A0A3Q0KCC2_SCHMA Loading...

receptor protein-tyrosine kinase

AlphaFold DB , UniProt , Accession A0A3Q0KCC2, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,100 aa.

						>A0A3Q0KCC2_SCHMA|A0A3Q0KCC2
MDNTLLTTTLATSNVTAVLTNLNRTDVDNFQFPEDEVPKPPLLIVKPLYCHSLPGQFILKCYRREIHFTWIPPDTKIARAMVKFREFHQPKFTTMSDYGWGHSGVKYRNHTITSLKPNRLYEFGLNLIYENSTFDRFPKIGSKDICACKTYPDVPDAPLDLRYHYMQGNQYTLEWTPNNDNGEPIFTYNMKSMPIVSSNSEQPKWDSITPHNLTDKQANITLDTNHQSAFQLRAVNKIGMSDPAYLIIRPPFQKVPDNKVYSSIFQPLNQVTSLLTYSLLSVALLLLFLFLIVLLIYRRRHRDGKSNKHSFFISFNPARRLHSSSGNGSSILGLGSDLTTSGLPLDLATLEPLWNQEVNSLYGISKPDLNNFEQVPQIPAANIRFLRYIGCGAFGKVWEGWFHVRDANGERFEKVALKVRNCKSLTEAEFKREATLMHKYQHTNIVRFFGVSFDSPGQQCLVLEMMDQGNLRDYLHRSRPRIAPDIAANVFAAAAICAAAGRTGGSDGSSVNTSTTSTAPGGGTPSASNVITLTAQLDLPALVNIMRDICHGCCYLEEQHFVHRDIAARNCLVSHNHSSGRIVKLCDFGLARDIYKNDYYRKRNEPKLPVRWMSPEAIRDGLFTTKSDVWAYAVTCWEVLTLGADPFYGRANVDVMNLVIGGHVLGRPENCPEELYNQLLQCWSRFTEMRPTFGQLCKKMDEFIMASQNNQSPFSQPFVVSLPLPKSLQGGSGQQASIYGSNKPHHEPNDLSLCMLSNNCQRITSLDGGRPVSDMDSSLINETNLSQGMSSSKQLLLSSNNSKDLKPSTFHTKSRSYAETVTRGYIVTPGVESISMNKFNYRESLMEKRNYTSSTAPLAGAYECSMSDPSTEQTTLATTSNGTESNRQASVKLKSRSIQGNTENRVDKVTNSTNANLQHRQNQIQPPSSNFCLDTLLRDQNGTKANSYKTLGYHDKSSNHNNKFIALSTTNANNSDQKGSHLVPFNYNHAHSKPLHSKSFNSKSTSMVETMPYSGSGSTNNRSLTAYWLMETGGGVDSLGYERPSLIRTSFPSQTNSVNSHGENTNISTFIDQNCNNDFLERVICNHQSLKKTSTNILTT
					

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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	32.1	Very low	32.5	Very low	228 Å²	228	145.4 Å²	145.4	100%	1.123	83%	0.825	S	S	*	*				0	100.7	0	-65.6	-176.7	-174.2	0	0	106.3
2	D	33.7	Very low	32.1	Very low	145 Å²	145	145.2 Å²	145.2	78%	0.775	83%	0.83	S	S	*	*			trans	-114.6	141.7	-131.2	-56.6	-38.1	0	0	0	116.4
3	N	34	Very low	31.9	Very low	152 Å²	152	140 Å²	140	81%	0.813	81%	0.808	S	S	*	*			trans	77.6	58.6	151.8	-59.5	-17.2	0	0	0	119.8	L5	N3-L5 VanDerWaalsContact C-N 3.33Å; N3-L5 PolarHBondContact O-N 3.49Å
4	T	34.8	Very low	32.1	Very low	143 Å²	143	141.6 Å²	141.6	88%	0.877	81%	0.812	S	S	*	*			trans	-74.5	77.9	140.7	31.5	0	0	0	0	111.5
5	L	33.8	Very low	32	Very low	156 Å²	156	140.9 Å²	140.9	82%	0.817	81%	0.811	S	S	*	*			trans	-176.6	86.5	161.4	-108.6	152.7	0	0	0	112.5	N3	N3-L5 VanDerWaalsContact C-N 3.33Å; N3-L5 PolarHBondContact O-N 3.49Å
6	L	34.1	Very low	31.9	Very low	163 Å²	163	137.9 Å²	137.9	85%	0.853	80%	0.796	S	S	*	*			trans	-162.9	84.6	157.8	-105.5	143.5	0	0	0	111.7
7	T	32.6	Very low	31.9	Very low	93 Å²	93	135.1 Å²	135.1	57%	0.571	79%	0.792	S	S	*	*			trans	40.6	101.1	136.1	57.7	0	0	0	0	119.5	T9	T7-T9 PolarHBondContact O-N 3.49Å; T7-T9 PolarHBondContact O-OG1 3.44Å
8	T	29.7	Very low	31.8	Very low	153 Å²	153	135.4 Å²	135.4	94%	0.939	80%	0.796	S	S	*	*	S	Bend		13.9	50.2	101.3	-30.6	0	0	0	0	119
9	T	29.8	Very low	31.7	Very low	110 Å²	110	136.4 Å²	136.4	68%	0.675	80%	0.796	S	S	*	*			trans	-157.3	79.5	169.4	22.3	0	0	0	0	110.6	T7	T7-T9 PolarHBondContact O-N 3.49Å; T7-T9 PolarHBondContact O-OG1 3.44Å
10	L	31.3	Very low	31.6	Very low	159 Å²	159	135.8 Å²	135.8	83%	0.832	80%	0.795	S	S	*	*			trans	-160.9	51.1	164.9	-108.4	167.8	0	0	0	110.3
11	A	31.2	Very low	31.5	Very low	97 Å²	97	135.9 Å²	135.9	80%	0.802	79%	0.792	S	S	*	*	S	Bend	trans	-127.4	26.1	-177.2	0	0	0	0	0	113.2
12	T	28.2	Very low	31.2	Very low	143 Å²	143	132 Å²	132	88%	0.877	78%	0.775	S	S	*	*	S	Bend	trans	-154.1	58.9	175.6	50.6	0	0	0	0	112
13	S	29.1	Very low	31.3	Very low	78 Å²	78	130.4 Å²	130.4	55%	0.545	77%	0.766	S	S	.	*			trans	-158.9	103.7	173	54.6	0	0	0	0	111.7
14	N	34.6	Very low	31.4	Very low	163 Å²	163	132.9 Å²	132.9	87%	0.872	76%	0.764	S	S	*	*	S	Bend	trans	164.1	15.4	154.6	-86.7	-9.3	0	0	0	114.9
15	V	31.7	Very low	31.7	Very low	131 Å²	131	129.6 Å²	129.6	79%	0.794	75%	0.745	S	S	*	*	S	Bend	trans	-107	22.4	-174.7	-165.4	0	0	0	0	113.1
16	T	29.7	Very low	32	Very low	93 Å²	93	125.8 Å²	125.8	57%	0.571	73%	0.725	S	S	*	*	S	Bend	trans	-139.9	50.8	-170.8	-30.8	0	0	0	0	113.7
17	A	31.7	Very low	32.4	Very low	89 Å²	89	120.4 Å²	120.4	74%	0.736	70%	0.699	S	S	*	*	S	Bend	trans	-141.9	-2.4	-174.5	0	0	0	0	0	118.1
18	V	30.6	Very low	32.8	Very low	141 Å²	141	121.3 Å²	121.3	86%	0.855	70%	0.7	S	S	*	*	S	Bend	trans	-112.2	-0.2	-159.8	-171.2	0	0	0	0	115.7
19	L	30.3	Very low	33.4	Very low	154 Å²	154	120.6 Å²	120.6	81%	0.806	69%	0.691	S	S	*	*	S	Bend	trans	-106.4	-3.1	-174.5	-79.4	170.3	0	0	0	116.9
20	T	29	Very low	34.4	Very low	124 Å²	124	118.7 Å²	118.7	76%	0.761	67%	0.673	S	S	*	*	S	Bend	trans	-146.2	72.6	178.3	52.2	0	0	0	0	111.8
21	N	28.8	Very low	35.3	Very low	138 Å²	138	120 Å²	120	74%	0.738	68%	0.675	S	S	*	*			trans	172.3	85.4	151.8	-91.6	-27.6	0	0	0	110.3	N23	N21-N23 PolarHBondContact O-N 3.02Å
22	L	27.5	Very low	36.4	Very low	146 Å²	146	116.8 Å²	116.8	76%	0.764	64%	0.643	S	S	*	*			trans	-81	68.9	163	-72.6	175.7	0	0	0	109.6	R249	L22-R249 VanDerWaalsContact CD2-NH1 3.34Å
23	N	35.9	Very low	37.7	Very low	112 Å²	112	112.5 Å²	112.5	60%	0.599	62%	0.618	S	S	*	*			trans	-84.7	167.7	168.3	-102.8	-19.9	0	0	0	110.5	N21 T25	N21-N23 PolarHBondContact O-N 3.02Å; N23-T25 PolarHBondContact O-N 3.05Å
24	R	35.8	Very low	38.9	Very low	204 Å²	204	117.9 Å²	117.9	77%	0.77	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	-47.3	-22.8	-179.1	-129.6	171.9	-175.9	152.6	-2.2	115.9	D26 V27 D28	R24-D26 VanDerWaalsContact C-N 3.33Å; R24-D26 PolarHBondContact O-N 3.05Å; R24-V27 PolarHBondContact O-N 2.91Å; R24-D28 PolarHBondContact O-N 3.31Å
25	T	41.4	Very low	39.9	Very low	75 Å²	75	112.7 Å²	112.7	46%	0.46	61%	0.606	S	S	.	*	H	α-helix	trans	-59.9	-27.2	-168.5	48.2	0	0	0	0	116	N23 N29	N23-T25 PolarHBondContact O-N 3.05Å; T25-N29 WeakPolarHBondContact O-CB 3.36Å; T25-N29 VanDerWaalsContact O-CG 3.31Å; T25-N29 PolarHBondContact O-N 2.93Å; T25-N29 PolarHBondContact O-ND2 3.44Å
26	D	38.9	Very low	40.8	Very low	75 Å²	75	115.9 Å²	115.9	40%	0.401	61%	0.612	S	S	.	*	H	α-helix	trans	-71.2	-33.6	175.6	-81.6	4	0	0	0	112.1	R24 R249	R24-D26 VanDerWaalsContact C-N 3.33Å; R24-D26 PolarHBondContact O-N 3.05Å; D26-R249 IonicContact OD2-CZ 3.88Å; D26-R249 IonicContact OD2-NH1 2.68Å; D26-R249 PolarHBondContact OD2-NH1 2.9Å; D26-R249 IonicContact OD2-NH2 3.21Å; D26-R249 PolarHBondContact OD2-NH2 3.13Å
27	V	43.4	Very low	41.9	Very low	51 Å²	51	115 Å²	115	31%	0.309	61%	0.607	S	S	.	*	H	α-helix	trans	-78.7	-39.6	177.9	-177	0	0	0	0	109.9	R24 N29 F30 F32 I247	R24-V27 PolarHBondContact O-N 2.91Å; V27-N29 PolarHBondContact O-N 2.91Å; V27-F30 PolarHBondContact O-N 3.32Å; V27-F32 HydrophobicContact CG1-CE2 4Å; V27-F32 HydrophobicContact CG1-CZ 4.22Å; V27-I247 HydrophobicContact CG2-CD1 4.3Å
28	D	40.1	Very low	42.9	Very low	111 Å²	111	115.7 Å²	115.7	59%	0.594	60%	0.604	S	S	*	*	H	α-helix	trans	-65.1	-20.6	178.2	-59.8	-35.5	0	0	0	112.9	R24	R24-D28 PolarHBondContact O-N 3.31Å
29	N	42.5	Very low	44	Very low	139 Å²	139	118.4 Å²	118.4	74%	0.743	60%	0.604	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.2	-9	177.4	-75.8	-32.2	0	0	0	114.5	T25 V27	T25-N29 WeakPolarHBondContact O-CB 3.36Å; T25-N29 VanDerWaalsContact O-CG 3.31Å; T25-N29 PolarHBondContact O-N 2.93Å; T25-N29 PolarHBondContact O-ND2 3.44Å; V27-N29 PolarHBondContact O-N 2.91Å
30	F	49.8	Very low	45.2	Very low	69 Å²	69	113.8 Å²	113.8	30%	0.303	58%	0.583	S	S	.	*	S	Bend	trans	-98.1	108.6	179	-168.1	-89.3	0	0	0	110.4	V27 F32 M193 I195	V27-F30 PolarHBondContact O-N 3.32Å; F30-F32 AromaticContact CD1-CD1 3.72Å; F30-F32 HydrophobicContact CD1-CD1 3.72Å; F30-F32 AromaticContact CD1-CE1 3.57Å; F30-F32 HydrophobicContact CD1-CE1 3.57Å; F30-F32 HydrophobicContact CD1-CE2 4.42Å; F30-F32 HydrophobicContact CD1-CG 4.21Å; F30-F32 AromaticContact CD1-CZ 3.95Å; F30-F32 HydrophobicContact CD1-CZ 3.95Å; F30-F32 AromaticContact CE1-CD1 3.92Å; F30-F32 HydrophobicContact CE1-CD1 3.92Å; F30-F32 AromaticContact CE1-CE1 3.99Å; F30-F32 HydrophobicContact CE1-CE1 3.99Å; F30-F32 WeakPolarHBondContact O-CD2 3.42Å; F30-F32 PolarHBondContact O-N 2.91Å; F30-F32 VanDerWaalsContact O-N 3.12Å; F30-M193 HydrophobicContact CE1-CE 3.88Å; F30-M193 HydrophobicContact CZ-CE 4.18Å; F30-I195 HydrophobicContact CE2-CG2 4.11Å; F30-I195 HydrophobicContact CZ-CG2 4.4Å
31	Q	51.1	Low	46.6	Very low	188 Å²	188	112.5 Å²	112.5	88%	0.879	58%	0.577	S	S	*	*			trans	-78.7	99.7	-178.6	-165.1	162.6	-1.3	0	0	110.4
32	F	54.8	Low	47.9	Very low	29 Å²	29	114.3 Å²	114.3	13%	0.127	59%	0.586	C	S	.	*	P	Polyproline II helix	trans	-67.1	146.9	177.1	-62.1	-76.6	0	0	0	111.7	V27 F30 E34 W205 A229 Y245	V27-F32 HydrophobicContact CG1-CE2 4Å; V27-F32 HydrophobicContact CG1-CZ 4.22Å; F30-F32 AromaticContact CD1-CD1 3.72Å; F30-F32 HydrophobicContact CD1-CD1 3.72Å; F30-F32 AromaticContact CD1-CE1 3.57Å; F30-F32 HydrophobicContact CD1-CE1 3.57Å; F30-F32 HydrophobicContact CD1-CE2 4.42Å; F30-F32 HydrophobicContact CD1-CG 4.21Å; F30-F32 AromaticContact CD1-CZ 3.95Å; F30-F32 HydrophobicContact CD1-CZ 3.95Å; F30-F32 AromaticContact CE1-CD1 3.92Å; F30-F32 HydrophobicContact CE1-CD1 3.92Å; F30-F32 AromaticContact CE1-CE1 3.99Å; F30-F32 HydrophobicContact CE1-CE1 3.99Å; F30-F32 WeakPolarHBondContact O-CD2 3.42Å; F30-F32 PolarHBondContact O-N 2.91Å; F30-F32 VanDerWaalsContact O-N 3.12Å; F32-E34 PolarHBondContact O-N 3.49Å; F32-W205 HydrophobicContact CB-CZ2 4.26Å; F32-W205 AromaticContact CD1-CH2 3.95Å; F32-W205 HydrophobicContact CD1-CH2 3.95Å; F32-W205 AromaticContact CD1-CZ2 3.74Å; F32-W205 HydrophobicContact CD1-CZ2 3.74Å; F32-W205 HydrophobicContact CE1-CH2 4.36Å; F32-W205 HydrophobicContact CG-CZ2 4.32Å; F32-A229 HydrophobicContact CD1-CB 4.49Å; F32-A229 HydrophobicContact CE1-CB 3.86Å; F32-Y245 HydrophobicContact CB-CE1 4.02Å; F32-Y245 HydrophobicContact CD1-CD1 4.01Å; F32-Y245 HydrophobicContact CD1-CE1 4.04Å; F32-Y245 AromaticContact CD2-CD1 3.91Å; F32-Y245 HydrophobicContact CD2-CD1 3.91Å; F32-Y245 HydrophobicContact CD2-CD2 4.31Å; F32-Y245 AromaticContact CD2-CE1 3.92Å; F32-Y245 HydrophobicContact CD2-CE1 3.92Å; F32-Y245 HydrophobicContact CD2-CE2 4.3Å; F32-Y245 HydrophobicContact CD2-CG 4.11Å; F32-Y245 HydrophobicContact CE1-CD1 4.06Å; F32-Y245 AromaticContact CE2-CD1 3.96Å; F32-Y245 HydrophobicContact CE2-CD1 3.96Å; F32-Y245 HydrophobicContact CE2-CD2 4.33Å; F32-Y245 HydrophobicContact CE2-CE1 4.44Å; F32-Y245 AromaticContact CE2-CG 3.89Å; F32-Y245 HydrophobicContact CE2-CG 3.89Å; F32-Y245 AromaticContact CG-CD1 3.95Å; F32-Y245 HydrophobicContact CG-CD1 3.95Å; F32-Y245 AromaticContact CG-CE1 3.71Å; F32-Y245 HydrophobicContact CG-CE1 3.71Å; F32-Y245 HydrophobicContact CZ-CD1 4.03Å; F32-Y245 HydrophobicContact CZ-CG 4.2Å
33	P	54.1	Low	49.6	Very low	53 Å²	53	110.3 Å²	110.3	34%	0.344	57%	0.565	S	S	.	*	P	Polyproline II helix	trans	-60.5	131.1	169.1	-19.8	31.6	0	0	0	111	D35 M193 W205	P33-D35 PolarHBondContact O-N 2.82Å; P33-M193 HydrophobicContact CG-SD 4.06Å; P33-W205 PolarHBondContact O-NE1 2.83Å
34	E	54.7	Low	50.6	Low	191 Å²	191	112.7 Å²	112.7	89%	0.893	58%	0.576	S	S	*	*	P	Polyproline II helix	trans	-77.3	116.6	172.2	-68.3	-171.3	167.2	0	0	110.2	F32	F32-E34 PolarHBondContact O-N 3.49Å
35	D	55.7	Low	51.7	Low	53 Å²	53	104 Å²	104	28%	0.283	55%	0.546	S	S	.	.	P	Polyproline II helix	trans	-80.4	133.4	164.5	-81.2	-27	0	0	0	109.4	P33 V37 K191	P33-D35 PolarHBondContact O-N 2.82Å; D35-V37 PolarHBondContact O-N 3.34Å; D35-V37 VanDerWaalsContact O-N 3.13Å; D35-K191 IonicContact OD2-NZ 3.1Å; D35-K191 PolarHBondContact OD2-NZ 2.89Å
36	E	50.7	Low	52.3	Low	198 Å²	198	108.7 Å²	108.7	93%	0.925	56%	0.56	S	S	*	*	P	Polyproline II helix	trans	-58	117	172.3	-71.9	-166.8	148.3	0	0	111
37	V	54.1	Low	53.2	Low	76 Å²	76	107.7 Å²	107.7	46%	0.461	56%	0.557	S	S	.	*	P	Polyproline II helix	trans	-84.5	122	178.3	-178.3	0	0	0	0	109.3	D35 K39	D35-V37 PolarHBondContact O-N 3.34Å; D35-V37 VanDerWaalsContact O-N 3.13Å; V37-K39 PolarHBondContact O-N 3.24Å; V37-K39 VanDerWaalsContact O-N 3.09Å
38	P	52.5	Low	54.1	Low	102 Å²	102	109.4 Å²	109.4	66%	0.662	56%	0.564	S	S	*	*	P	Polyproline II helix	trans	-62.5	116.5	174.6	25	-32.6	0	0	0	109.5
39	K	52.6	Low	55.1	Low	198 Å²	198	110.9 Å²	110.9	86%	0.861	56%	0.562	S	S	*	*	P	Polyproline II helix	trans	-62	134.2	177.6	-72.9	178.3	-178.9	170.7	0	109.3	V37	V37-K39 PolarHBondContact O-N 3.24Å; V37-K39 VanDerWaalsContact O-N 3.09Å
40	P	56.4	Low	56.3	Low	57 Å²	57	105 Å²	105	37%	0.37	53%	0.531	S	S	.	.	P	Polyproline II helix	trans	-65.3	153.7	178.3	27.7	-34.9	0	0	0	111.3	L42 I238	P40-L42 PolarHBondContact O-N 2.85Å; P40-I238 HydrophobicContact CB-CG2 4.32Å
41	P	57.9	Low	57.1	Low	97 Å²	97	110.1 Å²	110.1	63%	0.63	56%	0.556	S	S	*	*	P	Polyproline II helix	trans	-60.7	138.3	-176.5	23.4	-33.9	0	0	0	112.3	L43 R63	P41-L43 PolarHBondContact O-N 3.48Å; P41-R63 PolarHBondContact O-NH2 3.37Å
42	L	57	Low	57.9	Low	177 Å²	177	102.7 Å²	102.7	93%	0.927	53%	0.525	S	S	*	.	P	Polyproline II helix	trans	-60.8	125.9	176	-76.1	164.9	0	0	0	110.4	P40	P40-L42 PolarHBondContact O-N 2.85Å
43	L	61.7	Low	58.8	Low	61 Å²	61	101.7 Å²	101.7	32%	0.319	52%	0.521	S	S	.	.	P	Polyproline II helix	trans	-82.3	125.8	176.3	-85.9	153	0	0	0	110.8	P41 V45 R63 Y151	P41-L43 PolarHBondContact O-N 3.48Å; L43-V45 HydrophobicContact CB-CG2 4.27Å; L43-V45 PolarHBondContact O-N 2.82Å; L43-R63 HydrophobicContact CD1-CG 3.56Å; L43-Y151 HydrophobicContact CD1-CD1 4.33Å; L43-Y151 HydrophobicContact CD1-CD2 4.17Å; L43-Y151 HydrophobicContact CD1-CG 3.83Å; L43-Y151 HydrophobicContact CD2-CD1 3.89Å; L43-Y151 HydrophobicContact CD2-CE1 4.06Å; L43-Y151 HydrophobicContact CD2-CG 4.17Å
44	I	56.5	Low	59.9	Low	162 Å²	162	100.4 Å²	100.4	83%	0.831	51%	0.512	S	S	*	.			trans	-79	100.9	167.9	-57.5	177.6	0	0	0	108.2
45	V	59.6	Low	61	Low	23 Å²	23	92.9 Å²	92.9	14%	0.139	49%	0.486	C	S	.	.	P	Polyproline II helix	trans	-89.1	118	-176.3	178.6	0	0	0	0	110.9	L43 K60 C61 Y62 Y151	L43-V45 HydrophobicContact CB-CG2 4.27Å; L43-V45 PolarHBondContact O-N 2.82Å; V45-K60 HydrophobicContact CG1-CB 3.79Å; V45-K60 HydrophobicContact CG1-CG 4.42Å; V45-C61 WeakPolarHBondContact CG1-O 3.48Å; V45-C61 WeakPolarHBondContact CG2-O 3.29Å; V45-Y62 HydrophobicContact CB-CE1 4.29Å; V45-Y62 HydrophobicContact CG2-CD1 3.55Å; V45-Y62 HydrophobicContact CG2-CD2 4.41Å; V45-Y62 HydrophobicContact CG2-CE1 3.58Å; V45-Y62 HydrophobicContact CG2-CE2 4.43Å; V45-Y62 HydrophobicContact CG2-CG 3.98Å; V45-Y151 HydrophobicContact CG2-CE2 4.32Å
46	K	53.9	Low	62.1	Low	173 Å²	173	96.5 Å²	96.5	75%	0.752	50%	0.502	S	S	*	.	P	Polyproline II helix	trans	-75.8	139.6	169.1	-70.9	-174.4	177.9	-179.2	0	110.5
47	P	57.4	Low	63.4	Low	53 Å²	53	87.2 Å²	87.2	34%	0.344	46%	0.458	S	S	.	.	P	Polyproline II helix	trans	-67.3	132	173.9	27	-32.8	0	0	0	111.5	Y49 I58 L59	P47-Y49 HydrophobicContact CG-CE2 4.31Å; P47-I58 HydrophobicContact CB-CG2 3.55Å; P47-L59 WeakPolarHBondContact CA-O 3.35Å
48	L	63.4	Low	64.5	Low	87 Å²	87	85.8 Å²	85.8	46%	0.455	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	124.4	167.8	-81.6	151.2	0	0	0	109.3	L59 C148	L48-L59 HydrophobicContact CB-CB 3.98Å; L48-L59 PolarHBondContact N-O 2.92Å; L48-L59 PolarHBondContact O-N 2.92Å; L48-C148 HydrophobicContact CD1-CB 4.3Å; L48-C148 WeakPolarHBondContact CD1-SG 3.24Å
49	Y	61.5	Low	65.9	Low	143 Å²	143	81 Å²	81	56%	0.561	42%	0.416	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.7	136.7	173.1	-63.3	-80.1	0	0	0	109.9	P47 F57 I58	P47-Y49 HydrophobicContact CG-CE2 4.31Å; Y49-F57 WeakPolarHBondContact CD1-O 3.44Å; Y49-I58 HydrophobicContact CD1-CG1 4.35Å; Y49-I58 HydrophobicContact CE1-CD1 4.41Å; Y49-I58 HydrophobicContact CE1-CG1 3.91Å
50	C	67	Low	67.3	Low	14 Å²	14	75.8 Å²	75.8	10%	0.095	39%	0.393	C	S	.	.			trans	-120.3	102.3	-175.9	178.9	0	0	0	0	110.7	S52 F57 L59 C146	C50-S52 VanDerWaalsContact C-N 3.34Å; C50-S52 PolarHBondContact SG-OG 3.29Å; C50-S52 VanDerWaalsContact SG-OG 3.33Å; C50-F57 HydrophobicContact CB-CB 3.92Å; C50-F57 HydrophobicContact CB-CG 4.39Å; C50-F57 WeakPolarHBondContact O-CD2 3.44Å; C50-L59 HydrophobicContact CB-CD1 4.45Å; C50-C146 HydrophobicContact CB-CB 4.42Å; C50-C146 WeakPolarHBondContact CB-SG 3.41Å; C50-C146 VanDerWaalsContact SG-CA 3.55Å; C50-C146 WeakPolarHBondContact SG-CB 3.44Å; C50-C146 CovalentContact SG-SG 2.02Å; C50-C146 PolarHBondContact SG-SG 3.22Å
51	H	67.1	Low	68.5	Low	178 Å²	178	73.2 Å²	73.2	82%	0.824	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83	-7	-176.7	-56.2	-68.1	0	0	0	114.1
52	S	67.7	Low	69.8	Low	32 Å²	32	71.6 Å²	71.6	22%	0.224	36%	0.358	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.6	-5.4	-175.9	60.2	0	0	0	0	114.7	C50 D144 C146	C50-S52 VanDerWaalsContact C-N 3.34Å; C50-S52 PolarHBondContact SG-OG 3.29Å; C50-S52 VanDerWaalsContact SG-OG 3.33Å; S52-D144 WeakPolarHBondContact CB-O 3.36Å; S52-C146 PolarHBondContact OG-N 2.81Å
53	L	73.3	Confident	71.1	Confident	8 Å²	8	64.6 Å²	64.6	4%	0.042	32%	0.32	C	S	.	.	S	Bend	trans	-112	153.3	173.4	-58.7	-179.4	0	0	0	109	F57 F123 L125 F137 C146	L53-F57 HydrophobicContact CB-CD1 4.29Å; L53-F57 HydrophobicContact CB-CD2 3.94Å; L53-F57 HydrophobicContact CB-CE1 3.67Å; L53-F57 HydrophobicContact CB-CE2 3.34Å; L53-F57 HydrophobicContact CB-CG 4.4Å; L53-F57 HydrophobicContact CB-CZ 3.16Å; L53-F57 HydrophobicContact CD1-CD1 3.95Å; L53-F57 HydrophobicContact CD1-CE1 3.63Å; L53-F57 HydrophobicContact CD1-CZ 4.06Å; L53-F57 HydrophobicContact CG-CE1 4.31Å; L53-F57 HydrophobicContact CG-CZ 4.25Å; L53-F57 VanDerWaalsContact O-CE2 3.24Å; L53-F57 WeakPolarHBondContact O-CE2 3.27Å; L53-F123 HydrophobicContact CD1-CB 4.45Å; L53-L125 HydrophobicContact CD2-CB 4.35Å; L53-F137 HydrophobicContact CD2-CB 3.56Å; L53-C146 HydrophobicContact CD1-CB 3.89Å; L53-C146 WeakPolarHBondContact CD1-SG 3.4Å; L53-C146 HydrophobicContact CD2-CB 4.38Å; L53-C146 HydrophobicContact CG-CB 3.91Å
54	P	76.8	Confident	72.3	Confident	25 Å²	25	66.2 Å²	66.2	16%	0.162	32%	0.322	C	S	.	.	S	Bend	trans	-79.8	128.1	-176	31.8	-37.3	0	0	0	113.1	F57 W70 P73 L125 L127 F137	P54-F57 VanDerWaalsContact C-CE2 3.48Å; P54-F57 VanDerWaalsContact O-CE2 3.24Å; P54-F57 WeakPolarHBondContact O-CE2 3.29Å; P54-F57 WeakPolarHBondContact O-CZ 3.46Å; P54-W70 PolarHBondContact O-NE1 3.37Å; P54-P73 HydrophobicContact CB-CG 4.31Å; P54-L125 HydrophobicContact CG-CD2 3.8Å; P54-L127 HydrophobicContact CG-CD1 3.66Å; P54-F137 HydrophobicContact CB-CZ 4.36Å; P54-F137 HydrophobicContact CG-CD1 4.39Å; P54-F137 HydrophobicContact CG-CD2 3.86Å; P54-F137 HydrophobicContact CG-CE1 4.21Å; P54-F137 HydrophobicContact CG-CE2 3.66Å; P54-F137 HydrophobicContact CG-CG 4.23Å; P54-F137 HydrophobicContact CG-CZ 3.86Å
55	G	78.2	Confident	73.7	Confident	33 Å²	33	62 Å²	62	34%	0.34	30%	0.298	S	S	.	.	S	Bend	trans	105.9	-162.9	-173.7	0	0	0	0	0	112.4	I71	G55-I71 CarbonylContact C-O 3.53Å; G55-I71 VanDerWaalsContact CA-O 3.25Å; G55-I71 WeakPolarHBondContact CA-O 3.41Å
56	Q	79.1	Confident	74.9	Confident	130 Å²	130	60.9 Å²	60.9	61%	0.607	29%	0.292	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.1	140.2	171.1	-56.7	-177.7	-5.6	0	0	110.5	I71	Q56-I71 HydrophobicContact CB-CB 4.09Å; Q56-I71 HydrophobicContact CB-CD1 4.27Å; Q56-I71 HydrophobicContact CB-CG1 4.36Å; Q56-I71 PolarHBondContact N-O 3.39Å; Q56-I71 PolarHBondContact O-N 2.87Å
57	F	77.1	Confident	76.4	Confident	2 Å²	2	55.6 Å²	55.6	1%	0.009	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	135.3	-176.2	-63.4	-97.7	0	0	0	109.8	Y49 C50 L53 P54 F68 T69 W70 L125	Y49-F57 WeakPolarHBondContact CD1-O 3.44Å; C50-F57 HydrophobicContact CB-CB 3.92Å; C50-F57 HydrophobicContact CB-CG 4.39Å; C50-F57 WeakPolarHBondContact O-CD2 3.44Å; L53-F57 HydrophobicContact CB-CD1 4.29Å; L53-F57 HydrophobicContact CB-CD2 3.94Å; L53-F57 HydrophobicContact CB-CE1 3.67Å; L53-F57 HydrophobicContact CB-CE2 3.34Å; L53-F57 HydrophobicContact CB-CG 4.4Å; L53-F57 HydrophobicContact CB-CZ 3.16Å; L53-F57 HydrophobicContact CD1-CD1 3.95Å; L53-F57 HydrophobicContact CD1-CE1 3.63Å; L53-F57 HydrophobicContact CD1-CZ 4.06Å; L53-F57 HydrophobicContact CG-CE1 4.31Å; L53-F57 HydrophobicContact CG-CZ 4.25Å; L53-F57 VanDerWaalsContact O-CE2 3.24Å; L53-F57 WeakPolarHBondContact O-CE2 3.27Å; P54-F57 VanDerWaalsContact C-CE2 3.48Å; P54-F57 VanDerWaalsContact O-CE2 3.24Å; P54-F57 WeakPolarHBondContact O-CE2 3.29Å; P54-F57 WeakPolarHBondContact O-CZ 3.46Å; F57-F68 AromaticContact CD1-CE2 3.68Å; F57-F68 HydrophobicContact CD1-CE2 3.68Å; F57-F68 AromaticContact CD1-CZ 3.74Å; F57-F68 HydrophobicContact CD1-CZ 3.74Å; F57-F68 HydrophobicContact CE1-CE2 4.12Å; F57-F68 AromaticContact CE1-CZ 3.83Å; F57-F68 HydrophobicContact CE1-CZ 3.83Å; F57-T69 WeakPolarHBondContact CA-O 3.31Å; F57-W70 HydrophobicContact CD1-CB 4.22Å; F57-W70 AromaticContact CD1-CD1 3.62Å; F57-W70 HydrophobicContact CD1-CG 4.16Å; F57-W70 HydrophobicContact CE1-CB 4.16Å; F57-W70 AromaticContact CE1-CD1 3.07Å; F57-W70 HydrophobicContact CE1-CD2 4.47Å; F57-W70 AromaticContact CE1-CG 3.67Å; F57-W70 HydrophobicContact CE1-CG 3.67Å; F57-W70 AromaticContact CE1-NE1 3.55Å; F57-W70 AromaticContact CE2-CD1 3.66Å; F57-W70 AromaticContact CE2-NE1 3.76Å; F57-W70 AromaticContact CZ-CD1 3.08Å; F57-W70 HydrophobicContact CZ-CG 4.06Å; F57-W70 AromaticContact CZ-NE1 3.1Å; F57-L125 HydrophobicContact CZ-CD2 4.19Å
58	I	78.6	Confident	77.6	Confident	46 Å²	46	53.2 Å²	53.2	24%	0.236	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	111	173.8	-55	178.2	0	0	0	107.4	P47 Y49 T69	P47-I58 HydrophobicContact CB-CG2 3.55Å; Y49-I58 HydrophobicContact CD1-CG1 4.35Å; Y49-I58 HydrophobicContact CE1-CD1 4.41Å; Y49-I58 HydrophobicContact CE1-CG1 3.91Å; I58-T69 PolarHBondContact N-O 2.91Å; I58-T69 PolarHBondContact O-N 3.42Å
59	L	81.1	Confident	78.5	Confident	2 Å²	2	50.5 Å²	50.5	1%	0.01	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	120.6	174.2	-80.1	160.7	0	0	0	109.2	P47 L48 C50 I66 H67 F68 F123	P47-L59 WeakPolarHBondContact CA-O 3.35Å; L48-L59 HydrophobicContact CB-CB 3.98Å; L48-L59 PolarHBondContact N-O 2.92Å; L48-L59 PolarHBondContact O-N 2.92Å; C50-L59 HydrophobicContact CB-CD1 4.45Å; L59-I66 HydrophobicContact CD2-CG2 3.72Å; L59-H67 WeakPolarHBondContact CA-O 3.39Å; L59-F68 HydrophobicContact CD2-CB 4.24Å; L59-F68 HydrophobicContact CD2-CD2 3.84Å; L59-F68 HydrophobicContact CG-CD2 4.39Å; L59-F123 HydrophobicContact CD1-CD2 4.17Å; L59-F123 HydrophobicContact CD1-CE2 4.36Å; L59-F123 HydrophobicContact CD2-CD1 4.21Å; L59-F123 HydrophobicContact CD2-CD2 4.16Å; L59-F123 HydrophobicContact CD2-CE1 3.82Å; L59-F123 HydrophobicContact CD2-CE2 3.81Å; L59-F123 HydrophobicContact CD2-CG 4.38Å; L59-F123 HydrophobicContact CD2-CZ 3.63Å
60	K	81.8	Confident	79.6	Confident	88 Å²	88	43.7 Å²	43.7	38%	0.383	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	113	167	-61.9	-179.3	-178	-178.2	0	108.3	V45 Y62 I66 H67	V45-K60 HydrophobicContact CG1-CB 3.79Å; V45-K60 HydrophobicContact CG1-CG 4.42Å; K60-Y62 HydrophobicContact CB-CE2 3.93Å; K60-I66 WeakPolarHBondContact O-CA 3.37Å; K60-H67 HydrophobicContact CB-CB 4.25Å; K60-H67 PolarHBondContact N-O 2.84Å; K60-H67 PolarHBondContact O-N 3.34Å
61	C	82.7	Confident	80.3	Confident	3 Å²	3	45.7 Å²	45.7	2%	0.02	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	132.9	-175.8	-49.9	0	0	0	0	110.6	V45 I66 C148 Y151	V45-C61 WeakPolarHBondContact CG1-O 3.48Å; V45-C61 WeakPolarHBondContact CG2-O 3.29Å; C61-I66 HydrophobicContact CB-CG1 3.94Å; C61-C148 HydrophobicContact CB-CB 4.32Å; C61-C148 WeakPolarHBondContact CB-SG 3.5Å; C61-C148 WeakPolarHBondContact SG-CB 3.23Å; C61-C148 CovalentContact SG-SG 2Å; C61-C148 PolarHBondContact SG-SG 3.27Å; C61-Y151 WeakPolarHBondContact O-CD2 3.29Å; C61-Y151 WeakPolarHBondContact O-CE2 3.44Å
62	Y	84.4	Confident	80.9	Confident	63 Å²	63	38.1 Å²	38.1	25%	0.247	19%	0.19	C	C	.	.			trans	-114.8	-155.1	179	-59.7	-101.1	0	0	0	108.1	V45 K60 E65 H67 T150 Y151	V45-Y62 HydrophobicContact CB-CE1 4.29Å; V45-Y62 HydrophobicContact CG2-CD1 3.55Å; V45-Y62 HydrophobicContact CG2-CD2 4.41Å; V45-Y62 HydrophobicContact CG2-CE1 3.58Å; V45-Y62 HydrophobicContact CG2-CE2 4.43Å; V45-Y62 HydrophobicContact CG2-CG 3.98Å; K60-Y62 HydrophobicContact CB-CE2 3.93Å; Y62-E65 HydrophobicContact CD2-CG 3.82Å; Y62-E65 HydrophobicContact CG-CG 3.86Å; Y62-E65 PolarHBondContact N-O 3.33Å; Y62-H67 AromaticContact CE2-CD2 3.91Å; Y62-T150 WeakPolarHBondContact O-CA 3.39Å; Y62-T150 WeakPolarHBondContact O-CB 3.33Å; Y62-Y151 PolarHBondContact O-N 3.49Å
63	R	84.1	Confident	81.4	Confident	30 Å²	30	38.5 Å²	38.5	11%	0.113	19%	0.191	C	C	.	.	S	Bend	trans	-79.4	-47.9	-178.2	-55.8	-173.9	-174.9	-172	-3.1	113.2	P41 L43 P117 T150 P152 D153	P41-R63 PolarHBondContact O-NH2 3.37Å; L43-R63 HydrophobicContact CD1-CG 3.56Å; R63-P117 VanDerWaalsContact O-CA 3.26Å; R63-P117 WeakPolarHBondContact O-CA 3.42Å; R63-T150 WeakPolarHBondContact O-CB 3.4Å; R63-P152 WeakPolarHBondContact CD-O 3.47Å; R63-P152 WeakPolarHBondContact CG-O 3.35Å; R63-D153 HydrophobicContact CB-CB 4.23Å; R63-D153 WeakPolarHBondContact CD-OD1 3.36Å; R63-D153 IonicContact CZ-OD1 3.6Å; R63-D153 IonicContact NE-OD1 2.73Å; R63-D153 IonicContact NH1-OD1 2.67Å; R63-D153 PolarHBondContact NH1-OD1 2.92Å
64	R	86.4	Confident	81.4	Confident	95 Å²	95	46.6 Å²	46.6	36%	0.358	24%	0.235	S	C	.	.	S	Bend	trans	-125.9	13.5	-178.3	-59.6	-168.5	-178	-127.8	2.9	112.9	T113 S114 L115 D153 D156 N181	R64-T113 CarbonylContact O-C 3.53Å; R64-S114 PolarHBondContact O-N 2.86Å; R64-L115 WeakPolarHBondContact CA-O 3.44Å; R64-L115 WeakPolarHBondContact CB-O 3.39Å; R64-L115 WeakPolarHBondContact CG-O 3.45Å; R64-L115 PolarHBondContact O-N 3.35Å; R64-D153 IonicContact CZ-OD2 2.72Å; R64-D153 IonicContact NE-OD2 2.63Å; R64-D153 PolarHBondContact NE-OD2 2.83Å; R64-D153 IonicContact NH2-OD2 3.79Å; R64-D156 IonicContact CZ-OD1 3.94Å; R64-D156 IonicContact NH1-OD1 2.73Å; R64-D156 IonicContact NH2-OD1 3.84Å; R64-D156 PolarHBondContact NH2-OD1 3.38Å; R64-N181 PolarHBondContact NH2-ND2 3.25Å; R64-N181 VanDerWaalsContact NH2-ND2 3.17Å
65	E	86.7	Confident	81.3	Confident	73 Å²	73	48.6 Å²	48.6	34%	0.341	25%	0.247	S	C	.	.			trans	-144.5	152	178.5	62.5	-172.3	176.9	0	0	111.9	Y62 H67 I112	Y62-E65 HydrophobicContact CD2-CG 3.82Å; Y62-E65 HydrophobicContact CG-CG 3.86Å; Y62-E65 PolarHBondContact N-O 3.33Å; E65-H67 IonicContact OE2-NE2 3.82Å; E65-I112 CarbonylContact C-O 3.46Å; E65-I112 WeakPolarHBondContact CA-O 3.33Å; E65-I112 WeakPolarHBondContact CB-O 3.41Å
66	I	84.8	Confident	81.3	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	124.2	171	-62.8	170.8	0	0	0	108.3	L59 K60 C61 I112 L115 Y121 F123 C148 T150	L59-I66 HydrophobicContact CD2-CG2 3.72Å; K60-I66 WeakPolarHBondContact O-CA 3.37Å; C61-I66 HydrophobicContact CB-CG1 3.94Å; I66-I112 PolarHBondContact N-O 3.29Å; I66-I112 PolarHBondContact O-N 3.31Å; I66-L115 HydrophobicContact CB-CD1 4.03Å; I66-L115 HydrophobicContact CD1-CD1 3.59Å; I66-L115 HydrophobicContact CG1-CD1 3.54Å; I66-Y121 HydrophobicContact CD1-CD2 4.14Å; I66-Y121 HydrophobicContact CD1-CG 4.37Å; I66-F123 HydrophobicContact CB-CZ 4.42Å; I66-F123 HydrophobicContact CD1-CE2 4.29Å; I66-F123 HydrophobicContact CD1-CZ 3.84Å; I66-F123 HydrophobicContact CG2-CE1 4.42Å; I66-F123 HydrophobicContact CG2-CZ 3.8Å; I66-C148 HydrophobicContact CD1-CB 4.49Å; I66-T150 HydrophobicContact CD1-CG2 4.14Å; I66-T150 HydrophobicContact CG1-CG2 4.22Å
67	H	84.8	Confident	81.2	Confident	63 Å²	63	48 Å²	48	29%	0.292	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	124.1	172	-67.2	-150.2	0	0	0	108.2	L59 K60 Y62 E65 T111	L59-H67 WeakPolarHBondContact CA-O 3.39Å; K60-H67 HydrophobicContact CB-CB 4.25Å; K60-H67 PolarHBondContact N-O 2.84Å; K60-H67 PolarHBondContact O-N 3.34Å; Y62-H67 AromaticContact CE2-CD2 3.91Å; E65-H67 IonicContact OE2-NE2 3.82Å; H67-T111 VanDerWaalsContact CD2-CG2 3.48Å; H67-T111 WeakPolarHBondContact CD2-CG2 2.99Å; H67-T111 PolarHBondContact CD2-OG1 2.92Å; H67-T111 WeakPolarHBondContact NE2-CG2 3.47Å; H67-T111 PolarHBondContact NE2-OG1 3.19Å
68	F	82.8	Confident	81.3	Confident	3 Å²	3	49.6 Å²	49.6	1%	0.013	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	116.4	-177.9	169.6	-86.4	0	0	0	108.5	F57 L59 W70 V82 N109 H110 F123	F57-F68 AromaticContact CD1-CE2 3.68Å; F57-F68 HydrophobicContact CD1-CE2 3.68Å; F57-F68 AromaticContact CD1-CZ 3.74Å; F57-F68 HydrophobicContact CD1-CZ 3.74Å; F57-F68 HydrophobicContact CE1-CE2 4.12Å; F57-F68 AromaticContact CE1-CZ 3.83Å; F57-F68 HydrophobicContact CE1-CZ 3.83Å; L59-F68 HydrophobicContact CD2-CB 4.24Å; L59-F68 HydrophobicContact CD2-CD2 3.84Å; L59-F68 HydrophobicContact CG-CD2 4.39Å; F68-W70 HydrophobicContact CD1-CB 4.48Å; F68-W70 HydrophobicContact CE1-CB 3.56Å; F68-W70 HydrophobicContact CZ-CB 3.78Å; F68-W70 HydrophobicContact CZ-CG 4.42Å; F68-V82 HydrophobicContact CD1-CG1 4.02Å; F68-V82 HydrophobicContact CE1-CB 4.28Å; F68-V82 HydrophobicContact CE1-CG1 3.52Å; F68-V82 HydrophobicContact CE1-CG2 3.71Å; F68-V82 HydrophobicContact CE2-CG1 4.11Å; F68-V82 HydrophobicContact CZ-CG1 3.57Å; F68-V82 HydrophobicContact CZ-CG2 4.14Å; F68-N109 CarbonylContact O-C 3.5Å; F68-N109 WeakPolarHBondContact O-CA 3.31Å; F68-H110 HydrophobicContact CD1-CB 4.26Å; F68-H110 AromaticContact CD1-CD2 3.78Å; F68-H110 PolarHBondContact N-O 3.42Å; F68-H110 PolarHBondContact O-N 3.45Å; F68-F123 HydrophobicContact CD2-CD1 4.04Å; F68-F123 HydrophobicContact CD2-CE1 4.35Å; F68-F123 HydrophobicContact CE2-CD1 4.41Å
69	T	83.3	Confident	81.6	Confident	29 Å²	29	52.7 Å²	52.7	18%	0.178	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	129.6	170.5	-62.7	0	0	0	0	108.8	F57 I58 Y107 R108 N109	F57-T69 WeakPolarHBondContact CA-O 3.31Å; I58-T69 PolarHBondContact N-O 2.91Å; I58-T69 PolarHBondContact O-N 3.42Å; T69-Y107 HydrophobicContact CG2-CD2 4.24Å; T69-R108 WeakPolarHBondContact CA-O 3.39Å; T69-N109 WeakPolarHBondContact CB-OD1 3.45Å; T69-N109 WeakPolarHBondContact CG2-OD1 3.48Å; T69-N109 PolarHBondContact OG1-OD1 2.94Å
70	W	83.6	Confident	81.6	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	132.1	175.8	175.4	50.8	0	0	0	111.5	P54 F57 F68 P72 I77 A80 Y98 Y107 R108 L125 L127	P54-W70 PolarHBondContact O-NE1 3.37Å; F57-W70 HydrophobicContact CD1-CB 4.22Å; F57-W70 AromaticContact CD1-CD1 3.62Å; F57-W70 HydrophobicContact CD1-CG 4.16Å; F57-W70 HydrophobicContact CE1-CB 4.16Å; F57-W70 AromaticContact CE1-CD1 3.07Å; F57-W70 HydrophobicContact CE1-CD2 4.47Å; F57-W70 AromaticContact CE1-CG 3.67Å; F57-W70 HydrophobicContact CE1-CG 3.67Å; F57-W70 AromaticContact CE1-NE1 3.55Å; F57-W70 AromaticContact CE2-CD1 3.66Å; F57-W70 AromaticContact CE2-NE1 3.76Å; F57-W70 AromaticContact CZ-CD1 3.08Å; F57-W70 HydrophobicContact CZ-CG 4.06Å; F57-W70 AromaticContact CZ-NE1 3.1Å; F68-W70 HydrophobicContact CD1-CB 4.48Å; F68-W70 HydrophobicContact CE1-CB 3.56Å; F68-W70 HydrophobicContact CZ-CB 3.78Å; F68-W70 HydrophobicContact CZ-CG 4.42Å; W70-P72 HydrophobicContact CH2-CB 3.81Å; W70-P72 HydrophobicContact CH2-CG 4.45Å; W70-P72 HydrophobicContact CZ2-CB 3.58Å; W70-P72 HydrophobicContact CZ3-CB 4.39Å; W70-I77 HydrophobicContact CH2-CD1 4.21Å; W70-I77 HydrophobicContact CZ2-CD1 4.31Å; W70-A80 HydrophobicContact CH2-CB 3.55Å; W70-A80 HydrophobicContact CZ3-CB 3.42Å; W70-A80 VanDerWaalsContact CZ3-CB 3.42Å; W70-Y98 HydrophobicContact CZ3-CE2 4.22Å; W70-Y107 CarbonylContact O-C 3.59Å; W70-Y107 WeakPolarHBondContact O-CA 3.19Å; W70-R108 PolarHBondContact N-O 3.35Å; W70-R108 PolarHBondContact O-N 3.32Å; W70-L125 HydrophobicContact CH2-CD1 4.5Å; W70-L125 HydrophobicContact CH2-CD2 4.37Å; W70-L125 HydrophobicContact CZ2-CD2 3.74Å; W70-L127 HydrophobicContact CH2-CD2 3.71Å; W70-L127 HydrophobicContact CZ2-CD2 4.02Å
71	I	82.8	Confident	81.8	Confident	57 Å²	57	49.5 Å²	49.5	29%	0.292	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	109.5	171.6	-47.3	-175.4	0	0	0	105.8	G55 Q56	G55-I71 CarbonylContact C-O 3.53Å; G55-I71 VanDerWaalsContact CA-O 3.25Å; G55-I71 WeakPolarHBondContact CA-O 3.41Å; Q56-I71 HydrophobicContact CB-CB 4.09Å; Q56-I71 HydrophobicContact CB-CD1 4.27Å; Q56-I71 HydrophobicContact CB-CG1 4.36Å; Q56-I71 PolarHBondContact N-O 3.39Å; Q56-I71 PolarHBondContact O-N 2.87Å
72	P	78.3	Confident	81.8	Confident	18 Å²	18	49.3 Å²	49.3	12%	0.117	24%	0.241	C	C	.	.			trans	-65.5	156.7	-180	17.4	-21.1	0	0	0	112.2	W70 I77 W100	W70-P72 HydrophobicContact CH2-CB 3.81Å; W70-P72 HydrophobicContact CH2-CG 4.45Å; W70-P72 HydrophobicContact CZ2-CB 3.58Å; W70-P72 HydrophobicContact CZ3-CB 4.39Å; P72-I77 HydrophobicContact CB-CD1 4Å; P72-W100 HydrophobicContact CB-CZ2 4.47Å; P72-W100 HydrophobicContact CG-CH2 3.76Å; P72-W100 HydrophobicContact CG-CZ2 3.24Å
73	P	78.3	Confident	81.8	Confident	40 Å²	40	48 Å²	48	26%	0.26	24%	0.237	S	C	.	.			trans	-71.2	161.3	168.5	33.1	-35.2	0	0	0	110.9	P54 T75 I77	P54-P73 HydrophobicContact CB-CG 4.31Å; P73-T75 PolarHBondContact O-N 2.83Å; P73-I77 HydrophobicContact CG-CD1 4.4Å
74	D	74.3	Confident	82	Confident	179 Å²	179	48 Å²	48	96%	0.957	24%	0.237	S	C	*	.	S	Bend	trans	-66.5	14.3	-176.6	-58	-51.6	0	0	0	115.6
75	T	74.3	Confident	82	Confident	67 Å²	67	46.3 Å²	46.3	41%	0.411	23%	0.231	S	C	.	.	S	Bend	trans	-81	146.9	175.7	57.9	0	0	0	0	112	P73 I77	P73-T75 PolarHBondContact O-N 2.83Å; T75-I77 PolarHBondContact O-N 3.43Å
76	K	77.5	Confident	82	Confident	149 Å²	149	44.1 Å²	44.1	65%	0.648	22%	0.221	S	C	*	.			trans	-71	84.5	176.2	-60.1	-157.9	-173.8	-175.4	0	113.3	E130	K76-E130 HydrophobicContact CB-CB 4.39Å; K76-E130 HydrophobicContact CB-CG 4.06Å; K76-E130 WeakPolarHBondContact CD-OE2 3.25Å; K76-E130 IonicContact NZ-OE2 3.92Å; K76-E130 PolarHBondContact O-N 3.18Å; K76-E130 VanDerWaalsContact O-N 3.08Å
77	I	77.3	Confident	81.8	Confident	1 Å²	1	47.9 Å²	47.9	1%	0.005	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	132.9	174.8	-60.4	164.3	0	0	0	108.8	W70 P72 P73 T75 R79 W100 L127 I128 Y129	W70-I77 HydrophobicContact CH2-CD1 4.21Å; W70-I77 HydrophobicContact CZ2-CD1 4.31Å; P72-I77 HydrophobicContact CB-CD1 4Å; P73-I77 HydrophobicContact CG-CD1 4.4Å; T75-I77 PolarHBondContact O-N 3.43Å; I77-R79 WeakPolarHBondContact CG2-O 3.45Å; I77-W100 HydrophobicContact CB-CB 4.24Å; I77-W100 HydrophobicContact CB-CG 4.22Å; I77-W100 HydrophobicContact CG2-CB 3.88Å; I77-W100 HydrophobicContact CG2-CG 4.25Å; I77-W100 CarbonylContact O-C 3.58Å; I77-W100 VanDerWaalsContact O-C 3.28Å; I77-W100 WeakPolarHBondContact O-CB 3.32Å; I77-W100 VanDerWaalsContact O-O 3.09Å; I77-L127 HydrophobicContact CD1-CD1 3.94Å; I77-L127 HydrophobicContact CD1-CD2 4.17Å; I77-L127 HydrophobicContact CG1-CD1 4.39Å; I77-L127 HydrophobicContact CG2-CD2 4.05Å; I77-I128 WeakPolarHBondContact CG2-O 3.18Å; I77-Y129 HydrophobicContact CG1-CD1 4.03Å; I77-Y129 HydrophobicContact CG1-CE1 3.87Å
78	A	80.3	Confident	81.2	Confident	36 Å²	36	52.4 Å²	52.4	30%	0.298	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	-26.2	175.9	0	0	0	0	0	113.7	G99 W100 I128 E130	A78-G99 WeakPolarHBondContact O-CA 3.29Å; A78-W100 CarbonylContact C-O 3.49Å; A78-W100 VanDerWaalsContact C-O 3.24Å; A78-W100 WeakPolarHBondContact CA-O 3.39Å; A78-W100 PolarHBondContact O-N 2.89Å; A78-I128 WeakPolarHBondContact CA-O 3.48Å; A78-I128 PolarHBondContact N-O 3.25Å; A78-E130 HydrophobicContact CB-CG 4.2Å
79	R	83.5	Confident	81	Confident	110 Å²	110	56.2 Å²	56.2	42%	0.415	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.6	141.5	177.1	-157.9	174.5	176.3	142.8	-6.9	110.8	I77 D97 Y98 I128	I77-R79 WeakPolarHBondContact CG2-O 3.45Å; R79-D97 IonicContact CZ-OD1 3.1Å; R79-D97 IonicContact CZ-OD2 3.82Å; R79-D97 IonicContact NE-OD1 3.82Å; R79-D97 PolarHBondContact NE-OD1 2.93Å; R79-D97 IonicContact NE-OD2 2.97Å; R79-D97 VanDerWaalsContact NH2-CG 3.31Å; R79-D97 IonicContact NH2-OD1 3.32Å; R79-D97 PolarHBondContact NH2-OD1 3.27Å; R79-D97 IonicContact NH2-OD2 3.74Å; R79-D97 PolarHBondContact NH2-OD2 2.87Å; R79-Y98 WeakPolarHBondContact CA-O 3.43Å; R79-Y98 VanDerWaalsContact CG-O 3.27Å; R79-Y98 WeakPolarHBondContact CG-O 3.12Å; R79-I128 HydrophobicContact CB-CB 3.98Å; R79-I128 HydrophobicContact CB-CD1 4.2Å; R79-I128 HydrophobicContact CB-CG1 4.33Å; R79-I128 PolarHBondContact N-O 3.05Å; R79-I128 PolarHBondContact O-N 3.29Å
80	A	81.9	Confident	80.6	Confident	0 Å²	0	60.9 Å²	60.9	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	132.1	175.3	0	0	0	0	0	110.8	W70 Y98 L127	W70-A80 HydrophobicContact CH2-CB 3.55Å; W70-A80 HydrophobicContact CZ3-CB 3.42Å; W70-A80 VanDerWaalsContact CZ3-CB 3.42Å; A80-Y98 HydrophobicContact CB-CD2 4.42Å; A80-Y98 HydrophobicContact CB-CE2 3.87Å; A80-Y98 PolarHBondContact N-O 3.17Å; A80-Y98 PolarHBondContact O-N 2.68Å; A80-Y98 VanDerWaalsContact O-N 3.11Å; A80-L127 HydrophobicContact CB-CD2 3.78Å
81	M	84.7	Confident	80.3	Confident	23 Å²	23	68.5 Å²	68.5	11%	0.113	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	107.8	175.4	-69.5	163.5	-94.8	0	0	109.9	T94 S96 D97 L125 N126 I128 F134	M81-T94 HydrophobicContact CB-CG2 4.35Å; M81-S96 CarbonylContact C-O 3.53Å; M81-S96 VanDerWaalsContact CA-O 3.26Å; M81-S96 WeakPolarHBondContact CA-O 3.24Å; M81-D97 HydrophobicContact CG-CB 3.93Å; M81-D97 WeakPolarHBondContact CG-OD1 3.31Å; M81-L125 WeakPolarHBondContact O-CA 3.3Å; M81-N126 HydrophobicContact CB-CB 4.16Å; M81-N126 HydrophobicContact CE-CB 3.82Å; M81-N126 PolarHBondContact N-O 2.85Å; M81-N126 PolarHBondContact O-N 3.45Å; M81-N126 HydrophobicContact SD-CB 4.29Å; M81-I128 HydrophobicContact CE-CD1 4.04Å; M81-I128 HydrophobicContact CE-CG1 4.2Å; M81-F134 HydrophobicContact CE-CE2 4.35Å
82	V	83.2	Confident	80.3	Confident	0 Å²	0	68.7 Å²	68.7	0%	0	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	136.1	173.1	-172.7	0	0	0	0	108.7	F68 M95 S96 Y98 L125	F68-V82 HydrophobicContact CD1-CG1 4.02Å; F68-V82 HydrophobicContact CE1-CB 4.28Å; F68-V82 HydrophobicContact CE1-CG1 3.52Å; F68-V82 HydrophobicContact CE1-CG2 3.71Å; F68-V82 HydrophobicContact CE2-CG1 4.11Å; F68-V82 HydrophobicContact CZ-CG1 3.57Å; F68-V82 HydrophobicContact CZ-CG2 4.14Å; V82-M95 HydrophobicContact CB-CB 4.36Å; V82-M95 HydrophobicContact CG1-CB 4.42Å; V82-M95 HydrophobicContact CG1-CE 3.8Å; V82-M95 HydrophobicContact CG1-SD 4Å; V82-M95 WeakPolarHBondContact O-CB 3.39Å; V82-M95 PolarHBondContact O-N 2.82Å; V82-S96 PolarHBondContact N-O 3.4Å; V82-S96 PolarHBondContact O-N 2.89Å; V82-Y98 HydrophobicContact CG2-CE1 4.4Å; V82-L125 HydrophobicContact CG2-CD1 4.03Å
83	K	85.9	Confident	80.5	Confident	36 Å²	36	71.4 Å²	71.4	16%	0.157	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	150.9	-175.9	-55.2	-164.7	170.3	-177.5	0	111.4	F92 T93 T94 F123 G124 N126	K83-F92 HydrophobicContact CB-CB 4.16Å; K83-F92 HydrophobicContact CB-CD1 3.83Å; K83-F92 HydrophobicContact CB-CG 4.33Å; K83-F92 HydrophobicContact CD-CB 4.37Å; K83-T93 CarbonylContact C-O 3.52Å; K83-T93 VanDerWaalsContact CA-O 3.27Å; K83-T93 WeakPolarHBondContact CA-O 3.39Å; K83-T94 WeakPolarHBondContact CE-OG1 3.49Å; K83-F123 CarbonylContact O-C 3.49Å; K83-F123 WeakPolarHBondContact O-CA 3.14Å; K83-G124 PolarHBondContact N-O 3.37Å; K83-G124 PolarHBondContact O-N 2.82Å; K83-N126 PolarHBondContact NZ-ND2 2.89Å
84	F	87.3	Confident	80.7	Confident	30 Å²	30	72.6 Å²	72.6	13%	0.132	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	162.8	173.8	76.4	-73.4	0	0	0	112.1	T93 M95 I112 L115 Y121 E122 F123	F84-T93 HydrophobicContact CE1-CG2 3.82Å; F84-T93 HydrophobicContact CZ-CG2 4.22Å; F84-T93 PolarHBondContact N-O 3.43Å; F84-T93 PolarHBondContact O-N 3.33Å; F84-M95 HydrophobicContact CB-CE 4.42Å; F84-M95 HydrophobicContact CD1-CB 4.08Å; F84-M95 HydrophobicContact CD1-CE 4.14Å; F84-M95 HydrophobicContact CE1-CB 4.37Å; F84-I112 HydrophobicContact CB-CD1 4.26Å; F84-I112 HydrophobicContact CD1-CD1 4.07Å; F84-I112 HydrophobicContact CD2-CD1 3.84Å; F84-I112 HydrophobicContact CE1-CD1 4.37Å; F84-I112 HydrophobicContact CE1-CG2 4.39Å; F84-I112 HydrophobicContact CE2-CD1 4.16Å; F84-I112 HydrophobicContact CE2-CG2 4.09Å; F84-I112 HydrophobicContact CG-CD1 3.79Å; F84-I112 HydrophobicContact CZ-CD1 4.41Å; F84-I112 HydrophobicContact CZ-CG2 3.86Å; F84-L115 HydrophobicContact CE2-CD2 4.01Å; F84-Y121 HydrophobicContact CD2-CD1 4.22Å; F84-E122 CarbonylContact C-O 3.24Å; F84-E122 WeakPolarHBondContact CA-O 3.46Å; F84-F123 HydrophobicContact CB-CD1 4.15Å; F84-F123 HydrophobicContact CB-CE1 4.19Å
85	R	86.4	Confident	80.7	Confident	58 Å²	58	66.2 Å²	66.2	22%	0.219	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.8	154.5	170	59.6	178.1	-178.9	175.2	-4.6	111.4	Q89 K91 F92 Y121 E122	R85-Q89 VanDerWaalsContact CD-O 3.26Å; R85-Q89 WeakPolarHBondContact CD-O 3.5Å; R85-Q89 PolarHBondContact NH1-O 2.72Å; R85-K91 WeakPolarHBondContact CB-O 3.26Å; R85-F92 HydrophobicContact CB-CD1 4.24Å; R85-F92 HydrophobicContact CG-CD1 3.94Å; R85-F92 HydrophobicContact CG-CD2 4.47Å; R85-F92 HydrophobicContact CG-CE1 3.75Å; R85-F92 HydrophobicContact CG-CE2 4.31Å; R85-F92 HydrophobicContact CG-CG 4.3Å; R85-F92 HydrophobicContact CG-CZ 3.95Å; R85-F92 VanDerWaalsContact NE-CE2 3.31Å; R85-Y121 CarbonylContact O-C 3.57Å; R85-Y121 VanDerWaalsContact O-CA 3.24Å; R85-Y121 WeakPolarHBondContact O-CA 3.2Å; R85-E122 HydrophobicContact CG-CB 3.99Å; R85-E122 IonicContact CZ-OE2 2.74Å; R85-E122 PolarHBondContact N-O 2.85Å; R85-E122 IonicContact NE-OE2 3.62Å; R85-E122 PolarHBondContact NE-OE2 3.03Å; R85-E122 IonicContact NH2-OE1 3.56Å; R85-E122 IonicContact NH2-OE2 2.75Å; R85-E122 PolarHBondContact NH2-OE2 3.23Å; R85-E122 PolarHBondContact O-N 3.38Å
86	E	87	Confident	80.6	Confident	27 Å²	27	64 Å²	64	13%	0.126	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66	139	162.2	-171.5	176.4	-169	0	0	108.1	Q89 K116 R119 Y121	E86-Q89 HydrophobicContact CB-CG 4Å; E86-Q89 WeakPolarHBondContact O-CB 3.28Å; E86-Q89 PolarHBondContact O-N 3.46Å; E86-Q89 PolarHBondContact OE2-NE2 3.11Å; E86-K116 IonicContact OE1-NZ 2.83Å; E86-K116 PolarHBondContact OE1-NZ 2.98Å; E86-K116 IonicContact OE2-NZ 2.66Å; E86-K116 PolarHBondContact OE2-NZ 3.32Å; E86-R119 VanDerWaalsContact OE1-CD 3.27Å; E86-R119 WeakPolarHBondContact OE1-CD 3.27Å; E86-R119 WeakPolarHBondContact OE1-CG 3.38Å; E86-R119 IonicContact OE1-NE 3.57Å; E86-R119 PolarHBondContact OE1-NE 2.89Å; E86-Y121 HydrophobicContact CB-CD1 4.18Å; E86-Y121 HydrophobicContact CB-CE1 3.8Å; E86-Y121 HydrophobicContact CG-CE1 4.31Å
87	F	80	Confident	80.6	Confident	80 Å²	80	60.3 Å²	60.3	35%	0.351	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.7	141.2	-179.1	-169.2	-122	0	0	0	110.6	Q89 L120 E122	F87-Q89 PolarHBondContact O-N 3.13Å; F87-L120 HydrophobicContact CB-CB 3.85Å; F87-L120 HydrophobicContact CB-CD2 4.13Å; F87-L120 HydrophobicContact CB-CG 4.07Å; F87-L120 WeakPolarHBondContact CB-O 3.36Å; F87-L120 HydrophobicContact CD1-CD2 3.87Å; F87-L120 HydrophobicContact CD2-CD2 3.82Å; F87-L120 HydrophobicContact CD2-CG 4.41Å; F87-L120 HydrophobicContact CE1-CD2 4.11Å; F87-L120 HydrophobicContact CE2-CD2 4.11Å; F87-L120 HydrophobicContact CG-CB 4.33Å; F87-L120 HydrophobicContact CG-CD2 3.71Å; F87-L120 HydrophobicContact CG-CG 4.2Å; F87-L120 HydrophobicContact CZ-CD2 4.25Å; F87-L120 PolarHBondContact N-O 3.14Å; F87-E122 HydrophobicContact CD2-CG 3.83Å; F87-E122 WeakPolarHBondContact CD2-OE1 3.45Å; F87-E122 VanDerWaalsContact CE2-OE1 3.24Å; F87-E122 WeakPolarHBondContact CE2-OE1 3.44Å
88	H	71.9	Confident	80.4	Confident	158 Å²	158	61.3 Å²	61.3	73%	0.731	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.8	-6.8	-172	-61.4	9.7	0	0	0	117
89	Q	79.4	Confident	79.6	Confident	82 Å²	82	62 Å²	62	38%	0.383	32%	0.316	S	S	.	.			trans	-70.1	139	170.7	-67.3	-165.3	13.8	0	0	111.2	R85 E86 F87 K91	R85-Q89 VanDerWaalsContact CD-O 3.26Å; R85-Q89 WeakPolarHBondContact CD-O 3.5Å; R85-Q89 PolarHBondContact NH1-O 2.72Å; E86-Q89 HydrophobicContact CB-CG 4Å; E86-Q89 WeakPolarHBondContact O-CB 3.28Å; E86-Q89 PolarHBondContact O-N 3.46Å; E86-Q89 PolarHBondContact OE2-NE2 3.11Å; F87-Q89 PolarHBondContact O-N 3.13Å; Q89-K91 VanDerWaalsContact C-N 3.32Å; Q89-K91 PolarHBondContact O-N 2.84Å
90	P	74.2	Confident	78.8	Confident	127 Å²	127	58.7 Å²	58.7	83%	0.825	30%	0.303	S	S	*	.	S	Bend	trans	-74.1	-22.2	-176.5	28.6	-35.2	0	0	0	113.5
91	K	78.1	Confident	77.4	Confident	161 Å²	161	60 Å²	60	70%	0.7	32%	0.317	S	S	*	.			trans	-110.4	127.5	-170.8	-168.8	177.2	-178.8	-177.1	0	111	R85 Q89	R85-K91 WeakPolarHBondContact CB-O 3.26Å; Q89-K91 VanDerWaalsContact C-N 3.32Å; Q89-K91 PolarHBondContact O-N 2.84Å
92	F	82.1	Confident	75.9	Confident	61 Å²	61	68.5 Å²	68.5	27%	0.268	36%	0.356	S	S	.	.	P	Polyproline II helix	trans	-79.9	134.2	165.4	-85.2	-87.6	0	0	0	110.6	K83 R85 E122	K83-F92 HydrophobicContact CB-CB 4.16Å; K83-F92 HydrophobicContact CB-CD1 3.83Å; K83-F92 HydrophobicContact CB-CG 4.33Å; K83-F92 HydrophobicContact CD-CB 4.37Å; R85-F92 HydrophobicContact CB-CD1 4.24Å; R85-F92 HydrophobicContact CG-CD1 3.94Å; R85-F92 HydrophobicContact CG-CD2 4.47Å; R85-F92 HydrophobicContact CG-CE1 3.75Å; R85-F92 HydrophobicContact CG-CE2 4.31Å; R85-F92 HydrophobicContact CG-CG 4.3Å; R85-F92 HydrophobicContact CG-CZ 3.95Å; R85-F92 VanDerWaalsContact NE-CE2 3.31Å; F92-E122 HydrophobicContact CZ-CB 4.5Å
93	T	83.2	Confident	74.4	Confident	74 Å²	74	70.9 Å²	70.9	45%	0.454	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	129	168.1	-60.6	0	0	0	0	108.7	K83 F84 M95	K83-T93 CarbonylContact C-O 3.52Å; K83-T93 VanDerWaalsContact CA-O 3.27Å; K83-T93 WeakPolarHBondContact CA-O 3.39Å; F84-T93 HydrophobicContact CE1-CG2 3.82Å; F84-T93 HydrophobicContact CZ-CG2 4.22Å; F84-T93 PolarHBondContact N-O 3.43Å; F84-T93 PolarHBondContact O-N 3.33Å; T93-M95 PolarHBondContact O-N 3.4Å
94	T	82	Confident	73.1	Confident	65 Å²	65	73.1 Å²	73.1	40%	0.399	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	119.8	171.2	-53	0	0	0	0	108.6	M81 K83 S96 D97	M81-T94 HydrophobicContact CB-CG2 4.35Å; K83-T94 WeakPolarHBondContact CE-OG1 3.49Å; T94-S96 WeakPolarHBondContact CG2-O 3.44Å; T94-D97 HydrophobicContact CG2-CB 4.13Å
95	M	75.1	Confident	72	Confident	45 Å²	45	74.4 Å²	74.4	22%	0.222	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	-43.8	176.8	-177.4	-168.8	-51.5	0	0	110.9	V82 F84 T93 H110 I112 F123	V82-M95 HydrophobicContact CB-CB 4.36Å; V82-M95 HydrophobicContact CG1-CB 4.42Å; V82-M95 HydrophobicContact CG1-CE 3.8Å; V82-M95 HydrophobicContact CG1-SD 4Å; V82-M95 WeakPolarHBondContact O-CB 3.39Å; V82-M95 PolarHBondContact O-N 2.82Å; F84-M95 HydrophobicContact CB-CE 4.42Å; F84-M95 HydrophobicContact CD1-CB 4.08Å; F84-M95 HydrophobicContact CD1-CE 4.14Å; F84-M95 HydrophobicContact CE1-CB 4.37Å; T93-M95 PolarHBondContact O-N 3.4Å; M95-H110 HydrophobicContact SD-CB 3.45Å; M95-H110 WeakPolarHBondContact SD-CB 3.45Å; M95-I112 HydrophobicContact CE-CD1 3.5Å; M95-I112 VanDerWaalsContact CE-CD1 3.5Å; M95-I112 HydrophobicContact CE-CG1 3.61Å; M95-I112 HydrophobicContact SD-CG1 4.1Å; M95-F123 HydrophobicContact CE-CD1 4.34Å; M95-F123 HydrophobicContact CE-CE1 4.08Å
96	S	72.5	Confident	71.2	Confident	20 Å²	20	80.1 Å²	80.1	14%	0.14	44%	0.443	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157	144.7	-175.1	47.8	0	0	0	0	109.4	M81 V82 T94 H110	M81-S96 CarbonylContact C-O 3.53Å; M81-S96 VanDerWaalsContact CA-O 3.26Å; M81-S96 WeakPolarHBondContact CA-O 3.24Å; V82-S96 PolarHBondContact N-O 3.4Å; V82-S96 PolarHBondContact O-N 2.89Å; T94-S96 WeakPolarHBondContact CG2-O 3.44Å; S96-H110 VanDerWaalsContact CB-CE1 3.44Å; S96-H110 WeakPolarHBondContact CB-CE1 3.49Å; S96-H110 WeakPolarHBondContact CB-ND1 3.41Å; S96-H110 PolarHBondContact OG-CE1 2.89Å; S96-H110 PolarHBondContact OG-ND1 2.96Å; S96-H110 VanDerWaalsContact OG-ND1 3.07Å
97	D	77.4	Confident	70.7	Confident	73 Å²	73	85 Å²	85	39%	0.39	46%	0.461	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	111.5	-177.3	179.1	14.2	0	0	0	107.7	R79 M81 T94	R79-D97 IonicContact CZ-OD1 3.1Å; R79-D97 IonicContact CZ-OD2 3.82Å; R79-D97 IonicContact NE-OD1 3.82Å; R79-D97 PolarHBondContact NE-OD1 2.93Å; R79-D97 IonicContact NE-OD2 2.97Å; R79-D97 VanDerWaalsContact NH2-CG 3.31Å; R79-D97 IonicContact NH2-OD1 3.32Å; R79-D97 PolarHBondContact NH2-OD1 3.27Å; R79-D97 IonicContact NH2-OD2 3.74Å; R79-D97 PolarHBondContact NH2-OD2 2.87Å; M81-D97 HydrophobicContact CG-CB 3.93Å; M81-D97 WeakPolarHBondContact CG-OD1 3.31Å; T94-D97 HydrophobicContact CG2-CB 4.13Å
98	Y	71.2	Confident	70.5	Confident	21 Å²	21	85.6 Å²	85.6	8%	0.082	46%	0.461	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	142	-172.7	44.5	-86.8	0	0	0	111.6	W70 R79 A80 V82 W100 H110	W70-Y98 HydrophobicContact CZ3-CE2 4.22Å; R79-Y98 WeakPolarHBondContact CA-O 3.43Å; R79-Y98 VanDerWaalsContact CG-O 3.27Å; R79-Y98 WeakPolarHBondContact CG-O 3.12Å; A80-Y98 HydrophobicContact CB-CD2 4.42Å; A80-Y98 HydrophobicContact CB-CE2 3.87Å; A80-Y98 PolarHBondContact N-O 3.17Å; A80-Y98 PolarHBondContact O-N 2.68Å; A80-Y98 VanDerWaalsContact O-N 3.11Å; V82-Y98 HydrophobicContact CG2-CE1 4.4Å; Y98-W100 AromaticContact CD2-CE3 3.91Å; Y98-W100 HydrophobicContact CD2-CE3 3.91Å; Y98-W100 HydrophobicContact CD2-CZ3 4.35Å; Y98-W100 AromaticContact CE2-CE3 3.64Å; Y98-W100 HydrophobicContact CE2-CE3 3.64Å; Y98-W100 AromaticContact CE2-CZ3 3.84Å; Y98-W100 HydrophobicContact CE2-CZ3 3.84Å; Y98-H110 AromaticContact CE1-CE1 3.47Å; Y98-H110 VanDerWaalsContact CE1-CE1 3.47Å; Y98-H110 WeakPolarHBondContact CE1-CE1 3.49Å; Y98-H110 AromaticContact CE1-NE2 3.68Å; Y98-H110 AromaticContact CZ-NE2 3.81Å; Y98-H110 PolarHBondContact OH-NE2 3.2Å
99	G	65.6	Low	71	Confident	51 Å²	51	82.7 Å²	82.7	53%	0.526	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.6	136.7	165	0	0	0	0	0	109.9	A78	A78-G99 WeakPolarHBondContact O-CA 3.29Å
100	W	66.4	Low	71.1	Confident	40 Å²	40	80.1 Å²	80.1	15%	0.152	44%	0.439	C	S	.	.			trans	-114.1	143.7	168.6	-159.9	-93.7	0	0	0	107.2	P72 I77 A78 Y98 V105 R108	P72-W100 HydrophobicContact CB-CZ2 4.47Å; P72-W100 HydrophobicContact CG-CH2 3.76Å; P72-W100 HydrophobicContact CG-CZ2 3.24Å; I77-W100 HydrophobicContact CB-CB 4.24Å; I77-W100 HydrophobicContact CB-CG 4.22Å; I77-W100 HydrophobicContact CG2-CB 3.88Å; I77-W100 HydrophobicContact CG2-CG 4.25Å; I77-W100 CarbonylContact O-C 3.58Å; I77-W100 VanDerWaalsContact O-C 3.28Å; I77-W100 WeakPolarHBondContact O-CB 3.32Å; I77-W100 VanDerWaalsContact O-O 3.09Å; A78-W100 CarbonylContact C-O 3.49Å; A78-W100 VanDerWaalsContact C-O 3.24Å; A78-W100 WeakPolarHBondContact CA-O 3.39Å; A78-W100 PolarHBondContact O-N 2.89Å; Y98-W100 AromaticContact CD2-CE3 3.91Å; Y98-W100 HydrophobicContact CD2-CE3 3.91Å; Y98-W100 HydrophobicContact CD2-CZ3 4.35Å; Y98-W100 AromaticContact CE2-CE3 3.64Å; Y98-W100 HydrophobicContact CE2-CE3 3.64Å; Y98-W100 AromaticContact CE2-CZ3 3.84Å; Y98-W100 HydrophobicContact CE2-CZ3 3.84Å; W100-V105 HydrophobicContact CH2-CB 4.37Å; W100-V105 HydrophobicContact CH2-CG1 4.18Å; W100-V105 VanDerWaalsContact CH2-O 3.23Å; W100-V105 WeakPolarHBondContact CH2-O 3.38Å; W100-V105 WeakPolarHBondContact CZ2-O 3.29Å; W100-R108 HydrophobicContact CZ3-CG 4.19Å
