9	T	35.7	Very low	36.6	Very low	110 Å²	110	114.5 Å²	114.5	68%	0.675	63%	0.631	S	S	*	*			trans	-59.9	108.3	164.9	44.5	0	0	0	0	108.4	G7	G7-T9 PolarHBondContact O-N 2.96Å
10	K	32.5	Very low	36.2	Very low	181 Å²	181	116.3 Å²	116.3	79%	0.787	64%	0.64	S	S	*	*			trans	-68.9	131.3	155.7	-89.1	-177.2	171.5	-178	0	106.2	S8 D12	S8-K10 PolarHBondContact O-N 2.82Å; S8-K10 VanDerWaalsContact O-N 3.1Å; K10-D12 PolarHBondContact O-N 3.42Å
11	D	30.3	Very low	35.8	Very low	161 Å²	161	119.2 Å²	119.2	86%	0.861	65%	0.649	S	S	*	*			trans	-59.3	88.7	169.9	-77.6	-35.9	0	0	0	108.9	G13	D11-G13 VanDerWaalsContact C-N 3.32Å; D11-G13 PolarHBondContact O-N 3.28Å; D11-G13 VanDerWaalsContact O-N 3.13Å
12	D	30	Very low	34.9	Very low	132 Å²	132	124.2 Å²	124.2	71%	0.706	68%	0.676	S	S	*	*			trans	-76.2	96.5	161.2	-71.7	-25.3	0	0	0	105.6	K10 Y14	K10-D12 PolarHBondContact O-N 3.42Å; D12-Y14 VanDerWaalsContact C-N 3.29Å; D12-Y14 PolarHBondContact O-N 2.92Å
13	G	25	Very low	34.1	Very low	70 Å²	70	123.5 Å²	123.5	72%	0.722	69%	0.686	S	S	*	*			trans	-59.1	88.5	176.4	0	0	0	0	0	111	D11 H15	D11-G13 VanDerWaalsContact C-N 3.32Å; D11-G13 PolarHBondContact O-N 3.28Å; D11-G13 VanDerWaalsContact O-N 3.13Å; G13-H15 PolarHBondContact O-N 3.46Å
14	Y	28	Very low	33.1	Very low	216 Å²	216	118.6 Å²	118.6	85%	0.847	68%	0.683	S	S	*	*			trans	-82.8	104.1	160	-87	-89	0	0	0	107.4	D12 S16	D12-Y14 VanDerWaalsContact C-N 3.29Å; D12-Y14 PolarHBondContact O-N 2.92Å; Y14-S16 PolarHBondContact O-N 3.34Å
15	H	27.5	Very low	32.1	Very low	183 Å²	183	125 Å²	125	85%	0.847	71%	0.711	S	S	*	*			trans	-47.2	119	163.7	-80.5	-84	0	0	0	109.1	G13 E17	G13-H15 PolarHBondContact O-N 3.46Å; H15-E17 PolarHBondContact O-N 3.37Å
16	S	28.1	Very low	30.9	Very low	116 Å²	116	129.1 Å²	129.1	81%	0.811	74%	0.741	S	S	*	*			trans	-64.9	99.4	168.5	54	0	0	0	0	108.4	Y14 S18	Y14-S16 PolarHBondContact O-N 3.34Å; S16-S18 PolarHBondContact O-N 2.88Å
17	E	28.6	Very low	29.4	Very low	191 Å²	191	132.7 Å²	132.7	89%	0.893	77%	0.771	S	S	*	*			trans	-69.7	109.1	157.4	-84.6	-176.4	162.6	0	0	107.5	H15 G19	H15-E17 PolarHBondContact O-N 3.37Å; E17-G19 PolarHBondContact O-N 3Å
18	S	27.1	Very low	28.7	Very low	110 Å²	110	135.9 Å²	135.9	77%	0.769	79%	0.787	S	S	*	*			trans	-57.7	97.5	167.3	48.5	0	0	0	0	110	S16	S16-S18 PolarHBondContact O-N 2.88Å
19	G	27.9	Very low	28.4	Very low	70 Å²	70	139.7 Å²	139.7	72%	0.722	80%	0.801	S	S	*	*			trans	-107.8	83.8	164.6	0	0	0	0	0	109.2	E17 E21	E17-G19 PolarHBondContact O-N 3Å; G19-E21 PolarHBondContact O-N 3.21Å
20	D	27.5	Very low	28.1	Very low	151 Å²	151	138.1 Å²	138.1	81%	0.807	80%	0.799	S	S	*	*			trans	-67.9	75.7	169.7	-83.2	-37.9	0	0	0	110.4
21	E	28.7	Very low	28.2	Very low	178 Å²	178	134.6 Å²	134.6	83%	0.832	80%	0.797	S	S	*	*			trans	-146	88	165.5	-73.5	-168.4	168.2	0	0	109.4	G19	G19-E21 PolarHBondContact O-N 3.21Å
22	L	27.4	Very low	28.5	Very low	179 Å²	179	132.5 Å²	132.5	94%	0.937	79%	0.786	S	S	*	*			trans	166.2	61.1	149.5	-86.9	151.8	0	0	0	109.9
23	S	25.5	Very low	29.2	Very low	117 Å²	117	132.4 Å²	132.4	82%	0.818	79%	0.793	S	S	*	*			trans	-121.6	59.3	170.5	56	0	0	0	0	110.7
24	S	27.4	Very low	30.6	Very low	106 Å²	106	130.3 Å²	130.3	74%	0.741	77%	0.767	S	S	*	*			trans	-158.9	61.1	169	68.1	0	0	0	0	113.1
25	L	29.9	Very low	31.7	Very low	175 Å²	175	123.2 Å²	123.2	92%	0.916	75%	0.753	S	S	*	*			trans	-130.2	100.6	150.8	-77	174.1	0	0	0	108.1
26	S	26.4	Very low	33.2	Very low	102 Å²	102	117.4 Å²	117.4	71%	0.713	73%	0.728	S	S	*	*			trans	-46.2	138.1	175.7	48.3	0	0	0	0	113.5	S28	S26-S28 PolarHBondContact O-N 3.42Å
27	S	25.1	Very low	34.4	Very low	113 Å²	113	115.5 Å²	115.5	79%	0.79	72%	0.719	S	S	*	*			trans	-28.6	109	153.8	52.7	0	0	0	0	114
28	S	28.8	Very low	35.5	Very low	103 Å²	103	112.7 Å²	112.7	72%	0.72	72%	0.718	S	S	*	*			trans	-115.9	114	146.3	58.4	0	0	0	0	106.5	S26 A30	S26-S28 PolarHBondContact O-N 3.42Å; S28-A30 PolarHBondContact O-N 3.2Å
29	D	28.6	Very low	37.2	Very low	169 Å²	169	110.3 Å²	110.3	90%	0.904	70%	0.698	S	S	*	*			trans	-63.5	58.2	172	-74.8	-40.7	0	0	0	111.4	S31	D29-S31 VanDerWaalsContact C-N 3.32Å; D29-S31 PolarHBondContact O-N 2.7Å; D29-S31 VanDerWaalsContact O-N 3.1Å
30	A	30.9	Very low	39.3	Very low	77 Å²	77	115.7 Å²	115.7	64%	0.636	70%	0.704	S	S	*	*			trans	-77.6	92.6	164.3	0	0	0	0	0	106.1	S28 D32	S28-A30 PolarHBondContact O-N 3.2Å; A30-D32 PolarHBondContact O-N 3.2Å
31	S	33.9	Very low	41.7	Very low	107 Å²	107	110.2 Å²	110.2	75%	0.748	68%	0.676	S	S	*	*			trans	-44.9	108.6	161.3	53.8	0	0	0	0	107.8	D29 P33	D29-S31 VanDerWaalsContact C-N 3.32Å; D29-S31 PolarHBondContact O-N 2.7Å; D29-S31 VanDerWaalsContact O-N 3.1Å; S31-P33 WeakPolarHBondContact O-CD 3.24Å
32	D	37	Very low	44.3	Very low	118 Å²	118	103.5 Å²	103.5	63%	0.631	65%	0.648	S	S	*	*			trans	-56.4	108.1	-175.1	-134.2	-36.4	0	0	0	108.1	A30 S34 A35	A30-D32 PolarHBondContact O-N 3.2Å; D32-S34 PolarHBondContact O-N 3.44Å; D32-S34 PolarHBondContact OD1-OG 2.87Å; D32-A35 PolarHBondContact O-N 3.07Å
33	P	44.2	Very low	46.7	Very low	130 Å²	130	101.7 Å²	101.7	84%	0.844	64%	0.64	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.3	-5.8	-176.6	1.1	9.3	0	0	0	112	S31	S31-P33 WeakPolarHBondContact O-CD 3.24Å
34	S	54.4	Low	49.4	Very low	25 Å²	25	102.4 Å²	102.4	18%	0.175	63%	0.628	C	S	.	*	T	Hydrogen-bonded Turn	trans	-83.9	-24.1	-175	62	0	0	0	0	113.7	D32 E120	D32-S34 PolarHBondContact O-N 3.44Å; D32-S34 PolarHBondContact OD1-OG 2.87Å; S34-E120 WeakPolarHBondContact O-CA 3.17Å
35	A	50.7	Low	52.2	Low	67 Å²	67	98.9 Å²	98.9	55%	0.554	60%	0.6	S	S	*	*	B	Isolated β-bridge	trans	-90.4	117	-177.2	0	0	0	0	0	111.1	D32	D32-A35 PolarHBondContact O-N 3.07Å
36	L	58.7	Low	54.7	Low	61 Å²	61	92.4 Å²	92.4	32%	0.319	57%	0.568	S	S	.	*	P	Polyproline II helix	trans	-76.8	141.4	176.1	-67.1	165.9	0	0	0	110.5	I81 P86 I118	L36-I81 HydrophobicContact CD1-CG1 4.5Å; L36-I81 HydrophobicContact CD1-CG2 4.34Å; L36-I81 HydrophobicContact CD2-CG2 3.67Å; L36-P86 HydrophobicContact CD1-CB 3.69Å; L36-P86 HydrophobicContact CD1-CG 4.17Å; L36-I118 WeakPolarHBondContact CD1-O 2.96Å
37	A	53.3	Low	57.7	Low	76 Å²	76	89.7 Å²	89.7	63%	0.628	55%	0.547	S	S	*	.	P	Polyproline II helix	trans	-56.9	144	177.4	0	0	0	0	0	110.8	V39	A37-V39 PolarHBondContact O-N 3.11Å
38	P	51.7	Low	60.7	Low	133 Å²	133	84.3 Å²	84.3	86%	0.864	51%	0.51	S	S	*	.			trans	-66	95.9	178.9	25.5	-32.2	0	0	0	110.3
39	V	63.3	Low	63.6	Low	59 Å²	59	79.5 Å²	79.5	36%	0.358	48%	0.476	S	S	.	.	P	Polyproline II helix	trans	-81.9	133.6	170.8	-175	0	0	0	0	108.2	A37 V41 Y87	A37-V39 PolarHBondContact O-N 3.11Å; V39-V41 PolarHBondContact O-N 3.48Å; V39-V41 VanDerWaalsContact O-N 3.1Å; V39-Y87 WeakPolarHBondContact CG1-OH 3.07Å
40	Q	71.5	Confident	66.6	Low	183 Å²	183	71.6 Å²	71.6	86%	0.855	43%	0.433	S	S	*	.	P	Polyproline II helix	trans	-59.5	116.2	170.9	-171.8	173.9	7	0	0	108.7	P42 Y87	Q40-P42 WeakPolarHBondContact O-CD 3.48Å; Q40-Y87 PolarHBondContact O-OH 2.83Å
41	V	79.4	Confident	69.5	Low	36 Å²	36	68 Å²	68	22%	0.218	40%	0.404	C	S	.	.	P	Polyproline II helix	trans	-67.1	122.8	-175.8	-177.1	0	0	0	0	108.9	V39 Y87 F115 Q117	V39-V41 PolarHBondContact O-N 3.48Å; V39-V41 VanDerWaalsContact O-N 3.1Å; V41-Y87 HydrophobicContact CB-CE1 4.49Å; V41-Y87 HydrophobicContact CG1-CE1 4.06Å; V41-Y87 HydrophobicContact CG2-CE1 4.28Å; V41-F115 HydrophobicContact CG1-CD1 4.5Å; V41-F115 HydrophobicContact CG1-CE1 3.8Å; V41-Q117 VanDerWaalsContact CG2-OE1 3.31Å
42	P	83.1	Confident	72.1	Confident	38 Å²	38	63.9 Å²	63.9	25%	0.247	37%	0.374	C	S	.	.	P	Polyproline II helix	trans	-67.9	137.7	-177.9	26	-33.1	0	0	0	110.8	Q40 F44 F45 Y87 R136	Q40-P42 WeakPolarHBondContact O-CD 3.48Å; P42-F44 VanDerWaalsContact C-N 3.3Å; P42-F44 PolarHBondContact O-N 3.1Å; P42-F45 HydrophobicContact CB-CB 4.46Å; P42-F45 HydrophobicContact CB-CD2 4.45Å; P42-F45 HydrophobicContact CG-CB 3.92Å; P42-F45 HydrophobicContact CG-CD2 3.8Å; P42-F45 HydrophobicContact CG-CG 4.16Å; P42-Y87 VanDerWaalsContact CD-OH 3.28Å; P42-Y87 WeakPolarHBondContact CD-OH 3.4Å; P42-Y87 HydrophobicContact CG-CD2 4.31Å; P42-Y87 HydrophobicContact CG-CE2 3.86Å; P42-R136 PolarHBondContact O-NH1 2.73Å; P42-R136 PolarHBondContact O-NH2 2.91Å
43	D	77.8	Confident	74.7	Confident	141 Å²	141	59 Å²	59	75%	0.754	35%	0.348	S	S	*	.	S	Bend	trans	-66	-34.9	178.4	-66.7	-39.2	0	0	0	111.8	R136 N174	D43-R136 PolarHBondContact O-NE 3.18Å; D43-R136 PolarHBondContact O-NH2 3.39Å; D43-N174 PolarHBondContact O-ND2 3.06Å
44	F	81.7	Confident	76.6	Confident	132 Å²	132	56.1 Å²	56.1	58%	0.579	33%	0.325	S	S	*	.			trans	-128.9	122.1	176.9	-172.6	-107.3	0	0	0	110.6	P42 P46	P42-F44 VanDerWaalsContact C-N 3.3Å; P42-F44 PolarHBondContact O-N 3.1Å; F44-P46 HydrophobicContact CD1-CG 4.37Å; F44-P46 HydrophobicContact CE1-CB 4.02Å; F44-P46 HydrophobicContact CE1-CG 3.68Å; F44-P46 HydrophobicContact CZ-CB 3.82Å; F44-P46 HydrophobicContact CZ-CG 4.03Å
45	F	85.5	Confident	78	Confident	32 Å²	32	62.3 Å²	62.3	14%	0.14	34%	0.344	C	S	.	.			trans	-149.3	87.7	179.5	-163	-88	0	0	0	108.7	P42 V47 V48 Q85 Y87 F115	P42-F45 HydrophobicContact CB-CB 4.46Å; P42-F45 HydrophobicContact CB-CD2 4.45Å; P42-F45 HydrophobicContact CG-CB 3.92Å; P42-F45 HydrophobicContact CG-CD2 3.8Å; P42-F45 HydrophobicContact CG-CG 4.16Å; F45-V47 WeakPolarHBondContact CE1-O 3.45Å; F45-V48 HydrophobicContact CD1-CG1 3.67Å; F45-V48 HydrophobicContact CE1-CG1 4.13Å; F45-Q85 HydrophobicContact CE2-CG 4.45Å; F45-Q85 HydrophobicContact CZ-CB 4.32Å; F45-Q85 HydrophobicContact CZ-CG 4.45Å; F45-Y87 HydrophobicContact CE2-CD2 4.38Å; F45-Y87 HydrophobicContact CZ-CD2 4.37Å; F45-F115 HydrophobicContact CB-CE2 3.82Å; F45-F115 HydrophobicContact CB-CZ 3.99Å; F45-F115 HydrophobicContact CD1-CE2 4.06Å; F45-F115 HydrophobicContact CD1-CZ 4.48Å; F45-F115 HydrophobicContact CG-CE2 4.27Å; F45-F115 HydrophobicContact CG-CZ 4.39Å
46	P	83.2	Confident	79.8	Confident	38 Å²	38	63.8 Å²	63.8	25%	0.247	34%	0.336	C	S	.	.			trans	-75.1	-37.9	-162.4	26	-33.3	0	0	0	113.1	F44 E171 T172	F44-P46 HydrophobicContact CD1-CG 4.37Å; F44-P46 HydrophobicContact CE1-CB 4.02Å; F44-P46 HydrophobicContact CE1-CG 3.68Å; F44-P46 HydrophobicContact CZ-CB 3.82Å; F44-P46 HydrophobicContact CZ-CG 4.03Å; P46-E171 HydrophobicContact CB-CG 4.41Å; P46-E171 CarbonylContact O-C 3.59Å; P46-E171 WeakPolarHBondContact O-CA 3.47Å; P46-T172 VanDerWaalsContact CA-O 3.28Å; P46-T172 WeakPolarHBondContact CA-O 3.29Å; P46-T172 WeakPolarHBondContact CB-O 3.44Å; P46-T172 PolarHBondContact O-N 2.78Å; P46-T172 PolarHBondContact O-OG1 3.3Å
47	V	88.3	Confident	81.4	Confident	46 Å²	46	61.4 Å²	61.4	28%	0.279	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	110.8	-175.3	-175.9	0	0	0	0	110.5	F45 V144 V170	F45-V47 WeakPolarHBondContact CE1-O 3.45Å; V47-V144 HydrophobicContact CG1-CB 4.48Å; V47-V144 HydrophobicContact CG1-CG1 4.42Å; V47-V144 HydrophobicContact CG1-CG2 4.4Å; V47-V170 WeakPolarHBondContact CA-O 3.33Å
48	V	89.4	Confident	83.2	Confident	0 Å²	0	58.2 Å²	58.2	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	147.9	-177.1	-70.2	0	0	0	0	112.2	F45 L50 F115 I138 V170 T172	F45-V48 HydrophobicContact CD1-CG1 3.67Å; F45-V48 HydrophobicContact CE1-CG1 4.13Å; V48-L50 PolarHBondContact O-N 2.86Å; V48-F115 HydrophobicContact CG1-CD2 3.95Å; V48-F115 HydrophobicContact CG1-CE2 3.64Å; V48-I138 HydrophobicContact CG2-CD1 4.42Å; V48-V170 HydrophobicContact CG2-CG2 4.01Å; V48-V170 PolarHBondContact N-O 2.79Å; V48-V170 PolarHBondContact O-N 3.21Å; V48-T172 HydrophobicContact CG2-CG2 3.82Å
49	P	90.1	Very high	85.1	Confident	1 Å²	1	52 Å²	52	1%	0.006	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.5	134.4	162.6	-22.4	32.3	0	0	0	111	I76 K80 Y87 A88 G89 L168 L169	P49-I76 HydrophobicContact CB-CG2 4.13Å; P49-I76 HydrophobicContact CG-CG2 3.82Å; P49-K80 HydrophobicContact CG-CG 4.01Å; P49-Y87 VanDerWaalsContact CD-O 3.31Å; P49-Y87 WeakPolarHBondContact CD-O 3.29Å; P49-A88 HydrophobicContact CB-CB 4.33Å; P49-G89 PolarHBondContact O-N 2.81Å; P49-L168 WeakPolarHBondContact CA-O 3.15Å; P49-L169 HydrophobicContact CG-CD2 4.2Å
50	L	90.7	Very high	86.3	Confident	3 Å²	3	49.8 Å²	49.8	2%	0.016	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	124.8	178.4	178.7	60.3	0	0	0	110.3	V48 P52 F91 L109 L140 I167 L168 V170	V48-L50 PolarHBondContact O-N 2.86Å; L50-P52 HydrophobicContact CG-CG 4.23Å; L50-F91 HydrophobicContact CD1-CB 4.28Å; L50-F91 HydrophobicContact CD1-CD2 3.48Å; L50-F91 VanDerWaalsContact CD1-CD2 3.48Å; L50-F91 HydrophobicContact CD1-CE2 4.17Å; L50-F91 HydrophobicContact CD1-CG 4.19Å; L50-L109 HydrophobicContact CD1-CD1 3.78Å; L50-L109 HydrophobicContact CD2-CD1 3.74Å; L50-L109 HydrophobicContact CG-CD1 4.21Å; L50-L140 HydrophobicContact CD1-CD1 4.31Å; L50-I167 HydrophobicContact CD2-CB 4.42Å; L50-I167 HydrophobicContact CD2-CG2 4Å; L50-L168 PolarHBondContact N-O 3.29Å; L50-V170 HydrophobicContact CB-CG1 4.1Å; L50-V170 HydrophobicContact CB-CG2 4.13Å; L50-V170 HydrophobicContact CD1-CG1 4.31Å; L50-V170 HydrophobicContact CD1-CG2 4.18Å; L50-V170 HydrophobicContact CD2-CG1 3.94Å; L50-V170 HydrophobicContact CG-CG1 4.35Å
51	L	91.3	Very high	86.8	Confident	3 Å²	3	45.6 Å²	45.6	2%	0.016	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	97.4	172.8	-66.9	179.9	0	0	0	110	L53 V68 L73 I77 A88 G89 A90 F91 V116 M130 L132	L51-L53 PolarHBondContact O-N 2.84Å; L51-V68 HydrophobicContact CD2-CG2 4.26Å; L51-L73 HydrophobicContact CD2-CD1 4.42Å; L51-L73 HydrophobicContact CD2-CD2 4.06Å; L51-L73 HydrophobicContact CD2-CG 4.49Å; L51-I77 HydrophobicContact CD2-CD1 4.22Å; L51-A88 HydrophobicContact CD1-CB 3.5Å; L51-A88 HydrophobicContact CG-CB 3.89Å; L51-G89 PolarHBondContact N-O 3.06Å; L51-A90 VanDerWaalsContact O-CA 3.31Å; L51-A90 WeakPolarHBondContact O-CA 3.45Å; L51-F91 PolarHBondContact O-N 3.2Å; L51-V116 HydrophobicContact CD1-CG2 4.38Å; L51-M130 HydrophobicContact CD1-CE 4.29Å; L51-M130 HydrophobicContact CD2-CE 4.27Å; L51-L132 HydrophobicContact CD1-CD1 3.72Å; L51-L132 HydrophobicContact CD1-CD2 4.08Å
52	P	89.8	Confident	87.2	Confident	19 Å²	19	44.7 Å²	44.7	12%	0.123	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	120.9	174.4	-23.7	37.7	0	0	0	111.4	L50 F91 K93 E101 V103 L109	L50-P52 HydrophobicContact CG-CG 4.23Å; P52-F91 CarbonylContact C-O 3.59Å; P52-F91 WeakPolarHBondContact CA-O 3.18Å; P52-K93 HydrophobicContact CB-CD 4.4Å; P52-K93 VanDerWaalsContact CB-CE 3.42Å; P52-K93 HydrophobicContact CB-CG 4.2Å; P52-E101 WeakPolarHBondContact CD-O 3.44Å; P52-E101 VanDerWaalsContact CG-O 3.28Å; P52-E101 WeakPolarHBondContact CG-O 3.42Å; P52-V103 HydrophobicContact CB-CG2 4.06Å; P52-V103 HydrophobicContact CG-CG2 3.69Å; P52-L109 HydrophobicContact CB-CD2 4.14Å
53	L	90.3	Very high	87.3	Confident	15 Å²	15	45.6 Å²	45.6	8%	0.079	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	147.5	173.8	-62.4	-179.7	0	0	0	110.7	L51 L58 V66 A90 F91 L92 K93	L51-L53 PolarHBondContact O-N 2.84Å; L53-L58 HydrophobicContact CD1-CB 3.71Å; L53-V66 HydrophobicContact CD2-CG2 3.77Å; L53-A90 HydrophobicContact CD1-CB 3.85Å; L53-A90 HydrophobicContact CG-CB 4.1Å; L53-F91 PolarHBondContact N-O 3.43Å; L53-L92 HydrophobicContact CB-CD1 4.41Å; L53-K93 PolarHBondContact O-N 3.16Å; L53-K93 VanDerWaalsContact O-N 3.11Å
54	L	84.8	Confident	87.8	Confident	70 Å²	70	41.4 Å²	41.4	37%	0.366	21%	0.207	S	C	.	.			trans	-108	137.4	174.4	-79.3	160.2	0	0	0	109.7	Y56 K93 N98	L54-Y56 PolarHBondContact O-N 2.79Å; L54-K93 HydrophobicContact CD2-CD 3.85Å; L54-K93 HydrophobicContact CG-CD 4.29Å; L54-N98 WeakPolarHBondContact CD2-O 3.21Å
55	R	83.3	Confident	88.1	Confident	155 Å²	155	38.4 Å²	38.4	59%	0.585	20%	0.199	S	C	*	.	S	Bend	trans	68.6	-42.8	170.7	-163.4	175.9	-179.9	171.5	1.4	116.5	D96 S240	R55-D96 WeakPolarHBondContact CA-OD1 3.23Å; R55-D96 PolarHBondContact N-OD1 3.36Å; R55-S240 VanDerWaalsContact O-CB 3.29Å; R55-S240 WeakPolarHBondContact O-CB 3.44Å
56	Y	89.2	Confident	88.3	Confident	98 Å²	98	38 Å²	38	38%	0.384	20%	0.199	S	C	.	.	S	Bend	trans	-130.3	126.3	-175.6	-59.2	-61.4	0	0	0	112.2	L54 M243	L54-Y56 PolarHBondContact O-N 2.79Å; Y56-M243 HydrophobicContact CD1-CE 3.83Å; Y56-M243 HydrophobicContact CD1-SD 3.6Å; Y56-M243 HydrophobicContact CE1-CE 3.78Å; Y56-M243 HydrophobicContact CE1-SD 4.16Å
57	P	91.9	Very high	88.5	Confident	12 Å²	12	39.9 Å²	39.9	8%	0.078	21%	0.209	C	C	.	.	P	Polyproline II helix	trans	-71.6	147.2	172	28.4	-30.3	0	0	0	110.7	F59 L92 M243 L247	P57-F59 HydrophobicContact CG-CE2 3.96Å; P57-F59 HydrophobicContact CG-CZ 4.23Å; P57-L92 HydrophobicContact CB-CB 4.39Å; P57-L92 HydrophobicContact CB-CD2 4.33Å; P57-L92 HydrophobicContact CG-CD2 4.31Å; P57-M243 HydrophobicContact CG-CB 3.82Å; P57-L247 HydrophobicContact CB-CD2 4.03Å
58	L	91.1	Very high	88.5	Confident	9 Å²	9	37.9 Å²	37.9	5%	0.047	20%	0.197	C	C	.	.	P	Polyproline II helix	trans	-85.1	119	171.5	177	58.5	0	0	0	109.4	L53 L62 T64 T114 V116 L132	L53-L58 HydrophobicContact CD1-CB 3.71Å; L58-L62 HydrophobicContact CD1-CB 4.04Å; L58-T64 HydrophobicContact CB-CG2 4.36Å; L58-T64 HydrophobicContact CD1-CG2 3.98Å; L58-T64 HydrophobicContact CD2-CG2 3.9Å; L58-T64 HydrophobicContact CG-CG2 4.3Å; L58-T114 WeakPolarHBondContact O-CB 3.36Å; L58-T114 PolarHBondContact O-OG1 3.24Å; L58-V116 HydrophobicContact CD2-CB 4.37Å; L58-V116 HydrophobicContact CD2-CG1 3.35Å; L58-V116 HydrophobicContact CG-CG1 4.45Å; L58-L132 HydrophobicContact CD2-CB 4.1Å
59	F	90.7	Very high	88.2	Confident	3 Å²	3	41.2 Å²	41.2	1%	0.013	22%	0.218	C	C	.	.	P	Polyproline II helix	trans	-84.4	154.4	174.7	-68.2	-94.1	0	0	0	112.4	P57 L62 D230 C233 I246 L247	P57-F59 HydrophobicContact CG-CE2 3.96Å; P57-F59 HydrophobicContact CG-CZ 4.23Å; F59-L62 HydrophobicContact CB-CD1 3.76Å; F59-L62 HydrophobicContact CB-CG 4.12Å; F59-L62 HydrophobicContact CD2-CD1 4.34Å; F59-L62 HydrophobicContact CG-CD1 4.45Å; F59-L62 WeakPolarHBondContact O-CB 3.46Å; F59-L62 PolarHBondContact O-N 2.77Å; F59-D230 HydrophobicContact CB-CB 3.98Å; F59-D230 HydrophobicContact CD1-CB 3.77Å; F59-D230 WeakPolarHBondContact CD1-OD1 3.38Å; F59-D230 HydrophobicContact CG-CB 4.07Å; F59-C233 HydrophobicContact CE2-CB 4.23Å; F59-C233 HydrophobicContact CZ-CB 3.96Å; F59-I246 HydrophobicContact CE1-CG2 4.07Å; F59-I246 HydrophobicContact CZ-CG2 4.48Å; F59-L247 HydrophobicContact CD1-CD1 3.67Å; F59-L247 HydrophobicContact CE1-CB 3.93Å; F59-L247 HydrophobicContact CE1-CD1 3.96Å; F59-L247 HydrophobicContact CG-CD1 4.35Å; F59-L247 HydrophobicContact CZ-CB 4.43Å
60	P	88.5	Confident	88	Confident	11 Å²	11	43.4 Å²	43.4	7%	0.071	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.2	144.3	171.2	-27.6	37.3	0	0	0	113	L62 T114 R137	P60-L62 PolarHBondContact O-N 3.3Å; P60-T114 HydrophobicContact CG-CG2 4.41Å; P60-R137 HydrophobicContact CG-CG 3.91Å
61	K	83.2	Confident	87.6	Confident	95 Å²	95	47.3 Å²	47.3	41%	0.413	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.5	2.6	-176.3	-55.3	174.6	178.6	176.1	0	115.5	G134 Y227	K61-G134 WeakPolarHBondContact CA-O 3.41Å; K61-G134 PolarHBondContact N-O 3.49Å; K61-Y227 HydrophobicContact CB-CD2 4Å; K61-Y227 HydrophobicContact CB-CE2 3.62Å; K61-Y227 HydrophobicContact CD-CD2 3.69Å; K61-Y227 HydrophobicContact CD-CE2 4Å; K61-Y227 HydrophobicContact CD-CG 4.25Å; K61-Y227 HydrophobicContact CG-CD2 4.42Å; K61-Y227 HydrophobicContact CG-CE2 4.46Å
62	L	86.9	Confident	87.2	Confident	17 Å²	17	49.5 Å²	49.5	9%	0.089	27%	0.269	C	S	.	.			trans	-97.2	161.1	170.3	-55.8	-171.2	0	0	0	110.3	L58 F59 P60 G134 T214 Y227 L231 A234	L58-L62 HydrophobicContact CD1-CB 4.04Å; F59-L62 HydrophobicContact CB-CD1 3.76Å; F59-L62 HydrophobicContact CB-CG 4.12Å; F59-L62 HydrophobicContact CD2-CD1 4.34Å; F59-L62 HydrophobicContact CG-CD1 4.45Å; F59-L62 WeakPolarHBondContact O-CB 3.46Å; F59-L62 PolarHBondContact O-N 2.77Å; P60-L62 PolarHBondContact O-N 3.3Å; L62-G134 PolarHBondContact O-N 2.81Å; L62-T214 HydrophobicContact CD2-CG2 3.34Å; L62-Y227 HydrophobicContact CD2-CE2 4.42Å; L62-L231 HydrophobicContact CD2-CD1 4.48Å; L62-A234 HydrophobicContact CD1-CB 3.45Å; L62-A234 VanDerWaalsContact CD1-CB 3.45Å
63	A	86.1	Confident	86.9	Confident	58 Å²	58	48.8 Å²	48.8	48%	0.479	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	146.8	174.5	0	0	0	0	0	110.4	L132 D133	A63-L132 CarbonylContact C-O 3.59Å; A63-L132 WeakPolarHBondContact CA-O 3.21Å; A63-D133 VanDerWaalsContact CB-OD1 3.32Å; A63-D133 WeakPolarHBondContact CB-OD1 3.41Å
64	T	87.9	Confident	86.7	Confident	53 Å²	53	48.2 Å²	48.2	33%	0.325	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	162.3	170.8	-165.1	0	0	0	0	110.8	L58 V66 L132	L58-T64 HydrophobicContact CB-CG2 4.36Å; L58-T64 HydrophobicContact CD1-CG2 3.98Å; L58-T64 HydrophobicContact CD2-CG2 3.9Å; L58-T64 HydrophobicContact CG-CG2 4.3Å; T64-V66 HydrophobicContact CG2-CG2 4.07Å; T64-L132 HydrophobicContact CG2-CB 4.34Å; T64-L132 HydrophobicContact CG2-CD1 4.48Å; T64-L132 PolarHBondContact N-O 2.87Å; T64-L132 PolarHBondContact O-N 3.43Å
65	V	88.6	Confident	86.7	Confident	68 Å²	68	49.3 Å²	49.3	41%	0.412	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	128	176.7	-177.4	0	0	0	0	108.4	R129 M130 I131	V65-R129 HydrophobicContact CG1-CG 3.82Å; V65-M130 WeakPolarHBondContact CA-O 3.42Å; V65-I131 HydrophobicContact CG2-CG1 4.3Å
66	V	88.9	Confident	86.8	Confident	24 Å²	24	42.5 Å²	42.5	15%	0.145	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	141.5	177.1	-179.6	0	0	0	0	109.3	L53 T64 V68 M130 L132	L53-V66 HydrophobicContact CD2-CG2 3.77Å; T64-V66 HydrophobicContact CG2-CG2 4.07Å; V66-V68 HydrophobicContact CG1-CG2 4.15Å; V66-M130 PolarHBondContact N-O 3.06Å; V66-M130 PolarHBondContact O-N 2.82Å; V66-L132 HydrophobicContact CB-CD1 3.99Å; V66-L132 HydrophobicContact CG2-CD1 3.45Å; V66-L132 VanDerWaalsContact CG2-CD1 3.45Å; V66-L132 HydrophobicContact CG2-CG 4.27Å
67	V	87.9	Confident	86.6	Confident	77 Å²	77	37.9 Å²	37.9	47%	0.467	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	132.6	172.3	-177.3	0	0	0	0	107.9	R127 M128 R129	V67-R127 HydrophobicContact CG1-CB 4.34Å; V67-M128 CarbonylContact C-O 3.55Å; V67-M128 WeakPolarHBondContact CA-O 3.5Å; V67-R129 HydrophobicContact CG2-CB 4.32Å; V67-R129 HydrophobicContact CG2-CG 4.22Å
68	V	87.1	Confident	86.4	Confident	4 Å²	4	40.8 Å²	40.8	2%	0.024	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	130.6	178.3	179.7	0	0	0	0	108.7	L51 V66 L73 M74 E101 R127 M128 M130	L51-V68 HydrophobicContact CD2-CG2 4.26Å; V66-V68 HydrophobicContact CG1-CG2 4.15Å; V68-L73 HydrophobicContact CG1-CB 4.13Å; V68-L73 HydrophobicContact CG1-CD2 3.68Å; V68-L73 HydrophobicContact CG1-CG 3.91Å; V68-L73 HydrophobicContact CG2-CD2 4.43Å; V68-M74 HydrophobicContact CB-CG 4.5Å; V68-M74 HydrophobicContact CG1-CG 3.94Å; V68-E101 WeakPolarHBondContact CA-OE2 3.29Å; V68-E101 WeakPolarHBondContact CG1-OE2 3.26Å; V68-R127 CarbonylContact O-C 3.52Å; V68-R127 WeakPolarHBondContact O-CA 3.22Å; V68-M128 PolarHBondContact N-O 2.88Å; V68-M128 PolarHBondContact O-N 3.38Å; V68-M130 HydrophobicContact CG2-CE 3.66Å
69	T	84.4	Confident	86	Confident	71 Å²	71	45.4 Å²	45.4	44%	0.436	25%	0.251	S	S	.	.			trans	-114.6	-16	177.3	61.8	0	0	0	0	112.3	P71 E101 R127	T69-P71 VanDerWaalsContact O-CD 3.29Å; T69-P71 WeakPolarHBondContact O-CD 3.39Å; T69-E101 WeakPolarHBondContact CB-OE1 3.29Å; T69-E101 PolarHBondContact N-OE1 2.79Å; T69-E101 PolarHBondContact N-OE2 3.44Å; T69-E101 PolarHBondContact OG1-OE1 3.21Å; T69-E101 PolarHBondContact OG1-OE2 3.2Å; T69-R127 HydrophobicContact CG2-CB 3.91Å
70	H	85.4	Confident	85.6	Confident	46 Å²	46	47.1 Å²	47.1	21%	0.213	26%	0.258	C	S	.	.			trans	-67.6	117.6	-177.5	-168.6	-87.6	0	0	0	112.2	S72 L73 M74 E101 V102	H70-S72 PolarHBondContact ND1-N 3.03Å; H70-S72 PolarHBondContact O-N 2.91Å; H70-L73 HydrophobicContact CB-CB 4.17Å; H70-L73 PolarHBondContact O-N 2.77Å; H70-L73 VanDerWaalsContact O-N 3.12Å; H70-M74 WeakPolarHBondContact O-CG 3.39Å; H70-M74 PolarHBondContact O-N 2.87Å; H70-E101 HydrophobicContact CB-CB 4.49Å; H70-E101 PolarHBondContact N-OE2 3.36Å; H70-V102 HydrophobicContact CB-CG1 4.1Å
71	P	81.9	Confident	85.5	Confident	85 Å²	85	48.3 Å²	48.3	55%	0.552	26%	0.263	S	S	*	.	H	α-helix	trans	-59.2	-40.8	-170.8	-26.8	34.5	0	0	0	114.5	T69 M74 N75	T69-P71 VanDerWaalsContact O-CD 3.29Å; T69-P71 WeakPolarHBondContact O-CD 3.39Å; P71-M74 PolarHBondContact O-N 3.14Å; P71-N75 WeakPolarHBondContact O-CB 3.49Å; P71-N75 VanDerWaalsContact O-CG 3.25Å; P71-N75 PolarHBondContact O-N 3.4Å; P71-N75 PolarHBondContact O-ND2 3.44Å
72	S	82.9	Confident	85.4	Confident	50 Å²	50	52.5 Å²	52.5	35%	0.35	28%	0.282	S	S	.	.	H	α-helix	trans	-67.7	-37	-179.4	-47.8	0	0	0	0	112.1	H70 N75 I76	H70-S72 PolarHBondContact ND1-N 3.03Å; H70-S72 PolarHBondContact O-N 2.91Å; S72-N75 PolarHBondContact O-N 2.9Å; S72-I76 WeakPolarHBondContact O-CG1 3.41Å; S72-I76 PolarHBondContact O-N 2.82Å; S72-I76 VanDerWaalsContact O-N 3.12Å
73	L	84.7	Confident	85.3	Confident	3 Å²	3	56.7 Å²	56.7	2%	0.016	30%	0.303	C	S	.	.	H	α-helix	trans	-72.4	-43.2	179.1	-177.2	56.5	0	0	0	110	L51 V68 H70 N75 I76 I77 L168	L51-L73 HydrophobicContact CD2-CD1 4.42Å; L51-L73 HydrophobicContact CD2-CD2 4.06Å; L51-L73 HydrophobicContact CD2-CG 4.49Å; V68-L73 HydrophobicContact CG1-CB 4.13Å; V68-L73 HydrophobicContact CG1-CD2 3.68Å; V68-L73 HydrophobicContact CG1-CG 3.91Å; V68-L73 HydrophobicContact CG2-CD2 4.43Å; H70-L73 HydrophobicContact CB-CB 4.17Å; H70-L73 PolarHBondContact O-N 2.77Å; H70-L73 VanDerWaalsContact O-N 3.12Å; L73-N75 VanDerWaalsContact C-N 3.3Å; L73-N75 PolarHBondContact O-N 3.17Å; L73-I76 PolarHBondContact O-N 2.83Å; L73-I77 HydrophobicContact CD1-CD1 4.19Å; L73-I77 HydrophobicContact CD1-CG1 4.48Å; L73-I77 HydrophobicContact CG-CD1 3.91Å; L73-I77 WeakPolarHBondContact O-CD1 3.48Å; L73-I77 VanDerWaalsContact O-CG1 3.27Å; L73-I77 WeakPolarHBondContact O-CG1 3.37Å; L73-I77 PolarHBondContact O-N 3.46Å; L73-L168 HydrophobicContact CB-CD2 4.12Å
74	M	84.8	Confident	85	Confident	4 Å²	4	55.7 Å²	55.7	2%	0.02	30%	0.299	C	S	.	.	H	α-helix	trans	-57.1	-42.2	172.6	-69.9	174.9	60.6	0	0	112	V68 H70 P71 I77 R78 G125 M128	V68-M74 HydrophobicContact CB-CG 4.5Å; V68-M74 HydrophobicContact CG1-CG 3.94Å; H70-M74 WeakPolarHBondContact O-CG 3.39Å; H70-M74 PolarHBondContact O-N 2.87Å; P71-M74 PolarHBondContact O-N 3.14Å; M74-I77 PolarHBondContact O-N 3.36Å; M74-R78 WeakPolarHBondContact O-CB 3.2Å; M74-R78 VanDerWaalsContact O-CG 3.24Å; M74-R78 WeakPolarHBondContact O-CG 3.33Å; M74-R78 PolarHBondContact O-N 3.24Å; M74-G125 WeakPolarHBondContact CE-O 3.39Å; M74-M128 HydrophobicContact CE-CB 4.11Å; M74-M128 HydrophobicContact CG-CB 4.18Å
75	N	85.2	Confident	84.9	Confident	92 Å²	92	56.4 Å²	56.4	49%	0.492	30%	0.299	S	S	.	.	H	α-helix	trans	-65.6	-41.4	178	-76	-21.9	0	0	0	112.6	P71 S72 L73 R78 R79	P71-N75 WeakPolarHBondContact O-CB 3.49Å; P71-N75 VanDerWaalsContact O-CG 3.25Å; P71-N75 PolarHBondContact O-N 3.4Å; P71-N75 PolarHBondContact O-ND2 3.44Å; S72-N75 PolarHBondContact O-N 2.9Å; L73-N75 VanDerWaalsContact C-N 3.3Å; L73-N75 PolarHBondContact O-N 3.17Å; N75-R78 PolarHBondContact O-N 3.2Å; N75-R79 WeakPolarHBondContact O-CB 3.31Å; N75-R79 PolarHBondContact O-N 3.33Å
76	I	84.9	Confident	84.9	Confident	13 Å²	13	53.3 Å²	53.3	7%	0.067	28%	0.28	C	S	.	.	H	α-helix	trans	-62.4	-45.6	174.7	-70.5	167.4	0	0	0	110.5	P49 S72 L73 R79 K80 L168 L169	P49-I76 HydrophobicContact CB-CG2 4.13Å; P49-I76 HydrophobicContact CG-CG2 3.82Å; S72-I76 WeakPolarHBondContact O-CG1 3.41Å; S72-I76 PolarHBondContact O-N 2.82Å; S72-I76 VanDerWaalsContact O-N 3.12Å; L73-I76 PolarHBondContact O-N 2.83Å; I76-R79 WeakPolarHBondContact O-CB 3.5Å; I76-R79 PolarHBondContact O-N 3.5Å; I76-K80 HydrophobicContact CG2-CG 4.39Å; I76-K80 WeakPolarHBondContact O-CB 3.44Å; I76-K80 WeakPolarHBondContact O-CG 3.11Å; I76-K80 PolarHBondContact O-N 2.98Å; I76-L168 HydrophobicContact CD1-CB 3.53Å; I76-L168 HydrophobicContact CD1-CD1 3.66Å; I76-L168 HydrophobicContact CD1-CG 4.16Å; I76-L169 HydrophobicContact CG2-CD2 4.23Å
77	I	86.4	Confident	85.1	Confident	1 Å²	1	52.4 Å²	52.4	1%	0.005	27%	0.274	C	S	.	.	H	α-helix	trans	-61.8	-49.1	178.1	-68.2	161.6	0	0	0	110.8	L51 L73 M74 R79 K80 I81 I118 M128 M130	L51-I77 HydrophobicContact CD2-CD1 4.22Å; L73-I77 HydrophobicContact CD1-CD1 4.19Å; L73-I77 HydrophobicContact CD1-CG1 4.48Å; L73-I77 HydrophobicContact CG-CD1 3.91Å; L73-I77 WeakPolarHBondContact O-CD1 3.48Å; L73-I77 VanDerWaalsContact O-CG1 3.27Å; L73-I77 WeakPolarHBondContact O-CG1 3.37Å; L73-I77 PolarHBondContact O-N 3.46Å; M74-I77 PolarHBondContact O-N 3.36Å; I77-R79 VanDerWaalsContact C-N 3.25Å; I77-R79 PolarHBondContact O-N 2.75Å; I77-K80 PolarHBondContact O-N 3.34Å; I77-I81 HydrophobicContact CG2-CD1 3.61Å; I77-I81 HydrophobicContact CG2-CG1 4.33Å; I77-I81 VanDerWaalsContact O-CG1 3.29Å; I77-I81 WeakPolarHBondContact O-CG1 3.34Å; I77-I81 PolarHBondContact O-N 2.98Å; I77-I118 HydrophobicContact CG2-CD1 3.87Å; I77-M128 HydrophobicContact CB-SD 4.22Å; I77-M128 HydrophobicContact CG2-SD 3.56Å; I77-M128 VanDerWaalsContact CG2-SD 3.56Å; I77-M130 HydrophobicContact CD1-CE 3.7Å; I77-M130 HydrophobicContact CD1-SD 4Å; I77-M130 HydrophobicContact CG2-SD 3.71Å
78	R	86.1	Confident	85.3	Confident	72 Å²	72	48.8 Å²	48.8	27%	0.272	25%	0.252	S	S	.	.	H	α-helix	trans	-54.1	-42.6	174.7	-75.4	172.2	178.1	159.1	2.1	111.5	M74 N75 K82 D123 G125 M128	M74-R78 WeakPolarHBondContact O-CB 3.2Å; M74-R78 VanDerWaalsContact O-CG 3.24Å; M74-R78 WeakPolarHBondContact O-CG 3.33Å; M74-R78 PolarHBondContact O-N 3.24Å; N75-R78 PolarHBondContact O-N 3.2Å; R78-K82 WeakPolarHBondContact O-CB 3.24Å; R78-K82 VanDerWaalsContact O-CG 3.31Å; R78-K82 WeakPolarHBondContact O-CG 3.4Å; R78-K82 PolarHBondContact O-N 2.91Å; R78-D123 IonicContact CZ-OD1 3.21Å; R78-D123 IonicContact CZ-OD2 3.51Å; R78-D123 VanDerWaalsContact CZ-OD2 3.23Å; R78-D123 IonicContact NE-OD1 2.72Å; R78-D123 IonicContact NE-OD2 2.65Å; R78-D123 PolarHBondContact NE-OD2 2.78Å; R78-D123 VanDerWaalsContact NH2-CG 3.28Å; R78-D123 IonicContact NH2-OD1 2.74Å; R78-D123 PolarHBondContact NH2-OD1 3.06Å; R78-D123 IonicContact NH2-OD2 3.76Å; R78-D123 PolarHBondContact NH2-OD2 3.29Å; R78-G125 PolarHBondContact NH2-O 2.9Å; R78-G125 VanDerWaalsContact NH2-O 3.16Å; R78-M128 HydrophobicContact CG-CE 3.55Å
79	R	84.4	Confident	85.5	Confident	106 Å²	106	48.6 Å²	48.6	40%	0.4	25%	0.251	S	S	.	.	H	α-helix	trans	-66.4	-46.4	178.2	-173.7	180	179.3	-167	-1.4	111.6	N75 I76 I77 I81 K82 L83	N75-R79 WeakPolarHBondContact O-CB 3.31Å; N75-R79 PolarHBondContact O-N 3.33Å; I76-R79 WeakPolarHBondContact O-CB 3.5Å; I76-R79 PolarHBondContact O-N 3.5Å; I77-R79 VanDerWaalsContact C-N 3.25Å; I77-R79 PolarHBondContact O-N 2.75Å; R79-I81 VanDerWaalsContact C-N 3.34Å; R79-I81 PolarHBondContact O-N 3.36Å; R79-K82 PolarHBondContact O-N 2.81Å; R79-L83 HydrophobicContact CG-CD1 4.16Å; R79-L83 WeakPolarHBondContact O-CG 3.42Å; R79-L83 PolarHBondContact O-N 2.83Å
80	K	82.3	Confident	85.9	Confident	39 Å²	39	45.3 Å²	45.3	17%	0.17	23%	0.231	C	C	.	.	H	α-helix	trans	-62.4	-39.8	178.4	-76.4	-68.9	-173.9	177.9	0	112.2	P49 I76 I77 L83 G84 Q85	P49-K80 HydrophobicContact CG-CG 4.01Å; I76-K80 HydrophobicContact CG2-CG 4.39Å; I76-K80 WeakPolarHBondContact O-CB 3.44Å; I76-K80 WeakPolarHBondContact O-CG 3.11Å; I76-K80 PolarHBondContact O-N 2.98Å; I77-K80 PolarHBondContact O-N 3.34Å; K80-L83 PolarHBondContact O-N 3.48Å; K80-G84 PolarHBondContact O-N 3.34Å; K80-Q85 WeakPolarHBondContact CB-O 3.46Å; K80-Q85 HydrophobicContact CD-CB 4.46Å; K80-Q85 CarbonylContact O-C 3.57Å; K80-Q85 WeakPolarHBondContact O-CA 3.28Å; K80-Q85 PolarHBondContact O-N 2.86Å
81	I	84.6	Confident	86.4	Confident	36 Å²	36	43.1 Å²	43.1	19%	0.185	22%	0.221	C	C	.	.	H	α-helix	trans	-63.2	-47.1	173	-67.8	165.9	0	0	0	111.1	L36 I77 R79 L83 G84 P86 V121	L36-I81 HydrophobicContact CD1-CG1 4.5Å; L36-I81 HydrophobicContact CD1-CG2 4.34Å; L36-I81 HydrophobicContact CD2-CG2 3.67Å; I77-I81 HydrophobicContact CG2-CD1 3.61Å; I77-I81 HydrophobicContact CG2-CG1 4.33Å; I77-I81 VanDerWaalsContact O-CG1 3.29Å; I77-I81 WeakPolarHBondContact O-CG1 3.34Å; I77-I81 PolarHBondContact O-N 2.98Å; R79-I81 VanDerWaalsContact C-N 3.34Å; R79-I81 PolarHBondContact O-N 3.36Å; I81-L83 PolarHBondContact O-N 3.18Å; I81-G84 PolarHBondContact O-N 2.8Å; I81-P86 HydrophobicContact CG1-CB 4.23Å; I81-V121 HydrophobicContact CD1-CB 4.31Å; I81-V121 HydrophobicContact CD1-CG1 4.42Å; I81-V121 HydrophobicContact CD1-CG2 3.55Å
82	K	83.1	Confident	86.9	Confident	184 Å²	184	39.1 Å²	39.1	80%	0.8	20%	0.195	S	C	*	.	H	α-helix	trans	-61.1	-31.5	176.6	-76.6	178.5	-179.6	-176.1	0	113.4	R78 R79 G84	R78-K82 WeakPolarHBondContact O-CB 3.24Å; R78-K82 VanDerWaalsContact O-CG 3.31Å; R78-K82 WeakPolarHBondContact O-CG 3.4Å; R78-K82 PolarHBondContact O-N 2.91Å; R79-K82 PolarHBondContact O-N 2.81Å; K82-G84 PolarHBondContact O-N 3.13Å
83	L	83.5	Confident	87.2	Confident	104 Å²	104	36.9 Å²	36.9	55%	0.545	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.1	1.3	174.9	-70	170.7	0	0	0	113.3	R79 K80 I81 Q85	R79-L83 HydrophobicContact CG-CD1 4.16Å; R79-L83 WeakPolarHBondContact O-CG 3.42Å; R79-L83 PolarHBondContact O-N 2.83Å; K80-L83 PolarHBondContact O-N 3.48Å; I81-L83 PolarHBondContact O-N 3.18Å; L83-Q85 PolarHBondContact O-N 3.34Å
84	G	81	Confident	87.4	Confident	37 Å²	37	40.9 Å²	40.9	38%	0.381	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	70	19.8	-176.1	0	0	0	0	0	113.6	K80 I81 K82 P86	K80-G84 PolarHBondContact O-N 3.34Å; I81-G84 PolarHBondContact O-N 2.8Å; K82-G84 PolarHBondContact O-N 3.13Å; G84-P86 VanDerWaalsContact O-CD 3.28Å; G84-P86 WeakPolarHBondContact O-CD 3.49Å
85	Q	84.6	Confident	87.4	Confident	69 Å²	69	45 Å²	45	32%	0.322	22%	0.218	S	C	.	.			trans	-118.9	64.6	-179.9	-63.7	178.1	-5.4	0	0	110.8	F45 K80 L83 Y87	F45-Q85 HydrophobicContact CE2-CG 4.45Å; F45-Q85 HydrophobicContact CZ-CB 4.32Å; F45-Q85 HydrophobicContact CZ-CG 4.45Å; K80-Q85 WeakPolarHBondContact CB-O 3.46Å; K80-Q85 HydrophobicContact CD-CB 4.46Å; K80-Q85 CarbonylContact O-C 3.57Å; K80-Q85 WeakPolarHBondContact O-CA 3.28Å; K80-Q85 PolarHBondContact O-N 2.86Å; L83-Q85 PolarHBondContact O-N 3.34Å; Q85-Y87 HydrophobicContact CB-CD2 4.19Å; Q85-Y87 HydrophobicContact CB-CE2 4.49Å; Q85-Y87 PolarHBondContact O-N 3.4Å
86	P	89	Confident	87	Confident	3 Å²	3	43.8 Å²	43.8	2%	0.019	21%	0.212	C	C	.	.			trans	-76.7	59.9	-175.9	35.8	-38.4	0	0	0	111.8	L36 I81 G84 Q117 I118	L36-P86 HydrophobicContact CD1-CB 3.69Å; L36-P86 HydrophobicContact CD1-CG 4.17Å; I81-P86 HydrophobicContact CG1-CB 4.23Å; G84-P86 VanDerWaalsContact O-CD 3.28Å; G84-P86 WeakPolarHBondContact O-CD 3.49Å; P86-Q117 CarbonylContact O-C 3.6Å; P86-Q117 WeakPolarHBondContact O-CA 3.12Å; P86-I118 HydrophobicContact CB-CB 4.18Å; P86-I118 PolarHBondContact O-N 3.46Å
87	Y	92.3	Very high	86.8	Confident	5 Å²	5	50 Å²	50	2%	0.02	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	146.4	-176.3	-54.4	-61.3	0	0	0	111.5	V39 Q40 V41 P42 F45 P49 Q85 F115 V116 Q117	V39-Y87 WeakPolarHBondContact CG1-OH 3.07Å; Q40-Y87 PolarHBondContact O-OH 2.83Å; V41-Y87 HydrophobicContact CB-CE1 4.49Å; V41-Y87 HydrophobicContact CG1-CE1 4.06Å; V41-Y87 HydrophobicContact CG2-CE1 4.28Å; P42-Y87 VanDerWaalsContact CD-OH 3.28Å; P42-Y87 WeakPolarHBondContact CD-OH 3.4Å; P42-Y87 HydrophobicContact CG-CD2 4.31Å; P42-Y87 HydrophobicContact CG-CE2 3.86Å; F45-Y87 HydrophobicContact CE2-CD2 4.38Å; F45-Y87 HydrophobicContact CZ-CD2 4.37Å; P49-Y87 VanDerWaalsContact CD-O 3.31Å; P49-Y87 WeakPolarHBondContact CD-O 3.29Å; Q85-Y87 HydrophobicContact CB-CD2 4.19Å; Q85-Y87 HydrophobicContact CB-CE2 4.49Å; Q85-Y87 PolarHBondContact O-N 3.4Å; Y87-F115 AromaticContact CD1-CE1 3.71Å; Y87-F115 HydrophobicContact CD1-CE1 3.71Å; Y87-F115 AromaticContact CD1-CZ 3.58Å; Y87-F115 HydrophobicContact CD1-CZ 3.58Å; Y87-F115 HydrophobicContact CD2-CZ 4.27Å; Y87-F115 HydrophobicContact CE1-CE1 4.32Å; Y87-F115 HydrophobicContact CE1-CZ 4.4Å; Y87-F115 HydrophobicContact CG-CE1 4.16Å; Y87-F115 HydrophobicContact CG-CE2 4.36Å; Y87-F115 AromaticContact CG-CZ 3.53Å; Y87-F115 HydrophobicContact CG-CZ 3.53Å; Y87-V116 WeakPolarHBondContact CA-O 3.39Å; Y87-Q117 HydrophobicContact CD1-CB 4.17Å; Y87-Q117 HydrophobicContact CD1-CG 4.29Å; Y87-Q117 HydrophobicContact CE1-CB 4.21Å; Y87-Q117 HydrophobicContact CE1-CG 4.01Å
88	A	91.8	Very high	86.4	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	168.5	175.2	0	0	0	0	0	111.2	P49 L51 V116	P49-A88 HydrophobicContact CB-CB 4.33Å; L51-A88 HydrophobicContact CD1-CB 3.5Å; L51-A88 HydrophobicContact CG-CB 3.89Å; A88-V116 HydrophobicContact CB-CG2 3.76Å; A88-V116 PolarHBondContact N-O 3.42Å; A88-V116 WeakPolarHBondContact O-CG2 3.18Å; A88-V116 PolarHBondContact O-N 3.13Å
89	G	92.6	Very high	85.8	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	118.4	171.6	0	0	0	0	0	110.2	P49 L51	P49-G89 PolarHBondContact O-N 2.81Å; L51-G89 PolarHBondContact N-O 3.06Å
90	A	93.5	Very high	85.4	Confident	3 Å²	3	56.2 Å²	56.2	3%	0.025	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	120.5	179.7	0	0	0	0	0	110.7	L51 L53 G113 T114 V116	L51-A90 VanDerWaalsContact O-CA 3.31Å; L51-A90 WeakPolarHBondContact O-CA 3.45Å; L53-A90 HydrophobicContact CD1-CB 3.85Å; L53-A90 HydrophobicContact CG-CB 4.1Å; A90-G113 CarbonylContact O-C 3.33Å; A90-G113 WeakPolarHBondContact O-CA 3.44Å; A90-T114 PolarHBondContact N-O 3.38Å; A90-T114 PolarHBondContact O-N 2.89Å; A90-V116 HydrophobicContact CB-CG1 3.71Å; A90-V116 HydrophobicContact CB-CG2 4.46Å
91	F	94.1	Very high	84.9	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	137	-175.7	-67.3	-92.6	0	0	0	110.8	L50 L51 P52 L53 L109 G113 I138 L140 V170 T172	L50-F91 HydrophobicContact CD1-CB 4.28Å; L50-F91 HydrophobicContact CD1-CD2 3.48Å; L50-F91 VanDerWaalsContact CD1-CD2 3.48Å; L50-F91 HydrophobicContact CD1-CE2 4.17Å; L50-F91 HydrophobicContact CD1-CG 4.19Å; L51-F91 PolarHBondContact O-N 3.2Å; P52-F91 CarbonylContact C-O 3.59Å; P52-F91 WeakPolarHBondContact CA-O 3.18Å; L53-F91 PolarHBondContact N-O 3.43Å; F91-L109 HydrophobicContact CB-CD1 4.3Å; F91-L109 HydrophobicContact CB-CD2 4.36Å; F91-G113 VanDerWaalsContact CE1-N 3.31Å; F91-I138 HydrophobicContact CE1-CG1 4.4Å; F91-I138 HydrophobicContact CE2-CD1 4Å; F91-I138 HydrophobicContact CE2-CG1 4.44Å; F91-I138 HydrophobicContact CZ-CD1 3.79Å; F91-I138 HydrophobicContact CZ-CG1 3.79Å; F91-L140 HydrophobicContact CD1-CB 4.23Å; F91-L140 HydrophobicContact CD1-CD1 4.26Å; F91-L140 HydrophobicContact CD2-CD1 4.32Å; F91-L140 HydrophobicContact CE1-CB 3.64Å; F91-L140 HydrophobicContact CE1-CD1 4.26Å; F91-L140 HydrophobicContact CE2-CD1 4.28Å; F91-L140 HydrophobicContact CG-CD1 4.29Å; F91-L140 HydrophobicContact CZ-CB 3.9Å; F91-L140 HydrophobicContact CZ-CD1 4.25Å; F91-L140 HydrophobicContact CZ-CG 4.5Å; F91-V170 HydrophobicContact CE2-CG2 4.33Å; F91-T172 HydrophobicContact CE2-CG2 4.23Å; F91-T172 HydrophobicContact CZ-CG2 3.89Å
92	L	92.8	Very high	84.7	Confident	1 Å²	1	55.9 Å²	55.9	1%	0.005	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	142.7	179.6	-173.2	67.5	0	0	0	111.1	L53 P57 L109 Y110 Q244	L53-L92 HydrophobicContact CB-CD1 4.41Å; P57-L92 HydrophobicContact CB-CB 4.39Å; P57-L92 HydrophobicContact CB-CD2 4.33Å; P57-L92 HydrophobicContact CG-CD2 4.31Å; L92-L109 WeakPolarHBondContact O-CA 3.44Å; L92-Y110 HydrophobicContact CB-CD2 3.94Å; L92-Y110 HydrophobicContact CD2-CD2 4.02Å; L92-Y110 HydrophobicContact CD2-CE2 3.98Å; L92-Y110 HydrophobicContact CG-CD2 4.04Å; L92-Y110 HydrophobicContact CG-CE2 4.27Å; L92-Y110 WeakPolarHBondContact O-CD2 3.36Å; L92-Y110 PolarHBondContact O-N 3.49Å; L92-Q244 HydrophobicContact CD2-CB 3.92Å; L92-Q244 HydrophobicContact CD2-CG 4.33Å
93	K	90	Very high	84.5	Confident	3 Å²	3	47.1 Å²	47.1	1%	0.013	24%	0.242	C	C	.	.	B	Isolated β-bridge	trans	-79.3	145.6	170.2	-67.7	173.1	-177.6	164.8	0	112	P52 L53 L54 N95 N98 K100 E108 L109	P52-K93 HydrophobicContact CB-CD 4.4Å; P52-K93 VanDerWaalsContact CB-CE 3.42Å; P52-K93 HydrophobicContact CB-CG 4.2Å; L53-K93 PolarHBondContact O-N 3.16Å; L53-K93 VanDerWaalsContact O-N 3.11Å; L54-K93 HydrophobicContact CD2-CD 3.85Å; L54-K93 HydrophobicContact CG-CD 4.29Å; K93-N95 VanDerWaalsContact C-N 3.33Å; K93-N98 WeakPolarHBondContact CD-O 3.41Å; K93-N98 PolarHBondContact NZ-O 2.89Å; K93-K100 VanDerWaalsContact CE-O 3.31Å; K93-K100 WeakPolarHBondContact CE-O 3.47Å; K93-K100 PolarHBondContact NZ-O 2.83Å; K93-E108 WeakPolarHBondContact CA-O 3.44Å; K93-L109 HydrophobicContact CB-CD2 4.41Å; K93-L109 HydrophobicContact CG-CD2 3.69Å
94	K	88.3	Confident	84.3	Confident	86 Å²	86	45.7 Å²	45.7	37%	0.374	24%	0.235	S	C	.	.	S	Bend	trans	-73.1	-25.4	173.8	-67.9	-178.5	-176.1	149.5	0	113.3	D107 E108 L109 Y110	K94-D107 WeakPolarHBondContact CD-O 3.21Å; K94-D107 WeakPolarHBondContact CE-O 3.46Å; K94-D107 PolarHBondContact NZ-O 3.19Å; K94-E108 PolarHBondContact N-O 3.46Å; K94-L109 WeakPolarHBondContact CE-O 3.21Å; K94-L109 PolarHBondContact NZ-O 3.28Å; K94-Y110 HydrophobicContact CB-CE2 4.32Å; K94-Y110 HydrophobicContact CG-CD1 4.36Å; K94-Y110 HydrophobicContact CG-CD2 3.98Å; K94-Y110 HydrophobicContact CG-CE1 4.23Å; K94-Y110 HydrophobicContact CG-CE2 3.85Å; K94-Y110 HydrophobicContact CG-CG 4.25Å
95	N	85	Confident	84.3	Confident	91 Å²	91	46.1 Å²	46.1	49%	0.487	23%	0.232	S	C	.	.			trans	-112.8	106	178.7	-173.8	-1.2	0	0	0	110.5	K93 N97 N98	K93-N95 VanDerWaalsContact C-N 3.33Å; N95-N97 PolarHBondContact O-N 3.5Å; N95-N97 WeakPolarHBondContact OD1-CB 3.42Å; N95-N97 PolarHBondContact OD1-N 2.93Å; N95-N97 VanDerWaalsContact OD1-N 3.11Å; N95-N98 HydrophobicContact CB-CB 4.39Å; N95-N98 PolarHBondContact O-N 3.15Å; N95-N98 VanDerWaalsContact O-N 3.15Å
96	D	77.1	Confident	84.2	Confident	66 Å²	66	44.4 Å²	44.4	35%	0.353	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64	-19.5	-179.6	-72	-33.7	0	0	0	113.5	R55 S240	R55-D96 WeakPolarHBondContact CA-OD1 3.23Å; R55-D96 PolarHBondContact N-OD1 3.36Å; D96-S240 WeakPolarHBondContact OD2-CB 3.47Å; D96-S240 PolarHBondContact OD2-OG 2.91Å
97	N	80	Confident	84	Confident	144 Å²	144	49.6 Å²	49.6	77%	0.77	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.4	-8.5	178.6	-63.5	-26.9	0	0	0	113.4	N95 E99	N95-N97 PolarHBondContact O-N 3.5Å; N95-N97 WeakPolarHBondContact OD1-CB 3.42Å; N95-N97 PolarHBondContact OD1-N 2.93Å; N95-N97 VanDerWaalsContact OD1-N 3.11Å; N97-E99 PolarHBondContact O-N 2.77Å
98	N	77.5	Confident	83.7	Confident	33 Å²	33	51.9 Å²	51.9	18%	0.176	26%	0.264	C	S	.	.			trans	-88.5	88.7	-178.7	-176.1	6.1	0	0	0	111.5	L54 K93 N95 K100 E108	L54-N98 WeakPolarHBondContact CD2-O 3.21Å; K93-N98 WeakPolarHBondContact CD-O 3.41Å; K93-N98 PolarHBondContact NZ-O 2.89Å; N95-N98 HydrophobicContact CB-CB 4.39Å; N95-N98 PolarHBondContact O-N 3.15Å; N95-N98 VanDerWaalsContact O-N 3.15Å; N98-K100 PolarHBondContact O-N 2.89Å; N98-K100 VanDerWaalsContact O-N 3.17Å; N98-K100 WeakPolarHBondContact OD1-CB 3.39Å; N98-K100 VanDerWaalsContact OD1-CG 3.3Å; N98-K100 WeakPolarHBondContact OD1-CG 3.5Å; N98-K100 PolarHBondContact OD1-N 3.34Å; N98-E108 PolarHBondContact ND2-OE2 3.01Å
99	E	74.3	Confident	83.6	Confident	161 Å²	161	51.9 Å²	51.9	75%	0.752	26%	0.264	S	S	*	.			trans	-71.5	-4.2	-178.3	-64.3	-175.2	171.8	0	0	115	N97 E101	N97-E99 PolarHBondContact O-N 2.77Å; E99-E101 PolarHBondContact O-N 3.23Å
100	K	76.9	Confident	83.5	Confident	116 Å²	116	53.6 Å²	53.6	50%	0.504	27%	0.271	S	S	.	.			trans	-60.1	121.8	-179.2	-68.5	-175.7	-175.8	-176.8	0	112.2	K93 N98 V102 D104	K93-K100 VanDerWaalsContact CE-O 3.31Å; K93-K100 WeakPolarHBondContact CE-O 3.47Å; K93-K100 PolarHBondContact NZ-O 2.83Å; N98-K100 PolarHBondContact O-N 2.89Å; N98-K100 VanDerWaalsContact O-N 3.17Å; N98-K100 WeakPolarHBondContact OD1-CB 3.39Å; N98-K100 VanDerWaalsContact OD1-CG 3.3Å; N98-K100 WeakPolarHBondContact OD1-CG 3.5Å; N98-K100 PolarHBondContact OD1-N 3.34Å; K100-V102 PolarHBondContact O-N 3.45Å; K100-D104 IonicContact NZ-OD2 2.85Å; K100-D104 PolarHBondContact NZ-OD2 3.19Å
101	E	72	Confident	83.4	Confident	47 Å²	47	57.9 Å²	57.9	22%	0.22	29%	0.29	C	S	.	.	S	Bend	trans	-65.9	-24	-178.5	-66	-179	-173.6	0	0	114.5	P52 V68 T69 H70 E99	P52-E101 WeakPolarHBondContact CD-O 3.44Å; P52-E101 VanDerWaalsContact CG-O 3.28Å; P52-E101 WeakPolarHBondContact CG-O 3.42Å; V68-E101 WeakPolarHBondContact CA-OE2 3.29Å; V68-E101 WeakPolarHBondContact CG1-OE2 3.26Å; T69-E101 WeakPolarHBondContact CB-OE1 3.29Å; T69-E101 PolarHBondContact N-OE1 2.79Å; T69-E101 PolarHBondContact N-OE2 3.44Å; T69-E101 PolarHBondContact OG1-OE1 3.21Å; T69-E101 PolarHBondContact OG1-OE2 3.2Å; H70-E101 HydrophobicContact CB-CB 4.49Å; H70-E101 PolarHBondContact N-OE2 3.36Å; E99-E101 PolarHBondContact O-N 3.23Å
102	V	78.7	Confident	83.3	Confident	20 Å²	20	58.4 Å²	58.4	12%	0.121	29%	0.293	C	S	.	.	S	Bend	trans	-112.1	151	176.1	-67.4	0	0	0	0	110.4	H70 K100 L168	H70-V102 HydrophobicContact CB-CG1 4.1Å; K100-V102 PolarHBondContact O-N 3.45Å; V102-L168 HydrophobicContact CG1-CD2 3.75Å
103	V	80.3	Confident	83.3	Confident	0 Å²	0	58.4 Å²	58.4	0%	0	29%	0.293	C	S	.	.	B	Isolated β-bridge	trans	-113.3	136.5	-173.3	173.5	0	0	0	0	109.1	P52 S105 E108 L109 I167	P52-V103 HydrophobicContact CB-CG2 4.06Å; P52-V103 HydrophobicContact CG-CG2 3.69Å; V103-S105 WeakPolarHBondContact CG1-O 3.4Å; V103-E108 HydrophobicContact CG1-CB 3.74Å; V103-E108 HydrophobicContact CG1-CG 4.11Å; V103-L109 HydrophobicContact CG1-CG 4.42Å; V103-L109 HydrophobicContact CG2-CD1 4.31Å; V103-L109 HydrophobicContact CG2-CD2 4.13Å; V103-L109 HydrophobicContact CG2-CG 4.21Å; V103-I167 PolarHBondContact O-N 2.92Å
104	D	78.5	Confident	83.5	Confident	74 Å²	74	58.3 Å²	58.3	40%	0.396	29%	0.293	S	S	.	.	S	Bend	trans	-86.1	-30.3	-179.7	-64.3	-43.5	0	0	0	110.7	K100 E108	K100-D104 IonicContact NZ-OD2 2.85Å; K100-D104 PolarHBondContact NZ-OD2 3.19Å; D104-E108 PolarHBondContact N-OE1 3.46Å
105	S	81.3	Confident	83.8	Confident	46 Å²	46	54.2 Å²	54.2	32%	0.322	28%	0.275	S	S	.	.			trans	-136.3	138.6	175.9	178.8	0	0	0	0	113.5	V103 D107 E108	V103-S105 WeakPolarHBondContact CG1-O 3.4Å; S105-D107 PolarHBondContact O-N 2.74Å; S105-D107 PolarHBondContact OG-N 3.31Å; S105-E108 PolarHBondContact N-OE1 2.97Å; S105-E108 WeakPolarHBondContact O-CB 3.3Å; S105-E108 WeakPolarHBondContact O-CG 3.44Å; S105-E108 PolarHBondContact O-N 3.38Å
106	L	82.2	Confident	84.2	Confident	33 Å²	33	49.9 Å²	49.9	17%	0.173	25%	0.252	C	S	.	.	G	3₁₀ helix	trans	-56	-26	175.1	-63.6	176.9	0	0	0	113.4	E108 L109 L140 I167 V170	L106-E108 PolarHBondContact O-N 2.89Å; L106-L109 PolarHBondContact O-N 3.36Å; L106-L140 HydrophobicContact CB-CD2 4.19Å; L106-L140 HydrophobicContact CD1-CD2 3.72Å; L106-L140 HydrophobicContact CD2-CD1 4.04Å; L106-L140 HydrophobicContact CD2-CD2 3.68Å; L106-L140 HydrophobicContact CD2-CG 4.42Å; L106-L140 HydrophobicContact CG-CD2 4.05Å; L106-I167 HydrophobicContact CD2-CD1 3.65Å; L106-I167 HydrophobicContact CD2-CG2 4.08Å; L106-I167 HydrophobicContact CG-CD1 3.69Å; L106-V170 HydrophobicContact CD2-CG1 4.12Å
107	D	85.2	Confident	84.9	Confident	112 Å²	112	48 Å²	48	60%	0.599	24%	0.241	S	C	*	.	G	3₁₀ helix	trans	-64.5	-19.3	178.9	-66.7	-33.4	0	0	0	113	K94 S105 L109	K94-D107 WeakPolarHBondContact CD-O 3.21Å; K94-D107 WeakPolarHBondContact CE-O 3.46Å; K94-D107 PolarHBondContact NZ-O 3.19Å; S105-D107 PolarHBondContact O-N 2.74Å; S105-D107 PolarHBondContact OG-N 3.31Å; D107-L109 PolarHBondContact O-N 3.34Å
108	E	86.4	Confident	85.4	Confident	53 Å²	53	41.3 Å²	41.3	25%	0.248	21%	0.205	C	C	.	.	G	3₁₀ helix	trans	-72.1	-14.6	175.2	-61.3	-179.4	-126.3	0	0	112.9	K93 K94 N98 V103 D104 S105 L106	K93-E108 WeakPolarHBondContact CA-O 3.44Å; K94-E108 PolarHBondContact N-O 3.46Å; N98-E108 PolarHBondContact ND2-OE2 3.01Å; V103-E108 HydrophobicContact CG1-CB 3.74Å; V103-E108 HydrophobicContact CG1-CG 4.11Å; D104-E108 PolarHBondContact N-OE1 3.46Å; S105-E108 PolarHBondContact N-OE1 2.97Å; S105-E108 WeakPolarHBondContact O-CB 3.3Å; S105-E108 WeakPolarHBondContact O-CG 3.44Å; S105-E108 PolarHBondContact O-N 3.38Å; L106-E108 PolarHBondContact O-N 2.89Å
109	L	89.1	Confident	85.8	Confident	1 Å²	1	44.5 Å²	44.5	1%	0.005	22%	0.215	C	C	.	.	B	Isolated β-bridge	trans	-108.2	155.8	-177.4	-64.1	172.8	0	0	0	111.8	L50 P52 F91 L92 K93 K94 V103 L106 D107 L140	L50-L109 HydrophobicContact CD1-CD1 3.78Å; L50-L109 HydrophobicContact CD2-CD1 3.74Å; L50-L109 HydrophobicContact CG-CD1 4.21Å; P52-L109 HydrophobicContact CB-CD2 4.14Å; F91-L109 HydrophobicContact CB-CD1 4.3Å; F91-L109 HydrophobicContact CB-CD2 4.36Å; L92-L109 WeakPolarHBondContact O-CA 3.44Å; K93-L109 HydrophobicContact CB-CD2 4.41Å; K93-L109 HydrophobicContact CG-CD2 3.69Å; K94-L109 WeakPolarHBondContact CE-O 3.21Å; K94-L109 PolarHBondContact NZ-O 3.28Å; V103-L109 HydrophobicContact CG1-CG 4.42Å; V103-L109 HydrophobicContact CG2-CD1 4.31Å; V103-L109 HydrophobicContact CG2-CD2 4.13Å; V103-L109 HydrophobicContact CG2-CG 4.21Å; L106-L109 PolarHBondContact O-N 3.36Å; D107-L109 PolarHBondContact O-N 3.34Å; L109-L140 HydrophobicContact CD1-CD1 4.33Å
110	Y	90.8	Very high	86.4	Confident	36 Å²	36	39.4 Å²	39.4	14%	0.141	19%	0.191	C	C	.	.			trans	-73.9	147.3	164.1	-72.5	-83.6	0	0	0	111.2	L92 K94 V112 Q241 Q244	L92-Y110 HydrophobicContact CB-CD2 3.94Å; L92-Y110 HydrophobicContact CD2-CD2 4.02Å; L92-Y110 HydrophobicContact CD2-CE2 3.98Å; L92-Y110 HydrophobicContact CG-CD2 4.04Å; L92-Y110 HydrophobicContact CG-CE2 4.27Å; L92-Y110 WeakPolarHBondContact O-CD2 3.36Å; L92-Y110 PolarHBondContact O-N 3.49Å; K94-Y110 HydrophobicContact CB-CE2 4.32Å; K94-Y110 HydrophobicContact CG-CD1 4.36Å; K94-Y110 HydrophobicContact CG-CD2 3.98Å; K94-Y110 HydrophobicContact CG-CE1 4.23Å; K94-Y110 HydrophobicContact CG-CE2 3.85Å; K94-Y110 HydrophobicContact CG-CG 4.25Å; Y110-V112 PolarHBondContact O-N 2.95Å; Y110-Q241 WeakPolarHBondContact OH-CG 3.44Å; Y110-Q244 HydrophobicContact CD1-CG 3.45Å; Y110-Q244 VanDerWaalsContact CD1-CG 3.45Å; Y110-Q244 HydrophobicContact CD2-CG 3.79Å; Y110-Q244 HydrophobicContact CE1-CB 4.46Å; Y110-Q244 HydrophobicContact CE1-CG 3.77Å; Y110-Q244 HydrophobicContact CE2-CB 4.46Å; Y110-Q244 HydrophobicContact CE2-CG 4.09Å; Y110-Q244 HydrophobicContact CG-CG 3.46Å; Y110-Q244 VanDerWaalsContact CG-CG 3.46Å
111	H	90.1	Very high	86.9	Confident	93 Å²	93	35.1 Å²	35.1	43%	0.431	17%	0.174	S	C	.	.	S	Bend	trans	-75.5	-24.3	-172.5	-65.6	-72.4	0	0	0	113.2	R139 L140	H111-R139 CarbonylContact O-C 3.46Å; H111-R139 VanDerWaalsContact O-CA 3.32Å; H111-R139 WeakPolarHBondContact O-CA 3.24Å; H111-L140 PolarHBondContact O-N 2.83Å
112	V	92.8	Very high	87.7	Confident	11 Å²	11	35.8 Å²	35.8	7%	0.067	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	130.6	176.4	-178.3	0	0	0	0	109.8	Y110 R137 I138 V175 Q244 L247 E248	Y110-V112 PolarHBondContact O-N 2.95Å; V112-R137 HydrophobicContact CG1-CB 4.44Å; V112-I138 WeakPolarHBondContact CA-O 3.48Å; V112-V175 HydrophobicContact CG1-CG2 4.3Å; V112-Q244 PolarHBondContact O-NE2 3.23Å; V112-L247 HydrophobicContact CG1-CG 4.32Å; V112-E248 HydrophobicContact CB-CG 3.61Å; V112-E248 HydrophobicContact CG1-CG 4.43Å; V112-E248 HydrophobicContact CG2-CG 3.74Å
113	G	93.1	Very high	88.1	Confident	1 Å²	1	38.3 Å²	38.3	1%	0.01	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	-161.3	175.8	0	0	0	0	0	110.7	A90 F91 R137 I138	A90-G113 CarbonylContact O-C 3.33Å; A90-G113 WeakPolarHBondContact O-CA 3.44Å; F91-G113 VanDerWaalsContact CE1-N 3.31Å; G113-R137 WeakPolarHBondContact O-CA 3.23Å; G113-I138 PolarHBondContact N-O 2.84Å; G113-I138 PolarHBondContact O-N 3.26Å
114	T	94	Very high	88.4	Confident	1 Å²	1	44.4 Å²	44.4	1%	0.006	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	133.4	-177.6	-65.6	0	0	0	0	110.3	L58 P60 A90 V116 R136	L58-T114 WeakPolarHBondContact O-CB 3.36Å; L58-T114 PolarHBondContact O-OG1 3.24Å; P60-T114 HydrophobicContact CG-CG2 4.41Å; A90-T114 PolarHBondContact N-O 3.38Å; A90-T114 PolarHBondContact O-N 2.89Å; T114-V116 HydrophobicContact CG2-CG1 4.2Å; T114-V116 WeakPolarHBondContact O-CG1 3.44Å; T114-V116 PolarHBondContact O-N 2.9Å; T114-R136 CarbonylContact C-O 3.42Å; T114-R136 WeakPolarHBondContact CA-O 3.46Å
115	F	94	Very high	88.4	Confident	0 Å²	0	43 Å²	43	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	123.2	168.2	-177.2	-97.2	0	0	0	108.6	V41 F45 V48 Y87 H135 R136 I138	V41-F115 HydrophobicContact CG1-CD1 4.5Å; V41-F115 HydrophobicContact CG1-CE1 3.8Å; F45-F115 HydrophobicContact CB-CE2 3.82Å; F45-F115 HydrophobicContact CB-CZ 3.99Å; F45-F115 HydrophobicContact CD1-CE2 4.06Å; F45-F115 HydrophobicContact CD1-CZ 4.48Å; F45-F115 HydrophobicContact CG-CE2 4.27Å; F45-F115 HydrophobicContact CG-CZ 4.39Å; V48-F115 HydrophobicContact CG1-CD2 3.95Å; V48-F115 HydrophobicContact CG1-CE2 3.64Å; Y87-F115 AromaticContact CD1-CE1 3.71Å; Y87-F115 HydrophobicContact CD1-CE1 3.71Å; Y87-F115 AromaticContact CD1-CZ 3.58Å; Y87-F115 HydrophobicContact CD1-CZ 3.58Å; Y87-F115 HydrophobicContact CD2-CZ 4.27Å; Y87-F115 HydrophobicContact CE1-CE1 4.32Å; Y87-F115 HydrophobicContact CE1-CZ 4.4Å; Y87-F115 HydrophobicContact CG-CE1 4.16Å; Y87-F115 HydrophobicContact CG-CE2 4.36Å; Y87-F115 AromaticContact CG-CZ 3.53Å; Y87-F115 HydrophobicContact CG-CZ 3.53Å; F115-H135 HydrophobicContact CD1-CB 4.16Å; F115-H135 PolarHBondContact O-N 2.79Å; F115-R136 HydrophobicContact CB-CG 3.84Å; F115-R136 HydrophobicContact CG-CG 4.48Å; F115-R136 PolarHBondContact N-O 3.46Å; F115-I138 HydrophobicContact CB-CD1 4.07Å; F115-I138 HydrophobicContact CB-CG1 4.43Å; F115-I138 HydrophobicContact CB-CG2 3.78Å
116	V	93.1	Very high	88.5	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	145.3	-173.4	-53.6	0	0	0	0	111.3	L51 L58 Y87 A88 A90 T114 L132 D133	L51-V116 HydrophobicContact CD1-CG2 4.38Å; L58-V116 HydrophobicContact CD2-CB 4.37Å; L58-V116 HydrophobicContact CD2-CG1 3.35Å; L58-V116 HydrophobicContact CG-CG1 4.45Å; Y87-V116 WeakPolarHBondContact CA-O 3.39Å; A88-V116 HydrophobicContact CB-CG2 3.76Å; A88-V116 PolarHBondContact N-O 3.42Å; A88-V116 WeakPolarHBondContact O-CG2 3.18Å; A88-V116 PolarHBondContact O-N 3.13Å; A90-V116 HydrophobicContact CB-CG1 3.71Å; A90-V116 HydrophobicContact CB-CG2 4.46Å; T114-V116 HydrophobicContact CG2-CG1 4.2Å; T114-V116 WeakPolarHBondContact O-CG1 3.44Å; T114-V116 PolarHBondContact O-N 2.9Å; V116-L132 HydrophobicContact CB-CB 4.19Å; V116-L132 HydrophobicContact CG2-CB 4.35Å; V116-L132 HydrophobicContact CG2-CD1 4.27Å; V116-L132 HydrophobicContact CG2-CD2 4.15Å; V116-L132 HydrophobicContact CG2-CG 4.49Å; V116-D133 CarbonylContact C-O 3.54Å; V116-D133 VanDerWaalsContact CA-O 3.27Å; V116-D133 WeakPolarHBondContact CA-O 3.48Å
117	Q	92.5	Very high	88.7	Confident	26 Å²	26	51 Å²	51	12%	0.121	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	131.2	166.7	-179.3	179	9.7	0	0	108.8	V41 P86 Y87 R119 L132 D133 H135	V41-Q117 VanDerWaalsContact CG2-OE1 3.31Å; P86-Q117 CarbonylContact O-C 3.6Å; P86-Q117 WeakPolarHBondContact O-CA 3.12Å; Y87-Q117 HydrophobicContact CD1-CB 4.17Å; Y87-Q117 HydrophobicContact CD1-CG 4.29Å; Y87-Q117 HydrophobicContact CE1-CB 4.21Å; Y87-Q117 HydrophobicContact CE1-CG 4.01Å; Q117-R119 PolarHBondContact O-N 3Å; Q117-L132 WeakPolarHBondContact O-CA 3.44Å; Q117-D133 PolarHBondContact N-O 3.38Å; Q117-D133 PolarHBondContact O-N 2.99Å; Q117-H135 VanDerWaalsContact CB-NE2 3.3Å; Q117-H135 WeakPolarHBondContact CB-NE2 3.26Å; Q117-H135 PolarHBondContact OE1-NE2 2.96Å
118	I	90.2	Very high	88.7	Confident	3 Å²	3	45.7 Å²	45.7	2%	0.015	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	107.5	171.7	-56.6	165.5	0	0	0	106.7	L36 I77 P86 V121 M130 L132	L36-I118 WeakPolarHBondContact CD1-O 2.96Å; I77-I118 HydrophobicContact CG2-CD1 3.87Å; P86-I118 HydrophobicContact CB-CB 4.18Å; P86-I118 PolarHBondContact O-N 3.46Å; I118-V121 HydrophobicContact CG2-CG2 3.16Å; I118-M130 HydrophobicContact CD1-SD 3.85Å; I118-M130 HydrophobicContact CG1-SD 4.2Å; I118-M130 HydrophobicContact CG2-CB 4.11Å; I118-M130 HydrophobicContact CG2-CG 4.2Å; I118-M130 HydrophobicContact CG2-SD 4.06Å; I118-L132 HydrophobicContact CB-CD2 4.36Å; I118-L132 HydrophobicContact CG1-CD2 3.67Å
119	R	86.4	Confident	88.9	Confident	101 Å²	101	48 Å²	48	38%	0.381	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	-48.5	-177.4	-171.5	-177.2	79.5	-154.9	9	111.6	Q117 I131 D133	Q117-R119 PolarHBondContact O-N 3Å; R119-I131 PolarHBondContact N-O 3.27Å; R119-D133 WeakPolarHBondContact CD-OD2 3.38Å; R119-D133 IonicContact NH1-OD1 3Å
120	E	85.9	Confident	88.9	Confident	53 Å²	53	47.9 Å²	47.9	25%	0.248	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	141.9	-177.8	-74.7	163.3	-125.9	0	0	109.4	S34 M130 I131	S34-E120 WeakPolarHBondContact O-CA 3.17Å; E120-M130 WeakPolarHBondContact O-CA 3.36Å; E120-I131 HydrophobicContact CB-CB 4.33Å; E120-I131 HydrophobicContact CB-CD1 4.21Å; E120-I131 HydrophobicContact CB-CG1 4.21Å; E120-I131 PolarHBondContact O-N 3.44Å; E120-I131 WeakPolarHBondContact OE2-CD1 3.45Å
121	V	88	Confident	88.9	Confident	26 Å²	26	47.4 Å²	47.4	16%	0.158	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	126.6	174.3	-179.3	0	0	0	0	110.1	I81 I118 D123 M128 M130	I81-V121 HydrophobicContact CD1-CB 4.31Å; I81-V121 HydrophobicContact CD1-CG1 4.42Å; I81-V121 HydrophobicContact CD1-CG2 3.55Å; I118-V121 HydrophobicContact CG2-CG2 3.16Å; V121-D123 HydrophobicContact CG1-CB 4.44Å; V121-M128 HydrophobicContact CG1-CE 4.17Å; V121-M128 HydrophobicContact CG1-CG 3.5Å; V121-M128 HydrophobicContact CG1-SD 3.61Å; V121-M130 HydrophobicContact CG1-CG 4.32Å; V121-M130 HydrophobicContact CG2-CG 3.95Å; V121-M130 HydrophobicContact CG2-SD 4.45Å
122	Q	89.2	Confident	88.9	Confident	62 Å²	62	43 Å²	43	29%	0.29	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	104.2	167.8	-65	179.2	-15.4	0	0	107.8	Y124 R129	Q122-Y124 HydrophobicContact CB-CE2 3.77Å; Q122-Y124 PolarHBondContact OE1-OH 2.69Å; Q122-Y124 VanDerWaalsContact OE1-OH 3.06Å; Q122-R129 HydrophobicContact CB-CB 4.33Å; Q122-R129 PolarHBondContact N-O 2.84Å; Q122-R129 PolarHBondContact O-N 3.16Å; Q122-R129 VanDerWaalsContact OE1-NH1 3.09Å
123	D	86.7	Confident	88.8	Confident	72 Å²	72	43.6 Å²	43.6	39%	0.385	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	112.8	-178.9	-168.8	-9.6	0	0	0	110	R78 V121 G125 M128	R78-D123 IonicContact CZ-OD1 3.21Å; R78-D123 IonicContact CZ-OD2 3.51Å; R78-D123 VanDerWaalsContact CZ-OD2 3.23Å; R78-D123 IonicContact NE-OD1 2.72Å; R78-D123 IonicContact NE-OD2 2.65Å; R78-D123 PolarHBondContact NE-OD2 2.78Å; R78-D123 VanDerWaalsContact NH2-CG 3.28Å; R78-D123 IonicContact NH2-OD1 2.74Å; R78-D123 PolarHBondContact NH2-OD1 3.06Å; R78-D123 IonicContact NH2-OD2 3.76Å; R78-D123 PolarHBondContact NH2-OD2 3.29Å; V121-D123 HydrophobicContact CG1-CB 4.44Å; D123-G125 PolarHBondContact OD1-N 3Å; D123-M128 HydrophobicContact CB-CE 4.14Å; D123-M128 VanDerWaalsContact OD2-CE 3.3Å; D123-M128 WeakPolarHBondContact OD2-CE 3.43Å
124	Y	85.8	Confident	88.7	Confident	129 Å²	129	43.7 Å²	43.7	51%	0.506	21%	0.208	S	C	.	.			trans	-96.5	6.9	178.6	-61.2	-82.7	0	0	0	112.4	Q122 D126 R127 R129	Q122-Y124 HydrophobicContact CB-CE2 3.77Å; Q122-Y124 PolarHBondContact OE1-OH 2.69Å; Q122-Y124 VanDerWaalsContact OE1-OH 3.06Å; Y124-D126 PolarHBondContact O-N 2.97Å; Y124-R127 WeakPolarHBondContact CB-O 3.28Å; Y124-R127 HydrophobicContact CD2-CG 4.13Å; Y124-R127 HydrophobicContact CG-CG 4.42Å; Y124-R127 PolarHBondContact N-O 2.91Å; Y124-R129 HydrophobicContact CE2-CB 4.36Å
125	G	80.2	Confident	88.4	Confident	45 Å²	45	47 Å²	47	46%	0.464	22%	0.223	S	C	.	.	S	Bend	trans	92	-60.2	-178.8	0	0	0	0	0	112.7	M74 R78 D123	M74-G125 WeakPolarHBondContact CE-O 3.39Å; R78-G125 PolarHBondContact NH2-O 2.9Å; R78-G125 VanDerWaalsContact NH2-O 3.16Å; D123-G125 PolarHBondContact OD1-N 3Å
126	D	82.3	Confident	88.2	Confident	116 Å²	116	49.2 Å²	49.2	62%	0.62	23%	0.231	S	C	*	.	S	Bend	trans	-88.8	-23.9	179.4	67.8	-26.9	0	0	0	113.6	Y124	Y124-D126 PolarHBondContact O-N 2.97Å
127	R	86.4	Confident	88.2	Confident	130 Å²	130	50 Å²	50	49%	0.491	23%	0.234	S	C	.	.			trans	-140.8	146.3	175.7	66.5	-169.9	178.2	175.8	-1.4	111.1	V67 V68 T69 Y124	V67-R127 HydrophobicContact CG1-CB 4.34Å; V68-R127 CarbonylContact O-C 3.52Å; V68-R127 WeakPolarHBondContact O-CA 3.22Å; T69-R127 HydrophobicContact CG2-CB 3.91Å; Y124-R127 WeakPolarHBondContact CB-O 3.28Å; Y124-R127 HydrophobicContact CD2-CG 4.13Å; Y124-R127 HydrophobicContact CG-CG 4.42Å; Y124-R127 PolarHBondContact N-O 2.91Å
128	M	85.7	Confident	88.3	Confident	1 Å²	1	48.7 Å²	48.7	1%	0.005	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	118.5	178.2	-173.8	173.3	-69.4	0	0	109.4	V67 V68 M74 I77 R78 V121 D123 M130	V67-M128 CarbonylContact C-O 3.55Å; V67-M128 WeakPolarHBondContact CA-O 3.5Å; V68-M128 PolarHBondContact N-O 2.88Å; V68-M128 PolarHBondContact O-N 3.38Å; M74-M128 HydrophobicContact CE-CB 4.11Å; M74-M128 HydrophobicContact CG-CB 4.18Å; I77-M128 HydrophobicContact CB-SD 4.22Å; I77-M128 HydrophobicContact CG2-SD 3.56Å; I77-M128 VanDerWaalsContact CG2-SD 3.56Å; R78-M128 HydrophobicContact CG-CE 3.55Å; V121-M128 HydrophobicContact CG1-CE 4.17Å; V121-M128 HydrophobicContact CG1-CG 3.5Å; V121-M128 HydrophobicContact CG1-SD 3.61Å; D123-M128 HydrophobicContact CB-CE 4.14Å; D123-M128 VanDerWaalsContact OD2-CE 3.3Å; D123-M128 WeakPolarHBondContact OD2-CE 3.43Å; M128-M130 HydrophobicContact CG-CG 3.84Å; M128-M130 HydrophobicContact CG-SD 4.33Å; M128-M130 HydrophobicContact SD-CG 4.22Å; M128-M130 HydrophobicContact SD-SD 4Å
129	R	90.4	Very high	88.4	Confident	100 Å²	100	53.3 Å²	53.3	38%	0.377	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	127.4	173.1	179.6	179	179.3	-123.6	0.6	108.8	V65 V67 Q122 Y124	V65-R129 HydrophobicContact CG1-CG 3.82Å; V67-R129 HydrophobicContact CG2-CB 4.32Å; V67-R129 HydrophobicContact CG2-CG 4.22Å; Q122-R129 HydrophobicContact CB-CB 4.33Å; Q122-R129 PolarHBondContact N-O 2.84Å; Q122-R129 PolarHBondContact O-N 3.16Å; Q122-R129 VanDerWaalsContact OE1-NH1 3.09Å; Y124-R129 HydrophobicContact CE2-CB 4.36Å
130	M	89.8	Confident	88.6	Confident	0 Å²	0	49 Å²	49	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	143.8	-176.1	-58.6	-177.1	-70.6	0	0	111	L51 V65 V66 V68 I77 I118 E120 V121 M128 L132	L51-M130 HydrophobicContact CD1-CE 4.29Å; L51-M130 HydrophobicContact CD2-CE 4.27Å; V65-M130 WeakPolarHBondContact CA-O 3.42Å; V66-M130 PolarHBondContact N-O 3.06Å; V66-M130 PolarHBondContact O-N 2.82Å; V68-M130 HydrophobicContact CG2-CE 3.66Å; I77-M130 HydrophobicContact CD1-CE 3.7Å; I77-M130 HydrophobicContact CD1-SD 4Å; I77-M130 HydrophobicContact CG2-SD 3.71Å; I118-M130 HydrophobicContact CD1-SD 3.85Å; I118-M130 HydrophobicContact CG1-SD 4.2Å; I118-M130 HydrophobicContact CG2-CB 4.11Å; I118-M130 HydrophobicContact CG2-CG 4.2Å; I118-M130 HydrophobicContact CG2-SD 4.06Å; E120-M130 WeakPolarHBondContact O-CA 3.36Å; V121-M130 HydrophobicContact CG1-CG 4.32Å; V121-M130 HydrophobicContact CG2-CG 3.95Å; V121-M130 HydrophobicContact CG2-SD 4.45Å; M128-M130 HydrophobicContact CG-CG 3.84Å; M128-M130 HydrophobicContact CG-SD 4.33Å; M128-M130 HydrophobicContact SD-CG 4.22Å; M128-M130 HydrophobicContact SD-SD 4Å; M130-L132 HydrophobicContact CB-CD2 4.11Å
131	I	89.7	Confident	88.7	Confident	26 Å²	26	50.3 Å²	50.3	13%	0.133	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	119.5	167.6	-52.2	-174	0	0	0	107.9	V65 R119 E120	V65-I131 HydrophobicContact CG2-CG1 4.3Å; R119-I131 PolarHBondContact N-O 3.27Å; E120-I131 HydrophobicContact CB-CB 4.33Å; E120-I131 HydrophobicContact CB-CD1 4.21Å; E120-I131 HydrophobicContact CB-CG1 4.21Å; E120-I131 PolarHBondContact O-N 3.44Å; E120-I131 WeakPolarHBondContact OE2-CD1 3.45Å
132	L	91	Very high	88.7	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	122.5	-176.7	-54.6	-179.4	0	0	0	109.4	L51 L58 A63 T64 V66 V116 Q117 I118 M130	L51-L132 HydrophobicContact CD1-CD1 3.72Å; L51-L132 HydrophobicContact CD1-CD2 4.08Å; L58-L132 HydrophobicContact CD2-CB 4.1Å; A63-L132 CarbonylContact C-O 3.59Å; A63-L132 WeakPolarHBondContact CA-O 3.21Å; T64-L132 HydrophobicContact CG2-CB 4.34Å; T64-L132 HydrophobicContact CG2-CD1 4.48Å; T64-L132 PolarHBondContact N-O 2.87Å; T64-L132 PolarHBondContact O-N 3.43Å; V66-L132 HydrophobicContact CB-CD1 3.99Å; V66-L132 HydrophobicContact CG2-CD1 3.45Å; V66-L132 VanDerWaalsContact CG2-CD1 3.45Å; V66-L132 HydrophobicContact CG2-CG 4.27Å; V116-L132 HydrophobicContact CB-CB 4.19Å; V116-L132 HydrophobicContact CG2-CB 4.35Å; V116-L132 HydrophobicContact CG2-CD1 4.27Å; V116-L132 HydrophobicContact CG2-CD2 4.15Å; V116-L132 HydrophobicContact CG2-CG 4.49Å; Q117-L132 WeakPolarHBondContact O-CA 3.44Å; I118-L132 HydrophobicContact CB-CD2 4.36Å; I118-L132 HydrophobicContact CG1-CD2 3.67Å; M130-L132 HydrophobicContact CB-CD2 4.11Å
133	D	90.5	Very high	88.5	Confident	24 Å²	24	54.2 Å²	54.2	13%	0.128	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	118.3	170.6	-75	-11.3	0	0	0	109	A63 V116 Q117 R119 H135	A63-D133 VanDerWaalsContact CB-OD1 3.32Å; A63-D133 WeakPolarHBondContact CB-OD1 3.41Å; V116-D133 CarbonylContact C-O 3.54Å; V116-D133 VanDerWaalsContact CA-O 3.27Å; V116-D133 WeakPolarHBondContact CA-O 3.48Å; Q117-D133 PolarHBondContact N-O 3.38Å; Q117-D133 PolarHBondContact O-N 2.99Å; R119-D133 WeakPolarHBondContact CD-OD2 3.38Å; R119-D133 IonicContact NH1-OD1 3Å; D133-H135 PolarHBondContact O-CD2 3.21Å
134	G	90	Very high	88.3	Confident	3 Å²	3	52.1 Å²	52.1	3%	0.031	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	133.9	175.6	0	0	0	0	0	111.7	K61 L62	K61-G134 WeakPolarHBondContact CA-O 3.41Å; K61-G134 PolarHBondContact N-O 3.49Å; L62-G134 PolarHBondContact O-N 2.81Å
135	H	89.2	Confident	87.6	Confident	71 Å²	71	51.1 Å²	51.1	33%	0.329	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	-53.5	-177.7	-78.7	-77.6	0	0	0	113.3	F115 Q117 D133	F115-H135 HydrophobicContact CD1-CB 4.16Å; F115-H135 PolarHBondContact O-N 2.79Å; Q117-H135 VanDerWaalsContact CB-NE2 3.3Å; Q117-H135 WeakPolarHBondContact CB-NE2 3.26Å; Q117-H135 PolarHBondContact OE1-NE2 2.96Å; D133-H135 PolarHBondContact O-CD2 3.21Å
136	R	90.1	Very high	86.6	Confident	45 Å²	45	52.3 Å²	52.3	17%	0.17	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	160.4	-175.9	63.3	-179	-176.2	-89.1	-3.8	111.3	P42 D43 T114 F115 N174	P42-R136 PolarHBondContact O-NH1 2.73Å; P42-R136 PolarHBondContact O-NH2 2.91Å; D43-R136 PolarHBondContact O-NE 3.18Å; D43-R136 PolarHBondContact O-NH2 3.39Å; T114-R136 CarbonylContact C-O 3.42Å; T114-R136 WeakPolarHBondContact CA-O 3.46Å; F115-R136 HydrophobicContact CB-CG 3.84Å; F115-R136 HydrophobicContact CG-CG 4.48Å; F115-R136 PolarHBondContact N-O 3.46Å; R136-N174 PolarHBondContact NE-ND2 3.33Å; R136-N174 PolarHBondContact NE-OD1 3.25Å
137	R	92.7	Very high	85.2	Confident	16 Å²	16	55.3 Å²	55.3	6%	0.06	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	140.5	175.9	-69.4	169.2	177.6	76.5	0.4	110.4	P60 V112 G113 V175 M177 D230 L247	P60-R137 HydrophobicContact CG-CG 3.91Å; V112-R137 HydrophobicContact CG1-CB 4.44Å; G113-R137 WeakPolarHBondContact O-CA 3.23Å; R137-V175 HydrophobicContact CB-CB 3.95Å; R137-V175 HydrophobicContact CB-CG2 4.18Å; R137-V175 PolarHBondContact O-N 3.19Å; R137-M177 VanDerWaalsContact CD-CE 3.47Å; R137-D230 IonicContact CZ-OD1 2.84Å; R137-D230 IonicContact CZ-OD2 3.17Å; R137-D230 IonicContact NH1-OD2 3.77Å; R137-D230 PolarHBondContact NH1-OD2 3.37Å; R137-D230 IonicContact NH2-OD1 3.94Å; R137-D230 PolarHBondContact NH2-OD1 2.96Å; R137-D230 IonicContact NH2-OD2 2.84Å; R137-D230 PolarHBondContact NH2-OD2 3.49Å; R137-L247 WeakPolarHBondContact CD-O 3.31Å; R137-L247 HydrophobicContact CG-CD1 4.02Å; R137-L247 PolarHBondContact NE-O 3.42Å
138	I	94	Very high	83.3	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	146.6	176.9	54.1	175.8	0	0	0	110.2	V48 F91 V112 G113 F115 T172 E173	V48-I138 HydrophobicContact CG2-CD1 4.42Å; F91-I138 HydrophobicContact CE1-CG1 4.4Å; F91-I138 HydrophobicContact CE2-CD1 4Å; F91-I138 HydrophobicContact CE2-CG1 4.44Å; F91-I138 HydrophobicContact CZ-CD1 3.79Å; F91-I138 HydrophobicContact CZ-CG1 3.79Å; V112-I138 WeakPolarHBondContact CA-O 3.48Å; G113-I138 PolarHBondContact N-O 2.84Å; G113-I138 PolarHBondContact O-N 3.26Å; F115-I138 HydrophobicContact CB-CD1 4.07Å; F115-I138 HydrophobicContact CB-CG1 4.43Å; F115-I138 HydrophobicContact CB-CG2 3.78Å; I138-T172 HydrophobicContact CD1-CG2 4.07Å; I138-E173 CarbonylContact C-O 3.6Å; I138-E173 WeakPolarHBondContact CA-O 3.48Å; I138-E173 WeakPolarHBondContact CB-O 3.33Å
139	R	93.1	Very high	81.1	Confident	99 Å²	99	56.8 Å²	56.8	37%	0.374	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	135	173.9	-173.5	-179.5	-64.5	130.6	-3.1	109.6	H111 T172 E173 V175	H111-R139 CarbonylContact O-C 3.46Å; H111-R139 VanDerWaalsContact O-CA 3.32Å; H111-R139 WeakPolarHBondContact O-CA 3.24Å; R139-T172 WeakPolarHBondContact O-CA 3.39Å; R139-T172 WeakPolarHBondContact O-CB 3.4Å; R139-E173 HydrophobicContact CB-CG 3.89Å; R139-E173 WeakPolarHBondContact CD-OE1 3.39Å; R139-E173 IonicContact CZ-OE1 3.76Å; R139-E173 PolarHBondContact N-O 3.43Å; R139-E173 IonicContact NE-OE1 3.81Å; R139-E173 IonicContact NH1-OE1 2.88Å; R139-E173 PolarHBondContact NH1-OE1 2.82Å; R139-E173 PolarHBondContact O-N 2.69Å; R139-V175 HydrophobicContact CB-CG2 4.05Å
140	L	89.5	Confident	78.5	Confident	12 Å²	12	56.2 Å²	56.2	6%	0.063	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	125.6	175.7	-168.1	146.4	0	0	0	110	L50 F91 L106 L109 H111 V170	L50-L140 HydrophobicContact CD1-CD1 4.31Å; F91-L140 HydrophobicContact CD1-CB 4.23Å; F91-L140 HydrophobicContact CD1-CD1 4.26Å; F91-L140 HydrophobicContact CD2-CD1 4.32Å; F91-L140 HydrophobicContact CE1-CB 3.64Å; F91-L140 HydrophobicContact CE1-CD1 4.26Å; F91-L140 HydrophobicContact CE2-CD1 4.28Å; F91-L140 HydrophobicContact CG-CD1 4.29Å; F91-L140 HydrophobicContact CZ-CB 3.9Å; F91-L140 HydrophobicContact CZ-CD1 4.25Å; F91-L140 HydrophobicContact CZ-CG 4.5Å; L106-L140 HydrophobicContact CB-CD2 4.19Å; L106-L140 HydrophobicContact CD1-CD2 3.72Å; L106-L140 HydrophobicContact CD2-CD1 4.04Å; L106-L140 HydrophobicContact CD2-CD2 3.68Å; L106-L140 HydrophobicContact CD2-CG 4.42Å; L106-L140 HydrophobicContact CG-CD2 4.05Å; L109-L140 HydrophobicContact CD1-CD1 4.33Å; H111-L140 PolarHBondContact O-N 2.83Å; L140-V170 HydrophobicContact CD1-CB 4.41Å; L140-V170 HydrophobicContact CD1-CG1 4.05Å; L140-V170 HydrophobicContact CG-CB 4.47Å; L140-V170 HydrophobicContact CG-CG1 4.44Å
141	I	89.6	Confident	76	Confident	79 Å²	79	61.3 Å²	61.3	41%	0.405	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	-63.8	-179.4	-58	177.6	0	0	0	110.5	E171 E173	I141-E171 WeakPolarHBondContact CB-O 3.39Å; I141-E171 PolarHBondContact N-O 3.18Å; I141-E173 HydrophobicContact CD1-CB 3.96Å; I141-E173 HydrophobicContact CD1-CG 3.94Å; I141-E173 HydrophobicContact CG1-CG 4.18Å
142	K	86.8	Confident	73.3	Confident	115 Å²	115	69.7 Å²	69.7	50%	0.5	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.6	161.4	-177	61.1	179	175.3	178.4	0	111.8	V170 E171	K142-V170 WeakPolarHBondContact O-CA 3.49Å; K142-E171 WeakPolarHBondContact CE-OE2 3.43Å; K142-E171 HydrophobicContact CG-CB 4.16Å; K142-E171 IonicContact NZ-OE2 3.89Å; K142-E171 PolarHBondContact O-N 3.48Å
143	S	85.8	Confident	70.6	Confident	56 Å²	56	73.2 Å²	73.2	39%	0.392	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	147.2	169.6	52.4	0	0	0	0	110.1
144	V	82.1	Confident	67.9	Low	28 Å²	28	81.1 Å²	81.1	17%	0.17	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	128.7	176.8	-179	0	0	0	0	108.1	V47 D146 L169 E171	V47-V144 HydrophobicContact CG1-CB 4.48Å; V47-V144 HydrophobicContact CG1-CG1 4.42Å; V47-V144 HydrophobicContact CG1-CG2 4.4Å; V144-D146 PolarHBondContact O-N 3.31Å; V144-L169 HydrophobicContact CB-CB 4.24Å; V144-L169 PolarHBondContact N-O 3.41Å; V144-L169 WeakPolarHBondContact O-CB 3.28Å; V144-E171 HydrophobicContact CG2-CB 3.81Å
145	D	70.6	Confident	65.1	Low	108 Å²	108	90.7 Å²	90.7	58%	0.578	47%	0.473	S	S	*	.			trans	-72.9	128.2	175.8	-70.9	-24	0	0	0	110.5	K147 T148	D145-K147 PolarHBondContact O-N 2.88Å; D145-T148 PolarHBondContact O-N 3.07Å; D145-T148 PolarHBondContact O-OG1 3.06Å
146	D	59.6	Low	62.5	Low	69 Å²	69	92 Å²	92	37%	0.369	50%	0.497	S	S	.	.	G	3₁₀ helix	trans	-56.2	-26.2	179.4	-165.8	24.4	0	0	0	112.4	V144 T148 A149 L169	V144-D146 PolarHBondContact O-N 3.31Å; D146-T148 VanDerWaalsContact C-N 3.29Å; D146-T148 PolarHBondContact O-N 3.23Å; D146-A149 PolarHBondContact O-N 3.01Å; D146-L169 HydrophobicContact CB-CD1 3.94Å; D146-L169 WeakPolarHBondContact OD1-CD1 3.39Å
147	K	52.8	Low	59.8	Low	180 Å²	180	94.6 Å²	94.6	78%	0.783	53%	0.528	S	S	*	.	G	3₁₀ helix	trans	-64.4	-28.7	176	-67.3	-173	-178.1	177.9	0	113.6	D145 L150	D145-K147 PolarHBondContact O-N 2.88Å; K147-L150 WeakPolarHBondContact O-CD1 3.33Å
148	T	45.8	Very low	56.8	Low	109 Å²	109	97.9 Å²	97.9	67%	0.669	57%	0.567	S	S	*	*	G	3₁₀ helix	trans	-82.9	-11.8	-179.8	53	0	0	0	0	113.6	D145 D146 L150	D145-T148 PolarHBondContact O-N 3.07Å; D145-T148 PolarHBondContact O-OG1 3.06Å; D146-T148 VanDerWaalsContact C-N 3.29Å; D146-T148 PolarHBondContact O-N 3.23Å; T148-L150 VanDerWaalsContact C-N 3.29Å
149	A	40.1	Very low	53.8	Low	53 Å²	53	103 Å²	103	44%	0.438	60%	0.602	S	S	.	*	G	3₁₀ helix	trans	-87.4	7.3	173.2	0	0	0	0	0	113.6	D146	D146-A149 PolarHBondContact O-N 3.01Å
150	L	36.7	Very low	50.9	Low	87 Å²	87	106.6 Å²	106.6	46%	0.455	63%	0.629	S	S	.	*	S	Bend	trans	-81.8	124.7	176	-70.5	165.7	0	0	0	110.4	K147 T148 E152	K147-L150 WeakPolarHBondContact O-CD1 3.33Å; T148-L150 VanDerWaalsContact C-N 3.29Å; L150-E152 PolarHBondContact O-N 3.19Å
151	P	36.8	Very low	48.3	Very low	108 Å²	108	111 Å²	111	70%	0.701	65%	0.652	S	S	*	*			trans	-59.6	132.2	155.3	-12.1	26.8	0	0	0	107.9	G153	P151-G153 PolarHBondContact O-N 3.26Å
152	E	32.5	Very low	45.6	Very low	202 Å²	202	116.9 Å²	116.9	94%	0.944	68%	0.675	S	S	*	*	S	Bend	trans	-38.2	127	-179.6	-61	175.6	160.2	0	0	112.5	L150	L150-E152 PolarHBondContact O-N 3.19Å
153	G	34.8	Very low	43.5	Very low	74 Å²	74	120.2 Å²	120.2	76%	0.763	68%	0.684	S	S	*	*			trans	136.6	10.9	158.1	0	0	0	0	0	119.9	P151	P151-G153 PolarHBondContact O-N 3.26Å
154	K	33.8	Very low	41.5	Very low	189 Å²	189	125.9 Å²	125.9	82%	0.822	70%	0.702	S	S	*	*			trans	-134.8	92.4	169.7	-69.1	-168.2	178.6	-176.8	0	112.8	A156	K154-A156 PolarHBondContact O-N 3.39Å; K154-A156 VanDerWaalsContact O-N 3.16Å
155	E	31.2	Very low	40.3	Very low	204 Å²	204	131.4 Å²	131.4	95%	0.953	73%	0.731	S	S	*	*			trans	-63.3	103.3	163	-65.1	177.4	163.5	0	0	108.6
156	A	34.3	Very low	40.1	Very low	100 Å²	100	127.6 Å²	127.6	83%	0.826	71%	0.712	S	S	*	*	P	Polyproline II helix	trans	-82.9	120.6	169.1	0	0	0	0	0	108.9	K154	K154-A156 PolarHBondContact O-N 3.39Å; K154-A156 VanDerWaalsContact O-N 3.16Å
157	A	32.6	Very low	40.9	Very low	99 Å²	99	125.4 Å²	125.4	82%	0.818	70%	0.7	S	S	*	*	P	Polyproline II helix	trans	-58.2	158.1	-175.9	0	0	0	0	0	114.2
158	G	30	Very low	42.2	Very low	85 Å²	85	118.1 Å²	118.1	88%	0.876	67%	0.67	S	S	*	*	P	Polyproline II helix	trans	-50.2	139.5	-168.6	0	0	0	0	0	116.8
159	S	32.5	Very low	44.1	Very low	106 Å²	106	113.1 Å²	113.1	74%	0.741	64%	0.639	S	S	*	*			trans	-151.6	109.8	148.7	59.2	0	0	0	0	107.7	D161	S159-D161 PolarHBondContact O-N 3.31Å
160	D	31.2	Very low	46.4	Very low	176 Å²	176	110.6 Å²	110.6	94%	0.941	62%	0.618	S	S	*	*			trans	-64.5	31.2	-179.9	-87.6	-43.2	0	0	0	114.9	K162	D160-K162 PolarHBondContact O-N 2.9Å
161	D	34.4	Very low	49	Very low	103 Å²	103	109.3 Å²	109.3	55%	0.551	61%	0.61	S	S	*	*			trans	-86.7	98.9	178.6	-152.9	17.9	0	0	0	108.3	S159 R163	S159-D161 PolarHBondContact O-N 3.31Å; D161-R163 HydrophobicContact CB-CG 4.33Å; D161-R163 PolarHBondContact O-N 3.42Å; D161-R163 IonicContact OD2-CZ 2.69Å; D161-R163 IonicContact OD2-NE 3.91Å; D161-R163 PolarHBondContact OD2-NE 2.87Å; D161-R163 IonicContact OD2-NH2 3.76Å; D161-R163 PolarHBondContact OD2-NH2 3.48Å
162	K	34.5	Very low	51.6	Low	204 Å²	204	104.3 Å²	104.3	89%	0.887	58%	0.578	S	S	*	*			trans	-62.3	51.9	172.7	-66	179.6	177.1	177.2	0	111.7	D160 K164	D160-K162 PolarHBondContact O-N 2.9Å; K162-K164 PolarHBondContact O-N 2.68Å; K162-K164 VanDerWaalsContact O-N 3.07Å
163	R	41.2	Very low	54.4	Low	184 Å²	184	98.1 Å²	98.1	69%	0.694	55%	0.548	S	S	*	.			trans	-63.3	111.8	170.1	-69.4	-176.8	-178.5	-165.2	-2.6	105.7	D161 D165	D161-R163 HydrophobicContact CB-CG 4.33Å; D161-R163 PolarHBondContact O-N 3.42Å; D161-R163 IonicContact OD2-CZ 2.69Å; D161-R163 IonicContact OD2-NE 3.91Å; D161-R163 PolarHBondContact OD2-NE 2.87Å; D161-R163 IonicContact OD2-NH2 3.76Å; D161-R163 PolarHBondContact OD2-NH2 3.48Å; R163-D165 PolarHBondContact O-N 3.12Å
164	K	44.8	Very low	57	Low	175 Å²	175	97 Å²	97	76%	0.761	53%	0.525	S	S	*	.			trans	-38.5	116.6	168	-73.4	175.5	171.9	-178.4	0	107.7	K162 S166	K162-K164 PolarHBondContact O-N 2.68Å; K162-K164 VanDerWaalsContact O-N 3.07Å; K164-S166 VanDerWaalsContact C-N 3.28Å; K164-S166 PolarHBondContact O-N 3.5Å
165	D	56	Low	59.6	Low	144 Å²	144	89 Å²	89	77%	0.77	49%	0.492	S	S	*	.			trans	-65.2	91.5	-174.7	-78.2	-41	0	0	0	108.8	R163 I167	R163-D165 PolarHBondContact O-N 3.12Å; D165-I167 PolarHBondContact O-N 3.08Å
166	S	66.5	Low	61.9	Low	28 Å²	28	87.6 Å²	87.6	20%	0.196	49%	0.485	C	S	.	.			trans	-58.9	133	169	58.6	0	0	0	0	108.6	K164 L168	K164-S166 VanDerWaalsContact C-N 3.28Å; K164-S166 PolarHBondContact O-N 3.5Å; S166-L168 PolarHBondContact O-N 3.26Å
167	I	76.2	Confident	63.8	Low	23 Å²	23	86 Å²	86	12%	0.118	46%	0.461	C	S	.	.	B	Isolated β-bridge	trans	-75.6	116.6	-177.1	-57.4	173.5	0	0	0	109.2	L50 V103 L106 D165 V170	L50-I167 HydrophobicContact CD2-CB 4.42Å; L50-I167 HydrophobicContact CD2-CG2 4Å; V103-I167 PolarHBondContact O-N 2.92Å; L106-I167 HydrophobicContact CD2-CD1 3.65Å; L106-I167 HydrophobicContact CD2-CG2 4.08Å; L106-I167 HydrophobicContact CG-CD1 3.69Å; D165-I167 PolarHBondContact O-N 3.08Å; I167-V170 HydrophobicContact CG2-CG1 3.91Å
168	L	80.3	Confident	66	Low	27 Å²	27	84.5 Å²	84.5	14%	0.141	44%	0.444	C	S	.	.			trans	-111.2	-29.2	-177.4	-60.6	173.9	0	0	0	113.7	P49 L50 L73 I76 V102 S166	P49-L168 WeakPolarHBondContact CA-O 3.15Å; L50-L168 PolarHBondContact N-O 3.29Å; L73-L168 HydrophobicContact CB-CD2 4.12Å; I76-L168 HydrophobicContact CD1-CB 3.53Å; I76-L168 HydrophobicContact CD1-CD1 3.66Å; I76-L168 HydrophobicContact CD1-CG 4.16Å; V102-L168 HydrophobicContact CG1-CD2 3.75Å; S166-L168 PolarHBondContact O-N 3.26Å
169	L	86	Confident	68.3	Low	4 Å²	4	90 Å²	90	2%	0.021	45%	0.446	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	139.7	179.9	-71.1	164.2	0	0	0	109.7	P49 I76 V144 D146	P49-L169 HydrophobicContact CG-CD2 4.2Å; I76-L169 HydrophobicContact CG2-CD2 4.23Å; V144-L169 HydrophobicContact CB-CB 4.24Å; V144-L169 PolarHBondContact N-O 3.41Å; V144-L169 WeakPolarHBondContact O-CB 3.28Å; D146-L169 HydrophobicContact CB-CD1 3.94Å; D146-L169 WeakPolarHBondContact OD1-CD1 3.39Å
170	V	88.7	Confident	70.5	Confident	0 Å²	0	89.3 Å²	89.3	0%	0	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	145.1	179.5	-68.4	0	0	0	0	110.7	V47 V48 L50 F91 L106 L140 K142 I167 T172	V47-V170 WeakPolarHBondContact CA-O 3.33Å; V48-V170 HydrophobicContact CG2-CG2 4.01Å; V48-V170 PolarHBondContact N-O 2.79Å; V48-V170 PolarHBondContact O-N 3.21Å; L50-V170 HydrophobicContact CB-CG1 4.1Å; L50-V170 HydrophobicContact CB-CG2 4.13Å; L50-V170 HydrophobicContact CD1-CG1 4.31Å; L50-V170 HydrophobicContact CD1-CG2 4.18Å; L50-V170 HydrophobicContact CD2-CG1 3.94Å; L50-V170 HydrophobicContact CG-CG1 4.35Å; F91-V170 HydrophobicContact CE2-CG2 4.33Å; L106-V170 HydrophobicContact CD2-CG1 4.12Å; L140-V170 HydrophobicContact CD1-CB 4.41Å; L140-V170 HydrophobicContact CD1-CG1 4.05Å; L140-V170 HydrophobicContact CG-CB 4.47Å; L140-V170 HydrophobicContact CG-CG1 4.44Å; K142-V170 WeakPolarHBondContact O-CA 3.49Å; I167-V170 HydrophobicContact CG2-CG1 3.91Å; V170-T172 HydrophobicContact CB-CG2 4.46Å; V170-T172 HydrophobicContact CG2-CG2 3.86Å
171	E	91.9	Very high	72.7	Confident	61 Å²	61	88.8 Å²	88.8	29%	0.285	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	135	167.2	-169.1	174.8	178.1	0	0	109.2	P46 I141 K142 V144	P46-E171 HydrophobicContact CB-CG 4.41Å; P46-E171 CarbonylContact O-C 3.59Å; P46-E171 WeakPolarHBondContact O-CA 3.47Å; I141-E171 WeakPolarHBondContact CB-O 3.39Å; I141-E171 PolarHBondContact N-O 3.18Å; K142-E171 WeakPolarHBondContact CE-OE2 3.43Å; K142-E171 HydrophobicContact CG-CB 4.16Å; K142-E171 IonicContact NZ-OE2 3.89Å; K142-E171 PolarHBondContact O-N 3.48Å; V144-E171 HydrophobicContact CG2-CB 3.81Å
172	T	91.2	Very high	74.8	Confident	3 Å²	3	89.1 Å²	89.1	2%	0.018	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	151.9	-172.1	65.7	0	0	0	0	110.9	P46 V48 F91 I138 R139 V170	P46-T172 VanDerWaalsContact CA-O 3.28Å; P46-T172 WeakPolarHBondContact CA-O 3.29Å; P46-T172 WeakPolarHBondContact CB-O 3.44Å; P46-T172 PolarHBondContact O-N 2.78Å; P46-T172 PolarHBondContact O-OG1 3.3Å; V48-T172 HydrophobicContact CG2-CG2 3.82Å; F91-T172 HydrophobicContact CE2-CG2 4.23Å; F91-T172 HydrophobicContact CZ-CG2 3.89Å; I138-T172 HydrophobicContact CD1-CG2 4.07Å; R139-T172 WeakPolarHBondContact O-CA 3.39Å; R139-T172 WeakPolarHBondContact O-CB 3.4Å; V170-T172 HydrophobicContact CB-CG2 4.46Å; V170-T172 HydrophobicContact CG2-CG2 3.86Å
173	E	90.8	Very high	77.2	Confident	71 Å²	71	82.5 Å²	82.5	33%	0.332	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	154.9	172.2	57.6	-179.5	-163.5	0	0	110.4	I138 R139 I141	I138-E173 CarbonylContact C-O 3.6Å; I138-E173 WeakPolarHBondContact CA-O 3.48Å; I138-E173 WeakPolarHBondContact CB-O 3.33Å; R139-E173 HydrophobicContact CB-CG 3.89Å; R139-E173 WeakPolarHBondContact CD-OE1 3.39Å; R139-E173 IonicContact CZ-OE1 3.76Å; R139-E173 PolarHBondContact N-O 3.43Å; R139-E173 IonicContact NE-OE1 3.81Å; R139-E173 IonicContact NH1-OE1 2.88Å; R139-E173 PolarHBondContact NH1-OE1 2.82Å; R139-E173 PolarHBondContact O-N 2.69Å; I141-E173 HydrophobicContact CD1-CB 3.96Å; I141-E173 HydrophobicContact CD1-CG 3.94Å; I141-E173 HydrophobicContact CG1-CG 4.18Å
174	N	90	Very high	79.3	Confident	52 Å²	52	80.1 Å²	80.1	28%	0.278	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	135.8	174.9	-68.9	-13.7	0	0	0	110.2	D43 R136 E176	D43-N174 PolarHBondContact O-ND2 3.06Å; R136-N174 PolarHBondContact NE-ND2 3.33Å; R136-N174 PolarHBondContact NE-OD1 3.25Å; N174-E176 PolarHBondContact O-N 3.43Å
175	V	87	Confident	81.1	Confident	19 Å²	19	79.1 Å²	79.1	12%	0.115	39%	0.39	C	S	.	.			trans	-83.4	108	171.4	-177.2	0	0	0	0	108.6	V112 R137 R139 M177 T250	V112-V175 HydrophobicContact CG1-CG2 4.3Å; R137-V175 HydrophobicContact CB-CB 3.95Å; R137-V175 HydrophobicContact CB-CG2 4.18Å; R137-V175 PolarHBondContact O-N 3.19Å; R139-V175 HydrophobicContact CB-CG2 4.05Å; V175-M177 HydrophobicContact CG1-CE 4.05Å; V175-T250 HydrophobicContact CG1-CG2 4.29Å
176	E	80.2	Confident	82.4	Confident	175 Å²	175	72.4 Å²	72.4	82%	0.818	35%	0.354	S	S	*	.	P	Polyproline II helix	trans	-70.1	134.9	174.1	-64	-172.9	168.8	0	0	110.7	N174	N174-E176 PolarHBondContact O-N 3.43Å
177	M	74.6	Confident	83.3	Confident	66 Å²	66	75.7 Å²	75.7	33%	0.325	37%	0.365	S	S	.	.	P	Polyproline II helix	trans	-91.2	129	173.7	-68.8	-69.1	136.5	0	0	108.4	R137 V175 R255	R137-M177 VanDerWaalsContact CD-CE 3.47Å; V175-M177 HydrophobicContact CG1-CE 4.05Å; M177-R255 PolarHBondContact SD-NH2 3.05Å
178	P	78.9	Confident	83.7	Confident	69 Å²	69	77.2 Å²	77.2	45%	0.448	38%	0.381	S	S	.	.	P	Polyproline II helix	trans	-59.5	142.7	171.5	25.9	-32.5	0	0	0	109.9
179	E	77.3	Confident	84	Confident	199 Å²	199	77.7 Å²	77.7	93%	0.93	38%	0.383	S	S	*	.	P	Polyproline II helix	trans	-59.4	144.5	168.4	-65.1	-171.4	165.2	0	0	109.5
180	Y	78.9	Confident	84	Confident	92 Å²	92	77.6 Å²	77.6	36%	0.361	38%	0.383	S	S	.	.			trans	-133.3	141.4	-179.6	67.5	-85.8	0	0	0	110.2	Y182 L186 P225 V252	Y180-Y182 HydrophobicContact CE2-CD2 4.03Å; Y180-L186 HydrophobicContact CD2-CD2 3.67Å; Y180-L186 HydrophobicContact CE2-CD2 3.59Å; Y180-P225 HydrophobicContact CE2-CG 4.36Å; Y180-P225 WeakPolarHBondContact OH-CD 3.2Å; Y180-V252 HydrophobicContact CD1-CB 4.24Å; Y180-V252 HydrophobicContact CD1-CG2 3.59Å; Y180-V252 HydrophobicContact CD2-CG1 4.48Å; Y180-V252 HydrophobicContact CE1-CG2 4.02Å; Y180-V252 HydrophobicContact CE2-CG1 4.49Å; Y180-V252 HydrophobicContact CG-CB 4.2Å; Y180-V252 HydrophobicContact CG-CG1 4.49Å; Y180-V252 HydrophobicContact CG-CG2 4.01Å
181	E	77.9	Confident	83.9	Confident	166 Å²	166	83.3 Å²	83.3	78%	0.776	41%	0.409	S	S	*	.			trans	-83.7	138.2	172	-66.8	-173.3	168.4	0	0	110.2	T183	E181-T183 VanDerWaalsContact C-N 3.25Å; E181-T183 HydrophobicContact CB-CG2 4.4Å; E181-T183 PolarHBondContact O-N 3.23Å
182	Y	78.5	Confident	83.8	Confident	110 Å²	110	83.2 Å²	83.2	43%	0.431	41%	0.409	S	S	.	.			trans	-81.5	72.6	179.9	-151.2	-86.7	0	0	0	110.5	Y180 L186 K187 P225	Y180-Y182 HydrophobicContact CE2-CD2 4.03Å; Y182-L186 HydrophobicContact CD2-CD2 3.73Å; Y182-L186 HydrophobicContact CE2-CD2 3.93Å; Y182-L186 HydrophobicContact CG-CD2 4.22Å; Y182-K187 HydrophobicContact CD1-CB 4.34Å; Y182-K187 HydrophobicContact CE1-CB 3.78Å; Y182-K187 HydrophobicContact CE1-CD 4.43Å; Y182-K187 HydrophobicContact CE1-CG 4.02Å; Y182-P225 HydrophobicContact CE2-CG 3.69Å
183	T	84.9	Confident	83.6	Confident	64 Å²	64	83 Å²	83	39%	0.393	41%	0.408	S	S	.	.			trans	-68.8	160.9	179.3	63.9	0	0	0	0	112.1	E181 E185 L186 K187	E181-T183 VanDerWaalsContact C-N 3.25Å; E181-T183 HydrophobicContact CB-CG2 4.4Å; E181-T183 PolarHBondContact O-N 3.23Å; T183-E185 PolarHBondContact O-N 3.14Å; T183-L186 PolarHBondContact O-N 2.68Å; T183-L186 PolarHBondContact OG1-N 3.19Å; T183-K187 PolarHBondContact O-N 3.29Å
184	D	84.2	Confident	83.4	Confident	135 Å²	135	80.1 Å²	80.1	72%	0.722	40%	0.395	S	S	*	.	H	α-helix	trans	-60.3	-32.7	175.6	-76.2	-38.6	0	0	0	112.4	K187 A188	D184-K187 PolarHBondContact O-N 3.03Å; D184-A188 WeakPolarHBondContact O-CB 3.41Å; D184-A188 PolarHBondContact O-N 2.94Å
185	E	82.5	Confident	83.3	Confident	154 Å²	154	82.2 Å²	82.2	72%	0.72	40%	0.401	S	S	*	.	H	α-helix	trans	-62.6	-48.9	173.7	-65.7	-177.9	169.4	0	0	111.5	T183 K187 A188 M189	T183-E185 PolarHBondContact O-N 3.14Å; E185-K187 VanDerWaalsContact C-N 3.27Å; E185-K187 PolarHBondContact O-N 3.28Å; E185-A188 PolarHBondContact O-N 3.39Å; E185-A188 VanDerWaalsContact O-N 3.17Å; E185-M189 VanDerWaalsContact O-CG 3.27Å; E185-M189 WeakPolarHBondContact O-CG 3.33Å; E185-M189 PolarHBondContact O-N 2.84Å
186	L	84.7	Confident	83.4	Confident	2 Å²	2	81.3 Å²	81.3	1%	0.01	40%	0.396	C	S	.	.	H	α-helix	trans	-60.4	-40.1	178	-162.4	93.9	0	0	0	111.3	Y180 Y182 T183 M189 T190 P225 V252 P253 L256	Y180-L186 HydrophobicContact CD2-CD2 3.67Å; Y180-L186 HydrophobicContact CE2-CD2 3.59Å; Y182-L186 HydrophobicContact CD2-CD2 3.73Å; Y182-L186 HydrophobicContact CE2-CD2 3.93Å; Y182-L186 HydrophobicContact CG-CD2 4.22Å; T183-L186 PolarHBondContact O-N 2.68Å; T183-L186 PolarHBondContact OG1-N 3.19Å; L186-M189 PolarHBondContact O-N 3.25Å; L186-T190 WeakPolarHBondContact O-CB 3.27Å; L186-T190 PolarHBondContact O-N 3.3Å; L186-T190 PolarHBondContact O-OG1 3.2Å; L186-P225 HydrophobicContact CD2-CB 4.5Å; L186-P225 HydrophobicContact CD2-CG 3.91Å; L186-V252 HydrophobicContact CD1-CG1 4.25Å; L186-P253 HydrophobicContact CD1-CB 4.2Å; L186-P253 HydrophobicContact CD1-CG 3.75Å; L186-L256 HydrophobicContact CD1-CD1 3.94Å; L186-L256 HydrophobicContact CG-CD1 4.3Å
187	K	83.9	Confident	83.7	Confident	98 Å²	98	73.2 Å²	73.2	43%	0.426	36%	0.358	S	S	.	.	H	α-helix	trans	-63.3	-44.5	176.1	-173.8	177.6	178.8	-177	0	111.6	Y182 T183 D184 E185 T190 Q191	Y182-K187 HydrophobicContact CD1-CB 4.34Å; Y182-K187 HydrophobicContact CE1-CB 3.78Å; Y182-K187 HydrophobicContact CE1-CD 4.43Å; Y182-K187 HydrophobicContact CE1-CG 4.02Å; T183-K187 PolarHBondContact O-N 3.29Å; D184-K187 PolarHBondContact O-N 3.03Å; E185-K187 VanDerWaalsContact C-N 3.27Å; E185-K187 PolarHBondContact O-N 3.28Å; K187-T190 PolarHBondContact O-N 2.97Å; K187-Q191 WeakPolarHBondContact O-CG 3.45Å; K187-Q191 PolarHBondContact O-N 3.15Å
188	A	85.6	Confident	84.1	Confident	54 Å²	54	75.3 Å²	75.3	45%	0.446	36%	0.363	S	S	.	.	H	α-helix	trans	-62.4	-44.8	176.7	0	0	0	0	0	111.5	D184 E185 T190 Q191 E192	D184-A188 WeakPolarHBondContact O-CB 3.41Å; D184-A188 PolarHBondContact O-N 2.94Å; E185-A188 PolarHBondContact O-N 3.39Å; E185-A188 VanDerWaalsContact O-N 3.17Å; A188-T190 PolarHBondContact O-N 3.1Å; A188-Q191 PolarHBondContact O-N 3.41Å; A188-E192 PolarHBondContact O-N 2.77Å
189	M	85.5	Confident	84.5	Confident	37 Å²	37	74.8 Å²	74.8	18%	0.182	36%	0.356	C	S	.	.	H	α-helix	trans	-62.3	-44	177.1	-67.2	170.7	69.3	0	0	112.2	E185 L186 Q191 E192 V193 P253 L256 M257	E185-M189 VanDerWaalsContact O-CG 3.27Å; E185-M189 WeakPolarHBondContact O-CG 3.33Å; E185-M189 PolarHBondContact O-N 2.84Å; L186-M189 PolarHBondContact O-N 3.25Å; M189-Q191 VanDerWaalsContact C-N 3.31Å; M189-Q191 PolarHBondContact O-N 3.35Å; M189-E192 PolarHBondContact O-N 2.86Å; M189-V193 WeakPolarHBondContact O-CG2 3.4Å; M189-V193 PolarHBondContact O-N 3.03Å; M189-P253 WeakPolarHBondContact CE-O 3.48Å; M189-L256 HydrophobicContact CE-CB 3.76Å; M189-M257 HydrophobicContact CE-CB 4.16Å; M189-M257 HydrophobicContact CE-CG 3.21Å; M189-M257 HydrophobicContact CE-SD 4.45Å
190	T	86.1	Confident	84.9	Confident	3 Å²	3	65.4 Å²	65.4	2%	0.018	31%	0.312	C	S	.	.	H	α-helix	trans	-59.2	-43.7	176.5	-57.1	0	0	0	0	110.8	L186 K187 A188 V193 V194 V222 L228	L186-T190 WeakPolarHBondContact O-CB 3.27Å; L186-T190 PolarHBondContact O-N 3.3Å; L186-T190 PolarHBondContact O-OG1 3.2Å; K187-T190 PolarHBondContact O-N 2.97Å; A188-T190 PolarHBondContact O-N 3.1Å; T190-V193 PolarHBondContact O-N 2.84Å; T190-V194 WeakPolarHBondContact O-CG2 3.38Å; T190-V194 PolarHBondContact O-N 3.4Å; T190-V222 WeakPolarHBondContact CG2-O 3.47Å; T190-L228 HydrophobicContact CG2-CD2 3.55Å; T190-L228 WeakPolarHBondContact O-CD2 3.45Å
191	Q	87.2	Confident	85.1	Confident	119 Å²	119	61.9 Å²	61.9	56%	0.556	30%	0.3	S	S	*	.	H	α-helix	trans	-64.8	-40.1	176.2	-72.7	178.8	1.2	0	0	112.8	K187 A188 M189 V194 K195	K187-Q191 WeakPolarHBondContact O-CG 3.45Å; K187-Q191 PolarHBondContact O-N 3.15Å; A188-Q191 PolarHBondContact O-N 3.41Å; M189-Q191 VanDerWaalsContact C-N 3.31Å; M189-Q191 PolarHBondContact O-N 3.35Å; Q191-V194 PolarHBondContact O-N 2.87Å; Q191-K195 WeakPolarHBondContact O-CB 3.48Å; Q191-K195 PolarHBondContact O-N 3.06Å
192	E	89.8	Confident	85.4	Confident	59 Å²	59	57.9 Å²	57.9	28%	0.276	29%	0.291	S	S	.	.	H	α-helix	trans	-68.8	-36.2	178.9	-173.2	59.2	-160.6	0	0	112.1	A188 M189 K195 T196 L260 K264	A188-E192 PolarHBondContact O-N 2.77Å; M189-E192 PolarHBondContact O-N 2.86Å; E192-K195 PolarHBondContact O-N 3.46Å; E192-K195 IonicContact OE2-NZ 3.95Å; E192-T196 WeakPolarHBondContact O-CB 3.3Å; E192-T196 PolarHBondContact O-N 3.39Å; E192-T196 PolarHBondContact O-OG1 3.15Å; E192-L260 HydrophobicContact CB-CD2 4.45Å; E192-L260 HydrophobicContact CG-CD1 4.07Å; E192-L260 HydrophobicContact CG-CD2 4.04Å; E192-K264 WeakPolarHBondContact OE1-CE 3.42Å; E192-K264 IonicContact OE1-NZ 2.75Å; E192-K264 PolarHBondContact OE1-NZ 3.2Å
193	V	87.7	Confident	85.5	Confident	0 Å²	0	57 Å²	57	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-63	-49	171.1	170.8	0	0	0	0	110.6	M189 T190 K195 T196 I197 L228 L256 L260 L263	M189-V193 WeakPolarHBondContact O-CG2 3.4Å; M189-V193 PolarHBondContact O-N 3.03Å; T190-V193 PolarHBondContact O-N 2.84Å; V193-K195 VanDerWaalsContact C-N 3.3Å; V193-K195 PolarHBondContact O-N 2.8Å; V193-T196 PolarHBondContact O-N 3.18Å; V193-I197 HydrophobicContact CG1-CD1 3.91Å; V193-I197 HydrophobicContact CG1-CG1 4.48Å; V193-I197 WeakPolarHBondContact O-CG1 3.44Å; V193-I197 PolarHBondContact O-N 2.86Å; V193-L228 HydrophobicContact CB-CD2 3.88Å; V193-L228 HydrophobicContact CB-CG 4.37Å; V193-L228 HydrophobicContact CG1-CD1 4.11Å; V193-L228 HydrophobicContact CG1-CD2 3.66Å; V193-L228 HydrophobicContact CG1-CG 3.59Å; V193-L256 HydrophobicContact CG2-CD2 4.02Å; V193-L260 HydrophobicContact CB-CD1 4.49Å; V193-L260 HydrophobicContact CG2-CB 3.79Å; V193-L260 HydrophobicContact CG2-CD1 3.75Å; V193-L260 HydrophobicContact CG2-CG 4.22Å; V193-L263 HydrophobicContact CG1-CD1 3.68Å
194	V	86.6	Confident	85.2	Confident	10 Å²	10	56.5 Å²	56.5	6%	0.061	28%	0.284	C	S	.	.	H	α-helix	trans	-58.7	-42	176.3	170.9	0	0	0	0	111.6	L5 T190 Q191 R198 V222 L228	L5-V194 HydrophobicContact CD2-CG1 4.31Å; T190-V194 WeakPolarHBondContact O-CG2 3.38Å; T190-V194 PolarHBondContact O-N 3.4Å; Q191-V194 PolarHBondContact O-N 2.87Å; V194-R198 WeakPolarHBondContact O-CG 3.21Å; V194-R198 PolarHBondContact O-N 2.91Å; V194-R198 VanDerWaalsContact O-N 3.11Å; V194-V222 HydrophobicContact CG2-CG1 4.32Å; V194-L228 HydrophobicContact CG2-CD1 3.89Å; V194-L228 HydrophobicContact CG2-CD2 3.78Å
195	K	87.7	Confident	84.8	Confident	96 Å²	96	54.7 Å²	54.7	42%	0.417	28%	0.279	S	S	.	.	H	α-helix	trans	-62.4	-47.1	175.6	-178	-173.9	169.6	-165.8	0	111.5	Q191 E192 V193 I197 R198 D199	Q191-K195 WeakPolarHBondContact O-CB 3.48Å; Q191-K195 PolarHBondContact O-N 3.06Å; E192-K195 PolarHBondContact O-N 3.46Å; E192-K195 IonicContact OE2-NZ 3.95Å; V193-K195 VanDerWaalsContact C-N 3.3Å; V193-K195 PolarHBondContact O-N 2.8Å; K195-I197 PolarHBondContact O-N 3.3Å; K195-R198 WeakPolarHBondContact O-CB 3.48Å; K195-R198 PolarHBondContact O-N 3.47Å; K195-R198 VanDerWaalsContact O-N 3.13Å; K195-D199 PolarHBondContact O-N 2.88Å
196	T	88.7	Confident	84.5	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-63.6	-40.9	-179.2	-55	0	0	0	0	111.5	E192 V193 R198 D199 I200 L263 K264 L267	E192-T196 WeakPolarHBondContact O-CB 3.3Å; E192-T196 PolarHBondContact O-N 3.39Å; E192-T196 PolarHBondContact O-OG1 3.15Å; V193-T196 PolarHBondContact O-N 3.18Å; T196-R198 VanDerWaalsContact C-N 3.33Å; T196-R198 PolarHBondContact O-N 2.72Å; T196-D199 PolarHBondContact O-N 3.34Å; T196-I200 HydrophobicContact CG2-CD1 4.3Å; T196-I200 WeakPolarHBondContact O-CG1 3.4Å; T196-I200 PolarHBondContact O-N 3.33Å; T196-L263 HydrophobicContact CG2-CB 3.83Å; T196-K264 HydrophobicContact CG2-CD 4.08Å; T196-K264 WeakPolarHBondContact OG1-CE 3.37Å; T196-K264 PolarHBondContact OG1-NZ 3.39Å; T196-K264 VanDerWaalsContact OG1-NZ 3.09Å; T196-L267 HydrophobicContact CG2-CB 4.26Å; T196-L267 HydrophobicContact CG2-CD2 4.09Å
197	I	85.8	Confident	83.9	Confident	4 Å²	4	54.5 Å²	54.5	2%	0.021	28%	0.283	C	S	.	.	H	α-helix	trans	-60	-43.1	173.4	-68.9	170.5	0	0	0	111	L5 V193 K195 D199 I200 V201 I211 L228 L235 L263	L5-I197 HydrophobicContact CD2-CG2 4.21Å; V193-I197 HydrophobicContact CG1-CD1 3.91Å; V193-I197 HydrophobicContact CG1-CG1 4.48Å; V193-I197 WeakPolarHBondContact O-CG1 3.44Å; V193-I197 PolarHBondContact O-N 2.86Å; K195-I197 PolarHBondContact O-N 3.3Å; I197-D199 PolarHBondContact O-N 2.96Å; I197-I200 PolarHBondContact O-N 3.42Å; I197-V201 HydrophobicContact CG2-CG2 4.43Å; I197-V201 VanDerWaalsContact O-CG2 3.27Å; I197-V201 WeakPolarHBondContact O-CG2 3.12Å; I197-V201 PolarHBondContact O-N 2.99Å; I197-I211 HydrophobicContact CG2-CD1 4.01Å; I197-L228 HydrophobicContact CD1-CD1 3.95Å; I197-L235 HydrophobicContact CG2-CD1 4.11Å; I197-L263 HydrophobicContact CD1-CD1 4.24Å; I197-L263 HydrophobicContact CG1-CD1 3.89Å; I197-L263 HydrophobicContact CG1-CD2 3.89Å
198	R	84.3	Confident	83.4	Confident	111 Å²	111	55.3 Å²	55.3	42%	0.419	28%	0.283	S	S	.	.	H	α-helix	trans	-62.4	-43	176.7	-74.5	-171.2	-74.2	164.3	0.6	112.8	A4 L5 V194 K195 T196 I200 V201 S202	A4-R198 WeakPolarHBondContact O-CD 3.25Å; L5-R198 HydrophobicContact CD2-CG 4.23Å; L5-R198 VanDerWaalsContact O-CD 3.24Å; L5-R198 WeakPolarHBondContact O-CD 3.38Å; L5-R198 WeakPolarHBondContact O-CG 3.26Å; V194-R198 WeakPolarHBondContact O-CG 3.21Å; V194-R198 PolarHBondContact O-N 2.91Å; V194-R198 VanDerWaalsContact O-N 3.11Å; K195-R198 WeakPolarHBondContact O-CB 3.48Å; K195-R198 PolarHBondContact O-N 3.47Å; K195-R198 VanDerWaalsContact O-N 3.13Å; T196-R198 VanDerWaalsContact C-N 3.33Å; T196-R198 PolarHBondContact O-N 2.72Å; R198-I200 VanDerWaalsContact C-N 3.32Å; R198-I200 PolarHBondContact O-N 3.32Å; R198-V201 PolarHBondContact O-N 2.93Å; R198-S202 PolarHBondContact O-N 3.36Å
199	D	87.5	Confident	82.7	Confident	57 Å²	57	58.2 Å²	58.2	31%	0.305	29%	0.287	S	S	.	.	H	α-helix	trans	-62	-43.5	178.4	-66.5	-17.5	0	0	0	110.1	K195 T196 I197 V201 S202 F203 L267	K195-D199 PolarHBondContact O-N 2.88Å; T196-D199 PolarHBondContact O-N 3.34Å; I197-D199 PolarHBondContact O-N 2.96Å; D199-V201 PolarHBondContact O-N 3.14Å; D199-S202 WeakPolarHBondContact O-CB 3.24Å; D199-S202 PolarHBondContact O-N 2.61Å; D199-S202 PolarHBondContact O-OG 3.22Å; D199-F203 WeakPolarHBondContact O-CD2 3.19Å; D199-F203 PolarHBondContact O-N 2.84Å; D199-L267 HydrophobicContact CB-CD1 3.68Å; D199-L267 HydrophobicContact CB-CD2 4.07Å
200	I	85.2	Confident	81.9	Confident	2 Å²	2	59.7 Å²	59.7	1%	0.01	30%	0.298	C	S	.	.	H	α-helix	trans	-60	-47.4	175.2	-67	165.5	0	0	0	111.3	T196 I197 R198 S202 F203 N204 I207 L263 E266 L267	T196-I200 HydrophobicContact CG2-CD1 4.3Å; T196-I200 WeakPolarHBondContact O-CG1 3.4Å; T196-I200 PolarHBondContact O-N 3.33Å; I197-I200 PolarHBondContact O-N 3.42Å; R198-I200 VanDerWaalsContact C-N 3.32Å; R198-I200 PolarHBondContact O-N 3.32Å; I200-S202 PolarHBondContact O-N 3.3Å; I200-F203 PolarHBondContact O-N 3.31Å; I200-N204 PolarHBondContact O-N 3.47Å; I200-I207 HydrophobicContact CG2-CD1 3.62Å; I200-L263 HydrophobicContact CD1-CB 4.4Å; I200-L263 HydrophobicContact CD1-CD2 3.65Å; I200-E266 HydrophobicContact CD1-CB 4.19Å; I200-E266 HydrophobicContact CD1-CG 4.25Å; I200-L267 HydrophobicContact CD1-CB 4.33Å; I200-L267 HydrophobicContact CG1-CB 3.83Å; I200-L267 HydrophobicContact CG1-CD1 4Å; I200-L267 HydrophobicContact CG1-CG 4.49Å
201	V	83.7	Confident	81.2	Confident	18 Å²	18	59.6 Å²	59.6	11%	0.109	30%	0.297	C	S	.	.	H	α-helix	trans	-59.8	-32.2	178.3	170.2	0	0	0	0	112	F6 I197 R198 D199 F203 N204 I207 R208 I211	F6-V201 HydrophobicContact CD1-CG1 4.41Å; F6-V201 HydrophobicContact CE1-CG1 4.1Å; I197-V201 HydrophobicContact CG2-CG2 4.43Å; I197-V201 VanDerWaalsContact O-CG2 3.27Å; I197-V201 WeakPolarHBondContact O-CG2 3.12Å; I197-V201 PolarHBondContact O-N 2.99Å; R198-V201 PolarHBondContact O-N 2.93Å; D199-V201 PolarHBondContact O-N 3.14Å; V201-F203 VanDerWaalsContact C-N 3.28Å; V201-F203 PolarHBondContact O-N 3.09Å; V201-N204 CarbonylContact O-C 3.55Å; V201-N204 PolarHBondContact O-N 3.07Å; V201-I207 HydrophobicContact CG2-CG2 4.05Å; V201-R208 HydrophobicContact CG1-CB 3.93Å; V201-R208 HydrophobicContact CG1-CG 4.48Å; V201-I211 HydrophobicContact CG2-CD1 3.56Å
202	S	84.1	Confident	80.2	Confident	83 Å²	83	57.3 Å²	57.3	58%	0.58	29%	0.288	S	S	*	.	H	α-helix	trans	-67	-28.4	176.9	80.1	0	0	0	0	113.4	R198 D199 I200	R198-S202 PolarHBondContact O-N 3.36Å; D199-S202 WeakPolarHBondContact O-CB 3.24Å; D199-S202 PolarHBondContact O-N 2.61Å; D199-S202 PolarHBondContact O-OG 3.22Å; I200-S202 PolarHBondContact O-N 3.3Å
203	F	80.8	Confident	78.9	Confident	92 Å²	92	61.1 Å²	61.1	40%	0.404	31%	0.306	S	S	.	.	H	α-helix	trans	-89.2	-29.1	177.1	-69.8	-69.2	0	0	0	113	D199 I200 V201 L267 K271 A274	D199-F203 WeakPolarHBondContact O-CD2 3.19Å; D199-F203 PolarHBondContact O-N 2.84Å; I200-F203 PolarHBondContact O-N 3.31Å; V201-F203 VanDerWaalsContact C-N 3.28Å; V201-F203 PolarHBondContact O-N 3.09Å; F203-L267 HydrophobicContact CD2-CD1 4.01Å; F203-L267 HydrophobicContact CE2-CD1 4Å; F203-K271 HydrophobicContact CD2-CG 4.37Å; F203-K271 HydrophobicContact CE1-CG 4.45Å; F203-K271 HydrophobicContact CE2-CG 3.77Å; F203-K271 HydrophobicContact CZ-CG 3.82Å; F203-A274 HydrophobicContact CD1-CB 3.97Å; F203-A274 HydrophobicContact CE1-CB 4.46Å
204	N	77.1	Confident	77.8	Confident	52 Å²	52	63.3 Å²	63.3	28%	0.278	32%	0.319	S	S	.	.			trans	-128.7	93.8	179.6	-170.5	-12.6	0	0	0	111.8	I200 V201 L206 I207	I200-N204 PolarHBondContact O-N 3.47Å; V201-N204 CarbonylContact O-C 3.55Å; V201-N204 PolarHBondContact O-N 3.07Å; N204-L206 PolarHBondContact O-N 3.12Å; N204-L206 VanDerWaalsContact O-N 3.15Å; N204-L206 WeakPolarHBondContact OD1-CB 3.47Å; N204-L206 PolarHBondContact OD1-N 3.29Å; N204-I207 HydrophobicContact CB-CD1 3.76Å; N204-I207 HydrophobicContact CB-CG1 4Å; N204-I207 WeakPolarHBondContact O-CB 3.42Å; N204-I207 PolarHBondContact O-N 3.42Å; N204-I207 VanDerWaalsContact O-N 3.15Å
205	P	76.6	Confident	76.6	Confident	97 Å²	97	63.6 Å²	63.6	63%	0.63	32%	0.32	S	S	*	.	H	α-helix	trans	-60.5	-23.4	-179.7	-23.8	33.6	0	0	0	114.3	I207 R208	P205-I207 VanDerWaalsContact C-N 3.27Å; P205-I207 PolarHBondContact O-N 3.05Å; P205-R208 WeakPolarHBondContact O-CB 3.36Å; P205-R208 PolarHBondContact O-N 3.39Å; P205-R208 VanDerWaalsContact O-N 3.14Å
206	L	75.6	Confident	75.3	Confident	133 Å²	133	64.9 Å²	64.9	70%	0.696	33%	0.326	S	S	*	.	H	α-helix	trans	-66	-33.3	178.7	-64.2	171	0	0	0	111.5	N204 R208 H209 T210	N204-L206 PolarHBondContact O-N 3.12Å; N204-L206 VanDerWaalsContact O-N 3.15Å; N204-L206 WeakPolarHBondContact OD1-CB 3.47Å; N204-L206 PolarHBondContact OD1-N 3.29Å; L206-R208 PolarHBondContact O-N 2.89Å; L206-H209 WeakPolarHBondContact O-CB 3.32Å; L206-H209 PolarHBondContact O-N 3.41Å; L206-T210 PolarHBondContact O-N 2.96Å; L206-T210 PolarHBondContact O-OG1 3.33Å
207	I	73.5	Confident	73.6	Confident	20 Å²	20	71.4 Å²	71.4	10%	0.103	37%	0.368	C	S	.	.	H	α-helix	trans	-62.3	-32.1	176	-61	179.7	0	0	0	110.6	I200 V201 N204 P205 H209 T210 I211 L235	I200-I207 HydrophobicContact CG2-CD1 3.62Å; V201-I207 HydrophobicContact CG2-CG2 4.05Å; N204-I207 HydrophobicContact CB-CD1 3.76Å; N204-I207 HydrophobicContact CB-CG1 4Å; N204-I207 WeakPolarHBondContact O-CB 3.42Å; N204-I207 PolarHBondContact O-N 3.42Å; N204-I207 VanDerWaalsContact O-N 3.15Å; P205-I207 VanDerWaalsContact C-N 3.27Å; P205-I207 PolarHBondContact O-N 3.05Å; I207-H209 VanDerWaalsContact C-N 3.28Å; I207-H209 PolarHBondContact O-N 2.96Å; I207-T210 PolarHBondContact O-N 2.96Å; I207-I211 HydrophobicContact CG2-CD1 3.87Å; I207-I211 HydrophobicContact CG2-CG1 4.16Å; I207-I211 WeakPolarHBondContact O-CB 3.46Å; I207-I211 VanDerWaalsContact O-CG1 3.3Å; I207-I211 WeakPolarHBondContact O-CG1 3.28Å; I207-I211 PolarHBondContact O-N 2.87Å; I207-L235 HydrophobicContact CG2-CD2 3.67Å
208	R	72.6	Confident	71.9	Confident	115 Å²	115	76.5 Å²	76.5	43%	0.434	40%	0.404	S	S	.	.	H	α-helix	trans	-57.1	-42.8	174.1	-176.9	167.1	-178.1	176.1	-0.8	111.6	F6 V201 P205 L206 M212	F6-R208 HydrophobicContact CD1-CG 3.9Å; F6-R208 HydrophobicContact CE1-CB 4.31Å; F6-R208 HydrophobicContact CE1-CG 3.57Å; F6-R208 HydrophobicContact CZ-CG 4.39Å; V201-R208 HydrophobicContact CG1-CB 3.93Å; V201-R208 HydrophobicContact CG1-CG 4.48Å; P205-R208 WeakPolarHBondContact O-CB 3.36Å; P205-R208 PolarHBondContact O-N 3.39Å; P205-R208 VanDerWaalsContact O-N 3.14Å; L206-R208 PolarHBondContact O-N 2.89Å; R208-M212 WeakPolarHBondContact O-CB 3.39Å; R208-M212 VanDerWaalsContact O-CG 3.28Å; R208-M212 WeakPolarHBondContact O-CG 3.48Å; R208-M212 PolarHBondContact O-N 3.17Å
209	H	70.6	Confident	70.6	Confident	115 Å²	115	73.3 Å²	73.3	53%	0.532	39%	0.394	S	S	.	.	H	α-helix	trans	-67.5	-44.7	179.4	-167.1	-90.6	0	0	0	111	L206 I207 I211 M212 Q213	L206-H209 WeakPolarHBondContact O-CB 3.32Å; L206-H209 PolarHBondContact O-N 3.41Å; I207-H209 VanDerWaalsContact C-N 3.28Å; I207-H209 PolarHBondContact O-N 2.96Å; H209-I211 VanDerWaalsContact C-N 3.35Å; H209-I211 PolarHBondContact O-N 3.1Å; H209-M212 WeakPolarHBondContact O-CB 3.39Å; H209-M212 PolarHBondContact O-N 3.48Å; H209-M212 VanDerWaalsContact O-N 3.16Å; H209-Q213 PolarHBondContact CE1-NE2 3.46Å; H209-Q213 VanDerWaalsContact ND1-CD 3.28Å; H209-Q213 PolarHBondContact ND1-OE1 3.37Å; H209-Q213 WeakPolarHBondContact O-CG 3.39Å; H209-Q213 PolarHBondContact O-N 2.89Å
210	T	68.7	Low	69.1	Low	67 Å²	67	79.7 Å²	79.7	41%	0.411	41%	0.414	S	S	.	.	H	α-helix	trans	-58.4	-44.9	175.7	-50.1	0	0	0	0	112	L206 I207 Q213 T214	L206-T210 PolarHBondContact O-N 2.96Å; L206-T210 PolarHBondContact O-OG1 3.33Å; I207-T210 PolarHBondContact O-N 2.96Å; T210-Q213 PolarHBondContact O-N 2.81Å; T210-T214 VanDerWaalsContact O-CB 3.3Å; T210-T214 WeakPolarHBondContact O-CB 3.4Å; T210-T214 PolarHBondContact O-N 3.29Å; T210-T214 PolarHBondContact O-OG1 2.79Å
211	I	71	Confident	67.9	Low	1 Å²	1	79.7 Å²	79.7	1%	0.005	41%	0.414	C	S	.	.	H	α-helix	trans	-62.6	-44.8	175.8	-68.8	174.2	0	0	0	110.8	L5 F6 I197 V201 I207 H209 Q213 T214 L215 L235	L5-I211 HydrophobicContact CD1-CG2 4.49Å; F6-I211 HydrophobicContact CZ-CB 4.49Å; F6-I211 HydrophobicContact CZ-CG2 3.89Å; I197-I211 HydrophobicContact CG2-CD1 4.01Å; V201-I211 HydrophobicContact CG2-CD1 3.56Å; I207-I211 HydrophobicContact CG2-CD1 3.87Å; I207-I211 HydrophobicContact CG2-CG1 4.16Å; I207-I211 WeakPolarHBondContact O-CB 3.46Å; I207-I211 VanDerWaalsContact O-CG1 3.3Å; I207-I211 WeakPolarHBondContact O-CG1 3.28Å; I207-I211 PolarHBondContact O-N 2.87Å; H209-I211 VanDerWaalsContact C-N 3.35Å; H209-I211 PolarHBondContact O-N 3.1Å; I211-Q213 VanDerWaalsContact C-N 3.32Å; I211-Q213 PolarHBondContact O-N 2.95Å; I211-T214 PolarHBondContact O-N 3.36Å; I211-L215 HydrophobicContact CG2-CD1 3.26Å; I211-L215 HydrophobicContact CG2-CG 4.07Å; I211-L215 WeakPolarHBondContact O-CB 3.47Å; I211-L215 WeakPolarHBondContact O-CG 3.44Å; I211-L215 PolarHBondContact O-N 3.23Å; I211-L235 HydrophobicContact CD1-CD1 3.72Å; I211-L235 HydrophobicContact CD1-CD2 4.16Å; I211-L235 HydrophobicContact CG1-CD1 3.88Å; I211-L235 HydrophobicContact CG1-CD2 3.63Å; I211-L235 HydrophobicContact CG1-CG 4.4Å
212	M	66.6	Low	66.8	Low	71 Å²	71	81 Å²	81	35%	0.35	42%	0.421	S	S	.	.	H	α-helix	trans	-60.6	-40.2	177.3	-77.3	-71.6	134.5	0	0	112.6	Q2 F6 R208 H209	Q2-M212 HydrophobicContact CG-CE 4.04Å; F6-M212 HydrophobicContact CD2-CE 3.38Å; F6-M212 HydrophobicContact CE1-CE 4.22Å; F6-M212 HydrophobicContact CE2-CE 2.87Å; F6-M212 HydrophobicContact CG-CE 4.25Å; F6-M212 HydrophobicContact CZ-CE 3.35Å; R208-M212 WeakPolarHBondContact O-CB 3.39Å; R208-M212 VanDerWaalsContact O-CG 3.28Å; R208-M212 WeakPolarHBondContact O-CG 3.48Å; R208-M212 PolarHBondContact O-N 3.17Å; H209-M212 WeakPolarHBondContact O-CB 3.39Å; H209-M212 PolarHBondContact O-N 3.48Å; H209-M212 VanDerWaalsContact O-N 3.16Å
213	Q	63.3	Low	66	Low	140 Å²	140	81.3 Å²	81.3	65%	0.654	42%	0.417	S	S	*	.	H	α-helix	trans	-71.4	-32.1	177.6	-72.3	-178.6	-47.6	0	0	112.8	H209 T210 I211	H209-Q213 PolarHBondContact CE1-NE2 3.46Å; H209-Q213 VanDerWaalsContact ND1-CD 3.28Å; H209-Q213 PolarHBondContact ND1-OE1 3.37Å; H209-Q213 WeakPolarHBondContact O-CG 3.39Å; H209-Q213 PolarHBondContact O-N 2.89Å; T210-Q213 PolarHBondContact O-N 2.81Å; I211-Q213 VanDerWaalsContact C-N 3.32Å; I211-Q213 PolarHBondContact O-N 2.95Å
214	T	63.6	Low	66	Low	45 Å²	45	79.4 Å²	79.4	28%	0.276	41%	0.411	S	S	.	.	H	α-helix	trans	-79.5	-32.8	-177.6	-58.3	0	0	0	0	112.2	L62 T210 I211 K216 L231	L62-T214 HydrophobicContact CD2-CG2 3.34Å; T210-T214 VanDerWaalsContact O-CB 3.3Å; T210-T214 WeakPolarHBondContact O-CB 3.4Å; T210-T214 PolarHBondContact O-N 3.29Å; T210-T214 PolarHBondContact O-OG1 2.79Å; I211-T214 PolarHBondContact O-N 3.36Å; T214-K216 PolarHBondContact O-N 2.97Å; T214-L231 HydrophobicContact CG2-CD1 3.98Å
215	L	62.3	Low	66.3	Low	17 Å²	17	76.9 Å²	76.9	9%	0.089	40%	0.397	C	S	.	.	S	Bend	trans	-84.7	112.9	-175.2	-69.1	172.5	0	0	0	112.1	M1 L5 I211 V221 Y227 L231	M1-L215 HydrophobicContact CE-CD2 4.42Å; M1-L215 HydrophobicContact SD-CB 4.3Å; M1-L215 HydrophobicContact SD-CD1 3.6Å; M1-L215 VanDerWaalsContact SD-CD1 3.6Å; M1-L215 HydrophobicContact SD-CD2 4.21Å; M1-L215 HydrophobicContact SD-CG 4.27Å; L5-L215 HydrophobicContact CD1-CD1 4.09Å; I211-L215 HydrophobicContact CG2-CD1 3.26Å; I211-L215 HydrophobicContact CG2-CG 4.07Å; I211-L215 WeakPolarHBondContact O-CB 3.47Å; I211-L215 WeakPolarHBondContact O-CG 3.44Å; I211-L215 PolarHBondContact O-N 3.23Å; L215-V221 HydrophobicContact CD1-CG2 4.29Å; L215-V221 HydrophobicContact CD2-CG2 3.26Å; L215-V221 HydrophobicContact CG-CG2 4.41Å; L215-Y227 HydrophobicContact CD2-CE1 3.91Å; L215-Y227 WeakPolarHBondContact CD2-OH 3.38Å; L215-L231 HydrophobicContact CD2-CD2 4.15Å
216	K	60.7	Low	66.7	Low	122 Å²	122	73.3 Å²	73.3	53%	0.53	37%	0.374	S	S	.	.			trans	-65.5	136.2	167.7	-65.5	-175.7	-179.1	-179.3	0	109.6	T214 S218 Q219	T214-K216 PolarHBondContact O-N 2.97Å; K216-S218 PolarHBondContact O-N 3.27Å; K216-Q219 HydrophobicContact CB-CG 4.27Å; K216-Q219 PolarHBondContact O-N 3.48Å
217	P	53.1	Low	67.1	Low	137 Å²	137	67.3 Å²	67.3	89%	0.89	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.9	-27	-174.3	-27.3	32.6	0	0	0	115.4
218	S	48.6	Very low	67.6	Low	111 Å²	111	66.4 Å²	66.4	78%	0.776	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93	-4.2	-173	43.9	0	0	0	0	115.5	K216	K216-S218 PolarHBondContact O-N 3.27Å
219	Q	57	Low	68.3	Low	45 Å²	45	61 Å²	61	21%	0.21	32%	0.317	C	S	.	.			trans	-84.5	152.4	-180	-66	-176.5	-0.8	0	0	111.2	M1 K216	M1-Q219 HydrophobicContact CE-CB 4.43Å; M1-Q219 WeakPolarHBondContact CE-O 3.29Å; K216-Q219 HydrophobicContact CB-CG 4.27Å; K216-Q219 PolarHBondContact O-N 3.48Å
220	R	56.7	Low	69.1	Low	191 Å²	191	55.6 Å²	55.6	72%	0.721	29%	0.292	S	S	*	.			trans	-113.1	89.6	169.6	-63.1	-173.6	-158.9	175.1	8	108.6	V222 D223	R220-V222 PolarHBondContact O-N 3.38Å; R220-D223 HydrophobicContact CB-CB 4.16Å; R220-D223 WeakPolarHBondContact CD-OD2 3.17Å; R220-D223 IonicContact NH1-OD2 2.91Å; R220-D223 PolarHBondContact NH1-OD2 2.85Å; R220-D223 PolarHBondContact O-N 2.84Å
221	V	59.5	Low	69.9	Low	1 Å²	1	52.6 Å²	52.6	1%	0.006	27%	0.273	C	S	.	.	G	3₁₀ helix	trans	-57.2	-41	-176.9	-163.5	0	0	0	0	112.1	M1 L215 D223 N224 Y227 L228 L231	M1-V221 HydrophobicContact CE-CG2 3.66Å; M1-V221 HydrophobicContact CG-CG2 4.12Å; M1-V221 HydrophobicContact SD-CG2 3.56Å; M1-V221 VanDerWaalsContact SD-CG2 3.56Å; L215-V221 HydrophobicContact CD1-CG2 4.29Å; L215-V221 HydrophobicContact CD2-CG2 3.26Å; L215-V221 HydrophobicContact CG-CG2 4.41Å; V221-D223 PolarHBondContact O-N 2.84Å; V221-N224 PolarHBondContact O-N 2.93Å; V221-Y227 HydrophobicContact CB-CD1 4.16Å; V221-Y227 HydrophobicContact CB-CE1 4.18Å; V221-Y227 HydrophobicContact CG1-CD1 3.65Å; V221-Y227 HydrophobicContact CG1-CE1 3.77Å; V221-Y227 HydrophobicContact CG2-CD1 4.32Å; V221-Y227 HydrophobicContact CG2-CE1 3.87Å; V221-L228 HydrophobicContact CG1-CB 4.45Å; V221-L228 HydrophobicContact CG1-CD1 3.85Å; V221-L231 HydrophobicContact CG1-CD2 3.76Å
222	V	60.6	Low	70.5	Confident	45 Å²	45	52.5 Å²	52.5	27%	0.273	27%	0.273	S	S	.	.	G	3₁₀ helix	trans	-66.7	-26.4	-172.9	-170.5	0	0	0	0	111.8	A4 T190 V194 R220	A4-V222 HydrophobicContact CB-CG2 4.28Å; T190-V222 WeakPolarHBondContact CG2-O 3.47Å; V194-V222 HydrophobicContact CG2-CG1 4.32Å; R220-V222 PolarHBondContact O-N 3.38Å
223	D	68.6	Low	71.4	Confident	90 Å²	90	49.1 Å²	49.1	48%	0.481	26%	0.256	S	S	.	.	G	3₁₀ helix	trans	-90.8	-8.8	-176.1	-58.8	-10.7	0	0	0	112	R220 V221 P225	R220-D223 HydrophobicContact CB-CB 4.16Å; R220-D223 WeakPolarHBondContact CD-OD2 3.17Å; R220-D223 IonicContact NH1-OD2 2.91Å; R220-D223 PolarHBondContact NH1-OD2 2.85Å; R220-D223 PolarHBondContact O-N 2.84Å; V221-D223 PolarHBondContact O-N 2.84Å; D223-P225 WeakPolarHBondContact O-CD 3.32Å
224	N	80.4	Confident	72.3	Confident	52 Å²	52	44.9 Å²	44.9	28%	0.278	25%	0.245	S	C	.	.			trans	-119.3	94.7	-178.8	-170.7	-40.4	0	0	0	110.4	V221 V226 Y227 L228	V221-N224 PolarHBondContact O-N 2.93Å; N224-V226 PolarHBondContact O-N 2.98Å; N224-V226 WeakPolarHBondContact OD1-CB 3.43Å; N224-V226 PolarHBondContact OD1-N 2.96Å; N224-Y227 PolarHBondContact O-N 3.26Å; N224-Y227 PolarHBondContact OD1-N 2.95Å; N224-L228 WeakPolarHBondContact O-CB 3.3Å; N224-L228 PolarHBondContact O-N 2.85Å
225	P	82.9	Confident	73.2	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-61.3	-31.2	-177.3	-20.9	31.5	0	0	0	113.4	Y180 Y182 L186 D223 L228 S229 V252 L256	Y180-P225 HydrophobicContact CE2-CG 4.36Å; Y180-P225 WeakPolarHBondContact OH-CD 3.2Å; Y182-P225 HydrophobicContact CE2-CG 3.69Å; L186-P225 HydrophobicContact CD2-CB 4.5Å; L186-P225 HydrophobicContact CD2-CG 3.91Å; D223-P225 WeakPolarHBondContact O-CD 3.32Å; P225-L228 PolarHBondContact O-N 3.43Å; P225-S229 WeakPolarHBondContact O-CB 3.35Å; P225-S229 PolarHBondContact O-N 3.34Å; P225-S229 PolarHBondContact O-OG 3.24Å; P225-V252 HydrophobicContact CB-CG1 3.94Å; P225-L256 HydrophobicContact CB-CD1 3.41Å; P225-L256 VanDerWaalsContact CB-CD1 3.41Å; P225-L256 HydrophobicContact CB-CD2 4.3Å; P225-L256 HydrophobicContact CB-CG 4.26Å
226	V	85.3	Confident	74.2	Confident	22 Å²	22	43.5 Å²	43.5	13%	0.133	24%	0.236	C	C	.	.	H	α-helix	trans	-63.4	-53	174.7	169.9	0	0	0	0	110.6	N224 L228 S229 D230 V252	N224-V226 PolarHBondContact O-N 2.98Å; N224-V226 WeakPolarHBondContact OD1-CB 3.43Å; N224-V226 PolarHBondContact OD1-N 2.96Å; V226-L228 VanDerWaalsContact C-N 3.27Å; V226-L228 PolarHBondContact O-N 2.99Å; V226-S229 PolarHBondContact O-N 3.12Å; V226-S229 PolarHBondContact O-OG 3.46Å; V226-D230 PolarHBondContact O-N 3.25Å; V226-D230 VanDerWaalsContact O-N 3.1Å; V226-V252 HydrophobicContact CG2-CB 4.45Å; V226-V252 HydrophobicContact CG2-CG1 3.96Å; V226-V252 HydrophobicContact CG2-CG2 3.68Å
227	Y	83.4	Confident	75.2	Confident	6 Å²	6	40.3 Å²	40.3	2%	0.024	24%	0.238	C	C	.	.	H	α-helix	trans	-64.4	-35.2	179	-179.4	-117.9	0	0	0	112	K61 L62 L215 V221 N224 D230 L231	K61-Y227 HydrophobicContact CB-CD2 4Å; K61-Y227 HydrophobicContact CB-CE2 3.62Å; K61-Y227 HydrophobicContact CD-CD2 3.69Å; K61-Y227 HydrophobicContact CD-CE2 4Å; K61-Y227 HydrophobicContact CD-CG 4.25Å; K61-Y227 HydrophobicContact CG-CD2 4.42Å; K61-Y227 HydrophobicContact CG-CE2 4.46Å; L62-Y227 HydrophobicContact CD2-CE2 4.42Å; L215-Y227 HydrophobicContact CD2-CE1 3.91Å; L215-Y227 WeakPolarHBondContact CD2-OH 3.38Å; V221-Y227 HydrophobicContact CB-CD1 4.16Å; V221-Y227 HydrophobicContact CB-CE1 4.18Å; V221-Y227 HydrophobicContact CG1-CD1 3.65Å; V221-Y227 HydrophobicContact CG1-CE1 3.77Å; V221-Y227 HydrophobicContact CG2-CD1 4.32Å; V221-Y227 HydrophobicContact CG2-CE1 3.87Å; N224-Y227 PolarHBondContact O-N 3.26Å; N224-Y227 PolarHBondContact OD1-N 2.95Å; Y227-D230 PolarHBondContact O-N 3.36Å; Y227-L231 VanDerWaalsContact O-CB 3.31Å; Y227-L231 WeakPolarHBondContact O-CB 3.5Å; Y227-L231 PolarHBondContact O-N 2.9Å
228	L	84.5	Confident	76.8	Confident	2 Å²	2	34.7 Å²	34.7	1%	0.01	20%	0.203	C	C	.	.	H	α-helix	trans	-63.9	-40.9	175	-175	69.2	0	0	0	112	T190 V193 V194 I197 V221 N224 P225 V226 G232	T190-L228 HydrophobicContact CG2-CD2 3.55Å; T190-L228 WeakPolarHBondContact O-CD2 3.45Å; V193-L228 HydrophobicContact CB-CD2 3.88Å; V193-L228 HydrophobicContact CB-CG 4.37Å; V193-L228 HydrophobicContact CG1-CD1 4.11Å; V193-L228 HydrophobicContact CG1-CD2 3.66Å; V193-L228 HydrophobicContact CG1-CG 3.59Å; V194-L228 HydrophobicContact CG2-CD1 3.89Å; V194-L228 HydrophobicContact CG2-CD2 3.78Å; I197-L228 HydrophobicContact CD1-CD1 3.95Å; V221-L228 HydrophobicContact CG1-CB 4.45Å; V221-L228 HydrophobicContact CG1-CD1 3.85Å; N224-L228 WeakPolarHBondContact O-CB 3.3Å; N224-L228 PolarHBondContact O-N 2.85Å; P225-L228 PolarHBondContact O-N 3.43Å; V226-L228 VanDerWaalsContact C-N 3.27Å; V226-L228 PolarHBondContact O-N 2.99Å; L228-G232 PolarHBondContact O-N 3.16Å
229	S	86.7	Confident	78.7	Confident	0 Å²	0	35 Å²	35	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-65	-39.7	177	65.9	0	0	0	0	112.5	P225 V226 G232 C233 R255 S259	P225-S229 WeakPolarHBondContact O-CB 3.35Å; P225-S229 PolarHBondContact O-N 3.34Å; P225-S229 PolarHBondContact O-OG 3.24Å; V226-S229 PolarHBondContact O-N 3.12Å; V226-S229 PolarHBondContact O-OG 3.46Å; S229-G232 PolarHBondContact O-N 2.94Å; S229-C233 PolarHBondContact O-N 2.7Å; S229-R255 WeakPolarHBondContact OG-CD 3.27Å; S229-S259 PolarHBondContact O-OG 2.94Å
230	D	88.3	Confident	80.1	Confident	2 Å²	2	33.2 Å²	33.2	1%	0.011	19%	0.189	C	C	.	.	H	α-helix	trans	-68.9	-46.1	178.8	-68	-8.8	0	0	0	111	F59 R137 V226 Y227 G232 C233 A234	F59-D230 HydrophobicContact CB-CB 3.98Å; F59-D230 HydrophobicContact CD1-CB 3.77Å; F59-D230 WeakPolarHBondContact CD1-OD1 3.38Å; F59-D230 HydrophobicContact CG-CB 4.07Å; R137-D230 IonicContact CZ-OD1 2.84Å; R137-D230 IonicContact CZ-OD2 3.17Å; R137-D230 IonicContact NH1-OD2 3.77Å; R137-D230 PolarHBondContact NH1-OD2 3.37Å; R137-D230 IonicContact NH2-OD1 3.94Å; R137-D230 PolarHBondContact NH2-OD1 2.96Å; R137-D230 IonicContact NH2-OD2 2.84Å; R137-D230 PolarHBondContact NH2-OD2 3.49Å; V226-D230 PolarHBondContact O-N 3.25Å; V226-D230 VanDerWaalsContact O-N 3.1Å; Y227-D230 PolarHBondContact O-N 3.36Å; D230-G232 VanDerWaalsContact C-N 3.35Å; D230-C233 PolarHBondContact O-N 2.89Å; D230-A234 PolarHBondContact O-N 3.25Å; D230-A234 VanDerWaalsContact O-N 3.09Å
231	L	84.7	Confident	81.7	Confident	4 Å²	4	30.1 Å²	30.1	2%	0.021	18%	0.182	C	C	.	.	H	α-helix	trans	-62.4	-43.1	174.5	-178.9	67	0	0	0	111.3	L62 T214 L215 V221 Y227 C233 A234 L235	L62-L231 HydrophobicContact CD2-CD1 4.48Å; T214-L231 HydrophobicContact CG2-CD1 3.98Å; L215-L231 HydrophobicContact CD2-CD2 4.15Å; V221-L231 HydrophobicContact CG1-CD2 3.76Å; Y227-L231 VanDerWaalsContact O-CB 3.31Å; Y227-L231 WeakPolarHBondContact O-CB 3.5Å; Y227-L231 PolarHBondContact O-N 2.9Å; L231-C233 VanDerWaalsContact C-N 3.34Å; L231-C233 PolarHBondContact O-N 3.26Å; L231-A234 PolarHBondContact O-N 3.28Å; L231-L235 HydrophobicContact CG-CD1 4.25Å; L231-L235 VanDerWaalsContact O-CG 3.29Å; L231-L235 WeakPolarHBondContact O-CG 3.29Å; L231-L235 PolarHBondContact O-N 2.97Å
232	G	84.7	Confident	83.3	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-57.1	-47.6	177.6	0	0	0	0	0	112	L228 S229 D230 L235 T236 L263	L228-G232 PolarHBondContact O-N 3.16Å; S229-G232 PolarHBondContact O-N 2.94Å; D230-G232 VanDerWaalsContact C-N 3.35Å; G232-L235 PolarHBondContact O-N 3.14Å; G232-T236 WeakPolarHBondContact O-CG2 3.3Å; G232-L263 WeakPolarHBondContact O-CD2 3.15Å
233	C	84.9	Confident	84.7	Confident	0 Å²	0	31.2 Å²	31.2	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-61.7	-44	177.2	-170.6	0	0	0	0	112.6	F59 S229 D230 L231 L235 T236 M243 I246	F59-C233 HydrophobicContact CE2-CB 4.23Å; F59-C233 HydrophobicContact CZ-CB 3.96Å; S229-C233 PolarHBondContact O-N 2.7Å; D230-C233 PolarHBondContact O-N 2.89Å; L231-C233 VanDerWaalsContact C-N 3.34Å; L231-C233 PolarHBondContact O-N 3.26Å; C233-L235 PolarHBondContact O-N 3.12Å; C233-L235 VanDerWaalsContact O-N 3.15Å; C233-T236 PolarHBondContact O-N 3.45Å; C233-T236 PolarHBondContact O-OG1 3.25Å; C233-M243 VanDerWaalsContact SG-CG 3.57Å; C233-I246 HydrophobicContact CB-CD1 4.08Å; C233-I246 HydrophobicContact CB-CG2 4.45Å
234	A	82.9	Confident	85.9	Confident	50 Å²	50	27 Å²	27	41%	0.413	16%	0.164	S	C	.	.	H	α-helix	trans	-64.8	-17	-179.3	0	0	0	0	0	114.1	L62 D230 L231	L62-A234 HydrophobicContact CD1-CB 3.45Å; L62-A234 VanDerWaalsContact CD1-CB 3.45Å; D230-A234 PolarHBondContact O-N 3.25Å; D230-A234 VanDerWaalsContact O-N 3.09Å; L231-A234 PolarHBondContact O-N 3.28Å
235	L	81.4	Confident	86.5	Confident	23 Å²	23	26 Å²	26	12%	0.12	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90	-5.7	176.7	-64	167.8	0	0	0	113.3	I197 I207 I211 L231 G232 C233	I197-L235 HydrophobicContact CG2-CD1 4.11Å; I207-L235 HydrophobicContact CG2-CD2 3.67Å; I211-L235 HydrophobicContact CD1-CD1 3.72Å; I211-L235 HydrophobicContact CD1-CD2 4.16Å; I211-L235 HydrophobicContact CG1-CD1 3.88Å; I211-L235 HydrophobicContact CG1-CD2 3.63Å; I211-L235 HydrophobicContact CG1-CG 4.4Å; L231-L235 HydrophobicContact CG-CD1 4.25Å; L231-L235 VanDerWaalsContact O-CG 3.29Å; L231-L235 WeakPolarHBondContact O-CG 3.29Å; L231-L235 PolarHBondContact O-N 2.97Å; G232-L235 PolarHBondContact O-N 3.14Å; C233-L235 PolarHBondContact O-N 3.12Å; C233-L235 VanDerWaalsContact O-N 3.15Å
236	T	84	Confident	86.9	Confident	11 Å²	11	26.1 Å²	26.1	7%	0.067	16%	0.164	C	C	.	.	S	Bend	trans	-100	152.4	-178.5	65.9	0	0	0	0	112.3	G232 C233 A238 M243 L262 L263 E266	G232-T236 WeakPolarHBondContact O-CG2 3.3Å; C233-T236 PolarHBondContact O-N 3.45Å; C233-T236 PolarHBondContact O-OG1 3.25Å; T236-A238 PolarHBondContact O-N 2.73Å; T236-M243 WeakPolarHBondContact O-CE 3.49Å; T236-L262 HydrophobicContact CG2-CB 4.22Å; T236-L263 HydrophobicContact CG2-CD2 3.9Å; T236-L263 HydrophobicContact CG2-CG 4.23Å; T236-E266 HydrophobicContact CG2-CB 3.87Å; T236-E266 HydrophobicContact CG2-CG 4.22Å
237	G	81.2	Confident	87.2	Confident	54 Å²	54	25.2 Å²	25.2	56%	0.557	16%	0.158	S	C	*	.			trans	-87.1	29.9	171	0	0	0	0	0	114.1	E266	G237-E266 PolarHBondContact N-OE2 2.87Å
238	A	86.4	Confident	87.6	Confident	19 Å²	19	28.4 Å²	28.4	16%	0.157	17%	0.173	C	C	.	.			trans	-66.5	163.2	-173.9	0	0	0	0	0	113.8	T236 D242 M243 L262	T236-A238 PolarHBondContact O-N 2.73Å; A238-D242 HydrophobicContact CB-CB 4.49Å; A238-M243 HydrophobicContact CB-CE 3.91Å; A238-M243 HydrophobicContact CB-CG 4.14Å; A238-M243 WeakPolarHBondContact O-CE 3.32Å; A238-L262 HydrophobicContact CB-CD1 3.78Å; A238-L262 HydrophobicContact CB-CD2 3.97Å; A238-L262 HydrophobicContact CB-CG 4.34Å
239	D	88.5	Confident	87.9	Confident	117 Å²	117	30.4 Å²	30.4	63%	0.626	18%	0.182	S	C	*	.			trans	-66	149.1	176.5	-66.6	-33.7	0	0	0	111.2	Q241 D242 M243	D239-Q241 PolarHBondContact O-N 3.38Å; D239-D242 PolarHBondContact O-N 3.15Å; D239-M243 PolarHBondContact O-N 3.43Å; D239-M243 VanDerWaalsContact O-N 3.14Å
240	S	87.5	Confident	88	Confident	9 Å²	9	33 Å²	33	6%	0.063	20%	0.199	C	C	.	.	H	α-helix	trans	-51.4	-41.8	-178.9	53.3	0	0	0	0	112.4	R55 D96 M243 Q244	R55-S240 VanDerWaalsContact O-CB 3.29Å; R55-S240 WeakPolarHBondContact O-CB 3.44Å; D96-S240 WeakPolarHBondContact OD2-CB 3.47Å; D96-S240 PolarHBondContact OD2-OG 2.91Å; S240-M243 PolarHBondContact O-N 3.45Å; S240-Q244 VanDerWaalsContact O-CB 3.29Å; S240-Q244 WeakPolarHBondContact O-CB 3.48Å; S240-Q244 PolarHBondContact O-N 2.63Å
241	Q	90.4	Very high	88.1	Confident	125 Å²	125	34.8 Å²	34.8	58%	0.584	21%	0.211	S	C	*	.	H	α-helix	trans	-65	-42.2	179.5	-51.5	-169	-10.1	0	0	112.8	Y110 D239 Q244 A245	Y110-Q241 WeakPolarHBondContact OH-CG 3.44Å; D239-Q241 PolarHBondContact O-N 3.38Å; Q241-Q244 PolarHBondContact O-N 3.45Å; Q241-A245 WeakPolarHBondContact O-CB 3.35Å; Q241-A245 PolarHBondContact O-N 3.07Å
242	D	91.9	Very high	88.2	Confident	64 Å²	64	34.8 Å²	34.8	34%	0.342	21%	0.211	S	C	.	.	H	α-helix	trans	-67.2	-41.4	-180	-82.3	-10.8	0	0	0	110.6	A238 D239 A245 I246 L262	A238-D242 HydrophobicContact CB-CB 4.49Å; D239-D242 PolarHBondContact O-N 3.15Å; D242-A245 PolarHBondContact O-N 3.5Å; D242-I246 PolarHBondContact O-N 3.04Å; D242-L262 HydrophobicContact CB-CD1 4.22Å; D242-L262 HydrophobicContact CB-CD2 4.08Å
243	M	91.1	Very high	88.5	Confident	5 Å²	5	37 Å²	37	3%	0.025	23%	0.226	C	C	.	.	H	α-helix	trans	-65.4	-42.3	175.9	-61.8	-160.1	177.2	0	0	111.9	Y56 P57 C233 T236 A238 D239 S240 A245 I246 L247	Y56-M243 HydrophobicContact CD1-CE 3.83Å; Y56-M243 HydrophobicContact CD1-SD 3.6Å; Y56-M243 HydrophobicContact CE1-CE 3.78Å; Y56-M243 HydrophobicContact CE1-SD 4.16Å; P57-M243 HydrophobicContact CG-CB 3.82Å; C233-M243 VanDerWaalsContact SG-CG 3.57Å; T236-M243 WeakPolarHBondContact O-CE 3.49Å; A238-M243 HydrophobicContact CB-CE 3.91Å; A238-M243 HydrophobicContact CB-CG 4.14Å; A238-M243 WeakPolarHBondContact O-CE 3.32Å; D239-M243 PolarHBondContact O-N 3.43Å; D239-M243 VanDerWaalsContact O-N 3.14Å; S240-M243 PolarHBondContact O-N 3.45Å; M243-A245 VanDerWaalsContact C-N 3.31Å; M243-A245 PolarHBondContact O-N 2.83Å; M243-I246 WeakPolarHBondContact O-CB 3.45Å; M243-I246 PolarHBondContact O-N 3.35Å; M243-I246 VanDerWaalsContact O-N 3.14Å; M243-L247 PolarHBondContact O-N 3.48Å; M243-L247 VanDerWaalsContact O-N 3.12Å
244	Q	93.4	Very high	88.7	Confident	1 Å²	1	41.1 Å²	41.1	1%	0.005	25%	0.245	C	C	.	.	H	α-helix	trans	-63.3	-38.7	177.2	-175.2	62.1	24.3	0	0	111.8	L92 Y110 V112 S240 Q241 I246 L247 E248	L92-Q244 HydrophobicContact CD2-CB 3.92Å; L92-Q244 HydrophobicContact CD2-CG 4.33Å; Y110-Q244 HydrophobicContact CD1-CG 3.45Å; Y110-Q244 VanDerWaalsContact CD1-CG 3.45Å; Y110-Q244 HydrophobicContact CD2-CG 3.79Å; Y110-Q244 HydrophobicContact CE1-CB 4.46Å; Y110-Q244 HydrophobicContact CE1-CG 3.77Å; Y110-Q244 HydrophobicContact CE2-CB 4.46Å; Y110-Q244 HydrophobicContact CE2-CG 4.09Å; Y110-Q244 HydrophobicContact CG-CG 3.46Å; Y110-Q244 VanDerWaalsContact CG-CG 3.46Å; V112-Q244 PolarHBondContact O-NE2 3.23Å; S240-Q244 VanDerWaalsContact O-CB 3.29Å; S240-Q244 WeakPolarHBondContact O-CB 3.48Å; S240-Q244 PolarHBondContact O-N 2.63Å; Q241-Q244 PolarHBondContact O-N 3.45Å; Q244-I246 PolarHBondContact O-N 3.35Å; Q244-L247 WeakPolarHBondContact O-CB 3.36Å; Q244-L247 PolarHBondContact O-N 3.11Å; Q244-E248 HydrophobicContact CG-CG 4.49Å; Q244-E248 PolarHBondContact NE2-OE1 2.88Å; Q244-E248 WeakPolarHBondContact O-CB 3.03Å; Q244-E248 PolarHBondContact O-N 3Å
245	A	92.3	Very high	89	Confident	33 Å²	33	38.8 Å²	38.8	27%	0.273	23%	0.225	S	C	.	.	H	α-helix	trans	-62.6	-23.9	175.4	0	0	0	0	0	113.4	Q241 D242 M243 E249 K258	Q241-A245 WeakPolarHBondContact O-CB 3.35Å; Q241-A245 PolarHBondContact O-N 3.07Å; D242-A245 PolarHBondContact O-N 3.5Å; M243-A245 VanDerWaalsContact C-N 3.31Å; M243-A245 PolarHBondContact O-N 2.83Å; A245-E249 VanDerWaalsContact O-CB 3.3Å; A245-E249 WeakPolarHBondContact O-CB 3.46Å; A245-E249 PolarHBondContact O-N 3.38Å; A245-K258 PolarHBondContact O-NZ 3.49Å
246	I	91.5	Very high	89.4	Confident	1 Å²	1	37.7 Å²	37.7	1%	0.005	22%	0.22	C	C	.	.	H	α-helix	trans	-80.6	-39.4	172.1	-67.6	171.8	0	0	0	110.9	F59 C233 D242 M243 Q244 E248 R255 K258 L262	F59-I246 HydrophobicContact CE1-CG2 4.07Å; F59-I246 HydrophobicContact CZ-CG2 4.48Å; C233-I246 HydrophobicContact CB-CD1 4.08Å; C233-I246 HydrophobicContact CB-CG2 4.45Å; D242-I246 PolarHBondContact O-N 3.04Å; M243-I246 WeakPolarHBondContact O-CB 3.45Å; M243-I246 PolarHBondContact O-N 3.35Å; M243-I246 VanDerWaalsContact O-N 3.14Å; Q244-I246 PolarHBondContact O-N 3.35Å; I246-E248 VanDerWaalsContact C-N 3.31Å; I246-E248 PolarHBondContact O-N 3.36Å; I246-R255 HydrophobicContact CG2-CG 3.73Å; I246-R255 PolarHBondContact O-NE 3.06Å; I246-K258 HydrophobicContact CD1-CB 4.2Å; I246-K258 HydrophobicContact CG1-CB 3.73Å; I246-K258 HydrophobicContact CG1-CD 4.48Å; I246-L262 HydrophobicContact CD1-CD1 3.39Å; I246-L262 HydrophobicContact CD1-CG 4.24Å
247	L	90.9	Very high	89.7	Confident	3 Å²	3	41.4 Å²	41.4	2%	0.016	24%	0.238	C	C	.	.	H	α-helix	trans	-62.1	-41.5	175.9	-172.7	71.1	0	0	0	111.3	P57 F59 V112 R137 M243 Q244	P57-L247 HydrophobicContact CB-CD2 4.03Å; F59-L247 HydrophobicContact CD1-CD1 3.67Å; F59-L247 HydrophobicContact CE1-CB 3.93Å; F59-L247 HydrophobicContact CE1-CD1 3.96Å; F59-L247 HydrophobicContact CG-CD1 4.35Å; F59-L247 HydrophobicContact CZ-CB 4.43Å; V112-L247 HydrophobicContact CG1-CG 4.32Å; R137-L247 WeakPolarHBondContact CD-O 3.31Å; R137-L247 HydrophobicContact CG-CD1 4.02Å; R137-L247 PolarHBondContact NE-O 3.42Å; M243-L247 PolarHBondContact O-N 3.48Å; M243-L247 VanDerWaalsContact O-N 3.12Å; Q244-L247 WeakPolarHBondContact O-CB 3.36Å; Q244-L247 PolarHBondContact O-N 3.11Å
248	E	92.2	Very high	90.2	Very high	74 Å²	74	42.4 Å²	42.4	35%	0.346	23%	0.226	S	C	.	.	H	α-helix	trans	-75.8	-31.6	-179.4	-78.3	175.7	-173.4	0	0	114.3	V112 Q244 I246 T250	V112-E248 HydrophobicContact CB-CG 3.61Å; V112-E248 HydrophobicContact CG1-CG 4.43Å; V112-E248 HydrophobicContact CG2-CG 3.74Å; Q244-E248 HydrophobicContact CG-CG 4.49Å; Q244-E248 PolarHBondContact NE2-OE1 2.88Å; Q244-E248 WeakPolarHBondContact O-CB 3.03Å; Q244-E248 PolarHBondContact O-N 3Å; I246-E248 VanDerWaalsContact C-N 3.31Å; I246-E248 PolarHBondContact O-N 3.36Å; E248-T250 PolarHBondContact O-N 2.82Å
249	E	92.3	Very high	90.5	Very high	43 Å²	43	41.5 Å²	41.5	20%	0.201	22%	0.219	C	C	.	.			trans	-62.2	120.6	-176.7	-179.1	54.1	-116.6	0	0	110.9	A245 S251 E254 R255 K258	A245-E249 VanDerWaalsContact O-CB 3.3Å; A245-E249 WeakPolarHBondContact O-CB 3.46Å; A245-E249 PolarHBondContact O-N 3.38Å; E249-S251 WeakPolarHBondContact OE1-CB 3.46Å; E249-S251 PolarHBondContact OE1-N 3.16Å; E249-S251 VanDerWaalsContact OE1-N 3.11Å; E249-E254 HydrophobicContact CG-CB 3.98Å; E249-R255 HydrophobicContact CB-CB 4.31Å; E249-R255 HydrophobicContact CB-CG 4.48Å; E249-R255 HydrophobicContact CG-CB 3.94Å; E249-R255 PolarHBondContact O-NE 2.8Å; E249-R255 PolarHBondContact O-NH2 3.46Å; E249-K258 HydrophobicContact CB-CD 4.42Å; E249-K258 HydrophobicContact CG-CD 4.44Å; E249-K258 IonicContact OE2-NZ 3.92Å; E249-K258 PolarHBondContact OE2-NZ 3.37Å
250	T	88.2	Confident	90.6	Very high	56 Å²	56	37.3 Å²	37.3	34%	0.344	20%	0.196	S	C	.	.			trans	-86.7	-29	-178.4	50.6	0	0	0	0	113.1	V175 E248 V252	V175-T250 HydrophobicContact CG1-CG2 4.29Å; E248-T250 PolarHBondContact O-N 2.82Å; T250-V252 PolarHBondContact O-N 2.9Å
251	S	89.7	Confident	90.8	Very high	39 Å²	39	39.3 Å²	39.3	27%	0.273	21%	0.214	S	C	.	.			trans	-74.4	121.6	-178.3	174.7	0	0	0	0	111.1	E249 P253 E254 R255	E249-S251 WeakPolarHBondContact OE1-CB 3.46Å; E249-S251 PolarHBondContact OE1-N 3.16Å; E249-S251 VanDerWaalsContact OE1-N 3.11Å; S251-P253 WeakPolarHBondContact OG-CD 3.22Å; S251-E254 PolarHBondContact O-N 2.89Å; S251-R255 VanDerWaalsContact O-CB 3.25Å; S251-R255 WeakPolarHBondContact O-CB 3.43Å; S251-R255 PolarHBondContact O-N 3.12Å
252	V	87.6	Confident	90.9	Very high	3 Å²	3	34 Å²	34	2%	0.018	19%	0.189	C	C	.	.	H	α-helix	trans	-61.7	-46.2	-178.2	-176.7	0	0	0	0	112.6	Y180 L186 P225 V226 T250 R255 L256	Y180-V252 HydrophobicContact CD1-CB 4.24Å; Y180-V252 HydrophobicContact CD1-CG2 3.59Å; Y180-V252 HydrophobicContact CD2-CG1 4.48Å; Y180-V252 HydrophobicContact CE1-CG2 4.02Å; Y180-V252 HydrophobicContact CE2-CG1 4.49Å; Y180-V252 HydrophobicContact CG-CB 4.2Å; Y180-V252 HydrophobicContact CG-CG1 4.49Å; Y180-V252 HydrophobicContact CG-CG2 4.01Å; L186-V252 HydrophobicContact CD1-CG1 4.25Å; P225-V252 HydrophobicContact CB-CG1 3.94Å; V226-V252 HydrophobicContact CG2-CB 4.45Å; V226-V252 HydrophobicContact CG2-CG1 3.96Å; V226-V252 HydrophobicContact CG2-CG2 3.68Å; T250-V252 PolarHBondContact O-N 2.9Å; V252-R255 PolarHBondContact O-N 3.22Å; V252-L256 HydrophobicContact CG1-CD1 3.92Å; V252-L256 WeakPolarHBondContact O-CD1 3.3Å; V252-L256 PolarHBondContact O-N 3.37Å