101	G	51.9	Low	71.5	Confident	28 Å²	28	77.5 Å²	77.5	29%	0.289	42%	0.42	S	S	.	.	S	Bend	trans	116.7	138.4	-169.1	0	0	0	0	0	112.4	S103	G101-S103 PolarHBondContact O-N 3.39Å
102	H	52.7	Low	71.7	Confident	202 Å²	202	70.6 Å²	70.6	94%	0.935	39%	0.391	S	S	*	.	S	Bend	trans	66.4	-18.1	-179.3	-53.3	75.2	0	0	0	117.1
103	S	51.9	Low	71.8	Confident	49 Å²	49	71.7 Å²	71.7	34%	0.343	40%	0.403	S	S	.	.			trans	-89.5	121.3	168.6	68.4	0	0	0	0	111.4	G101 V105	G101-S103 PolarHBondContact O-N 3.39Å; S103-V105 PolarHBondContact O-N 3.06Å
104	G	59.8	Low	71.8	Confident	84 Å²	84	73.7 Å²	73.7	87%	0.866	42%	0.42	S	S	*	.			trans	-69.4	32.8	178.1	0	0	0	0	0	115.9	K106	G104-K106 PolarHBondContact O-N 3.2Å
105	V	62.6	Low	72	Confident	56 Å²	56	71.1 Å²	71.1	34%	0.339	40%	0.403	S	S	.	.			trans	-84.1	109.2	-173.9	174.2	0	0	0	0	109.3	W100 S103 Y107 R108	W100-V105 HydrophobicContact CH2-CB 4.37Å; W100-V105 HydrophobicContact CH2-CG1 4.18Å; W100-V105 VanDerWaalsContact CH2-O 3.23Å; W100-V105 WeakPolarHBondContact CH2-O 3.38Å; W100-V105 WeakPolarHBondContact CZ2-O 3.29Å; S103-V105 PolarHBondContact O-N 3.06Å; V105-Y107 VanDerWaalsContact C-N 3.34Å; V105-Y107 WeakPolarHBondContact CG1-O 3.31Å; V105-Y107 PolarHBondContact O-N 2.85Å; V105-R108 HydrophobicContact CG1-CG 3.96Å
106	K	70	Confident	72.4	Confident	179 Å²	179	73.7 Å²	73.7	78%	0.778	41%	0.413	S	S	*	.			trans	-70.3	-25.3	-177.1	-65.8	-173.6	178.4	-177.1	0	114.3	G104	G104-K106 PolarHBondContact O-N 3.2Å
107	Y	76.5	Confident	73.1	Confident	130 Å²	130	72.9 Å²	72.9	51%	0.51	41%	0.408	S	S	.	.			trans	-157.4	162.3	-177.5	65.1	-89.1	0	0	0	110.8	T69 W70 V105	T69-Y107 HydrophobicContact CG2-CD2 4.24Å; W70-Y107 CarbonylContact O-C 3.59Å; W70-Y107 WeakPolarHBondContact O-CA 3.19Å; V105-Y107 VanDerWaalsContact C-N 3.34Å; V105-Y107 WeakPolarHBondContact CG1-O 3.31Å; V105-Y107 PolarHBondContact O-N 2.85Å
108	R	76.9	Confident	73.6	Confident	91 Å²	91	71.2 Å²	71.2	34%	0.343	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	139.5	168.8	-76.4	-164.8	179.4	-131.8	4.6	112.6	T69 W70 W100 V105	T69-R108 WeakPolarHBondContact CA-O 3.39Å; W70-R108 PolarHBondContact N-O 3.35Å; W70-R108 PolarHBondContact O-N 3.32Å; W100-R108 HydrophobicContact CZ3-CG 4.19Å; V105-R108 HydrophobicContact CG1-CG 3.96Å
109	N	81.7	Confident	74.4	Confident	98 Å²	98	74.6 Å²	74.6	52%	0.524	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	139.4	171.5	-62	-15	0	0	0	109.4	F68 T69	F68-N109 CarbonylContact O-C 3.5Å; F68-N109 WeakPolarHBondContact O-CA 3.31Å; T69-N109 WeakPolarHBondContact CB-OD1 3.45Å; T69-N109 WeakPolarHBondContact CG2-OD1 3.48Å; T69-N109 PolarHBondContact OG1-OD1 2.94Å
110	H	81	Confident	75.4	Confident	28 Å²	28	74.9 Å²	74.9	13%	0.13	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	139.9	173.6	-57.2	-94	0	0	0	108.2	F68 M95 S96 Y98	F68-H110 HydrophobicContact CD1-CB 4.26Å; F68-H110 AromaticContact CD1-CD2 3.78Å; F68-H110 PolarHBondContact N-O 3.42Å; F68-H110 PolarHBondContact O-N 3.45Å; M95-H110 HydrophobicContact SD-CB 3.45Å; M95-H110 WeakPolarHBondContact SD-CB 3.45Å; S96-H110 VanDerWaalsContact CB-CE1 3.44Å; S96-H110 WeakPolarHBondContact CB-CE1 3.49Å; S96-H110 WeakPolarHBondContact CB-ND1 3.41Å; S96-H110 PolarHBondContact OG-CE1 2.89Å; S96-H110 PolarHBondContact OG-ND1 2.96Å; S96-H110 VanDerWaalsContact OG-ND1 3.07Å; Y98-H110 AromaticContact CE1-CE1 3.47Å; Y98-H110 VanDerWaalsContact CE1-CE1 3.47Å; Y98-H110 WeakPolarHBondContact CE1-CE1 3.49Å; Y98-H110 AromaticContact CE1-NE2 3.68Å; Y98-H110 AromaticContact CZ-NE2 3.81Å; Y98-H110 PolarHBondContact OH-NE2 3.2Å
111	T	82.6	Confident	76.4	Confident	71 Å²	71	73.5 Å²	73.5	44%	0.436	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	125.5	174.2	-68.1	0	0	0	0	108.9	H67 T113	H67-T111 VanDerWaalsContact CD2-CG2 3.48Å; H67-T111 WeakPolarHBondContact CD2-CG2 2.99Å; H67-T111 PolarHBondContact CD2-OG1 2.92Å; H67-T111 WeakPolarHBondContact NE2-CG2 3.47Å; H67-T111 PolarHBondContact NE2-OG1 3.19Å; T111-T113 HydrophobicContact CG2-CG2 3.9Å
112	I	82.8	Confident	78	Confident	16 Å²	16	72.6 Å²	72.6	8%	0.082	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	127.1	166	-35.1	171.9	0	0	0	107.4	E65 I66 F84 M95 L115 F123	E65-I112 CarbonylContact C-O 3.46Å; E65-I112 WeakPolarHBondContact CA-O 3.33Å; E65-I112 WeakPolarHBondContact CB-O 3.41Å; I66-I112 PolarHBondContact N-O 3.29Å; I66-I112 PolarHBondContact O-N 3.31Å; F84-I112 HydrophobicContact CB-CD1 4.26Å; F84-I112 HydrophobicContact CD1-CD1 4.07Å; F84-I112 HydrophobicContact CD2-CD1 3.84Å; F84-I112 HydrophobicContact CE1-CD1 4.37Å; F84-I112 HydrophobicContact CE1-CG2 4.39Å; F84-I112 HydrophobicContact CE2-CD1 4.16Å; F84-I112 HydrophobicContact CE2-CG2 4.09Å; F84-I112 HydrophobicContact CG-CD1 3.79Å; F84-I112 HydrophobicContact CZ-CD1 4.41Å; F84-I112 HydrophobicContact CZ-CG2 3.86Å; M95-I112 HydrophobicContact CE-CD1 3.5Å; M95-I112 VanDerWaalsContact CE-CD1 3.5Å; M95-I112 HydrophobicContact CE-CG1 3.61Å; M95-I112 HydrophobicContact SD-CG1 4.1Å; I112-L115 HydrophobicContact CB-CD1 4.13Å; I112-L115 HydrophobicContact CB-CD2 4.48Å; I112-L115 HydrophobicContact CB-CG 4.35Å; I112-L115 HydrophobicContact CD1-CD1 4.48Å; I112-L115 HydrophobicContact CG2-CD1 4.28Å; I112-L115 HydrophobicContact CG2-CD2 3.74Å; I112-L115 HydrophobicContact CG2-CG 4.02Å; I112-F123 HydrophobicContact CD1-CE1 3.94Å; I112-F123 HydrophobicContact CD1-CZ 4.28Å
113	T	84.8	Confident	79.6	Confident	84 Å²	84	63 Å²	63	52%	0.515	34%	0.339	S	S	.	.			trans	-109.6	175.8	173.2	57.9	0	0	0	0	110.8	R64 T111 L115	R64-T113 CarbonylContact O-C 3.53Å; T111-T113 HydrophobicContact CG2-CG2 3.9Å; T113-L115 PolarHBondContact O-N 3.05Å; T113-L115 VanDerWaalsContact O-N 3.12Å
114	S	82.4	Confident	81	Confident	116 Å²	116	60.8 Å²	60.8	81%	0.811	32%	0.324	S	S	*	.	S	Bend	trans	57.2	27.5	175.3	-54.5	0	0	0	0	114.9	R64	R64-S114 PolarHBondContact O-N 2.86Å
115	L	85.2	Confident	82.2	Confident	11 Å²	11	56.9 Å²	56.9	6%	0.058	28%	0.283	C	S	.	.	P	Polyproline II helix	trans	-72	157.1	172	-63.9	177	0	0	0	111	R64 I66 F84 I112 T113 Y121 T150	R64-L115 WeakPolarHBondContact CA-O 3.44Å; R64-L115 WeakPolarHBondContact CB-O 3.39Å; R64-L115 WeakPolarHBondContact CG-O 3.45Å; R64-L115 PolarHBondContact O-N 3.35Å; I66-L115 HydrophobicContact CB-CD1 4.03Å; I66-L115 HydrophobicContact CD1-CD1 3.59Å; I66-L115 HydrophobicContact CG1-CD1 3.54Å; F84-L115 HydrophobicContact CE2-CD2 4.01Å; I112-L115 HydrophobicContact CB-CD1 4.13Å; I112-L115 HydrophobicContact CB-CD2 4.48Å; I112-L115 HydrophobicContact CB-CG 4.35Å; I112-L115 HydrophobicContact CD1-CD1 4.48Å; I112-L115 HydrophobicContact CG2-CD1 4.28Å; I112-L115 HydrophobicContact CG2-CD2 3.74Å; I112-L115 HydrophobicContact CG2-CG 4.02Å; T113-L115 PolarHBondContact O-N 3.05Å; T113-L115 VanDerWaalsContact O-N 3.12Å; L115-Y121 HydrophobicContact CB-CE2 4.06Å; L115-Y121 HydrophobicContact CD1-CD2 4.43Å; L115-Y121 HydrophobicContact CD1-CE2 4.33Å; L115-Y121 HydrophobicContact CD2-CD1 4.29Å; L115-Y121 HydrophobicContact CD2-CE1 3.76Å; L115-Y121 HydrophobicContact CD2-CE2 4.24Å; L115-Y121 HydrophobicContact CG-CE2 4.46Å; L115-T150 HydrophobicContact CB-CG2 4.22Å; L115-T150 HydrophobicContact CD1-CG2 4.18Å
116	K	85.2	Confident	83.4	Confident	100 Å²	100	54.8 Å²	54.8	44%	0.435	27%	0.27	S	S	.	.	P	Polyproline II helix	trans	-75.1	137.4	172	-63.6	173.2	-172.6	163.5	0	109.2	E86 R119 Y121 T150	E86-K116 IonicContact OE1-NZ 2.83Å; E86-K116 PolarHBondContact OE1-NZ 2.98Å; E86-K116 IonicContact OE2-NZ 2.66Å; E86-K116 PolarHBondContact OE2-NZ 3.32Å; K116-R119 HydrophobicContact CB-CB 4.29Å; K116-R119 HydrophobicContact CB-CG 3.69Å; K116-R119 HydrophobicContact CD-CG 4.24Å; K116-Y121 PolarHBondContact N-OH 2.91Å; K116-T150 PolarHBondContact O-OG1 3.11Å
117	P	86.8	Confident	84.1	Confident	3 Å²	3	46.3 Å²	46.3	2%	0.019	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.3	158.8	173.1	32.6	-36.7	0	0	0	111.9	R63 R119 Y151 D153 N181	R63-P117 VanDerWaalsContact O-CA 3.26Å; R63-P117 WeakPolarHBondContact O-CA 3.42Å; P117-R119 PolarHBondContact O-N 3.33Å; P117-Y151 WeakPolarHBondContact CB-O 3.37Å; P117-D153 HydrophobicContact CB-CB 3.52Å; P117-D153 HydrophobicContact CG-CB 3.85Å; P117-N181 HydrophobicContact CB-CB 4.26Å; P117-N181 HydrophobicContact CG-CB 3.48Å; P117-N181 VanDerWaalsContact CG-CB 3.48Å; P117-N181 WeakPolarHBondContact CG-OD1 3.47Å
118	N	87.7	Confident	84.4	Confident	37 Å²	37	42.4 Å²	42.4	20%	0.198	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	49	39.8	-177	-165.9	37.4	0	0	0	114.2	K149 T150 Y151 P152 N181 G182	N118-K149 WeakPolarHBondContact OD1-CE 3.17Å; N118-K149 PolarHBondContact OD1-NZ 3.19Å; N118-T150 WeakPolarHBondContact CA-O 3.28Å; N118-T150 PolarHBondContact N-O 3.13Å; N118-T150 PolarHBondContact N-OG1 3.35Å; N118-Y151 PolarHBondContact N-O 3.31Å; N118-Y151 VanDerWaalsContact N-O 3.08Å; N118-P152 HydrophobicContact CB-CB 4.41Å; N118-P152 HydrophobicContact CB-CG 4.28Å; N118-N181 WeakPolarHBondContact CB-O 3.4Å; N118-G182 WeakPolarHBondContact ND2-CA 3.34Å
119	R	86.8	Confident	84.7	Confident	92 Å²	92	39.8 Å²	39.8	35%	0.347	21%	0.211	S	C	.	.			trans	-123.8	141.6	177.8	-71.6	-61.4	-175.4	-96.5	-1.4	111.7	E86 K116 P117 Y121 K149 T150	E86-R119 VanDerWaalsContact OE1-CD 3.27Å; E86-R119 WeakPolarHBondContact OE1-CD 3.27Å; E86-R119 WeakPolarHBondContact OE1-CG 3.38Å; E86-R119 IonicContact OE1-NE 3.57Å; E86-R119 PolarHBondContact OE1-NE 2.89Å; K116-R119 HydrophobicContact CB-CB 4.29Å; K116-R119 HydrophobicContact CB-CG 3.69Å; K116-R119 HydrophobicContact CD-CG 4.24Å; P117-R119 PolarHBondContact O-N 3.33Å; R119-Y121 HydrophobicContact CB-CD2 4.39Å; R119-Y121 HydrophobicContact CB-CE2 3.71Å; R119-Y121 WeakPolarHBondContact O-CD2 3.3Å; R119-K149 CarbonylContact O-C 3.58Å; R119-K149 WeakPolarHBondContact O-CA 3.27Å; R119-T150 PolarHBondContact N-OG1 3.29Å; R119-T150 PolarHBondContact O-N 3.17Å; R119-T150 PolarHBondContact O-OG1 3.23Å; R119-T150 VanDerWaalsContact O-OG1 3.13Å
120	L	86.7	Confident	84.7	Confident	57 Å²	57	40 Å²	40	30%	0.298	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	128.9	175	-172.5	64.5	0	0	0	108.8	F87 A147 K149	F87-L120 HydrophobicContact CB-CB 3.85Å; F87-L120 HydrophobicContact CB-CD2 4.13Å; F87-L120 HydrophobicContact CB-CG 4.07Å; F87-L120 WeakPolarHBondContact CB-O 3.36Å; F87-L120 HydrophobicContact CD1-CD2 3.87Å; F87-L120 HydrophobicContact CD2-CD2 3.82Å; F87-L120 HydrophobicContact CD2-CG 4.41Å; F87-L120 HydrophobicContact CE1-CD2 4.11Å; F87-L120 HydrophobicContact CE2-CD2 4.11Å; F87-L120 HydrophobicContact CG-CB 4.33Å; F87-L120 HydrophobicContact CG-CD2 3.71Å; F87-L120 HydrophobicContact CG-CG 4.2Å; F87-L120 HydrophobicContact CZ-CD2 4.25Å; F87-L120 PolarHBondContact N-O 3.14Å; L120-A147 HydrophobicContact CD1-CB 3.86Å; L120-A147 HydrophobicContact CG-CB 4.25Å; L120-K149 HydrophobicContact CD1-CB 4.08Å
121	Y	87.5	Confident	84.8	Confident	11 Å²	11	44.1 Å²	44.1	4%	0.043	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	128.6	176.8	-72	-83.8	0	0	0	109.7	I66 F84 R85 E86 L115 K116 R119 A147 C148 T150	I66-Y121 HydrophobicContact CD1-CD2 4.14Å; I66-Y121 HydrophobicContact CD1-CG 4.37Å; F84-Y121 HydrophobicContact CD2-CD1 4.22Å; R85-Y121 CarbonylContact O-C 3.57Å; R85-Y121 VanDerWaalsContact O-CA 3.24Å; R85-Y121 WeakPolarHBondContact O-CA 3.2Å; E86-Y121 HydrophobicContact CB-CD1 4.18Å; E86-Y121 HydrophobicContact CB-CE1 3.8Å; E86-Y121 HydrophobicContact CG-CE1 4.31Å; L115-Y121 HydrophobicContact CB-CE2 4.06Å; L115-Y121 HydrophobicContact CD1-CD2 4.43Å; L115-Y121 HydrophobicContact CD1-CE2 4.33Å; L115-Y121 HydrophobicContact CD2-CD1 4.29Å; L115-Y121 HydrophobicContact CD2-CE1 3.76Å; L115-Y121 HydrophobicContact CD2-CE2 4.24Å; L115-Y121 HydrophobicContact CG-CE2 4.46Å; K116-Y121 PolarHBondContact N-OH 2.91Å; R119-Y121 HydrophobicContact CB-CD2 4.39Å; R119-Y121 HydrophobicContact CB-CE2 3.71Å; R119-Y121 WeakPolarHBondContact O-CD2 3.3Å; Y121-A147 CarbonylContact O-C 3.58Å; Y121-A147 WeakPolarHBondContact O-CA 3.41Å; Y121-C148 PolarHBondContact N-O 3.34Å; Y121-C148 PolarHBondContact O-N 3.5Å; Y121-T150 HydrophobicContact CD2-CG2 4Å; Y121-T150 HydrophobicContact CE2-CG2 3.88Å
122	E	86.7	Confident	84.4	Confident	9 Å²	9	45.5 Å²	45.5	4%	0.042	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	146.4	172.6	-59.4	-174.7	175	0	0	110.8	F84 R85 F87 F92 I145 C146 A147	F84-E122 CarbonylContact C-O 3.24Å; F84-E122 WeakPolarHBondContact CA-O 3.46Å; R85-E122 HydrophobicContact CG-CB 3.99Å; R85-E122 IonicContact CZ-OE2 2.74Å; R85-E122 PolarHBondContact N-O 2.85Å; R85-E122 IonicContact NE-OE2 3.62Å; R85-E122 PolarHBondContact NE-OE2 3.03Å; R85-E122 IonicContact NH2-OE1 3.56Å; R85-E122 IonicContact NH2-OE2 2.75Å; R85-E122 PolarHBondContact NH2-OE2 3.23Å; R85-E122 PolarHBondContact O-N 3.38Å; F87-E122 HydrophobicContact CD2-CG 3.83Å; F87-E122 WeakPolarHBondContact CD2-OE1 3.45Å; F87-E122 VanDerWaalsContact CE2-OE1 3.24Å; F87-E122 WeakPolarHBondContact CE2-OE1 3.44Å; F92-E122 HydrophobicContact CZ-CB 4.5Å; E122-I145 HydrophobicContact CB-CG2 4.19Å; E122-I145 HydrophobicContact CG-CG2 3.63Å; E122-C146 CarbonylContact C-O 3.28Å; E122-C146 WeakPolarHBondContact CA-O 3.13Å; E122-A147 HydrophobicContact CG-CB 4.47Å
123	F	85.3	Confident	84.4	Confident	1 Å²	1	47.9 Å²	47.9	0%	0.004	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	144.5	177.8	-64.7	-95.5	0	0	0	110.2	L53 L59 I66 F68 K83 F84 M95 I112 C146 C148	L53-F123 HydrophobicContact CD1-CB 4.45Å; L59-F123 HydrophobicContact CD1-CD2 4.17Å; L59-F123 HydrophobicContact CD1-CE2 4.36Å; L59-F123 HydrophobicContact CD2-CD1 4.21Å; L59-F123 HydrophobicContact CD2-CD2 4.16Å; L59-F123 HydrophobicContact CD2-CE1 3.82Å; L59-F123 HydrophobicContact CD2-CE2 3.81Å; L59-F123 HydrophobicContact CD2-CG 4.38Å; L59-F123 HydrophobicContact CD2-CZ 3.63Å; I66-F123 HydrophobicContact CB-CZ 4.42Å; I66-F123 HydrophobicContact CD1-CE2 4.29Å; I66-F123 HydrophobicContact CD1-CZ 3.84Å; I66-F123 HydrophobicContact CG2-CE1 4.42Å; I66-F123 HydrophobicContact CG2-CZ 3.8Å; F68-F123 HydrophobicContact CD2-CD1 4.04Å; F68-F123 HydrophobicContact CD2-CE1 4.35Å; F68-F123 HydrophobicContact CE2-CD1 4.41Å; K83-F123 CarbonylContact O-C 3.49Å; K83-F123 WeakPolarHBondContact O-CA 3.14Å; F84-F123 HydrophobicContact CB-CD1 4.15Å; F84-F123 HydrophobicContact CB-CE1 4.19Å; M95-F123 HydrophobicContact CE-CD1 4.34Å; M95-F123 HydrophobicContact CE-CE1 4.08Å; I112-F123 HydrophobicContact CD1-CE1 3.94Å; I112-F123 HydrophobicContact CD1-CZ 4.28Å; F123-C146 HydrophobicContact CB-CB 4.08Å; F123-C146 PolarHBondContact N-O 3.37Å; F123-C148 HydrophobicContact CE2-CB 4.12Å
124	G	82.9	Confident	84.4	Confident	3 Å²	3	48.6 Å²	48.6	3%	0.031	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	164	175.7	0	0	0	0	0	110.8	K83 F137	K83-G124 PolarHBondContact N-O 3.37Å; K83-G124 PolarHBondContact O-N 2.82Å; G124-F137 CarbonylContact C-O 3.5Å; G124-F137 WeakPolarHBondContact CA-O 3.44Å
125	L	84.8	Confident	84.4	Confident	1 Å²	1	45.9 Å²	45.9	1%	0.005	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	128.3	-178.5	-171.8	71.7	0	0	0	108.5	L53 P54 F57 W70 M81 V82 L127 F137	L53-L125 HydrophobicContact CD2-CB 4.35Å; P54-L125 HydrophobicContact CG-CD2 3.8Å; F57-L125 HydrophobicContact CZ-CD2 4.19Å; W70-L125 HydrophobicContact CH2-CD1 4.5Å; W70-L125 HydrophobicContact CH2-CD2 4.37Å; W70-L125 HydrophobicContact CZ2-CD2 3.74Å; M81-L125 WeakPolarHBondContact O-CA 3.3Å; V82-L125 HydrophobicContact CG2-CD1 4.03Å; L125-L127 HydrophobicContact CD1-CD2 4.3Å; L125-L127 HydrophobicContact CD2-CD1 4.17Å; L125-L127 HydrophobicContact CD2-CD2 3.78Å; L125-L127 HydrophobicContact CD2-CG 3.93Å; L125-L127 HydrophobicContact CG-CD2 3.88Å; L125-L127 HydrophobicContact CG-CG 4.1Å; L125-F137 HydrophobicContact CB-CB 4.34Å; L125-F137 PolarHBondContact N-O 3.05Å; L125-F137 PolarHBondContact O-N 3.11Å
126	N	86.2	Confident	84.3	Confident	13 Å²	13	51.3 Å²	51.3	7%	0.07	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	128.1	164.2	-63.8	7.2	0	0	0	108.3	M81 K83 F134 D135	M81-N126 HydrophobicContact CB-CB 4.16Å; M81-N126 HydrophobicContact CE-CB 3.82Å; M81-N126 PolarHBondContact N-O 2.85Å; M81-N126 PolarHBondContact O-N 3.45Å; M81-N126 HydrophobicContact SD-CB 4.29Å; K83-N126 PolarHBondContact NZ-ND2 2.89Å; N126-F134 HydrophobicContact CB-CE2 3.78Å; N126-F134 HydrophobicContact CB-CZ 4.06Å; N126-F134 WeakPolarHBondContact ND2-CZ 3.46Å; N126-D135 CarbonylContact C-O 3.59Å; N126-D135 WeakPolarHBondContact CA-O 3.25Å
127	L	84.6	Confident	83.9	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	140.5	175.5	-64.7	-176.1	0	0	0	110.1	P54 W70 I77 A80 L125 Y129 F134 D135 F137	P54-L127 HydrophobicContact CG-CD1 3.66Å; W70-L127 HydrophobicContact CH2-CD2 3.71Å; W70-L127 HydrophobicContact CZ2-CD2 4.02Å; I77-L127 HydrophobicContact CD1-CD1 3.94Å; I77-L127 HydrophobicContact CD1-CD2 4.17Å; I77-L127 HydrophobicContact CG1-CD1 4.39Å; I77-L127 HydrophobicContact CG2-CD2 4.05Å; A80-L127 HydrophobicContact CB-CD2 3.78Å; L125-L127 HydrophobicContact CD1-CD2 4.3Å; L125-L127 HydrophobicContact CD2-CD1 4.17Å; L125-L127 HydrophobicContact CD2-CD2 3.78Å; L125-L127 HydrophobicContact CD2-CG 3.93Å; L125-L127 HydrophobicContact CG-CD2 3.88Å; L125-L127 HydrophobicContact CG-CG 4.1Å; L127-Y129 HydrophobicContact CB-CE2 4.08Å; L127-F134 WeakPolarHBondContact O-CA 3.35Å; L127-D135 PolarHBondContact N-O 3.05Å; L127-D135 PolarHBondContact O-N 2.73Å; L127-F137 HydrophobicContact CD1-CE2 4.23Å
128	I	84.2	Confident	83.2	Confident	49 Å²	49	49.3 Å²	49.3	25%	0.251	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	129.2	163.9	-55.7	177.1	0	0	0	106.5	I77 A78 R79 M81 T133 F134	I77-I128 WeakPolarHBondContact CG2-O 3.18Å; A78-I128 WeakPolarHBondContact CA-O 3.48Å; A78-I128 PolarHBondContact N-O 3.25Å; R79-I128 HydrophobicContact CB-CB 3.98Å; R79-I128 HydrophobicContact CB-CD1 4.2Å; R79-I128 HydrophobicContact CB-CG1 4.33Å; R79-I128 PolarHBondContact N-O 3.05Å; R79-I128 PolarHBondContact O-N 3.29Å; M81-I128 HydrophobicContact CE-CD1 4.04Å; M81-I128 HydrophobicContact CE-CG1 4.2Å; I128-T133 WeakPolarHBondContact CA-O 3.37Å; I128-F134 HydrophobicContact CG1-CD2 3.99Å
129	Y	83.9	Confident	82.4	Confident	36 Å²	36	53.8 Å²	53.8	14%	0.141	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	164.1	179.4	-63.2	-89.2	0	0	0	111.3	I77 L127 N131 S132 T133 D135	I77-Y129 HydrophobicContact CG1-CD1 4.03Å; I77-Y129 HydrophobicContact CG1-CE1 3.87Å; L127-Y129 HydrophobicContact CB-CE2 4.08Å; Y129-N131 WeakPolarHBondContact CB-OD1 3.38Å; Y129-N131 PolarHBondContact O-N 3.11Å; Y129-S132 WeakPolarHBondContact O-CA 3.35Å; Y129-S132 PolarHBondContact O-N 2.77Å; Y129-T133 VanDerWaalsContact CD2-OG1 3.23Å; Y129-T133 WeakPolarHBondContact CD2-OG1 3.43Å; Y129-T133 PolarHBondContact N-O 3.22Å; Y129-D135 HydrophobicContact CE2-CB 4.15Å
130	E	81.1	Confident	81.4	Confident	101 Å²	101	56.9 Å²	56.9	47%	0.472	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-28.8	-179.4	-73.6	-178.2	-174.6	0	0	113.6	K76 A78 S132	K76-E130 HydrophobicContact CB-CB 4.39Å; K76-E130 HydrophobicContact CB-CG 4.06Å; K76-E130 WeakPolarHBondContact CD-OE2 3.25Å; K76-E130 IonicContact NZ-OE2 3.92Å; K76-E130 PolarHBondContact O-N 3.18Å; K76-E130 VanDerWaalsContact O-N 3.08Å; A78-E130 HydrophobicContact CB-CG 4.2Å; E130-S132 PolarHBondContact O-N 3.49Å
131	N	82.1	Confident	80.2	Confident	115 Å²	115	57.5 Å²	57.5	62%	0.615	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.5	11.3	172.2	67.3	-6.6	0	0	0	113.6	Y129 T133	Y129-N131 WeakPolarHBondContact CB-OD1 3.38Å; Y129-N131 PolarHBondContact O-N 3.11Å; N131-T133 PolarHBondContact O-N 3.25Å; N131-T133 PolarHBondContact OD1-N 3.27Å; N131-T133 VanDerWaalsContact OD1-N 3.12Å; N131-T133 PolarHBondContact OD1-OG1 3.41Å
132	S	75.5	Confident	79.2	Confident	101 Å²	101	59 Å²	59	71%	0.706	32%	0.319	S	S	*	.			trans	62.5	14.5	-176.5	-55.9	0	0	0	0	116.3	Y129 E130	Y129-S132 WeakPolarHBondContact O-CA 3.35Å; Y129-S132 PolarHBondContact O-N 2.77Å; E130-S132 PolarHBondContact O-N 3.49Å
133	T	81.9	Confident	78	Confident	65 Å²	65	65.8 Å²	65.8	40%	0.399	35%	0.348	S	S	.	.			trans	-70.5	147.6	168.1	62.4	0	0	0	0	110.7	I128 Y129 N131	I128-T133 WeakPolarHBondContact CA-O 3.37Å; Y129-T133 VanDerWaalsContact CD2-OG1 3.23Å; Y129-T133 WeakPolarHBondContact CD2-OG1 3.43Å; Y129-T133 PolarHBondContact N-O 3.22Å; N131-T133 PolarHBondContact O-N 3.25Å; N131-T133 PolarHBondContact OD1-N 3.27Å; N131-T133 VanDerWaalsContact OD1-N 3.12Å; N131-T133 PolarHBondContact OD1-OG1 3.41Å
134	F	85.1	Confident	77	Confident	99 Å²	99	70.5 Å²	70.5	43%	0.434	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	123.4	-179.4	168.4	-88.1	0	0	0	109.8	M81 N126 L127 I128 R136	M81-F134 HydrophobicContact CE-CE2 4.35Å; N126-F134 HydrophobicContact CB-CE2 3.78Å; N126-F134 HydrophobicContact CB-CZ 4.06Å; N126-F134 WeakPolarHBondContact ND2-CZ 3.46Å; L127-F134 WeakPolarHBondContact O-CA 3.35Å; I128-F134 HydrophobicContact CG1-CD2 3.99Å; F134-R136 HydrophobicContact CE1-CB 4.22Å; F134-R136 HydrophobicContact CZ-CB 4.5Å
135	D	83.2	Confident	76.3	Confident	59 Å²	59	74.2 Å²	74.2	32%	0.316	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	148	173.5	-87.1	-45.3	0	0	0	111.8	N126 L127 Y129 F137	N126-D135 CarbonylContact C-O 3.59Å; N126-D135 WeakPolarHBondContact CA-O 3.25Å; L127-D135 PolarHBondContact N-O 3.05Å; L127-D135 PolarHBondContact O-N 2.73Å; Y129-D135 HydrophobicContact CE2-CB 4.15Å; D135-F137 HydrophobicContact CB-CD2 4.41Å; D135-F137 HydrophobicContact CB-CE2 3.56Å; D135-F137 HydrophobicContact CB-CZ 4.02Å
136	R	81.3	Confident	76	Confident	126 Å²	126	74.3 Å²	74.3	48%	0.475	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	128.2	176.9	-179.9	-177.1	-56.9	-172	4.6	110.2	F134 P138 K139	F134-R136 HydrophobicContact CE1-CB 4.22Å; F134-R136 HydrophobicContact CZ-CB 4.5Å; R136-P138 CarbonylContact O-C 3.53Å; R136-K139 PolarHBondContact O-N 2.95Å
137	F	77.6	Confident	75.7	Confident	32 Å²	32	75.4 Å²	75.4	14%	0.14	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	136.9	176.5	-58.9	-89.9	0	0	0	110.5	L53 P54 G124 L125 L127 D135	L53-F137 HydrophobicContact CD2-CB 3.56Å; P54-F137 HydrophobicContact CB-CZ 4.36Å; P54-F137 HydrophobicContact CG-CD1 4.39Å; P54-F137 HydrophobicContact CG-CD2 3.86Å; P54-F137 HydrophobicContact CG-CE1 4.21Å; P54-F137 HydrophobicContact CG-CE2 3.66Å; P54-F137 HydrophobicContact CG-CG 4.23Å; P54-F137 HydrophobicContact CG-CZ 3.86Å; G124-F137 CarbonylContact C-O 3.5Å; G124-F137 WeakPolarHBondContact CA-O 3.44Å; L125-F137 HydrophobicContact CB-CB 4.34Å; L125-F137 PolarHBondContact N-O 3.05Å; L125-F137 PolarHBondContact O-N 3.11Å; L127-F137 HydrophobicContact CD1-CE2 4.23Å; D135-F137 HydrophobicContact CB-CD2 4.41Å; D135-F137 HydrophobicContact CB-CE2 3.56Å; D135-F137 HydrophobicContact CB-CZ 4.02Å
138	P	71.9	Confident	75.6	Confident	29 Å²	29	75.6 Å²	75.6	19%	0.188	40%	0.404	C	S	.	.	S	Bend	cis	-62.3	150.1	-10.4	28	-34.9	0	0	0	111.8	R136	R136-P138 CarbonylContact O-C 3.53Å
139	K	71.2	Confident	75.6	Confident	131 Å²	131	78.8 Å²	78.8	57%	0.57	42%	0.416	S	S	*	.	P	Polyproline II helix	trans	-62.4	146.1	176.7	-70.7	-174.4	176.7	-177.3	0	109.7	R136 G141 S142	R136-K139 PolarHBondContact O-N 2.95Å; K139-G141 PolarHBondContact O-N 3.26Å; K139-G141 VanDerWaalsContact O-N 3.07Å; K139-S142 WeakPolarHBondContact O-CB 3.5Å; K139-S142 PolarHBondContact O-N 3.19Å
140	I	66.3	Low	75.7	Confident	156 Å²	156	77.1 Å²	77.1	80%	0.8	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	116.2	-178.8	-59.7	175.5	0	0	0	109
141	G	61.9	Low	76	Confident	70 Å²	70	76.6 Å²	76.6	72%	0.722	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	93.8	-3.2	-177	0	0	0	0	0	115.7	K139	K139-G141 PolarHBondContact O-N 3.26Å; K139-G141 VanDerWaalsContact O-N 3.07Å
142	S	65.5	Low	76.2	Confident	44 Å²	44	72.6 Å²	72.6	31%	0.308	38%	0.384	S	S	.	.			trans	-68.7	143.4	170.6	179.3	0	0	0	0	111.4	K139 D144	K139-S142 WeakPolarHBondContact O-CB 3.5Å; K139-S142 PolarHBondContact O-N 3.19Å; S142-D144 VanDerWaalsContact C-N 3.34Å; S142-D144 WeakPolarHBondContact OG-CB 3.27Å; S142-D144 PolarHBondContact OG-N 3Å; S142-D144 PolarHBondContact OG-OD2 3.17Å
143	K	60.7	Low	76.8	Confident	150 Å²	150	68.5 Å²	68.5	65%	0.652	36%	0.355	S	S	*	.			trans	-84.1	-9.7	170.5	-66.2	-175.6	178.9	-178.8	0	112.9	I145	K143-I145 PolarHBondContact O-N 3.42Å; K143-I145 VanDerWaalsContact O-N 3.07Å
144	D	64.8	Low	77.1	Confident	101 Å²	101	66.7 Å²	66.7	54%	0.54	34%	0.344	S	S	.	.			trans	-83.2	88.6	-172.9	-51.6	-43.7	0	0	0	110.2	S52 S142	S52-D144 WeakPolarHBondContact CB-O 3.36Å; S142-D144 VanDerWaalsContact C-N 3.34Å; S142-D144 WeakPolarHBondContact OG-CB 3.27Å; S142-D144 PolarHBondContact OG-N 3Å; S142-D144 PolarHBondContact OG-OD2 3.17Å
145	I	68	Low	77.4	Confident	81 Å²	81	62.1 Å²	62.1	42%	0.415	32%	0.324	S	S	.	.			trans	-93.7	121.2	-177.2	-55.3	173.8	0	0	0	109.6	E122 K143 A147	E122-I145 HydrophobicContact CB-CG2 4.19Å; E122-I145 HydrophobicContact CG-CG2 3.63Å; K143-I145 PolarHBondContact O-N 3.42Å; K143-I145 VanDerWaalsContact O-N 3.07Å; I145-A147 HydrophobicContact CG2-CB 4.03Å; I145-A147 PolarHBondContact O-N 3.02Å
146	C	78.2	Confident	77.7	Confident	3 Å²	3	61.3 Å²	61.3	2%	0.02	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	105.2	166.1	-159.6	0	0	0	0	108.4	C50 S52 L53 E122 F123	C50-C146 HydrophobicContact CB-CB 4.42Å; C50-C146 WeakPolarHBondContact CB-SG 3.41Å; C50-C146 VanDerWaalsContact SG-CA 3.55Å; C50-C146 WeakPolarHBondContact SG-CB 3.44Å; C50-C146 CovalentContact SG-SG 2.02Å; C50-C146 PolarHBondContact SG-SG 3.22Å; S52-C146 PolarHBondContact OG-N 2.81Å; L53-C146 HydrophobicContact CD1-CB 3.89Å; L53-C146 WeakPolarHBondContact CD1-SG 3.4Å; L53-C146 HydrophobicContact CD2-CB 4.38Å; L53-C146 HydrophobicContact CG-CB 3.91Å; E122-C146 CarbonylContact C-O 3.28Å; E122-C146 WeakPolarHBondContact CA-O 3.13Å; F123-C146 HydrophobicContact CB-CB 4.08Å; F123-C146 PolarHBondContact N-O 3.37Å
147	A	80.7	Confident	78.1	Confident	36 Å²	36	56.7 Å²	56.7	30%	0.298	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	150.6	-178.3	0	0	0	0	0	113.1	L120 Y121 E122 I145	L120-A147 HydrophobicContact CD1-CB 3.86Å; L120-A147 HydrophobicContact CG-CB 4.25Å; Y121-A147 CarbonylContact O-C 3.58Å; Y121-A147 WeakPolarHBondContact O-CA 3.41Å; E122-A147 HydrophobicContact CG-CB 4.47Å; I145-A147 HydrophobicContact CG2-CB 4.03Å; I145-A147 PolarHBondContact O-N 3.02Å
148	C	82.1	Confident	78.6	Confident	4 Å²	4	55.5 Å²	55.5	3%	0.027	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	141.6	171.6	-167.5	0	0	0	0	111.5	L48 C61 I66 Y121 F123	L48-C148 HydrophobicContact CD1-CB 4.3Å; L48-C148 WeakPolarHBondContact CD1-SG 3.24Å; C61-C148 HydrophobicContact CB-CB 4.32Å; C61-C148 WeakPolarHBondContact CB-SG 3.5Å; C61-C148 WeakPolarHBondContact SG-CB 3.23Å; C61-C148 CovalentContact SG-SG 2Å; C61-C148 PolarHBondContact SG-SG 3.27Å; I66-C148 HydrophobicContact CD1-CB 4.49Å; Y121-C148 PolarHBondContact N-O 3.34Å; Y121-C148 PolarHBondContact O-N 3.5Å; F123-C148 HydrophobicContact CE2-CB 4.12Å
149	K	84.1	Confident	79.3	Confident	115 Å²	115	57.8 Å²	57.8	50%	0.5	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	127.8	176.5	-160.3	-173.8	177.1	-162.2	0	109.6	N118 R119 L120	N118-K149 WeakPolarHBondContact OD1-CE 3.17Å; N118-K149 PolarHBondContact OD1-NZ 3.19Å; R119-K149 CarbonylContact O-C 3.58Å; R119-K149 WeakPolarHBondContact O-CA 3.27Å; L120-K149 HydrophobicContact CD1-CB 4.08Å
150	T	87.3	Confident	79.8	Confident	2 Å²	2	55.4 Å²	55.4	1%	0.012	31%	0.307	C	S	.	.	P	Polyproline II helix	trans	-66.6	146.5	168.4	48	0	0	0	0	110.3	Y62 R63 I66 L115 K116 N118 R119 Y121	Y62-T150 WeakPolarHBondContact O-CA 3.39Å; Y62-T150 WeakPolarHBondContact O-CB 3.33Å; R63-T150 WeakPolarHBondContact O-CB 3.4Å; I66-T150 HydrophobicContact CD1-CG2 4.14Å; I66-T150 HydrophobicContact CG1-CG2 4.22Å; L115-T150 HydrophobicContact CB-CG2 4.22Å; L115-T150 HydrophobicContact CD1-CG2 4.18Å; K116-T150 PolarHBondContact O-OG1 3.11Å; N118-T150 WeakPolarHBondContact CA-O 3.28Å; N118-T150 PolarHBondContact N-O 3.13Å; N118-T150 PolarHBondContact N-OG1 3.35Å; R119-T150 PolarHBondContact N-OG1 3.29Å; R119-T150 PolarHBondContact O-N 3.17Å; R119-T150 PolarHBondContact O-OG1 3.23Å; R119-T150 VanDerWaalsContact O-OG1 3.13Å; Y121-T150 HydrophobicContact CD2-CG2 4Å; Y121-T150 HydrophobicContact CE2-CG2 3.88Å
151	Y	86.2	Confident	80.7	Confident	89 Å²	89	49.2 Å²	49.2	35%	0.349	28%	0.276	S	S	.	.	P	Polyproline II helix	trans	-68.6	154.8	176.6	-75.2	-87.4	0	0	0	111.2	L43 V45 C61 Y62 P117 N118	L43-Y151 HydrophobicContact CD1-CD1 4.33Å; L43-Y151 HydrophobicContact CD1-CD2 4.17Å; L43-Y151 HydrophobicContact CD1-CG 3.83Å; L43-Y151 HydrophobicContact CD2-CD1 3.89Å; L43-Y151 HydrophobicContact CD2-CE1 4.06Å; L43-Y151 HydrophobicContact CD2-CG 4.17Å; V45-Y151 HydrophobicContact CG2-CE2 4.32Å; C61-Y151 WeakPolarHBondContact O-CD2 3.29Å; C61-Y151 WeakPolarHBondContact O-CE2 3.44Å; Y62-Y151 PolarHBondContact O-N 3.49Å; P117-Y151 WeakPolarHBondContact CB-O 3.37Å; N118-Y151 PolarHBondContact N-O 3.31Å; N118-Y151 VanDerWaalsContact N-O 3.08Å
152	P	86.8	Confident	81.7	Confident	31 Å²	31	49.1 Å²	49.1	20%	0.201	25%	0.253	C	S	.	.	P	Polyproline II helix	trans	-60.7	162	168.5	-21.1	33.8	0	0	0	112.4	R63 N118 N181 E183 I238	R63-P152 WeakPolarHBondContact CD-O 3.47Å; R63-P152 WeakPolarHBondContact CG-O 3.35Å; N118-P152 HydrophobicContact CB-CB 4.41Å; N118-P152 HydrophobicContact CB-CG 4.28Å; P152-N181 WeakPolarHBondContact CA-O 3.22Å; P152-N181 WeakPolarHBondContact CB-O 3.41Å; P152-E183 HydrophobicContact CB-CG 4.03Å; P152-I238 HydrophobicContact CB-CD1 3.74Å
153	D	88.7	Confident	82.5	Confident	15 Å²	15	50.8 Å²	50.8	8%	0.08	25%	0.254	C	S	.	.			trans	-142.4	178.6	-174.8	-159.1	15.8	0	0	0	112.4	R63 R64 P117 N181 N236	R63-D153 HydrophobicContact CB-CB 4.23Å; R63-D153 WeakPolarHBondContact CD-OD1 3.36Å; R63-D153 IonicContact CZ-OD1 3.6Å; R63-D153 IonicContact NE-OD1 2.73Å; R63-D153 IonicContact NH1-OD1 2.67Å; R63-D153 PolarHBondContact NH1-OD1 2.92Å; R64-D153 IonicContact CZ-OD2 2.72Å; R64-D153 IonicContact NE-OD2 2.63Å; R64-D153 PolarHBondContact NE-OD2 2.83Å; R64-D153 IonicContact NH2-OD2 3.79Å; P117-D153 HydrophobicContact CB-CB 3.52Å; P117-D153 HydrophobicContact CG-CB 3.85Å; D153-N181 HydrophobicContact CB-CB 4.19Å; D153-N181 PolarHBondContact N-O 3.3Å; D153-N236 PolarHBondContact O-ND2 2.94Å
154	V	88.4	Confident	83.2	Confident	28 Å²	28	45 Å²	45	17%	0.17	23%	0.229	C	C	.	.	P	Polyproline II helix	trans	-58.6	152.7	169.7	-60.2	0	0	0	0	110.9	N181 I238	V154-N181 WeakPolarHBondContact O-CB 3.11Å; V154-N181 PolarHBondContact O-ND2 3.3Å; V154-I238 HydrophobicContact CG1-CG2 3.9Å
155	P	90.4	Very high	83.6	Confident	2 Å²	2	42.5 Å²	42.5	1%	0.013	21%	0.212	C	C	.	.	P	Polyproline II helix	trans	-65.9	156.1	-179.7	-14.6	30.4	0	0	0	111.4	I185 A234 N236 S241	P155-I185 HydrophobicContact CB-CD1 4.08Å; P155-I185 HydrophobicContact CB-CG1 3.92Å; P155-I185 HydrophobicContact CG-CG1 3.88Å; P155-A234 HydrophobicContact CB-CB 3.84Å; P155-A234 HydrophobicContact CG-CB 4.1Å; P155-N236 VanDerWaalsContact CD-CG 3.49Å; P155-N236 HydrophobicContact CG-CB 3.81Å; P155-S241 VanDerWaalsContact O-CA 3.32Å; P155-S241 WeakPolarHBondContact O-CA 3.45Å; P155-S241 WeakPolarHBondContact O-CB 3.4Å
156	D	89.6	Confident	83.6	Confident	43 Å²	43	41.6 Å²	41.6	23%	0.23	21%	0.207	C	C	.	.	P	Polyproline II helix	trans	-73.4	156.2	168.9	-64.3	-25.9	0	0	0	110.3	R64 N178 N179 N181	R64-D156 IonicContact CZ-OD1 3.94Å; R64-D156 IonicContact NH1-OD1 2.73Å; R64-D156 IonicContact NH2-OD1 3.84Å; R64-D156 PolarHBondContact NH2-OD1 3.38Å; D156-N178 HydrophobicContact CB-CB 4.13Å; D156-N178 WeakPolarHBondContact CB-ND2 3.44Å; D156-N179 PolarHBondContact N-O 2.8Å; D156-N181 VanDerWaalsContact CG-ND2 3.33Å; D156-N181 PolarHBondContact N-ND2 2.9Å; D156-N181 PolarHBondContact OD1-ND2 2.99Å
157	A	89.2	Confident	83.2	Confident	28 Å²	28	48 Å²	48	23%	0.231	24%	0.237	C	C	.	.	P	Polyproline II helix	trans	-59.1	141.3	-175.4	0	0	0	0	0	113.2	N178 D242	A157-N178 WeakPolarHBondContact O-CB 3.23Å; A157-N178 PolarHBondContact O-ND2 3.05Å; A157-D242 HydrophobicContact CB-CB 4.12Å; A157-D242 VanDerWaalsContact CB-O 3.24Å; A157-D242 WeakPolarHBondContact CB-O 3.28Å
158	P	88.9	Confident	82.7	Confident	7 Å²	7	47.8 Å²	47.8	5%	0.045	24%	0.238	C	C	.	.	P	Polyproline II helix	trans	-53.7	140.4	177.3	-26.1	33.9	0	0	0	113.4	W175 Y188 L232 A234 A244	P158-W175 HydrophobicContact CB-CB 4.47Å; P158-Y188 HydrophobicContact CG-CD1 4.13Å; P158-Y188 HydrophobicContact CG-CE1 4.14Å; P158-L232 HydrophobicContact CB-CD2 3.92Å; P158-L232 HydrophobicContact CG-CD2 3.95Å; P158-L232 HydrophobicContact CG-CG 4.13Å; P158-A234 HydrophobicContact CG-CB 4.24Å; P158-A244 HydrophobicContact CB-CB 4.19Å; P158-A244 HydrophobicContact CG-CB 4.49Å; P158-A244 WeakPolarHBondContact O-CB 3.49Å
159	L	86.4	Confident	82.4	Confident	77 Å²	77	50.1 Å²	50.1	40%	0.403	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	161.3	-179.8	-61.9	174.6	0	0	0	111.3	L161 T176 N178	L159-L161 PolarHBondContact O-N 3.23Å; L159-T176 PolarHBondContact N-O 3.33Å; L159-T176 PolarHBondContact O-N 3.15Å; L159-N178 HydrophobicContact CD1-CB 4.36Å; L159-N178 HydrophobicContact CG-CB 4.14Å
160	D	82.3	Confident	82.1	Confident	81 Å²	81	49.5 Å²	49.5	43%	0.433	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	52.5	24.3	172.1	-47.9	-49.2	0	0	0	117.4	R162 T176	D160-R162 WeakPolarHBondContact O-CG 3.45Å; D160-R162 PolarHBondContact O-N 3.45Å; D160-R162 PolarHBondContact O-NH1 2.92Å; D160-T176 WeakPolarHBondContact OD2-CB 3.38Å; D160-T176 PolarHBondContact OD2-OG1 2.94Å
161	L	85.3	Confident	81.8	Confident	27 Å²	27	49.5 Å²	49.5	14%	0.141	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-53.7	119.8	-179.9	179.9	61.7	0	0	0	111	L159 L173 E174 W175 L232 A244 L246	L159-L161 PolarHBondContact O-N 3.23Å; L161-L173 HydrophobicContact CD1-CD2 4.36Å; L161-E174 WeakPolarHBondContact CA-O 3.43Å; L161-W175 HydrophobicContact CD1-CB 4.08Å; L161-W175 HydrophobicContact CD1-CE3 4.27Å; L161-L232 HydrophobicContact CD1-CB 4.4Å; L161-L232 HydrophobicContact CD1-CD2 3.87Å; L161-L232 HydrophobicContact CD2-CB 3.94Å; L161-A244 HydrophobicContact CB-CB 4.39Å; L161-A244 HydrophobicContact CD2-CB 3.92Å; L161-L246 HydrophobicContact CD1-CD2 4.46Å; L161-L246 HydrophobicContact CD2-CB 3.81Å; L161-L246 HydrophobicContact CG-CB 3.98Å; L161-L246 HydrophobicContact CG-CD2 4.05Å
162	R	82.4	Confident	81.6	Confident	67 Å²	67	45.6 Å²	45.6	25%	0.253	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	162.4	-174.2	60.4	-173.4	172.1	-110.3	5.3	111.5	D160 L173 E174	D160-R162 WeakPolarHBondContact O-CG 3.45Å; D160-R162 PolarHBondContact O-N 3.45Å; D160-R162 PolarHBondContact O-NH1 2.92Å; R162-L173 CarbonylContact O-C 3.54Å; R162-L173 WeakPolarHBondContact O-CA 3.22Å; R162-E174 HydrophobicContact CG-CB 4Å; R162-E174 IonicContact CZ-OE1 3.57Å; R162-E174 IonicContact CZ-OE2 3.57Å; R162-E174 PolarHBondContact N-O 3.27Å; R162-E174 VanDerWaalsContact NE-CD 3.31Å; R162-E174 IonicContact NE-OE1 3.59Å; R162-E174 IonicContact NE-OE2 2.72Å; R162-E174 PolarHBondContact NE-OE2 3.33Å; R162-E174 IonicContact NH2-OE1 3.77Å; R162-E174 PolarHBondContact NH2-OE1 3.14Å; R162-E174 IonicContact NH2-OE2 3.38Å; R162-E174 PolarHBondContact NH2-OE2 2.91Å; R162-E174 PolarHBondContact O-N 2.85Å
163	Y	82.3	Confident	81.5	Confident	80 Å²	80	44.2 Å²	44.2	31%	0.314	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	155.3	173.5	71.3	-84.6	0	0	0	111.8	Y171 T172 L246 I247 I248	Y163-Y171 AromaticContact CD2-CD1 3.91Å; Y163-Y171 HydrophobicContact CD2-CD1 3.91Å; Y163-Y171 HydrophobicContact CD2-CE1 4.45Å; Y163-Y171 HydrophobicContact CE2-CD1 4.37Å; Y163-Y171 HydrophobicContact CE2-CE1 4.47Å; Y163-T172 CarbonylContact C-O 3.47Å; Y163-T172 WeakPolarHBondContact CA-O 3.44Å; Y163-L246 HydrophobicContact CD1-CD1 4.09Å; Y163-L246 HydrophobicContact CD1-CD2 4Å; Y163-L246 HydrophobicContact CD1-CG 4.23Å; Y163-I247 WeakPolarHBondContact CE1-O 3.27Å; Y163-I248 HydrophobicContact CD1-CB 4.45Å; Y163-I248 HydrophobicContact CD1-CD1 4.21Å; Y163-I248 HydrophobicContact CD1-CG1 3.69Å; Y163-I248 HydrophobicContact CD2-CD1 4.31Å; Y163-I248 HydrophobicContact CD2-CG1 4.32Å; Y163-I248 HydrophobicContact CD2-CG2 4.01Å; Y163-I248 HydrophobicContact CE1-CB 4.43Å; Y163-I248 HydrophobicContact CE1-CG1 4.12Å; Y163-I248 HydrophobicContact CE2-CG2 3.92Å; Y163-I248 HydrophobicContact CG-CD1 3.81Å; Y163-I248 HydrophobicContact CG-CG1 3.78Å; Y163-I248 HydrophobicContact CG-CG2 4.35Å
164	H	74.6	Confident	81.3	Confident	27 Å²	27	44.6 Å²	44.6	13%	0.125	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	131.4	169.3	-49.8	-78.7	0	0	0	108.2	Y171 T172 E174 W398	H164-Y171 CarbonylContact O-C 3.56Å; H164-Y171 VanDerWaalsContact O-CA 3.27Å; H164-Y171 WeakPolarHBondContact O-CA 3.47Å; H164-T172 PolarHBondContact CD2-O 3.38Å; H164-T172 PolarHBondContact N-O 3.31Å; H164-T172 PolarHBondContact O-N 3.01Å; H164-E174 IonicContact CD2-OE2 3.89Å; H164-E174 IonicContact CE1-OE2 2.79Å; H164-E174 IonicContact NE2-OE2 3.6Å; H164-E174 PolarHBondContact NE2-OE2 2.8Å; H164-W398 HydrophobicContact CB-CH2 4.37Å; H164-W398 AromaticContact CD2-CH2 3.6Å; H164-W398 AromaticContact CD2-CZ2 3.94Å; H164-W398 AromaticContact CE1-CZ2 3.56Å; H164-W398 AromaticContact CG-CH2 3.74Å; H164-W398 AromaticContact CG-CZ2 3.82Å; H164-W398 AromaticContact ND1-CZ2 3.6Å; H164-W398 AromaticContact NE2-CH2 3.76Å; H164-W398 AromaticContact NE2-CZ2 3.76Å
165	Y	73.6	Confident	81.3	Confident	50 Å²	50	43.4 Å²	43.4	20%	0.196	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	133.5	173	173.3	-103.5	0	0	0	110	G168 Y171 P251 Q458	Y165-G168 WeakPolarHBondContact CE2-O 3.46Å; Y165-G168 PolarHBondContact OH-N 2.88Å; Y165-Y171 HydrophobicContact CD2-CD1 4.12Å; Y165-Y171 AromaticContact CD2-CE1 3.67Å; Y165-Y171 HydrophobicContact CD2-CE1 3.67Å; Y165-Y171 HydrophobicContact CG-CE1 4.48Å; Y165-P251 HydrophobicContact CD1-CG 4.38Å; Y165-P251 HydrophobicContact CD2-CG 3.73Å; Y165-P251 HydrophobicContact CE1-CG 4.22Å; Y165-P251 HydrophobicContact CE2-CG 3.54Å; Y165-P251 HydrophobicContact CG-CG 4.14Å; Y165-Q458 PolarHBondContact O-NE2 3.36Å; Y165-Q458 VanDerWaalsContact O-NE2 3.13Å
166	M	68.9	Low	81.1	Confident	61 Å²	61	45.7 Å²	45.7	30%	0.3	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	-72.8	-179	-67.3	-72.6	-79.4	0	0	111	Q170 T172	M166-Q170 HydrophobicContact CB-CB 4.21Å; M166-Q170 WeakPolarHBondContact CB-O 3.29Å; M166-Q170 PolarHBondContact N-O 3.48Å; M166-T172 WeakPolarHBondContact CG-OG1 3.44Å
167	Q	68.4	Low	80.9	Confident	138 Å²	138	45.6 Å²	45.6	65%	0.645	23%	0.234	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-161.7	132.1	178.1	-171.1	176.1	6.1	0	0	111.3	N169 Q170	Q167-N169 PolarHBondContact O-N 3.47Å; Q167-Q170 PolarHBondContact N-O 2.88Å; Q167-Q170 WeakPolarHBondContact O-CB 3.35Å; Q167-Q170 PolarHBondContact O-N 3.24Å
168	G	71.3	Confident	80.8	Confident	31 Å²	31	46.7 Å²	46.7	32%	0.32	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.3	-101	174.8	0	0	0	0	0	112.5	Y165	Y165-G168 WeakPolarHBondContact CE2-O 3.46Å; Y165-G168 PolarHBondContact OH-N 2.88Å
169	N	75.1	Confident	80.7	Confident	53 Å²	53	48.9 Å²	48.9	28%	0.283	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.5	-1.3	-179	-76.3	57.7	0	0	0	112.7	Q167 Y171 T221 L222 T224	Q167-N169 PolarHBondContact O-N 3.47Å; N169-Y171 WeakPolarHBondContact O-CD2 3.35Å; N169-Y171 WeakPolarHBondContact O-CE2 3.47Å; N169-T221 HydrophobicContact CB-CG2 3.77Å; N169-T221 CarbonylContact O-C 3.52Å; N169-T221 WeakPolarHBondContact O-CA 3.49Å; N169-L222 WeakPolarHBondContact CB-O 3.28Å; N169-L222 VanDerWaalsContact CG-O 3.32Å; N169-L222 PolarHBondContact ND2-O 3.05Å; N169-L222 PolarHBondContact O-N 3.03Å; N169-T224 PolarHBondContact ND2-N 2.84Å; N169-T224 PolarHBondContact ND2-OG1 3.02Å; N169-T224 VanDerWaalsContact OD1-CG2 3.22Å; N169-T224 WeakPolarHBondContact OD1-CG2 3.44Å; N169-T224 PolarHBondContact OD1-OG1 3.37Å
170	Q	78.8	Confident	80.7	Confident	102 Å²	102	48.3 Å²	48.3	48%	0.477	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	136.7	-172.4	-61.8	-173.6	-24.8	0	0	113.3	M166 Q167 I220 T221	M166-Q170 HydrophobicContact CB-CB 4.21Å; M166-Q170 WeakPolarHBondContact CB-O 3.29Å; M166-Q170 PolarHBondContact N-O 3.48Å; Q167-Q170 PolarHBondContact N-O 2.88Å; Q167-Q170 WeakPolarHBondContact O-CB 3.35Å; Q167-Q170 PolarHBondContact O-N 3.24Å; Q170-I220 WeakPolarHBondContact CA-O 3.34Å; Q170-T221 HydrophobicContact CG-CG2 4.48Å
171	Y	80.1	Confident	81	Confident	2 Å²	2	44.5 Å²	44.5	1%	0.008	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	150.6	177.8	-54.9	-102.9	0	0	0	109.9	Y163 H164 Y165 N169 I220 L222 I248 P250 P251	Y163-Y171 AromaticContact CD2-CD1 3.91Å; Y163-Y171 HydrophobicContact CD2-CD1 3.91Å; Y163-Y171 HydrophobicContact CD2-CE1 4.45Å; Y163-Y171 HydrophobicContact CE2-CD1 4.37Å; Y163-Y171 HydrophobicContact CE2-CE1 4.47Å; H164-Y171 CarbonylContact O-C 3.56Å; H164-Y171 VanDerWaalsContact O-CA 3.27Å; H164-Y171 WeakPolarHBondContact O-CA 3.47Å; Y165-Y171 HydrophobicContact CD2-CD1 4.12Å; Y165-Y171 AromaticContact CD2-CE1 3.67Å; Y165-Y171 HydrophobicContact CD2-CE1 3.67Å; Y165-Y171 HydrophobicContact CG-CE1 4.48Å; N169-Y171 WeakPolarHBondContact O-CD2 3.35Å; N169-Y171 WeakPolarHBondContact O-CE2 3.47Å; Y171-I220 PolarHBondContact N-O 3.4Å; Y171-I220 VanDerWaalsContact O-CG1 3.25Å; Y171-I220 WeakPolarHBondContact O-CG1 3.46Å; Y171-I220 PolarHBondContact O-N 3.4Å; Y171-L222 HydrophobicContact CD2-CB 4.17Å; Y171-L222 HydrophobicContact CD2-CD1 3.9Å; Y171-L222 HydrophobicContact CD2-CG 4.27Å; Y171-L222 HydrophobicContact CE2-CB 3.91Å; Y171-L222 HydrophobicContact CE2-CD1 3.92Å; Y171-L222 HydrophobicContact CE2-CG 4.38Å; Y171-I248 HydrophobicContact CD1-CG2 3.77Å; Y171-I248 HydrophobicContact CE1-CG2 3.57Å; Y171-I248 HydrophobicContact CG-CG2 4.35Å; Y171-P250 WeakPolarHBondContact OH-CA 3.44Å; Y171-P251 WeakPolarHBondContact OH-CD 3.41Å
172	T	82.1	Confident	80.8	Confident	7 Å²	7	44.1 Å²	44.1	4%	0.043	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	116.1	170.4	-59	0	0	0	0	108.9	Y163 H164 M166 A218 N219	Y163-T172 CarbonylContact C-O 3.47Å; Y163-T172 WeakPolarHBondContact CA-O 3.44Å; H164-T172 PolarHBondContact CD2-O 3.38Å; H164-T172 PolarHBondContact N-O 3.31Å; H164-T172 PolarHBondContact O-N 3.01Å; M166-T172 WeakPolarHBondContact CG-OG1 3.44Å; T172-A218 WeakPolarHBondContact CA-O 3.44Å; T172-N219 WeakPolarHBondContact CB-OD1 3.15Å; T172-N219 WeakPolarHBondContact CG2-OD1 3.04Å; T172-N219 PolarHBondContact OG1-OD1 3.27Å
173	L	84.8	Confident	80.9	Confident	2 Å²	2	43.5 Å²	43.5	1%	0.01	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	145.1	167.8	-75.3	167.3	0	0	0	110	L161 R162 W175 M190 Q217 A218 I220 F230 L246 I248	L161-L173 HydrophobicContact CD1-CD2 4.36Å; R162-L173 CarbonylContact O-C 3.54Å; R162-L173 WeakPolarHBondContact O-CA 3.22Å; L173-W175 HydrophobicContact CB-CE3 4.34Å; L173-W175 HydrophobicContact CB-CZ3 3.96Å; L173-M190 HydrophobicContact CD1-CE 3.68Å; L173-M190 HydrophobicContact CD1-SD 3.44Å; L173-M190 WeakPolarHBondContact CD1-SD 3.38Å; L173-Q217 CarbonylContact O-C 3.54Å; L173-Q217 WeakPolarHBondContact O-CA 3.47Å; L173-Q217 WeakPolarHBondContact O-CB 3.49Å; L173-A218 PolarHBondContact N-O 3.16Å; L173-A218 PolarHBondContact O-N 2.67Å; L173-I220 HydrophobicContact CD1-CD1 3.68Å; L173-I220 HydrophobicContact CD1-CG1 4.17Å; L173-I220 HydrophobicContact CD1-CG2 3.99Å; L173-I220 HydrophobicContact CG-CD1 3.84Å; L173-I220 HydrophobicContact CG-CG1 4.23Å; L173-F230 HydrophobicContact CD1-CD1 3.83Å; L173-F230 HydrophobicContact CD1-CE1 3.81Å; L173-L246 HydrophobicContact CD2-CD2 3.46Å; L173-L246 VanDerWaalsContact CD2-CD2 3.46Å; L173-I248 HydrophobicContact CD2-CD1 4.13Å
174	E	84.3	Confident	81	Confident	24 Å²	24	43.6 Å²	43.6	11%	0.112	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	139.4	179.4	-169.3	-165.1	169	0	0	109.4	L161 R162 H164 K216 K396	L161-E174 WeakPolarHBondContact CA-O 3.43Å; R162-E174 HydrophobicContact CG-CB 4Å; R162-E174 IonicContact CZ-OE1 3.57Å; R162-E174 IonicContact CZ-OE2 3.57Å; R162-E174 PolarHBondContact N-O 3.27Å; R162-E174 VanDerWaalsContact NE-CD 3.31Å; R162-E174 IonicContact NE-OE1 3.59Å; R162-E174 IonicContact NE-OE2 2.72Å; R162-E174 PolarHBondContact NE-OE2 3.33Å; R162-E174 IonicContact NH2-OE1 3.77Å; R162-E174 PolarHBondContact NH2-OE1 3.14Å; R162-E174 IonicContact NH2-OE2 3.38Å; R162-E174 PolarHBondContact NH2-OE2 2.91Å; R162-E174 PolarHBondContact O-N 2.85Å; H164-E174 IonicContact CD2-OE2 3.89Å; H164-E174 IonicContact CE1-OE2 2.79Å; H164-E174 IonicContact NE2-OE2 3.6Å; H164-E174 PolarHBondContact NE2-OE2 2.8Å; E174-K216 WeakPolarHBondContact CA-O 3.22Å; E174-K396 IonicContact OE2-NZ 3.44Å
175	W	87.5	Confident	81.4	Confident	3 Å²	3	44.2 Å²	44.2	1%	0.011	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	158	179.6	58.7	95.1	0	0	0	112.4	P158 L161 L173 Y188 M190 L213 D215 K216 A218 L232	P158-W175 HydrophobicContact CB-CB 4.47Å; L161-W175 HydrophobicContact CD1-CB 4.08Å; L161-W175 HydrophobicContact CD1-CE3 4.27Å; L173-W175 HydrophobicContact CB-CE3 4.34Å; L173-W175 HydrophobicContact CB-CZ3 3.96Å; W175-Y188 AromaticContact CD1-CE1 3.81Å; W175-Y188 AromaticContact CD1-CZ 3.98Å; W175-Y188 AromaticContact CE2-CD2 3.9Å; W175-Y188 AromaticContact CZ2-CD2 3.73Å; W175-Y188 HydrophobicContact CZ2-CD2 3.73Å; W175-Y188 HydrophobicContact CZ2-CE2 4.28Å; W175-Y188 HydrophobicContact CZ2-CG 4.02Å; W175-Y188 AromaticContact NE1-CD1 3.53Å; W175-Y188 AromaticContact NE1-CD2 3.47Å; W175-Y188 AromaticContact NE1-CE1 3.37Å; W175-Y188 AromaticContact NE1-CE2 3.34Å; W175-Y188 VanDerWaalsContact NE1-CE2 3.34Å; W175-Y188 AromaticContact NE1-CG 3.62Å; W175-Y188 AromaticContact NE1-CZ 3.32Å; W175-Y188 VanDerWaalsContact NE1-CZ 3.32Å; W175-M190 HydrophobicContact CH2-CE 3.88Å; W175-M190 HydrophobicContact CZ3-CE 3.84Å; W175-L213 HydrophobicContact CH2-CD2 3.56Å; W175-L213 HydrophobicContact CZ2-CD2 3.86Å; W175-D215 WeakPolarHBondContact CZ2-O 3.32Å; W175-K216 PolarHBondContact N-O 3.25Å; W175-K216 WeakPolarHBondContact O-CB 3.45Å; W175-A218 HydrophobicContact CH2-CB 3.83Å; W175-A218 HydrophobicContact CZ3-CB 4.05Å; W175-L232 HydrophobicContact CB-CD2 3.9Å; W175-L232 HydrophobicContact CD2-CD2 3.35Å; W175-L232 HydrophobicContact CE3-CD2 3.81Å; W175-L232 HydrophobicContact CG-CD2 3.37Å; W175-L232 HydrophobicContact CZ2-CD2 4.45Å
176	T	86.2	Confident	81.8	Confident	49 Å²	49	47.2 Å²	47.2	30%	0.301	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	122.5	174.1	-56.3	0	0	0	0	108.9	L159 D160 N178	L159-T176 PolarHBondContact N-O 3.33Å; L159-T176 PolarHBondContact O-N 3.15Å; D160-T176 WeakPolarHBondContact OD2-CB 3.38Å; D160-T176 PolarHBondContact OD2-OG1 2.94Å; T176-N178 PolarHBondContact O-N 3.18Å
177	P	85.4	Confident	82.7	Confident	41 Å²	41	46.4 Å²	46.4	27%	0.266	26%	0.255	S	S	.	.			trans	-57.7	136.4	170.4	-22.9	33.3	0	0	0	110.8	I185 Y188 K216	P177-I185 HydrophobicContact CB-CD1 4.46Å; P177-Y188 VanDerWaalsContact CB-OH 3.3Å; P177-Y188 WeakPolarHBondContact CB-OH 3.16Å; P177-Y188 WeakPolarHBondContact CG-OH 3.33Å; P177-K216 HydrophobicContact CG-CD 4.11Å; P177-K216 HydrophobicContact CG-CG 3.94Å
178	N	87.6	Confident	83.6	Confident	51 Å²	51	40.6 Å²	40.6	27%	0.273	23%	0.227	S	C	.	.			trans	-94.3	-172.8	175	-156	-12.3	0	0	0	110.3	D156 A157 L159 T176 D180	D156-N178 HydrophobicContact CB-CB 4.13Å; D156-N178 WeakPolarHBondContact CB-ND2 3.44Å; A157-N178 WeakPolarHBondContact O-CB 3.23Å; A157-N178 PolarHBondContact O-ND2 3.05Å; L159-N178 HydrophobicContact CD1-CB 4.36Å; L159-N178 HydrophobicContact CG-CB 4.14Å; T176-N178 PolarHBondContact O-N 3.18Å; N178-D180 PolarHBondContact O-N 3.35Å
179	N	86.5	Confident	84.3	Confident	53 Å²	53	41 Å²	41	28%	0.283	22%	0.222	S	C	.	.			trans	-57.1	125.5	178.1	-175.8	20.7	0	0	0	111.4	D156 N181	D156-N179 PolarHBondContact N-O 2.8Å; N179-N181 PolarHBondContact ND2-OD1 2.74Å; N179-N181 PolarHBondContact O-N 2.7Å; N179-N181 PolarHBondContact OD1-N 3.24Å
180	D	87.6	Confident	84.8	Confident	65 Å²	65	38.6 Å²	38.6	35%	0.348	21%	0.209	S	C	.	.			trans	-73.6	-9.3	-179.5	67.6	14.1	0	0	0	113.4	N178 G182 E183 I185 N236	N178-D180 PolarHBondContact O-N 3.35Å; D180-G182 PolarHBondContact O-N 2.87Å; D180-G182 VanDerWaalsContact O-N 3.09Å; D180-G182 PolarHBondContact OD1-N 2.71Å; D180-E183 PolarHBondContact O-N 2.91Å; D180-E183 VanDerWaalsContact O-O 3.07Å; D180-I185 HydrophobicContact CB-CD1 4.46Å; D180-I185 HydrophobicContact CB-CG1 4.13Å; D180-N236 PolarHBondContact O-ND2 2.87Å; D180-N236 VanDerWaalsContact O-ND2 3.16Å
181	N	87.9	Confident	85.2	Confident	1 Å²	1	35.5 Å²	35.5	1%	0.005	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.4	23.6	-179	-72.2	-33.9	0	0	0	114.4	R64 P117 N118 P152 D153 V154 D156 N179	R64-N181 PolarHBondContact NH2-ND2 3.25Å; R64-N181 VanDerWaalsContact NH2-ND2 3.17Å; P117-N181 HydrophobicContact CB-CB 4.26Å; P117-N181 HydrophobicContact CG-CB 3.48Å; P117-N181 VanDerWaalsContact CG-CB 3.48Å; P117-N181 WeakPolarHBondContact CG-OD1 3.47Å; N118-N181 WeakPolarHBondContact CB-O 3.4Å; P152-N181 WeakPolarHBondContact CA-O 3.22Å; P152-N181 WeakPolarHBondContact CB-O 3.41Å; D153-N181 HydrophobicContact CB-CB 4.19Å; D153-N181 PolarHBondContact N-O 3.3Å; V154-N181 WeakPolarHBondContact O-CB 3.11Å; V154-N181 PolarHBondContact O-ND2 3.3Å; D156-N181 VanDerWaalsContact CG-ND2 3.33Å; D156-N181 PolarHBondContact N-ND2 2.9Å; D156-N181 PolarHBondContact OD1-ND2 2.99Å; N179-N181 PolarHBondContact ND2-OD1 2.74Å; N179-N181 PolarHBondContact O-N 2.7Å; N179-N181 PolarHBondContact OD1-N 3.24Å
182	G	81.2	Confident	85.5	Confident	20 Å²	20	36.3 Å²	36.3	21%	0.206	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	100.4	-4.3	172.1	0	0	0	0	0	116.9	N118 D180	N118-G182 WeakPolarHBondContact ND2-CA 3.34Å; D180-G182 PolarHBondContact O-N 2.87Å; D180-G182 VanDerWaalsContact O-N 3.09Å; D180-G182 PolarHBondContact OD1-N 2.71Å
183	E	85.6	Confident	85.5	Confident	53 Å²	53	36 Å²	36	25%	0.248	20%	0.198	C	C	.	.	S	Bend	trans	-124.5	124.1	169.6	-81.3	-66.5	155.7	0	0	108.7	P152 D180 I185 N236 K237 I238	P152-E183 HydrophobicContact CB-CG 4.03Å; D180-E183 PolarHBondContact O-N 2.91Å; D180-E183 VanDerWaalsContact O-O 3.07Å; E183-I185 PolarHBondContact O-N 2.88Å; E183-N236 HydrophobicContact CB-CB 4.13Å; E183-N236 WeakPolarHBondContact O-CB 3.36Å; E183-N236 PolarHBondContact O-ND2 2.74Å; E183-K237 WeakPolarHBondContact OE2-CD 3.43Å; E183-K237 IonicContact OE2-NZ 2.6Å; E183-I238 HydrophobicContact CB-CD1 4.28Å; E183-I238 HydrophobicContact CG-CD1 3.75Å; E183-I238 HydrophobicContact CG-CG1 4.12Å
184	P	83.4	Confident	85.1	Confident	83 Å²	83	38.1 Å²	38.1	54%	0.539	21%	0.212	S	C	.	.			trans	-55.4	136.4	-172.6	-27.9	34.7	0	0	0	114	F186 N236	P184-F186 PolarHBondContact O-N 2.8Å; P184-N236 VanDerWaalsContact O-CB 3.27Å; P184-N236 WeakPolarHBondContact O-CB 3.45Å
185	I	83.5	Confident	84.6	Confident	39 Å²	39	39 Å²	39	20%	0.2	22%	0.217	C	C	.	.			trans	-66.5	118	169.2	-57.6	168.1	0	0	0	107.8	P155 P177 D180 E183 T187 Y188 A234 V235	P155-I185 HydrophobicContact CB-CD1 4.08Å; P155-I185 HydrophobicContact CB-CG1 3.92Å; P155-I185 HydrophobicContact CG-CG1 3.88Å; P177-I185 HydrophobicContact CB-CD1 4.46Å; D180-I185 HydrophobicContact CB-CD1 4.46Å; D180-I185 HydrophobicContact CB-CG1 4.13Å; E183-I185 PolarHBondContact O-N 2.88Å; I185-T187 WeakPolarHBondContact CG2-O 3.41Å; I185-Y188 HydrophobicContact CG2-CE1 4.19Å; I185-Y188 HydrophobicContact CG2-CE2 4.3Å; I185-A234 HydrophobicContact CD1-CB 4.03Å; I185-A234 HydrophobicContact CG1-CB 4.33Å; I185-A234 HydrophobicContact CG2-CB 4.07Å; I185-V235 CarbonylContact C-O 3.49Å; I185-V235 WeakPolarHBondContact CA-O 3.46Å
186	F	82.5	Confident	83.5	Confident	114 Å²	114	42 Å²	42	50%	0.5	24%	0.236	S	C	.	.			trans	-104.6	-18.9	-177.9	69.6	-105.2	0	0	0	113.5	P184 V235 N236	P184-F186 PolarHBondContact O-N 2.8Å; F186-V235 HydrophobicContact CE1-CG1 4.07Å; F186-V235 HydrophobicContact CE2-CG1 4.32Å; F186-V235 HydrophobicContact CZ-CG1 3.72Å; F186-V235 PolarHBondContact N-O 3.46Å; F186-N236 WeakPolarHBondContact CE1-O 3.48Å
187	T	86.6	Confident	82	Confident	44 Å²	44	45.7 Å²	45.7	27%	0.27	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.5	172	173.2	-165.7	0	0	0	0	111	I185 L213 V235	I185-T187 WeakPolarHBondContact CG2-O 3.41Å; T187-L213 WeakPolarHBondContact CA-O 3.46Å; T187-V235 HydrophobicContact CG2-CB 3.8Å; T187-V235 HydrophobicContact CG2-CG1 4.36Å; T187-V235 HydrophobicContact CG2-CG2 4.02Å; T187-V235 WeakPolarHBondContact O-CB 3.44Å; T187-V235 PolarHBondContact O-N 2.75Å
188	Y	87.5	Confident	80.3	Confident	15 Å²	15	46.9 Å²	46.9	6%	0.059	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	148.4	164.1	-60.9	-89.4	0	0	0	110.1	P158 W175 P177 I185 L213 L232 R233 A234	P158-Y188 HydrophobicContact CG-CD1 4.13Å; P158-Y188 HydrophobicContact CG-CE1 4.14Å; W175-Y188 AromaticContact CD1-CE1 3.81Å; W175-Y188 AromaticContact CD1-CZ 3.98Å; W175-Y188 AromaticContact CE2-CD2 3.9Å; W175-Y188 AromaticContact CZ2-CD2 3.73Å; W175-Y188 HydrophobicContact CZ2-CD2 3.73Å; W175-Y188 HydrophobicContact CZ2-CE2 4.28Å; W175-Y188 HydrophobicContact CZ2-CG 4.02Å; W175-Y188 AromaticContact NE1-CD1 3.53Å; W175-Y188 AromaticContact NE1-CD2 3.47Å; W175-Y188 AromaticContact NE1-CE1 3.37Å; W175-Y188 AromaticContact NE1-CE2 3.34Å; W175-Y188 VanDerWaalsContact NE1-CE2 3.34Å; W175-Y188 AromaticContact NE1-CG 3.62Å; W175-Y188 AromaticContact NE1-CZ 3.32Å; W175-Y188 VanDerWaalsContact NE1-CZ 3.32Å; P177-Y188 VanDerWaalsContact CB-OH 3.3Å; P177-Y188 WeakPolarHBondContact CB-OH 3.16Å; P177-Y188 WeakPolarHBondContact CG-OH 3.33Å; I185-Y188 HydrophobicContact CG2-CE1 4.19Å; I185-Y188 HydrophobicContact CG2-CE2 4.3Å; Y188-L213 VanDerWaalsContact CD2-O 3.28Å; Y188-L213 WeakPolarHBondContact CD2-O 3.41Å; Y188-L213 PolarHBondContact N-O 2.65Å; Y188-L213 WeakPolarHBondContact O-CD1 3.38Å; Y188-L232 HydrophobicContact CD1-CD2 4.35Å; Y188-L232 HydrophobicContact CD1-CG 4.36Å; Y188-L232 HydrophobicContact CG-CD1 4.42Å; Y188-R233 CarbonylContact C-O 3.58Å; Y188-R233 WeakPolarHBondContact CA-O 3.18Å; Y188-R233 WeakPolarHBondContact CB-O 3.46Å; Y188-A234 HydrophobicContact CD1-CB 3.97Å; Y188-A234 HydrophobicContact CE1-CB 3.71Å
189	N	85.7	Confident	78.4	Confident	40 Å²	40	53.1 Å²	53.1	21%	0.214	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	125.3	165.8	-179.5	-110.6	0	0	0	108.5	L232 R233 V235 M240	N189-L232 WeakPolarHBondContact O-CA 3.21Å; N189-R233 HydrophobicContact CB-CB 4.47Å; N189-R233 PolarHBondContact N-O 2.99Å; N189-R233 PolarHBondContact O-N 2.88Å; N189-V235 HydrophobicContact CB-CG2 4.2Å; N189-M240 HydrophobicContact CB-SD 4.33Å
190	M	86.9	Confident	76.5	Confident	2 Å²	2	55.4 Å²	55.4	1%	0.01	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	132.4	-177.5	-172.8	-176.4	-64.4	0	0	109.7	L173 W175 I208 P210 L213 A218 I220 Q231 L232	L173-M190 HydrophobicContact CD1-CE 3.68Å; L173-M190 HydrophobicContact CD1-SD 3.44Å; L173-M190 WeakPolarHBondContact CD1-SD 3.38Å; W175-M190 HydrophobicContact CH2-CE 3.88Å; W175-M190 HydrophobicContact CZ3-CE 3.84Å; M190-I208 HydrophobicContact CB-CB 4.44Å; M190-I208 HydrophobicContact CG-CB 4.19Å; M190-I208 HydrophobicContact CG-CD1 4.15Å; M190-I208 PolarHBondContact O-N 3.39Å; M190-I208 HydrophobicContact SD-CB 4.15Å; M190-I208 HydrophobicContact SD-CD1 4.04Å; M190-I208 HydrophobicContact SD-CG2 4.1Å; M190-P210 HydrophobicContact CE-CG 4.4Å; M190-P210 HydrophobicContact SD-CG 4.25Å; M190-L213 HydrophobicContact CB-CD1 4.27Å; M190-L213 HydrophobicContact CE-CD2 4.06Å; M190-A218 HydrophobicContact CE-CB 3.94Å; M190-I220 HydrophobicContact SD-CG2 4.04Å; M190-Q231 WeakPolarHBondContact CA-O 3.22Å; M190-L232 HydrophobicContact CB-CD1 3.96Å; M190-L232 HydrophobicContact CE-CD1 3.86Å; M190-L232 HydrophobicContact CG-CD1 4.23Å
191	K	86.6	Confident	75	Confident	37 Å²	37	60.8 Å²	60.8	16%	0.161	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	151	172.5	-51.6	-170.7	-171	177.3	0	110.6	D35 W205 D206 F230 Q231	D35-K191 IonicContact OD2-NZ 3.1Å; D35-K191 PolarHBondContact OD2-NZ 2.89Å; K191-W205 HydrophobicContact CB-CB 4.1Å; K191-W205 HydrophobicContact CB-CD2 4.43Å; K191-W205 HydrophobicContact CB-CE3 3.88Å; K191-W205 HydrophobicContact CD-CB 3.62Å; K191-W205 HydrophobicContact CD-CG 4.29Å; K191-D206 CarbonylContact C-O 3.59Å; K191-D206 WeakPolarHBondContact CA-O 3.46Å; K191-D206 WeakPolarHBondContact CB-O 3.49Å; K191-F230 WeakPolarHBondContact O-CA 3.41Å; K191-Q231 HydrophobicContact CB-CB 4.46Å; K191-Q231 PolarHBondContact N-O 2.86Å; K191-Q231 PolarHBondContact O-N 2.82Å
192	S	85.3	Confident	73.6	Confident	19 Å²	19	69.6 Å²	69.6	13%	0.133	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	156.3	168.9	54.2	0	0	0	0	111.4	D206 I208 A229	S192-D206 PolarHBondContact N-O 2.81Å; S192-D206 PolarHBondContact O-N 3.38Å; S192-I208 VanDerWaalsContact CB-CD1 3.5Å; S192-I208 WeakPolarHBondContact OG-CD1 3.48Å; S192-I208 WeakPolarHBondContact OG-CG1 3.46Å; S192-A229 CarbonylContact C-O 3.56Å; S192-A229 VanDerWaalsContact CA-O 3.23Å; S192-A229 WeakPolarHBondContact CA-O 3.41Å
193	M	82.8	Confident	72.7	Confident	0 Å²	0	71.3 Å²	71.3	0%	0	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	123.3	177.2	179.2	-177.9	82.3	0	0	108.9	F30 P33 I195 P203 K204 W205 S228 A229	F30-M193 HydrophobicContact CE1-CE 3.88Å; F30-M193 HydrophobicContact CZ-CE 4.18Å; P33-M193 HydrophobicContact CG-SD 4.06Å; M193-I195 PolarHBondContact O-N 3.28Å; M193-P203 HydrophobicContact CE-CB 4.37Å; M193-P203 HydrophobicContact CE-CG 4.15Å; M193-P203 HydrophobicContact CG-CB 3.65Å; M193-P203 HydrophobicContact CG-CG 4.41Å; M193-P203 HydrophobicContact SD-CB 3.74Å; M193-P203 HydrophobicContact SD-CG 3.88Å; M193-K204 WeakPolarHBondContact CG-O 3.49Å; M193-W205 HydrophobicContact CB-CD2 4.09Å; M193-W205 HydrophobicContact CB-CE3 3.62Å; M193-W205 HydrophobicContact CB-CH2 4.46Å; M193-W205 HydrophobicContact CB-CZ3 3.83Å; M193-W205 HydrophobicContact SD-CD2 4.47Å; M193-S228 CarbonylContact O-C 3.58Å; M193-S228 WeakPolarHBondContact O-CA 3.05Å; M193-A229 HydrophobicContact CB-CB 4.43Å; M193-A229 HydrophobicContact CE-CB 4.25Å; M193-A229 PolarHBondContact N-O 3.05Å; M193-A229 PolarHBondContact O-N 2.93Å
194	P	77	Confident	71.9	Confident	48 Å²	48	76.4 Å²	76.4	31%	0.312	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	132.5	176.4	29	-33.5	0	0	0	110.5	V196	P194-V196 HydrophobicContact CB-CG2 4Å; P194-V196 HydrophobicContact CG-CG2 4.32Å; P194-V196 PolarHBondContact O-N 2.79Å
195	I	72.9	Confident	71.6	Confident	42 Å²	42	73.2 Å²	73.2	22%	0.215	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	88.3	174.8	-52.5	175.9	0	0	0	107.3	F30 M193 Q227 A229 I247	F30-I195 HydrophobicContact CE2-CG2 4.11Å; F30-I195 HydrophobicContact CZ-CG2 4.4Å; M193-I195 PolarHBondContact O-N 3.28Å; I195-Q227 HydrophobicContact CB-CB 4.23Å; I195-Q227 WeakPolarHBondContact CB-O 3.36Å; I195-Q227 HydrophobicContact CD1-CB 4.23Å; I195-Q227 PolarHBondContact N-O 3.33Å; I195-A229 HydrophobicContact CD1-CB 4.17Å; I195-A229 HydrophobicContact CG1-CB 4.16Å; I195-I247 HydrophobicContact CD1-CD1 4.29Å; I195-I247 HydrophobicContact CD1-CG1 4.33Å; I195-I247 HydrophobicContact CD1-CG2 3.8Å
196	V	65.4	Low	71.4	Confident	67 Å²	67	75.9 Å²	75.9	41%	0.406	41%	0.41	S	S	.	.			trans	-96.5	134.8	179.4	-165.7	0	0	0	0	109.9	P194 S198	P194-V196 HydrophobicContact CB-CG2 4Å; P194-V196 HydrophobicContact CG-CG2 4.32Å; P194-V196 PolarHBondContact O-N 2.79Å; V196-S198 VanDerWaalsContact C-N 3.34Å; V196-S198 WeakPolarHBondContact CG1-OG 3.37Å; V196-S198 PolarHBondContact O-N 2.89Å
197	S	53.3	Low	71.1	Confident	126 Å²	126	74.2 Å²	74.2	88%	0.881	41%	0.413	S	S	*	.			trans	-92.4	24.2	-175.5	64.4	0	0	0	0	114.4
198	S	51.1	Low	70.4	Confident	66 Å²	66	73.9 Å²	73.9	46%	0.462	41%	0.409	S	S	.	.	S	Bend	trans	-127	134.4	-174.4	56	0	0	0	0	112.6	V196 S200	V196-S198 VanDerWaalsContact C-N 3.34Å; V196-S198 WeakPolarHBondContact CG1-OG 3.37Å; V196-S198 PolarHBondContact O-N 2.89Å; S198-S200 PolarHBondContact O-N 3.2Å
199	N	47.2	Very low	69	Low	182 Å²	182	79.3 Å²	79.3	97%	0.973	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.4	32.2	-165.3	-63.4	-14.4	0	0	0	116.6
200	S	46.5	Very low	67.6	Low	100 Å²	100	78.6 Å²	78.6	70%	0.699	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.6	-20.1	-167.9	55.1	0	0	0	0	117	S198	S198-S200 PolarHBondContact O-N 3.2Å
201	E	56.6	Low	65.9	Low	179 Å²	179	87.6 Å²	87.6	84%	0.836	48%	0.483	S	S	*	.	S	Bend	trans	-157.9	144.8	175.1	-113	160.4	-158.3	0	0	110
202	Q	57	Low	64.3	Low	186 Å²	186	91.8 Å²	91.8	87%	0.869	51%	0.507	S	S	*	.			trans	-69.5	126.8	173.5	-78.5	-168.7	-10.6	0	0	109.1	K204	Q202-K204 PolarHBondContact O-N 3.2Å
203	P	62.8	Low	63	Low	55 Å²	55	91.5 Å²	91.5	36%	0.357	51%	0.505	S	S	.	.			trans	-68.1	131	-176.3	30.9	-36.4	0	0	0	109.4	M193	M193-P203 HydrophobicContact CE-CB 4.37Å; M193-P203 HydrophobicContact CE-CG 4.15Å; M193-P203 HydrophobicContact CG-CB 3.65Å; M193-P203 HydrophobicContact CG-CG 4.41Å; M193-P203 HydrophobicContact SD-CB 3.74Å; M193-P203 HydrophobicContact SD-CG 3.88Å
204	K	69	Low	61.7	Low	160 Å²	160	95.9 Å²	95.9	70%	0.696	53%	0.531	S	S	*	.			trans	-106	148.4	-174.6	-170.2	175.9	179.6	-178.9	0	110.7	M193 Q202 D206	M193-K204 WeakPolarHBondContact CG-O 3.49Å; Q202-K204 PolarHBondContact O-N 3.2Å; K204-D206 PolarHBondContact O-N 3.24Å
205	W	78	Confident	61	Low	17 Å²	17	97.1 Å²	97.1	6%	0.064	54%	0.535	C	S	.	.			trans	-74.9	111.4	171.7	-69.4	114.7	0	0	0	111.4	F32 P33 K191 M193 A229 Q231 Y245	F32-W205 HydrophobicContact CB-CZ2 4.26Å; F32-W205 AromaticContact CD1-CH2 3.95Å; F32-W205 HydrophobicContact CD1-CH2 3.95Å; F32-W205 AromaticContact CD1-CZ2 3.74Å; F32-W205 HydrophobicContact CD1-CZ2 3.74Å; F32-W205 HydrophobicContact CE1-CH2 4.36Å; F32-W205 HydrophobicContact CG-CZ2 4.32Å; P33-W205 PolarHBondContact O-NE1 2.83Å; K191-W205 HydrophobicContact CB-CB 4.1Å; K191-W205 HydrophobicContact CB-CD2 4.43Å; K191-W205 HydrophobicContact CB-CE3 3.88Å; K191-W205 HydrophobicContact CD-CB 3.62Å; K191-W205 HydrophobicContact CD-CG 4.29Å; M193-W205 HydrophobicContact CB-CD2 4.09Å; M193-W205 HydrophobicContact CB-CE3 3.62Å; M193-W205 HydrophobicContact CB-CH2 4.46Å; M193-W205 HydrophobicContact CB-CZ3 3.83Å; M193-W205 HydrophobicContact SD-CD2 4.47Å; W205-A229 HydrophobicContact CH2-CB 4.03Å; W205-A229 HydrophobicContact CZ3-CB 4.27Å; W205-Q231 HydrophobicContact CE3-CB 4.13Å; W205-Q231 HydrophobicContact CH2-CB 3.85Å; W205-Q231 HydrophobicContact CZ2-CB 4.28Å; W205-Q231 HydrophobicContact CZ3-CB 3.76Å; W205-Y245 HydrophobicContact CH2-CD1 4.16Å; W205-Y245 HydrophobicContact CH2-CE1 4.06Å; W205-Y245 HydrophobicContact CZ2-CD1 4.34Å; W205-Y245 AromaticContact CZ2-CE1 3.81Å; W205-Y245 HydrophobicContact CZ2-CE1 3.81Å
206	D	79.7	Confident	61.2	Low	94 Å²	94	99.6 Å²	99.6	50%	0.503	55%	0.545	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	127.5	172.1	-67.8	-41.3	0	0	0	110.5	K191 S192 K204 I208	K191-D206 CarbonylContact C-O 3.59Å; K191-D206 WeakPolarHBondContact CA-O 3.46Å; K191-D206 WeakPolarHBondContact CB-O 3.49Å; S192-D206 PolarHBondContact N-O 2.81Å; S192-D206 PolarHBondContact O-N 3.38Å; K204-D206 PolarHBondContact O-N 3.24Å; D206-I208 PolarHBondContact O-N 3.29Å
207	S	74.9	Confident	61.9	Low	79 Å²	79	101 Å²	101	55%	0.552	55%	0.546	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.7	124	175.9	-65	0	0	0	0	110.9
208	I	71.3	Confident	63.2	Low	37 Å²	37	95.3 Å²	95.3	19%	0.19	51%	0.508	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	130.3	169.1	-57.1	169.9	0	0	0	107.3	M190 S192 D206 P210 I220 F230	M190-I208 HydrophobicContact CB-CB 4.44Å; M190-I208 HydrophobicContact CG-CB 4.19Å; M190-I208 HydrophobicContact CG-CD1 4.15Å; M190-I208 PolarHBondContact O-N 3.39Å; M190-I208 HydrophobicContact SD-CB 4.15Å; M190-I208 HydrophobicContact SD-CD1 4.04Å; M190-I208 HydrophobicContact SD-CG2 4.1Å; S192-I208 VanDerWaalsContact CB-CD1 3.5Å; S192-I208 WeakPolarHBondContact OG-CD1 3.48Å; S192-I208 WeakPolarHBondContact OG-CG1 3.46Å; D206-I208 PolarHBondContact O-N 3.29Å; I208-P210 VanDerWaalsContact C-CD 3.43Å; I208-P210 HydrophobicContact CG2-CG 3.94Å; I208-P210 WeakPolarHBondContact O-CD 3.4Å; I208-I220 HydrophobicContact CG2-CG2 3.99Å; I208-F230 HydrophobicContact CD1-CD1 3.94Å; I208-F230 HydrophobicContact CD1-CE1 3.32Å; I208-F230 HydrophobicContact CD1-CZ 4.2Å
209	T	58.9	Low	64.7	Low	129 Å²	129	97.8 Å²	97.8	79%	0.791	52%	0.515	S	S	*	.			trans	-115.2	75.2	-179.7	-35.1	0	0	0	0	111.5
210	P	56.7	Low	66.2	Low	25 Å²	25	89.5 Å²	89.5	16%	0.162	47%	0.471	C	S	.	.			trans	-64.1	146.3	168.6	-16.4	31.2	0	0	0	111	M190 I208 N212 L213 A218	M190-P210 HydrophobicContact CE-CG 4.4Å; M190-P210 HydrophobicContact SD-CG 4.25Å; I208-P210 VanDerWaalsContact C-CD 3.43Å; I208-P210 HydrophobicContact CG2-CG 3.94Å; I208-P210 WeakPolarHBondContact O-CD 3.4Å; P210-N212 PolarHBondContact O-N 3.17Å; P210-L213 HydrophobicContact CB-CD2 4.22Å; P210-L213 HydrophobicContact CB-CG 4.22Å; P210-L213 HydrophobicContact CG-CD1 4.18Å; P210-L213 HydrophobicContact CG-CD2 4.05Å; P210-L213 HydrophobicContact CG-CG 4.15Å; P210-A218 HydrophobicContact CB-CB 4.01Å; P210-A218 HydrophobicContact CG-CB 3.92Å
211	H	51.3	Low	67.8	Low	191 Å²	191	89.2 Å²	89.2	88%	0.884	47%	0.465	S	S	*	.	S	Bend	trans	-63.2	123.5	172.2	-65.5	-73.3	0	0	0	110.5
212	N	52.6	Low	68.7	Low	125 Å²	125	81.5 Å²	81.5	67%	0.668	43%	0.43	S	S	*	.			trans	49.6	79.2	179.2	-75	3.2	0	0	0	116	P210 T214	P210-N212 PolarHBondContact O-N 3.17Å; N212-T214 PolarHBondContact O-N 2.87Å
213	L	59	Low	69.2	Low	14 Å²	14	76.9 Å²	76.9	7%	0.073	41%	0.411	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.6	42.4	165.6	-76.2	175.2	0	0	0	113.8	W175 T187 Y188 M190 P210 A218	W175-L213 HydrophobicContact CH2-CD2 3.56Å; W175-L213 HydrophobicContact CZ2-CD2 3.86Å; T187-L213 WeakPolarHBondContact CA-O 3.46Å; Y188-L213 VanDerWaalsContact CD2-O 3.28Å; Y188-L213 WeakPolarHBondContact CD2-O 3.41Å; Y188-L213 PolarHBondContact N-O 2.65Å; Y188-L213 WeakPolarHBondContact O-CD1 3.38Å; M190-L213 HydrophobicContact CB-CD1 4.27Å; M190-L213 HydrophobicContact CE-CD2 4.06Å; P210-L213 HydrophobicContact CB-CD2 4.22Å; P210-L213 HydrophobicContact CB-CG 4.22Å; P210-L213 HydrophobicContact CG-CD1 4.18Å; P210-L213 HydrophobicContact CG-CD2 4.05Å; P210-L213 HydrophobicContact CG-CG 4.15Å; L213-A218 HydrophobicContact CD2-CB 3.94Å
214	T	55.5	Low	69	Low	92 Å²	92	76.1 Å²	76.1	56%	0.564	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.1	-22.7	161.3	47.5	0	0	0	0	111.7	N212	N212-T214 PolarHBondContact O-N 2.87Å
215	D	62.4	Low	68.6	Low	73 Å²	73	73 Å²	73	39%	0.39	40%	0.397	S	S	.	.	S	Bend	trans	-85.1	158.4	-173.7	-69.6	-13.1	0	0	0	113.1	W175 Q217	W175-D215 WeakPolarHBondContact CZ2-O 3.32Å; D215-Q217 PolarHBondContact O-N 3.1Å
216	K	76.1	Confident	68.1	Low	95 Å²	95	76.3 Å²	76.3	41%	0.413	41%	0.412	S	S	.	.	S	Bend	trans	-77.7	9.4	178.6	-59.5	-173.5	-174.6	-175.6	0	113.8	E174 W175 P177	E174-K216 WeakPolarHBondContact CA-O 3.22Å; W175-K216 PolarHBondContact N-O 3.25Å; W175-K216 WeakPolarHBondContact O-CB 3.45Å; P177-K216 HydrophobicContact CG-CD 4.11Å; P177-K216 HydrophobicContact CG-CG 3.94Å
217	Q	80.1	Confident	68.1	Low	95 Å²	95	75.1 Å²	75.1	44%	0.444	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	152.3	-173.4	63	-178.4	7.6	0	0	110.4	L173 D215	L173-Q217 CarbonylContact O-C 3.54Å; L173-Q217 WeakPolarHBondContact O-CA 3.47Å; L173-Q217 WeakPolarHBondContact O-CB 3.49Å; D215-Q217 PolarHBondContact O-N 3.1Å
218	A	81.1	Confident	68.3	Low	8 Å²	8	71.9 Å²	71.9	7%	0.066	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	137.8	171.4	0	0	0	0	0	111.1	T172 L173 W175 M190 P210 L213	T172-A218 WeakPolarHBondContact CA-O 3.44Å; L173-A218 PolarHBondContact N-O 3.16Å; L173-A218 PolarHBondContact O-N 2.67Å; W175-A218 HydrophobicContact CH2-CB 3.83Å; W175-A218 HydrophobicContact CZ3-CB 4.05Å; M190-A218 HydrophobicContact CE-CB 3.94Å; P210-A218 HydrophobicContact CB-CB 4.01Å; P210-A218 HydrophobicContact CG-CB 3.92Å; L213-A218 HydrophobicContact CD2-CB 3.94Å
219	N	81.1	Confident	68.9	Low	117 Å²	117	70.1 Å²	70.1	63%	0.626	37%	0.372	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.9	129.1	170.5	-66.5	-24.7	0	0	0	109.3	T172	T172-N219 WeakPolarHBondContact CB-OD1 3.15Å; T172-N219 WeakPolarHBondContact CG2-OD1 3.04Å; T172-N219 PolarHBondContact OG1-OD1 3.27Å
220	I	79.4	Confident	70.2	Confident	8 Å²	8	64.1 Å²	64.1	4%	0.041	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	156.5	-178.7	53.9	156.6	0	0	0	110.2	Q170 Y171 L173 M190 I208 L222 F230 I248	Q170-I220 WeakPolarHBondContact CA-O 3.34Å; Y171-I220 PolarHBondContact N-O 3.4Å; Y171-I220 VanDerWaalsContact O-CG1 3.25Å; Y171-I220 WeakPolarHBondContact O-CG1 3.46Å; Y171-I220 PolarHBondContact O-N 3.4Å; L173-I220 HydrophobicContact CD1-CD1 3.68Å; L173-I220 HydrophobicContact CD1-CG1 4.17Å; L173-I220 HydrophobicContact CD1-CG2 3.99Å; L173-I220 HydrophobicContact CG-CD1 3.84Å; L173-I220 HydrophobicContact CG-CG1 4.23Å; M190-I220 HydrophobicContact SD-CG2 4.04Å; I208-I220 HydrophobicContact CG2-CG2 3.99Å; I220-L222 HydrophobicContact CD1-CD1 4.37Å; I220-L222 HydrophobicContact CD1-CG 4.34Å; I220-F230 HydrophobicContact CD1-CE1 3.5Å; I220-F230 VanDerWaalsContact CD1-CE1 3.5Å; I220-F230 HydrophobicContact CD1-CE2 4.39Å; I220-F230 HydrophobicContact CD1-CZ 3.36Å; I220-I248 HydrophobicContact CD1-CD1 3.95Å
221	T	80.6	Confident	71.7	Confident	95 Å²	95	63 Å²	63	58%	0.583	33%	0.327	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.6	130	171.1	-53.9	0	0	0	0	108.2	N169 Q170	N169-T221 HydrophobicContact CB-CG2 3.77Å; N169-T221 CarbonylContact O-C 3.52Å; N169-T221 WeakPolarHBondContact O-CA 3.49Å; Q170-T221 HydrophobicContact CG-CG2 4.48Å
222	L	74.8	Confident	73.5	Confident	16 Å²	16	54 Å²	54	8%	0.084	29%	0.286	C	S	.	.			trans	-117.3	150.8	-180	-79.5	174.6	0	0	0	110.1	N169 Y171 I220 F230 I248	N169-L222 WeakPolarHBondContact CB-O 3.28Å; N169-L222 VanDerWaalsContact CG-O 3.32Å; N169-L222 PolarHBondContact ND2-O 3.05Å; N169-L222 PolarHBondContact O-N 3.03Å; Y171-L222 HydrophobicContact CD2-CB 4.17Å; Y171-L222 HydrophobicContact CD2-CD1 3.9Å; Y171-L222 HydrophobicContact CD2-CG 4.27Å; Y171-L222 HydrophobicContact CE2-CB 3.91Å; Y171-L222 HydrophobicContact CE2-CD1 3.92Å; Y171-L222 HydrophobicContact CE2-CG 4.38Å; I220-L222 HydrophobicContact CD1-CD1 4.37Å; I220-L222 HydrophobicContact CD1-CG 4.34Å; L222-F230 HydrophobicContact CD1-CE2 3.76Å; L222-F230 HydrophobicContact CD1-CZ 3.76Å; L222-F230 HydrophobicContact CD2-CE2 4.05Å; L222-F230 HydrophobicContact CD2-CZ 3.63Å; L222-F230 HydrophobicContact CG-CE2 4.37Å; L222-F230 HydrophobicContact CG-CZ 3.94Å; L222-I248 HydrophobicContact CD1-CB 4Å; L222-I248 HydrophobicContact CD1-CD1 4.08Å; L222-I248 HydrophobicContact CD1-CG2 3.78Å
223	D	68.8	Low	75.2	Confident	90 Å²	90	48.8 Å²	48.8	48%	0.481	26%	0.257	S	S	.	.			trans	-65.6	144	166.7	-171.6	27.4	0	0	0	111	N225	D223-N225 VanDerWaalsContact C-N 3.32Å; D223-N225 PolarHBondContact O-N 2.87Å; D223-N225 PolarHBondContact OD1-ND2 3.29Å; D223-N225 PolarHBondContact OD2-ND2 2.9Å
224	T	57.2	Low	76.6	Confident	39 Å²	39	48.1 Å²	48.1	24%	0.239	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.2	-11.5	-167.9	3.9	0	0	0	0	113.7	N169	N169-T224 PolarHBondContact ND2-N 2.84Å; N169-T224 PolarHBondContact ND2-OG1 3.02Å; N169-T224 VanDerWaalsContact OD1-CG2 3.22Å; N169-T224 WeakPolarHBondContact OD1-CG2 3.44Å; N169-T224 PolarHBondContact OD1-OG1 3.37Å
225	N	62	Low	78.1	Confident	95 Å²	95	44.3 Å²	44.3	51%	0.508	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.5	-16.5	-164.9	-57.6	-57	0	0	0	114.7	D223	D223-N225 VanDerWaalsContact C-N 3.32Å; D223-N225 PolarHBondContact O-N 2.87Å; D223-N225 PolarHBondContact OD1-ND2 3.29Å; D223-N225 PolarHBondContact OD2-ND2 2.9Å
226	H	67.3	Low	79.3	Confident	85 Å²	85	41 Å²	41	39%	0.394	21%	0.212	S	C	.	.	S	Bend	trans	-133.7	153.8	-170.9	-58.4	-64.8	0	0	0	112.3	P250	H226-P250 WeakPolarHBondContact O-CD 3.36Å; H226-P250 WeakPolarHBondContact O-CG 3.47Å
227	Q	78.4	Confident	79.6	Confident	70 Å²	70	44.2 Å²	44.2	33%	0.327	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	147.5	166.7	-58.5	-175.7	30.2	0	0	108.4	I195 I248 R249	I195-Q227 HydrophobicContact CB-CB 4.23Å; I195-Q227 WeakPolarHBondContact CB-O 3.36Å; I195-Q227 HydrophobicContact CD1-CB 4.23Å; I195-Q227 PolarHBondContact N-O 3.33Å; Q227-I248 WeakPolarHBondContact CA-O 3.3Å; Q227-R249 HydrophobicContact CG-CB 4.41Å; Q227-R249 HydrophobicContact CG-CG 4.05Å; Q227-R249 VanDerWaalsContact OE1-NE 3.11Å
228	S	79.1	Confident	79.9	Confident	10 Å²	10	41.5 Å²	41.5	7%	0.07	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	127.9	179.5	-64.9	0	0	0	0	111.2	M193 I248	M193-S228 CarbonylContact O-C 3.58Å; M193-S228 WeakPolarHBondContact O-CA 3.05Å; S228-I248 PolarHBondContact N-O 3.41Å; S228-I248 PolarHBondContact O-N 3.18Å
229	A	84.8	Confident	80	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	149.9	166.4	0	0	0	0	0	110.2	F32 S192 M193 I195 W205 L246	F32-A229 HydrophobicContact CD1-CB 4.49Å; F32-A229 HydrophobicContact CE1-CB 3.86Å; S192-A229 CarbonylContact C-O 3.56Å; S192-A229 VanDerWaalsContact CA-O 3.23Å; S192-A229 WeakPolarHBondContact CA-O 3.41Å; M193-A229 HydrophobicContact CB-CB 4.43Å; M193-A229 HydrophobicContact CE-CB 4.25Å; M193-A229 PolarHBondContact N-O 3.05Å; M193-A229 PolarHBondContact O-N 2.93Å; I195-A229 HydrophobicContact CD1-CB 4.17Å; I195-A229 HydrophobicContact CG1-CB 4.16Å; W205-A229 HydrophobicContact CH2-CB 4.03Å; W205-A229 HydrophobicContact CZ3-CB 4.27Å; A229-L246 CarbonylContact C-O 3.53Å; A229-L246 WeakPolarHBondContact CA-O 3.49Å
230	F	86.6	Confident	80.3	Confident	3 Å²	3	40.4 Å²	40.4	1%	0.013	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	143.3	179.1	-79.5	-99.3	0	0	0	110.4	L173 K191 I208 I220 L222 Y245 L246 I248	L173-F230 HydrophobicContact CD1-CD1 3.83Å; L173-F230 HydrophobicContact CD1-CE1 3.81Å; K191-F230 WeakPolarHBondContact O-CA 3.41Å; I208-F230 HydrophobicContact CD1-CD1 3.94Å; I208-F230 HydrophobicContact CD1-CE1 3.32Å; I208-F230 HydrophobicContact CD1-CZ 4.2Å; I220-F230 HydrophobicContact CD1-CE1 3.5Å; I220-F230 VanDerWaalsContact CD1-CE1 3.5Å; I220-F230 HydrophobicContact CD1-CE2 4.39Å; I220-F230 HydrophobicContact CD1-CZ 3.36Å; L222-F230 HydrophobicContact CD1-CE2 3.76Å; L222-F230 HydrophobicContact CD1-CZ 3.76Å; L222-F230 HydrophobicContact CD2-CE2 4.05Å; L222-F230 HydrophobicContact CD2-CZ 3.63Å; L222-F230 HydrophobicContact CG-CE2 4.37Å; L222-F230 HydrophobicContact CG-CZ 3.94Å; F230-Y245 WeakPolarHBondContact O-CA 3.34Å; F230-L246 HydrophobicContact CB-CB 4.2Å; F230-L246 PolarHBondContact N-O 3.48Å; F230-L246 PolarHBondContact O-N 3.14Å; F230-L246 VanDerWaalsContact O-N 3.08Å; F230-I248 HydrophobicContact CD2-CB 4.42Å; F230-I248 HydrophobicContact CD2-CD1 3.94Å; F230-I248 HydrophobicContact CD2-CG1 3.78Å; F230-I248 HydrophobicContact CE2-CB 4.03Å; F230-I248 HydrophobicContact CE2-CD1 3.5Å; F230-I248 VanDerWaalsContact CE2-CD1 3.5Å; F230-I248 HydrophobicContact CE2-CG1 3.64Å; F230-I248 HydrophobicContact CZ-CD1 3.87Å; F230-I248 HydrophobicContact CZ-CG1 4.5Å
231	Q	87.3	Confident	80.8	Confident	1 Å²	1	40 Å²	40	1%	0.005	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	131.5	171.5	-163.5	-172.9	82.5	0	0	108.9	M190 K191 W205 P243 A244 Y245	M190-Q231 WeakPolarHBondContact CA-O 3.22Å; K191-Q231 HydrophobicContact CB-CB 4.46Å; K191-Q231 PolarHBondContact N-O 2.86Å; K191-Q231 PolarHBondContact O-N 2.82Å; W205-Q231 HydrophobicContact CE3-CB 4.13Å; W205-Q231 HydrophobicContact CH2-CB 3.85Å; W205-Q231 HydrophobicContact CZ2-CB 4.28Å; W205-Q231 HydrophobicContact CZ3-CB 3.76Å; Q231-P243 HydrophobicContact CG-CB 3.32Å; Q231-P243 HydrophobicContact CG-CG 4.48Å; Q231-A244 CarbonylContact C-O 3.42Å; Q231-A244 WeakPolarHBondContact CA-O 3.22Å; Q231-Y245 HydrophobicContact CB-CD1 4.38Å; Q231-Y245 HydrophobicContact CB-CE1 4.24Å; Q231-Y245 HydrophobicContact CG-CD1 4.23Å; Q231-Y245 HydrophobicContact CG-CE1 3.8Å; Q231-Y245 PolarHBondContact NE2-OH 2.94Å
232	L	88.7	Confident	81.1	Confident	2 Å²	2	41.1 Å²	41.1	1%	0.01	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	129.8	174.1	-171.5	74.9	0	0	0	110.6	P158 L161 W175 Y188 N189 M190 A244	P158-L232 HydrophobicContact CB-CD2 3.92Å; P158-L232 HydrophobicContact CG-CD2 3.95Å; P158-L232 HydrophobicContact CG-CG 4.13Å; L161-L232 HydrophobicContact CD1-CB 4.4Å; L161-L232 HydrophobicContact CD1-CD2 3.87Å; L161-L232 HydrophobicContact CD2-CB 3.94Å; W175-L232 HydrophobicContact CB-CD2 3.9Å; W175-L232 HydrophobicContact CD2-CD2 3.35Å; W175-L232 HydrophobicContact CE3-CD2 3.81Å; W175-L232 HydrophobicContact CG-CD2 3.37Å; W175-L232 HydrophobicContact CZ2-CD2 4.45Å; Y188-L232 HydrophobicContact CD1-CD2 4.35Å; Y188-L232 HydrophobicContact CD1-CG 4.36Å; Y188-L232 HydrophobicContact CG-CD1 4.42Å; N189-L232 WeakPolarHBondContact O-CA 3.21Å; M190-L232 HydrophobicContact CB-CD1 3.96Å; M190-L232 HydrophobicContact CE-CD1 3.86Å; M190-L232 HydrophobicContact CG-CD1 4.23Å; L232-A244 PolarHBondContact N-O 2.91Å; L232-A244 PolarHBondContact O-N 2.93Å
233	R	89.6	Confident	81.7	Confident	17 Å²	17	41.9 Å²	41.9	6%	0.064	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	140	174.7	-63.4	173.5	-179.5	-106.2	13.6	110.2	Y188 N189 M240 S241 P243	Y188-R233 CarbonylContact C-O 3.58Å; Y188-R233 WeakPolarHBondContact CA-O 3.18Å; Y188-R233 WeakPolarHBondContact CB-O 3.46Å; N189-R233 HydrophobicContact CB-CB 4.47Å; N189-R233 PolarHBondContact N-O 2.99Å; N189-R233 PolarHBondContact O-N 2.88Å; R233-M240 HydrophobicContact CB-CB 4.44Å; R233-S241 WeakPolarHBondContact CA-OG 3.22Å; R233-S241 WeakPolarHBondContact CG-O 3.44Å; R233-S241 PolarHBondContact NH1-O 3.31Å; R233-P243 HydrophobicContact CG-CB 4.18Å
234	A	88.1	Confident	82.5	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	145	168.8	0	0	0	0	0	110	P155 P158 I185 Y188 M240 S241	P155-A234 HydrophobicContact CB-CB 3.84Å; P155-A234 HydrophobicContact CG-CB 4.1Å; P158-A234 HydrophobicContact CG-CB 4.24Å; I185-A234 HydrophobicContact CD1-CB 4.03Å; I185-A234 HydrophobicContact CG1-CB 4.33Å; I185-A234 HydrophobicContact CG2-CB 4.07Å; Y188-A234 HydrophobicContact CD1-CB 3.97Å; Y188-A234 HydrophobicContact CE1-CB 3.71Å; A234-M240 CarbonylContact O-C 3.54Å; A234-M240 WeakPolarHBondContact O-CA 3.37Å; A234-S241 PolarHBondContact N-OG 3.44Å; A234-S241 PolarHBondContact O-N 2.81Å
235	V	86.9	Confident	84	Confident	12 Å²	12	40.1 Å²	40.1	7%	0.073	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	125.8	-177.4	-168.5	0	0	0	0	110.5	I185 F186 T187 N189 M240	I185-V235 CarbonylContact C-O 3.49Å; I185-V235 WeakPolarHBondContact CA-O 3.46Å; F186-V235 HydrophobicContact CE1-CG1 4.07Å; F186-V235 HydrophobicContact CE2-CG1 4.32Å; F186-V235 HydrophobicContact CZ-CG1 3.72Å; F186-V235 PolarHBondContact N-O 3.46Å; T187-V235 HydrophobicContact CG2-CB 3.8Å; T187-V235 HydrophobicContact CG2-CG1 4.36Å; T187-V235 HydrophobicContact CG2-CG2 4.02Å; T187-V235 WeakPolarHBondContact O-CB 3.44Å; T187-V235 PolarHBondContact O-N 2.75Å; N189-V235 HydrophobicContact CB-CG2 4.2Å; V235-M240 HydrophobicContact CG1-CG 4.21Å; V235-M240 HydrophobicContact CG2-CG 3.98Å; V235-M240 HydrophobicContact CG2-SD 4.45Å
236	N	86.6	Confident	85.2	Confident	3 Å²	3	36.8 Å²	36.8	2%	0.016	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	-178.8	168	73.2	9.8	0	0	0	110.4	D153 P155 D180 E183 P184 F186 I238 G239	D153-N236 PolarHBondContact O-ND2 2.94Å; P155-N236 VanDerWaalsContact CD-CG 3.49Å; P155-N236 HydrophobicContact CG-CB 3.81Å; D180-N236 PolarHBondContact O-ND2 2.87Å; D180-N236 VanDerWaalsContact O-ND2 3.16Å; E183-N236 HydrophobicContact CB-CB 4.13Å; E183-N236 WeakPolarHBondContact O-CB 3.36Å; E183-N236 PolarHBondContact O-ND2 2.74Å; P184-N236 VanDerWaalsContact O-CB 3.27Å; P184-N236 WeakPolarHBondContact O-CB 3.45Å; F186-N236 WeakPolarHBondContact CE1-O 3.48Å; N236-I238 PolarHBondContact O-N 2.81Å; N236-I238 WeakPolarHBondContact OD1-CB 3.41Å; N236-I238 PolarHBondContact OD1-N 2.65Å; N236-G239 PolarHBondContact N-O 2.9Å; N236-G239 PolarHBondContact O-N 3.13Å; N236-G239 PolarHBondContact OD1-N 2.66Å; N236-G239 PolarHBondContact OD1-O 3.23Å
237	K	83.7	Confident	85.9	Confident	163 Å²	163	33.8 Å²	33.8	71%	0.709	17%	0.172	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59	-16.6	-177.7	-66.6	-174.7	-170.9	160.9	0	114.8	E183	E183-K237 WeakPolarHBondContact OE2-CD 3.43Å; E183-K237 IonicContact OE2-NZ 2.6Å
238	I	84.8	Confident	86	Confident	37 Å²	37	30.5 Å²	30.5	19%	0.19	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.4	-29	-176.4	-67.4	177	0	0	0	111.6	P40 P152 V154 E183 N236	P40-I238 HydrophobicContact CB-CG2 4.32Å; P152-I238 HydrophobicContact CB-CD1 3.74Å; V154-I238 HydrophobicContact CG1-CG2 3.9Å; E183-I238 HydrophobicContact CB-CD1 4.28Å; E183-I238 HydrophobicContact CG-CD1 3.75Å; E183-I238 HydrophobicContact CG-CG1 4.12Å; N236-I238 PolarHBondContact O-N 2.81Å; N236-I238 WeakPolarHBondContact OD1-CB 3.41Å; N236-I238 PolarHBondContact OD1-N 2.65Å
239	G	84.7	Confident	86	Confident	24 Å²	24	34.4 Å²	34.4	25%	0.247	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	156.1	-159.3	-179.8	0	0	0	0	0	113.1	N236	N236-G239 PolarHBondContact N-O 2.9Å; N236-G239 PolarHBondContact O-N 3.13Å; N236-G239 PolarHBondContact OD1-N 2.66Å; N236-G239 PolarHBondContact OD1-O 3.23Å
240	M	87.2	Confident	85.2	Confident	78 Å²	78	35.5 Å²	35.5	38%	0.384	18%	0.177	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	147.7	-176.7	-52	-170.2	-176.8	0	0	111.2	N189 R233 A234 V235	N189-M240 HydrophobicContact CB-SD 4.33Å; R233-M240 HydrophobicContact CB-CB 4.44Å; A234-M240 CarbonylContact O-C 3.54Å; A234-M240 WeakPolarHBondContact O-CA 3.37Å; V235-M240 HydrophobicContact CG1-CG 4.21Å; V235-M240 HydrophobicContact CG2-CG 3.98Å; V235-M240 HydrophobicContact CG2-SD 4.45Å
241	S	89.4	Confident	84	Confident	1 Å²	1	38.6 Å²	38.6	1%	0.007	20%	0.198	C	C	.	.	P	Polyproline II helix	trans	-68.4	168.5	173.4	74.8	0	0	0	0	112.6	P155 R233 A234	P155-S241 VanDerWaalsContact O-CA 3.32Å; P155-S241 WeakPolarHBondContact O-CA 3.45Å; P155-S241 WeakPolarHBondContact O-CB 3.4Å; R233-S241 WeakPolarHBondContact CA-OG 3.22Å; R233-S241 WeakPolarHBondContact CG-O 3.44Å; R233-S241 PolarHBondContact NH1-O 3.31Å; A234-S241 PolarHBondContact N-OG 3.44Å; A234-S241 PolarHBondContact O-N 2.81Å
242	D	87.3	Confident	82.4	Confident	118 Å²	118	45.2 Å²	45.2	63%	0.631	23%	0.227	S	C	*	.	P	Polyproline II helix	trans	-55.3	150.8	156.4	-72.4	-36	0	0	0	111	A157	A157-D242 HydrophobicContact CB-CB 4.12Å; A157-D242 VanDerWaalsContact CB-O 3.24Å; A157-D242 WeakPolarHBondContact CB-O 3.28Å
243	P	86.5	Confident	80.6	Confident	31 Å²	31	52.7 Å²	52.7	20%	0.201	26%	0.261	C	S	.	.	P	Polyproline II helix	trans	-78.5	135.3	-176.4	28.7	-32	0	0	0	113.6	Q231 R233 Y245	Q231-P243 HydrophobicContact CG-CB 3.32Å; Q231-P243 HydrophobicContact CG-CG 4.48Å; R233-P243 HydrophobicContact CG-CB 4.18Å; P243-Y245 HydrophobicContact CB-CE1 4.35Å; P243-Y245 HydrophobicContact CB-CE2 3.93Å; P243-Y245 HydrophobicContact CG-CE2 3.61Å; P243-Y245 WeakPolarHBondContact CG-OH 3.38Å
244	A	87	Confident	78.3	Confident	13 Å²	13	61 Å²	61	11%	0.107	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	133	159.6	0	0	0	0	0	109.8	P158 L161 Q231 L232	P158-A244 HydrophobicContact CB-CB 4.19Å; P158-A244 HydrophobicContact CG-CB 4.49Å; P158-A244 WeakPolarHBondContact O-CB 3.49Å; L161-A244 HydrophobicContact CB-CB 4.39Å; L161-A244 HydrophobicContact CD2-CB 3.92Å; Q231-A244 CarbonylContact C-O 3.42Å; Q231-A244 WeakPolarHBondContact CA-O 3.22Å; L232-A244 PolarHBondContact N-O 2.91Å; L232-A244 PolarHBondContact O-N 2.93Å
245	Y	87.6	Confident	76.1	Confident	79 Å²	79	65.7 Å²	65.7	31%	0.31	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	148.9	-177	-66.4	-77.8	0	0	0	112.8	F32 W205 F230 Q231 P243	F32-Y245 HydrophobicContact CB-CE1 4.02Å; F32-Y245 HydrophobicContact CD1-CD1 4.01Å; F32-Y245 HydrophobicContact CD1-CE1 4.04Å; F32-Y245 AromaticContact CD2-CD1 3.91Å; F32-Y245 HydrophobicContact CD2-CD1 3.91Å; F32-Y245 HydrophobicContact CD2-CD2 4.31Å; F32-Y245 AromaticContact CD2-CE1 3.92Å; F32-Y245 HydrophobicContact CD2-CE1 3.92Å; F32-Y245 HydrophobicContact CD2-CE2 4.3Å; F32-Y245 HydrophobicContact CD2-CG 4.11Å; F32-Y245 HydrophobicContact CE1-CD1 4.06Å; F32-Y245 AromaticContact CE2-CD1 3.96Å; F32-Y245 HydrophobicContact CE2-CD1 3.96Å; F32-Y245 HydrophobicContact CE2-CD2 4.33Å; F32-Y245 HydrophobicContact CE2-CE1 4.44Å; F32-Y245 AromaticContact CE2-CG 3.89Å; F32-Y245 HydrophobicContact CE2-CG 3.89Å; F32-Y245 AromaticContact CG-CD1 3.95Å; F32-Y245 HydrophobicContact CG-CD1 3.95Å; F32-Y245 AromaticContact CG-CE1 3.71Å; F32-Y245 HydrophobicContact CG-CE1 3.71Å; F32-Y245 HydrophobicContact CZ-CD1 4.03Å; F32-Y245 HydrophobicContact CZ-CG 4.2Å; W205-Y245 HydrophobicContact CH2-CD1 4.16Å; W205-Y245 HydrophobicContact CH2-CE1 4.06Å; W205-Y245 HydrophobicContact CZ2-CD1 4.34Å; W205-Y245 AromaticContact CZ2-CE1 3.81Å; W205-Y245 HydrophobicContact CZ2-CE1 3.81Å; F230-Y245 WeakPolarHBondContact O-CA 3.34Å; Q231-Y245 HydrophobicContact CB-CD1 4.38Å; Q231-Y245 HydrophobicContact CB-CE1 4.24Å; Q231-Y245 HydrophobicContact CG-CD1 4.23Å; Q231-Y245 HydrophobicContact CG-CE1 3.8Å; Q231-Y245 PolarHBondContact NE2-OH 2.94Å; P243-Y245 HydrophobicContact CB-CE1 4.35Å; P243-Y245 HydrophobicContact CB-CE2 3.93Å; P243-Y245 HydrophobicContact CG-CE2 3.61Å; P243-Y245 WeakPolarHBondContact CG-OH 3.38Å
246	L	86.6	Confident	73.9	Confident	25 Å²	25	69.4 Å²	69.4	13%	0.131	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	147.3	175.6	178.3	66.8	0	0	0	110.3	L161 Y163 L173 A229 F230 I248	L161-L246 HydrophobicContact CD1-CD2 4.46Å; L161-L246 HydrophobicContact CD2-CB 3.81Å; L161-L246 HydrophobicContact CG-CB 3.98Å; L161-L246 HydrophobicContact CG-CD2 4.05Å; Y163-L246 HydrophobicContact CD1-CD1 4.09Å; Y163-L246 HydrophobicContact CD1-CD2 4Å; Y163-L246 HydrophobicContact CD1-CG 4.23Å; L173-L246 HydrophobicContact CD2-CD2 3.46Å; L173-L246 VanDerWaalsContact CD2-CD2 3.46Å; A229-L246 CarbonylContact C-O 3.53Å; A229-L246 WeakPolarHBondContact CA-O 3.49Å; F230-L246 HydrophobicContact CB-CB 4.2Å; F230-L246 PolarHBondContact N-O 3.48Å; F230-L246 PolarHBondContact O-N 3.14Å; F230-L246 VanDerWaalsContact O-N 3.08Å; L246-I248 HydrophobicContact CD2-CG1 4.38Å; L246-I248 HydrophobicContact CG-CG1 4.49Å
247	I	83.6	Confident	71.7	Confident	22 Å²	22	76 Å²	76	11%	0.113	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	123.3	172.2	-60.1	175.3	0	0	0	108.7	V27 Y163 I195 R249	V27-I247 HydrophobicContact CG2-CD1 4.3Å; Y163-I247 WeakPolarHBondContact CE1-O 3.27Å; I195-I247 HydrophobicContact CD1-CD1 4.29Å; I195-I247 HydrophobicContact CD1-CG1 4.33Å; I195-I247 HydrophobicContact CD1-CG2 3.8Å; I247-R249 HydrophobicContact CG2-CG 4.28Å
248	I	80.2	Confident	69.9	Low	1 Å²	1	76 Å²	76	1%	0.005	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	127.9	173.9	-57.1	-166.9	0	0	0	108.8	Y163 Y171 L173 I220 L222 Q227 S228 F230 L246	Y163-I248 HydrophobicContact CD1-CB 4.45Å; Y163-I248 HydrophobicContact CD1-CD1 4.21Å; Y163-I248 HydrophobicContact CD1-CG1 3.69Å; Y163-I248 HydrophobicContact CD2-CD1 4.31Å; Y163-I248 HydrophobicContact CD2-CG1 4.32Å; Y163-I248 HydrophobicContact CD2-CG2 4.01Å; Y163-I248 HydrophobicContact CE1-CB 4.43Å; Y163-I248 HydrophobicContact CE1-CG1 4.12Å; Y163-I248 HydrophobicContact CE2-CG2 3.92Å; Y163-I248 HydrophobicContact CG-CD1 3.81Å; Y163-I248 HydrophobicContact CG-CG1 3.78Å; Y163-I248 HydrophobicContact CG-CG2 4.35Å; Y171-I248 HydrophobicContact CD1-CG2 3.77Å; Y171-I248 HydrophobicContact CE1-CG2 3.57Å; Y171-I248 HydrophobicContact CG-CG2 4.35Å; L173-I248 HydrophobicContact CD2-CD1 4.13Å; I220-I248 HydrophobicContact CD1-CD1 3.95Å; L222-I248 HydrophobicContact CD1-CB 4Å; L222-I248 HydrophobicContact CD1-CD1 4.08Å; L222-I248 HydrophobicContact CD1-CG2 3.78Å; Q227-I248 WeakPolarHBondContact CA-O 3.3Å; S228-I248 PolarHBondContact N-O 3.41Å; S228-I248 PolarHBondContact O-N 3.18Å; F230-I248 HydrophobicContact CD2-CB 4.42Å; F230-I248 HydrophobicContact CD2-CD1 3.94Å; F230-I248 HydrophobicContact CD2-CG1 3.78Å; F230-I248 HydrophobicContact CE2-CB 4.03Å; F230-I248 HydrophobicContact CE2-CD1 3.5Å; F230-I248 VanDerWaalsContact CE2-CD1 3.5Å; F230-I248 HydrophobicContact CE2-CG1 3.64Å; F230-I248 HydrophobicContact CZ-CD1 3.87Å; F230-I248 HydrophobicContact CZ-CG1 4.5Å; L246-I248 HydrophobicContact CD2-CG1 4.38Å; L246-I248 HydrophobicContact CG-CG1 4.49Å
249	R	77.9	Confident	67.9	Low	92 Å²	92	81 Å²	81	35%	0.347	41%	0.414	S	S	.	.			trans	-113.4	118.6	177.9	-60.1	-174.1	172.5	149.4	-0.4	108.3	L22 D26 Q227 I247	L22-R249 VanDerWaalsContact CD2-NH1 3.34Å; D26-R249 IonicContact OD2-CZ 3.88Å; D26-R249 IonicContact OD2-NH1 2.68Å; D26-R249 PolarHBondContact OD2-NH1 2.9Å; D26-R249 IonicContact OD2-NH2 3.21Å; D26-R249 PolarHBondContact OD2-NH2 3.13Å; Q227-R249 HydrophobicContact CG-CB 4.41Å; Q227-R249 HydrophobicContact CG-CG 4.05Å; Q227-R249 VanDerWaalsContact OE1-NE 3.11Å; I247-R249 HydrophobicContact CG2-CG 4.28Å
250	P	69.1	Low	65.8	Low	23 Å²	23	83.2 Å²	83.2	15%	0.149	42%	0.423	C	S	.	.			trans	-60.1	139.9	179.6	-25.1	33.5	0	0	0	112.4	Y171 H226 F252	Y171-P250 WeakPolarHBondContact OH-CA 3.44Å; H226-P250 WeakPolarHBondContact O-CD 3.36Å; H226-P250 WeakPolarHBondContact O-CG 3.47Å; P250-F252 PolarHBondContact O-N 2.94Å
251	P	60.7	Low	63.6	Low	69 Å²	69	89.4 Å²	89.4	45%	0.448	44%	0.443	S	S	.	.	S	Bend	trans	-70.9	-14.2	-178.9	25.8	-31.9	0	0	0	114	Y165 Y171	Y165-P251 HydrophobicContact CD1-CG 4.38Å; Y165-P251 HydrophobicContact CD2-CG 3.73Å; Y165-P251 HydrophobicContact CE1-CG 4.22Å; Y165-P251 HydrophobicContact CE2-CG 3.54Å; Y165-P251 HydrophobicContact CG-CG 4.14Å; Y171-P251 WeakPolarHBondContact OH-CD 3.41Å
252	F	54.3	Low	61.6	Low	140 Å²	140	93 Å²	93	61%	0.614	47%	0.468	S	S	*	.			trans	-127.2	79.6	-177	-57.5	-70.4	0	0	0	111.6	P250 K254	P250-F252 PolarHBondContact O-N 2.94Å; F252-K254 PolarHBondContact O-N 3.44Å; F252-K254 VanDerWaalsContact O-N 3.14Å
253	Q	50.9	Low	59.7	Low	158 Å²	158	89.9 Å²	89.9	74%	0.738	46%	0.456	S	S	*	.			trans	-72.6	105.5	167.5	-161.1	171.5	22.1	0	0	108.5	V255	Q253-V255 PolarHBondContact O-N 3.09Å
254	K	42.2	Very low	57.9	Low	192 Å²	192	93.8 Å²	93.8	84%	0.835	47%	0.474	S	S	*	.			trans	-59.8	103.8	173.6	-109.7	-175.5	175.8	-177.3	0	109	F252 P256	F252-K254 PolarHBondContact O-N 3.44Å; F252-K254 VanDerWaalsContact O-N 3.14Å; K254-P256 WeakPolarHBondContact O-CD 3.38Å
255	V	40.6	Very low	55.9	Low	98 Å²	98	100.1 Å²	100.1	59%	0.594	50%	0.499	S	S	*	.			trans	-66.2	127	170.9	-179.1	0	0	0	0	107.4	Q253 D257	Q253-V255 PolarHBondContact O-N 3.09Å; V255-D257 PolarHBondContact O-N 2.78Å
256	P	40.4	Very low	54.1	Low	91 Å²	91	102.5 Å²	102.5	59%	0.591	51%	0.513	S	S	*	.			trans	-60.3	130.7	177.4	-23.4	33.7	0	0	0	110.9	K254 N258 K259	K254-P256 WeakPolarHBondContact O-CD 3.38Å; P256-N258 PolarHBondContact O-N 3.39Å; P256-K259 PolarHBondContact O-N 3.46Å
257	D	41.3	Very low	52.5	Low	142 Å²	142	104.9 Å²	104.9	76%	0.759	53%	0.53	S	S	*	.	G	3₁₀ helix	trans	-55.4	-22.8	-170.2	-62.6	-63.7	0	0	0	114.1	V255 K259 V260	V255-D257 PolarHBondContact O-N 2.78Å; D257-K259 VanDerWaalsContact C-N 3.28Å; D257-K259 PolarHBondContact O-N 2.59Å; D257-V260 WeakPolarHBondContact O-CG2 3.09Å
258	N	45	Very low	50.9	Low	161 Å²	161	108.9 Å²	108.9	86%	0.861	55%	0.551	S	S	*	*	G	3₁₀ helix	trans	-77.5	4.7	178.7	-70.2	-10	0	0	0	115.5	P256	P256-N258 PolarHBondContact O-N 3.39Å
259	K	43.4	Very low	49.8	Very low	143 Å²	143	114 Å²	114	62%	0.622	58%	0.578	S	S	*	*	G	3₁₀ helix	trans	-111.5	1.8	174.5	-77.4	-168.6	176.3	-177.8	0	115.7	P256 D257 Y261 S262	P256-K259 PolarHBondContact O-N 3.46Å; D257-K259 VanDerWaalsContact C-N 3.28Å; D257-K259 PolarHBondContact O-N 2.59Å; K259-Y261 PolarHBondContact O-N 2.72Å; K259-Y261 VanDerWaalsContact O-N 3.11Å; K259-S262 PolarHBondContact O-N 3.08Å; K259-S262 PolarHBondContact O-OG 3.17Å
260	V	41.8	Very low	48.9	Very low	71 Å²	71	115.5 Å²	115.5	43%	0.43	59%	0.59	S	S	.	*	H	α-helix	trans	-58.2	-27.3	-176.5	177	0	0	0	0	113.8	D257 S262 S263	D257-V260 WeakPolarHBondContact O-CG2 3.09Å; V260-S262 VanDerWaalsContact C-N 3.27Å; V260-S262 PolarHBondContact O-N 3.31Å; V260-S263 PolarHBondContact O-OG 3.37Å; V260-S263 VanDerWaalsContact O-OG 3.14Å
261	Y	40.2	Very low	49	Very low	207 Å²	207	118.5 Å²	118.5	81%	0.812	61%	0.607	S	S	*	*	H	α-helix	trans	-72.1	-14.7	175.7	-71.9	-79.4	0	0	0	114.8	K259	K259-Y261 PolarHBondContact O-N 2.72Å; K259-Y261 VanDerWaalsContact O-N 3.11Å
262	S	46.9	Very low	49.4	Very low	77 Å²	77	118.6 Å²	118.6	54%	0.538	61%	0.607	S	S	.	*	H	α-helix	trans	-91.9	-25.3	178.9	66.1	0	0	0	0	114	K259 V260	K259-S262 PolarHBondContact O-N 3.08Å; K259-S262 PolarHBondContact O-OG 3.17Å; V260-S262 VanDerWaalsContact C-N 3.27Å; V260-S262 PolarHBondContact O-N 3.31Å
263	S	47.2	Very low	50.3	Low	52 Å²	52	113.1 Å²	113.1	36%	0.364	59%	0.586	S	S	.	*	H	α-helix	trans	-81.6	-24	-178.2	47.4	0	0	0	0	113.8	V260 F265 Q266	V260-S263 PolarHBondContact O-OG 3.37Å; V260-S263 VanDerWaalsContact O-OG 3.14Å; S263-F265 PolarHBondContact O-N 2.8Å; S263-Q266 PolarHBondContact O-N 2.83Å
264	I	48.1	Very low	51.5	Low	113 Å²	113	111.2 Å²	111.2	58%	0.579	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.8	-24.6	177.3	-62.6	172.2	0	0	0	112.1	P267	I264-P267 VanDerWaalsContact O-CD 3.31Å; I264-P267 WeakPolarHBondContact O-CD 3.28Å
265	F	45.1	Very low	53.3	Low	146 Å²	146	106.8 Å²	106.8	64%	0.64	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.6	-6.3	177	-80.9	-82.9	0	0	0	115	S263 L268	S263-F265 PolarHBondContact O-N 2.8Å; F265-L268 PolarHBondContact O-N 3.01Å
266	Q	51.5	Low	55.2	Low	129 Å²	129	105.5 Å²	105.5	60%	0.603	56%	0.557	S	S	*	*	H	α-helix	trans	-60.7	-31.4	176.5	-75.6	-172	-61.2	0	0	115.5	S263 L268 N269	S263-Q266 PolarHBondContact O-N 2.83Å; Q266-L268 VanDerWaalsContact C-N 3.27Å; Q266-L268 PolarHBondContact O-N 3.49Å; Q266-N269 PolarHBondContact O-N 3.12Å
267	P	51.4	Low	57.3	Low	76 Å²	76	107.7 Å²	107.7	49%	0.494	56%	0.555	S	S	.	*	H	α-helix	trans	-59.9	-33.9	177.3	-25.1	35.3	0	0	0	113.4	I264 N269 Q270 V271	I264-P267 VanDerWaalsContact O-CD 3.31Å; I264-P267 WeakPolarHBondContact O-CD 3.28Å; P267-N269 VanDerWaalsContact C-N 3.27Å; P267-N269 PolarHBondContact O-N 2.71Å; P267-Q270 PolarHBondContact O-N 3.11Å; P267-V271 WeakPolarHBondContact O-CG2 3.4Å; P267-V271 PolarHBondContact O-N 2.93Å; P267-V271 VanDerWaalsContact O-N 3.11Å
268	L	51.8	Low	59.4	Low	106 Å²	106	103.8 Å²	103.8	56%	0.555	54%	0.539	S	S	*	.	H	α-helix	trans	-63	-33.6	179.1	-97.2	78.6	0	0	0	112.3	F265 Q266 V271 T272	F265-L268 PolarHBondContact O-N 3.01Å; Q266-L268 VanDerWaalsContact C-N 3.27Å; Q266-L268 PolarHBondContact O-N 3.49Å; L268-V271 PolarHBondContact O-N 3.03Å; L268-T272 WeakPolarHBondContact O-CG2 3.43Å; L268-T272 PolarHBondContact O-N 3.13Å; L268-T272 PolarHBondContact O-OG1 3.44Å; L268-T272 VanDerWaalsContact O-OG1 3.05Å
269	N	56.8	Low	61.5	Low	107 Å²	107	101.9 Å²	101.9	57%	0.572	53%	0.528	S	S	*	.	H	α-helix	trans	-73.7	-25.6	179.3	-77.5	-10.7	0	0	0	113.3	Q266 P267 T272 S273	Q266-N269 PolarHBondContact O-N 3.12Å; P267-N269 VanDerWaalsContact C-N 3.27Å; P267-N269 PolarHBondContact O-N 2.71Å; N269-T272 WeakPolarHBondContact CA-OG1 3.37Å; N269-T272 PolarHBondContact O-OG1 3.13Å; N269-S273 WeakPolarHBondContact O-CB 3.33Å; N269-S273 PolarHBondContact O-N 3.37Å; N269-S273 PolarHBondContact O-OG 2.89Å
270	Q	57.4	Low	63.6	Low	125 Å²	125	99.7 Å²	99.7	58%	0.584	52%	0.523	S	S	*	.	H	α-helix	trans	-75.6	-40.6	169	-77.1	-166.6	-15.6	0	0	111.6	P267 S273 L274	P267-Q270 PolarHBondContact O-N 3.11Å; Q270-S273 PolarHBondContact O-N 3.01Å; Q270-S273 PolarHBondContact O-OG 3.29Å; Q270-L274 WeakPolarHBondContact O-CB 3.46Å; Q270-L274 PolarHBondContact O-N 2.91Å
271	V	71.1	Confident	65.7	Low	85 Å²	85	99.7 Å²	99.7	52%	0.515	53%	0.526	S	S	.	.	H	α-helix	trans	-65.7	-41.4	177.2	177.4	0	0	0	0	111.5	P267 L268 L274 L275	P267-V271 WeakPolarHBondContact O-CG2 3.4Å; P267-V271 PolarHBondContact O-N 2.93Å; P267-V271 VanDerWaalsContact O-N 3.11Å; L268-V271 PolarHBondContact O-N 3.03Å; V271-L274 PolarHBondContact O-N 2.9Å; V271-L275 HydrophobicContact CG1-CD1 4.03Å; V271-L275 WeakPolarHBondContact O-CB 3.38Å; V271-L275 WeakPolarHBondContact O-CG 3.32Å; V271-L275 PolarHBondContact O-N 3.28Å
272	T	70.7	Confident	68.2	Low	72 Å²	72	93.7 Å²	93.7	44%	0.442	51%	0.51	S	S	.	.	H	α-helix	trans	-66.2	-37.9	174.3	53.3	0	0	0	0	112.2	L268 N269 L275 T276	L268-T272 WeakPolarHBondContact O-CG2 3.43Å; L268-T272 PolarHBondContact O-N 3.13Å; L268-T272 PolarHBondContact O-OG1 3.44Å; L268-T272 VanDerWaalsContact O-OG1 3.05Å; N269-T272 WeakPolarHBondContact CA-OG1 3.37Å; N269-T272 PolarHBondContact O-OG1 3.13Å; T272-L275 PolarHBondContact O-N 3.2Å; T272-T276 WeakPolarHBondContact O-CG2 3.33Å; T272-T276 PolarHBondContact O-N 3.36Å; T272-T276 PolarHBondContact O-OG1 2.99Å
273	S	72.8	Confident	70.3	Confident	25 Å²	25	92.6 Å²	92.6	18%	0.175	51%	0.506	C	S	.	.	H	α-helix	trans	-66.9	-40.5	174.8	69.6	0	0	0	0	112.6	N269 Q270 L275 T276 Y277	N269-S273 WeakPolarHBondContact O-CB 3.33Å; N269-S273 PolarHBondContact O-N 3.37Å; N269-S273 PolarHBondContact O-OG 2.89Å; Q270-S273 PolarHBondContact O-N 3.01Å; Q270-S273 PolarHBondContact O-OG 3.29Å; S273-L275 VanDerWaalsContact C-N 3.34Å; S273-L275 PolarHBondContact O-N 2.81Å; S273-T276 WeakPolarHBondContact CA-OG1 3.38Å; S273-T276 PolarHBondContact O-N 3.25Å; S273-T276 PolarHBondContact O-OG1 3.49Å; S273-T276 VanDerWaalsContact O-OG1 3.06Å; S273-Y277 WeakPolarHBondContact O-CB 3.06Å; S273-Y277 WeakPolarHBondContact O-CD2 3.39Å; S273-Y277 PolarHBondContact O-N 3.5Å
274	L	74.8	Confident	72.5	Confident	117 Å²	117	95.6 Å²	95.6	61%	0.613	52%	0.517	S	S	*	.	H	α-helix	trans	-59.8	-42.4	171.9	-94.9	154.8	0	0	0	112.2	Q270 V271 S278	Q270-L274 WeakPolarHBondContact O-CB 3.46Å; Q270-L274 PolarHBondContact O-N 2.91Å; V271-L274 PolarHBondContact O-N 2.9Å; L274-S278 VanDerWaalsContact O-CB 3.26Å; L274-S278 WeakPolarHBondContact O-CB 3.21Å; L274-S278 PolarHBondContact O-N 3.45Å; L274-S278 PolarHBondContact O-OG 3.04Å
275	L	80.5	Confident	74.6	Confident	99 Å²	99	95.5 Å²	95.5	52%	0.518	52%	0.517	S	S	.	.	H	α-helix	trans	-66.8	-42.2	175.5	-74.2	167.6	0	0	0	112.3	V271 T272 S273 S278 L279	V271-L275 HydrophobicContact CG1-CD1 4.03Å; V271-L275 WeakPolarHBondContact O-CB 3.38Å; V271-L275 WeakPolarHBondContact O-CG 3.32Å; V271-L275 PolarHBondContact O-N 3.28Å; T272-L275 PolarHBondContact O-N 3.2Å; S273-L275 VanDerWaalsContact C-N 3.34Å; S273-L275 PolarHBondContact O-N 2.81Å; L275-S278 PolarHBondContact O-N 2.83Å; L275-L279 WeakPolarHBondContact O-CB 3.46Å; L275-L279 VanDerWaalsContact O-CG 3.27Å; L275-L279 WeakPolarHBondContact O-CG 3.34Å; L275-L279 PolarHBondContact O-N 3.48Å
276	T	80.6	Confident	76.9	Confident	71 Å²	71	93.6 Å²	93.6	44%	0.436	51%	0.514	S	S	.	.	H	α-helix	trans	-68.7	-41.1	178.1	55.7	0	0	0	0	112.1	T272 S273 L279 L280	T272-T276 WeakPolarHBondContact O-CG2 3.33Å; T272-T276 PolarHBondContact O-N 3.36Å; T272-T276 PolarHBondContact O-OG1 2.99Å; S273-T276 WeakPolarHBondContact CA-OG1 3.38Å; S273-T276 PolarHBondContact O-N 3.25Å; S273-T276 PolarHBondContact O-OG1 3.49Å; S273-T276 VanDerWaalsContact O-OG1 3.06Å; T276-L279 PolarHBondContact O-N 3.2Å; T276-L280 VanDerWaalsContact O-CB 3.28Å; T276-L280 WeakPolarHBondContact O-CB 3.45Å; T276-L280 VanDerWaalsContact O-CG 3.27Å; T276-L280 WeakPolarHBondContact O-CG 3.31Å; T276-L280 PolarHBondContact O-N 3.45Å
277	Y	85.8	Confident	78.8	Confident	137 Å²	137	92.1 Å²	92.1	54%	0.537	51%	0.509	S	S	.	.	H	α-helix	trans	-64.6	-39.1	173.4	-69.9	-55.7	0	0	0	112.1	S273 L280 S281	S273-Y277 WeakPolarHBondContact O-CB 3.06Å; S273-Y277 WeakPolarHBondContact O-CD2 3.39Å; S273-Y277 PolarHBondContact O-N 3.5Å; Y277-L280 HydrophobicContact CD1-CD1 4.49Å; Y277-L280 PolarHBondContact O-N 3.47Å; Y277-S281 WeakPolarHBondContact O-CB 3.35Å; Y277-S281 PolarHBondContact O-N 2.88Å
278	S	84	Confident	80.7	Confident	61 Å²	61	94.8 Å²	94.8	43%	0.427	51%	0.513	S	S	.	.	H	α-helix	trans	-60.4	-51	173.5	-60.9	0	0	0	0	111.3	L274 L275 L280 S281 V282	L274-S278 VanDerWaalsContact O-CB 3.26Å; L274-S278 WeakPolarHBondContact O-CB 3.21Å; L274-S278 PolarHBondContact O-N 3.45Å; L274-S278 PolarHBondContact O-OG 3.04Å; L275-S278 PolarHBondContact O-N 2.83Å; S278-L280 PolarHBondContact O-N 3.44Å; S278-S281 PolarHBondContact O-N 3.42Å; S278-S281 PolarHBondContact O-OG 2.8Å; S278-V282 WeakPolarHBondContact O-CG2 3.44Å; S278-V282 PolarHBondContact O-N 2.96Å