253	P	89.4	Confident	90.9	Very high	47 Å²	47	31 Å²	31	31%	0.305	17%	0.173	S	C	.	.	H	α-helix	trans	-58.5	-49.5	174.5	-22.4	30.7	0	0	0	113.2	L186 M189 S251 R255 L256 M257	L186-P253 HydrophobicContact CD1-CB 4.2Å; L186-P253 HydrophobicContact CD1-CG 3.75Å; M189-P253 WeakPolarHBondContact CE-O 3.48Å; S251-P253 WeakPolarHBondContact OG-CD 3.22Å; P253-R255 VanDerWaalsContact C-N 3.3Å; P253-R255 PolarHBondContact O-N 2.8Å; P253-L256 PolarHBondContact O-N 3.41Å; P253-M257 PolarHBondContact O-N 3.04Å
254	E	89.4	Confident	91	Very high	87 Å²	87	34.2 Å²	34.2	41%	0.407	19%	0.187	S	C	.	.	H	α-helix	trans	-63	-39.3	-179.3	-66.9	-60.2	145.2	0	0	111.5	E249 S251 L256 M257 K258	E249-E254 HydrophobicContact CG-CB 3.98Å; S251-E254 PolarHBondContact O-N 2.89Å; E254-L256 PolarHBondContact O-N 3.33Å; E254-M257 PolarHBondContact O-N 2.77Å; E254-M257 VanDerWaalsContact OE1-CE 3.3Å; E254-M257 WeakPolarHBondContact OE1-CE 3.48Å; E254-K258 WeakPolarHBondContact O-CG 3.36Å; E254-K258 PolarHBondContact O-N 3.26Å
255	R	89.6	Confident	90.8	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-62.3	-43.8	176	-167.7	-172.4	-69.4	153.9	-4.5	111.9	M177 S229 I246 E249 S251 V252 P253 K258 S259	M177-R255 PolarHBondContact SD-NH2 3.05Å; S229-R255 WeakPolarHBondContact OG-CD 3.27Å; I246-R255 HydrophobicContact CG2-CG 3.73Å; I246-R255 PolarHBondContact O-NE 3.06Å; E249-R255 HydrophobicContact CB-CB 4.31Å; E249-R255 HydrophobicContact CB-CG 4.48Å; E249-R255 HydrophobicContact CG-CB 3.94Å; E249-R255 PolarHBondContact O-NE 2.8Å; E249-R255 PolarHBondContact O-NH2 3.46Å; S251-R255 VanDerWaalsContact O-CB 3.25Å; S251-R255 WeakPolarHBondContact O-CB 3.43Å; S251-R255 PolarHBondContact O-N 3.12Å; V252-R255 PolarHBondContact O-N 3.22Å; P253-R255 VanDerWaalsContact C-N 3.3Å; P253-R255 PolarHBondContact O-N 2.8Å; R255-K258 PolarHBondContact O-N 2.71Å; R255-S259 WeakPolarHBondContact O-CB 3.36Å; R255-S259 PolarHBondContact O-N 2.99Å
256	L	89.8	Confident	90.7	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-61.9	-41.2	173.6	-84.4	140.7	0	0	0	111.9	L186 M189 V193 P225 V252 P253 E254 S259 L260	L186-L256 HydrophobicContact CD1-CD1 3.94Å; L186-L256 HydrophobicContact CG-CD1 4.3Å; M189-L256 HydrophobicContact CE-CB 3.76Å; V193-L256 HydrophobicContact CG2-CD2 4.02Å; P225-L256 HydrophobicContact CB-CD1 3.41Å; P225-L256 VanDerWaalsContact CB-CD1 3.41Å; P225-L256 HydrophobicContact CB-CD2 4.3Å; P225-L256 HydrophobicContact CB-CG 4.26Å; V252-L256 HydrophobicContact CG1-CD1 3.92Å; V252-L256 WeakPolarHBondContact O-CD1 3.3Å; V252-L256 PolarHBondContact O-N 3.37Å; P253-L256 PolarHBondContact O-N 3.41Å; E254-L256 PolarHBondContact O-N 3.33Å; L256-S259 PolarHBondContact O-N 2.97Å; L256-L260 WeakPolarHBondContact O-CB 3.48Å; L256-L260 PolarHBondContact O-N 3.06Å
257	M	91	Very high	90.6	Very high	90 Å²	90	40.7 Å²	40.7	44%	0.443	21%	0.209	S	C	.	.	H	α-helix	trans	-61.1	-48.9	175.9	-80.2	-161.7	-89.7	0	0	111.7	M189 P253 E254 S259 L260 A261	M189-M257 HydrophobicContact CE-CB 4.16Å; M189-M257 HydrophobicContact CE-CG 3.21Å; M189-M257 HydrophobicContact CE-SD 4.45Å; P253-M257 PolarHBondContact O-N 3.04Å; E254-M257 PolarHBondContact O-N 2.77Å; E254-M257 VanDerWaalsContact OE1-CE 3.3Å; E254-M257 WeakPolarHBondContact OE1-CE 3.48Å; M257-S259 PolarHBondContact O-N 2.58Å; M257-L260 PolarHBondContact O-N 3.22Å; M257-A261 WeakPolarHBondContact O-CB 3.31Å; M257-A261 PolarHBondContact O-N 3.14Å
258	K	91.5	Very high	90.6	Very high	74 Å²	74	45.7 Å²	45.7	32%	0.322	23%	0.233	S	C	.	.	H	α-helix	trans	-58.8	-47.9	177.5	-70.6	178.2	178.5	177.2	0	111.3	A245 I246 E249 E254 R255 A261 L262	A245-K258 PolarHBondContact O-NZ 3.49Å; I246-K258 HydrophobicContact CD1-CB 4.2Å; I246-K258 HydrophobicContact CG1-CB 3.73Å; I246-K258 HydrophobicContact CG1-CD 4.48Å; E249-K258 HydrophobicContact CB-CD 4.42Å; E249-K258 HydrophobicContact CG-CD 4.44Å; E249-K258 IonicContact OE2-NZ 3.92Å; E249-K258 PolarHBondContact OE2-NZ 3.37Å; E254-K258 WeakPolarHBondContact O-CG 3.36Å; E254-K258 PolarHBondContact O-N 3.26Å; R255-K258 PolarHBondContact O-N 2.71Å; K258-A261 WeakPolarHBondContact O-CB 3.39Å; K258-A261 PolarHBondContact O-N 3.36Å; K258-L262 PolarHBondContact O-N 3.34Å; K258-L262 VanDerWaalsContact O-N 3.15Å
259	S	91.8	Very high	90.4	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-62.3	-44.3	177.5	-177.5	0	0	0	0	112.3	S229 R255 L256 M257 A261 L262 L263	S229-S259 PolarHBondContact O-OG 2.94Å; R255-S259 WeakPolarHBondContact O-CB 3.36Å; R255-S259 PolarHBondContact O-N 2.99Å; L256-S259 PolarHBondContact O-N 2.97Å; M257-S259 PolarHBondContact O-N 2.58Å; S259-A261 VanDerWaalsContact C-N 3.31Å; S259-A261 PolarHBondContact O-N 2.79Å; S259-L262 PolarHBondContact O-N 2.82Å; S259-L263 WeakPolarHBondContact O-CB 3.48Å; S259-L263 WeakPolarHBondContact O-CG 3.26Å; S259-L263 PolarHBondContact O-N 3.48Å
260	L	90.8	Very high	90.1	Very high	29 Å²	29	45.9 Å²	45.9	15%	0.152	23%	0.233	C	C	.	.	H	α-helix	trans	-61.2	-40	176.1	-177.4	61.2	0	0	0	111.7	E192 V193 L256 M257 L263 K264	E192-L260 HydrophobicContact CB-CD2 4.45Å; E192-L260 HydrophobicContact CG-CD1 4.07Å; E192-L260 HydrophobicContact CG-CD2 4.04Å; V193-L260 HydrophobicContact CB-CD1 4.49Å; V193-L260 HydrophobicContact CG2-CB 3.79Å; V193-L260 HydrophobicContact CG2-CD1 3.75Å; V193-L260 HydrophobicContact CG2-CG 4.22Å; L256-L260 WeakPolarHBondContact O-CB 3.48Å; L256-L260 PolarHBondContact O-N 3.06Å; M257-L260 PolarHBondContact O-N 3.22Å; L260-L263 PolarHBondContact O-N 2.81Å; L260-K264 HydrophobicContact CD1-CG 4.36Å; L260-K264 HydrophobicContact CG-CG 4.46Å; L260-K264 WeakPolarHBondContact O-CB 3.43Å; L260-K264 VanDerWaalsContact O-CG 3.29Å; L260-K264 WeakPolarHBondContact O-CG 3.37Å; L260-K264 PolarHBondContact O-N 3.17Å
261	A	92.4	Very high	90.2	Very high	52 Å²	52	47.1 Å²	47.1	43%	0.43	23%	0.233	S	C	.	.	H	α-helix	trans	-62.1	-43.2	177.2	0	0	0	0	0	111.9	M257 K258 S259 K264 K265	M257-A261 WeakPolarHBondContact O-CB 3.31Å; M257-A261 PolarHBondContact O-N 3.14Å; K258-A261 WeakPolarHBondContact O-CB 3.39Å; K258-A261 PolarHBondContact O-N 3.36Å; S259-A261 VanDerWaalsContact C-N 3.31Å; S259-A261 PolarHBondContact O-N 2.79Å; A261-K264 PolarHBondContact O-N 3.13Å; A261-K265 PolarHBondContact O-N 3.02Å; A261-K265 VanDerWaalsContact O-N 3.15Å
262	L	92.2	Very high	89.9	Confident	12 Å²	12	49.8 Å²	49.8	6%	0.063	24%	0.244	C	C	.	.	H	α-helix	trans	-65.2	-44.4	174.6	-63.2	-174.6	0	0	0	111.8	T236 A238 D242 I246 K258 S259 K264 K265 E266	T236-L262 HydrophobicContact CG2-CB 4.22Å; A238-L262 HydrophobicContact CB-CD1 3.78Å; A238-L262 HydrophobicContact CB-CD2 3.97Å; A238-L262 HydrophobicContact CB-CG 4.34Å; D242-L262 HydrophobicContact CB-CD1 4.22Å; D242-L262 HydrophobicContact CB-CD2 4.08Å; I246-L262 HydrophobicContact CD1-CD1 3.39Å; I246-L262 HydrophobicContact CD1-CG 4.24Å; K258-L262 PolarHBondContact O-N 3.34Å; K258-L262 VanDerWaalsContact O-N 3.15Å; S259-L262 PolarHBondContact O-N 2.82Å; L262-K264 VanDerWaalsContact C-N 3.31Å; L262-K264 PolarHBondContact O-N 3.18Å; L262-K265 WeakPolarHBondContact O-CB 3.28Å; L262-K265 PolarHBondContact O-N 3.48Å; L262-K265 VanDerWaalsContact O-N 3.16Å; L262-E266 PolarHBondContact O-N 3.39Å
263	L	91.8	Very high	89.7	Confident	1 Å²	1	54.9 Å²	54.9	1%	0.005	27%	0.268	C	S	.	.	H	α-helix	trans	-60.7	-37.8	176.1	-77.2	168.2	0	0	0	112.6	V193 T196 I197 I200 G232 T236 S259 L260 E266 L267	V193-L263 HydrophobicContact CG1-CD1 3.68Å; T196-L263 HydrophobicContact CG2-CB 3.83Å; I197-L263 HydrophobicContact CD1-CD1 4.24Å; I197-L263 HydrophobicContact CG1-CD1 3.89Å; I197-L263 HydrophobicContact CG1-CD2 3.89Å; I200-L263 HydrophobicContact CD1-CB 4.4Å; I200-L263 HydrophobicContact CD1-CD2 3.65Å; G232-L263 WeakPolarHBondContact O-CD2 3.15Å; T236-L263 HydrophobicContact CG2-CD2 3.9Å; T236-L263 HydrophobicContact CG2-CG 4.23Å; S259-L263 WeakPolarHBondContact O-CB 3.48Å; S259-L263 WeakPolarHBondContact O-CG 3.26Å; S259-L263 PolarHBondContact O-N 3.48Å; L260-L263 PolarHBondContact O-N 2.81Å; L263-E266 PolarHBondContact O-N 3.2Å; L263-L267 WeakPolarHBondContact O-CB 3.41Å; L263-L267 PolarHBondContact O-N 2.9Å
264	K	92.7	Very high	89.5	Confident	74 Å²	74	54.4 Å²	54.4	32%	0.322	27%	0.268	S	S	.	.	H	α-helix	trans	-66	-40.3	175.3	-73	-67.9	-176	-164.9	0	111.8	E192 T196 L260 A261 L262 L267 E268	E192-K264 WeakPolarHBondContact OE1-CE 3.42Å; E192-K264 IonicContact OE1-NZ 2.75Å; E192-K264 PolarHBondContact OE1-NZ 3.2Å; T196-K264 HydrophobicContact CG2-CD 4.08Å; T196-K264 WeakPolarHBondContact OG1-CE 3.37Å; T196-K264 PolarHBondContact OG1-NZ 3.39Å; T196-K264 VanDerWaalsContact OG1-NZ 3.09Å; L260-K264 HydrophobicContact CD1-CG 4.36Å; L260-K264 HydrophobicContact CG-CG 4.46Å; L260-K264 WeakPolarHBondContact O-CB 3.43Å; L260-K264 VanDerWaalsContact O-CG 3.29Å; L260-K264 WeakPolarHBondContact O-CG 3.37Å; L260-K264 PolarHBondContact O-N 3.17Å; A261-K264 PolarHBondContact O-N 3.13Å; L262-K264 VanDerWaalsContact C-N 3.31Å; L262-K264 PolarHBondContact O-N 3.18Å; K264-L267 PolarHBondContact O-N 2.94Å; K264-E268 WeakPolarHBondContact O-CG 2.73Å; K264-E268 PolarHBondContact O-N 2.97Å; K264-E268 VanDerWaalsContact O-N 3.09Å
265	K	90.7	Very high	89.4	Confident	133 Å²	133	56.3 Å²	56.3	58%	0.578	27%	0.274	S	S	*	.	H	α-helix	trans	-60.3	-46.1	172.8	-70.7	177.9	-178.2	176.4	0	110.9	A261 L262 L267 E268 F269	A261-K265 PolarHBondContact O-N 3.02Å; A261-K265 VanDerWaalsContact O-N 3.15Å; L262-K265 WeakPolarHBondContact O-CB 3.28Å; L262-K265 PolarHBondContact O-N 3.48Å; L262-K265 VanDerWaalsContact O-N 3.16Å; K265-L267 PolarHBondContact O-N 3.18Å; K265-E268 PolarHBondContact O-N 3.39Å; K265-F269 PolarHBondContact O-N 2.79Å
266	E	89.2	Confident	89	Confident	33 Å²	33	60.4 Å²	60.4	15%	0.154	30%	0.295	C	S	.	.	H	α-helix	trans	-63.6	-38.7	178.5	-170.2	63.2	-133.7	0	0	112.5	I200 T236 G237 L262 L263 F269 S270	I200-E266 HydrophobicContact CD1-CB 4.19Å; I200-E266 HydrophobicContact CD1-CG 4.25Å; T236-E266 HydrophobicContact CG2-CB 3.87Å; T236-E266 HydrophobicContact CG2-CG 4.22Å; G237-E266 PolarHBondContact N-OE2 2.87Å; L262-E266 PolarHBondContact O-N 3.39Å; L263-E266 PolarHBondContact O-N 3.2Å; E266-F269 PolarHBondContact O-N 2.74Å; E266-S270 WeakPolarHBondContact O-CB 3.47Å; E266-S270 PolarHBondContact O-N 3.07Å; E266-S270 PolarHBondContact O-OG 3.24Å
267	L	90.1	Very high	88.7	Confident	4 Å²	4	62.2 Å²	62.2	2%	0.021	31%	0.314	C	S	.	.	H	α-helix	trans	-63.3	-43.7	175.2	177.3	60.8	0	0	0	111.9	T196 D199 I200 F203 L263 K264 K265 S270 K271	T196-L267 HydrophobicContact CG2-CB 4.26Å; T196-L267 HydrophobicContact CG2-CD2 4.09Å; D199-L267 HydrophobicContact CB-CD1 3.68Å; D199-L267 HydrophobicContact CB-CD2 4.07Å; I200-L267 HydrophobicContact CD1-CB 4.33Å; I200-L267 HydrophobicContact CG1-CB 3.83Å; I200-L267 HydrophobicContact CG1-CD1 4Å; I200-L267 HydrophobicContact CG1-CG 4.49Å; F203-L267 HydrophobicContact CD2-CD1 4.01Å; F203-L267 HydrophobicContact CE2-CD1 4Å; L263-L267 WeakPolarHBondContact O-CB 3.41Å; L263-L267 PolarHBondContact O-N 2.9Å; K264-L267 PolarHBondContact O-N 2.94Å; K265-L267 PolarHBondContact O-N 3.18Å; L267-S270 PolarHBondContact O-N 3.33Å; L267-K271 WeakPolarHBondContact O-CG 3.49Å; L267-K271 PolarHBondContact O-N 3.16Å
268	E	90.2	Very high	88.5	Confident	108 Å²	108	65.2 Å²	65.2	51%	0.505	33%	0.325	S	S	.	.	H	α-helix	trans	-66.5	-39.3	176.6	-70.3	-57.7	123.7	0	0	111.6	K264 K265 K271 L272	K264-E268 WeakPolarHBondContact O-CG 2.73Å; K264-E268 PolarHBondContact O-N 2.97Å; K264-E268 VanDerWaalsContact O-N 3.09Å; K265-E268 PolarHBondContact O-N 3.39Å; E268-K271 PolarHBondContact O-N 2.98Å; E268-K271 IonicContact OE1-NZ 3.57Å; E268-K271 PolarHBondContact OE1-NZ 3.5Å; E268-L272 WeakPolarHBondContact O-CB 3.34Å; E268-L272 PolarHBondContact O-N 2.87Å
269	F	89	Confident	88.1	Confident	116 Å²	116	66.5 Å²	66.5	51%	0.509	33%	0.332	S	S	.	.	H	α-helix	trans	-59.1	-49	171.8	178.7	-99.8	0	0	0	111.6	K265 E266 K271 L272 Q273	K265-F269 PolarHBondContact O-N 2.79Å; E266-F269 PolarHBondContact O-N 2.74Å; F269-K271 VanDerWaalsContact C-N 3.35Å; F269-K271 PolarHBondContact O-N 3.35Å; F269-L272 PolarHBondContact O-N 2.84Å; F269-L272 VanDerWaalsContact O-N 3.16Å; F269-Q273 WeakPolarHBondContact O-CB 3.46Å; F269-Q273 PolarHBondContact O-N 3.01Å
270	S	86	Confident	87.6	Confident	5 Å²	5	70.3 Å²	70.3	4%	0.035	36%	0.355	C	S	.	.	H	α-helix	trans	-59.6	-41.5	177.7	-66.5	0	0	0	0	112.4	E266 L267 Q273 A274	E266-S270 WeakPolarHBondContact O-CB 3.47Å; E266-S270 PolarHBondContact O-N 3.07Å; E266-S270 PolarHBondContact O-OG 3.24Å; L267-S270 PolarHBondContact O-N 3.33Å; S270-Q273 PolarHBondContact O-N 3.29Å; S270-A274 WeakPolarHBondContact O-CB 3.36Å; S270-A274 PolarHBondContact O-N 3.18Å
271	K	88.6	Confident	87.1	Confident	83 Å²	83	75.4 Å²	75.4	36%	0.361	38%	0.378	S	S	.	.	H	α-helix	trans	-63.7	-43.5	174.4	-75	174.4	-172.8	167.7	0	112.2	F203 L267 E268 F269 A274 K275	F203-K271 HydrophobicContact CD2-CG 4.37Å; F203-K271 HydrophobicContact CE1-CG 4.45Å; F203-K271 HydrophobicContact CE2-CG 3.77Å; F203-K271 HydrophobicContact CZ-CG 3.82Å; L267-K271 WeakPolarHBondContact O-CG 3.49Å; L267-K271 PolarHBondContact O-N 3.16Å; E268-K271 PolarHBondContact O-N 2.98Å; E268-K271 IonicContact OE1-NZ 3.57Å; E268-K271 PolarHBondContact OE1-NZ 3.5Å; F269-K271 VanDerWaalsContact C-N 3.35Å; F269-K271 PolarHBondContact O-N 3.35Å; K271-A274 PolarHBondContact O-N 3.29Å; K271-K275 WeakPolarHBondContact O-CB 3.3Å; K271-K275 PolarHBondContact O-N 3.01Å
272	L	84.9	Confident	86.8	Confident	95 Å²	95	78.5 Å²	78.5	50%	0.497	38%	0.384	S	S	.	.	H	α-helix	trans	-64.1	-44.7	178	-178.2	64.1	0	0	0	110.6	E268 F269 A274 K275 I276	E268-L272 WeakPolarHBondContact O-CB 3.34Å; E268-L272 PolarHBondContact O-N 2.87Å; F269-L272 PolarHBondContact O-N 2.84Å; F269-L272 VanDerWaalsContact O-N 3.16Å; L272-A274 VanDerWaalsContact C-N 3.34Å; L272-A274 PolarHBondContact O-N 3.49Å; L272-K275 WeakPolarHBondContact O-CB 3.47Å; L272-K275 PolarHBondContact O-N 3.46Å; L272-K275 VanDerWaalsContact O-N 3.13Å; L272-I276 HydrophobicContact CD1-CD1 4.36Å; L272-I276 HydrophobicContact CD1-CG1 4.47Å; L272-I276 HydrophobicContact CG-CD1 3.98Å; L272-I276 HydrophobicContact CG-CG1 4.49Å; L272-I276 WeakPolarHBondContact O-CG1 3.34Å; L272-I276 PolarHBondContact O-N 2.63Å
273	Q	83	Confident	86.1	Confident	110 Å²	110	85 Å²	85	51%	0.514	41%	0.411	S	S	.	.	H	α-helix	trans	-59.5	-44.5	176.4	-169	177.7	10.8	0	0	111.4	F269 S270 K275 I276 G277	F269-Q273 WeakPolarHBondContact O-CB 3.46Å; F269-Q273 PolarHBondContact O-N 3.01Å; S270-Q273 PolarHBondContact O-N 3.29Å; Q273-K275 VanDerWaalsContact C-N 3.34Å; Q273-K275 PolarHBondContact O-N 3.48Å; Q273-I276 PolarHBondContact O-N 2.86Å; Q273-G277 PolarHBondContact O-N 3.15Å
274	A	85.4	Confident	85.6	Confident	37 Å²	37	88 Å²	88	31%	0.306	43%	0.43	S	S	.	.	H	α-helix	trans	-63.7	-37.1	174.6	0	0	0	0	0	112.7	F203 S270 K271 L272 G277 K278	F203-A274 HydrophobicContact CD1-CB 3.97Å; F203-A274 HydrophobicContact CE1-CB 4.46Å; S270-A274 WeakPolarHBondContact O-CB 3.36Å; S270-A274 PolarHBondContact O-N 3.18Å; K271-A274 PolarHBondContact O-N 3.29Å; L272-A274 VanDerWaalsContact C-N 3.34Å; L272-A274 PolarHBondContact O-N 3.49Å; A274-G277 PolarHBondContact O-N 3.04Å; A274-K278 WeakPolarHBondContact O-CG 3.47Å; A274-K278 PolarHBondContact O-N 3.24Å
275	K	85.8	Confident	85.1	Confident	126 Å²	126	92.2 Å²	92.2	55%	0.548	45%	0.448	S	S	.	.	H	α-helix	trans	-67	-43.4	175.4	-174.6	-179	179.3	-178	0	111.7	K271 L272 Q273 K278 Q279	K271-K275 WeakPolarHBondContact O-CB 3.3Å; K271-K275 PolarHBondContact O-N 3.01Å; L272-K275 WeakPolarHBondContact O-CB 3.47Å; L272-K275 PolarHBondContact O-N 3.46Å; L272-K275 VanDerWaalsContact O-N 3.13Å; Q273-K275 VanDerWaalsContact C-N 3.34Å; Q273-K275 PolarHBondContact O-N 3.48Å; K275-K278 PolarHBondContact O-N 2.7Å; K275-Q279 WeakPolarHBondContact O-CG 3.31Å; K275-Q279 PolarHBondContact O-N 2.6Å
276	I	83.2	Confident	84.7	Confident	86 Å²	86	91.3 Å²	91.3	44%	0.441	45%	0.446	S	S	.	.	H	α-helix	trans	-62	-46.4	175	-68.5	168.3	0	0	0	109.5	L272 Q273 K278 Q279 V280	L272-I276 HydrophobicContact CD1-CD1 4.36Å; L272-I276 HydrophobicContact CD1-CG1 4.47Å; L272-I276 HydrophobicContact CG-CD1 3.98Å; L272-I276 HydrophobicContact CG-CG1 4.49Å; L272-I276 WeakPolarHBondContact O-CG1 3.34Å; L272-I276 PolarHBondContact O-N 2.63Å; Q273-I276 PolarHBondContact O-N 2.86Å; I276-K278 VanDerWaalsContact C-N 3.33Å; I276-K278 PolarHBondContact O-N 3.23Å; I276-Q279 PolarHBondContact O-N 2.77Å; I276-Q279 VanDerWaalsContact O-N 3.11Å; I276-V280 HydrophobicContact CG2-CG2 4.05Å; I276-V280 WeakPolarHBondContact O-CB 3.44Å; I276-V280 WeakPolarHBondContact O-CG2 3.27Å; I276-V280 PolarHBondContact O-N 3.19Å
277	G	82.2	Confident	84.2	Confident	38 Å²	38	96.3 Å²	96.3	39%	0.392	47%	0.469	S	S	.	.	H	α-helix	trans	-53	-49	175.9	0	0	0	0	0	112.2	Q273 A274 Q279 V280 E281	Q273-G277 PolarHBondContact O-N 3.15Å; A274-G277 PolarHBondContact O-N 3.04Å; G277-Q279 PolarHBondContact O-N 2.82Å; G277-V280 PolarHBondContact O-N 3.2Å; G277-E281 WeakPolarHBondContact O-CB 3.46Å; G277-E281 PolarHBondContact O-N 3.17Å
278	K	86.6	Confident	83.8	Confident	154 Å²	154	102 Å²	102	67%	0.67	50%	0.496	S	S	*	.	H	α-helix	trans	-61.1	-42.9	175.3	-75.2	178.8	177.5	-179.8	0	113.4	A274 K275 I276 E281 E282	A274-K278 WeakPolarHBondContact O-CG 3.47Å; A274-K278 PolarHBondContact O-N 3.24Å; K275-K278 PolarHBondContact O-N 2.7Å; I276-K278 VanDerWaalsContact C-N 3.33Å; I276-K278 PolarHBondContact O-N 3.23Å; K278-E281 PolarHBondContact O-N 3.27Å; K278-E282 WeakPolarHBondContact O-CB 3.48Å; K278-E282 PolarHBondContact O-N 3.23Å
279	Q	83.1	Confident	83.2	Confident	101 Å²	101	105.5 Å²	105.5	47%	0.472	50%	0.504	S	S	.	.	H	α-helix	trans	-67.6	-38.6	178.6	-75.3	-175.9	-12.1	0	0	112.7	K275 I276 G277 K283	K275-Q279 WeakPolarHBondContact O-CG 3.31Å; K275-Q279 PolarHBondContact O-N 2.6Å; I276-Q279 PolarHBondContact O-N 2.77Å; I276-Q279 VanDerWaalsContact O-N 3.11Å; G277-Q279 PolarHBondContact O-N 2.82Å; Q279-K283 WeakPolarHBondContact O-CB 3.18Å; Q279-K283 WeakPolarHBondContact O-CG 3.46Å; Q279-K283 PolarHBondContact O-N 3.46Å
280	V	81.7	Confident	82.6	Confident	79 Å²	79	107 Å²	107	48%	0.479	51%	0.51	S	S	.	.	H	α-helix	trans	-66.2	-46.8	175	172	0	0	0	0	109.6	I276 G277 E282 K283 V284	I276-V280 HydrophobicContact CG2-CG2 4.05Å; I276-V280 WeakPolarHBondContact O-CB 3.44Å; I276-V280 WeakPolarHBondContact O-CG2 3.27Å; I276-V280 PolarHBondContact O-N 3.19Å; G277-V280 PolarHBondContact O-N 3.2Å; V280-E282 VanDerWaalsContact C-N 3.31Å; V280-E282 PolarHBondContact O-N 2.97Å; V280-K283 PolarHBondContact O-N 3.23Å; V280-V284 HydrophobicContact CG1-CG2 4.22Å; V280-V284 WeakPolarHBondContact O-CB 3.29Å; V280-V284 VanDerWaalsContact O-CG2 3.27Å; V280-V284 WeakPolarHBondContact O-CG2 3.27Å; V280-V284 PolarHBondContact O-N 2.84Å
281	E	81.4	Confident	82.3	Confident	137 Å²	137	113.5 Å²	113.5	64%	0.64	54%	0.535	S	S	*	.	H	α-helix	trans	-59.8	-41.2	176.6	-168.1	-178.9	175.7	0	0	111.7	G277 K278 V284 K285	G277-E281 WeakPolarHBondContact O-CB 3.46Å; G277-E281 PolarHBondContact O-N 3.17Å; K278-E281 PolarHBondContact O-N 3.27Å; E281-V284 PolarHBondContact O-N 3.39Å; E281-K285 VanDerWaalsContact O-CB 3.23Å; E281-K285 WeakPolarHBondContact O-CB 3.36Å; E281-K285 PolarHBondContact O-N 2.93Å
282	E	84.4	Confident	81.8	Confident	117 Å²	117	115.1 Å²	115.1	55%	0.547	55%	0.545	S	S	.	.	H	α-helix	trans	-64.6	-43	175	-166.6	178.1	-179.8	0	0	112.1	K278 V280 K285 Q286	K278-E282 WeakPolarHBondContact O-CB 3.48Å; K278-E282 PolarHBondContact O-N 3.23Å; V280-E282 VanDerWaalsContact C-N 3.31Å; V280-E282 PolarHBondContact O-N 2.97Å; E282-K285 PolarHBondContact O-N 3.13Å; E282-Q286 WeakPolarHBondContact O-CB 3.24Å; E282-Q286 VanDerWaalsContact O-CG 3.3Å; E282-Q286 WeakPolarHBondContact O-CG 3.36Å; E282-Q286 PolarHBondContact O-N 3.45Å
283	K	78.9	Confident	81.5	Confident	148 Å²	148	114.4 Å²	114.4	64%	0.643	54%	0.541	S	S	*	.	H	α-helix	trans	-62.4	-44.8	173.6	-81.8	-176.6	177	-179.8	0	112.1	Q279 V280 K285 Q286 Q287	Q279-K283 WeakPolarHBondContact O-CB 3.18Å; Q279-K283 WeakPolarHBondContact O-CG 3.46Å; Q279-K283 PolarHBondContact O-N 3.46Å; V280-K283 PolarHBondContact O-N 3.23Å; K283-K285 VanDerWaalsContact C-N 3.34Å; K283-Q286 PolarHBondContact O-N 2.83Å; K283-Q287 WeakPolarHBondContact O-CB 3.34Å; K283-Q287 PolarHBondContact O-N 2.81Å
284	V	80.9	Confident	81.2	Confident	65 Å²	65	115.2 Å²	115.2	39%	0.394	55%	0.545	S	S	.	.	H	α-helix	trans	-62.5	-43.5	177	170.1	0	0	0	0	109.9	V280 E281 Q286 Q287 H288	V280-V284 HydrophobicContact CG1-CG2 4.22Å; V280-V284 WeakPolarHBondContact O-CB 3.29Å; V280-V284 VanDerWaalsContact O-CG2 3.27Å; V280-V284 WeakPolarHBondContact O-CG2 3.27Å; V280-V284 PolarHBondContact O-N 2.84Å; E281-V284 PolarHBondContact O-N 3.39Å; V284-Q286 PolarHBondContact O-N 3.38Å; V284-Q287 PolarHBondContact O-N 2.96Å; V284-H288 WeakPolarHBondContact O-CB 3.45Å; V284-H288 PolarHBondContact O-CD2 3.05Å; V284-H288 PolarHBondContact O-N 3.16Å
285	K	82.3	Confident	80.9	Confident	161 Å²	161	118 Å²	118	70%	0.7	55%	0.552	S	S	*	*	H	α-helix	trans	-64.2	-40.2	176.1	-166.7	173.6	-175.2	173.7	0	112.1	E281 E282 K283 R289	E281-K285 VanDerWaalsContact O-CB 3.23Å; E281-K285 WeakPolarHBondContact O-CB 3.36Å; E281-K285 PolarHBondContact O-N 2.93Å; E282-K285 PolarHBondContact O-N 3.13Å; K283-K285 VanDerWaalsContact C-N 3.34Å; K285-R289 WeakPolarHBondContact O-CB 3.41Å; K285-R289 PolarHBondContact O-N 3.42Å
286	Q	81.4	Confident	80.7	Confident	114 Å²	114	116.7 Å²	116.7	53%	0.533	55%	0.548	S	S	.	.	H	α-helix	trans	-64.9	-39.5	172.9	-74.7	179.1	14	0	0	112.1	E282 K283 V284 R289 K290	E282-Q286 WeakPolarHBondContact O-CB 3.24Å; E282-Q286 VanDerWaalsContact O-CG 3.3Å; E282-Q286 WeakPolarHBondContact O-CG 3.36Å; E282-Q286 PolarHBondContact O-N 3.45Å; K283-Q286 PolarHBondContact O-N 2.83Å; V284-Q286 PolarHBondContact O-N 3.38Å; Q286-R289 PolarHBondContact O-N 3.03Å; Q286-K290 WeakPolarHBondContact O-CB 3.28Å; Q286-K290 PolarHBondContact O-N 2.67Å
287	Q	79.7	Confident	80.2	Confident	138 Å²	138	117.1 Å²	117.1	65%	0.645	55%	0.55	S	S	*	*	H	α-helix	trans	-69	-45.4	178	-166.8	172.5	5.7	0	0	111.5	K283 V284 R289 K290 Y291	K283-Q287 WeakPolarHBondContact O-CB 3.34Å; K283-Q287 PolarHBondContact O-N 2.81Å; V284-Q287 PolarHBondContact O-N 2.96Å; Q287-R289 VanDerWaalsContact C-N 3.32Å; Q287-R289 PolarHBondContact O-N 3.29Å; Q287-K290 PolarHBondContact O-N 2.96Å; Q287-Y291 WeakPolarHBondContact O-CB 3.43Å; Q287-Y291 PolarHBondContact O-N 3.42Å
288	H	80.2	Confident	79.5	Confident	125 Å²	125	120.2 Å²	120.2	58%	0.579	55%	0.553	S	S	*	*	H	α-helix	trans	-59.2	-42	170.7	-92.4	-84.2	0	0	0	111.7	V284 Y291 M292	V284-H288 WeakPolarHBondContact O-CB 3.45Å; V284-H288 PolarHBondContact O-CD2 3.05Å; V284-H288 PolarHBondContact O-N 3.16Å; H288-Y291 PolarHBondContact O-N 2.96Å; H288-M292 WeakPolarHBondContact O-CB 3.15Å; H288-M292 PolarHBondContact O-N 2.89Å
289	R	79	Confident	78.8	Confident	181 Å²	181	115.5 Å²	115.5	68%	0.683	54%	0.543	S	S	*	.	H	α-helix	trans	-64	-43.9	175.8	-172.9	178.9	-179.2	-164.4	0.3	111.5	K285 Q286 Q287 M292 L293	K285-R289 WeakPolarHBondContact O-CB 3.41Å; K285-R289 PolarHBondContact O-N 3.42Å; Q286-R289 PolarHBondContact O-N 3.03Å; Q287-R289 VanDerWaalsContact C-N 3.32Å; Q287-R289 PolarHBondContact O-N 3.29Å; R289-M292 PolarHBondContact O-N 2.84Å; R289-L293 HydrophobicContact CG-CD1 4.05Å; R289-L293 HydrophobicContact CG-CG 4.49Å; R289-L293 VanDerWaalsContact O-CB 3.31Å; R289-L293 WeakPolarHBondContact O-CB 3.31Å; R289-L293 WeakPolarHBondContact O-CG 3.43Å; R289-L293 PolarHBondContact O-N 3.05Å
290	K	76.5	Confident	77.9	Confident	146 Å²	146	114.9 Å²	114.9	64%	0.635	54%	0.542	S	S	*	.	H	α-helix	trans	-61.6	-43.6	173.8	-94.3	-175.3	174	178.8	0	111.7	Q286 Q287 L293 Q294	Q286-K290 WeakPolarHBondContact O-CB 3.28Å; Q286-K290 PolarHBondContact O-N 2.67Å; Q287-K290 PolarHBondContact O-N 2.96Å; K290-L293 PolarHBondContact O-N 3.41Å; K290-Q294 WeakPolarHBondContact O-CB 3.42Å; K290-Q294 VanDerWaalsContact O-CG 3.28Å; K290-Q294 WeakPolarHBondContact O-CG 3.45Å; K290-Q294 PolarHBondContact O-N 3.32Å
291	Y	79.4	Confident	77	Confident	142 Å²	142	116.2 Å²	116.2	56%	0.557	54%	0.541	S	S	*	.	H	α-helix	trans	-61.6	-49.9	177	176.7	-97	0	0	0	111.1	Q287 H288 L293 Q294 E295	Q287-Y291 WeakPolarHBondContact O-CB 3.43Å; Q287-Y291 PolarHBondContact O-N 3.42Å; H288-Y291 PolarHBondContact O-N 2.96Å; Y291-L293 VanDerWaalsContact C-N 3.34Å; Y291-L293 PolarHBondContact O-N 2.9Å; Y291-Q294 WeakPolarHBondContact O-CB 3.36Å; Y291-Q294 PolarHBondContact O-N 2.93Å; Y291-Q294 VanDerWaalsContact O-N 3.13Å; Y291-E295 HydrophobicContact CE1-CG 4.05Å; Y291-E295 HydrophobicContact CE2-CG 4.46Å; Y291-E295 PolarHBondContact O-N 3.33Å
292	M	78	Confident	76.3	Confident	117 Å²	117	116.4 Å²	116.4	58%	0.576	54%	0.54	S	S	*	.	H	α-helix	trans	-58.4	-43.8	173.9	-87.7	-166.4	79.1	0	0	112.2	H288 R289 Q294 E295 Q296	H288-M292 WeakPolarHBondContact O-CB 3.15Å; H288-M292 PolarHBondContact O-N 2.89Å; R289-M292 PolarHBondContact O-N 2.84Å; M292-Q294 VanDerWaalsContact C-N 3.3Å; M292-Q294 PolarHBondContact O-N 3.14Å; M292-E295 PolarHBondContact O-N 2.86Å; M292-Q296 WeakPolarHBondContact O-CB 3.3Å; M292-Q296 VanDerWaalsContact O-CG 3.29Å; M292-Q296 WeakPolarHBondContact O-CG 3.29Å; M292-Q296 PolarHBondContact O-N 2.99Å
293	L	78.2	Confident	75.6	Confident	80 Å²	80	119.4 Å²	119.4	42%	0.419	55%	0.554	S	S	.	*	H	α-helix	trans	-65.2	-33.9	177	-75	169.5	0	0	0	112.1	R289 K290 Y291 L297	R289-L293 HydrophobicContact CG-CD1 4.05Å; R289-L293 HydrophobicContact CG-CG 4.49Å; R289-L293 VanDerWaalsContact O-CB 3.31Å; R289-L293 WeakPolarHBondContact O-CB 3.31Å; R289-L293 WeakPolarHBondContact O-CG 3.43Å; R289-L293 PolarHBondContact O-N 3.05Å; K290-L293 PolarHBondContact O-N 3.41Å; Y291-L293 VanDerWaalsContact C-N 3.34Å; Y291-L293 PolarHBondContact O-N 2.9Å; L293-L297 VanDerWaalsContact O-CB 3.24Å; L293-L297 WeakPolarHBondContact O-CB 3.32Å; L293-L297 WeakPolarHBondContact O-CG 3.43Å; L293-L297 PolarHBondContact O-N 3.4Å
294	Q	77.6	Confident	74.8	Confident	127 Å²	127	117.9 Å²	117.9	59%	0.593	55%	0.552	S	S	*	*	H	α-helix	trans	-71.7	-43.5	175.3	-79.6	178.2	-18.2	0	0	111.8	K290 Y291 M292 Q296 L297 K298	K290-Q294 WeakPolarHBondContact O-CB 3.42Å; K290-Q294 VanDerWaalsContact O-CG 3.28Å; K290-Q294 WeakPolarHBondContact O-CG 3.45Å; K290-Q294 PolarHBondContact O-N 3.32Å; Y291-Q294 WeakPolarHBondContact O-CB 3.36Å; Y291-Q294 PolarHBondContact O-N 2.93Å; Y291-Q294 VanDerWaalsContact O-N 3.13Å; M292-Q294 VanDerWaalsContact C-N 3.3Å; M292-Q294 PolarHBondContact O-N 3.14Å; Q294-Q296 VanDerWaalsContact C-N 3.34Å; Q294-L297 PolarHBondContact O-N 2.87Å; Q294-K298 WeakPolarHBondContact O-CB 3.33Å; Q294-K298 PolarHBondContact O-N 3.48Å
295	E	77.8	Confident	73.6	Confident	95 Å²	95	117.8 Å²	117.8	44%	0.444	57%	0.565	S	S	.	*	H	α-helix	trans	-59.1	-45.4	171.5	-95.3	-71.1	133.1	0	0	110.9	Y291 M292 K298 A299	Y291-E295 HydrophobicContact CE1-CG 4.05Å; Y291-E295 HydrophobicContact CE2-CG 4.46Å; Y291-E295 PolarHBondContact O-N 3.33Å; M292-E295 PolarHBondContact O-N 2.86Å; E295-K298 WeakPolarHBondContact O-CB 3.44Å; E295-K298 PolarHBondContact O-N 3.19Å; E295-A299 WeakPolarHBondContact O-CB 3.05Å; E295-A299 PolarHBondContact O-N 3.15Å
296	Q	81.9	Confident	72.5	Confident	99 Å²	99	115.6 Å²	115.6	46%	0.463	56%	0.56	S	S	.	*	H	α-helix	trans	-64.4	-43.5	174.2	-75.8	-177.5	-16	0	0	112.1	M292 Q294 K298 A299 I300	M292-Q296 WeakPolarHBondContact O-CB 3.3Å; M292-Q296 VanDerWaalsContact O-CG 3.29Å; M292-Q296 WeakPolarHBondContact O-CG 3.29Å; M292-Q296 PolarHBondContact O-N 2.99Å; Q294-Q296 VanDerWaalsContact C-N 3.34Å; Q296-K298 VanDerWaalsContact C-N 3.25Å; Q296-K298 PolarHBondContact O-N 2.92Å; Q296-A299 PolarHBondContact O-N 3.38Å; Q296-I300 VanDerWaalsContact O-CB 3.29Å; Q296-I300 WeakPolarHBondContact O-CB 3.08Å; Q296-I300 WeakPolarHBondContact O-CD1 3.26Å; Q296-I300 WeakPolarHBondContact O-CG1 3.27Å; Q296-I300 PolarHBondContact O-N 3.44Å
297	L	73.1	Confident	71	Confident	95 Å²	95	115.6 Å²	115.6	50%	0.497	56%	0.56	S	S	.	*	H	α-helix	trans	-60.4	-37.4	173.8	-92.1	165.4	0	0	0	111.4	L293 Q294 K301	L293-L297 VanDerWaalsContact O-CB 3.24Å; L293-L297 WeakPolarHBondContact O-CB 3.32Å; L293-L297 WeakPolarHBondContact O-CG 3.43Å; L293-L297 PolarHBondContact O-N 3.4Å; Q294-L297 PolarHBondContact O-N 2.87Å; L297-K301 WeakPolarHBondContact O-CB 3.49Å; L297-K301 WeakPolarHBondContact O-CG 3.43Å; L297-K301 PolarHBondContact O-N 2.86Å
298	K	66.5	Low	69.8	Low	103 Å²	103	116.2 Å²	116.2	45%	0.448	56%	0.561	S	S	.	*	H	α-helix	trans	-67	-46.6	176.8	-167.2	177.7	-178.9	-177.7	0	110.6	Q294 E295 Q296 K301 K302	Q294-K298 WeakPolarHBondContact O-CB 3.33Å; Q294-K298 PolarHBondContact O-N 3.48Å; E295-K298 WeakPolarHBondContact O-CB 3.44Å; E295-K298 PolarHBondContact O-N 3.19Å; Q296-K298 VanDerWaalsContact C-N 3.25Å; Q296-K298 PolarHBondContact O-N 2.92Å; K298-K301 PolarHBondContact O-N 2.98Å; K298-K302 WeakPolarHBondContact O-CB 3.49Å; K298-K302 PolarHBondContact O-N 3.06Å
299	A	72.1	Confident	68.8	Low	55 Å²	55	115 Å²	115	46%	0.455	56%	0.558	S	S	.	*	H	α-helix	trans	-60.2	-46.1	173.6	0	0	0	0	0	112	E295 Q296 K302 E303	E295-A299 WeakPolarHBondContact O-CB 3.05Å; E295-A299 PolarHBondContact O-N 3.15Å; Q296-A299 PolarHBondContact O-N 3.38Å; A299-K302 PolarHBondContact O-N 2.8Å; A299-E303 PolarHBondContact O-N 3.27Å
300	I	65.8	Low	68.1	Low	89 Å²	89	111.6 Å²	111.6	46%	0.456	55%	0.554	S	S	.	*	H	α-helix	trans	-64.3	-43.9	177.6	-69.7	165.1	0	0	0	111.1	Q296 K302 E303 L304	Q296-I300 VanDerWaalsContact O-CB 3.29Å; Q296-I300 WeakPolarHBondContact O-CB 3.08Å; Q296-I300 WeakPolarHBondContact O-CD1 3.26Å; Q296-I300 WeakPolarHBondContact O-CG1 3.27Å; Q296-I300 PolarHBondContact O-N 3.44Å; I300-K302 VanDerWaalsContact C-N 3.32Å; I300-K302 PolarHBondContact O-N 2.7Å; I300-E303 PolarHBondContact O-N 2.85Å; I300-L304 HydrophobicContact CG2-CD1 3.49Å; I300-L304 VanDerWaalsContact CG2-CD1 3.49Å; I300-L304 HydrophobicContact CG2-CG 4.16Å; I300-L304 VanDerWaalsContact O-CB 3.31Å; I300-L304 WeakPolarHBondContact O-CB 3.49Å; I300-L304 VanDerWaalsContact O-CG 3.26Å; I300-L304 WeakPolarHBondContact O-CG 3.44Å; I300-L304 PolarHBondContact O-N 2.98Å
301	K	61.8	Low	67.7	Low	106 Å²	106	106.6 Å²	106.6	46%	0.461	53%	0.532	S	S	.	.	H	α-helix	trans	-62.9	-39.2	177	-80.7	178.4	177	-168.6	0	111.9	L297 K298 L304 G305 L306	L297-K301 WeakPolarHBondContact O-CB 3.49Å; L297-K301 WeakPolarHBondContact O-CG 3.43Å; L297-K301 PolarHBondContact O-N 2.86Å; K298-K301 PolarHBondContact O-N 2.98Å; K301-L304 PolarHBondContact O-N 3.18Å; K301-G305 PolarHBondContact O-N 3.14Å; K301-L306 PolarHBondContact O-N 3.46Å
302	K	67.4	Low	67.5	Low	142 Å²	142	104.3 Å²	104.3	62%	0.617	53%	0.53	S	S	*	.	H	α-helix	trans	-64.3	-43	174.2	-171	174.6	-177	176.9	0	111.6	K298 A299 I300 G305	K298-K302 WeakPolarHBondContact O-CB 3.49Å; K298-K302 PolarHBondContact O-N 3.06Å; A299-K302 PolarHBondContact O-N 2.8Å; I300-K302 VanDerWaalsContact C-N 3.32Å; I300-K302 PolarHBondContact O-N 2.7Å; K302-G305 PolarHBondContact O-N 3.34Å
303	E	69.1	Low	67.4	Low	180 Å²	180	101.3 Å²	101.3	84%	0.841	52%	0.523	S	S	*	.	H	α-helix	trans	-68.3	-35.1	174.3	-74.4	-148.3	171	0	0	113.6	A299 I300 G305	A299-E303 PolarHBondContact O-N 3.27Å; I300-E303 PolarHBondContact O-N 2.85Å; E303-G305 PolarHBondContact O-N 3.11Å
304	L	62.2	Low	67.4	Low	115 Å²	115	98.6 Å²	98.6	60%	0.602	51%	0.51	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.7	-4.1	178.5	-73.4	169.7	0	0	0	113.6	I300 K301 L306	I300-L304 HydrophobicContact CG2-CD1 3.49Å; I300-L304 VanDerWaalsContact CG2-CD1 3.49Å; I300-L304 HydrophobicContact CG2-CG 4.16Å; I300-L304 VanDerWaalsContact O-CB 3.31Å; I300-L304 WeakPolarHBondContact O-CB 3.49Å; I300-L304 VanDerWaalsContact O-CG 3.26Å; I300-L304 WeakPolarHBondContact O-CG 3.44Å; I300-L304 PolarHBondContact O-N 2.98Å; K301-L304 PolarHBondContact O-N 3.18Å; L304-L306 HydrophobicContact CB-CB 4.41Å; L304-L306 HydrophobicContact CB-CD1 3.91Å; L304-L306 HydrophobicContact CB-CG 3.99Å; L304-L306 HydrophobicContact CD1-CD1 3.98Å; L304-L306 PolarHBondContact O-N 3.44Å
305	G	56.3	Low	67.5	Low	64 Å²	64	93 Å²	93	66%	0.66	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.7	19.3	-174.7	0	0	0	0	0	113.6	K301 K302 E303 E307	K301-G305 PolarHBondContact O-N 3.14Å; K302-G305 PolarHBondContact O-N 3.34Å; E303-G305 PolarHBondContact O-N 3.11Å; G305-E307 VanDerWaalsContact C-N 3.27Å
306	L	58.2	Low	67.8	Low	115 Å²	115	93.5 Å²	93.5	60%	0.602	49%	0.488	S	S	*	.			trans	-88.4	10.4	179.1	-71.8	171.9	0	0	0	112.6	K301 L304 K308	K301-L306 PolarHBondContact O-N 3.46Å; L304-L306 HydrophobicContact CB-CB 4.41Å; L304-L306 HydrophobicContact CB-CD1 3.91Å; L304-L306 HydrophobicContact CB-CG 3.99Å; L304-L306 HydrophobicContact CD1-CD1 3.98Å; L304-L306 PolarHBondContact O-N 3.44Å; L306-K308 PolarHBondContact O-N 2.6Å
307	E	50.9	Low	67.9	Low	113 Å²	113	94 Å²	94	53%	0.528	49%	0.488	S	S	.	.			trans	-64.1	76.9	162.3	-77.7	-177.9	165.1	0	0	108.5	G305 D309	G305-E307 VanDerWaalsContact C-N 3.27Å; E307-D309 PolarHBondContact O-N 2.93Å
308	K	53.9	Low	68.7	Low	151 Å²	151	89.6 Å²	89.6	66%	0.657	47%	0.465	S	S	*	.			trans	-62.8	123.1	139.8	-79.3	-171	173.1	-169.3	0	104.6	L306 D310	L306-K308 PolarHBondContact O-N 2.6Å; K308-D310 PolarHBondContact O-N 3.49Å
309	D	59.1	Low	69.7	Low	99 Å²	99	90.7 Å²	90.7	53%	0.529	47%	0.467	S	S	.	.			trans	-45.9	127.4	180	-122.2	-30.4	0	0	0	108.5	E307 K311 D312 A313	E307-D309 PolarHBondContact O-N 2.93Å; D309-K311 HydrophobicContact CB-CB 4.4Å; D309-K311 PolarHBondContact O-N 2.77Å; D309-D312 PolarHBondContact O-N 2.95Å; D309-A313 PolarHBondContact O-N 3.06Å
310	D	64.1	Low	70.4	Confident	111 Å²	111	91.8 Å²	91.8	59%	0.594	47%	0.465	S	S	*	.	H	α-helix	trans	-52.1	-26.1	-179.4	-86.6	-25.1	0	0	0	111	K308 V314	K308-D310 PolarHBondContact O-N 3.49Å; D310-V314 VanDerWaalsContact O-CG2 3.29Å; D310-V314 WeakPolarHBondContact O-CG2 3.34Å; D310-V314 PolarHBondContact O-N 3.42Å
311	K	69.1	Low	71.4	Confident	41 Å²	41	91.4 Å²	91.4	18%	0.178	46%	0.458	C	S	.	.	H	α-helix	trans	-58	-49.2	171.5	-62.2	-174	173	-173.8	0	113.5	D309 A313 V314 A315 A343 L345 P347 F352	D309-K311 HydrophobicContact CB-CB 4.4Å; D309-K311 PolarHBondContact O-N 2.77Å; K311-A313 PolarHBondContact O-N 3.47Å; K311-V314 PolarHBondContact O-N 3.48Å; K311-A315 WeakPolarHBondContact O-CB 3.13Å; K311-A315 PolarHBondContact O-N 2.85Å; K311-A343 PolarHBondContact NZ-O 3.27Å; K311-L345 WeakPolarHBondContact CE-O 3.31Å; K311-L345 PolarHBondContact NZ-O 2.94Å; K311-P347 HydrophobicContact CD-CG 4.38Å; K311-P347 VanDerWaalsContact CE-CD 3.47Å; K311-P347 HydrophobicContact CG-CG 4.03Å; K311-F352 HydrophobicContact CG-CE2 4.02Å; K311-F352 HydrophobicContact CG-CZ 4.33Å
312	D	74	Confident	72.6	Confident	94 Å²	94	87.2 Å²	87.2	50%	0.503	44%	0.44	S	S	.	.	H	α-helix	trans	-66.9	-40.5	-176.6	-73.1	-24.5	0	0	0	110.9	D309 V314 A315 E316	D309-D312 PolarHBondContact O-N 2.95Å; D312-V314 VanDerWaalsContact C-N 3.35Å; D312-V314 PolarHBondContact O-N 3.3Å; D312-A315 PolarHBondContact O-N 3.34Å; D312-E316 PolarHBondContact O-N 3.03Å
313	A	76.4	Confident	73.4	Confident	54 Å²	54	87.6 Å²	87.6	45%	0.446	44%	0.442	S	S	.	.	H	α-helix	trans	-63.8	-40	177.2	0	0	0	0	0	112.2	D309 K311 K317	D309-A313 PolarHBondContact O-N 3.06Å; K311-A313 PolarHBondContact O-N 3.47Å; A313-K317 WeakPolarHBondContact O-CB 3.46Å; A313-K317 PolarHBondContact O-N 3.28Å
314	V	78.1	Confident	73.9	Confident	22 Å²	22	85 Å²	85	13%	0.133	43%	0.434	C	S	.	.	H	α-helix	trans	-66.4	-42.9	174.4	171.9	0	0	0	0	110.5	D310 K311 D312 K317 F318 L342 R356	D310-V314 VanDerWaalsContact O-CG2 3.29Å; D310-V314 WeakPolarHBondContact O-CG2 3.34Å; D310-V314 PolarHBondContact O-N 3.42Å; K311-V314 PolarHBondContact O-N 3.48Å; D312-V314 VanDerWaalsContact C-N 3.35Å; D312-V314 PolarHBondContact O-N 3.3Å; V314-K317 PolarHBondContact O-N 3.24Å; V314-F318 HydrophobicContact CG1-CD2 3.85Å; V314-F318 HydrophobicContact CG1-CE2 3.33Å; V314-F318 HydrophobicContact CG1-CZ 3.91Å; V314-F318 WeakPolarHBondContact O-CD2 3.37Å; V314-F318 WeakPolarHBondContact O-CG 3.33Å; V314-F318 PolarHBondContact O-N 3.29Å; V314-L342 HydrophobicContact CG1-CD2 4.16Å; V314-R356 HydrophobicContact CG1-CG 4.13Å
315	A	80.1	Confident	75.1	Confident	10 Å²	10	80.9 Å²	80.9	8%	0.083	41%	0.413	C	S	.	.	H	α-helix	trans	-66.2	-45	-179.4	0	0	0	0	0	112.7	K311 D312 K317 F318 R319 F339	K311-A315 WeakPolarHBondContact O-CB 3.13Å; K311-A315 PolarHBondContact O-N 2.85Å; D312-A315 PolarHBondContact O-N 3.34Å; A315-K317 PolarHBondContact O-N 2.78Å; A315-F318 PolarHBondContact O-N 3.48Å; A315-R319 WeakPolarHBondContact O-CG 3.33Å; A315-R319 PolarHBondContact O-N 2.94Å; A315-F339 HydrophobicContact CB-CD1 4.35Å; A315-F339 HydrophobicContact CB-CE1 4.17Å
316	E	83.2	Confident	76.7	Confident	106 Å²	106	81.2 Å²	81.2	50%	0.495	41%	0.409	S	S	.	.	H	α-helix	trans	-59.5	-45.9	175.1	-77.1	-153.6	134.5	0	0	111.5	D312 F318 R319 D320	D312-E316 PolarHBondContact O-N 3.03Å; E316-F318 VanDerWaalsContact C-N 3.27Å; E316-F318 PolarHBondContact O-N 2.98Å; E316-R319 PolarHBondContact O-N 2.77Å; E316-D320 WeakPolarHBondContact O-CB 3.22Å; E316-D320 VanDerWaalsContact O-CG 3.32Å; E316-D320 PolarHBondContact O-N 2.86Å
317	K	85.6	Confident	78.2	Confident	108 Å²	108	77.1 Å²	77.1	47%	0.47	39%	0.389	S	S	.	.	H	α-helix	trans	-56.4	-41.2	178.1	-179	-174.1	177.2	-172	0	112.5	A313 V314 A315 R321	A313-K317 WeakPolarHBondContact O-CB 3.46Å; A313-K317 PolarHBondContact O-N 3.28Å; V314-K317 PolarHBondContact O-N 3.24Å; A315-K317 PolarHBondContact O-N 2.78Å; K317-R321 PolarHBondContact O-N 2.99Å
318	F	89.1	Confident	80.1	Confident	4 Å²	4	74 Å²	74	2%	0.018	38%	0.378	C	S	.	.	H	α-helix	trans	-73.6	-41.4	179.3	-67.1	-31.2	0	0	0	111.8	V314 A315 E316 D320 R321 L322 F339 R356 L359 D360 T363	V314-F318 HydrophobicContact CG1-CD2 3.85Å; V314-F318 HydrophobicContact CG1-CE2 3.33Å; V314-F318 HydrophobicContact CG1-CZ 3.91Å; V314-F318 WeakPolarHBondContact O-CD2 3.37Å; V314-F318 WeakPolarHBondContact O-CG 3.33Å; V314-F318 PolarHBondContact O-N 3.29Å; A315-F318 PolarHBondContact O-N 3.48Å; E316-F318 VanDerWaalsContact C-N 3.27Å; E316-F318 PolarHBondContact O-N 2.98Å; F318-D320 VanDerWaalsContact C-N 3.31Å; F318-D320 PolarHBondContact O-N 3.41Å; F318-R321 PolarHBondContact O-N 2.86Å; F318-L322 WeakPolarHBondContact O-CG 3.42Å; F318-L322 PolarHBondContact O-N 2.86Å; F318-F339 HydrophobicContact CB-CE1 3.81Å; F318-F339 HydrophobicContact CB-CZ 3.48Å; F318-F339 VanDerWaalsContact CB-CZ 3.48Å; F318-F339 HydrophobicContact CD2-CE1 4.1Å; F318-F339 HydrophobicContact CD2-CZ 4.47Å; F318-F339 HydrophobicContact CG-CE1 4.5Å; F318-F339 HydrophobicContact CG-CZ 4.49Å; F318-R356 HydrophobicContact CE2-CG 4.23Å; F318-R356 HydrophobicContact CZ-CG 4.08Å; F318-R356 WeakPolarHBondContact CZ-O 3.36Å; F318-L359 HydrophobicContact CD2-CB 3.78Å; F318-L359 HydrophobicContact CD2-CD1 4.26Å; F318-L359 HydrophobicContact CE2-CB 3.64Å; F318-L359 HydrophobicContact CE2-CD1 4.36Å; F318-L359 HydrophobicContact CZ-CB 4.26Å; F318-D360 HydrophobicContact CE1-CB 3.92Å; F318-D360 HydrophobicContact CZ-CB 4.01Å; F318-T363 HydrophobicContact CB-CG2 3.84Å; F318-T363 WeakPolarHBondContact CD1-OG1 3.45Å; F318-T363 HydrophobicContact CG-CG2 4.3Å
319	R	86.8	Confident	81.8	Confident	125 Å²	125	70.3 Å²	70.3	47%	0.472	38%	0.376	S	S	.	.	H	α-helix	trans	-60.4	-40.8	173.4	-70.6	-179	-171.5	120.7	0.7	112	A315 E316 R321 L322 K323 F339	A315-R319 WeakPolarHBondContact O-CG 3.33Å; A315-R319 PolarHBondContact O-N 2.94Å; E316-R319 PolarHBondContact O-N 2.77Å; R319-R321 VanDerWaalsContact C-N 3.27Å; R319-R321 PolarHBondContact O-N 3.49Å; R319-L322 PolarHBondContact O-N 2.86Å; R319-K323 PolarHBondContact O-N 2.57Å; R319-F339 HydrophobicContact CG-CE2 4.32Å; R319-F339 HydrophobicContact CG-CZ 3.97Å
320	D	87.9	Confident	83.3	Confident	79 Å²	79	69.4 Å²	69.4	42%	0.422	37%	0.368	S	S	.	.	H	α-helix	trans	-60.8	-34.8	177.9	-77.9	-17.6	0	0	0	112.7	E316 F318 L322 K323	E316-D320 WeakPolarHBondContact O-CB 3.22Å; E316-D320 VanDerWaalsContact O-CG 3.32Å; E316-D320 PolarHBondContact O-N 2.86Å; F318-D320 VanDerWaalsContact C-N 3.31Å; F318-D320 PolarHBondContact O-N 3.41Å; D320-L322 VanDerWaalsContact C-N 3.3Å; D320-L322 PolarHBondContact O-N 3.5Å; D320-K323 WeakPolarHBondContact OD1-CE 3.37Å; D320-K323 IonicContact OD1-NZ 3.03Å; D320-K323 PolarHBondContact OD1-NZ 2.9Å
321	R	86.2	Confident	84.5	Confident	80 Å²	80	64.2 Å²	64.2	30%	0.302	34%	0.34	S	S	.	.	H	α-helix	trans	-67.8	-30.9	175.1	-71.4	175.3	176.5	173.2	-5.2	112.9	K317 F318 R319 L325 D360 S364	K317-R321 PolarHBondContact O-N 2.99Å; F318-R321 PolarHBondContact O-N 2.86Å; R319-R321 VanDerWaalsContact C-N 3.27Å; R319-R321 PolarHBondContact O-N 3.49Å; R321-L325 VanDerWaalsContact O-CD1 3.24Å; R321-L325 WeakPolarHBondContact O-CD1 3.18Å; R321-L325 WeakPolarHBondContact O-CG 3.31Å; R321-D360 IonicContact CZ-OD1 2.75Å; R321-D360 IonicContact NH1-OD1 2.72Å; R321-D360 PolarHBondContact NH1-OD1 3.09Å; R321-D360 IonicContact NH2-OD1 3.7Å; R321-D360 PolarHBondContact NH2-OD1 3.28Å; R321-S364 PolarHBondContact NH1-OG 2.75Å
322	L	86.5	Confident	85.6	Confident	18 Å²	18	65 Å²	65	9%	0.094	35%	0.345	C	S	.	.	H	α-helix	trans	-81.8	-23.4	-176.4	-62	174.6	0	0	0	113.2	F318 R319 D320 D324 L325 V327 I335 F339 T363	F318-L322 WeakPolarHBondContact O-CG 3.42Å; F318-L322 PolarHBondContact O-N 2.86Å; R319-L322 PolarHBondContact O-N 2.86Å; D320-L322 VanDerWaalsContact C-N 3.3Å; D320-L322 PolarHBondContact O-N 3.5Å; L322-D324 PolarHBondContact O-N 2.9Å; L322-D324 VanDerWaalsContact O-N 3.12Å; L322-L325 HydrophobicContact CD2-CD1 4.39Å; L322-L325 PolarHBondContact O-N 2.94Å; L322-V327 HydrophobicContact CD2-CG2 3.95Å; L322-I335 HydrophobicContact CD1-CD1 4.2Å; L322-I335 HydrophobicContact CD1-CG2 3.81Å; L322-I335 HydrophobicContact CD2-CD1 4.07Å; L322-F339 HydrophobicContact CD1-CE2 4.29Å; L322-T363 HydrophobicContact CD1-CG2 3.96Å; L322-T363 HydrophobicContact CD2-CG2 3.95Å; L322-T363 HydrophobicContact CG-CG2 3.98Å
323	K	83.7	Confident	86.4	Confident	150 Å²	150	66.5 Å²	66.5	65%	0.652	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.3	-34.2	-176.7	-75	175.3	-178.6	165.9	0	114	R319 D320	R319-K323 PolarHBondContact O-N 2.57Å; D320-K323 WeakPolarHBondContact OD1-CE 3.37Å; D320-K323 IonicContact OD1-NZ 3.03Å; D320-K323 PolarHBondContact OD1-NZ 2.9Å
324	D	80.8	Confident	87.1	Confident	127 Å²	127	64.8 Å²	64.8	68%	0.679	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.5	18	-177.1	-57.4	-34	0	0	0	113.2	L322 K369	L322-D324 PolarHBondContact O-N 2.9Å; L322-D324 VanDerWaalsContact O-N 3.12Å; D324-K369 VanDerWaalsContact O-CE 3.26Å; D324-K369 WeakPolarHBondContact O-CE 3.44Å
325	L	88	Confident	87.7	Confident	28 Å²	28	63.8 Å²	63.8	15%	0.147	33%	0.328	C	S	.	.	S	Bend	trans	-122.7	143.6	-175.2	-65.3	175.8	0	0	0	110.8	R321 L322 V327 M365 W367 K369	R321-L325 VanDerWaalsContact O-CD1 3.24Å; R321-L325 WeakPolarHBondContact O-CD1 3.18Å; R321-L325 WeakPolarHBondContact O-CG 3.31Å; L322-L325 HydrophobicContact CD2-CD1 4.39Å; L322-L325 PolarHBondContact O-N 2.94Å; L325-V327 HydrophobicContact CB-CG2 4.19Å; L325-V327 PolarHBondContact O-N 2.83Å; L325-M365 WeakPolarHBondContact CD1-O 3.5Å; L325-W367 HydrophobicContact CB-CB 4.27Å; L325-W367 VanDerWaalsContact CD2-O 3.31Å; L325-W367 WeakPolarHBondContact CD2-O 3.24Å; L325-K369 HydrophobicContact CD2-CD 3.46Å; L325-K369 VanDerWaalsContact CD2-CD 3.46Å; L325-K369 VanDerWaalsContact CD2-CE 3.45Å; L325-K369 HydrophobicContact CD2-CG 3.73Å
326	A	88.6	Confident	88.2	Confident	71 Å²	71	66.8 Å²	66.8	59%	0.587	34%	0.343	S	S	*	.			trans	-95.4	87.3	172.6	0	0	0	0	0	108.7	W367	A326-W367 PolarHBondContact N-O 3.25Å; A326-W367 VanDerWaalsContact N-O 3.13Å; A326-W367 CarbonylContact O-C 3.53Å
327	V	89.7	Confident	88.6	Confident	29 Å²	29	67.3 Å²	67.3	18%	0.176	35%	0.346	C	S	.	.			trans	-80	129.6	-176.7	-170.7	0	0	0	0	110.2	L322 L325 I331 Q332 I335 W367	L322-V327 HydrophobicContact CD2-CG2 3.95Å; L325-V327 HydrophobicContact CB-CG2 4.19Å; L325-V327 PolarHBondContact O-N 2.83Å; V327-I331 HydrophobicContact CG1-CB 3.89Å; V327-I331 HydrophobicContact CG1-CG2 3.91Å; V327-Q332 HydrophobicContact CG1-CB 4.17Å; V327-I335 HydrophobicContact CG1-CD1 4.16Å; V327-W367 HydrophobicContact CG1-CG 4.39Å; V327-W367 HydrophobicContact CG2-CB 4.18Å; V327-W367 HydrophobicContact CG2-CG 4.27Å
328	P	91.2	Very high	88.7	Confident	47 Å²	47	62.9 Å²	62.9	31%	0.305	33%	0.326	S	S	.	.			trans	-58.3	145.8	171.9	-24.3	34	0	0	0	112.5	H330 I331 Q332 W367	P328-H330 VanDerWaalsContact C-N 3.35Å; P328-H330 PolarHBondContact O-N 2.9Å; P328-I331 HydrophobicContact CB-CD1 4.22Å; P328-I331 HydrophobicContact CB-CG1 4.15Å; P328-I331 HydrophobicContact CG-CD1 3.92Å; P328-I331 HydrophobicContact CG-CG1 4.38Å; P328-I331 PolarHBondContact O-N 3.05Å; P328-Q332 PolarHBondContact O-N 3.09Å; P328-W367 HydrophobicContact CG-CE3 4.47Å
329	A	90.4	Very high	88.7	Confident	73 Å²	73	63.3 Å²	63.3	60%	0.603	33%	0.328	S	S	*	.	H	α-helix	trans	-55.8	-45	-173.9	0	0	0	0	0	113.2	I331 Q332 E333	A329-I331 PolarHBondContact O-N 3.3Å; A329-Q332 PolarHBondContact O-N 3.46Å; A329-E333 WeakPolarHBondContact O-CG 3.29Å; A329-E333 PolarHBondContact O-N 3.06Å
330	H	90.1	Very high	88.8	Confident	81 Å²	81	62.2 Å²	62.2	38%	0.375	33%	0.332	S	S	.	.	H	α-helix	trans	-64.7	-28.8	179.7	70.5	-74.7	0	0	0	113.2	P328 A334 T525	P328-H330 VanDerWaalsContact C-N 3.35Å; P328-H330 PolarHBondContact O-N 2.9Å; H330-A334 PolarHBondContact O-N 3.47Å; H330-T525 PolarHBondContact NE2-O 3.43Å; H330-T525 VanDerWaalsContact NE2-O 3.07Å; H330-T525 PolarHBondContact NE2-OG1 2.98Å
331	I	90.1	Very high	88.7	Confident	1 Å²	1	63.2 Å²	63.2	1%	0.005	33%	0.333	C	S	.	.	H	α-helix	trans	-80.9	-37.5	177.3	-54.2	-173.1	0	0	0	110	V327 P328 A329 E333 A334 I335 L362 W367 V524	V327-I331 HydrophobicContact CG1-CB 3.89Å; V327-I331 HydrophobicContact CG1-CG2 3.91Å; P328-I331 HydrophobicContact CB-CD1 4.22Å; P328-I331 HydrophobicContact CB-CG1 4.15Å; P328-I331 HydrophobicContact CG-CD1 3.92Å; P328-I331 HydrophobicContact CG-CG1 4.38Å; P328-I331 PolarHBondContact O-N 3.05Å; A329-I331 PolarHBondContact O-N 3.3Å; I331-E333 VanDerWaalsContact C-N 3.32Å; I331-A334 PolarHBondContact O-N 3.29Å; I331-I335 HydrophobicContact CG2-CD1 4.01Å; I331-I335 HydrophobicContact CG2-CG1 4.43Å; I331-I335 WeakPolarHBondContact O-CB 3.41Å; I331-I335 VanDerWaalsContact O-CG1 3.26Å; I331-I335 WeakPolarHBondContact O-CG1 3.31Å; I331-I335 PolarHBondContact O-N 3.44Å; I331-L362 HydrophobicContact CG2-CD2 4.15Å; I331-W367 HydrophobicContact CD1-CD2 4.27Å; I331-W367 HydrophobicContact CD1-CE3 3.89Å; I331-W367 HydrophobicContact CD1-CH2 3.24Å; I331-W367 HydrophobicContact CD1-CZ2 3.64Å; I331-W367 HydrophobicContact CD1-CZ3 3.36Å; I331-W367 HydrophobicContact CG2-CZ2 3.87Å; I331-V524 HydrophobicContact CG1-CG2 4.47Å
332	Q	90.6	Very high	88.6	Confident	58 Å²	58	59.6 Å²	59.6	27%	0.271	32%	0.319	S	S	.	.	H	α-helix	trans	-62.1	-42.4	175	-172.6	57.1	48.1	0	0	111	V327 P328 A329 A334 I335 D336	V327-Q332 HydrophobicContact CG1-CB 4.17Å; P328-Q332 PolarHBondContact O-N 3.09Å; A329-Q332 PolarHBondContact O-N 3.46Å; Q332-A334 PolarHBondContact O-N 3.11Å; Q332-I335 WeakPolarHBondContact O-CB 3.48Å; Q332-I335 PolarHBondContact O-N 3.13Å; Q332-D336 VanDerWaalsContact NE2-CG 3.34Å; Q332-D336 PolarHBondContact NE2-OD1 2.88Å; Q332-D336 PolarHBondContact NE2-OD2 3.4Å; Q332-D336 VanDerWaalsContact NE2-OD2 3.14Å; Q332-D336 WeakPolarHBondContact O-CB 3.14Å; Q332-D336 VanDerWaalsContact O-CG 3.27Å; Q332-D336 PolarHBondContact O-N 3.44Å
333	E	92	Very high	88.4	Confident	125 Å²	125	61.5 Å²	61.5	58%	0.584	34%	0.337	S	S	*	.	H	α-helix	trans	-56.9	-49.2	172.6	-73.1	172.5	-175.5	0	0	111.6	A329 I331 I335 D336 E337	A329-E333 WeakPolarHBondContact O-CG 3.29Å; A329-E333 PolarHBondContact O-N 3.06Å; I331-E333 VanDerWaalsContact C-N 3.32Å; E333-I335 VanDerWaalsContact C-N 3.32Å; E333-I335 PolarHBondContact O-N 2.92Å; E333-D336 PolarHBondContact O-N 3.18Å; E333-E337 WeakPolarHBondContact O-CG 2.96Å; E333-E337 PolarHBondContact O-N 3.35Å
334	A	90.2	Very high	88.4	Confident	19 Å²	19	63.1 Å²	63.1	16%	0.157	35%	0.345	C	S	.	.	H	α-helix	trans	-61.8	-37.9	177.5	0	0	0	0	0	112.9	H330 I331 Q332 E338 V524	H330-A334 PolarHBondContact O-N 3.47Å; I331-A334 PolarHBondContact O-N 3.29Å; Q332-A334 PolarHBondContact O-N 3.11Å; A334-E338 WeakPolarHBondContact O-CG 3.16Å; A334-E338 PolarHBondContact O-N 3.43Å; A334-V524 HydrophobicContact CB-CG1 4.03Å
335	I	91.1	Very high	88.6	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-64.7	-45.9	175.4	-74.4	170.3	0	0	0	110.7	L322 V327 I331 Q332 E333 E338 F339 L359 L362	L322-I335 HydrophobicContact CD1-CD1 4.2Å; L322-I335 HydrophobicContact CD1-CG2 3.81Å; L322-I335 HydrophobicContact CD2-CD1 4.07Å; V327-I335 HydrophobicContact CG1-CD1 4.16Å; I331-I335 HydrophobicContact CG2-CD1 4.01Å; I331-I335 HydrophobicContact CG2-CG1 4.43Å; I331-I335 WeakPolarHBondContact O-CB 3.41Å; I331-I335 VanDerWaalsContact O-CG1 3.26Å; I331-I335 WeakPolarHBondContact O-CG1 3.31Å; I331-I335 PolarHBondContact O-N 3.44Å; Q332-I335 WeakPolarHBondContact O-CB 3.48Å; Q332-I335 PolarHBondContact O-N 3.13Å; E333-I335 VanDerWaalsContact C-N 3.32Å; E333-I335 PolarHBondContact O-N 2.92Å; I335-E338 PolarHBondContact O-N 2.96Å; I335-F339 HydrophobicContact CG2-CD2 3.51Å; I335-F339 HydrophobicContact CG2-CE2 3.34Å; I335-F339 VanDerWaalsContact O-CD2 3.23Å; I335-F339 WeakPolarHBondContact O-CD2 3.13Å; I335-F339 PolarHBondContact O-N 3.29Å; I335-L359 HydrophobicContact CG2-CD2 4.28Å; I335-L362 HydrophobicContact CD1-CB 4.31Å; I335-L362 HydrophobicContact CG1-CB 4.03Å; I335-L362 HydrophobicContact CG1-CD1 3.87Å
336	D	91.5	Very high	88.2	Confident	73 Å²	73	62.3 Å²	62.3	39%	0.39	34%	0.34	S	S	.	.	H	α-helix	trans	-68.6	-39.3	-177.2	-69.9	-28.6	0	0	0	111.7	Q332 E333 E338 F339 N340	Q332-D336 VanDerWaalsContact NE2-CG 3.34Å; Q332-D336 PolarHBondContact NE2-OD1 2.88Å; Q332-D336 PolarHBondContact NE2-OD2 3.4Å; Q332-D336 VanDerWaalsContact NE2-OD2 3.14Å; Q332-D336 WeakPolarHBondContact O-CB 3.14Å; Q332-D336 VanDerWaalsContact O-CG 3.27Å; Q332-D336 PolarHBondContact O-N 3.44Å; E333-D336 PolarHBondContact O-N 3.18Å; D336-E338 VanDerWaalsContact C-N 3.34Å; D336-E338 PolarHBondContact O-N 3.28Å; D336-F339 PolarHBondContact O-N 3.46Å; D336-N340 VanDerWaalsContact O-CG 3.26Å; D336-N340 PolarHBondContact O-N 2.97Å; D336-N340 PolarHBondContact O-ND2 2.77Å
337	E	90.6	Very high	87.7	Confident	117 Å²	117	61.3 Å²	61.3	55%	0.547	33%	0.328	S	S	.	.	H	α-helix	trans	-58.5	-44.4	171.7	-75.8	-172.4	-177.5	0	0	112.2	E333 N340 K341	E333-E337 WeakPolarHBondContact O-CG 2.96Å; E333-E337 PolarHBondContact O-N 3.35Å; E337-N340 WeakPolarHBondContact O-CB 3.4Å; E337-N340 PolarHBondContact O-N 3.35Å; E337-K341 WeakPolarHBondContact O-CG 3.31Å; E337-K341 PolarHBondContact O-N 2.76Å
338	E	88.5	Confident	87.2	Confident	15 Å²	15	67.5 Å²	67.5	7%	0.07	36%	0.355	C	S	.	.	H	α-helix	trans	-72.7	-33	178.7	-73.9	-65.2	141.2	0	0	113.4	A334 I335 D336 N340 K341 L342 S355 Y358 L359	A334-E338 WeakPolarHBondContact O-CG 3.16Å; A334-E338 PolarHBondContact O-N 3.43Å; I335-E338 PolarHBondContact O-N 2.96Å; D336-E338 VanDerWaalsContact C-N 3.34Å; D336-E338 PolarHBondContact O-N 3.28Å; E338-N340 VanDerWaalsContact C-N 3.3Å; E338-K341 PolarHBondContact O-N 3.05Å; E338-K341 WeakPolarHBondContact OE1-CD 3.37Å; E338-K341 IonicContact OE1-NZ 3.75Å; E338-K341 PolarHBondContact OE1-NZ 3.36Å; E338-L342 VanDerWaalsContact O-CB 3.29Å; E338-L342 WeakPolarHBondContact O-CB 3.48Å; E338-L342 PolarHBondContact O-N 3.03Å; E338-S355 WeakPolarHBondContact OE2-CB 3.41Å; E338-S355 PolarHBondContact OE2-OG 3.08Å; E338-Y358 HydrophobicContact CB-CD1 4.44Å; E338-Y358 HydrophobicContact CG-CD1 3.54Å; E338-Y358 HydrophobicContact CG-CE1 3.47Å; E338-Y358 VanDerWaalsContact CG-CE1 3.47Å; E338-L359 HydrophobicContact CB-CD1 4.25Å; E338-L359 HydrophobicContact CB-CD2 3.78Å; E338-L359 HydrophobicContact CB-CG 3.96Å
339	F	89	Confident	86.7	Confident	13 Å²	13	67.2 Å²	67.2	6%	0.057	35%	0.354	C	S	.	.	H	α-helix	trans	-60.9	-42.7	169.7	-87.5	-58.4	0	0	0	111.5	A315 F318 R319 L322 I335 D336 L342 A343 L359	A315-F339 HydrophobicContact CB-CD1 4.35Å; A315-F339 HydrophobicContact CB-CE1 4.17Å; F318-F339 HydrophobicContact CB-CE1 3.81Å; F318-F339 HydrophobicContact CB-CZ 3.48Å; F318-F339 VanDerWaalsContact CB-CZ 3.48Å; F318-F339 HydrophobicContact CD2-CE1 4.1Å; F318-F339 HydrophobicContact CD2-CZ 4.47Å; F318-F339 HydrophobicContact CG-CE1 4.5Å; F318-F339 HydrophobicContact CG-CZ 4.49Å; R319-F339 HydrophobicContact CG-CE2 4.32Å; R319-F339 HydrophobicContact CG-CZ 3.97Å; L322-F339 HydrophobicContact CD1-CE2 4.29Å; I335-F339 HydrophobicContact CG2-CD2 3.51Å; I335-F339 HydrophobicContact CG2-CE2 3.34Å; I335-F339 VanDerWaalsContact O-CD2 3.23Å; I335-F339 WeakPolarHBondContact O-CD2 3.13Å; I335-F339 PolarHBondContact O-N 3.29Å; D336-F339 PolarHBondContact O-N 3.46Å; F339-L342 PolarHBondContact O-N 2.78Å; F339-A343 PolarHBondContact O-N 3.31Å; F339-L359 HydrophobicContact CD1-CD1 4.07Å; F339-L359 HydrophobicContact CD2-CD2 4.34Å; F339-L359 HydrophobicContact CE1-CD1 4.28Å; F339-L359 HydrophobicContact CE2-CD2 4.37Å; F339-L359 HydrophobicContact CG-CD1 4.48Å; F339-L359 HydrophobicContact CG-CD2 4.49Å
340	N	88	Confident	86.2	Confident	103 Å²	103	68 Å²	68	55%	0.551	36%	0.355	S	S	*	.	H	α-helix	trans	-61.7	-47.3	175.9	-70.8	-31.4	0	0	0	110.6	D336 E337 E338 L342 A343 F344	D336-N340 VanDerWaalsContact O-CG 3.26Å; D336-N340 PolarHBondContact O-N 2.97Å; D336-N340 PolarHBondContact O-ND2 2.77Å; E337-N340 WeakPolarHBondContact O-CB 3.4Å; E337-N340 PolarHBondContact O-N 3.35Å; E338-N340 VanDerWaalsContact C-N 3.3Å; N340-L342 PolarHBondContact O-N 3.07Å; N340-A343 WeakPolarHBondContact O-CB 3.16Å; N340-A343 PolarHBondContact O-N 3.11Å; N340-F344 WeakPolarHBondContact O-CD2 3.21Å; N340-F344 PolarHBondContact O-N 3.46Å
341	K	86	Confident	85.9	Confident	99 Å²	99	69.2 Å²	69.2	43%	0.43	36%	0.361	S	S	.	.	H	α-helix	trans	-58.3	-47.9	175	-68.9	173.7	-161.7	166.5	0	111.7	E337 E338 A343 F344 L345	E337-K341 WeakPolarHBondContact O-CG 3.31Å; E337-K341 PolarHBondContact O-N 2.76Å; E338-K341 PolarHBondContact O-N 3.05Å; E338-K341 WeakPolarHBondContact OE1-CD 3.37Å; E338-K341 IonicContact OE1-NZ 3.75Å; E338-K341 PolarHBondContact OE1-NZ 3.36Å; K341-A343 PolarHBondContact O-N 2.87Å; K341-F344 PolarHBondContact O-N 3.36Å; K341-F344 VanDerWaalsContact O-N 3.11Å; K341-L345 VanDerWaalsContact O-CG 3.26Å; K341-L345 WeakPolarHBondContact O-CG 3.39Å; K341-L345 PolarHBondContact O-N 2.91Å
342	L	85.1	Confident	85.7	Confident	4 Å²	4	69.8 Å²	69.8	2%	0.021	36%	0.363	C	S	.	.	H	α-helix	trans	-58.5	-35.2	-179.4	-168.5	75.9	0	0	0	112.4	V314 E338 F339 N340 F352 R356 L359	V314-L342 HydrophobicContact CG1-CD2 4.16Å; E338-L342 VanDerWaalsContact O-CB 3.29Å; E338-L342 WeakPolarHBondContact O-CB 3.48Å; E338-L342 PolarHBondContact O-N 3.03Å; F339-L342 PolarHBondContact O-N 2.78Å; N340-L342 PolarHBondContact O-N 3.07Å; L342-F352 HydrophobicContact CD1-CD2 3.51Å; L342-F352 HydrophobicContact CD1-CE2 3.42Å; L342-F352 VanDerWaalsContact CD1-CE2 3.42Å; L342-F352 HydrophobicContact CD1-CG 4.1Å; L342-F352 HydrophobicContact CD1-CZ 3.97Å; L342-F352 HydrophobicContact CG-CD2 4.19Å; L342-F352 HydrophobicContact CG-CE2 3.74Å; L342-F352 HydrophobicContact CG-CZ 4.38Å; L342-R356 HydrophobicContact CD1-CB 4.25Å; L342-L359 HydrophobicContact CB-CD1 4.28Å; L342-L359 HydrophobicContact CD2-CD1 3.84Å
343	A	82	Confident	85.3	Confident	58 Å²	58	69.8 Å²	69.8	48%	0.479	37%	0.37	S	S	.	.	H	α-helix	trans	-63.6	-40.9	177.5	0	0	0	0	0	112.2	K311 F339 N340 K341	K311-A343 PolarHBondContact NZ-O 3.27Å; F339-A343 PolarHBondContact O-N 3.31Å; N340-A343 WeakPolarHBondContact O-CB 3.16Å; N340-A343 PolarHBondContact O-N 3.11Å; K341-A343 PolarHBondContact O-N 2.87Å
344	F	84	Confident	85	Confident	184 Å²	184	66.7 Å²	66.7	81%	0.807	36%	0.359	S	S	*	.	H	α-helix	trans	-82.8	-21.6	-179.1	-65.6	-71.2	0	0	0	114.2	N340 K341	N340-F344 WeakPolarHBondContact O-CD2 3.21Å; N340-F344 PolarHBondContact O-N 3.46Å; K341-F344 PolarHBondContact O-N 3.36Å; K341-F344 VanDerWaalsContact O-N 3.11Å
345	L	84.3	Confident	84.8	Confident	43 Å²	43	66.2 Å²	66.2	23%	0.225	36%	0.355	C	S	.	.	S	Bend	trans	-73.2	142.8	-177.9	-73.4	170.5	0	0	0	112.8	K311 K341 E351 F352	K311-L345 WeakPolarHBondContact CE-O 3.31Å; K311-L345 PolarHBondContact NZ-O 2.94Å; K341-L345 VanDerWaalsContact O-CG 3.26Å; K341-L345 WeakPolarHBondContact O-CG 3.39Å; K341-L345 PolarHBondContact O-N 2.91Å; L345-E351 HydrophobicContact CD1-CB 4.14Å; L345-E351 HydrophobicContact CD2-CB 3.91Å; L345-F352 HydrophobicContact CB-CB 4.21Å; L345-F352 HydrophobicContact CB-CD2 4.05Å
346	D	79.8	Confident	84.6	Confident	95 Å²	95	71.7 Å²	71.7	51%	0.508	38%	0.375	S	S	.	.			trans	-67.9	128.5	171.8	-176	-23.6	0	0	0	110.1	H348 S349 F352	D346-H348 PolarHBondContact O-N 3.29Å; D346-H348 IonicContact OD1-CD2 3.21Å; D346-H348 IonicContact OD1-CG 2.66Å; D346-H348 PolarHBondContact OD1-N 2.95Å; D346-S349 VanDerWaalsContact O-CB 3.24Å; D346-S349 WeakPolarHBondContact O-CB 3.4Å; D346-S349 PolarHBondContact O-N 3.47Å; D346-F352 WeakPolarHBondContact O-CB 3.37Å
347	P	77.7	Confident	84.5	Confident	51 Å²	51	71.9 Å²	71.9	33%	0.331	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.7	-23.4	176.5	-26.7	36.6	0	0	0	115.2	K311 F352	K311-P347 HydrophobicContact CD-CG 4.38Å; K311-P347 VanDerWaalsContact CE-CD 3.47Å; K311-P347 HydrophobicContact CG-CG 4.03Å; P347-F352 HydrophobicContact CB-CE1 4.4Å; P347-F352 HydrophobicContact CB-CZ 4.48Å
348	H	78.5	Confident	84.5	Confident	159 Å²	159	66.7 Å²	66.7	74%	0.736	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.6	-7.2	177.5	-66.9	-58.7	0	0	0	114.2	D346	D346-H348 PolarHBondContact O-N 3.29Å; D346-H348 IonicContact OD1-CD2 3.21Å; D346-H348 IonicContact OD1-CG 2.66Å; D346-H348 PolarHBondContact OD1-N 2.95Å
349	S	81	Confident	84.6	Confident	41 Å²	41	66 Å²	66	29%	0.287	35%	0.349	S	S	.	.	S	Bend	trans	-73.8	145.5	178.1	179.7	0	0	0	0	112.2	D346 E351 F352 S353	D346-S349 VanDerWaalsContact O-CB 3.24Å; D346-S349 WeakPolarHBondContact O-CB 3.4Å; D346-S349 PolarHBondContact O-N 3.47Å; S349-E351 PolarHBondContact O-N 3.09Å; S349-E351 PolarHBondContact OG-N 3.41Å; S349-F352 WeakPolarHBondContact O-CB 3.48Å; S349-F352 PolarHBondContact O-N 2.95Å; S349-S353 PolarHBondContact O-N 3.39Å
350	S	81.2	Confident	84.7	Confident	88 Å²	88	67.2 Å²	67.2	62%	0.615	36%	0.356	S	S	*	.	H	α-helix	trans	-59.2	-35.9	169.5	51.9	0	0	0	0	111.9	F352 S353 V354	S350-F352 VanDerWaalsContact C-N 3.32Å; S350-F352 PolarHBondContact O-N 3.37Å; S350-S353 WeakPolarHBondContact O-CB 3.43Å; S350-S353 PolarHBondContact O-N 2.83Å; S350-V354 WeakPolarHBondContact O-CG2 3.41Å; S350-V354 PolarHBondContact O-N 2.77Å
351	E	83.5	Confident	84.9	Confident	107 Å²	107	64.5 Å²	64.5	50%	0.5	34%	0.338	S	S	.	.	H	α-helix	trans	-62.3	-38.6	177.4	-65.8	-59.5	145.9	0	0	111.7	L345 S349 S353 V354 S355	L345-E351 HydrophobicContact CD1-CB 4.14Å; L345-E351 HydrophobicContact CD2-CB 3.91Å; S349-E351 PolarHBondContact O-N 3.09Å; S349-E351 PolarHBondContact OG-N 3.41Å; E351-S353 VanDerWaalsContact C-N 3.31Å; E351-S353 PolarHBondContact O-N 3.27Å; E351-V354 PolarHBondContact O-N 2.96Å; E351-V354 VanDerWaalsContact O-N 3.14Å; E351-S355 PolarHBondContact O-N 3.15Å
352	F	84.9	Confident	85.1	Confident	13 Å²	13	59.8 Å²	59.8	6%	0.057	32%	0.317	C	S	.	.	H	α-helix	trans	-61.5	-41.9	176.3	-178	-89.8	0	0	0	111.3	K311 L342 L345 D346 P347 S349 S350 V354 R356	K311-F352 HydrophobicContact CG-CE2 4.02Å; K311-F352 HydrophobicContact CG-CZ 4.33Å; L342-F352 HydrophobicContact CD1-CD2 3.51Å; L342-F352 HydrophobicContact CD1-CE2 3.42Å; L342-F352 VanDerWaalsContact CD1-CE2 3.42Å; L342-F352 HydrophobicContact CD1-CG 4.1Å; L342-F352 HydrophobicContact CD1-CZ 3.97Å; L342-F352 HydrophobicContact CG-CD2 4.19Å; L342-F352 HydrophobicContact CG-CE2 3.74Å; L342-F352 HydrophobicContact CG-CZ 4.38Å; L345-F352 HydrophobicContact CB-CB 4.21Å; L345-F352 HydrophobicContact CB-CD2 4.05Å; D346-F352 WeakPolarHBondContact O-CB 3.37Å; P347-F352 HydrophobicContact CB-CE1 4.4Å; P347-F352 HydrophobicContact CB-CZ 4.48Å; S349-F352 WeakPolarHBondContact O-CB 3.48Å; S349-F352 PolarHBondContact O-N 2.95Å; S350-F352 VanDerWaalsContact C-N 3.32Å; S350-F352 PolarHBondContact O-N 3.37Å; F352-V354 VanDerWaalsContact C-N 3.34Å; F352-V354 PolarHBondContact O-N 2.95Å; F352-R356 WeakPolarHBondContact O-CB 3.29Å; F352-R356 PolarHBondContact O-N 2.81Å
353	S	83.3	Confident	85.4	Confident	59 Å²	59	59.7 Å²	59.7	41%	0.413	32%	0.317	S	S	.	.	H	α-helix	trans	-64.8	-38.1	175.3	-171.3	0	0	0	0	112.2	S349 S350 E351 N357	S349-S353 PolarHBondContact O-N 3.39Å; S350-S353 WeakPolarHBondContact O-CB 3.43Å; S350-S353 PolarHBondContact O-N 2.83Å; E351-S353 VanDerWaalsContact C-N 3.31Å; E351-S353 PolarHBondContact O-N 3.27Å; S353-N357 WeakPolarHBondContact O-CB 3.33Å; S353-N357 PolarHBondContact O-N 3.11Å; S353-N357 PolarHBondContact O-ND2 3.19Å; S353-N357 VanDerWaalsContact O-ND2 3.15Å
354	V	85.2	Confident	85.8	Confident	59 Å²	59	58.3 Å²	58.3	36%	0.358	30%	0.304	S	S	.	.	H	α-helix	trans	-68.1	-52.8	179.1	173.8	0	0	0	0	110.7	S350 E351 F352 R356 N357 Y358	S350-V354 WeakPolarHBondContact O-CG2 3.41Å; S350-V354 PolarHBondContact O-N 2.77Å; E351-V354 PolarHBondContact O-N 2.96Å; E351-V354 VanDerWaalsContact O-N 3.14Å; F352-V354 VanDerWaalsContact C-N 3.34Å; F352-V354 PolarHBondContact O-N 2.95Å; V354-R356 VanDerWaalsContact C-N 3.3Å; V354-R356 PolarHBondContact O-N 3.41Å; V354-N357 PolarHBondContact O-N 3.25Å; V354-N357 VanDerWaalsContact O-N 3.16Å; V354-Y358 WeakPolarHBondContact O-CB 3.47Å; V354-Y358 PolarHBondContact O-N 3.13Å
355	S	86.7	Confident	86.3	Confident	10 Å²	10	49.6 Å²	49.6	7%	0.07	27%	0.266	C	S	.	.	H	α-helix	trans	-59.7	-39.4	176.5	-75.4	0	0	0	0	111.9	E338 E351 Y358 L359	E338-S355 WeakPolarHBondContact OE2-CB 3.41Å; E338-S355 PolarHBondContact OE2-OG 3.08Å; E351-S355 PolarHBondContact O-N 3.15Å; S355-Y358 PolarHBondContact O-N 3.13Å; S355-L359 WeakPolarHBondContact O-CB 3.48Å; S355-L359 WeakPolarHBondContact O-CG 3.08Å; S355-L359 PolarHBondContact O-N 3.04Å
356	R	86.7	Confident	86.7	Confident	114 Å²	114	47.9 Å²	47.9	43%	0.43	26%	0.257	S	S	.	.	H	α-helix	trans	-62	-45.4	174.7	178.1	-177.1	170.7	-165.2	-1.3	112.3	V314 F318 L342 F352 V354 Y358 L359 D360	V314-R356 HydrophobicContact CG1-CG 4.13Å; F318-R356 HydrophobicContact CE2-CG 4.23Å; F318-R356 HydrophobicContact CZ-CG 4.08Å; F318-R356 WeakPolarHBondContact CZ-O 3.36Å; L342-R356 HydrophobicContact CD1-CB 4.25Å; F352-R356 WeakPolarHBondContact O-CB 3.29Å; F352-R356 PolarHBondContact O-N 2.81Å; V354-R356 VanDerWaalsContact C-N 3.3Å; V354-R356 PolarHBondContact O-N 3.41Å; R356-Y358 VanDerWaalsContact C-N 3.32Å; R356-L359 PolarHBondContact O-N 3.07Å; R356-D360 PolarHBondContact O-N 3.4Å
357	N	88.6	Confident	87.3	Confident	78 Å²	78	43.7 Å²	43.7	42%	0.417	23%	0.234	S	C	.	.	H	α-helix	trans	-66	-38.6	178.4	-75.4	-26.9	0	0	0	111.1	S353 V354 D360 W361	S353-N357 WeakPolarHBondContact O-CB 3.33Å; S353-N357 PolarHBondContact O-N 3.11Å; S353-N357 PolarHBondContact O-ND2 3.19Å; S353-N357 VanDerWaalsContact O-ND2 3.15Å; V354-N357 PolarHBondContact O-N 3.25Å; V354-N357 VanDerWaalsContact O-N 3.16Å; N357-D360 PolarHBondContact O-N 3.49Å; N357-W361 PolarHBondContact O-N 2.85Å; N357-W361 VanDerWaalsContact O-N 3.08Å
358	Y	90.7	Very high	87.8	Confident	7 Å²	7	43.1 Å²	43.1	3%	0.027	24%	0.237	C	C	.	.	H	α-helix	trans	-62.2	-49.2	175.3	179	-131.1	0	0	0	111.9	E338 V354 S355 R356 D360 W361 L362 R460 Y521 L522	E338-Y358 HydrophobicContact CB-CD1 4.44Å; E338-Y358 HydrophobicContact CG-CD1 3.54Å; E338-Y358 HydrophobicContact CG-CE1 3.47Å; E338-Y358 VanDerWaalsContact CG-CE1 3.47Å; V354-Y358 WeakPolarHBondContact O-CB 3.47Å; V354-Y358 PolarHBondContact O-N 3.13Å; S355-Y358 PolarHBondContact O-N 3.13Å; R356-Y358 VanDerWaalsContact C-N 3.32Å; Y358-D360 VanDerWaalsContact C-N 3.31Å; Y358-D360 PolarHBondContact O-N 3.14Å; Y358-W361 PolarHBondContact O-N 3.31Å; Y358-W361 VanDerWaalsContact O-N 3.12Å; Y358-L362 HydrophobicContact CD1-CD1 4.12Å; Y358-L362 HydrophobicContact CD2-CD1 4.2Å; Y358-L362 HydrophobicContact CD2-CG 4.2Å; Y358-L362 HydrophobicContact CE1-CD1 3.54Å; Y358-L362 HydrophobicContact CE2-CD1 3.61Å; Y358-L362 HydrophobicContact CE2-CD2 4.23Å; Y358-L362 HydrophobicContact CE2-CG 3.73Å; Y358-L362 HydrophobicContact CG-CD1 4.42Å; Y358-L362 PolarHBondContact O-N 2.87Å; Y358-R460 PolarHBondContact OH-NH1 2.96Å; Y358-Y521 HydrophobicContact CD2-CE1 4.43Å; Y358-L522 HydrophobicContact CE2-CD2 4.32Å; Y358-L522 WeakPolarHBondContact CE2-O 3.44Å; Y358-L522 PolarHBondContact OH-O 2.89Å
359	L	90.5	Very high	88.3	Confident	0 Å²	0	40 Å²	40	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-60.4	-37.4	173.2	-75.8	169.8	0	0	0	112.2	F318 I335 E338 F339 L342 S355 R356 W361 L362 T363	F318-L359 HydrophobicContact CD2-CB 3.78Å; F318-L359 HydrophobicContact CD2-CD1 4.26Å; F318-L359 HydrophobicContact CE2-CB 3.64Å; F318-L359 HydrophobicContact CE2-CD1 4.36Å; F318-L359 HydrophobicContact CZ-CB 4.26Å; I335-L359 HydrophobicContact CG2-CD2 4.28Å; E338-L359 HydrophobicContact CB-CD1 4.25Å; E338-L359 HydrophobicContact CB-CD2 3.78Å; E338-L359 HydrophobicContact CB-CG 3.96Å; F339-L359 HydrophobicContact CD1-CD1 4.07Å; F339-L359 HydrophobicContact CD2-CD2 4.34Å; F339-L359 HydrophobicContact CE1-CD1 4.28Å; F339-L359 HydrophobicContact CE2-CD2 4.37Å; F339-L359 HydrophobicContact CG-CD1 4.48Å; F339-L359 HydrophobicContact CG-CD2 4.49Å; L342-L359 HydrophobicContact CB-CD1 4.28Å; L342-L359 HydrophobicContact CD2-CD1 3.84Å; S355-L359 WeakPolarHBondContact O-CB 3.48Å; S355-L359 WeakPolarHBondContact O-CG 3.08Å; S355-L359 PolarHBondContact O-N 3.04Å; R356-L359 PolarHBondContact O-N 3.07Å; L359-W361 VanDerWaalsContact C-N 3.31Å; L359-W361 PolarHBondContact O-N 2.93Å; L359-L362 PolarHBondContact O-N 3.33Å; L359-T363 VanDerWaalsContact O-CB 3.28Å; L359-T363 WeakPolarHBondContact O-CB 3.49Å; L359-T363 WeakPolarHBondContact O-CG2 3.44Å; L359-T363 PolarHBondContact O-N 3.02Å; L359-T363 PolarHBondContact O-OG1 2.82Å
360	D	90.4	Very high	88.7	Confident	39 Å²	39	42.9 Å²	42.9	21%	0.209	23%	0.231	C	C	.	.	H	α-helix	trans	-60.9	-41.2	174.6	-175.2	73.8	0	0	0	111.8	F318 R321 R356 N357 Y358 S364 K475	F318-D360 HydrophobicContact CE1-CB 3.92Å; F318-D360 HydrophobicContact CZ-CB 4.01Å; R321-D360 IonicContact CZ-OD1 2.75Å; R321-D360 IonicContact NH1-OD1 2.72Å; R321-D360 PolarHBondContact NH1-OD1 3.09Å; R321-D360 IonicContact NH2-OD1 3.7Å; R321-D360 PolarHBondContact NH2-OD1 3.28Å; R356-D360 PolarHBondContact O-N 3.4Å; N357-D360 PolarHBondContact O-N 3.49Å; Y358-D360 VanDerWaalsContact C-N 3.31Å; Y358-D360 PolarHBondContact O-N 3.14Å; D360-S364 WeakPolarHBondContact O-CB 3.34Å; D360-S364 PolarHBondContact O-N 2.91Å; D360-S364 VanDerWaalsContact O-N 3.09Å; D360-S364 PolarHBondContact O-OG 2.95Å; D360-K475 IonicContact OD2-NZ 3.23Å; D360-K475 PolarHBondContact OD2-NZ 2.99Å
361	W	92.6	Very high	89	Confident	46 Å²	46	40.2 Å²	40.2	17%	0.174	21%	0.211	C	C	.	.	H	α-helix	trans	-66.9	-54.3	175.4	-81	106.5	0	0	0	111.8	N357 Y358 L359 T363 S364 M365 P467 I471 Q472 K475 Y521 L522	N357-W361 PolarHBondContact O-N 2.85Å; N357-W361 VanDerWaalsContact O-N 3.08Å; Y358-W361 PolarHBondContact O-N 3.31Å; Y358-W361 VanDerWaalsContact O-N 3.12Å; L359-W361 VanDerWaalsContact C-N 3.31Å; L359-W361 PolarHBondContact O-N 2.93Å; W361-T363 VanDerWaalsContact C-N 3.3Å; W361-T363 PolarHBondContact O-N 2.79Å; W361-S364 PolarHBondContact O-N 3.49Å; W361-S364 VanDerWaalsContact O-N 3.14Å; W361-M365 WeakPolarHBondContact O-CG 3.48Å; W361-M365 PolarHBondContact O-N 3.36Å; W361-P467 HydrophobicContact CD2-CG 3.47Å; W361-P467 VanDerWaalsContact CD2-CG 3.47Å; W361-P467 HydrophobicContact CE3-CG 3.69Å; W361-P467 HydrophobicContact CG-CG 3.95Å; W361-P467 HydrophobicContact CH2-CG 4.07Å; W361-P467 HydrophobicContact CZ2-CG 3.87Å; W361-P467 HydrophobicContact CZ3-CG 3.96Å; W361-I471 HydrophobicContact CE3-CG2 4.04Å; W361-I471 HydrophobicContact CZ3-CG2 4.23Å; W361-Q472 HydrophobicContact CH2-CG 3.99Å; W361-Q472 HydrophobicContact CZ3-CG 4.43Å; W361-K475 HydrophobicContact CD2-CD 4.23Å; W361-K475 HydrophobicContact CE3-CB 4.44Å; W361-K475 HydrophobicContact CE3-CD 3.43Å; W361-K475 VanDerWaalsContact CE3-CD 3.43Å; W361-K475 HydrophobicContact CH2-CD 3.71Å; W361-K475 HydrophobicContact CZ2-CD 4.46Å; W361-K475 HydrophobicContact CZ3-CB 3.9Å; W361-K475 HydrophobicContact CZ3-CD 3.15Å; W361-K475 HydrophobicContact CZ3-CG 4.13Å; W361-Y521 HydrophobicContact CB-CE1 4.26Å; W361-Y521 AromaticContact CD1-CE1 3.58Å; W361-Y521 AromaticContact CD1-CZ 3.87Å; W361-Y521 AromaticContact CG-CE1 4Å; W361-Y521 HydrophobicContact CG-CE1 4Å; W361-L522 HydrophobicContact CB-CD2 3.95Å
362	L	91.2	Very high	89.2	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-57.2	-41.2	-179.8	-77.6	177.9	0	0	0	112.8	I331 I335 Y358 L359 W367 L522 V524	I331-L362 HydrophobicContact CG2-CD2 4.15Å; I335-L362 HydrophobicContact CD1-CB 4.31Å; I335-L362 HydrophobicContact CG1-CB 4.03Å; I335-L362 HydrophobicContact CG1-CD1 3.87Å; Y358-L362 HydrophobicContact CD1-CD1 4.12Å; Y358-L362 HydrophobicContact CD2-CD1 4.2Å; Y358-L362 HydrophobicContact CD2-CG 4.2Å; Y358-L362 HydrophobicContact CE1-CD1 3.54Å; Y358-L362 HydrophobicContact CE2-CD1 3.61Å; Y358-L362 HydrophobicContact CE2-CD2 4.23Å; Y358-L362 HydrophobicContact CE2-CG 3.73Å; Y358-L362 HydrophobicContact CG-CD1 4.42Å; Y358-L362 PolarHBondContact O-N 2.87Å; L359-L362 PolarHBondContact O-N 3.33Å; L362-W367 PolarHBondContact O-NE1 3.42Å; L362-L522 HydrophobicContact CD2-CD2 4.06Å; L362-L522 HydrophobicContact CG-CD2 4.37Å; L362-V524 HydrophobicContact CD2-CG2 4.03Å
363	T	90.4	Very high	89.2	Confident	2 Å²	2	45.8 Å²	45.8	1%	0.012	24%	0.237	C	C	.	.	H	α-helix	trans	-82	-14.3	-179.4	63.6	0	0	0	0	114.3	F318 L322 L359 W361	F318-T363 HydrophobicContact CB-CG2 3.84Å; F318-T363 WeakPolarHBondContact CD1-OG1 3.45Å; F318-T363 HydrophobicContact CG-CG2 4.3Å; L322-T363 HydrophobicContact CD1-CG2 3.96Å; L322-T363 HydrophobicContact CD2-CG2 3.95Å; L322-T363 HydrophobicContact CG-CG2 3.98Å; L359-T363 VanDerWaalsContact O-CB 3.28Å; L359-T363 WeakPolarHBondContact O-CB 3.49Å; L359-T363 WeakPolarHBondContact O-CG2 3.44Å; L359-T363 PolarHBondContact O-N 3.02Å; L359-T363 PolarHBondContact O-OG1 2.82Å; W361-T363 VanDerWaalsContact C-N 3.3Å; W361-T363 PolarHBondContact O-N 2.79Å
364	S	90.9	Very high	89.4	Confident	29 Å²	29	45.4 Å²	45.4	20%	0.203	23%	0.23	C	C	.	.	H	α-helix	trans	-90.3	-9.1	175.3	-61.7	0	0	0	0	113.2	R321 D360 W361	R321-S364 PolarHBondContact NH1-OG 2.75Å; D360-S364 WeakPolarHBondContact O-CB 3.34Å; D360-S364 PolarHBondContact O-N 2.91Å; D360-S364 VanDerWaalsContact O-N 3.09Å; D360-S364 PolarHBondContact O-OG 2.95Å; W361-S364 PolarHBondContact O-N 3.49Å; W361-S364 VanDerWaalsContact O-N 3.14Å
365	M	93.6	Very high	89.5	Confident	2 Å²	2	45.2 Å²	45.2	1%	0.01	23%	0.225	C	C	.	.	S	Bend	trans	-68.8	142.2	176.5	-73.3	-65.6	-76.1	0	0	110.5	L325 W361 W367 I471 L474 V526	L325-M365 WeakPolarHBondContact CD1-O 3.5Å; W361-M365 WeakPolarHBondContact O-CG 3.48Å; W361-M365 PolarHBondContact O-N 3.36Å; M365-W367 HydrophobicContact CB-CD2 4.01Å; M365-W367 HydrophobicContact CB-CG 4.4Å; M365-W367 HydrophobicContact CB-CH2 4.23Å; M365-W367 HydrophobicContact CB-CZ2 3.51Å; M365-W367 HydrophobicContact CE-CH2 4.1Å; M365-W367 HydrophobicContact CE-CZ2 4.43Å; M365-W367 HydrophobicContact CG-CH2 4.37Å; M365-W367 HydrophobicContact CG-CZ2 3.79Å; M365-W367 PolarHBondContact O-N 3.19Å; M365-I471 HydrophobicContact CE-CD1 3.82Å; M365-I471 HydrophobicContact CE-CG2 4.34Å; M365-I471 HydrophobicContact SD-CG2 3.74Å; M365-L474 HydrophobicContact CE-CB 3.82Å; M365-L474 HydrophobicContact CE-CD1 3.61Å; M365-L474 HydrophobicContact CE-CG 4.37Å; M365-L474 HydrophobicContact SD-CB 4.07Å; M365-V526 HydrophobicContact CE-CG1 4.38Å
366	P	92.7	Very high	89.6	Confident	7 Å²	7	48.1 Å²	48.1	5%	0.045	24%	0.239	C	C	.	.			trans	-82.7	50.7	-173.3	35.7	-37.7	0	0	0	112.7	G368 K369 L474 K478 E480	P366-G368 PolarHBondContact O-N 2.96Å; P366-K369 HydrophobicContact CB-CB 4.2Å; P366-K369 WeakPolarHBondContact O-CB 3.32Å; P366-K369 PolarHBondContact O-N 2.94Å; P366-L474 HydrophobicContact CG-CB 4.33Å; P366-K478 WeakPolarHBondContact CB-O 3.39Å; P366-E480 HydrophobicContact CG-CG 4.48Å; P366-E480 WeakPolarHBondContact O-CG 3.32Å
367	W	93.4	Very high	89.8	Confident	7 Å²	7	45.8 Å²	45.8	3%	0.027	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.1	120.4	-174.6	-54.4	116.7	0	0	0	112.8	L325 A326 V327 P328 I331 L362 M365 K369 E480 V526	L325-W367 HydrophobicContact CB-CB 4.27Å; L325-W367 VanDerWaalsContact CD2-O 3.31Å; L325-W367 WeakPolarHBondContact CD2-O 3.24Å; A326-W367 PolarHBondContact N-O 3.25Å; A326-W367 VanDerWaalsContact N-O 3.13Å; A326-W367 CarbonylContact O-C 3.53Å; V327-W367 HydrophobicContact CG1-CG 4.39Å; V327-W367 HydrophobicContact CG2-CB 4.18Å; V327-W367 HydrophobicContact CG2-CG 4.27Å; P328-W367 HydrophobicContact CG-CE3 4.47Å; I331-W367 HydrophobicContact CD1-CD2 4.27Å; I331-W367 HydrophobicContact CD1-CE3 3.89Å; I331-W367 HydrophobicContact CD1-CH2 3.24Å; I331-W367 HydrophobicContact CD1-CZ2 3.64Å; I331-W367 HydrophobicContact CD1-CZ3 3.36Å; I331-W367 HydrophobicContact CG2-CZ2 3.87Å; L362-W367 PolarHBondContact O-NE1 3.42Å; M365-W367 HydrophobicContact CB-CD2 4.01Å; M365-W367 HydrophobicContact CB-CG 4.4Å; M365-W367 HydrophobicContact CB-CH2 4.23Å; M365-W367 HydrophobicContact CB-CZ2 3.51Å; M365-W367 HydrophobicContact CE-CH2 4.1Å; M365-W367 HydrophobicContact CE-CZ2 4.43Å; M365-W367 HydrophobicContact CG-CH2 4.37Å; M365-W367 HydrophobicContact CG-CZ2 3.79Å; M365-W367 PolarHBondContact O-N 3.19Å; W367-K369 PolarHBondContact O-N 3.19Å; W367-E480 WeakPolarHBondContact CA-OE1 3.39Å; W367-V526 HydrophobicContact CH2-CG1 4.37Å; W367-V526 HydrophobicContact CH2-CG2 4.03Å; W367-V526 HydrophobicContact CZ3-CG1 4.19Å
368	G	87.3	Confident	90.1	Very high	38 Å²	38	47.8 Å²	47.8	39%	0.392	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	70.7	0.6	-178.2	0	0	0	0	0	115.7	P366 E480	P366-G368 PolarHBondContact O-N 2.96Å; G368-E480 PolarHBondContact N-OE1 3.27Å
369	K	90	Very high	90.2	Very high	94 Å²	94	51 Å²	51	41%	0.409	25%	0.254	S	S	.	.			trans	-90.2	122.4	177.8	-77.2	-176.7	175.8	162.3	0	111	D324 L325 P366 W367 C479 E480	D324-K369 VanDerWaalsContact O-CE 3.26Å; D324-K369 WeakPolarHBondContact O-CE 3.44Å; L325-K369 HydrophobicContact CD2-CD 3.46Å; L325-K369 VanDerWaalsContact CD2-CD 3.46Å; L325-K369 VanDerWaalsContact CD2-CE 3.45Å; L325-K369 HydrophobicContact CD2-CG 3.73Å; P366-K369 HydrophobicContact CB-CB 4.2Å; P366-K369 WeakPolarHBondContact O-CB 3.32Å; P366-K369 PolarHBondContact O-N 2.94Å; W367-K369 PolarHBondContact O-N 3.19Å; K369-C479 CarbonylContact O-C 3.47Å; K369-C479 WeakPolarHBondContact O-CA 3.2Å; K369-E480 PolarHBondContact O-N 2.86Å
370	Q	88.7	Confident	90.3	Very high	102 Å²	102	51 Å²	51	48%	0.477	25%	0.254	S	S	.	.			trans	-129.1	149.4	179.5	-65.4	172	24.3	0	0	110	E480 N481 K530	Q370-E480 HydrophobicContact CG-CB 4.3Å; Q370-N481 WeakPolarHBondContact CA-OD1 3.21Å; Q370-K530 VanDerWaalsContact NE2-CD 3.27Å; Q370-K530 VanDerWaalsContact NE2-CE 3.26Å
371	T	88.4	Confident	90.5	Very high	32 Å²	32	55.4 Å²	55.4	20%	0.196	27%	0.268	C	S	.	.	P	Polyproline II helix	trans	-82.6	142.1	168.3	48	0	0	0	0	110.2	E373 Q440 C479 N481	T371-E373 PolarHBondContact O-N 2.74Å; T371-Q440 HydrophobicContact CG2-CG 4.02Å; T371-C479 HydrophobicContact CG2-CB 4.14Å; T371-N481 PolarHBondContact N-OD1 3.44Å; T371-N481 PolarHBondContact O-ND2 3.15Å; T371-N481 PolarHBondContact OG1-OD1 2.75Å
372	E	86.8	Confident	90.6	Very high	171 Å²	171	60 Å²	60	80%	0.799	29%	0.289	S	S	*	.	P	Polyproline II helix	trans	-64.1	119.6	171.1	-70.5	-173.9	170.2	0	0	110.5	N438	E372-N438 PolarHBondContact O-ND2 2.91Å
373	E	86.2	Confident	90.6	Very high	66 Å²	66	61.5 Å²	61.5	31%	0.308	30%	0.297	S	S	.	.	P	Polyproline II helix	trans	-86.1	147.5	-178.2	-59.4	-172.7	72.4	0	0	111.7	T371 F375 L437 R439	T371-E373 PolarHBondContact O-N 2.74Å; E373-F375 HydrophobicContact CB-CD2 4.24Å; E373-F375 HydrophobicContact CB-CE2 3.52Å; E373-F375 HydrophobicContact CB-CZ 3.85Å; E373-F375 HydrophobicContact CG-CE2 4.44Å; E373-F375 HydrophobicContact CG-CZ 4.44Å; E373-F375 VanDerWaalsContact OE1-CZ 3.28Å; E373-F375 WeakPolarHBondContact OE1-CZ 3.29Å; E373-L437 WeakPolarHBondContact CA-O 3.35Å; E373-R439 HydrophobicContact CG-CG 4.44Å; E373-R439 IonicContact OE1-CZ 2.58Å; E373-R439 IonicContact OE1-NE 2.79Å; E373-R439 PolarHBondContact OE1-NE 2.8Å; E373-R439 IonicContact OE1-NH2 2.7Å; E373-R439 PolarHBondContact OE1-NH2 3.48Å; E373-R439 IonicContact OE2-NH2 2.81Å; E373-R439 PolarHBondContact OE2-NH2 2.91Å
374	N	87.3	Confident	90.8	Very high	51 Å²	51	61.4 Å²	61.4	27%	0.273	30%	0.296	S	S	.	.			trans	-119.4	110.7	178	-169.7	-28.4	0	0	0	111.1	D376 R379 L437 N438	N374-D376 WeakPolarHBondContact OD1-CB 3.17Å; N374-D376 PolarHBondContact OD1-N 2.86Å; N374-R379 VanDerWaalsContact CB-NH1 3.33Å; N374-R379 VanDerWaalsContact CG-NH1 3.28Å; N374-R379 WeakPolarHBondContact ND2-CD 3.22Å; N374-R379 PolarHBondContact ND2-NH1 3.26Å; N374-L437 PolarHBondContact N-O 3.44Å; N374-N438 HydrophobicContact CB-CB 4.2Å
375	F	85.8	Confident	90.8	Very high	55 Å²	55	63 Å²	63	24%	0.241	30%	0.302	C	S	.	.			trans	-103.6	32.1	178.2	-57.8	-80.8	0	0	0	112.6	E373 L377 I402 K406 L437	E373-F375 HydrophobicContact CB-CD2 4.24Å; E373-F375 HydrophobicContact CB-CE2 3.52Å; E373-F375 HydrophobicContact CB-CZ 3.85Å; E373-F375 HydrophobicContact CG-CE2 4.44Å; E373-F375 HydrophobicContact CG-CZ 4.44Å; E373-F375 VanDerWaalsContact OE1-CZ 3.28Å; E373-F375 WeakPolarHBondContact OE1-CZ 3.29Å; F375-L377 PolarHBondContact O-N 2.91Å; F375-I402 HydrophobicContact CD1-CG2 4.28Å; F375-K406 HydrophobicContact CB-CB 4.04Å; F375-K406 HydrophobicContact CB-CD 3.98Å; F375-K406 HydrophobicContact CB-CG 3.92Å; F375-K406 HydrophobicContact CD1-CB 4.45Å; F375-K406 HydrophobicContact CG-CB 4.36Å; F375-K406 PolarHBondContact O-NZ 2.93Å; F375-K406 VanDerWaalsContact O-NZ 3.12Å; F375-L437 HydrophobicContact CD1-CD2 3.99Å; F375-L437 HydrophobicContact CE1-CD2 4.14Å
376	D	90.2	Very high	90.6	Very high	70 Å²	70	66.1 Å²	66.1	37%	0.374	33%	0.329	S	S	.	.			trans	-77.8	110.7	171.2	-179.5	12.2	0	0	0	110.4	N374 E378 R379 A380	N374-D376 WeakPolarHBondContact OD1-CB 3.17Å; N374-D376 PolarHBondContact OD1-N 2.86Å; D376-E378 VanDerWaalsContact C-N 3.31Å; D376-E378 PolarHBondContact O-N 2.86Å; D376-E378 WeakPolarHBondContact OD1-CB 3.42Å; D376-E378 PolarHBondContact OD1-N 2.91Å; D376-R379 HydrophobicContact CB-CB 3.93Å; D376-R379 PolarHBondContact O-N 2.85Å; D376-R379 VanDerWaalsContact OD2-CB 3.32Å; D376-R379 WeakPolarHBondContact OD2-CB 3.34Å; D376-R379 PolarHBondContact OD2-N 2.97Å; D376-A380 WeakPolarHBondContact O-CB 3.34Å; D376-A380 PolarHBondContact O-N 2.69Å
377	L	91.2	Very high	90.5	Very high	66 Å²	66	68.9 Å²	68.9	35%	0.346	34%	0.343	S	S	.	.	H	α-helix	trans	-65.8	-33.8	-179.5	-63.3	177.4	0	0	0	112	F375 A380 R381 L399 I402 A403	F375-L377 PolarHBondContact O-N 2.91Å; L377-A380 PolarHBondContact O-N 2.67Å; L377-R381 WeakPolarHBondContact O-CB 3.46Å; L377-R381 PolarHBondContact O-N 2.93Å; L377-L399 HydrophobicContact CD2-CD2 4.49Å; L377-I402 HydrophobicContact CD2-CB 4.02Å; L377-I402 HydrophobicContact CD2-CG2 3.67Å; L377-A403 HydrophobicContact CD1-CB 4.15Å; L377-A403 HydrophobicContact CD2-CB 4.2Å
378	E	93.4	Very high	90.3	Very high	120 Å²	120	69.2 Å²	69.2	56%	0.561	35%	0.345	S	S	*	.	H	α-helix	trans	-67.2	-46.2	178.2	-77	-70.9	142.8	0	0	110.5	D376 R381 K382	D376-E378 VanDerWaalsContact C-N 3.31Å; D376-E378 PolarHBondContact O-N 2.86Å; D376-E378 WeakPolarHBondContact OD1-CB 3.42Å; D376-E378 PolarHBondContact OD1-N 2.91Å; E378-R381 PolarHBondContact O-N 3.37Å; E378-K382 WeakPolarHBondContact O-CG 3.43Å; E378-K382 PolarHBondContact O-N 3.37Å
379	R	93.1	Very high	90.2	Very high	74 Å²	74	71.5 Å²	71.5	28%	0.279	34%	0.342	S	S	.	.	H	α-helix	trans	-62.8	-44.7	173.5	178.7	176	173.6	-100.5	-7.8	111.8	N374 D376 R381 K382 I383 S435 A436	N374-R379 VanDerWaalsContact CB-NH1 3.33Å; N374-R379 VanDerWaalsContact CG-NH1 3.28Å; N374-R379 WeakPolarHBondContact ND2-CD 3.22Å; N374-R379 PolarHBondContact ND2-NH1 3.26Å; D376-R379 HydrophobicContact CB-CB 3.93Å; D376-R379 PolarHBondContact O-N 2.85Å; D376-R379 VanDerWaalsContact OD2-CB 3.32Å; D376-R379 WeakPolarHBondContact OD2-CB 3.34Å; D376-R379 PolarHBondContact OD2-N 2.97Å; R379-R381 VanDerWaalsContact C-N 3.33Å; R379-R381 PolarHBondContact O-N 3.46Å; R379-K382 PolarHBondContact O-N 3.04Å; R379-I383 HydrophobicContact CG-CD1 3.81Å; R379-I383 WeakPolarHBondContact O-CG1 3.28Å; R379-I383 PolarHBondContact O-N 3.21Å; R379-S435 PolarHBondContact NH2-O 3.43Å; R379-S435 VanDerWaalsContact NH2-O 3.15Å; R379-A436 PolarHBondContact NH1-O 2.93Å
380	A	92.2	Very high	89.9	Confident	1 Å²	1	67.6 Å²	67.6	1%	0.008	33%	0.328	C	S	.	.	H	α-helix	trans	-58.9	-46.4	178.9	0	0	0	0	0	111	D376 L377 K382 I383 L384 L399 I402 A436	D376-A380 WeakPolarHBondContact O-CB 3.34Å; D376-A380 PolarHBondContact O-N 2.69Å; L377-A380 PolarHBondContact O-N 2.67Å; A380-K382 PolarHBondContact O-N 3.37Å; A380-I383 PolarHBondContact O-N 3.19Å; A380-L384 WeakPolarHBondContact O-CB 3.38Å; A380-L384 VanDerWaalsContact O-CG 3.23Å; A380-L384 WeakPolarHBondContact O-CG 3.44Å; A380-L384 PolarHBondContact O-N 2.95Å; A380-L399 HydrophobicContact CB-CD2 3.87Å; A380-I402 HydrophobicContact CB-CD1 3.89Å; A380-A436 HydrophobicContact CB-CB 4.07Å
381	R	94.6	Very high	89.8	Confident	131 Å²	131	63.9 Å²	63.9	49%	0.494	31%	0.311	S	S	.	.	H	α-helix	trans	-59.1	-48.2	175.9	-174.2	171.3	-172.2	165.3	7.1	111.9	L377 E378 R379 I383 L384 D385 L399	L377-R381 WeakPolarHBondContact O-CB 3.46Å; L377-R381 PolarHBondContact O-N 2.93Å; E378-R381 PolarHBondContact O-N 3.37Å; R379-R381 VanDerWaalsContact C-N 3.33Å; R379-R381 PolarHBondContact O-N 3.46Å; R381-I383 VanDerWaalsContact C-N 3.32Å; R381-I383 PolarHBondContact O-N 3.1Å; R381-L384 PolarHBondContact O-N 2.88Å; R381-D385 WeakPolarHBondContact CG-OD2 3.43Å; R381-D385 IonicContact NE-OD2 3.26Å; R381-D385 WeakPolarHBondContact O-CB 3.43Å; R381-D385 PolarHBondContact O-N 3.42Å; R381-L399 HydrophobicContact CB-CD1 4.14Å; R381-L399 HydrophobicContact CB-CD2 4.28Å; R381-L399 HydrophobicContact CG-CD1 4.24Å
382	K	94.3	Very high	89.7	Confident	142 Å²	142	67.4 Å²	67.4	62%	0.617	33%	0.326	S	S	*	.	H	α-helix	trans	-57.2	-42.8	177.3	-75	173.9	-176	173.2	0	112.8	E378 R379 A380 A386	E378-K382 WeakPolarHBondContact O-CG 3.43Å; E378-K382 PolarHBondContact O-N 3.37Å; R379-K382 PolarHBondContact O-N 3.04Å; A380-K382 PolarHBondContact O-N 3.37Å; K382-A386 WeakPolarHBondContact O-CB 3.46Å; K382-A386 PolarHBondContact O-N 3.04Å
383	I	93.2	Very high	89.6	Confident	32 Å²	32	64.9 Å²	64.9	16%	0.164	32%	0.318	C	S	.	.	H	α-helix	trans	-68.3	-45.2	178.9	-70.2	167.1	0	0	0	110.7	R379 A380 R381 D385 A386 D387 A436	R379-I383 HydrophobicContact CG-CD1 3.81Å; R379-I383 WeakPolarHBondContact O-CG1 3.28Å; R379-I383 PolarHBondContact O-N 3.21Å; A380-I383 PolarHBondContact O-N 3.19Å; R381-I383 VanDerWaalsContact C-N 3.32Å; R381-I383 PolarHBondContact O-N 3.1Å; I383-D385 VanDerWaalsContact C-N 3.33Å; I383-D385 PolarHBondContact O-N 3.27Å; I383-A386 PolarHBondContact O-N 3.46Å; I383-D387 WeakPolarHBondContact O-CB 3.16Å; I383-D387 PolarHBondContact O-N 2.84Å; I383-A436 HydrophobicContact CB-CB 4.47Å; I383-A436 HydrophobicContact CD1-CB 4.38Å; I383-A436 HydrophobicContact CG2-CB 4.34Å
384	L	92.7	Very high	89.9	Confident	0 Å²	0	62.1 Å²	62.1	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-62.6	-40.8	178.9	-68.2	169.8	0	0	0	111.8	A380 R381 H388 K395 V398 L399 I429 I433	A380-L384 WeakPolarHBondContact O-CB 3.38Å; A380-L384 VanDerWaalsContact O-CG 3.23Å; A380-L384 WeakPolarHBondContact O-CG 3.44Å; A380-L384 PolarHBondContact O-N 2.95Å; R381-L384 PolarHBondContact O-N 2.88Å; L384-H388 WeakPolarHBondContact O-CB 3.15Å; L384-H388 PolarHBondContact O-N 3.12Å; L384-K395 HydrophobicContact CB-CD 4.41Å; L384-K395 HydrophobicContact CB-CG 4.23Å; L384-K395 WeakPolarHBondContact O-CE 3.49Å; L384-V398 HydrophobicContact CD1-CB 4.3Å; L384-V398 HydrophobicContact CD1-CG1 3.77Å; L384-V398 HydrophobicContact CD2-CG1 4.37Å; L384-L399 HydrophobicContact CD1-CD2 4.22Å; L384-L399 HydrophobicContact CD1-CG 4.32Å; L384-I429 HydrophobicContact CD2-CD1 3.75Å; L384-I433 HydrophobicContact CD2-CG1 4.39Å
385	D	91.6	Very high	90.1	Very high	61 Å²	61	60.1 Å²	60.1	33%	0.326	29%	0.294	S	S	.	.	H	α-helix	trans	-70.7	-37	176.4	-70.4	-26.4	0	0	0	112.5	R381 I383 D387 K395 Y571	R381-D385 WeakPolarHBondContact CG-OD2 3.43Å; R381-D385 IonicContact NE-OD2 3.26Å; R381-D385 WeakPolarHBondContact O-CB 3.43Å; R381-D385 PolarHBondContact O-N 3.42Å; I383-D385 VanDerWaalsContact C-N 3.33Å; I383-D385 PolarHBondContact O-N 3.27Å; D385-D387 VanDerWaalsContact C-N 3.33Å; D385-K395 WeakPolarHBondContact OD1-CD 3.37Å; D385-K395 WeakPolarHBondContact OD1-CE 3.4Å; D385-K395 IonicContact OD1-NZ 3.07Å; D385-K395 PolarHBondContact OD1-NZ 3.38Å; D385-Y571 PolarHBondContact O-OH 3.45Å
386	A	90	Very high	90.4	Very high	68 Å²	68	60.9 Å²	60.9	56%	0.562	30%	0.301	S	S	*	.	H	α-helix	trans	-69.9	-28.6	176.9	0	0	0	0	0	113.3	K382 I383 Y571	K382-A386 WeakPolarHBondContact O-CB 3.46Å; K382-A386 PolarHBondContact O-N 3.04Å; I383-A386 PolarHBondContact O-N 3.46Å; A386-Y571 WeakPolarHBondContact O-CE1 3.39Å
387	D	89.4	Confident	90.5	Very high	66 Å²	66	63.4 Å²	63.4	35%	0.353	31%	0.305	S	S	.	.	H	α-helix	trans	-95.7	-22.1	-177.7	-77.3	-7.4	0	0	0	113.8	I383 D385 S432 Y571	I383-D387 WeakPolarHBondContact O-CB 3.16Å; I383-D387 PolarHBondContact O-N 2.84Å; D385-D387 VanDerWaalsContact C-N 3.33Å; D387-S432 WeakPolarHBondContact CB-OG 3.49Å; D387-S432 VanDerWaalsContact OD2-CB 3.25Å; D387-S432 WeakPolarHBondContact OD2-CB 3.47Å; D387-S432 PolarHBondContact OD2-OG 3.35Å; D387-Y571 VanDerWaalsContact O-CD1 3.3Å; D387-Y571 WeakPolarHBondContact O-CD1 3.48Å; D387-Y571 WeakPolarHBondContact O-CE1 3.48Å
388	H	89.9	Confident	90.5	Very high	14 Å²	14	60.2 Å²	60.2	7%	0.065	29%	0.288	C	S	.	.			trans	-137.8	129.1	-174.1	-64.5	-67.1	0	0	0	113	L384 M391 K395 S428 I429 S432 Y571	L384-H388 WeakPolarHBondContact O-CB 3.15Å; L384-H388 PolarHBondContact O-N 3.12Å; H388-M391 HydrophobicContact CB-CE 3.41Å; H388-M391 VanDerWaalsContact CB-CE 3.41Å; H388-M391 WeakPolarHBondContact ND1-CE 3.4Å; H388-K395 WeakPolarHBondContact O-CE 3.48Å; H388-K395 PolarHBondContact O-NZ 3.39Å; H388-S428 PolarHBondContact CE1-OG 3.09Å; H388-I429 VanDerWaalsContact CD2-CD1 3.45Å; H388-I429 WeakPolarHBondContact CD2-CD1 3.35Å; H388-S432 PolarHBondContact CD2-OG 3.07Å; H388-S432 PolarHBondContact NE2-OG 3.41Å; H388-Y571 VanDerWaalsContact C-OH 3.28Å
389	Y	86.2	Confident	90.4	Very high	86 Å²	86	55.7 Å²	55.7	34%	0.337	27%	0.268	S	S	.	.	S	Bend	trans	-77.6	134.9	169.5	-169.5	-104.3	0	0	0	111.1	E563 R566 I567 Y571	Y389-E563 HydrophobicContact CD1-CB 4.42Å; Y389-E563 HydrophobicContact CD1-CG 4.43Å; Y389-E563 HydrophobicContact CE1-CB 4.34Å; Y389-E563 HydrophobicContact CE1-CG 4.06Å; Y389-R566 HydrophobicContact CD1-CB 4.05Å; Y389-R566 HydrophobicContact CD2-CB 4.08Å; Y389-R566 HydrophobicContact CE1-CB 3.8Å; Y389-R566 HydrophobicContact CE1-CG 4.14Å; Y389-R566 HydrophobicContact CE2-CB 3.85Å; Y389-R566 HydrophobicContact CE2-CG 4.18Å; Y389-R566 HydrophobicContact CG-CB 4.18Å; Y389-I567 HydrophobicContact CD1-CG1 4.2Å; Y389-I567 HydrophobicContact CG-CG1 4.27Å; Y389-Y571 PolarHBondContact N-OH 2.93Å
390	G	83.5	Confident	90.3	Very high	11 Å²	11	56.7 Å²	56.7	11%	0.113	28%	0.276	C	S	.	.	S	Bend	trans	61	-140.4	178.2	0	0	0	0	0	112.5	E392 K395	G390-E392 VanDerWaalsContact C-N 3.29Å; G390-E392 WeakPolarHBondContact CA-OE2 3.1Å; G390-E392 PolarHBondContact O-N 2.87Å; G390-K395 WeakPolarHBondContact O-CD 3.35Å; G390-K395 WeakPolarHBondContact O-CE 3.46Å; G390-K395 PolarHBondContact O-NZ 3.07Å
391	M	85.5	Confident	90.1	Very high	25 Å²	25	57.7 Å²	57.7	12%	0.123	28%	0.28	C	S	.	.			trans	59.2	36	-178.1	-57.2	-171.1	-76.2	0	0	113.4	H388 D393 V394 K395 V556 Y559	H388-M391 HydrophobicContact CB-CE 3.41Å; H388-M391 VanDerWaalsContact CB-CE 3.41Å; H388-M391 WeakPolarHBondContact ND1-CE 3.4Å; M391-D393 VanDerWaalsContact C-N 3.27Å; M391-D393 PolarHBondContact O-N 2.81Å; M391-V394 HydrophobicContact CB-CB 4.11Å; M391-V394 HydrophobicContact CB-CG2 4.21Å; M391-V394 WeakPolarHBondContact O-CB 3.47Å; M391-V394 PolarHBondContact O-N 2.77Å; M391-K395 WeakPolarHBondContact O-CG 3.39Å; M391-K395 PolarHBondContact O-N 2.68Å; M391-V556 HydrophobicContact SD-CG1 3.72Å; M391-Y559 WeakPolarHBondContact CE-OH 3.2Å; M391-Y559 HydrophobicContact CG-CE1 4.16Å; M391-Y559 HydrophobicContact SD-CE1 4.22Å; M391-Y559 PolarHBondContact SD-OH 2.9Å; M391-Y559 VanDerWaalsContact SD-OH 3.37Å
392	E	85.9	Confident	89.8	Confident	105 Å²	105	51.5 Å²	51.5	49%	0.491	26%	0.257	S	S	.	.	H	α-helix	trans	-51.9	-44.3	-178.6	-85.4	60.4	-150.2	0	0	112.2	G390 V394 K395 N396	G390-E392 VanDerWaalsContact C-N 3.29Å; G390-E392 WeakPolarHBondContact CA-OE2 3.1Å; G390-E392 PolarHBondContact O-N 2.87Å; E392-V394 PolarHBondContact O-N 3.46Å; E392-K395 PolarHBondContact O-N 3.14Å; E392-N396 VanDerWaalsContact O-CB 3.29Å; E392-N396 WeakPolarHBondContact O-CB 3.46Å; E392-N396 PolarHBondContact O-N 2.86Å; E392-N396 PolarHBondContact O-ND2 2.97Å; E392-N396 VanDerWaalsContact O-ND2 3.14Å
393	D	85.9	Confident	89.5	Confident	119 Å²	119	46.1 Å²	46.1	64%	0.636	24%	0.239	S	C	*	.	H	α-helix	trans	-60.1	-47.5	178.3	-58.5	-28	0	0	0	111.2	M391 K395 N396 R397	M391-D393 VanDerWaalsContact C-N 3.27Å; M391-D393 PolarHBondContact O-N 2.81Å; D393-K395 PolarHBondContact O-N 3.4Å; D393-N396 PolarHBondContact O-N 3.14Å; D393-R397 VanDerWaalsContact O-CG 3.31Å; D393-R397 WeakPolarHBondContact O-CG 3.35Å; D393-R397 PolarHBondContact O-N 3.37Å
394	V	91.5	Very high	89.1	Confident	7 Å²	7	48 Å²	48	4%	0.042	25%	0.252	C	S	.	.	H	α-helix	trans	-63.2	-45.2	178.7	-176.5	0	0	0	0	110.6	M391 E392 R397 V398 F418 I429 I554 V556	M391-V394 HydrophobicContact CB-CB 4.11Å; M391-V394 HydrophobicContact CB-CG2 4.21Å; M391-V394 WeakPolarHBondContact O-CB 3.47Å; M391-V394 PolarHBondContact O-N 2.77Å; E392-V394 PolarHBondContact O-N 3.46Å; V394-R397 PolarHBondContact O-N 3.42Å; V394-V398 VanDerWaalsContact O-CG2 3.31Å; V394-V398 WeakPolarHBondContact O-CG2 3.39Å; V394-V398 PolarHBondContact O-N 3.15Å; V394-F418 HydrophobicContact CG1-CD1 4.01Å; V394-F418 HydrophobicContact CG1-CE1 3.64Å; V394-I429 HydrophobicContact CG1-CG1 4.36Å; V394-I554 HydrophobicContact CB-CG2 4.37Å; V394-I554 HydrophobicContact CG1-CG2 4.06Å; V394-I554 HydrophobicContact CG2-CG2 4.18Å; V394-V556 HydrophobicContact CG1-CG2 4.43Å; V394-V556 HydrophobicContact CG2-CG2 4.15Å
395	K	92.8	Very high	88.6	Confident	10 Å²	10	48.5 Å²	48.5	4%	0.043	26%	0.255	C	S	.	.	H	α-helix	trans	-63.7	-42.7	179	-70.3	174.9	176.9	170.9	0	111.5	L384 D385 H388 G390 M391 E392 D393 V398 L399	L384-K395 HydrophobicContact CB-CD 4.41Å; L384-K395 HydrophobicContact CB-CG 4.23Å; L384-K395 WeakPolarHBondContact O-CE 3.49Å; D385-K395 WeakPolarHBondContact OD1-CD 3.37Å; D385-K395 WeakPolarHBondContact OD1-CE 3.4Å; D385-K395 IonicContact OD1-NZ 3.07Å; D385-K395 PolarHBondContact OD1-NZ 3.38Å; H388-K395 WeakPolarHBondContact O-CE 3.48Å; H388-K395 PolarHBondContact O-NZ 3.39Å; G390-K395 WeakPolarHBondContact O-CD 3.35Å; G390-K395 WeakPolarHBondContact O-CE 3.46Å; G390-K395 PolarHBondContact O-NZ 3.07Å; M391-K395 WeakPolarHBondContact O-CG 3.39Å; M391-K395 PolarHBondContact O-N 2.68Å; E392-K395 PolarHBondContact O-N 3.14Å; D393-K395 PolarHBondContact O-N 3.4Å; K395-V398 PolarHBondContact O-N 3.34Å; K395-L399 VanDerWaalsContact O-CG 3.32Å; K395-L399 WeakPolarHBondContact O-CG 3.47Å; K395-L399 PolarHBondContact O-N 3.48Å
396	N	92.1	Very high	88.1	Confident	70 Å²	70	51.2 Å²	51.2	37%	0.374	26%	0.264	S	S	.	.	H	α-helix	trans	-61.7	-44.4	176.7	-71	-25	0	0	0	110.8	E392 D393 V398 L399 E400	E392-N396 VanDerWaalsContact O-CB 3.29Å; E392-N396 WeakPolarHBondContact O-CB 3.46Å; E392-N396 PolarHBondContact O-N 2.86Å; E392-N396 PolarHBondContact O-ND2 2.97Å; E392-N396 VanDerWaalsContact O-ND2 3.14Å; D393-N396 PolarHBondContact O-N 3.14Å; N396-V398 VanDerWaalsContact C-N 3.34Å; N396-V398 PolarHBondContact O-N 3.4Å; N396-L399 PolarHBondContact O-N 3.09Å; N396-L399 VanDerWaalsContact O-N 3.17Å; N396-E400 WeakPolarHBondContact O-CG 3.44Å; N396-E400 PolarHBondContact O-N 3.06Å
397	R	91	Very high	87.7	Confident	123 Å²	123	55.3 Å²	55.3	46%	0.464	28%	0.276	S	S	.	.	H	α-helix	trans	-60.6	-41.4	174.2	-66.7	-53.2	-176.4	178.3	3.1	113.1	D393 V394 L399 E400 F401 I554	D393-R397 VanDerWaalsContact O-CG 3.31Å; D393-R397 WeakPolarHBondContact O-CG 3.35Å; D393-R397 PolarHBondContact O-N 3.37Å; V394-R397 PolarHBondContact O-N 3.42Å; R397-L399 VanDerWaalsContact C-N 3.35Å; R397-E400 VanDerWaalsContact CD-OE2 3.32Å; R397-E400 WeakPolarHBondContact CD-OE2 3.43Å; R397-E400 IonicContact CZ-OE2 2.77Å; R397-E400 IonicContact NE-OE2 3.99Å; R397-E400 IonicContact NH1-OE1 3.21Å; R397-E400 IonicContact NH1-OE2 3.27Å; R397-E400 PolarHBondContact NH1-OE2 3.26Å; R397-E400 PolarHBondContact O-N 3.35Å; R397-F401 WeakPolarHBondContact O-CB 3.29Å; R397-F401 PolarHBondContact O-N 2.93Å; R397-I554 HydrophobicContact CB-CD1 3.81Å; R397-I554 HydrophobicContact CB-CG1 4.37Å
398	V	91.7	Very high	87	Confident	0 Å²	0	58.4 Å²	58.4	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-62.9	-42.7	174.8	170.1	0	0	0	0	111	L384 V394 K395 N396 F401 I402 F418 I433	L384-V398 HydrophobicContact CD1-CB 4.3Å; L384-V398 HydrophobicContact CD1-CG1 3.77Å; L384-V398 HydrophobicContact CD2-CG1 4.37Å; V394-V398 VanDerWaalsContact O-CG2 3.31Å; V394-V398 WeakPolarHBondContact O-CG2 3.39Å; V394-V398 PolarHBondContact O-N 3.15Å; K395-V398 PolarHBondContact O-N 3.34Å; N396-V398 VanDerWaalsContact C-N 3.34Å; N396-V398 PolarHBondContact O-N 3.4Å; V398-F401 WeakPolarHBondContact O-CB 3.49Å; V398-F401 PolarHBondContact O-N 3.02Å; V398-I402 HydrophobicContact CG1-CD1 3.97Å; V398-I402 VanDerWaalsContact O-CG1 3.25Å; V398-I402 WeakPolarHBondContact O-CG1 3.29Å; V398-I402 PolarHBondContact O-N 2.66Å; V398-F418 HydrophobicContact CG2-CE1 4.15Å; V398-F418 HydrophobicContact CG2-CZ 3.83Å; V398-I433 HydrophobicContact CG1-CD1 3.89Å; V398-I433 HydrophobicContact CG1-CG1 3.65Å; V398-I433 HydrophobicContact CG2-CD1 3.75Å; V398-I433 HydrophobicContact CG2-CG1 4.34Å
399	L	92.1	Very high	85.8	Confident	25 Å²	25	60.7 Å²	60.7	13%	0.131	31%	0.313	C	S	.	.	H	α-helix	trans	-66.4	-39.7	177.2	-69.2	172.1	0	0	0	112.1	L377 A380 R381 L384 K395 N396 R397 F401 I402 A403	L377-L399 HydrophobicContact CD2-CD2 4.49Å; A380-L399 HydrophobicContact CB-CD2 3.87Å; R381-L399 HydrophobicContact CB-CD1 4.14Å; R381-L399 HydrophobicContact CB-CD2 4.28Å; R381-L399 HydrophobicContact CG-CD1 4.24Å; L384-L399 HydrophobicContact CD1-CD2 4.22Å; L384-L399 HydrophobicContact CD1-CG 4.32Å; K395-L399 VanDerWaalsContact O-CG 3.32Å; K395-L399 WeakPolarHBondContact O-CG 3.47Å; K395-L399 PolarHBondContact O-N 3.48Å; N396-L399 PolarHBondContact O-N 3.09Å; N396-L399 VanDerWaalsContact O-N 3.17Å; R397-L399 VanDerWaalsContact C-N 3.35Å; L399-F401 VanDerWaalsContact C-N 3.34Å; L399-I402 PolarHBondContact O-N 3.07Å; L399-A403 WeakPolarHBondContact O-CB 3.5Å; L399-A403 PolarHBondContact O-N 3.19Å
400	E	90.3	Very high	84.8	Confident	95 Å²	95	61.5 Å²	61.5	44%	0.444	32%	0.323	S	S	.	.	H	α-helix	trans	-57.6	-47.2	171.6	-74.3	170.8	-171.4	0	0	110.6	N396 R397 I402 A403 V404	N396-E400 WeakPolarHBondContact O-CG 3.44Å; N396-E400 PolarHBondContact O-N 3.06Å; R397-E400 VanDerWaalsContact CD-OE2 3.32Å; R397-E400 WeakPolarHBondContact CD-OE2 3.43Å; R397-E400 IonicContact CZ-OE2 2.77Å; R397-E400 IonicContact NE-OE2 3.99Å; R397-E400 IonicContact NH1-OE1 3.21Å; R397-E400 IonicContact NH1-OE2 3.27Å; R397-E400 PolarHBondContact NH1-OE2 3.26Å; R397-E400 PolarHBondContact O-N 3.35Å; E400-I402 PolarHBondContact O-N 3.16Å; E400-A403 PolarHBondContact O-N 3.15Å; E400-V404 WeakPolarHBondContact O-CG2 2.87Å; E400-V404 PolarHBondContact O-N 3.3Å
401	F	88.1	Confident	83.6	Confident	22 Å²	22	62.5 Å²	62.5	10%	0.096	33%	0.327	C	S	.	.	H	α-helix	trans	-59.6	-44.7	176.4	176.5	-93.1	0	0	0	112.5	R397 V398 L399 A403 V404 S405 V411 L416 L532	R397-F401 WeakPolarHBondContact O-CB 3.29Å; R397-F401 PolarHBondContact O-N 2.93Å; V398-F401 WeakPolarHBondContact O-CB 3.49Å; V398-F401 PolarHBondContact O-N 3.02Å; L399-F401 VanDerWaalsContact C-N 3.34Å; F401-A403 VanDerWaalsContact C-N 3.34Å; F401-A403 PolarHBondContact O-N 3.39Å; F401-V404 PolarHBondContact O-N 2.82Å; F401-S405 WeakPolarHBondContact O-CB 3.36Å; F401-S405 PolarHBondContact O-N 3.18Å; F401-S405 PolarHBondContact O-OG 3.42Å; F401-V411 HydrophobicContact CZ-CG1 4.25Å; F401-L416 HydrophobicContact CB-CD1 4.16Å; F401-L416 HydrophobicContact CB-CD2 4.34Å; F401-L416 HydrophobicContact CD1-CD1 3.88Å; F401-L416 HydrophobicContact CD1-CG 4.5Å; F401-L416 HydrophobicContact CD2-CD1 4.06Å; F401-L416 HydrophobicContact CD2-CD2 3.68Å; F401-L416 HydrophobicContact CD2-CG 3.87Å; F401-L416 HydrophobicContact CE1-CD1 4.31Å; F401-L416 HydrophobicContact CE2-CD1 4.46Å; F401-L416 HydrophobicContact CE2-CD2 4.24Å; F401-L416 HydrophobicContact CE2-CG 4.07Å; F401-L416 HydrophobicContact CG-CD1 3.75Å; F401-L416 HydrophobicContact CG-CD2 4.08Å; F401-L416 HydrophobicContact CG-CG 4.1Å; F401-L416 HydrophobicContact CZ-CG 4.48Å; F401-L532 HydrophobicContact CE1-CD1 3.84Å; F401-L532 HydrophobicContact CE1-CD2 4.22Å; F401-L532 HydrophobicContact CZ-CD1 3.56Å
402	I	88.2	Confident	82.2	Confident	1 Å²	1	66.1 Å²	66.1	1%	0.005	34%	0.344	C	S	.	.	H	α-helix	trans	-64.2	-40.8	177	-64.9	170.5	0	0	0	110.4	F375 L377 A380 V398 L399 E400 S405 K406 L437	F375-I402 HydrophobicContact CD1-CG2 4.28Å; L377-I402 HydrophobicContact CD2-CB 4.02Å; L377-I402 HydrophobicContact CD2-CG2 3.67Å; A380-I402 HydrophobicContact CB-CD1 3.89Å; V398-I402 HydrophobicContact CG1-CD1 3.97Å; V398-I402 VanDerWaalsContact O-CG1 3.25Å; V398-I402 WeakPolarHBondContact O-CG1 3.29Å; V398-I402 PolarHBondContact O-N 2.66Å; L399-I402 PolarHBondContact O-N 3.07Å; E400-I402 PolarHBondContact O-N 3.16Å; I402-S405 PolarHBondContact O-N 3.01Å; I402-K406 WeakPolarHBondContact O-CB 3.49Å; I402-K406 PolarHBondContact O-N 3.02Å; I402-L437 HydrophobicContact CD1-CD2 4.22Å; I402-L437 HydrophobicContact CG1-CD2 4.04Å; I402-L437 HydrophobicContact CG2-CD2 4.02Å
403	A	87.6	Confident	81.1	Confident	29 Å²	29	62.8 Å²	62.8	24%	0.24	34%	0.337	C	S	.	.	H	α-helix	trans	-64.4	-44.3	178.2	0	0	0	0	0	111.9	L377 L399 E400 F401 S405 K406 L407	L377-A403 HydrophobicContact CD1-CB 4.15Å; L377-A403 HydrophobicContact CD2-CB 4.2Å; L399-A403 WeakPolarHBondContact O-CB 3.5Å; L399-A403 PolarHBondContact O-N 3.19Å; E400-A403 PolarHBondContact O-N 3.15Å; F401-A403 VanDerWaalsContact C-N 3.34Å; F401-A403 PolarHBondContact O-N 3.39Å; A403-S405 VanDerWaalsContact C-N 3.34Å; A403-S405 PolarHBondContact O-N 3.13Å; A403-K406 WeakPolarHBondContact O-CB 3.46Å; A403-K406 PolarHBondContact O-N 2.91Å; A403-L407 WeakPolarHBondContact O-CG 3.44Å; A403-L407 PolarHBondContact O-N 2.77Å; A403-L407 VanDerWaalsContact O-N 3.15Å
404	V	84.7	Confident	80.5	Confident	72 Å²	72	63 Å²	63	44%	0.436	33%	0.332	S	S	.	.	H	α-helix	trans	-63	-42.4	175.3	173.2	0	0	0	0	110.8	E400 F401 K406 L407 K408	E400-V404 WeakPolarHBondContact O-CG2 2.87Å; E400-V404 PolarHBondContact O-N 3.3Å; F401-V404 PolarHBondContact O-N 2.82Å; V404-K406 VanDerWaalsContact C-N 3.34Å; V404-K406 PolarHBondContact O-N 3.01Å; V404-L407 PolarHBondContact O-N 3.22Å; V404-K408 HydrophobicContact CG1-CD 4.05Å; V404-K408 HydrophobicContact CG1-CG 4.34Å; V404-K408 PolarHBondContact O-N 2.97Å
405	S	82	Confident	80.3	Confident	10 Å²	10	63.4 Å²	63.4	7%	0.07	33%	0.334	C	S	.	.	H	α-helix	trans	-61.9	-41.7	177.8	-60	0	0	0	0	111.8	F401 I402 A403 L407 K408 G409	F401-S405 WeakPolarHBondContact O-CB 3.36Å; F401-S405 PolarHBondContact O-N 3.18Å; F401-S405 PolarHBondContact O-OG 3.42Å; I402-S405 PolarHBondContact O-N 3.01Å; A403-S405 VanDerWaalsContact C-N 3.34Å; A403-S405 PolarHBondContact O-N 3.13Å; S405-L407 VanDerWaalsContact C-N 3.32Å; S405-L407 PolarHBondContact O-N 3.14Å; S405-K408 PolarHBondContact O-N 3.09Å; S405-G409 PolarHBondContact O-N 2.98Å
406	K	82	Confident	80.2	Confident	117 Å²	117	63 Å²	63	51%	0.509	33%	0.332	S	S	.	.	H	α-helix	trans	-60.6	-39.1	175.4	-173.6	178.9	-172.1	163	0	112.6	F375 I402 A403 V404	F375-K406 HydrophobicContact CB-CB 4.04Å; F375-K406 HydrophobicContact CB-CD 3.98Å; F375-K406 HydrophobicContact CB-CG 3.92Å; F375-K406 HydrophobicContact CD1-CB 4.45Å; F375-K406 HydrophobicContact CG-CB 4.36Å; F375-K406 PolarHBondContact O-NZ 2.93Å; F375-K406 VanDerWaalsContact O-NZ 3.12Å; I402-K406 WeakPolarHBondContact O-CB 3.49Å; I402-K406 PolarHBondContact O-N 3.02Å; A403-K406 WeakPolarHBondContact O-CB 3.46Å; A403-K406 PolarHBondContact O-N 2.91Å; V404-K406 VanDerWaalsContact C-N 3.34Å; V404-K406 PolarHBondContact O-N 3.01Å
407	L	82.4	Confident	80.3	Confident	155 Å²	155	59.6 Å²	59.6	81%	0.812	32%	0.315	S	S	*	.	H	α-helix	trans	-76.2	-39	-179.4	-69.3	174.5	0	0	0	112.7	A403 V404 S405 G409	A403-L407 WeakPolarHBondContact O-CG 3.44Å; A403-L407 PolarHBondContact O-N 2.77Å; A403-L407 VanDerWaalsContact O-N 3.15Å; V404-L407 PolarHBondContact O-N 3.22Å; S405-L407 VanDerWaalsContact C-N 3.32Å; S405-L407 PolarHBondContact O-N 3.14Å; L407-G409 VanDerWaalsContact C-N 3.35Å
408	K	73.8	Confident	80.6	Confident	131 Å²	131	53.8 Å²	53.8	57%	0.57	29%	0.292	S	S	*	.	H	α-helix	trans	-76.1	-23	179.7	-73.9	-172.5	174.9	-174.6	0	113.1	V404 S405 N410 Q412	V404-K408 HydrophobicContact CG1-CD 4.05Å; V404-K408 HydrophobicContact CG1-CG 4.34Å; V404-K408 PolarHBondContact O-N 2.97Å; S405-K408 PolarHBondContact O-N 3.09Å; K408-N410 PolarHBondContact O-N 2.8Å; K408-Q412 PolarHBondContact NZ-O 2.99Å
409	G	65.7	Low	80.6	Confident	61 Å²	61	56.4 Å²	56.4	63%	0.629	30%	0.303	S	S	*	.	S	Bend	trans	72.1	-17.1	-175.5	0	0	0	0	0	114.4	S405 L407	S405-G409 PolarHBondContact O-N 2.98Å; L407-G409 VanDerWaalsContact C-N 3.35Å
410	N	63.6	Low	80.4	Confident	103 Å²	103	55.6 Å²	55.6	55%	0.551	30%	0.3	S	S	*	.	S	Bend	trans	-122.9	149.6	173.6	-74.2	-15.4	0	0	0	110.4	K408 Q412	K408-N410 PolarHBondContact O-N 2.8Å; N410-Q412 HydrophobicContact CB-CG 4.44Å; N410-Q412 PolarHBondContact O-N 2.84Å
411	V	60	Low	80.1	Confident	33 Å²	33	52.1 Å²	52.1	20%	0.2	29%	0.286	C	S	.	.			trans	-74.2	14.1	176.2	-119.2	0	0	0	0	113.7	F401 G413 L532	F401-V411 HydrophobicContact CZ-CG1 4.25Å; V411-G413 PolarHBondContact O-N 3.32Å; V411-L532 HydrophobicContact CG1-CB 4.41Å; V411-L532 HydrophobicContact CG1-CD1 3.85Å
412	Q	54.9	Low	80.1	Confident	101 Å²	101	53.4 Å²	53.4	47%	0.472	30%	0.297	S	S	.	.			trans	-70.1	102.5	-179.9	-75.9	-178.5	-29.5	0	0	111	K408 N410	K408-Q412 PolarHBondContact NZ-O 2.99Å; N410-Q412 HydrophobicContact CB-CG 4.44Å; N410-Q412 PolarHBondContact O-N 2.84Å
413	G	63	Low	80	Confident	35 Å²	35	54.5 Å²	54.5	36%	0.361	31%	0.308	S	S	.	.	S	Bend	trans	-170.9	-175.5	180	0	0	0	0	0	111.5	V411	V411-G413 PolarHBondContact O-N 3.32Å
414	K	73.6	Confident	80.1	Confident	122 Å²	122	53.1 Å²	53.1	53%	0.53	30%	0.297	S	S	.	.	P	Polyproline II helix	trans	-63.8	145.7	171.7	-68.7	-171.1	175.7	-166.1	0	110	R550 E552	K414-R550 WeakPolarHBondContact CA-O 3.47Å; K414-E552 HydrophobicContact CB-CB 3.94Å; K414-E552 HydrophobicContact CD-CB 4.44Å
415	I	86.1	Confident	80.3	Confident	17 Å²	17	50.4 Å²	50.4	9%	0.087	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	131.2	179.1	-71.1	145.8	0	0	0	109.5	C417 L509 F533 R550 M551 E552	I415-C417 PolarHBondContact O-N 2.94Å; I415-L509 HydrophobicContact CD1-CB 3.38Å; I415-L509 HydrophobicContact CD1-CD1 4.23Å; I415-L509 HydrophobicContact CD1-CD2 3.49Å; I415-L509 VanDerWaalsContact CD1-CD2 3.49Å; I415-L509 HydrophobicContact CD1-CG 3.83Å; I415-L509 WeakPolarHBondContact CD1-O 3.48Å; I415-L509 HydrophobicContact CG1-CD2 4.26Å; I415-L509 HydrophobicContact CG2-CD2 4.49Å; I415-F533 HydrophobicContact CG1-CB 4.41Å; I415-F533 HydrophobicContact CG2-CB 4.27Å; I415-R550 PolarHBondContact N-O 3.24Å; I415-R550 VanDerWaalsContact N-O 3.09Å; I415-M551 HydrophobicContact CB-CG 4.38Å; I415-M551 HydrophobicContact CG2-CG 4.44Å; I415-M551 CarbonylContact O-C 3.58Å; I415-M551 VanDerWaalsContact O-CA 3.23Å; I415-M551 WeakPolarHBondContact O-CA 3.34Å; I415-E552 PolarHBondContact O-N 3.02Å
416	L	91.9	Very high	80.8	Confident	0 Å²	0	50.4 Å²	50.4	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	125.7	176	-60.3	-173.7	0	0	0	110.3	F401 F418 I534 C535 E552 I554	F401-L416 HydrophobicContact CB-CD1 4.16Å; F401-L416 HydrophobicContact CB-CD2 4.34Å; F401-L416 HydrophobicContact CD1-CD1 3.88Å; F401-L416 HydrophobicContact CD1-CG 4.5Å; F401-L416 HydrophobicContact CD2-CD1 4.06Å; F401-L416 HydrophobicContact CD2-CD2 3.68Å; F401-L416 HydrophobicContact CD2-CG 3.87Å; F401-L416 HydrophobicContact CE1-CD1 4.31Å; F401-L416 HydrophobicContact CE2-CD1 4.46Å; F401-L416 HydrophobicContact CE2-CD2 4.24Å; F401-L416 HydrophobicContact CE2-CG 4.07Å; F401-L416 HydrophobicContact CG-CD1 3.75Å; F401-L416 HydrophobicContact CG-CD2 4.08Å; F401-L416 HydrophobicContact CG-CG 4.1Å; F401-L416 HydrophobicContact CZ-CG 4.48Å; L416-F418 HydrophobicContact CB-CE2 4.44Å; L416-F418 HydrophobicContact CD1-CZ 4.35Å; L416-I534 WeakPolarHBondContact O-CA 3.18Å; L416-C535 PolarHBondContact O-N 3.46Å; L416-E552 HydrophobicContact CD2-CB 4.24Å; L416-I554 HydrophobicContact CD2-CD1 3.9Å
417	C	94.8	Very high	81.2	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	107.5	173	-178.6	0	0	0	0	110.4	I415 C535 M551 E552 M553 I554	I415-C417 PolarHBondContact O-N 2.94Å; C417-C535 WeakPolarHBondContact CA-O 3.5Å; C417-C535 HydrophobicContact CB-CB 4.07Å; C417-M551 HydrophobicContact CB-CB 3.82Å; C417-M551 HydrophobicContact CB-CG 4.06Å; C417-M551 HydrophobicContact CB-SD 3.76Å; C417-E552 PolarHBondContact N-O 3.04Å; C417-M553 HydrophobicContact CB-CE 4.33Å; C417-M553 HydrophobicContact CB-SD 3.64Å; C417-I554 PolarHBondContact O-N 2.94Å
418	F	96.1	Very high	81.6	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	119.5	174.3	-61.7	-72.3	0	0	0	109.6	V394 V398 L416 K426 I429 I433 I534 C535 T536 A537 I554 V556	V394-F418 HydrophobicContact CG1-CD1 4.01Å; V394-F418 HydrophobicContact CG1-CE1 3.64Å; V398-F418 HydrophobicContact CG2-CE1 4.15Å; V398-F418 HydrophobicContact CG2-CZ 3.83Å; L416-F418 HydrophobicContact CB-CE2 4.44Å; L416-F418 HydrophobicContact CD1-CZ 4.35Å; F418-K426 HydrophobicContact CB-CB 4.06Å; F418-K426 HydrophobicContact CB-CG 4.29Å; F418-K426 WeakPolarHBondContact O-CD 3.45Å; F418-I429 HydrophobicContact CD1-CG2 4.09Å; F418-I429 HydrophobicContact CD2-CG2 3.78Å; F418-I429 HydrophobicContact CE1-CG2 4.11Å; F418-I429 HydrophobicContact CE2-CG2 3.79Å; F418-I429 HydrophobicContact CG-CG2 3.93Å; F418-I429 HydrophobicContact CZ-CG1 4.45Å; F418-I429 HydrophobicContact CZ-CG2 3.97Å; F418-I433 HydrophobicContact CE2-CD1 3.94Å; F418-I433 HydrophobicContact CZ-CD1 3.78Å; F418-I534 HydrophobicContact CD2-CG2 3.64Å; F418-I534 HydrophobicContact CE2-CD1 4.42Å; F418-I534 HydrophobicContact CE2-CG2 3.57Å; F418-C535 PolarHBondContact N-O 2.84Å; F418-T536 CarbonylContact O-C 3.59Å; F418-T536 VanDerWaalsContact O-CA 3.27Å; F418-T536 WeakPolarHBondContact O-CA 3.38Å; F418-A537 PolarHBondContact O-N 3.43Å; F418-I554 WeakPolarHBondContact CA-O 3.5Å; F418-I554 HydrophobicContact CD1-CB 3.9Å; F418-I554 HydrophobicContact CD1-CD1 4.45Å; F418-I554 HydrophobicContact CD1-CG2 3.96Å; F418-I554 HydrophobicContact CE1-CB 4.09Å; F418-I554 HydrophobicContact CE1-CD1 3.82Å; F418-I554 HydrophobicContact CE1-CG2 4.01Å; F418-I554 HydrophobicContact CZ-CD1 4.35Å; F418-V556 HydrophobicContact CB-CG2 4.08Å; F418-V556 HydrophobicContact CD1-CG2 3.99Å; F418-V556 HydrophobicContact CG-CG2 4.46Å
419	Y	92.9	Very high	82.6	Confident	56 Å²	56	35.7 Å²	35.7	22%	0.22	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	157.5	178.9	76.5	-82.7	0	0	0	112.3	A537 T540 M553 I554 E555 V556	Y419-A537 VanDerWaalsContact CA-O 3.25Å; Y419-A537 WeakPolarHBondContact CA-O 3.41Å; Y419-T540 HydrophobicContact CD1-CG2 4.38Å; Y419-T540 HydrophobicContact CD2-CG2 3.41Å; Y419-T540 VanDerWaalsContact CD2-CG2 3.41Å; Y419-T540 HydrophobicContact CE2-CG2 3.71Å; Y419-T540 HydrophobicContact CG-CG2 3.75Å; Y419-M553 HydrophobicContact CD1-CB 3.98Å; Y419-M553 HydrophobicContact CD1-CE 3.75Å; Y419-M553 HydrophobicContact CE1-CB 3.66Å; Y419-M553 HydrophobicContact CE1-CE 4.37Å; Y419-M553 HydrophobicContact CG-CE 4.06Å; Y419-I554 VanDerWaalsContact CD1-C 3.48Å; Y419-I554 VanDerWaalsContact CD1-O 3.3Å; Y419-I554 WeakPolarHBondContact CD1-O 3.44Å; Y419-I554 VanDerWaalsContact CE1-C 3.46Å; Y419-I554 PolarHBondContact N-O 2.88Å; Y419-E555 HydrophobicContact CD2-CG 4.37Å; Y419-E555 HydrophobicContact CE1-CB 3.79Å; Y419-E555 HydrophobicContact CE1-CG 4.47Å; Y419-E555 VanDerWaalsContact CE1-N 3.29Å; Y419-E555 HydrophobicContact CE2-CB 3.99Å; Y419-E555 HydrophobicContact CE2-CG 3.78Å; Y419-E555 CarbonylContact O-C 3.58Å; Y419-V556 PolarHBondContact O-N 2.8Å
420	G	87.2	Confident	83.9	Confident	7 Å²	7	32.8 Å²	32.8	7%	0.072	19%	0.192	C	C	.	.	S	Bend	trans	143	-173.2	178.3	0	0	0	0	0	113.1	K426 A537 N538	G420-K426 PolarHBondContact O-NZ 2.97Å; G420-A537 PolarHBondContact N-O 2.89Å; G420-N538 WeakPolarHBondContact O-CA 3.3Å
421	P	84.2	Confident	85.3	Confident	22 Å²	22	34 Å²	34	14%	0.143	19%	0.192	C	C	.	.	S	Bend	trans	-58.9	158.7	-175.4	-24.2	34	0	0	0	113.9	V424 K426 V556 S605	P421-V424 HydrophobicContact CB-CG1 4.02Å; P421-V424 WeakPolarHBondContact O-CG2 3.38Å; P421-K426 PolarHBondContact O-NZ 3.13Å; P421-V556 WeakPolarHBondContact CD-O 3.2Å; P421-S605 WeakPolarHBondContact CB-OG 3.5Å
422	P	86.6	Confident	86.9	Confident	50 Å²	50	32.6 Å²	32.6	33%	0.325	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.1	142.8	177.8	27.1	-34	0	0	0	111.8
423	G	87.8	Confident	88.7	Confident	24 Å²	24	27.8 Å²	27.8	25%	0.247	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	80.3	13.5	173.9	0	0	0	0	0	115.9	G606 V607	G423-G606 VanDerWaalsContact O-CA 3.3Å; G423-G606 WeakPolarHBondContact O-CA 3.36Å; G423-V607 PolarHBondContact O-N 3.27Å
424	V	88.8	Confident	90.2	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	15%	0.146	C	C	.	.	S	Bend	trans	-91.1	11.6	178.5	-56.8	0	0	0	0	114	P421 K426 V556 Y559	P421-V424 HydrophobicContact CB-CG1 4.02Å; P421-V424 WeakPolarHBondContact O-CG2 3.38Å; V424-K426 HydrophobicContact CG2-CD 4.27Å; V424-K426 HydrophobicContact CG2-CG 3.7Å; V424-V556 HydrophobicContact CB-CG1 3.98Å; V424-V556 HydrophobicContact CG2-CB 3.81Å; V424-V556 HydrophobicContact CG2-CG1 3.6Å; V424-V556 VanDerWaalsContact O-CG1 3.31Å; V424-V556 WeakPolarHBondContact O-CG1 3.47Å; V424-Y559 HydrophobicContact CB-CE2 4.35Å; V424-Y559 PolarHBondContact O-OH 3.22Å
425	G	89.9	Confident	91.1	Very high	15 Å²	15	23.1 Å²	23.1	16%	0.155	14%	0.138	C	C	.	.	S	Bend	trans	89.4	11.6	174.8	0	0	0	0	0	117.3	T427 S428 I429	G425-T427 VanDerWaalsContact C-N 3.34Å; G425-T427 PolarHBondContact O-N 3.37Å; G425-S428 VanDerWaalsContact C-OG 3.29Å; G425-S428 WeakPolarHBondContact CA-OG 3.5Å; G425-S428 PolarHBondContact O-N 2.98Å; G425-S428 VanDerWaalsContact O-N 3.11Å; G425-S428 PolarHBondContact O-OG 2.67Å; G425-I429 PolarHBondContact O-N 3.42Å
426	K	92.5	Very high	91.4	Very high	10 Å²	10	22.3 Å²	22.3	4%	0.043	13%	0.134	C	C	.	.	H	α-helix	trans	-54.6	-42.5	178.3	-53.8	-173.7	-66	-97.5	0	114.4	F418 G420 P421 V424 I429 T536 A537 N538 V556	F418-K426 HydrophobicContact CB-CB 4.06Å; F418-K426 HydrophobicContact CB-CG 4.29Å; F418-K426 WeakPolarHBondContact O-CD 3.45Å; G420-K426 PolarHBondContact O-NZ 2.97Å; P421-K426 PolarHBondContact O-NZ 3.13Å; V424-K426 HydrophobicContact CG2-CD 4.27Å; V424-K426 HydrophobicContact CG2-CG 3.7Å; K426-I429 WeakPolarHBondContact O-CG2 3.48Å; K426-T536 HydrophobicContact CB-CG2 4.1Å; K426-A537 WeakPolarHBondContact CD-O 3.44Å; K426-A537 WeakPolarHBondContact CE-O 3.28Å; K426-N538 PolarHBondContact NZ-OD1 3.12Å; K426-V556 HydrophobicContact CG-CB 4.26Å; K426-V556 HydrophobicContact CG-CG2 4.2Å
427	T	90	Very high	91.3	Very high	41 Å²	41	22.5 Å²	22.5	25%	0.252	14%	0.135	S	C	.	.	H	α-helix	trans	-75.8	-34.5	178.5	-46.3	0	0	0	0	111.3	G425 K431 R443 L485 D487	G425-T427 VanDerWaalsContact C-N 3.34Å; G425-T427 PolarHBondContact O-N 3.37Å; T427-K431 PolarHBondContact O-N 2.66Å; T427-R443 VanDerWaalsContact CG2-CZ 3.5Å; T427-L485 HydrophobicContact CG2-CD2 3.47Å; T427-L485 VanDerWaalsContact CG2-CD2 3.47Å; T427-D487 PolarHBondContact OG1-OD1 3.5Å
428	S	91.3	Very high	91.2	Very high	52 Å²	52	26.4 Å²	26.4	36%	0.364	16%	0.156	S	C	.	.	H	α-helix	trans	-75.1	-34.6	-177.7	50.1	0	0	0	0	112.4	H388 G425 A430 K431 S432	H388-S428 PolarHBondContact CE1-OG 3.09Å; G425-S428 VanDerWaalsContact C-OG 3.29Å; G425-S428 WeakPolarHBondContact CA-OG 3.5Å; G425-S428 PolarHBondContact O-N 2.98Å; G425-S428 VanDerWaalsContact O-N 3.11Å; G425-S428 PolarHBondContact O-OG 2.67Å; S428-A430 VanDerWaalsContact C-N 3.3Å; S428-A430 PolarHBondContact O-N 3.17Å; S428-K431 WeakPolarHBondContact O-CB 3.17Å; S428-K431 PolarHBondContact O-N 3.19Å; S428-K431 VanDerWaalsContact O-N 3.12Å; S428-S432 PolarHBondContact O-N 3.19Å; S428-S432 PolarHBondContact O-OG 3.38Å
429	I	93.5	Very high	91	Very high	1 Å²	1	27 Å²	27	1%	0.005	16%	0.158	C	C	.	.	H	α-helix	trans	-61.8	-39.4	175.6	-165.6	70.7	0	0	0	111.1	L384 H388 V394 F418 G425 K426 K431 S432 I433	L384-I429 HydrophobicContact CD2-CD1 3.75Å; H388-I429 VanDerWaalsContact CD2-CD1 3.45Å; H388-I429 WeakPolarHBondContact CD2-CD1 3.35Å; V394-I429 HydrophobicContact CG1-CG1 4.36Å; F418-I429 HydrophobicContact CD1-CG2 4.09Å; F418-I429 HydrophobicContact CD2-CG2 3.78Å; F418-I429 HydrophobicContact CE1-CG2 4.11Å; F418-I429 HydrophobicContact CE2-CG2 3.79Å; F418-I429 HydrophobicContact CG-CG2 3.93Å; F418-I429 HydrophobicContact CZ-CG1 4.45Å; F418-I429 HydrophobicContact CZ-CG2 3.97Å; G425-I429 PolarHBondContact O-N 3.42Å; K426-I429 WeakPolarHBondContact O-CG2 3.48Å; I429-K431 VanDerWaalsContact C-N 3.29Å; I429-K431 PolarHBondContact O-N 3.05Å; I429-S432 WeakPolarHBondContact O-CB 3.38Å; I429-S432 PolarHBondContact O-N 2.95Å; I429-S432 VanDerWaalsContact O-N 3.11Å; I429-I433 HydrophobicContact CG1-CD1 4.44Å; I429-I433 VanDerWaalsContact O-CG1 3.29Å; I429-I433 WeakPolarHBondContact O-CG1 3.29Å; I429-I433 PolarHBondContact O-N 2.88Å
430	A	93.3	Very high	91.1	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-61	-37	174.9	0	0	0	0	0	112.7	S428 I433 S434 Y441 L485 I534	S428-A430 VanDerWaalsContact C-N 3.3Å; S428-A430 PolarHBondContact O-N 3.17Å; A430-I433 PolarHBondContact O-N 3.02Å; A430-S434 PolarHBondContact O-N 3.21Å; A430-S434 VanDerWaalsContact O-N 3.1Å; A430-Y441 HydrophobicContact CB-CE2 4.4Å; A430-L485 HydrophobicContact CB-CB 4.45Å; A430-L485 HydrophobicContact CB-CD1 3.59Å; A430-L485 HydrophobicContact CB-CD2 3.94Å; A430-L485 HydrophobicContact CB-CG 4.21Å; A430-I534 HydrophobicContact CB-CD1 4.31Å; A430-I534 HydrophobicContact CB-CG2 4.06Å
431	K	93.4	Very high	91.5	Very high	127 Å²	127	31.2 Å²	31.2	55%	0.552	18%	0.176	S	C	*	.	H	α-helix	trans	-66.4	-43.1	173.9	-170.1	-179.2	178.5	-173.6	0	111	T427 S428 I429 I433 S434 S435 Y441	T427-K431 PolarHBondContact O-N 2.66Å; S428-K431 WeakPolarHBondContact O-CB 3.17Å; S428-K431 PolarHBondContact O-N 3.19Å; S428-K431 VanDerWaalsContact O-N 3.12Å; I429-K431 VanDerWaalsContact C-N 3.29Å; I429-K431 PolarHBondContact O-N 3.05Å; K431-I433 VanDerWaalsContact C-N 3.32Å; K431-I433 PolarHBondContact O-N 2.98Å; K431-S434 PolarHBondContact O-N 3.04Å; K431-S434 VanDerWaalsContact O-N 3.16Å; K431-S434 PolarHBondContact O-OG 2.59Å; K431-S435 PolarHBondContact O-N 2.88Å; K431-S435 VanDerWaalsContact O-N 3.11Å; K431-S435 PolarHBondContact O-OG 3.01Å; K431-Y441 HydrophobicContact CB-CE2 4.18Å
432	S	92.8	Very high	92.1	Very high	4 Å²	4	31.5 Å²	31.5	3%	0.028	18%	0.175	C	C	.	.	H	α-helix	trans	-62.7	-37.7	175.9	-57.7	0	0	0	0	112.4	D387 H388 S428 I429 S434 S435 A436	D387-S432 WeakPolarHBondContact CB-OG 3.49Å; D387-S432 VanDerWaalsContact OD2-CB 3.25Å; D387-S432 WeakPolarHBondContact OD2-CB 3.47Å; D387-S432 PolarHBondContact OD2-OG 3.35Å; H388-S432 PolarHBondContact CD2-OG 3.07Å; H388-S432 PolarHBondContact NE2-OG 3.41Å; S428-S432 PolarHBondContact O-N 3.19Å; S428-S432 PolarHBondContact O-OG 3.38Å; I429-S432 WeakPolarHBondContact O-CB 3.38Å; I429-S432 PolarHBondContact O-N 2.95Å; I429-S432 VanDerWaalsContact O-N 3.11Å; S432-S434 VanDerWaalsContact C-N 3.34Å; S432-S434 PolarHBondContact O-N 3.34Å; S432-S435 PolarHBondContact O-N 3.36Å; S432-A436 WeakPolarHBondContact O-CB 3.46Å; S432-A436 PolarHBondContact O-N 3.49Å
433	I	93.6	Very high	92.4	Very high	1 Å²	1	35.2 Å²	35.2	1%	0.005	18%	0.183	C	C	.	.	H	α-helix	trans	-61.5	-42.7	173.2	-65.1	166	0	0	0	110.9	L384 V398 F418 I429 A430 K431 S435 A436 L437 L483 I534	L384-I433 HydrophobicContact CD2-CG1 4.39Å; V398-I433 HydrophobicContact CG1-CD1 3.89Å; V398-I433 HydrophobicContact CG1-CG1 3.65Å; V398-I433 HydrophobicContact CG2-CD1 3.75Å; V398-I433 HydrophobicContact CG2-CG1 4.34Å; F418-I433 HydrophobicContact CE2-CD1 3.94Å; F418-I433 HydrophobicContact CZ-CD1 3.78Å; I429-I433 HydrophobicContact CG1-CD1 4.44Å; I429-I433 VanDerWaalsContact O-CG1 3.29Å; I429-I433 WeakPolarHBondContact O-CG1 3.29Å; I429-I433 PolarHBondContact O-N 2.88Å; A430-I433 PolarHBondContact O-N 3.02Å; K431-I433 VanDerWaalsContact C-N 3.32Å; K431-I433 PolarHBondContact O-N 2.98Å; I433-S435 PolarHBondContact O-N 3.03Å; I433-A436 PolarHBondContact O-N 3.43Å; I433-L437 HydrophobicContact CG2-CD1 3.84Å; I433-L437 HydrophobicContact CG2-CG 4.38Å; I433-L437 WeakPolarHBondContact O-CB 3.43Å; I433-L437 WeakPolarHBondContact O-CG 3.42Å; I433-L437 PolarHBondContact O-N 2.92Å; I433-L483 HydrophobicContact CB-CD1 4.09Å; I433-L483 HydrophobicContact CG2-CD1 3.66Å; I433-I534 HydrophobicContact CB-CD1 4.32Å; I433-I534 HydrophobicContact CD1-CD1 3.74Å; I433-I534 HydrophobicContact CG2-CD1 4.12Å
434	S	93.1	Very high	92.7	Very high	5 Å²	5	34.8 Å²	34.8	4%	0.035	17%	0.174	C	C	.	.	H	α-helix	trans	-61.6	-42.9	177.2	71.5	0	0	0	0	112.3	A430 K431 S432 L437 N438 R439	A430-S434 PolarHBondContact O-N 3.21Å; A430-S434 VanDerWaalsContact O-N 3.1Å; K431-S434 PolarHBondContact O-N 3.04Å; K431-S434 VanDerWaalsContact O-N 3.16Å; K431-S434 PolarHBondContact O-OG 2.59Å; S432-S434 VanDerWaalsContact C-N 3.34Å; S432-S434 PolarHBondContact O-N 3.34Å; S434-L437 PolarHBondContact O-N 2.83Å; S434-N438 PolarHBondContact O-N 3.06Å; S434-R439 PolarHBondContact O-N 3.07Å
435	S	93.2	Very high	92.8	Very high	53 Å²	53	36.6 Å²	36.6	37%	0.371	19%	0.186	S	C	.	.	H	α-helix	trans	-65.1	-40.8	175.4	-59.7	0	0	0	0	112.3	R379 K431 S432 I433 N438	R379-S435 PolarHBondContact NH2-O 3.43Å; R379-S435 VanDerWaalsContact NH2-O 3.15Å; K431-S435 PolarHBondContact O-N 2.88Å; K431-S435 VanDerWaalsContact O-N 3.11Å; K431-S435 PolarHBondContact O-OG 3.01Å; S432-S435 PolarHBondContact O-N 3.36Å; I433-S435 PolarHBondContact O-N 3.03Å; S435-N438 PolarHBondContact O-N 2.72Å
436	A	92	Very high	92.6	Very high	1 Å²	1	35.9 Å²	35.9	1%	0.008	18%	0.179	C	C	.	.	H	α-helix	trans	-62.2	-46	177.5	0	0	0	0	0	111.6	R379 A380 I383 S432 I433 N438	R379-A436 PolarHBondContact NH1-O 2.93Å; A380-A436 HydrophobicContact CB-CB 4.07Å; I383-A436 HydrophobicContact CB-CB 4.47Å; I383-A436 HydrophobicContact CD1-CB 4.38Å; I383-A436 HydrophobicContact CG2-CB 4.34Å; S432-A436 WeakPolarHBondContact O-CB 3.46Å; S432-A436 PolarHBondContact O-N 3.49Å; I433-A436 PolarHBondContact O-N 3.43Å; A436-N438 VanDerWaalsContact C-N 3.29Å; A436-N438 PolarHBondContact O-N 2.93Å
437	L	91.1	Very high	92.1	Very high	4 Å²	4	36.9 Å²	36.9	2%	0.021	19%	0.193	C	C	.	.	H	α-helix	trans	-81.2	-6.1	179.3	-66.3	176.9	0	0	0	114.2	E373 N374 F375 I402 I433 S434 R439 L532	E373-L437 WeakPolarHBondContact CA-O 3.35Å; N374-L437 PolarHBondContact N-O 3.44Å; F375-L437 HydrophobicContact CD1-CD2 3.99Å; F375-L437 HydrophobicContact CE1-CD2 4.14Å; I402-L437 HydrophobicContact CD1-CD2 4.22Å; I402-L437 HydrophobicContact CG1-CD2 4.04Å; I402-L437 HydrophobicContact CG2-CD2 4.02Å; I433-L437 HydrophobicContact CG2-CD1 3.84Å; I433-L437 HydrophobicContact CG2-CG 4.38Å; I433-L437 WeakPolarHBondContact O-CB 3.43Å; I433-L437 WeakPolarHBondContact O-CG 3.42Å; I433-L437 PolarHBondContact O-N 2.92Å; S434-L437 PolarHBondContact O-N 2.83Å; L437-R439 VanDerWaalsContact C-N 3.25Å; L437-R439 HydrophobicContact CB-CG 4.11Å; L437-R439 PolarHBondContact O-N 3.17Å; L437-L532 HydrophobicContact CD1-CD2 3.6Å
438	N	92.1	Very high	91.5	Very high	82 Å²	82	38.1 Å²	38.1	44%	0.439	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.2	35.3	-172.3	-165.2	47.2	0	0	0	113.3	E372 N374 S434 S435 A436	E372-N438 PolarHBondContact O-ND2 2.91Å; N374-N438 HydrophobicContact CB-CB 4.2Å; S434-N438 PolarHBondContact O-N 3.06Å; S435-N438 PolarHBondContact O-N 2.72Å; A436-N438 VanDerWaalsContact C-N 3.29Å; A436-N438 PolarHBondContact O-N 2.93Å
439	R	92.4	Very high	91	Very high	11 Å²	11	36.1 Å²	36.1	4%	0.042	20%	0.198	C	C	.	.			trans	-98.4	145.5	177	-74.2	-177.8	166.3	-128.3	1.9	110.7	E373 S434 L437 N481 P482 L483 K530 L532	E373-R439 HydrophobicContact CG-CG 4.44Å; E373-R439 IonicContact OE1-CZ 2.58Å; E373-R439 IonicContact OE1-NE 2.79Å; E373-R439 PolarHBondContact OE1-NE 2.8Å; E373-R439 IonicContact OE1-NH2 2.7Å; E373-R439 PolarHBondContact OE1-NH2 3.48Å; E373-R439 IonicContact OE2-NH2 2.81Å; E373-R439 PolarHBondContact OE2-NH2 2.91Å; S434-R439 PolarHBondContact O-N 3.07Å; L437-R439 VanDerWaalsContact C-N 3.25Å; L437-R439 HydrophobicContact CB-CG 4.11Å; L437-R439 PolarHBondContact O-N 3.17Å; R439-N481 PolarHBondContact NH1-O 3.33Å; R439-N481 VanDerWaalsContact NH1-O 3.09Å; R439-P482 PolarHBondContact NH1-O 2.92Å; R439-L483 HydrophobicContact CB-CB 4.22Å; R439-K530 PolarHBondContact NH1-O 2.84Å; R439-K530 PolarHBondContact NH2-O 2.86Å; R439-L532 VanDerWaalsContact NH1-CB 3.3Å
440	Q	94.8	Very high	90.2	Very high	90 Å²	90	39.7 Å²	39.7	42%	0.421	22%	0.22	S	C	.	.			trans	-62.3	141.6	170.3	-64.9	-58.4	-41.2	0	0	110.6	T371 V477 C479 P482 L483	T371-Q440 HydrophobicContact CG2-CG 4.02Å; Q440-V477 HydrophobicContact CB-CB 3.84Å; Q440-V477 HydrophobicContact CB-CG1 4.08Å; Q440-V477 HydrophobicContact CG-CB 4.33Å; Q440-C479 VanDerWaalsContact CG-SG 3.55Å; Q440-P482 HydrophobicContact CB-CB 4.34Å; Q440-P482 CarbonylContact O-C 3.42Å; Q440-P482 WeakPolarHBondContact O-CA 3.23Å; Q440-L483 PolarHBondContact O-N 3.44Å
441	Y	95.2	Very high	89.8	Confident	63 Å²	63	43 Å²	43	25%	0.247	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	128.1	-176.2	179.7	-100.3	0	0	0	111.3	A430 K431 R443 L483 L485	A430-Y441 HydrophobicContact CB-CE2 4.4Å; K431-Y441 HydrophobicContact CB-CE2 4.18Å; Y441-R443 HydrophobicContact CE1-CB 3.85Å; Y441-L483 HydrophobicContact CD2-CD2 4.06Å; Y441-L483 HydrophobicContact CE2-CD2 4.24Å; Y441-L485 HydrophobicContact CE2-CB 4.09Å; Y441-L485 WeakPolarHBondContact OH-CD2 3.42Å
442	F	96.2	Very high	89.4	Confident	28 Å²	28	38.4 Å²	38.4	12%	0.123	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	145	168.3	-170.6	-93.3	0	0	0	110.2	F444 C473 K476 V477 L483 I484 L485	F442-F444 HydrophobicContact CD1-CD1 4.08Å; F442-F444 HydrophobicContact CE1-CB 4.21Å; F442-F444 AromaticContact CE1-CD1 3.82Å; F442-F444 HydrophobicContact CE1-CD1 3.82Å; F442-F444 HydrophobicContact CE1-CG 4.45Å; F442-C473 HydrophobicContact CB-CB 4.39Å; F442-C473 WeakPolarHBondContact CB-SG 3.36Å; F442-C473 HydrophobicContact CD1-CB 3.58Å; F442-C473 HydrophobicContact CD2-CB 3.96Å; F442-C473 HydrophobicContact CE1-CB 3.69Å; F442-C473 HydrophobicContact CE2-CB 4.05Å; F442-C473 HydrophobicContact CG-CB 3.72Å; F442-C473 WeakPolarHBondContact CG-SG 3.49Å; F442-C473 HydrophobicContact CZ-CB 3.93Å; F442-K476 HydrophobicContact CD2-CD 4.1Å; F442-K476 HydrophobicContact CE2-CD 3.76Å; F442-V477 HydrophobicContact CB-CG1 4.11Å; F442-V477 HydrophobicContact CD2-CG1 4.45Å; F442-L483 PolarHBondContact N-O 3.49Å; F442-I484 WeakPolarHBondContact O-CA 3.44Å; F442-L485 PolarHBondContact O-N 2.77Å
443	R	94.4	Very high	89.2	Confident	128 Å²	128	38.7 Å²	38.7	48%	0.483	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	136	-179.8	174.6	-175.4	170	-150.1	-2.7	110	T427 Y441 L485 D487	T427-R443 VanDerWaalsContact CG2-CZ 3.5Å; Y441-R443 HydrophobicContact CE1-CB 3.85Å; R443-L485 WeakPolarHBondContact CA-O 3.39Å; R443-L485 HydrophobicContact CB-CB 4.21Å; R443-L485 HydrophobicContact CG-CB 4.25Å; R443-L485 HydrophobicContact CG-CD2 4.03Å; R443-L485 HydrophobicContact CG-CG 4.38Å; R443-D487 IonicContact CZ-OD2 2.98Å; R443-D487 IonicContact NE-OD2 2.83Å; R443-D487 PolarHBondContact NE-OD2 3.26Å; R443-D487 IonicContact NH2-OD2 3.81Å; R443-D487 PolarHBondContact NH2-OD2 2.93Å
444	F	93.4	Very high	88.9	Confident	15 Å²	15	41.5 Å²	41.5	7%	0.066	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	150.2	164.2	68.1	-86	0	0	0	110.3	F442 V446 M449 K469 I470 I484 L485 I486 D487	F442-F444 HydrophobicContact CD1-CD1 4.08Å; F442-F444 HydrophobicContact CE1-CB 4.21Å; F442-F444 AromaticContact CE1-CD1 3.82Å; F442-F444 HydrophobicContact CE1-CD1 3.82Å; F442-F444 HydrophobicContact CE1-CG 4.45Å; F444-V446 HydrophobicContact CD2-CG1 4.22Å; F444-V446 HydrophobicContact CE2-CG1 3.7Å; F444-M449 HydrophobicContact CD2-CE 3.8Å; F444-M449 HydrophobicContact CE2-CE 3.94Å; F444-K469 HydrophobicContact CB-CD 4.12Å; F444-K469 HydrophobicContact CD2-CD 3.89Å; F444-K469 HydrophobicContact CG-CD 4.07Å; F444-I470 HydrophobicContact CE1-CD1 3.86Å; F444-I470 HydrophobicContact CZ-CD1 4.12Å; F444-I484 HydrophobicContact CD1-CG2 4.07Å; F444-I484 HydrophobicContact CE1-CG2 3.57Å; F444-L485 PolarHBondContact N-O 3.5Å; F444-L485 VanDerWaalsContact N-O 3.08Å; F444-I486 HydrophobicContact CE1-CG1 4.15Å; F444-I486 HydrophobicContact CE2-CG2 4.32Å; F444-I486 HydrophobicContact CZ-CD1 4.29Å; F444-I486 HydrophobicContact CZ-CG1 3.92Å; F444-I486 HydrophobicContact CZ-CG2 4.39Å; F444-D487 PolarHBondContact O-N 3.21Å
445	S	90.6	Very high	88.7	Confident	37 Å²	37	41.3 Å²	41.3	26%	0.259	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	141.1	171.8	176.6	0	0	0	0	109.5	G447 D487 E488	S445-G447 PolarHBondContact OG-N 3.42Å; S445-D487 WeakPolarHBondContact CA-O 3.45Å; S445-D487 PolarHBondContact OG-O 3.44Å; S445-E488 PolarHBondContact OG-OE2 3.45Å
446	V	86.7	Confident	88.6	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	22%	0.222	C	C	.	.			trans	-91.6	-5	170.1	-62.9	0	0	0	0	112	F444 G448 M449 I486 D487 E488 V489 L505	F444-V446 HydrophobicContact CD2-CG1 4.22Å; F444-V446 HydrophobicContact CE2-CG1 3.7Å; V446-G448 PolarHBondContact O-N 3.38Å; V446-M449 HydrophobicContact CB-SD 3.9Å; V446-M449 HydrophobicContact CG1-CE 4.35Å; V446-M449 HydrophobicContact CG1-SD 3.79Å; V446-M449 WeakPolarHBondContact O-CB 3.47Å; V446-M449 WeakPolarHBondContact O-CG 3.47Å; V446-M449 PolarHBondContact O-N 3.22Å; V446-M449 VanDerWaalsContact O-N 3.13Å; V446-I486 HydrophobicContact CB-CG2 4.48Å; V446-I486 HydrophobicContact CG1-CG2 3.42Å; V446-I486 VanDerWaalsContact CG1-CG2 3.42Å; V446-I486 HydrophobicContact CG2-CG2 4.24Å; V446-D487 WeakPolarHBondContact CG2-O 3.48Å; V446-D487 PolarHBondContact N-O 2.93Å; V446-E488 WeakPolarHBondContact CG2-O 3.3Å; V446-V489 HydrophobicContact CG2-CB 4.42Å; V446-V489 HydrophobicContact CG2-CG1 4.15Å; V446-L505 HydrophobicContact CG1-CD1 3.99Å; V446-L505 HydrophobicContact CG1-CD2 4.31Å
447	G	81.1	Confident	88.6	Confident	32 Å²	32	39.9 Å²	39.9	33%	0.33	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.8	121.8	175.2	0	0	0	0	0	111.7	S445 M449	S445-G447 PolarHBondContact OG-N 3.42Å; G447-M449 VanDerWaalsContact C-N 3.33Å
448	G	76.6	Confident	88.6	Confident	67 Å²	67	43 Å²	43	69%	0.691	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	84.6	1	-179.6	0	0	0	0	0	114.9	V446 T450	V446-G448 PolarHBondContact O-N 3.38Å; G448-T450 PolarHBondContact O-N 2.93Å
449	M	82.3	Confident	88.3	Confident	9 Å²	9	47 Å²	47	4%	0.044	25%	0.246	C	C	.	.			trans	-65.3	129.6	170.3	-72	-175.3	166.2	0	0	110	F444 V446 G447 E454 I455 K469 P501	F444-M449 HydrophobicContact CD2-CE 3.8Å; F444-M449 HydrophobicContact CE2-CE 3.94Å; V446-M449 HydrophobicContact CB-SD 3.9Å; V446-M449 HydrophobicContact CG1-CE 4.35Å; V446-M449 HydrophobicContact CG1-SD 3.79Å; V446-M449 WeakPolarHBondContact O-CB 3.47Å; V446-M449 WeakPolarHBondContact O-CG 3.47Å; V446-M449 PolarHBondContact O-N 3.22Å; V446-M449 VanDerWaalsContact O-N 3.13Å; G447-M449 VanDerWaalsContact C-N 3.33Å; M449-E454 HydrophobicContact CE-CB 4.19Å; M449-E454 HydrophobicContact SD-CB 4.49Å; M449-I455 HydrophobicContact CE-CG1 4.44Å; M449-I455 HydrophobicContact SD-CD1 4.14Å; M449-I455 HydrophobicContact SD-CG1 4.1Å; M449-K469 HydrophobicContact CE-CD 3.6Å; M449-P501 HydrophobicContact CB-CB 4.49Å
450	T	76.8	Confident	87.8	Confident	76 Å²	76	49.7 Å²	49.7	47%	0.466	26%	0.256	S	S	.	.			trans	-120.8	-26.4	175.2	54.6	0	0	0	0	111.8	G448 A495	G448-T450 PolarHBondContact O-N 2.93Å; T450-A495 HydrophobicContact CG2-CB 3.58Å