279	L	89.1	Confident	82.6	Confident	121 Å²	121	94 Å²	94	63%	0.634	51%	0.509	S	S	*	.	H	α-helix	trans	-62.5	-39.6	177.4	-71.9	168.1	0	0	0	112.5	L275 T276 V282 A283	L275-L279 WeakPolarHBondContact O-CB 3.46Å; L275-L279 VanDerWaalsContact O-CG 3.27Å; L275-L279 WeakPolarHBondContact O-CG 3.34Å; L275-L279 PolarHBondContact O-N 3.48Å; T276-L279 PolarHBondContact O-N 3.2Å; L279-V282 PolarHBondContact O-N 3.22Å; L279-A283 VanDerWaalsContact O-CB 3.3Å; L279-A283 WeakPolarHBondContact O-CB 2.98Å; L279-A283 PolarHBondContact O-N 3.03Å
280	L	88.9	Confident	84.3	Confident	97 Å²	97	94.7 Å²	94.7	51%	0.508	51%	0.507	S	S	.	.	H	α-helix	trans	-63.6	-41.3	174.4	-80	164.5	0	0	0	111.9	T276 Y277 S278 A283 L284	T276-L280 VanDerWaalsContact O-CB 3.28Å; T276-L280 WeakPolarHBondContact O-CB 3.45Å; T276-L280 VanDerWaalsContact O-CG 3.27Å; T276-L280 WeakPolarHBondContact O-CG 3.31Å; T276-L280 PolarHBondContact O-N 3.45Å; Y277-L280 HydrophobicContact CD1-CD1 4.49Å; Y277-L280 PolarHBondContact O-N 3.47Å; S278-L280 PolarHBondContact O-N 3.44Å; L280-A283 PolarHBondContact O-N 3.16Å; L280-L284 WeakPolarHBondContact O-CB 3.49Å; L280-L284 WeakPolarHBondContact O-CG 3.12Å; L280-L284 PolarHBondContact O-N 3.03Å
281	S	85.8	Confident	85.9	Confident	71 Å²	71	92.8 Å²	92.8	50%	0.497	50%	0.5	S	S	.	.	H	α-helix	trans	-64.2	-40.4	176	77	0	0	0	0	112.3	Y277 S278 L284 L285	Y277-S281 WeakPolarHBondContact O-CB 3.35Å; Y277-S281 PolarHBondContact O-N 2.88Å; S278-S281 PolarHBondContact O-N 3.42Å; S278-S281 PolarHBondContact O-OG 2.8Å; S281-L284 PolarHBondContact O-N 2.66Å; S281-L285 WeakPolarHBondContact O-CB 3.4Å; S281-L285 PolarHBondContact O-N 2.92Å
282	V	92.4	Very high	86.8	Confident	80 Å²	80	91.8 Å²	91.8	49%	0.485	49%	0.492	S	S	.	.	H	α-helix	trans	-68	-41.8	175.9	173	0	0	0	0	110.4	S278 L279 L285 L286	S278-V282 WeakPolarHBondContact O-CG2 3.44Å; S278-V282 PolarHBondContact O-N 2.96Å; L279-V282 PolarHBondContact O-N 3.22Å; V282-L285 PolarHBondContact O-N 3.08Å; V282-L286 HydrophobicContact CG1-CD1 4Å; V282-L286 HydrophobicContact CG1-CG 4.43Å; V282-L286 WeakPolarHBondContact O-CB 3.36Å; V282-L286 VanDerWaalsContact O-CG 3.29Å; V282-L286 WeakPolarHBondContact O-CG 3.46Å; V282-L286 PolarHBondContact O-N 3.02Å
283	A	90.7	Very high	87.6	Confident	55 Å²	55	92.7 Å²	92.7	46%	0.455	50%	0.497	S	S	.	.	H	α-helix	trans	-63.4	-40.9	175.6	0	0	0	0	0	112.3	L279 L280 L286 L287	L279-A283 VanDerWaalsContact O-CB 3.3Å; L279-A283 WeakPolarHBondContact O-CB 2.98Å; L279-A283 PolarHBondContact O-N 3.03Å; L280-A283 PolarHBondContact O-N 3.16Å; A283-L286 PolarHBondContact O-N 2.85Å; A283-L287 VanDerWaalsContact O-CB 3.29Å; A283-L287 WeakPolarHBondContact O-CB 3.38Å; A283-L287 PolarHBondContact O-N 3.26Å
284	L	93.6	Very high	88.3	Confident	114 Å²	114	94.8 Å²	94.8	60%	0.597	51%	0.506	S	S	*	.	H	α-helix	trans	-64.7	-41	173.3	-82.5	165	0	0	0	112.1	L280 S281 L287 F288	L280-L284 WeakPolarHBondContact O-CB 3.49Å; L280-L284 WeakPolarHBondContact O-CG 3.12Å; L280-L284 PolarHBondContact O-N 3.03Å; S281-L284 PolarHBondContact O-N 2.66Å; L284-L287 PolarHBondContact O-N 3.26Å; L284-F288 VanDerWaalsContact O-CB 3.31Å; L284-F288 WeakPolarHBondContact O-CB 2.99Å; L284-F288 PolarHBondContact O-N 3.16Å
285	L	92.3	Very high	88.8	Confident	111 Å²	111	94.7 Å²	94.7	58%	0.581	51%	0.505	S	S	*	.	H	α-helix	trans	-63.8	-43.2	175.5	-162.7	98.6	0	0	0	111.4	S281 V282 F288 L289	S281-L285 WeakPolarHBondContact O-CB 3.4Å; S281-L285 PolarHBondContact O-N 2.92Å; V282-L285 PolarHBondContact O-N 3.08Å; L285-F288 PolarHBondContact O-N 3.34Å; L285-L289 HydrophobicContact CD2-CD1 4.31Å; L285-L289 WeakPolarHBondContact O-CB 3.4Å; L285-L289 VanDerWaalsContact O-CG 3.32Å; L285-L289 WeakPolarHBondContact O-CG 3.45Å; L285-L289 PolarHBondContact O-N 2.82Å
286	L	92.8	Very high	89.1	Confident	107 Å²	107	94.8 Å²	94.8	56%	0.56	51%	0.505	S	S	*	.	H	α-helix	trans	-66.5	-39.9	175.7	-71.1	172.1	0	0	0	112.1	V282 A283 L289 F290	V282-L286 HydrophobicContact CG1-CD1 4Å; V282-L286 HydrophobicContact CG1-CG 4.43Å; V282-L286 WeakPolarHBondContact O-CB 3.36Å; V282-L286 VanDerWaalsContact O-CG 3.29Å; V282-L286 WeakPolarHBondContact O-CG 3.46Å; V282-L286 PolarHBondContact O-N 3.02Å; A283-L286 PolarHBondContact O-N 2.85Å; L286-L289 PolarHBondContact O-N 2.96Å; L286-F290 VanDerWaalsContact O-CB 3.31Å; L286-F290 WeakPolarHBondContact O-CB 3.47Å; L286-F290 PolarHBondContact O-N 3.01Å
287	L	91.5	Very high	89.1	Confident	97 Å²	97	98.3 Å²	98.3	51%	0.508	51%	0.512	S	S	.	.	H	α-helix	trans	-62.9	-42.3	173.7	-172.8	75.8	0	0	0	111.1	A283 L284 F290 L291	A283-L287 VanDerWaalsContact O-CB 3.29Å; A283-L287 WeakPolarHBondContact O-CB 3.38Å; A283-L287 PolarHBondContact O-N 3.26Å; L284-L287 PolarHBondContact O-N 3.26Å; L287-F290 PolarHBondContact O-N 3.35Å; L287-L291 HydrophobicContact CG-CD1 4.31Å; L287-L291 WeakPolarHBondContact O-CB 3.37Å; L287-L291 VanDerWaalsContact O-CG 3.31Å; L287-L291 WeakPolarHBondContact O-CG 3.23Å; L287-L291 PolarHBondContact O-N 2.83Å
288	F	91.4	Very high	88.9	Confident	132 Å²	132	100.7 Å²	100.7	58%	0.579	52%	0.52	S	S	*	.	H	α-helix	trans	-65.1	-43.5	176.9	-174.9	-107.3	0	0	0	111.9	L284 L285 L291 I292	L284-F288 VanDerWaalsContact O-CB 3.31Å; L284-F288 WeakPolarHBondContact O-CB 2.99Å; L284-F288 PolarHBondContact O-N 3.16Å; L285-F288 PolarHBondContact O-N 3.34Å; F288-L291 PolarHBondContact O-N 2.72Å; F288-I292 HydrophobicContact CD1-CD1 3.8Å; F288-I292 HydrophobicContact CE1-CD1 3.48Å; F288-I292 VanDerWaalsContact CE1-CD1 3.48Å; F288-I292 HydrophobicContact CE1-CG1 4.47Å; F288-I292 HydrophobicContact CZ-CD1 3.98Å; F288-I292 WeakPolarHBondContact O-CG1 3.16Å; F288-I292 PolarHBondContact O-N 2.75Å
289	L	92.5	Very high	88.5	Confident	89 Å²	89	104.8 Å²	104.8	47%	0.466	53%	0.526	S	S	.	.	H	α-helix	trans	-62.3	-42	172.7	-72.8	168.7	0	0	0	111.9	L285 L286 I292 V293	L285-L289 HydrophobicContact CD2-CD1 4.31Å; L285-L289 WeakPolarHBondContact O-CB 3.4Å; L285-L289 VanDerWaalsContact O-CG 3.32Å; L285-L289 WeakPolarHBondContact O-CG 3.45Å; L285-L289 PolarHBondContact O-N 2.82Å; L286-L289 PolarHBondContact O-N 2.96Å; L289-I292 PolarHBondContact O-N 3.06Å; L289-V293 WeakPolarHBondContact O-CG2 3.41Å; L289-V293 PolarHBondContact O-N 3.19Å
290	F	91.7	Very high	87.8	Confident	122 Å²	122	109.2 Å²	109.2	54%	0.535	53%	0.534	S	S	.	.	H	α-helix	trans	-64.8	-39.4	175.5	-178.5	-109.1	0	0	0	112.3	L286 L287 V293 L294	L286-F290 VanDerWaalsContact O-CB 3.31Å; L286-F290 WeakPolarHBondContact O-CB 3.47Å; L286-F290 PolarHBondContact O-N 3.01Å; L287-F290 PolarHBondContact O-N 3.35Å; F290-V293 PolarHBondContact O-N 3.14Å; F290-L294 HydrophobicContact CD1-CD1 3.85Å; F290-L294 HydrophobicContact CD1-CG 4.36Å; F290-L294 HydrophobicContact CE1-CD1 3.37Å; F290-L294 HydrophobicContact CE1-CG 3.99Å; F290-L294 HydrophobicContact CE2-CG 4.41Å; F290-L294 HydrophobicContact CZ-CD1 3.81Å; F290-L294 HydrophobicContact CZ-CD2 4.33Å; F290-L294 HydrophobicContact CZ-CG 4.01Å; F290-L294 WeakPolarHBondContact O-CB 3.38Å; F290-L294 PolarHBondContact O-N 2.9Å
291	L	90.7	Very high	86.9	Confident	85 Å²	85	110.8 Å²	110.8	45%	0.445	54%	0.538	S	S	.	.	H	α-helix	trans	-63.7	-40.4	172.5	-76.9	168.4	0	0	0	111.8	L287 F288 L294 L295	L287-L291 HydrophobicContact CG-CD1 4.31Å; L287-L291 WeakPolarHBondContact O-CB 3.37Å; L287-L291 VanDerWaalsContact O-CG 3.31Å; L287-L291 WeakPolarHBondContact O-CG 3.23Å; L287-L291 PolarHBondContact O-N 2.83Å; F288-L291 PolarHBondContact O-N 2.72Å; L291-L294 PolarHBondContact O-N 2.88Å; L291-L295 WeakPolarHBondContact O-CB 3.47Å; L291-L295 VanDerWaalsContact O-CG 3.23Å; L291-L295 WeakPolarHBondContact O-CG 3.36Å; L291-L295 PolarHBondContact O-N 2.84Å
292	I	89.1	Confident	85.7	Confident	65 Å²	65	117.5 Å²	117.5	33%	0.333	55%	0.553	S	S	.	*	H	α-helix	trans	-60.8	-46.5	172.3	-72.1	167.7	0	0	0	110.6	F288 L289 L294 L295 I296	F288-I292 HydrophobicContact CD1-CD1 3.8Å; F288-I292 HydrophobicContact CE1-CD1 3.48Å; F288-I292 VanDerWaalsContact CE1-CD1 3.48Å; F288-I292 HydrophobicContact CE1-CG1 4.47Å; F288-I292 HydrophobicContact CZ-CD1 3.98Å; F288-I292 WeakPolarHBondContact O-CG1 3.16Å; F288-I292 PolarHBondContact O-N 2.75Å; L289-I292 PolarHBondContact O-N 3.06Å; I292-L294 PolarHBondContact O-N 2.98Å; I292-L295 PolarHBondContact O-N 2.82Å; I292-I296 HydrophobicContact CG2-CD1 3.77Å; I292-I296 HydrophobicContact CG2-CG1 4.48Å; I292-I296 VanDerWaalsContact O-CG1 3.29Å; I292-I296 WeakPolarHBondContact O-CG1 3.36Å; I292-I296 PolarHBondContact O-N 3.27Å
293	V	88.6	Confident	83.8	Confident	90 Å²	90	119.7 Å²	119.7	55%	0.545	56%	0.562	S	S	.	*	H	α-helix	trans	-62.3	-42.4	177	172.2	0	0	0	0	111.5	L289 F290 I296 Y297	L289-V293 WeakPolarHBondContact O-CG2 3.41Å; L289-V293 PolarHBondContact O-N 3.19Å; F290-V293 PolarHBondContact O-N 3.14Å; V293-I296 PolarHBondContact O-N 2.99Å; V293-Y297 WeakPolarHBondContact O-CB 3.42Å; V293-Y297 PolarHBondContact O-N 2.84Å
294	L	86.9	Confident	81.6	Confident	70 Å²	70	120 Å²	120	37%	0.366	57%	0.571	S	S	.	*	H	α-helix	trans	-64.5	-37.1	174.5	-81.3	179.3	0	0	0	112.9	F290 L291 I292 Y297 R298	F290-L294 HydrophobicContact CD1-CD1 3.85Å; F290-L294 HydrophobicContact CD1-CG 4.36Å; F290-L294 HydrophobicContact CE1-CD1 3.37Å; F290-L294 HydrophobicContact CE1-CG 3.99Å; F290-L294 HydrophobicContact CE2-CG 4.41Å; F290-L294 HydrophobicContact CZ-CD1 3.81Å; F290-L294 HydrophobicContact CZ-CD2 4.33Å; F290-L294 HydrophobicContact CZ-CG 4.01Å; F290-L294 WeakPolarHBondContact O-CB 3.38Å; F290-L294 PolarHBondContact O-N 2.9Å; L291-L294 PolarHBondContact O-N 2.88Å; I292-L294 PolarHBondContact O-N 2.98Å; L294-Y297 PolarHBondContact O-N 2.79Å; L294-R298 VanDerWaalsContact O-CB 3.29Å; L294-R298 WeakPolarHBondContact O-CB 3.33Å; L294-R298 PolarHBondContact O-N 2.85Å
295	L	85.7	Confident	79.1	Confident	114 Å²	114	123.3 Å²	123.3	60%	0.597	58%	0.58	S	S	*	*	H	α-helix	trans	-68.3	-40.4	175.1	-74.8	170	0	0	0	111.4	L291 I292 R299	L291-L295 WeakPolarHBondContact O-CB 3.47Å; L291-L295 VanDerWaalsContact O-CG 3.23Å; L291-L295 WeakPolarHBondContact O-CG 3.36Å; L291-L295 PolarHBondContact O-N 2.84Å; I292-L295 PolarHBondContact O-N 2.82Å; L295-R299 WeakPolarHBondContact O-CB 3.16Å; L295-R299 PolarHBondContact O-N 2.92Å
296	I	86.3	Confident	76.5	Confident	102 Å²	102	123.7 Å²	123.7	52%	0.523	59%	0.592	S	S	.	*	H	α-helix	trans	-63.7	-46.1	173.1	-68.3	166.3	0	0	0	110.2	I292 V293 R299 R300	I292-I296 HydrophobicContact CG2-CD1 3.77Å; I292-I296 HydrophobicContact CG2-CG1 4.48Å; I292-I296 VanDerWaalsContact O-CG1 3.29Å; I292-I296 WeakPolarHBondContact O-CG1 3.36Å; I292-I296 PolarHBondContact O-N 3.27Å; V293-I296 PolarHBondContact O-N 2.99Å; I296-R299 PolarHBondContact O-N 2.96Å; I296-R300 WeakPolarHBondContact O-CB 3.27Å; I296-R300 PolarHBondContact O-N 3.03Å
297	Y	80.9	Confident	73.7	Confident	145 Å²	145	126.1 Å²	126.1	57%	0.569	61%	0.606	S	S	*	*	H	α-helix	trans	-62	-46.7	177	-174.7	-97.1	0	0	0	111.9	V293 L294 R299 R300 H301	V293-Y297 WeakPolarHBondContact O-CB 3.42Å; V293-Y297 PolarHBondContact O-N 2.84Å; L294-Y297 PolarHBondContact O-N 2.79Å; Y297-R299 VanDerWaalsContact C-N 3.35Å; Y297-R299 PolarHBondContact O-N 2.94Å; Y297-R300 PolarHBondContact O-N 3.23Å; Y297-H301 WeakPolarHBondContact O-CB 3.35Å; Y297-H301 PolarHBondContact O-N 2.88Å
298	R	82	Confident	71.1	Confident	187 Å²	187	130.2 Å²	130.2	71%	0.706	62%	0.619	S	S	*	*	H	α-helix	trans	-64.5	-33.5	176	-85.5	-175.8	160.1	175.2	-4	113.2	L294 R302	L294-R298 VanDerWaalsContact O-CB 3.29Å; L294-R298 WeakPolarHBondContact O-CB 3.33Å; L294-R298 PolarHBondContact O-N 2.85Å; R298-R302 WeakPolarHBondContact O-CB 3.44Å; R298-R302 WeakPolarHBondContact O-CG 3.36Å; R298-R302 PolarHBondContact O-N 3.38Å
299	R	76.3	Confident	68.4	Low	147 Å²	147	133 Å²	133	56%	0.555	63%	0.634	S	S	*	*	H	α-helix	trans	-63.6	-58.1	169.3	-102.9	-176.6	172.5	138	4	110.3	L295 I296 Y297 H301 R302 D303 F312	L295-R299 WeakPolarHBondContact O-CB 3.16Å; L295-R299 PolarHBondContact O-N 2.92Å; I296-R299 PolarHBondContact O-N 2.96Å; Y297-R299 VanDerWaalsContact C-N 3.35Å; Y297-R299 PolarHBondContact O-N 2.94Å; R299-H301 PolarHBondContact O-N 2.89Å; R299-R302 PolarHBondContact O-N 3.32Å; R299-D303 PolarHBondContact O-N 3.19Å; R299-F312 VanDerWaalsContact CZ-CE1 3.42Å
300	R	74.6	Confident	65.5	Low	213 Å²	213	133.4 Å²	133.4	80%	0.804	64%	0.644	S	S	*	*	H	α-helix	trans	-57.9	-28.8	-176.6	-143.5	174.8	-166.7	177.4	3.1	113.4	I296 Y297	I296-R300 WeakPolarHBondContact O-CB 3.27Å; I296-R300 PolarHBondContact O-N 3.03Å; Y297-R300 PolarHBondContact O-N 3.23Å
301	H	69.2	Low	62.8	Low	130 Å²	130	137.1 Å²	137.1	60%	0.602	66%	0.661	S	S	*	*	H	α-helix	trans	-91	-18.6	176.3	-150.8	-52.9	0	0	0	114.4	Y297 R299	Y297-H301 WeakPolarHBondContact O-CB 3.35Å; Y297-H301 PolarHBondContact O-N 2.88Å; R299-H301 PolarHBondContact O-N 2.89Å
302	R	59.7	Low	59.9	Low	212 Å²	212	139.1 Å²	139.1	80%	0.8	67%	0.666	S	S	*	*	H	α-helix	trans	-80	-29.6	167.1	-80.1	-176.8	77.2	148.8	1.1	112.1	R298 R299 G304 K305	R298-R302 WeakPolarHBondContact O-CB 3.44Å; R298-R302 WeakPolarHBondContact O-CG 3.36Å; R298-R302 PolarHBondContact O-N 3.38Å; R299-R302 PolarHBondContact O-N 3.32Å; R302-G304 PolarHBondContact O-N 3.35Å; R302-K305 PolarHBondContact O-N 2.93Å
303	D	52.5	Low	57.3	Low	127 Å²	127	142.9 Å²	142.9	68%	0.679	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.7	1.9	177.1	-59.6	-26.6	0	0	0	113.2	R299 K305	R299-D303 PolarHBondContact O-N 3.19Å; D303-K305 VanDerWaalsContact C-N 3.31Å; D303-K305 PolarHBondContact O-N 3.48Å
304	G	44.8	Very low	54.4	Low	62 Å²	62	142 Å²	142	64%	0.639	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.1	-2.8	172.7	0	0	0	0	0	115.9	R302	R302-G304 PolarHBondContact O-N 3.35Å
305	K	42.3	Very low	51.7	Low	183 Å²	183	148.4 Å²	148.4	80%	0.796	71%	0.708	S	S	*	*	S	Bend	trans	-140	120.3	175.4	-71.4	-172.8	177.9	178.2	0	113.2	R302 D303	R302-K305 PolarHBondContact O-N 2.93Å; D303-K305 VanDerWaalsContact C-N 3.31Å; D303-K305 PolarHBondContact O-N 3.48Å
306	S	37.9	Very low	49.1	Very low	118 Å²	118	148.9 Å²	148.9	83%	0.825	71%	0.711	S	S	*	*			trans	54.1	108.8	168.5	63.2	0	0	0	0	118.5	K308	S306-K308 PolarHBondContact O-N 2.94Å
307	N	32.5	Very low	46.7	Very low	158 Å²	158	149.5 Å²	149.5	85%	0.845	72%	0.722	S	S	*	*			trans	-49.8	131.9	156.7	-64.4	-47.6	0	0	0	112.1
308	K	36.8	Very low	44.5	Very low	183 Å²	183	146.7 Å²	146.7	80%	0.796	73%	0.728	S	S	*	*				171.3	141	126.2	-93.2	161.6	-175.3	-177.8	0	112.6	S306	S306-K308 PolarHBondContact O-N 2.94Å
309	H	34.5	Very low	42.1	Very low	190 Å²	190	148.8 Å²	148.8	88%	0.88	74%	0.737	S	S	*	*			trans	66.9	122.7	174.8	-67	-76.4	0	0	0	118.7
310	S	32.5	Very low	39.9	Very low	98 Å²	98	153.2 Å²	153.2	69%	0.685	75%	0.753	S	S	*	*			trans	-102.5	135.3	-177.1	-177.1	0	0	0	0	110.9
311	F	35.3	Very low	37.9	Very low	201 Å²	201	149.9 Å²	149.9	88%	0.882	75%	0.751	S	S	*	*			trans	-132.5	90.1	161.7	-139	-88.2	0	0	0	108.2
312	F	30.3	Very low	36.3	Very low	127 Å²	127	151.3 Å²	151.3	56%	0.557	76%	0.757	S	S	*	*			trans	-125.2	111.5	172.6	-90.1	-101	0	0	0	108.3	R299 S314	R299-F312 VanDerWaalsContact CZ-CE1 3.42Å; F312-S314 PolarHBondContact O-N 3.25Å
313	I	33	Very low	35	Very low	144 Å²	144	146.3 Å²	146.3	74%	0.738	75%	0.754	S	S	*	*			trans	-74.7	105.4	159.3	-65.8	177.3	0	0	0	106.4	F315	I313-F315 HydrophobicContact CG2-CD2 4.05Å; I313-F315 HydrophobicContact CG2-CE2 4.22Å
314	S	27.9	Very low	34.1	Very low	71 Å²	71	145.7 Å²	145.7	50%	0.497	76%	0.76	S	S	.	*			trans	-109.5	98.1	177.8	151.2	0	0	0	0	108.2	F312 N316	F312-S314 PolarHBondContact O-N 3.25Å; S314-N316 PolarHBondContact O-N 3.19Å; S314-N316 WeakPolarHBondContact OG-CB 3.36Å; S314-N316 PolarHBondContact OG-ND2 2.88Å
315	F	31.5	Very low	33.5	Very low	204 Å²	204	148.4 Å²	148.4	90%	0.895	77%	0.77	S	S	*	*			trans	-78	74.5	159.5	-88.7	-82.8	0	0	0	108.9	I313	I313-F315 HydrophobicContact CG2-CD2 4.05Å; I313-F315 HydrophobicContact CG2-CE2 4.22Å
316	N	31.2	Very low	33.1	Very low	125 Å²	125	143.3 Å²	143.3	67%	0.668	77%	0.769	S	S	*	*			trans	-84.9	140.6	169.8	-107.5	-58.3	0	0	0	109.5	S314	S314-N316 PolarHBondContact O-N 3.19Å; S314-N316 WeakPolarHBondContact OG-CB 3.36Å; S314-N316 PolarHBondContact OG-ND2 2.88Å
317	P	35.6	Very low	32.8	Very low	114 Å²	114	145.7 Å²	145.7	74%	0.74	77%	0.772	S	S	*	*	S	Bend	trans	-66.7	137.9	160	29.8	-31.7	0	0	0	109.9
318	A	33.2	Very low	32.8	Very low	86 Å²	86	141.1 Å²	141.1	71%	0.711	76%	0.763	S	S	*	*	S	Bend	trans	74	116.5	172.5	0	0	0	0	0	120.5
319	R	31.8	Very low	32.7	Very low	232 Å²	232	138 Å²	138	88%	0.875	76%	0.764	S	S	*	*			trans	53.6	112.8	142.4	-69.4	-171.8	-104.9	-156.7	-6.6	121.4
320	R	31.8	Very low	32.6	Very low	240 Å²	240	133.4 Å²	133.4	91%	0.906	75%	0.753	S	S	*	*				-172.7	127.4	119.2	-103.5	167.7	-91.9	-152.9	-3.1	108.8
321	L	31.8	Very low	32.5	Very low	143 Å²	143	135.8 Å²	135.8	75%	0.749	76%	0.757	S	S	*	*				68.3	130.7	61.3	-102.9	174.7	0	0	0	115.4
322	H	35.1	Very low	32.3	Very low	160 Å²	160	134.4 Å²	134.4	74%	0.741	76%	0.758	S	S	*	*			trans	75.2	147.3	174.2	-53.8	-73.7	0	0	0	118.4
323	S	33.3	Very low	32.3	Very low	106 Å²	106	131.6 Å²	131.6	74%	0.741	77%	0.765	S	S	*	*			cis	-178.8	131.8	-38.2	46.8	0	0	0	0	109
324	S	33	Very low	32.2	Very low	115 Å²	115	133.2 Å²	133.2	80%	0.804	77%	0.774	S	S	*	*			trans	-161.4	86.2	161.8	-178.4	0	0	0	0	106.9
325	S	33.3	Very low	32.3	Very low	119 Å²	119	132.9 Å²	132.9	83%	0.832	78%	0.781	S	S	*	*				60.3	103.4	86.6	-163.6	0	0	0	0	111.7
326	G	32	Very low	32.3	Very low	76 Å²	76	128 Å²	128	78%	0.784	77%	0.773	S	S	*	*			trans	179.6	83	-172.8	0	0	0	0	0	110.3
327	N	33.3	Very low	32.3	Very low	167 Å²	167	129 Å²	129	89%	0.893	78%	0.778	S	S	*	*			trans	-53.6	158.8	-170.1	-61	-28.4	0	0	0	116.8
328	G	32.2	Very low	32	Very low	63 Å²	63	130.9 Å²	130.9	65%	0.649	78%	0.781	S	S	*	*			trans	126.4	94.2	154	0	0	0	0	0	113.2
329	S	34.4	Very low	31.9	Very low	116 Å²	116	133.4 Å²	133.4	81%	0.811	79%	0.787	S	S	*	*				60.8	126.4	84.7	71.7	0	0	0	0	112.8
330	S	31.2	Very low	31.8	Very low	94 Å²	94	129 Å²	129	66%	0.657	79%	0.787	S	S	*	*			cis	160.8	176.8	0.4	42.6	0	0	0	0	105
331	I	32.4	Very low	31.8	Very low	148 Å²	148	123.2 Å²	123.2	76%	0.759	78%	0.783	S	S	*	*			trans	79.1	107.1	167.4	-55	158.9	0	0	0	112.7
332	L	29.7	Very low	31.8	Very low	173 Å²	173	120 Å²	120	91%	0.906	78%	0.784	S	S	*	*			cis	74.8	121.2	48.8	-67	172.1	0	0	0	115.3
333	G	30.5	Very low	31.5	Very low	68 Å²	68	120.2 Å²	120.2	70%	0.701	79%	0.79	S	S	*	*			trans	130.7	138.3	176.7	0	0	0	0	0	110.8
334	L	30.2	Very low	31.4	Very low	178 Å²	178	120.9 Å²	120.9	93%	0.932	79%	0.792	S	S	*	*			cis	171.5	147.9	-13.9	-113.9	160.6	0	0	0	103.4
335	G	30.9	Very low	31.4	Very low	63 Å²	63	122.3 Å²	122.3	65%	0.649	79%	0.79	S	S	*	*			trans	84.2	113.2	-179.4	0	0	0	0	0	112.3
336	S	31.8	Very low	31.3	Very low	102 Å²	102	121.9 Å²	121.9	71%	0.713	78%	0.778	S	S	*	*				98.8	140.4	51	73.7	0	0	0	0	112.6
337	D	31.5	Very low	31.5	Very low	145 Å²	145	123.2 Å²	123.2	78%	0.775	77%	0.767	S	S	*	*			trans	89	140.4	159.7	-48.7	-47.6	0	0	0	120.5
338	L	28.7	Very low	31.6	Very low	155 Å²	155	118.3 Å²	118.3	81%	0.812	75%	0.75	S	S	*	*			trans	-71	144.8	-170.7	-73.4	54.5	0	0	0	110.9
339	T	31.2	Very low	31.8	Very low	138 Å²	138	120.6 Å²	120.6	85%	0.847	75%	0.751	S	S	*	*				-175.9	143.1	116.4	24.3	0	0	0	0	113.8	S341	T339-S341 PolarHBondContact O-N 3.1Å
340	T	29.2	Very low	31.6	Very low	141 Å²	141	121.3 Å²	121.3	87%	0.865	75%	0.745	S	S	*	*			trans	-31.5	109	168.1	-44	0	0	0	0	116.8
341	S	33	Very low	31.6	Very low	117 Å²	117	125.6 Å²	125.6	82%	0.818	75%	0.754	S	S	*	*			trans	-175	136.4	140.5	46.9	0	0	0	0	115.1	T339	T339-S341 PolarHBondContact O-N 3.1Å
342	G	30.2	Very low	31.7	Very low	76 Å²	76	123.9 Å²	123.9	78%	0.784	75%	0.753	S	S	*	*			trans	51.5	97.2	143.9	0	0	0	0	0	121.8
343	L	29.8	Very low	31.6	Very low	165 Å²	165	122.6 Å²	122.6	86%	0.864	75%	0.746	S	S	*	*			trans	-140.4	131.3	138.4	-101.8	136.4	0	0	0	108.6
344	P	31.7	Very low	31.5	Very low	119 Å²	119	129.3 Å²	129.3	77%	0.773	75%	0.751	S	S	*	*			trans	-72.7	131.1	-177.7	29.3	-33.6	0	0	0	110.4	D346	P344-D346 PolarHBondContact O-N 3.39Å; P344-D346 VanDerWaalsContact O-N 3.08Å
345	L	32.2	Very low	31.5	Very low	145 Å²	145	128.2 Å²	128.2	76%	0.759	75%	0.746	S	S	*	*			trans	-65.1	109.2	170.3	-114.6	76.2	0	0	0	109.3	L347	L345-L347 VanDerWaalsContact C-N 3.28Å; L345-L347 HydrophobicContact CD2-CD1 4.21Å; L345-L347 PolarHBondContact O-N 3.21Å
346	D	31.9	Very low	31.5	Very low	111 Å²	111	132.8 Å²	132.8	59%	0.594	75%	0.75	S	S	*	*			trans	-73.7	88.1	166.2	-172	6.1	0	0	0	109.2	P344 A348 T349	P344-D346 PolarHBondContact O-N 3.39Å; P344-D346 VanDerWaalsContact O-N 3.08Å; D346-A348 PolarHBondContact O-N 2.86Å; D346-A348 WeakPolarHBondContact OD1-CB 3.44Å; D346-A348 PolarHBondContact OD1-N 2.79Å; D346-T349 PolarHBondContact O-N 3.29Å; D346-T349 PolarHBondContact O-OG1 3.07Å
347	L	35.3	Very low	31.3	Very low	104 Å²	104	136.5 Å²	136.5	55%	0.545	76%	0.756	S	S	.	*	T	Hydrogen-bonded Turn	trans	-64.2	4.5	-176.9	-143.8	74	0	0	0	113.8	L345	L345-L347 VanDerWaalsContact C-N 3.28Å; L345-L347 HydrophobicContact CD2-CD1 4.21Å; L345-L347 PolarHBondContact O-N 3.21Å
348	A	36.2	Very low	31.3	Very low	64 Å²	64	135.1 Å²	135.1	53%	0.529	75%	0.753	S	S	.	*	T	Hydrogen-bonded Turn	trans	-85.4	-1.6	172.4	0	0	0	0	0	114.3	D346	D346-A348 PolarHBondContact O-N 2.86Å; D346-A348 WeakPolarHBondContact OD1-CB 3.44Å; D346-A348 PolarHBondContact OD1-N 2.79Å
349	T	35.2	Very low	31.6	Very low	110 Å²	110	133 Å²	133	68%	0.675	74%	0.742	S	S	*	*	S	Bend	trans	-112.2	0.5	-172.5	54.5	0	0	0	0	115.6	D346	D346-T349 PolarHBondContact O-N 3.29Å; D346-T349 PolarHBondContact O-OG1 3.07Å
350	L	31.4	Very low	31.4	Very low	131 Å²	131	133 Å²	133	69%	0.686	75%	0.748	S	S	*	*			trans	-101.9	89.5	173.2	-75.5	166	0	0	0	110.1	P352	L350-P352 WeakPolarHBondContact O-CD 3.47Å
351	E	30.8	Very low	31.4	Very low	184 Å²	184	130.9 Å²	130.9	86%	0.86	73%	0.731	S	S	*	*			trans	-86.8	114.9	160.9	-70.7	-171.7	157.4	0	0	109.5
352	P	35.1	Very low	31.3	Very low	112 Å²	112	132.7 Å²	132.7	73%	0.727	72%	0.721	S	S	*	*			trans	-88.7	115.7	165.7	-2.8	23.6	0	0	0	109.2	L350	L350-P352 WeakPolarHBondContact O-CD 3.47Å
353	L	27.4	Very low	31.1	Very low	146 Å²	146	131.9 Å²	131.9	76%	0.764	71%	0.712	S	S	*	*			trans	-59.1	146.7	168	-75.3	145.8	0	0	0	111.1
354	W	28.4	Very low	31.4	Very low	210 Å²	210	127.7 Å²	127.7	80%	0.795	69%	0.69	S	S	*	*			trans	-5.5	135.9	173.6	-51	-35.9	0	0	0	120.1
355	N	29.7	Very low	31.5	Very low	154 Å²	154	125.6 Å²	125.6	82%	0.824	68%	0.678	S	S	*	*			trans	-134.7	106.8	141.4	-90.3	-39	0	0	0	109.1
356	Q	30.3	Very low	31.9	Very low	160 Å²	160	127.9 Å²	127.9	75%	0.748	68%	0.682	S	S	*	*			trans	-100.4	10.2	-166.2	-158.6	169.8	-3.3	0	0	113
357	E	27.7	Very low	32.4	Very low	180 Å²	180	125.8 Å²	125.8	84%	0.841	67%	0.674	S	S	*	*			trans	-125.4	11.7	-157	-62.1	-170.3	137.3	0	0	115.9
358	V	32.8	Very low	33	Very low	116 Å²	116	123.2 Å²	123.2	70%	0.703	66%	0.661	S	S	*	*	S	Bend	trans	-129.2	76.3	176.5	-85.2	0	0	0	0	113.3
359	N	33.2	Very low	33.7	Very low	110 Å²	110	125.1 Å²	125.1	59%	0.588	66%	0.662	S	S	*	*				168.9	130.1	124.5	-86.3	-25.9	0	0	0	110.7	L361 Y362	N359-L361 PolarHBondContact O-N 3.43Å; N359-Y362 WeakPolarHBondContact O-CD2 3.46Å; N359-Y362 VanDerWaalsContact O-CE2 3.29Å; N359-Y362 WeakPolarHBondContact O-CE2 3.49Å
360	S	27.6	Very low	34.4	Very low	137 Å²	137	125.7 Å²	125.7	96%	0.958	66%	0.66	S	S	*	*	S	Bend	trans	-74.7	45.2	-177.6	-51.7	0	0	0	0	114.1
361	L	29.1	Very low	36	Very low	97 Å²	97	122 Å²	122	51%	0.508	64%	0.642	S	S	.	*			trans	-130.3	20	-170.4	-150	90.9	0	0	0	114.5	N359 G363 H560	N359-L361 PolarHBondContact O-N 3.43Å; L361-G363 PolarHBondContact O-N 3.29Å; L361-H560 HydrophobicContact CD1-CB 3.65Å; L361-H560 HydrophobicContact CD2-CB 3.65Å; L361-H560 WeakPolarHBondContact CD2-O 3.34Å; L361-H560 HydrophobicContact CG-CB 4.24Å
362	Y	30.8	Very low	38.2	Very low	156 Å²	156	114.7 Å²	114.7	61%	0.612	61%	0.607	S	S	*	*			trans	-78	55.7	177.3	-71.4	-96.3	0	0	0	112.1	N359 Y595	N359-Y362 WeakPolarHBondContact O-CD2 3.46Å; N359-Y362 VanDerWaalsContact O-CE2 3.29Å; N359-Y362 WeakPolarHBondContact O-CE2 3.49Å; Y362-Y595 HydrophobicContact CD1-CE2 4.49Å; Y362-Y595 AromaticContact CE1-CE2 3.68Å; Y362-Y595 HydrophobicContact CE1-CE2 3.68Å; Y362-Y595 PolarHBondContact OH-OH 3.4Å
363	G	27	Very low	40.1	Very low	58 Å²	58	118.2 Å²	118.2	60%	0.598	61%	0.614	S	S	*	*			trans	-99	-28.5	-164.7	0	0	0	0	0	117.1	L361 S365	L361-G363 PolarHBondContact O-N 3.29Å; G363-S365 PolarHBondContact O-N 2.95Å
364	I	35.8	Very low	42.8	Very low	77 Å²	77	117.5 Å²	117.5	40%	0.395	61%	0.607	S	S	.	*			trans	-80.7	78.9	-179.6	-58	-175.5	0	0	0	109.5	D368	I364-D368 HydrophobicContact CG2-CB 3.66Å
365	S	32.8	Very low	45.7	Very low	75 Å²	75	107.7 Å²	107.7	52%	0.524	57%	0.57	S	S	.	*			trans	-68.4	160.9	163	54.1	0	0	0	0	109.9	G363 P367 D368	G363-S365 PolarHBondContact O-N 2.95Å; S365-P367 VanDerWaalsContact O-CD 3.24Å; S365-P367 WeakPolarHBondContact O-CD 3.4Å; S365-P367 WeakPolarHBondContact OG-CD 3.5Å; S365-P367 WeakPolarHBondContact OG-CG 3.33Å; S365-D368 PolarHBondContact O-N 3.27Å
366	K	41.8	Very low	48.6	Very low	194 Å²	194	102.8 Å²	102.8	84%	0.843	55%	0.546	S	S	*	.	G	3₁₀ helix	trans	-39	-31.7	177.1	-75	179.3	177.6	173.4	0	117.6	D368 L369	K366-D368 PolarHBondContact O-N 3.32Å; K366-D368 VanDerWaalsContact O-N 3.13Å; K366-L369 PolarHBondContact O-N 3.13Å
367	P	42.4	Very low	51.5	Low	67 Å²	67	99.6 Å²	99.6	44%	0.435	53%	0.531	S	S	.	.	G	3₁₀ helix	trans	-46.7	-26.9	172.3	11.3	-31.9	0	0	0	118.3	S365 L369 N370	S365-P367 VanDerWaalsContact O-CD 3.24Å; S365-P367 WeakPolarHBondContact O-CD 3.4Å; S365-P367 WeakPolarHBondContact OG-CD 3.5Å; S365-P367 WeakPolarHBondContact OG-CG 3.33Å; P367-L369 PolarHBondContact O-N 3.25Å; P367-L369 VanDerWaalsContact O-N 3.11Å; P367-N370 WeakPolarHBondContact O-CA 3.06Å; P367-N370 WeakPolarHBondContact O-CB 3.4Å; P367-N370 PolarHBondContact O-N 2.63Å
368	D	48.5	Very low	54.5	Low	49 Å²	49	91.5 Å²	91.5	26%	0.262	49%	0.494	S	S	.	.	G	3₁₀ helix	trans	-66.7	-15.9	-177.9	-90.9	12.4	0	0	0	114.1	I364 S365 K366 N370 N371	I364-D368 HydrophobicContact CG2-CB 3.66Å; S365-D368 PolarHBondContact O-N 3.27Å; K366-D368 PolarHBondContact O-N 3.32Å; K366-D368 VanDerWaalsContact O-N 3.13Å; D368-N370 PolarHBondContact O-N 2.69Å; D368-N371 WeakPolarHBondContact O-CB 3.29Å; D368-N371 PolarHBondContact O-N 3.38Å; D368-N371 PolarHBondContact OD1-ND2 2.71Å
369	L	49.6	Very low	57.2	Low	105 Å²	105	88.8 Å²	88.8	55%	0.55	48%	0.479	S	S	.	.	G	3₁₀ helix	trans	-66.9	-21.5	167.8	-90.6	155.9	0	0	0	112.9	K366 P367 N371	K366-L369 PolarHBondContact O-N 3.13Å; P367-L369 PolarHBondContact O-N 3.25Å; P367-L369 VanDerWaalsContact O-N 3.11Å; L369-N371 VanDerWaalsContact C-N 3.27Å
370	N	49.6	Very low	59.7	Low	121 Å²	121	85 Å²	85	65%	0.647	46%	0.462	S	S	*	.	G	3₁₀ helix	trans	-74.3	-19	173.3	-59.2	-10.6	0	0	0	112	P367 D368 F372	P367-N370 WeakPolarHBondContact O-CA 3.06Å; P367-N370 WeakPolarHBondContact O-CB 3.4Å; P367-N370 PolarHBondContact O-N 2.63Å; D368-N370 PolarHBondContact O-N 2.69Å; N370-F372 PolarHBondContact O-N 3.07Å
371	N	64.6	Low	62.4	Low	55 Å²	55	83.1 Å²	83.1	29%	0.294	46%	0.455	S	S	.	.	G	3₁₀ helix	trans	-75	-1.3	178.5	-63.1	-27.3	0	0	0	113	D368 L369 E373 Q374	D368-N371 WeakPolarHBondContact O-CB 3.29Å; D368-N371 PolarHBondContact O-N 3.38Å; D368-N371 PolarHBondContact OD1-ND2 2.71Å; L369-N371 VanDerWaalsContact C-N 3.27Å; N371-E373 PolarHBondContact O-N 3.13Å; N371-Q374 WeakPolarHBondContact O-CB 3.12Å; N371-Q374 PolarHBondContact O-N 3.45Å; N371-Q374 VanDerWaalsContact O-N 3.11Å
372	F	77.4	Confident	65.2	Low	30 Å²	30	80.8 Å²	80.8	13%	0.132	44%	0.443	C	S	.	.	G	3₁₀ helix	trans	-60.8	-29.2	176.8	-166.9	-97.7	0	0	0	113	N370 Q374 V375 K431 A434 V451 F453	N370-F372 PolarHBondContact O-N 3.07Å; F372-Q374 PolarHBondContact O-N 3.14Å; F372-V375 HydrophobicContact CD2-CB 4.42Å; F372-V375 HydrophobicContact CD2-CG2 3.95Å; F372-V375 HydrophobicContact CE2-CB 4.21Å; F372-V375 HydrophobicContact CE2-CG1 4.32Å; F372-V375 HydrophobicContact CE2-CG2 4.09Å; F372-V375 HydrophobicContact CZ-CB 4.5Å; F372-V375 WeakPolarHBondContact O-CB 3.4Å; F372-V375 PolarHBondContact O-N 3.17Å; F372-K431 HydrophobicContact CD1-CD 4.14Å; F372-K431 HydrophobicContact CD1-CG 4.47Å; F372-K431 HydrophobicContact CD2-CB 3.67Å; F372-K431 HydrophobicContact CD2-CD 4.34Å; F372-K431 HydrophobicContact CD2-CG 3.97Å; F372-K431 HydrophobicContact CE1-CD 4.03Å; F372-K431 HydrophobicContact CE1-CG 4.08Å; F372-K431 HydrophobicContact CE2-CB 3.56Å; F372-K431 HydrophobicContact CE2-CD 4.26Å; F372-K431 HydrophobicContact CE2-CG 3.56Å; F372-K431 HydrophobicContact CG-CB 4.39Å; F372-K431 HydrophobicContact CG-CD 4.31Å; F372-K431 HydrophobicContact CG-CG 4.42Å; F372-K431 HydrophobicContact CZ-CB 4.17Å; F372-K431 HydrophobicContact CZ-CD 4.11Å; F372-K431 HydrophobicContact CZ-CG 3.62Å; F372-A434 HydrophobicContact CE2-CB 4.13Å; F372-V451 HydrophobicContact CZ-CG1 4.13Å; F372-F453 HydrophobicContact CE1-CE2 4.03Å; F372-F453 HydrophobicContact CE1-CZ 4.35Å; F372-F453 AromaticContact CZ-CE2 3.63Å; F372-F453 HydrophobicContact CZ-CE2 3.63Å; F372-F453 AromaticContact CZ-CZ 3.81Å; F372-F453 HydrophobicContact CZ-CZ 3.81Å
373	E	76.5	Confident	68	Low	186 Å²	186	74.2 Å²	74.2	87%	0.869	42%	0.418	S	S	*	.	G	3₁₀ helix	trans	-62.9	-20.3	177	-61.6	-175.4	169.8	0	0	113.3	N371	N371-E373 PolarHBondContact O-N 3.13Å
374	Q	83.1	Confident	71	Confident	131 Å²	131	79.1 Å²	79.1	61%	0.612	42%	0.419	S	S	*	.	G	3₁₀ helix	trans	-82.9	-17.8	176.4	-58.3	174.3	10.5	0	0	112.6	N371 F372 P376 H438	N371-Q374 WeakPolarHBondContact O-CB 3.12Å; N371-Q374 PolarHBondContact O-N 3.45Å; N371-Q374 VanDerWaalsContact O-N 3.11Å; F372-Q374 PolarHBondContact O-N 3.14Å; Q374-P376 WeakPolarHBondContact O-CD 3.18Å; Q374-H438 PolarHBondContact O-NE2 2.81Å
375	V	88.6	Confident	73.5	Confident	3 Å²	3	76.9 Å²	76.9	2%	0.018	41%	0.407	C	S	.	.	S	Bend	trans	-69.8	123	-178.1	-178.6	0	0	0	0	109.1	F372 Q377 A434 H438 F448 V451	F372-V375 HydrophobicContact CD2-CB 4.42Å; F372-V375 HydrophobicContact CD2-CG2 3.95Å; F372-V375 HydrophobicContact CE2-CB 4.21Å; F372-V375 HydrophobicContact CE2-CG1 4.32Å; F372-V375 HydrophobicContact CE2-CG2 4.09Å; F372-V375 HydrophobicContact CZ-CB 4.5Å; F372-V375 WeakPolarHBondContact O-CB 3.4Å; F372-V375 PolarHBondContact O-N 3.17Å; V375-Q377 PolarHBondContact O-N 3.1Å; V375-Q377 VanDerWaalsContact O-N 3.14Å; V375-Q377 PolarHBondContact O-NE2 3.36Å; V375-A434 HydrophobicContact CG1-CB 4.13Å; V375-H438 HydrophobicContact CG2-CB 4.26Å; V375-F448 HydrophobicContact CG1-CE1 3.79Å; V375-F448 HydrophobicContact CG1-CZ 3.79Å; V375-V451 HydrophobicContact CG1-CG1 3.77Å
376	P	91.8	Very high	76	Confident	51 Å²	51	76.3 Å²	76.3	33%	0.331	40%	0.397	S	S	.	.	P	Polyproline II helix	trans	-58.5	119.1	-176.9	-26.8	34.7	0	0	0	112.7	Q374 H438 G450 V451	Q374-P376 WeakPolarHBondContact O-CD 3.18Å; P376-H438 WeakPolarHBondContact CD-ND1 3.37Å; P376-G450 CarbonylContact O-C 3.45Å; P376-G450 WeakPolarHBondContact O-CA 3.45Å; P376-V451 PolarHBondContact O-N 3.23Å
377	Q	91.1	Very high	78.1	Confident	94 Å²	94	73.5 Å²	73.5	44%	0.439	38%	0.381	S	S	.	.	B	Isolated β-bridge	trans	-87.5	118.8	174.4	-54.1	-57.8	-51.9	0	0	108.8	V375 V451 F453	V375-Q377 PolarHBondContact O-N 3.1Å; V375-Q377 VanDerWaalsContact O-N 3.14Å; V375-Q377 PolarHBondContact O-NE2 3.36Å; Q377-V451 CarbonylContact C-O 3.6Å; Q377-V451 WeakPolarHBondContact CA-O 3.29Å; Q377-F453 VanDerWaalsContact OE1-CD2 3.25Å
378	I	91	Very high	80.1	Confident	9 Å²	9	73.4 Å²	73.4	5%	0.046	37%	0.373	C	S	.	.	P	Polyproline II helix	trans	-102.6	117.3	-179.2	-63	169.7	0	0	0	108.7	A380 N382 I383 F402 F449 V451 S452 V462	I378-A380 PolarHBondContact O-N 3.19Å; I378-N382 HydrophobicContact CG2-CB 4.25Å; I378-I383 HydrophobicContact CB-CD1 4.25Å; I378-I383 HydrophobicContact CG2-CD1 3.65Å; I378-I383 HydrophobicContact CG2-CG1 3.69Å; I378-F402 HydrophobicContact CB-CE2 4.41Å; I378-F402 HydrophobicContact CD1-CD1 4.43Å; I378-F402 HydrophobicContact CD1-CE1 3.82Å; I378-F402 HydrophobicContact CD1-CE2 3.98Å; I378-F402 HydrophobicContact CD1-CZ 3.59Å; I378-F402 HydrophobicContact CG1-CE2 4.14Å; I378-F402 HydrophobicContact CG1-CZ 3.92Å; I378-F402 HydrophobicContact CG2-CD2 3.86Å; I378-F402 HydrophobicContact CG2-CE2 3.38Å; I378-F402 HydrophobicContact CG2-CZ 4.06Å; I378-F449 HydrophobicContact CD1-CB 3.97Å; I378-V451 PolarHBondContact N-O 3.45Å; I378-S452 WeakPolarHBondContact O-CA 3.33Å; I378-S452 VanDerWaalsContact O-CB 3.22Å; I378-S452 WeakPolarHBondContact O-CB 3.4Å; I378-S452 PolarHBondContact O-OG 3.41Å; I378-V462 HydrophobicContact CD1-CB 3.77Å; I378-V462 HydrophobicContact CD1-CG1 4.11Å; I378-V462 HydrophobicContact CD1-CG2 3.72Å
379	P	88.3	Confident	81.5	Confident	60 Å²	60	74.9 Å²	74.9	39%	0.39	38%	0.38	S	S	.	.	P	Polyproline II helix	trans	-58.6	137.4	175.4	-24.8	34.3	0	0	0	111.4	A381 N382 D454	P379-A381 PolarHBondContact O-N 2.6Å; P379-A381 VanDerWaalsContact O-N 3.13Å; P379-N382 WeakPolarHBondContact O-CB 3.39Å; P379-N382 PolarHBondContact O-N 2.74Å; P379-D454 WeakPolarHBondContact CA-OD2 3Å
380	A	85.6	Confident	82.4	Confident	30 Å²	30	71 Å²	71	25%	0.248	37%	0.365	C	S	.	.	G	3₁₀ helix	trans	-61.2	-26.2	-179.3	0	0	0	0	0	112.2	I378 N382 I383 D454	I378-A380 PolarHBondContact O-N 3.19Å; A380-N382 PolarHBondContact O-N 3.31Å; A380-I383 PolarHBondContact O-N 2.8Å; A380-D454 HydrophobicContact CB-CB 3.78Å; A380-D454 PolarHBondContact N-OD2 3.43Å
381	A	85.4	Confident	83.1	Confident	98 Å²	98	69.8 Å²	69.8	81%	0.81	37%	0.365	S	S	*	.	G	3₁₀ helix	trans	-61.4	-23	172.6	0	0	0	0	0	114	P379 I383	P379-A381 PolarHBondContact O-N 2.6Å; P379-A381 VanDerWaalsContact O-N 3.13Å; A381-I383 VanDerWaalsContact C-N 3.35Å
382	N	88.4	Confident	82.7	Confident	47 Å²	47	69.4 Å²	69.4	25%	0.251	37%	0.374	S	S	.	.	G	3₁₀ helix	trans	-88.2	-2.3	174.8	-68.2	-8.2	0	0	0	112.5	I378 P379 A380 F402 H403	I378-N382 HydrophobicContact CG2-CB 4.25Å; P379-N382 WeakPolarHBondContact O-CB 3.39Å; P379-N382 PolarHBondContact O-N 2.74Å; A380-N382 PolarHBondContact O-N 3.31Å; N382-F402 HydrophobicContact CB-CD2 4.32Å; N382-F402 HydrophobicContact CB-CE2 4.2Å; N382-F402 CarbonylContact O-C 3.55Å; N382-F402 WeakPolarHBondContact O-CA 3.34Å; N382-H403 HydrophobicContact CB-CB 4.15Å; N382-H403 PolarHBondContact O-N 3.49Å
383	I	89.7	Confident	81.3	Confident	18 Å²	18	72.1 Å²	72.1	9%	0.092	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	129.3	-176.9	-58	169	0	0	0	109.5	I378 A380 A381 F385 W401 F402 L417 V462	I378-I383 HydrophobicContact CB-CD1 4.25Å; I378-I383 HydrophobicContact CG2-CD1 3.65Å; I378-I383 HydrophobicContact CG2-CG1 3.69Å; A380-I383 PolarHBondContact O-N 2.8Å; A381-I383 VanDerWaalsContact C-N 3.35Å; I383-F385 HydrophobicContact CG2-CD2 4.49Å; I383-F385 HydrophobicContact CG2-CE2 4.3Å; I383-W401 WeakPolarHBondContact CA-O 3.31Å; I383-F402 HydrophobicContact CG1-CD2 4.44Å; I383-L417 HydrophobicContact CG2-CD1 3.43Å; I383-L417 VanDerWaalsContact CG2-CD1 3.43Å; I383-L417 HydrophobicContact CG2-CD2 3.61Å; I383-L417 HydrophobicContact CG2-CG 4.18Å; I383-V462 HydrophobicContact CD1-CG2 3.56Å; I383-V462 HydrophobicContact CG1-CG2 4.36Å
384	R	88.6	Confident	80.2	Confident	161 Å²	161	65.4 Å²	65.4	61%	0.608	37%	0.37	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120.8	111.7	174.9	-177.3	178.4	-179.8	-176.1	2.5	110.4	G400 W401	R384-G400 CarbonylContact O-C 3.54Å; R384-G400 WeakPolarHBondContact O-CA 3.48Å; R384-W401 HydrophobicContact CB-CB 4.41Å; R384-W401 PolarHBondContact N-O 3.13Å; R384-W401 PolarHBondContact O-N 3.49Å
385	F	87.7	Confident	79.3	Confident	31 Å²	31	59.5 Å²	59.5	14%	0.136	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.1	144.4	170.3	-68.7	-101.5	0	0	0	110.7	I383 W398 L417 V419	I383-F385 HydrophobicContact CG2-CD2 4.49Å; I383-F385 HydrophobicContact CG2-CE2 4.3Å; F385-W398 HydrophobicContact CD1-CB 3.67Å; F385-W398 AromaticContact CD1-CD2 3.98Å; F385-W398 HydrophobicContact CD1-CD2 3.98Å; F385-W398 HydrophobicContact CD1-CE3 4.36Å; F385-W398 AromaticContact CD1-CG 3.67Å; F385-W398 HydrophobicContact CD1-CG 3.67Å; F385-W398 HydrophobicContact CE1-CB 4.11Å; F385-W398 HydrophobicContact CE1-CG 4.02Å; F385-L417 HydrophobicContact CD1-CD1 3.61Å; F385-L417 HydrophobicContact CD2-CD1 4.04Å; F385-L417 HydrophobicContact CE1-CB 3.96Å; F385-L417 HydrophobicContact CE1-CD1 3.63Å; F385-L417 HydrophobicContact CE1-CG 4.44Å; F385-L417 HydrophobicContact CE2-CD1 4.05Å; F385-L417 HydrophobicContact CG-CD1 3.82Å; F385-L417 HydrophobicContact CZ-CB 4.41Å; F385-L417 HydrophobicContact CZ-CD1 3.86Å; F385-V419 HydrophobicContact CE1-CG2 3.78Å; F385-V419 HydrophobicContact CZ-CG2 4.21Å
386	L	85.6	Confident	78.8	Confident	62 Å²	62	62.1 Å²	62.1	33%	0.325	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	-71.3	-179.5	-64.9	173.3	0	0	0	112.4	E399 W401	L386-E399 HydrophobicContact CB-CB 4.44Å; L386-E399 WeakPolarHBondContact CB-O 3.35Å; L386-E399 HydrophobicContact CD1-CG 4.22Å; L386-E399 PolarHBondContact N-O 2.89Å; L386-W401 HydrophobicContact CD1-CG 4.31Å
387	R	86.6	Confident	78.5	Confident	135 Å²	135	61.4 Å²	61.4	51%	0.509	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	149.1	-177.7	59	173.7	150	145.8	-7	110.8	W398 E399	R387-W398 CarbonylContact O-C 3.57Å; R387-W398 WeakPolarHBondContact O-CA 3.4Å; R387-E399 HydrophobicContact CG-CB 3.67Å; R387-E399 HydrophobicContact CG-CG 4.43Å; R387-E399 VanDerWaalsContact CZ-CD 3.46Å; R387-E399 IonicContact CZ-OE1 3.93Å; R387-E399 VanDerWaalsContact CZ-OE1 3.24Å; R387-E399 IonicContact CZ-OE2 3.26Å; R387-E399 IonicContact NE-OE1 3Å; R387-E399 PolarHBondContact NE-OE1 3.32Å; R387-E399 IonicContact NE-OE2 2.65Å; R387-E399 PolarHBondContact NE-OE2 3.03Å; R387-E399 IonicContact NH1-OE2 2.66Å; R387-E399 IonicContact NH2-OE1 3.94Å; R387-E399 PolarHBondContact NH2-OE1 2.95Å; R387-E399 IonicContact NH2-OE2 3.87Å; R387-E399 PolarHBondContact NH2-OE2 3.4Å; R387-E399 PolarHBondContact O-N 3.42Å
388	Y	83.8	Confident	78.5	Confident	66 Å²	66	57.7 Å²	57.7	26%	0.259	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	131.4	171.2	178.3	-111.8	0	0	0	110.5	G390 C391 K396 W398	Y388-G390 VanDerWaalsContact CE2-O 3.24Å; Y388-G390 WeakPolarHBondContact CE2-O 3.39Å; Y388-G390 VanDerWaalsContact OH-C 3.28Å; Y388-C391 WeakPolarHBondContact OH-CB 3.49Å; Y388-C391 PolarHBondContact OH-N 2.77Å; Y388-C391 VanDerWaalsContact OH-N 3.08Å; Y388-C391 PolarHBondContact OH-SG 3.13Å; Y388-C391 VanDerWaalsContact OH-SG 3.39Å; Y388-K396 HydrophobicContact CD2-CB 4.46Å; Y388-K396 HydrophobicContact CE2-CB 3.87Å; Y388-K396 HydrophobicContact CE2-CD 4.06Å; Y388-K396 HydrophobicContact CE2-CG 3.88Å; Y388-W398 HydrophobicContact CD2-CD2 4.45Å; Y388-W398 HydrophobicContact CD2-CZ2 4.41Å
389	I	79.1	Confident	78.5	Confident	79 Å²	79	57.8 Å²	57.8	41%	0.405	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	-39.8	177	-60.9	166.3	0	0	0	110.3	V397 E399 M465	I389-V397 HydrophobicContact CD1-CG1 4.31Å; I389-V397 PolarHBondContact N-O 2.89Å; I389-E399 HydrophobicContact CD1-CB 3.79Å; I389-E399 VanDerWaalsContact CD1-N 3.29Å; I389-E399 HydrophobicContact CG1-CB 3.9Å; I389-M465 HydrophobicContact CD1-CE 3.63Å; I389-M465 HydrophobicContact CD1-SD 3.63Å; I389-M465 HydrophobicContact CG1-CE 4.38Å
390	G	68	Low	78.6	Confident	23 Å²	23	54.9 Å²	54.9	24%	0.237	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	168.2	176.3	178.9	0	0	0	0	0	114.2	Y388 V397	Y388-G390 VanDerWaalsContact CE2-O 3.24Å; Y388-G390 WeakPolarHBondContact CE2-O 3.39Å; Y388-G390 VanDerWaalsContact OH-C 3.28Å; G390-V397 PolarHBondContact N-O 3.27Å; G390-V397 PolarHBondContact O-N 3.44Å
391	C	64.9	Low	78.9	Confident	96 Å²	96	58 Å²	58	65%	0.649	32%	0.319	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111	124.9	172.2	47.3	0	0	0	0	109.9	Y388 G395	Y388-C391 WeakPolarHBondContact OH-CB 3.49Å; Y388-C391 PolarHBondContact OH-N 2.77Å; Y388-C391 VanDerWaalsContact OH-N 3.08Å; Y388-C391 PolarHBondContact OH-SG 3.13Å; Y388-C391 VanDerWaalsContact OH-SG 3.39Å; C391-G395 WeakPolarHBondContact CA-O 3.34Å
392	G	54.6	Low	79.3	Confident	47 Å²	47	54.3 Å²	54.3	49%	0.485	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	177.1	163.6	0	0	0	0	0	110.9	F394 G395	G392-F394 PolarHBondContact O-N 3.48Å; G392-F394 VanDerWaalsContact O-N 3.09Å; G392-G395 PolarHBondContact N-O 2.94Å; G392-G395 PolarHBondContact O-N 3.03Å
393	A	48.3	Very low	79.3	Confident	87 Å²	87	53.3 Å²	53.3	72%	0.719	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-22.9	173.9	0	0	0	0	0	113.3
394	F	53	Low	79	Confident	46 Å²	46	53.4 Å²	53.4	20%	0.202	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.7	-8.6	-173.3	-55.7	-78.9	0	0	0	114.3	G392 K418 D587	G392-F394 PolarHBondContact O-N 3.48Å; G392-F394 VanDerWaalsContact O-N 3.09Å; F394-K418 VanDerWaalsContact CB-CE 3.48Å; F394-D587 WeakPolarHBondContact CD2-OD1 3.46Å; F394-D587 WeakPolarHBondContact CD2-OD2 3.16Å; F394-D587 WeakPolarHBondContact CE2-OD1 3.35Å; F394-D587 WeakPolarHBondContact CE2-OD2 3.38Å
395	G	65.1	Low	78.6	Confident	7 Å²	7	54.4 Å²	54.4	7%	0.072	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	147.8	-168.1	179.6	0	0	0	0	0	115.1	C391 G392	C391-G395 WeakPolarHBondContact CA-O 3.34Å; G392-G395 PolarHBondContact N-O 2.94Å; G392-G395 PolarHBondContact O-N 3.03Å
396	K	79.2	Confident	77.8	Confident	57 Å²	57	55.2 Å²	55.2	25%	0.248	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	133.9	179.9	-68.7	-170.9	176.5	-172.6	0	110.1	E174 Y388 V419	E174-K396 IonicContact OE2-NZ 3.44Å; Y388-K396 HydrophobicContact CD2-CB 4.46Å; Y388-K396 HydrophobicContact CE2-CB 3.87Å; Y388-K396 HydrophobicContact CE2-CD 4.06Å; Y388-K396 HydrophobicContact CE2-CG 3.88Å; K396-V419 PolarHBondContact N-O 3.45Å; K396-V419 PolarHBondContact O-N 2.95Å
397	V	85.5	Confident	77.1	Confident	37 Å²	37	57.5 Å²	57.5	22%	0.224	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	127.5	176	-172.6	0	0	0	0	109.3	I389 G390 A416 L417 K418	I389-V397 HydrophobicContact CD1-CG1 4.31Å; I389-V397 PolarHBondContact N-O 2.89Å; G390-V397 PolarHBondContact N-O 3.27Å; G390-V397 PolarHBondContact O-N 3.44Å; V397-A416 HydrophobicContact CG1-CB 4.07Å; V397-L417 WeakPolarHBondContact CA-O 3.45Å; V397-K418 HydrophobicContact CG2-CB 4.44Å; V397-K418 HydrophobicContact CG2-CG 4.34Å
398	W	90	Very high	76	Confident	15 Å²	15	58.3 Å²	58.3	6%	0.057	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	147.5	178.5	-64.8	76.1	0	0	0	111.2	H164 F385 R387 Y388 A416 L417	H164-W398 HydrophobicContact CB-CH2 4.37Å; H164-W398 AromaticContact CD2-CH2 3.6Å; H164-W398 AromaticContact CD2-CZ2 3.94Å; H164-W398 AromaticContact CE1-CZ2 3.56Å; H164-W398 AromaticContact CG-CH2 3.74Å; H164-W398 AromaticContact CG-CZ2 3.82Å; H164-W398 AromaticContact ND1-CZ2 3.6Å; H164-W398 AromaticContact NE2-CH2 3.76Å; H164-W398 AromaticContact NE2-CZ2 3.76Å; F385-W398 HydrophobicContact CD1-CB 3.67Å; F385-W398 AromaticContact CD1-CD2 3.98Å; F385-W398 HydrophobicContact CD1-CD2 3.98Å; F385-W398 HydrophobicContact CD1-CE3 4.36Å; F385-W398 AromaticContact CD1-CG 3.67Å; F385-W398 HydrophobicContact CD1-CG 3.67Å; F385-W398 HydrophobicContact CE1-CB 4.11Å; F385-W398 HydrophobicContact CE1-CG 4.02Å; R387-W398 CarbonylContact O-C 3.57Å; R387-W398 WeakPolarHBondContact O-CA 3.4Å; Y388-W398 HydrophobicContact CD2-CD2 4.45Å; Y388-W398 HydrophobicContact CD2-CZ2 4.41Å; W398-A416 CarbonylContact O-C 3.53Å; W398-A416 WeakPolarHBondContact O-CA 3.43Å; W398-L417 HydrophobicContact CB-CB 4.26Å; W398-L417 PolarHBondContact N-O 2.83Å; W398-L417 PolarHBondContact O-N 3.03Å
399	E	91	Very high	75.4	Confident	11 Å²	11	56.9 Å²	56.9	5%	0.051	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	139.5	161.8	-166.9	170	104.7	0	0	108.2	L386 R387 I389 K414 M465	L386-E399 HydrophobicContact CB-CB 4.44Å; L386-E399 WeakPolarHBondContact CB-O 3.35Å; L386-E399 HydrophobicContact CD1-CG 4.22Å; L386-E399 PolarHBondContact N-O 2.89Å; R387-E399 HydrophobicContact CG-CB 3.67Å; R387-E399 HydrophobicContact CG-CG 4.43Å; R387-E399 VanDerWaalsContact CZ-CD 3.46Å; R387-E399 IonicContact CZ-OE1 3.93Å; R387-E399 VanDerWaalsContact CZ-OE1 3.24Å; R387-E399 IonicContact CZ-OE2 3.26Å; R387-E399 IonicContact NE-OE1 3Å; R387-E399 PolarHBondContact NE-OE1 3.32Å; R387-E399 IonicContact NE-OE2 2.65Å; R387-E399 PolarHBondContact NE-OE2 3.03Å; R387-E399 IonicContact NH1-OE2 2.66Å; R387-E399 IonicContact NH2-OE1 3.94Å; R387-E399 PolarHBondContact NH2-OE1 2.95Å; R387-E399 IonicContact NH2-OE2 3.87Å; R387-E399 PolarHBondContact NH2-OE2 3.4Å; R387-E399 PolarHBondContact O-N 3.42Å; I389-E399 HydrophobicContact CD1-CB 3.79Å; I389-E399 VanDerWaalsContact CD1-N 3.29Å; I389-E399 HydrophobicContact CG1-CB 3.9Å; E399-K414 VanDerWaalsContact CG-CE 3.4Å; E399-K414 WeakPolarHBondContact OE1-CE 3.43Å; E399-K414 IonicContact OE1-NZ 3.92Å; E399-K414 PolarHBondContact OE1-NZ 3.31Å; E399-K414 VanDerWaalsContact OE1-NZ 3.09Å; E399-K414 WeakPolarHBondContact OE2-CE 3.42Å; E399-K414 IonicContact OE2-NZ 3.76Å; E399-K414 PolarHBondContact OE2-NZ 3.09Å; E399-M465 HydrophobicContact CG-CE 4.32Å; E399-M465 HydrophobicContact CG-SD 4.27Å; E399-M465 VanDerWaalsContact OE2-CE 3.28Å; E399-M465 WeakPolarHBondContact OE2-CE 3.34Å
400	G	91	Very high	75.2	Confident	0 Å²	0	58.8 Å²	58.8	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	175.6	174.9	0	0	0	0	0	113.6	R384 V415	R384-G400 CarbonylContact O-C 3.54Å; R384-G400 WeakPolarHBondContact O-CA 3.48Å; G400-V415 PolarHBondContact N-O 2.92Å; G400-V415 WeakPolarHBondContact O-CG2 3.43Å; G400-V415 PolarHBondContact O-N 2.81Å
401	W	91.8	Very high	76	Confident	96 Å²	96	62.7 Å²	62.7	36%	0.364	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	134.9	162.8	-67.4	109.3	0	0	0	109.5	I383 R384 L386 F412 E413 K414	I383-W401 WeakPolarHBondContact CA-O 3.31Å; R384-W401 HydrophobicContact CB-CB 4.41Å; R384-W401 PolarHBondContact N-O 3.13Å; R384-W401 PolarHBondContact O-N 3.49Å; L386-W401 HydrophobicContact CD1-CG 4.31Å; W401-F412 HydrophobicContact CB-CD1 4.28Å; W401-F412 HydrophobicContact CD2-CB 4.37Å; W401-F412 HydrophobicContact CE3-CB 3.83Å; W401-F412 HydrophobicContact CZ3-CB 4.43Å; W401-F412 WeakPolarHBondContact CZ3-O 3.49Å; W401-E413 CarbonylContact C-O 3.59Å; W401-E413 WeakPolarHBondContact CA-O 3.3Å; W401-E413 VanDerWaalsContact CE3-C 3.48Å; W401-K414 HydrophobicContact CE3-CB 4.11Å; W401-K414 HydrophobicContact CH2-CB 4.13Å; W401-K414 HydrophobicContact CZ3-CB 3.72Å; W401-K414 HydrophobicContact CZ3-CG 4.44Å
402	F	92.6	Very high	76.9	Confident	20 Å²	20	64.6 Å²	64.6	9%	0.088	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	124.1	167.8	173.2	-147	0	0	0	108.5	I378 N382 I383 V404 F412 E413 V415 F449 V462	I378-F402 HydrophobicContact CB-CE2 4.41Å; I378-F402 HydrophobicContact CD1-CD1 4.43Å; I378-F402 HydrophobicContact CD1-CE1 3.82Å; I378-F402 HydrophobicContact CD1-CE2 3.98Å; I378-F402 HydrophobicContact CD1-CZ 3.59Å; I378-F402 HydrophobicContact CG1-CE2 4.14Å; I378-F402 HydrophobicContact CG1-CZ 3.92Å; I378-F402 HydrophobicContact CG2-CD2 3.86Å; I378-F402 HydrophobicContact CG2-CE2 3.38Å; I378-F402 HydrophobicContact CG2-CZ 4.06Å; N382-F402 HydrophobicContact CB-CD2 4.32Å; N382-F402 HydrophobicContact CB-CE2 4.2Å; N382-F402 CarbonylContact O-C 3.55Å; N382-F402 WeakPolarHBondContact O-CA 3.34Å; I383-F402 HydrophobicContact CG1-CD2 4.44Å; F402-V404 HydrophobicContact CD1-CG2 3.48Å; F402-V404 VanDerWaalsContact CD1-CG2 3.48Å; F402-V404 HydrophobicContact CE1-CG2 3.55Å; F402-V404 HydrophobicContact CG-CG2 4Å; F402-V404 HydrophobicContact CZ-CG2 4.1Å; F402-V404 PolarHBondContact O-N 2.99Å; F402-F412 WeakPolarHBondContact O-CA 3.37Å; F402-E413 PolarHBondContact N-O 2.87Å; F402-E413 PolarHBondContact O-N 3.41Å; F402-V415 HydrophobicContact CB-CB 4.34Å; F402-V415 HydrophobicContact CB-CG1 3.56Å; F402-V415 HydrophobicContact CB-CG2 3.84Å; F402-V415 HydrophobicContact CD1-CG1 4.37Å; F402-V415 HydrophobicContact CG-CG1 4.46Å; F402-F449 HydrophobicContact CD1-CB 4.07Å; F402-F449 HydrophobicContact CD1-CD1 4.05Å; F402-F449 HydrophobicContact CD1-CD2 4.48Å; F402-F449 AromaticContact CD1-CG 3.96Å; F402-F449 HydrophobicContact CD1-CG 3.96Å; F402-F449 HydrophobicContact CE1-CB 3.75Å; F402-F449 AromaticContact CE1-CD1 3.87Å; F402-F449 HydrophobicContact CE1-CD1 3.87Å; F402-F449 AromaticContact CE1-CG 3.95Å; F402-F449 HydrophobicContact CE1-CG 3.95Å; F402-V462 HydrophobicContact CB-CG1 4.17Å; F402-V462 HydrophobicContact CD1-CG1 4.02Å; F402-V462 HydrophobicContact CG-CG1 4.11Å
403	H	89.8	Confident	78.5	Confident	25 Å²	25	64.2 Å²	64.2	12%	0.116	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	102.9	173.9	-177.4	-146.7	0	0	0	109.7	N382 E410 F412	N382-H403 HydrophobicContact CB-CB 4.15Å; N382-H403 PolarHBondContact O-N 3.49Å; H403-E410 VanDerWaalsContact CE1-CD 3.43Å; H403-E410 IonicContact CE1-OE1 3.09Å; H403-E410 PolarHBondContact CE1-OE1 3.21Å; H403-E410 VanDerWaalsContact CE1-OE1 3.24Å; H403-E410 IonicContact CE1-OE2 3.24Å; H403-E410 VanDerWaalsContact NE2-CB 3.35Å; H403-E410 WeakPolarHBondContact NE2-CB 3.28Å; H403-E410 VanDerWaalsContact NE2-CD 3.3Å; H403-E410 WeakPolarHBondContact NE2-CG 3.23Å; H403-E410 IonicContact NE2-OE1 2.82Å; H403-E410 IonicContact NE2-OE2 3.29Å; H403-F412 HydrophobicContact CB-CD1 4.1Å; H403-F412 HydrophobicContact CB-CE1 3.77Å; H403-F412 HydrophobicContact CB-CZ 4.47Å; H403-F412 AromaticContact CD2-CZ 3.93Å; H403-F412 AromaticContact CG-CE1 3.97Å
404	V	82.9	Confident	80.6	Confident	21 Å²	21	63.7 Å²	63.7	13%	0.127	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	123.9	179.6	-176.2	0	0	0	0	109	F402 D406 R411 E413	F402-V404 HydrophobicContact CD1-CG2 3.48Å; F402-V404 VanDerWaalsContact CD1-CG2 3.48Å; F402-V404 HydrophobicContact CE1-CG2 3.55Å; F402-V404 HydrophobicContact CG-CG2 4Å; F402-V404 HydrophobicContact CZ-CG2 4.1Å; F402-V404 PolarHBondContact O-N 2.99Å; V404-D406 HydrophobicContact CG1-CB 4.45Å; V404-R411 HydrophobicContact CB-CG 3.87Å; V404-R411 HydrophobicContact CG1-CG 4.44Å; V404-R411 PolarHBondContact N-O 2.88Å; V404-R411 PolarHBondContact O-N 3.18Å; V404-E413 HydrophobicContact CG2-CB 4.1Å; V404-E413 HydrophobicContact CG2-CG 3.9Å; V404-E413 WeakPolarHBondContact CG2-OE1 3.12Å
405	R	79.4	Confident	82.5	Confident	181 Å²	181	61.5 Å²	61.5	68%	0.683	31%	0.307	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.5	107	165	-77.2	175.6	171.6	176.4	-1.7	107.9	E410	R405-E410 HydrophobicContact CG-CG 3.97Å; R405-E410 IonicContact CZ-OE1 2.66Å; R405-E410 IonicContact NE-OE1 3.95Å; R405-E410 PolarHBondContact NE-OE1 3.37Å; R405-E410 IonicContact NH2-OE1 3.89Å; R405-E410 PolarHBondContact NH2-OE1 3.4Å
406	D	71.5	Confident	83.9	Confident	49 Å²	49	61.7 Å²	61.7	26%	0.262	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	177.9	171	72.2	18.1	0	0	0	110.5	V404 N408 G409 R411	V404-D406 HydrophobicContact CG1-CB 4.45Å; D406-N408 PolarHBondContact O-N 3.1Å; D406-N408 VanDerWaalsContact OD1-CA 3.25Å; D406-N408 WeakPolarHBondContact OD1-CA 3.44Å; D406-N408 VanDerWaalsContact OD1-CB 3.29Å; D406-N408 WeakPolarHBondContact OD1-CB 3.24Å; D406-N408 PolarHBondContact OD1-N 3.46Å; D406-G409 PolarHBondContact N-O 3.42Å; D406-G409 PolarHBondContact O-N 3.25Å; D406-G409 PolarHBondContact OD1-N 2.9Å; D406-R411 WeakPolarHBondContact OD2-CD 3.14Å; D406-R411 IonicContact OD2-CZ 2.67Å; D406-R411 IonicContact OD2-NE 2.74Å; D406-R411 PolarHBondContact OD2-NE 3.4Å; D406-R411 IonicContact OD2-NH1 2.7Å; D406-R411 PolarHBondContact OD2-NH1 3.01Å
407	A	70.3	Confident	84.4	Confident	110 Å²	110	59 Å²	59	91%	0.909	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-12.7	178.7	0	0	0	0	0	113.8
408	N	63.8	Low	84.6	Confident	152 Å²	152	58.2 Å²	58.2	81%	0.813	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.1	-10.2	-180	-54.8	-35.7	0	0	0	112.2	D406	D406-N408 PolarHBondContact O-N 3.1Å; D406-N408 VanDerWaalsContact OD1-CA 3.25Å; D406-N408 WeakPolarHBondContact OD1-CA 3.44Å; D406-N408 VanDerWaalsContact OD1-CB 3.29Å; D406-N408 WeakPolarHBondContact OD1-CB 3.24Å; D406-N408 PolarHBondContact OD1-N 3.46Å
409	G	71.3	Confident	84.4	Confident	35 Å²	35	58.2 Å²	58.2	36%	0.361	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	141.8	-157.7	169.6	0	0	0	0	0	114.6	D406	D406-G409 PolarHBondContact N-O 3.42Å; D406-G409 PolarHBondContact O-N 3.25Å; D406-G409 PolarHBondContact OD1-N 2.9Å
410	E	75.5	Confident	83.9	Confident	120 Å²	120	59.7 Å²	59.7	56%	0.561	30%	0.296	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93	117.2	172.2	-76	-167.8	152	0	0	109.6	H403 R405	H403-E410 VanDerWaalsContact CE1-CD 3.43Å; H403-E410 IonicContact CE1-OE1 3.09Å; H403-E410 PolarHBondContact CE1-OE1 3.21Å; H403-E410 VanDerWaalsContact CE1-OE1 3.24Å; H403-E410 IonicContact CE1-OE2 3.24Å; H403-E410 VanDerWaalsContact NE2-CB 3.35Å; H403-E410 WeakPolarHBondContact NE2-CB 3.28Å; H403-E410 VanDerWaalsContact NE2-CD 3.3Å; H403-E410 WeakPolarHBondContact NE2-CG 3.23Å; H403-E410 IonicContact NE2-OE1 2.82Å; H403-E410 IonicContact NE2-OE2 3.29Å; R405-E410 HydrophobicContact CG-CG 3.97Å; R405-E410 IonicContact CZ-OE1 2.66Å; R405-E410 IonicContact NE-OE1 3.95Å; R405-E410 PolarHBondContact NE-OE1 3.37Å; R405-E410 IonicContact NH2-OE1 3.89Å; R405-E410 PolarHBondContact NH2-OE1 3.4Å
411	R	84	Confident	83.1	Confident	104 Å²	104	62.6 Å²	62.6	39%	0.392	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	146.5	177.8	72.8	-173.2	-162.8	-169.2	14.6	111.6	V404 D406 E413	V404-R411 HydrophobicContact CB-CG 3.87Å; V404-R411 HydrophobicContact CG1-CG 4.44Å; V404-R411 PolarHBondContact N-O 2.88Å; V404-R411 PolarHBondContact O-N 3.18Å; D406-R411 WeakPolarHBondContact OD2-CD 3.14Å; D406-R411 IonicContact OD2-CZ 2.67Å; D406-R411 IonicContact OD2-NE 2.74Å; D406-R411 PolarHBondContact OD2-NE 3.4Å; D406-R411 IonicContact OD2-NH1 2.7Å; D406-R411 PolarHBondContact OD2-NH1 3.01Å; R411-E413 HydrophobicContact CG-CG 4.36Å; R411-E413 IonicContact CZ-OE1 3.11Å; R411-E413 IonicContact NE-OE1 3.88Å; R411-E413 PolarHBondContact NE-OE1 2.97Å; R411-E413 IonicContact NH2-OE1 2.86Å; R411-E413 PolarHBondContact NH2-OE1 2.95Å; R411-E413 IonicContact NH2-OE2 3.14Å
412	F	84.2	Confident	82	Confident	137 Å²	137	62.6 Å²	62.6	60%	0.601	33%	0.325	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.9	112.9	172.2	-69.1	-85.4	0	0	0	109.3	W401 F402 H403	W401-F412 HydrophobicContact CB-CD1 4.28Å; W401-F412 HydrophobicContact CD2-CB 4.37Å; W401-F412 HydrophobicContact CE3-CB 3.83Å; W401-F412 HydrophobicContact CZ3-CB 4.43Å; W401-F412 WeakPolarHBondContact CZ3-O 3.49Å; F402-F412 WeakPolarHBondContact O-CA 3.37Å; H403-F412 HydrophobicContact CB-CD1 4.1Å; H403-F412 HydrophobicContact CB-CE1 3.77Å; H403-F412 HydrophobicContact CB-CZ 4.47Å; H403-F412 AromaticContact CD2-CZ 3.93Å; H403-F412 AromaticContact CG-CE1 3.97Å
413	E	88.4	Confident	80.6	Confident	38 Å²	38	70.9 Å²	70.9	18%	0.178	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	140	173.9	-72.6	-169.4	-132.8	0	0	110.9	W401 F402 V404 R411 F449	W401-E413 CarbonylContact C-O 3.59Å; W401-E413 WeakPolarHBondContact CA-O 3.3Å; W401-E413 VanDerWaalsContact CE3-C 3.48Å; F402-E413 PolarHBondContact N-O 2.87Å; F402-E413 PolarHBondContact O-N 3.41Å; V404-E413 HydrophobicContact CG2-CB 4.1Å; V404-E413 HydrophobicContact CG2-CG 3.9Å; V404-E413 WeakPolarHBondContact CG2-OE1 3.12Å; R411-E413 HydrophobicContact CG-CG 4.36Å; R411-E413 IonicContact CZ-OE1 3.11Å; R411-E413 IonicContact NE-OE1 3.88Å; R411-E413 PolarHBondContact NE-OE1 2.97Å; R411-E413 IonicContact NH2-OE1 2.86Å; R411-E413 PolarHBondContact NH2-OE1 2.95Å; R411-E413 IonicContact NH2-OE2 3.14Å; E413-F449 WeakPolarHBondContact OE2-CE1 3.38Å; E413-F449 WeakPolarHBondContact OE2-CZ 3.43Å
414	K	91.4	Very high	79.2	Confident	76 Å²	76	73 Å²	73	33%	0.33	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	122.7	177.2	-166.4	177.8	179.2	-177.4	0	109.3	E399 W401 M465	E399-K414 VanDerWaalsContact CG-CE 3.4Å; E399-K414 WeakPolarHBondContact OE1-CE 3.43Å; E399-K414 IonicContact OE1-NZ 3.92Å; E399-K414 PolarHBondContact OE1-NZ 3.31Å; E399-K414 VanDerWaalsContact OE1-NZ 3.09Å; E399-K414 WeakPolarHBondContact OE2-CE 3.42Å; E399-K414 IonicContact OE2-NZ 3.76Å; E399-K414 PolarHBondContact OE2-NZ 3.09Å; W401-K414 HydrophobicContact CE3-CB 4.11Å; W401-K414 HydrophobicContact CH2-CB 4.13Å; W401-K414 HydrophobicContact CZ3-CB 3.72Å; W401-K414 HydrophobicContact CZ3-CG 4.44Å; K414-M465 HydrophobicContact CB-CB 4.33Å; K414-M465 HydrophobicContact CD-CB 4.5Å; K414-M465 HydrophobicContact CD-CG 4.11Å; K414-M465 HydrophobicContact CG-CB 4.03Å; K414-M465 HydrophobicContact CG-CG 4.06Å; K414-M465 VanDerWaalsContact O-CB 3.23Å; K414-M465 WeakPolarHBondContact O-CB 3.38Å; K414-M465 PolarHBondContact O-N 3.48Å
415	V	94.1	Very high	78.5	Confident	0 Å²	0	72.9 Å²	72.9	0%	0	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	156.5	-170.3	-68.2	0	0	0	0	112.8	G400 F402 L417 F449 V462 L463	G400-V415 PolarHBondContact N-O 2.92Å; G400-V415 WeakPolarHBondContact O-CG2 3.43Å; G400-V415 PolarHBondContact O-N 2.81Å; F402-V415 HydrophobicContact CB-CB 4.34Å; F402-V415 HydrophobicContact CB-CG1 3.56Å; F402-V415 HydrophobicContact CB-CG2 3.84Å; F402-V415 HydrophobicContact CD1-CG1 4.37Å; F402-V415 HydrophobicContact CG-CG1 4.46Å; V415-L417 HydrophobicContact CG2-CD2 3.82Å; V415-L417 HydrophobicContact CG2-CG 4.19Å; V415-F449 HydrophobicContact CG1-CD2 4.07Å; V415-F449 HydrophobicContact CG1-CE2 3.88Å; V415-V462 HydrophobicContact CB-CG1 4.02Å; V415-V462 HydrophobicContact CG1-CG1 3.86Å; V415-V462 HydrophobicContact CG2-CG1 4.18Å; V415-L463 CarbonylContact C-O 3.52Å; V415-L463 VanDerWaalsContact CA-O 3.22Å; V415-L463 WeakPolarHBondContact CA-O 3.48Å; V415-L463 WeakPolarHBondContact CB-O 3.4Å
416	A	93.4	Very high	78.1	Confident	11 Å²	11	67.8 Å²	67.8	9%	0.091	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	128.8	163.8	0	0	0	0	0	109.5	V397 W398 L463 M465	V397-A416 HydrophobicContact CG1-CB 4.07Å; W398-A416 CarbonylContact O-C 3.53Å; W398-A416 WeakPolarHBondContact O-CA 3.43Å; A416-L463 HydrophobicContact CB-CB 4.34Å; A416-L463 PolarHBondContact N-O 2.88Å; A416-L463 PolarHBondContact O-N 3Å; A416-M465 HydrophobicContact CB-SD 4.36Å
417	L	91.4	Very high	78.4	Confident	0 Å²	0	69.1 Å²	69.1	0%	0	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	98.4	-176.8	-56.8	172.5	0	0	0	108.8	I383 F385 V397 W398 V415 V419 L461 V462	I383-L417 HydrophobicContact CG2-CD1 3.43Å; I383-L417 VanDerWaalsContact CG2-CD1 3.43Å; I383-L417 HydrophobicContact CG2-CD2 3.61Å; I383-L417 HydrophobicContact CG2-CG 4.18Å; F385-L417 HydrophobicContact CD1-CD1 3.61Å; F385-L417 HydrophobicContact CD2-CD1 4.04Å; F385-L417 HydrophobicContact CE1-CB 3.96Å; F385-L417 HydrophobicContact CE1-CD1 3.63Å; F385-L417 HydrophobicContact CE1-CG 4.44Å; F385-L417 HydrophobicContact CE2-CD1 4.05Å; F385-L417 HydrophobicContact CG-CD1 3.82Å; F385-L417 HydrophobicContact CZ-CB 4.41Å; F385-L417 HydrophobicContact CZ-CD1 3.86Å; V397-L417 WeakPolarHBondContact CA-O 3.45Å; W398-L417 HydrophobicContact CB-CB 4.26Å; W398-L417 PolarHBondContact N-O 2.83Å; W398-L417 PolarHBondContact O-N 3.03Å; V415-L417 HydrophobicContact CG2-CD2 3.82Å; V415-L417 HydrophobicContact CG2-CG 4.19Å; L417-V419 PolarHBondContact O-N 2.98Å; L417-L461 WeakPolarHBondContact CA-O 3.41Å; L417-V462 HydrophobicContact CD2-CB 4.34Å; L417-V462 HydrophobicContact CD2-CG1 4.1Å; L417-V462 HydrophobicContact CD2-CG2 3.95Å
418	K	88.2	Confident	78.6	Confident	21 Å²	21	66.4 Å²	66.4	9%	0.091	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	95.6	178.3	-174.5	178.2	179.9	-177.5	0	108.6	F394 V397 E433 C460 L461 L463 D587	F394-K418 VanDerWaalsContact CB-CE 3.48Å; V397-K418 HydrophobicContact CG2-CB 4.44Å; V397-K418 HydrophobicContact CG2-CG 4.34Å; K418-E433 WeakPolarHBondContact CE-OE1 3.44Å; K418-E433 IonicContact NZ-OE1 3.95Å; K418-E433 PolarHBondContact NZ-OE1 3.47Å; K418-E433 IonicContact NZ-OE2 3.91Å; K418-C460 VanDerWaalsContact O-CA 3.28Å; K418-C460 WeakPolarHBondContact O-CA 3.28Å; K418-L461 HydrophobicContact CB-CB 4.3Å; K418-L461 HydrophobicContact CD-CD1 4.36Å; K418-L461 PolarHBondContact N-O 2.82Å; K418-L461 PolarHBondContact O-N 3.47Å; K418-L463 HydrophobicContact CB-CD1 4.39Å; K418-D587 IonicContact NZ-OD1 3.25Å; K418-D587 PolarHBondContact NZ-OD1 3.49Å; K418-D587 VanDerWaalsContact NZ-OD1 3.1Å
419	V	86.8	Confident	79	Confident	16 Å²	16	62.3 Å²	62.3	10%	0.097	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	127.9	-178.1	-176.3	0	0	0	0	110.3	F385 K396 L417 N421 Q459 C460	F385-V419 HydrophobicContact CE1-CG2 3.78Å; F385-V419 HydrophobicContact CZ-CG2 4.21Å; K396-V419 PolarHBondContact N-O 3.45Å; K396-V419 PolarHBondContact O-N 2.95Å; L417-V419 PolarHBondContact O-N 2.98Å; V419-N421 PolarHBondContact O-N 3.28Å; V419-Q459 WeakPolarHBondContact CA-O 3.24Å; V419-C460 HydrophobicContact CB-CB 4.47Å; V419-C460 HydrophobicContact CG2-CB 4.01Å
420	R	80.5	Confident	79.4	Confident	41 Å²	41	60.7 Å²	60.7	16%	0.155	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.2	125.1	178.2	-174.3	170.8	76.2	99.4	-9.9	110.8	C422 L425 F430 Q459	R420-C422 PolarHBondContact O-N 2.82Å; R420-C422 VanDerWaalsContact O-N 3.16Å; R420-L425 HydrophobicContact CG-CB 4.31Å; R420-L425 HydrophobicContact CG-CD2 4.34Å; R420-L425 PolarHBondContact NH1-O 2.78Å; R420-F430 HydrophobicContact CB-CD2 3.77Å; R420-F430 HydrophobicContact CB-CE1 4.5Å; R420-F430 HydrophobicContact CB-CE2 3.74Å; R420-F430 HydrophobicContact CB-CG 4.15Å; R420-F430 HydrophobicContact CB-CZ 4.12Å; R420-F430 VanDerWaalsContact CD-CB 3.46Å; R420-F430 HydrophobicContact CG-CB 4.21Å; R420-F430 HydrophobicContact CG-CD2 3.93Å; R420-F430 HydrophobicContact CG-CE2 4.42Å; R420-F430 HydrophobicContact CG-CG 4.04Å; R420-Q459 HydrophobicContact CB-CB 4.41Å; R420-Q459 VanDerWaalsContact CZ-OE1 3.26Å; R420-Q459 PolarHBondContact N-O 2.82Å
421	N	74.1	Confident	79.8	Confident	61 Å²	61	57.9 Å²	57.9	33%	0.326	29%	0.294	S	S	.	.			trans	-77.4	99.1	164.7	-176.1	2.7	0	0	0	109.9	V419 K423 S424 L425	V419-N421 PolarHBondContact O-N 3.28Å; N421-K423 PolarHBondContact O-N 3.04Å; N421-K423 WeakPolarHBondContact OD1-CB 3.47Å; N421-K423 PolarHBondContact OD1-N 3.2Å; N421-K423 VanDerWaalsContact OD1-N 3.16Å; N421-S424 WeakPolarHBondContact CB-OG 3.34Å; N421-S424 VanDerWaalsContact CG-OG 3.31Å; N421-S424 PolarHBondContact ND2-OG 2.91Å; N421-S424 PolarHBondContact O-N 3.23Å; N421-L425 PolarHBondContact O-N 3Å
422	C	68.8	Low	79.4	Confident	96 Å²	96	57.8 Å²	57.8	65%	0.649	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-17.8	-179.7	61.4	0	0	0	0	114.6	R420	R420-C422 PolarHBondContact O-N 2.82Å; R420-C422 VanDerWaalsContact O-N 3.16Å
423	K	64	Low	79.1	Confident	194 Å²	194	51.7 Å²	51.7	84%	0.843	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84	-23.2	175.8	-60.3	-171.8	178.4	-172.6	0	114.3	N421	N421-K423 PolarHBondContact O-N 3.04Å; N421-K423 WeakPolarHBondContact OD1-CB 3.47Å; N421-K423 PolarHBondContact OD1-N 3.2Å; N421-K423 VanDerWaalsContact OD1-N 3.16Å
424	S	59.5	Low	79	Confident	70 Å²	70	49.9 Å²	49.9	49%	0.49	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-126.4	-11.6	-170.4	72.9	0	0	0	0	115.2	N421	N421-S424 WeakPolarHBondContact CB-OG 3.34Å; N421-S424 VanDerWaalsContact CG-OG 3.31Å; N421-S424 PolarHBondContact ND2-OG 2.91Å; N421-S424 PolarHBondContact O-N 3.23Å
425	L	67	Low	78.8	Confident	18 Å²	18	47.4 Å²	47.4	9%	0.094	25%	0.25	C	C	.	.	S	Bend	trans	-132.5	119.2	179.7	-167.9	68.9	0	0	0	109.2	R420 N421 E429 F430	R420-L425 HydrophobicContact CG-CB 4.31Å; R420-L425 HydrophobicContact CG-CD2 4.34Å; R420-L425 PolarHBondContact NH1-O 2.78Å; N421-L425 PolarHBondContact O-N 3Å; L425-E429 HydrophobicContact CD1-CB 3.55Å; L425-E429 HydrophobicContact CD1-CG 4.43Å; L425-E429 HydrophobicContact CG-CB 4.09Å; L425-F430 HydrophobicContact CD2-CB 3.98Å; L425-F430 HydrophobicContact CD2-CD2 3.92Å; L425-F430 HydrophobicContact CD2-CG 4.46Å; L425-F430 HydrophobicContact CG-CB 4.37Å
426	T	73	Confident	78.3	Confident	75 Å²	75	48.6 Å²	48.6	46%	0.46	26%	0.256	S	S	.	.			trans	-66	156.9	176.5	64.3	0	0	0	0	110.8	A428 E429 F430	T426-A428 PolarHBondContact O-N 2.75Å; T426-E429 WeakPolarHBondContact CB-OE2 3.39Å; T426-E429 WeakPolarHBondContact CG2-OE2 3.07Å; T426-E429 PolarHBondContact N-OE2 2.88Å; T426-E429 PolarHBondContact O-N 3.13Å; T426-E429 WeakPolarHBondContact OG1-CB 3.17Å; T426-E429 VanDerWaalsContact OG1-CD 3.27Å; T426-E429 VanDerWaalsContact OG1-CG 3.24Å; T426-E429 WeakPolarHBondContact OG1-CG 3.49Å; T426-E429 PolarHBondContact OG1-N 3.25Å; T426-E429 VanDerWaalsContact OG1-N 3.17Å; T426-E429 PolarHBondContact OG1-OE2 3.4Å; T426-F430 PolarHBondContact O-N 2.81Å
427	E	77	Confident	77.9	Confident	77 Å²	77	48.3 Å²	48.3	36%	0.36	25%	0.253	S	S	.	.	H	α-helix	trans	-61.7	-33.8	174.9	-170.2	-179.9	130.2	0	0	111.4	F430 K431 F453	E427-F430 PolarHBondContact O-N 2.89Å; E427-K431 HydrophobicContact CG-CD 4.3Å; E427-K431 HydrophobicContact CG-CG 4.4Å; E427-K431 WeakPolarHBondContact O-CB 3.47Å; E427-K431 VanDerWaalsContact O-CG 3.28Å; E427-K431 WeakPolarHBondContact O-CG 3.25Å; E427-K431 PolarHBondContact O-N 3.3Å; E427-K431 WeakPolarHBondContact OE1-CE 3.27Å; E427-K431 IonicContact OE1-NZ 3.41Å; E427-K431 PolarHBondContact OE1-NZ 2.93Å; E427-F453 HydrophobicContact CG-CE1 4.39Å
428	A	74.3	Confident	77.9	Confident	53 Å²	53	50.8 Å²	50.8	44%	0.438	26%	0.264	S	S	.	.	H	α-helix	trans	-66	-39.9	176.8	0	0	0	0	0	113	T426 R432	T426-A428 PolarHBondContact O-N 2.75Å; A428-R432 WeakPolarHBondContact O-CB 3.5Å; A428-R432 PolarHBondContact O-N 3.41Å
429	E	71.8	Confident	77.8	Confident	65 Å²	65	54.3 Å²	54.3	30%	0.304	28%	0.28	S	S	.	.	H	α-helix	trans	-68	-41.3	174.3	-71.1	161.8	130.7	0	0	111.6	L425 T426 R432 E433	L425-E429 HydrophobicContact CD1-CB 3.55Å; L425-E429 HydrophobicContact CD1-CG 4.43Å; L425-E429 HydrophobicContact CG-CB 4.09Å; T426-E429 WeakPolarHBondContact CB-OE2 3.39Å; T426-E429 WeakPolarHBondContact CG2-OE2 3.07Å; T426-E429 PolarHBondContact N-OE2 2.88Å; T426-E429 PolarHBondContact O-N 3.13Å; T426-E429 WeakPolarHBondContact OG1-CB 3.17Å; T426-E429 VanDerWaalsContact OG1-CD 3.27Å; T426-E429 VanDerWaalsContact OG1-CG 3.24Å; T426-E429 WeakPolarHBondContact OG1-CG 3.49Å; T426-E429 PolarHBondContact OG1-N 3.25Å; T426-E429 VanDerWaalsContact OG1-N 3.17Å; T426-E429 PolarHBondContact OG1-OE2 3.4Å; E429-R432 WeakPolarHBondContact O-CB 3.46Å; E429-R432 PolarHBondContact O-N 2.86Å; E429-E433 PolarHBondContact O-N 2.94Å
430	F	80	Confident	77.9	Confident	1 Å²	1	54 Å²	54	0%	0.004	28%	0.277	C	S	.	.	H	α-helix	trans	-65	-41	176.5	-176.7	-104.4	0	0	0	112.7	R420 L425 T426 E427 E433 A434 V451 F453 Q459 L461	R420-F430 HydrophobicContact CB-CD2 3.77Å; R420-F430 HydrophobicContact CB-CE1 4.5Å; R420-F430 HydrophobicContact CB-CE2 3.74Å; R420-F430 HydrophobicContact CB-CG 4.15Å; R420-F430 HydrophobicContact CB-CZ 4.12Å; R420-F430 VanDerWaalsContact CD-CB 3.46Å; R420-F430 HydrophobicContact CG-CB 4.21Å; R420-F430 HydrophobicContact CG-CD2 3.93Å; R420-F430 HydrophobicContact CG-CE2 4.42Å; R420-F430 HydrophobicContact CG-CG 4.04Å; L425-F430 HydrophobicContact CD2-CB 3.98Å; L425-F430 HydrophobicContact CD2-CD2 3.92Å; L425-F430 HydrophobicContact CD2-CG 4.46Å; L425-F430 HydrophobicContact CG-CB 4.37Å; T426-F430 PolarHBondContact O-N 2.81Å; E427-F430 PolarHBondContact O-N 2.89Å; F430-E433 PolarHBondContact O-N 2.87Å; F430-A434 PolarHBondContact O-N 2.97Å; F430-V451 HydrophobicContact CE1-CG2 3.67Å; F430-V451 HydrophobicContact CZ-CG2 4.17Å; F430-F453 HydrophobicContact CD1-CE1 4.04Å; F430-F453 HydrophobicContact CD1-CZ 4.06Å; F430-F453 HydrophobicContact CE1-CE1 4.03Å; F430-F453 HydrophobicContact CE1-CZ 4Å; F430-Q459 HydrophobicContact CE1-CB 4.33Å; F430-L461 HydrophobicContact CD2-CD2 4.28Å; F430-L461 HydrophobicContact CD2-CG 4.42Å; F430-L461 HydrophobicContact CE1-CD2 3.97Å; F430-L461 HydrophobicContact CE2-CD1 4.33Å; F430-L461 HydrophobicContact CE2-CD2 3.64Å; F430-L461 HydrophobicContact CE2-CG 3.6Å; F430-L461 HydrophobicContact CZ-CD2 3.46Å; F430-L461 VanDerWaalsContact CZ-CD2 3.46Å; F430-L461 HydrophobicContact CZ-CG 3.79Å
431	K	83.6	Confident	78.3	Confident	61 Å²	61	56.7 Å²	56.7	27%	0.265	29%	0.291	S	S	.	.	H	α-helix	trans	-62.8	-41.7	172.1	-75.5	-175.8	176	168.6	0	111.6	F372 E427 A434 T435 F453	F372-K431 HydrophobicContact CD1-CD 4.14Å; F372-K431 HydrophobicContact CD1-CG 4.47Å; F372-K431 HydrophobicContact CD2-CB 3.67Å; F372-K431 HydrophobicContact CD2-CD 4.34Å; F372-K431 HydrophobicContact CD2-CG 3.97Å; F372-K431 HydrophobicContact CE1-CD 4.03Å; F372-K431 HydrophobicContact CE1-CG 4.08Å; F372-K431 HydrophobicContact CE2-CB 3.56Å; F372-K431 HydrophobicContact CE2-CD 4.26Å; F372-K431 HydrophobicContact CE2-CG 3.56Å; F372-K431 HydrophobicContact CG-CB 4.39Å; F372-K431 HydrophobicContact CG-CD 4.31Å; F372-K431 HydrophobicContact CG-CG 4.42Å; F372-K431 HydrophobicContact CZ-CB 4.17Å; F372-K431 HydrophobicContact CZ-CD 4.11Å; F372-K431 HydrophobicContact CZ-CG 3.62Å; E427-K431 HydrophobicContact CG-CD 4.3Å; E427-K431 HydrophobicContact CG-CG 4.4Å; E427-K431 WeakPolarHBondContact O-CB 3.47Å; E427-K431 VanDerWaalsContact O-CG 3.28Å; E427-K431 WeakPolarHBondContact O-CG 3.25Å; E427-K431 PolarHBondContact O-N 3.3Å; E427-K431 WeakPolarHBondContact OE1-CE 3.27Å; E427-K431 IonicContact OE1-NZ 3.41Å; E427-K431 PolarHBondContact OE1-NZ 2.93Å; K431-A434 PolarHBondContact O-N 2.97Å; K431-T435 PolarHBondContact O-N 3.02Å; K431-T435 PolarHBondContact O-OG1 3.08Å; K431-F453 HydrophobicContact CG-CZ 3.99Å
432	R	75.9	Confident	79.3	Confident	102 Å²	102	56.7 Å²	56.7	39%	0.385	29%	0.289	S	S	.	.	H	α-helix	trans	-61.6	-45.1	174.3	-173.2	-171.6	-63.5	147.5	-0	111.8	A428 E429 A434 T435 L436	A428-R432 WeakPolarHBondContact O-CB 3.5Å; A428-R432 PolarHBondContact O-N 3.41Å; E429-R432 WeakPolarHBondContact O-CB 3.46Å; E429-R432 PolarHBondContact O-N 2.86Å; R432-A434 VanDerWaalsContact C-N 3.33Å; R432-A434 PolarHBondContact O-N 3.42Å; R432-T435 PolarHBondContact O-N 3.27Å; R432-L436 HydrophobicContact CG-CD1 4.24Å; R432-L436 HydrophobicContact CG-CG 4.47Å; R432-L436 WeakPolarHBondContact O-CG 3.33Å; R432-L436 PolarHBondContact O-N 2.77Å
433	E	78.7	Confident	80.5	Confident	9 Å²	9	55.6 Å²	55.6	4%	0.042	28%	0.28	C	S	.	.	H	α-helix	trans	-57.1	-47.3	175.9	-170.5	-177.3	164.2	0	0	110.7	K418 E429 F430 T435 L436 M437 L461	K418-E433 WeakPolarHBondContact CE-OE1 3.44Å; K418-E433 IonicContact NZ-OE1 3.95Å; K418-E433 PolarHBondContact NZ-OE1 3.47Å; K418-E433 IonicContact NZ-OE2 3.91Å; E429-E433 PolarHBondContact O-N 2.94Å; F430-E433 PolarHBondContact O-N 2.87Å; E433-T435 PolarHBondContact O-N 3.25Å; E433-L436 PolarHBondContact O-N 2.97Å; E433-M437 WeakPolarHBondContact O-CB 3.44Å; E433-M437 WeakPolarHBondContact O-CG 3.45Å; E433-M437 PolarHBondContact O-N 2.93Å; E433-L461 HydrophobicContact CG-CD1 4.03Å
434	A	86.2	Confident	82	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-61.8	-41	175.9	0	0	0	0	0	113.3	F372 V375 F430 K431 R432 M437 H438 F448 L461	F372-A434 HydrophobicContact CE2-CB 4.13Å; V375-A434 HydrophobicContact CG1-CB 4.13Å; F430-A434 PolarHBondContact O-N 2.97Å; K431-A434 PolarHBondContact O-N 2.97Å; R432-A434 VanDerWaalsContact C-N 3.33Å; R432-A434 PolarHBondContact O-N 3.42Å; A434-M437 PolarHBondContact O-N 2.88Å; A434-H438 VanDerWaalsContact O-CB 3.3Å; A434-H438 WeakPolarHBondContact O-CB 3.32Å; A434-H438 PolarHBondContact O-N 3.43Å; A434-F448 HydrophobicContact CB-CE2 4.3Å; A434-F448 HydrophobicContact CB-CZ 3.97Å; A434-L461 HydrophobicContact CB-CD2 3.74Å
435	T	86.1	Confident	83.7	Confident	25 Å²	25	43.4 Å²	43.4	15%	0.153	22%	0.218	C	C	.	.	H	α-helix	trans	-63.3	-43.4	174.7	-60.7	0	0	0	0	112	K431 R432 E433 H438 K439	K431-T435 PolarHBondContact O-N 3.02Å; K431-T435 PolarHBondContact O-OG1 3.08Å; R432-T435 PolarHBondContact O-N 3.27Å; E433-T435 PolarHBondContact O-N 3.25Å; T435-H438 PolarHBondContact O-N 3.25Å; T435-K439 WeakPolarHBondContact O-CB 3.19Å; T435-K439 PolarHBondContact O-N 2.76Å
436	L	83.2	Confident	85	Confident	25 Å²	25	42.8 Å²	42.8	13%	0.131	22%	0.215	C	C	.	.	H	α-helix	trans	-64.6	-45.7	176.8	-65.9	173.8	0	0	0	111.1	R432 E433 H438 K439 Y440 F561 A591	R432-L436 HydrophobicContact CG-CD1 4.24Å; R432-L436 HydrophobicContact CG-CG 4.47Å; R432-L436 WeakPolarHBondContact O-CG 3.33Å; R432-L436 PolarHBondContact O-N 2.77Å; E433-L436 PolarHBondContact O-N 2.97Å; L436-H438 VanDerWaalsContact C-N 3.3Å; L436-H438 PolarHBondContact O-N 3.24Å; L436-K439 PolarHBondContact O-N 3Å; L436-Y440 HydrophobicContact CB-CD2 4.48Å; L436-Y440 HydrophobicContact CD2-CE2 3.97Å; L436-Y440 WeakPolarHBondContact O-CD2 3.38Å; L436-Y440 PolarHBondContact O-N 3.18Å; L436-F561 HydrophobicContact CD2-CE2 4.16Å; L436-A591 HydrophobicContact CD1-CB 4.43Å
437	M	86.5	Confident	85.9	Confident	5 Å²	5	44.9 Å²	44.9	3%	0.025	21%	0.214	C	C	.	.	H	α-helix	trans	-65.2	-30.7	176.7	-70.2	-163.6	82.7	0	0	113.4	E433 A434 F448 L461 L463 F588	E433-M437 WeakPolarHBondContact O-CB 3.44Å; E433-M437 WeakPolarHBondContact O-CG 3.45Å; E433-M437 PolarHBondContact O-N 2.93Å; A434-M437 PolarHBondContact O-N 2.88Å; M437-F448 HydrophobicContact CB-CB 3.85Å; M437-F448 HydrophobicContact CB-CD1 4.37Å; M437-F448 HydrophobicContact CB-CD2 3.89Å; M437-F448 HydrophobicContact CB-CG 3.79Å; M437-F448 HydrophobicContact CE-CB 4.41Å; M437-F448 HydrophobicContact SD-CD2 4.36Å; M437-L461 HydrophobicContact SD-CD1 4.02Å; M437-L463 HydrophobicContact CE-CD1 4.3Å; M437-L463 HydrophobicContact CE-CD2 3.43Å; M437-L463 VanDerWaalsContact CE-CD2 3.43Å; M437-L463 HydrophobicContact SD-CD2 3.94Å; M437-F588 HydrophobicContact CG-CD2 3.77Å; M437-F588 HydrophobicContact CG-CE2 4.12Å
438	H	90	Very high	86.7	Confident	51 Å²	51	41.5 Å²	41.5	24%	0.236	20%	0.199	C	C	.	.	H	α-helix	trans	-70.9	-40.2	173.4	-177.5	58.1	0	0	0	112.2	Q374 V375 P376 A434 T435 L436 Q441 F448	Q374-H438 PolarHBondContact O-NE2 2.81Å; V375-H438 HydrophobicContact CG2-CB 4.26Å; P376-H438 WeakPolarHBondContact CD-ND1 3.37Å; A434-H438 VanDerWaalsContact O-CB 3.3Å; A434-H438 WeakPolarHBondContact O-CB 3.32Å; A434-H438 PolarHBondContact O-N 3.43Å; T435-H438 PolarHBondContact O-N 3.25Å; L436-H438 VanDerWaalsContact C-N 3.3Å; L436-H438 PolarHBondContact O-N 3.24Å; H438-Q441 PolarHBondContact O-NE2 3.18Å; H438-F448 HydrophobicContact CB-CD1 4.01Å; H438-F448 HydrophobicContact CB-CE1 3.9Å
439	K	86.8	Confident	87.6	Confident	96 Å²	96	40.2 Å²	40.2	42%	0.417	18%	0.183	S	C	.	.	H	α-helix	trans	-68.5	-41.3	-179.7	-175.6	176.5	-178.9	179.4	0	113	T435 L436	T435-K439 WeakPolarHBondContact O-CB 3.19Å; T435-K439 PolarHBondContact O-N 2.76Å; L436-K439 PolarHBondContact O-N 3Å
440	Y	88	Confident	88.6	Confident	9 Å²	9	37.1 Å²	37.1	4%	0.035	17%	0.169	C	C	.	.			trans	-102.9	94.3	-173.2	-59.7	-60.1	0	0	0	111.6	L436 Y555 L556 Q559 F561	L436-Y440 HydrophobicContact CB-CD2 4.48Å; L436-Y440 HydrophobicContact CD2-CE2 3.97Å; L436-Y440 WeakPolarHBondContact O-CD2 3.38Å; L436-Y440 PolarHBondContact O-N 3.18Å; Y440-Y555 HydrophobicContact CD1-CE1 4.24Å; Y440-L556 HydrophobicContact CD1-CD2 4.28Å; Y440-L556 HydrophobicContact CG-CD2 4.19Å; Y440-Q559 HydrophobicContact CD1-CB 4.03Å; Y440-Q559 HydrophobicContact CD1-CG 4.24Å; Y440-Q559 HydrophobicContact CE1-CB 3.66Å; Y440-Q559 HydrophobicContact CE1-CG 4.3Å; Y440-F561 HydrophobicContact CD2-CD2 4.18Å; Y440-F561 HydrophobicContact CD2-CE2 4.25Å; Y440-F561 HydrophobicContact CD2-CG 4.45Å; Y440-F561 HydrophobicContact CE1-CB 4.04Å; Y440-F561 HydrophobicContact CE1-CD2 4.44Å; Y440-F561 HydrophobicContact CE1-CG 4.39Å; Y440-F561 HydrophobicContact CE2-CB 4.39Å; Y440-F561 AromaticContact CE2-CD2 3.33Å; Y440-F561 HydrophobicContact CE2-CD2 3.33Å; Y440-F561 AromaticContact CE2-CE2 3.6Å; Y440-F561 HydrophobicContact CE2-CE2 3.6Å; Y440-F561 AromaticContact CE2-CG 3.9Å; Y440-F561 HydrophobicContact CE2-CG 3.9Å; Y440-F561 HydrophobicContact CE2-CZ 4.34Å; Y440-F561 AromaticContact CZ-CD2 3.49Å; Y440-F561 VanDerWaalsContact CZ-CD2 3.49Å; Y440-F561 AromaticContact CZ-CG 3.86Å; Y440-F561 WeakPolarHBondContact OH-CD2 3.33Å
441	Q	90.5	Very high	89.2	Confident	97 Å²	97	37.1 Å²	37.1	45%	0.453	17%	0.169	S	C	.	.			trans	-120.1	121.1	-180	-65.1	-177.5	49.8	0	0	110.7	H438 Y555	H438-Q441 PolarHBondContact O-NE2 3.18Å; Q441-Y555 PolarHBondContact N-OH 3.34Å; Q441-Y555 VanDerWaalsContact N-OH 3.16Å; Q441-Y555 PolarHBondContact O-OH 3.5Å
442	H	94.4	Very high	89.5	Confident	61 Å²	61	34.5 Å²	34.5	28%	0.282	16%	0.158	S	C	.	.			trans	-152.1	158.7	-177.9	-176.3	-107.9	0	0	0	110.4	N444 I445 Y555	H442-N444 PolarHBondContact ND1-N 3.47Å; H442-N444 PolarHBondContact O-N 3.39Å; H442-I445 HydrophobicContact CB-CB 4.17Å; H442-I445 HydrophobicContact CB-CD1 3.91Å; H442-I445 HydrophobicContact CB-CG1 4.03Å; H442-I445 PolarHBondContact O-N 3.45Å; H442-Y555 HydrophobicContact CB-CD1 3.66Å; H442-Y555 HydrophobicContact CB-CD2 4.08Å; H442-Y555 HydrophobicContact CB-CE1 3.95Å; H442-Y555 HydrophobicContact CB-CE2 4.35Å; H442-Y555 HydrophobicContact CB-CG 3.72Å; H442-Y555 AromaticContact CD2-CD2 3.85Å; H442-Y555 AromaticContact CD2-CG 3.9Å; H442-Y555 AromaticContact CG-CG 3.73Å
443	T	94.6	Very high	90	Very high	74 Å²	74	31.3 Å²	31.3	45%	0.454	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-33.8	-177.5	-165.1	0	0	0	0	112.8	K584	T443-K584 WeakPolarHBondContact O-CD 3.33Å; T443-K584 WeakPolarHBondContact O-CE 3.41Å; T443-K584 PolarHBondContact O-NZ 2.9Å
444	N	95.9	Very high	90.1	Very high	6 Å²	6	35.8 Å²	35.8	3%	0.032	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.9	23.6	174.4	-57.6	102.1	0	0	0	114.2	H442 D548 H551 V583 K584 L585	H442-N444 PolarHBondContact ND1-N 3.47Å; H442-N444 PolarHBondContact O-N 3.39Å; N444-D548 WeakPolarHBondContact CB-O 3.21Å; N444-D548 WeakPolarHBondContact ND2-CA 3.48Å; N444-D548 WeakPolarHBondContact ND2-CB 3.18Å; N444-D548 PolarHBondContact ND2-O 3.24Å; N444-D548 PolarHBondContact ND2-OD1 3.04Å; N444-H551 WeakPolarHBondContact OD1-CB 3.3Å; N444-V583 PolarHBondContact ND2-O 2.88Å; N444-K584 CarbonylContact O-C 3.59Å; N444-K584 VanDerWaalsContact O-CA 3.32Å; N444-K584 WeakPolarHBondContact O-CA 3.36Å; N444-L585 PolarHBondContact O-N 3.35Å
445	I	94.5	Very high	89.5	Confident	2 Å²	2	37.6 Å²	37.6	1%	0.01	18%	0.184	C	C	.	.	B	Isolated β-bridge	trans	-122.4	139.4	167.9	-68.6	175.8	0	0	0	107.8	H442 R447 Y555 L556 L585 F588	H442-I445 HydrophobicContact CB-CB 4.17Å; H442-I445 HydrophobicContact CB-CD1 3.91Å; H442-I445 HydrophobicContact CB-CG1 4.03Å; H442-I445 PolarHBondContact O-N 3.45Å; I445-R447 PolarHBondContact O-N 3.25Å; I445-R447 VanDerWaalsContact O-N 3.08Å; I445-Y555 HydrophobicContact CD1-CD1 3.52Å; I445-Y555 HydrophobicContact CD1-CE1 3.79Å; I445-L556 HydrophobicContact CD1-CD1 4.48Å; I445-L556 HydrophobicContact CD1-CD2 3.71Å; I445-L556 HydrophobicContact CD1-CG 4.02Å; I445-L585 HydrophobicContact CG1-CB 4.38Å; I445-F588 HydrophobicContact CD1-CZ 4.33Å; I445-F588 HydrophobicContact CG2-CE2 4.12Å; I445-F588 HydrophobicContact CG2-CZ 3.76Å
446	V	93.5	Very high	88.6	Confident	4 Å²	4	41.6 Å²	41.6	2%	0.024	21%	0.21	C	C	.	.			trans	-61.4	114.8	-179.2	172.1	0	0	0	0	110.2	F448 L463 E464 M466 L572 K584 L585 C586	V446-F448 PolarHBondContact O-N 2.94Å; V446-L463 HydrophobicContact CG1-CB 4.21Å; V446-E464 WeakPolarHBondContact CA-OE1 3.4Å; V446-E464 HydrophobicContact CG1-CG 4.02Å; V446-M466 HydrophobicContact CG2-CG 4.19Å; V446-L572 HydrophobicContact CG2-CB 4.28Å; V446-L572 HydrophobicContact CG2-CD1 3.98Å; V446-L572 HydrophobicContact CG2-CG 4.26Å; V446-K584 HydrophobicContact CG2-CB 3.83Å; V446-L585 WeakPolarHBondContact CG2-O 3.38Å; V446-L585 PolarHBondContact N-O 2.74Å; V446-C586 HydrophobicContact CB-CB 4.19Å; V446-C586 HydrophobicContact CG2-CB 3.77Å
447	R	93.4	Very high	87.9	Confident	119 Å²	119	43.9 Å²	43.9	45%	0.449	24%	0.24	S	C	.	.			trans	-59.4	125.1	-177.8	-177.9	180	180	164.2	1.4	110.8	I445 L463 E464	I445-R447 PolarHBondContact O-N 3.25Å; I445-R447 VanDerWaalsContact O-N 3.08Å; R447-L463 WeakPolarHBondContact O-CA 3.41Å; R447-E464 HydrophobicContact CB-CB 4.2Å; R447-E464 HydrophobicContact CB-CG 4Å; R447-E464 WeakPolarHBondContact CB-OE1 3.45Å; R447-E464 PolarHBondContact N-OE1 2.9Å; R447-E464 PolarHBondContact O-N 3.02Å
448	F	93.2	Very high	87.4	Confident	7 Å²	7	45.6 Å²	45.6	3%	0.031	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	125.8	171.9	174.6	-100.1	0	0	0	109.7	V375 A434 M437 H438 V446 G450 V451 L461 L463	V375-F448 HydrophobicContact CG1-CE1 3.79Å; V375-F448 HydrophobicContact CG1-CZ 3.79Å; A434-F448 HydrophobicContact CB-CE2 4.3Å; A434-F448 HydrophobicContact CB-CZ 3.97Å; M437-F448 HydrophobicContact CB-CB 3.85Å; M437-F448 HydrophobicContact CB-CD1 4.37Å; M437-F448 HydrophobicContact CB-CD2 3.89Å; M437-F448 HydrophobicContact CB-CG 3.79Å; M437-F448 HydrophobicContact CE-CB 4.41Å; M437-F448 HydrophobicContact SD-CD2 4.36Å; H438-F448 HydrophobicContact CB-CD1 4.01Å; H438-F448 HydrophobicContact CB-CE1 3.9Å; V446-F448 PolarHBondContact O-N 2.94Å; F448-G450 WeakPolarHBondContact CE2-O 3.37Å; F448-G450 VanDerWaalsContact CZ-CA 3.42Å; F448-G450 WeakPolarHBondContact CZ-O 3.39Å; F448-V451 HydrophobicContact CZ-CB 4.28Å; F448-L461 HydrophobicContact CE2-CB 4.14Å; F448-L461 HydrophobicContact CE2-CD2 4.04Å; F448-L463 HydrophobicContact CB-CD2 4.16Å; F448-L463 HydrophobicContact CD2-CD2 3.74Å; F448-L463 HydrophobicContact CG-CD2 4.44Å
449	F	92.8	Very high	87.2	Confident	26 Å²	26	44.2 Å²	44.2	11%	0.114	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	-33.5	176.1	-68.5	-82.4	0	0	0	112.4	I378 F402 E413 V415 V462 E464	I378-F449 HydrophobicContact CD1-CB 3.97Å; F402-F449 HydrophobicContact CD1-CB 4.07Å; F402-F449 HydrophobicContact CD1-CD1 4.05Å; F402-F449 HydrophobicContact CD1-CD2 4.48Å; F402-F449 AromaticContact CD1-CG 3.96Å; F402-F449 HydrophobicContact CD1-CG 3.96Å; F402-F449 HydrophobicContact CE1-CB 3.75Å; F402-F449 AromaticContact CE1-CD1 3.87Å; F402-F449 HydrophobicContact CE1-CD1 3.87Å; F402-F449 AromaticContact CE1-CG 3.95Å; F402-F449 HydrophobicContact CE1-CG 3.95Å; E413-F449 WeakPolarHBondContact OE2-CE1 3.38Å; E413-F449 WeakPolarHBondContact OE2-CZ 3.43Å; V415-F449 HydrophobicContact CG1-CD2 4.07Å; V415-F449 HydrophobicContact CG1-CE2 3.88Å; F449-V462 HydrophobicContact CB-CB 4.22Å; F449-V462 HydrophobicContact CB-CG1 4.04Å; F449-V462 HydrophobicContact CD2-CG1 4.19Å; F449-V462 HydrophobicContact CG-CG1 4.46Å; F449-V462 PolarHBondContact N-O 3.43Å; F449-E464 HydrophobicContact CE2-CB 4.07Å
450	G	92.7	Very high	87.4	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	155.5	-171.3	-171.7	0	0	0	0	0	112.1	P376 F448 V462	P376-G450 CarbonylContact O-C 3.45Å; P376-G450 WeakPolarHBondContact O-CA 3.45Å; F448-G450 WeakPolarHBondContact CE2-O 3.37Å; F448-G450 VanDerWaalsContact CZ-CA 3.42Å; F448-G450 WeakPolarHBondContact CZ-O 3.39Å; G450-V462 PolarHBondContact O-N 3.13Å
451	V	92.3	Very high	87.5	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	145.3	-176.2	59.4	0	0	0	0	109.7	F372 V375 P376 Q377 I378 F430 F448 F453 C460 L461	F372-V451 HydrophobicContact CZ-CG1 4.13Å; V375-V451 HydrophobicContact CG1-CG1 3.77Å; P376-V451 PolarHBondContact O-N 3.23Å; Q377-V451 CarbonylContact C-O 3.6Å; Q377-V451 WeakPolarHBondContact CA-O 3.29Å; I378-V451 PolarHBondContact N-O 3.45Å; F430-V451 HydrophobicContact CE1-CG2 3.67Å; F430-V451 HydrophobicContact CZ-CG2 4.17Å; F448-V451 HydrophobicContact CZ-CB 4.28Å; V451-F453 HydrophobicContact CB-CE2 4.07Å; V451-F453 HydrophobicContact CG1-CD2 4.2Å; V451-F453 HydrophobicContact CG1-CE2 3.57Å; V451-F453 HydrophobicContact CG1-CZ 4.5Å; V451-F453 HydrophobicContact CG2-CD2 3.93Å; V451-F453 HydrophobicContact CG2-CE2 3.3Å; V451-F453 HydrophobicContact CG2-CZ 3.66Å; V451-C460 WeakPolarHBondContact CA-O 3.46Å; V451-C460 WeakPolarHBondContact CG2-O 3.39Å; V451-L461 HydrophobicContact CB-CD2 4.31Å; V451-L461 HydrophobicContact CG2-CD2 3.97Å
452	S	91.3	Very high	87.6	Confident	6 Å²	6	34.7 Å²	34.7	4%	0.042	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	130.6	175	-162.2	0	0	0	0	110.6	I378 Q459 C460	I378-S452 WeakPolarHBondContact O-CA 3.33Å; I378-S452 VanDerWaalsContact O-CB 3.22Å; I378-S452 WeakPolarHBondContact O-CB 3.4Å; I378-S452 PolarHBondContact O-OG 3.41Å; S452-Q459 CarbonylContact O-C 3.52Å; S452-Q459 VanDerWaalsContact O-CA 3.28Å; S452-Q459 WeakPolarHBondContact O-CA 3.48Å; S452-C460 PolarHBondContact N-O 3.11Å; S452-C460 PolarHBondContact O-N 3.24Å
453	F	86.3	Confident	87.6	Confident	36 Å²	36	32.8 Å²	32.8	16%	0.158	19%	0.191	C	C	.	.			trans	-118.1	-12.2	177.1	-70.8	-87.1	0	0	0	114.3	F372 Q377 E427 F430 K431 V451 S455 Q459	F372-F453 HydrophobicContact CE1-CE2 4.03Å; F372-F453 HydrophobicContact CE1-CZ 4.35Å; F372-F453 AromaticContact CZ-CE2 3.63Å; F372-F453 HydrophobicContact CZ-CE2 3.63Å; F372-F453 AromaticContact CZ-CZ 3.81Å; F372-F453 HydrophobicContact CZ-CZ 3.81Å; Q377-F453 VanDerWaalsContact OE1-CD2 3.25Å; E427-F453 HydrophobicContact CG-CE1 4.39Å; F430-F453 HydrophobicContact CD1-CE1 4.04Å; F430-F453 HydrophobicContact CD1-CZ 4.06Å; F430-F453 HydrophobicContact CE1-CE1 4.03Å; F430-F453 HydrophobicContact CE1-CZ 4Å; K431-F453 HydrophobicContact CG-CZ 3.99Å; V451-F453 HydrophobicContact CB-CE2 4.07Å; V451-F453 HydrophobicContact CG1-CD2 4.2Å; V451-F453 HydrophobicContact CG1-CE2 3.57Å; V451-F453 HydrophobicContact CG1-CZ 4.5Å; V451-F453 HydrophobicContact CG2-CD2 3.93Å; V451-F453 HydrophobicContact CG2-CE2 3.3Å; V451-F453 HydrophobicContact CG2-CZ 3.66Å; F453-S455 CarbonylContact O-C 3.59Å; F453-S455 PolarHBondContact O-N 3.41Å; F453-Q459 HydrophobicContact CD1-CB 4.25Å; F453-Q459 HydrophobicContact CD1-CG 3.88Å
454	D	80.3	Confident	87.5	Confident	103 Å²	103	31 Å²	31	55%	0.551	18%	0.177	S	C	*	.	S	Bend	trans	-52.8	-29.8	-171.6	-55.3	8.8	0	0	0	113.8	P379 A380 P456	P379-D454 WeakPolarHBondContact CA-OD2 3Å; A380-D454 HydrophobicContact CB-CB 3.78Å; A380-D454 PolarHBondContact N-OD2 3.43Å; D454-P456 WeakPolarHBondContact O-CD 3.01Å
455	S	73.2	Confident	87.3	Confident	37 Å²	37	31.9 Å²	31.9	26%	0.259	18%	0.182	S	C	.	.	S	Bend	trans	-102.5	103.8	173.3	-69.7	0	0	0	0	110.1	F453 G457 Q458 Q459	F453-S455 CarbonylContact O-C 3.59Å; F453-S455 PolarHBondContact O-N 3.41Å; S455-G457 PolarHBondContact O-N 2.87Å; S455-Q458 CarbonylContact O-C 3.54Å; S455-Q458 PolarHBondContact O-N 3.06Å; S455-Q459 PolarHBondContact O-N 3.17Å
456	P	67.3	Low	87.2	Confident	109 Å²	109	32.3 Å²	32.3	71%	0.708	18%	0.184	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.9	-29.7	-175.3	-28.2	35.6	0	0	0	114.9	D454	D454-P456 WeakPolarHBondContact O-CD 3.01Å
457	G	69	Low	87	Confident	74 Å²	74	34.6 Å²	34.6	76%	0.763	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.4	-4.2	176.4	0	0	0	0	0	115.7	S455	S455-G457 PolarHBondContact O-N 2.87Å
458	Q	74.9	Confident	86.9	Confident	41 Å²	41	31.2 Å²	31.2	19%	0.192	19%	0.185	C	C	.	.			trans	-132.2	21.1	-175	-67	174.3	-36	0	0	112.8	Y165 S455 C460	Y165-Q458 PolarHBondContact O-NE2 3.36Å; Y165-Q458 VanDerWaalsContact O-NE2 3.13Å; S455-Q458 CarbonylContact O-C 3.54Å; S455-Q458 PolarHBondContact O-N 3.06Å; Q458-C460 WeakPolarHBondContact O-CB 3.41Å; Q458-C460 PolarHBondContact O-N 3.09Å; Q458-C460 VanDerWaalsContact O-N 3.14Å
459	Q	86.5	Confident	86.6	Confident	22 Å²	22	32.1 Å²	32.1	10%	0.103	20%	0.197	C	C	.	.			trans	-48.7	119.6	177.1	-61.4	177.2	-24	0	0	110.4	V419 R420 F430 S452 F453 S455	V419-Q459 WeakPolarHBondContact CA-O 3.24Å; R420-Q459 HydrophobicContact CB-CB 4.41Å; R420-Q459 VanDerWaalsContact CZ-OE1 3.26Å; R420-Q459 PolarHBondContact N-O 2.82Å; F430-Q459 HydrophobicContact CE1-CB 4.33Å; S452-Q459 CarbonylContact O-C 3.52Å; S452-Q459 VanDerWaalsContact O-CA 3.28Å; S452-Q459 WeakPolarHBondContact O-CA 3.48Å; F453-Q459 HydrophobicContact CD1-CB 4.25Å; F453-Q459 HydrophobicContact CD1-CG 3.88Å; S455-Q459 PolarHBondContact O-N 3.17Å
460	C	90.1	Very high	86.5	Confident	2 Å²	2	32.9 Å²	32.9	1%	0.014	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142	146.2	-167.6	70.4	0	0	0	0	114.3	K418 V419 V451 S452 Q458	K418-C460 VanDerWaalsContact O-CA 3.28Å; K418-C460 WeakPolarHBondContact O-CA 3.28Å; V419-C460 HydrophobicContact CB-CB 4.47Å; V419-C460 HydrophobicContact CG2-CB 4.01Å; V451-C460 WeakPolarHBondContact CA-O 3.46Å; V451-C460 WeakPolarHBondContact CG2-O 3.39Å; S452-C460 PolarHBondContact N-O 3.11Å; S452-C460 PolarHBondContact O-N 3.24Å; Q458-C460 WeakPolarHBondContact O-CB 3.41Å; Q458-C460 PolarHBondContact O-N 3.09Å; Q458-C460 VanDerWaalsContact O-N 3.14Å
461	L	90.9	Very high	86.5	Confident	0 Å²	0	32.9 Å²	32.9	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	132.7	166.7	-49.2	-177.7	0	0	0	108.5	L417 K418 F430 E433 A434 M437 F448 V451 L463	L417-L461 WeakPolarHBondContact CA-O 3.41Å; K418-L461 HydrophobicContact CB-CB 4.3Å; K418-L461 HydrophobicContact CD-CD1 4.36Å; K418-L461 PolarHBondContact N-O 2.82Å; K418-L461 PolarHBondContact O-N 3.47Å; F430-L461 HydrophobicContact CD2-CD2 4.28Å; F430-L461 HydrophobicContact CD2-CG 4.42Å; F430-L461 HydrophobicContact CE1-CD2 3.97Å; F430-L461 HydrophobicContact CE2-CD1 4.33Å; F430-L461 HydrophobicContact CE2-CD2 3.64Å; F430-L461 HydrophobicContact CE2-CG 3.6Å; F430-L461 HydrophobicContact CZ-CD2 3.46Å; F430-L461 VanDerWaalsContact CZ-CD2 3.46Å; F430-L461 HydrophobicContact CZ-CG 3.79Å; E433-L461 HydrophobicContact CG-CD1 4.03Å; A434-L461 HydrophobicContact CB-CD2 3.74Å; M437-L461 HydrophobicContact SD-CD1 4.02Å; F448-L461 HydrophobicContact CE2-CB 4.14Å; F448-L461 HydrophobicContact CE2-CD2 4.04Å; V451-L461 HydrophobicContact CB-CD2 4.31Å; V451-L461 HydrophobicContact CG2-CD2 3.97Å; L461-L463 HydrophobicContact CB-CD2 4.37Å; L461-L463 HydrophobicContact CB-CG 4.37Å
462	V	93.4	Very high	86.4	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	111.2	177.5	-172.1	0	0	0	0	108.5	I378 I383 F402 V415 L417 F449 G450	I378-V462 HydrophobicContact CD1-CB 3.77Å; I378-V462 HydrophobicContact CD1-CG1 4.11Å; I378-V462 HydrophobicContact CD1-CG2 3.72Å; I383-V462 HydrophobicContact CD1-CG2 3.56Å; I383-V462 HydrophobicContact CG1-CG2 4.36Å; F402-V462 HydrophobicContact CB-CG1 4.17Å; F402-V462 HydrophobicContact CD1-CG1 4.02Å; F402-V462 HydrophobicContact CG-CG1 4.11Å; V415-V462 HydrophobicContact CB-CG1 4.02Å; V415-V462 HydrophobicContact CG1-CG1 3.86Å; V415-V462 HydrophobicContact CG2-CG1 4.18Å; L417-V462 HydrophobicContact CD2-CB 4.34Å; L417-V462 HydrophobicContact CD2-CG1 4.1Å; L417-V462 HydrophobicContact CD2-CG2 3.95Å; F449-V462 HydrophobicContact CB-CB 4.22Å; F449-V462 HydrophobicContact CB-CG1 4.04Å; F449-V462 HydrophobicContact CD2-CG1 4.19Å; F449-V462 HydrophobicContact CG-CG1 4.46Å; F449-V462 PolarHBondContact N-O 3.43Å; G450-V462 PolarHBondContact O-N 3.13Å
463	L	93.2	Very high	86.2	Confident	20 Å²	20	38.2 Å²	38.2	11%	0.105	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	158.4	-173.4	-55.9	179.9	0	0	0	110.9	V415 A416 K418 M437 V446 R447 F448 L461	V415-L463 CarbonylContact C-O 3.52Å; V415-L463 VanDerWaalsContact CA-O 3.22Å; V415-L463 WeakPolarHBondContact CA-O 3.48Å; V415-L463 WeakPolarHBondContact CB-O 3.4Å; A416-L463 HydrophobicContact CB-CB 4.34Å; A416-L463 PolarHBondContact N-O 2.88Å; A416-L463 PolarHBondContact O-N 3Å; K418-L463 HydrophobicContact CB-CD1 4.39Å; M437-L463 HydrophobicContact CE-CD1 4.3Å; M437-L463 HydrophobicContact CE-CD2 3.43Å; M437-L463 VanDerWaalsContact CE-CD2 3.43Å; M437-L463 HydrophobicContact SD-CD2 3.94Å; V446-L463 HydrophobicContact CG1-CB 4.21Å; R447-L463 WeakPolarHBondContact O-CA 3.41Å; F448-L463 HydrophobicContact CB-CD2 4.16Å; F448-L463 HydrophobicContact CD2-CD2 3.74Å; F448-L463 HydrophobicContact CG-CD2 4.44Å; L461-L463 HydrophobicContact CB-CD2 4.37Å; L461-L463 HydrophobicContact CB-CG 4.37Å
464	E	92.9	Very high	86.4	Confident	36 Å²	36	37.3 Å²	37.3	17%	0.168	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.1	144.5	169.3	68.2	-176.7	149.6	0	0	112.3	V446 R447 F449 M466 K584	V446-E464 WeakPolarHBondContact CA-OE1 3.4Å; V446-E464 HydrophobicContact CG1-CG 4.02Å; R447-E464 HydrophobicContact CB-CB 4.2Å; R447-E464 HydrophobicContact CB-CG 4Å; R447-E464 WeakPolarHBondContact CB-OE1 3.45Å; R447-E464 PolarHBondContact N-OE1 2.9Å; R447-E464 PolarHBondContact O-N 3.02Å; F449-E464 HydrophobicContact CE2-CB 4.07Å; E464-M466 HydrophobicContact CG-CG 4.39Å; E464-M466 HydrophobicContact CG-SD 4.16Å; E464-M466 PolarHBondContact O-N 2.91Å; E464-K584 WeakPolarHBondContact OE1-CD 3.38Å; E464-K584 WeakPolarHBondContact OE1-CE 3.42Å; E464-K584 IonicContact OE1-NZ 3.24Å; E464-K584 PolarHBondContact OE1-NZ 3.06Å; E464-K584 IonicContact OE2-NZ 3.56Å; E464-K584 PolarHBondContact OE2-NZ 2.66Å
465	M	92.2	Very high	87	Confident	26 Å²	26	32.4 Å²	32.4	13%	0.128	19%	0.194	C	C	.	.			trans	-78.7	106	178.5	-178.2	66.6	-173.3	0	0	111.1	I389 E399 K414 A416 D467	I389-M465 HydrophobicContact CD1-CE 3.63Å; I389-M465 HydrophobicContact CD1-SD 3.63Å; I389-M465 HydrophobicContact CG1-CE 4.38Å; E399-M465 HydrophobicContact CG-CE 4.32Å; E399-M465 HydrophobicContact CG-SD 4.27Å; E399-M465 VanDerWaalsContact OE2-CE 3.28Å; E399-M465 WeakPolarHBondContact OE2-CE 3.34Å; K414-M465 HydrophobicContact CB-CB 4.33Å; K414-M465 HydrophobicContact CD-CB 4.5Å; K414-M465 HydrophobicContact CD-CG 4.11Å; K414-M465 HydrophobicContact CG-CB 4.03Å; K414-M465 HydrophobicContact CG-CG 4.06Å; K414-M465 VanDerWaalsContact O-CB 3.23Å; K414-M465 WeakPolarHBondContact O-CB 3.38Å; K414-M465 PolarHBondContact O-N 3.48Å; A416-M465 HydrophobicContact CB-SD 4.36Å; M465-D467 PolarHBondContact O-N 3.03Å
466	M	92.9	Very high	87.6	Confident	11 Å²	11	33.5 Å²	33.5	5%	0.054	20%	0.195	C	C	.	.			trans	-88.1	90.4	171.6	-60.6	-64.2	-73.8	0	0	109.6	V446 E464 Q468 G469 L572 V573 K584	V446-M466 HydrophobicContact CG2-CG 4.19Å; E464-M466 HydrophobicContact CG-CG 4.39Å; E464-M466 HydrophobicContact CG-SD 4.16Å; E464-M466 PolarHBondContact O-N 2.91Å; M466-Q468 PolarHBondContact O-N 3.22Å; M466-Q468 VanDerWaalsContact O-N 3.13Å; M466-G469 PolarHBondContact O-N 2.94Å; M466-L572 HydrophobicContact CB-CB 3.63Å; M466-L572 HydrophobicContact CB-CD1 3.91Å; M466-L572 HydrophobicContact CB-CG 4.39Å; M466-L572 HydrophobicContact CE-CB 3.99Å; M466-L572 VanDerWaalsContact CE-O 3.28Å; M466-L572 WeakPolarHBondContact CE-O 3.48Å; M466-L572 HydrophobicContact CG-CB 3.68Å; M466-L572 HydrophobicContact CG-CD1 3.87Å; M466-L572 HydrophobicContact CG-CG 4.43Å; M466-V573 CarbonylContact C-O 3.58Å; M466-K584 HydrophobicContact CE-CB 3.95Å; M466-K584 HydrophobicContact CE-CD 3.94Å; M466-K584 HydrophobicContact CE-CG 3.69Å; M466-K584 HydrophobicContact SD-CD 4.01Å; M466-K584 HydrophobicContact SD-CG 4.43Å
467	D	88.4	Confident	88.4	Confident	52 Å²	52	31.3 Å²	31.3	28%	0.278	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-22.2	-165.3	65.8	-70.1	0	0	0	115.4	M465 S574 H575	M465-D467 PolarHBondContact O-N 3.03Å; D467-S574 WeakPolarHBondContact OD1-CA 3.36Å; D467-S574 VanDerWaalsContact OD1-CB 3.23Å; D467-S574 WeakPolarHBondContact OD1-CB 3.31Å; D467-S574 PolarHBondContact OD1-OG 2.83Å; D467-H575 PolarHBondContact OD1-N 3.37Å; D467-H575 VanDerWaalsContact OD1-N 3.08Å
468	Q	90.4	Very high	89.2	Confident	47 Å²	47	28 Å²	28	22%	0.22	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.9	-3.4	177.7	-61.5	-54.2	-46.6	0	0	113.8	M466 Y474 R477 V573 H575	M466-Q468 PolarHBondContact O-N 3.22Å; M466-Q468 VanDerWaalsContact O-N 3.13Å; Q468-Y474 HydrophobicContact CB-CD2 3.88Å; Q468-Y474 HydrophobicContact CB-CE2 4.21Å; Q468-Y474 HydrophobicContact CG-CD2 4.28Å; Q468-Y474 HydrophobicContact CG-CE2 4.11Å; Q468-R477 PolarHBondContact O-NH2 3.01Å; Q468-V573 HydrophobicContact CB-CB 3.9Å; Q468-V573 HydrophobicContact CB-CG1 4.06Å; Q468-V573 WeakPolarHBondContact CB-O 3.49Å; Q468-V573 HydrophobicContact CG-CG1 4.47Å; Q468-V573 PolarHBondContact N-O 2.82Å; Q468-V573 VanDerWaalsContact N-O 3.09Å; Q468-H575 WeakPolarHBondContact CG-CD2 3.45Å
469	G	88.5	Confident	89.5	Confident	27 Å²	27	28.4 Å²	28.4	28%	0.278	14%	0.137	S	C	.	.	E	Extended strand (participates in β ladder)	trans	72	-151.7	-179.4	0	0	0	0	0	112.8	M466 L572 V573	M466-G469 PolarHBondContact O-N 2.94Å; G469-L572 CarbonylContact O-C 3.37Å; G469-L572 WeakPolarHBondContact O-CA 3.41Å; G469-V573 PolarHBondContact O-N 3.44Å
470	N	89.9	Confident	88.8	Confident	41 Å²	41	28 Å²	28	22%	0.219	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	151.1	-177.4	73.5	81.4	0	0	0	112.9	R472 D473 Y474 C571 L572	N470-R472 PolarHBondContact O-N 3.38Å; N470-R472 PolarHBondContact OD1-N 2.85Å; N470-D473 VanDerWaalsContact ND2-CG 3.29Å; N470-D473 PolarHBondContact ND2-OD2 2.98Å; N470-D473 VanDerWaalsContact ND2-OD2 3.12Å; N470-D473 PolarHBondContact O-N 2.9Å; N470-D473 WeakPolarHBondContact OD1-CB 3.39Å; N470-D473 PolarHBondContact OD1-N 2.95Å; N470-Y474 PolarHBondContact O-N 3.34Å; N470-C571 CarbonylContact C-O 3.58Å; N470-C571 VanDerWaalsContact CA-O 3.31Å; N470-C571 WeakPolarHBondContact CA-O 3.36Å; N470-L572 HydrophobicContact CB-CD2 4.05Å
471	L	93.6	Very high	87.7	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-67.2	-36.3	-174.8	173.1	67	0	0	0	112.7	D473 Y474 L475 I545 I549 A568 C571 V573 V583 V639	L471-D473 PolarHBondContact O-N 3Å; L471-Y474 HydrophobicContact CD1-CD1 4.21Å; L471-Y474 WeakPolarHBondContact O-CB 3.14Å; L471-Y474 PolarHBondContact O-N 3.36Å; L471-Y474 VanDerWaalsContact O-N 3.15Å; L471-L475 HydrophobicContact CD1-CD1 4.07Å; L471-L475 HydrophobicContact CD1-CD2 4.31Å; L471-L475 HydrophobicContact CD1-CG 3.88Å; L471-L475 HydrophobicContact CG-CD1 3.85Å; L471-L475 HydrophobicContact CG-CG 4.17Å; L471-L475 WeakPolarHBondContact O-CB 3.44Å; L471-L475 VanDerWaalsContact O-CG 3.24Å; L471-L475 WeakPolarHBondContact O-CG 3.35Å; L471-L475 PolarHBondContact O-N 2.81Å; L471-I545 HydrophobicContact CD1-CD1 4.08Å; L471-I545 HydrophobicContact CD1-CG2 3.91Å; L471-I545 HydrophobicContact CD2-CG2 3.65Å; L471-I545 HydrophobicContact CG-CG2 4.43Å; L471-I549 HydrophobicContact CD2-CD1 3.74Å; L471-A568 WeakPolarHBondContact CB-O 3.32Å; L471-A568 HydrophobicContact CD2-CB 4.31Å; L471-A568 HydrophobicContact CG-CB 4.4Å; L471-A568 PolarHBondContact N-O 3.25Å; L471-C571 HydrophobicContact CB-CB 3.86Å; L471-C571 HydrophobicContact CD2-CB 3.95Å; L471-C571 PolarHBondContact N-O 2.91Å; L471-V573 HydrophobicContact CB-CG2 3.76Å; L471-V573 HydrophobicContact CD1-CG2 3.7Å; L471-V573 HydrophobicContact CG-CG2 4.34Å; L471-V583 HydrophobicContact CD2-CG1 4.19Å; L471-V639 HydrophobicContact CD2-CG2 4.02Å
472	R	89.1	Confident	86.3	Confident	71 Å²	71	37.8 Å²	37.8	27%	0.268	18%	0.175	S	C	.	.	H	α-helix	trans	-58.7	-47.3	176	-176.5	166.3	171.7	-110	4.9	111.7	N470 Y474 L475 H476 A568 D645	N470-R472 PolarHBondContact O-N 3.38Å; N470-R472 PolarHBondContact OD1-N 2.85Å; R472-Y474 VanDerWaalsContact C-N 3.33Å; R472-Y474 PolarHBondContact O-N 3.49Å; R472-L475 PolarHBondContact O-N 2.66Å; R472-H476 PolarHBondContact O-CD2 3.03Å; R472-H476 PolarHBondContact O-N 2.8Å; R472-A568 HydrophobicContact CB-CB 4.11Å; R472-A568 PolarHBondContact N-O 2.77Å; R472-D645 IonicContact CZ-OD1 2.78Å; R472-D645 IonicContact NE-OD1 3.46Å; R472-D645 IonicContact NH2-OD1 2.72Å; R472-D645 PolarHBondContact NH2-OD1 3.38Å; R472-D645 IonicContact NH2-OD2 3.33Å
473	D	87.7	Confident	84.5	Confident	47 Å²	47	39.7 Å²	39.7	25%	0.251	19%	0.191	S	C	.	.	H	α-helix	trans	-66.8	-31.1	174.5	-81.2	5	0	0	0	113.5	N470 L471 R477 R762	N470-D473 VanDerWaalsContact ND2-CG 3.29Å; N470-D473 PolarHBondContact ND2-OD2 2.98Å; N470-D473 VanDerWaalsContact ND2-OD2 3.12Å; N470-D473 PolarHBondContact O-N 2.9Å; N470-D473 WeakPolarHBondContact OD1-CB 3.39Å; N470-D473 PolarHBondContact OD1-N 2.95Å; L471-D473 PolarHBondContact O-N 3Å; D473-R477 WeakPolarHBondContact O-CG 3.43Å; D473-R477 PolarHBondContact O-N 3.16Å; D473-R477 PolarHBondContact O-NE 3.49Å; D473-R762 VanDerWaalsContact CG-NH2 3.25Å; D473-R762 IonicContact OD1-NH2 3.24Å; D473-R762 IonicContact OD2-CZ 2.86Å; D473-R762 IonicContact OD2-NH1 2.74Å; D473-R762 IonicContact OD2-NH2 3.55Å; D473-R762 PolarHBondContact OD2-NH2 3.45Å