451	D	84.1	Confident	87	Confident	70 Å²	70	51 Å²	51	37%	0.374	27%	0.27	S	S	.	.			trans	-102.3	129	-177.5	-166	-8.9	0	0	0	111.6	A453 E454 H458	D451-A453 PolarHBondContact O-N 3.47Å; D451-A453 WeakPolarHBondContact OD1-CB 3.31Å; D451-A453 PolarHBondContact OD1-N 2.98Å; D451-E454 WeakPolarHBondContact O-CB 3.46Å; D451-E454 PolarHBondContact O-N 3.18Å; D451-E454 VanDerWaalsContact O-N 3.12Å; D451-H458 IonicContact OD2-CE1 2.78Å; D451-H458 PolarHBondContact OD2-CE1 3.31Å
452	V	85.4	Confident	86	Confident	30 Å²	30	55.1 Å²	55.1	18%	0.182	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-30.9	170.8	168.6	0	0	0	0	111.3	E454 I455 K456 A504	V452-E454 PolarHBondContact O-N 3.22Å; V452-I455 PolarHBondContact O-N 2.81Å; V452-K456 HydrophobicContact CG1-CB 4.45Å; V452-K456 HydrophobicContact CG1-CD 4.25Å; V452-K456 HydrophobicContact CG1-CG 4.32Å; V452-K456 PolarHBondContact O-N 2.93Å; V452-A504 HydrophobicContact CG1-CB 4Å
453	A	87.8	Confident	84.9	Confident	11 Å²	11	61.4 Å²	61.4	9%	0.091	33%	0.326	C	S	.	.	H	α-helix	trans	-64.2	-18.8	178.1	0	0	0	0	0	113.5	D451 I455 G457 H458	D451-A453 PolarHBondContact O-N 3.47Å; D451-A453 WeakPolarHBondContact OD1-CB 3.31Å; D451-A453 PolarHBondContact OD1-N 2.98Å; A453-I455 PolarHBondContact O-N 3.33Å; A453-G457 WeakPolarHBondContact CA-O 3.5Å; A453-G457 WeakPolarHBondContact CB-O 3.35Å; A453-G457 CarbonylContact O-C 3.34Å; A453-G457 WeakPolarHBondContact O-CA 3.46Å; A453-G457 PolarHBondContact O-N 3.05Å; A453-H458 VanDerWaalsContact CB-CE1 3.42Å; A453-H458 WeakPolarHBondContact CB-CE1 3.4Å; A453-H458 WeakPolarHBondContact CB-ND1 3.27Å
454	E	87	Confident	84.2	Confident	60 Å²	60	58.5 Å²	58.5	28%	0.28	34%	0.336	S	S	.	.	H	α-helix	trans	-64.8	-31.2	172	-75.3	-163.4	-129.2	0	0	112.3	M449 D451 V452 K469	M449-E454 HydrophobicContact CE-CB 4.19Å; M449-E454 HydrophobicContact SD-CB 4.49Å; D451-E454 WeakPolarHBondContact O-CB 3.46Å; D451-E454 PolarHBondContact O-N 3.18Å; D451-E454 VanDerWaalsContact O-N 3.12Å; V452-E454 PolarHBondContact O-N 3.22Å; E454-K469 WeakPolarHBondContact O-CG 3.43Å; E454-K469 PolarHBondContact O-N 2.75Å; E454-K469 VanDerWaalsContact OE2-CE 3.29Å; E454-K469 WeakPolarHBondContact OE2-CE 3.28Å; E454-K469 IonicContact OE2-NZ 3.97Å; E454-K469 PolarHBondContact OE2-NZ 3.42Å
455	I	90.5	Very high	83.8	Confident	1 Å²	1	58.8 Å²	58.8	1%	0.005	34%	0.34	C	S	.	.	H	α-helix	trans	-94.2	-46.2	179.9	-63	167.6	0	0	0	110.5	M449 V452 A453 G468 P501 A504 L505 L508 F517	M449-I455 HydrophobicContact CE-CG1 4.44Å; M449-I455 HydrophobicContact SD-CD1 4.14Å; M449-I455 HydrophobicContact SD-CG1 4.1Å; V452-I455 PolarHBondContact O-N 2.81Å; A453-I455 PolarHBondContact O-N 3.33Å; I455-G468 WeakPolarHBondContact O-CA 3.48Å; I455-P501 HydrophobicContact CD1-CB 4.35Å; I455-A504 HydrophobicContact CB-CB 4.01Å; I455-A504 HydrophobicContact CD1-CB 4.08Å; I455-A504 HydrophobicContact CG2-CB 3.98Å; I455-L505 HydrophobicContact CD1-CD2 3.6Å; I455-L505 HydrophobicContact CD1-CG 3.65Å; I455-L505 HydrophobicContact CG1-CD2 4.49Å; I455-L508 HydrophobicContact CG2-CD1 3.81Å; I455-F517 HydrophobicContact CG2-CZ 4.4Å
456	K	91.1	Very high	83.7	Confident	23 Å²	23	62.4 Å²	62.4	10%	0.1	35%	0.354	C	S	.	.	H	α-helix	trans	-93.6	-3.9	-176	-69.8	-161.3	174.7	-155.9	0	115.2	V452 A504 E507 F517 D519 H520	V452-K456 HydrophobicContact CG1-CB 4.45Å; V452-K456 HydrophobicContact CG1-CD 4.25Å; V452-K456 HydrophobicContact CG1-CG 4.32Å; V452-K456 PolarHBondContact O-N 2.93Å; K456-A504 HydrophobicContact CG-CB 4.1Å; K456-E507 WeakPolarHBondContact CE-OE1 3.32Å; K456-E507 WeakPolarHBondContact CE-OE2 3.36Å; K456-E507 IonicContact NZ-OE1 3.52Å; K456-E507 PolarHBondContact NZ-OE1 3.27Å; K456-E507 IonicContact NZ-OE2 2.68Å; K456-E507 PolarHBondContact NZ-OE2 2.9Å; K456-F517 HydrophobicContact CG-CE2 4.35Å; K456-F517 HydrophobicContact CG-CZ 4.06Å; K456-D519 CarbonylContact O-C 3.6Å; K456-D519 VanDerWaalsContact O-CA 3.3Å; K456-D519 WeakPolarHBondContact O-CA 2.73Å; K456-D519 VanDerWaalsContact O-CG 3.29Å; K456-H520 PolarHBondContact O-N 3.49Å
457	G	91.5	Very high	84	Confident	0 Å²	0	62.5 Å²	62.5	0%	0	36%	0.355	C	S	.	.			trans	81.2	157.7	-173.7	0	0	0	0	0	113.5	A453 M466 G468 H520	A453-G457 WeakPolarHBondContact CA-O 3.5Å; A453-G457 WeakPolarHBondContact CB-O 3.35Å; A453-G457 CarbonylContact O-C 3.34Å; A453-G457 WeakPolarHBondContact O-CA 3.46Å; A453-G457 PolarHBondContact O-N 3.05Å; G457-M466 WeakPolarHBondContact CA-O 3.43Å; G457-G468 VanDerWaalsContact N-CA 3.34Å; G457-H520 WeakPolarHBondContact O-CB 3.48Å; G457-H520 PolarHBondContact O-ND1 3.11Å
458	H	90.6	Very high	84.6	Confident	69 Å²	69	61 Å²	61	32%	0.319	34%	0.339	S	S	.	.			trans	-82.8	147.1	170.5	-65.6	-81.6	0	0	0	109.9	D451 A453 R460 M466 Y521	D451-H458 IonicContact OD2-CE1 2.78Å; D451-H458 PolarHBondContact OD2-CE1 3.31Å; A453-H458 VanDerWaalsContact CB-CE1 3.42Å; A453-H458 WeakPolarHBondContact CB-CE1 3.4Å; A453-H458 WeakPolarHBondContact CB-ND1 3.27Å; H458-R460 PolarHBondContact O-N 3.43Å; H458-M466 PolarHBondContact N-O 3.12Å; H458-Y521 WeakPolarHBondContact O-CA 3.32Å; H458-Y521 VanDerWaalsContact O-CB 3.25Å; H458-Y521 WeakPolarHBondContact O-CB 3.31Å; H458-Y521 PolarHBondContact O-N 2.86Å
459	R	86.9	Confident	85.3	Confident	168 Å²	168	60.3 Å²	60.3	63%	0.634	32%	0.317	S	S	*	.			trans	-56.3	131.3	168.7	-67.6	-172.6	178.7	-166.5	-1.3	109.7	T461 Y462 S465 H520	R459-T461 PolarHBondContact O-N 2.81Å; R459-Y462 HydrophobicContact CB-CD2 3.92Å; R459-Y462 HydrophobicContact CB-CE2 3.98Å; R459-Y462 WeakPolarHBondContact O-CD2 3.42Å; R459-Y462 PolarHBondContact O-N 3.32Å; R459-S465 WeakPolarHBondContact O-CB 3.46Å; R459-H520 HydrophobicContact CG-CB 4.35Å
460	R	80.9	Confident	85.8	Confident	67 Å²	67	59.9 Å²	59.9	25%	0.253	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.4	-23.4	-177.1	66.1	177.9	130	-163.1	1	115	Y358 H458 Y462 S465 Y521 D523	Y358-R460 PolarHBondContact OH-NH1 2.96Å; H458-R460 PolarHBondContact O-N 3.43Å; R460-Y462 PolarHBondContact O-N 2.53Å; R460-S465 WeakPolarHBondContact CA-OG 3.18Å; R460-S465 PolarHBondContact O-OG 3.48Å; R460-Y521 HydrophobicContact CB-CD2 4.32Å; R460-Y521 HydrophobicContact CB-CE2 4.43Å; R460-D523 IonicContact CZ-OD2 3.94Å; R460-D523 IonicContact NH2-OD2 2.75Å; R460-D523 PolarHBondContact NH2-OD2 2.65Å
461	T	77.8	Confident	86.7	Confident	117 Å²	117	56.2 Å²	56.2	72%	0.718	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	-17.4	179.2	55.5	0	0	0	0	113.2	R459	R459-T461 PolarHBondContact O-N 2.81Å
462	Y	74.9	Confident	87.1	Confident	150 Å²	150	56.2 Å²	56.2	59%	0.588	29%	0.291	S	S	*	.	S	Bend	trans	-82.5	136.9	178.1	-67.6	-67.7	0	0	0	111.9	R459 R460 G464 S465	R459-Y462 HydrophobicContact CB-CD2 3.92Å; R459-Y462 HydrophobicContact CB-CE2 3.98Å; R459-Y462 WeakPolarHBondContact O-CD2 3.42Å; R459-Y462 PolarHBondContact O-N 3.32Å; R460-Y462 PolarHBondContact O-N 2.53Å; Y462-G464 PolarHBondContact O-N 3.23Å; Y462-S465 WeakPolarHBondContact O-CB 3.3Å; Y462-S465 PolarHBondContact O-N 2.96Å; Y462-S465 PolarHBondContact O-OG 3.12Å
463	V	72.6	Confident	87.5	Confident	159 Å²	159	54.8 Å²	54.8	96%	0.964	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	125.9	172.4	-179.6	0	0	0	0	109.1	S465	V463-S465 VanDerWaalsContact C-N 3.3Å
464	G	78.8	Confident	87.8	Confident	67 Å²	67	54.5 Å²	54.5	69%	0.691	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.4	14	-177.8	0	0	0	0	0	114.6	Y462	Y462-G464 PolarHBondContact O-N 3.23Å
465	S	84.9	Confident	88.1	Confident	22 Å²	22	54.2 Å²	54.2	15%	0.154	28%	0.276	C	S	.	.			trans	-55.8	141.5	174	53.8	0	0	0	0	111.8	R459 R460 Y462 V463 Y521	R459-S465 WeakPolarHBondContact O-CB 3.46Å; R460-S465 WeakPolarHBondContact CA-OG 3.18Å; R460-S465 PolarHBondContact O-OG 3.48Å; Y462-S465 WeakPolarHBondContact O-CB 3.3Å; Y462-S465 PolarHBondContact O-N 2.96Å; Y462-S465 PolarHBondContact O-OG 3.12Å; V463-S465 VanDerWaalsContact C-N 3.3Å; S465-Y521 WeakPolarHBondContact O-CE2 3.32Å; S465-Y521 WeakPolarHBondContact OG-CE2 3.14Å
466	M	90.1	Very high	88.2	Confident	113 Å²	113	61.6 Å²	61.6	56%	0.557	31%	0.309	S	S	*	.			trans	-131.4	149	175.5	-66.2	-164.7	-178.7	0	0	110	G457 H458	G457-M466 WeakPolarHBondContact CA-O 3.43Å; H458-M466 PolarHBondContact N-O 3.12Å
467	P	93.1	Very high	88.3	Confident	2 Å²	2	61.5 Å²	61.5	1%	0.013	31%	0.31	C	S	.	.			trans	-61.1	159.9	168.1	-11.8	20.1	0	0	0	112.4	W361 I471 Q472 Y521	W361-P467 HydrophobicContact CD2-CG 3.47Å; W361-P467 VanDerWaalsContact CD2-CG 3.47Å; W361-P467 HydrophobicContact CE3-CG 3.69Å; W361-P467 HydrophobicContact CG-CG 3.95Å; W361-P467 HydrophobicContact CH2-CG 4.07Å; W361-P467 HydrophobicContact CZ2-CG 3.87Å; W361-P467 HydrophobicContact CZ3-CG 3.96Å; P467-I471 HydrophobicContact CB-CB 3.69Å; P467-I471 HydrophobicContact CB-CG1 4.32Å; P467-I471 HydrophobicContact CB-CG2 3.57Å; P467-I471 HydrophobicContact CG-CG2 4.13Å; P467-Q472 PolarHBondContact O-NE2 3.34Å; P467-Y521 HydrophobicContact CB-CD1 4.12Å; P467-Y521 HydrophobicContact CB-CG 4.23Å; P467-Y521 HydrophobicContact CG-CD1 3.48Å; P467-Y521 VanDerWaalsContact CG-CD1 3.48Å; P467-Y521 HydrophobicContact CG-CE1 3.87Å; P467-Y521 HydrophobicContact CG-CG 3.87Å
468	G	92.6	Very high	88.3	Confident	0 Å²	0	68.8 Å²	68.8	0%	0	34%	0.341	C	S	.	.			trans	-64	161.1	177.6	0	0	0	0	0	112.9	I455 G457 I470 I471 Q472 D519	I455-G468 WeakPolarHBondContact O-CA 3.48Å; G457-G468 VanDerWaalsContact N-CA 3.34Å; G468-I470 PolarHBondContact O-N 2.72Å; G468-I471 PolarHBondContact O-N 2.95Å; G468-Q472 WeakPolarHBondContact O-CG 3.48Å; G468-Q472 PolarHBondContact O-N 3.45Å; G468-D519 WeakPolarHBondContact CA-OD2 3.38Å; G468-D519 PolarHBondContact N-OD2 3.29Å
469	K	92.2	Very high	88.3	Confident	52 Å²	52	65.6 Å²	65.6	23%	0.226	33%	0.327	C	S	.	.	H	α-helix	trans	-56.3	-26.4	-177.8	-78	-172.8	-168.8	172	0	113.7	F444 M449 E454 C473	F444-K469 HydrophobicContact CB-CD 4.12Å; F444-K469 HydrophobicContact CD2-CD 3.89Å; F444-K469 HydrophobicContact CG-CD 4.07Å; M449-K469 HydrophobicContact CE-CD 3.6Å; E454-K469 WeakPolarHBondContact O-CG 3.43Å; E454-K469 PolarHBondContact O-N 2.75Å; E454-K469 VanDerWaalsContact OE2-CE 3.29Å; E454-K469 WeakPolarHBondContact OE2-CE 3.28Å; E454-K469 IonicContact OE2-NZ 3.97Å; E454-K469 PolarHBondContact OE2-NZ 3.42Å; K469-C473 VanDerWaalsContact O-CB 3.27Å; K469-C473 WeakPolarHBondContact O-CB 3.38Å; K469-C473 PolarHBondContact O-N 3.11Å
470	I	92.7	Very high	88.6	Confident	0 Å²	0	58.7 Å²	58.7	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-71.8	-44.2	177.6	-54.4	-52	0	0	0	111.8	F444 G468 Q472 C473 L474 I484 L508 L528	F444-I470 HydrophobicContact CE1-CD1 3.86Å; F444-I470 HydrophobicContact CZ-CD1 4.12Å; G468-I470 PolarHBondContact O-N 2.72Å; I470-Q472 VanDerWaalsContact C-N 3.31Å; I470-Q472 PolarHBondContact O-N 3.1Å; I470-C473 WeakPolarHBondContact O-CA 3.35Å; I470-C473 VanDerWaalsContact O-CB 3.26Å; I470-C473 WeakPolarHBondContact O-CB 3.47Å; I470-C473 PolarHBondContact O-N 3.32Å; I470-C473 VanDerWaalsContact O-N 3.14Å; I470-L474 HydrophobicContact CG2-CD1 4.37Å; I470-L474 WeakPolarHBondContact O-CG 3.27Å; I470-L474 PolarHBondContact O-N 3.45Å; I470-I484 HydrophobicContact CD1-CD1 4.05Å; I470-L508 HydrophobicContact CD1-CD1 3.61Å; I470-L508 HydrophobicContact CG1-CD1 3.4Å; I470-L528 HydrophobicContact CG2-CD1 3.79Å; I470-L528 HydrophobicContact CG2-CD2 3.58Å; I470-L528 HydrophobicContact CG2-CG 4.35Å
471	I	94.4	Very high	89.1	Confident	0 Å²	0	55.6 Å²	55.6	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-64.1	-41.1	174.2	-59.1	-50.1	0	0	0	110.4	W361 M365 P467 G468 C473 L474 K475 D519 L522 V526	W361-I471 HydrophobicContact CE3-CG2 4.04Å; W361-I471 HydrophobicContact CZ3-CG2 4.23Å; M365-I471 HydrophobicContact CE-CD1 3.82Å; M365-I471 HydrophobicContact CE-CG2 4.34Å; M365-I471 HydrophobicContact SD-CG2 3.74Å; P467-I471 HydrophobicContact CB-CB 3.69Å; P467-I471 HydrophobicContact CB-CG1 4.32Å; P467-I471 HydrophobicContact CB-CG2 3.57Å; P467-I471 HydrophobicContact CG-CG2 4.13Å; G468-I471 PolarHBondContact O-N 2.95Å; I471-C473 VanDerWaalsContact C-N 3.3Å; I471-C473 PolarHBondContact O-N 2.86Å; I471-L474 PolarHBondContact O-N 3.31Å; I471-K475 PolarHBondContact O-N 2.83Å; I471-D519 HydrophobicContact CD1-CB 4.24Å; I471-D519 HydrophobicContact CG1-CB 3.79Å; I471-D519 WeakPolarHBondContact CG1-OD2 3.29Å; I471-L522 HydrophobicContact CB-CD1 4.42Å; I471-L522 HydrophobicContact CD1-CD1 3.67Å; I471-L522 HydrophobicContact CG1-CD1 3.81Å; I471-L522 HydrophobicContact CG1-CG 4.41Å; I471-L522 HydrophobicContact CG2-CD1 3.72Å; I471-L522 HydrophobicContact CG2-CG 4.18Å; I471-V526 HydrophobicContact CD1-CB 4.43Å; I471-V526 HydrophobicContact CD1-CG1 4.36Å; I471-V526 HydrophobicContact CD1-CG2 3.93Å
472	Q	93.7	Very high	89.9	Confident	70 Å²	70	50 Å²	50	33%	0.327	26%	0.256	S	S	.	.	H	α-helix	trans	-60.9	-39.4	173.3	-61.8	-179	27.1	0	0	112.1	W361 P467 G468 I470 K476	W361-Q472 HydrophobicContact CH2-CG 3.99Å; W361-Q472 HydrophobicContact CZ3-CG 4.43Å; P467-Q472 PolarHBondContact O-NE2 3.34Å; G468-Q472 WeakPolarHBondContact O-CG 3.48Å; G468-Q472 PolarHBondContact O-N 3.45Å; I470-Q472 VanDerWaalsContact C-N 3.31Å; I470-Q472 PolarHBondContact O-N 3.1Å; Q472-K476 WeakPolarHBondContact O-CB 3.36Å; Q472-K476 PolarHBondContact O-N 2.93Å
473	C	94.2	Very high	90.8	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-60.1	-54.6	173.9	169.1	0	0	0	0	110.9	F442 K469 I470 I471 K475 K476 V477 I484	F442-C473 HydrophobicContact CB-CB 4.39Å; F442-C473 WeakPolarHBondContact CB-SG 3.36Å; F442-C473 HydrophobicContact CD1-CB 3.58Å; F442-C473 HydrophobicContact CD2-CB 3.96Å; F442-C473 HydrophobicContact CE1-CB 3.69Å; F442-C473 HydrophobicContact CE2-CB 4.05Å; F442-C473 HydrophobicContact CG-CB 3.72Å; F442-C473 WeakPolarHBondContact CG-SG 3.49Å; F442-C473 HydrophobicContact CZ-CB 3.93Å; K469-C473 VanDerWaalsContact O-CB 3.27Å; K469-C473 WeakPolarHBondContact O-CB 3.38Å; K469-C473 PolarHBondContact O-N 3.11Å; I470-C473 WeakPolarHBondContact O-CA 3.35Å; I470-C473 VanDerWaalsContact O-CB 3.26Å; I470-C473 WeakPolarHBondContact O-CB 3.47Å; I470-C473 PolarHBondContact O-N 3.32Å; I470-C473 VanDerWaalsContact O-N 3.14Å; I471-C473 VanDerWaalsContact C-N 3.3Å; I471-C473 PolarHBondContact O-N 2.86Å; C473-K475 VanDerWaalsContact C-N 3.32Å; C473-K475 PolarHBondContact O-N 3.47Å; C473-K476 PolarHBondContact O-N 3.16Å; C473-V477 WeakPolarHBondContact O-CG2 3.23Å; C473-V477 PolarHBondContact O-N 3.43Å; C473-I484 HydrophobicContact CB-CD1 4.27Å; C473-I484 VanDerWaalsContact SG-CD1 3.51Å
474	L	94.2	Very high	91.9	Very high	5 Å²	5	35.3 Å²	35.3	3%	0.026	18%	0.182	C	C	.	.	H	α-helix	trans	-58.8	-42.6	-178.3	-67.2	174	0	0	0	111.7	M365 P366 I470 I471 K476 K478 C479 P482 V526 L528	M365-L474 HydrophobicContact CE-CB 3.82Å; M365-L474 HydrophobicContact CE-CD1 3.61Å; M365-L474 HydrophobicContact CE-CG 4.37Å; M365-L474 HydrophobicContact SD-CB 4.07Å; P366-L474 HydrophobicContact CG-CB 4.33Å; I470-L474 HydrophobicContact CG2-CD1 4.37Å; I470-L474 WeakPolarHBondContact O-CG 3.27Å; I470-L474 PolarHBondContact O-N 3.45Å; I471-L474 PolarHBondContact O-N 3.31Å; L474-K476 VanDerWaalsContact C-N 3.33Å; L474-K476 PolarHBondContact O-N 3.48Å; L474-K478 WeakPolarHBondContact O-CA 3.42Å; L474-K478 PolarHBondContact O-N 2.61Å; L474-C479 WeakPolarHBondContact CD2-O 3.41Å; L474-P482 HydrophobicContact CD2-CG 4Å; L474-V526 HydrophobicContact CD1-CG1 4.2Å; L474-L528 HydrophobicContact CD1-CD2 3.87Å
475	K	92.2	Very high	92.7	Very high	53 Å²	53	32.1 Å²	32.1	23%	0.23	15%	0.149	C	C	.	.	H	α-helix	trans	-61.1	-39.1	173.1	-176.8	173	-175.3	168.2	0	112.6	D360 W361 I471 C473	D360-K475 IonicContact OD2-NZ 3.23Å; D360-K475 PolarHBondContact OD2-NZ 2.99Å; W361-K475 HydrophobicContact CD2-CD 4.23Å; W361-K475 HydrophobicContact CE3-CB 4.44Å; W361-K475 HydrophobicContact CE3-CD 3.43Å; W361-K475 VanDerWaalsContact CE3-CD 3.43Å; W361-K475 HydrophobicContact CH2-CD 3.71Å; W361-K475 HydrophobicContact CZ2-CD 4.46Å; W361-K475 HydrophobicContact CZ3-CB 3.9Å; W361-K475 HydrophobicContact CZ3-CD 3.15Å; W361-K475 HydrophobicContact CZ3-CG 4.13Å; I471-K475 PolarHBondContact O-N 2.83Å; C473-K475 VanDerWaalsContact C-N 3.32Å; C473-K475 PolarHBondContact O-N 3.47Å
476	K	93.7	Very high	93.2	Very high	157 Å²	157	31 Å²	31	68%	0.683	14%	0.142	S	C	*	.	H	α-helix	trans	-74.4	-46.2	-177.5	-172	-177.8	-176.7	178.6	0	112.6	F442 Q472 C473 L474	F442-K476 HydrophobicContact CD2-CD 4.1Å; F442-K476 HydrophobicContact CE2-CD 3.76Å; Q472-K476 WeakPolarHBondContact O-CB 3.36Å; Q472-K476 PolarHBondContact O-N 2.93Å; C473-K476 PolarHBondContact O-N 3.16Å; L474-K476 VanDerWaalsContact C-N 3.33Å; L474-K476 PolarHBondContact O-N 3.48Å
477	V	93	Very high	93.4	Very high	20 Å²	20	26 Å²	26	12%	0.121	12%	0.117	C	C	.	.	H	α-helix	trans	-79.3	-22.4	-178	-63.4	0	0	0	0	112.9	Q440 F442 C473 C479 P482	Q440-V477 HydrophobicContact CB-CB 3.84Å; Q440-V477 HydrophobicContact CB-CG1 4.08Å; Q440-V477 HydrophobicContact CG-CB 4.33Å; F442-V477 HydrophobicContact CB-CG1 4.11Å; F442-V477 HydrophobicContact CD2-CG1 4.45Å; C473-V477 WeakPolarHBondContact O-CG2 3.23Å; C473-V477 PolarHBondContact O-N 3.43Å; V477-C479 VanDerWaalsContact C-N 3.27Å; V477-C479 PolarHBondContact O-N 3.34Å; V477-P482 HydrophobicContact CB-CB 4.47Å; V477-P482 HydrophobicContact CG1-CB 4.49Å; V477-P482 HydrophobicContact CG2-CB 3.89Å; V477-P482 HydrophobicContact CG2-CG 3.96Å
478	K	90.9	Very high	93.3	Very high	153 Å²	153	29 Å²	29	67%	0.665	13%	0.131	S	C	*	.			trans	60.7	29.8	178.7	-52.9	178.3	179.6	178.9	0	114.4	P366 L474	P366-K478 WeakPolarHBondContact CB-O 3.39Å; L474-K478 WeakPolarHBondContact O-CA 3.42Å; L474-K478 PolarHBondContact O-N 2.61Å
479	C	91.6	Very high	93.2	Very high	3 Å²	3	29.1 Å²	29.1	2%	0.02	13%	0.132	C	C	.	.	S	Bend	trans	-143.8	157.7	170.5	64.6	0	0	0	0	111.6	K369 T371 Q440 L474 V477	K369-C479 CarbonylContact O-C 3.47Å; K369-C479 WeakPolarHBondContact O-CA 3.2Å; T371-C479 HydrophobicContact CG2-CB 4.14Å; Q440-C479 VanDerWaalsContact CG-SG 3.55Å; L474-C479 WeakPolarHBondContact CD2-O 3.41Å; V477-C479 VanDerWaalsContact C-N 3.27Å; V477-C479 PolarHBondContact O-N 3.34Å
480	E	92.2	Very high	93	Very high	23 Å²	23	26.6 Å²	26.6	11%	0.107	12%	0.121	C	C	.	.	S	Bend	trans	-85.5	-16.6	178.1	-67.8	-172	168.3	0	0	114.4	P366 W367 G368 K369 Q370 P482 K530	P366-E480 HydrophobicContact CG-CG 4.48Å; P366-E480 WeakPolarHBondContact O-CG 3.32Å; W367-E480 WeakPolarHBondContact CA-OE1 3.39Å; G368-E480 PolarHBondContact N-OE1 3.27Å; K369-E480 PolarHBondContact O-N 2.86Å; Q370-E480 HydrophobicContact CG-CB 4.3Å; E480-P482 VanDerWaalsContact O-CD 3.29Å; E480-P482 WeakPolarHBondContact O-CD 3.49Å; E480-K530 IonicContact OE2-NZ 3.42Å; E480-K530 PolarHBondContact OE2-NZ 3.17Å
481	N	92	Very high	92.6	Very high	1 Å²	1	30 Å²	30	1%	0.005	14%	0.136	C	C	.	.	S	Bend	trans	-112.5	41.2	-177.8	66.5	-26.4	0	0	0	114.8	Q370 T371 R439 K530	Q370-N481 WeakPolarHBondContact CA-OD1 3.21Å; T371-N481 PolarHBondContact N-OD1 3.44Å; T371-N481 PolarHBondContact O-ND2 3.15Å; T371-N481 PolarHBondContact OG1-OD1 2.75Å; R439-N481 PolarHBondContact NH1-O 3.33Å; R439-N481 VanDerWaalsContact NH1-O 3.09Å; N481-K530 HydrophobicContact CB-CB 4.08Å
482	P	94.4	Very high	91.9	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	14%	0.137	C	C	.	.			trans	-66.5	163	176	31.9	-35.7	0	0	0	111.7	R439 Q440 L474 V477 E480 I484 V531 L532	R439-P482 PolarHBondContact NH1-O 2.92Å; Q440-P482 HydrophobicContact CB-CB 4.34Å; Q440-P482 CarbonylContact O-C 3.42Å; Q440-P482 WeakPolarHBondContact O-CA 3.23Å; L474-P482 HydrophobicContact CD2-CG 4Å; V477-P482 HydrophobicContact CB-CB 4.47Å; V477-P482 HydrophobicContact CG1-CB 4.49Å; V477-P482 HydrophobicContact CG2-CB 3.89Å; V477-P482 HydrophobicContact CG2-CG 3.96Å; E480-P482 VanDerWaalsContact O-CD 3.29Å; E480-P482 WeakPolarHBondContact O-CD 3.49Å; P482-I484 HydrophobicContact CB-CG1 4.5Å; P482-I484 HydrophobicContact CG-CD1 4.36Å; P482-I484 HydrophobicContact CG-CG1 4.17Å; P482-V531 HydrophobicContact CG-CG1 4.45Å; P482-V531 HydrophobicContact CG-CG2 4.45Å; P482-L532 PolarHBondContact O-N 3.4Å
483	L	94.1	Very high	90.5	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	120.8	160.8	-172.7	162.8	0	0	0	108.3	I433 R439 Q440 Y441 F442 L532 I534	I433-L483 HydrophobicContact CB-CD1 4.09Å; I433-L483 HydrophobicContact CG2-CD1 3.66Å; R439-L483 HydrophobicContact CB-CB 4.22Å; Q440-L483 PolarHBondContact O-N 3.44Å; Y441-L483 HydrophobicContact CD2-CD2 4.06Å; Y441-L483 HydrophobicContact CE2-CD2 4.24Å; F442-L483 PolarHBondContact N-O 3.49Å; L483-L532 CarbonylContact C-O 3.46Å; L483-L532 VanDerWaalsContact CA-O 3.31Å; L483-L532 WeakPolarHBondContact CA-O 3.34Å; L483-L532 HydrophobicContact CD1-CD2 3.85Å; L483-L532 HydrophobicContact CD1-CG 4.35Å; L483-L532 HydrophobicContact CG-CB 4.44Å; L483-L532 HydrophobicContact CG-CD2 4.17Å; L483-L532 HydrophobicContact CG-CG 4.15Å; L483-I534 HydrophobicContact CD1-CD1 3.81Å; L483-I534 HydrophobicContact CD2-CD1 4.09Å; L483-I534 HydrophobicContact CD2-CG1 4.26Å; L483-I534 HydrophobicContact CG-CD1 4.2Å; L483-I534 HydrophobicContact CG-CG1 4.43Å
484	I	95.4	Very high	88.9	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	117.8	179.4	-61.2	-172.3	0	0	0	109.6	F442 F444 I470 C473 P482 I486 V531 L532 F533 I534	F442-I484 WeakPolarHBondContact O-CA 3.44Å; F444-I484 HydrophobicContact CD1-CG2 4.07Å; F444-I484 HydrophobicContact CE1-CG2 3.57Å; I470-I484 HydrophobicContact CD1-CD1 4.05Å; C473-I484 HydrophobicContact CB-CD1 4.27Å; C473-I484 VanDerWaalsContact SG-CD1 3.51Å; P482-I484 HydrophobicContact CB-CG1 4.5Å; P482-I484 HydrophobicContact CG-CD1 4.36Å; P482-I484 HydrophobicContact CG-CG1 4.17Å; I484-I486 HydrophobicContact CG2-CG1 4.33Å; I484-V531 HydrophobicContact CB-CG1 4.15Å; I484-V531 HydrophobicContact CD1-CG1 3.55Å; I484-V531 HydrophobicContact CG1-CG1 3.63Å; I484-L532 PolarHBondContact N-O 3.03Å; I484-F533 HydrophobicContact CB-CD1 3.95Å; I484-F533 HydrophobicContact CB-CE1 4.12Å; I484-F533 HydrophobicContact CD1-CE1 4.05Å; I484-F533 HydrophobicContact CG2-CD1 4.2Å; I484-F533 HydrophobicContact CG2-CE1 4.31Å; I484-F533 WeakPolarHBondContact O-CA 3.4Å; I484-I534 PolarHBondContact O-N 3.42Å
485	L	96.1	Very high	86.9	Confident	0 Å²	0	39 Å²	39	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	116.7	170.7	-176	65.7	0	0	0	110.7	T427 A430 Y441 F442 R443 F444 I534 T536	T427-L485 HydrophobicContact CG2-CD2 3.47Å; T427-L485 VanDerWaalsContact CG2-CD2 3.47Å; A430-L485 HydrophobicContact CB-CB 4.45Å; A430-L485 HydrophobicContact CB-CD1 3.59Å; A430-L485 HydrophobicContact CB-CD2 3.94Å; A430-L485 HydrophobicContact CB-CG 4.21Å; Y441-L485 HydrophobicContact CE2-CB 4.09Å; Y441-L485 WeakPolarHBondContact OH-CD2 3.42Å; F442-L485 PolarHBondContact O-N 2.77Å; R443-L485 WeakPolarHBondContact CA-O 3.39Å; R443-L485 HydrophobicContact CB-CB 4.21Å; R443-L485 HydrophobicContact CG-CB 4.25Å; R443-L485 HydrophobicContact CG-CD2 4.03Å; R443-L485 HydrophobicContact CG-CG 4.38Å; F444-L485 PolarHBondContact N-O 3.5Å; F444-L485 VanDerWaalsContact N-O 3.08Å; L485-I534 CarbonylContact C-O 3.56Å; L485-I534 WeakPolarHBondContact CA-O 3.48Å; L485-I534 HydrophobicContact CD1-CB 3.98Å; L485-I534 HydrophobicContact CD1-CG2 3.68Å; L485-I534 WeakPolarHBondContact CD1-O 3.16Å; L485-T536 HydrophobicContact CD1-CG2 3.59Å; L485-T536 HydrophobicContact CD2-CG2 4.3Å; L485-T536 HydrophobicContact CG-CG2 4.3Å
486	I	94.8	Very high	84.9	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	100.1	171	-51.1	-176.1	0	0	0	107.8	F444 V446 I484 V489 L505 L508 L509 F533 I534 C535 T536	F444-I486 HydrophobicContact CE1-CG1 4.15Å; F444-I486 HydrophobicContact CE2-CG2 4.32Å; F444-I486 HydrophobicContact CZ-CD1 4.29Å; F444-I486 HydrophobicContact CZ-CG1 3.92Å; F444-I486 HydrophobicContact CZ-CG2 4.39Å; V446-I486 HydrophobicContact CB-CG2 4.48Å; V446-I486 HydrophobicContact CG1-CG2 3.42Å; V446-I486 VanDerWaalsContact CG1-CG2 3.42Å; V446-I486 HydrophobicContact CG2-CG2 4.24Å; I484-I486 HydrophobicContact CG2-CG1 4.33Å; I486-V489 HydrophobicContact CB-CG1 4.4Å; I486-V489 HydrophobicContact CG2-CG1 3.76Å; I486-L505 HydrophobicContact CD1-CD2 4.1Å; I486-L505 HydrophobicContact CG2-CD2 4.47Å; I486-L508 HydrophobicContact CD1-CD2 3.96Å; I486-L509 HydrophobicContact CD1-CD2 3.87Å; I486-L509 HydrophobicContact CD1-CG 4.48Å; I486-F533 HydrophobicContact CD1-CD1 4.12Å; I486-I534 PolarHBondContact N-O 3.08Å; I486-C535 CarbonylContact O-C 3.41Å; I486-C535 VanDerWaalsContact O-CA 3.29Å; I486-C535 WeakPolarHBondContact O-CA 3.49Å; I486-T536 PolarHBondContact O-N 2.81Å
487	D	94	Very high	82.9	Confident	7 Å²	7	42 Å²	42	4%	0.037	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	144.8	-173.3	-146.2	26.3	0	0	0	110.9	T427 R443 F444 S445 V446 T536	T427-D487 PolarHBondContact OG1-OD1 3.5Å; R443-D487 IonicContact CZ-OD2 2.98Å; R443-D487 IonicContact NE-OD2 2.83Å; R443-D487 PolarHBondContact NE-OD2 3.26Å; R443-D487 IonicContact NH2-OD2 3.81Å; R443-D487 PolarHBondContact NH2-OD2 2.93Å; F444-D487 PolarHBondContact O-N 3.21Å; S445-D487 WeakPolarHBondContact CA-O 3.45Å; S445-D487 PolarHBondContact OG-O 3.44Å; V446-D487 WeakPolarHBondContact CG2-O 3.48Å; V446-D487 PolarHBondContact N-O 2.93Å; D487-T536 WeakPolarHBondContact CA-OG1 3.46Å; D487-T536 WeakPolarHBondContact OD1-CB 3.41Å; D487-T536 WeakPolarHBondContact OD1-CG2 3.48Å; D487-T536 PolarHBondContact OD1-OG1 2.94Å
488	E	91.2	Very high	80.8	Confident	66 Å²	66	49.4 Å²	49.4	31%	0.308	26%	0.256	S	S	.	.			trans	62	46	172.6	-54.1	180	134.2	0	0	114.9	S445 V446 D490 K491 T536	S445-E488 PolarHBondContact OG-OE2 3.45Å; V446-E488 WeakPolarHBondContact CG2-O 3.3Å; E488-D490 PolarHBondContact O-N 2.93Å; E488-D490 VanDerWaalsContact O-N 3.13Å; E488-K491 HydrophobicContact CB-CB 4.46Å; E488-K491 HydrophobicContact CB-CG 3.99Å; E488-K491 WeakPolarHBondContact O-CB 3.12Å; E488-K491 PolarHBondContact O-N 3.35Å; E488-T536 WeakPolarHBondContact CA-O 3.25Å; E488-T536 PolarHBondContact N-O 3.45Å; E488-T536 VanDerWaalsContact N-O 3.09Å; E488-T536 PolarHBondContact N-OG1 3.35Å; E488-T536 VanDerWaalsContact N-OG1 3.14Å
489	V	90.4	Very high	79.3	Confident	1 Å²	1	44 Å²	44	1%	0.006	24%	0.243	C	C	.	.	G	3₁₀ helix	trans	-62.6	-19.7	177.7	-57.6	0	0	0	0	113.4	V446 I486 K491 I492 C535 T536 A537 I543	V446-V489 HydrophobicContact CG2-CB 4.42Å; V446-V489 HydrophobicContact CG2-CG1 4.15Å; I486-V489 HydrophobicContact CB-CG1 4.4Å; I486-V489 HydrophobicContact CG2-CG1 3.76Å; V489-K491 PolarHBondContact O-N 2.94Å; V489-I492 WeakPolarHBondContact O-CG2 3.33Å; V489-I492 PolarHBondContact O-N 3.21Å; V489-C535 HydrophobicContact CG1-CB 3.95Å; V489-C535 HydrophobicContact CG2-CB 4.37Å; V489-T536 WeakPolarHBondContact CG2-O 3.34Å; V489-T536 PolarHBondContact N-O 3.41Å; V489-A537 HydrophobicContact CG2-CB 3.96Å; V489-I543 HydrophobicContact CG2-CD1 3.98Å; V489-I543 HydrophobicContact CG2-CG1 4.2Å
490	D	88.6	Confident	78.2	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	26%	0.263	C	S	.	.	G	3₁₀ helix	trans	-68.7	-8.9	172.5	69.3	-77.7	0	0	0	114.1	E488 A537 N538 V539 T542 I543	E488-D490 PolarHBondContact O-N 2.93Å; E488-D490 VanDerWaalsContact O-N 3.13Å; D490-A537 HydrophobicContact CB-CB 4.16Å; D490-A537 WeakPolarHBondContact OD1-CA 3.01Å; D490-N538 PolarHBondContact OD1-N 3.21Å; D490-V539 VanDerWaalsContact CB-O 3.23Å; D490-V539 WeakPolarHBondContact CB-O 2.99Å; D490-T542 WeakPolarHBondContact CB-OG1 3.35Å; D490-T542 PolarHBondContact O-OG1 3.5Å; D490-I543 HydrophobicContact CB-CG1 4.47Å
491	K	84.5	Confident	77.5	Confident	72 Å²	72	46.9 Å²	46.9	31%	0.313	26%	0.26	S	S	.	.	G	3₁₀ helix	trans	-99.1	1.3	178.2	-57.5	-56.6	-179.8	-159.7	0	113.3	E488 V489	E488-K491 HydrophobicContact CB-CB 4.46Å; E488-K491 HydrophobicContact CB-CG 3.99Å; E488-K491 WeakPolarHBondContact O-CB 3.12Å; E488-K491 PolarHBondContact O-N 3.35Å; V489-K491 PolarHBondContact O-N 2.94Å
492	I	78.1	Confident	77	Confident	7 Å²	7	46.9 Å²	46.9	4%	0.036	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.6	152.5	174	-153.2	162.3	0	0	0	111.4	V489 R494 P501 A502 L505 P544	V489-I492 WeakPolarHBondContact O-CG2 3.33Å; V489-I492 PolarHBondContact O-N 3.21Å; I492-R494 PolarHBondContact O-N 3.15Å; I492-R494 VanDerWaalsContact O-N 3.13Å; I492-P501 HydrophobicContact CD1-CB 4.27Å; I492-P501 HydrophobicContact CD1-CG 4.28Å; I492-P501 HydrophobicContact CG1-CB 4.48Å; I492-P501 HydrophobicContact CG1-CG 3.96Å; I492-A502 HydrophobicContact CD1-CB 3.87Å; I492-A502 HydrophobicContact CG1-CB 4.3Å; I492-L505 HydrophobicContact CD1-CD1 3.29Å; I492-L505 HydrophobicContact CD1-CG 4.14Å; I492-P544 HydrophobicContact CG2-CG 3.85Å
493	G	64.2	Low	76.4	Confident	51 Å²	51	49.7 Å²	49.7	53%	0.526	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.7	-0.8	172.3	0	0	0	0	0	116.4	A495	G493-A495 VanDerWaalsContact C-N 3.29Å
494	R	60.5	Low	76.1	Confident	154 Å²	154	49.7 Å²	49.7	58%	0.581	28%	0.28	S	S	*	.			trans	-73.2	-23	174.6	-65.5	-172.5	-170.6	-153.3	-5.3	113.2	I492	I492-R494 PolarHBondContact O-N 3.15Å; I492-R494 VanDerWaalsContact O-N 3.13Å
495	A	52.6	Low	75.7	Confident	52 Å²	52	49.7 Å²	49.7	43%	0.43	28%	0.28	S	S	.	.	S	Bend	trans	-85.2	129.9	174.4	0	0	0	0	0	108.7	T450 G493	T450-A495 HydrophobicContact CG2-CB 3.58Å; G493-A495 VanDerWaalsContact C-N 3.29Å
496	G	51.7	Low	75.2	Confident	57 Å²	57	51.4 Å²	51.4	59%	0.588	29%	0.289	S	S	*	.			trans	-56.6	171.1	-172.2	0	0	0	0	0	115	H498	G496-H498 PolarHBondContact O-N 2.94Å
497	F	50.3	Low	74.9	Confident	216 Å²	216	53.3 Å²	53.3	95%	0.947	30%	0.298	S	S	*	.	S	Bend	trans	-32.7	-1.4	-174.5	-70.6	-92.2	0	0	0	121.8	G499	F497-G499 PolarHBondContact O-N 3.34Å; F497-G499 VanDerWaalsContact O-N 3.16Å
498	H	49.8	Very low	74.6	Confident	174 Å²	174	53 Å²	53	81%	0.806	30%	0.296	S	S	*	.	S	Bend	trans	-84.6	84.1	176.3	-75	72.5	0	0	0	111.1	G496	G496-H498 PolarHBondContact O-N 2.94Å
499	G	58.5	Low	74.4	Confident	39 Å²	39	50 Å²	50	40%	0.402	28%	0.282	S	S	.	.			trans	83.1	126.9	179.3	0	0	0	0	0	111.8	F497 P501	F497-G499 PolarHBondContact O-N 3.34Å; F497-G499 VanDerWaalsContact O-N 3.16Å; G499-P501 WeakPolarHBondContact O-CD 3.46Å
500	D	69.2	Low	74.2	Confident	82 Å²	82	50.8 Å²	50.8	44%	0.439	29%	0.286	S	S	.	.			trans	-99.3	93.9	174.2	-174.9	11.5	0	0	0	109.3	A502 S503	D500-A502 PolarHBondContact O-N 3.24Å; D500-A502 WeakPolarHBondContact OD1-CA 3.17Å; D500-A502 WeakPolarHBondContact OD1-CB 3.37Å; D500-A502 PolarHBondContact OD1-N 3.18Å; D500-S503 WeakPolarHBondContact O-CB 3.12Å; D500-S503 PolarHBondContact O-N 3.3Å; D500-S503 PolarHBondContact O-OG 2.93Å
501	P	77.7	Confident	73.8	Confident	5 Å²	5	52.8 Å²	52.8	3%	0.032	30%	0.299	C	S	.	.	H	α-helix	trans	-57.8	-19.6	174.2	23.7	-33.2	0	0	0	112.2	M449 I455 I492 G499 S503 A504 L505	M449-P501 HydrophobicContact CB-CB 4.49Å; I455-P501 HydrophobicContact CD1-CB 4.35Å; I492-P501 HydrophobicContact CD1-CB 4.27Å; I492-P501 HydrophobicContact CD1-CG 4.28Å; I492-P501 HydrophobicContact CG1-CB 4.48Å; I492-P501 HydrophobicContact CG1-CG 3.96Å; G499-P501 WeakPolarHBondContact O-CD 3.46Å; P501-S503 VanDerWaalsContact C-N 3.26Å; P501-S503 PolarHBondContact O-N 2.72Å; P501-A504 PolarHBondContact O-N 3.11Å; P501-L505 PolarHBondContact O-N 3.45Å
502	A	81.1	Confident	73.6	Confident	1 Å²	1	56.5 Å²	56.5	1%	0.008	32%	0.318	C	S	.	.	H	α-helix	trans	-64.7	-31.8	173.7	0	0	0	0	0	111.7	I492 D500 A504 L505 L506 P544 L547	I492-A502 HydrophobicContact CD1-CB 3.87Å; I492-A502 HydrophobicContact CG1-CB 4.3Å; D500-A502 PolarHBondContact O-N 3.24Å; D500-A502 WeakPolarHBondContact OD1-CA 3.17Å; D500-A502 WeakPolarHBondContact OD1-CB 3.37Å; D500-A502 PolarHBondContact OD1-N 3.18Å; A502-A504 VanDerWaalsContact C-N 3.34Å; A502-A504 PolarHBondContact O-N 2.7Å; A502-L505 PolarHBondContact O-N 2.73Å; A502-L506 WeakPolarHBondContact O-CB 3.32Å; A502-L506 VanDerWaalsContact O-CG 3.24Å; A502-L506 WeakPolarHBondContact O-CG 3.39Å; A502-L506 PolarHBondContact O-N 2.88Å; A502-P544 HydrophobicContact CB-CG 4.13Å; A502-L547 HydrophobicContact CB-CD1 4.02Å
503	S	82.6	Confident	74	Confident	59 Å²	59	60.1 Å²	60.1	41%	0.413	33%	0.334	S	S	.	.	H	α-helix	trans	-65.2	-38.9	175.9	82.6	0	0	0	0	111.9	D500 P501 L506 E507	D500-S503 WeakPolarHBondContact O-CB 3.12Å; D500-S503 PolarHBondContact O-N 3.3Å; D500-S503 PolarHBondContact O-OG 2.93Å; P501-S503 VanDerWaalsContact C-N 3.26Å; P501-S503 PolarHBondContact O-N 2.72Å; S503-L506 WeakPolarHBondContact O-CB 3.5Å; S503-L506 PolarHBondContact O-N 3.42Å; S503-E507 PolarHBondContact O-N 2.91Å
504	A	86.6	Confident	75.1	Confident	0 Å²	0	58.3 Å²	58.3	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-70.5	-37.7	175.8	0	0	0	0	0	112.3	V452 I455 K456 P501 A502 L506 L508	V452-A504 HydrophobicContact CG1-CB 4Å; I455-A504 HydrophobicContact CB-CB 4.01Å; I455-A504 HydrophobicContact CD1-CB 4.08Å; I455-A504 HydrophobicContact CG2-CB 3.98Å; K456-A504 HydrophobicContact CG-CB 4.1Å; P501-A504 PolarHBondContact O-N 3.11Å; A502-A504 VanDerWaalsContact C-N 3.34Å; A502-A504 PolarHBondContact O-N 2.7Å; A504-L506 VanDerWaalsContact C-N 3.32Å; A504-L508 WeakPolarHBondContact O-CB 3.25Å; A504-L508 PolarHBondContact O-N 2.86Å; A504-L508 VanDerWaalsContact O-N 3.15Å
505	L	87.9	Confident	76.4	Confident	1 Å²	1	54.6 Å²	54.6	1%	0.005	30%	0.302	C	S	.	.	H	α-helix	trans	-64.9	-37.1	170.8	-73.6	-174.7	0	0	0	111.9	V446 I455 I486 I492 P501 A502 L508 L509 L547	V446-L505 HydrophobicContact CG1-CD1 3.99Å; V446-L505 HydrophobicContact CG1-CD2 4.31Å; I455-L505 HydrophobicContact CD1-CD2 3.6Å; I455-L505 HydrophobicContact CD1-CG 3.65Å; I455-L505 HydrophobicContact CG1-CD2 4.49Å; I486-L505 HydrophobicContact CD1-CD2 4.1Å; I486-L505 HydrophobicContact CG2-CD2 4.47Å; I492-L505 HydrophobicContact CD1-CD1 3.29Å; I492-L505 HydrophobicContact CD1-CG 4.14Å; P501-L505 PolarHBondContact O-N 3.45Å; A502-L505 PolarHBondContact O-N 2.73Å; L505-L508 PolarHBondContact O-N 3.1Å; L505-L509 HydrophobicContact CB-CD1 4.48Å; L505-L509 WeakPolarHBondContact O-CB 3.39Å; L505-L509 WeakPolarHBondContact O-CG 3.12Å; L505-L509 PolarHBondContact O-N 3.31Å; L505-L547 HydrophobicContact CB-CD1 4.5Å; L505-L547 HydrophobicContact CB-CD2 4.17Å
506	L	85.3	Confident	78.1	Confident	36 Å²	36	56.4 Å²	56.4	19%	0.188	30%	0.304	C	S	.	.	H	α-helix	trans	-59.7	-49.3	177.8	-80.1	166.3	0	0	0	110.8	A502 S503 A504 L508 L509 D510 P546 L547 R550	A502-L506 WeakPolarHBondContact O-CB 3.32Å; A502-L506 VanDerWaalsContact O-CG 3.24Å; A502-L506 WeakPolarHBondContact O-CG 3.39Å; A502-L506 PolarHBondContact O-N 2.88Å; S503-L506 WeakPolarHBondContact O-CB 3.5Å; S503-L506 PolarHBondContact O-N 3.42Å; A504-L506 VanDerWaalsContact C-N 3.32Å; L506-L508 VanDerWaalsContact C-N 3.32Å; L506-L508 PolarHBondContact O-N 3.49Å; L506-L509 PolarHBondContact O-N 3.47Å; L506-D510 WeakPolarHBondContact O-CB 3.16Å; L506-D510 PolarHBondContact O-N 3.36Å; L506-P546 HydrophobicContact CD1-CB 4.07Å; L506-P546 HydrophobicContact CD2-CB 3.83Å; L506-L547 HydrophobicContact CB-CD2 4.49Å; L506-L547 HydrophobicContact CD2-CD2 3.53Å; L506-L547 HydrophobicContact CD2-CG 3.78Å; L506-L547 HydrophobicContact CG-CD2 3.72Å; L506-L547 HydrophobicContact CG-CG 3.97Å; L506-R550 PolarHBondContact O-NH1 3.27Å
507	E	87.2	Confident	80.1	Confident	39 Å²	39	53.7 Å²	53.7	18%	0.182	28%	0.276	C	S	.	.	H	α-helix	trans	-61.5	-39.7	177.5	-174.5	172.5	133	0	0	112.6	K456 S503 Q513 F517	K456-E507 WeakPolarHBondContact CE-OE1 3.32Å; K456-E507 WeakPolarHBondContact CE-OE2 3.36Å; K456-E507 IonicContact NZ-OE1 3.52Å; K456-E507 PolarHBondContact NZ-OE1 3.27Å; K456-E507 IonicContact NZ-OE2 2.68Å; K456-E507 PolarHBondContact NZ-OE2 2.9Å; S503-E507 PolarHBondContact O-N 2.91Å; E507-Q513 HydrophobicContact CG-CB 3.97Å; E507-F517 HydrophobicContact CG-CD2 4.48Å
508	L	89	Confident	82.1	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-68.3	-37.5	178.4	176.5	157	0	0	0	113	I455 I470 I486 A504 L505 L506 N514 F517 F533	I455-L508 HydrophobicContact CG2-CD1 3.81Å; I470-L508 HydrophobicContact CD1-CD1 3.61Å; I470-L508 HydrophobicContact CG1-CD1 3.4Å; I486-L508 HydrophobicContact CD1-CD2 3.96Å; A504-L508 WeakPolarHBondContact O-CB 3.25Å; A504-L508 PolarHBondContact O-N 2.86Å; A504-L508 VanDerWaalsContact O-N 3.15Å; L505-L508 PolarHBondContact O-N 3.1Å; L506-L508 VanDerWaalsContact C-N 3.32Å; L506-L508 PolarHBondContact O-N 3.49Å; L508-N514 VanDerWaalsContact O-CB 3.31Å; L508-N514 WeakPolarHBondContact O-CB 3.18Å; L508-F517 HydrophobicContact CB-CD2 4.45Å; L508-F517 HydrophobicContact CB-CE2 4.13Å; L508-F533 HydrophobicContact CD2-CD1 3.71Å; L508-F533 HydrophobicContact CD2-CD2 4.44Å; L508-F533 HydrophobicContact CD2-CE1 3.34Å; L508-F533 HydrophobicContact CD2-CE2 4.12Å; L508-F533 HydrophobicContact CD2-CG 4.24Å; L508-F533 HydrophobicContact CD2-CZ 3.56Å; L508-F533 HydrophobicContact CG-CE1 4.05Å; L508-F533 HydrophobicContact CG-CZ 3.94Å
509	L	86.9	Confident	84.1	Confident	4 Å²	4	38.1 Å²	38.1	2%	0.021	21%	0.209	C	C	.	.	H	α-helix	trans	-89.8	-8.4	-177.6	-69.1	179.6	0	0	0	112.8	I415 I486 L505 L506 P511 F533 L547 M551	I415-L509 HydrophobicContact CD1-CB 3.38Å; I415-L509 HydrophobicContact CD1-CD1 4.23Å; I415-L509 HydrophobicContact CD1-CD2 3.49Å; I415-L509 VanDerWaalsContact CD1-CD2 3.49Å; I415-L509 HydrophobicContact CD1-CG 3.83Å; I415-L509 WeakPolarHBondContact CD1-O 3.48Å; I415-L509 HydrophobicContact CG1-CD2 4.26Å; I415-L509 HydrophobicContact CG2-CD2 4.49Å; I486-L509 HydrophobicContact CD1-CD2 3.87Å; I486-L509 HydrophobicContact CD1-CG 4.48Å; L505-L509 HydrophobicContact CB-CD1 4.48Å; L505-L509 WeakPolarHBondContact O-CB 3.39Å; L505-L509 WeakPolarHBondContact O-CG 3.12Å; L505-L509 PolarHBondContact O-N 3.31Å; L506-L509 PolarHBondContact O-N 3.47Å; L509-P511 WeakPolarHBondContact O-CD 3.21Å; L509-F533 HydrophobicContact CD2-CB 3.59Å; L509-F533 HydrophobicContact CD2-CD1 4.1Å; L509-F533 HydrophobicContact CD2-CD2 4.07Å; L509-F533 HydrophobicContact CD2-CG 3.65Å; L509-L547 HydrophobicContact CD1-CD2 3.86Å; L509-M551 HydrophobicContact CD1-CE 3.89Å
510	D	85.4	Confident	85.7	Confident	18 Å²	18	39.3 Å²	39.3	10%	0.096	20%	0.203	C	C	.	.			trans	-80.5	117.8	176	-153	-22.9	0	0	0	111.2	L506 E512 Q513 N514 R550	L506-D510 WeakPolarHBondContact O-CB 3.16Å; L506-D510 PolarHBondContact O-N 3.36Å; D510-E512 PolarHBondContact O-N 3.17Å; D510-E512 PolarHBondContact OD1-N 3.26Å; D510-E512 VanDerWaalsContact OD1-N 3.14Å; D510-Q513 HydrophobicContact CB-CB 3.95Å; D510-Q513 HydrophobicContact CB-CG 4.04Å; D510-Q513 PolarHBondContact O-N 2.72Å; D510-Q513 VanDerWaalsContact O-N 3.11Å; D510-Q513 PolarHBondContact OD2-NE2 2.76Å; D510-N514 WeakPolarHBondContact O-CB 3.25Å; D510-N514 PolarHBondContact O-N 3.3Å; D510-N514 PolarHBondContact O-ND2 2.83Å; D510-N514 PolarHBondContact O-OD1 3.11Å; D510-R550 IonicContact OD1-NH1 2.72Å; D510-R550 IonicContact OD1-NH2 3.45Å; D510-R550 IonicContact OD2-CZ 3.47Å; D510-R550 IonicContact OD2-NH1 3.58Å; D510-R550 PolarHBondContact OD2-NH1 3.28Å; D510-R550 IonicContact OD2-NH2 2.7Å; D510-R550 PolarHBondContact OD2-NH2 2.95Å
511	P	80.1	Confident	86.8	Confident	41 Å²	41	35.9 Å²	35.9	27%	0.266	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-27.9	170.7	-23.6	35.5	0	0	0	113.3	L509 Q513 N514	L509-P511 WeakPolarHBondContact O-CD 3.21Å; P511-Q513 VanDerWaalsContact C-N 3.34Å; P511-N514 PolarHBondContact O-OD1 2.85Å
512	E	81.6	Confident	87.5	Confident	151 Å²	151	35.7 Å²	35.7	71%	0.706	18%	0.183	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.1	-14.6	-180	-64.9	-65.2	156.5	0	0	113.3	D510 H515	D510-E512 PolarHBondContact O-N 3.17Å; D510-E512 PolarHBondContact OD1-N 3.26Å; D510-E512 VanDerWaalsContact OD1-N 3.14Å; E512-H515 PolarHBondContact O-CE1 2.75Å; E512-H515 PolarHBondContact O-ND1 3.33Å
513	Q	85.6	Confident	87.9	Confident	82 Å²	82	40 Å²	40	38%	0.383	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-119.8	-28.2	-178.1	-56.9	178.9	56.9	0	0	112.9	E507 D510 P511 H515 N516 F517	E507-Q513 HydrophobicContact CG-CB 3.97Å; D510-Q513 HydrophobicContact CB-CB 3.95Å; D510-Q513 HydrophobicContact CB-CG 4.04Å; D510-Q513 PolarHBondContact O-N 2.72Å; D510-Q513 VanDerWaalsContact O-N 3.11Å; D510-Q513 PolarHBondContact OD2-NE2 2.76Å; P511-Q513 VanDerWaalsContact C-N 3.34Å; Q513-H515 PolarHBondContact O-N 2.78Å; Q513-N516 CarbonylContact O-C 3.54Å; Q513-N516 PolarHBondContact O-N 3.34Å; Q513-F517 PolarHBondContact O-N 3.41Å
514	N	88	Confident	88.3	Confident	13 Å²	13	37.8 Å²	37.8	7%	0.07	19%	0.19	C	C	.	.	G	3₁₀ helix	trans	-68.4	-17.8	-172.8	72.7	5.1	0	0	0	114.1	L508 D510 P511 N516 L528	L508-N514 VanDerWaalsContact O-CB 3.31Å; L508-N514 WeakPolarHBondContact O-CB 3.18Å; D510-N514 WeakPolarHBondContact O-CB 3.25Å; D510-N514 PolarHBondContact O-N 3.3Å; D510-N514 PolarHBondContact O-ND2 2.83Å; D510-N514 PolarHBondContact O-OD1 3.11Å; P511-N514 PolarHBondContact O-OD1 2.85Å; N514-N516 PolarHBondContact O-N 2.88Å; N514-L528 HydrophobicContact CB-CB 4.22Å; N514-L528 WeakPolarHBondContact O-CB 3.36Å; N514-L528 PolarHBondContact O-N 2.82Å
515	H	87.8	Confident	88.5	Confident	77 Å²	77	40 Å²	40	36%	0.356	20%	0.203	S	C	.	.	G	3₁₀ helix	trans	-68.6	-21.5	172.2	71.5	-91.9	0	0	0	113.1	E512 Q513 D527 S529	E512-H515 PolarHBondContact O-CE1 2.75Å; E512-H515 PolarHBondContact O-ND1 3.33Å; Q513-H515 PolarHBondContact O-N 2.78Å; H515-D527 WeakPolarHBondContact O-CA 3.3Å; H515-S529 VanDerWaalsContact CA-OG 3.31Å; H515-S529 WeakPolarHBondContact CA-OG 3.27Å; H515-S529 WeakPolarHBondContact CB-OG 3.19Å
516	N	88.9	Confident	88.7	Confident	89 Å²	89	40.1 Å²	40.1	48%	0.476	20%	0.204	S	C	.	.	G	3₁₀ helix	trans	-124.3	36.5	179.4	-83.7	-31.3	0	0	0	111.1	Q513 N514 L518 T525	Q513-N516 CarbonylContact O-C 3.54Å; Q513-N516 PolarHBondContact O-N 3.34Å; N514-N516 PolarHBondContact O-N 2.88Å; N516-L518 PolarHBondContact O-N 3.03Å; N516-T525 HydrophobicContact CB-CG2 4.46Å
517	F	92.8	Very high	89	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.8	121.9	-177.4	-179.8	-95.5	0	0	0	111.2	I455 K456 E507 L508 Q513 D519 T525 V526 L528	I455-F517 HydrophobicContact CG2-CZ 4.4Å; K456-F517 HydrophobicContact CG-CE2 4.35Å; K456-F517 HydrophobicContact CG-CZ 4.06Å; E507-F517 HydrophobicContact CG-CD2 4.48Å; L508-F517 HydrophobicContact CB-CD2 4.45Å; L508-F517 HydrophobicContact CB-CE2 4.13Å; Q513-F517 PolarHBondContact O-N 3.41Å; F517-D519 HydrophobicContact CE1-CB 4.3Å; F517-T525 CarbonylContact O-C 3.46Å; F517-T525 WeakPolarHBondContact O-CA 3.45Å; F517-V526 WeakPolarHBondContact CB-O 3.25Å; F517-V526 PolarHBondContact N-O 3.45Å; F517-V526 VanDerWaalsContact N-O 3.14Å; F517-V526 PolarHBondContact O-N 2.89Å; F517-L528 HydrophobicContact CB-CD1 3.57Å; F517-L528 HydrophobicContact CB-CG 3.89Å; F517-L528 HydrophobicContact CD1-CD1 3.66Å; F517-L528 HydrophobicContact CD1-CG 4.43Å; F517-L528 HydrophobicContact CD2-CD1 3.93Å; F517-L528 HydrophobicContact CE1-CD1 4.31Å; F517-L528 HydrophobicContact CG-CD1 3.43Å; F517-L528 VanDerWaalsContact CG-CD1 3.43Å; F517-L528 HydrophobicContact CG-CG 4.25Å
518	L	91.3	Very high	89.2	Confident	64 Å²	64	39.4 Å²	39.4	34%	0.335	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	110.9	-179.5	-176.8	67.9	0	0	0	110.7	N516 T525	N516-L518 PolarHBondContact O-N 3.03Å; L518-T525 HydrophobicContact CD1-CG2 4.35Å
519	D	92.6	Very high	89.1	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	124.2	166.9	-178.5	-77.6	0	0	0	109.6	K456 G468 I471 F517 Y521 L522 D523	K456-D519 CarbonylContact O-C 3.6Å; K456-D519 VanDerWaalsContact O-CA 3.3Å; K456-D519 WeakPolarHBondContact O-CA 2.73Å; K456-D519 VanDerWaalsContact O-CG 3.29Å; G468-D519 WeakPolarHBondContact CA-OD2 3.38Å; G468-D519 PolarHBondContact N-OD2 3.29Å; I471-D519 HydrophobicContact CD1-CB 4.24Å; I471-D519 HydrophobicContact CG1-CB 3.79Å; I471-D519 WeakPolarHBondContact CG1-OD2 3.29Å; F517-D519 HydrophobicContact CE1-CB 4.3Å; D519-Y521 VanDerWaalsContact C-N 3.26Å; D519-Y521 PolarHBondContact O-N 2.61Å; D519-Y521 WeakPolarHBondContact OD1-CA 3.43Å; D519-Y521 WeakPolarHBondContact OD1-CB 3.35Å; D519-Y521 PolarHBondContact OD1-N 3.49Å; D519-L522 HydrophobicContact CB-CB 4.26Å; D519-L522 HydrophobicContact CB-CG 4.47Å; D519-L522 PolarHBondContact O-N 2.94Å; D519-L522 PolarHBondContact OD1-N 2.87Å; D519-D523 WeakPolarHBondContact O-CA 3.47Å; D519-D523 PolarHBondContact O-N 3.11Å
520	H	92.5	Very high	89.2	Confident	63 Å²	63	43.5 Å²	43.5	29%	0.292	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-20.7	-176.1	-56.8	153.5	0	0	0	114.1	K456 G457 R459	K456-H520 PolarHBondContact O-N 3.49Å; G457-H520 WeakPolarHBondContact O-CB 3.48Å; G457-H520 PolarHBondContact O-ND1 3.11Å; R459-H520 HydrophobicContact CG-CB 4.35Å
521	Y	92.7	Very high	89.4	Confident	11 Å²	11	43 Å²	43	4%	0.043	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.7	-47.6	174.8	-178.9	-84.5	0	0	0	109.7	Y358 W361 H458 R460 S465 P467 D519 D523	Y358-Y521 HydrophobicContact CD2-CE1 4.43Å; W361-Y521 HydrophobicContact CB-CE1 4.26Å; W361-Y521 AromaticContact CD1-CE1 3.58Å; W361-Y521 AromaticContact CD1-CZ 3.87Å; W361-Y521 AromaticContact CG-CE1 4Å; W361-Y521 HydrophobicContact CG-CE1 4Å; H458-Y521 WeakPolarHBondContact O-CA 3.32Å; H458-Y521 VanDerWaalsContact O-CB 3.25Å; H458-Y521 WeakPolarHBondContact O-CB 3.31Å; H458-Y521 PolarHBondContact O-N 2.86Å; R460-Y521 HydrophobicContact CB-CD2 4.32Å; R460-Y521 HydrophobicContact CB-CE2 4.43Å; S465-Y521 WeakPolarHBondContact O-CE2 3.32Å; S465-Y521 WeakPolarHBondContact OG-CE2 3.14Å; P467-Y521 HydrophobicContact CB-CD1 4.12Å; P467-Y521 HydrophobicContact CB-CG 4.23Å; P467-Y521 HydrophobicContact CG-CD1 3.48Å; P467-Y521 VanDerWaalsContact CG-CD1 3.48Å; P467-Y521 HydrophobicContact CG-CE1 3.87Å; P467-Y521 HydrophobicContact CG-CG 3.87Å; D519-Y521 VanDerWaalsContact C-N 3.26Å; D519-Y521 PolarHBondContact O-N 2.61Å; D519-Y521 WeakPolarHBondContact OD1-CA 3.43Å; D519-Y521 WeakPolarHBondContact OD1-CB 3.35Å; D519-Y521 PolarHBondContact OD1-N 3.49Å; Y521-D523 VanDerWaalsContact C-N 3.33Å
522	L	91.3	Very high	89.9	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-30.7	179.9	-67.8	-173.9	0	0	0	112.7	Y358 W361 L362 I471 D519 V524 V526	Y358-L522 HydrophobicContact CE2-CD2 4.32Å; Y358-L522 WeakPolarHBondContact CE2-O 3.44Å; Y358-L522 PolarHBondContact OH-O 2.89Å; W361-L522 HydrophobicContact CB-CD2 3.95Å; L362-L522 HydrophobicContact CD2-CD2 4.06Å; L362-L522 HydrophobicContact CG-CD2 4.37Å; I471-L522 HydrophobicContact CB-CD1 4.42Å; I471-L522 HydrophobicContact CD1-CD1 3.67Å; I471-L522 HydrophobicContact CG1-CD1 3.81Å; I471-L522 HydrophobicContact CG1-CG 4.41Å; I471-L522 HydrophobicContact CG2-CD1 3.72Å; I471-L522 HydrophobicContact CG2-CG 4.18Å; D519-L522 HydrophobicContact CB-CB 4.26Å; D519-L522 HydrophobicContact CB-CG 4.47Å; D519-L522 PolarHBondContact O-N 2.94Å; D519-L522 PolarHBondContact OD1-N 2.87Å; L522-V524 HydrophobicContact CB-CG2 3.94Å; L522-V524 PolarHBondContact O-N 3.25Å; L522-V526 HydrophobicContact CD1-CG2 4.25Å
523	D	90	Very high	90.4	Very high	91 Å²	91	34.6 Å²	34.6	49%	0.487	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.2	28.9	-179.5	-153.5	26.6	0	0	0	113	R460 D519 Y521	R460-D523 IonicContact CZ-OD2 3.94Å; R460-D523 IonicContact NH2-OD2 2.75Å; R460-D523 PolarHBondContact NH2-OD2 2.65Å; D519-D523 WeakPolarHBondContact O-CA 3.47Å; D519-D523 PolarHBondContact O-N 3.11Å; Y521-D523 VanDerWaalsContact C-N 3.33Å
524	V	90.8	Very high	90.9	Very high	14 Å²	14	30.7 Å²	30.7	9%	0.085	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	151.2	173.6	-65	0	0	0	0	108.6	I331 A334 L362 L522	I331-V524 HydrophobicContact CG1-CG2 4.47Å; A334-V524 HydrophobicContact CB-CG1 4.03Å; L362-V524 HydrophobicContact CD2-CG2 4.03Å; L522-V524 HydrophobicContact CB-CG2 3.94Å; L522-V524 PolarHBondContact O-N 3.25Å
525	T	91.8	Very high	91.2	Very high	45 Å²	45	30 Å²	30	28%	0.276	16%	0.156	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	137.1	176	54.2	0	0	0	0	110.7	H330 N516 F517 L518	H330-T525 PolarHBondContact NE2-O 3.43Å; H330-T525 VanDerWaalsContact NE2-O 3.07Å; H330-T525 PolarHBondContact NE2-OG1 2.98Å; N516-T525 HydrophobicContact CB-CG2 4.46Å; F517-T525 CarbonylContact O-C 3.46Å; F517-T525 WeakPolarHBondContact O-CA 3.45Å; L518-T525 HydrophobicContact CD1-CG2 4.35Å
526	V	91.6	Very high	91.6	Very high	5 Å²	5	26.5 Å²	26.5	3%	0.03	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	129.6	179.9	-176.8	0	0	0	0	108.8	M365 W367 I471 L474 F517 L522 L528	M365-V526 HydrophobicContact CE-CG1 4.38Å; W367-V526 HydrophobicContact CH2-CG1 4.37Å; W367-V526 HydrophobicContact CH2-CG2 4.03Å; W367-V526 HydrophobicContact CZ3-CG1 4.19Å; I471-V526 HydrophobicContact CD1-CB 4.43Å; I471-V526 HydrophobicContact CD1-CG1 4.36Å; I471-V526 HydrophobicContact CD1-CG2 3.93Å; L474-V526 HydrophobicContact CD1-CG1 4.2Å; F517-V526 WeakPolarHBondContact CB-O 3.25Å; F517-V526 PolarHBondContact N-O 3.45Å; F517-V526 VanDerWaalsContact N-O 3.14Å; F517-V526 PolarHBondContact O-N 2.89Å; L522-V526 HydrophobicContact CD1-CG2 4.25Å; V526-L528 HydrophobicContact CG1-CD2 4.03Å; V526-L528 PolarHBondContact O-N 2.94Å
527	D	91.2	Very high	91.7	Very high	59 Å²	59	22.2 Å²	22.2	32%	0.316	12%	0.117	S	C	.	.			trans	-78	110.1	176.1	172.4	27.7	0	0	0	110.8	H515 S529 K530	H515-D527 WeakPolarHBondContact O-CA 3.3Å; D527-S529 WeakPolarHBondContact OD1-CB 3.21Å; D527-S529 PolarHBondContact OD1-N 3.45Å; D527-S529 PolarHBondContact OD1-OG 3.31Å; D527-K530 IonicContact OD2-NZ 3.74Å; D527-K530 PolarHBondContact OD2-NZ 3.38Å
528	L	91	Very high	91.6	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	13%	0.129	C	C	.	.			trans	-101.6	6	175.5	-55.5	-180	0	0	0	113	I470 L474 N514 F517 V526 K530 V531	I470-L528 HydrophobicContact CG2-CD1 3.79Å; I470-L528 HydrophobicContact CG2-CD2 3.58Å; I470-L528 HydrophobicContact CG2-CG 4.35Å; L474-L528 HydrophobicContact CD1-CD2 3.87Å; N514-L528 HydrophobicContact CB-CB 4.22Å; N514-L528 WeakPolarHBondContact O-CB 3.36Å; N514-L528 PolarHBondContact O-N 2.82Å; F517-L528 HydrophobicContact CB-CD1 3.57Å; F517-L528 HydrophobicContact CB-CG 3.89Å; F517-L528 HydrophobicContact CD1-CD1 3.66Å; F517-L528 HydrophobicContact CD1-CG 4.43Å; F517-L528 HydrophobicContact CD2-CD1 3.93Å; F517-L528 HydrophobicContact CE1-CD1 4.31Å; F517-L528 HydrophobicContact CG-CD1 3.43Å; F517-L528 VanDerWaalsContact CG-CD1 3.43Å; F517-L528 HydrophobicContact CG-CG 4.25Å; V526-L528 HydrophobicContact CG1-CD2 4.03Å; V526-L528 PolarHBondContact O-N 2.94Å; L528-K530 PolarHBondContact O-N 3.31Å; L528-V531 HydrophobicContact CB-CG2 4.22Å; L528-V531 HydrophobicContact CD2-CG2 4.26Å; L528-V531 VanDerWaalsContact O-CB 3.29Å; L528-V531 WeakPolarHBondContact O-CB 3.48Å; L528-V531 WeakPolarHBondContact O-CG2 3.35Å; L528-V531 PolarHBondContact O-N 2.96Å
529	S	87.7	Confident	91.3	Very high	30 Å²	30	23.8 Å²	23.8	21%	0.21	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-25	-175	-46.2	0	0	0	0	113.5	H515 D527	H515-S529 VanDerWaalsContact CA-OG 3.31Å; H515-S529 WeakPolarHBondContact CA-OG 3.27Å; H515-S529 WeakPolarHBondContact CB-OG 3.19Å; D527-S529 WeakPolarHBondContact OD1-CB 3.21Å; D527-S529 PolarHBondContact OD1-N 3.45Å; D527-S529 PolarHBondContact OD1-OG 3.31Å
530	K	87.7	Confident	90.9	Very high	61 Å²	61	25.7 Å²	25.7	27%	0.265	14%	0.139	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.2	-15.1	-179.1	-53.9	-177	-167.9	97.1	0	112.9	Q370 R439 E480 N481 D527 L528	Q370-K530 VanDerWaalsContact NE2-CD 3.27Å; Q370-K530 VanDerWaalsContact NE2-CE 3.26Å; R439-K530 PolarHBondContact NH1-O 2.84Å; R439-K530 PolarHBondContact NH2-O 2.86Å; E480-K530 IonicContact OE2-NZ 3.42Å; E480-K530 PolarHBondContact OE2-NZ 3.17Å; N481-K530 HydrophobicContact CB-CB 4.08Å; D527-K530 IonicContact OD2-NZ 3.74Å; D527-K530 PolarHBondContact OD2-NZ 3.38Å; L528-K530 PolarHBondContact O-N 3.31Å
531	V	90.8	Very high	90.4	Very high	7 Å²	7	29 Å²	29	4%	0.042	16%	0.159	C	C	.	.			trans	-73.4	131	-179.7	-178.7	0	0	0	0	109.4	P482 I484 L528 F533	P482-V531 HydrophobicContact CG-CG1 4.45Å; P482-V531 HydrophobicContact CG-CG2 4.45Å; I484-V531 HydrophobicContact CB-CG1 4.15Å; I484-V531 HydrophobicContact CD1-CG1 3.55Å; I484-V531 HydrophobicContact CG1-CG1 3.63Å; L528-V531 HydrophobicContact CB-CG2 4.22Å; L528-V531 HydrophobicContact CD2-CG2 4.26Å; L528-V531 VanDerWaalsContact O-CB 3.29Å; L528-V531 WeakPolarHBondContact O-CB 3.48Å; L528-V531 WeakPolarHBondContact O-CG2 3.35Å; L528-V531 PolarHBondContact O-N 2.96Å; V531-F533 HydrophobicContact CB-CD2 4.48Å; V531-F533 HydrophobicContact CB-CE1 4.38Å; V531-F533 HydrophobicContact CB-CE2 3.79Å; V531-F533 HydrophobicContact CB-CZ 3.74Å; V531-F533 HydrophobicContact CG1-CD1 4.05Å; V531-F533 HydrophobicContact CG1-CD2 4.25Å; V531-F533 HydrophobicContact CG1-CE1 3.56Å; V531-F533 HydrophobicContact CG1-CE2 3.79Å; V531-F533 HydrophobicContact CG1-CG 4.38Å; V531-F533 HydrophobicContact CG1-CZ 3.43Å; V531-F533 VanDerWaalsContact CG1-CZ 3.43Å; V531-F533 HydrophobicContact CG2-CZ 4.49Å
532	L	90.9	Very high	90	Very high	7 Å²	7	31.1 Å²	31.1	4%	0.037	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	111.3	173.2	173	56.4	0	0	0	109.1	F401 V411 L437 R439 P482 L483 I484	F401-L532 HydrophobicContact CE1-CD1 3.84Å; F401-L532 HydrophobicContact CE1-CD2 4.22Å; F401-L532 HydrophobicContact CZ-CD1 3.56Å; V411-L532 HydrophobicContact CG1-CB 4.41Å; V411-L532 HydrophobicContact CG1-CD1 3.85Å; L437-L532 HydrophobicContact CD1-CD2 3.6Å; R439-L532 VanDerWaalsContact NH1-CB 3.3Å; P482-L532 PolarHBondContact O-N 3.4Å; L483-L532 CarbonylContact C-O 3.46Å; L483-L532 VanDerWaalsContact CA-O 3.31Å; L483-L532 WeakPolarHBondContact CA-O 3.34Å; L483-L532 HydrophobicContact CD1-CD2 3.85Å; L483-L532 HydrophobicContact CD1-CG 4.35Å; L483-L532 HydrophobicContact CG-CB 4.44Å; L483-L532 HydrophobicContact CG-CD2 4.17Å; L483-L532 HydrophobicContact CG-CG 4.15Å; I484-L532 PolarHBondContact N-O 3.03Å
533	F	92.4	Very high	89.7	Confident	8 Å²	8	31.2 Å²	31.2	4%	0.035	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	136	175.9	-61.3	-76.5	0	0	0	111.1	I415 I484 I486 L508 L509 V531	I415-F533 HydrophobicContact CG1-CB 4.41Å; I415-F533 HydrophobicContact CG2-CB 4.27Å; I484-F533 HydrophobicContact CB-CD1 3.95Å; I484-F533 HydrophobicContact CB-CE1 4.12Å; I484-F533 HydrophobicContact CD1-CE1 4.05Å; I484-F533 HydrophobicContact CG2-CD1 4.2Å; I484-F533 HydrophobicContact CG2-CE1 4.31Å; I484-F533 WeakPolarHBondContact O-CA 3.4Å; I486-F533 HydrophobicContact CD1-CD1 4.12Å; L508-F533 HydrophobicContact CD2-CD1 3.71Å; L508-F533 HydrophobicContact CD2-CD2 4.44Å; L508-F533 HydrophobicContact CD2-CE1 3.34Å; L508-F533 HydrophobicContact CD2-CE2 4.12Å; L508-F533 HydrophobicContact CD2-CG 4.24Å; L508-F533 HydrophobicContact CD2-CZ 3.56Å; L508-F533 HydrophobicContact CG-CE1 4.05Å; L508-F533 HydrophobicContact CG-CZ 3.94Å; L509-F533 HydrophobicContact CD2-CB 3.59Å; L509-F533 HydrophobicContact CD2-CD1 4.1Å; L509-F533 HydrophobicContact CD2-CD2 4.07Å; L509-F533 HydrophobicContact CD2-CG 3.65Å; V531-F533 HydrophobicContact CB-CD2 4.48Å; V531-F533 HydrophobicContact CB-CE1 4.38Å; V531-F533 HydrophobicContact CB-CE2 3.79Å; V531-F533 HydrophobicContact CB-CZ 3.74Å; V531-F533 HydrophobicContact CG1-CD1 4.05Å; V531-F533 HydrophobicContact CG1-CD2 4.25Å; V531-F533 HydrophobicContact CG1-CE1 3.56Å; V531-F533 HydrophobicContact CG1-CE2 3.79Å; V531-F533 HydrophobicContact CG1-CG 4.38Å; V531-F533 HydrophobicContact CG1-CZ 3.43Å; V531-F533 VanDerWaalsContact CG1-CZ 3.43Å; V531-F533 HydrophobicContact CG2-CZ 4.49Å
534	I	94.8	Very high	89.5	Confident	0 Å²	0	28.8 Å²	28.8	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	135.9	168.8	-62.4	-171.8	0	0	0	107.7	L416 F418 A430 I433 L483 I484 L485 I486	L416-I534 WeakPolarHBondContact O-CA 3.18Å; F418-I534 HydrophobicContact CD2-CG2 3.64Å; F418-I534 HydrophobicContact CE2-CD1 4.42Å; F418-I534 HydrophobicContact CE2-CG2 3.57Å; A430-I534 HydrophobicContact CB-CD1 4.31Å; A430-I534 HydrophobicContact CB-CG2 4.06Å; I433-I534 HydrophobicContact CB-CD1 4.32Å; I433-I534 HydrophobicContact CD1-CD1 3.74Å; I433-I534 HydrophobicContact CG2-CD1 4.12Å; L483-I534 HydrophobicContact CD1-CD1 3.81Å; L483-I534 HydrophobicContact CD2-CD1 4.09Å; L483-I534 HydrophobicContact CD2-CG1 4.26Å; L483-I534 HydrophobicContact CG-CD1 4.2Å; L483-I534 HydrophobicContact CG-CG1 4.43Å; I484-I534 PolarHBondContact O-N 3.42Å; L485-I534 CarbonylContact C-O 3.56Å; L485-I534 WeakPolarHBondContact CA-O 3.48Å; L485-I534 HydrophobicContact CD1-CB 3.98Å; L485-I534 HydrophobicContact CD1-CG2 3.68Å; L485-I534 WeakPolarHBondContact CD1-O 3.16Å; I486-I534 PolarHBondContact N-O 3.08Å
535	C	94.9	Very high	89.3	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	152.8	176.9	-63.2	0	0	0	0	111.4	L416 C417 F418 I486 V489 M551	L416-C535 PolarHBondContact O-N 3.46Å; C417-C535 WeakPolarHBondContact CA-O 3.5Å; C417-C535 HydrophobicContact CB-CB 4.07Å; F418-C535 PolarHBondContact N-O 2.84Å; I486-C535 CarbonylContact O-C 3.41Å; I486-C535 VanDerWaalsContact O-CA 3.29Å; I486-C535 WeakPolarHBondContact O-CA 3.49Å; V489-C535 HydrophobicContact CG1-CB 3.95Å; V489-C535 HydrophobicContact CG2-CB 4.37Å; C535-M551 HydrophobicContact CB-CE 4.24Å; C535-M551 HydrophobicContact CB-SD 4.24Å
536	T	95.2	Very high	88.9	Confident	2 Å²	2	33.8 Å²	33.8	1%	0.012	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	145.4	164.4	82	0	0	0	0	111.4	F418 K426 L485 I486 D487 E488 V489	F418-T536 CarbonylContact O-C 3.59Å; F418-T536 VanDerWaalsContact O-CA 3.27Å; F418-T536 WeakPolarHBondContact O-CA 3.38Å; K426-T536 HydrophobicContact CB-CG2 4.1Å; L485-T536 HydrophobicContact CD1-CG2 3.59Å; L485-T536 HydrophobicContact CD2-CG2 4.3Å; L485-T536 HydrophobicContact CG-CG2 4.3Å; I486-T536 PolarHBondContact O-N 2.81Å; D487-T536 WeakPolarHBondContact CA-OG1 3.46Å; D487-T536 WeakPolarHBondContact OD1-CB 3.41Å; D487-T536 WeakPolarHBondContact OD1-CG2 3.48Å; D487-T536 PolarHBondContact OD1-OG1 2.94Å; E488-T536 WeakPolarHBondContact CA-O 3.25Å; E488-T536 PolarHBondContact N-O 3.45Å; E488-T536 VanDerWaalsContact N-O 3.09Å; E488-T536 PolarHBondContact N-OG1 3.35Å; E488-T536 VanDerWaalsContact N-OG1 3.14Å; V489-T536 WeakPolarHBondContact CG2-O 3.34Å; V489-T536 PolarHBondContact N-O 3.41Å
537	A	92.6	Very high	88.6	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	151.2	173.3	0	0	0	0	0	110.8	F418 Y419 G420 K426 V489 D490 I543	F418-A537 PolarHBondContact O-N 3.43Å; Y419-A537 VanDerWaalsContact CA-O 3.25Å; Y419-A537 WeakPolarHBondContact CA-O 3.41Å; G420-A537 PolarHBondContact N-O 2.89Å; K426-A537 WeakPolarHBondContact CD-O 3.44Å; K426-A537 WeakPolarHBondContact CE-O 3.28Å; V489-A537 HydrophobicContact CG2-CB 3.96Å; D490-A537 HydrophobicContact CB-CB 4.16Å; D490-A537 WeakPolarHBondContact OD1-CA 3.01Å; A537-I543 HydrophobicContact CB-CD1 3.67Å; A537-I543 HydrophobicContact CB-CG1 4.43Å
538	N	89.4	Confident	88.4	Confident	44 Å²	44	34.8 Å²	34.8	24%	0.235	19%	0.19	C	C	.	.	S	Bend	trans	-93	-30.4	166.8	-61.4	-65	0	0	0	112.5	G420 K426 D490	G420-N538 WeakPolarHBondContact O-CA 3.3Å; K426-N538 PolarHBondContact NZ-OD1 3.12Å; D490-N538 PolarHBondContact OD1-N 3.21Å
539	V	84.9	Confident	88.1	Confident	53 Å²	53	39.9 Å²	39.9	32%	0.321	22%	0.218	S	C	.	.			trans	-136.4	138.1	-177.9	-177	0	0	0	0	108.5	D490 D541	D490-V539 VanDerWaalsContact CB-O 3.23Å; D490-V539 WeakPolarHBondContact CB-O 2.99Å; V539-D541 HydrophobicContact CG1-CB 4.32Å
540	T	84.8	Confident	87.9	Confident	39 Å²	39	42.1 Å²	42.1	24%	0.239	22%	0.222	C	C	.	.	S	Bend	trans	-82	-33.5	-177.7	46.9	0	0	0	0	113.2	Y419 T542 I543 M553	Y419-T540 HydrophobicContact CD1-CG2 4.38Å; Y419-T540 HydrophobicContact CD2-CG2 3.41Å; Y419-T540 VanDerWaalsContact CD2-CG2 3.41Å; Y419-T540 HydrophobicContact CE2-CG2 3.71Å; Y419-T540 HydrophobicContact CG-CG2 3.75Å; T540-T542 PolarHBondContact O-N 3.44Å; T540-I543 WeakPolarHBondContact O-CB 3.41Å; T540-I543 PolarHBondContact O-N 2.84Å; T540-I543 VanDerWaalsContact O-N 3.12Å; T540-M553 HydrophobicContact CG2-CE 3.74Å
541	D	82.4	Confident	88	Confident	133 Å²	133	39.6 Å²	39.6	71%	0.711	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71	-20.7	-167.6	-48.5	-24	0	0	0	113.1	V539	V539-D541 HydrophobicContact CG1-CB 4.32Å
542	T	83	Confident	87.9	Confident	55 Å²	55	42.4 Å²	42.4	34%	0.337	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.3	-2.2	178.3	53.4	0	0	0	0	113.1	D490 T540	D490-T542 WeakPolarHBondContact CB-OG1 3.35Å; D490-T542 PolarHBondContact O-OG1 3.5Å; T540-T542 PolarHBondContact O-N 3.44Å
543	I	87	Confident	87.9	Confident	3 Å²	3	44.7 Å²	44.7	2%	0.015	24%	0.235	C	C	.	.	S	Bend	trans	-80.5	127.4	176.1	-55	175.1	0	0	0	107.7	V489 D490 A537 T540 D545 L547 R548 M553	V489-I543 HydrophobicContact CG2-CD1 3.98Å; V489-I543 HydrophobicContact CG2-CG1 4.2Å; D490-I543 HydrophobicContact CB-CG1 4.47Å; A537-I543 HydrophobicContact CB-CD1 3.67Å; A537-I543 HydrophobicContact CB-CG1 4.43Å; T540-I543 WeakPolarHBondContact O-CB 3.41Å; T540-I543 PolarHBondContact O-N 2.84Å; T540-I543 VanDerWaalsContact O-N 3.12Å; I543-D545 PolarHBondContact O-N 3.34Å; I543-L547 HydrophobicContact CG2-CB 4.19Å; I543-R548 HydrophobicContact CG2-CB 4.21Å; I543-M553 HydrophobicContact CD1-CE 3.97Å
544	P	85.3	Confident	87.9	Confident	40 Å²	40	44.8 Å²	44.8	26%	0.26	24%	0.236	S	C	.	.			trans	-53.1	130.9	174.8	-26.8	34.8	0	0	0	111.8	I492 A502 P546 L547 R548	I492-P544 HydrophobicContact CG2-CG 3.85Å; A502-P544 HydrophobicContact CB-CG 4.13Å; P544-P546 VanDerWaalsContact C-N 3.3Å; P544-L547 HydrophobicContact CB-CD1 4.38Å; P544-L547 HydrophobicContact CG-CD1 4.17Å; P544-L547 WeakPolarHBondContact O-CB 3.2Å; P544-L547 PolarHBondContact O-N 3.1Å; P544-R548 PolarHBondContact O-N 3.22Å
545	D	85.8	Confident	87.6	Confident	91 Å²	91	49.7 Å²	49.7	49%	0.487	26%	0.258	S	S	.	.	H	α-helix	trans	-50.7	-42.4	-178.2	-62.1	-43.3	0	0	0	113.3	I543 L547 R548 D549	I543-D545 PolarHBondContact O-N 3.34Å; D545-L547 PolarHBondContact O-N 2.86Å; D545-R548 PolarHBondContact O-N 2.9Å; D545-R548 VanDerWaalsContact O-N 3.13Å; D545-R548 IonicContact OD1-CZ 2.77Å; D545-R548 IonicContact OD1-NH1 2.89Å; D545-R548 PolarHBondContact OD1-NH1 3.38Å; D545-R548 IonicContact OD1-NH2 3.29Å; D545-R548 PolarHBondContact OD1-NH2 3.46Å; D545-D549 PolarHBondContact O-N 3.46Å
546	P	83.8	Confident	87.3	Confident	73 Å²	73	49.7 Å²	49.7	47%	0.474	26%	0.259	S	S	.	.	H	α-helix	trans	-61.5	-30.4	178.4	-24.6	36	0	0	0	114.2	L506 P544 R550	L506-P546 HydrophobicContact CD1-CB 4.07Å; L506-P546 HydrophobicContact CD2-CB 3.83Å; P544-P546 VanDerWaalsContact C-N 3.3Å; P546-R550 WeakPolarHBondContact O-CG 3.3Å
547	L	85.6	Confident	86.7	Confident	1 Å²	1	51 Å²	51	1%	0.005	27%	0.268	C	S	.	.	H	α-helix	trans	-77.7	-43.8	175.1	-77.2	173.9	0	0	0	110.5	A502 L505 L506 L509 I543 P544 D545 D549 R550 M551	A502-L547 HydrophobicContact CB-CD1 4.02Å; L505-L547 HydrophobicContact CB-CD1 4.5Å; L505-L547 HydrophobicContact CB-CD2 4.17Å; L506-L547 HydrophobicContact CB-CD2 4.49Å; L506-L547 HydrophobicContact CD2-CD2 3.53Å; L506-L547 HydrophobicContact CD2-CG 3.78Å; L506-L547 HydrophobicContact CG-CD2 3.72Å; L506-L547 HydrophobicContact CG-CG 3.97Å; L509-L547 HydrophobicContact CD1-CD2 3.86Å; I543-L547 HydrophobicContact CG2-CB 4.19Å; P544-L547 HydrophobicContact CB-CD1 4.38Å; P544-L547 HydrophobicContact CG-CD1 4.17Å; P544-L547 WeakPolarHBondContact O-CB 3.2Å; P544-L547 PolarHBondContact O-N 3.1Å; D545-L547 PolarHBondContact O-N 2.86Å; L547-D549 VanDerWaalsContact C-N 3.31Å; L547-D549 PolarHBondContact O-N 3.44Å; L547-R550 PolarHBondContact O-N 2.77Å; L547-M551 HydrophobicContact CB-CE 4.05Å; L547-M551 HydrophobicContact CD2-CE 4.41Å; L547-M551 WeakPolarHBondContact O-CG 3.35Å; L547-M551 PolarHBondContact O-N 3.13Å
548	R	86.5	Confident	86.1	Confident	83 Å²	83	51.7 Å²	51.7	31%	0.313	28%	0.275	S	S	.	.	H	α-helix	trans	-59.7	-41.3	-179.5	-170.4	-176.1	66.9	-135.2	-9.5	111.7	I543 P544 D545 R550 M551 M553	I543-R548 HydrophobicContact CG2-CB 4.21Å; P544-R548 PolarHBondContact O-N 3.22Å; D545-R548 PolarHBondContact O-N 2.9Å; D545-R548 VanDerWaalsContact O-N 3.13Å; D545-R548 IonicContact OD1-CZ 2.77Å; D545-R548 IonicContact OD1-NH1 2.89Å; D545-R548 PolarHBondContact OD1-NH1 3.38Å; D545-R548 IonicContact OD1-NH2 3.29Å; D545-R548 PolarHBondContact OD1-NH2 3.46Å; R548-R550 PolarHBondContact O-N 2.49Å; R548-M551 PolarHBondContact O-N 2.78Å; R548-M553 HydrophobicContact CG-CG 4.46Å; R548-M553 HydrophobicContact CG-SD 4.32Å
549	D	84.8	Confident	85.8	Confident	108 Å²	108	50.7 Å²	50.7	58%	0.578	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-22.5	-178.4	-69.4	-10.4	0	0	0	113.2	D545 L547	D545-D549 PolarHBondContact O-N 3.46Å; L547-D549 VanDerWaalsContact C-N 3.31Å; L547-D549 PolarHBondContact O-N 3.44Å
550	R	83.5	Confident	85.4	Confident	76 Å²	76	48.8 Å²	48.8	29%	0.287	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.4	-11.3	175.7	-63.6	176	176.8	-158	-12.6	113.2	K414 I415 L506 D510 P546 L547 R548	K414-R550 WeakPolarHBondContact CA-O 3.47Å; I415-R550 PolarHBondContact N-O 3.24Å; I415-R550 VanDerWaalsContact N-O 3.09Å; L506-R550 PolarHBondContact O-NH1 3.27Å; D510-R550 IonicContact OD1-NH1 2.72Å; D510-R550 IonicContact OD1-NH2 3.45Å; D510-R550 IonicContact OD2-CZ 3.47Å; D510-R550 IonicContact OD2-NH1 3.58Å; D510-R550 PolarHBondContact OD2-NH1 3.28Å; D510-R550 IonicContact OD2-NH2 2.7Å; D510-R550 PolarHBondContact OD2-NH2 2.95Å; P546-R550 WeakPolarHBondContact O-CG 3.3Å; L547-R550 PolarHBondContact O-N 2.77Å; R548-R550 PolarHBondContact O-N 2.49Å
551	M	89.7	Confident	85.1	Confident	8 Å²	8	49.4 Å²	49.4	4%	0.039	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	144.7	-178.3	-67.1	174.4	-168.9	0	0	111.4	I415 C417 L509 C535 L547 R548 M553	I415-M551 HydrophobicContact CB-CG 4.38Å; I415-M551 HydrophobicContact CG2-CG 4.44Å; I415-M551 CarbonylContact O-C 3.58Å; I415-M551 VanDerWaalsContact O-CA 3.23Å; I415-M551 WeakPolarHBondContact O-CA 3.34Å; C417-M551 HydrophobicContact CB-CB 3.82Å; C417-M551 HydrophobicContact CB-CG 4.06Å; C417-M551 HydrophobicContact CB-SD 3.76Å; L509-M551 HydrophobicContact CD1-CE 3.89Å; C535-M551 HydrophobicContact CB-CE 4.24Å; C535-M551 HydrophobicContact CB-SD 4.24Å; L547-M551 HydrophobicContact CB-CE 4.05Å; L547-M551 HydrophobicContact CD2-CE 4.41Å; L547-M551 WeakPolarHBondContact O-CG 3.35Å; L547-M551 PolarHBondContact O-N 3.13Å; R548-M551 PolarHBondContact O-N 2.78Å; M551-M553 HydrophobicContact CB-SD 3.84Å
552	E	89.4	Confident	85.1	Confident	66 Å²	66	48 Å²	48	31%	0.308	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	109.4	162.8	-174.3	172.2	160.4	0	0	108.1	K414 I415 L416 C417 I554	K414-E552 HydrophobicContact CB-CB 3.94Å; K414-E552 HydrophobicContact CD-CB 4.44Å; I415-E552 PolarHBondContact O-N 3.02Å; L416-E552 HydrophobicContact CD2-CB 4.24Å; C417-E552 PolarHBondContact N-O 3.04Å; E552-I554 PolarHBondContact O-N 3.3Å
553	M	90.5	Very high	85.1	Confident	56 Å²	56	47 Å²	47	28%	0.276	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	115.2	-173.9	-58.1	-57.8	-68.1	0	0	109.9	C417 Y419 T540 I543 R548 M551	C417-M553 HydrophobicContact CB-CE 4.33Å; C417-M553 HydrophobicContact CB-SD 3.64Å; Y419-M553 HydrophobicContact CD1-CB 3.98Å; Y419-M553 HydrophobicContact CD1-CE 3.75Å; Y419-M553 HydrophobicContact CE1-CB 3.66Å; Y419-M553 HydrophobicContact CE1-CE 4.37Å; Y419-M553 HydrophobicContact CG-CE 4.06Å; T540-M553 HydrophobicContact CG2-CE 3.74Å; I543-M553 HydrophobicContact CD1-CE 3.97Å; R548-M553 HydrophobicContact CG-CG 4.46Å; R548-M553 HydrophobicContact CG-SD 4.32Å; M551-M553 HydrophobicContact CB-SD 3.84Å
554	I	92.6	Very high	85.1	Confident	10 Å²	10	47.3 Å²	47.3	5%	0.051	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	114.2	176.4	-58.7	173.7	0	0	0	108.7	V394 R397 L416 C417 F418 Y419 E552	V394-I554 HydrophobicContact CB-CG2 4.37Å; V394-I554 HydrophobicContact CG1-CG2 4.06Å; V394-I554 HydrophobicContact CG2-CG2 4.18Å; R397-I554 HydrophobicContact CB-CD1 3.81Å; R397-I554 HydrophobicContact CB-CG1 4.37Å; L416-I554 HydrophobicContact CD2-CD1 3.9Å; C417-I554 PolarHBondContact O-N 2.94Å; F418-I554 WeakPolarHBondContact CA-O 3.5Å; F418-I554 HydrophobicContact CD1-CB 3.9Å; F418-I554 HydrophobicContact CD1-CD1 4.45Å; F418-I554 HydrophobicContact CD1-CG2 3.96Å; F418-I554 HydrophobicContact CE1-CB 4.09Å; F418-I554 HydrophobicContact CE1-CD1 3.82Å; F418-I554 HydrophobicContact CE1-CG2 4.01Å; F418-I554 HydrophobicContact CZ-CD1 4.35Å; Y419-I554 VanDerWaalsContact CD1-C 3.48Å; Y419-I554 VanDerWaalsContact CD1-O 3.3Å; Y419-I554 WeakPolarHBondContact CD1-O 3.44Å; Y419-I554 VanDerWaalsContact CE1-C 3.46Å; Y419-I554 PolarHBondContact N-O 2.88Å; E552-I554 PolarHBondContact O-N 3.3Å
555	E	88.2	Confident	85.3	Confident	102 Å²	102	46.5 Å²	46.5	48%	0.477	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	131.4	177.3	-165.6	177.4	176.9	0	0	110.6	Y419	Y419-E555 HydrophobicContact CD2-CG 4.37Å; Y419-E555 HydrophobicContact CE1-CB 3.79Å; Y419-E555 HydrophobicContact CE1-CG 4.47Å; Y419-E555 VanDerWaalsContact CE1-N 3.29Å; Y419-E555 HydrophobicContact CE2-CB 3.99Å; Y419-E555 HydrophobicContact CE2-CG 3.78Å; Y419-E555 CarbonylContact O-C 3.58Å
556	V	89.5	Confident	85.4	Confident	1 Å²	1	47.9 Å²	47.9	1%	0.006	24%	0.239	C	C	.	.			trans	-111.9	100	171.5	-168.9	0	0	0	0	107.8	M391 V394 F418 Y419 P421 V424 K426	M391-V556 HydrophobicContact SD-CG1 3.72Å; V394-V556 HydrophobicContact CG1-CG2 4.43Å; V394-V556 HydrophobicContact CG2-CG2 4.15Å; F418-V556 HydrophobicContact CB-CG2 4.08Å; F418-V556 HydrophobicContact CD1-CG2 3.99Å; F418-V556 HydrophobicContact CG-CG2 4.46Å; Y419-V556 PolarHBondContact O-N 2.8Å; P421-V556 WeakPolarHBondContact CD-O 3.2Å; V424-V556 HydrophobicContact CB-CG1 3.98Å; V424-V556 HydrophobicContact CG2-CB 3.81Å; V424-V556 HydrophobicContact CG2-CG1 3.6Å; V424-V556 VanDerWaalsContact O-CG1 3.31Å; V424-V556 WeakPolarHBondContact O-CG1 3.47Å; K426-V556 HydrophobicContact CG-CB 4.26Å; K426-V556 HydrophobicContact CG-CG2 4.2Å
557	S	81.8	Confident	85.6	Confident	30 Å²	30	44.9 Å²	44.9	21%	0.21	22%	0.219	C	C	.	.	P	Polyproline II helix	trans	-68	159.4	-177.1	61.4	0	0	0	0	112.6	K806	S557-K806 PolarHBondContact OG-NZ 3.16Å
558	G	80	Confident	85.8	Confident	14 Å²	14	44.9 Å²	44.9	14%	0.144	22%	0.219	C	C	.	.	P	Polyproline II helix	trans	-66.3	158	171.8	0	0	0	0	0	113.1
559	Y	83	Confident	85.8	Confident	22 Å²	22	43.7 Å²	43.7	9%	0.086	22%	0.217	C	C	.	.	P	Polyproline II helix	trans	-91.9	141.5	179.3	-56.6	-63.2	0	0	0	112.1	M391 V424 E563 K564 I567 S605 V607	M391-Y559 WeakPolarHBondContact CE-OH 3.2Å; M391-Y559 HydrophobicContact CG-CE1 4.16Å; M391-Y559 HydrophobicContact SD-CE1 4.22Å; M391-Y559 PolarHBondContact SD-OH 2.9Å; M391-Y559 VanDerWaalsContact SD-OH 3.37Å; V424-Y559 HydrophobicContact CB-CE2 4.35Å; V424-Y559 PolarHBondContact O-OH 3.22Å; Y559-E563 VanDerWaalsContact CA-OE2 3.27Å; Y559-E563 WeakPolarHBondContact CA-OE2 3.14Å; Y559-E563 HydrophobicContact CD1-CB 4.39Å; Y559-K564 WeakPolarHBondContact O-CE 3.4Å; Y559-I567 HydrophobicContact CD1-CD1 3.45Å; Y559-I567 VanDerWaalsContact CD1-CD1 3.45Å; Y559-I567 HydrophobicContact CD2-CD1 3.69Å; Y559-I567 HydrophobicContact CE1-CD1 3.52Å; Y559-I567 HydrophobicContact CE2-CD1 3.71Å; Y559-I567 HydrophobicContact CG-CD1 3.53Å; Y559-S605 PolarHBondContact N-O 3.46Å; Y559-V607 HydrophobicContact CD2-CG1 3.91Å; Y559-V607 HydrophobicContact CE2-CG1 4.36Å; Y559-V607 HydrophobicContact CE2-CG2 4.4Å
560	V	77.3	Confident	85.9	Confident	13 Å²	13	42.7 Å²	42.7	8%	0.079	21%	0.212	C	C	.	.	P	Polyproline II helix	trans	-76.2	165.6	169	-52.6	0	0	0	0	111.7	E562 E563 K564 I810 F836 I837	V560-E562 VanDerWaalsContact C-N 3.27Å; V560-E562 HydrophobicContact CG2-CB 4.24Å; V560-E562 PolarHBondContact O-N 3.24Å; V560-E563 HydrophobicContact CG2-CB 3.96Å; V560-E563 HydrophobicContact CG2-CG 3.66Å; V560-E563 PolarHBondContact N-OE2 3.11Å; V560-E563 PolarHBondContact O-N 3.41Å; V560-K564 VanDerWaalsContact O-CG 3.3Å; V560-K564 WeakPolarHBondContact O-CG 3.12Å; V560-K564 PolarHBondContact O-N 3.13Å; V560-I810 HydrophobicContact CB-CG2 4.48Å; V560-I810 HydrophobicContact CG1-CB 4.34Å; V560-I810 HydrophobicContact CG1-CD1 3.55Å; V560-I810 HydrophobicContact CG1-CG1 3.55Å; V560-I810 HydrophobicContact CG1-CG2 3.84Å; V560-F836 HydrophobicContact CG1-CE2 4.21Å; V560-F836 HydrophobicContact CG2-CD2 4.1Å; V560-F836 HydrophobicContact CG2-CE2 3.54Å; V560-I837 HydrophobicContact CG1-CD1 4.17Å; V560-I837 HydrophobicContact CG1-CG1 4.36Å
561	A	77.1	Confident	86.1	Confident	52 Å²	52	40.8 Å²	40.8	43%	0.43	21%	0.205	S	C	.	.	H	α-helix	trans	-57	-38.6	-178.3	0	0	0	0	0	113.4	K564 L565 I598	A561-K564 PolarHBondContact O-N 2.85Å; A561-L565 PolarHBondContact O-N 3.49Å; A561-I598 HydrophobicContact CB-CG2 4.34Å
562	E	81.9	Confident	85.9	Confident	104 Å²	104	41 Å²	41	49%	0.486	21%	0.206	S	C	.	.	H	α-helix	trans	-68.8	-42.8	177	-66.8	178.7	-169.3	0	0	112.3	V560 K564 L565 R566	V560-E562 VanDerWaalsContact C-N 3.27Å; V560-E562 HydrophobicContact CG2-CB 4.24Å; V560-E562 PolarHBondContact O-N 3.24Å; E562-K564 VanDerWaalsContact C-N 3.34Å; E562-K564 PolarHBondContact O-N 3.32Å; E562-L565 WeakPolarHBondContact O-CB 3.3Å; E562-L565 PolarHBondContact O-N 3.47Å; E562-R566 WeakPolarHBondContact O-CG 3.37Å; E562-R566 PolarHBondContact O-N 3.44Å; E562-R566 VanDerWaalsContact O-N 3.11Å
563	E	84.7	Confident	85.8	Confident	35 Å²	35	38.8 Å²	38.8	16%	0.164	20%	0.196	C	C	.	.	H	α-helix	trans	-60.8	-44.1	173.2	-73.3	172.5	147.1	0	0	110.9	Y389 Y559 V560 L565 R566 I567 F836	Y389-E563 HydrophobicContact CD1-CB 4.42Å; Y389-E563 HydrophobicContact CD1-CG 4.43Å; Y389-E563 HydrophobicContact CE1-CB 4.34Å; Y389-E563 HydrophobicContact CE1-CG 4.06Å; Y559-E563 VanDerWaalsContact CA-OE2 3.27Å; Y559-E563 WeakPolarHBondContact CA-OE2 3.14Å; Y559-E563 HydrophobicContact CD1-CB 4.39Å; V560-E563 HydrophobicContact CG2-CB 3.96Å; V560-E563 HydrophobicContact CG2-CG 3.66Å; V560-E563 PolarHBondContact N-OE2 3.11Å; V560-E563 PolarHBondContact O-N 3.41Å; E563-L565 VanDerWaalsContact C-N 3.28Å; E563-L565 PolarHBondContact O-N 2.88Å; E563-R566 PolarHBondContact O-N 2.85Å; E563-R566 VanDerWaalsContact O-N 3.17Å; E563-I567 HydrophobicContact CB-CD1 4.49Å; E563-I567 WeakPolarHBondContact O-CB 3.3Å; E563-I567 WeakPolarHBondContact O-CD1 3.49Å; E563-I567 WeakPolarHBondContact O-CG1 3.35Å; E563-I567 PolarHBondContact O-N 2.63Å; E563-F836 HydrophobicContact CG-CE2 4.49Å; E563-F836 HydrophobicContact CG-CZ 4.42Å
564	K	87.2	Confident	85.5	Confident	8 Å²	8	39.1 Å²	39.1	4%	0.035	20%	0.202	C	C	.	.	H	α-helix	trans	-60.5	-37.7	176.3	-69.1	-174.6	-171.3	-154	0	112.8	Y559 V560 A561 E562 I567 A568 I598 E604 G606 V607 L610	Y559-K564 WeakPolarHBondContact O-CE 3.4Å; V560-K564 VanDerWaalsContact O-CG 3.3Å; V560-K564 WeakPolarHBondContact O-CG 3.12Å; V560-K564 PolarHBondContact O-N 3.13Å; A561-K564 PolarHBondContact O-N 2.85Å; E562-K564 VanDerWaalsContact C-N 3.34Å; E562-K564 PolarHBondContact O-N 3.32Å; K564-I567 PolarHBondContact O-N 2.88Å; K564-A568 VanDerWaalsContact O-CB 3.24Å; K564-A568 WeakPolarHBondContact O-CB 3.31Å; K564-A568 PolarHBondContact O-N 2.84Å; K564-I598 HydrophobicContact CB-CD1 3.99Å; K564-I598 HydrophobicContact CB-CG2 4.47Å; K564-I598 HydrophobicContact CD-CG2 4.23Å; K564-E604 PolarHBondContact NZ-O 2.82Å; K564-G606 VanDerWaalsContact CE-O 3.27Å; K564-G606 WeakPolarHBondContact CE-O 3.35Å; K564-G606 PolarHBondContact NZ-O 3.48Å; K564-V607 HydrophobicContact CB-CG1 4.29Å; K564-V607 HydrophobicContact CD-CG1 4.37Å; K564-V607 HydrophobicContact CG-CG1 3.81Å; K564-L610 HydrophobicContact CB-CD2 3.97Å
565	L	88.6	Confident	85.1	Confident	24 Å²	24	42.9 Å²	42.9	13%	0.126	22%	0.22	C	C	.	.	H	α-helix	trans	-60.4	-50.1	175.1	-174.8	73.7	0	0	0	109.9	A561 E562 E563 A568 E569 L594 K595 I598	A561-L565 PolarHBondContact O-N 3.49Å; E562-L565 WeakPolarHBondContact O-CB 3.3Å; E562-L565 PolarHBondContact O-N 3.47Å; E563-L565 VanDerWaalsContact C-N 3.28Å; E563-L565 PolarHBondContact O-N 2.88Å; L565-A568 PolarHBondContact O-N 3.25Å; L565-E569 WeakPolarHBondContact O-CG 3.48Å; L565-E569 PolarHBondContact O-N 3.03Å; L565-L594 HydrophobicContact CD1-CB 3.97Å; L565-L594 HydrophobicContact CD1-CD2 3.59Å; L565-L594 HydrophobicContact CD1-CG 3.65Å; L565-K595 HydrophobicContact CD1-CG 3.97Å; L565-K595 HydrophobicContact CD2-CG 4.26Å; L565-I598 HydrophobicContact CB-CD1 4.06Å; L565-I598 HydrophobicContact CD1-CD1 4.18Å
566	R	87.7	Confident	84.7	Confident	119 Å²	119	38 Å²	38	45%	0.449	20%	0.197	S	C	.	.	H	α-helix	trans	-63.9	-41.3	177.9	-63.3	-55.9	-169.3	178.7	5.5	112.9	Y389 E562 E563 A568 E569 N570	Y389-R566 HydrophobicContact CD1-CB 4.05Å; Y389-R566 HydrophobicContact CD2-CB 4.08Å; Y389-R566 HydrophobicContact CE1-CB 3.8Å; Y389-R566 HydrophobicContact CE1-CG 4.14Å; Y389-R566 HydrophobicContact CE2-CB 3.85Å; Y389-R566 HydrophobicContact CE2-CG 4.18Å; Y389-R566 HydrophobicContact CG-CB 4.18Å; E562-R566 WeakPolarHBondContact O-CG 3.37Å; E562-R566 PolarHBondContact O-N 3.44Å; E562-R566 VanDerWaalsContact O-N 3.11Å; E563-R566 PolarHBondContact O-N 2.85Å; E563-R566 VanDerWaalsContact O-N 3.17Å; R566-A568 VanDerWaalsContact C-N 3.31Å; R566-A568 PolarHBondContact O-N 3.09Å; R566-E569 IonicContact NH1-OE2 2.74Å; R566-E569 PolarHBondContact NH1-OE2 2.95Å; R566-E569 PolarHBondContact O-N 3.07Å; R566-N570 VanDerWaalsContact O-CB 3.32Å; R566-N570 WeakPolarHBondContact O-CB 3.45Å; R566-N570 PolarHBondContact O-N 2.86Å
567	I	88.9	Confident	84	Confident	11 Å²	11	39.1 Å²	39.1	6%	0.056	20%	0.202	C	C	.	.	H	α-helix	trans	-61.9	-42.8	175.8	-69.2	162.6	0	0	0	110.3	Y389 Y559 E563 K564 Y571 L572 V607	Y389-I567 HydrophobicContact CD1-CG1 4.2Å; Y389-I567 HydrophobicContact CG-CG1 4.27Å; Y559-I567 HydrophobicContact CD1-CD1 3.45Å; Y559-I567 VanDerWaalsContact CD1-CD1 3.45Å; Y559-I567 HydrophobicContact CD2-CD1 3.69Å; Y559-I567 HydrophobicContact CE1-CD1 3.52Å; Y559-I567 HydrophobicContact CE2-CD1 3.71Å; Y559-I567 HydrophobicContact CG-CD1 3.53Å; E563-I567 HydrophobicContact CB-CD1 4.49Å; E563-I567 WeakPolarHBondContact O-CB 3.3Å; E563-I567 WeakPolarHBondContact O-CD1 3.49Å; E563-I567 WeakPolarHBondContact O-CG1 3.35Å; E563-I567 PolarHBondContact O-N 2.63Å; K564-I567 PolarHBondContact O-N 2.88Å; I567-Y571 WeakPolarHBondContact O-CA 3.45Å; I567-Y571 WeakPolarHBondContact O-CB 3.17Å; I567-Y571 PolarHBondContact O-N 3.33Å; I567-L572 HydrophobicContact CG2-CD1 4.16Å; I567-L572 HydrophobicContact CG2-CD2 4.44Å; I567-L572 HydrophobicContact CG2-CG 4.04Å; I567-L572 PolarHBondContact O-N 2.94Å; I567-V607 HydrophobicContact CD1-CG1 4.45Å; I567-V607 HydrophobicContact CG2-CG1 4.14Å; I567-V607 HydrophobicContact CG2-CG2 4.11Å
568	A	88.1	Confident	83.8	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	22%	0.223	C	C	.	.	I	π-helix	trans	-64.5	-47.8	177.5	0	0	0	0	0	112.2	K564 L565 R566 L572 I573 L594 L610 I614	K564-A568 VanDerWaalsContact O-CB 3.24Å; K564-A568 WeakPolarHBondContact O-CB 3.31Å; K564-A568 PolarHBondContact O-N 2.84Å; L565-A568 PolarHBondContact O-N 3.25Å; R566-A568 VanDerWaalsContact C-N 3.31Å; R566-A568 PolarHBondContact O-N 3.09Å; A568-L572 HydrophobicContact CB-CD1 4.23Å; A568-L572 PolarHBondContact O-N 2.85Å; A568-I573 WeakPolarHBondContact O-CB 3.46Å; A568-I573 VanDerWaalsContact O-CG1 3.26Å; A568-I573 WeakPolarHBondContact O-CG1 3.39Å; A568-I573 PolarHBondContact O-N 3.05Å; A568-L594 HydrophobicContact CB-CD1 4.02Å; A568-L594 HydrophobicContact CB-CD2 3.87Å; A568-L594 HydrophobicContact CB-CG 4.37Å; A568-L610 HydrophobicContact CB-CD2 4.09Å; A568-I614 HydrophobicContact CB-CD1 3.83Å
569	E	86.6	Confident	83.3	Confident	59 Å²	59	46.7 Å²	46.7	28%	0.276	24%	0.244	S	C	.	.	I	π-helix	trans	-61	-50	178.9	-73.3	173.8	172.6	0	0	112.4	L565 R566 P574 L594	L565-E569 WeakPolarHBondContact O-CG 3.48Å; L565-E569 PolarHBondContact O-N 3.03Å; R566-E569 IonicContact NH1-OE2 2.74Å; R566-E569 PolarHBondContact NH1-OE2 2.95Å; R566-E569 PolarHBondContact O-N 3.07Å; E569-P574 VanDerWaalsContact O-CD 3.29Å; E569-P574 WeakPolarHBondContact O-CD 3.35Å; E569-L594 HydrophobicContact CG-CD2 3.9Å
570	N	86.9	Confident	82.4	Confident	87 Å²	87	46.2 Å²	46.2	47%	0.465	24%	0.243	S	C	.	.	I	π-helix	trans	-86.8	-25.5	-169.5	-66.2	-16.5	0	0	0	113.5	R566	R566-N570 VanDerWaalsContact O-CB 3.32Å; R566-N570 WeakPolarHBondContact O-CB 3.45Å; R566-N570 PolarHBondContact O-N 2.86Å
571	Y	87.9	Confident	81.9	Confident	35 Å²	35	48.3 Å²	48.3	14%	0.137	27%	0.267	C	S	.	.	I	π-helix	trans	-126.2	-58	-170.6	-53.5	-93.3	0	0	0	112.5	D385 A386 D387 H388 Y389 I567 P574 Q575	D385-Y571 PolarHBondContact O-OH 3.45Å; A386-Y571 WeakPolarHBondContact O-CE1 3.39Å; D387-Y571 VanDerWaalsContact O-CD1 3.3Å; D387-Y571 WeakPolarHBondContact O-CD1 3.48Å; D387-Y571 WeakPolarHBondContact O-CE1 3.48Å; H388-Y571 VanDerWaalsContact C-OH 3.28Å; Y389-Y571 PolarHBondContact N-OH 2.93Å; I567-Y571 WeakPolarHBondContact O-CA 3.45Å; I567-Y571 WeakPolarHBondContact O-CB 3.17Å; I567-Y571 PolarHBondContact O-N 3.33Å; Y571-P574 WeakPolarHBondContact O-CD 3.38Å; Y571-Q575 WeakPolarHBondContact O-CB 3.47Å; Y571-Q575 WeakPolarHBondContact O-CG 3.17Å; Y571-Q575 PolarHBondContact O-N 3.37Å
572	L	87.2	Confident	81.3	Confident	12 Å²	12	46.3 Å²	46.3	6%	0.063	25%	0.249	C	C	.	.	I	π-helix	trans	-68.4	-43.6	-170.3	-52.8	176.2	0	0	0	112.1	I567 A568 T576 V607 L610 K611 I614	I567-L572 HydrophobicContact CG2-CD1 4.16Å; I567-L572 HydrophobicContact CG2-CD2 4.44Å; I567-L572 HydrophobicContact CG2-CG 4.04Å; I567-L572 PolarHBondContact O-N 2.94Å; A568-L572 HydrophobicContact CB-CD1 4.23Å; A568-L572 PolarHBondContact O-N 2.85Å; L572-T576 WeakPolarHBondContact O-CB 3.13Å; L572-T576 PolarHBondContact O-N 3.19Å; L572-T576 PolarHBondContact O-OG1 3.25Å; L572-V607 HydrophobicContact CD1-CB 3.86Å; L572-V607 HydrophobicContact CD1-CG1 4.45Å; L572-V607 HydrophobicContact CD1-CG2 4.09Å; L572-V607 HydrophobicContact CD2-CG2 4.29Å; L572-L610 HydrophobicContact CD1-CD2 4.06Å; L572-L610 HydrophobicContact CD1-CG 3.97Å; L572-K611 HydrophobicContact CD2-CB 4.33Å; L572-K611 HydrophobicContact CD2-CG 4.41Å; L572-I614 HydrophobicContact CB-CD1 3.84Å; L572-I614 HydrophobicContact CD1-CD1 4.03Å
573	I	85.7	Confident	80.5	Confident	21 Å²	21	43.7 Å²	43.7	11%	0.108	25%	0.246	C	C	.	.	H	α-helix	trans	-65.2	-51.4	179.4	-68.4	168.6	0	0	0	110.5	A568 Q575 T576 K577 I589 L594 I614	A568-I573 WeakPolarHBondContact O-CB 3.46Å; A568-I573 VanDerWaalsContact O-CG1 3.26Å; A568-I573 WeakPolarHBondContact O-CG1 3.39Å; A568-I573 PolarHBondContact O-N 3.05Å; I573-Q575 PolarHBondContact O-N 3.04Å; I573-T576 PolarHBondContact O-N 2.88Å; I573-K577 HydrophobicContact CG2-CD 4.22Å; I573-K577 HydrophobicContact CG2-CG 4.48Å; I573-K577 WeakPolarHBondContact O-CB 3.31Å; I573-K577 WeakPolarHBondContact O-CG 3.32Å; I573-K577 PolarHBondContact O-N 2.94Å; I573-I589 HydrophobicContact CD1-CD1 4.19Å; I573-I589 HydrophobicContact CG1-CD1 4.33Å; I573-L594 HydrophobicContact CD1-CD2 4.09Å; I573-I614 HydrophobicContact CG1-CD1 4.26Å; I573-I614 HydrophobicContact CG1-CG2 3.98Å
574	P	84.6	Confident	79.5	Confident	62 Å²	62	46.7 Å²	46.7	40%	0.403	27%	0.266	S	S	.	.	H	α-helix	trans	-58.5	-44.7	175.6	-27.8	36.6	0	0	0	113.6	E569 Y571 K577 A578	E569-P574 VanDerWaalsContact O-CD 3.29Å; E569-P574 WeakPolarHBondContact O-CD 3.35Å; Y571-P574 WeakPolarHBondContact O-CD 3.38Å; P574-K577 PolarHBondContact O-N 3.29Å; P574-A578 WeakPolarHBondContact O-CB 3.23Å; P574-A578 PolarHBondContact O-N 2.9Å
575	Q	83.6	Confident	78.5	Confident	89 Å²	89	52.1 Å²	52.1	42%	0.416	30%	0.296	S	S	.	.	H	α-helix	trans	-63.1	-44.3	178	-74.2	174.5	5.9	0	0	111.5	Y571 I573 K577 A578 E579	Y571-Q575 WeakPolarHBondContact O-CB 3.47Å; Y571-Q575 WeakPolarHBondContact O-CG 3.17Å; Y571-Q575 PolarHBondContact O-N 3.37Å; I573-Q575 PolarHBondContact O-N 3.04Å; Q575-K577 VanDerWaalsContact C-N 3.34Å; Q575-K577 PolarHBondContact O-N 2.92Å; Q575-A578 PolarHBondContact O-N 2.95Å; Q575-E579 WeakPolarHBondContact O-CB 3.36Å; Q575-E579 VanDerWaalsContact O-CG 3.32Å; Q575-E579 WeakPolarHBondContact O-CG 3.36Å; Q575-E579 PolarHBondContact O-N 3.34Å
576	T	79.6	Confident	77.4	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-64.1	-41.1	177.6	-55.2	0	0	0	0	110.7	L572 I573 A578 E579 C580 I614 E615	L572-T576 WeakPolarHBondContact O-CB 3.13Å; L572-T576 PolarHBondContact O-N 3.19Å; L572-T576 PolarHBondContact O-OG1 3.25Å; I573-T576 PolarHBondContact O-N 2.88Å; T576-A578 PolarHBondContact O-N 3.45Å; T576-E579 PolarHBondContact O-N 3.01Å; T576-C580 WeakPolarHBondContact O-CB 3.32Å; T576-C580 PolarHBondContact O-N 3.44Å; T576-C580 PolarHBondContact O-SG 2.89Å; T576-I614 HydrophobicContact CG2-CG2 4.29Å; T576-E615 HydrophobicContact CG2-CB 4.37Å; T576-E615 HydrophobicContact CG2-CG 3.84Å
577	K	76.3	Confident	76.4	Confident	25 Å²	25	48.7 Å²	48.7	11%	0.109	29%	0.285	C	S	.	.	H	α-helix	trans	-59.5	-45	174	-75.7	-178.7	176.9	-174.2	0	111.6	I573 P574 Q575 C580 G581 I582 T584 V587	I573-K577 HydrophobicContact CG2-CD 4.22Å; I573-K577 HydrophobicContact CG2-CG 4.48Å; I573-K577 WeakPolarHBondContact O-CB 3.31Å; I573-K577 WeakPolarHBondContact O-CG 3.32Å; I573-K577 PolarHBondContact O-N 2.94Å; P574-K577 PolarHBondContact O-N 3.29Å; Q575-K577 VanDerWaalsContact C-N 3.34Å; Q575-K577 PolarHBondContact O-N 2.92Å; K577-C580 CarbonylContact O-C 3.53Å; K577-C580 PolarHBondContact O-N 3.38Å; K577-G581 PolarHBondContact O-N 3.31Å; K577-I582 HydrophobicContact CB-CB 4.44Å; K577-I582 HydrophobicContact CG-CB 4.46Å; K577-I582 PolarHBondContact O-N 2.92Å; K577-T584 PolarHBondContact NZ-O 3.46Å; K577-V587 WeakPolarHBondContact CE-O 3.41Å; K577-V587 PolarHBondContact NZ-O 3.49Å
578	A	76.1	Confident	75.8	Confident	79 Å²	79	51.9 Å²	51.9	65%	0.653	30%	0.302	S	S	*	.	H	α-helix	trans	-67.1	-47.1	178.5	0	0	0	0	0	112.6	P574 Q575 T576 C580 G581	P574-A578 WeakPolarHBondContact O-CB 3.23Å; P574-A578 PolarHBondContact O-N 2.9Å; Q575-A578 PolarHBondContact O-N 2.95Å; T576-A578 PolarHBondContact O-N 3.45Å; A578-C580 PolarHBondContact O-N 3.5Å; A578-G581 PolarHBondContact O-N 3.35Å; A578-G581 VanDerWaalsContact O-N 3.11Å
579	E	71.2	Confident	75.5	Confident	124 Å²	124	53.1 Å²	53.1	58%	0.579	31%	0.309	S	S	*	.	H	α-helix	trans	-60.9	-35.2	176.3	-73.8	174.5	-178.7	0	0	111.5	Q575 T576 K611	Q575-E579 WeakPolarHBondContact O-CB 3.36Å; Q575-E579 VanDerWaalsContact O-CG 3.32Å; Q575-E579 WeakPolarHBondContact O-CG 3.36Å; Q575-E579 PolarHBondContact O-N 3.34Å; T576-E579 PolarHBondContact O-N 3.01Å; E579-K611 IonicContact OE1-NZ 3.06Å; E579-K611 PolarHBondContact OE1-NZ 2.64Å; E579-K611 IonicContact OE2-NZ 2.95Å; E579-K611 PolarHBondContact OE2-NZ 2.61Å
580	C	64.3	Low	75.2	Confident	12 Å²	12	51.2 Å²	51.2	8%	0.081	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.8	9.2	176.4	-62.3	0	0	0	0	113.9	T576 K577 A578 I582 I621	T576-C580 WeakPolarHBondContact O-CB 3.32Å; T576-C580 PolarHBondContact O-N 3.44Å; T576-C580 PolarHBondContact O-SG 2.89Å; K577-C580 CarbonylContact O-C 3.53Å; K577-C580 PolarHBondContact O-N 3.38Å; A578-C580 PolarHBondContact O-N 3.5Å; C580-I582 HydrophobicContact CB-CD1 3.85Å; C580-I582 HydrophobicContact CB-CG1 3.76Å; C580-I582 WeakPolarHBondContact O-CG1 3.36Å; C580-I582 PolarHBondContact O-N 2.81Å; C580-I582 VanDerWaalsContact O-N 3.1Å; C580-I621 WeakPolarHBondContact O-CB 3.47Å; C580-I621 WeakPolarHBondContact O-CD1 3.29Å; C580-I621 WeakPolarHBondContact O-CG1 3.32Å
581	G	65.5	Low	75	Confident	56 Å²	56	50.6 Å²	50.6	58%	0.577	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.3	28.2	177.4	0	0	0	0	0	116.2	K577 A578	K577-G581 PolarHBondContact O-N 3.31Å; A578-G581 PolarHBondContact O-N 3.35Å; A578-G581 VanDerWaalsContact O-N 3.11Å
582	I	64.7	Low	74.9	Confident	11 Å²	11	53.8 Å²	53.8	6%	0.056	33%	0.325	C	S	.	.			trans	-88.8	130.5	-177.4	-49.2	-176.7	0	0	0	109.1	K577 C580 M586 V587 F620	K577-I582 HydrophobicContact CB-CB 4.44Å; K577-I582 HydrophobicContact CG-CB 4.46Å; K577-I582 PolarHBondContact O-N 2.92Å; C580-I582 HydrophobicContact CB-CD1 3.85Å; C580-I582 HydrophobicContact CB-CG1 3.76Å; C580-I582 WeakPolarHBondContact O-CG1 3.36Å; C580-I582 PolarHBondContact O-N 2.81Å; C580-I582 VanDerWaalsContact O-N 3.1Å; I582-M586 HydrophobicContact CG2-CB 3.82Å; I582-M586 HydrophobicContact CG2-SD 4.41Å; I582-V587 HydrophobicContact CD1-CG2 4.49Å; I582-V587 HydrophobicContact CG2-CG2 4.08Å; I582-F620 HydrophobicContact CD1-CB 3.65Å; I582-F620 HydrophobicContact CG1-CB 3.73Å
583	A	65.1	Low	74.6	Confident	49 Å²	49	53.2 Å²	53.2	41%	0.405	32%	0.322	S	S	.	.			trans	-61.6	145.6	170.4	0	0	0	0	0	110.4	D585 M586	A583-D585 PolarHBondContact O-N 3.48Å; A583-M586 HydrophobicContact CB-CE 4.02Å; A583-M586 HydrophobicContact CB-CG 4.08Å; A583-M586 HydrophobicContact CB-SD 4.02Å; A583-M586 PolarHBondContact O-N 3.29Å
584	T	63.4	Low	74.6	Confident	97 Å²	97	52.3 Å²	52.3	60%	0.595	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.9	-30	-173.1	40.4	0	0	0	0	113.6	K577	K577-T584 PolarHBondContact NZ-O 3.46Å
585	D	65.9	Low	74.7	Confident	122 Å²	122	54.6 Å²	54.6	65%	0.652	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.9	-9.6	-168.3	-50.3	-17.9	0	0	0	113.2	A583	A583-D585 PolarHBondContact O-N 3.48Å
586	M	65.4	Low	74.7	Confident	68 Å²	68	52.5 Å²	52.5	34%	0.335	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.7	-30	-174.5	-72.8	179.8	178.1	0	0	113.8	I582 A583 F620 A643 I644	I582-M586 HydrophobicContact CG2-CB 3.82Å; I582-M586 HydrophobicContact CG2-SD 4.41Å; A583-M586 HydrophobicContact CB-CE 4.02Å; A583-M586 HydrophobicContact CB-CG 4.08Å; A583-M586 HydrophobicContact CB-SD 4.02Å; A583-M586 PolarHBondContact O-N 3.29Å; M586-F620 HydrophobicContact SD-CE1 4.34Å; M586-F620 HydrophobicContact SD-CZ 4.24Å; M586-A643 CarbonylContact O-C 3.56Å; M586-A643 WeakPolarHBondContact O-CA 3.18Å; M586-I644 PolarHBondContact O-N 2.96Å
587	V	68.6	Low	74.9	Confident	3 Å²	3	52.5 Å²	52.5	2%	0.018	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	117.1	-178	-179.1	0	0	0	0	110.2	K577 I582 I644	K577-V587 WeakPolarHBondContact CE-O 3.41Å; K577-V587 PolarHBondContact NZ-O 3.49Å; I582-V587 HydrophobicContact CD1-CG2 4.49Å; I582-V587 HydrophobicContact CG2-CG2 4.08Å; V587-I644 WeakPolarHBondContact CA-O 3.37Å
588	N	75.6	Confident	75.3	Confident	79 Å²	79	51.9 Å²	51.9	42%	0.422	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	121	176.6	-73.5	-32.8	0	0	0	110.5	I644 T645 V646	N588-I644 PolarHBondContact N-O 2.77Å; N588-I644 VanDerWaalsContact N-O 3.08Å; N588-T645 CarbonylContact O-C 3.58Å; N588-T645 WeakPolarHBondContact O-CA 3.34Å; N588-V646 PolarHBondContact O-N 2.86Å
589	I	80.7	Confident	75.4	Confident	25 Å²	25	54 Å²	54	13%	0.128	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	117.8	174.8	-56.4	175.2	0	0	0	107.1	I573 A593 L594 I614 V617 V646	I573-I589 HydrophobicContact CD1-CD1 4.19Å; I573-I589 HydrophobicContact CG1-CD1 4.33Å; I589-A593 HydrophobicContact CG2-CB 4.19Å; I589-L594 HydrophobicContact CG2-CB 4.06Å; I589-I614 HydrophobicContact CD1-CG2 4.36Å; I589-V617 HydrophobicContact CD1-CB 4.27Å; I589-V617 HydrophobicContact CD1-CG1 3.74Å; I589-V617 HydrophobicContact CG1-CG1 3.89Å; I589-V646 HydrophobicContact CG1-CB 4.41Å
590	G	80.8	Confident	75.8	Confident	19 Å²	19	51.9 Å²	51.9	20%	0.196	29%	0.294	C	S	.	.			trans	-62.6	147.1	177	0	0	0	0	0	111.5	D592 A593 L594 V646	G590-D592 PolarHBondContact O-N 2.99Å; G590-A593 WeakPolarHBondContact O-CB 3.23Å; G590-A593 PolarHBondContact O-N 3.28Å; G590-L594 PolarHBondContact O-N 2.84Å; G590-V646 PolarHBondContact N-O 2.82Å
591	P	82.9	Confident	76.6	Confident	74 Å²	74	51.7 Å²	51.7	48%	0.481	29%	0.291	S	S	.	.	H	α-helix	trans	-58.5	-36.2	-177.6	22.5	-33.2	0	0	0	112.4	L594 K595	P591-L594 PolarHBondContact O-N 2.84Å; P591-K595 WeakPolarHBondContact O-CG 2.97Å; P591-K595 PolarHBondContact O-N 3.24Å
592	D	84.8	Confident	77.4	Confident	102 Å²	102	49.3 Å²	49.3	55%	0.545	27%	0.266	S	S	.	.	H	α-helix	trans	-72.7	-34.2	177.8	-62.7	-34.6	0	0	0	112.7	G590 L594 K595 L596	G590-D592 PolarHBondContact O-N 2.99Å; D592-L594 VanDerWaalsContact C-N 3.32Å; D592-K595 PolarHBondContact O-N 3.28Å; D592-K595 IonicContact OD1-NZ 3.64Å; D592-L596 VanDerWaalsContact O-CB 3.31Å; D592-L596 WeakPolarHBondContact O-CB 3.35Å; D592-L596 PolarHBondContact O-N 3.27Å
593	A	82.6	Confident	77.8	Confident	1 Å²	1	53.5 Å²	53.5	1%	0.008	28%	0.281	C	S	.	.	H	α-helix	trans	-64.7	-40.1	172.4	0	0	0	0	0	110.8	I589 G590 L596 L597	I589-A593 HydrophobicContact CG2-CB 4.19Å; G590-A593 WeakPolarHBondContact O-CB 3.23Å; G590-A593 PolarHBondContact O-N 3.28Å; A593-L596 WeakPolarHBondContact O-CB 3.33Å; A593-L596 PolarHBondContact O-N 3.05Å; A593-L597 VanDerWaalsContact O-CB 3.32Å; A593-L597 WeakPolarHBondContact O-CB 3.36Å; A593-L597 PolarHBondContact O-N 2.96Å
594	L	85.6	Confident	78.4	Confident	2 Å²	2	52.8 Å²	52.8	1%	0.01	27%	0.269	C	S	.	.	H	α-helix	trans	-68	-42.5	177.7	-171.4	58.2	0	0	0	112.1	L565 A568 E569 I573 I589 G590 P591 D592 L596 L597 I598 I614	L565-L594 HydrophobicContact CD1-CB 3.97Å; L565-L594 HydrophobicContact CD1-CD2 3.59Å; L565-L594 HydrophobicContact CD1-CG 3.65Å; A568-L594 HydrophobicContact CB-CD1 4.02Å; A568-L594 HydrophobicContact CB-CD2 3.87Å; A568-L594 HydrophobicContact CB-CG 4.37Å; E569-L594 HydrophobicContact CG-CD2 3.9Å; I573-L594 HydrophobicContact CD1-CD2 4.09Å; I589-L594 HydrophobicContact CG2-CB 4.06Å; G590-L594 PolarHBondContact O-N 2.84Å; P591-L594 PolarHBondContact O-N 2.84Å; D592-L594 VanDerWaalsContact C-N 3.32Å; L594-L596 VanDerWaalsContact C-N 3.33Å; L594-L596 PolarHBondContact O-N 3.33Å; L594-L597 WeakPolarHBondContact O-CB 3.33Å; L594-L597 PolarHBondContact O-N 3.09Å; L594-I598 HydrophobicContact CG-CD1 4.41Å; L594-I598 WeakPolarHBondContact O-CG1 3.36Å; L594-I598 PolarHBondContact O-N 3.01Å; L594-I614 HydrophobicContact CD1-CD1 4.45Å
595	K	85.9	Confident	79.1	Confident	110 Å²	110	48.8 Å²	48.8	48%	0.478	25%	0.245	S	C	.	.	H	α-helix	trans	-58.5	-44.8	171.2	-72.9	173.3	-173.6	169	0	111.6	L565 P591 D592 L597 I598 K599	L565-K595 HydrophobicContact CD1-CG 3.97Å; L565-K595 HydrophobicContact CD2-CG 4.26Å; P591-K595 WeakPolarHBondContact O-CG 2.97Å; P591-K595 PolarHBondContact O-N 3.24Å; D592-K595 PolarHBondContact O-N 3.28Å; D592-K595 IonicContact OD1-NZ 3.64Å; K595-L597 VanDerWaalsContact C-N 3.31Å; K595-L597 PolarHBondContact O-N 3.26Å; K595-I598 PolarHBondContact O-N 2.94Å; K595-K599 WeakPolarHBondContact O-CB 3.46Å; K595-K599 PolarHBondContact O-N 3.14Å
596	L	83.3	Confident	80.1	Confident	44 Å²	44	43 Å²	43	23%	0.23	21%	0.214	C	C	.	.	H	α-helix	trans	-62.2	-40.6	176.9	-173.1	66.4	0	0	0	111.4	D592 A593 L594 K599 K600 D648 L651	D592-L596 VanDerWaalsContact O-CB 3.31Å; D592-L596 WeakPolarHBondContact O-CB 3.35Å; D592-L596 PolarHBondContact O-N 3.27Å; A593-L596 WeakPolarHBondContact O-CB 3.33Å; A593-L596 PolarHBondContact O-N 3.05Å; L594-L596 VanDerWaalsContact C-N 3.33Å; L594-L596 PolarHBondContact O-N 3.33Å; L596-K599 PolarHBondContact O-N 2.99Å; L596-K600 HydrophobicContact CD1-CD 3.55Å; L596-K600 HydrophobicContact CD1-CG 3.92Å; L596-K600 HydrophobicContact CG-CD 4.31Å; L596-K600 WeakPolarHBondContact O-CB 3.46Å; L596-K600 PolarHBondContact O-N 3.38Å; L596-D648 HydrophobicContact CD2-CB 4.01Å; L596-L651 HydrophobicContact CB-CD2 4.14Å; L596-L651 HydrophobicContact CD2-CD2 3.89Å; L596-L651 HydrophobicContact CG-CD2 4.05Å
597	L	84.4	Confident	81.3	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-63.4	-46.3	177.5	-174.6	146.3	0	0	0	111.6	A593 L594 K595 Y601 C602 L610 Q613 V617 L651 V655	A593-L597 VanDerWaalsContact O-CB 3.32Å; A593-L597 WeakPolarHBondContact O-CB 3.36Å; A593-L597 PolarHBondContact O-N 2.96Å; L594-L597 WeakPolarHBondContact O-CB 3.33Å; L594-L597 PolarHBondContact O-N 3.09Å; K595-L597 VanDerWaalsContact C-N 3.31Å; K595-L597 PolarHBondContact O-N 3.26Å; L597-Y601 WeakPolarHBondContact O-CB 3.47Å; L597-Y601 PolarHBondContact O-N 3.39Å; L597-C602 PolarHBondContact O-N 3.18Å; L597-C602 PolarHBondContact O-SG 3.44Å; L597-L610 HydrophobicContact CD2-CD1 3.15Å; L597-Q613 HydrophobicContact CD1-CB 3.98Å; L597-Q613 HydrophobicContact CD2-CB 3.92Å; L597-Q613 HydrophobicContact CG-CB 4.17Å; L597-V617 HydrophobicContact CD1-CG2 4.03Å; L597-L651 HydrophobicContact CB-CD2 4.06Å; L597-L651 HydrophobicContact CD1-CD1 4.01Å; L597-V655 HydrophobicContact CD1-CG1 4.04Å
598	I	83.8	Confident	82.2	Confident	13 Å²	13	47.7 Å²	47.7	7%	0.067	23%	0.229	C	C	.	.	H	α-helix	trans	-60.7	-48.7	176.3	-68.3	166.4	0	0	0	110	A561 K564 L565 L594 K595 C602 L610	A561-I598 HydrophobicContact CB-CG2 4.34Å; K564-I598 HydrophobicContact CB-CD1 3.99Å; K564-I598 HydrophobicContact CB-CG2 4.47Å; K564-I598 HydrophobicContact CD-CG2 4.23Å; L565-I598 HydrophobicContact CB-CD1 4.06Å; L565-I598 HydrophobicContact CD1-CD1 4.18Å; L594-I598 HydrophobicContact CG-CD1 4.41Å; L594-I598 WeakPolarHBondContact O-CG1 3.36Å; L594-I598 PolarHBondContact O-N 3.01Å; K595-I598 PolarHBondContact O-N 2.94Å; I598-C602 CarbonylContact O-C 3.54Å; I598-C602 PolarHBondContact O-N 3.31Å; I598-L610 HydrophobicContact CD1-CD2 4.29Å; I598-L610 HydrophobicContact CG1-CD1 3.8Å; I598-L610 HydrophobicContact CG1-CD2 4.01Å
599	K	79.6	Confident	82.7	Confident	123 Å²	123	46.3 Å²	46.3	54%	0.535	22%	0.222	S	C	.	.	H	α-helix	trans	-68.1	-49	-175.8	-172.5	173.1	-177.8	172.1	0	113.4	K595 L596	K595-K599 WeakPolarHBondContact O-CB 3.46Å; K595-K599 PolarHBondContact O-N 3.14Å; L596-K599 PolarHBondContact O-N 2.99Å
600	K	79.1	Confident	83	Confident	80 Å²	80	45.1 Å²	45.1	35%	0.348	22%	0.216	S	C	.	.	H	α-helix	trans	-94.4	-12.5	-170.2	-69.7	-166.1	-179.4	179.9	0	115.1	L596 P658 V659 F660	L596-K600 HydrophobicContact CD1-CD 3.55Å; L596-K600 HydrophobicContact CD1-CG 3.92Å; L596-K600 HydrophobicContact CG-CD 4.31Å; L596-K600 WeakPolarHBondContact O-CB 3.46Å; L596-K600 PolarHBondContact O-N 3.38Å; K600-P658 HydrophobicContact CB-CB 4.2Å; K600-P658 HydrophobicContact CD-CB 4.12Å; K600-P658 HydrophobicContact CD-CG 4.18Å; K600-V659 PolarHBondContact O-N 2.79Å; K600-F660 WeakPolarHBondContact O-CD2 3.39Å; K600-F660 PolarHBondContact O-N 2.97Å
601	Y	81.6	Confident	83.3	Confident	7 Å²	7	46.5 Å²	46.5	3%	0.027	22%	0.216	C	C	.	.	H	α-helix	trans	-127.7	-17.1	-175.5	-58	-99.9	0	0	0	114.3	L597 N609 L651 V655 G656 K657 P658 V659	L597-Y601 WeakPolarHBondContact O-CB 3.47Å; L597-Y601 PolarHBondContact O-N 3.39Å; Y601-N609 PolarHBondContact O-ND2 2.99Å; Y601-L651 HydrophobicContact CE2-CD2 4.07Å; Y601-V655 HydrophobicContact CD1-CB 4.35Å; Y601-V655 HydrophobicContact CD1-CG2 3.9Å; Y601-V655 HydrophobicContact CD2-CG2 4.39Å; Y601-V655 HydrophobicContact CE1-CB 4.16Å; Y601-V655 HydrophobicContact CE1-CG2 3.41Å; Y601-V655 VanDerWaalsContact CE1-CG2 3.41Å; Y601-V655 HydrophobicContact CE2-CG2 3.94Å; Y601-V655 HydrophobicContact CG-CG2 4.36Å; Y601-V655 VanDerWaalsContact CZ-CG2 3.43Å; Y601-G656 PolarHBondContact OH-O 3.26Å; Y601-K657 WeakPolarHBondContact CE1-O 3.3Å; Y601-P658 WeakPolarHBondContact OH-CD 3.36Å; Y601-V659 HydrophobicContact CD1-CG2 4.32Å
602	C	81.2	Confident	83.4	Confident	6 Å²	6	48.1 Å²	48.1	4%	0.041	22%	0.216	C	C	.	.			trans	-124.5	71	-170	-52.5	0	0	0	0	113.5	L597 I598 E604 L610	L597-C602 PolarHBondContact O-N 3.18Å; L597-C602 PolarHBondContact O-SG 3.44Å; I598-C602 CarbonylContact O-C 3.54Å; I598-C602 PolarHBondContact O-N 3.31Å; C602-E604 PolarHBondContact O-N 3.12Å; C602-L610 HydrophobicContact CB-CB 4.44Å
603	R	73.7	Confident	83.3	Confident	100 Å²	100	43.9 Å²	43.9	38%	0.377	19%	0.193	S	C	.	.			trans	-87.7	80.7	169.9	-167.9	173.3	171.2	177.9	-6.7	110.9	F660 E756	R603-F660 HydrophobicContact CB-CD1 4.33Å; R603-F660 HydrophobicContact CB-CD2 4.06Å; R603-F660 HydrophobicContact CB-CE1 3.9Å; R603-F660 HydrophobicContact CB-CE2 3.62Å; R603-F660 HydrophobicContact CB-CG 4.42Å; R603-F660 HydrophobicContact CB-CZ 3.53Å; R603-E756 IonicContact NH2-OE1 2.75Å; R603-E756 PolarHBondContact NH2-OE1 2.95Å
604	E	77.3	Confident	83.4	Confident	34 Å²	34	43.8 Å²	43.8	16%	0.159	19%	0.192	C	C	.	.	S	Bend	trans	-139.4	168.7	173.9	52.1	171.3	164.2	0	0	109.8	K564 C602 G606 V607 R608 N609 L610	K564-E604 PolarHBondContact NZ-O 2.82Å; C602-E604 PolarHBondContact O-N 3.12Å; E604-G606 VanDerWaalsContact CD-O 3.27Å; E604-G606 VanDerWaalsContact CG-O 3.24Å; E604-G606 WeakPolarHBondContact CG-O 3.03Å; E604-V607 WeakPolarHBondContact OE1-CA 3.18Å; E604-R608 PolarHBondContact OE1-N 3.26Å; E604-R608 VanDerWaalsContact OE1-N 3.07Å; E604-R608 PolarHBondContact OE2-N 3.43Å; E604-N609 HydrophobicContact CG-CB 4.32Å; E604-N609 VanDerWaalsContact OE1-CA 3.3Å; E604-N609 WeakPolarHBondContact OE1-CA 3.29Å; E604-N609 VanDerWaalsContact OE1-CB 3.28Å; E604-N609 WeakPolarHBondContact OE1-CB 3.45Å; E604-N609 PolarHBondContact OE1-N 2.92Å; E604-N609 PolarHBondContact OE2-N 2.78Å; E604-L610 PolarHBondContact OE1-N 2.74Å
605	S	78.8	Confident	83	Confident	12 Å²	12	46.3 Å²	46.3	8%	0.084	20%	0.204	C	C	.	.	S	Bend	trans	-82.6	-36.9	170.7	-11.7	0	0	0	0	111.3	P421 Y559 M682	P421-S605 WeakPolarHBondContact CB-OG 3.5Å; Y559-S605 PolarHBondContact N-O 3.46Å; S605-M682 PolarHBondContact OG-O 3.4Å
606	G	86.3	Confident	82.3	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	19%	0.192	C	C	.	.	S	Bend	trans	-86	-157.3	176.3	0	0	0	0	0	114.3	G423 K564 E604	G423-G606 VanDerWaalsContact O-CA 3.3Å; G423-G606 WeakPolarHBondContact O-CA 3.36Å; K564-G606 VanDerWaalsContact CE-O 3.27Å; K564-G606 WeakPolarHBondContact CE-O 3.35Å; K564-G606 PolarHBondContact NZ-O 3.48Å; E604-G606 VanDerWaalsContact CD-O 3.27Å; E604-G606 VanDerWaalsContact CG-O 3.24Å; E604-G606 WeakPolarHBondContact CG-O 3.03Å
607	V	90	Very high	81.6	Confident	15 Å²	15	41.5 Å²	41.5	9%	0.091	18%	0.181	C	C	.	.	S	Bend	trans	-124.5	20.3	178.5	-65.8	0	0	0	0	113.4	G423 Y559 K564 I567 L572 E604 L610 K611	G423-V607 PolarHBondContact O-N 3.27Å; Y559-V607 HydrophobicContact CD2-CG1 3.91Å; Y559-V607 HydrophobicContact CE2-CG1 4.36Å; Y559-V607 HydrophobicContact CE2-CG2 4.4Å; K564-V607 HydrophobicContact CB-CG1 4.29Å; K564-V607 HydrophobicContact CD-CG1 4.37Å; K564-V607 HydrophobicContact CG-CG1 3.81Å; I567-V607 HydrophobicContact CD1-CG1 4.45Å; I567-V607 HydrophobicContact CG2-CG1 4.14Å; I567-V607 HydrophobicContact CG2-CG2 4.11Å; L572-V607 HydrophobicContact CD1-CB 3.86Å; L572-V607 HydrophobicContact CD1-CG1 4.45Å; L572-V607 HydrophobicContact CD1-CG2 4.09Å; L572-V607 HydrophobicContact CD2-CG2 4.29Å; E604-V607 WeakPolarHBondContact OE1-CA 3.18Å; V607-L610 HydrophobicContact CB-CB 4.13Å; V607-L610 HydrophobicContact CB-CD2 4.2Å; V607-L610 HydrophobicContact CG1-CD2 3.89Å; V607-L610 PolarHBondContact O-N 2.95Å; V607-K611 WeakPolarHBondContact O-CB 3.27Å; V607-K611 PolarHBondContact O-N 2.97Å
608	R	88.4	Confident	80.3	Confident	155 Å²	155	41.7 Å²	41.7	59%	0.585	18%	0.182	S	C	*	.	H	α-helix	trans	-72.1	-44.6	-174.7	-167.6	178.8	-160	173.9	6.6	112	E604 K612	E604-R608 PolarHBondContact OE1-N 3.26Å; E604-R608 VanDerWaalsContact OE1-N 3.07Å; E604-R608 PolarHBondContact OE2-N 3.43Å; R608-K612 WeakPolarHBondContact O-CG 3.35Å; R608-K612 PolarHBondContact O-N 2.84Å
609	N	85.3	Confident	78.5	Confident	50 Å²	50	41.9 Å²	41.9	27%	0.267	18%	0.184	S	C	.	.	H	α-helix	trans	-69.4	-38	171.9	-173.6	31.9	0	0	0	110.5	Y601 E604 K611 K612 Q613	Y601-N609 PolarHBondContact O-ND2 2.99Å; E604-N609 HydrophobicContact CG-CB 4.32Å; E604-N609 VanDerWaalsContact OE1-CA 3.3Å; E604-N609 WeakPolarHBondContact OE1-CA 3.29Å; E604-N609 VanDerWaalsContact OE1-CB 3.28Å; E604-N609 WeakPolarHBondContact OE1-CB 3.45Å; E604-N609 PolarHBondContact OE1-N 2.92Å; E604-N609 PolarHBondContact OE2-N 2.78Å; N609-K611 PolarHBondContact O-N 3.42Å; N609-K612 CarbonylContact O-C 3.53Å; N609-K612 WeakPolarHBondContact O-CB 3.26Å; N609-K612 PolarHBondContact O-N 2.87Å; N609-K612 VanDerWaalsContact O-N 3.11Å; N609-Q613 WeakPolarHBondContact O-CG 3.24Å; N609-Q613 PolarHBondContact O-N 3.25Å; N609-Q613 PolarHBondContact OD1-NE2 3.39Å
610	L	88.8	Confident	77	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-55.5	-48.8	173.1	179.6	55.4	0	0	0	111.6	K564 A568 L572 L597 I598 C602 E604 V607 K612 Q613 I614	K564-L610 HydrophobicContact CB-CD2 3.97Å; A568-L610 HydrophobicContact CB-CD2 4.09Å; L572-L610 HydrophobicContact CD1-CD2 4.06Å; L572-L610 HydrophobicContact CD1-CG 3.97Å; L597-L610 HydrophobicContact CD2-CD1 3.15Å; I598-L610 HydrophobicContact CD1-CD2 4.29Å; I598-L610 HydrophobicContact CG1-CD1 3.8Å; I598-L610 HydrophobicContact CG1-CD2 4.01Å; C602-L610 HydrophobicContact CB-CB 4.44Å; E604-L610 PolarHBondContact OE1-N 2.74Å; V607-L610 HydrophobicContact CB-CB 4.13Å; V607-L610 HydrophobicContact CB-CD2 4.2Å; V607-L610 HydrophobicContact CG1-CD2 3.89Å; V607-L610 PolarHBondContact O-N 2.95Å; L610-K612 VanDerWaalsContact C-N 3.34Å; L610-K612 PolarHBondContact O-N 3.39Å; L610-Q613 PolarHBondContact O-N 3.48Å; L610-Q613 VanDerWaalsContact O-N 3.16Å; L610-I614 HydrophobicContact CD1-CD1 3.98Å; L610-I614 HydrophobicContact CD1-CG1 4.27Å; L610-I614 HydrophobicContact CG-CD1 3.97Å; L610-I614 WeakPolarHBondContact O-CG1 3.24Å; L610-I614 PolarHBondContact O-N 2.95Å
611	K	87.1	Confident	75.1	Confident	48 Å²	48	39.6 Å²	39.6	21%	0.209	18%	0.178	C	C	.	.	H	α-helix	trans	-55.2	-48.9	173.4	-170	-176.5	-179.4	-171.5	0	111	L572 E579 V607 N609 Q613 I614 E615	L572-K611 HydrophobicContact CD2-CB 4.33Å; L572-K611 HydrophobicContact CD2-CG 4.41Å; E579-K611 IonicContact OE1-NZ 3.06Å; E579-K611 PolarHBondContact OE1-NZ 2.64Å; E579-K611 IonicContact OE2-NZ 2.95Å; E579-K611 PolarHBondContact OE2-NZ 2.61Å; V607-K611 WeakPolarHBondContact O-CB 3.27Å; V607-K611 PolarHBondContact O-N 2.97Å; N609-K611 PolarHBondContact O-N 3.42Å; K611-Q613 VanDerWaalsContact C-N 3.3Å; K611-Q613 PolarHBondContact O-N 2.87Å; K611-I614 PolarHBondContact O-N 2.83Å; K611-I614 VanDerWaalsContact O-N 3.13Å; K611-E615 WeakPolarHBondContact CE-OE1 3.29Å; K611-E615 HydrophobicContact CG-CG 4.42Å; K611-E615 IonicContact NZ-OE1 2.92Å; K611-E615 WeakPolarHBondContact O-CG 3.19Å; K611-E615 PolarHBondContact O-N 2.75Å
612	K	83.7	Confident	73	Confident	109 Å²	109	45.2 Å²	45.2	47%	0.474	21%	0.208	S	C	.	.	H	α-helix	trans	-59.4	-36.5	177.8	-72	179	178.6	-177.4	0	113.6	R608 N609 L610 K616	R608-K612 WeakPolarHBondContact O-CG 3.35Å; R608-K612 PolarHBondContact O-N 2.84Å; N609-K612 CarbonylContact O-C 3.53Å; N609-K612 WeakPolarHBondContact O-CB 3.26Å; N609-K612 PolarHBondContact O-N 2.87Å; N609-K612 VanDerWaalsContact O-N 3.11Å; L610-K612 VanDerWaalsContact C-N 3.34Å; L610-K612 PolarHBondContact O-N 3.39Å; K612-K616 WeakPolarHBondContact O-CG 3.37Å; K612-K616 PolarHBondContact O-N 3.07Å
613	Q	83.4	Confident	70.7	Confident	12 Å²	12	51.7 Å²	51.7	6%	0.056	24%	0.241	C	C	.	.	H	α-helix	trans	-74.5	-36.4	176.9	-60.8	-58.1	-18.8	0	0	111.1	L597 N609 L610 K611 K616 V617 V655	L597-Q613 HydrophobicContact CD1-CB 3.98Å; L597-Q613 HydrophobicContact CD2-CB 3.92Å; L597-Q613 HydrophobicContact CG-CB 4.17Å; N609-Q613 WeakPolarHBondContact O-CG 3.24Å; N609-Q613 PolarHBondContact O-N 3.25Å; N609-Q613 PolarHBondContact OD1-NE2 3.39Å; L610-Q613 PolarHBondContact O-N 3.48Å; L610-Q613 VanDerWaalsContact O-N 3.16Å; K611-Q613 VanDerWaalsContact C-N 3.3Å; K611-Q613 PolarHBondContact O-N 2.87Å; Q613-K616 WeakPolarHBondContact O-CB 3.47Å; Q613-K616 PolarHBondContact O-N 2.88Å; Q613-K616 VanDerWaalsContact OE1-NZ 3.16Å; Q613-V617 WeakPolarHBondContact O-CG2 3.47Å; Q613-V617 PolarHBondContact O-N 2.84Å; Q613-V617 VanDerWaalsContact O-N 3.14Å; Q613-V655 HydrophobicContact CB-CG1 4.36Å
614	I	83.8	Confident	68.9	Low	0 Å²	0	52.5 Å²	52.5	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-63.7	-44.6	173.1	-66.9	165.8	0	0	0	110.6	A568 L572 I573 T576 I589 L594 L610 K611 K616 V617 S618	A568-I614 HydrophobicContact CB-CD1 3.83Å; L572-I614 HydrophobicContact CB-CD1 3.84Å; L572-I614 HydrophobicContact CD1-CD1 4.03Å; I573-I614 HydrophobicContact CG1-CD1 4.26Å; I573-I614 HydrophobicContact CG1-CG2 3.98Å; T576-I614 HydrophobicContact CG2-CG2 4.29Å; I589-I614 HydrophobicContact CD1-CG2 4.36Å; L594-I614 HydrophobicContact CD1-CD1 4.45Å; L610-I614 HydrophobicContact CD1-CD1 3.98Å; L610-I614 HydrophobicContact CD1-CG1 4.27Å; L610-I614 HydrophobicContact CG-CD1 3.97Å; L610-I614 WeakPolarHBondContact O-CG1 3.24Å; L610-I614 PolarHBondContact O-N 2.95Å; K611-I614 PolarHBondContact O-N 2.83Å; K611-I614 VanDerWaalsContact O-N 3.13Å; I614-K616 PolarHBondContact O-N 3.29Å; I614-V617 WeakPolarHBondContact O-CA 3.4Å; I614-V617 WeakPolarHBondContact O-CB 3.27Å; I614-V617 PolarHBondContact O-N 2.96Å; I614-S618 PolarHBondContact O-N 3.33Å; I614-S618 PolarHBondContact O-OG 3.49Å
615	E	78.2	Confident	67.1	Low	55 Å²	55	58.4 Å²	58.4	26%	0.257	29%	0.294	S	S	.	.	H	α-helix	trans	-56.4	-36.7	174.3	-74	168	-177.2	0	0	112.5	T576 K611	T576-E615 HydrophobicContact CG2-CB 4.37Å; T576-E615 HydrophobicContact CG2-CG 3.84Å; K611-E615 WeakPolarHBondContact CE-OE1 3.29Å; K611-E615 HydrophobicContact CG-CG 4.42Å; K611-E615 IonicContact NZ-OE1 2.92Å; K611-E615 WeakPolarHBondContact O-CG 3.19Å; K611-E615 PolarHBondContact O-N 2.75Å
616	K	71.6	Confident	65.1	Low	52 Å²	52	66.2 Å²	66.2	23%	0.226	32%	0.321	C	S	.	.	H	α-helix	trans	-69.3	-31.8	173.7	-77.5	178.5	-170.4	173.4	0	113.3	K612 Q613 I614 Y629 V655	K612-K616 WeakPolarHBondContact O-CG 3.37Å; K612-K616 PolarHBondContact O-N 3.07Å; Q613-K616 WeakPolarHBondContact O-CB 3.47Å; Q613-K616 PolarHBondContact O-N 2.88Å; Q613-K616 VanDerWaalsContact OE1-NZ 3.16Å; I614-K616 PolarHBondContact O-N 3.29Å; K616-Y629 HydrophobicContact CB-CE2 4.16Å; K616-Y629 WeakPolarHBondContact CB-OH 2.95Å; K616-Y629 HydrophobicContact CG-CE2 4.19Å; K616-V655 HydrophobicContact CB-CG1 4.4Å
617	V	66.9	Low	62.8	Low	0 Å²	0	75.8 Å²	75.8	0%	0	37%	0.366	C	S	.	.	H	α-helix	trans	-77.5	-28.4	179.1	175.7	0	0	0	0	111.6	I589 L597 Q613 I614 P619 V646 L651 F654 V655	I589-V617 HydrophobicContact CD1-CB 4.27Å; I589-V617 HydrophobicContact CD1-CG1 3.74Å; I589-V617 HydrophobicContact CG1-CG1 3.89Å; L597-V617 HydrophobicContact CD1-CG2 4.03Å; Q613-V617 WeakPolarHBondContact O-CG2 3.47Å; Q613-V617 PolarHBondContact O-N 2.84Å; Q613-V617 VanDerWaalsContact O-N 3.14Å; I614-V617 WeakPolarHBondContact O-CA 3.4Å; I614-V617 WeakPolarHBondContact O-CB 3.27Å; I614-V617 PolarHBondContact O-N 2.96Å; V617-P619 WeakPolarHBondContact O-CD 3.44Å; V617-P619 VanDerWaalsContact O-CG 3.23Å; V617-P619 WeakPolarHBondContact O-CG 3.21Å; V617-V646 HydrophobicContact CG1-CB 4.16Å; V617-V646 HydrophobicContact CG1-CG1 3.94Å; V617-V646 HydrophobicContact CG1-CG2 3.65Å; V617-L651 HydrophobicContact CG2-CD1 4.25Å; V617-F654 HydrophobicContact CG2-CB 4.21Å; V617-V655 HydrophobicContact CG2-CG1 3.41Å; V617-V655 VanDerWaalsContact CG2-CG1 3.41Å
618	S	57	Low	60.3	Low	4 Å²	4	79.7 Å²	79.7	3%	0.028	39%	0.389	C	S	.	.			trans	-88.1	83.5	178.3	-63.4	0	0	0	0	111	I614 F620	I614-S618 PolarHBondContact O-N 3.33Å; I614-S618 PolarHBondContact O-OG 3.49Å; S618-F620 VanDerWaalsContact C-N 3.27Å; S618-F620 PolarHBondContact O-N 2.86Å; S618-F620 VanDerWaalsContact O-N 3.13Å
619	P	47.9	Very low	58.1	Low	17 Å²	17	74.6 Å²	74.6	11%	0.11	37%	0.37	C	S	.	.			trans	-86.4	7.9	-157.5	-0.2	22.6	0	0	0	113.2	V617 A632 F654	V617-P619 WeakPolarHBondContact O-CD 3.44Å; V617-P619 VanDerWaalsContact O-CG 3.23Å; V617-P619 WeakPolarHBondContact O-CG 3.21Å; P619-A632 HydrophobicContact CB-CB 4.25Å; P619-A632 HydrophobicContact CG-CB 4.4Å; P619-F654 HydrophobicContact CG-CD1 4.2Å; P619-F654 HydrophobicContact CG-CE1 4.18Å
620	F	47.7	Very low	56	Low	71 Å²	71	82.5 Å²	82.5	31%	0.311	40%	0.396	S	S	.	.	S	Bend	trans	-82.7	-30.5	-153.9	-136.5	-91.7	0	0	0	115.2	I582 M586 S618 I636	I582-F620 HydrophobicContact CD1-CB 3.65Å; I582-F620 HydrophobicContact CG1-CB 3.73Å; M586-F620 HydrophobicContact SD-CE1 4.34Å; M586-F620 HydrophobicContact SD-CZ 4.24Å; S618-F620 VanDerWaalsContact C-N 3.27Å; S618-F620 PolarHBondContact O-N 2.86Å; S618-F620 VanDerWaalsContact O-N 3.13Å; F620-I636 HydrophobicContact CE2-CD1 3.93Å; F620-I636 HydrophobicContact CE2-CG2 4.06Å; F620-I636 HydrophobicContact CZ-CG2 3.86Å
621	I	38.1	Very low	53.7	Low	84 Å²	84	91.1 Å²	91.1	43%	0.431	43%	0.434	S	S	.	.	S	Bend	trans	-132.9	-0.3	-168.8	-60.6	-161.4	0	0	0	115.9	C580 L623	C580-I621 WeakPolarHBondContact O-CB 3.47Å; C580-I621 WeakPolarHBondContact O-CD1 3.29Å; C580-I621 WeakPolarHBondContact O-CG1 3.32Å; I621-L623 PolarHBondContact O-N 2.98Å
622	L	38.6	Very low	51.6	Low	126 Å²	126	89.9 Å²	89.9	66%	0.66	43%	0.432	S	S	*	.			trans	-75.9	65.2	166.6	-75.5	171.4	0	0	0	110.9	C624	L622-C624 VanDerWaalsContact C-N 3.28Å; L622-C624 PolarHBondContact O-N 2.92Å
623	L	32.9	Very low	49.8	Very low	141 Å²	141	86.4 Å²	86.4	74%	0.738	42%	0.424	S	S	*	.			trans	-79.2	3.9	179.2	-91.6	165.5	0	0	0	113.9	I621	I621-L623 PolarHBondContact O-N 2.98Å
624	C	35.6	Very low	48	Very low	118 Å²	118	91.7 Å²	91.7	80%	0.797	45%	0.452	S	S	*	.	S	Bend	trans	-127.4	-8.3	-172.7	-67.3	0	0	0	0	118.7	L622	L622-C624 VanDerWaalsContact C-N 3.28Å; L622-C624 PolarHBondContact O-N 2.92Å
625	D	38.4	Very low	46.2	Very low	158 Å²	158	97.7 Å²	97.7	85%	0.845	48%	0.478	S	S	*	.	S	Bend	trans	-158	22.4	-176.9	-122.3	-24.2	0	0	0	120.3
626	R	38.7	Very low	44.7	Very low	176 Å²	176	96.4 Å²	96.4	66%	0.664	47%	0.473	S	S	*	.			trans	-143.3	119.4	175.1	-134.2	171.2	-178.2	178.2	1.8	115.1	V628	R626-V628 PolarHBondContact O-N 2.92Å
627	H	37.4	Very low	43.7	Very low	201 Å²	201	98.3 Å²	98.3	93%	0.931	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.5	0.8	-172.7	-81.8	-89.5	0	0	0	118
628	V	37.4	Very low	43.1	Very low	97 Å²	97	101.2 Å²	101.2	59%	0.588	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.5	-23	-169.8	-177.5	0	0	0	0	115.2	R626	R626-V628 PolarHBondContact O-N 2.92Å
629	Y	41.7	Very low	42.7	Very low	47 Å²	47	109.6 Å²	109.6	18%	0.184	56%	0.557	C	S	.	*			trans	-114.5	27.7	-167.3	-60.4	-70.9	0	0	0	117.6	K616 K631 F654	K616-Y629 HydrophobicContact CB-CE2 4.16Å; K616-Y629 WeakPolarHBondContact CB-OH 2.95Å; K616-Y629 HydrophobicContact CG-CE2 4.19Å; Y629-K631 VanDerWaalsContact C-N 3.28Å; Y629-K631 PolarHBondContact O-N 3.43Å; Y629-F654 WeakPolarHBondContact CE1-O 3.39Å; Y629-F654 PolarHBondContact OH-O 3.32Å
630	R	40.9	Very low	42.9	Very low	216 Å²	216	115 Å²	115	82%	0.815	58%	0.581	S	S	*	*	H	α-helix	trans	-66.1	-26.9	174.3	-134.9	174.4	180	176.9	-0.7	113.2	L634	R630-L634 VanDerWaalsContact O-CB 3.27Å; R630-L634 WeakPolarHBondContact O-CB 3.37Å; R630-L634 PolarHBondContact O-N 3.15Å
631	K	41.8	Very low	43	Very low	182 Å²	182	114.8 Å²	114.8	79%	0.791	59%	0.585	S	S	*	*	H	α-helix	trans	-71.4	-41.9	-175.4	-79.6	-173.8	176.9	-179.1	0	114.7	Y629 K635	Y629-K631 VanDerWaalsContact C-N 3.28Å; Y629-K631 PolarHBondContact O-N 3.43Å; K631-K635 PolarHBondContact O-N 2.86Å
632	A	42.8	Very low	44.1	Very low	21 Å²	21	118.2 Å²	118.2	17%	0.174	61%	0.605	C	S	.	*	H	α-helix	trans	-71.7	-41.7	178.3	0	0	0	0	0	111	P619 L634 K635 I636	P619-A632 HydrophobicContact CB-CB 4.25Å; P619-A632 HydrophobicContact CG-CB 4.4Å; A632-L634 VanDerWaalsContact C-N 3.33Å; A632-L634 PolarHBondContact O-N 2.79Å; A632-K635 PolarHBondContact O-N 3.42Å; A632-I636 PolarHBondContact O-N 2.97Å
633	A	44.3	Very low	45.3	Very low	36 Å²	36	114.8 Å²	114.8	30%	0.298	59%	0.594	S	S	.	*	H	α-helix	trans	-62.1	-39.1	173.4	0	0	0	0	0	112	K635 I636 A637	A633-K635 VanDerWaalsContact C-N 3.34Å; A633-K635 PolarHBondContact O-N 3.25Å; A633-I636 PolarHBondContact O-N 3.06Å; A633-A637 WeakPolarHBondContact O-CB 3.4Å; A633-A637 PolarHBondContact O-N 2.83Å
634	L	45.7	Very low	47	Very low	123 Å²	123	109.4 Å²	109.4	64%	0.644	57%	0.566	S	S	*	*	H	α-helix	trans	-60.7	-43.5	176.1	-150.4	102.1	0	0	0	111.3	R630 A632 I636 S638	R630-L634 VanDerWaalsContact O-CB 3.27Å; R630-L634 WeakPolarHBondContact O-CB 3.37Å; R630-L634 PolarHBondContact O-N 3.15Å; A632-L634 VanDerWaalsContact C-N 3.33Å; A632-L634 PolarHBondContact O-N 2.79Å; L634-I636 VanDerWaalsContact C-N 3.34Å; L634-I636 PolarHBondContact O-N 2.75Å; L634-S638 WeakPolarHBondContact O-CB 3.45Å; L634-S638 PolarHBondContact O-N 3.14Å; L634-S638 VanDerWaalsContact O-N 3.1Å; L634-S638 PolarHBondContact O-OG 3.02Å
635	K	46.8	Very low	48.9	Very low	126 Å²	126	107.7 Å²	107.7	55%	0.548	55%	0.552	S	S	.	*	H	α-helix	trans	-65.2	-30.5	-179.6	-85.7	-172.5	167	-172.5	0	114.1	K631 A632 A633 S638 E640	K631-K635 PolarHBondContact O-N 2.86Å; A632-K635 PolarHBondContact O-N 3.42Å; A633-K635 VanDerWaalsContact C-N 3.34Å; A633-K635 PolarHBondContact O-N 3.25Å; K635-S638 WeakPolarHBondContact CA-OG 3.42Å; K635-S638 PolarHBondContact O-OG 3.15Å; K635-E640 WeakPolarHBondContact O-CB 3.2Å; K635-E640 PolarHBondContact O-N 3.05Å
636	I	46.1	Very low	50.7	Low	29 Å²	29	100.2 Å²	100.2	15%	0.149	51%	0.512	C	S	.	.	H	α-helix	trans	-101.3	-33.3	-177.3	-60.7	-178	0	0	0	112.4	F620 A632 A633 L634 S638 Q639 T641 I644	F620-I636 HydrophobicContact CE2-CD1 3.93Å; F620-I636 HydrophobicContact CE2-CG2 4.06Å; F620-I636 HydrophobicContact CZ-CG2 3.86Å; A632-I636 PolarHBondContact O-N 2.97Å; A633-I636 PolarHBondContact O-N 3.06Å; L634-I636 VanDerWaalsContact C-N 3.34Å; L634-I636 PolarHBondContact O-N 2.75Å; I636-S638 PolarHBondContact O-N 3.32Å; I636-Q639 WeakPolarHBondContact O-CA 3.32Å; I636-Q639 PolarHBondContact O-N 3.31Å; I636-T641 WeakPolarHBondContact CD1-O 3.29Å; I636-T641 WeakPolarHBondContact CG1-O 3.13Å; I636-T641 WeakPolarHBondContact CG1-OG1 3.41Å; I636-T641 WeakPolarHBondContact CG2-O 3.31Å; I636-I644 HydrophobicContact CD1-CD1 3.66Å; I636-I644 HydrophobicContact CD1-CG1 3.87Å
637	A	50.2	Low	52.6	Low	91 Å²	91	94.4 Å²	94.4	75%	0.752	50%	0.497	S	S	*	.	H	α-helix	trans	-60.4	-25.8	165.8	0	0	0	0	0	111.1	A633 Q639	A633-A637 WeakPolarHBondContact O-CB 3.4Å; A633-A637 PolarHBondContact O-N 2.83Å; A637-Q639 PolarHBondContact O-N 3.23Å
638	S	54.3	Low	54.6	Low	61 Å²	61	89 Å²	89	43%	0.427	47%	0.474	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.2	11.9	167.3	66.8	0	0	0	0	114.9	L634 K635 I636 E640	L634-S638 WeakPolarHBondContact O-CB 3.45Å; L634-S638 PolarHBondContact O-N 3.14Å; L634-S638 VanDerWaalsContact O-N 3.1Å; L634-S638 PolarHBondContact O-OG 3.02Å; K635-S638 WeakPolarHBondContact CA-OG 3.42Å; K635-S638 PolarHBondContact O-OG 3.15Å; I636-S638 PolarHBondContact O-N 3.32Å; S638-E640 VanDerWaalsContact C-N 3.32Å; S638-E640 PolarHBondContact O-N 2.95Å
639	Q	50.2	Low	56.5	Low	181 Å²	181	92.7 Å²	92.7	85%	0.846	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.7	22.7	178.6	-60.6	178	-20.7	0	0	115.8	I636 A637	I636-Q639 WeakPolarHBondContact O-CA 3.32Å; I636-Q639 PolarHBondContact O-N 3.31Å; A637-Q639 PolarHBondContact O-N 3.23Å
640	E	50.6	Low	58.3	Low	130 Å²	130	92.3 Å²	92.3	61%	0.607	48%	0.484	S	S	*	.			trans	-84	-16.9	-174.2	-60.2	-177.4	159.5	0	0	114.8	K635 S638	K635-E640 WeakPolarHBondContact O-CB 3.2Å; K635-E640 PolarHBondContact O-N 3.05Å; S638-E640 VanDerWaalsContact C-N 3.32Å; S638-E640 PolarHBondContact O-N 2.95Å
641	T	51	Low	60	Low	66 Å²	66	82 Å²	82	41%	0.405	45%	0.445	S	S	.	.			trans	-155.2	132.3	178.9	28.6	0	0	0	0	113.7	I636	I636-T641 WeakPolarHBondContact CD1-O 3.29Å; I636-T641 WeakPolarHBondContact CG1-O 3.13Å; I636-T641 WeakPolarHBondContact CG1-OG1 3.41Å; I636-T641 WeakPolarHBondContact CG2-O 3.31Å
642	D	60.2	Low	61.7	Low	156 Å²	156	75.9 Å²	75.9	83%	0.834	43%	0.425	S	S	*	.	S	Bend	trans	-82.9	-24.9	179	-66.7	-37.7	0	0	0	113.8
643	A	64.4	Low	63	Low	54 Å²	54	80.9 Å²	80.9	45%	0.446	45%	0.449	S	S	.	.			trans	-146.4	141.8	-177.6	0	0	0	0	0	112.3	M586	M586-A643 CarbonylContact O-C 3.56Å; M586-A643 WeakPolarHBondContact O-CA 3.18Å
644	I	68.1	Low	64.3	Low	28 Å²	28	80.3 Å²	80.3	14%	0.144	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	120.5	176	-58.3	177	0	0	0	109.3	M586 V587 N588 I636 V646 F654	M586-I644 PolarHBondContact O-N 2.96Å; V587-I644 WeakPolarHBondContact CA-O 3.37Å; N588-I644 PolarHBondContact N-O 2.77Å; N588-I644 VanDerWaalsContact N-O 3.08Å; I636-I644 HydrophobicContact CD1-CD1 3.66Å; I636-I644 HydrophobicContact CD1-CG1 3.87Å; I644-V646 HydrophobicContact CG2-CG2 4.15Å; I644-F654 HydrophobicContact CG2-CZ 3.96Å
645	T	75.5	Confident	65.7	Low	83 Å²	83	75 Å²	75	51%	0.509	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	118.6	168.3	-54.6	0	0	0	0	109.7	N588 T647 N650	N588-T645 CarbonylContact O-C 3.58Å; N588-T645 WeakPolarHBondContact O-CA 3.34Å; T645-T647 HydrophobicContact CG2-CG2 4.36Å; T645-N650 PolarHBondContact O-ND2 3.33Å
646	V	75.9	Confident	67	Low	0 Å²	0	70.7 Å²	70.7	0%	0	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	115.4	179.3	-177.2	0	0	0	0	108.7	N588 I589 G590 V617 I644 N650 L651 F654	N588-V646 PolarHBondContact O-N 2.86Å; I589-V646 HydrophobicContact CG1-CB 4.41Å; G590-V646 PolarHBondContact N-O 2.82Å; V617-V646 HydrophobicContact CG1-CB 4.16Å; V617-V646 HydrophobicContact CG1-CG1 3.94Å; V617-V646 HydrophobicContact CG1-CG2 3.65Å; I644-V646 HydrophobicContact CG2-CG2 4.15Å; V646-N650 WeakPolarHBondContact CA-OD1 3.41Å; V646-L651 HydrophobicContact CG1-CD1 3.86Å; V646-F654 HydrophobicContact CG1-CD2 4.18Å; V646-F654 HydrophobicContact CG1-CE2 4.41Å; V646-F654 HydrophobicContact CG2-CD2 4.38Å; V646-F654 HydrophobicContact CG2-CE2 4.12Å; V646-F654 HydrophobicContact CG2-CZ 4.46Å
647	T	79.6	Confident	68.3	Low	55 Å²	55	78.3 Å²	78.3	34%	0.337	44%	0.435	S	S	.	.			trans	-108.5	169.4	179.4	61.4	0	0	0	0	110.2	T645 K649 N650 L651	T645-T647 HydrophobicContact CG2-CG2 4.36Å; T647-K649 PolarHBondContact O-N 3.36Å; T647-N650 PolarHBondContact N-OD1 2.93Å; T647-N650 PolarHBondContact O-N 2.83Å; T647-N650 PolarHBondContact O-OD1 3.06Å; T647-L651 WeakPolarHBondContact O-CB 3.34Å; T647-L651 PolarHBondContact O-N 2.86Å
648	D	78.4	Confident	69.2	Low	86 Å²	86	76.4 Å²	76.4	46%	0.46	42%	0.415	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.9	-35.3	174.5	62.8	-29.3	0	0	0	113.3	L596	L596-D648 HydrophobicContact CD2-CB 4.01Å
649	K	79	Confident	69.9	Low	176 Å²	176	77.9 Å²	77.9	77%	0.765	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.3	-38.1	-177.8	-67.3	179.5	-175.2	179.2	0	114.1	T647	T647-K649 PolarHBondContact O-N 3.36Å
650	N	78.9	Confident	70.7	Confident	38 Å²	38	72.3 Å²	72.3	20%	0.203	39%	0.394	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.6	-8.1	-178.8	70.3	11.2	0	0	0	112.9	T645 V646 T647 S652 D653 F654	T645-N650 PolarHBondContact O-ND2 3.33Å; V646-N650 WeakPolarHBondContact CA-OD1 3.41Å; T647-N650 PolarHBondContact N-OD1 2.93Å; T647-N650 PolarHBondContact O-N 2.83Å; T647-N650 PolarHBondContact O-OD1 3.06Å; N650-S652 PolarHBondContact O-N 3.43Å; N650-S652 VanDerWaalsContact O-N 3.15Å; N650-D653 VanDerWaalsContact O-CB 3.31Å; N650-D653 WeakPolarHBondContact O-CB 3.32Å; N650-D653 PolarHBondContact O-N 2.87Å; N650-F654 HydrophobicContact CB-CE2 4.2Å; N650-F654 WeakPolarHBondContact O-CD2 3.17Å
651	L	76.2	Confident	71	Confident	1 Å²	1	71 Å²	71	1%	0.005	40%	0.396	C	S	.	.	H	α-helix	trans	-51.1	-41.9	-178.6	-174.2	65	0	0	0	112.8	L596 L597 Y601 V617 V646 T647 D653 F654 V655	L596-L651 HydrophobicContact CB-CD2 4.14Å; L596-L651 HydrophobicContact CD2-CD2 3.89Å; L596-L651 HydrophobicContact CG-CD2 4.05Å; L597-L651 HydrophobicContact CB-CD2 4.06Å; L597-L651 HydrophobicContact CD1-CD1 4.01Å; Y601-L651 HydrophobicContact CE2-CD2 4.07Å; V617-L651 HydrophobicContact CG2-CD1 4.25Å; V646-L651 HydrophobicContact CG1-CD1 3.86Å; T647-L651 WeakPolarHBondContact O-CB 3.34Å; T647-L651 PolarHBondContact O-N 2.86Å; L651-D653 PolarHBondContact O-N 2.91Å; L651-F654 PolarHBondContact O-N 3.08Å; L651-F654 VanDerWaalsContact O-N 3.09Å; L651-V655 HydrophobicContact CD1-CG2 4.25Å; L651-V655 HydrophobicContact CG-CG2 3.92Å; L651-V655 WeakPolarHBondContact O-CG2 3.4Å; L651-V655 PolarHBondContact O-N 2.88Å
652	S	77.6	Confident	71.2	Confident	52 Å²	52	75.1 Å²	75.1	36%	0.364	41%	0.41	S	S	.	.	H	α-helix	trans	-65.5	-25.3	-179.2	51.5	0	0	0	0	114.1	N650 F654 G656	N650-S652 PolarHBondContact O-N 3.43Å; N650-S652 VanDerWaalsContact O-N 3.15Å; S652-F654 PolarHBondContact O-N 2.83Å; S652-G656 WeakPolarHBondContact CA-O 3.37Å; S652-G656 CarbonylContact O-C 3.56Å; S652-G656 WeakPolarHBondContact O-CA 3.34Å; S652-G656 PolarHBondContact O-N 3.08Å
653	D	71	Confident	71.1	Confident	127 Å²	127	70.4 Å²	70.4	68%	0.679	39%	0.385	S	S	*	.	H	α-helix	trans	-70.1	-26.2	176.9	-58.2	-21.4	0	0	0	110.7	N650 L651	N650-D653 VanDerWaalsContact O-CB 3.31Å; N650-D653 WeakPolarHBondContact O-CB 3.32Å; N650-D653 PolarHBondContact O-N 2.87Å; L651-D653 PolarHBondContact O-N 2.91Å
654	F	71.5	Confident	71.1	Confident	23 Å²	23	70.4 Å²	70.4	10%	0.101	37%	0.373	C	S	.	.	H	α-helix	trans	-89.8	-65.3	175.7	-56.8	-80.6	0	0	0	110.8	V617 P619 Y629 I644 V646 N650 L651 S652 G656	V617-F654 HydrophobicContact CG2-CB 4.21Å; P619-F654 HydrophobicContact CG-CD1 4.2Å; P619-F654 HydrophobicContact CG-CE1 4.18Å; Y629-F654 WeakPolarHBondContact CE1-O 3.39Å; Y629-F654 PolarHBondContact OH-O 3.32Å; I644-F654 HydrophobicContact CG2-CZ 3.96Å; V646-F654 HydrophobicContact CG1-CD2 4.18Å; V646-F654 HydrophobicContact CG1-CE2 4.41Å; V646-F654 HydrophobicContact CG2-CD2 4.38Å; V646-F654 HydrophobicContact CG2-CE2 4.12Å; V646-F654 HydrophobicContact CG2-CZ 4.46Å; N650-F654 HydrophobicContact CB-CE2 4.2Å; N650-F654 WeakPolarHBondContact O-CD2 3.17Å; L651-F654 PolarHBondContact O-N 3.08Å; L651-F654 VanDerWaalsContact O-N 3.09Å; S652-F654 PolarHBondContact O-N 2.83Å; F654-G656 VanDerWaalsContact C-N 3.34Å; F654-G656 PolarHBondContact O-N 3.36Å
655	V	73.9	Confident	70.9	Confident	13 Å²	13	74.4 Å²	74.4	8%	0.079	39%	0.394	C	S	.	.	H	α-helix	trans	-84.3	-5.9	-170	-66.4	0	0	0	0	114.9	L597 Y601 Q613 K616 V617 L651	L597-V655 HydrophobicContact CD1-CG1 4.04Å; Y601-V655 HydrophobicContact CD1-CB 4.35Å; Y601-V655 HydrophobicContact CD1-CG2 3.9Å; Y601-V655 HydrophobicContact CD2-CG2 4.39Å; Y601-V655 HydrophobicContact CE1-CB 4.16Å; Y601-V655 HydrophobicContact CE1-CG2 3.41Å; Y601-V655 VanDerWaalsContact CE1-CG2 3.41Å; Y601-V655 HydrophobicContact CE2-CG2 3.94Å; Y601-V655 HydrophobicContact CG-CG2 4.36Å; Y601-V655 VanDerWaalsContact CZ-CG2 3.43Å; Q613-V655 HydrophobicContact CB-CG1 4.36Å; K616-V655 HydrophobicContact CB-CG1 4.4Å; V617-V655 HydrophobicContact CG2-CG1 3.41Å; V617-V655 VanDerWaalsContact CG2-CG1 3.41Å; L651-V655 HydrophobicContact CD1-CG2 4.25Å; L651-V655 HydrophobicContact CG-CG2 3.92Å; L651-V655 WeakPolarHBondContact O-CG2 3.4Å; L651-V655 PolarHBondContact O-N 2.88Å
656	G	73.7	Confident	70.7	Confident	34 Å²	34	73.6 Å²	73.6	35%	0.351	38%	0.382	S	S	.	.			trans	88.6	-165.6	-173.8	0	0	0	0	0	112.7	Y601 S652 F654	Y601-G656 PolarHBondContact OH-O 3.26Å; S652-G656 WeakPolarHBondContact CA-O 3.37Å; S652-G656 CarbonylContact O-C 3.56Å; S652-G656 WeakPolarHBondContact O-CA 3.34Å; S652-G656 PolarHBondContact O-N 3.08Å; F654-G656 VanDerWaalsContact C-N 3.34Å; F654-G656 PolarHBondContact O-N 3.36Å
657	K	74.3	Confident	70.5	Confident	189 Å²	189	79.5 Å²	79.5	82%	0.822	42%	0.418	S	S	*	.	S	Bend	trans	-70.4	145.4	-179.4	-65.4	-177.8	-178.8	-179.9	0	111.2	Y601 V659	Y601-K657 WeakPolarHBondContact CE1-O 3.3Å; K657-V659 PolarHBondContact O-N 2.98Å
658	P	69.8	Low	70.5	Confident	51 Å²	51	82.6 Å²	82.6	33%	0.331	43%	0.432	S	S	.	.			trans	-49.4	127.7	172.8	-30.3	36.7	0	0	0	112.6	K600 Y601	K600-P658 HydrophobicContact CB-CB 4.2Å; K600-P658 HydrophobicContact CD-CB 4.12Å; K600-P658 HydrophobicContact CD-CG 4.18Å; Y601-P658 WeakPolarHBondContact OH-CD 3.36Å
659	V	69.1	Low	70.9	Confident	93 Å²	93	79.2 Å²	79.2	56%	0.564	41%	0.414	S	S	*	.	S	Bend	trans	-79.7	-34.5	177.4	-177.9	0	0	0	0	110.5	K600 Y601 K657	K600-V659 PolarHBondContact O-N 2.79Å; Y601-V659 HydrophobicContact CD1-CG2 4.32Å; K657-V659 PolarHBondContact O-N 2.98Å
660	F	66.3	Low	71.5	Confident	63 Å²	63	73.2 Å²	73.2	28%	0.276	39%	0.393	S	S	.	.			trans	-115	113.9	-178.8	-52.4	-72	0	0	0	109.6	K600 R603	K600-F660 WeakPolarHBondContact O-CD2 3.39Å; K600-F660 PolarHBondContact O-N 2.97Å; R603-F660 HydrophobicContact CB-CD1 4.33Å; R603-F660 HydrophobicContact CB-CD2 4.06Å; R603-F660 HydrophobicContact CB-CE1 3.9Å; R603-F660 HydrophobicContact CB-CE2 3.62Å; R603-F660 HydrophobicContact CB-CG 4.42Å; R603-F660 HydrophobicContact CB-CZ 3.53Å
661	T	57.6	Low	72.2	Confident	103 Å²	103	73.3 Å²	73.3	63%	0.632	40%	0.396	S	S	*	.			trans	-99.1	-33	-177.4	48.8	0	0	0	0	113.5
662	H	54.7	Low	73	Confident	153 Å²	153	73.3 Å²	73.3	71%	0.708	40%	0.396	S	S	*	.			trans	-140.9	127.6	-177.1	-57.8	97.7	0	0	0	110.4
663	D	57.7	Low	73.7	Confident	56 Å²	56	71.2 Å²	71.2	30%	0.299	38%	0.381	S	S	.	.	S	Bend	trans	-82.3	-25.3	171.2	-81	-43.4	0	0	0	111.9
664	R	64.4	Low	74.8	Confident	54 Å²	54	65.3 Å²	65.3	20%	0.204	35%	0.349	C	S	.	.			trans	-112	132	-179.8	-72.1	-169.5	-179.2	-171.5	3	111.7	M675 N786 A815 N816	R664-M675 HydrophobicContact CG-CE 4.43Å; R664-N786 PolarHBondContact NH1-OD1 3.39Å; R664-N786 PolarHBondContact NH2-OD1 3.22Å; R664-A815 PolarHBondContact NE-O 2.94Å; R664-A815 PolarHBondContact NH2-O 3.09Å; R664-N816 PolarHBondContact NH2-O 2.85Å
665	L	64.2	Low	75.8	Confident	112 Å²	112	64.5 Å²	64.5	59%	0.586	35%	0.346	S	S	*	.	S	Bend	trans	-68.9	-38.1	169.4	-157.3	73.7	0	0	0	110.9	F688 P755	L665-F688 HydrophobicContact CB-CD2 3.83Å; L665-F688 HydrophobicContact CB-CE2 3.86Å; L665-P755 HydrophobicContact CD2-CB 4.27Å; L665-P755 HydrophobicContact CD2-CG 4.12Å
666	Y	72.2	Confident	76.6	Confident	66 Å²	66	64 Å²	64	26%	0.259	34%	0.343	S	S	.	.			trans	-120.1	127.7	-179.3	-62.6	-78.7	0	0	0	111.4	P670 V673 F688 E690	Y666-P670 HydrophobicContact CD1-CG 4.49Å; Y666-P670 HydrophobicContact CE1-CG 4.37Å; Y666-V673 HydrophobicContact CD2-CG1 3.75Å; Y666-V673 HydrophobicContact CE2-CG1 3.67Å; Y666-V673 HydrophobicContact CG-CG1 4.45Å; Y666-F688 HydrophobicContact CD2-CB 4.44Å; Y666-F688 AromaticContact CD2-CD1 3.84Å; Y666-F688 HydrophobicContact CD2-CD1 3.84Å; Y666-F688 HydrophobicContact CD2-CD2 4.23Å; Y666-F688 HydrophobicContact CD2-CE1 4.07Å; Y666-F688 HydrophobicContact CD2-CE2 4.46Å; Y666-F688 AromaticContact CD2-CG 3.9Å; Y666-F688 HydrophobicContact CD2-CG 3.9Å; Y666-F688 HydrophobicContact CD2-CZ 4.35Å; Y666-F688 HydrophobicContact CE2-CB 4.43Å; Y666-F688 HydrophobicContact CE2-CG 4.37Å; Y666-E690 WeakPolarHBondContact CE2-OE1 3.43Å; Y666-E690 PolarHBondContact OH-OE1 3.42Å