474	Y	91.2	Very high	82.6	Confident	18 Å²	18	43.3 Å²	43.3	7%	0.071	22%	0.215	C	C	.	.	H	α-helix	trans	-66.1	-52.4	173.8	-176.6	-101.4	0	0	0	110.5	Q468 N470 L471 R472 H476 R477 S478 L537 V573 H575	Q468-Y474 HydrophobicContact CB-CD2 3.88Å; Q468-Y474 HydrophobicContact CB-CE2 4.21Å; Q468-Y474 HydrophobicContact CG-CD2 4.28Å; Q468-Y474 HydrophobicContact CG-CE2 4.11Å; N470-Y474 PolarHBondContact O-N 3.34Å; L471-Y474 HydrophobicContact CD1-CD1 4.21Å; L471-Y474 WeakPolarHBondContact O-CB 3.14Å; L471-Y474 PolarHBondContact O-N 3.36Å; L471-Y474 VanDerWaalsContact O-N 3.15Å; R472-Y474 VanDerWaalsContact C-N 3.33Å; R472-Y474 PolarHBondContact O-N 3.49Å; Y474-H476 VanDerWaalsContact C-N 3.33Å; Y474-H476 PolarHBondContact O-N 3.05Å; Y474-R477 WeakPolarHBondContact O-CA 3.44Å; Y474-R477 WeakPolarHBondContact O-CB 3.4Å; Y474-R477 PolarHBondContact O-N 3.15Å; Y474-S478 PolarHBondContact O-N 3.41Å; Y474-S478 PolarHBondContact O-OG 2.85Å; Y474-L537 HydrophobicContact CD1-CD1 4.34Å; Y474-L537 HydrophobicContact CE1-CD1 3.84Å; Y474-L537 HydrophobicContact CE1-CD2 4.25Å; Y474-V573 HydrophobicContact CD1-CG1 4.28Å; Y474-V573 HydrophobicContact CD1-CG2 4.3Å; Y474-V573 HydrophobicContact CD2-CG1 4.21Å; Y474-V573 HydrophobicContact CE1-CG1 4.29Å; Y474-V573 HydrophobicContact CE2-CG1 4.22Å; Y474-V573 HydrophobicContact CG-CB 4.39Å; Y474-V573 HydrophobicContact CG-CG1 4.24Å; Y474-V573 HydrophobicContact CG-CG2 4.17Å; Y474-H575 AromaticContact CE2-NE2 3.66Å; Y474-H575 AromaticContact CZ-NE2 3.9Å; Y474-H575 PolarHBondContact OH-CE1 3.35Å; Y474-H575 PolarHBondContact OH-NE2 3.36Å
475	L	91.2	Very high	80.6	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-58.4	-41.2	176.6	-67.3	166.1	0	0	0	112.5	L471 R472 R477 S478 R479 L537 L542 V639 L642	L471-L475 HydrophobicContact CD1-CD1 4.07Å; L471-L475 HydrophobicContact CD1-CD2 4.31Å; L471-L475 HydrophobicContact CD1-CG 3.88Å; L471-L475 HydrophobicContact CG-CD1 3.85Å; L471-L475 HydrophobicContact CG-CG 4.17Å; L471-L475 WeakPolarHBondContact O-CB 3.44Å; L471-L475 VanDerWaalsContact O-CG 3.24Å; L471-L475 WeakPolarHBondContact O-CG 3.35Å; L471-L475 PolarHBondContact O-N 2.81Å; R472-L475 PolarHBondContact O-N 2.66Å; L475-R477 VanDerWaalsContact C-N 3.29Å; L475-R477 PolarHBondContact O-N 3.34Å; L475-S478 PolarHBondContact O-N 3.48Å; L475-R479 PolarHBondContact O-N 2.92Å; L475-L537 HydrophobicContact CD2-CD1 4.1Å; L475-L542 HydrophobicContact CD2-CD2 3.85Å; L475-V639 HydrophobicContact CD1-CB 4.49Å; L475-V639 HydrophobicContact CD1-CG2 4.17Å; L475-V639 HydrophobicContact CD2-CG1 4.45Å; L475-L642 HydrophobicContact CD2-CD2 4.13Å
476	H	85.7	Confident	78.9	Confident	59 Å²	59	49.3 Å²	49.3	27%	0.273	25%	0.249	S	C	.	.	H	α-helix	trans	-60	-36.1	173.3	-77.8	-170	0	0	0	113	R472 Y474 L642 G643	R472-H476 PolarHBondContact O-CD2 3.03Å; R472-H476 PolarHBondContact O-N 2.8Å; Y474-H476 VanDerWaalsContact C-N 3.33Å; Y474-H476 PolarHBondContact O-N 3.05Å; H476-L642 PolarHBondContact CD2-O 3.33Å; H476-G643 PolarHBondContact CD2-O 2.82Å; H476-G643 PolarHBondContact NE2-O 2.82Å
477	R	85.5	Confident	77.2	Confident	64 Å²	64	49.2 Å²	49.2	24%	0.242	25%	0.249	C	C	.	.	H	α-helix	trans	-71.7	-33.3	176.2	-78.8	173.6	-73.5	165.3	-0.9	112.3	Q468 D473 Y474 L475 R479	Q468-R477 PolarHBondContact O-NH2 3.01Å; D473-R477 WeakPolarHBondContact O-CG 3.43Å; D473-R477 PolarHBondContact O-N 3.16Å; D473-R477 PolarHBondContact O-NE 3.49Å; Y474-R477 WeakPolarHBondContact O-CA 3.44Å; Y474-R477 WeakPolarHBondContact O-CB 3.4Å; Y474-R477 PolarHBondContact O-N 3.15Å; L475-R477 VanDerWaalsContact C-N 3.29Å; L475-R477 PolarHBondContact O-N 3.34Å; R477-R479 VanDerWaalsContact C-N 3.3Å; R477-R479 PolarHBondContact O-N 3.22Å
478	S	85	Confident	75.7	Confident	4 Å²	4	49.8 Å²	49.8	3%	0.028	26%	0.261	C	S	.	.	H	α-helix	trans	-76.5	-7.5	178.4	-57.4	0	0	0	0	115.4	Y474 L475 Q536 L537	Y474-S478 PolarHBondContact O-N 3.41Å; Y474-S478 PolarHBondContact O-OG 2.85Å; L475-S478 PolarHBondContact O-N 3.48Å; S478-Q536 PolarHBondContact O-N 2.86Å; S478-L537 WeakPolarHBondContact OG-CD1 3.01Å
479	R	82.2	Confident	74.2	Confident	49 Å²	49	53 Å²	53	19%	0.185	28%	0.28	C	S	.	.	S	Bend	trans	-60.1	141.7	173	-70.3	-178.3	179.7	-171.9	-3.4	111	L475 R477 R481 L642 G643 M755	L475-R479 PolarHBondContact O-N 2.92Å; R477-R479 VanDerWaalsContact C-N 3.3Å; R477-R479 PolarHBondContact O-N 3.22Å; R479-R481 PolarHBondContact O-N 3.39Å; R479-L642 HydrophobicContact CG-CB 3.78Å; R479-L642 HydrophobicContact CG-CD1 4.12Å; R479-L642 VanDerWaalsContact CZ-O 3.27Å; R479-L642 PolarHBondContact NE-O 3.47Å; R479-L642 PolarHBondContact NH2-O 2.99Å; R479-G643 VanDerWaalsContact NH2-C 3.33Å; R479-G643 PolarHBondContact NH2-O 2.84Å; R479-M755 HydrophobicContact CB-SD 4.5Å
480	P	71.7	Confident	73	Confident	14 Å²	14	53.9 Å²	53.9	9%	0.091	28%	0.28	C	S	.	.			trans	-55.9	136.1	171.8	-17.9	26.3	0	0	0	111.3	L533 T534 A535 V720 M755	P480-L533 HydrophobicContact CB-CB 3.57Å; P480-L533 HydrophobicContact CB-CD1 3.7Å; P480-L533 HydrophobicContact CB-CG 4.29Å; P480-L533 HydrophobicContact CG-CB 3.87Å; P480-T534 WeakPolarHBondContact CG-O 3.23Å; P480-A535 HydrophobicContact CG-CB 4.19Å; P480-V720 HydrophobicContact CG-CB 4.02Å; P480-V720 HydrophobicContact CG-CG2 3.73Å; P480-M755 WeakPolarHBondContact O-CE 3.44Å
481	R	66.5	Low	71.7	Confident	183 Å²	183	53.8 Å²	53.8	69%	0.691	28%	0.277	S	S	*	.			trans	-121	128	175.6	-60.6	-179.5	-173.8	-174.5	-3.4	108.8	R479	R479-R481 PolarHBondContact O-N 3.39Å
482	I	61.8	Low	70	Confident	24 Å²	24	55.8 Å²	55.8	12%	0.123	29%	0.294	C	S	.	.			trans	-94.1	125.9	163.8	-41.8	176.9	0	0	0	106.8	I486 A487 V490 L533 L722	I482-I486 HydrophobicContact CG2-CB 4.13Å; I482-I486 HydrophobicContact CG2-CG2 3.89Å; I482-A487 HydrophobicContact CB-CB 4.3Å; I482-A487 HydrophobicContact CG2-CB 3.89Å; I482-V490 HydrophobicContact CD1-CG1 4.32Å; I482-V490 HydrophobicContact CG2-CG2 4.35Å; I482-L533 HydrophobicContact CD1-CD1 4Å; I482-L533 HydrophobicContact CD1-CD2 4.4Å; I482-L533 HydrophobicContact CG1-CD1 3.74Å; I482-L533 HydrophobicContact CG1-CD2 4.31Å; I482-L722 HydrophobicContact CD1-CD1 4.31Å
483	A	54.7	Low	68.6	Low	40 Å²	40	54.9 Å²	54.9	33%	0.331	30%	0.302	S	S	.	.			trans	-64.1	144.4	174.7	0	0	0	0	0	109.8	D485 I486 A487	A483-D485 VanDerWaalsContact C-N 3.26Å; A483-D485 WeakPolarHBondContact CB-OD1 3.33Å; A483-D485 PolarHBondContact O-N 2.83Å; A483-I486 HydrophobicContact CB-CB 4.29Å; A483-I486 HydrophobicContact CB-CD1 4.05Å; A483-I486 HydrophobicContact CB-CG1 4.16Å; A483-I486 CarbonylContact O-C 3.6Å; A483-I486 PolarHBondContact O-N 3.08Å; A483-A487 WeakPolarHBondContact O-CB 3.42Å; A483-A487 PolarHBondContact O-N 2.95Å
484	P	52.6	Low	67.3	Low	96 Å²	96	53.7 Å²	53.7	62%	0.623	30%	0.298	S	S	*	.	H	α-helix	trans	-59.4	-33.4	-170.2	-26.1	35.3	0	0	0	114.8
485	D	51.6	Low	65.6	Low	112 Å²	112	53.8 Å²	53.8	60%	0.599	30%	0.303	S	S	*	.	H	α-helix	trans	-69.3	-42	173.7	60.4	-46.2	0	0	0	112.4	A483	A483-D485 VanDerWaalsContact C-N 3.26Å; A483-D485 WeakPolarHBondContact CB-OD1 3.33Å; A483-D485 PolarHBondContact O-N 2.83Å
486	I	55.8	Low	64.1	Low	77 Å²	77	59.3 Å²	59.3	40%	0.395	33%	0.331	S	S	.	.	H	α-helix	trans	-72.3	-31.7	176.2	-61.1	178	0	0	0	111	I482 A483 A488 N489 V490	I482-I486 HydrophobicContact CG2-CB 4.13Å; I482-I486 HydrophobicContact CG2-CG2 3.89Å; A483-I486 HydrophobicContact CB-CB 4.29Å; A483-I486 HydrophobicContact CB-CD1 4.05Å; A483-I486 HydrophobicContact CB-CG1 4.16Å; A483-I486 CarbonylContact O-C 3.6Å; A483-I486 PolarHBondContact O-N 3.08Å; I486-A488 PolarHBondContact O-N 3.08Å; I486-N489 PolarHBondContact O-N 2.66Å; I486-N489 VanDerWaalsContact O-N 3.08Å; I486-V490 HydrophobicContact CG2-CG2 3.68Å; I486-V490 WeakPolarHBondContact O-CG2 3.42Å; I486-V490 PolarHBondContact O-N 3.03Å
487	A	58.3	Low	62.8	Low	9 Å²	9	60.7 Å²	60.7	7%	0.074	35%	0.347	C	S	.	.	H	α-helix	trans	-58.7	-45.4	-176.3	0	0	0	0	0	112.2	I482 A483 N489 V490 F491	I482-A487 HydrophobicContact CB-CB 4.3Å; I482-A487 HydrophobicContact CG2-CB 3.89Å; A483-A487 WeakPolarHBondContact O-CB 3.42Å; A483-A487 PolarHBondContact O-N 2.95Å; A487-N489 VanDerWaalsContact C-N 3.28Å; A487-N489 PolarHBondContact O-N 2.81Å; A487-V490 PolarHBondContact O-N 2.86Å; A487-F491 HydrophobicContact CB-CD2 4.23Å; A487-F491 HydrophobicContact CB-CE2 4.15Å; A487-F491 WeakPolarHBondContact O-CB 3.4Å; A487-F491 WeakPolarHBondContact O-CD2 3.37Å; A487-F491 PolarHBondContact O-N 2.8Å
488	A	56.6	Low	61.4	Low	64 Å²	64	58 Å²	58	53%	0.529	34%	0.339	S	S	.	.	H	α-helix	trans	-56.2	-43.9	175.5	0	0	0	0	0	111.9	I486 A492	I486-A488 PolarHBondContact O-N 3.08Å; A488-A492 WeakPolarHBondContact O-CB 3.31Å; A488-A492 PolarHBondContact O-N 3.29Å
489	N	60	Low	60	Low	115 Å²	115	60.4 Å²	60.4	62%	0.615	36%	0.359	S	S	*	.	H	α-helix	trans	-70.2	-39.7	179.5	-66.5	-25.4	0	0	0	112.6	I486 A487 A492 A493	I486-N489 PolarHBondContact O-N 2.66Å; I486-N489 VanDerWaalsContact O-N 3.08Å; A487-N489 VanDerWaalsContact C-N 3.28Å; A487-N489 PolarHBondContact O-N 2.81Å; N489-A492 PolarHBondContact O-N 3.13Å; N489-A493 WeakPolarHBondContact O-CB 3.45Å; N489-A493 PolarHBondContact O-N 3.01Å
490	V	62	Low	58.7	Low	45 Å²	45	61 Å²	61	27%	0.273	37%	0.374	S	S	.	.	H	α-helix	trans	-69	-43.9	177.9	172.9	0	0	0	0	111.2	I482 I486 A487 A494 I531	I482-V490 HydrophobicContact CD1-CG1 4.32Å; I482-V490 HydrophobicContact CG2-CG2 4.35Å; I486-V490 HydrophobicContact CG2-CG2 3.68Å; I486-V490 WeakPolarHBondContact O-CG2 3.42Å; I486-V490 PolarHBondContact O-N 3.03Å; A487-V490 PolarHBondContact O-N 2.86Å; V490-A494 VanDerWaalsContact O-CB 3.26Å; V490-A494 WeakPolarHBondContact O-CB 3.33Å; V490-A494 PolarHBondContact O-N 2.93Å; V490-I531 HydrophobicContact CG1-CD1 4.06Å; V490-I531 HydrophobicContact CG1-CG1 4.3Å; V490-I531 HydrophobicContact CG1-CG2 3.88Å
491	F	62.8	Low	57.7	Low	38 Å²	38	63.1 Å²	63.1	17%	0.167	40%	0.398	C	S	.	.	H	α-helix	trans	-65	-40.3	174.2	-73.3	-61	0	0	0	111.8	A487 A495 I531 L724 P725	A487-F491 HydrophobicContact CB-CD2 4.23Å; A487-F491 HydrophobicContact CB-CE2 4.15Å; A487-F491 WeakPolarHBondContact O-CB 3.4Å; A487-F491 WeakPolarHBondContact O-CD2 3.37Å; A487-F491 PolarHBondContact O-N 2.8Å; F491-A495 VanDerWaalsContact O-CB 3.24Å; F491-A495 WeakPolarHBondContact O-CB 3.36Å; F491-A495 PolarHBondContact O-N 3.08Å; F491-I531 HydrophobicContact CD1-CD1 3.25Å; F491-I531 HydrophobicContact CE1-CD1 3.43Å; F491-I531 VanDerWaalsContact CE1-CD1 3.43Å; F491-I531 HydrophobicContact CG-CD1 4.16Å; F491-I531 HydrophobicContact CZ-CD1 4.45Å; F491-L724 HydrophobicContact CD1-CD2 4.1Å; F491-P725 HydrophobicContact CD1-CG 4.12Å; F491-P725 HydrophobicContact CE1-CG 4.17Å
492	A	59	Low	56.6	Low	43 Å²	43	62 Å²	62	36%	0.355	39%	0.394	S	S	.	.	H	α-helix	trans	-65.2	-47.2	175.4	0	0	0	0	0	112.1	A488 N489 A495 I496	A488-A492 WeakPolarHBondContact O-CB 3.31Å; A488-A492 PolarHBondContact O-N 3.29Å; N489-A492 PolarHBondContact O-N 3.13Å; A492-A495 PolarHBondContact O-N 2.75Å; A492-I496 WeakPolarHBondContact O-CB 3.32Å; A492-I496 WeakPolarHBondContact O-CD1 3.35Å; A492-I496 VanDerWaalsContact O-CG1 3.23Å; A492-I496 WeakPolarHBondContact O-CG1 3.4Å; A492-I496 PolarHBondContact O-N 2.76Å
493	A	58.4	Low	55.8	Low	51 Å²	51	66 Å²	66	42%	0.421	42%	0.42	S	S	.	.	H	α-helix	trans	-61.2	-46.4	177.7	0	0	0	0	0	111.7	N489 A495 I496 C497	N489-A493 WeakPolarHBondContact O-CB 3.45Å; N489-A493 PolarHBondContact O-N 3.01Å; A493-A495 VanDerWaalsContact C-N 3.34Å; A493-A495 PolarHBondContact O-N 3.21Å; A493-I496 PolarHBondContact O-N 2.86Å; A493-C497 PolarHBondContact O-N 3.27Å; A493-C497 PolarHBondContact O-SG 3.09Å; A493-C497 VanDerWaalsContact O-SG 3.34Å
494	A	60.2	Low	54.8	Low	22 Å²	22	68.4 Å²	68.4	18%	0.182	45%	0.448	C	S	.	.	H	α-helix	trans	-65	-36.2	177.1	0	0	0	0	0	112.4	V490 A498 I531 L724	V490-A494 VanDerWaalsContact O-CB 3.26Å; V490-A494 WeakPolarHBondContact O-CB 3.33Å; V490-A494 PolarHBondContact O-N 2.93Å; A494-A498 VanDerWaalsContact O-CB 3.27Å; A494-A498 WeakPolarHBondContact O-CB 3.43Å; A494-A498 PolarHBondContact O-N 2.76Å; A494-I531 HydrophobicContact CB-CD1 3.99Å; A494-I531 HydrophobicContact CB-CG1 3.6Å; A494-L724 HydrophobicContact CB-CD1 4.09Å; A494-L724 HydrophobicContact CB-CD2 3.97Å; A494-L724 HydrophobicContact CB-CG 4.36Å
495	A	56	Low	53.9	Low	21 Å²	21	67.2 Å²	67.2	17%	0.174	45%	0.453	C	S	.	.	H	α-helix	trans	-66.5	-40	171.8	0	0	0	0	0	112.6	F491 A492 A493 A498 A499 L728	F491-A495 VanDerWaalsContact O-CB 3.24Å; F491-A495 WeakPolarHBondContact O-CB 3.36Å; F491-A495 PolarHBondContact O-N 3.08Å; A492-A495 PolarHBondContact O-N 2.75Å; A493-A495 VanDerWaalsContact C-N 3.34Å; A493-A495 PolarHBondContact O-N 3.21Å; A495-A498 PolarHBondContact O-N 2.55Å; A495-A499 WeakPolarHBondContact O-CB 3.47Å; A495-A499 PolarHBondContact O-N 3.22Å; A495-L728 HydrophobicContact CB-CB 4.29Å; A495-L728 HydrophobicContact CB-CD1 4.25Å
496	I	60.6	Low	53	Low	115 Å²	115	66.6 Å²	66.6	59%	0.59	46%	0.458	S	S	*	.	H	α-helix	trans	-63	-46.2	175	-70.3	162.2	0	0	0	110.5	A492 A493 A498 A499 A500	A492-I496 WeakPolarHBondContact O-CB 3.32Å; A492-I496 WeakPolarHBondContact O-CD1 3.35Å; A492-I496 VanDerWaalsContact O-CG1 3.23Å; A492-I496 WeakPolarHBondContact O-CG1 3.4Å; A492-I496 PolarHBondContact O-N 2.76Å; A493-I496 PolarHBondContact O-N 2.86Å; I496-A498 PolarHBondContact O-N 3.07Å; I496-A499 PolarHBondContact O-N 3.23Å; I496-A500 WeakPolarHBondContact O-CB 3.31Å; I496-A500 PolarHBondContact O-N 3.5Å
497	C	57.4	Low	52.1	Low	88 Å²	88	70.3 Å²	70.3	60%	0.595	48%	0.478	S	S	*	.	H	α-helix	trans	-62.1	-42.7	175.4	-67.1	0	0	0	0	112.2	A493 A499 A500 G501	A493-C497 PolarHBondContact O-N 3.27Å; A493-C497 PolarHBondContact O-SG 3.09Å; A493-C497 VanDerWaalsContact O-SG 3.34Å; C497-A499 PolarHBondContact O-N 3.2Å; C497-A500 PolarHBondContact O-N 3.06Å; C497-G501 PolarHBondContact O-N 2.87Å; C497-G501 VanDerWaalsContact O-N 3.14Å
498	A	56.2	Low	50.7	Low	9 Å²	9	73.6 Å²	73.6	7%	0.074	51%	0.514	C	S	.	.	H	α-helix	trans	-69	-19.5	176.9	0	0	0	0	0	114.1	A494 A495 I496 R502 L724	A494-A498 VanDerWaalsContact O-CB 3.27Å; A494-A498 WeakPolarHBondContact O-CB 3.43Å; A494-A498 PolarHBondContact O-N 2.76Å; A495-A498 PolarHBondContact O-N 2.55Å; I496-A498 PolarHBondContact O-N 3.07Å; A498-R502 PolarHBondContact O-NE 2.83Å; A498-L724 HydrophobicContact CB-CD1 4.26Å
499	A	55.2	Low	49.6	Very low	54 Å²	54	76.4 Å²	76.4	45%	0.446	53%	0.529	S	S	.	.	H	α-helix	trans	-85.9	-45.2	171.4	0	0	0	0	0	112.1	A495 I496 C497 G501 R502	A495-A499 WeakPolarHBondContact O-CB 3.47Å; A495-A499 PolarHBondContact O-N 3.22Å; I496-A499 PolarHBondContact O-N 3.23Å; C497-A499 PolarHBondContact O-N 3.2Å; A499-G501 VanDerWaalsContact C-N 3.26Å; A499-G501 PolarHBondContact O-N 2.82Å; A499-R502 WeakPolarHBondContact O-CB 3.21Å; A499-R502 PolarHBondContact O-N 3.09Å
500	A	54.4	Low	48	Very low	61 Å²	61	76 Å²	76	50%	0.504	54%	0.535	S	S	.	.	H	α-helix	trans	-60.1	-34	178.7	0	0	0	0	0	112.6	I496 C497 R502 T503	I496-A500 WeakPolarHBondContact O-CB 3.31Å; I496-A500 PolarHBondContact O-N 3.5Å; C497-A500 PolarHBondContact O-N 3.06Å; A500-R502 PolarHBondContact O-N 2.86Å; A500-T503 PolarHBondContact O-N 2.89Å; A500-T503 PolarHBondContact O-OG1 2.82Å
501	G	50.9	Low	46.7	Very low	58 Å²	58	80 Å²	80	60%	0.598	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.3	-0.9	172.9	0	0	0	0	0	115.7	C497 A499	C497-G501 PolarHBondContact O-N 2.87Å; C497-G501 VanDerWaalsContact O-N 3.14Å; A499-G501 VanDerWaalsContact C-N 3.26Å; A499-G501 PolarHBondContact O-N 2.82Å
502	R	45.2	Very low	45	Very low	160 Å²	160	85.7 Å²	85.7	60%	0.604	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.5	-13.3	179.7	-54.1	-176.2	-167.2	-155.1	-1.1	113.9	A498 A499 A500 G504	A498-R502 PolarHBondContact O-NE 2.83Å; A499-R502 WeakPolarHBondContact O-CB 3.21Å; A499-R502 PolarHBondContact O-N 3.09Å; A500-R502 PolarHBondContact O-N 2.86Å; R502-G504 PolarHBondContact O-N 3.29Å
503	T	44.2	Very low	43.6	Very low	109 Å²	109	89.5 Å²	89.5	67%	0.669	61%	0.611	S	S	*	*			trans	-98.9	86	179.7	50.4	0	0	0	0	110.6	A500 G505	A500-T503 PolarHBondContact O-N 2.89Å; A500-T503 PolarHBondContact O-OG1 2.82Å; T503-G505 PolarHBondContact O-N 2.85Å
504	G	33.4	Very low	42	Very low	90 Å²	90	92.7 Å²	92.7	93%	0.928	63%	0.63	S	S	*	*			trans	-71.5	102.2	160.3	0	0	0	0	0	109	R502	R502-G504 PolarHBondContact O-N 3.29Å
505	G	33.7	Very low	40.6	Very low	71 Å²	71	98 Å²	98	73%	0.732	66%	0.66	S	S	*	*			trans	-169.3	145.9	-177.1	0	0	0	0	0	110.2	T503	T503-G505 PolarHBondContact O-N 2.85Å
506	S	32.6	Very low	39.4	Very low	98 Å²	98	104.3 Å²	104.3	69%	0.685	70%	0.697	S	S	*	*			trans	-77.1	174.7	-170.7	51.8	0	0	0	0	114.2
507	D	36.4	Very low	37.8	Very low	155 Å²	155	103.8 Å²	103.8	83%	0.829	70%	0.703	S	S	*	*			trans	85.2	121.7	158.4	-47.7	-49.9	0	0	0	116.8
508	G	30.4	Very low	36.7	Very low	79 Å²	79	106.5 Å²	106.5	81%	0.814	72%	0.718	S	S	*	*			trans	-104.6	160.9	-161	0	0	0	0	0	114.9
509	S	31.8	Very low	35.6	Very low	122 Å²	122	110.4 Å²	110.4	85%	0.853	75%	0.75	S	S	*	*			trans	-151.9	142.5	146.1	52.8	0	0	0	0	109.3
510	S	28.1	Very low	34.6	Very low	106 Å²	106	114.3 Å²	114.3	74%	0.741	77%	0.77	S	S	*	*			trans	-81.3	131	-172.9	44.4	0	0	0	0	112.2
511	V	33.5	Very low	33.4	Very low	131 Å²	131	115 Å²	115	79%	0.794	78%	0.784	S	S	*	*			trans	-130.8	110.8	157.6	-177.4	0	0	0	0	108.1	T513	V511-T513 PolarHBondContact O-N 2.82Å
512	N	27.2	Very low	32.2	Very low	156 Å²	156	116.8 Å²	116.8	83%	0.834	80%	0.802	S	S	*	*			trans	-77	120	-178.5	-62.1	-27.4	0	0	0	110.1
513	T	29.3	Very low	31.3	Very low	124 Å²	124	112.4 Å²	112.4	76%	0.761	81%	0.807	S	S	*	*			trans	-132.8	114.1	160.2	-47.5	0	0	0	0	108	V511 T515	V511-T513 PolarHBondContact O-N 2.82Å; T513-T515 PolarHBondContact O-N 2.85Å
514	S	25.9	Very low	30.7	Very low	118 Å²	118	113.7 Å²	113.7	83%	0.825	82%	0.815	S	S	*	*			trans	-71	112.9	-169.3	50.6	0	0	0	0	113
515	T	29.8	Very low	30.7	Very low	133 Å²	133	115.6 Å²	115.6	82%	0.816	81%	0.811	S	S	*	*			trans	-124.4	116.6	157.1	47.1	0	0	0	0	108.8	T513	T513-T515 PolarHBondContact O-N 2.85Å
516	T	30.6	Very low	30.7	Very low	153 Å²	153	117.5 Å²	117.5	94%	0.939	81%	0.813	S	S	*	*			trans	-67.6	136.1	-172.3	-27.9	0	0	0	0	111.5
517	S	27.7	Very low	31	Very low	104 Å²	104	114.8 Å²	114.8	73%	0.727	80%	0.796	S	S	*	*			trans	-103.6	146.5	-177.4	53.3	0	0	0	0	112.7
518	T	33.9	Very low	31.6	Very low	146 Å²	146	111.4 Å²	111.4	90%	0.896	79%	0.785	S	S	*	*			trans	-179.4	135.1	153.4	21	0	0	0	0	106.7
519	A	33.6	Very low	32.9	Very low	91 Å²	91	110.8 Å²	110.8	75%	0.752	76%	0.763	S	S	*	*			cis	-153.6	-165.6	-15.2	0	0	0	0	0	107.6
520	P	33.1	Very low	34.1	Very low	135 Å²	135	107.6 Å²	107.6	88%	0.877	74%	0.738	S	S	*	*			trans	-109.1	152.1	-130.3	38.2	-25.7	0	0	0	116.9
521	G	29.2	Very low	35.7	Very low	77 Å²	77	103 Å²	103	79%	0.794	71%	0.705	S	S	*	*			trans	-159.6	126.1	167.7	0	0	0	0	0	110.8	G523	G521-G523 PolarHBondContact O-N 2.85Å
522	G	26.2	Very low	37.1	Very low	95 Å²	95	101.2 Å²	101.2	98%	0.979	69%	0.694	S	S	*	*			trans	-74.8	122.9	-167.9	0	0	0	0	0	114.6
523	G	27.2	Very low	39	Very low	68 Å²	68	95.4 Å²	95.4	70%	0.701	66%	0.663	S	S	*	*			trans	-167.2	132.7	168.9	0	0	0	0	0	110	G521	G521-G523 PolarHBondContact O-N 2.85Å
524	T	30.6	Very low	40.7	Very low	135 Å²	135	94.3 Å²	94.3	83%	0.828	66%	0.657	S	S	*	*			trans	-63.7	133.8	177.2	43.8	0	0	0	0	110	S526	T524-S526 PolarHBondContact O-N 2.7Å
525	P	33.2	Very low	42.8	Very low	130 Å²	130	89.6 Å²	89.6	84%	0.844	62%	0.624	S	S	*	*			trans	-71.7	95.4	-178.9	28.8	-33.8	0	0	0	109.7	A527	P525-A527 PolarHBondContact O-N 3.5Å
526	S	35.1	Very low	44.9	Very low	112 Å²	112	90.2 Å²	90.2	78%	0.783	62%	0.618	S	S	*	*			trans	-66	119.3	165.6	-162	0	0	0	0	107.8	T524 S528	T524-S526 PolarHBondContact O-N 2.7Å; S526-S528 PolarHBondContact O-N 3.47Å
527	A	38.3	Very low	47.5	Very low	40 Å²	40	83.5 Å²	83.5	33%	0.331	58%	0.576	S	S	.	*			trans	-61.3	97.3	-175.1	0	0	0	0	0	111.2	P525 N529	P525-A527 PolarHBondContact O-N 3.5Å; A527-N529 PolarHBondContact O-N 2.96Å
528	S	48.6	Very low	50.3	Low	84 Å²	84	82.1 Å²	82.1	59%	0.587	56%	0.561	S	S	*	*			trans	-71.1	118.2	-178.9	43.6	0	0	0	0	110.1	S526 V530	S526-S528 PolarHBondContact O-N 3.47Å; S528-V530 PolarHBondContact O-N 3.34Å
529	N	57.3	Low	53	Low	66 Å²	66	75.4 Å²	75.4	35%	0.353	52%	0.519	S	S	.	.			trans	-76.9	38.8	177.1	-62.2	-63.3	0	0	0	112.1	A527 L724	A527-N529 PolarHBondContact O-N 2.96Å; N529-L724 PolarHBondContact O-N 3.23Å
530	V	57.7	Low	55.7	Low	55 Å²	55	72.3 Å²	72.3	33%	0.333	49%	0.492	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	135.5	-164.4	-179.6	0	0	0	0	110.1	S528 L722	S528-V530 PolarHBondContact O-N 3.34Å; V530-L722 CarbonylContact C-O 3.51Å; V530-L722 VanDerWaalsContact CA-O 3.31Å; V530-L722 WeakPolarHBondContact CA-O 3.41Å
531	I	62.5	Low	58.5	Low	11 Å²	11	66.3 Å²	66.3	6%	0.056	45%	0.453	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	125.3	169.6	-69.1	155.2	0	0	0	108.5	V490 F491 A494 L533 L722 L724	V490-I531 HydrophobicContact CG1-CD1 4.06Å; V490-I531 HydrophobicContact CG1-CG1 4.3Å; V490-I531 HydrophobicContact CG1-CG2 3.88Å; F491-I531 HydrophobicContact CD1-CD1 3.25Å; F491-I531 HydrophobicContact CE1-CD1 3.43Å; F491-I531 VanDerWaalsContact CE1-CD1 3.43Å; F491-I531 HydrophobicContact CG-CD1 4.16Å; F491-I531 HydrophobicContact CZ-CD1 4.45Å; A494-I531 HydrophobicContact CB-CD1 3.99Å; A494-I531 HydrophobicContact CB-CG1 3.6Å; I531-L533 HydrophobicContact CG2-CD2 3.92Å; I531-L533 HydrophobicContact CG2-CG 4.18Å; I531-L722 HydrophobicContact CB-CB 4.37Å; I531-L722 PolarHBondContact N-O 2.94Å; I531-L722 PolarHBondContact O-N 3.21Å; I531-L724 HydrophobicContact CD1-CD2 4.07Å; I531-L724 HydrophobicContact CD1-CG 4.45Å
532	T	62.6	Low	61.5	Low	92 Å²	92	62.6 Å²	62.6	56%	0.564	42%	0.416	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.4	118.9	-174.1	-54.7	0	0	0	0	109.5	V719	T532-V719 HydrophobicContact CG2-CG1 3.22Å
533	L	67.2	Low	64.8	Low	34 Å²	34	58.2 Å²	58.2	18%	0.178	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	136.2	-178.2	-56.8	177.5	0	0	0	111.7	P480 I482 I531 V719 V720 L722	P480-L533 HydrophobicContact CB-CB 3.57Å; P480-L533 HydrophobicContact CB-CD1 3.7Å; P480-L533 HydrophobicContact CB-CG 4.29Å; P480-L533 HydrophobicContact CG-CB 3.87Å; I482-L533 HydrophobicContact CD1-CD1 4Å; I482-L533 HydrophobicContact CD1-CD2 4.4Å; I482-L533 HydrophobicContact CG1-CD1 3.74Å; I482-L533 HydrophobicContact CG1-CD2 4.31Å; I531-L533 HydrophobicContact CG2-CD2 3.92Å; I531-L533 HydrophobicContact CG2-CG 4.18Å; L533-V719 CarbonylContact O-C 3.52Å; L533-V719 WeakPolarHBondContact O-CA 3.21Å; L533-V720 PolarHBondContact N-O 2.84Å; L533-V720 PolarHBondContact O-N 3.07Å; L533-L722 HydrophobicContact CD1-CD1 3.65Å; L533-L722 HydrophobicContact CD1-CG 4.49Å; L533-L722 HydrophobicContact CG-CD1 4.47Å
534	T	64.4	Low	68	Low	102 Å²	102	57.3 Å²	57.3	63%	0.626	35%	0.349	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.9	137.3	171.8	47.2	0	0	0	0	111.5	P480 V719	P480-T534 WeakPolarHBondContact CG-O 3.23Å; T534-V719 HydrophobicContact CG2-CG2 4.35Å
535	A	69.4	Low	71.1	Confident	18 Å²	18	51 Å²	51	15%	0.149	31%	0.31	C	S	.	.			trans	-82.6	162.1	174.8	0	0	0	0	0	112.2	P480 L537 L642 F718	P480-A535 HydrophobicContact CG-CB 4.19Å; A535-L537 PolarHBondContact O-N 3.49Å; A535-L642 HydrophobicContact CB-CD1 3.77Å; A535-F718 HydrophobicContact CB-CB 4.33Å; A535-F718 HydrophobicContact CB-CD1 3.72Å; A535-F718 HydrophobicContact CB-CG 4.43Å; A535-F718 PolarHBondContact N-O 3.07Å
536	Q	75.1	Confident	74.2	Confident	147 Å²	147	44.8 Å²	44.8	69%	0.687	27%	0.27	S	S	*	.	S	Bend	trans	-73.4	-16.5	177.4	-65.1	-175.7	-17.3	0	0	113.7	S478	S478-Q536 PolarHBondContact O-N 2.86Å
537	L	84.4	Confident	77.1	Confident	11 Å²	11	42 Å²	42	6%	0.058	24%	0.242	C	C	.	.	S	Bend	trans	-115.1	122.1	175.3	-61.3	173.6	0	0	0	107.5	Y474 L475 S478 A535 A541 L542 I545 F718	Y474-L537 HydrophobicContact CD1-CD1 4.34Å; Y474-L537 HydrophobicContact CE1-CD1 3.84Å; Y474-L537 HydrophobicContact CE1-CD2 4.25Å; L475-L537 HydrophobicContact CD2-CD1 4.1Å; S478-L537 WeakPolarHBondContact OG-CD1 3.01Å; A535-L537 PolarHBondContact O-N 3.49Å; L537-A541 HydrophobicContact CB-CB 4.23Å; L537-A541 HydrophobicContact CD2-CB 4.24Å; L537-L542 HydrophobicContact CB-CD2 4Å; L537-L542 HydrophobicContact CB-CG 4.32Å; L537-L542 HydrophobicContact CD1-CD2 3.91Å; L537-I545 HydrophobicContact CD1-CD1 4.28Å; L537-F718 WeakPolarHBondContact O-CB 3.47Å
538	D	87	Confident	79.9	Confident	76 Å²	76	41 Å²	41	41%	0.406	23%	0.231	S	C	.	.			trans	-76.3	172.3	171.2	59.4	23.6	0	0	0	111.6	P540 A541 L542	D538-P540 WeakPolarHBondContact OD1-CD 3.48Å; D538-A541 WeakPolarHBondContact O-CB 3.44Å; D538-A541 PolarHBondContact O-N 3.03Å; D538-A541 WeakPolarHBondContact OD1-CA 3.47Å; D538-A541 WeakPolarHBondContact OD1-CB 3.42Å; D538-A541 PolarHBondContact OD1-N 2.88Å; D538-L542 WeakPolarHBondContact O-CG 3.47Å; D538-L542 PolarHBondContact O-N 3.21Å; D538-L542 VanDerWaalsContact O-N 3.13Å
539	L	89.8	Confident	82.3	Confident	4 Å²	4	37.1 Å²	37.1	2%	0.021	20%	0.204	C	C	.	.	H	α-helix	trans	-61.9	-42.2	178.9	-178.2	60.3	0	0	0	113.2	A541 L542 V543 L640 P672 P713	L539-A541 VanDerWaalsContact C-N 3.3Å; L539-A541 PolarHBondContact O-N 3.09Å; L539-L542 PolarHBondContact O-N 3.4Å; L539-V543 HydrophobicContact CD1-CG2 4.22Å; L539-V543 HydrophobicContact CG-CG2 4.42Å; L539-V543 WeakPolarHBondContact O-CG2 3.41Å; L539-V543 PolarHBondContact O-N 3.34Å; L539-L640 HydrophobicContact CD1-CD2 3.96Å; L539-P672 HydrophobicContact CD2-CG 3.56Å; L539-P713 VanDerWaalsContact CD2-O 3.31Å; L539-P713 WeakPolarHBondContact CD2-O 3.33Å
540	P	90.3	Very high	84.2	Confident	26 Å²	26	34 Å²	34	17%	0.169	19%	0.187	C	C	.	.	H	α-helix	trans	-54.3	-42.3	171.6	-23.8	30.7	0	0	0	113.3	D538 L542 V543 N544 F714	D538-P540 WeakPolarHBondContact OD1-CD 3.48Å; P540-L542 VanDerWaalsContact C-N 3.3Å; P540-L542 PolarHBondContact O-N 3.02Å; P540-V543 PolarHBondContact O-N 3.08Å; P540-N544 PolarHBondContact O-N 3.27Å; P540-N544 PolarHBondContact O-ND2 3.13Å; P540-F714 WeakPolarHBondContact CD-O 3.23Å; P540-F714 WeakPolarHBondContact CG-O 3.18Å
541	A	91.5	Very high	86.1	Confident	9 Å²	9	34.1 Å²	34.1	7%	0.074	18%	0.184	C	C	.	.	H	α-helix	trans	-63	-33.5	176	0	0	0	0	0	112.9	L537 D538 L539 I545 R581	L537-A541 HydrophobicContact CB-CB 4.23Å; L537-A541 HydrophobicContact CD2-CB 4.24Å; D538-A541 WeakPolarHBondContact O-CB 3.44Å; D538-A541 PolarHBondContact O-N 3.03Å; D538-A541 WeakPolarHBondContact OD1-CA 3.47Å; D538-A541 WeakPolarHBondContact OD1-CB 3.42Å; D538-A541 PolarHBondContact OD1-N 2.88Å; L539-A541 VanDerWaalsContact C-N 3.3Å; L539-A541 PolarHBondContact O-N 3.09Å; A541-I545 WeakPolarHBondContact O-CG1 3.43Å; A541-I545 PolarHBondContact O-N 2.74Å; A541-R581 PolarHBondContact O-NH1 3.4Å
542	L	93.9	Very high	87.7	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-78	-37.8	176.3	-64.4	177.8	0	0	0	112.1	L475 L537 D538 L539 P540 I545 M546 V639 L642 F718	L475-L542 HydrophobicContact CD2-CD2 3.85Å; L537-L542 HydrophobicContact CB-CD2 4Å; L537-L542 HydrophobicContact CB-CG 4.32Å; L537-L542 HydrophobicContact CD1-CD2 3.91Å; D538-L542 WeakPolarHBondContact O-CG 3.47Å; D538-L542 PolarHBondContact O-N 3.21Å; D538-L542 VanDerWaalsContact O-N 3.13Å; L539-L542 PolarHBondContact O-N 3.4Å; P540-L542 VanDerWaalsContact C-N 3.3Å; P540-L542 PolarHBondContact O-N 3.02Å; L542-I545 HydrophobicContact CD2-CD1 4.25Å; L542-I545 WeakPolarHBondContact O-CB 3.46Å; L542-I545 PolarHBondContact O-N 3.02Å; L542-M546 HydrophobicContact CB-CE 4.13Å; L542-M546 WeakPolarHBondContact O-CE 3.43Å; L542-M546 WeakPolarHBondContact O-CG 3.12Å; L542-M546 PolarHBondContact O-N 3.44Å; L542-V639 HydrophobicContact CB-CG1 3.91Å; L542-V639 HydrophobicContact CD2-CG1 3.75Å; L542-V639 HydrophobicContact CG-CG1 4.34Å; L542-L642 HydrophobicContact CD1-CD2 4.19Å; L542-L642 HydrophobicContact CD2-CD2 3.97Å; L542-F718 HydrophobicContact CD1-CD2 3.3Å; L542-F718 HydrophobicContact CD1-CE2 3.28Å; L542-F718 HydrophobicContact CD1-CG 4.07Å; L542-F718 HydrophobicContact CD1-CZ 4.06Å
543	V	94.3	Very high	89.4	Confident	2 Å²	2	29.3 Å²	29.3	1%	0.012	16%	0.155	C	C	.	.	H	α-helix	trans	-65.6	-38.7	174.5	-178.6	0	0	0	0	111.1	L539 P540 I545 M546 R547 M700 F703 I704 F714	L539-V543 HydrophobicContact CD1-CG2 4.22Å; L539-V543 HydrophobicContact CG-CG2 4.42Å; L539-V543 WeakPolarHBondContact O-CG2 3.41Å; L539-V543 PolarHBondContact O-N 3.34Å; P540-V543 PolarHBondContact O-N 3.08Å; V543-I545 VanDerWaalsContact C-N 3.33Å; V543-I545 PolarHBondContact O-N 3.25Å; V543-M546 HydrophobicContact CG2-CE 4.29Å; V543-M546 PolarHBondContact O-N 2.72Å; V543-M546 VanDerWaalsContact O-N 3.15Å; V543-R547 PolarHBondContact O-N 3.07Å; V543-M700 HydrophobicContact CG1-SD 4.31Å; V543-F703 HydrophobicContact CG1-CB 3.93Å; V543-I704 HydrophobicContact CB-CG1 4.36Å; V543-I704 HydrophobicContact CG1-CD1 4.27Å; V543-I704 HydrophobicContact CG1-CG1 3.68Å; V543-F714 HydrophobicContact CG2-CD1 4.29Å
544	N	94.1	Very high	90.8	Very high	50 Å²	50	28.3 Å²	28.3	27%	0.267	15%	0.151	S	C	.	.	H	α-helix	trans	-60.1	-40.1	171.9	-82.3	-85	0	0	0	112.4	P540 R547 D548	P540-N544 PolarHBondContact O-N 3.27Å; P540-N544 PolarHBondContact O-ND2 3.13Å; N544-R547 PolarHBondContact O-N 3.44Å; N544-R547 PolarHBondContact OD1-NH2 3.42Å; N544-D548 PolarHBondContact O-N 3.4Å
545	I	96.2	Very high	92.3	Very high	1 Å²	1	25.2 Å²	25.2	1%	0.005	13%	0.128	C	C	.	.	H	α-helix	trans	-60.5	-45.8	172.5	-73.5	164.6	0	0	0	111	L471 L537 A541 L542 V543 D548 I549 V583 V639	L471-I545 HydrophobicContact CD1-CD1 4.08Å; L471-I545 HydrophobicContact CD1-CG2 3.91Å; L471-I545 HydrophobicContact CD2-CG2 3.65Å; L471-I545 HydrophobicContact CG-CG2 4.43Å; L537-I545 HydrophobicContact CD1-CD1 4.28Å; A541-I545 WeakPolarHBondContact O-CG1 3.43Å; A541-I545 PolarHBondContact O-N 2.74Å; L542-I545 HydrophobicContact CD2-CD1 4.25Å; L542-I545 WeakPolarHBondContact O-CB 3.46Å; L542-I545 PolarHBondContact O-N 3.02Å; V543-I545 VanDerWaalsContact C-N 3.33Å; V543-I545 PolarHBondContact O-N 3.25Å; I545-D548 PolarHBondContact O-N 3.43Å; I545-I549 HydrophobicContact CG2-CD1 4.03Å; I545-I549 WeakPolarHBondContact O-CG1 3.42Å; I545-I549 PolarHBondContact O-N 2.74Å; I545-V583 HydrophobicContact CB-CG2 4.27Å; I545-V583 HydrophobicContact CG1-CG2 3.82Å; I545-V583 HydrophobicContact CG2-CG2 4.1Å; I545-V639 HydrophobicContact CB-CG1 4.33Å; I545-V639 HydrophobicContact CG2-CG1 3.98Å; I545-V639 HydrophobicContact CG2-CG2 3.77Å
546	M	97.8	Very high	93.3	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-63.7	-40.9	179.5	-70.3	-179.2	-103.2	0	0	111.7	L542 V543 I549 C550 Y632 C636 V639 L640 L675 M700	L542-M546 HydrophobicContact CB-CE 4.13Å; L542-M546 WeakPolarHBondContact O-CE 3.43Å; L542-M546 WeakPolarHBondContact O-CG 3.12Å; L542-M546 PolarHBondContact O-N 3.44Å; V543-M546 HydrophobicContact CG2-CE 4.29Å; V543-M546 PolarHBondContact O-N 2.72Å; V543-M546 VanDerWaalsContact O-N 3.15Å; M546-I549 PolarHBondContact O-N 3.48Å; M546-C550 WeakPolarHBondContact O-CB 3.2Å; M546-C550 PolarHBondContact O-N 3.19Å; M546-Y632 PolarHBondContact O-OH 2.97Å; M546-Y632 VanDerWaalsContact O-OH 3.13Å; M546-C636 HydrophobicContact CG-CB 4.21Å; M546-C636 HydrophobicContact SD-CB 3.64Å; M546-V639 HydrophobicContact CE-CG1 4.06Å; M546-V639 HydrophobicContact CG-CB 4.23Å; M546-V639 HydrophobicContact CG-CG1 4.06Å; M546-V639 HydrophobicContact CG-CG2 4.46Å; M546-L640 HydrophobicContact CE-CD1 4.25Å; M546-L640 HydrophobicContact CE-CD2 3.74Å; M546-L640 HydrophobicContact CE-CG 3.7Å; M546-L640 HydrophobicContact SD-CD1 4.3Å; M546-L640 HydrophobicContact SD-CG 4.24Å; M546-L675 HydrophobicContact CE-CD2 4.2Å; M546-M700 HydrophobicContact CB-SD 3.91Å
547	R	97	Very high	94	Very high	53 Å²	53	19 Å²	19	20%	0.2	10%	0.096	C	C	.	.	H	α-helix	trans	-61.8	-46.9	175	-170.5	-169.2	55.8	-161.8	-9.3	112.4	V543 N544 I549 C550 H551 M700 D701 I704	V543-R547 PolarHBondContact O-N 3.07Å; N544-R547 PolarHBondContact O-N 3.44Å; N544-R547 PolarHBondContact OD1-NH2 3.42Å; R547-I549 VanDerWaalsContact C-N 3.3Å; R547-I549 PolarHBondContact O-N 3.25Å; R547-C550 CarbonylContact O-C 3.49Å; R547-C550 WeakPolarHBondContact O-CA 3.24Å; R547-C550 VanDerWaalsContact O-CB 3.32Å; R547-C550 WeakPolarHBondContact O-CB 3.32Å; R547-C550 PolarHBondContact O-N 3.29Å; R547-H551 WeakPolarHBondContact CD-NE2 3.41Å; R547-H551 WeakPolarHBondContact CG-NE2 3.34Å; R547-H551 PolarHBondContact O-CD2 3.21Å; R547-H551 PolarHBondContact O-N 3.18Å; R547-M700 HydrophobicContact CB-CB 3.88Å; R547-M700 HydrophobicContact CG-CB 3.96Å; R547-D701 WeakPolarHBondContact CD-OD1 3.4Å; R547-D701 IonicContact CZ-OD1 2.77Å; R547-D701 IonicContact NE-OD1 2.81Å; R547-D701 IonicContact NH1-OD1 3.56Å; R547-D701 PolarHBondContact NH1-OD1 2.81Å; R547-I704 HydrophobicContact CB-CD1 4.06Å; R547-I704 HydrophobicContact CG-CD1 4.43Å; R547-I704 VanDerWaalsContact CZ-CD1 3.48Å
548	D	97.2	Very high	94.3	Very high	21 Å²	21	24.1 Å²	24.1	11%	0.112	12%	0.12	C	C	.	.	H	α-helix	trans	-55.1	-47.1	178.6	-83.9	1.4	0	0	0	111.3	N444 N544 I545 C550 H551 G552 I582 V583	N444-D548 WeakPolarHBondContact CB-O 3.21Å; N444-D548 WeakPolarHBondContact ND2-CA 3.48Å; N444-D548 WeakPolarHBondContact ND2-CB 3.18Å; N444-D548 PolarHBondContact ND2-O 3.24Å; N444-D548 PolarHBondContact ND2-OD1 3.04Å; N544-D548 PolarHBondContact O-N 3.4Å; I545-D548 PolarHBondContact O-N 3.43Å; D548-C550 VanDerWaalsContact C-N 3.34Å; D548-C550 PolarHBondContact O-N 2.87Å; D548-H551 PolarHBondContact O-N 3.12Å; D548-G552 PolarHBondContact O-N 2.93Å; D548-I582 WeakPolarHBondContact OD2-CA 3.42Å; D548-V583 HydrophobicContact CB-CB 3.86Å; D548-V583 PolarHBondContact OD2-N 3.39Å
549	I	97.9	Very high	94.3	Very high	2 Å²	2	24.7 Å²	24.7	1%	0.01	12%	0.12	C	C	.	.	H	α-helix	trans	-61.4	-44.5	174.8	-60.9	166.7	0	0	0	110.3	L471 I545 M546 R547 H551 G552 C553 V583 L585 Y632 T635	L471-I549 HydrophobicContact CD2-CD1 3.74Å; I545-I549 HydrophobicContact CG2-CD1 4.03Å; I545-I549 WeakPolarHBondContact O-CG1 3.42Å; I545-I549 PolarHBondContact O-N 2.74Å; M546-I549 PolarHBondContact O-N 3.48Å; R547-I549 VanDerWaalsContact C-N 3.3Å; R547-I549 PolarHBondContact O-N 3.25Å; I549-H551 PolarHBondContact O-N 3.15Å; I549-G552 PolarHBondContact O-N 3.23Å; I549-C553 PolarHBondContact O-N 3.24Å; I549-C553 PolarHBondContact O-SG 3.07Å; I549-V583 HydrophobicContact CD1-CG1 4.4Å; I549-V583 HydrophobicContact CG1-CG1 3.88Å; I549-L585 HydrophobicContact CG2-CD2 4.17Å; I549-Y632 HydrophobicContact CB-CE2 4.19Å; I549-Y632 HydrophobicContact CG2-CD2 3.8Å; I549-Y632 HydrophobicContact CG2-CE2 3.93Å; I549-T635 HydrophobicContact CD1-CG2 4.01Å
550	C	98.2	Very high	94.1	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-60.6	-42.8	-179.5	-162.1	0	0	0	0	113	M546 R547 D548 C553 C554 Y632 L696	M546-C550 WeakPolarHBondContact O-CB 3.2Å; M546-C550 PolarHBondContact O-N 3.19Å; R547-C550 CarbonylContact O-C 3.49Å; R547-C550 WeakPolarHBondContact O-CA 3.24Å; R547-C550 VanDerWaalsContact O-CB 3.32Å; R547-C550 WeakPolarHBondContact O-CB 3.32Å; R547-C550 PolarHBondContact O-N 3.29Å; D548-C550 VanDerWaalsContact C-N 3.34Å; D548-C550 PolarHBondContact O-N 2.87Å; C550-C553 PolarHBondContact O-N 3.34Å; C550-C554 WeakPolarHBondContact O-CB 3.49Å; C550-C554 PolarHBondContact O-N 2.89Å; C550-Y632 HydrophobicContact CB-CE2 3.85Å; C550-Y632 WeakPolarHBondContact CB-OH 3.49Å; C550-L696 WeakPolarHBondContact SG-CB 3.36Å
551	H	97.7	Very high	93.7	Very high	58 Å²	58	30 Å²	30	27%	0.269	14%	0.141	S	C	.	.	H	α-helix	trans	-64.8	-38.9	175.6	-75.4	-59.7	0	0	0	112.1	N444 R547 D548 I549 C553 C554 Y555 C697	N444-H551 WeakPolarHBondContact OD1-CB 3.3Å; R547-H551 WeakPolarHBondContact CD-NE2 3.41Å; R547-H551 WeakPolarHBondContact CG-NE2 3.34Å; R547-H551 PolarHBondContact O-CD2 3.21Å; R547-H551 PolarHBondContact O-N 3.18Å; D548-H551 PolarHBondContact O-N 3.12Å; I549-H551 PolarHBondContact O-N 3.15Å; H551-C553 VanDerWaalsContact C-N 3.33Å; H551-C553 PolarHBondContact O-N 3.34Å; H551-C554 PolarHBondContact O-N 3.01Å; H551-Y555 PolarHBondContact O-N 3.12Å; H551-Y555 VanDerWaalsContact O-N 3.1Å; H551-C697 PolarHBondContact ND1-SG 3.14Å; H551-C697 VanDerWaalsContact ND1-SG 3.45Å
552	G	96.5	Very high	93.4	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-57.8	-45.9	171.7	0	0	0	0	0	111.8	D548 I549 L556	D548-G552 PolarHBondContact O-N 2.93Å; I549-G552 PolarHBondContact O-N 3.23Å; G552-L556 WeakPolarHBondContact O-CG 3.28Å; G552-L556 PolarHBondContact O-N 2.85Å
553	C	96.5	Very high	93	Very high	2 Å²	2	30.9 Å²	30.9	1%	0.014	15%	0.146	C	C	.	.	H	α-helix	trans	-69.1	-36.2	177.4	-61.4	0	0	0	0	113.5	I549 C550 H551 L556 E557 F693	I549-C553 PolarHBondContact O-N 3.24Å; I549-C553 PolarHBondContact O-SG 3.07Å; C550-C553 PolarHBondContact O-N 3.34Å; H551-C553 VanDerWaalsContact C-N 3.33Å; H551-C553 PolarHBondContact O-N 3.34Å; C553-L556 PolarHBondContact O-N 3.15Å; C553-E557 PolarHBondContact O-N 3.37Å; C553-F693 HydrophobicContact CB-CD1 3.39Å; C553-F693 HydrophobicContact CB-CD2 3.89Å; C553-F693 HydrophobicContact CB-CE1 3.29Å; C553-F693 HydrophobicContact CB-CE2 3.78Å; C553-F693 HydrophobicContact CB-CG 3.7Å; C553-F693 HydrophobicContact CB-CZ 3.48Å; C553-F693 VanDerWaalsContact CB-CZ 3.48Å
554	C	96.9	Very high	92.7	Very high	13 Å²	13	33 Å²	33	9%	0.088	15%	0.154	C	C	.	.	H	α-helix	trans	-61.1	-47.3	176.9	-165.2	0	0	0	0	111.2	C550 H551 L556 E557 E558 F693	C550-C554 WeakPolarHBondContact O-CB 3.49Å; C550-C554 PolarHBondContact O-N 2.89Å; H551-C554 PolarHBondContact O-N 3.01Å; C554-L556 VanDerWaalsContact C-N 3.32Å; C554-L556 PolarHBondContact O-N 3.45Å; C554-E557 PolarHBondContact O-N 2.91Å; C554-E558 WeakPolarHBondContact O-CG 3.21Å; C554-E558 PolarHBondContact O-N 3.04Å; C554-E558 PolarHBondContact SG-OE1 2.82Å; C554-F693 HydrophobicContact CB-CB 3.83Å
555	Y	95.9	Very high	92.4	Very high	36 Å²	36	31.2 Å²	31.2	14%	0.141	14%	0.144	C	C	.	.	H	α-helix	trans	-58.2	-42.7	173.2	170.9	-94.1	0	0	0	111.9	Y440 Q441 H442 I445 H551 E558 Q559	Y440-Y555 HydrophobicContact CD1-CE1 4.24Å; Q441-Y555 PolarHBondContact N-OH 3.34Å; Q441-Y555 VanDerWaalsContact N-OH 3.16Å; Q441-Y555 PolarHBondContact O-OH 3.5Å; H442-Y555 HydrophobicContact CB-CD1 3.66Å; H442-Y555 HydrophobicContact CB-CD2 4.08Å; H442-Y555 HydrophobicContact CB-CE1 3.95Å; H442-Y555 HydrophobicContact CB-CE2 4.35Å; H442-Y555 HydrophobicContact CB-CG 3.72Å; H442-Y555 AromaticContact CD2-CD2 3.85Å; H442-Y555 AromaticContact CD2-CG 3.9Å; H442-Y555 AromaticContact CG-CG 3.73Å; I445-Y555 HydrophobicContact CD1-CD1 3.52Å; I445-Y555 HydrophobicContact CD1-CE1 3.79Å; H551-Y555 PolarHBondContact O-N 3.12Å; H551-Y555 VanDerWaalsContact O-N 3.1Å; Y555-E558 PolarHBondContact O-N 3.13Å; Y555-Q559 HydrophobicContact CD1-CG 4.36Å; Y555-Q559 HydrophobicContact CD2-CG 4.26Å; Y555-Q559 HydrophobicContact CE1-CG 3.97Å; Y555-Q559 HydrophobicContact CE2-CG 3.85Å; Y555-Q559 VanDerWaalsContact O-CG 3.27Å; Y555-Q559 WeakPolarHBondContact O-CG 3.41Å; Y555-Q559 PolarHBondContact O-N 3.33Å
556	L	91.3	Very high	92.3	Very high	3 Å²	3	31.2 Å²	31.2	2%	0.016	14%	0.144	C	C	.	.	H	α-helix	trans	-65.3	-39.5	176.8	-65.1	176.1	0	0	0	112.4	Y440 I445 G552 C553 C554 Q559 H560 F561 H563 L585 F588	Y440-L556 HydrophobicContact CD1-CD2 4.28Å; Y440-L556 HydrophobicContact CG-CD2 4.19Å; I445-L556 HydrophobicContact CD1-CD1 4.48Å; I445-L556 HydrophobicContact CD1-CD2 3.71Å; I445-L556 HydrophobicContact CD1-CG 4.02Å; G552-L556 WeakPolarHBondContact O-CG 3.28Å; G552-L556 PolarHBondContact O-N 2.85Å; C553-L556 PolarHBondContact O-N 3.15Å; C554-L556 VanDerWaalsContact C-N 3.32Å; C554-L556 PolarHBondContact O-N 3.45Å; L556-Q559 CarbonylContact O-C 3.5Å; L556-Q559 PolarHBondContact O-N 3.25Å; L556-H560 PolarHBondContact O-N 3.13Å; L556-H560 VanDerWaalsContact O-N 3.13Å; L556-F561 HydrophobicContact CB-CB 4.42Å; L556-F561 HydrophobicContact CB-CD1 4.28Å; L556-F561 HydrophobicContact CD1-CD1 4.16Å; L556-F561 HydrophobicContact CD2-CB 4.35Å; L556-F561 HydrophobicContact CD2-CD1 3.73Å; L556-F561 HydrophobicContact CD2-CE1 4.37Å; L556-F561 HydrophobicContact CD2-CG 4.31Å; L556-F561 HydrophobicContact CG-CD1 4.26Å; L556-F561 PolarHBondContact O-N 2.91Å; L556-H563 HydrophobicContact CD1-CB 4.29Å; L556-L585 HydrophobicContact CD1-CD1 4.02Å; L556-F588 HydrophobicContact CD1-CE1 4.06Å; L556-F588 HydrophobicContact CD2-CE1 4.23Å
557	E	90.1	Very high	92.1	Very high	32 Å²	32	31.2 Å²	31.2	15%	0.15	14%	0.144	C	C	.	.	H	α-helix	trans	-61.9	-43.6	173.8	171	162.4	-108.5	0	0	112.1	C553 C554 Q559 H560 T625 T692 F693	C553-E557 PolarHBondContact O-N 3.37Å; C554-E557 PolarHBondContact O-N 2.91Å; E557-Q559 VanDerWaalsContact C-N 3.34Å; E557-Q559 PolarHBondContact O-N 2.77Å; E557-H560 WeakPolarHBondContact O-CA 3.16Å; E557-H560 PolarHBondContact O-N 3.48Å; E557-H560 PolarHBondContact O-ND1 2.76Å; E557-T625 HydrophobicContact CB-CG2 4.1Å; E557-T625 HydrophobicContact CG-CG2 4.03Å; E557-T625 VanDerWaalsContact OE1-CB 3.25Å; E557-T625 WeakPolarHBondContact OE1-CB 3.34Å; E557-T625 PolarHBondContact OE1-OG1 2.71Å; E557-T692 WeakPolarHBondContact OE2-CB 3.33Å; E557-F693 HydrophobicContact CB-CD2 4.08Å; E557-F693 WeakPolarHBondContact OE2-CB 3.48Å; E557-F693 PolarHBondContact OE2-N 3.41Å
558	E	90.7	Very high	91.9	Very high	119 Å²	119	28.7 Å²	28.7	56%	0.556	14%	0.135	S	C	*	.	H	α-helix	trans	-63.3	-37	174.7	-72.6	166.5	-158.7	0	0	112.6	C554 Y555 H560	C554-E558 WeakPolarHBondContact O-CG 3.21Å; C554-E558 PolarHBondContact O-N 3.04Å; C554-E558 PolarHBondContact SG-OE1 2.82Å; Y555-E558 PolarHBondContact O-N 3.13Å; E558-H560 PolarHBondContact O-N 3.12Å
559	Q	87.4	Confident	91.6	Very high	88 Å²	88	31.3 Å²	31.3	41%	0.411	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.8	11	173	-57.4	-57.5	-61.8	0	0	113.5	Y440 Y555 L556 E557 F561	Y440-Q559 HydrophobicContact CD1-CB 4.03Å; Y440-Q559 HydrophobicContact CD1-CG 4.24Å; Y440-Q559 HydrophobicContact CE1-CB 3.66Å; Y440-Q559 HydrophobicContact CE1-CG 4.3Å; Y555-Q559 HydrophobicContact CD1-CG 4.36Å; Y555-Q559 HydrophobicContact CD2-CG 4.26Å; Y555-Q559 HydrophobicContact CE1-CG 3.97Å; Y555-Q559 HydrophobicContact CE2-CG 3.85Å; Y555-Q559 VanDerWaalsContact O-CG 3.27Å; Y555-Q559 WeakPolarHBondContact O-CG 3.41Å; Y555-Q559 PolarHBondContact O-N 3.33Å; L556-Q559 CarbonylContact O-C 3.5Å; L556-Q559 PolarHBondContact O-N 3.25Å; E557-Q559 VanDerWaalsContact C-N 3.34Å; E557-Q559 PolarHBondContact O-N 2.77Å; Q559-F561 PolarHBondContact O-N 3.42Å
560	H	83.8	Confident	91.3	Very high	122 Å²	122	31.8 Å²	31.8	57%	0.565	15%	0.146	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.8	36.3	-179	-53.6	-49.4	0	0	0	114.7	L361 L556 E557 E558	L361-H560 HydrophobicContact CD1-CB 3.65Å; L361-H560 HydrophobicContact CD2-CB 3.65Å; L361-H560 WeakPolarHBondContact CD2-O 3.34Å; L361-H560 HydrophobicContact CG-CB 4.24Å; L556-H560 PolarHBondContact O-N 3.13Å; L556-H560 VanDerWaalsContact O-N 3.13Å; E557-H560 WeakPolarHBondContact O-CA 3.16Å; E557-H560 PolarHBondContact O-N 3.48Å; E557-H560 PolarHBondContact O-ND1 2.76Å; E558-H560 PolarHBondContact O-N 3.12Å
561	F	82.3	Confident	91.1	Very high	18 Å²	18	31.8 Å²	31.8	8%	0.079	15%	0.146	C	C	.	.			trans	-106.5	134	-179.4	-177.4	-92.4	0	0	0	111.3	L436 Y440 L556 Q559 H563 F588 A591	L436-F561 HydrophobicContact CD2-CE2 4.16Å; Y440-F561 HydrophobicContact CD2-CD2 4.18Å; Y440-F561 HydrophobicContact CD2-CE2 4.25Å; Y440-F561 HydrophobicContact CD2-CG 4.45Å; Y440-F561 HydrophobicContact CE1-CB 4.04Å; Y440-F561 HydrophobicContact CE1-CD2 4.44Å; Y440-F561 HydrophobicContact CE1-CG 4.39Å; Y440-F561 HydrophobicContact CE2-CB 4.39Å; Y440-F561 AromaticContact CE2-CD2 3.33Å; Y440-F561 HydrophobicContact CE2-CD2 3.33Å; Y440-F561 AromaticContact CE2-CE2 3.6Å; Y440-F561 HydrophobicContact CE2-CE2 3.6Å; Y440-F561 AromaticContact CE2-CG 3.9Å; Y440-F561 HydrophobicContact CE2-CG 3.9Å; Y440-F561 HydrophobicContact CE2-CZ 4.34Å; Y440-F561 AromaticContact CZ-CD2 3.49Å; Y440-F561 VanDerWaalsContact CZ-CD2 3.49Å; Y440-F561 AromaticContact CZ-CG 3.86Å; Y440-F561 WeakPolarHBondContact OH-CD2 3.33Å; L556-F561 HydrophobicContact CB-CB 4.42Å; L556-F561 HydrophobicContact CB-CD1 4.28Å; L556-F561 HydrophobicContact CD1-CD1 4.16Å; L556-F561 HydrophobicContact CD2-CB 4.35Å; L556-F561 HydrophobicContact CD2-CD1 3.73Å; L556-F561 HydrophobicContact CD2-CE1 4.37Å; L556-F561 HydrophobicContact CD2-CG 4.31Å; L556-F561 HydrophobicContact CG-CD1 4.26Å; L556-F561 PolarHBondContact O-N 2.91Å; Q559-F561 PolarHBondContact O-N 3.42Å; F561-H563 HydrophobicContact CE1-CB 4.4Å; F561-F588 AromaticContact CE1-CD1 3.58Å; F561-F588 HydrophobicContact CE1-CD1 3.58Å; F561-F588 AromaticContact CE1-CE1 3.99Å; F561-F588 HydrophobicContact CE1-CE1 3.99Å; F561-F588 HydrophobicContact CE1-CG 4.46Å; F561-F588 HydrophobicContact CZ-CB 4.26Å; F561-F588 AromaticContact CZ-CD1 3.8Å; F561-F588 HydrophobicContact CZ-CD1 3.8Å; F561-F588 HydrophobicContact CZ-CG 4.26Å; F561-A591 HydrophobicContact CE1-CB 4.21Å; F561-A591 HydrophobicContact CE2-CB 3.75Å; F561-A591 HydrophobicContact CZ-CB 3.29Å
562	V	85.4	Confident	90.9	Very high	28 Å²	28	30.9 Å²	30.9	17%	0.17	14%	0.143	C	C	.	.			trans	-108.5	118	177.8	-172.2	0	0	0	0	109	R564 F623 T624 T625 D628	V562-R564 HydrophobicContact CB-CG 4.44Å; V562-R564 HydrophobicContact CG1-CG 3.76Å; V562-F623 HydrophobicContact CG1-CB 4.27Å; V562-T624 WeakPolarHBondContact CG1-O 3.11Å; V562-T625 HydrophobicContact CG2-CG2 4.37Å; V562-D628 WeakPolarHBondContact CA-OD2 3.05Å; V562-D628 WeakPolarHBondContact CG1-OD2 3.5Å
563	H	86.5	Confident	90.8	Very high	1 Å²	1	30.9 Å²	30.9	1%	0.005	14%	0.143	C	C	.	.			trans	-78.5	-34.8	-174.1	-167.6	-40.9	0	0	0	113	L556 F561 D565 I566 C586 D628	L556-H563 HydrophobicContact CD1-CB 4.29Å; F561-H563 HydrophobicContact CE1-CB 4.4Å; H563-D565 PolarHBondContact O-N 3.05Å; H563-I566 HydrophobicContact CB-CD1 4.24Å; H563-I566 HydrophobicContact CB-CG1 3.9Å; H563-C586 PolarHBondContact NE2-O 3.39Å; H563-D628 PolarHBondContact N-OD2 2.88Å
564	R	88.1	Confident	90.5	Very high	46 Å²	46	31.1 Å²	31.1	17%	0.174	14%	0.144	C	C	.	.	S	Bend	trans	63.2	-10.4	176	-48.7	-174.2	-168.7	154.2	15.1	117.7	V562 R592 F623 D628	V562-R564 HydrophobicContact CB-CG 4.44Å; V562-R564 HydrophobicContact CG1-CG 3.76Å; R564-R592 PolarHBondContact NH1-O 2.91Å; R564-R592 PolarHBondContact NH2-O 2.99Å; R564-F623 HydrophobicContact CB-CD1 3.8Å; R564-F623 HydrophobicContact CB-CE1 4.04Å; R564-F623 HydrophobicContact CB-CG 4.42Å; R564-F623 HydrophobicContact CG-CB 3.91Å; R564-F623 HydrophobicContact CG-CD1 3.69Å; R564-F623 HydrophobicContact CG-CE1 4.38Å; R564-F623 HydrophobicContact CG-CG 3.87Å; R564-D628 WeakPolarHBondContact CA-OD1 3.48Å; R564-D628 PolarHBondContact N-OD1 3.22Å
565	D	87.4	Confident	90.1	Very high	13 Å²	13	34 Å²	34	7%	0.07	16%	0.156	C	C	.	.			trans	-139	48.8	178.5	-161	27.2	0	0	0	112.4	H563 A567 R569 N570 L590 P609	H563-D565 PolarHBondContact O-N 3.05Å; D565-A567 PolarHBondContact O-N 2.71Å; D565-R569 IonicContact OD1-CZ 2.71Å; D565-R569 IonicContact OD1-NH2 3.69Å; D565-R569 PolarHBondContact OD1-NH2 3.26Å; D565-R569 IonicContact OD2-CZ 3.36Å; D565-R569 IonicContact OD2-NH2 3.52Å; D565-R569 PolarHBondContact OD2-NH2 3.15Å; D565-N570 PolarHBondContact O-ND2 2.73Å; D565-N570 PolarHBondContact OD2-ND2 3.01Å; D565-L590 HydrophobicContact CB-CB 4.4Å; D565-L590 HydrophobicContact CB-CD1 3.8Å; D565-P609 WeakPolarHBondContact OD1-CB 3.41Å; D565-P609 VanDerWaalsContact OD1-CG 3.28Å; D565-P609 WeakPolarHBondContact OD1-CG 3.22Å
566	I	93.2	Very high	89.3	Confident	1 Å²	1	38.5 Å²	38.5	1%	0.005	18%	0.183	C	C	.	.			trans	-72.2	115.8	171.5	-60.3	165.4	0	0	0	108.1	H563 W612 D628 A631 T635 F693	H563-I566 HydrophobicContact CB-CD1 4.24Å; H563-I566 HydrophobicContact CB-CG1 3.9Å; I566-W612 VanDerWaalsContact O-CD1 3.32Å; I566-D628 HydrophobicContact CD1-CB 3.52Å; I566-A631 HydrophobicContact CB-CB 4.04Å; I566-T635 PolarHBondContact O-OG1 3.36Å; I566-F693 HydrophobicContact CD1-CZ 4.39Å
567	A	93.5	Very high	88.8	Confident	0 Å²	0	42 Å²	42	0%	0	20%	0.199	C	C	.	.			trans	-158.7	156.6	-179.6	0	0	0	0	0	110.1	D565 R569 N570 C571 W612 T635	D565-A567 PolarHBondContact O-N 2.71Å; A567-R569 HydrophobicContact CB-CG 3.99Å; A567-R569 PolarHBondContact O-N 2.68Å; A567-N570 PolarHBondContact O-N 3.12Å; A567-C571 PolarHBondContact O-N 2.88Å; A567-C571 PolarHBondContact O-SG 2.76Å; A567-W612 HydrophobicContact CB-CD2 4.17Å; A567-W612 HydrophobicContact CB-CG 4.22Å; A567-W612 HydrophobicContact CB-CZ2 4.28Å; A567-T635 VanDerWaalsContact CA-OG1 3.29Å; A567-T635 WeakPolarHBondContact CA-OG1 3.02Å; A567-T635 PolarHBondContact N-OG1 3.2Å
568	A	93.4	Very high	88	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	23%	0.232	C	C	.	.	G	3₁₀ helix	trans	-63.3	-18.1	-179	0	0	0	0	0	113.8	L471 R472 T635 E638	L471-A568 WeakPolarHBondContact CB-O 3.32Å; L471-A568 HydrophobicContact CD2-CB 4.31Å; L471-A568 HydrophobicContact CG-CB 4.4Å; L471-A568 PolarHBondContact N-O 3.25Å; R472-A568 HydrophobicContact CB-CB 4.11Å; R472-A568 PolarHBondContact N-O 2.77Å; A568-T635 HydrophobicContact CB-CG2 4.32Å; A568-E638 HydrophobicContact CB-CB 3.98Å; A568-E638 HydrophobicContact CB-CG 4.44Å; A568-E638 WeakPolarHBondContact CB-OE2 3.49Å; A568-E638 PolarHBondContact N-OE2 2.91Å
569	R	90.6	Very high	87.1	Confident	75 Å²	75	44.5 Å²	44.5	28%	0.283	23%	0.233	S	C	.	.	G	3₁₀ helix	trans	-75.7	-23.5	172.6	65.2	176.7	-167.9	-79.4	-4.5	114.1	D565 A567	D565-R569 IonicContact OD1-CZ 2.71Å; D565-R569 IonicContact OD1-NH2 3.69Å; D565-R569 PolarHBondContact OD1-NH2 3.26Å; D565-R569 IonicContact OD2-CZ 3.36Å; D565-R569 IonicContact OD2-NH2 3.52Å; D565-R569 PolarHBondContact OD2-NH2 3.15Å; A567-R569 HydrophobicContact CB-CG 3.99Å; A567-R569 PolarHBondContact O-N 2.68Å
570	N	91.1	Very high	87	Confident	13 Å²	13	42.2 Å²	42.2	7%	0.07	23%	0.233	C	C	.	.	G	3₁₀ helix	trans	-102.4	13.6	179.9	-63.6	-10	0	0	0	111.8	D565 A567 C586	D565-N570 PolarHBondContact O-ND2 2.73Å; D565-N570 PolarHBondContact OD2-ND2 3.01Å; A567-N570 PolarHBondContact O-N 3.12Å; N570-C586 PolarHBondContact O-N 3.08Å; N570-C586 PolarHBondContact O-SG 2.92Å
571	C	94	Very high	87.4	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	133	167.4	-57.4	0	0	0	0	107.8	N470 L471 A567 V583 K584	N470-C571 CarbonylContact C-O 3.58Å; N470-C571 VanDerWaalsContact CA-O 3.31Å; N470-C571 WeakPolarHBondContact CA-O 3.36Å; L471-C571 HydrophobicContact CB-CB 3.86Å; L471-C571 HydrophobicContact CD2-CB 3.95Å; L471-C571 PolarHBondContact N-O 2.91Å; A567-C571 PolarHBondContact O-N 2.88Å; A567-C571 PolarHBondContact O-SG 2.76Å; C571-V583 HydrophobicContact CB-CG1 3.81Å; C571-K584 CarbonylContact C-O 3.52Å; C571-K584 WeakPolarHBondContact CA-O 3.35Å