667	T	70	Confident	77.3	Confident	124 Å²	124	62.5 Å²	62.5	76%	0.761	33%	0.327	S	S	*	.	S	Bend	trans	-76.7	-40.5	168.6	46.1	0	0	0	0	111.2
668	I	81.3	Confident	77.6	Confident	121 Å²	121	54.2 Å²	54.2	62%	0.621	29%	0.294	S	S	*	.	S	Bend	trans	-122.8	125.5	171.9	-58.9	173.6	0	0	0	106.5	P670	I668-P670 WeakPolarHBondContact O-CD 3.42Å
669	T	86.3	Confident	77.7	Confident	14 Å²	14	58.7 Å²	58.7	9%	0.086	30%	0.304	C	S	.	.	P	Polyproline II helix	trans	-79.3	117.9	179.4	48.4	0	0	0	0	110.2	F688 P782 Q785	T669-F688 HydrophobicContact CG2-CD1 4.29Å; T669-F688 HydrophobicContact CG2-CE1 3.76Å; T669-P782 WeakPolarHBondContact O-CB 3.4Å; T669-Q785 PolarHBondContact O-NE2 3.47Å; T669-Q785 VanDerWaalsContact O-NE2 3.14Å; T669-Q785 VanDerWaalsContact OG1-CD 3.31Å; T669-Q785 PolarHBondContact OG1-NE2 3.46Å; T669-Q785 PolarHBondContact OG1-OE1 3.35Å
670	P	91.2	Very high	77.5	Confident	51 Å²	51	56.4 Å²	56.4	33%	0.331	29%	0.29	S	S	.	.	P	Polyproline II helix	trans	-75.4	168.3	176.5	31.7	-35.3	0	0	0	111.6	Y666 I668 G672 V673	Y666-P670 HydrophobicContact CD1-CG 4.49Å; Y666-P670 HydrophobicContact CE1-CG 4.37Å; I668-P670 WeakPolarHBondContact O-CD 3.42Å; P670-G672 PolarHBondContact O-N 2.89Å; P670-V673 HydrophobicContact CG-CB 4.04Å; P670-V673 HydrophobicContact CG-CG2 3.68Å; P670-V673 PolarHBondContact O-N 3.35Å; P670-V673 VanDerWaalsContact O-N 3.1Å
671	P	93.1	Very high	76.9	Confident	40 Å²	40	57.7 Å²	57.7	26%	0.26	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.9	137	170.3	-24.3	32.9	0	0	0	111.9	V673 S776 P782	P671-V673 VanDerWaalsContact C-N 3.31Å; P671-S776 WeakPolarHBondContact CA-OG 3.39Å; P671-P782 HydrophobicContact CG-CB 4.42Å
672	G	92.7	Very high	76.8	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	85.4	-4.6	-177.3	0	0	0	0	0	114.8	P670 S691 S773 S776	P670-G672 PolarHBondContact O-N 2.89Å; G672-S691 PolarHBondContact O-N 3.25Å; G672-S773 WeakPolarHBondContact CA-O 3.47Å; G672-S776 PolarHBondContact N-OG 3.04Å
673	V	93.5	Very high	77.3	Confident	9 Å²	9	50.7 Å²	50.7	6%	0.055	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	121.5	-178.6	-178	0	0	0	0	110.5	Y666 P670 P671 F688 V689 E690	Y666-V673 HydrophobicContact CD2-CG1 3.75Å; Y666-V673 HydrophobicContact CE2-CG1 3.67Å; Y666-V673 HydrophobicContact CG-CG1 4.45Å; P670-V673 HydrophobicContact CG-CB 4.04Å; P670-V673 HydrophobicContact CG-CG2 3.68Å; P670-V673 PolarHBondContact O-N 3.35Å; P670-V673 VanDerWaalsContact O-N 3.1Å; P671-V673 VanDerWaalsContact C-N 3.31Å; V673-F688 HydrophobicContact CG1-CB 4.17Å; V673-F688 HydrophobicContact CG1-CD1 3.88Å; V673-F688 HydrophobicContact CG1-CG 4.39Å; V673-V689 WeakPolarHBondContact CA-O 3.37Å; V673-E690 HydrophobicContact CG1-CG 4.21Å; V673-E690 HydrophobicContact CG2-CB 4.39Å; V673-E690 HydrophobicContact CG2-CG 4.02Å
674	V	93.6	Very high	77.9	Confident	2 Å²	2	48.6 Å²	48.6	1%	0.012	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	138.2	-176.1	-173.4	0	0	0	0	110.5	F688 V689 T769 T772 V783 M789	V674-F688 CarbonylContact O-C 3.6Å; V674-F688 WeakPolarHBondContact O-CA 3.35Å; V674-V689 PolarHBondContact N-O 2.88Å; V674-V689 PolarHBondContact O-N 3.45Å; V674-T769 HydrophobicContact CB-CG2 4.05Å; V674-T769 HydrophobicContact CG1-CG2 3.88Å; V674-T772 HydrophobicContact CG1-CG2 4.26Å; V674-T772 HydrophobicContact CG2-CG2 4.07Å; V674-V783 HydrophobicContact CG2-CG2 3.71Å; V674-M789 HydrophobicContact CG1-CE 3.56Å; V674-M789 HydrophobicContact CG1-CG 4.43Å; V674-M789 HydrophobicContact CG1-SD 3.83Å
675	M	91.7	Very high	78.5	Confident	7 Å²	7	46.4 Å²	46.4	3%	0.034	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	121.2	175.5	-169.5	-176.3	-66	0	0	110.6	R664 T686 L687 F688 A788 M789 V817	R664-M675 HydrophobicContact CG-CE 4.43Å; M675-T686 HydrophobicContact SD-CG2 4.05Å; M675-L687 CarbonylContact C-O 3.53Å; M675-L687 WeakPolarHBondContact CA-O 3.49Å; M675-F688 HydrophobicContact CB-CD1 4.23Å; M675-F688 HydrophobicContact CB-CE1 4.05Å; M675-F688 HydrophobicContact CE-CE1 3.63Å; M675-F688 HydrophobicContact CE-CE2 4.28Å; M675-F688 HydrophobicContact CE-CZ 3.38Å; M675-F688 HydrophobicContact CG-CE1 4.35Å; M675-A788 HydrophobicContact CB-CB 4.37Å; M675-A788 HydrophobicContact CG-CB 4.05Å; M675-A788 WeakPolarHBondContact O-CA 3.08Å; M675-A788 HydrophobicContact SD-CB 3.97Å; M675-M789 PolarHBondContact O-N 3.31Å; M675-V817 HydrophobicContact CE-CG2 4.47Å; M675-V817 HydrophobicContact SD-CG2 3.51Å; M675-V817 VanDerWaalsContact SD-CG2 3.51Å
676	G	90.9	Very high	79.3	Confident	1 Å²	1	42 Å²	42	1%	0.01	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	157.6	171.5	0	0	0	0	0	112.5	T686 L687 M789	G676-T686 WeakPolarHBondContact O-CA 3.43Å; G676-L687 PolarHBondContact N-O 3.29Å; G676-L687 PolarHBondContact O-N 3.48Å; G676-M789 CarbonylContact C-O 3.54Å; G676-M789 VanDerWaalsContact CA-O 3.29Å; G676-M789 WeakPolarHBondContact CA-O 3.49Å
677	L	89.5	Confident	80	Confident	4 Å²	4	39.3 Å²	39.3	2%	0.021	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	123.1	171.2	-53	172.9	0	0	0	110	T686 A788 M789 T790 K808 A812 I820	L677-T686 HydrophobicContact CD2-CG2 3.85Å; L677-A788 HydrophobicContact CD1-CB 4.27Å; L677-A788 HydrophobicContact CD2-CB 3.68Å; L677-A788 HydrophobicContact CG-CB 3.84Å; L677-M789 PolarHBondContact N-O 3.17Å; L677-T790 PolarHBondContact O-OG1 3.23Å; L677-T790 VanDerWaalsContact O-OG1 3.11Å; L677-K808 HydrophobicContact CB-CB 3.9Å; L677-K808 HydrophobicContact CB-CD 4.21Å; L677-K808 HydrophobicContact CB-CG 3.94Å; L677-K808 HydrophobicContact CD1-CB 4.25Å; L677-A812 HydrophobicContact CD1-CB 4.13Å; L677-A812 HydrophobicContact CD2-CB 3.79Å; L677-I820 HydrophobicContact CD1-CG2 4.27Å
678	A	80.3	Confident	80.9	Confident	15 Å²	15	33.9 Å²	33.9	12%	0.124	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	157.3	178	0	0	0	0	0	111.8	G684 S685 L687	A678-G684 WeakPolarHBondContact O-CA 3.48Å; A678-S685 PolarHBondContact N-O 3.15Å; A678-S685 PolarHBondContact O-N 3.06Å; A678-L687 HydrophobicContact CB-CD2 3.36Å; A678-L687 HydrophobicContact CB-CG 4.2Å
679	W	71.1	Confident	81.4	Confident	145 Å²	145	28.1 Å²	28.1	55%	0.549	16%	0.16	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	134.2	172.3	-177.7	93.6	0	0	0	108.9
680	T	64.3	Low	81.8	Confident	44 Å²	44	29.3 Å²	29.3	27%	0.27	17%	0.165	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	168.5	173.8	70.6	0	0	0	0	108.9	M682 G683	T680-M682 PolarHBondContact O-N 3.41Å; T680-M682 VanDerWaalsContact O-N 3.09Å; T680-M682 PolarHBondContact OG1-N 2.99Å; T680-G683 PolarHBondContact N-O 3.49Å; T680-G683 WeakPolarHBondContact O-CA 3.32Å; T680-G683 PolarHBondContact O-N 3.48Å; T680-G683 PolarHBondContact OG1-O 2.93Å
681	S	55.3	Low	81.9	Confident	90 Å²	90	27.2 Å²	27.2	63%	0.629	15%	0.151	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-19.8	172.4	61.8	0	0	0	0	113.7	G683	S681-G683 VanDerWaalsContact C-N 3.27Å
682	M	54.9	Low	81.9	Confident	101 Å²	101	28 Å²	28	50%	0.498	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.5	5.9	174.5	-63.3	-63	-68.3	0	0	112.5	S605 T680	S605-M682 PolarHBondContact OG-O 3.4Å; T680-M682 PolarHBondContact O-N 3.41Å; T680-M682 VanDerWaalsContact O-N 3.09Å; T680-M682 PolarHBondContact OG1-N 2.99Å
683	G	64.9	Low	81.8	Confident	9 Å²	9	31.1 Å²	31.1	9%	0.093	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	97.4	-163.9	-174.1	0	0	0	0	0	112.6	T680 S681	T680-G683 PolarHBondContact N-O 3.49Å; T680-G683 WeakPolarHBondContact O-CA 3.32Å; T680-G683 PolarHBondContact O-N 3.48Å; T680-G683 PolarHBondContact OG1-O 2.93Å; S681-G683 VanDerWaalsContact C-N 3.27Å
684	G	70.1	Confident	81.5	Confident	12 Å²	12	37.6 Å²	37.6	12%	0.124	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	144	-175.7	0	0	0	0	0	112	A678 E807 A811	A678-G684 WeakPolarHBondContact O-CA 3.48Å; G684-E807 WeakPolarHBondContact CA-O 3.07Å; G684-A811 WeakPolarHBondContact O-CB 3.39Å
685	S	76.5	Confident	80.9	Confident	8 Å²	8	42.9 Å²	42.9	6%	0.056	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	146.1	177.9	57.8	0	0	0	0	110.5	A678	A678-S685 PolarHBondContact N-O 3.15Å; A678-S685 PolarHBondContact O-N 3.06Å
686	T	82.8	Confident	80.1	Confident	19 Å²	19	53.7 Å²	53.7	12%	0.117	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	127.4	166.4	55	0	0	0	0	108.1	M675 G676 L677 A811 A815	M675-T686 HydrophobicContact SD-CG2 4.05Å; G676-T686 WeakPolarHBondContact O-CA 3.43Å; L677-T686 HydrophobicContact CD2-CG2 3.85Å; T686-A811 HydrophobicContact CG2-CB 4.33Å; T686-A815 HydrophobicContact CG2-CB 3.53Å
687	L	86	Confident	79.4	Confident	9 Å²	9	56.8 Å²	56.8	5%	0.047	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	147.1	175	57.6	82.2	0	0	0	109.5	M675 G676 A678 V689 V754 K761	M675-L687 CarbonylContact C-O 3.53Å; M675-L687 WeakPolarHBondContact CA-O 3.49Å; G676-L687 PolarHBondContact N-O 3.29Å; G676-L687 PolarHBondContact O-N 3.48Å; A678-L687 HydrophobicContact CB-CD2 3.36Å; A678-L687 HydrophobicContact CB-CG 4.2Å; L687-V689 HydrophobicContact CD1-CG2 3.61Å; L687-V754 HydrophobicContact CB-CG1 4.17Å; L687-V754 HydrophobicContact CD1-CG1 3.67Å; L687-V754 HydrophobicContact CD2-CG1 4.03Å; L687-V754 HydrophobicContact CG-CG1 4.18Å; L687-K761 HydrophobicContact CD2-CD 4.39Å
688	F	89.2	Confident	78.5	Confident	11 Å²	11	61 Å²	61	5%	0.048	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	134.1	169.6	-68.3	-83.7	0	0	0	108.2	L665 Y666 T669 V673 V674 M675 P755	L665-F688 HydrophobicContact CB-CD2 3.83Å; L665-F688 HydrophobicContact CB-CE2 3.86Å; Y666-F688 HydrophobicContact CD2-CB 4.44Å; Y666-F688 AromaticContact CD2-CD1 3.84Å; Y666-F688 HydrophobicContact CD2-CD1 3.84Å; Y666-F688 HydrophobicContact CD2-CD2 4.23Å; Y666-F688 HydrophobicContact CD2-CE1 4.07Å; Y666-F688 HydrophobicContact CD2-CE2 4.46Å; Y666-F688 AromaticContact CD2-CG 3.9Å; Y666-F688 HydrophobicContact CD2-CG 3.9Å; Y666-F688 HydrophobicContact CD2-CZ 4.35Å; Y666-F688 HydrophobicContact CE2-CB 4.43Å; Y666-F688 HydrophobicContact CE2-CG 4.37Å; T669-F688 HydrophobicContact CG2-CD1 4.29Å; T669-F688 HydrophobicContact CG2-CE1 3.76Å; V673-F688 HydrophobicContact CG1-CB 4.17Å; V673-F688 HydrophobicContact CG1-CD1 3.88Å; V673-F688 HydrophobicContact CG1-CG 4.39Å; V674-F688 CarbonylContact O-C 3.6Å; V674-F688 WeakPolarHBondContact O-CA 3.35Å; M675-F688 HydrophobicContact CB-CD1 4.23Å; M675-F688 HydrophobicContact CB-CE1 4.05Å; M675-F688 HydrophobicContact CE-CE1 3.63Å; M675-F688 HydrophobicContact CE-CE2 4.28Å; M675-F688 HydrophobicContact CE-CZ 3.38Å; M675-F688 HydrophobicContact CG-CE1 4.35Å; F688-P755 WeakPolarHBondContact O-CD 3.48Å
689	V	91.6	Very high	77.8	Confident	0 Å²	0	64.1 Å²	64.1	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	120.8	166.4	179.5	0	0	0	0	106.2	V673 V674 L687 V752 V754 T769 I770	V673-V689 WeakPolarHBondContact CA-O 3.37Å; V674-V689 PolarHBondContact N-O 2.88Å; V674-V689 PolarHBondContact O-N 3.45Å; L687-V689 HydrophobicContact CD1-CG2 3.61Å; V689-V752 HydrophobicContact CG1-CG1 3.75Å; V689-V754 HydrophobicContact CG1-CG2 4.5Å; V689-V754 HydrophobicContact CG2-CG2 4.24Å; V689-T769 HydrophobicContact CB-CG2 4.02Å; V689-T769 HydrophobicContact CG2-CG2 3.6Å; V689-I770 HydrophobicContact CG1-CG1 3.94Å; V689-I770 HydrophobicContact CG2-CG1 4.47Å
690	E	93.5	Very high	77.3	Confident	39 Å²	39	62.7 Å²	62.7	18%	0.182	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	121.2	-177.7	-61.4	174.1	-175.2	0	0	108.9	Y666 V673 V752 H753 P755	Y666-E690 WeakPolarHBondContact CE2-OE1 3.43Å; Y666-E690 PolarHBondContact OH-OE1 3.42Å; V673-E690 HydrophobicContact CG1-CG 4.21Å; V673-E690 HydrophobicContact CG2-CB 4.39Å; V673-E690 HydrophobicContact CG2-CG 4.02Å; E690-V752 CarbonylContact O-C 3.56Å; E690-V752 VanDerWaalsContact O-CA 3.29Å; E690-V752 WeakPolarHBondContact O-CA 3.48Å; E690-H753 HydrophobicContact CB-CB 4.45Å; E690-H753 PolarHBondContact N-O 3.09Å; E690-H753 PolarHBondContact O-N 3.16Å; E690-H753 IonicContact OE2-CD2 3.95Å; E690-P755 VanDerWaalsContact CD-CG 3.5Å; E690-P755 HydrophobicContact CG-CG 4.17Å; E690-P755 WeakPolarHBondContact OE1-CG 3.46Å
691	S	94.2	Very high	77	Confident	7 Å²	7	62.9 Å²	62.9	5%	0.049	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	129.1	171.4	-73.3	0	0	0	0	109	G672 H751 S773 L774	G672-S691 PolarHBondContact O-N 3.25Å; S691-H751 WeakPolarHBondContact CA-O 3.48Å; S691-S773 PolarHBondContact OG-OG 2.85Å; S691-L774 WeakPolarHBondContact OG-CD2 3.46Å
692	S	93.2	Very high	76.8	Confident	56 Å²	56	67.9 Å²	67.9	39%	0.392	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	162.5	177.6	66.7	0	0	0	0	112.5	L750 H751	S692-L750 CarbonylContact O-C 3.56Å; S692-L750 WeakPolarHBondContact O-CA 3.33Å; S692-H751 PolarHBondContact N-O 3.02Å; S692-H751 PolarHBondContact O-N 3.37Å
693	L	90.9	Very high	76.7	Confident	65 Å²	65	68.6 Å²	68.6	34%	0.34	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	133.7	172.2	-76.3	170.9	0	0	0	110.8	Q695 F744 A748 L750	L693-Q695 WeakPolarHBondContact CB-O 3.23Å; L693-F744 HydrophobicContact CD1-CE2 4.02Å; L693-F744 HydrophobicContact CD1-CZ 3.97Å; L693-F744 HydrophobicContact CD2-CE1 4.42Å; L693-F744 HydrophobicContact CD2-CE2 3.95Å; L693-F744 HydrophobicContact CD2-CZ 3.56Å; L693-F744 HydrophobicContact CG-CE2 4.33Å; L693-F744 HydrophobicContact CG-CZ 3.84Å; L693-A748 HydrophobicContact CD2-CB 3.7Å; L693-L750 HydrophobicContact CD2-CD2 4.27Å
694	R	87.9	Confident	76.1	Confident	145 Å²	145	77.2 Å²	77.2	55%	0.547	38%	0.375	S	S	.	.	S	Bend	trans	-78.2	-24.5	173.8	-70.3	-171.4	59.5	-155	-7.4	113.6	H749 H751	R694-H749 HydrophobicContact CB-CB 4.23Å; R694-H749 PolarHBondContact N-O 3.22Å; R694-H751 HydrophobicContact CG-CB 3.72Å
695	Q	80.3	Confident	75.4	Confident	113 Å²	113	80.4 Å²	80.4	53%	0.528	41%	0.408	S	S	.	.	S	Bend	trans	-145.2	164.3	-179.4	66.7	-172.5	32.1	0	0	109.6	L693 Y697 H749	L693-Q695 WeakPolarHBondContact CB-O 3.23Å; Q695-Y697 PolarHBondContact O-N 3Å; Q695-H749 VanDerWaalsContact CD-CD2 3.44Å; Q695-H749 HydrophobicContact CG-CB 4.31Å; Q695-H749 PolarHBondContact NE2-CD2 2.98Å; Q695-H749 PolarHBondContact NE2-NE2 3.43Å
696	R	75.6	Confident	74.7	Confident	235 Å²	235	86 Å²	86	89%	0.887	43%	0.432	S	S	*	.			trans	-57.2	128.5	173.9	-71.3	-177.3	176.4	173.8	-1.3	109.3
697	Y	75	Confident	74.2	Confident	66 Å²	66	92.2 Å²	92.2	26%	0.259	46%	0.459	S	S	.	.			trans	-76.3	123.3	174.3	179.9	-102	0	0	0	108.6	Q695 D699 F744 K747 A748	Q695-Y697 PolarHBondContact O-N 3Å; Y697-D699 HydrophobicContact CE1-CB 3.82Å; Y697-D699 PolarHBondContact OH-OD1 3.11Å; Y697-D699 PolarHBondContact OH-OD2 2.86Å; Y697-F744 AromaticContact CD1-CD2 3.98Å; Y697-F744 HydrophobicContact CD1-CD2 3.98Å; Y697-F744 HydrophobicContact CD1-CE2 4.21Å; Y697-F744 AromaticContact CD2-CD2 3.76Å; Y697-F744 HydrophobicContact CD2-CD2 3.76Å; Y697-F744 AromaticContact CD2-CE2 3.92Å; Y697-F744 HydrophobicContact CD2-CE2 3.92Å; Y697-F744 AromaticContact CE1-CD2 3.94Å; Y697-F744 HydrophobicContact CE1-CD2 3.94Å; Y697-F744 AromaticContact CE2-CD2 3.7Å; Y697-F744 HydrophobicContact CE2-CD2 3.7Å; Y697-F744 HydrophobicContact CE2-CE2 4.34Å; Y697-F744 HydrophobicContact CE2-CG 4.34Å; Y697-F744 AromaticContact CG-CD2 3.89Å; Y697-F744 HydrophobicContact CG-CD2 3.89Å; Y697-F744 AromaticContact CG-CE2 3.84Å; Y697-F744 HydrophobicContact CG-CE2 3.84Å; Y697-F744 AromaticContact CZ-CD2 3.81Å; Y697-K747 HydrophobicContact CE2-CB 4.15Å; Y697-A748 HydrophobicContact CD2-CB 3.98Å; Y697-A748 HydrophobicContact CE2-CB 4.23Å
698	D	70	Confident	73.9	Confident	92 Å²	92	92.2 Å²	92.2	49%	0.492	46%	0.461	S	S	.	.			trans	-125	104.2	175.5	-172.1	-7	0	0	0	108.5	T700 A701	D698-T700 PolarHBondContact O-N 2.89Å; D698-T700 WeakPolarHBondContact OD1-CB 3.38Å; D698-T700 PolarHBondContact OD1-N 3.36Å; D698-T700 PolarHBondContact OD1-OG1 3.24Å; D698-A701 HydrophobicContact CB-CB 4.27Å
699	D	66.5	Low	73.8	Confident	81 Å²	81	94.4 Å²	94.4	43%	0.433	48%	0.475	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-17.9	179	-137.5	-25.8	0	0	0	112.1	Y697 K747	Y697-D699 HydrophobicContact CE1-CB 3.82Å; Y697-D699 PolarHBondContact OH-OD1 3.11Å; Y697-D699 PolarHBondContact OH-OD2 2.86Å; D699-K747 IonicContact OD1-NZ 3.26Å; D699-K747 PolarHBondContact OD1-NZ 3.24Å
700	T	61.4	Low	73.7	Confident	114 Å²	114	96.5 Å²	96.5	70%	0.699	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.2	-13	-178.5	71.6	0	0	0	0	113.3	D698 K702	D698-T700 PolarHBondContact O-N 2.89Å; D698-T700 WeakPolarHBondContact OD1-CB 3.38Å; D698-T700 PolarHBondContact OD1-N 3.36Å; D698-T700 PolarHBondContact OD1-OG1 3.24Å; T700-K702 PolarHBondContact O-N 2.89Å
701	A	56.4	Low	73.6	Confident	48 Å²	48	97.9 Å²	97.9	40%	0.397	50%	0.495	S	S	.	.			trans	-62.8	99.8	175	0	0	0	0	0	109.2	D698 E703	D698-A701 HydrophobicContact CB-CB 4.27Å; A701-E703 PolarHBondContact O-N 2.8Å
702	K	51	Low	73.5	Confident	195 Å²	195	99.3 Å²	99.3	85%	0.848	50%	0.502	S	S	*	.			trans	-69.6	39	170.9	-65.8	-174.5	177.1	-175.8	0	112.1	T700 E704	T700-K702 PolarHBondContact O-N 2.89Å; K702-E704 PolarHBondContact O-N 3.17Å
703	E	53.6	Low	73.3	Confident	116 Å²	116	99 Å²	99	54%	0.542	50%	0.498	S	S	.	.			trans	-73.9	80.3	168.1	-69.6	-159.4	146	0	0	107.9	A701 G705 K706	A701-E703 PolarHBondContact O-N 2.8Å; E703-G705 PolarHBondContact O-N 3.47Å; E703-G705 VanDerWaalsContact O-N 3.09Å; E703-K706 IonicContact OE1-NZ 2.91Å; E703-K706 PolarHBondContact OE1-NZ 3.17Å; E703-K706 VanDerWaalsContact OE2-CD 3.31Å; E703-K706 WeakPolarHBondContact OE2-CD 3.47Å; E703-K706 WeakPolarHBondContact OE2-CE 3.4Å; E703-K706 IonicContact OE2-NZ 3.51Å; E703-K706 PolarHBondContact OE2-NZ 3.11Å
704	E	52.2	Low	72.9	Confident	190 Å²	190	96.8 Å²	96.8	89%	0.888	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.7	113.6	172.8	-72	179.3	170.2	0	0	109.3	K702	K702-E704 PolarHBondContact O-N 3.17Å
705	G	54.6	Low	72.6	Confident	80 Å²	80	94.5 Å²	94.5	83%	0.825	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	101.6	0.3	167.7	0	0	0	0	0	117.9	E703 E707	E703-G705 PolarHBondContact O-N 3.47Å; E703-G705 VanDerWaalsContact O-N 3.09Å; G705-E707 PolarHBondContact O-N 2.8Å
706	K	63	Low	72.7	Confident	126 Å²	126	89.7 Å²	89.7	55%	0.548	47%	0.466	S	S	.	.			trans	-89.1	104.4	171	-71	-165.4	-158.1	149.4	0	111.1	E703	E703-K706 IonicContact OE1-NZ 2.91Å; E703-K706 PolarHBondContact OE1-NZ 3.17Å; E703-K706 VanDerWaalsContact OE2-CD 3.31Å; E703-K706 WeakPolarHBondContact OE2-CD 3.47Å; E703-K706 WeakPolarHBondContact OE2-CE 3.4Å; E703-K706 IonicContact OE2-NZ 3.51Å; E703-K706 PolarHBondContact OE2-NZ 3.11Å
707	E	72.3	Confident	73	Confident	149 Å²	149	79.3 Å²	79.3	70%	0.696	43%	0.432	S	S	*	.	P	Polyproline II helix	trans	-65.7	141.8	168.3	-70.9	-168.7	169.7	0	0	111.4	G705	G705-E707 PolarHBondContact O-N 2.8Å
708	G	78.9	Confident	73.6	Confident	8 Å²	8	81.6 Å²	81.6	8%	0.082	45%	0.449	C	S	.	.	P	Polyproline II helix	trans	-63.1	143.4	173.3	0	0	0	0	0	112.5	R732 E746 A748	G708-R732 PolarHBondContact O-NH2 3.06Å; G708-E746 PolarHBondContact N-O 3.29Å; G708-A748 WeakPolarHBondContact CA-O 3.45Å
709	T	86.6	Confident	74.4	Confident	57 Å²	57	80.2 Å²	80.2	35%	0.35	44%	0.444	S	S	.	.	P	Polyproline II helix	trans	-98.7	147.6	-177.4	62.1	0	0	0	0	112.6	H749 L750	T709-H749 PolarHBondContact N-ND1 3.4Å; T709-H749 CarbonylContact O-C 3.59Å; T709-H749 WeakPolarHBondContact O-CA 3.33Å; T709-H749 PolarHBondContact OG1-ND1 2.92Å; T709-L750 PolarHBondContact O-N 2.96Å
710	L	90.5	Very high	75.4	Confident	45 Å²	45	76.6 Å²	76.6	24%	0.236	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	116.2	172.7	-177.9	66.8	0	0	0	111.3	L712 H728 L750 V752	L710-L712 HydrophobicContact CD1-CD2 4.14Å; L710-L712 HydrophobicContact CD2-CD2 3.9Å; L710-L712 HydrophobicContact CD2-CG 4.45Å; L710-L712 HydrophobicContact CG-CD2 3.79Å; L710-L712 HydrophobicContact CG-CG 4.3Å; L710-H728 HydrophobicContact CD2-CB 3.86Å; L710-L750 HydrophobicContact CD1-CB 4.08Å; L710-V752 HydrophobicContact CD1-CB 4.49Å; L710-V752 HydrophobicContact CD1-CG2 3.67Å
711	L	92.3	Very high	76.8	Confident	67 Å²	67	75 Å²	75	35%	0.351	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	135.9	170	-176.5	65.7	0	0	0	110.2	T713 L750 H751 V752	L711-T713 HydrophobicContact CD2-CG2 4.41Å; L711-T713 HydrophobicContact CG-CG2 4.26Å; L711-L750 PolarHBondContact N-O 2.97Å; L711-H751 HydrophobicContact CB-CB 4.49Å; L711-H751 WeakPolarHBondContact O-CA 3.3Å; L711-H751 PolarHBondContact O-CD2 3.4Å; L711-V752 PolarHBondContact O-N 3.37Å
712	L	92	Very high	78.5	Confident	38 Å²	38	78.6 Å²	78.6	20%	0.199	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	123.2	-179	-58.6	-179.4	0	0	0	109.5	L710 M716 K721 A724 V752	L710-L712 HydrophobicContact CD1-CD2 4.14Å; L710-L712 HydrophobicContact CD2-CD2 3.9Å; L710-L712 HydrophobicContact CD2-CG 4.45Å; L710-L712 HydrophobicContact CG-CD2 3.79Å; L710-L712 HydrophobicContact CG-CG 4.3Å; L712-M716 HydrophobicContact CB-CE 3.56Å; L712-M716 HydrophobicContact CB-SD 4.34Å; L712-M716 HydrophobicContact CD2-CE 4.02Å; L712-M716 HydrophobicContact CG-CE 4.33Å; L712-K721 HydrophobicContact CD1-CB 3.98Å; L712-K721 HydrophobicContact CD1-CG 3.96Å; L712-A724 HydrophobicContact CD1-CB 3.76Å; L712-A724 HydrophobicContact CD2-CB 3.71Å; L712-A724 HydrophobicContact CG-CB 4.42Å; L712-V752 WeakPolarHBondContact CA-O 3.29Å; L712-V752 HydrophobicContact CD2-CB 3.85Å; L712-V752 HydrophobicContact CD2-CG2 4.42Å
713	T	88.1	Confident	80.4	Confident	50 Å²	50	69.6 Å²	69.6	31%	0.307	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	168.8	174.2	68.4	0	0	0	0	113	L711 M716 H751 V752 H753 V754	L711-T713 HydrophobicContact CD2-CG2 4.41Å; L711-T713 HydrophobicContact CG-CG2 4.26Å; T713-M716 WeakPolarHBondContact O-CE 3.49Å; T713-H751 VanDerWaalsContact CG2-NE2 3.3Å; T713-H751 WeakPolarHBondContact CG2-NE2 3.43Å; T713-H751 PolarHBondContact OG1-NE2 2.96Å; T713-V752 PolarHBondContact N-O 3.32Å; T713-V752 VanDerWaalsContact N-O 3.08Å; T713-H753 PolarHBondContact O-ND1 2.9Å; T713-H753 PolarHBondContact OG1-ND1 3.48Å; T713-V754 PolarHBondContact O-N 3.05Å
714	G	83.1	Confident	82.2	Confident	17 Å²	17	64.1 Å²	64.1	18%	0.175	35%	0.352	C	S	.	.	S	Bend	trans	105.4	32.6	-176.3	0	0	0	0	0	113.5	M716	G714-M716 VanDerWaalsContact C-N 3.28Å; G714-M716 PolarHBondContact O-N 3.24Å
715	N	81.3	Confident	84.2	Confident	97 Å²	97	61.5 Å²	61.5	52%	0.519	34%	0.338	S	S	.	.	S	Bend	trans	52.4	43.3	-178.8	-68.2	-12	0	0	0	113.8	K761	N715-K761 PolarHBondContact O-N 3.46Å; N715-K761 VanDerWaalsContact O-N 3.12Å
716	M	82	Confident	86	Confident	13 Å²	13	59.8 Å²	59.8	6%	0.064	31%	0.309	C	S	.	.	B	Isolated β-bridge	trans	-68	131	172.3	-63.5	-168	-117.5	0	0	110.1	L712 T713 G714 M720 K721 V752 V754 K761	L712-M716 HydrophobicContact CB-CE 3.56Å; L712-M716 HydrophobicContact CB-SD 4.34Å; L712-M716 HydrophobicContact CD2-CE 4.02Å; L712-M716 HydrophobicContact CG-CE 4.33Å; T713-M716 WeakPolarHBondContact O-CE 3.49Å; G714-M716 VanDerWaalsContact C-N 3.28Å; G714-M716 PolarHBondContact O-N 3.24Å; M716-M720 HydrophobicContact CB-CB 4.24Å; M716-M720 HydrophobicContact CB-CG 4.27Å; M716-M720 HydrophobicContact CB-SD 4.17Å; M716-M720 HydrophobicContact CG-CE 4.43Å; M716-M720 HydrophobicContact CG-CG 4.16Å; M716-M720 HydrophobicContact CG-SD 3.7Å; M716-M720 HydrophobicContact SD-CE 4.22Å; M716-M720 HydrophobicContact SD-CG 3.97Å; M716-M720 HydrophobicContact SD-SD 4.04Å; M716-K721 HydrophobicContact CB-CG 4.25Å; M716-K721 WeakPolarHBondContact O-CE 3.34Å; M716-V752 HydrophobicContact CE-CG1 4.45Å; M716-V752 WeakPolarHBondContact CE-O 3.45Å; M716-V754 HydrophobicContact CE-CG2 4.17Å; M716-V754 HydrophobicContact SD-CG2 4.2Å; M716-K761 WeakPolarHBondContact CA-O 3.19Å
717	G	82.2	Confident	87.6	Confident	16 Å²	16	53.8 Å²	53.8	17%	0.165	28%	0.283	C	S	.	.			trans	-75	-179.4	169.8	0	0	0	0	0	112.2	M720 K721 K761 D762	G717-M720 PolarHBondContact O-N 3.38Å; G717-K721 VanDerWaalsContact O-CG 3.29Å; G717-K721 WeakPolarHBondContact O-CG 3.3Å; G717-K721 PolarHBondContact O-N 3.02Å; G717-K761 PolarHBondContact N-O 3.37Å; G717-D762 VanDerWaalsContact CA-OD1 3.3Å; G717-D762 WeakPolarHBondContact CA-OD1 3.37Å
718	D	87.3	Confident	88.6	Confident	115 Å²	115	47.3 Å²	47.3	62%	0.615	25%	0.253	S	S	*	.	H	α-helix	trans	-73.9	-35.2	-169.9	-66.4	-29.2	0	0	0	112.6	M720 K721 E722 D762	D718-M720 VanDerWaalsContact C-N 3.33Å; D718-M720 PolarHBondContact O-N 2.98Å; D718-K721 PolarHBondContact O-N 2.87Å; D718-K721 IonicContact OD1-NZ 3.49Å; D718-K721 PolarHBondContact OD1-NZ 3.4Å; D718-E722 WeakPolarHBondContact O-CB 3.22Å; D718-E722 PolarHBondContact O-N 3.24Å; D718-D762 PolarHBondContact N-OD1 3.39Å
719	V	86.6	Confident	89.3	Confident	63 Å²	63	50.6 Å²	50.6	38%	0.382	27%	0.271	S	S	.	.	H	α-helix	trans	-65.4	-40.6	174.5	-173.5	0	0	0	0	110.3	E722 S723 D762 P764	V719-E722 PolarHBondContact O-N 3Å; V719-S723 WeakPolarHBondContact O-CB 3.4Å; V719-S723 PolarHBondContact O-N 3.4Å; V719-D762 WeakPolarHBondContact CA-OD1 3.37Å; V719-D762 WeakPolarHBondContact CB-OD1 3.43Å; V719-D762 PolarHBondContact N-OD1 2.89Å; V719-P764 HydrophobicContact CG1-CB 4.19Å; V719-P764 HydrophobicContact CG1-CG 4.4Å
720	M	88	Confident	89.7	Confident	4 Å²	4	48.5 Å²	48.5	2%	0.02	26%	0.257	C	S	.	.	H	α-helix	trans	-69.4	-37.6	177.3	-168.1	173.2	-169.5	0	0	112.3	M716 G717 D718 E722 S723 A724 V754 K761 D762 A766	M716-M720 HydrophobicContact CB-CB 4.24Å; M716-M720 HydrophobicContact CB-CG 4.27Å; M716-M720 HydrophobicContact CB-SD 4.17Å; M716-M720 HydrophobicContact CG-CE 4.43Å; M716-M720 HydrophobicContact CG-CG 4.16Å; M716-M720 HydrophobicContact CG-SD 3.7Å; M716-M720 HydrophobicContact SD-CE 4.22Å; M716-M720 HydrophobicContact SD-CG 3.97Å; M716-M720 HydrophobicContact SD-SD 4.04Å; G717-M720 PolarHBondContact O-N 3.38Å; D718-M720 VanDerWaalsContact C-N 3.33Å; D718-M720 PolarHBondContact O-N 2.98Å; M720-E722 VanDerWaalsContact C-N 3.32Å; M720-S723 PolarHBondContact O-N 2.89Å; M720-A724 WeakPolarHBondContact O-CB 3.19Å; M720-A724 PolarHBondContact O-N 2.96Å; M720-V754 HydrophobicContact CE-CB 4.42Å; M720-V754 HydrophobicContact CE-CG1 4.33Å; M720-V754 HydrophobicContact CE-CG2 3.71Å; M720-K761 HydrophobicContact SD-CB 3.78Å; M720-D762 PolarHBondContact N-OD1 2.81Å; M720-A766 HydrophobicContact CE-CB 3.64Å
721	K	90.4	Very high	89.8	Confident	82 Å²	82	46.3 Å²	46.3	36%	0.357	25%	0.246	S	C	.	.	H	α-helix	trans	-63.2	-39.7	173.2	-72.3	171.4	-159.6	152.9	0	111.9	L712 M716 G717 D718 A724 K725	L712-K721 HydrophobicContact CD1-CB 3.98Å; L712-K721 HydrophobicContact CD1-CG 3.96Å; M716-K721 HydrophobicContact CB-CG 4.25Å; M716-K721 WeakPolarHBondContact O-CE 3.34Å; G717-K721 VanDerWaalsContact O-CG 3.29Å; G717-K721 WeakPolarHBondContact O-CG 3.3Å; G717-K721 PolarHBondContact O-N 3.02Å; D718-K721 PolarHBondContact O-N 2.87Å; D718-K721 IonicContact OD1-NZ 3.49Å; D718-K721 PolarHBondContact OD1-NZ 3.4Å; K721-A724 PolarHBondContact O-N 2.77Å; K721-K725 WeakPolarHBondContact O-CG 3.49Å; K721-K725 PolarHBondContact O-N 2.88Å; K721-K725 VanDerWaalsContact O-N 3.15Å
722	E	91.3	Very high	89.8	Confident	122 Å²	122	45.6 Å²	45.6	57%	0.57	24%	0.239	S	C	*	.	H	α-helix	trans	-64.5	-47.7	174.5	-174.1	172.5	-170.9	0	0	111.1	D718 V719 M720 A724 K725 I726	D718-E722 WeakPolarHBondContact O-CB 3.22Å; D718-E722 PolarHBondContact O-N 3.24Å; V719-E722 PolarHBondContact O-N 3Å; M720-E722 VanDerWaalsContact C-N 3.32Å; E722-A724 VanDerWaalsContact C-N 3.27Å; E722-A724 PolarHBondContact O-N 2.77Å; E722-K725 WeakPolarHBondContact O-CB 3.25Å; E722-K725 PolarHBondContact O-N 3.01Å; E722-I726 HydrophobicContact CG-CD1 4.18Å; E722-I726 WeakPolarHBondContact O-CG1 3.36Å; E722-I726 PolarHBondContact O-N 3.46Å
723	S	91.2	Very high	89.7	Confident	7 Å²	7	48.2 Å²	48.2	5%	0.049	25%	0.25	C	C	.	.	H	α-helix	trans	-55.4	-41.4	174.2	-172.7	0	0	0	0	112.2	V719 M720 K725 I726 A727 P764 G767	V719-S723 WeakPolarHBondContact O-CB 3.4Å; V719-S723 PolarHBondContact O-N 3.4Å; M720-S723 PolarHBondContact O-N 2.89Å; S723-K725 PolarHBondContact O-N 2.9Å; S723-I726 PolarHBondContact O-N 2.88Å; S723-A727 VanDerWaalsContact O-CB 3.23Å; S723-A727 WeakPolarHBondContact O-CB 3.42Å; S723-A727 PolarHBondContact O-N 3.39Å; S723-P764 PolarHBondContact OG-O 2.89Å; S723-G767 WeakPolarHBondContact OG-CA 3.19Å; S723-G767 PolarHBondContact OG-N 3.4Å
724	A	92.9	Very high	89.9	Confident	0 Å²	0	46 Å²	46	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-65.3	-36.8	176.8	0	0	0	0	0	113.2	L712 M720 K721 E722 H728 I770	L712-A724 HydrophobicContact CD1-CB 3.76Å; L712-A724 HydrophobicContact CD2-CB 3.71Å; L712-A724 HydrophobicContact CG-CB 4.42Å; M720-A724 WeakPolarHBondContact O-CB 3.19Å; M720-A724 PolarHBondContact O-N 2.96Å; K721-A724 PolarHBondContact O-N 2.77Å; E722-A724 VanDerWaalsContact C-N 3.27Å; E722-A724 PolarHBondContact O-N 2.77Å; A724-H728 WeakPolarHBondContact O-CB 3.31Å; A724-H728 PolarHBondContact O-N 2.8Å; A724-I770 HydrophobicContact CB-CD1 3.88Å
725	K	93.1	Very high	90.2	Very high	136 Å²	136	45.4 Å²	45.4	59%	0.591	23%	0.228	S	C	*	.	H	α-helix	trans	-67.2	-46.6	174.8	-70.8	172.8	-178	177.7	0	111.2	K721 E722 S723 A727 H728 T729	K721-K725 WeakPolarHBondContact O-CG 3.49Å; K721-K725 PolarHBondContact O-N 2.88Å; K721-K725 VanDerWaalsContact O-N 3.15Å; E722-K725 WeakPolarHBondContact O-CB 3.25Å; E722-K725 PolarHBondContact O-N 3.01Å; S723-K725 PolarHBondContact O-N 2.9Å; K725-A727 VanDerWaalsContact C-N 3.3Å; K725-A727 PolarHBondContact O-N 2.78Å; K725-H728 PolarHBondContact O-N 2.93Å; K725-T729 PolarHBondContact O-N 2.98Å; K725-T729 PolarHBondContact O-OG1 3.32Å
726	I	93.7	Very high	90.5	Very high	43 Å²	43	42.7 Å²	42.7	22%	0.221	22%	0.22	C	C	.	.	H	α-helix	trans	-58.9	-45.9	176	-65.1	168.6	0	0	0	110	E722 S723 H728 T729 Y730 V793 L795	E722-I726 HydrophobicContact CG-CD1 4.18Å; E722-I726 WeakPolarHBondContact O-CG1 3.36Å; E722-I726 PolarHBondContact O-N 3.46Å; S723-I726 PolarHBondContact O-N 2.88Å; I726-H728 VanDerWaalsContact C-N 3.34Å; I726-H728 PolarHBondContact O-N 2.85Å; I726-T729 PolarHBondContact O-N 3.05Å; I726-Y730 WeakPolarHBondContact O-CB 3.31Å; I726-Y730 PolarHBondContact O-N 3.02Å; I726-V793 HydrophobicContact CG2-CG1 4.3Å; I726-V793 WeakPolarHBondContact CG2-O 3.35Å; I726-L795 HydrophobicContact CG2-CD2 3.99Å; I726-L795 HydrophobicContact CG2-CG 4.12Å
727	A	95	Very high	90.7	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-59.3	-42.5	176.4	0	0	0	0	0	112.3	S723 K725 A731 I770 V771 V793	S723-A727 VanDerWaalsContact O-CB 3.23Å; S723-A727 WeakPolarHBondContact O-CB 3.42Å; S723-A727 PolarHBondContact O-N 3.39Å; K725-A727 VanDerWaalsContact C-N 3.3Å; K725-A727 PolarHBondContact O-N 2.78Å; A727-A731 WeakPolarHBondContact O-CB 3.4Å; A727-A731 PolarHBondContact O-N 3.27Å; A727-I770 HydrophobicContact CB-CB 3.81Å; A727-I770 HydrophobicContact CB-CG2 3.63Å; A727-V771 HydrophobicContact CB-CG2 3.53Å; A727-V793 HydrophobicContact CB-CG1 4.24Å
728	H	94.1	Very high	90.9	Very high	14 Å²	14	45.8 Å²	45.8	7%	0.065	23%	0.232	C	C	.	.	H	α-helix	trans	-65.7	-44.3	177.3	-176.7	-156.9	0	0	0	112.4	L710 A724 K725 I726 A731 R732 L745 L774	L710-H728 HydrophobicContact CD2-CB 3.86Å; A724-H728 WeakPolarHBondContact O-CB 3.31Å; A724-H728 PolarHBondContact O-N 2.8Å; K725-H728 PolarHBondContact O-N 2.93Å; I726-H728 VanDerWaalsContact C-N 3.34Å; I726-H728 PolarHBondContact O-N 2.85Å; H728-A731 PolarHBondContact O-N 2.93Å; H728-R732 PolarHBondContact CE1-NH2 2.99Å; H728-R732 VanDerWaalsContact CE1-NH2 3.32Å; H728-R732 PolarHBondContact NE2-NE 2.97Å; H728-R732 VanDerWaalsContact NE2-NE 3.19Å; H728-R732 WeakPolarHBondContact O-CG 3.39Å; H728-R732 PolarHBondContact O-N 3.48Å; H728-L745 PolarHBondContact NE2-O 3.37Å; H728-L774 HydrophobicContact CB-CD1 4.03Å
729	T	92.6	Very high	90.8	Very high	76 Å²	76	41.9 Å²	41.9	47%	0.466	21%	0.213	S	C	.	.	H	α-helix	trans	-60.1	-47.5	175.5	-59.3	0	0	0	0	111.5	K725 I726 R732 Q733 L795	K725-T729 PolarHBondContact O-N 2.98Å; K725-T729 PolarHBondContact O-OG1 3.32Å; I726-T729 PolarHBondContact O-N 3.05Å; T729-R732 PolarHBondContact O-N 3.22Å; T729-Q733 PolarHBondContact O-N 3.32Å; T729-Q733 VanDerWaalsContact O-N 3.17Å; T729-L795 HydrophobicContact CG2-CD2 3.85Å
730	Y	94.9	Very high	90.5	Very high	13 Å²	13	43.4 Å²	43.4	5%	0.051	22%	0.224	C	C	.	.	H	α-helix	trans	-67.3	-40.3	179	179.6	-103.6	0	0	0	112.3	I726 R732 Q733 F734 V771 V793 G797 Y849	I726-Y730 WeakPolarHBondContact O-CB 3.31Å; I726-Y730 PolarHBondContact O-N 3.02Å; Y730-R732 VanDerWaalsContact C-N 3.31Å; Y730-R732 PolarHBondContact O-N 2.8Å; Y730-Q733 PolarHBondContact O-N 3.36Å; Y730-F734 HydrophobicContact CE1-CB 4.37Å; Y730-F734 HydrophobicContact CE1-CD2 4.27Å; Y730-F734 WeakPolarHBondContact O-CB 3.08Å; Y730-F734 PolarHBondContact O-N 3.31Å; Y730-V771 HydrophobicContact CD1-CG1 3.85Å; Y730-V771 HydrophobicContact CD1-CG2 4.08Å; Y730-V771 HydrophobicContact CE1-CG1 4.21Å; Y730-V793 HydrophobicContact CD1-CG2 4.05Å; Y730-V793 HydrophobicContact CE1-CG2 4.48Å; Y730-V793 HydrophobicContact CG-CG2 4.46Å; Y730-G797 VanDerWaalsContact CE2-N 3.28Å; Y730-G797 WeakPolarHBondContact OH-CA 3.31Å; Y730-Y849 HydrophobicContact CD1-CG 4.48Å; Y730-Y849 AromaticContact CE1-CD1 3.57Å; Y730-Y849 HydrophobicContact CE1-CD1 3.57Å; Y730-Y849 HydrophobicContact CE1-CD2 4.42Å; Y730-Y849 HydrophobicContact CE1-CE1 4.43Å; Y730-Y849 AromaticContact CE1-CG 3.58Å; Y730-Y849 HydrophobicContact CE1-CG 3.58Å
731	A	93.8	Very high	90.3	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-60.3	-39.5	176.7	0	0	0	0	0	112.4	A727 H728 F734 L735 L745 V771 L774 I775	A727-A731 WeakPolarHBondContact O-CB 3.4Å; A727-A731 PolarHBondContact O-N 3.27Å; H728-A731 PolarHBondContact O-N 2.93Å; A731-F734 PolarHBondContact O-N 3.32Å; A731-L735 PolarHBondContact O-N 3.19Å; A731-L735 VanDerWaalsContact O-N 3.08Å; A731-L745 HydrophobicContact CB-CD1 3.63Å; A731-V771 HydrophobicContact CB-CG1 4.05Å; A731-L774 HydrophobicContact CB-CB 4.15Å; A731-L774 HydrophobicContact CB-CD1 4.2Å; A731-I775 HydrophobicContact CB-CD1 4.47Å; A731-I775 HydrophobicContact CB-CG1 4.12Å
732	R	91.5	Very high	89.9	Confident	52 Å²	52	48.8 Å²	48.8	20%	0.196	26%	0.256	C	S	.	.	H	α-helix	trans	-59.4	-51.3	172.2	-76.9	179	172.1	179.6	-0.3	111.1	G708 H728 T729 Y730 F734 L735 A736 L745 E746	G708-R732 PolarHBondContact O-NH2 3.06Å; H728-R732 PolarHBondContact CE1-NH2 2.99Å; H728-R732 VanDerWaalsContact CE1-NH2 3.32Å; H728-R732 PolarHBondContact NE2-NE 2.97Å; H728-R732 VanDerWaalsContact NE2-NE 3.19Å; H728-R732 WeakPolarHBondContact O-CG 3.39Å; H728-R732 PolarHBondContact O-N 3.48Å; T729-R732 PolarHBondContact O-N 3.22Å; Y730-R732 VanDerWaalsContact C-N 3.31Å; Y730-R732 PolarHBondContact O-N 2.8Å; R732-F734 VanDerWaalsContact C-N 3.32Å; R732-F734 PolarHBondContact O-N 2.76Å; R732-L735 PolarHBondContact O-N 2.97Å; R732-A736 WeakPolarHBondContact O-CB 3.5Å; R732-A736 PolarHBondContact O-N 3.18Å; R732-L745 HydrophobicContact CG-CB 3.74Å; R732-L745 VanDerWaalsContact CZ-O 3.31Å; R732-L745 PolarHBondContact NE-O 2.92Å; R732-L745 PolarHBondContact NH2-O 3.09Å; R732-E746 PolarHBondContact NH2-O 3.36Å
733	Q	90.5	Very high	89.5	Confident	92 Å²	92	44 Å²	44	43%	0.43	24%	0.237	S	C	.	.	H	α-helix	trans	-61.4	-40.7	179.6	-174.9	179.6	-1.4	0	0	112.2	T729 Y730 A736 N737	T729-Q733 PolarHBondContact O-N 3.32Å; T729-Q733 VanDerWaalsContact O-N 3.17Å; Y730-Q733 PolarHBondContact O-N 3.36Å; Q733-A736 PolarHBondContact O-N 2.95Å; Q733-N737 VanDerWaalsContact O-CG 3.27Å; Q733-N737 PolarHBondContact O-N 3.43Å; Q733-N737 PolarHBondContact O-ND2 3.19Å
734	F	91.7	Very high	89.3	Confident	5 Å²	5	44.8 Å²	44.8	2%	0.022	24%	0.239	C	C	.	.	H	α-helix	trans	-61.7	-46	178.1	-174.3	-85.9	0	0	0	111.7	Y730 A731 R732 N737 H738 I775 Y849 E850 F853 L862	Y730-F734 HydrophobicContact CE1-CB 4.37Å; Y730-F734 HydrophobicContact CE1-CD2 4.27Å; Y730-F734 WeakPolarHBondContact O-CB 3.08Å; Y730-F734 PolarHBondContact O-N 3.31Å; A731-F734 PolarHBondContact O-N 3.32Å; R732-F734 VanDerWaalsContact C-N 3.32Å; R732-F734 PolarHBondContact O-N 2.76Å; F734-N737 PolarHBondContact O-N 2.85Å; F734-H738 AromaticContact CD2-CD2 3.77Å; F734-H738 AromaticContact CE1-CD2 3.88Å; F734-H738 AromaticContact CE2-CD2 3.59Å; F734-H738 AromaticContact CE2-NE2 3.76Å; F734-H738 AromaticContact CZ-CD2 3.65Å; F734-H738 PolarHBondContact O-CD2 3.33Å; F734-H738 PolarHBondContact O-N 2.96Å; F734-H738 VanDerWaalsContact O-N 3.07Å; F734-I775 HydrophobicContact CB-CD1 4.2Å; F734-I775 HydrophobicContact CD1-CD1 3.49Å; F734-I775 VanDerWaalsContact CD1-CD1 3.49Å; F734-I775 HydrophobicContact CE1-CD1 4.05Å; F734-I775 HydrophobicContact CG-CD1 3.94Å; F734-Y849 AromaticContact CD2-CD1 3.92Å; F734-Y849 HydrophobicContact CD2-CD1 3.92Å; F734-Y849 HydrophobicContact CD2-CE1 4.3Å; F734-Y849 AromaticContact CE2-CD1 3.87Å; F734-Y849 HydrophobicContact CE2-CD1 3.87Å; F734-Y849 HydrophobicContact CE2-CE1 4.21Å; F734-Y849 HydrophobicContact CZ-CD1 4.43Å; F734-Y849 HydrophobicContact CZ-CE1 4.36Å; F734-E850 HydrophobicContact CE2-CG 3.79Å; F734-F853 AromaticContact CE1-CD2 3.69Å; F734-F853 HydrophobicContact CE1-CD2 3.69Å; F734-F853 HydrophobicContact CE1-CE2 4Å; F734-F853 AromaticContact CE1-CG 3.99Å; F734-F853 HydrophobicContact CE1-CG 3.99Å; F734-F853 HydrophobicContact CZ-CB 3.87Å; F734-F853 HydrophobicContact CZ-CD1 4.17Å; F734-F853 AromaticContact CZ-CD2 3.85Å; F734-F853 HydrophobicContact CZ-CD2 3.85Å; F734-F853 AromaticContact CZ-CG 3.67Å; F734-F853 HydrophobicContact CZ-CG 3.67Å; F734-L862 HydrophobicContact CE1-CD2 3.97Å; F734-L862 HydrophobicContact CZ-CD1 4.35Å; F734-L862 HydrophobicContact CZ-CD2 3.81Å
735	L	89.7	Confident	89	Confident	3 Å²	3	44.9 Å²	44.9	2%	0.016	24%	0.24	C	C	.	.	H	α-helix	trans	-65.7	-42.9	175.4	-72.7	-178.7	0	0	0	112	A731 R732 N737 H738 V739 L745 I775 A778 L779	A731-L735 PolarHBondContact O-N 3.19Å; A731-L735 VanDerWaalsContact O-N 3.08Å; R732-L735 PolarHBondContact O-N 2.97Å; L735-N737 PolarHBondContact O-N 3.06Å; L735-H738 PolarHBondContact O-N 3.41Å; L735-V739 HydrophobicContact CD2-CB 4.5Å; L735-V739 HydrophobicContact CD2-CG2 4.37Å; L735-V739 CarbonylContact O-C 3.02Å; L735-V739 VanDerWaalsContact O-CA 3.29Å; L735-V739 WeakPolarHBondContact O-CA 3.21Å; L735-V739 PolarHBondContact O-N 3.06Å; L735-V739 VanDerWaalsContact O-O 3.09Å; L735-L745 HydrophobicContact CD1-CB 4.33Å; L735-L745 HydrophobicContact CD1-CD1 3.45Å; L735-L745 VanDerWaalsContact CD1-CD1 3.45Å; L735-L745 HydrophobicContact CD1-CG 3.63Å; L735-L745 HydrophobicContact CG-CD1 4.28Å; L735-I775 HydrophobicContact CD2-CG2 4.37Å; L735-A778 HydrophobicContact CD1-CB 3.47Å; L735-A778 VanDerWaalsContact CD1-CB 3.47Å; L735-L779 HydrophobicContact CD2-CD2 4.06Å; L735-L779 HydrophobicContact CD2-CG 4.42Å
736	A	88.1	Confident	88.7	Confident	41 Å²	41	43 Å²	43	34%	0.339	23%	0.233	S	C	.	.	H	α-helix	trans	-58.5	-35.6	178.4	0	0	0	0	0	112.5	R732 Q733 P740	R732-A736 WeakPolarHBondContact O-CB 3.5Å; R732-A736 PolarHBondContact O-N 3.18Å; Q733-A736 PolarHBondContact O-N 2.95Å; A736-P740 WeakPolarHBondContact O-CB 3.47Å
737	N	87.2	Confident	88.3	Confident	80 Å²	80	45.1 Å²	45.1	43%	0.428	24%	0.241	S	C	.	.	H	α-helix	trans	-80.1	-39	179.8	-68.3	-12.5	0	0	0	113.4	Q733 F734 L735 A865	Q733-N737 VanDerWaalsContact O-CG 3.27Å; Q733-N737 PolarHBondContact O-N 3.43Å; Q733-N737 PolarHBondContact O-ND2 3.19Å; F734-N737 PolarHBondContact O-N 2.85Å; L735-N737 PolarHBondContact O-N 3.06Å; N737-A865 HydrophobicContact CB-CB 4.43Å
738	H	85.4	Confident	87.9	Confident	14 Å²	14	45.2 Å²	45.2	7%	0.065	24%	0.242	C	C	.	.	H	α-helix	trans	-103.9	-20.2	-171.8	-66.6	-66.7	0	0	0	114.8	F734 L735 L862 A863	F734-H738 AromaticContact CD2-CD2 3.77Å; F734-H738 AromaticContact CE1-CD2 3.88Å; F734-H738 AromaticContact CE2-CD2 3.59Å; F734-H738 AromaticContact CE2-NE2 3.76Å; F734-H738 AromaticContact CZ-CD2 3.65Å; F734-H738 PolarHBondContact O-CD2 3.33Å; F734-H738 PolarHBondContact O-N 2.96Å; F734-H738 VanDerWaalsContact O-N 3.07Å; L735-H738 PolarHBondContact O-N 3.41Å; H738-L862 HydrophobicContact CB-CD2 3.71Å; H738-A863 PolarHBondContact ND1-O 3.44Å; H738-A863 WeakPolarHBondContact O-CB 3.4Å
739	V	86.1	Confident	87.6	Confident	33 Å²	33	46.4 Å²	46.4	20%	0.2	25%	0.247	C	C	.	.			trans	-142.5	63.5	179.7	-163.6	0	0	0	0	109	L735 D741 N742 L779 F860	L735-V739 HydrophobicContact CD2-CB 4.5Å; L735-V739 HydrophobicContact CD2-CG2 4.37Å; L735-V739 CarbonylContact O-C 3.02Å; L735-V739 VanDerWaalsContact O-CA 3.29Å; L735-V739 WeakPolarHBondContact O-CA 3.21Å; L735-V739 PolarHBondContact O-N 3.06Å; L735-V739 VanDerWaalsContact O-O 3.09Å; V739-D741 PolarHBondContact O-N 3.24Å; V739-D741 VanDerWaalsContact O-N 3.09Å; V739-N742 HydrophobicContact CB-CB 4.17Å; V739-N742 HydrophobicContact CG1-CB 3.7Å; V739-N742 VanDerWaalsContact O-CB 3.3Å; V739-N742 WeakPolarHBondContact O-CB 3.29Å; V739-N742 PolarHBondContact O-N 3.4Å; V739-L779 HydrophobicContact CG2-CD2 4.23Å; V739-F860 HydrophobicContact CG2-CE1 4.06Å; V739-F860 HydrophobicContact CG2-CZ 3.85Å
740	P	79.5	Confident	87.7	Confident	94 Å²	94	42.8 Å²	42.8	61%	0.61	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-25.7	-170.5	21	-33.3	0	0	0	114.6	A736 N742	A736-P740 WeakPolarHBondContact O-CB 3.47Å; P740-N742 PolarHBondContact O-N 2.91Å
741	D	82.6	Confident	87.6	Confident	161 Å²	161	44.3 Å²	44.3	86%	0.861	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.6	-12	175.4	-62.4	-33.2	0	0	0	112.8	V739 S743	V739-D741 PolarHBondContact O-N 3.24Å; V739-D741 VanDerWaalsContact O-N 3.09Å; D741-S743 PolarHBondContact O-N 3.42Å
742	N	83.5	Confident	87.6	Confident	38 Å²	38	44.3 Å²	44.3	20%	0.203	23%	0.232	C	C	.	.			trans	-96.8	90.1	-177.6	-169.5	-26.8	0	0	0	111.7	V739 P740 F744 A778	V739-N742 HydrophobicContact CB-CB 4.17Å; V739-N742 HydrophobicContact CG1-CB 3.7Å; V739-N742 VanDerWaalsContact O-CB 3.3Å; V739-N742 WeakPolarHBondContact O-CB 3.29Å; V739-N742 PolarHBondContact O-N 3.4Å; P740-N742 PolarHBondContact O-N 2.91Å; N742-F744 PolarHBondContact O-N 3.11Å; N742-F744 WeakPolarHBondContact OD1-CB 3.46Å; N742-F744 PolarHBondContact OD1-N 3.34Å; N742-A778 PolarHBondContact ND2-O 2.75Å
743	S	82.4	Confident	87.7	Confident	23 Å²	23	44.6 Å²	44.6	16%	0.161	24%	0.236	C	C	.	.			trans	-83.9	14	174	68.4	0	0	0	0	114.4	D741 L745 E746 K747	D741-S743 PolarHBondContact O-N 3.42Å; S743-L745 PolarHBondContact O-N 3.4Å; S743-E746 WeakPolarHBondContact O-CB 2.94Å; S743-E746 PolarHBondContact O-N 2.91Å; S743-K747 PolarHBondContact O-N 3.48Å; S743-K747 VanDerWaalsContact OG-CE 3.27Å; S743-K747 WeakPolarHBondContact OG-CE 3.42Å; S743-K747 PolarHBondContact OG-NZ 2.91Å
744	F	87.1	Confident	87.5	Confident	22 Å²	22	40.2 Å²	40.2	10%	0.096	22%	0.215	C	C	.	.	H	α-helix	trans	-58.2	-51.6	-170.3	-179.6	-94.4	0	0	0	113	L693 Y697 N742 E746 K747 A748 L750 L777 A778	L693-F744 HydrophobicContact CD1-CE2 4.02Å; L693-F744 HydrophobicContact CD1-CZ 3.97Å; L693-F744 HydrophobicContact CD2-CE1 4.42Å; L693-F744 HydrophobicContact CD2-CE2 3.95Å; L693-F744 HydrophobicContact CD2-CZ 3.56Å; L693-F744 HydrophobicContact CG-CE2 4.33Å; L693-F744 HydrophobicContact CG-CZ 3.84Å; Y697-F744 AromaticContact CD1-CD2 3.98Å; Y697-F744 HydrophobicContact CD1-CD2 3.98Å; Y697-F744 HydrophobicContact CD1-CE2 4.21Å; Y697-F744 AromaticContact CD2-CD2 3.76Å; Y697-F744 HydrophobicContact CD2-CD2 3.76Å; Y697-F744 AromaticContact CD2-CE2 3.92Å; Y697-F744 HydrophobicContact CD2-CE2 3.92Å; Y697-F744 AromaticContact CE1-CD2 3.94Å; Y697-F744 HydrophobicContact CE1-CD2 3.94Å; Y697-F744 AromaticContact CE2-CD2 3.7Å; Y697-F744 HydrophobicContact CE2-CD2 3.7Å; Y697-F744 HydrophobicContact CE2-CE2 4.34Å; Y697-F744 HydrophobicContact CE2-CG 4.34Å; Y697-F744 AromaticContact CG-CD2 3.89Å; Y697-F744 HydrophobicContact CG-CD2 3.89Å; Y697-F744 AromaticContact CG-CE2 3.84Å; Y697-F744 HydrophobicContact CG-CE2 3.84Å; Y697-F744 AromaticContact CZ-CD2 3.81Å; N742-F744 PolarHBondContact O-N 3.11Å; N742-F744 WeakPolarHBondContact OD1-CB 3.46Å; N742-F744 PolarHBondContact OD1-N 3.34Å; F744-E746 PolarHBondContact O-N 3.07Å; F744-K747 PolarHBondContact O-N 3.37Å; F744-A748 HydrophobicContact CD1-CB 4.24Å; F744-A748 HydrophobicContact CD2-CB 4.45Å; F744-A748 HydrophobicContact CE1-CB 4.13Å; F744-A748 HydrophobicContact CE2-CB 4.35Å; F744-A748 HydrophobicContact CG-CB 4.41Å; F744-A748 HydrophobicContact CZ-CB 4.2Å; F744-A748 WeakPolarHBondContact O-CA 3.39Å; F744-A748 WeakPolarHBondContact O-CB 3.35Å; F744-A748 PolarHBondContact O-N 3.38Å; F744-L750 HydrophobicContact CE1-CD2 4.02Å; F744-L777 HydrophobicContact CE1-CD2 4.1Å; F744-L777 HydrophobicContact CE1-CG 4.02Å; F744-L777 HydrophobicContact CZ-CD2 4.3Å; F744-L777 HydrophobicContact CZ-CG 4.14Å; F744-A778 HydrophobicContact CB-CB 4.35Å; F744-A778 HydrophobicContact CD1-CB 3.56Å; F744-A778 HydrophobicContact CE1-CB 4.19Å; F744-A778 HydrophobicContact CG-CB 4.25Å
745	L	87.7	Confident	86.7	Confident	2 Å²	2	41.1 Å²	41.1	1%	0.01	22%	0.221	C	C	.	.	H	α-helix	trans	-69.7	-17.2	-176.4	-68.1	-177	0	0	0	113.5	H728 A731 R732 L735 S743 L750 L774 A778	H728-L745 PolarHBondContact NE2-O 3.37Å; A731-L745 HydrophobicContact CB-CD1 3.63Å; R732-L745 HydrophobicContact CG-CB 3.74Å; R732-L745 VanDerWaalsContact CZ-O 3.31Å; R732-L745 PolarHBondContact NE-O 2.92Å; R732-L745 PolarHBondContact NH2-O 3.09Å; L735-L745 HydrophobicContact CD1-CB 4.33Å; L735-L745 HydrophobicContact CD1-CD1 3.45Å; L735-L745 VanDerWaalsContact CD1-CD1 3.45Å; L735-L745 HydrophobicContact CD1-CG 3.63Å; L735-L745 HydrophobicContact CG-CD1 4.28Å; S743-L745 PolarHBondContact O-N 3.4Å; L745-L750 HydrophobicContact CD2-CD1 3.59Å; L745-L750 HydrophobicContact CD2-CD2 4.42Å; L745-L774 HydrophobicContact CD1-CB 4.27Å; L745-L774 HydrophobicContact CD2-CB 4.21Å; L745-A778 HydrophobicContact CD1-CB 4.43Å; L745-A778 HydrophobicContact CD2-CB 4.13Å; L745-A778 HydrophobicContact CG-CB 3.95Å
746	E	85.6	Confident	85.5	Confident	98 Å²	98	44.1 Å²	44.1	46%	0.458	24%	0.236	S	C	.	.	H	α-helix	trans	-77.9	-47	176.5	-60.2	-177.9	166	0	0	111.1	G708 R732 S743 F744	G708-E746 PolarHBondContact N-O 3.29Å; R732-E746 PolarHBondContact NH2-O 3.36Å; S743-E746 WeakPolarHBondContact O-CB 2.94Å; S743-E746 PolarHBondContact O-N 2.91Å; F744-E746 PolarHBondContact O-N 3.07Å
747	K	84.9	Confident	83.9	Confident	87 Å²	87	45.5 Å²	45.5	38%	0.378	25%	0.253	S	S	.	.	H	α-helix	trans	-92.3	-25.8	-174.9	-59.5	179.5	-171.6	170.9	0	114.1	Y697 D699 S743 F744	Y697-K747 HydrophobicContact CE2-CB 4.15Å; D699-K747 IonicContact OD1-NZ 3.26Å; D699-K747 PolarHBondContact OD1-NZ 3.24Å; S743-K747 PolarHBondContact O-N 3.48Å; S743-K747 VanDerWaalsContact OG-CE 3.27Å; S743-K747 WeakPolarHBondContact OG-CE 3.42Å; S743-K747 PolarHBondContact OG-NZ 2.91Å; F744-K747 PolarHBondContact O-N 3.37Å
748	A	86.2	Confident	82.1	Confident	2 Å²	2	46 Å²	46	2%	0.017	27%	0.269	C	S	.	.			trans	-72.5	140	-172.8	0	0	0	0	0	113.3	L693 Y697 G708 F744 L750	L693-A748 HydrophobicContact CD2-CB 3.7Å; Y697-A748 HydrophobicContact CD2-CB 3.98Å; Y697-A748 HydrophobicContact CE2-CB 4.23Å; G708-A748 WeakPolarHBondContact CA-O 3.45Å; F744-A748 HydrophobicContact CD1-CB 4.24Å; F744-A748 HydrophobicContact CD2-CB 4.45Å; F744-A748 HydrophobicContact CE1-CB 4.13Å; F744-A748 HydrophobicContact CE2-CB 4.35Å; F744-A748 HydrophobicContact CG-CB 4.41Å; F744-A748 HydrophobicContact CZ-CB 4.2Å; F744-A748 WeakPolarHBondContact O-CA 3.39Å; F744-A748 WeakPolarHBondContact O-CB 3.35Å; F744-A748 PolarHBondContact O-N 3.38Å; A748-L750 HydrophobicContact CB-CD2 3.86Å; A748-L750 HydrophobicContact CB-CG 4.14Å
749	H	89.8	Confident	80.8	Confident	38 Å²	38	49.1 Å²	49.1	18%	0.176	29%	0.289	C	S	.	.			trans	-87.7	109.3	166.5	-61.5	-90.5	0	0	0	109.6	R694 Q695 T709	R694-H749 HydrophobicContact CB-CB 4.23Å; R694-H749 PolarHBondContact N-O 3.22Å; Q695-H749 VanDerWaalsContact CD-CD2 3.44Å; Q695-H749 HydrophobicContact CG-CB 4.31Å; Q695-H749 PolarHBondContact NE2-CD2 2.98Å; Q695-H749 PolarHBondContact NE2-NE2 3.43Å; T709-H749 PolarHBondContact N-ND1 3.4Å; T709-H749 CarbonylContact O-C 3.59Å; T709-H749 WeakPolarHBondContact O-CA 3.33Å; T709-H749 PolarHBondContact OG1-ND1 2.92Å
750	L	93.1	Very high	79.5	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	150.6	-169.4	-58.9	168	0	0	0	111.3	S692 L693 T709 L710 L711 F744 L745 A748 L774 L777	S692-L750 CarbonylContact O-C 3.56Å; S692-L750 WeakPolarHBondContact O-CA 3.33Å; L693-L750 HydrophobicContact CD2-CD2 4.27Å; T709-L750 PolarHBondContact O-N 2.96Å; L710-L750 HydrophobicContact CD1-CB 4.08Å; L711-L750 PolarHBondContact N-O 2.97Å; F744-L750 HydrophobicContact CE1-CD2 4.02Å; L745-L750 HydrophobicContact CD2-CD1 3.59Å; L745-L750 HydrophobicContact CD2-CD2 4.42Å; A748-L750 HydrophobicContact CB-CD2 3.86Å; A748-L750 HydrophobicContact CB-CG 4.14Å; L750-L774 HydrophobicContact CD1-CD2 4.01Å; L750-L777 HydrophobicContact CD2-CD2 3.84Å
751	H	94.3	Very high	79.1	Confident	45 Å²	45	49.3 Å²	49.3	21%	0.208	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	115.2	170.3	-171.9	178	0	0	0	108.8	S691 S692 R694 L711 T713	S691-H751 WeakPolarHBondContact CA-O 3.48Å; S692-H751 PolarHBondContact N-O 3.02Å; S692-H751 PolarHBondContact O-N 3.37Å; R694-H751 HydrophobicContact CG-CB 3.72Å; L711-H751 HydrophobicContact CB-CB 4.49Å; L711-H751 WeakPolarHBondContact O-CA 3.3Å; L711-H751 PolarHBondContact O-CD2 3.4Å; T713-H751 VanDerWaalsContact CG2-NE2 3.3Å; T713-H751 WeakPolarHBondContact CG2-NE2 3.43Å; T713-H751 PolarHBondContact OG1-NE2 2.96Å
752	V	93.8	Very high	78.8	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	120.8	170.6	-179.3	0	0	0	0	108.8	V689 E690 L710 L711 L712 T713 M716 I770 L774	V689-V752 HydrophobicContact CG1-CG1 3.75Å; E690-V752 CarbonylContact O-C 3.56Å; E690-V752 VanDerWaalsContact O-CA 3.29Å; E690-V752 WeakPolarHBondContact O-CA 3.48Å; L710-V752 HydrophobicContact CD1-CB 4.49Å; L710-V752 HydrophobicContact CD1-CG2 3.67Å; L711-V752 PolarHBondContact O-N 3.37Å; L712-V752 WeakPolarHBondContact CA-O 3.29Å; L712-V752 HydrophobicContact CD2-CB 3.85Å; L712-V752 HydrophobicContact CD2-CG2 4.42Å; T713-V752 PolarHBondContact N-O 3.32Å; T713-V752 VanDerWaalsContact N-O 3.08Å; M716-V752 HydrophobicContact CE-CG1 4.45Å; M716-V752 WeakPolarHBondContact CE-O 3.45Å; V752-I770 HydrophobicContact CG1-CG2 4.5Å; V752-L774 HydrophobicContact CG2-CD2 3.89Å
753	H	91.8	Very high	78.7	Confident	58 Å²	58	45.2 Å²	45.2	27%	0.269	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	139.5	176.6	-175.4	56.6	0	0	0	110.1	E690 T713	E690-H753 HydrophobicContact CB-CB 4.45Å; E690-H753 PolarHBondContact N-O 3.09Å; E690-H753 PolarHBondContact O-N 3.16Å; E690-H753 IonicContact OE2-CD2 3.95Å; T713-H753 PolarHBondContact O-ND1 2.9Å; T713-H753 PolarHBondContact OG1-ND1 3.48Å
754	V	86.6	Confident	78.8	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	28%	0.277	C	S	.	.			trans	-119.1	96.8	172.6	-168	0	0	0	0	108.2	L687 V689 T713 M716 M720 E756 K761	L687-V754 HydrophobicContact CB-CG1 4.17Å; L687-V754 HydrophobicContact CD1-CG1 3.67Å; L687-V754 HydrophobicContact CD2-CG1 4.03Å; L687-V754 HydrophobicContact CG-CG1 4.18Å; V689-V754 HydrophobicContact CG1-CG2 4.5Å; V689-V754 HydrophobicContact CG2-CG2 4.24Å; T713-V754 PolarHBondContact O-N 3.05Å; M716-V754 HydrophobicContact CE-CG2 4.17Å; M716-V754 HydrophobicContact SD-CG2 4.2Å; M720-V754 HydrophobicContact CE-CB 4.42Å; M720-V754 HydrophobicContact CE-CG1 4.33Å; M720-V754 HydrophobicContact CE-CG2 3.71Å; V754-E756 PolarHBondContact O-N 3.21Å; V754-K761 HydrophobicContact CB-CD 4.42Å; V754-K761 HydrophobicContact CG1-CD 3.89Å; V754-K761 PolarHBondContact O-NZ 2.94Å
755	P	75.3	Confident	78.8	Confident	24 Å²	24	46 Å²	46	16%	0.156	28%	0.279	C	S	.	.			trans	-61.6	129.1	-179.4	-12.1	25.6	0	0	0	110.5	L665 F688 E690 K761	L665-P755 HydrophobicContact CD2-CB 4.27Å; L665-P755 HydrophobicContact CD2-CG 4.12Å; F688-P755 WeakPolarHBondContact O-CD 3.48Å; E690-P755 VanDerWaalsContact CD-CG 3.5Å; E690-P755 HydrophobicContact CG-CG 4.17Å; E690-P755 WeakPolarHBondContact OE1-CG 3.46Å; P755-K761 PolarHBondContact O-NZ 2.89Å
756	E	63.9	Low	78.7	Confident	67 Å²	67	46.3 Å²	46.3	31%	0.313	28%	0.281	S	S	.	.			trans	163	114.6	149.4	-90.7	-171.6	150.6	0	0	107.5	R603 V754	R603-E756 IonicContact NH2-OE1 2.75Å; R603-E756 PolarHBondContact NH2-OE1 2.95Å; V754-E756 PolarHBondContact O-N 3.21Å
757	G	55.3	Low	79	Confident	69 Å²	69	41.6 Å²	41.6	71%	0.711	26%	0.26	S	S	*	.	S	Bend	trans	46.9	-164.3	155.3	0	0	0	0	0	119.8
758	A	48.5	Very low	79.5	Confident	91 Å²	91	37.5 Å²	37.5	75%	0.752	24%	0.242	S	C	*	.	S	Bend	trans	-91.9	7.6	179.5	0	0	0	0	0	113.3	P760	A758-P760 WeakPolarHBondContact O-CD 3.44Å
759	T	59.1	Low	79.9	Confident	80 Å²	80	37.4 Å²	37.4	49%	0.491	24%	0.241	S	C	.	.			trans	-78.8	120.1	-180	41.4	0	0	0	0	110.4	K761	T759-K761 PolarHBondContact O-N 3.04Å
760	P	57.8	Low	80.1	Confident	111 Å²	111	35.7 Å²	35.7	72%	0.721	23%	0.233	S	C	*	.			trans	-59.2	134.4	175.1	-19.9	31.4	0	0	0	110.6	A758	A758-P760 WeakPolarHBondContact O-CD 3.44Å
761	K	71.5	Confident	80.3	Confident	20 Å²	20	35.7 Å²	35.7	9%	0.087	23%	0.233	C	C	.	.	B	Isolated β-bridge	trans	-113.3	106.3	176.1	-63.3	173.1	-170.6	170.7	0	108.1	L687 N715 M716 G717 M720 V754 P755 T759	L687-K761 HydrophobicContact CD2-CD 4.39Å; N715-K761 PolarHBondContact O-N 3.46Å; N715-K761 VanDerWaalsContact O-N 3.12Å; M716-K761 WeakPolarHBondContact CA-O 3.19Å; G717-K761 PolarHBondContact N-O 3.37Å; M720-K761 HydrophobicContact SD-CB 3.78Å; V754-K761 HydrophobicContact CB-CD 4.42Å; V754-K761 HydrophobicContact CG1-CD 3.89Å; V754-K761 PolarHBondContact O-NZ 2.94Å; P755-K761 PolarHBondContact O-NZ 2.89Å; T759-K761 PolarHBondContact O-N 3.04Å
762	D	75.6	Confident	80.4	Confident	93 Å²	93	33.5 Å²	33.5	50%	0.497	22%	0.223	S	C	.	.			trans	-134.3	115.3	-179	-154.2	19.4	0	0	0	110	G717 D718 V719 M720	G717-D762 VanDerWaalsContact CA-OD1 3.3Å; G717-D762 WeakPolarHBondContact CA-OD1 3.37Å; D718-D762 PolarHBondContact N-OD1 3.39Å; V719-D762 WeakPolarHBondContact CA-OD1 3.37Å; V719-D762 WeakPolarHBondContact CB-OD1 3.43Å; V719-D762 PolarHBondContact N-OD1 2.89Å; M720-D762 PolarHBondContact N-OD1 2.81Å
763	G	81.5	Confident	80.5	Confident	19 Å²	19	33.5 Å²	33.5	20%	0.196	22%	0.223	C	C	.	.			trans	169.6	144.1	-178.7	0	0	0	0	0	112.6	S765	G763-S765 PolarHBondContact O-N 2.88Å
764	P	85.4	Confident	80.8	Confident	43 Å²	43	30.8 Å²	30.8	28%	0.279	21%	0.21	S	C	.	.	G	3₁₀ helix	trans	-76.3	-10.2	-175	32.4	-36	0	0	0	113.2	V719 S723 A766 G767 E792	V719-P764 HydrophobicContact CG1-CB 4.19Å; V719-P764 HydrophobicContact CG1-CG 4.4Å; S723-P764 PolarHBondContact OG-O 2.89Å; P764-A766 PolarHBondContact O-N 3.03Å; P764-G767 PolarHBondContact O-N 3.34Å; P764-G767 VanDerWaalsContact O-N 3.07Å; P764-E792 HydrophobicContact CB-CB 4.01Å; P764-E792 HydrophobicContact CB-CG 3.83Å; P764-E792 VanDerWaalsContact CB-OE2 3.3Å; P764-E792 WeakPolarHBondContact CB-OE2 3.29Å; P764-E792 HydrophobicContact CG-CB 4.49Å; P764-E792 VanDerWaalsContact CG-OE2 3.29Å; P764-E792 WeakPolarHBondContact CG-OE2 3.46Å; P764-E792 WeakPolarHBondContact O-CA 3.42Å
765	S	86.6	Confident	81.1	Confident	19 Å²	19	30.8 Å²	30.8	13%	0.133	21%	0.21	C	C	.	.	G	3₁₀ helix	trans	-66.9	-7.2	-172.3	67.8	0	0	0	0	115.9	G763 T790 G791	G763-S765 PolarHBondContact O-N 2.88Å; S765-T790 PolarHBondContact O-OG1 3.08Å; S765-G791 CarbonylContact C-O 3.55Å; S765-G791 PolarHBondContact O-N 3.47Å
766	A	86.8	Confident	82.1	Confident	8 Å²	8	29.6 Å²	29.6	7%	0.066	20%	0.203	C	C	.	.	G	3₁₀ helix	trans	-88.6	-5.1	176	0	0	0	0	0	113.1	M720 P764 C768 T769 I770	M720-A766 HydrophobicContact CE-CB 3.64Å; P764-A766 PolarHBondContact O-N 3.03Å; A766-C768 PolarHBondContact O-N 3.3Å; A766-T769 WeakPolarHBondContact O-CB 3.42Å; A766-T769 PolarHBondContact O-N 3.36Å; A766-T769 VanDerWaalsContact O-N 3.11Å; A766-I770 HydrophobicContact CB-CD1 4.09Å; A766-I770 HydrophobicContact CB-CG1 4.44Å; A766-I770 WeakPolarHBondContact O-CG1 3.41Å; A766-I770 PolarHBondContact O-N 3.04Å
767	G	91.3	Very high	83.6	Confident	0 Å²	0	27.6 Å²	27.6	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-51.3	-55	-174.3	0	0	0	0	0	112.8	S723 P764 T769 I770 V771 G791	S723-G767 WeakPolarHBondContact OG-CA 3.19Å; S723-G767 PolarHBondContact OG-N 3.4Å; P764-G767 PolarHBondContact O-N 3.34Å; P764-G767 VanDerWaalsContact O-N 3.07Å; G767-T769 VanDerWaalsContact C-N 3.34Å; G767-T769 PolarHBondContact O-N 3.16Å; G767-I770 PolarHBondContact O-N 3.2Å; G767-V771 WeakPolarHBondContact O-CG2 3.47Å; G767-V771 PolarHBondContact O-N 3.05Å; G767-G791 PolarHBondContact N-O 3.14Å
768	C	94.5	Very high	85.3	Confident	0 Å²	0	24.8 Å²	24.8	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-63	-39.1	179.4	70.6	0	0	0	0	112.8	A766 I770 V771 T772 G791 I799 L852	A766-C768 PolarHBondContact O-N 3.3Å; C768-I770 VanDerWaalsContact C-N 3.32Å; C768-I770 PolarHBondContact O-N 3.23Å; C768-V771 PolarHBondContact O-N 3.24Å; C768-T772 PolarHBondContact O-N 3.18Å; C768-T772 PolarHBondContact O-OG1 3.42Å; C768-G791 PolarHBondContact N-O 3.17Å; C768-G791 PolarHBondContact SG-N 3.28Å; C768-G791 VanDerWaalsContact SG-N 3.4Å; C768-I799 HydrophobicContact CB-CD1 3.95Å; C768-L852 HydrophobicContact CB-CD1 3.71Å
769	T	94.8	Very high	87.3	Confident	1 Å²	1	21.8 Å²	21.8	1%	0.006	14%	0.135	C	C	.	.	H	α-helix	trans	-61.7	-41.2	177.3	-43.3	0	0	0	0	111.5	V674 V689 A766 G767 T772 S773 M789	V674-T769 HydrophobicContact CB-CG2 4.05Å; V674-T769 HydrophobicContact CG1-CG2 3.88Å; V689-T769 HydrophobicContact CB-CG2 4.02Å; V689-T769 HydrophobicContact CG2-CG2 3.6Å; A766-T769 WeakPolarHBondContact O-CB 3.42Å; A766-T769 PolarHBondContact O-N 3.36Å; A766-T769 VanDerWaalsContact O-N 3.11Å; G767-T769 VanDerWaalsContact C-N 3.34Å; G767-T769 PolarHBondContact O-N 3.16Å; T769-T772 PolarHBondContact O-N 2.95Å; T769-S773 WeakPolarHBondContact O-CB 3.49Å; T769-S773 PolarHBondContact O-N 2.84Å; T769-M789 HydrophobicContact CG2-CG 4.24Å; T769-M789 PolarHBondContact OG1-O 3.17Å
770	I	95.4	Very high	88.8	Confident	1 Å²	1	25.1 Å²	25.1	1%	0.005	15%	0.145	C	C	.	.	H	α-helix	trans	-66.6	-46.7	178.3	-64.2	164.3	0	0	0	110	V689 A724 A727 V752 A766 G767 C768 T772 S773 L774	V689-I770 HydrophobicContact CG1-CG1 3.94Å; V689-I770 HydrophobicContact CG2-CG1 4.47Å; A724-I770 HydrophobicContact CB-CD1 3.88Å; A727-I770 HydrophobicContact CB-CB 3.81Å; A727-I770 HydrophobicContact CB-CG2 3.63Å; V752-I770 HydrophobicContact CG1-CG2 4.5Å; A766-I770 HydrophobicContact CB-CD1 4.09Å; A766-I770 HydrophobicContact CB-CG1 4.44Å; A766-I770 WeakPolarHBondContact O-CG1 3.41Å; A766-I770 PolarHBondContact O-N 3.04Å; G767-I770 PolarHBondContact O-N 3.2Å; C768-I770 VanDerWaalsContact C-N 3.32Å; C768-I770 PolarHBondContact O-N 3.23Å; I770-T772 VanDerWaalsContact C-N 3.3Å; I770-T772 PolarHBondContact O-N 3.24Å; I770-S773 PolarHBondContact O-N 2.78Å; I770-S773 VanDerWaalsContact O-N 3.15Å; I770-S773 PolarHBondContact O-OG 3.09Å; I770-L774 HydrophobicContact CG2-CD1 3.98Å; I770-L774 HydrophobicContact CG2-CG 4.35Å; I770-L774 WeakPolarHBondContact O-CG 3.46Å; I770-L774 PolarHBondContact O-N 2.85Å
771	V	96.8	Very high	90.4	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-54.8	-48.9	175.5	-178.5	0	0	0	0	110.3	A727 Y730 A731 G767 C768 S773 L774 I775 V793 Y849	A727-V771 HydrophobicContact CB-CG2 3.53Å; Y730-V771 HydrophobicContact CD1-CG1 3.85Å; Y730-V771 HydrophobicContact CD1-CG2 4.08Å; Y730-V771 HydrophobicContact CE1-CG1 4.21Å; A731-V771 HydrophobicContact CB-CG1 4.05Å; G767-V771 WeakPolarHBondContact O-CG2 3.47Å; G767-V771 PolarHBondContact O-N 3.05Å; C768-V771 PolarHBondContact O-N 3.24Å; V771-S773 VanDerWaalsContact C-N 3.33Å; V771-S773 PolarHBondContact O-N 3.25Å; V771-L774 PolarHBondContact O-N 3.23Å; V771-I775 HydrophobicContact CG1-CD1 3.71Å; V771-I775 HydrophobicContact CG1-CG1 4.41Å; V771-I775 WeakPolarHBondContact O-CG1 3.44Å; V771-I775 PolarHBondContact O-N 3.39Å; V771-V793 HydrophobicContact CG2-CB 4.43Å; V771-V793 HydrophobicContact CG2-CG1 3.87Å; V771-V793 HydrophobicContact CG2-CG2 4.25Å; V771-Y849 HydrophobicContact CB-CD2 4.15Å; V771-Y849 HydrophobicContact CB-CE2 3.54Å; V771-Y849 HydrophobicContact CG1-CD1 4.11Å; V771-Y849 HydrophobicContact CG1-CD2 3.93Å; V771-Y849 HydrophobicContact CG1-CE1 3.6Å; V771-Y849 HydrophobicContact CG1-CE2 3.39Å; V771-Y849 HydrophobicContact CG1-CG 4.27Å; V771-Y849 HydrophobicContact CG2-CE2 4.5Å
772	T	96.8	Very high	91.4	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-62.7	-39.2	179.7	-47.5	0	0	0	0	112.2	V674 C768 T769 I770 I775 S776 V783 M789 Y849 L852 F857	V674-T772 HydrophobicContact CG1-CG2 4.26Å; V674-T772 HydrophobicContact CG2-CG2 4.07Å; C768-T772 PolarHBondContact O-N 3.18Å; C768-T772 PolarHBondContact O-OG1 3.42Å; T769-T772 PolarHBondContact O-N 2.95Å; I770-T772 VanDerWaalsContact C-N 3.3Å; I770-T772 PolarHBondContact O-N 3.24Å; T772-I775 PolarHBondContact O-N 2.83Å; T772-S776 WeakPolarHBondContact O-CB 3.36Å; T772-S776 PolarHBondContact O-N 2.97Å; T772-V783 HydrophobicContact CG2-CG2 3.6Å; T772-M789 HydrophobicContact CG2-CE 4.06Å; T772-M789 HydrophobicContact CG2-SD 4.19Å; T772-M789 PolarHBondContact OG1-SD 3.42Å; T772-Y849 WeakPolarHBondContact CA-OH 3.2Å; T772-Y849 PolarHBondContact N-OH 3.31Å; T772-Y849 VanDerWaalsContact N-OH 3.17Å; T772-Y849 WeakPolarHBondContact OG1-CE2 3.43Å; T772-Y849 PolarHBondContact OG1-OH 3.41Å; T772-Y849 VanDerWaalsContact OG1-OH 3.08Å; T772-L852 WeakPolarHBondContact OG1-CD2 3.32Å; T772-F857 HydrophobicContact CG2-CE2 3.82Å; T772-F857 HydrophobicContact CG2-CZ 4Å
773	S	96	Very high	92.3	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-64.9	-40.7	177.1	77.2	0	0	0	0	112.4	G672 S691 T769 I770 V771 L777	G672-S773 WeakPolarHBondContact CA-O 3.47Å; S691-S773 PolarHBondContact OG-OG 2.85Å; T769-S773 WeakPolarHBondContact O-CB 3.49Å; T769-S773 PolarHBondContact O-N 2.84Å; I770-S773 PolarHBondContact O-N 2.78Å; I770-S773 VanDerWaalsContact O-N 3.15Å; I770-S773 PolarHBondContact O-OG 3.09Å; V771-S773 VanDerWaalsContact C-N 3.33Å; V771-S773 PolarHBondContact O-N 3.25Å; S773-L777 PolarHBondContact O-N 2.84Å
774	L	96.2	Very high	92.8	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-67.5	-44.1	178.3	-68	172.6	0	0	0	111.2	S691 H728 A731 L745 L750 V752 I770 V771 L777 A778	S691-L774 WeakPolarHBondContact OG-CD2 3.46Å; H728-L774 HydrophobicContact CB-CD1 4.03Å; A731-L774 HydrophobicContact CB-CB 4.15Å; A731-L774 HydrophobicContact CB-CD1 4.2Å; L745-L774 HydrophobicContact CD1-CB 4.27Å; L745-L774 HydrophobicContact CD2-CB 4.21Å; L750-L774 HydrophobicContact CD1-CD2 4.01Å; V752-L774 HydrophobicContact CG2-CD2 3.89Å; I770-L774 HydrophobicContact CG2-CD1 3.98Å; I770-L774 HydrophobicContact CG2-CG 4.35Å; I770-L774 WeakPolarHBondContact O-CG 3.46Å; I770-L774 PolarHBondContact O-N 2.85Å; V771-L774 PolarHBondContact O-N 3.23Å; L774-L777 PolarHBondContact O-N 3.19Å; L774-A778 WeakPolarHBondContact O-CB 3.43Å; L774-A778 PolarHBondContact O-N 2.98Å
775	I	94.9	Very high	93	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-67.9	-41.8	178	-68.5	176.1	0	0	0	111.1	A731 F734 L735 V771 T772 L777 A778 L779 Y849 F853 F857	A731-I775 HydrophobicContact CB-CD1 4.47Å; A731-I775 HydrophobicContact CB-CG1 4.12Å; F734-I775 HydrophobicContact CB-CD1 4.2Å; F734-I775 HydrophobicContact CD1-CD1 3.49Å; F734-I775 VanDerWaalsContact CD1-CD1 3.49Å; F734-I775 HydrophobicContact CE1-CD1 4.05Å; F734-I775 HydrophobicContact CG-CD1 3.94Å; L735-I775 HydrophobicContact CD2-CG2 4.37Å; V771-I775 HydrophobicContact CG1-CD1 3.71Å; V771-I775 HydrophobicContact CG1-CG1 4.41Å; V771-I775 WeakPolarHBondContact O-CG1 3.44Å; V771-I775 PolarHBondContact O-N 3.39Å; T772-I775 PolarHBondContact O-N 2.83Å; I775-L777 VanDerWaalsContact C-N 3.28Å; I775-L777 PolarHBondContact O-N 2.77Å; I775-A778 PolarHBondContact O-N 3.23Å; I775-A778 VanDerWaalsContact O-N 3.16Å; I775-L779 HydrophobicContact CG2-CD1 3.68Å; I775-L779 HydrophobicContact CG2-CG 4.1Å; I775-L779 WeakPolarHBondContact O-CB 3.4Å; I775-L779 WeakPolarHBondContact O-CG 3.47Å; I775-L779 PolarHBondContact O-N 2.79Å; I775-Y849 HydrophobicContact CD1-CE1 3.59Å; I775-F853 HydrophobicContact CG2-CD2 4.04Å; I775-F853 HydrophobicContact CG2-CE2 3.57Å; I775-F857 HydrophobicContact CG2-CE2 4.32Å
776	S	95.6	Very high	93.1	Very high	0 Å²	0	26 Å²	26	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-56	-43.4	174	177.1	0	0	0	0	111.7	P671 G672 T772 H780 L781	P671-S776 WeakPolarHBondContact CA-OG 3.39Å; G672-S776 PolarHBondContact N-OG 3.04Å; T772-S776 WeakPolarHBondContact O-CB 3.36Å; T772-S776 PolarHBondContact O-N 2.97Å; S776-H780 WeakPolarHBondContact O-CA 3.23Å; S776-H780 PolarHBondContact O-N 3.1Å; S776-H780 VanDerWaalsContact O-N 3.09Å; S776-L781 WeakPolarHBondContact CB-O 3.32Å; S776-L781 PolarHBondContact O-N 2.84Å; S776-L781 VanDerWaalsContact O-N 3.09Å; S776-L781 PolarHBondContact OG-O 3.25Å