572	L	94.1	Very high	88	Confident	39 Å²	39	38.3 Å²	38.3	20%	0.204	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	151.9	173.2	-56.8	-171.2	0	0	0	111	V446 M466 G469 N470 V583 K584 C586	V446-L572 HydrophobicContact CG2-CB 4.28Å; V446-L572 HydrophobicContact CG2-CD1 3.98Å; V446-L572 HydrophobicContact CG2-CG 4.26Å; M466-L572 HydrophobicContact CB-CB 3.63Å; M466-L572 HydrophobicContact CB-CD1 3.91Å; M466-L572 HydrophobicContact CB-CG 4.39Å; M466-L572 HydrophobicContact CE-CB 3.99Å; M466-L572 VanDerWaalsContact CE-O 3.28Å; M466-L572 WeakPolarHBondContact CE-O 3.48Å; M466-L572 HydrophobicContact CG-CB 3.68Å; M466-L572 HydrophobicContact CG-CD1 3.87Å; M466-L572 HydrophobicContact CG-CG 4.43Å; G469-L572 CarbonylContact O-C 3.37Å; G469-L572 WeakPolarHBondContact O-CA 3.41Å; N470-L572 HydrophobicContact CB-CD2 4.05Å; L572-V583 WeakPolarHBondContact O-CA 3.42Å; L572-K584 PolarHBondContact N-O 3.27Å; L572-K584 PolarHBondContact O-N 3.08Å; L572-C586 HydrophobicContact CD1-CB 4.37Å; L572-C586 HydrophobicContact CG-CB 4.22Å
573	V	94.1	Very high	88.5	Confident	0 Å²	0	37 Å²	37	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	140.3	-177.2	-172.6	0	0	0	0	110	M466 Q468 G469 L471 Y474 R581 I582 V583	M466-V573 CarbonylContact C-O 3.58Å; Q468-V573 HydrophobicContact CB-CB 3.9Å; Q468-V573 HydrophobicContact CB-CG1 4.06Å; Q468-V573 WeakPolarHBondContact CB-O 3.49Å; Q468-V573 HydrophobicContact CG-CG1 4.47Å; Q468-V573 PolarHBondContact N-O 2.82Å; Q468-V573 VanDerWaalsContact N-O 3.09Å; G469-V573 PolarHBondContact O-N 3.44Å; L471-V573 HydrophobicContact CB-CG2 3.76Å; L471-V573 HydrophobicContact CD1-CG2 3.7Å; L471-V573 HydrophobicContact CG-CG2 4.34Å; Y474-V573 HydrophobicContact CD1-CG1 4.28Å; Y474-V573 HydrophobicContact CD1-CG2 4.3Å; Y474-V573 HydrophobicContact CD2-CG1 4.21Å; Y474-V573 HydrophobicContact CE1-CG1 4.29Å; Y474-V573 HydrophobicContact CE2-CG1 4.22Å; Y474-V573 HydrophobicContact CG-CB 4.39Å; Y474-V573 HydrophobicContact CG-CG1 4.24Å; Y474-V573 HydrophobicContact CG-CG2 4.17Å; V573-R581 HydrophobicContact CG1-CG 4.15Å; V573-I582 WeakPolarHBondContact CA-O 3.44Å; V573-V583 HydrophobicContact CG2-CG2 4.12Å
574	S	91.7	Very high	89	Confident	6 Å²	6	38 Å²	38	4%	0.042	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	146.4	169.3	-178.9	0	0	0	0	111.1	D467 N576 R581 I582	D467-S574 WeakPolarHBondContact OD1-CA 3.36Å; D467-S574 VanDerWaalsContact OD1-CB 3.23Å; D467-S574 WeakPolarHBondContact OD1-CB 3.31Å; D467-S574 PolarHBondContact OD1-OG 2.83Å; S574-N576 PolarHBondContact OG-N 2.85Å; S574-N576 VanDerWaalsContact OG-N 3.07Å; S574-R581 CarbonylContact O-C 3.46Å; S574-R581 VanDerWaalsContact O-CA 3.3Å; S574-R581 WeakPolarHBondContact O-CA 3.5Å; S574-I582 PolarHBondContact N-O 2.86Å; S574-I582 PolarHBondContact O-N 3.39Å
575	H	88.1	Confident	89.3	Confident	73 Å²	73	35.8 Å²	35.8	34%	0.338	20%	0.201	S	C	.	.	S	Bend	trans	-89.9	-8.1	169.5	-78.5	-55.2	0	0	0	113.2	D467 Q468 Y474 H577 G580	D467-H575 PolarHBondContact OD1-N 3.37Å; D467-H575 VanDerWaalsContact OD1-N 3.08Å; Q468-H575 WeakPolarHBondContact CG-CD2 3.45Å; Y474-H575 AromaticContact CE2-NE2 3.66Å; Y474-H575 AromaticContact CZ-NE2 3.9Å; Y474-H575 PolarHBondContact OH-CE1 3.35Å; Y474-H575 PolarHBondContact OH-NE2 3.36Å; H575-H577 PolarHBondContact O-N 2.85Å; H575-G580 WeakPolarHBondContact CA-O 3.27Å; H575-G580 PolarHBondContact ND1-O 2.83Å; H575-G580 CarbonylContact O-C 3.49Å
576	N	78.7	Confident	89.3	Confident	131 Å²	131	36 Å²	36	70%	0.701	20%	0.204	S	C	*	.			trans	-82.5	57	-178.3	-60.8	-37.8	0	0	0	112.2	S574	S574-N576 PolarHBondContact OG-N 2.85Å; S574-N576 VanDerWaalsContact OG-N 3.07Å
577	H	81.1	Confident	88.5	Confident	76 Å²	76	37.6 Å²	37.6	35%	0.352	21%	0.212	S	C	.	.	S	Bend	trans	-135.2	158.7	176.1	-167	-108.4	0	0	0	110.9	H575 S579 G580 I582	H575-H577 PolarHBondContact O-N 2.85Å; H577-S579 PolarHBondContact ND1-OG 3.26Å; H577-S579 PolarHBondContact O-N 3.19Å; H577-G580 WeakPolarHBondContact O-CA 3.34Å; H577-G580 PolarHBondContact O-N 3.26Å; H577-I582 HydrophobicContact CB-CB 3.86Å; H577-I582 HydrophobicContact CB-CG2 3.78Å
578	S	72.7	Confident	87.2	Confident	120 Å²	120	37.8 Å²	37.8	84%	0.839	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62	-27.4	-178	53	0	0	0	0	113.8	G580	S578-G580 VanDerWaalsContact C-N 3.27Å
579	S	72.9	Confident	85.4	Confident	85 Å²	85	39.1 Å²	39.1	59%	0.594	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.2	1.9	171.3	55.8	0	0	0	0	114.2	H577 R581	H577-S579 PolarHBondContact ND1-OG 3.26Å; H577-S579 PolarHBondContact O-N 3.19Å; S579-R581 PolarHBondContact O-N 2.8Å; S579-R581 PolarHBondContact OG-O 3.16Å
580	G	84.5	Confident	83.3	Confident	39 Å²	39	37.5 Å²	37.5	40%	0.402	22%	0.223	S	C	.	.	S	Bend	trans	73.9	-5.3	-173.8	0	0	0	0	0	115.2	H575 H577 S578	H575-G580 WeakPolarHBondContact CA-O 3.27Å; H575-G580 PolarHBondContact ND1-O 2.83Å; H575-G580 CarbonylContact O-C 3.49Å; H577-G580 WeakPolarHBondContact O-CA 3.34Å; H577-G580 PolarHBondContact O-N 3.26Å; S578-G580 VanDerWaalsContact C-N 3.27Å
581	R	92.2	Very high	81.2	Confident	50 Å²	50	37.5 Å²	37.5	19%	0.189	23%	0.225	C	C	.	.			trans	-162.3	139.6	173.8	174.2	167.4	37.2	117	11.1	111.2	A541 V573 S574 S579	A541-R581 PolarHBondContact O-NH1 3.4Å; V573-R581 HydrophobicContact CG1-CG 4.15Å; S574-R581 CarbonylContact O-C 3.46Å; S574-R581 VanDerWaalsContact O-CA 3.3Å; S574-R581 WeakPolarHBondContact O-CA 3.5Å; S579-R581 PolarHBondContact O-N 2.8Å; S579-R581 PolarHBondContact OG-O 3.16Å
582	I	94.9	Very high	78.7	Confident	8 Å²	8	43.3 Å²	43.3	4%	0.041	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	145.2	170	-170.8	163.3	0	0	0	110.7	D548 V573 S574 H577 K584	D548-I582 WeakPolarHBondContact OD2-CA 3.42Å; V573-I582 WeakPolarHBondContact CA-O 3.44Å; S574-I582 PolarHBondContact N-O 2.86Å; S574-I582 PolarHBondContact O-N 3.39Å; H577-I582 HydrophobicContact CB-CB 3.86Å; H577-I582 HydrophobicContact CB-CG2 3.78Å; I582-K584 HydrophobicContact CG1-CG 4.24Å
583	V	96.5	Very high	76.1	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	139.4	169.9	-175.7	0	0	0	0	110.3	N444 L471 I545 D548 I549 C571 L572 V573	N444-V583 PolarHBondContact ND2-O 2.88Å; L471-V583 HydrophobicContact CD2-CG1 4.19Å; I545-V583 HydrophobicContact CB-CG2 4.27Å; I545-V583 HydrophobicContact CG1-CG2 3.82Å; I545-V583 HydrophobicContact CG2-CG2 4.1Å; D548-V583 HydrophobicContact CB-CB 3.86Å; D548-V583 PolarHBondContact OD2-N 3.39Å; I549-V583 HydrophobicContact CD1-CG1 4.4Å; I549-V583 HydrophobicContact CG1-CG1 3.88Å; C571-V583 HydrophobicContact CB-CG1 3.81Å; L572-V583 WeakPolarHBondContact O-CA 3.42Å; V573-V583 HydrophobicContact CG2-CG2 4.12Å
584	K	96.2	Very high	73.3	Confident	22 Å²	22	49.2 Å²	49.2	10%	0.096	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	138.9	-179.1	-52.8	-169.3	179.2	-162.4	0	111.8	T443 N444 V446 E464 M466 C571 L572 I582	T443-K584 WeakPolarHBondContact O-CD 3.33Å; T443-K584 WeakPolarHBondContact O-CE 3.41Å; T443-K584 PolarHBondContact O-NZ 2.9Å; N444-K584 CarbonylContact O-C 3.59Å; N444-K584 VanDerWaalsContact O-CA 3.32Å; N444-K584 WeakPolarHBondContact O-CA 3.36Å; V446-K584 HydrophobicContact CG2-CB 3.83Å; E464-K584 WeakPolarHBondContact OE1-CD 3.38Å; E464-K584 WeakPolarHBondContact OE1-CE 3.42Å; E464-K584 IonicContact OE1-NZ 3.24Å; E464-K584 PolarHBondContact OE1-NZ 3.06Å; E464-K584 IonicContact OE2-NZ 3.56Å; E464-K584 PolarHBondContact OE2-NZ 2.66Å; M466-K584 HydrophobicContact CE-CB 3.95Å; M466-K584 HydrophobicContact CE-CD 3.94Å; M466-K584 HydrophobicContact CE-CG 3.69Å; M466-K584 HydrophobicContact SD-CD 4.01Å; M466-K584 HydrophobicContact SD-CG 4.43Å; C571-K584 CarbonylContact C-O 3.52Å; C571-K584 WeakPolarHBondContact CA-O 3.35Å; L572-K584 PolarHBondContact N-O 3.27Å; L572-K584 PolarHBondContact O-N 3.08Å; I582-K584 HydrophobicContact CG1-CG 4.24Å
585	L	93.9	Very high	70.3	Confident	0 Å²	0	57.1 Å²	57.1	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	144.9	171.9	-69.1	171.5	0	0	0	111.2	N444 I445 V446 I549 L556	N444-L585 PolarHBondContact O-N 3.35Å; I445-L585 HydrophobicContact CG1-CB 4.38Å; V446-L585 WeakPolarHBondContact CG2-O 3.38Å; V446-L585 PolarHBondContact N-O 2.74Å; I549-L585 HydrophobicContact CG2-CD2 4.17Å; L556-L585 HydrophobicContact CD1-CD1 4.02Å
586	C	88.5	Confident	67.8	Low	18 Å²	18	62.8 Å²	62.8	12%	0.122	33%	0.332	C	S	.	.			trans	-143.5	175.1	173.1	75.4	0	0	0	0	111.9	V446 H563 N570 L572	V446-C586 HydrophobicContact CB-CB 4.19Å; V446-C586 HydrophobicContact CG2-CB 3.77Å; H563-C586 PolarHBondContact NE2-O 3.39Å; N570-C586 PolarHBondContact O-N 3.08Å; N570-C586 PolarHBondContact O-SG 2.92Å; L572-C586 HydrophobicContact CD1-CB 4.37Å; L572-C586 HydrophobicContact CG-CB 4.22Å
587	D	75.9	Confident	65.4	Low	34 Å²	34	63.2 Å²	63.2	18%	0.182	33%	0.334	C	S	.	.			trans	67.1	67.3	168.5	-142.7	-2.2	0	0	0	115.3	F394 K418 G589	F394-D587 WeakPolarHBondContact CD2-OD1 3.46Å; F394-D587 WeakPolarHBondContact CD2-OD2 3.16Å; F394-D587 WeakPolarHBondContact CE2-OD1 3.35Å; F394-D587 WeakPolarHBondContact CE2-OD2 3.38Å; K418-D587 IonicContact NZ-OD1 3.25Å; K418-D587 PolarHBondContact NZ-OD1 3.49Å; K418-D587 VanDerWaalsContact NZ-OD1 3.1Å; D587-G589 PolarHBondContact O-N 3.41Å
588	F	67	Low	63	Low	4 Å²	4	65.4 Å²	65.4	2%	0.018	35%	0.349	C	S	.	.	G	3₁₀ helix	trans	-69.9	10.8	171.2	-53.1	-64.8	0	0	0	114	M437 I445 L556 F561 L590 A591	M437-F588 HydrophobicContact CG-CD2 3.77Å; M437-F588 HydrophobicContact CG-CE2 4.12Å; I445-F588 HydrophobicContact CD1-CZ 4.33Å; I445-F588 HydrophobicContact CG2-CE2 4.12Å; I445-F588 HydrophobicContact CG2-CZ 3.76Å; L556-F588 HydrophobicContact CD1-CE1 4.06Å; L556-F588 HydrophobicContact CD2-CE1 4.23Å; F561-F588 AromaticContact CE1-CD1 3.58Å; F561-F588 HydrophobicContact CE1-CD1 3.58Å; F561-F588 AromaticContact CE1-CE1 3.99Å; F561-F588 HydrophobicContact CE1-CE1 3.99Å; F561-F588 HydrophobicContact CE1-CG 4.46Å; F561-F588 HydrophobicContact CZ-CB 4.26Å; F561-F588 AromaticContact CZ-CD1 3.8Å; F561-F588 HydrophobicContact CZ-CD1 3.8Å; F561-F588 HydrophobicContact CZ-CG 4.26Å; F588-L590 PolarHBondContact O-N 3.27Å; F588-A591 HydrophobicContact CB-CB 4.5Å; F588-A591 VanDerWaalsContact O-CB 3.27Å; F588-A591 WeakPolarHBondContact O-CB 3.36Å; F588-A591 PolarHBondContact O-N 3.4Å
589	G	54.2	Low	60.9	Low	28 Å²	28	65.9 Å²	65.9	29%	0.289	33%	0.333	S	S	.	.	G	3₁₀ helix	trans	-61.7	-13.7	-172.9	0	0	0	0	0	115.9	D587	D587-G589 PolarHBondContact O-N 3.41Å
590	L	48.1	Very low	59	Low	41 Å²	41	68.6 Å²	68.6	22%	0.215	33%	0.331	C	S	.	.	G	3₁₀ helix	trans	-102.7	0.6	173.5	-68.6	178.8	0	0	0	114.4	D565 F588 R592	D565-L590 HydrophobicContact CB-CB 4.4Å; D565-L590 HydrophobicContact CB-CD1 3.8Å; F588-L590 PolarHBondContact O-N 3.27Å; L590-R592 PolarHBondContact O-N 3.3Å
591	A	46	Very low	56.9	Low	13 Å²	13	72.2 Å²	72.2	11%	0.107	33%	0.333	C	S	.	.			trans	-73.5	67.7	169.6	0	0	0	0	0	110.6	L436 F561 F588	L436-A591 HydrophobicContact CD1-CB 4.43Å; F561-A591 HydrophobicContact CE1-CB 4.21Å; F561-A591 HydrophobicContact CE2-CB 3.75Å; F561-A591 HydrophobicContact CZ-CB 3.29Å; F588-A591 HydrophobicContact CB-CB 4.5Å; F588-A591 VanDerWaalsContact O-CB 3.27Å; F588-A591 WeakPolarHBondContact O-CB 3.36Å; F588-A591 PolarHBondContact O-N 3.4Å
592	R	41.5	Very low	54.1	Low	123 Å²	123	77.8 Å²	77.8	46%	0.464	36%	0.358	S	S	.	.	P	Polyproline II helix	trans	-76.4	135.1	176	-69.1	-177.3	171.2	-161.8	-7.6	109.9	R564 L590 I594	R564-R592 PolarHBondContact NH1-O 2.91Å; R564-R592 PolarHBondContact NH2-O 2.99Å; L590-R592 PolarHBondContact O-N 3.3Å; R592-I594 PolarHBondContact O-N 2.96Å
593	D	40.5	Very low	51.3	Low	106 Å²	106	89 Å²	89	57%	0.567	40%	0.4	S	S	*	.	P	Polyproline II helix	trans	-52.2	123.7	159	-130.2	-18.9	0	0	0	108
594	I	34.4	Very low	48.9	Very low	57 Å²	57	96.3 Å²	96.3	29%	0.292	44%	0.439	S	S	.	.	S	Bend	trans	-70.1	153.5	173.4	-54.3	178.5	0	0	0	105.9	R592	R592-I594 PolarHBondContact O-N 2.96Å
595	Y	29.8	Very low	46.4	Very low	172 Å²	172	98.9 Å²	98.9	68%	0.675	45%	0.452	S	S	*	.			trans	76.1	53.2	-175.5	-40.6	-73.2	0	0	0	116.3	Y362	Y362-Y595 HydrophobicContact CD1-CE2 4.49Å; Y362-Y595 AromaticContact CE1-CE2 3.68Å; Y362-Y595 HydrophobicContact CE1-CE2 3.68Å; Y362-Y595 PolarHBondContact OH-OH 3.4Å
596	K	33.9	Very low	44.1	Very low	191 Å²	191	101.2 Å²	101.2	83%	0.83	47%	0.467	S	S	*	.	S	Bend	trans	-144.3	90.9	134.4	-131.8	-177.9	-176.5	-168.5	0	113.3
597	N	29.3	Very low	42.4	Very low	140 Å²	140	106.8 Å²	106.8	75%	0.749	49%	0.489	S	S	*	.	S	Bend	trans	55.8	133	164	-60.6	16.1	0	0	0	118.8
598	D	30.6	Very low	42	Very low	123 Å²	123	109.1 Å²	109.1	66%	0.658	50%	0.501	S	S	*	.			trans	68.1	87.8	156.7	-49.4	-28.1	0	0	0	116.5
599	Y	28	Very low	42.7	Very low	129 Å²	129	109.5 Å²	109.5	51%	0.506	50%	0.504	S	S	.	.			trans	-68.6	158.4	152.2	-97.8	-106.3	0	0	0	110.9	G621 F623	Y599-G621 VanDerWaalsContact CE1-CA 3.43Å; Y599-G621 PolarHBondContact OH-O 3.11Å; Y599-F623 HydrophobicContact CE1-CE2 4.21Å; Y599-F623 WeakPolarHBondContact OH-CD2 3.1Å; Y599-F623 WeakPolarHBondContact OH-CE2 3.42Å
600	Y	33.2	Very low	44.2	Very low	142 Å²	142	109 Å²	109	56%	0.557	50%	0.495	S	S	*	.	S	Bend	trans	82	102.7	168.2	-145.5	-83.8	0	0	0	117.2	K602	Y600-K602 PolarHBondContact O-N 3.47Å
601	R	40.2	Very low	46.3	Very low	115 Å²	115	109.1 Å²	109.1	43%	0.434	49%	0.493	S	S	.	.			trans	-70.5	76.2	-171.3	-156.2	-157.9	-163.7	175.8	10	114.9	R603 E605 P606	R601-R603 PolarHBondContact O-N 3.27Å; R601-E605 HydrophobicContact CB-CB 4.27Å; R601-E605 HydrophobicContact CG-CB 3.57Å; R601-E605 PolarHBondContact NE-O 3.43Å; R601-E605 PolarHBondContact NH2-O 3.44Å; R601-P606 WeakPolarHBondContact CD-O 3.11Å; R601-P606 VanDerWaalsContact NE-C 3.34Å; R601-P606 PolarHBondContact NE-O 3.47Å
602	K	34.8	Very low	48.6	Very low	167 Å²	167	109.9 Å²	109.9	73%	0.726	49%	0.493	S	S	*	.	S	Bend	trans	-80.3	98.8	167.3	-116.6	171.4	-178.5	168.6	0	110	Y600 N604	Y600-K602 PolarHBondContact O-N 3.47Å; K602-N604 VanDerWaalsContact C-N 3.28Å; K602-N604 PolarHBondContact O-N 3.38Å
603	R	35.8	Very low	51	Low	244 Å²	244	104.8 Å²	104.8	92%	0.921	47%	0.474	S	S	*	.	S	Bend	trans	57	-21	173.7	-87.9	-174.9	176.3	175.8	-0	120.8	R601	R601-R603 PolarHBondContact O-N 3.27Å
604	N	44.6	Very low	53.5	Low	153 Å²	153	99.7 Å²	99.7	82%	0.818	45%	0.447	S	S	*	.	S	Bend	trans	-134.1	9.8	-171.3	-80.9	-24.3	0	0	0	118.4	K602	K602-N604 VanDerWaalsContact C-N 3.28Å; K602-N604 PolarHBondContact O-N 3.38Å
605	E	44.9	Very low	56.3	Low	77 Å²	77	97.4 Å²	97.4	36%	0.36	44%	0.436	S	S	.	.	S	Bend	trans	-108.8	-159.3	-168.8	-99.8	165	-153.2	0	0	114.4	R601	R601-E605 HydrophobicContact CB-CB 4.27Å; R601-E605 HydrophobicContact CG-CB 3.57Å; R601-E605 PolarHBondContact NE-O 3.43Å; R601-E605 PolarHBondContact NH2-O 3.44Å
606	P	44.6	Very low	59	Low	48 Å²	48	89.6 Å²	89.6	31%	0.312	41%	0.406	S	S	.	.			trans	-81.5	156.3	-178	-16.5	32.2	0	0	0	117.5	R601 L608	R601-P606 WeakPolarHBondContact CD-O 3.11Å; R601-P606 VanDerWaalsContact NE-C 3.34Å; R601-P606 PolarHBondContact NE-O 3.47Å; P606-L608 PolarHBondContact O-N 2.99Å
607	K	53.4	Low	61.5	Low	135 Å²	135	80.7 Å²	80.7	59%	0.587	37%	0.368	S	S	*	.			trans	-74.8	109.6	175	-74.6	173.7	-177	171.9	0	110	E1031	K607-E1031 IonicContact NZ-OE1 2.65Å; K607-E1031 IonicContact NZ-OE2 3.98Å; K607-E1031 PolarHBondContact NZ-OE2 2.8Å
608	L	66.8	Low	64.2	Low	84 Å²	84	75.2 Å²	75.2	44%	0.44	34%	0.338	S	S	.	.			trans	-85.1	148	175.2	-69.4	177.7	0	0	0	113	P606 V610 M613	P606-L608 PolarHBondContact O-N 2.99Å; L608-V610 VanDerWaalsContact C-N 3.26Å; L608-V610 HydrophobicContact CB-CG2 4.48Å; L608-V610 PolarHBondContact O-N 3.35Å; L608-M613 HydrophobicContact CB-SD 4.22Å
609	P	82.4	Confident	66.7	Low	11 Å²	11	76.2 Å²	76.2	7%	0.071	33%	0.333	C	S	.	.			trans	-84.3	54.7	-177	37.8	-39.2	0	0	0	112.8	D565 R611 W612 M613	D565-P609 WeakPolarHBondContact OD1-CB 3.41Å; D565-P609 VanDerWaalsContact OD1-CG 3.28Å; D565-P609 WeakPolarHBondContact OD1-CG 3.22Å; P609-R611 PolarHBondContact O-N 3.38Å; P609-W612 HydrophobicContact CB-CE3 4.12Å; P609-W612 PolarHBondContact O-N 3.29Å; P609-M613 HydrophobicContact CG-CG 4.25Å
610	V	86.2	Confident	69.1	Low	18 Å²	18	74.1 Å²	74.1	11%	0.109	33%	0.33	C	S	.	.	G	3₁₀ helix	trans	-43.5	-37.5	-168.6	177.1	0	0	0	0	115.5	L608 W612 M613 N652 M656	L608-V610 VanDerWaalsContact C-N 3.26Å; L608-V610 HydrophobicContact CB-CG2 4.48Å; L608-V610 PolarHBondContact O-N 3.35Å; V610-W612 VanDerWaalsContact C-N 3.31Å; V610-W612 PolarHBondContact O-N 3.19Å; V610-M613 PolarHBondContact O-N 3.07Å; V610-N652 HydrophobicContact CB-CB 4.34Å; V610-N652 HydrophobicContact CG1-CB 4.13Å; V610-N652 HydrophobicContact CG2-CB 4.4Å; V610-M656 HydrophobicContact CG1-CG 3.43Å; V610-M656 VanDerWaalsContact CG1-CG 3.43Å; V610-M656 HydrophobicContact CG1-SD 4.1Å
611	R	91.7	Very high	71.1	Confident	44 Å²	44	67.9 Å²	67.9	17%	0.166	31%	0.309	C	S	.	.	G	3₁₀ helix	trans	-74.3	-16	-176.6	-64.4	164.8	-172.9	-81.6	-13.7	114.8	P609 P646 F647 R650 N652 V655	P609-R611 PolarHBondContact O-N 3.38Å; R611-P646 HydrophobicContact CB-CB 4.28Å; R611-P646 WeakPolarHBondContact CD-O 3.2Å; R611-P646 PolarHBondContact NH1-O 2.89Å; R611-F647 PolarHBondContact NH1-O 2.96Å; R611-R650 PolarHBondContact NH2-O 3.26Å; R611-N652 PolarHBondContact NH2-OD1 2.81Å; R611-N652 VanDerWaalsContact NH2-OD1 3.13Å; R611-V655 HydrophobicContact CG-CG1 4.23Å; R611-V655 HydrophobicContact CG-CG2 4.47Å
612	W	94.1	Very high	72.9	Confident	28 Å²	28	66.6 Å²	66.6	11%	0.106	31%	0.31	C	S	.	.	G	3₁₀ helix	trans	-104.6	-7.7	177.2	-64.7	-102.4	0	0	0	112.4	I566 A567 P609 V610 A631 V634 E638 P646	I566-W612 VanDerWaalsContact O-CD1 3.32Å; A567-W612 HydrophobicContact CB-CD2 4.17Å; A567-W612 HydrophobicContact CB-CG 4.22Å; A567-W612 HydrophobicContact CB-CZ2 4.28Å; P609-W612 HydrophobicContact CB-CE3 4.12Å; P609-W612 PolarHBondContact O-N 3.29Å; V610-W612 VanDerWaalsContact C-N 3.31Å; V610-W612 PolarHBondContact O-N 3.19Å; W612-A631 HydrophobicContact CB-CB 4.28Å; W612-A631 WeakPolarHBondContact O-CA 3.47Å; W612-A631 WeakPolarHBondContact O-CB 3.35Å; W612-V634 VanDerWaalsContact CD1-CG1 3.45Å; W612-V634 HydrophobicContact CD2-CG1 4.46Å; W612-V634 HydrophobicContact CG-CB 4.4Å; W612-V634 HydrophobicContact CG-CG1 3.93Å; W612-E638 PolarHBondContact NE1-OE2 3.28Å; W612-P646 HydrophobicContact CZ2-CG 4.13Å
613	M	91.9	Very high	75.2	Confident	16 Å²	16	60 Å²	60	8%	0.079	28%	0.282	C	S	.	.			trans	-77.3	142.9	-177.1	-66.7	172.7	60.3	0	0	111.6	L608 P609 V610 A617 I618 F623 W630	L608-M613 HydrophobicContact CB-SD 4.22Å; P609-M613 HydrophobicContact CG-CG 4.25Å; V610-M613 PolarHBondContact O-N 3.07Å; M613-A617 HydrophobicContact CB-CB 4.3Å; M613-A617 HydrophobicContact CE-CB 4.16Å; M613-A617 WeakPolarHBondContact CE-O 3.39Å; M613-I618 HydrophobicContact CB-CD1 4.08Å; M613-I618 HydrophobicContact CB-CG1 3.56Å; M613-I618 HydrophobicContact CE-CG1 4.07Å; M613-F623 HydrophobicContact CE-CZ 4.02Å; M613-W630 PolarHBondContact O-NE1 2.99Å
614	S	93.3	Very high	77.6	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	25%	0.246	C	C	.	.			trans	-77.9	162.6	174.3	59.4	0	0	0	0	112.6	E616 A617 I618 S627	S614-E616 VanDerWaalsContact C-N 3.29Å; S614-E616 WeakPolarHBondContact CB-OE1 3.36Å; S614-E616 WeakPolarHBondContact CB-OE2 3.27Å; S614-E616 PolarHBondContact O-N 3.27Å; S614-E616 PolarHBondContact OG-OE1 3.42Å; S614-E616 PolarHBondContact OG-OE2 2.8Å; S614-A617 PolarHBondContact O-N 2.86Å; S614-A617 VanDerWaalsContact O-N 3.09Å; S614-A617 WeakPolarHBondContact OG-CB 3.43Å; S614-A617 PolarHBondContact OG-N 2.85Å; S614-I618 WeakPolarHBondContact O-CG1 3.49Å; S614-I618 PolarHBondContact O-N 2.96Å; S614-S627 VanDerWaalsContact OG-CB 3.23Å; S614-S627 WeakPolarHBondContact OG-CB 3.41Å
615	P	91.9	Very high	79.8	Confident	9 Å²	9	43.8 Å²	43.8	6%	0.058	22%	0.216	C	C	.	.	H	α-helix	trans	-54.6	-40.5	-179.8	-25.9	33.6	0	0	0	113.9	I618 R619 W630 V659	P615-I618 PolarHBondContact O-N 3.19Å; P615-R619 WeakPolarHBondContact O-CB 3.5Å; P615-R619 PolarHBondContact O-N 3.42Å; P615-W630 VanDerWaalsContact CD-CZ3 3.45Å; P615-W630 HydrophobicContact CG-CE3 4.43Å; P615-W630 HydrophobicContact CG-CH2 3.79Å; P615-W630 HydrophobicContact CG-CZ2 4.38Å; P615-W630 HydrophobicContact CG-CZ3 3.8Å; P615-V659 HydrophobicContact CB-CG1 4.43Å; P615-V659 HydrophobicContact CG-CG1 3.78Å
616	E	87.1	Confident	82.1	Confident	8 Å²	8	42 Å²	42	4%	0.037	21%	0.207	C	C	.	.	H	α-helix	trans	-73.7	-31.9	177.4	72	-70.4	167.1	0	0	113.2	S614 D620 G621 L622 R690	S614-E616 VanDerWaalsContact C-N 3.29Å; S614-E616 WeakPolarHBondContact CB-OE1 3.36Å; S614-E616 WeakPolarHBondContact CB-OE2 3.27Å; S614-E616 PolarHBondContact O-N 3.27Å; S614-E616 PolarHBondContact OG-OE1 3.42Å; S614-E616 PolarHBondContact OG-OE2 2.8Å; E616-D620 WeakPolarHBondContact O-CA 3.27Å; E616-D620 WeakPolarHBondContact O-CB 3.14Å; E616-D620 PolarHBondContact O-N 3.48Å; E616-G621 PolarHBondContact O-N 3.19Å; E616-L622 HydrophobicContact CB-CB 4.33Å; E616-L622 HydrophobicContact CG-CB 4.23Å; E616-L622 HydrophobicContact CG-CD2 4.35Å; E616-L622 HydrophobicContact CG-CG 4.43Å; E616-L622 PolarHBondContact O-N 2.9Å; E616-L622 VanDerWaalsContact O-N 3.13Å; E616-R690 IonicContact OE1-CZ 3.75Å; E616-R690 IonicContact OE1-NH1 2.76Å; E616-R690 PolarHBondContact OE1-NH1 2.78Å; E616-R690 IonicContact OE1-NH2 3.62Å; E616-R690 IonicContact OE2-CZ 3.52Å; E616-R690 IonicContact OE2-NH1 2.89Å; E616-R690 PolarHBondContact OE2-NH1 2.88Å; E616-R690 IonicContact OE2-NH2 2.83Å; E616-R690 PolarHBondContact OE2-NH2 3.46Å
617	A	87.6	Confident	84.4	Confident	3 Å²	3	40 Å²	40	3%	0.025	19%	0.194	C	C	.	.	H	α-helix	trans	-70.9	-31.3	172.6	0	0	0	0	0	112.4	M613 S614 G621 L622 F623	M613-A617 HydrophobicContact CB-CB 4.3Å; M613-A617 HydrophobicContact CE-CB 4.16Å; M613-A617 WeakPolarHBondContact CE-O 3.39Å; S614-A617 PolarHBondContact O-N 2.86Å; S614-A617 VanDerWaalsContact O-N 3.09Å; S614-A617 WeakPolarHBondContact OG-CB 3.43Å; S614-A617 PolarHBondContact OG-N 2.85Å; A617-G621 WeakPolarHBondContact O-CA 3.49Å; A617-G621 PolarHBondContact O-N 2.88Å; A617-L622 WeakPolarHBondContact CA-O 3.26Å; A617-F623 HydrophobicContact CB-CD1 4.09Å; A617-F623 HydrophobicContact CB-CE1 3.84Å; A617-F623 HydrophobicContact CB-CZ 4.15Å
618	I	85.2	Confident	86.3	Confident	26 Å²	26	33.8 Å²	33.8	13%	0.133	17%	0.167	C	C	.	.	H	α-helix	trans	-77.7	-46.8	176	-62.3	169	0	0	0	111.2	M613 S614 P615 M656 V659 I660	M613-I618 HydrophobicContact CB-CD1 4.08Å; M613-I618 HydrophobicContact CB-CG1 3.56Å; M613-I618 HydrophobicContact CE-CG1 4.07Å; S614-I618 WeakPolarHBondContact O-CG1 3.49Å; S614-I618 PolarHBondContact O-N 2.96Å; P615-I618 PolarHBondContact O-N 3.19Å; I618-M656 HydrophobicContact CD1-CG 4.37Å; I618-M656 HydrophobicContact CG2-CB 3.8Å; I618-M656 HydrophobicContact CG2-CG 3.58Å; I618-M656 HydrophobicContact CG2-SD 3.85Å; I618-V659 HydrophobicContact CD1-CB 4.06Å; I618-V659 HydrophobicContact CD1-CG1 3.76Å; I618-I660 HydrophobicContact CG2-CD1 3.79Å; I618-I660 HydrophobicContact CG2-CG1 4.29Å
619	R	83.8	Confident	87.8	Confident	143 Å²	143	29.8 Å²	29.8	54%	0.54	15%	0.146	S	C	.	.	H	α-helix	trans	-79.4	-49.1	-173.5	-176	-171.2	61.2	-125.3	-4.7	112.9	P615	P615-R619 WeakPolarHBondContact O-CB 3.5Å; P615-R619 PolarHBondContact O-N 3.42Å
620	D	78.3	Confident	88.5	Confident	86 Å²	86	29.6 Å²	29.6	46%	0.46	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	-108.4	-8.2	-169.9	-43.2	-43.6	0	0	0	112.4	E616 L622	E616-D620 WeakPolarHBondContact O-CA 3.27Å; E616-D620 WeakPolarHBondContact O-CB 3.14Å; E616-D620 PolarHBondContact O-N 3.48Å; D620-L622 HydrophobicContact CB-CB 4.3Å; D620-L622 PolarHBondContact O-N 3.43Å
621	G	74.5	Confident	89	Confident	11 Å²	11	29 Å²	29	11%	0.113	14%	0.141	C	C	.	.			trans	70.1	15.5	-169.2	0	0	0	0	0	113.9	Y599 E616 A617 F623	Y599-G621 VanDerWaalsContact CE1-CA 3.43Å; Y599-G621 PolarHBondContact OH-O 3.11Å; E616-G621 PolarHBondContact O-N 3.19Å; A617-G621 WeakPolarHBondContact O-CA 3.49Å; A617-G621 PolarHBondContact O-N 2.88Å; G621-F623 WeakPolarHBondContact O-CD2 3.24Å; G621-F623 PolarHBondContact O-N 2.91Å
622	L	77.6	Confident	89.3	Confident	87 Å²	87	27 Å²	27	46%	0.455	13%	0.133	S	C	.	.			trans	-79.2	111.5	-174.8	-178.9	59.5	0	0	0	111.2	E616 A617 D620 T624	E616-L622 HydrophobicContact CB-CB 4.33Å; E616-L622 HydrophobicContact CG-CB 4.23Å; E616-L622 HydrophobicContact CG-CD2 4.35Å; E616-L622 HydrophobicContact CG-CG 4.43Å; E616-L622 PolarHBondContact O-N 2.9Å; E616-L622 VanDerWaalsContact O-N 3.13Å; A617-L622 WeakPolarHBondContact CA-O 3.26Å; D620-L622 HydrophobicContact CB-CB 4.3Å; D620-L622 PolarHBondContact O-N 3.43Å; L622-T624 HydrophobicContact CD1-CG2 4.05Å; L622-T624 HydrophobicContact CG-CG2 4.13Å
623	F	83.2	Confident	89.5	Confident	28 Å²	28	25.6 Å²	25.6	12%	0.123	13%	0.128	C	C	.	.			trans	-107.2	127.4	174.5	-67.8	-85	0	0	0	111.4	V562 R564 Y599 M613 A617 G621 S627	V562-F623 HydrophobicContact CG1-CB 4.27Å; R564-F623 HydrophobicContact CB-CD1 3.8Å; R564-F623 HydrophobicContact CB-CE1 4.04Å; R564-F623 HydrophobicContact CB-CG 4.42Å; R564-F623 HydrophobicContact CG-CB 3.91Å; R564-F623 HydrophobicContact CG-CD1 3.69Å; R564-F623 HydrophobicContact CG-CE1 4.38Å; R564-F623 HydrophobicContact CG-CG 3.87Å; Y599-F623 HydrophobicContact CE1-CE2 4.21Å; Y599-F623 WeakPolarHBondContact OH-CD2 3.1Å; Y599-F623 WeakPolarHBondContact OH-CE2 3.42Å; M613-F623 HydrophobicContact CE-CZ 4.02Å; A617-F623 HydrophobicContact CB-CD1 4.09Å; A617-F623 HydrophobicContact CB-CE1 3.84Å; A617-F623 HydrophobicContact CB-CZ 4.15Å; G621-F623 WeakPolarHBondContact O-CD2 3.24Å; G621-F623 PolarHBondContact O-N 2.91Å; F623-S627 WeakPolarHBondContact CA-OG 3.26Å
624	T	86.5	Confident	89.8	Confident	27 Å²	27	24.9 Å²	24.9	17%	0.166	13%	0.125	C	C	.	.			trans	-146	172.8	-178.4	61.8	0	0	0	0	110.3	V562 L622 K626 S627 D628	V562-T624 WeakPolarHBondContact CG1-O 3.11Å; L622-T624 HydrophobicContact CD1-CG2 4.05Å; L622-T624 HydrophobicContact CG-CG2 4.13Å; T624-K626 PolarHBondContact O-N 2.88Å; T624-K626 VanDerWaalsContact O-N 3.12Å; T624-K626 PolarHBondContact OG1-N 2.82Å; T624-S627 PolarHBondContact N-OG 3.38Å; T624-S627 PolarHBondContact O-N 3.42Å; T624-S627 PolarHBondContact O-OG 3.19Å; T624-S627 PolarHBondContact OG1-N 3.06Å; T624-D628 PolarHBondContact O-N 2.81Å; T624-D628 VanDerWaalsContact O-N 3.11Å
625	T	90.6	Very high	90	Very high	31 Å²	31	24.9 Å²	24.9	19%	0.19	13%	0.125	C	C	.	.	H	α-helix	trans	-58.4	-26.6	171.6	67.9	0	0	0	0	111.9	E557 V562 D628 V629	E557-T625 HydrophobicContact CB-CG2 4.1Å; E557-T625 HydrophobicContact CG-CG2 4.03Å; E557-T625 VanDerWaalsContact OE1-CB 3.25Å; E557-T625 WeakPolarHBondContact OE1-CB 3.34Å; E557-T625 PolarHBondContact OE1-OG1 2.71Å; V562-T625 HydrophobicContact CG2-CG2 4.37Å; T625-D628 WeakPolarHBondContact O-CB 3.22Å; T625-D628 PolarHBondContact O-N 2.81Å; T625-V629 WeakPolarHBondContact O-CG2 3.06Å; T625-V629 PolarHBondContact O-N 2.91Å
626	K	93.9	Very high	90.3	Very high	39 Å²	39	24.5 Å²	24.5	17%	0.17	12%	0.122	C	C	.	.	H	α-helix	trans	-77.1	-24.6	175.5	-59.6	-68	-178.3	173.7	0	114.2	T624 W630 T687 R690 P691	T624-K626 PolarHBondContact O-N 2.88Å; T624-K626 VanDerWaalsContact O-N 3.12Å; T624-K626 PolarHBondContact OG1-N 2.82Å; K626-W630 PolarHBondContact O-N 3.48Å; K626-T687 HydrophobicContact CB-CG2 3.35Å; K626-T687 HydrophobicContact CG-CG2 3.89Å; K626-R690 HydrophobicContact CD-CB 4.26Å; K626-R690 PolarHBondContact NZ-O 2.9Å; K626-R690 WeakPolarHBondContact O-CD 3.42Å; K626-R690 PolarHBondContact O-NH1 2.96Å; K626-P691 PolarHBondContact NZ-O 3.13Å
627	S	91.7	Very high	90.8	Very high	5 Å²	5	25.7 Å²	25.7	4%	0.035	13%	0.126	C	C	.	.	H	α-helix	trans	-74.4	-32.7	166	65.7	0	0	0	0	111	S614 F623 T624 W630 A631	S614-S627 VanDerWaalsContact OG-CB 3.23Å; S614-S627 WeakPolarHBondContact OG-CB 3.41Å; F623-S627 WeakPolarHBondContact CA-OG 3.26Å; T624-S627 PolarHBondContact N-OG 3.38Å; T624-S627 PolarHBondContact O-N 3.42Å; T624-S627 PolarHBondContact O-OG 3.19Å; T624-S627 PolarHBondContact OG1-N 3.06Å; S627-W630 WeakPolarHBondContact O-CB 3.42Å; S627-W630 PolarHBondContact O-N 3.38Å; S627-A631 PolarHBondContact O-N 3.45Å; S627-A631 VanDerWaalsContact O-N 3.14Å
628	D	94.6	Very high	91.2	Very high	6 Å²	6	25.5 Å²	25.5	3%	0.032	13%	0.125	C	C	.	.	H	α-helix	trans	-67	-35.9	172.9	-80.8	-3.7	0	0	0	112	V562 H563 R564 I566 T624 T625 W630 A631 Y632 F693	V562-D628 WeakPolarHBondContact CA-OD2 3.05Å; V562-D628 WeakPolarHBondContact CG1-OD2 3.5Å; H563-D628 PolarHBondContact N-OD2 2.88Å; R564-D628 WeakPolarHBondContact CA-OD1 3.48Å; R564-D628 PolarHBondContact N-OD1 3.22Å; I566-D628 HydrophobicContact CD1-CB 3.52Å; T624-D628 PolarHBondContact O-N 2.81Å; T624-D628 VanDerWaalsContact O-N 3.11Å; T625-D628 WeakPolarHBondContact O-CB 3.22Å; T625-D628 PolarHBondContact O-N 2.81Å; D628-W630 VanDerWaalsContact C-N 3.3Å; D628-W630 PolarHBondContact O-N 3.41Å; D628-A631 PolarHBondContact O-N 2.83Å; D628-Y632 WeakPolarHBondContact O-CB 3.44Å; D628-Y632 PolarHBondContact O-N 3.34Å; D628-F693 HydrophobicContact CB-CE2 4.11Å; D628-F693 HydrophobicContact CB-CZ 4.22Å
629	V	97.8	Very high	91.7	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-60	-37.2	171.3	166.8	0	0	0	0	112.2	T625 A633 C682 R690 P691 F693 L696	T625-V629 WeakPolarHBondContact O-CG2 3.06Å; T625-V629 PolarHBondContact O-N 2.91Å; V629-A633 PolarHBondContact O-N 2.59Å; V629-A633 VanDerWaalsContact O-N 3.13Å; V629-C682 HydrophobicContact CG1-CB 3.81Å; V629-R690 HydrophobicContact CG1-CB 4.1Å; V629-P691 HydrophobicContact CG1-CG 4.38Å; V629-F693 HydrophobicContact CB-CZ 4.33Å; V629-F693 HydrophobicContact CG2-CD1 4.41Å; V629-F693 HydrophobicContact CG2-CD2 3.92Å; V629-F693 HydrophobicContact CG2-CE1 4.09Å; V629-F693 HydrophobicContact CG2-CE2 3.57Å; V629-F693 HydrophobicContact CG2-CG 4.34Å; V629-F693 HydrophobicContact CG2-CZ 3.66Å; V629-L696 HydrophobicContact CG1-CD1 4.16Å; V629-L696 HydrophobicContact CG2-CD1 4.41Å
630	W	97.7	Very high	92.3	Very high	7 Å²	7	17.6 Å²	17.6	3%	0.027	9%	0.093	C	C	.	.	H	α-helix	trans	-65.4	-47.4	173.6	177.1	-71.4	0	0	0	111.4	M613 P615 K626 S627 D628 Y632 A633 V634 V659 V664 W683	M613-W630 PolarHBondContact O-NE1 2.99Å; P615-W630 VanDerWaalsContact CD-CZ3 3.45Å; P615-W630 HydrophobicContact CG-CE3 4.43Å; P615-W630 HydrophobicContact CG-CH2 3.79Å; P615-W630 HydrophobicContact CG-CZ2 4.38Å; P615-W630 HydrophobicContact CG-CZ3 3.8Å; K626-W630 PolarHBondContact O-N 3.48Å; S627-W630 WeakPolarHBondContact O-CB 3.42Å; S627-W630 PolarHBondContact O-N 3.38Å; D628-W630 VanDerWaalsContact C-N 3.3Å; D628-W630 PolarHBondContact O-N 3.41Å; W630-Y632 VanDerWaalsContact C-N 3.32Å; W630-Y632 PolarHBondContact O-N 2.87Å; W630-A633 PolarHBondContact O-N 3.26Å; W630-V634 PolarHBondContact O-N 3.13Å; W630-V634 VanDerWaalsContact O-N 3.1Å; W630-V659 HydrophobicContact CH2-CG1 4.06Å; W630-V659 HydrophobicContact CZ2-CG1 3.58Å; W630-V659 HydrophobicContact CZ2-CG2 4.38Å; W630-V664 HydrophobicContact CH2-CG1 4.33Å; W630-W683 AromaticContact CD2-CD1 3.58Å; W630-W683 HydrophobicContact CD2-CG 4.49Å; W630-W683 AromaticContact CE2-CD1 3.72Å; W630-W683 HydrophobicContact CE3-CB 4.15Å; W630-W683 AromaticContact CE3-CD1 3.88Å; W630-W683 HydrophobicContact CE3-CG 4.42Å; W630-W683 AromaticContact CG-CD1 3.94Å; W630-W683 HydrophobicContact CH2-CB 4.16Å; W630-W683 HydrophobicContact CZ3-CB 3.88Å; W630-W683 HydrophobicContact CZ3-CG 4.44Å; W630-W683 VanDerWaalsContact CZ3-O 3.27Å; W630-W683 WeakPolarHBondContact CZ3-O 3.48Å; W630-W683 PolarHBondContact O-NE1 3.23Å
631	A	96.5	Very high	92.9	Very high	5 Å²	5	15 Å²	15	4%	0.041	8%	0.081	C	C	.	.	H	α-helix	trans	-63.7	-36.4	178.1	0	0	0	0	0	112.5	I566 W612 S627 D628 V634 T635	I566-A631 HydrophobicContact CB-CB 4.04Å; W612-A631 HydrophobicContact CB-CB 4.28Å; W612-A631 WeakPolarHBondContact O-CA 3.47Å; W612-A631 WeakPolarHBondContact O-CB 3.35Å; S627-A631 PolarHBondContact O-N 3.45Å; S627-A631 VanDerWaalsContact O-N 3.14Å; D628-A631 PolarHBondContact O-N 2.83Å; A631-V634 PolarHBondContact O-N 2.97Å; A631-T635 PolarHBondContact O-N 3Å; A631-T635 PolarHBondContact O-OG1 2.88Å
632	Y	98.2	Very high	93.7	Very high	1 Å²	1	14.7 Å²	14.7	0%	0.004	8%	0.076	C	C	.	.	H	α-helix	trans	-59.1	-45.9	170.7	170.2	-102.2	0	0	0	111.7	M546 I549 C550 D628 W630 V634 T635 C636 F693 L696	M546-Y632 PolarHBondContact O-OH 2.97Å; M546-Y632 VanDerWaalsContact O-OH 3.13Å; I549-Y632 HydrophobicContact CB-CE2 4.19Å; I549-Y632 HydrophobicContact CG2-CD2 3.8Å; I549-Y632 HydrophobicContact CG2-CE2 3.93Å; C550-Y632 HydrophobicContact CB-CE2 3.85Å; C550-Y632 WeakPolarHBondContact CB-OH 3.49Å; D628-Y632 WeakPolarHBondContact O-CB 3.44Å; D628-Y632 PolarHBondContact O-N 3.34Å; W630-Y632 VanDerWaalsContact C-N 3.32Å; W630-Y632 PolarHBondContact O-N 2.87Å; Y632-V634 PolarHBondContact O-N 2.77Å; Y632-T635 CarbonylContact O-C 3.56Å; Y632-T635 WeakPolarHBondContact O-CA 3.46Å; Y632-T635 VanDerWaalsContact O-CB 3.29Å; Y632-T635 WeakPolarHBondContact O-CB 3.36Å; Y632-T635 PolarHBondContact O-N 3.38Å; Y632-C636 VanDerWaalsContact CE1-SG 3.58Å; Y632-C636 PolarHBondContact O-N 2.65Å; Y632-C636 PolarHBondContact O-SG 3.3Å; Y632-C636 VanDerWaalsContact O-SG 3.38Å; Y632-F693 HydrophobicContact CD1-CE1 4.09Å; Y632-F693 HydrophobicContact CD2-CE1 4.16Å; Y632-F693 AromaticContact CG-CE1 3.72Å; Y632-F693 HydrophobicContact CG-CE1 3.72Å; Y632-L696 HydrophobicContact CD1-CD1 3.93Å; Y632-L696 HydrophobicContact CE1-CD1 3.95Å
633	A	98.3	Very high	94.2	Very high	0 Å²	0	10.5 Å²	10.5	0%	0	6%	0.055	C	C	.	.	H	α-helix	trans	-66.2	-35.3	177.6	0	0	0	0	0	113.1	V629 W630 T635 C636 W637 L679 C682 W683	V629-A633 PolarHBondContact O-N 2.59Å; V629-A633 VanDerWaalsContact O-N 3.13Å; W630-A633 PolarHBondContact O-N 3.26Å; A633-T635 VanDerWaalsContact C-N 3.29Å; A633-T635 PolarHBondContact O-N 2.77Å; A633-C636 PolarHBondContact O-N 3.27Å; A633-W637 PolarHBondContact O-N 3.28Å; A633-L679 HydrophobicContact CB-CD2 3.96Å; A633-C682 HydrophobicContact CB-CB 3.45Å; A633-C682 VanDerWaalsContact CB-CB 3.45Å; A633-W683 VanDerWaalsContact C-CZ2 3.5Å; A633-W683 HydrophobicContact CB-CD2 4.28Å; A633-W683 HydrophobicContact CB-CG 4.47Å; A633-W683 HydrophobicContact CB-CZ2 3.99Å; A633-W683 WeakPolarHBondContact O-CZ2 3.36Å
634	V	97.6	Very high	94.5	Very high	1 Å²	1	10.5 Å²	10.5	1%	0.006	6%	0.06	C	C	.	.	H	α-helix	trans	-62.4	-38.8	168.8	179.8	0	0	0	0	111	W612 W630 A631 Y632 W637 E638 P646 L665 W683	W612-V634 VanDerWaalsContact CD1-CG1 3.45Å; W612-V634 HydrophobicContact CD2-CG1 4.46Å; W612-V634 HydrophobicContact CG-CB 4.4Å; W612-V634 HydrophobicContact CG-CG1 3.93Å; W630-V634 PolarHBondContact O-N 3.13Å; W630-V634 VanDerWaalsContact O-N 3.1Å; A631-V634 PolarHBondContact O-N 2.97Å; Y632-V634 PolarHBondContact O-N 2.77Å; V634-W637 WeakPolarHBondContact O-CB 3.26Å; V634-W637 PolarHBondContact O-N 2.9Å; V634-E638 PolarHBondContact O-N 2.81Å; V634-P646 HydrophobicContact CG1-CB 3.86Å; V634-P646 HydrophobicContact CG1-CG 3.57Å; V634-L665 HydrophobicContact CB-CD1 4.48Å; V634-L665 HydrophobicContact CG1-CD1 4.07Å; V634-L665 HydrophobicContact CG2-CD1 4.23Å; V634-W683 HydrophobicContact CG2-CZ2 4.31Å
635	T	97.5	Very high	94.5	Very high	0 Å²	0	12 Å²	12	0%	0	7%	0.067	C	C	.	.	H	α-helix	trans	-66.6	-40.2	175.7	-55.1	0	0	0	0	112.1	I549 I566 A567 A568 A631 Y632 A633 W637 E638 V639	I549-T635 HydrophobicContact CD1-CG2 4.01Å; I566-T635 PolarHBondContact O-OG1 3.36Å; A567-T635 VanDerWaalsContact CA-OG1 3.29Å; A567-T635 WeakPolarHBondContact CA-OG1 3.02Å; A567-T635 PolarHBondContact N-OG1 3.2Å; A568-T635 HydrophobicContact CB-CG2 4.32Å; A631-T635 PolarHBondContact O-N 3Å; A631-T635 PolarHBondContact O-OG1 2.88Å; Y632-T635 CarbonylContact O-C 3.56Å; Y632-T635 WeakPolarHBondContact O-CA 3.46Å; Y632-T635 VanDerWaalsContact O-CB 3.29Å; Y632-T635 WeakPolarHBondContact O-CB 3.36Å; Y632-T635 PolarHBondContact O-N 3.38Å; A633-T635 VanDerWaalsContact C-N 3.29Å; A633-T635 PolarHBondContact O-N 2.77Å; T635-W637 VanDerWaalsContact C-N 3.28Å; T635-W637 PolarHBondContact O-N 3.17Å; T635-E638 WeakPolarHBondContact O-CB 3.32Å; T635-E638 PolarHBondContact O-N 3.43Å; T635-E638 VanDerWaalsContact O-N 3.16Å; T635-V639 WeakPolarHBondContact O-CG2 2.94Å; T635-V639 PolarHBondContact O-N 3.24Å
636	C	98.1	Very high	94.5	Very high	1 Å²	1	10.6 Å²	10.6	1%	0.007	6%	0.058	C	C	.	.	H	α-helix	trans	-60.5	-38.4	171.2	-68	0	0	0	0	111.7	M546 Y632 A633 V639 L640 L679	M546-C636 HydrophobicContact CG-CB 4.21Å; M546-C636 HydrophobicContact SD-CB 3.64Å; Y632-C636 VanDerWaalsContact CE1-SG 3.58Å; Y632-C636 PolarHBondContact O-N 2.65Å; Y632-C636 PolarHBondContact O-SG 3.3Å; Y632-C636 VanDerWaalsContact O-SG 3.38Å; A633-C636 PolarHBondContact O-N 3.27Å; C636-V639 PolarHBondContact O-N 3.09Å; C636-L640 WeakPolarHBondContact O-CB 3.48Å; C636-L640 WeakPolarHBondContact O-CG 3.27Å; C636-L640 PolarHBondContact O-N 2.86Å; C636-L679 HydrophobicContact CB-CD1 4.31Å; C636-L679 HydrophobicContact CB-CD2 3.57Å
637	W	97.3	Very high	94.2	Very high	32 Å²	32	10.1 Å²	10.1	12%	0.121	6%	0.056	C	C	.	.	H	α-helix	trans	-65.6	-39.2	173.1	-170.5	97.1	0	0	0	112.2	A633 V634 T635 V639 L640 T641 A644 P646 L665 G666 P668 W683	A633-W637 PolarHBondContact O-N 3.28Å; V634-W637 WeakPolarHBondContact O-CB 3.26Å; V634-W637 PolarHBondContact O-N 2.9Å; T635-W637 VanDerWaalsContact C-N 3.28Å; T635-W637 PolarHBondContact O-N 3.17Å; W637-V639 VanDerWaalsContact C-N 3.34Å; W637-V639 PolarHBondContact O-N 2.77Å; W637-L640 PolarHBondContact O-N 3.4Å; W637-T641 HydrophobicContact CD2-CG2 3.92Å; W637-T641 HydrophobicContact CE3-CG2 4.08Å; W637-T641 HydrophobicContact CH2-CG2 3.95Å; W637-T641 HydrophobicContact CZ2-CG2 3.78Å; W637-T641 HydrophobicContact CZ3-CG2 4.09Å; W637-T641 WeakPolarHBondContact O-CB 3.45Å; W637-T641 WeakPolarHBondContact O-CG2 3.1Å; W637-T641 PolarHBondContact O-N 3.01Å; W637-T641 VanDerWaalsContact O-N 3.07Å; W637-T641 PolarHBondContact O-OG1 3.3Å; W637-A644 HydrophobicContact CH2-CB 4.14Å; W637-A644 HydrophobicContact CZ3-CB 4.01Å; W637-P646 HydrophobicContact CE3-CG 4.32Å; W637-P646 HydrophobicContact CZ3-CB 4.47Å; W637-P646 HydrophobicContact CZ3-CG 4.39Å; W637-L665 HydrophobicContact CB-CD1 4.03Å; W637-L665 HydrophobicContact CD2-CB 4.22Å; W637-L665 HydrophobicContact CD2-CD1 3.83Å; W637-L665 HydrophobicContact CD2-CG 4.41Å; W637-L665 HydrophobicContact CE3-CD1 4.13Å; W637-L665 HydrophobicContact CG-CB 4.04Å; W637-L665 HydrophobicContact CG-CD1 3.78Å; W637-L665 HydrophobicContact CG-CG 4.48Å; W637-L665 HydrophobicContact CZ2-CD2 4.43Å; W637-G666 PolarHBondContact NE1-O 2.82Å; W637-P668 HydrophobicContact CG-CG 4.4Å; W637-W683 HydrophobicContact CB-CH2 4.14Å; W637-W683 HydrophobicContact CB-CZ2 4.28Å; W637-W683 HydrophobicContact CG-CH2 4.41Å
638	E	96.7	Very high	93.9	Very high	0 Å²	0	17.4 Å²	17.4	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-58.1	-45.4	169.5	-67.4	-176.3	93.7	0	0	110.9	A568 W612 V634 T635 T641 L642 G643 P646	A568-E638 HydrophobicContact CB-CB 3.98Å; A568-E638 HydrophobicContact CB-CG 4.44Å; A568-E638 WeakPolarHBondContact CB-OE2 3.49Å; A568-E638 PolarHBondContact N-OE2 2.91Å; W612-E638 PolarHBondContact NE1-OE2 3.28Å; V634-E638 PolarHBondContact O-N 2.81Å; T635-E638 WeakPolarHBondContact O-CB 3.32Å; T635-E638 PolarHBondContact O-N 3.43Å; T635-E638 VanDerWaalsContact O-N 3.16Å; E638-T641 PolarHBondContact O-N 3.33Å; E638-T641 PolarHBondContact O-OG1 3.27Å; E638-L642 PolarHBondContact O-N 2.82Å; E638-G643 WeakPolarHBondContact O-CA 3.37Å; E638-G643 PolarHBondContact O-N 2.91Å; E638-P646 HydrophobicContact CG-CG 3.94Å
639	V	96.4	Very high	93.2	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-61.2	-49.7	178	176.2	0	0	0	0	111.4	L471 L475 L542 I545 M546 T635 C636 W637 T641 L642	L471-V639 HydrophobicContact CD2-CG2 4.02Å; L475-V639 HydrophobicContact CD1-CB 4.49Å; L475-V639 HydrophobicContact CD1-CG2 4.17Å; L475-V639 HydrophobicContact CD2-CG1 4.45Å; L542-V639 HydrophobicContact CB-CG1 3.91Å; L542-V639 HydrophobicContact CD2-CG1 3.75Å; L542-V639 HydrophobicContact CG-CG1 4.34Å; I545-V639 HydrophobicContact CB-CG1 4.33Å; I545-V639 HydrophobicContact CG2-CG1 3.98Å; I545-V639 HydrophobicContact CG2-CG2 3.77Å; M546-V639 HydrophobicContact CE-CG1 4.06Å; M546-V639 HydrophobicContact CG-CB 4.23Å; M546-V639 HydrophobicContact CG-CG1 4.06Å; M546-V639 HydrophobicContact CG-CG2 4.46Å; T635-V639 WeakPolarHBondContact O-CG2 2.94Å; T635-V639 PolarHBondContact O-N 3.24Å; C636-V639 PolarHBondContact O-N 3.09Å; W637-V639 VanDerWaalsContact C-N 3.34Å; W637-V639 PolarHBondContact O-N 2.77Å; V639-T641 PolarHBondContact O-N 2.81Å; V639-L642 PolarHBondContact O-N 3.35Å; V639-L642 VanDerWaalsContact O-N 3.12Å
640	L	94.5	Very high	92.4	Very high	2 Å²	2	27 Å²	27	1%	0.01	14%	0.141	C	C	.	.	H	α-helix	trans	-69.3	-6.1	179.2	-73.4	165.4	0	0	0	114.8	L539 M546 C636 W637 P668 C671 L675 L679 F718	L539-L640 HydrophobicContact CD1-CD2 3.96Å; M546-L640 HydrophobicContact CE-CD1 4.25Å; M546-L640 HydrophobicContact CE-CD2 3.74Å; M546-L640 HydrophobicContact CE-CG 3.7Å; M546-L640 HydrophobicContact SD-CD1 4.3Å; M546-L640 HydrophobicContact SD-CG 4.24Å; C636-L640 WeakPolarHBondContact O-CB 3.48Å; C636-L640 WeakPolarHBondContact O-CG 3.27Å; C636-L640 PolarHBondContact O-N 2.86Å; W637-L640 PolarHBondContact O-N 3.4Å; L640-P668 HydrophobicContact CB-CB 4.1Å; L640-P668 HydrophobicContact CB-CG 3.83Å; L640-C671 HydrophobicContact CD1-CB 4.31Å; L640-C671 HydrophobicContact CD2-CB 4.46Å; L640-L675 HydrophobicContact CD1-CD2 3.96Å; L640-L675 HydrophobicContact CD1-CG 4.43Å; L640-L675 HydrophobicContact CD2-CD2 4Å; L640-L679 HydrophobicContact CD1-CD1 3.95Å; L640-F718 WeakPolarHBondContact O-CZ 3.23Å
641	T	91.3	Very high	91.5	Very high	32 Å²	32	29.2 Å²	29.2	20%	0.196	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-117.4	14.6	174.3	57.7	0	0	0	0	112.4	W637 E638 V639 G643 A644 P668	W637-T641 HydrophobicContact CD2-CG2 3.92Å; W637-T641 HydrophobicContact CE3-CG2 4.08Å; W637-T641 HydrophobicContact CH2-CG2 3.95Å; W637-T641 HydrophobicContact CZ2-CG2 3.78Å; W637-T641 HydrophobicContact CZ3-CG2 4.09Å; W637-T641 WeakPolarHBondContact O-CB 3.45Å; W637-T641 WeakPolarHBondContact O-CG2 3.1Å; W637-T641 PolarHBondContact O-N 3.01Å; W637-T641 VanDerWaalsContact O-N 3.07Å; W637-T641 PolarHBondContact O-OG1 3.3Å; E638-T641 PolarHBondContact O-N 3.33Å; E638-T641 PolarHBondContact O-OG1 3.27Å; V639-T641 PolarHBondContact O-N 2.81Å; T641-G643 VanDerWaalsContact C-N 3.26Å; T641-G643 PolarHBondContact O-N 3.41Å; T641-A644 HydrophobicContact CG2-CB 4.45Å; T641-A644 PolarHBondContact O-N 2.74Å; T641-A644 WeakPolarHBondContact OG1-CB 3.39Å; T641-A644 PolarHBondContact OG1-N 3.24Å; T641-P668 HydrophobicContact CG2-CB 4.01Å; T641-P668 HydrophobicContact CG2-CG 3.94Å
642	L	91.3	Very high	90.7	Very high	4 Å²	4	32.6 Å²	32.6	2%	0.021	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	49.1	48.5	-175.8	-56.5	178.6	0	0	0	111.7	L475 H476 R479 A535 L542 E638 V639 F718 V720	L475-L642 HydrophobicContact CD2-CD2 4.13Å; H476-L642 PolarHBondContact CD2-O 3.33Å; R479-L642 HydrophobicContact CG-CB 3.78Å; R479-L642 HydrophobicContact CG-CD1 4.12Å; R479-L642 VanDerWaalsContact CZ-O 3.27Å; R479-L642 PolarHBondContact NE-O 3.47Å; R479-L642 PolarHBondContact NH2-O 2.99Å; A535-L642 HydrophobicContact CB-CD1 3.77Å; L542-L642 HydrophobicContact CD1-CD2 4.19Å; L542-L642 HydrophobicContact CD2-CD2 3.97Å; E638-L642 PolarHBondContact O-N 2.82Å; V639-L642 PolarHBondContact O-N 3.35Å; V639-L642 VanDerWaalsContact O-N 3.12Å; L642-F718 HydrophobicContact CD1-CD1 4.1Å; L642-F718 HydrophobicContact CD1-CE1 3.67Å; L642-F718 HydrophobicContact CD1-CZ 4.48Å; L642-F718 HydrophobicContact CD2-CE1 4.28Å; L642-F718 HydrophobicContact CD2-CZ 4.44Å; L642-F718 HydrophobicContact CG-CD1 4.49Å; L642-F718 HydrophobicContact CG-CE1 3.76Å; L642-F718 HydrophobicContact CG-CZ 4.08Å; L642-V720 HydrophobicContact CD1-CG2 4.41Å
643	G	89.3	Confident	90	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	20%	0.204	C	C	.	.	S	Bend	trans	80.1	28.9	176.1	0	0	0	0	0	115.4	H476 R479 E638 T641	H476-G643 PolarHBondContact CD2-O 2.82Å; H476-G643 PolarHBondContact NE2-O 2.82Å; R479-G643 VanDerWaalsContact NH2-C 3.33Å; R479-G643 PolarHBondContact NH2-O 2.84Å; E638-G643 WeakPolarHBondContact O-CA 3.37Å; E638-G643 PolarHBondContact O-N 2.91Å; T641-G643 VanDerWaalsContact C-N 3.26Å; T641-G643 PolarHBondContact O-N 3.41Å
644	A	88.4	Confident	89.5	Confident	28 Å²	28	40.1 Å²	40.1	23%	0.231	22%	0.222	C	C	.	.	P	Polyproline II helix	trans	-67.1	152.8	174.7	0	0	0	0	0	111.5	W637 T641 P646	W637-A644 HydrophobicContact CH2-CB 4.14Å; W637-A644 HydrophobicContact CZ3-CB 4.01Å; T641-A644 HydrophobicContact CG2-CB 4.45Å; T641-A644 PolarHBondContact O-N 2.74Å; T641-A644 WeakPolarHBondContact OG1-CB 3.39Å; T641-A644 PolarHBondContact OG1-N 3.24Å; A644-P646 WeakPolarHBondContact O-CD 3.46Å
645	D	86.5	Confident	89	Confident	59 Å²	59	40 Å²	40	32%	0.316	22%	0.222	S	C	.	.	P	Polyproline II helix	trans	-76	122.6	179.4	-67.9	-32.1	0	0	0	110.6	R472 F647 Y648	R472-D645 IonicContact CZ-OD1 2.78Å; R472-D645 IonicContact NE-OD1 3.46Å; R472-D645 IonicContact NH2-OD1 2.72Å; R472-D645 PolarHBondContact NH2-OD1 3.38Å; R472-D645 IonicContact NH2-OD2 3.33Å; D645-F647 PolarHBondContact O-N 3.14Å; D645-Y648 HydrophobicContact CB-CD2 4.25Å; D645-Y648 PolarHBondContact O-N 3.12Å; D645-Y648 VanDerWaalsContact O-N 3.16Å
646	P	90.5	Very high	88.5	Confident	0 Å²	0	42 Å²	42	0%	0	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.1	134.5	177.4	-24.3	34.4	0	0	0	111.4	R611 W612 V634 W637 E638 A644 Y648 L665	R611-P646 HydrophobicContact CB-CB 4.28Å; R611-P646 WeakPolarHBondContact CD-O 3.2Å; R611-P646 PolarHBondContact NH1-O 2.89Å; W612-P646 HydrophobicContact CZ2-CG 4.13Å; V634-P646 HydrophobicContact CG1-CB 3.86Å; V634-P646 HydrophobicContact CG1-CG 3.57Å; W637-P646 HydrophobicContact CE3-CG 4.32Å; W637-P646 HydrophobicContact CZ3-CB 4.47Å; W637-P646 HydrophobicContact CZ3-CG 4.39Å; E638-P646 HydrophobicContact CG-CG 3.94Å; A644-P646 WeakPolarHBondContact O-CD 3.46Å; P646-Y648 VanDerWaalsContact C-N 3.31Å; P646-Y648 PolarHBondContact O-N 2.87Å; P646-L665 HydrophobicContact CB-CD1 4.01Å; P646-L665 HydrophobicContact CB-CD2 4.14Å
647	F	88.1	Confident	88.1	Confident	29 Å²	29	46.8 Å²	46.8	13%	0.127	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	53.6	42.2	-174.4	-50.2	-86.5	0	0	0	113.8	R611 D645 R650 V655 V659 L665	R611-F647 PolarHBondContact NH1-O 2.96Å; D645-F647 PolarHBondContact O-N 3.14Å; F647-R650 HydrophobicContact CB-CB 4.45Å; F647-R650 WeakPolarHBondContact O-CB 3.18Å; F647-R650 PolarHBondContact O-N 3.01Å; F647-V655 HydrophobicContact CB-CG1 4.43Å; F647-V655 HydrophobicContact CB-CG2 3.57Å; F647-V655 HydrophobicContact CD2-CG1 3.64Å; F647-V655 HydrophobicContact CD2-CG2 4.35Å; F647-V655 HydrophobicContact CE2-CG1 3.99Å; F647-V655 HydrophobicContact CG-CG1 4.01Å; F647-V655 HydrophobicContact CG-CG2 4.02Å; F647-V659 HydrophobicContact CE2-CG2 4.16Å; F647-V659 HydrophobicContact CZ-CG2 3.78Å; F647-L665 HydrophobicContact CD1-CD2 3.91Å; F647-L665 HydrophobicContact CD2-CD2 3.78Å; F647-L665 HydrophobicContact CD2-CG 4.5Å; F647-L665 HydrophobicContact CE1-CD2 3.88Å; F647-L665 HydrophobicContact CE1-CG 4.3Å; F647-L665 HydrophobicContact CE2-CD1 4.43Å; F647-L665 HydrophobicContact CE2-CD2 3.75Å; F647-L665 HydrophobicContact CE2-CG 3.99Å; F647-L665 HydrophobicContact CG-CD2 3.86Å; F647-L665 HydrophobicContact CZ-CD2 3.81Å; F647-L665 HydrophobicContact CZ-CG 3.88Å
648	Y	85.7	Confident	87.8	Confident	159 Å²	159	47.2 Å²	47.2	62%	0.624	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-45.6	139.1	177.4	-178.6	-98.5	0	0	0	112.9	D645 P646 R650	D645-Y648 HydrophobicContact CB-CD2 4.25Å; D645-Y648 PolarHBondContact O-N 3.12Å; D645-Y648 VanDerWaalsContact O-N 3.16Å; P646-Y648 VanDerWaalsContact C-N 3.31Å; P646-Y648 PolarHBondContact O-N 2.87Å; Y648-R650 VanDerWaalsContact C-N 3.26Å; Y648-R650 PolarHBondContact O-N 2.79Å
649	G	79.4	Confident	87.6	Confident	70 Å²	70	47.3 Å²	47.3	72%	0.722	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.8	-6.2	-179.8	0	0	0	0	0	116.6
650	R	80.7	Confident	87.3	Confident	136 Å²	136	50.1 Å²	50.1	51%	0.513	28%	0.276	S	S	.	.			trans	-91.1	146.9	172.7	-62.5	-59.6	-165.8	-85.2	2	111.8	R611 F647 Y648 D654 V655 L658	R611-R650 PolarHBondContact NH2-O 3.26Å; F647-R650 HydrophobicContact CB-CB 4.45Å; F647-R650 WeakPolarHBondContact O-CB 3.18Å; F647-R650 PolarHBondContact O-N 3.01Å; Y648-R650 VanDerWaalsContact C-N 3.26Å; Y648-R650 PolarHBondContact O-N 2.79Å; R650-D654 HydrophobicContact CB-CB 4.22Å; R650-V655 HydrophobicContact CB-CG2 3.79Å; R650-L658 HydrophobicContact CG-CD1 4.19Å
651	A	80.1	Confident	87.2	Confident	55 Å²	55	52.3 Å²	52.3	46%	0.455	30%	0.299	S	S	.	.			trans	-76	159.3	168.8	0	0	0	0	0	110.9	V653 D654 V655	A651-V653 PolarHBondContact O-N 3.09Å; A651-D654 VanDerWaalsContact CB-OD2 3.31Å; A651-D654 WeakPolarHBondContact CB-OD2 3.47Å; A651-D654 PolarHBondContact N-OD2 3.16Å; A651-D654 WeakPolarHBondContact O-CB 3.26Å; A651-D654 PolarHBondContact O-N 3.2Å; A651-D654 VanDerWaalsContact O-N 3.09Å; A651-V655 WeakPolarHBondContact O-CG2 3.48Å; A651-V655 PolarHBondContact O-N 3.41Å
652	N	79.8	Confident	87.2	Confident	75 Å²	75	52.8 Å²	52.8	40%	0.401	31%	0.311	S	S	.	.	H	α-helix	trans	-60.5	-32.2	-177.6	-73.7	8.8	0	0	0	112.9	V610 R611 V655 M656	V610-N652 HydrophobicContact CB-CB 4.34Å; V610-N652 HydrophobicContact CG1-CB 4.13Å; V610-N652 HydrophobicContact CG2-CB 4.4Å; R611-N652 PolarHBondContact NH2-OD1 2.81Å; R611-N652 VanDerWaalsContact NH2-OD1 3.13Å; N652-V655 PolarHBondContact O-N 2.87Å; N652-M656 WeakPolarHBondContact O-CG 3.44Å; N652-M656 PolarHBondContact O-N 3.46Å
653	V	83.5	Confident	87.3	Confident	87 Å²	87	57.7 Å²	57.7	53%	0.527	33%	0.333	S	S	.	.	H	α-helix	trans	-65.8	-44.1	174.8	179.7	0	0	0	0	111.2	A651 V655 M656 N657	A651-V653 PolarHBondContact O-N 3.09Å; V653-V655 VanDerWaalsContact C-N 3.29Å; V653-V655 PolarHBondContact O-N 2.86Å; V653-M656 HydrophobicContact CB-CE 4.37Å; V653-M656 HydrophobicContact CG2-CE 4.1Å; V653-M656 PolarHBondContact O-N 3.06Å; V653-N657 PolarHBondContact O-N 3.05Å; V653-N657 PolarHBondContact O-ND2 3.29Å
654	D	87.5	Confident	87.5	Confident	72 Å²	72	60.1 Å²	60.1	39%	0.385	35%	0.348	S	S	.	.	H	α-helix	trans	-60.8	-41.4	175.7	-43.7	-32.4	0	0	0	110.9	R650 A651 N657 L658	R650-D654 HydrophobicContact CB-CB 4.22Å; A651-D654 VanDerWaalsContact CB-OD2 3.31Å; A651-D654 WeakPolarHBondContact CB-OD2 3.47Å; A651-D654 PolarHBondContact N-OD2 3.16Å; A651-D654 WeakPolarHBondContact O-CB 3.26Å; A651-D654 PolarHBondContact O-N 3.2Å; A651-D654 VanDerWaalsContact O-N 3.09Å; D654-N657 PolarHBondContact O-N 2.98Å; D654-L658 WeakPolarHBondContact O-CB 3.27Å; D654-L658 WeakPolarHBondContact O-CG 3.38Å; D654-L658 PolarHBondContact O-N 3.46Å