777	L	94.2	Very high	93.5	Very high	24 Å²	24	26 Å²	26	13%	0.126	13%	0.13	C	C	.	.	H	α-helix	trans	-65.3	-46	175.8	-177.8	67.1	0	0	0	111.5	F744 L750 S773 L774 I775 L779 H780	F744-L777 HydrophobicContact CE1-CD2 4.1Å; F744-L777 HydrophobicContact CE1-CG 4.02Å; F744-L777 HydrophobicContact CZ-CD2 4.3Å; F744-L777 HydrophobicContact CZ-CG 4.14Å; L750-L777 HydrophobicContact CD2-CD2 3.84Å; S773-L777 PolarHBondContact O-N 2.84Å; L774-L777 PolarHBondContact O-N 3.19Å; I775-L777 VanDerWaalsContact C-N 3.28Å; I775-L777 PolarHBondContact O-N 2.77Å; L777-L779 PolarHBondContact O-N 3.49Å; L777-H780 PolarHBondContact O-N 2.95Å; L777-H780 VanDerWaalsContact O-N 3.13Å
778	A	91.6	Very high	93.6	Very high	11 Å²	11	26 Å²	26	9%	0.091	13%	0.13	C	C	.	.	H	α-helix	trans	-67.8	-32.6	-176.7	0	0	0	0	0	114	L735 N742 F744 L745 L774 I775 H780	L735-A778 HydrophobicContact CD1-CB 3.47Å; L735-A778 VanDerWaalsContact CD1-CB 3.47Å; N742-A778 PolarHBondContact ND2-O 2.75Å; F744-A778 HydrophobicContact CB-CB 4.35Å; F744-A778 HydrophobicContact CD1-CB 3.56Å; F744-A778 HydrophobicContact CE1-CB 4.19Å; F744-A778 HydrophobicContact CG-CB 4.25Å; L745-A778 HydrophobicContact CD1-CB 4.43Å; L745-A778 HydrophobicContact CD2-CB 4.13Å; L745-A778 HydrophobicContact CG-CB 3.95Å; L774-A778 WeakPolarHBondContact O-CB 3.43Å; L774-A778 PolarHBondContact O-N 2.98Å; I775-A778 PolarHBondContact O-N 3.23Å; I775-A778 VanDerWaalsContact O-N 3.16Å; A778-H780 VanDerWaalsContact C-N 3.33Å
779	L	91	Very high	93.6	Very high	27 Å²	27	26 Å²	26	14%	0.141	13%	0.13	C	C	.	.	H	α-helix	trans	-85.7	-9.7	173.9	-61.8	179.2	0	0	0	112.5	L735 V739 I775 L777 L781 F853 F860	L735-L779 HydrophobicContact CD2-CD2 4.06Å; L735-L779 HydrophobicContact CD2-CG 4.42Å; V739-L779 HydrophobicContact CG2-CD2 4.23Å; I775-L779 HydrophobicContact CG2-CD1 3.68Å; I775-L779 HydrophobicContact CG2-CG 4.1Å; I775-L779 WeakPolarHBondContact O-CB 3.4Å; I775-L779 WeakPolarHBondContact O-CG 3.47Å; I775-L779 PolarHBondContact O-N 2.79Å; L777-L779 PolarHBondContact O-N 3.49Å; L779-L781 HydrophobicContact CB-CB 4.19Å; L779-L781 HydrophobicContact CB-CD1 4.04Å; L779-L781 HydrophobicContact CB-CG 4.2Å; L779-L781 PolarHBondContact O-N 3.06Å; L779-F853 HydrophobicContact CD1-CE2 3.83Å; L779-F853 HydrophobicContact CD1-CZ 3.86Å; L779-F860 HydrophobicContact CD1-CD2 4.45Å; L779-F860 HydrophobicContact CD1-CE2 4.33Å; L779-F860 HydrophobicContact CD1-CZ 4.37Å; L779-F860 HydrophobicContact CD2-CE2 4.17Å; L779-F860 HydrophobicContact CD2-CZ 4.04Å
780	H	90.4	Very high	93.6	Very high	150 Å²	150	26 Å²	26	69%	0.694	13%	0.13	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.9	35.1	-169.8	-160.2	56.6	0	0	0	113.1	S776 L777 A778	S776-H780 WeakPolarHBondContact O-CA 3.23Å; S776-H780 PolarHBondContact O-N 3.1Å; S776-H780 VanDerWaalsContact O-N 3.09Å; L777-H780 PolarHBondContact O-N 2.95Å; L777-H780 VanDerWaalsContact O-N 3.13Å; A778-H780 VanDerWaalsContact C-N 3.33Å
781	L	92.1	Very high	93.5	Very high	65 Å²	65	25.9 Å²	25.9	34%	0.34	13%	0.13	S	C	.	.			trans	-117.2	129.2	-178.3	-74.3	171	0	0	0	110	S776 L779 F857 F860	S776-L781 WeakPolarHBondContact CB-O 3.32Å; S776-L781 PolarHBondContact O-N 2.84Å; S776-L781 VanDerWaalsContact O-N 3.09Å; S776-L781 PolarHBondContact OG-O 3.25Å; L779-L781 HydrophobicContact CB-CB 4.19Å; L779-L781 HydrophobicContact CB-CD1 4.04Å; L779-L781 HydrophobicContact CB-CG 4.2Å; L779-L781 PolarHBondContact O-N 3.06Å; L781-F857 HydrophobicContact CB-CD1 4.3Å; L781-F857 HydrophobicContact CB-CE1 4.35Å; L781-F860 HydrophobicContact CD1-CB 4.48Å; L781-F860 HydrophobicContact CD1-CD2 3.54Å; L781-F860 HydrophobicContact CD1-CE2 4.19Å; L781-F860 HydrophobicContact CD1-CG 4.36Å
782	P	92.5	Very high	93.4	Very high	60 Å²	60	28.9 Å²	28.9	39%	0.39	14%	0.144	S	C	.	.			trans	-69.2	147.6	172.7	30.9	-32.8	0	0	0	110	T669 P671	T669-P782 WeakPolarHBondContact O-CB 3.4Å; P671-P782 HydrophobicContact CG-CB 4.42Å
783	V	92.9	Very high	93.3	Very high	5 Å²	5	29 Å²	29	3%	0.03	15%	0.145	C	C	.	.			trans	-70	156.4	171.8	173.4	0	0	0	0	109.9	V674 T772 Q785 I787 F857	V674-V783 HydrophobicContact CG2-CG2 3.71Å; T772-V783 HydrophobicContact CG2-CG2 3.6Å; V783-Q785 PolarHBondContact O-N 3.37Å; V783-Q785 PolarHBondContact O-NE2 3.39Å; V783-Q785 VanDerWaalsContact O-NE2 3.08Å; V783-I787 HydrophobicContact CG1-CG2 3.49Å; V783-I787 VanDerWaalsContact CG1-CG2 3.49Å; V783-F857 HydrophobicContact CG2-CE1 3.7Å; V783-F857 HydrophobicContact CG2-CE2 4.28Å; V783-F857 HydrophobicContact CG2-CZ 3.53Å
784	R	92.7	Very high	93.2	Very high	74 Å²	74	30.3 Å²	30.3	28%	0.279	15%	0.154	S	C	.	.			trans	-41	125.9	167.1	175.4	175.1	171.2	-177.2	-0.5	110.3	I787 E842 S856	R784-I787 HydrophobicContact CB-CG2 4.48Å; R784-I787 WeakPolarHBondContact O-CG2 3.5Å; R784-E842 IonicContact CZ-OE1 2.69Å; R784-E842 IonicContact CZ-OE2 3.93Å; R784-E842 IonicContact NH1-OE1 3.62Å; R784-E842 PolarHBondContact NH1-OE1 2.84Å; R784-E842 IonicContact NH1-OE2 2.67Å; R784-E842 IonicContact NH2-OE1 2.68Å; R784-E842 IonicContact NH2-OE2 3.01Å; R784-E842 PolarHBondContact NH2-OE2 2.93Å; R784-S856 PolarHBondContact N-O 3.15Å
785	Q	90.7	Very high	93	Very high	61 Å²	61	35 Å²	35	29%	0.285	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.7	154.6	-179.1	-59.3	-57.5	-45.6	0	0	111.1	T669 V783 I787	T669-Q785 PolarHBondContact O-NE2 3.47Å; T669-Q785 VanDerWaalsContact O-NE2 3.14Å; T669-Q785 VanDerWaalsContact OG1-CD 3.31Å; T669-Q785 PolarHBondContact OG1-NE2 3.46Å; T669-Q785 PolarHBondContact OG1-OE1 3.35Å; V783-Q785 PolarHBondContact O-N 3.37Å; V783-Q785 PolarHBondContact O-NE2 3.39Å; V783-Q785 VanDerWaalsContact O-NE2 3.08Å; Q785-I787 PolarHBondContact O-N 2.98Å
786	N	88.7	Confident	92.9	Very high	59 Å²	59	40 Å²	40	32%	0.316	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.6	19.8	-178.1	-63	-24.6	0	0	0	116.1	R664 V817 D818 C819	R664-N786 PolarHBondContact NH1-OD1 3.39Å; R664-N786 PolarHBondContact NH2-OD1 3.22Å; N786-V817 WeakPolarHBondContact O-CG1 3.32Å; N786-D818 VanDerWaalsContact CB-CG 3.44Å; N786-D818 WeakPolarHBondContact CB-OD1 3.48Å; N786-D818 VanDerWaalsContact CB-OD2 3.26Å; N786-D818 WeakPolarHBondContact CB-OD2 2.98Å; N786-D818 PolarHBondContact ND2-OD2 3.23Å; N786-D818 VanDerWaalsContact ND2-OD2 3.16Å; N786-D818 PolarHBondContact O-N 3.31Å; N786-D818 VanDerWaalsContact O-OD1 3.05Å; N786-C819 PolarHBondContact O-N 3Å
787	I	93.4	Very high	92.6	Very high	7 Å²	7	40.1 Å²	40.1	4%	0.036	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	145.9	172.4	-157	168.3	0	0	0	111.5	V783 R784 Q785 M789 C819 L821 I855	V783-I787 HydrophobicContact CG1-CG2 3.49Å; V783-I787 VanDerWaalsContact CG1-CG2 3.49Å; R784-I787 HydrophobicContact CB-CG2 4.48Å; R784-I787 WeakPolarHBondContact O-CG2 3.5Å; Q785-I787 PolarHBondContact O-N 2.98Å; I787-M789 HydrophobicContact CG2-CE 4.34Å; I787-C819 CarbonylContact C-O 3.55Å; I787-C819 VanDerWaalsContact CA-O 3.27Å; I787-C819 WeakPolarHBondContact CA-O 2.93Å; I787-C819 HydrophobicContact CB-CB 4.39Å; I787-C819 HydrophobicContact CG1-CB 3.97Å; I787-L821 HydrophobicContact CD1-CD1 3.68Å; I787-L821 HydrophobicContact CD1-CD2 3.99Å; I787-L821 HydrophobicContact CD1-CG 3.82Å; I787-L821 HydrophobicContact CG1-CD1 4.34Å; I787-L821 HydrophobicContact CG1-CG 4.1Å; I787-I855 HydrophobicContact CD1-CG2 4.12Å
788	A	93.5	Very high	92.7	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	150.6	166.9	0	0	0	0	0	111.2	M675 L677 V817 C819 I820 L821	M675-A788 HydrophobicContact CB-CB 4.37Å; M675-A788 HydrophobicContact CG-CB 4.05Å; M675-A788 WeakPolarHBondContact O-CA 3.08Å; M675-A788 HydrophobicContact SD-CB 3.97Å; L677-A788 HydrophobicContact CD1-CB 4.27Å; L677-A788 HydrophobicContact CD2-CB 3.68Å; L677-A788 HydrophobicContact CG-CB 3.84Å; A788-V817 HydrophobicContact CB-CG1 3.76Å; A788-V817 HydrophobicContact CB-CG2 4.04Å; A788-C819 PolarHBondContact N-O 2.76Å; A788-I820 CarbonylContact O-C 3.55Å; A788-I820 VanDerWaalsContact O-CA 3.27Å; A788-I820 WeakPolarHBondContact O-CA 3.5Å; A788-L821 PolarHBondContact O-N 2.93Å
789	M	96	Very high	92.9	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	154.4	-175	62.4	-167	68.6	0	0	113.1	V674 M675 G676 L677 T769 T772 I787 L821 L852	V674-M789 HydrophobicContact CG1-CE 3.56Å; V674-M789 HydrophobicContact CG1-CG 4.43Å; V674-M789 HydrophobicContact CG1-SD 3.83Å; M675-M789 PolarHBondContact O-N 3.31Å; G676-M789 CarbonylContact C-O 3.54Å; G676-M789 VanDerWaalsContact CA-O 3.29Å; G676-M789 WeakPolarHBondContact CA-O 3.49Å; L677-M789 PolarHBondContact N-O 3.17Å; T769-M789 HydrophobicContact CG2-CG 4.24Å; T769-M789 PolarHBondContact OG1-O 3.17Å; T772-M789 HydrophobicContact CG2-CE 4.06Å; T772-M789 HydrophobicContact CG2-SD 4.19Å; T772-M789 PolarHBondContact OG1-SD 3.42Å; I787-M789 HydrophobicContact CG2-CE 4.34Å; M789-L821 HydrophobicContact CB-CB 3.83Å; M789-L821 HydrophobicContact CB-CD1 4.26Å; M789-L821 HydrophobicContact CB-CG 4.31Å; M789-L821 HydrophobicContact CE-CD1 4.08Å; M789-L852 HydrophobicContact CE-CD2 4.25Å; M789-L852 HydrophobicContact SD-CD2 3.88Å
790	T	93.9	Very high	93.1	Very high	1 Å²	1	46.1 Å²	46.1	1%	0.006	24%	0.235	C	C	.	.			trans	-148.4	148.6	171.2	-164.6	0	0	0	0	109.5	L677 S765 V802 K808 L821 L822 P823	L677-T790 PolarHBondContact O-OG1 3.23Å; L677-T790 VanDerWaalsContact O-OG1 3.11Å; S765-T790 PolarHBondContact O-OG1 3.08Å; T790-V802 HydrophobicContact CG2-CG2 3.75Å; T790-K808 HydrophobicContact CG2-CD 4.03Å; T790-K808 PolarHBondContact OG1-NZ 2.84Å; T790-L821 PolarHBondContact N-O 3.38Å; T790-L821 VanDerWaalsContact N-O 3.16Å; T790-L822 HydrophobicContact CG2-CD2 3.64Å; T790-P823 WeakPolarHBondContact O-CD 3.34Å
791	G	93.8	Very high	93.3	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	22%	0.217	C	C	.	.			trans	157.2	136.5	-178.2	0	0	0	0	0	110.8	S765 G767 C768	S765-G791 CarbonylContact C-O 3.55Å; S765-G791 PolarHBondContact O-N 3.47Å; G767-G791 PolarHBondContact N-O 3.14Å; C768-G791 PolarHBondContact N-O 3.17Å; C768-G791 PolarHBondContact SG-N 3.28Å; C768-G791 VanDerWaalsContact SG-N 3.4Å
792	E	94.2	Very high	93.2	Very high	63 Å²	63	38.9 Å²	38.9	29%	0.294	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	138.5	167.2	171.8	176.8	168.6	0	0	108.7	P764 I799 L800 V802	P764-E792 HydrophobicContact CB-CB 4.01Å; P764-E792 HydrophobicContact CB-CG 3.83Å; P764-E792 VanDerWaalsContact CB-OE2 3.3Å; P764-E792 WeakPolarHBondContact CB-OE2 3.29Å; P764-E792 HydrophobicContact CG-CB 4.49Å; P764-E792 VanDerWaalsContact CG-OE2 3.29Å; P764-E792 WeakPolarHBondContact CG-OE2 3.46Å; P764-E792 WeakPolarHBondContact O-CA 3.42Å; E792-I799 CarbonylContact O-C 3.45Å; E792-I799 WeakPolarHBondContact O-CA 3.34Å; E792-L800 HydrophobicContact CB-CB 4.07Å; E792-L800 HydrophobicContact CG-CB 4.32Å; E792-L800 HydrophobicContact CG-CD1 4.19Å; E792-L800 PolarHBondContact N-O 3.44Å; E792-L800 PolarHBondContact O-N 3.25Å; E792-V802 HydrophobicContact CB-CG1 4.43Å
793	V	95.2	Very high	92.9	Very high	2 Å²	2	38.7 Å²	38.7	1%	0.012	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	133	179.2	70.2	0	0	0	0	109.6	I726 A727 Y730 V771 K798 I799	I726-V793 HydrophobicContact CG2-CG1 4.3Å; I726-V793 WeakPolarHBondContact CG2-O 3.35Å; A727-V793 HydrophobicContact CB-CG1 4.24Å; Y730-V793 HydrophobicContact CD1-CG2 4.05Å; Y730-V793 HydrophobicContact CE1-CG2 4.48Å; Y730-V793 HydrophobicContact CG-CG2 4.46Å; V771-V793 HydrophobicContact CG2-CB 4.43Å; V771-V793 HydrophobicContact CG2-CG1 3.87Å; V771-V793 HydrophobicContact CG2-CG2 4.25Å; V793-K798 WeakPolarHBondContact CA-O 3.47Å; V793-I799 HydrophobicContact CB-CD1 4.39Å; V793-I799 HydrophobicContact CG2-CD1 4.14Å
794	S	94.6	Very high	92.4	Very high	27 Å²	27	39.5 Å²	39.5	19%	0.189	22%	0.223	C	C	.	.			trans	-84.5	163.4	171	79.8	0	0	0	0	111.5	T796 G797 K798	S794-T796 PolarHBondContact O-N 3.08Å; S794-T796 PolarHBondContact OG-N 3.19Å; S794-T796 PolarHBondContact OG-OG1 3.32Å; S794-G797 PolarHBondContact O-N 2.97Å; S794-G797 PolarHBondContact OG-N 3.28Å; S794-K798 PolarHBondContact N-O 2.91Å; S794-K798 PolarHBondContact OG-N 2.89Å
795	L	91.8	Very high	92.2	Very high	98 Å²	98	36.3 Å²	36.3	51%	0.513	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-19	171.4	-73.5	170.6	0	0	0	113.6	I726 T729	I726-L795 HydrophobicContact CG2-CD2 3.99Å; I726-L795 HydrophobicContact CG2-CG 4.12Å; T729-L795 HydrophobicContact CG2-CD2 3.85Å
796	T	91.1	Very high	91.8	Very high	107 Å²	107	36 Å²	36	66%	0.656	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	-98	5.2	177.5	67.6	0	0	0	0	112.9	S794	S794-T796 PolarHBondContact O-N 3.08Å; S794-T796 PolarHBondContact OG-N 3.19Å; S794-T796 PolarHBondContact OG-OG1 3.32Å
797	G	91.1	Very high	91.4	Very high	1 Å²	1	34.6 Å²	34.6	1%	0.01	20%	0.2	C	C	.	.			trans	81	14.9	178.8	0	0	0	0	0	116.1	Y730 S794 K848 Y849	Y730-G797 VanDerWaalsContact CE2-N 3.28Å; Y730-G797 WeakPolarHBondContact OH-CA 3.31Å; S794-G797 PolarHBondContact O-N 2.97Å; S794-G797 PolarHBondContact OG-N 3.28Å; G797-K848 WeakPolarHBondContact O-CA 3.48Å; G797-Y849 PolarHBondContact O-N 3.24Å
798	K	95.9	Very high	91.1	Very high	120 Å²	120	34.4 Å²	34.4	52%	0.522	20%	0.199	S	C	.	.	B	Isolated β-bridge	trans	-75.6	142	170.6	-70.7	-168.1	173.8	-169.4	0	109.9	V793 S794	V793-K798 WeakPolarHBondContact CA-O 3.47Å; S794-K798 PolarHBondContact N-O 2.91Å; S794-K798 PolarHBondContact OG-N 2.89Å
799	I	96.4	Very high	90.8	Very high	11 Å²	11	34.4 Å²	34.4	6%	0.056	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	111.9	173	-54.5	-53.6	0	0	0	108.5	C768 E792 V793 P823 I846 E847 Y849 L852	C768-I799 HydrophobicContact CB-CD1 3.95Å; E792-I799 CarbonylContact O-C 3.45Å; E792-I799 WeakPolarHBondContact O-CA 3.34Å; V793-I799 HydrophobicContact CB-CD1 4.39Å; V793-I799 HydrophobicContact CG2-CD1 4.14Å; I799-P823 HydrophobicContact CG2-CB 3.92Å; I799-P823 HydrophobicContact CG2-CG 3.85Å; I799-I846 HydrophobicContact CB-CG2 4.31Å; I799-I846 HydrophobicContact CG1-CG2 3.73Å; I799-E847 PolarHBondContact N-O 2.95Å; I799-Y849 HydrophobicContact CD1-CD2 4.22Å; I799-L852 HydrophobicContact CD1-CD1 4.49Å
800	L	95.2	Very high	90.1	Very high	57 Å²	57	35.3 Å²	35.3	30%	0.298	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	151.4	-176.8	-61.2	178	0	0	0	111.1	E792 P823	E792-L800 HydrophobicContact CB-CB 4.07Å; E792-L800 HydrophobicContact CG-CB 4.32Å; E792-L800 HydrophobicContact CG-CD1 4.19Å; E792-L800 PolarHBondContact N-O 3.44Å; E792-L800 PolarHBondContact O-N 3.25Å; L800-P823 WeakPolarHBondContact O-CG 3.46Å
801	P	93.6	Very high	89.5	Confident	50 Å²	50	35.4 Å²	35.4	33%	0.325	21%	0.205	S	C	.	.			trans	-62.5	153.3	-179.1	27.9	-37.7	0	0	0	112.6	E825 N826	P801-E825 HydrophobicContact CB-CB 3.92Å; P801-E825 WeakPolarHBondContact CD-OE2 3.49Å; P801-E825 HydrophobicContact CG-CB 4.14Å; P801-E825 VanDerWaalsContact CG-OE2 3.31Å; P801-E825 WeakPolarHBondContact CG-OE2 3.13Å; P801-N826 VanDerWaalsContact CA-OD1 3.25Å; P801-N826 WeakPolarHBondContact CA-OD1 3.45Å
802	V	90.7	Very high	89.1	Confident	14 Å²	14	35.4 Å²	35.4	9%	0.085	21%	0.205	C	C	.	.			trans	-133.1	152.3	179.1	-62.7	0	0	0	0	110.7	T790 E792 I805 P823 N826	T790-V802 HydrophobicContact CG2-CG2 3.75Å; E792-V802 HydrophobicContact CB-CG1 4.43Å; V802-I805 HydrophobicContact CG2-CD1 3.91Å; V802-P823 HydrophobicContact CG2-CG 4.28Å; V802-N826 PolarHBondContact N-OD1 2.81Å; V802-N826 PolarHBondContact O-ND2 2.94Å; V802-N826 PolarHBondContact O-OD1 2.98Å
803	G	85.4	Confident	88.5	Confident	56 Å²	56	35.8 Å²	35.8	58%	0.577	20%	0.204	S	C	*	.	S	Bend	trans	-77.4	170.1	175.4	0	0	0	0	0	114	K808	G803-K808 WeakPolarHBondContact O-CE 3.27Å; G803-K808 PolarHBondContact O-NZ 3.39Å
804	G	82.5	Confident	87.6	Confident	21 Å²	21	40.2 Å²	40.2	22%	0.216	22%	0.22	C	C	.	.			trans	69.8	34.2	171.7	0	0	0	0	0	114.4	K806 E807 K808	G804-K806 PolarHBondContact O-N 2.76Å; G804-E807 WeakPolarHBondContact CA-OE2 3.38Å; G804-E807 PolarHBondContact O-N 2.81Å; G804-K808 WeakPolarHBondContact O-CB 3.05Å; G804-K808 VanDerWaalsContact O-CG 3.22Å; G804-K808 WeakPolarHBondContact O-CG 3.19Å; G804-K808 PolarHBondContact O-N 3.33Å
805	I	88.2	Confident	86.8	Confident	7 Å²	7	39.2 Å²	39.2	4%	0.036	21%	0.214	C	C	.	.	H	α-helix	trans	-60.7	-44.2	-176.7	-62.7	-63.2	0	0	0	111.1	V802 E807 K808 V809 L822 N826 D829 F830 L833	V802-I805 HydrophobicContact CG2-CD1 3.91Å; I805-E807 PolarHBondContact O-N 2.82Å; I805-K808 PolarHBondContact O-N 2.85Å; I805-V809 HydrophobicContact CG2-CG2 4.06Å; I805-V809 WeakPolarHBondContact O-CG2 3.41Å; I805-V809 PolarHBondContact O-N 3.42Å; I805-L822 HydrophobicContact CD1-CD2 4.31Å; I805-L822 HydrophobicContact CG2-CD1 4.18Å; I805-N826 HydrophobicContact CD1-CB 3.86Å; I805-N826 HydrophobicContact CG1-CB 3.97Å; I805-D829 HydrophobicContact CB-CB 3.99Å; I805-D829 HydrophobicContact CG1-CB 3.98Å; I805-D829 HydrophobicContact CG2-CB 4.26Å; I805-F830 HydrophobicContact CG2-CB 4.38Å; I805-L833 HydrophobicContact CG2-CD1 4.43Å
806	K	82.6	Confident	86.2	Confident	55 Å²	55	40 Å²	40	24%	0.239	22%	0.219	C	C	.	.	H	α-helix	trans	-51.6	-54.9	175.8	-178.3	173.8	-175	-178.8	0	111.4	S557 G804 K808 V809 I810 L833	S557-K806 PolarHBondContact OG-NZ 3.16Å; G804-K806 PolarHBondContact O-N 2.76Å; K806-K808 PolarHBondContact O-N 2.89Å; K806-V809 PolarHBondContact O-N 3.41Å; K806-I810 HydrophobicContact CG-CD1 3.94Å; K806-I810 WeakPolarHBondContact O-CD1 3.49Å; K806-I810 WeakPolarHBondContact O-CG1 3.35Å; K806-I810 PolarHBondContact O-N 3.16Å; K806-L833 HydrophobicContact CB-CD2 3.54Å; K806-L833 HydrophobicContact CD-CD2 4.31Å; K806-L833 HydrophobicContact CG-CD2 3.72Å
807	E	79.4	Confident	86	Confident	29 Å²	29	35.2 Å²	35.2	14%	0.136	19%	0.189	C	C	.	.	H	α-helix	trans	-64.7	-40.7	-177.9	-69.1	68.1	-143.1	0	0	112	G684 G804 I805 I810 A811	G684-E807 WeakPolarHBondContact CA-O 3.07Å; G804-E807 WeakPolarHBondContact CA-OE2 3.38Å; G804-E807 PolarHBondContact O-N 2.81Å; I805-E807 PolarHBondContact O-N 2.82Å; E807-I810 PolarHBondContact O-N 2.97Å; E807-A811 WeakPolarHBondContact O-CB 3.33Å; E807-A811 PolarHBondContact O-N 3Å
808	K	87.3	Confident	85.8	Confident	3 Å²	3	38.1 Å²	38.1	1%	0.013	20%	0.204	C	C	.	.	H	α-helix	trans	-64.3	-42.6	178.4	-76.3	174.3	179.5	173.8	0	111.9	L677 T790 G803 G804 I805 K806 A811 A812	L677-K808 HydrophobicContact CB-CB 3.9Å; L677-K808 HydrophobicContact CB-CD 4.21Å; L677-K808 HydrophobicContact CB-CG 3.94Å; L677-K808 HydrophobicContact CD1-CB 4.25Å; T790-K808 HydrophobicContact CG2-CD 4.03Å; T790-K808 PolarHBondContact OG1-NZ 2.84Å; G803-K808 WeakPolarHBondContact O-CE 3.27Å; G803-K808 PolarHBondContact O-NZ 3.39Å; G804-K808 WeakPolarHBondContact O-CB 3.05Å; G804-K808 VanDerWaalsContact O-CG 3.22Å; G804-K808 WeakPolarHBondContact O-CG 3.19Å; G804-K808 PolarHBondContact O-N 3.33Å; I805-K808 PolarHBondContact O-N 2.85Å; K806-K808 PolarHBondContact O-N 2.89Å; K808-A811 WeakPolarHBondContact O-CB 3.4Å; K808-A811 PolarHBondContact O-N 2.88Å; K808-A812 PolarHBondContact O-N 2.87Å
809	V	87.9	Confident	85.7	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-66.3	-40.8	176	179.7	0	0	0	0	110.4	I805 K806 A811 A812 R813 I820 F830 L833 I837 I841	I805-V809 HydrophobicContact CG2-CG2 4.06Å; I805-V809 WeakPolarHBondContact O-CG2 3.41Å; I805-V809 PolarHBondContact O-N 3.42Å; K806-V809 PolarHBondContact O-N 3.41Å; V809-A811 VanDerWaalsContact C-N 3.28Å; V809-A811 PolarHBondContact O-N 2.92Å; V809-A812 WeakPolarHBondContact O-CB 3.5Å; V809-A812 PolarHBondContact O-N 2.87Å; V809-R813 PolarHBondContact O-N 2.94Å; V809-I820 HydrophobicContact CG1-CD1 4.28Å; V809-I820 HydrophobicContact CG2-CD1 3.86Å; V809-F830 HydrophobicContact CG1-CE2 4Å; V809-F830 HydrophobicContact CG2-CD2 3.83Å; V809-F830 HydrophobicContact CG2-CE2 3.89Å; V809-L833 HydrophobicContact CB-CD1 4.01Å; V809-L833 HydrophobicContact CG1-CD1 4.24Å; V809-L833 HydrophobicContact CG2-CD1 3.84Å; V809-I837 HydrophobicContact CB-CG2 4.25Å; V809-I837 HydrophobicContact CG1-CG2 3.63Å; V809-I841 HydrophobicContact CG1-CD1 4.24Å
810	I	81.3	Confident	85.6	Confident	20 Å²	20	31.9 Å²	31.9	10%	0.103	18%	0.176	C	C	.	.	H	α-helix	trans	-59.7	-41.1	173.3	-67.3	164.7	0	0	0	110.9	V560 K806 E807 R813 R814 I837	V560-I810 HydrophobicContact CB-CG2 4.48Å; V560-I810 HydrophobicContact CG1-CB 4.34Å; V560-I810 HydrophobicContact CG1-CD1 3.55Å; V560-I810 HydrophobicContact CG1-CG1 3.55Å; V560-I810 HydrophobicContact CG1-CG2 3.84Å; K806-I810 HydrophobicContact CG-CD1 3.94Å; K806-I810 WeakPolarHBondContact O-CD1 3.49Å; K806-I810 WeakPolarHBondContact O-CG1 3.35Å; K806-I810 PolarHBondContact O-N 3.16Å; E807-I810 PolarHBondContact O-N 2.97Å; I810-R813 PolarHBondContact O-N 2.62Å; I810-R814 WeakPolarHBondContact O-CB 3.48Å; I810-R814 VanDerWaalsContact O-CG 3.29Å; I810-R814 WeakPolarHBondContact O-CG 3.48Å; I810-R814 PolarHBondContact O-N 3.3Å; I810-I837 HydrophobicContact CD1-CD1 4.08Å; I810-I837 HydrophobicContact CG1-CD1 4Å; I810-I837 HydrophobicContact CG1-CG2 3.97Å
811	A	80.4	Confident	85.7	Confident	3 Å²	3	29.2 Å²	29.2	3%	0.025	16%	0.162	C	C	.	.	H	α-helix	trans	-64.6	-44.2	176.7	0	0	0	0	0	112	G684 T686 E807 K808 V809 R814 A815	G684-A811 WeakPolarHBondContact O-CB 3.39Å; T686-A811 HydrophobicContact CG2-CB 4.33Å; E807-A811 WeakPolarHBondContact O-CB 3.33Å; E807-A811 PolarHBondContact O-N 3Å; K808-A811 WeakPolarHBondContact O-CB 3.4Å; K808-A811 PolarHBondContact O-N 2.88Å; V809-A811 VanDerWaalsContact C-N 3.28Å; V809-A811 PolarHBondContact O-N 2.92Å; A811-R814 PolarHBondContact O-N 2.75Å; A811-A815 WeakPolarHBondContact O-CB 3.41Å; A811-A815 PolarHBondContact O-N 3.13Å
812	A	86.2	Confident	85.8	Confident	0 Å²	0	26.9 Å²	26.9	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-57.8	-49.4	175.2	0	0	0	0	0	111.2	L677 K808 V809 R814 A815 N816 V817 I820	L677-A812 HydrophobicContact CD1-CB 4.13Å; L677-A812 HydrophobicContact CD2-CB 3.79Å; K808-A812 PolarHBondContact O-N 2.87Å; V809-A812 WeakPolarHBondContact O-CB 3.5Å; V809-A812 PolarHBondContact O-N 2.87Å; A812-R814 PolarHBondContact O-N 2.94Å; A812-A815 CarbonylContact O-C 3.55Å; A812-A815 WeakPolarHBondContact O-CA 3.12Å; A812-A815 PolarHBondContact O-N 3.48Å; A812-A815 VanDerWaalsContact O-N 3.09Å; A812-N816 PolarHBondContact O-N 3.42Å; A812-V817 HydrophobicContact CB-CB 4.01Å; A812-V817 HydrophobicContact CB-CG1 4.27Å; A812-V817 HydrophobicContact CB-CG2 4.34Å; A812-V817 WeakPolarHBondContact O-CB 3.08Å; A812-V817 WeakPolarHBondContact O-CG2 3.42Å; A812-V817 PolarHBondContact O-N 3.05Å; A812-I820 HydrophobicContact CB-CG2 3.64Å
813	R	81.6	Confident	86.2	Confident	70 Å²	70	26.2 Å²	26.2	26%	0.264	14%	0.143	S	C	.	.	H	α-helix	trans	-59.3	-44.6	177.8	-165.7	179.5	-178.4	105	-0.5	111.9	V809 I810 A815 N816 F836 I837 E839 I841	V809-R813 PolarHBondContact O-N 2.94Å; I810-R813 PolarHBondContact O-N 2.62Å; R813-A815 VanDerWaalsContact C-N 3.26Å; R813-A815 PolarHBondContact O-N 3.09Å; R813-N816 PolarHBondContact O-N 2.89Å; R813-F836 PolarHBondContact NE-O 3.39Å; R813-F836 PolarHBondContact NH1-O 2.74Å; R813-F836 PolarHBondContact NH2-O 3.07Å; R813-I837 PolarHBondContact NH1-O 2.83Å; R813-E839 PolarHBondContact NH1-O 3.31Å; R813-I841 HydrophobicContact CB-CD1 3.96Å; R813-I841 HydrophobicContact CG-CD1 4.24Å
814	R	75.8	Confident	86.7	Confident	96 Å²	96	26 Å²	26	36%	0.362	13%	0.127	S	C	.	.	H	α-helix	trans	-60.7	-36.2	176.1	-78.1	172.5	54.3	-132.2	-13.5	112.5	I810 A811 A812 N816	I810-R814 WeakPolarHBondContact O-CB 3.48Å; I810-R814 VanDerWaalsContact O-CG 3.29Å; I810-R814 WeakPolarHBondContact O-CG 3.48Å; I810-R814 PolarHBondContact O-N 3.3Å; A811-R814 PolarHBondContact O-N 2.75Å; A812-R814 PolarHBondContact O-N 2.94Å; R814-N816 PolarHBondContact O-N 3.25Å
815	A	78.6	Confident	87.2	Confident	6 Å²	6	31.5 Å²	31.5	5%	0.05	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.5	7.7	175.7	0	0	0	0	0	113.2	R664 T686 A811 A812 R813 V817	R664-A815 PolarHBondContact NE-O 2.94Å; R664-A815 PolarHBondContact NH2-O 3.09Å; T686-A815 HydrophobicContact CG2-CB 3.53Å; A811-A815 WeakPolarHBondContact O-CB 3.41Å; A811-A815 PolarHBondContact O-N 3.13Å; A812-A815 CarbonylContact O-C 3.55Å; A812-A815 WeakPolarHBondContact O-CA 3.12Å; A812-A815 PolarHBondContact O-N 3.48Å; A812-A815 VanDerWaalsContact O-N 3.09Å; R813-A815 VanDerWaalsContact C-N 3.26Å; R813-A815 PolarHBondContact O-N 3.09Å; A815-V817 HydrophobicContact CB-CG2 4.04Å; A815-V817 PolarHBondContact O-N 2.9Å
816	N	79.5	Confident	87.5	Confident	115 Å²	115	31.4 Å²	31.4	62%	0.615	15%	0.147	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.7	40	-175.9	-64.1	-20.9	0	0	0	112.7	R664 A812 R813 R814	R664-N816 PolarHBondContact NH2-O 2.85Å; A812-N816 PolarHBondContact O-N 3.42Å; R813-N816 PolarHBondContact O-N 2.89Å; R814-N816 PolarHBondContact O-N 3.25Å
817	V	86.3	Confident	88.1	Confident	5 Å²	5	34.2 Å²	34.2	3%	0.03	16%	0.156	C	C	.	.			trans	-76	129.3	171.7	173.5	0	0	0	0	107.7	M675 N786 A788 A812 A815 C819 I820	M675-V817 HydrophobicContact CE-CG2 4.47Å; M675-V817 HydrophobicContact SD-CG2 3.51Å; M675-V817 VanDerWaalsContact SD-CG2 3.51Å; N786-V817 WeakPolarHBondContact O-CG1 3.32Å; A788-V817 HydrophobicContact CB-CG1 3.76Å; A788-V817 HydrophobicContact CB-CG2 4.04Å; A812-V817 HydrophobicContact CB-CB 4.01Å; A812-V817 HydrophobicContact CB-CG1 4.27Å; A812-V817 HydrophobicContact CB-CG2 4.34Å; A812-V817 WeakPolarHBondContact O-CB 3.08Å; A812-V817 WeakPolarHBondContact O-CG2 3.42Å; A812-V817 PolarHBondContact O-N 3.05Å; A815-V817 HydrophobicContact CB-CG2 4.04Å; A815-V817 PolarHBondContact O-N 2.9Å; V817-C819 WeakPolarHBondContact CG1-O 3.04Å; V817-I820 HydrophobicContact CG1-CG2 3.72Å
818	D	86.1	Confident	88.6	Confident	62 Å²	62	40.4 Å²	40.4	33%	0.332	18%	0.183	S	C	.	.	S	Bend	trans	-96.5	-21	179.7	53.5	27	0	0	0	112.1	N786 I841 E842	N786-D818 VanDerWaalsContact CB-CG 3.44Å; N786-D818 WeakPolarHBondContact CB-OD1 3.48Å; N786-D818 VanDerWaalsContact CB-OD2 3.26Å; N786-D818 WeakPolarHBondContact CB-OD2 2.98Å; N786-D818 PolarHBondContact ND2-OD2 3.23Å; N786-D818 VanDerWaalsContact ND2-OD2 3.16Å; N786-D818 PolarHBondContact O-N 3.31Å; N786-D818 VanDerWaalsContact O-OD1 3.05Å; D818-I841 CarbonylContact O-C 3.6Å; D818-E842 WeakPolarHBondContact O-CB 3.38Å; D818-E842 PolarHBondContact O-N 3.14Å
819	C	94.2	Very high	88.6	Confident	0 Å²	0	44 Å²	44	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	126.8	-179.8	-173.4	0	0	0	0	111.4	N786 I787 A788 V817 E842	N786-C819 PolarHBondContact O-N 3Å; I787-C819 CarbonylContact C-O 3.55Å; I787-C819 VanDerWaalsContact CA-O 3.27Å; I787-C819 WeakPolarHBondContact CA-O 2.93Å; I787-C819 HydrophobicContact CB-CB 4.39Å; I787-C819 HydrophobicContact CG1-CB 3.97Å; A788-C819 PolarHBondContact N-O 2.76Å; V817-C819 WeakPolarHBondContact CG1-O 3.04Å; C819-E842 CarbonylContact C-O 3.59Å; C819-E842 VanDerWaalsContact CA-O 3.26Å; C819-E842 WeakPolarHBondContact CA-O 3.27Å; C819-E842 HydrophobicContact CB-CB 4.38Å
820	I	95.1	Very high	88.6	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	141.2	174.2	62.5	173.6	0	0	0	112.1	L677 A788 V809 A812 V817 L822 F830 I841 E842 V843 H844	L677-I820 HydrophobicContact CD1-CG2 4.27Å; A788-I820 CarbonylContact O-C 3.55Å; A788-I820 VanDerWaalsContact O-CA 3.27Å; A788-I820 WeakPolarHBondContact O-CA 3.5Å; V809-I820 HydrophobicContact CG1-CD1 4.28Å; V809-I820 HydrophobicContact CG2-CD1 3.86Å; A812-I820 HydrophobicContact CB-CG2 3.64Å; V817-I820 HydrophobicContact CG1-CG2 3.72Å; I820-L822 HydrophobicContact CD1-CD1 4.02Å; I820-L822 HydrophobicContact CD1-CD2 4.45Å; I820-L822 HydrophobicContact CD1-CG 4.21Å; I820-L822 HydrophobicContact CG1-CG 4.48Å; I820-F830 HydrophobicContact CD1-CD2 4.44Å; I820-F830 HydrophobicContact CD1-CE2 3.89Å; I820-I841 HydrophobicContact CB-CG2 4.4Å; I820-I841 HydrophobicContact CD1-CG2 4.08Å; I820-I841 HydrophobicContact CG1-CG2 3.76Å; I820-I841 HydrophobicContact CG2-CG2 4Å; I820-E842 PolarHBondContact N-O 2.73Å; I820-V843 HydrophobicContact CD1-CG1 4.23Å; I820-V843 HydrophobicContact CD1-CG2 3.75Å; I820-V843 HydrophobicContact CG1-CB 4.1Å; I820-V843 HydrophobicContact CG1-CG1 3.97Å; I820-V843 HydrophobicContact CG1-CG2 3.57Å; I820-V843 WeakPolarHBondContact O-CA 3.47Å; I820-H844 PolarHBondContact O-N 3.41Å
821	L	97.2	Very high	88.9	Confident	1 Å²	1	48.2 Å²	48.2	1%	0.005	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	118.8	175	-49.2	-176.5	0	0	0	109.2	I787 A788 M789 T790 H844 I846 L852 I855	I787-L821 HydrophobicContact CD1-CD1 3.68Å; I787-L821 HydrophobicContact CD1-CD2 3.99Å; I787-L821 HydrophobicContact CD1-CG 3.82Å; I787-L821 HydrophobicContact CG1-CD1 4.34Å; I787-L821 HydrophobicContact CG1-CG 4.1Å; A788-L821 PolarHBondContact O-N 2.93Å; M789-L821 HydrophobicContact CB-CB 3.83Å; M789-L821 HydrophobicContact CB-CD1 4.26Å; M789-L821 HydrophobicContact CB-CG 4.31Å; M789-L821 HydrophobicContact CE-CD1 4.08Å; T790-L821 PolarHBondContact N-O 3.38Å; T790-L821 VanDerWaalsContact N-O 3.16Å; L821-H844 WeakPolarHBondContact CA-O 3.46Å; L821-H844 HydrophobicContact CD2-CB 3.66Å; L821-I846 HydrophobicContact CB-CG1 4.31Å; L821-L852 HydrophobicContact CD1-CD1 4.39Å; L821-L852 HydrophobicContact CD1-CD2 4.03Å; L821-L852 HydrophobicContact CD1-CG 3.67Å; L821-I855 HydrophobicContact CD2-CB 4.38Å; L821-I855 HydrophobicContact CD2-CD1 4.23Å; L821-I855 HydrophobicContact CD2-CG2 3.81Å
822	L	96.4	Very high	88.9	Confident	1 Å²	1	54.3 Å²	54.3	1%	0.005	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	152.7	-179.2	-59.6	-177.4	0	0	0	110.3	T790 I805 I820 F830 V843 H844 F845 I846	T790-L822 HydrophobicContact CG2-CD2 3.64Å; I805-L822 HydrophobicContact CD1-CD2 4.31Å; I805-L822 HydrophobicContact CG2-CD1 4.18Å; I820-L822 HydrophobicContact CD1-CD1 4.02Å; I820-L822 HydrophobicContact CD1-CD2 4.45Å; I820-L822 HydrophobicContact CD1-CG 4.21Å; I820-L822 HydrophobicContact CG1-CG 4.48Å; L822-F830 HydrophobicContact CD1-CB 4.15Å; L822-F830 HydrophobicContact CD1-CD2 3.65Å; L822-F830 HydrophobicContact CD1-CE2 4.43Å; L822-F830 HydrophobicContact CD1-CG 4.12Å; L822-V843 HydrophobicContact CD1-CG1 4.06Å; L822-V843 HydrophobicContact CG-CG1 4.36Å; L822-H844 PolarHBondContact N-O 3.03Å; L822-F845 HydrophobicContact CB-CD1 4.08Å; L822-F845 HydrophobicContact CB-CE1 4.14Å; L822-F845 HydrophobicContact CD1-CE1 4.06Å; L822-F845 CarbonylContact O-C 3.5Å; L822-F845 VanDerWaalsContact O-CA 3.32Å; L822-F845 WeakPolarHBondContact O-CA 3.38Å; L822-I846 PolarHBondContact O-N 2.94Å
823	P	97.1	Very high	88.8	Confident	0 Å²	0	55.1 Å²	55.1	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.6	145.5	170.3	-21.5	34.7	0	0	0	111.4	T790 I799 L800 V802 E825 N826 I846	T790-P823 WeakPolarHBondContact O-CD 3.34Å; I799-P823 HydrophobicContact CG2-CB 3.92Å; I799-P823 HydrophobicContact CG2-CG 3.85Å; L800-P823 WeakPolarHBondContact O-CG 3.46Å; V802-P823 HydrophobicContact CG2-CG 4.28Å; P823-E825 VanDerWaalsContact C-N 3.28Å; P823-E825 PolarHBondContact O-N 3.36Å; P823-N826 WeakPolarHBondContact CD-OD1 3.06Å; P823-N826 VanDerWaalsContact CG-OD1 3.32Å; P823-N826 WeakPolarHBondContact CG-OD1 3.47Å; P823-N826 WeakPolarHBondContact O-CB 3.41Å; P823-N826 PolarHBondContact O-N 3.47Å; P823-I846 CarbonylContact C-O 3.56Å; P823-I846 WeakPolarHBondContact CA-O 3.45Å
824	E	96.7	Very high	88.6	Confident	52 Å²	52	54.2 Å²	54.2	24%	0.243	27%	0.27	C	S	.	.	G	3₁₀ helix	trans	-57.2	-40.5	-179.5	-178.9	62	-141.5	0	0	112.8	N826 R827 F845 I846 E847	E824-N826 PolarHBondContact O-N 2.82Å; E824-R827 VanDerWaalsContact CD-NH2 3.32Å; E824-R827 VanDerWaalsContact O-CB 3.23Å; E824-R827 WeakPolarHBondContact O-CB 3.39Å; E824-R827 PolarHBondContact O-N 3.16Å; E824-R827 IonicContact OE1-CZ 2.72Å; E824-R827 VanDerWaalsContact OE1-CZ 3.26Å; E824-R827 IonicContact OE1-NE 2.68Å; E824-R827 PolarHBondContact OE1-NE 2.97Å; E824-R827 IonicContact OE1-NH2 3.54Å; E824-R827 PolarHBondContact OE1-NH2 3.35Å; E824-R827 IonicContact OE2-CZ 3.64Å; E824-R827 IonicContact OE2-NE 3.58Å; E824-R827 IonicContact OE2-NH2 2.94Å; E824-R827 PolarHBondContact OE2-NH2 3.37Å; E824-F845 WeakPolarHBondContact OE2-CB 3.47Å; E824-I846 PolarHBondContact N-O 3.11Å; E824-E847 HydrophobicContact CB-CG 3.5Å; E824-E847 HydrophobicContact CG-CG 3.69Å
825	E	94.3	Very high	88.6	Confident	136 Å²	136	57.9 Å²	57.9	64%	0.636	29%	0.288	S	S	*	.	G	3₁₀ helix	trans	-64.6	-23.3	179.3	-69.9	-172.7	-165.1	0	0	113.1	P801 P823 R827	P801-E825 HydrophobicContact CB-CB 3.92Å; P801-E825 WeakPolarHBondContact CD-OE2 3.49Å; P801-E825 HydrophobicContact CG-CB 4.14Å; P801-E825 VanDerWaalsContact CG-OE2 3.31Å; P801-E825 WeakPolarHBondContact CG-OE2 3.13Å; P823-E825 VanDerWaalsContact C-N 3.28Å; P823-E825 PolarHBondContact O-N 3.36Å; E825-R827 PolarHBondContact O-N 3.16Å
826	N	93.9	Very high	88.4	Confident	5 Å²	5	60.7 Å²	60.7	3%	0.027	30%	0.299	C	S	.	.	G	3₁₀ helix	trans	-81.8	4.9	175.8	-72	128.3	0	0	0	114.1	P801 V802 I805 P823 E824 K828 D829 F830	P801-N826 VanDerWaalsContact CA-OD1 3.25Å; P801-N826 WeakPolarHBondContact CA-OD1 3.45Å; V802-N826 PolarHBondContact N-OD1 2.81Å; V802-N826 PolarHBondContact O-ND2 2.94Å; V802-N826 PolarHBondContact O-OD1 2.98Å; I805-N826 HydrophobicContact CD1-CB 3.86Å; I805-N826 HydrophobicContact CG1-CB 3.97Å; P823-N826 WeakPolarHBondContact CD-OD1 3.06Å; P823-N826 VanDerWaalsContact CG-OD1 3.32Å; P823-N826 WeakPolarHBondContact CG-OD1 3.47Å; P823-N826 WeakPolarHBondContact O-CB 3.41Å; P823-N826 PolarHBondContact O-N 3.47Å; E824-N826 PolarHBondContact O-N 2.82Å; N826-K828 PolarHBondContact O-N 2.94Å; N826-D829 WeakPolarHBondContact CA-OD2 3.21Å; N826-D829 PolarHBondContact ND2-OD2 3.2Å; N826-D829 PolarHBondContact O-N 2.88Å; N826-F830 PolarHBondContact O-N 2.61Å
827	R	94.6	Very high	88.3	Confident	114 Å²	114	55.3 Å²	55.3	43%	0.43	27%	0.271	S	S	.	.	H	α-helix	trans	-55.6	-38	174.6	-175.6	-175.4	-64.6	-88.5	3.2	112.8	E824 E825 F830 S831 F845	E824-R827 VanDerWaalsContact CD-NH2 3.32Å; E824-R827 VanDerWaalsContact O-CB 3.23Å; E824-R827 WeakPolarHBondContact O-CB 3.39Å; E824-R827 PolarHBondContact O-N 3.16Å; E824-R827 IonicContact OE1-CZ 2.72Å; E824-R827 VanDerWaalsContact OE1-CZ 3.26Å; E824-R827 IonicContact OE1-NE 2.68Å; E824-R827 PolarHBondContact OE1-NE 2.97Å; E824-R827 IonicContact OE1-NH2 3.54Å; E824-R827 PolarHBondContact OE1-NH2 3.35Å; E824-R827 IonicContact OE2-CZ 3.64Å; E824-R827 IonicContact OE2-NE 3.58Å; E824-R827 IonicContact OE2-NH2 2.94Å; E824-R827 PolarHBondContact OE2-NH2 3.37Å; E825-R827 PolarHBondContact O-N 3.16Å; R827-F830 PolarHBondContact O-N 3.36Å; R827-S831 PolarHBondContact O-N 3.43Å; R827-S831 PolarHBondContact O-OG 2.76Å; R827-F845 HydrophobicContact CB-CD1 3.84Å; R827-F845 HydrophobicContact CB-CE1 3.83Å; R827-F845 HydrophobicContact CB-CG 4.26Å; R827-F845 HydrophobicContact CB-CZ 4.18Å; R827-F845 HydrophobicContact CG-CD1 4.35Å; R827-F845 HydrophobicContact CG-CD2 4.33Å; R827-F845 HydrophobicContact CG-CE1 4.16Å; R827-F845 HydrophobicContact CG-CE2 4.08Å; R827-F845 HydrophobicContact CG-CG 4.44Å; R827-F845 HydrophobicContact CG-CZ 3.99Å; R827-F845 VanDerWaalsContact NH2-CB 3.33Å
828	K	89.4	Confident	88.1	Confident	160 Å²	160	56.5 Å²	56.5	70%	0.696	28%	0.278	S	S	*	.	H	α-helix	trans	-64.9	-48	178.2	-63	176.8	-176.4	172.7	0	111.2	N826 F830 S831 D832	N826-K828 PolarHBondContact O-N 2.94Å; K828-F830 VanDerWaalsContact C-N 3.25Å; K828-F830 PolarHBondContact O-N 3.41Å; K828-S831 WeakPolarHBondContact CA-OG 3.26Å; K828-S831 PolarHBondContact O-N 3.2Å; K828-S831 PolarHBondContact O-OG 3.07Å; K828-D832 PolarHBondContact O-N 3.44Å
829	D	87.6	Confident	87.8	Confident	78 Å²	78	60.1 Å²	60.1	42%	0.417	29%	0.293	S	S	.	.	H	α-helix	trans	-61.6	-36	178.3	-52	-67.3	0	0	0	111.9	I805 N826 L833	I805-D829 HydrophobicContact CB-CB 3.99Å; I805-D829 HydrophobicContact CG1-CB 3.98Å; I805-D829 HydrophobicContact CG2-CB 4.26Å; N826-D829 WeakPolarHBondContact CA-OD2 3.21Å; N826-D829 PolarHBondContact ND2-OD2 3.2Å; N826-D829 PolarHBondContact O-N 2.88Å; D829-L833 WeakPolarHBondContact O-CG 3.43Å
830	F	88.9	Confident	87.2	Confident	26 Å²	26	63.7 Å²	63.7	11%	0.114	33%	0.329	C	S	.	.	H	α-helix	trans	-72.5	-38.5	176.4	-174.7	-91.7	0	0	0	112.8	I805 V809 I820 L822 N826 R827 K828 D832 L833 T838 V843 F845	I805-F830 HydrophobicContact CG2-CB 4.38Å; V809-F830 HydrophobicContact CG1-CE2 4Å; V809-F830 HydrophobicContact CG2-CD2 3.83Å; V809-F830 HydrophobicContact CG2-CE2 3.89Å; I820-F830 HydrophobicContact CD1-CD2 4.44Å; I820-F830 HydrophobicContact CD1-CE2 3.89Å; L822-F830 HydrophobicContact CD1-CB 4.15Å; L822-F830 HydrophobicContact CD1-CD2 3.65Å; L822-F830 HydrophobicContact CD1-CE2 4.43Å; L822-F830 HydrophobicContact CD1-CG 4.12Å; N826-F830 PolarHBondContact O-N 2.61Å; R827-F830 PolarHBondContact O-N 3.36Å; K828-F830 VanDerWaalsContact C-N 3.25Å; K828-F830 PolarHBondContact O-N 3.41Å; F830-D832 PolarHBondContact O-N 3.32Å; F830-L833 HydrophobicContact CD2-CD1 3.87Å; F830-L833 HydrophobicContact CE2-CD1 4.25Å; F830-L833 HydrophobicContact CG-CD1 4.5Å; F830-L833 VanDerWaalsContact O-CB 3.32Å; F830-L833 WeakPolarHBondContact O-CB 3.47Å; F830-L833 WeakPolarHBondContact O-CG 3.3Å; F830-L833 PolarHBondContact O-N 2.8Å; F830-L833 VanDerWaalsContact O-N 3.14Å; F830-T838 HydrophobicContact CD1-CG2 4.45Å; F830-T838 HydrophobicContact CD2-CG2 4.48Å; F830-T838 HydrophobicContact CE1-CG2 3.74Å; F830-T838 HydrophobicContact CE2-CG2 3.76Å; F830-T838 HydrophobicContact CZ-CG2 3.33Å; F830-V843 HydrophobicContact CE1-CB 4.42Å; F830-V843 HydrophobicContact CE1-CG1 4.45Å; F830-V843 HydrophobicContact CE1-CG2 3.91Å; F830-V843 HydrophobicContact CE2-CG1 4.44Å; F830-V843 HydrophobicContact CE2-CG2 3.8Å; F830-V843 HydrophobicContact CZ-CB 4.27Å; F830-V843 HydrophobicContact CZ-CG1 4.39Å; F830-V843 HydrophobicContact CZ-CG2 3.34Å; F830-F845 HydrophobicContact CB-CE1 3.98Å; F830-F845 HydrophobicContact CB-CZ 3.86Å; F830-F845 AromaticContact CD1-CZ 3.75Å; F830-F845 HydrophobicContact CD1-CZ 3.75Å; F830-F845 HydrophobicContact CG-CE1 4.36Å; F830-F845 AromaticContact CG-CZ 3.9Å; F830-F845 HydrophobicContact CG-CZ 3.9Å
831	S	86.4	Confident	86.8	Confident	82 Å²	82	64.7 Å²	64.7	57%	0.573	34%	0.335	S	S	*	.	H	α-helix	trans	-66.5	-25.7	179.8	54.3	0	0	0	0	113.4	R827 K828 L833	R827-S831 PolarHBondContact O-N 3.43Å; R827-S831 PolarHBondContact O-OG 2.76Å; K828-S831 WeakPolarHBondContact CA-OG 3.26Å; K828-S831 PolarHBondContact O-N 3.2Å; K828-S831 PolarHBondContact O-OG 3.07Å; S831-L833 PolarHBondContact O-N 3.49Å
832	D	81.9	Confident	86.6	Confident	131 Å²	131	68.5 Å²	68.5	70%	0.701	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.6	-8.1	177.2	-66	-13.7	0	0	0	112.4	K828 F830	K828-D832 PolarHBondContact O-N 3.44Å; F830-D832 PolarHBondContact O-N 3.32Å
833	L	82.5	Confident	86.4	Confident	18 Å²	18	70 Å²	70	9%	0.094	36%	0.362	C	S	.	.	S	Bend	trans	-75.2	138.3	-179.8	-58.4	-176.6	0	0	0	111.9	I805 K806 V809 D829 F830 S831 T838	I805-L833 HydrophobicContact CG2-CD1 4.43Å; K806-L833 HydrophobicContact CB-CD2 3.54Å; K806-L833 HydrophobicContact CD-CD2 4.31Å; K806-L833 HydrophobicContact CG-CD2 3.72Å; V809-L833 HydrophobicContact CB-CD1 4.01Å; V809-L833 HydrophobicContact CG1-CD1 4.24Å; V809-L833 HydrophobicContact CG2-CD1 3.84Å; D829-L833 WeakPolarHBondContact O-CG 3.43Å; F830-L833 HydrophobicContact CD2-CD1 3.87Å; F830-L833 HydrophobicContact CE2-CD1 4.25Å; F830-L833 HydrophobicContact CG-CD1 4.5Å; F830-L833 VanDerWaalsContact O-CB 3.32Å; F830-L833 WeakPolarHBondContact O-CB 3.47Å; F830-L833 WeakPolarHBondContact O-CG 3.3Å; F830-L833 PolarHBondContact O-N 2.8Å; F830-L833 VanDerWaalsContact O-N 3.14Å; S831-L833 PolarHBondContact O-N 3.49Å; L833-T838 HydrophobicContact CB-CG2 3.68Å; L833-T838 HydrophobicContact CD1-CG2 4.34Å
834	P	77.1	Confident	86.4	Confident	51 Å²	51	72.7 Å²	72.7	33%	0.331	37%	0.374	S	S	.	.			trans	-54.8	144.3	173.7	-26.6	32.8	0	0	0	113.5	F836 I837 T838	P834-F836 HydrophobicContact CB-CD1 3.47Å; P834-F836 VanDerWaalsContact CB-CD1 3.47Å; P834-F836 HydrophobicContact CB-CE1 3.13Å; P834-F836 HydrophobicContact CB-CG 4.34Å; P834-F836 HydrophobicContact CB-CZ 3.75Å; P834-F836 HydrophobicContact CG-CE1 3.76Å; P834-F836 HydrophobicContact CG-CZ 4.01Å; P834-F836 PolarHBondContact O-N 3.33Å; P834-F836 VanDerWaalsContact O-N 3.16Å; P834-I837 HydrophobicContact CB-CG1 4.47Å; P834-I837 HydrophobicContact CG-CD1 4.35Å; P834-I837 WeakPolarHBondContact O-CB 3.27Å; P834-I837 PolarHBondContact O-N 3.44Å; P834-T838 PolarHBondContact O-N 3.35Å
835	K	77.4	Confident	86.4	Confident	172 Å²	172	72 Å²	72	75%	0.748	37%	0.37	S	S	*	.	H	α-helix	trans	-54.5	-37.3	-178.9	-69.9	-174.4	178.7	-179	0	113.5	I837 T838 E839	K835-I837 PolarHBondContact O-N 3.36Å; K835-I837 VanDerWaalsContact O-N 3.09Å; K835-T838 PolarHBondContact O-N 3.13Å; K835-T838 VanDerWaalsContact O-N 3.16Å; K835-T838 PolarHBondContact O-OG1 3.38Å; K835-E839 WeakPolarHBondContact O-CB 3.26Å; K835-E839 PolarHBondContact O-N 3.11Å
836	F	73.7	Confident	86.5	Confident	66 Å²	66	65.7 Å²	65.7	29%	0.289	34%	0.341	S	S	.	.	H	α-helix	trans	-65.8	-12	178.7	70.5	-98.2	0	0	0	113.7	V560 E563 R813 P834	V560-F836 HydrophobicContact CG1-CE2 4.21Å; V560-F836 HydrophobicContact CG2-CD2 4.1Å; V560-F836 HydrophobicContact CG2-CE2 3.54Å; E563-F836 HydrophobicContact CG-CE2 4.49Å; E563-F836 HydrophobicContact CG-CZ 4.42Å; R813-F836 PolarHBondContact NE-O 3.39Å; R813-F836 PolarHBondContact NH1-O 2.74Å; R813-F836 PolarHBondContact NH2-O 3.07Å; P834-F836 HydrophobicContact CB-CD1 3.47Å; P834-F836 VanDerWaalsContact CB-CD1 3.47Å; P834-F836 HydrophobicContact CB-CE1 3.13Å; P834-F836 HydrophobicContact CB-CG 4.34Å; P834-F836 HydrophobicContact CB-CZ 3.75Å; P834-F836 HydrophobicContact CG-CE1 3.76Å; P834-F836 HydrophobicContact CG-CZ 4.01Å; P834-F836 PolarHBondContact O-N 3.33Å; P834-F836 VanDerWaalsContact O-N 3.16Å
837	I	76.7	Confident	86.6	Confident	2 Å²	2	71.3 Å²	71.3	1%	0.01	37%	0.367	C	S	.	.	H	α-helix	trans	-93.2	-39.4	173.6	-56.5	-175.3	0	0	0	110.3	V560 V809 I810 R813 P834 K835	V560-I837 HydrophobicContact CG1-CD1 4.17Å; V560-I837 HydrophobicContact CG1-CG1 4.36Å; V809-I837 HydrophobicContact CB-CG2 4.25Å; V809-I837 HydrophobicContact CG1-CG2 3.63Å; I810-I837 HydrophobicContact CD1-CD1 4.08Å; I810-I837 HydrophobicContact CG1-CD1 4Å; I810-I837 HydrophobicContact CG1-CG2 3.97Å; R813-I837 PolarHBondContact NH1-O 2.83Å; P834-I837 HydrophobicContact CB-CG1 4.47Å; P834-I837 HydrophobicContact CG-CD1 4.35Å; P834-I837 WeakPolarHBondContact O-CB 3.27Å; P834-I837 PolarHBondContact O-N 3.44Å; K835-I837 PolarHBondContact O-N 3.36Å; K835-I837 VanDerWaalsContact O-N 3.09Å
838	T	81.9	Confident	86.6	Confident	30 Å²	30	70.9 Å²	70.9	18%	0.184	37%	0.368	C	S	.	.	H	α-helix	trans	-89.6	-23.3	-172.5	58.7	0	0	0	0	113.8	F830 L833 P834 K835 G840 I841	F830-T838 HydrophobicContact CD1-CG2 4.45Å; F830-T838 HydrophobicContact CD2-CG2 4.48Å; F830-T838 HydrophobicContact CE1-CG2 3.74Å; F830-T838 HydrophobicContact CE2-CG2 3.76Å; F830-T838 HydrophobicContact CZ-CG2 3.33Å; L833-T838 HydrophobicContact CB-CG2 3.68Å; L833-T838 HydrophobicContact CD1-CG2 4.34Å; P834-T838 PolarHBondContact O-N 3.35Å; K835-T838 PolarHBondContact O-N 3.13Å; K835-T838 VanDerWaalsContact O-N 3.16Å; K835-T838 PolarHBondContact O-OG1 3.38Å; T838-G840 PolarHBondContact O-N 3.47Å; T838-I841 PolarHBondContact O-N 3.3Å
839	E	81.1	Confident	86.8	Confident	137 Å²	137	63.2 Å²	63.2	64%	0.64	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	128.6	-177.3	-176	172.6	-159	0	0	111.8	R813 K835	R813-E839 PolarHBondContact NH1-O 3.31Å; K835-E839 WeakPolarHBondContact O-CB 3.26Å; K835-E839 PolarHBondContact O-N 3.11Å
840	G	80.4	Confident	87.1	Confident	75 Å²	75	62.4 Å²	62.4	77%	0.773	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.1	1.1	179.3	0	0	0	0	0	115.4	T838	T838-G840 PolarHBondContact O-N 3.47Å
841	I	87.2	Confident	87.2	Confident	22 Å²	22	64 Å²	64	11%	0.113	34%	0.339	C	S	.	.			trans	-108.4	122.9	176.9	-53.5	177.5	0	0	0	109.3	V809 R813 D818 I820 T838 V843	V809-I841 HydrophobicContact CG1-CD1 4.24Å; R813-I841 HydrophobicContact CB-CD1 3.96Å; R813-I841 HydrophobicContact CG-CD1 4.24Å; D818-I841 CarbonylContact O-C 3.6Å; I820-I841 HydrophobicContact CB-CG2 4.4Å; I820-I841 HydrophobicContact CD1-CG2 4.08Å; I820-I841 HydrophobicContact CG1-CG2 3.76Å; I820-I841 HydrophobicContact CG2-CG2 4Å; T838-I841 PolarHBondContact O-N 3.3Å; I841-V843 HydrophobicContact CG2-CG2 4.15Å
842	E	92.9	Very high	87.5	Confident	80 Å²	80	60.2 Å²	60.2	37%	0.374	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	123.5	168	-177.3	-172.6	149.1	0	0	108.9	R784 D818 C819 I820 H844	R784-E842 IonicContact CZ-OE1 2.69Å; R784-E842 IonicContact CZ-OE2 3.93Å; R784-E842 IonicContact NH1-OE1 3.62Å; R784-E842 PolarHBondContact NH1-OE1 2.84Å; R784-E842 IonicContact NH1-OE2 2.67Å; R784-E842 IonicContact NH2-OE1 2.68Å; R784-E842 IonicContact NH2-OE2 3.01Å; R784-E842 PolarHBondContact NH2-OE2 2.93Å; D818-E842 WeakPolarHBondContact O-CB 3.38Å; D818-E842 PolarHBondContact O-N 3.14Å; C819-E842 CarbonylContact C-O 3.59Å; C819-E842 VanDerWaalsContact CA-O 3.26Å; C819-E842 WeakPolarHBondContact CA-O 3.27Å; C819-E842 HydrophobicContact CB-CB 4.38Å; I820-E842 PolarHBondContact N-O 2.73Å; E842-H844 IonicContact OE1-CD2 3.88Å; E842-H844 IonicContact OE1-CE1 3.52Å; E842-H844 IonicContact OE1-NE2 3.04Å; E842-H844 PolarHBondContact OE1-NE2 3.22Å
843	V	93.9	Very high	88.1	Confident	33 Å²	33	54 Å²	54	20%	0.2	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	126.3	-176.8	-175.6	0	0	0	0	109.9	I820 L822 F830 I841 F845	I820-V843 HydrophobicContact CD1-CG1 4.23Å; I820-V843 HydrophobicContact CD1-CG2 3.75Å; I820-V843 HydrophobicContact CG1-CB 4.1Å; I820-V843 HydrophobicContact CG1-CG1 3.97Å; I820-V843 HydrophobicContact CG1-CG2 3.57Å; I820-V843 WeakPolarHBondContact O-CA 3.47Å; L822-V843 HydrophobicContact CD1-CG1 4.06Å; L822-V843 HydrophobicContact CG-CG1 4.36Å; F830-V843 HydrophobicContact CE1-CB 4.42Å; F830-V843 HydrophobicContact CE1-CG1 4.45Å; F830-V843 HydrophobicContact CE1-CG2 3.91Å; F830-V843 HydrophobicContact CE2-CG1 4.44Å; F830-V843 HydrophobicContact CE2-CG2 3.8Å; F830-V843 HydrophobicContact CZ-CB 4.27Å; F830-V843 HydrophobicContact CZ-CG1 4.39Å; F830-V843 HydrophobicContact CZ-CG2 3.34Å; I841-V843 HydrophobicContact CG2-CG2 4.15Å; V843-F845 HydrophobicContact CB-CE2 4.47Å; V843-F845 HydrophobicContact CG1-CD2 4.28Å; V843-F845 HydrophobicContact CG1-CE1 4.06Å; V843-F845 HydrophobicContact CG1-CE2 3.74Å; V843-F845 HydrophobicContact CG1-CZ 3.62Å
844	H	96.5	Very high	88.6	Confident	56 Å²	56	59.4 Å²	59.4	26%	0.259	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	132.7	170.4	-62.3	-85.4	0	0	0	110.2	I820 L821 L822 E842 I846 I855	I820-H844 PolarHBondContact O-N 3.41Å; L821-H844 WeakPolarHBondContact CA-O 3.46Å; L821-H844 HydrophobicContact CD2-CB 3.66Å; L822-H844 PolarHBondContact N-O 3.03Å; E842-H844 IonicContact OE1-CD2 3.88Å; E842-H844 IonicContact OE1-CE1 3.52Å; E842-H844 IonicContact OE1-NE2 3.04Å; E842-H844 PolarHBondContact OE1-NE2 3.22Å; H844-I846 HydrophobicContact CB-CD1 4.01Å; H844-I855 HydrophobicContact CB-CD1 3.63Å
845	F	97.1	Very high	89.3	Confident	38 Å²	38	58.6 Å²	58.6	17%	0.167	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	128.9	177	-66.4	-76.9	0	0	0	108.8	L822 E824 R827 F830 V843	L822-F845 HydrophobicContact CB-CD1 4.08Å; L822-F845 HydrophobicContact CB-CE1 4.14Å; L822-F845 HydrophobicContact CD1-CE1 4.06Å; L822-F845 CarbonylContact O-C 3.5Å; L822-F845 VanDerWaalsContact O-CA 3.32Å; L822-F845 WeakPolarHBondContact O-CA 3.38Å; E824-F845 WeakPolarHBondContact OE2-CB 3.47Å; R827-F845 HydrophobicContact CB-CD1 3.84Å; R827-F845 HydrophobicContact CB-CE1 3.83Å; R827-F845 HydrophobicContact CB-CG 4.26Å; R827-F845 HydrophobicContact CB-CZ 4.18Å; R827-F845 HydrophobicContact CG-CD1 4.35Å; R827-F845 HydrophobicContact CG-CD2 4.33Å; R827-F845 HydrophobicContact CG-CE1 4.16Å; R827-F845 HydrophobicContact CG-CE2 4.08Å; R827-F845 HydrophobicContact CG-CG 4.44Å; R827-F845 HydrophobicContact CG-CZ 3.99Å; R827-F845 VanDerWaalsContact NH2-CB 3.33Å; F830-F845 HydrophobicContact CB-CE1 3.98Å; F830-F845 HydrophobicContact CB-CZ 3.86Å; F830-F845 AromaticContact CD1-CZ 3.75Å; F830-F845 HydrophobicContact CD1-CZ 3.75Å; F830-F845 HydrophobicContact CG-CE1 4.36Å; F830-F845 AromaticContact CG-CZ 3.9Å; F830-F845 HydrophobicContact CG-CZ 3.9Å; V843-F845 HydrophobicContact CB-CE2 4.47Å; V843-F845 HydrophobicContact CG1-CD2 4.28Å; V843-F845 HydrophobicContact CG1-CE1 4.06Å; V843-F845 HydrophobicContact CG1-CE2 3.74Å; V843-F845 HydrophobicContact CG1-CZ 3.62Å
846	I	95.9	Very high	90	Very high	3 Å²	3	50.4 Å²	50.4	2%	0.015	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	125.7	-163	-54	-58.7	0	0	0	109.8	I799 L821 L822 P823 E824 H844 K848 D851 L852 I855	I799-I846 HydrophobicContact CB-CG2 4.31Å; I799-I846 HydrophobicContact CG1-CG2 3.73Å; L821-I846 HydrophobicContact CB-CG1 4.31Å; L822-I846 PolarHBondContact O-N 2.94Å; P823-I846 CarbonylContact C-O 3.56Å; P823-I846 WeakPolarHBondContact CA-O 3.45Å; E824-I846 PolarHBondContact N-O 3.11Å; H844-I846 HydrophobicContact CB-CD1 4.01Å; I846-K848 WeakPolarHBondContact CG2-O 3.23Å; I846-D851 HydrophobicContact CD1-CB 4.35Å; I846-D851 HydrophobicContact CG2-CB 4.4Å; I846-L852 HydrophobicContact CG2-CB 3.88Å; I846-L852 HydrophobicContact CG2-CD1 4.46Å; I846-I855 HydrophobicContact CD1-CD1 3.51Å
847	E	94.8	Very high	90.9	Very high	124 Å²	124	47.6 Å²	47.6	58%	0.579	24%	0.242	S	C	*	.	S	Bend	trans	-93.7	-40.7	171.5	-69.3	-173.4	-176.5	0	0	112.5	I799 E824	I799-E847 PolarHBondContact N-O 2.95Å; E824-E847 HydrophobicContact CB-CG 3.5Å; E824-E847 HydrophobicContact CG-CG 3.69Å
848	K	95	Very high	91.3	Very high	104 Å²	104	51.4 Å²	51.4	45%	0.452	27%	0.267	S	S	.	.	B	Isolated β-bridge	trans	-124.9	148.7	-177.6	-67.2	-176.9	-178.9	179.8	0	111.1	G797 I846 E850 D851 L852	G797-K848 WeakPolarHBondContact O-CA 3.48Å; I846-K848 WeakPolarHBondContact CG2-O 3.23Å; K848-E850 PolarHBondContact O-N 2.87Å; K848-D851 PolarHBondContact O-N 3.06Å; K848-D851 VanDerWaalsContact O-N 3.11Å; K848-L852 PolarHBondContact O-N 2.75Å
849	Y	95	Very high	91.4	Very high	0 Å²	0	57.9 Å²	57.9	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-62.3	-27.6	179.8	-176.5	-88.4	0	0	0	113.2	Y730 F734 V771 T772 I775 G797 I799 D851 L852 F853	Y730-Y849 HydrophobicContact CD1-CG 4.48Å; Y730-Y849 AromaticContact CE1-CD1 3.57Å; Y730-Y849 HydrophobicContact CE1-CD1 3.57Å; Y730-Y849 HydrophobicContact CE1-CD2 4.42Å; Y730-Y849 HydrophobicContact CE1-CE1 4.43Å; Y730-Y849 AromaticContact CE1-CG 3.58Å; Y730-Y849 HydrophobicContact CE1-CG 3.58Å; F734-Y849 AromaticContact CD2-CD1 3.92Å; F734-Y849 HydrophobicContact CD2-CD1 3.92Å; F734-Y849 HydrophobicContact CD2-CE1 4.3Å; F734-Y849 AromaticContact CE2-CD1 3.87Å; F734-Y849 HydrophobicContact CE2-CD1 3.87Å; F734-Y849 HydrophobicContact CE2-CE1 4.21Å; F734-Y849 HydrophobicContact CZ-CD1 4.43Å; F734-Y849 HydrophobicContact CZ-CE1 4.36Å; V771-Y849 HydrophobicContact CB-CD2 4.15Å; V771-Y849 HydrophobicContact CB-CE2 3.54Å; V771-Y849 HydrophobicContact CG1-CD1 4.11Å; V771-Y849 HydrophobicContact CG1-CD2 3.93Å; V771-Y849 HydrophobicContact CG1-CE1 3.6Å; V771-Y849 HydrophobicContact CG1-CE2 3.39Å; V771-Y849 HydrophobicContact CG1-CG 4.27Å; V771-Y849 HydrophobicContact CG2-CE2 4.5Å; T772-Y849 WeakPolarHBondContact CA-OH 3.2Å; T772-Y849 PolarHBondContact N-OH 3.31Å; T772-Y849 VanDerWaalsContact N-OH 3.17Å; T772-Y849 WeakPolarHBondContact OG1-CE2 3.43Å; T772-Y849 PolarHBondContact OG1-OH 3.41Å; T772-Y849 VanDerWaalsContact OG1-OH 3.08Å; I775-Y849 HydrophobicContact CD1-CE1 3.59Å; G797-Y849 PolarHBondContact O-N 3.24Å; I799-Y849 HydrophobicContact CD1-CD2 4.22Å; Y849-D851 VanDerWaalsContact C-N 3.26Å; Y849-D851 PolarHBondContact O-N 3.08Å; Y849-L852 HydrophobicContact CD2-CB 4.32Å; Y849-L852 HydrophobicContact CD2-CD1 4.32Å; Y849-L852 HydrophobicContact CD2-CD2 4.29Å; Y849-L852 HydrophobicContact CE2-CD1 4.49Å; Y849-L852 HydrophobicContact CE2-CD2 3.8Å; Y849-L852 WeakPolarHBondContact O-CA 3.3Å; Y849-L852 VanDerWaalsContact O-CB 3.23Å; Y849-L852 WeakPolarHBondContact O-CB 3.48Å; Y849-L852 PolarHBondContact O-N 3.34Å; Y849-L852 VanDerWaalsContact O-N 3.13Å; Y849-F853 HydrophobicContact CD1-CB 4.48Å; Y849-F853 HydrophobicContact CE1-CB 4.08Å; Y849-F853 HydrophobicContact CE1-CD2 4.45Å; Y849-F853 PolarHBondContact O-N 3.11Å
850	E	92.3	Very high	91.4	Very high	61 Å²	61	54 Å²	54	29%	0.285	28%	0.282	S	S	.	.	H	α-helix	trans	-55.6	-40.5	173.1	-72.9	166.9	-147.7	0	0	112.7	F734 K848 F853 R854	F734-E850 HydrophobicContact CE2-CG 3.79Å; K848-E850 PolarHBondContact O-N 2.87Å; E850-F853 PolarHBondContact O-N 3.19Å; E850-R854 WeakPolarHBondContact O-CG 3.45Å; E850-R854 PolarHBondContact O-N 3.28Å; E850-R854 VanDerWaalsContact O-N 3.11Å
851	D	92.3	Very high	91.1	Very high	60 Å²	60	54.9 Å²	54.9	32%	0.321	28%	0.281	S	S	.	.	H	α-helix	trans	-69.8	-39.5	178.1	-56.3	-46.2	0	0	0	110.7	I846 K848 Y849 F853 R854 I855	I846-D851 HydrophobicContact CD1-CB 4.35Å; I846-D851 HydrophobicContact CG2-CB 4.4Å; K848-D851 PolarHBondContact O-N 3.06Å; K848-D851 VanDerWaalsContact O-N 3.11Å; Y849-D851 VanDerWaalsContact C-N 3.26Å; Y849-D851 PolarHBondContact O-N 3.08Å; D851-F853 VanDerWaalsContact C-N 3.32Å; D851-F853 PolarHBondContact O-N 2.83Å; D851-R854 PolarHBondContact O-N 2.85Å; D851-R854 IonicContact OD1-NH1 2.83Å; D851-R854 PolarHBondContact OD1-NH1 3.09Å; D851-I855 WeakPolarHBondContact O-CD1 3.42Å; D851-I855 WeakPolarHBondContact O-CG1 3.44Å; D851-I855 PolarHBondContact O-N 3.23Å
852	L	93.2	Very high	90.3	Very high	2 Å²	2	55.6 Å²	55.6	1%	0.01	29%	0.285	C	S	.	.	H	α-helix	trans	-57.1	-46.2	172.2	-163.1	150.6	0	0	0	111.4	C768 T772 M789 I799 L821 I846 K848 Y849 I855 S856	C768-L852 HydrophobicContact CB-CD1 3.71Å; T772-L852 WeakPolarHBondContact OG1-CD2 3.32Å; M789-L852 HydrophobicContact CE-CD2 4.25Å; M789-L852 HydrophobicContact SD-CD2 3.88Å; I799-L852 HydrophobicContact CD1-CD1 4.49Å; L821-L852 HydrophobicContact CD1-CD1 4.39Å; L821-L852 HydrophobicContact CD1-CD2 4.03Å; L821-L852 HydrophobicContact CD1-CG 3.67Å; I846-L852 HydrophobicContact CG2-CB 3.88Å; I846-L852 HydrophobicContact CG2-CD1 4.46Å; K848-L852 PolarHBondContact O-N 2.75Å; Y849-L852 HydrophobicContact CD2-CB 4.32Å; Y849-L852 HydrophobicContact CD2-CD1 4.32Å; Y849-L852 HydrophobicContact CD2-CD2 4.29Å; Y849-L852 HydrophobicContact CE2-CD1 4.49Å; Y849-L852 HydrophobicContact CE2-CD2 3.8Å; Y849-L852 WeakPolarHBondContact O-CA 3.3Å; Y849-L852 VanDerWaalsContact O-CB 3.23Å; Y849-L852 WeakPolarHBondContact O-CB 3.48Å; Y849-L852 PolarHBondContact O-N 3.34Å; Y849-L852 VanDerWaalsContact O-N 3.13Å; L852-I855 PolarHBondContact O-N 3.24Å; L852-S856 WeakPolarHBondContact CD2-OG 3.5Å; L852-S856 VanDerWaalsContact O-CB 3.3Å; L852-S856 WeakPolarHBondContact O-CB 3.29Å; L852-S856 PolarHBondContact O-N 2.94Å; L852-S856 PolarHBondContact O-OG 3.04Å
853	F	93.7	Very high	88.9	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-61.6	-47.4	-179.2	178.4	-83	0	0	0	111.1	F734 I775 L779 Y849 E850 D851 I855 S856 F857 F860 L862	F734-F853 AromaticContact CE1-CD2 3.69Å; F734-F853 HydrophobicContact CE1-CD2 3.69Å; F734-F853 HydrophobicContact CE1-CE2 4Å; F734-F853 AromaticContact CE1-CG 3.99Å; F734-F853 HydrophobicContact CE1-CG 3.99Å; F734-F853 HydrophobicContact CZ-CB 3.87Å; F734-F853 HydrophobicContact CZ-CD1 4.17Å; F734-F853 AromaticContact CZ-CD2 3.85Å; F734-F853 HydrophobicContact CZ-CD2 3.85Å; F734-F853 AromaticContact CZ-CG 3.67Å; F734-F853 HydrophobicContact CZ-CG 3.67Å; I775-F853 HydrophobicContact CG2-CD2 4.04Å; I775-F853 HydrophobicContact CG2-CE2 3.57Å; L779-F853 HydrophobicContact CD1-CE2 3.83Å; L779-F853 HydrophobicContact CD1-CZ 3.86Å; Y849-F853 HydrophobicContact CD1-CB 4.48Å; Y849-F853 HydrophobicContact CE1-CB 4.08Å; Y849-F853 HydrophobicContact CE1-CD2 4.45Å; Y849-F853 PolarHBondContact O-N 3.11Å; E850-F853 PolarHBondContact O-N 3.19Å; D851-F853 VanDerWaalsContact C-N 3.32Å; D851-F853 PolarHBondContact O-N 2.83Å; F853-I855 PolarHBondContact O-N 3.1Å; F853-S856 PolarHBondContact O-N 2.72Å; F853-S856 VanDerWaalsContact O-N 3.1Å; F853-F857 HydrophobicContact CD1-CD2 4.42Å; F853-F857 AromaticContact CD2-CD2 3.4Å; F853-F857 HydrophobicContact CD2-CD2 3.4Å; F853-F857 VanDerWaalsContact CD2-CD2 3.4Å; F853-F857 AromaticContact CD2-CE2 3.71Å; F853-F857 HydrophobicContact CD2-CE2 3.71Å; F853-F857 HydrophobicContact CD2-CG 4.45Å; F853-F857 HydrophobicContact CE1-CB 4.15Å; F853-F857 HydrophobicContact CE1-CD2 4.34Å; F853-F857 HydrophobicContact CE2-CB 4.37Å; F853-F857 AromaticContact CE2-CD2 3.29Å; F853-F857 HydrophobicContact CE2-CD2 3.29Å; F853-F857 AromaticContact CE2-CE2 3.67Å; F853-F857 HydrophobicContact CE2-CE2 3.67Å; F853-F857 AromaticContact CE2-CG 3.99Å; F853-F857 HydrophobicContact CE2-CG 3.99Å; F853-F857 AromaticContact CG-CD2 3.99Å; F853-F857 HydrophobicContact CG-CD2 3.99Å; F853-F857 HydrophobicContact CZ-CB 4Å; F853-F857 AromaticContact CZ-CD2 3.8Å; F853-F857 HydrophobicContact CZ-CD2 3.8Å; F853-F857 HydrophobicContact CZ-CG 4.09Å; F853-F857 PolarHBondContact O-N 3.25Å; F853-F860 HydrophobicContact CE1-CB 4.34Å; F853-F860 AromaticContact CE1-CD1 3.74Å; F853-F860 HydrophobicContact CE1-CD1 3.74Å; F853-F860 HydrophobicContact CE1-CG 4.4Å; F853-F860 HydrophobicContact CZ-CB 4.29Å; F853-F860 AromaticContact CZ-CD1 3.58Å; F853-F860 HydrophobicContact CZ-CD1 3.58Å; F853-F860 HydrophobicContact CZ-CE1 4.2Å; F853-F860 HydrophobicContact CZ-CG 4.11Å; F853-L862 HydrophobicContact CD1-CD1 3.7Å; F853-L862 HydrophobicContact CD1-CD2 3.75Å; F853-L862 HydrophobicContact CD1-CG 3.78Å; F853-L862 HydrophobicContact CE1-CD1 4.14Å; F853-L862 HydrophobicContact CE1-CD2 3.49Å; F853-L862 VanDerWaalsContact CE1-CD2 3.49Å; F853-L862 HydrophobicContact CE1-CG 3.67Å; F853-L862 HydrophobicContact CZ-CD2 4.07Å
854	R	92.3	Very high	87.2	Confident	132 Å²	132	58.5 Å²	58.5	50%	0.498	32%	0.319	S	S	.	.	H	α-helix	trans	-58	-36.4	179.5	-70.9	175.2	-171.5	134.7	4.6	112.6	E850 D851 P858 L862	E850-R854 WeakPolarHBondContact O-CG 3.45Å; E850-R854 PolarHBondContact O-N 3.28Å; E850-R854 VanDerWaalsContact O-N 3.11Å; D851-R854 PolarHBondContact O-N 2.85Å; D851-R854 IonicContact OD1-NH1 2.83Å; D851-R854 PolarHBondContact OD1-NH1 3.09Å; R854-P858 WeakPolarHBondContact O-CA 3.47Å; R854-L862 HydrophobicContact CG-CD1 4.17Å
855	I	92.6	Very high	85	Confident	33 Å²	33	61.4 Å²	61.4	17%	0.169	35%	0.353	C	S	.	.	H	α-helix	trans	-78	-36.2	178.1	-60.4	157.7	0	0	0	111.3	I787 L821 H844 I846 D851 L852 F853	I787-I855 HydrophobicContact CD1-CG2 4.12Å; L821-I855 HydrophobicContact CD2-CB 4.38Å; L821-I855 HydrophobicContact CD2-CD1 4.23Å; L821-I855 HydrophobicContact CD2-CG2 3.81Å; H844-I855 HydrophobicContact CB-CD1 3.63Å; I846-I855 HydrophobicContact CD1-CD1 3.51Å; D851-I855 WeakPolarHBondContact O-CD1 3.42Å; D851-I855 WeakPolarHBondContact O-CG1 3.44Å; D851-I855 PolarHBondContact O-N 3.23Å; L852-I855 PolarHBondContact O-N 3.24Å; F853-I855 PolarHBondContact O-N 3.1Å
856	S	92.5	Very high	84.4	Confident	0 Å²	0	62.6 Å²	62.6	0%	0	36%	0.362	C	S	.	.	H	α-helix	trans	-74.6	-31.4	-178.4	-60.9	0	0	0	0	112.9	R784 L852 F853	R784-S856 PolarHBondContact N-O 3.15Å; L852-S856 WeakPolarHBondContact CD2-OG 3.5Å; L852-S856 VanDerWaalsContact O-CB 3.3Å; L852-S856 WeakPolarHBondContact O-CB 3.29Å; L852-S856 PolarHBondContact O-N 2.94Å; L852-S856 PolarHBondContact O-OG 3.04Å; F853-S856 PolarHBondContact O-N 2.72Å; F853-S856 VanDerWaalsContact O-N 3.1Å
857	F	92.3	Very high	83.8	Confident	7 Å²	7	65.7 Å²	65.7	3%	0.031	38%	0.38	C	S	.	.			trans	-129.2	68.8	-179.4	-55.9	-82.2	0	0	0	110.6	T772 I775 L781 V783 F853 D859 F860	T772-F857 HydrophobicContact CG2-CE2 3.82Å; T772-F857 HydrophobicContact CG2-CZ 4Å; I775-F857 HydrophobicContact CG2-CE2 4.32Å; L781-F857 HydrophobicContact CB-CD1 4.3Å; L781-F857 HydrophobicContact CB-CE1 4.35Å; V783-F857 HydrophobicContact CG2-CE1 3.7Å; V783-F857 HydrophobicContact CG2-CE2 4.28Å; V783-F857 HydrophobicContact CG2-CZ 3.53Å; F853-F857 HydrophobicContact CD1-CD2 4.42Å; F853-F857 AromaticContact CD2-CD2 3.4Å; F853-F857 HydrophobicContact CD2-CD2 3.4Å; F853-F857 VanDerWaalsContact CD2-CD2 3.4Å; F853-F857 AromaticContact CD2-CE2 3.71Å; F853-F857 HydrophobicContact CD2-CE2 3.71Å; F853-F857 HydrophobicContact CD2-CG 4.45Å; F853-F857 HydrophobicContact CE1-CB 4.15Å; F853-F857 HydrophobicContact CE1-CD2 4.34Å; F853-F857 HydrophobicContact CE2-CB 4.37Å; F853-F857 AromaticContact CE2-CD2 3.29Å; F853-F857 HydrophobicContact CE2-CD2 3.29Å; F853-F857 AromaticContact CE2-CE2 3.67Å; F853-F857 HydrophobicContact CE2-CE2 3.67Å; F853-F857 AromaticContact CE2-CG 3.99Å; F853-F857 HydrophobicContact CE2-CG 3.99Å; F853-F857 AromaticContact CG-CD2 3.99Å; F853-F857 HydrophobicContact CG-CD2 3.99Å; F853-F857 HydrophobicContact CZ-CB 4Å; F853-F857 AromaticContact CZ-CD2 3.8Å; F853-F857 HydrophobicContact CZ-CD2 3.8Å; F853-F857 HydrophobicContact CZ-CG 4.09Å; F853-F857 PolarHBondContact O-N 3.25Å; F857-D859 PolarHBondContact O-N 2.68Å; F857-F860 HydrophobicContact CB-CB 4.05Å; F857-F860 PolarHBondContact O-N 2.83Å; F857-F860 VanDerWaalsContact O-N 3.11Å
858	P	85.7	Confident	83.2	Confident	82 Å²	82	62.4 Å²	62.4	53%	0.532	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-27.4	-172.6	25.8	-35.1	0	0	0	113.6	R854 F860	R854-P858 WeakPolarHBondContact O-CA 3.47Å; P858-F860 VanDerWaalsContact C-N 3.32Å
859	D	82.4	Confident	82.5	Confident	166 Å²	166	60 Å²	60	89%	0.888	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.4	-1.3	-178.6	-58.3	-42.3	0	0	0	113.3	F857	F857-D859 PolarHBondContact O-N 2.68Å
860	F	81.8	Confident	81.8	Confident	57 Å²	57	63.8 Å²	63.8	25%	0.25	39%	0.387	C	S	.	.			trans	-104.4	112.6	-179.7	-166.1	-87.2	0	0	0	111.2	V739 L779 L781 F853 F857 P858 L862	V739-F860 HydrophobicContact CG2-CE1 4.06Å; V739-F860 HydrophobicContact CG2-CZ 3.85Å; L779-F860 HydrophobicContact CD1-CD2 4.45Å; L779-F860 HydrophobicContact CD1-CE2 4.33Å; L779-F860 HydrophobicContact CD1-CZ 4.37Å; L779-F860 HydrophobicContact CD2-CE2 4.17Å; L779-F860 HydrophobicContact CD2-CZ 4.04Å; L781-F860 HydrophobicContact CD1-CB 4.48Å; L781-F860 HydrophobicContact CD1-CD2 3.54Å; L781-F860 HydrophobicContact CD1-CE2 4.19Å; L781-F860 HydrophobicContact CD1-CG 4.36Å; F853-F860 HydrophobicContact CE1-CB 4.34Å; F853-F860 AromaticContact CE1-CD1 3.74Å; F853-F860 HydrophobicContact CE1-CD1 3.74Å; F853-F860 HydrophobicContact CE1-CG 4.4Å; F853-F860 HydrophobicContact CZ-CB 4.29Å; F853-F860 AromaticContact CZ-CD1 3.58Å; F853-F860 HydrophobicContact CZ-CD1 3.58Å; F853-F860 HydrophobicContact CZ-CE1 4.2Å; F853-F860 HydrophobicContact CZ-CG 4.11Å; F857-F860 HydrophobicContact CB-CB 4.05Å; F857-F860 PolarHBondContact O-N 2.83Å; F857-F860 VanDerWaalsContact O-N 3.11Å; P858-F860 VanDerWaalsContact C-N 3.32Å; F860-L862 HydrophobicContact CE1-CD2 4.49Å; F860-L862 PolarHBondContact O-N 3.41Å
861	A	74.6	Confident	81	Confident	92 Å²	92	63.9 Å²	63.9	76%	0.76	39%	0.394	S	S	*	.			trans	-78.9	115.4	173.8	0	0	0	0	0	110.3
862	L	69	Low	80.2	Confident	37 Å²	37	64.2 Å²	64.2	19%	0.194	40%	0.399	C	S	.	.	P	Polyproline II helix	trans	-66.8	131	171	-71.7	167.7	0	0	0	109.8	F734 H738 F853 R854 F860	F734-L862 HydrophobicContact CE1-CD2 3.97Å; F734-L862 HydrophobicContact CZ-CD1 4.35Å; F734-L862 HydrophobicContact CZ-CD2 3.81Å; H738-L862 HydrophobicContact CB-CD2 3.71Å; F853-L862 HydrophobicContact CD1-CD1 3.7Å; F853-L862 HydrophobicContact CD1-CD2 3.75Å; F853-L862 HydrophobicContact CD1-CG 3.78Å; F853-L862 HydrophobicContact CE1-CD1 4.14Å; F853-L862 HydrophobicContact CE1-CD2 3.49Å; F853-L862 VanDerWaalsContact CE1-CD2 3.49Å; F853-L862 HydrophobicContact CE1-CG 3.67Å; F853-L862 HydrophobicContact CZ-CD2 4.07Å; R854-L862 HydrophobicContact CG-CD1 4.17Å; F860-L862 HydrophobicContact CE1-CD2 4.49Å; F860-L862 PolarHBondContact O-N 3.41Å
863	A	64.9	Low	79.2	Confident	55 Å²	55	69 Å²	69	46%	0.455	43%	0.429	S	S	.	.	P	Polyproline II helix	trans	-62.3	143.5	161.8	0	0	0	0	0	108.9	H738 A865	H738-A863 PolarHBondContact ND1-O 3.44Å; H738-A863 WeakPolarHBondContact O-CB 3.4Å; A863-A865 PolarHBondContact O-N 3.2Å
864	S	57.5	Low	78	Confident	119 Å²	119	74.8 Å²	74.8	83%	0.832	47%	0.465	S	S	*	.	P	Polyproline II helix	trans	-58.3	123.3	170.2	53.8	0	0	0	0	108.6
865	A	50.9	Low	76.8	Confident	117 Å²	117	69.5 Å²	69.5	97%	0.967	46%	0.462	S	S	*	.			trans	-60.9	0	172.6	0	0	0	0	0	112	N737 A863	N737-A865 HydrophobicContact CB-CB 4.43Å; A863-A865 PolarHBondContact O-N 3.2Å

Retrieved 865 of 865 residues in 646.7 ms (Link to these results)

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