655	V	86.3	Confident	87.8	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	34%	0.34	C	S	.	.	H	α-helix	trans	-62.9	-43.9	177.1	177.6	0	0	0	0	111.5	R611 F647 R650 A651 N652 V653 N657 L658 V659	R611-V655 HydrophobicContact CG-CG1 4.23Å; R611-V655 HydrophobicContact CG-CG2 4.47Å; F647-V655 HydrophobicContact CB-CG1 4.43Å; F647-V655 HydrophobicContact CB-CG2 3.57Å; F647-V655 HydrophobicContact CD2-CG1 3.64Å; F647-V655 HydrophobicContact CD2-CG2 4.35Å; F647-V655 HydrophobicContact CE2-CG1 3.99Å; F647-V655 HydrophobicContact CG-CG1 4.01Å; F647-V655 HydrophobicContact CG-CG2 4.02Å; R650-V655 HydrophobicContact CB-CG2 3.79Å; A651-V655 WeakPolarHBondContact O-CG2 3.48Å; A651-V655 PolarHBondContact O-N 3.41Å; N652-V655 PolarHBondContact O-N 2.87Å; V653-V655 VanDerWaalsContact C-N 3.29Å; V653-V655 PolarHBondContact O-N 2.86Å; V655-N657 PolarHBondContact O-N 3Å; V655-L658 PolarHBondContact O-N 3.19Å; V655-V659 HydrophobicContact CG1-CG2 4.27Å; V655-V659 WeakPolarHBondContact O-CB 3.24Å; V655-V659 WeakPolarHBondContact O-CG2 3.09Å; V655-V659 PolarHBondContact O-N 2.72Å
656	M	87.1	Confident	88.2	Confident	40 Å²	40	58.7 Å²	58.7	20%	0.197	35%	0.348	C	S	.	.	H	α-helix	trans	-58.9	-47.1	175.2	-69.7	-175.1	-62.5	0	0	111.5	V610 I618 N652 V653 L658 V659 I660	V610-M656 HydrophobicContact CG1-CG 3.43Å; V610-M656 VanDerWaalsContact CG1-CG 3.43Å; V610-M656 HydrophobicContact CG1-SD 4.1Å; I618-M656 HydrophobicContact CD1-CG 4.37Å; I618-M656 HydrophobicContact CG2-CB 3.8Å; I618-M656 HydrophobicContact CG2-CG 3.58Å; I618-M656 HydrophobicContact CG2-SD 3.85Å; N652-M656 WeakPolarHBondContact O-CG 3.44Å; N652-M656 PolarHBondContact O-N 3.46Å; V653-M656 HydrophobicContact CB-CE 4.37Å; V653-M656 HydrophobicContact CG2-CE 4.1Å; V653-M656 PolarHBondContact O-N 3.06Å; M656-L658 PolarHBondContact O-N 3.33Å; M656-V659 PolarHBondContact O-N 3.45Å; M656-I660 WeakPolarHBondContact O-CB 3.24Å; M656-I660 VanDerWaalsContact O-CG1 3.27Å; M656-I660 WeakPolarHBondContact O-CG1 3.45Å; M656-I660 PolarHBondContact O-N 3.34Å
657	N	89.7	Confident	88.4	Confident	103 Å²	103	64.6 Å²	64.6	55%	0.551	37%	0.37	S	S	*	.	H	α-helix	trans	-64.4	-40.3	178.7	-68.4	-21.1	0	0	0	112.4	V653 D654 V655 G661	V653-N657 PolarHBondContact O-N 3.05Å; V653-N657 PolarHBondContact O-ND2 3.29Å; D654-N657 PolarHBondContact O-N 2.98Å; V655-N657 PolarHBondContact O-N 3Å; N657-G661 PolarHBondContact O-N 3.28Å
658	L	91.7	Very high	88.5	Confident	41 Å²	41	63.7 Å²	63.7	22%	0.215	37%	0.367	C	S	.	.	H	α-helix	trans	-61.9	-51.7	176.2	-76.8	168	0	0	0	111.1	R650 D654 V655 M656 G661 G662 H663	R650-L658 HydrophobicContact CG-CD1 4.19Å; D654-L658 WeakPolarHBondContact O-CB 3.27Å; D654-L658 WeakPolarHBondContact O-CG 3.38Å; D654-L658 PolarHBondContact O-N 3.46Å; V655-L658 PolarHBondContact O-N 3.19Å; M656-L658 PolarHBondContact O-N 3.33Å; L658-G661 CarbonylContact O-C 3.35Å; L658-G661 WeakPolarHBondContact O-CA 3.35Å; L658-G661 PolarHBondContact O-N 2.88Å; L658-G662 PolarHBondContact O-N 3.33Å; L658-H663 HydrophobicContact CB-CB 4.04Å; L658-H663 HydrophobicContact CD2-CB 4.16Å; L658-H663 VanDerWaalsContact O-CB 3.32Å; L658-H663 WeakPolarHBondContact O-CB 3.47Å; L658-H663 PolarHBondContact O-N 2.85Å; L658-H663 PolarHBondContact O-ND1 3.49Å
659	V	91.6	Very high	88.4	Confident	2 Å²	2	62.1 Å²	62.1	1%	0.012	37%	0.366	C	S	.	.	H	α-helix	trans	-64.3	-45.2	-178.8	169.5	0	0	0	0	111.7	P615 I618 W630 F647 V655 M656 G661 G662	P615-V659 HydrophobicContact CB-CG1 4.43Å; P615-V659 HydrophobicContact CG-CG1 3.78Å; I618-V659 HydrophobicContact CD1-CB 4.06Å; I618-V659 HydrophobicContact CD1-CG1 3.76Å; W630-V659 HydrophobicContact CH2-CG1 4.06Å; W630-V659 HydrophobicContact CZ2-CG1 3.58Å; W630-V659 HydrophobicContact CZ2-CG2 4.38Å; F647-V659 HydrophobicContact CE2-CG2 4.16Å; F647-V659 HydrophobicContact CZ-CG2 3.78Å; V655-V659 HydrophobicContact CG1-CG2 4.27Å; V655-V659 WeakPolarHBondContact O-CB 3.24Å; V655-V659 WeakPolarHBondContact O-CG2 3.09Å; V655-V659 PolarHBondContact O-N 2.72Å; M656-V659 PolarHBondContact O-N 3.45Å; V659-G661 VanDerWaalsContact C-N 3.26Å; V659-G661 PolarHBondContact O-N 2.85Å; V659-G662 PolarHBondContact O-N 2.96Å
660	I	90.9	Very high	88.6	Confident	58 Å²	58	60.5 Å²	60.5	30%	0.297	34%	0.34	S	S	.	.	H	α-helix	trans	-62.2	-36.7	173.8	-69.2	168.6	0	0	0	111.1	I618 M656 G662	I618-I660 HydrophobicContact CG2-CD1 3.79Å; I618-I660 HydrophobicContact CG2-CG1 4.29Å; M656-I660 WeakPolarHBondContact O-CB 3.24Å; M656-I660 VanDerWaalsContact O-CG1 3.27Å; M656-I660 WeakPolarHBondContact O-CG1 3.45Å; M656-I660 PolarHBondContact O-N 3.34Å; I660-G662 PolarHBondContact O-N 2.87Å
661	G	91.6	Very high	89.2	Confident	48 Å²	48	54.2 Å²	54.2	50%	0.495	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-9	173.1	0	0	0	0	0	114.7	N657 L658 V659	N657-G661 PolarHBondContact O-N 3.28Å; L658-G661 CarbonylContact O-C 3.35Å; L658-G661 WeakPolarHBondContact O-CA 3.35Å; L658-G661 PolarHBondContact O-N 2.88Å; V659-G661 VanDerWaalsContact C-N 3.26Å; V659-G661 PolarHBondContact O-N 2.85Å
662	G	92	Very high	89.8	Confident	43 Å²	43	52.1 Å²	52.1	44%	0.443	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	90.6	13	-178.8	0	0	0	0	0	115	L658 V659 I660	L658-G662 PolarHBondContact O-N 3.33Å; V659-G662 PolarHBondContact O-N 2.96Å; I660-G662 PolarHBondContact O-N 2.87Å
663	H	92.7	Very high	90.4	Very high	106 Å²	106	53.8 Å²	53.8	49%	0.491	31%	0.305	S	S	.	.			trans	-77.9	136.9	173.3	-59.1	77.4	0	0	0	110.7	L658	L658-H663 HydrophobicContact CB-CB 4.04Å; L658-H663 HydrophobicContact CD2-CB 4.16Å; L658-H663 VanDerWaalsContact O-CB 3.32Å; L658-H663 WeakPolarHBondContact O-CB 3.47Å; L658-H663 PolarHBondContact O-N 2.85Å; L658-H663 PolarHBondContact O-ND1 3.49Å
664	V	94.6	Very high	90.9	Very high	52 Å²	52	54.3 Å²	54.3	32%	0.315	30%	0.301	S	S	.	.			trans	-120.4	172.1	177.7	-59.4	0	0	0	0	110.5	W630 L680 W683	W630-V664 HydrophobicContact CH2-CG1 4.33Å; V664-L680 HydrophobicContact CG2-CD2 3.95Å; V664-W683 HydrophobicContact CB-CB 4.38Å; V664-W683 HydrophobicContact CB-CD2 4.29Å; V664-W683 HydrophobicContact CB-CE3 3.93Å; V664-W683 HydrophobicContact CG1-CB 3.66Å; V664-W683 HydrophobicContact CG1-CD2 4.49Å; V664-W683 HydrophobicContact CG1-CE3 4.46Å; V664-W683 HydrophobicContact CG1-CG 4.22Å; V664-W683 HydrophobicContact CG2-CE3 4.36Å
665	L	95	Very high	91.3	Very high	9 Å²	9	50.9 Å²	50.9	5%	0.047	28%	0.283	C	S	.	.	P	Polyproline II helix	trans	-75	134	176.9	-64	163.2	0	0	0	110.2	V634 W637 P646 F647 Y676 W683	V634-L665 HydrophobicContact CB-CD1 4.48Å; V634-L665 HydrophobicContact CG1-CD1 4.07Å; V634-L665 HydrophobicContact CG2-CD1 4.23Å; W637-L665 HydrophobicContact CB-CD1 4.03Å; W637-L665 HydrophobicContact CD2-CB 4.22Å; W637-L665 HydrophobicContact CD2-CD1 3.83Å; W637-L665 HydrophobicContact CD2-CG 4.41Å; W637-L665 HydrophobicContact CE3-CD1 4.13Å; W637-L665 HydrophobicContact CG-CB 4.04Å; W637-L665 HydrophobicContact CG-CD1 3.78Å; W637-L665 HydrophobicContact CG-CG 4.48Å; W637-L665 HydrophobicContact CZ2-CD2 4.43Å; P646-L665 HydrophobicContact CB-CD1 4.01Å; P646-L665 HydrophobicContact CB-CD2 4.14Å; F647-L665 HydrophobicContact CD1-CD2 3.91Å; F647-L665 HydrophobicContact CD2-CD2 3.78Å; F647-L665 HydrophobicContact CD2-CG 4.5Å; F647-L665 HydrophobicContact CE1-CD2 3.88Å; F647-L665 HydrophobicContact CE1-CG 4.3Å; F647-L665 HydrophobicContact CE2-CD1 4.43Å; F647-L665 HydrophobicContact CE2-CD2 3.75Å; F647-L665 HydrophobicContact CE2-CG 3.99Å; F647-L665 HydrophobicContact CG-CD2 3.86Å; F647-L665 HydrophobicContact CZ-CD2 3.81Å; F647-L665 HydrophobicContact CZ-CG 3.88Å; L665-Y676 PolarHBondContact O-OH 2.84Å; L665-Y676 VanDerWaalsContact O-OH 3.08Å; L665-W683 HydrophobicContact CB-CH2 3.85Å; L665-W683 HydrophobicContact CB-CZ2 4.31Å; L665-W683 HydrophobicContact CB-CZ3 4.32Å; L665-W683 HydrophobicContact CD1-CH2 4.27Å; L665-W683 HydrophobicContact CD1-CZ2 3.97Å
666	G	93	Very high	91.8	Very high	48 Å²	48	52.4 Å²	52.4	50%	0.495	29%	0.289	S	S	.	.	P	Polyproline II helix	trans	-69.2	157.2	179.5	0	0	0	0	0	113.9	W637 P668	W637-G666 PolarHBondContact NE1-O 2.82Å; G666-P668 WeakPolarHBondContact O-CD 3.2Å
667	R	94.8	Very high	92.3	Very high	124 Å²	124	53.8 Å²	53.8	47%	0.468	30%	0.297	S	S	.	.	P	Polyproline II helix	trans	-58.1	122.6	-178.1	-168.1	172.1	83.5	175.8	5.4	111.8	C671 E673 Y676	R667-C671 HydrophobicContact CG-CB 3.97Å; R667-E673 IonicContact NH1-OE2 2.81Å; R667-E673 PolarHBondContact NH1-OE2 2.91Å; R667-Y676 HydrophobicContact CB-CD1 3.91Å; R667-Y676 HydrophobicContact CB-CD2 3.78Å; R667-Y676 HydrophobicContact CB-CE1 3.85Å; R667-Y676 HydrophobicContact CB-CE2 3.74Å; R667-Y676 HydrophobicContact CB-CG 3.86Å; R667-Y676 HydrophobicContact CG-CD1 3.96Å; R667-Y676 HydrophobicContact CG-CD2 3.75Å; R667-Y676 HydrophobicContact CG-CE1 4.42Å; R667-Y676 HydrophobicContact CG-CE2 4.25Å; R667-Y676 HydrophobicContact CG-CG 3.58Å; R667-Y676 PolarHBondContact N-OH 2.82Å
668	P	91.4	Very high	92.7	Very high	10 Å²	10	49.4 Å²	49.4	7%	0.065	27%	0.273	C	S	.	.	P	Polyproline II helix	trans	-62	150.6	170.3	-22.9	34.6	0	0	0	112.1	W637 L640 T641 G666 N670 C671	W637-P668 HydrophobicContact CG-CG 4.4Å; L640-P668 HydrophobicContact CB-CB 4.1Å; L640-P668 HydrophobicContact CB-CG 3.83Å; T641-P668 HydrophobicContact CG2-CB 4.01Å; T641-P668 HydrophobicContact CG2-CG 3.94Å; G666-P668 WeakPolarHBondContact O-CD 3.2Å; P668-N670 VanDerWaalsContact C-N 3.33Å; P668-N670 PolarHBondContact O-N 3.4Å; P668-C671 HydrophobicContact CB-CB 4.12Å; P668-C671 HydrophobicContact CG-CB 4.31Å; P668-C671 WeakPolarHBondContact O-CB 3.15Å; P668-C671 PolarHBondContact O-N 2.93Å; P668-C671 VanDerWaalsContact O-N 3.08Å
669	E	83.4	Confident	92.9	Very high	126 Å²	126	47.5 Å²	47.5	59%	0.589	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.2	-43.2	-173.9	-171	174.7	-170.3	0	0	113.4	S721	E669-S721 WeakPolarHBondContact OE1-CB 3.24Å; E669-S721 PolarHBondContact OE1-OG 3.3Å
670	N	84.1	Confident	93.2	Very high	35 Å²	35	50.6 Å²	50.6	19%	0.187	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.7	12.3	-179.4	-56.8	-80.6	0	0	0	114.4	P668 P672 F718 V719	P668-N670 VanDerWaalsContact C-N 3.33Å; P668-N670 PolarHBondContact O-N 3.4Å; N670-P672 WeakPolarHBondContact O-CD 3.47Å; N670-F718 HydrophobicContact CB-CD2 3.55Å; N670-F718 HydrophobicContact CB-CE2 3.48Å; N670-F718 VanDerWaalsContact CB-CE2 3.48Å; N670-F718 HydrophobicContact CB-CG 4.18Å; N670-F718 HydrophobicContact CB-CZ 4.03Å; N670-F718 VanDerWaalsContact ND2-CE1 3.32Å; N670-F718 WeakPolarHBondContact ND2-CE1 3.17Å; N670-F718 WeakPolarHBondContact ND2-CZ 3.25Å; N670-V719 VanDerWaalsContact CG-O 3.29Å; N670-V719 PolarHBondContact ND2-O 2.9Å; N670-V719 PolarHBondContact OD1-N 2.98Å; N670-V719 PolarHBondContact OD1-O 2.81Å; N670-V719 VanDerWaalsContact OD1-O 3.06Å
671	C	92	Very high	93.5	Very high	5 Å²	5	52.3 Å²	52.3	3%	0.034	29%	0.286	C	S	.	.			trans	-86.7	119.7	-178	-173.1	0	0	0	0	110.5	L640 R667 P668	L640-C671 HydrophobicContact CD1-CB 4.31Å; L640-C671 HydrophobicContact CD2-CB 4.46Å; R667-C671 HydrophobicContact CG-CB 3.97Å; P668-C671 HydrophobicContact CB-CB 4.12Å; P668-C671 HydrophobicContact CG-CB 4.31Å; P668-C671 WeakPolarHBondContact O-CB 3.15Å; P668-C671 PolarHBondContact O-N 2.93Å; P668-C671 VanDerWaalsContact O-N 3.08Å
672	P	93.3	Very high	93.8	Very high	10 Å²	10	50 Å²	50	7%	0.065	26%	0.262	C	S	.	.			trans	-55.1	152.9	167.8	-25.1	36.1	0	0	0	111.3	L539 N670 E674 L675 Y676 P713 F714	L539-P672 HydrophobicContact CD2-CG 3.56Å; N670-P672 WeakPolarHBondContact O-CD 3.47Å; P672-E674 WeakPolarHBondContact CB-OE2 3.22Å; P672-L675 HydrophobicContact CB-CB 4.38Å; P672-L675 PolarHBondContact O-N 2.82Å; P672-Y676 PolarHBondContact O-N 3.01Å; P672-P713 HydrophobicContact CB-CB 4.09Å; P672-P713 HydrophobicContact CB-CG 4.26Å; P672-P713 HydrophobicContact CG-CB 4.18Å; P672-F714 HydrophobicContact CB-CD2 4.43Å; P672-F714 HydrophobicContact CB-CE1 4.06Å; P672-F714 HydrophobicContact CB-CE2 3.85Å; P672-F714 HydrophobicContact CB-CZ 3.64Å; P672-F714 HydrophobicContact CG-CD1 3.95Å; P672-F714 HydrophobicContact CG-CD2 4.34Å; P672-F714 HydrophobicContact CG-CE1 3.78Å; P672-F714 HydrophobicContact CG-CE2 4.16Å; P672-F714 HydrophobicContact CG-CG 4.24Å; P672-F714 HydrophobicContact CG-CZ 3.87Å
673	E	93.1	Very high	94.1	Very high	111 Å²	111	48.4 Å²	48.4	52%	0.519	24%	0.243	S	C	.	.	H	α-helix	trans	-69.3	-37.8	-175.6	-168.3	163.3	142.2	0	0	111.9	R667 L675 Y676 N677	R667-E673 IonicContact NH1-OE2 2.81Å; R667-E673 PolarHBondContact NH1-OE2 2.91Å; E673-L675 VanDerWaalsContact C-N 3.33Å; E673-L675 PolarHBondContact O-N 2.73Å; E673-Y676 PolarHBondContact O-N 3.22Å; E673-N677 WeakPolarHBondContact O-CB 2.99Å; E673-N677 PolarHBondContact O-N 3.35Å; E673-N677 PolarHBondContact O-ND2 2.88Å
674	E	93.8	Very high	94.2	Very high	97 Å²	97	44.5 Å²	44.5	45%	0.453	23%	0.228	S	C	.	.	H	α-helix	trans	-61.8	-41.8	176.8	-52.9	84.8	170	0	0	111.2	P672 Q678 F703 F714	P672-E674 WeakPolarHBondContact CB-OE2 3.22Å; E674-Q678 PolarHBondContact O-N 3.28Å; E674-Q678 VanDerWaalsContact O-N 3.11Å; E674-F703 HydrophobicContact CB-CE1 3.94Å; E674-F703 HydrophobicContact CB-CZ 4.37Å; E674-F714 HydrophobicContact CB-CE2 4.42Å; E674-F714 HydrophobicContact CB-CZ 4.3Å
675	L	95.9	Very high	94	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-67	-44	175.7	-179.9	59.1	0	0	0	111.2	M546 L640 P672 E673 Q678 L679 M700 F703 F714	M546-L675 HydrophobicContact CE-CD2 4.2Å; L640-L675 HydrophobicContact CD1-CD2 3.96Å; L640-L675 HydrophobicContact CD1-CG 4.43Å; L640-L675 HydrophobicContact CD2-CD2 4Å; P672-L675 HydrophobicContact CB-CB 4.38Å; P672-L675 PolarHBondContact O-N 2.82Å; E673-L675 VanDerWaalsContact C-N 3.33Å; E673-L675 PolarHBondContact O-N 2.73Å; L675-Q678 WeakPolarHBondContact O-CB 3.21Å; L675-Q678 PolarHBondContact O-N 2.88Å; L675-Q678 VanDerWaalsContact O-N 3.17Å; L675-L679 WeakPolarHBondContact O-CG 3.47Å; L675-L679 PolarHBondContact O-N 2.89Å; L675-L679 VanDerWaalsContact O-N 3.09Å; L675-M700 HydrophobicContact CD1-CE 3.81Å; L675-F703 HydrophobicContact CB-CE2 4.29Å; L675-F703 HydrophobicContact CB-CZ 4.44Å; L675-F703 HydrophobicContact CD1-CD2 3.86Å; L675-F703 HydrophobicContact CD1-CE2 3.59Å; L675-F703 HydrophobicContact CD1-CZ 4.48Å; L675-F714 HydrophobicContact CB-CE1 3.97Å; L675-F714 HydrophobicContact CB-CZ 4.04Å; L675-F714 HydrophobicContact CD2-CE1 4.39Å
676	Y	97.2	Very high	93.8	Very high	33 Å²	33	55 Å²	55	13%	0.129	27%	0.265	C	S	.	.	H	α-helix	trans	-65.7	-39	178.1	-174.1	-112.6	0	0	0	112.3	L665 R667 P672 E673 Q678 L679 L680 W683	L665-Y676 PolarHBondContact O-OH 2.84Å; L665-Y676 VanDerWaalsContact O-OH 3.08Å; R667-Y676 HydrophobicContact CB-CD1 3.91Å; R667-Y676 HydrophobicContact CB-CD2 3.78Å; R667-Y676 HydrophobicContact CB-CE1 3.85Å; R667-Y676 HydrophobicContact CB-CE2 3.74Å; R667-Y676 HydrophobicContact CB-CG 3.86Å; R667-Y676 HydrophobicContact CG-CD1 3.96Å; R667-Y676 HydrophobicContact CG-CD2 3.75Å; R667-Y676 HydrophobicContact CG-CE1 4.42Å; R667-Y676 HydrophobicContact CG-CE2 4.25Å; R667-Y676 HydrophobicContact CG-CG 3.58Å; R667-Y676 PolarHBondContact N-OH 2.82Å; P672-Y676 PolarHBondContact O-N 3.01Å; E673-Y676 PolarHBondContact O-N 3.22Å; Y676-Q678 PolarHBondContact O-N 2.92Å; Y676-L679 WeakPolarHBondContact O-CA 3.18Å; Y676-L679 WeakPolarHBondContact O-CB 3.18Å; Y676-L679 PolarHBondContact O-N 2.69Å; Y676-L680 HydrophobicContact CD1-CD1 3.89Å; Y676-L680 HydrophobicContact CD1-CG 4.13Å; Y676-L680 HydrophobicContact CE1-CD1 3.65Å; Y676-L680 HydrophobicContact CE1-CD2 4.01Å; Y676-L680 HydrophobicContact CE1-CG 3.83Å; Y676-L680 WeakPolarHBondContact O-CG 3.37Å; Y676-L680 PolarHBondContact O-N 2.89Å; Y676-W683 HydrophobicContact CE2-CZ3 4.19Å
677	N	96.7	Very high	93.7	Very high	68 Å²	68	54.5 Å²	54.5	36%	0.364	25%	0.252	S	S	.	.	H	α-helix	trans	-61	-35.2	173.4	-72.3	-22.1	0	0	0	111.5	E673 L680 Q681	E673-N677 WeakPolarHBondContact O-CB 2.99Å; E673-N677 PolarHBondContact O-N 3.35Å; E673-N677 PolarHBondContact O-ND2 2.88Å; N677-L680 PolarHBondContact O-N 3.13Å; N677-Q681 WeakPolarHBondContact O-CG 3.35Å; N677-Q681 PolarHBondContact O-N 2.96Å; N677-Q681 VanDerWaalsContact O-N 3.13Å
678	Q	97	Very high	93.6	Very high	12 Å²	12	55.1 Å²	55.1	6%	0.056	26%	0.26	C	S	.	.	H	α-helix	trans	-67.2	-37.1	172.5	-163.5	57.6	66.3	0	0	112.5	E674 L675 Y676 Q681 C682 L696 K699 F703	E674-Q678 PolarHBondContact O-N 3.28Å; E674-Q678 VanDerWaalsContact O-N 3.11Å; L675-Q678 WeakPolarHBondContact O-CB 3.21Å; L675-Q678 PolarHBondContact O-N 2.88Å; L675-Q678 VanDerWaalsContact O-N 3.17Å; Y676-Q678 PolarHBondContact O-N 2.92Å; Q678-Q681 PolarHBondContact O-N 3.38Å; Q678-C682 PolarHBondContact O-N 3.19Å; Q678-C682 PolarHBondContact O-SG 3.29Å; Q678-L696 HydrophobicContact CG-CD2 3.78Å; Q678-K699 HydrophobicContact CG-CB 4.46Å; Q678-F703 HydrophobicContact CB-CE2 4.48Å; Q678-F703 HydrophobicContact CB-CZ 4.45Å
679	L	97.5	Very high	93.8	Very high	1 Å²	1	60.8 Å²	60.8	1%	0.005	29%	0.287	C	S	.	.	H	α-helix	trans	-67.7	-38.8	173.2	-59.1	-177.4	0	0	0	112.2	A633 C636 L640 L675 Y676 Q681 C682 W683	A633-L679 HydrophobicContact CB-CD2 3.96Å; C636-L679 HydrophobicContact CB-CD1 4.31Å; C636-L679 HydrophobicContact CB-CD2 3.57Å; L640-L679 HydrophobicContact CD1-CD1 3.95Å; L675-L679 WeakPolarHBondContact O-CG 3.47Å; L675-L679 PolarHBondContact O-N 2.89Å; L675-L679 VanDerWaalsContact O-N 3.09Å; Y676-L679 WeakPolarHBondContact O-CA 3.18Å; Y676-L679 WeakPolarHBondContact O-CB 3.18Å; Y676-L679 PolarHBondContact O-N 2.69Å; L679-Q681 VanDerWaalsContact C-N 3.32Å; L679-Q681 PolarHBondContact O-N 2.8Å; L679-C682 WeakPolarHBondContact O-CB 3.41Å; L679-C682 PolarHBondContact O-N 3.08Å; L679-C682 VanDerWaalsContact O-N 3.13Å; L679-W683 HydrophobicContact CB-CE3 4.26Å; L679-W683 HydrophobicContact CB-CH2 4.19Å; L679-W683 HydrophobicContact CB-CZ3 3.94Å; L679-W683 HydrophobicContact CD1-CH2 4.36Å; L679-W683 PolarHBondContact O-N 3.08Å
680	L	97.3	Very high	94.4	Very high	66 Å²	66	54.9 Å²	54.9	35%	0.346	26%	0.26	S	S	.	.	H	α-helix	trans	-60.7	-38.5	174.4	-71.8	176.6	0	0	0	112.2	V664 Y676 N677 W683 S684	V664-L680 HydrophobicContact CG2-CD2 3.95Å; Y676-L680 HydrophobicContact CD1-CD1 3.89Å; Y676-L680 HydrophobicContact CD1-CG 4.13Å; Y676-L680 HydrophobicContact CE1-CD1 3.65Å; Y676-L680 HydrophobicContact CE1-CD2 4.01Å; Y676-L680 HydrophobicContact CE1-CG 3.83Å; Y676-L680 WeakPolarHBondContact O-CG 3.37Å; Y676-L680 PolarHBondContact O-N 2.89Å; N677-L680 PolarHBondContact O-N 3.13Å; L680-W683 HydrophobicContact CD2-CE3 4.46Å; L680-W683 CarbonylContact O-C 3.49Å; L680-W683 PolarHBondContact O-N 3.2Å; L680-S684 PolarHBondContact O-N 3.35Å
681	Q	96.9	Very high	95.1	Very high	94 Å²	94	53.6 Å²	53.6	44%	0.439	25%	0.253	S	S	.	.	H	α-helix	trans	-63.1	-41.8	172.6	-68.9	171.7	27.5	0	0	111.8	N677 Q678 L679 W683 S684	N677-Q681 WeakPolarHBondContact O-CG 3.35Å; N677-Q681 PolarHBondContact O-N 2.96Å; N677-Q681 VanDerWaalsContact O-N 3.13Å; Q678-Q681 PolarHBondContact O-N 3.38Å; L679-Q681 VanDerWaalsContact C-N 3.32Å; L679-Q681 PolarHBondContact O-N 2.8Å; Q681-W683 VanDerWaalsContact C-N 3.26Å; Q681-W683 PolarHBondContact O-N 3.02Å; Q681-S684 VanDerWaalsContact O-CB 3.3Å; Q681-S684 WeakPolarHBondContact O-CB 3.35Å; Q681-S684 PolarHBondContact O-N 2.72Å; Q681-S684 VanDerWaalsContact O-N 3.1Å
682	C	98.1	Very high	95.3	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-63.7	-30.9	174.3	-62.2	0	0	0	0	113.1	V629 A633 Q678 L679 S684 R690	V629-C682 HydrophobicContact CG1-CB 3.81Å; A633-C682 HydrophobicContact CB-CB 3.45Å; A633-C682 VanDerWaalsContact CB-CB 3.45Å; Q678-C682 PolarHBondContact O-N 3.19Å; Q678-C682 PolarHBondContact O-SG 3.29Å; L679-C682 WeakPolarHBondContact O-CB 3.41Å; L679-C682 PolarHBondContact O-N 3.08Å; L679-C682 VanDerWaalsContact O-N 3.13Å; C682-S684 VanDerWaalsContact C-N 3.3Å; C682-R690 VanDerWaalsContact O-CD 3.22Å; C682-R690 WeakPolarHBondContact O-CD 3.38Å; C682-R690 WeakPolarHBondContact O-CG 3.46Å
683	W	97.5	Very high	95.5	Very high	9 Å²	9	55.3 Å²	55.3	3%	0.034	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.5	20.3	172.9	-61.5	-41.3	0	0	0	114.1	W630 A633 V634 W637 V664 L665 Y676 L679 L680 Q681 R685	W630-W683 AromaticContact CD2-CD1 3.58Å; W630-W683 HydrophobicContact CD2-CG 4.49Å; W630-W683 AromaticContact CE2-CD1 3.72Å; W630-W683 HydrophobicContact CE3-CB 4.15Å; W630-W683 AromaticContact CE3-CD1 3.88Å; W630-W683 HydrophobicContact CE3-CG 4.42Å; W630-W683 AromaticContact CG-CD1 3.94Å; W630-W683 HydrophobicContact CH2-CB 4.16Å; W630-W683 HydrophobicContact CZ3-CB 3.88Å; W630-W683 HydrophobicContact CZ3-CG 4.44Å; W630-W683 VanDerWaalsContact CZ3-O 3.27Å; W630-W683 WeakPolarHBondContact CZ3-O 3.48Å; W630-W683 PolarHBondContact O-NE1 3.23Å; A633-W683 VanDerWaalsContact C-CZ2 3.5Å; A633-W683 HydrophobicContact CB-CD2 4.28Å; A633-W683 HydrophobicContact CB-CG 4.47Å; A633-W683 HydrophobicContact CB-CZ2 3.99Å; A633-W683 WeakPolarHBondContact O-CZ2 3.36Å; V634-W683 HydrophobicContact CG2-CZ2 4.31Å; W637-W683 HydrophobicContact CB-CH2 4.14Å; W637-W683 HydrophobicContact CB-CZ2 4.28Å; W637-W683 HydrophobicContact CG-CH2 4.41Å; V664-W683 HydrophobicContact CB-CB 4.38Å; V664-W683 HydrophobicContact CB-CD2 4.29Å; V664-W683 HydrophobicContact CB-CE3 3.93Å; V664-W683 HydrophobicContact CG1-CB 3.66Å; V664-W683 HydrophobicContact CG1-CD2 4.49Å; V664-W683 HydrophobicContact CG1-CE3 4.46Å; V664-W683 HydrophobicContact CG1-CG 4.22Å; V664-W683 HydrophobicContact CG2-CE3 4.36Å; L665-W683 HydrophobicContact CB-CH2 3.85Å; L665-W683 HydrophobicContact CB-CZ2 4.31Å; L665-W683 HydrophobicContact CB-CZ3 4.32Å; L665-W683 HydrophobicContact CD1-CH2 4.27Å; L665-W683 HydrophobicContact CD1-CZ2 3.97Å; Y676-W683 HydrophobicContact CE2-CZ3 4.19Å; L679-W683 HydrophobicContact CB-CE3 4.26Å; L679-W683 HydrophobicContact CB-CH2 4.19Å; L679-W683 HydrophobicContact CB-CZ3 3.94Å; L679-W683 HydrophobicContact CD1-CH2 4.36Å; L679-W683 PolarHBondContact O-N 3.08Å; L680-W683 HydrophobicContact CD2-CE3 4.46Å; L680-W683 CarbonylContact O-C 3.49Å; L680-W683 PolarHBondContact O-N 3.2Å; Q681-W683 VanDerWaalsContact C-N 3.26Å; Q681-W683 PolarHBondContact O-N 3.02Å; W683-R685 PolarHBondContact O-N 3.39Å
684	S	95.8	Very high	95.7	Very high	25 Å²	25	51.3 Å²	51.3	18%	0.175	25%	0.251	C	S	.	.			trans	-57.9	134.8	172.1	-177.8	0	0	0	0	111.1	L680 Q681 C682 F686 M689 R690	L680-S684 PolarHBondContact O-N 3.35Å; Q681-S684 VanDerWaalsContact O-CB 3.3Å; Q681-S684 WeakPolarHBondContact O-CB 3.35Å; Q681-S684 PolarHBondContact O-N 2.72Å; Q681-S684 VanDerWaalsContact O-N 3.1Å; C682-S684 VanDerWaalsContact C-N 3.3Å; S684-F686 WeakPolarHBondContact CB-O 3.2Å; S684-F686 PolarHBondContact O-N 3.4Å; S684-F686 PolarHBondContact OG-N 3.49Å; S684-F686 PolarHBondContact OG-O 2.73Å; S684-M689 WeakPolarHBondContact OG-CB 3.46Å; S684-R690 PolarHBondContact O-NE 3.11Å; S684-R690 PolarHBondContact O-NH2 2.88Å
685	R	90.1	Very high	95.9	Very high	158 Å²	158	51.8 Å²	51.8	60%	0.596	25%	0.254	S	S	*	.	S	Bend	trans	-60.7	-29.1	171.7	-174.3	175.5	-178.2	133.3	1.9	111.9	W683	W683-R685 PolarHBondContact O-N 3.39Å
686	F	91.1	Very high	96	Very high	123 Å²	123	51.8 Å²	51.8	54%	0.539	25%	0.254	S	S	.	.	S	Bend	trans	-91.4	113.5	175.5	-64.4	-73.8	0	0	0	109.3	S684 E688 M689	S684-F686 WeakPolarHBondContact CB-O 3.2Å; S684-F686 PolarHBondContact O-N 3.4Å; S684-F686 PolarHBondContact OG-N 3.49Å; S684-F686 PolarHBondContact OG-O 2.73Å; F686-E688 HydrophobicContact CB-CG 4.48Å; F686-E688 WeakPolarHBondContact CD1-OE1 3.45Å; F686-E688 PolarHBondContact O-N 3.02Å; F686-M689 HydrophobicContact CB-CB 4.07Å; F686-M689 HydrophobicContact CB-CG 3.73Å; F686-M689 PolarHBondContact O-N 2.93Å; F686-M689 VanDerWaalsContact O-N 3.08Å
687	T	91.9	Very high	96	Very high	38 Å²	38	50.7 Å²	50.7	23%	0.233	25%	0.251	C	S	.	.	G	3₁₀ helix	trans	-58.3	-37	-175.2	-56.2	0	0	0	0	112.3	K626 M689 R690	K626-T687 HydrophobicContact CB-CG2 3.35Å; K626-T687 HydrophobicContact CG-CG2 3.89Å; T687-M689 VanDerWaalsContact C-N 3.34Å; T687-R690 PolarHBondContact O-N 2.99Å
688	E	91.7	Very high	96	Very high	136 Å²	136	54.3 Å²	54.3	64%	0.636	26%	0.263	S	S	*	.	G	3₁₀ helix	trans	-67.6	-28	177.3	65.1	-82.4	-162.2	0	0	113.6	F686	F686-E688 HydrophobicContact CB-CG 4.48Å; F686-E688 WeakPolarHBondContact CD1-OE1 3.45Å; F686-E688 PolarHBondContact O-N 3.02Å
689	M	95.2	Very high	96	Very high	129 Å²	129	57.2 Å²	57.2	64%	0.635	28%	0.276	S	S	*	.	G	3₁₀ helix	trans	-83.8	-11.4	178.1	-65.1	-61.3	-63.9	0	0	113	S684 F686 T687	S684-M689 WeakPolarHBondContact OG-CB 3.46Å; F686-M689 HydrophobicContact CB-CB 4.07Å; F686-M689 HydrophobicContact CB-CG 3.73Å; F686-M689 PolarHBondContact O-N 2.93Å; F686-M689 VanDerWaalsContact O-N 3.08Å; T687-M689 VanDerWaalsContact C-N 3.34Å
690	R	97.4	Very high	95.9	Very high	3 Å²	3	57.2 Å²	57.2	1%	0.011	28%	0.276	C	S	.	.	S	Bend	trans	-72.4	140.4	173.4	-56	178.1	-168.1	153.9	12.7	108.9	E616 K626 V629 C682 S684 T687	E616-R690 IonicContact OE1-CZ 3.75Å; E616-R690 IonicContact OE1-NH1 2.76Å; E616-R690 PolarHBondContact OE1-NH1 2.78Å; E616-R690 IonicContact OE1-NH2 3.62Å; E616-R690 IonicContact OE2-CZ 3.52Å; E616-R690 IonicContact OE2-NH1 2.89Å; E616-R690 PolarHBondContact OE2-NH1 2.88Å; E616-R690 IonicContact OE2-NH2 2.83Å; E616-R690 PolarHBondContact OE2-NH2 3.46Å; K626-R690 HydrophobicContact CD-CB 4.26Å; K626-R690 PolarHBondContact NZ-O 2.9Å; K626-R690 WeakPolarHBondContact O-CD 3.42Å; K626-R690 PolarHBondContact O-NH1 2.96Å; V629-R690 HydrophobicContact CG1-CB 4.1Å; C682-R690 VanDerWaalsContact O-CD 3.22Å; C682-R690 WeakPolarHBondContact O-CD 3.38Å; C682-R690 WeakPolarHBondContact O-CG 3.46Å; S684-R690 PolarHBondContact O-NE 3.11Å; S684-R690 PolarHBondContact O-NH2 2.88Å; T687-R690 PolarHBondContact O-N 2.99Å
691	P	97.5	Very high	95.8	Very high	8 Å²	8	56.4 Å²	56.4	5%	0.052	27%	0.272	C	S	.	.	P	Polyproline II helix	trans	-64.2	167.7	178.1	28.1	-36.2	0	0	0	112.4	K626 V629 Q695 L696	K626-P691 PolarHBondContact NZ-O 3.13Å; V629-P691 HydrophobicContact CG1-CG 4.38Å; P691-Q695 VanDerWaalsContact CA-OE1 3.24Å; P691-Q695 HydrophobicContact CB-CB 4.13Å; P691-L696 HydrophobicContact CB-CD2 4.33Å; P691-L696 HydrophobicContact CB-CG 4.1Å; P691-L696 HydrophobicContact CG-CD1 4.03Å; P691-L696 HydrophobicContact CG-CD2 3.68Å; P691-L696 HydrophobicContact CG-CG 3.76Å
692	T	97	Very high	95.7	Very high	48 Å²	48	56.2 Å²	56.2	29%	0.294	27%	0.271	S	S	.	.	P	Polyproline II helix	trans	-84.8	162.2	163.6	62	0	0	0	0	110.3	E557 G694 Q695 L696	E557-T692 WeakPolarHBondContact OE2-CB 3.33Å; T692-G694 PolarHBondContact O-N 3.06Å; T692-Q695 WeakPolarHBondContact O-CB 3.4Å; T692-Q695 PolarHBondContact O-N 3.1Å; T692-Q695 VanDerWaalsContact O-N 3.13Å; T692-Q695 WeakPolarHBondContact OG1-CG 3.12Å; T692-Q695 PolarHBondContact OG1-N 2.67Å; T692-L696 WeakPolarHBondContact O-CG 3.43Å; T692-L696 PolarHBondContact O-N 3.38Å
693	F	97.9	Very high	95.5	Very high	3 Å²	3	57 Å²	57	1%	0.013	27%	0.274	C	S	.	.	H	α-helix	trans	-63.9	-33.2	174.6	-76.3	-69.7	0	0	0	111.8	C553 C554 E557 I566 D628 V629 Y632 Q695 L696 C697	C553-F693 HydrophobicContact CB-CD1 3.39Å; C553-F693 HydrophobicContact CB-CD2 3.89Å; C553-F693 HydrophobicContact CB-CE1 3.29Å; C553-F693 HydrophobicContact CB-CE2 3.78Å; C553-F693 HydrophobicContact CB-CG 3.7Å; C553-F693 HydrophobicContact CB-CZ 3.48Å; C553-F693 VanDerWaalsContact CB-CZ 3.48Å; C554-F693 HydrophobicContact CB-CB 3.83Å; E557-F693 HydrophobicContact CB-CD2 4.08Å; E557-F693 WeakPolarHBondContact OE2-CB 3.48Å; E557-F693 PolarHBondContact OE2-N 3.41Å; I566-F693 HydrophobicContact CD1-CZ 4.39Å; D628-F693 HydrophobicContact CB-CE2 4.11Å; D628-F693 HydrophobicContact CB-CZ 4.22Å; V629-F693 HydrophobicContact CB-CZ 4.33Å; V629-F693 HydrophobicContact CG2-CD1 4.41Å; V629-F693 HydrophobicContact CG2-CD2 3.92Å; V629-F693 HydrophobicContact CG2-CE1 4.09Å; V629-F693 HydrophobicContact CG2-CE2 3.57Å; V629-F693 HydrophobicContact CG2-CG 4.34Å; V629-F693 HydrophobicContact CG2-CZ 3.66Å; Y632-F693 HydrophobicContact CD1-CE1 4.09Å; Y632-F693 HydrophobicContact CD2-CE1 4.16Å; Y632-F693 AromaticContact CG-CE1 3.72Å; Y632-F693 HydrophobicContact CG-CE1 3.72Å; F693-Q695 VanDerWaalsContact C-N 3.3Å; F693-Q695 PolarHBondContact O-N 3.18Å; F693-L696 HydrophobicContact CD1-CD1 4.06Å; F693-L696 HydrophobicContact CE1-CD1 4.36Å; F693-L696 PolarHBondContact O-N 2.95Å; F693-L696 VanDerWaalsContact O-N 3.13Å; F693-C697 PolarHBondContact O-N 3.35Å; F693-C697 PolarHBondContact O-SG 2.98Å
694	G	97.1	Very high	95.2	Very high	26 Å²	26	57.6 Å²	57.6	27%	0.268	28%	0.278	S	S	.	.	H	α-helix	trans	-63.6	-30.2	172.6	0	0	0	0	0	114.3	T692	T692-G694 PolarHBondContact O-N 3.06Å
695	Q	97.6	Very high	95.1	Very high	107 Å²	107	62.6 Å²	62.6	50%	0.5	30%	0.3	S	S	.	.	H	α-helix	trans	-74.5	-40	170.5	-72.7	169	-31.4	0	0	111.4	P691 T692 F693 K698 K699	P691-Q695 VanDerWaalsContact CA-OE1 3.24Å; P691-Q695 HydrophobicContact CB-CB 4.13Å; T692-Q695 WeakPolarHBondContact O-CB 3.4Å; T692-Q695 PolarHBondContact O-N 3.1Å; T692-Q695 VanDerWaalsContact O-N 3.13Å; T692-Q695 WeakPolarHBondContact OG1-CG 3.12Å; T692-Q695 PolarHBondContact OG1-N 2.67Å; F693-Q695 VanDerWaalsContact C-N 3.3Å; F693-Q695 PolarHBondContact O-N 3.18Å; Q695-K698 PolarHBondContact O-N 3.19Å; Q695-K699 PolarHBondContact O-N 3.49Å
696	L	98	Very high	95.1	Very high	1 Å²	1	56.8 Å²	56.8	1%	0.005	29%	0.286	C	S	.	.	H	α-helix	trans	-66.3	-39.5	178.3	-71.5	169.5	0	0	0	112.9	C550 V629 Y632 Q678 P691 T692 F693 K698 K699 M700	C550-L696 WeakPolarHBondContact SG-CB 3.36Å; V629-L696 HydrophobicContact CG1-CD1 4.16Å; V629-L696 HydrophobicContact CG2-CD1 4.41Å; Y632-L696 HydrophobicContact CD1-CD1 3.93Å; Y632-L696 HydrophobicContact CE1-CD1 3.95Å; Q678-L696 HydrophobicContact CG-CD2 3.78Å; P691-L696 HydrophobicContact CB-CD2 4.33Å; P691-L696 HydrophobicContact CB-CG 4.1Å; P691-L696 HydrophobicContact CG-CD1 4.03Å; P691-L696 HydrophobicContact CG-CD2 3.68Å; P691-L696 HydrophobicContact CG-CG 3.76Å; T692-L696 WeakPolarHBondContact O-CG 3.43Å; T692-L696 PolarHBondContact O-N 3.38Å; F693-L696 HydrophobicContact CD1-CD1 4.06Å; F693-L696 HydrophobicContact CE1-CD1 4.36Å; F693-L696 PolarHBondContact O-N 2.95Å; F693-L696 VanDerWaalsContact O-N 3.13Å; L696-K698 VanDerWaalsContact C-N 3.35Å; L696-K698 PolarHBondContact O-N 3.07Å; L696-K699 PolarHBondContact O-N 2.99Å; L696-M700 VanDerWaalsContact O-CG 3.31Å; L696-M700 WeakPolarHBondContact O-CG 2.91Å; L696-M700 PolarHBondContact O-N 3.42Å
697	C	97.2	Very high	94.9	Very high	9 Å²	9	51.9 Å²	51.9	6%	0.061	27%	0.267	C	S	.	.	H	α-helix	trans	-56	-49	174.5	-78.5	0	0	0	0	111.1	H551 F693 K699 M700 D701	H551-C697 PolarHBondContact ND1-SG 3.14Å; H551-C697 VanDerWaalsContact ND1-SG 3.45Å; F693-C697 PolarHBondContact O-N 3.35Å; F693-C697 PolarHBondContact O-SG 2.98Å; C697-K699 VanDerWaalsContact C-N 3.32Å; C697-K699 PolarHBondContact O-N 2.82Å; C697-M700 PolarHBondContact O-N 3.28Å; C697-M700 VanDerWaalsContact O-N 3.13Å; C697-D701 PolarHBondContact O-N 2.85Å
698	K	96.8	Very high	94.6	Very high	145 Å²	145	57.3 Å²	57.3	63%	0.63	29%	0.29	S	S	*	.	H	α-helix	trans	-57	-44.6	176.4	-66.4	176.7	-177.4	-176.4	0	112	Q695 L696 M700 D701 E702	Q695-K698 PolarHBondContact O-N 3.19Å; L696-K698 VanDerWaalsContact C-N 3.35Å; L696-K698 PolarHBondContact O-N 3.07Å; K698-M700 PolarHBondContact O-N 3.45Å; K698-D701 PolarHBondContact O-N 2.94Å; K698-E702 WeakPolarHBondContact O-CG 3.39Å; K698-E702 PolarHBondContact O-N 2.92Å
699	K	96.4	Very high	94.3	Very high	73 Å²	73	55 Å²	55	32%	0.317	28%	0.282	S	S	.	.	H	α-helix	trans	-63.9	-38.5	176.7	-73.1	-75.1	161.1	-150	0	113	Q678 Q695 L696 C697 E702 F703	Q678-K699 HydrophobicContact CG-CB 4.46Å; Q695-K699 PolarHBondContact O-N 3.49Å; L696-K699 PolarHBondContact O-N 2.99Å; C697-K699 VanDerWaalsContact C-N 3.32Å; C697-K699 PolarHBondContact O-N 2.82Å; K699-E702 IonicContact NZ-OE1 2.66Å; K699-E702 PolarHBondContact NZ-OE1 2.77Å; K699-E702 IonicContact NZ-OE2 3.14Å; K699-E702 PolarHBondContact NZ-OE2 2.94Å; K699-E702 PolarHBondContact O-N 2.83Å; K699-F703 HydrophobicContact CB-CE2 4.37Å; K699-F703 WeakPolarHBondContact O-CD2 3.07Å; K699-F703 WeakPolarHBondContact O-CG 3.48Å; K699-F703 PolarHBondContact O-N 2.84Å
700	M	95.4	Very high	93.5	Very high	1 Å²	1	55.7 Å²	55.7	1%	0.005	29%	0.288	C	S	.	.	H	α-helix	trans	-67.9	-38	176.2	-66.6	-68.3	149	0	0	112	V543 M546 R547 L675 L696 C697 K698 F703 I704	V543-M700 HydrophobicContact CG1-SD 4.31Å; M546-M700 HydrophobicContact CB-SD 3.91Å; R547-M700 HydrophobicContact CB-CB 3.88Å; R547-M700 HydrophobicContact CG-CB 3.96Å; L675-M700 HydrophobicContact CD1-CE 3.81Å; L696-M700 VanDerWaalsContact O-CG 3.31Å; L696-M700 WeakPolarHBondContact O-CG 2.91Å; L696-M700 PolarHBondContact O-N 3.42Å; C697-M700 PolarHBondContact O-N 3.28Å; C697-M700 VanDerWaalsContact O-N 3.13Å; K698-M700 PolarHBondContact O-N 3.45Å; M700-F703 HydrophobicContact CE-CD2 4.44Å; M700-F703 HydrophobicContact CE-CE2 4.39Å; M700-F703 PolarHBondContact O-N 2.89Å; M700-F703 HydrophobicContact SD-CD2 4.27Å; M700-I704 WeakPolarHBondContact O-CG1 3.49Å; M700-I704 PolarHBondContact O-N 3.21Å
701	D	94.8	Very high	92.7	Very high	49 Å²	49	63.9 Å²	63.9	26%	0.262	33%	0.326	S	S	.	.	H	α-helix	trans	-67.7	-40.6	172.7	-74.7	-43.8	0	0	0	112.3	R547 C697 K698 F703 I704 M705	R547-D701 WeakPolarHBondContact CD-OD1 3.4Å; R547-D701 IonicContact CZ-OD1 2.77Å; R547-D701 IonicContact NE-OD1 2.81Å; R547-D701 IonicContact NH1-OD1 3.56Å; R547-D701 PolarHBondContact NH1-OD1 2.81Å; C697-D701 PolarHBondContact O-N 2.85Å; K698-D701 PolarHBondContact O-N 2.94Å; D701-F703 VanDerWaalsContact C-N 3.32Å; D701-F703 PolarHBondContact O-N 3.34Å; D701-I704 PolarHBondContact O-N 2.79Å; D701-M705 WeakPolarHBondContact O-CG 3.23Å; D701-M705 PolarHBondContact O-N 2.88Å
702	E	95.1	Very high	92.1	Very high	90 Å²	90	64.1 Å²	64.1	42%	0.421	33%	0.328	S	S	.	.	H	α-helix	trans	-55.9	-45.1	171.1	-73.6	169.7	-145.8	0	0	111.5	K698 K699 I704 M705 A706	K698-E702 WeakPolarHBondContact O-CG 3.39Å; K698-E702 PolarHBondContact O-N 2.92Å; K699-E702 IonicContact NZ-OE1 2.66Å; K699-E702 PolarHBondContact NZ-OE1 2.77Å; K699-E702 IonicContact NZ-OE2 3.14Å; K699-E702 PolarHBondContact NZ-OE2 2.94Å; K699-E702 PolarHBondContact O-N 2.83Å; E702-I704 PolarHBondContact O-N 2.78Å; E702-M705 PolarHBondContact O-N 3.49Å; E702-A706 WeakPolarHBondContact O-CB 3.01Å; E702-A706 PolarHBondContact O-N 2.84Å
703	F	94.2	Very high	91.5	Very high	16 Å²	16	64.6 Å²	64.6	7%	0.07	33%	0.332	C	S	.	.	H	α-helix	trans	-66	-34.6	176.9	-62.9	-33.8	0	0	0	113	V543 E674 L675 Q678 K699 M700 D701 A706 S707 F714	V543-F703 HydrophobicContact CG1-CB 3.93Å; E674-F703 HydrophobicContact CB-CE1 3.94Å; E674-F703 HydrophobicContact CB-CZ 4.37Å; L675-F703 HydrophobicContact CB-CE2 4.29Å; L675-F703 HydrophobicContact CB-CZ 4.44Å; L675-F703 HydrophobicContact CD1-CD2 3.86Å; L675-F703 HydrophobicContact CD1-CE2 3.59Å; L675-F703 HydrophobicContact CD1-CZ 4.48Å; Q678-F703 HydrophobicContact CB-CE2 4.48Å; Q678-F703 HydrophobicContact CB-CZ 4.45Å; K699-F703 HydrophobicContact CB-CE2 4.37Å; K699-F703 WeakPolarHBondContact O-CD2 3.07Å; K699-F703 WeakPolarHBondContact O-CG 3.48Å; K699-F703 PolarHBondContact O-N 2.84Å; M700-F703 HydrophobicContact CE-CD2 4.44Å; M700-F703 HydrophobicContact CE-CE2 4.39Å; M700-F703 PolarHBondContact O-N 2.89Å; M700-F703 HydrophobicContact SD-CD2 4.27Å; D701-F703 VanDerWaalsContact C-N 3.32Å; D701-F703 PolarHBondContact O-N 3.34Å; F703-A706 PolarHBondContact O-N 3.41Å; F703-S707 PolarHBondContact O-N 3.36Å; F703-F714 HydrophobicContact CB-CD1 3.87Å; F703-F714 HydrophobicContact CB-CE1 3.65Å; F703-F714 HydrophobicContact CB-CZ 4.2Å; F703-F714 HydrophobicContact CD1-CD1 4.42Å; F703-F714 AromaticContact CD1-CE1 3.58Å; F703-F714 HydrophobicContact CD1-CE1 3.58Å; F703-F714 AromaticContact CD1-CE2 3.8Å; F703-F714 HydrophobicContact CD1-CE2 3.8Å; F703-F714 AromaticContact CD1-CZ 3.22Å; F703-F714 HydrophobicContact CD1-CZ 3.22Å; F703-F714 HydrophobicContact CD2-CE1 4.12Å; F703-F714 HydrophobicContact CD2-CZ 4.4Å; F703-F714 HydrophobicContact CE1-CE1 4.23Å; F703-F714 HydrophobicContact CE1-CE2 4.23Å; F703-F714 AromaticContact CE1-CZ 3.57Å; F703-F714 HydrophobicContact CE1-CZ 3.57Å; F703-F714 HydrophobicContact CG-CD1 4.25Å; F703-F714 AromaticContact CG-CE1 3.52Å; F703-F714 HydrophobicContact CG-CE1 3.52Å; F703-F714 AromaticContact CG-CZ 3.7Å; F703-F714 HydrophobicContact CG-CZ 3.7Å; F703-F714 HydrophobicContact CZ-CZ 4.29Å
704	I	91.9	Very high	91	Very high	22 Å²	22	64.8 Å²	64.8	11%	0.113	33%	0.333	C	S	.	.	H	α-helix	trans	-70.2	-40	174.7	-70.1	167.1	0	0	0	111	V543 R547 M700 D701 E702 S707	V543-I704 HydrophobicContact CB-CG1 4.36Å; V543-I704 HydrophobicContact CG1-CD1 4.27Å; V543-I704 HydrophobicContact CG1-CG1 3.68Å; R547-I704 HydrophobicContact CB-CD1 4.06Å; R547-I704 HydrophobicContact CG-CD1 4.43Å; R547-I704 VanDerWaalsContact CZ-CD1 3.48Å; M700-I704 WeakPolarHBondContact O-CG1 3.49Å; M700-I704 PolarHBondContact O-N 3.21Å; D701-I704 PolarHBondContact O-N 2.79Å; E702-I704 PolarHBondContact O-N 2.78Å; I704-S707 WeakPolarHBondContact O-CB 3.4Å; I704-S707 PolarHBondContact O-N 2.96Å; I704-S707 PolarHBondContact O-OG 2.81Å
705	M	91.9	Very high	90.3	Very high	129 Å²	129	65 Å²	65	64%	0.635	33%	0.33	S	S	*	.	H	α-helix	trans	-62.9	-44.5	171.8	-67.3	-179.8	-168	0	0	110.8	D701 E702 S707 Q708	D701-M705 WeakPolarHBondContact O-CG 3.23Å; D701-M705 PolarHBondContact O-N 2.88Å; E702-M705 PolarHBondContact O-N 3.49Å; M705-S707 PolarHBondContact O-N 2.88Å; M705-Q708 WeakPolarHBondContact O-CB 3.45Å; M705-Q708 PolarHBondContact O-N 2Å; M705-Q708 VanDerWaalsContact O-N 3.08Å
706	A	91.2	Very high	89.2	Confident	37 Å²	37	64.3 Å²	64.3	31%	0.306	33%	0.327	S	S	.	.	H	α-helix	trans	-60.5	-28.7	175.6	0	0	0	0	0	113	E702 F703 Q708 N709 S712 F714	E702-A706 WeakPolarHBondContact O-CB 3.01Å; E702-A706 PolarHBondContact O-N 2.84Å; F703-A706 PolarHBondContact O-N 3.41Å; A706-Q708 PolarHBondContact O-N 2.98Å; A706-N709 PolarHBondContact O-N 3.23Å; A706-S712 WeakPolarHBondContact O-CB 3.49Å; A706-S712 PolarHBondContact O-OG 2.93Å; A706-F714 HydrophobicContact CB-CD2 4.22Å
707	S	86.7	Confident	87.9	Confident	19 Å²	19	67.8 Å²	67.8	13%	0.133	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-15.1	176.7	81.1	0	0	0	0	114.4	F703 I704 M705 N709 S715	F703-S707 PolarHBondContact O-N 3.36Å; I704-S707 WeakPolarHBondContact O-CB 3.4Å; I704-S707 PolarHBondContact O-N 2.96Å; I704-S707 PolarHBondContact O-OG 2.81Å; M705-S707 PolarHBondContact O-N 2.88Å; S707-N709 VanDerWaalsContact C-N 3.3Å; S707-S715 WeakPolarHBondContact O-CB 3.17Å
708	Q	85	Confident	86.9	Confident	153 Å²	153	67.7 Å²	67.7	72%	0.715	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.1	-18.2	176.4	-58.6	178.7	0.9	0	0	112.6	M705 A706	M705-Q708 WeakPolarHBondContact O-CB 3.45Å; M705-Q708 PolarHBondContact O-N 2Å; M705-Q708 VanDerWaalsContact O-N 3.08Å; A706-Q708 PolarHBondContact O-N 2.98Å
709	N	86.7	Confident	85.7	Confident	88 Å²	88	62.3 Å²	62.3	47%	0.471	33%	0.327	S	S	.	.	S	Bend	trans	-87.6	113.9	173	178.6	1.3	0	0	0	109.4	A706 S707 Q711 S712 S715	A706-N709 PolarHBondContact O-N 3.23Å; S707-N709 VanDerWaalsContact C-N 3.3Å; N709-Q711 PolarHBondContact O-N 2.98Å; N709-Q711 PolarHBondContact OD1-N 2.94Å; N709-S712 WeakPolarHBondContact O-CB 3.46Å; N709-S712 PolarHBondContact O-N 2.74Å; N709-S715 WeakPolarHBondContact O-CB 3.4Å; N709-S715 PolarHBondContact O-OG 2.87Å; N709-S715 VanDerWaalsContact O-OG 3.12Å
710	N	78.1	Confident	84.6	Confident	142 Å²	142	60.1 Å²	60.1	76%	0.759	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-15.9	-179.4	-70.3	-14.6	0	0	0	115.1	S715	N710-S715 VanDerWaalsContact C-OG 3.26Å; N710-S715 WeakPolarHBondContact CA-OG 3.38Å; N710-S715 PolarHBondContact O-OG 3.12Å; N710-S715 VanDerWaalsContact O-OG 3.11Å
711	Q	80	Confident	83.2	Confident	175 Å²	175	61.8 Å²	61.8	82%	0.818	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.1	-5	175.2	-61.6	-179.2	-4.1	0	0	113.2	N709	N709-Q711 PolarHBondContact O-N 2.98Å; N709-Q711 PolarHBondContact OD1-N 2.94Å
712	S	85.5	Confident	81.7	Confident	13 Å²	13	61 Å²	61	9%	0.091	33%	0.327	C	S	.	.	S	Bend	trans	-73.1	148	-177	-174	0	0	0	0	111.8	A706 N709 F714 S715 Q716	A706-S712 WeakPolarHBondContact O-CB 3.49Å; A706-S712 PolarHBondContact O-OG 2.93Å; N709-S712 WeakPolarHBondContact O-CB 3.46Å; N709-S712 PolarHBondContact O-N 2.74Å; S712-F714 PolarHBondContact O-N 3.49Å; S712-F714 WeakPolarHBondContact OG-CB 3.08Å; S712-F714 PolarHBondContact OG-N 2.92Å; S712-F714 VanDerWaalsContact OG-N 3.15Å; S712-S715 PolarHBondContact O-N 3.07Å; S712-S715 PolarHBondContact O-OG 3.4Å; S712-Q716 PolarHBondContact O-NE2 3.49Å
713	P	84.8	Confident	79.8	Confident	59 Å²	59	60 Å²	60	38%	0.383	33%	0.329	S	S	.	.	G	3₁₀ helix	trans	-62.7	-19.8	165.5	28	-34.4	0	0	0	111.7	L539 P672 Q716	L539-P713 VanDerWaalsContact CD2-O 3.31Å; L539-P713 WeakPolarHBondContact CD2-O 3.33Å; P672-P713 HydrophobicContact CB-CB 4.09Å; P672-P713 HydrophobicContact CB-CG 4.26Å; P672-P713 HydrophobicContact CG-CB 4.18Å; P713-Q716 WeakPolarHBondContact O-CG 2.95Å
714	F	87.5	Confident	78	Confident	7 Å²	7	60.2 Å²	60.2	3%	0.031	33%	0.331	C	S	.	.	G	3₁₀ helix	trans	-80.9	-14.9	178.4	-67.4	-89.3	0	0	0	114.7	P540 V543 P672 E674 L675 F703 A706 S712	P540-F714 WeakPolarHBondContact CD-O 3.23Å; P540-F714 WeakPolarHBondContact CG-O 3.18Å; V543-F714 HydrophobicContact CG2-CD1 4.29Å; P672-F714 HydrophobicContact CB-CD2 4.43Å; P672-F714 HydrophobicContact CB-CE1 4.06Å; P672-F714 HydrophobicContact CB-CE2 3.85Å; P672-F714 HydrophobicContact CB-CZ 3.64Å; P672-F714 HydrophobicContact CG-CD1 3.95Å; P672-F714 HydrophobicContact CG-CD2 4.34Å; P672-F714 HydrophobicContact CG-CE1 3.78Å; P672-F714 HydrophobicContact CG-CE2 4.16Å; P672-F714 HydrophobicContact CG-CG 4.24Å; P672-F714 HydrophobicContact CG-CZ 3.87Å; E674-F714 HydrophobicContact CB-CE2 4.42Å; E674-F714 HydrophobicContact CB-CZ 4.3Å; L675-F714 HydrophobicContact CB-CE1 3.97Å; L675-F714 HydrophobicContact CB-CZ 4.04Å; L675-F714 HydrophobicContact CD2-CE1 4.39Å; F703-F714 HydrophobicContact CB-CD1 3.87Å; F703-F714 HydrophobicContact CB-CE1 3.65Å; F703-F714 HydrophobicContact CB-CZ 4.2Å; F703-F714 HydrophobicContact CD1-CD1 4.42Å; F703-F714 AromaticContact CD1-CE1 3.58Å; F703-F714 HydrophobicContact CD1-CE1 3.58Å; F703-F714 AromaticContact CD1-CE2 3.8Å; F703-F714 HydrophobicContact CD1-CE2 3.8Å; F703-F714 AromaticContact CD1-CZ 3.22Å; F703-F714 HydrophobicContact CD1-CZ 3.22Å; F703-F714 HydrophobicContact CD2-CE1 4.12Å; F703-F714 HydrophobicContact CD2-CZ 4.4Å; F703-F714 HydrophobicContact CE1-CE1 4.23Å; F703-F714 HydrophobicContact CE1-CE2 4.23Å; F703-F714 AromaticContact CE1-CZ 3.57Å; F703-F714 HydrophobicContact CE1-CZ 3.57Å; F703-F714 HydrophobicContact CG-CD1 4.25Å; F703-F714 AromaticContact CG-CE1 3.52Å; F703-F714 HydrophobicContact CG-CE1 3.52Å; F703-F714 AromaticContact CG-CZ 3.7Å; F703-F714 HydrophobicContact CG-CZ 3.7Å; F703-F714 HydrophobicContact CZ-CZ 4.29Å; A706-F714 HydrophobicContact CB-CD2 4.22Å; S712-F714 PolarHBondContact O-N 3.49Å; S712-F714 WeakPolarHBondContact OG-CB 3.08Å; S712-F714 PolarHBondContact OG-N 2.92Å; S712-F714 VanDerWaalsContact OG-N 3.15Å
715	S	80.9	Confident	76	Confident	30 Å²	30	61.5 Å²	61.5	21%	0.21	34%	0.34	C	S	.	.	G	3₁₀ helix	trans	-93.4	6	178.2	65.1	0	0	0	0	113.5	S707 N709 N710 S712	S707-S715 WeakPolarHBondContact O-CB 3.17Å; N709-S715 WeakPolarHBondContact O-CB 3.4Å; N709-S715 PolarHBondContact O-OG 2.87Å; N709-S715 VanDerWaalsContact O-OG 3.12Å; N710-S715 VanDerWaalsContact C-OG 3.26Å; N710-S715 WeakPolarHBondContact CA-OG 3.38Å; N710-S715 PolarHBondContact O-OG 3.12Å; N710-S715 VanDerWaalsContact O-OG 3.11Å; S712-S715 PolarHBondContact O-N 3.07Å; S712-S715 PolarHBondContact O-OG 3.4Å
716	Q	74.3	Confident	74.2	Confident	92 Å²	92	61.9 Å²	61.9	43%	0.43	34%	0.338	S	S	.	.	S	Bend	trans	-78.6	147.9	-172.9	-59.3	-56.2	-45.1	0	0	112.5	S712 P713	S712-Q716 PolarHBondContact O-NE2 3.49Å; P713-Q716 WeakPolarHBondContact O-CG 2.95Å
717	P	70.9	Confident	72	Confident	74 Å²	74	65.4 Å²	65.4	48%	0.481	36%	0.361	S	S	.	.	P	Polyproline II helix	trans	-62.9	140.6	170	28.5	-34.6	0	0	0	109.9	V719	P717-V719 HydrophobicContact CG-CG2 4.42Å; P717-V719 PolarHBondContact O-N 3Å
718	F	76.4	Confident	69.8	Low	8 Å²	8	69 Å²	69	4%	0.035	38%	0.378	C	S	.	.	P	Polyproline II helix	trans	-81.1	121.4	176.7	-166.8	-79.7	0	0	0	109.9	A535 L537 L542 L640 L642 N670 V720	A535-F718 HydrophobicContact CB-CB 4.33Å; A535-F718 HydrophobicContact CB-CD1 3.72Å; A535-F718 HydrophobicContact CB-CG 4.43Å; A535-F718 PolarHBondContact N-O 3.07Å; L537-F718 WeakPolarHBondContact O-CB 3.47Å; L542-F718 HydrophobicContact CD1-CD2 3.3Å; L542-F718 HydrophobicContact CD1-CE2 3.28Å; L542-F718 HydrophobicContact CD1-CG 4.07Å; L542-F718 HydrophobicContact CD1-CZ 4.06Å; L640-F718 WeakPolarHBondContact O-CZ 3.23Å; L642-F718 HydrophobicContact CD1-CD1 4.1Å; L642-F718 HydrophobicContact CD1-CE1 3.67Å; L642-F718 HydrophobicContact CD1-CZ 4.48Å; L642-F718 HydrophobicContact CD2-CE1 4.28Å; L642-F718 HydrophobicContact CD2-CZ 4.44Å; L642-F718 HydrophobicContact CG-CD1 4.49Å; L642-F718 HydrophobicContact CG-CE1 3.76Å; L642-F718 HydrophobicContact CG-CZ 4.08Å; N670-F718 HydrophobicContact CB-CD2 3.55Å; N670-F718 HydrophobicContact CB-CE2 3.48Å; N670-F718 VanDerWaalsContact CB-CE2 3.48Å; N670-F718 HydrophobicContact CB-CG 4.18Å; N670-F718 HydrophobicContact CB-CZ 4.03Å; N670-F718 VanDerWaalsContact ND2-CE1 3.32Å; N670-F718 WeakPolarHBondContact ND2-CE1 3.17Å; N670-F718 WeakPolarHBondContact ND2-CZ 3.25Å; F718-V720 HydrophobicContact CD1-CG2 4.46Å; F718-V720 HydrophobicContact CE1-CG2 4.21Å
719	V	73	Confident	67.6	Low	31 Å²	31	67 Å²	67	19%	0.188	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	131.7	-166.2	166.7	0	0	0	0	110.9	T532 L533 T534 N670 P717	T532-V719 HydrophobicContact CG2-CG1 3.22Å; L533-V719 CarbonylContact O-C 3.52Å; L533-V719 WeakPolarHBondContact O-CA 3.21Å; T534-V719 HydrophobicContact CG2-CG2 4.35Å; N670-V719 VanDerWaalsContact CG-O 3.29Å; N670-V719 PolarHBondContact ND2-O 2.9Å; N670-V719 PolarHBondContact OD1-N 2.98Å; N670-V719 PolarHBondContact OD1-O 2.81Å; N670-V719 VanDerWaalsContact OD1-O 3.06Å; P717-V719 HydrophobicContact CG-CG2 4.42Å; P717-V719 PolarHBondContact O-N 3Å
720	V	71.8	Confident	65	Low	27 Å²	27	66.6 Å²	66.6	16%	0.164	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	117.7	176.2	-174.3	0	0	0	0	109.5	P480 L533 L642 F718 M755	P480-V720 HydrophobicContact CG-CB 4.02Å; P480-V720 HydrophobicContact CG-CG2 3.73Å; L533-V720 PolarHBondContact N-O 2.84Å; L533-V720 PolarHBondContact O-N 3.07Å; L642-V720 HydrophobicContact CD1-CG2 4.41Å; F718-V720 HydrophobicContact CD1-CG2 4.46Å; F718-V720 HydrophobicContact CE1-CG2 4.21Å; V720-M755 HydrophobicContact CG1-CE 3.91Å
721	S	67.2	Low	62.6	Low	37 Å²	37	63.4 Å²	63.4	26%	0.259	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	127.7	174.4	-69.4	0	0	0	0	111.5	E669	E669-S721 WeakPolarHBondContact OE1-CB 3.24Å; E669-S721 PolarHBondContact OE1-OG 3.3Å
722	L	62.5	Low	60.2	Low	31 Å²	31	61 Å²	61	16%	0.162	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	124.3	175	-65.4	178.6	0	0	0	110.7	I482 V530 I531 L533 M755	I482-L722 HydrophobicContact CD1-CD1 4.31Å; V530-L722 CarbonylContact C-O 3.51Å; V530-L722 VanDerWaalsContact CA-O 3.31Å; V530-L722 WeakPolarHBondContact CA-O 3.41Å; I531-L722 HydrophobicContact CB-CB 4.37Å; I531-L722 PolarHBondContact N-O 2.94Å; I531-L722 PolarHBondContact O-N 3.21Å; L533-L722 HydrophobicContact CD1-CD1 3.65Å; L533-L722 HydrophobicContact CD1-CG 4.49Å; L533-L722 HydrophobicContact CG-CD1 4.47Å; L722-M755 HydrophobicContact CD2-CB 4.42Å; L722-M755 HydrophobicContact CD2-CE 4.26Å; L722-M755 HydrophobicContact CD2-CG 4Å
723	P	56	Low	57.4	Low	70 Å²	70	63.7 Å²	63.7	46%	0.455	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	140.1	175.6	28.1	-33.8	0	0	0	111.4	L751	P723-L751 HydrophobicContact CG-CB 4.39Å; P723-L751 WeakPolarHBondContact CG-O 3.38Å
724	L	55.3	Low	54.8	Low	21 Å²	21	70.5 Å²	70.5	11%	0.11	45%	0.446	C	S	.	.	P	Polyproline II helix	trans	-65.1	138.6	172.4	-91.2	163.2	0	0	0	111.3	F491 A494 A498 N529 I531 K726	F491-L724 HydrophobicContact CD1-CD2 4.1Å; A494-L724 HydrophobicContact CB-CD1 4.09Å; A494-L724 HydrophobicContact CB-CD2 3.97Å; A494-L724 HydrophobicContact CB-CG 4.36Å; A498-L724 HydrophobicContact CB-CD1 4.26Å; N529-L724 PolarHBondContact O-N 3.23Å; I531-L724 HydrophobicContact CD1-CD2 4.07Å; I531-L724 HydrophobicContact CD1-CG 4.45Å; L724-K726 PolarHBondContact O-N 3.3Å
725	P	51.2	Low	51.8	Low	48 Å²	48	79.6 Å²	79.6	31%	0.312	49%	0.488	S	S	.	.	P	Polyproline II helix	trans	-58.2	128.3	176.4	-25.1	34.5	0	0	0	112.4	F491 S727 L728	F491-P725 HydrophobicContact CD1-CG 4.12Å; F491-P725 HydrophobicContact CE1-CG 4.17Å; P725-S727 PolarHBondContact O-N 3.41Å; P725-L728 PolarHBondContact O-N 3.07Å
726	K	52.2	Low	49.2	Very low	137 Å²	137	82.5 Å²	82.5	60%	0.596	51%	0.514	S	S	*	.	G	3₁₀ helix	trans	-56.5	-25.8	179.2	-65.8	167.6	-175.5	150.1	0	113	L724 L728 Q729 D750	L724-K726 PolarHBondContact O-N 3.3Å; K726-L728 PolarHBondContact O-N 2.93Å; K726-Q729 WeakPolarHBondContact O-CB 3.24Å; K726-Q729 PolarHBondContact O-N 2.93Å; K726-Q729 VanDerWaalsContact O-N 3.1Å; K726-D750 IonicContact NZ-OD1 3.45Å; K726-D750 PolarHBondContact NZ-OD1 2.92Å
727	S	45.2	Very low	47	Very low	112 Å²	112	83 Å²	83	78%	0.783	53%	0.528	S	S	*	.	G	3₁₀ helix	trans	-65.9	-11	179.7	53.7	0	0	0	0	115.6	P725	P725-S727 PolarHBondContact O-N 3.41Å
728	L	41	Very low	44.9	Very low	95 Å²	95	86.2 Å²	86.2	50%	0.497	54%	0.539	S	S	.	.	G	3₁₀ helix	trans	-97.9	-1.2	174.1	-76.4	159.8	0	0	0	113.3	A495 P725 K726 G730	A495-L728 HydrophobicContact CB-CB 4.29Å; A495-L728 HydrophobicContact CB-CD1 4.25Å; P725-L728 PolarHBondContact O-N 3.07Å; K726-L728 PolarHBondContact O-N 2.93Å; L728-G730 PolarHBondContact O-N 3.28Å
729	Q	39.3	Very low	42.5	Very low	109 Å²	109	94.7 Å²	94.7	51%	0.509	57%	0.572	S	S	.	*	S	Bend	trans	-81	85.9	173.9	-61.8	-173.9	4.1	0	0	109.6	K726 G731	K726-Q729 WeakPolarHBondContact O-CB 3.24Å; K726-Q729 PolarHBondContact O-N 2.93Å; K726-Q729 VanDerWaalsContact O-N 3.1Å; Q729-G731 PolarHBondContact O-N 2.02Å; Q729-G731 VanDerWaalsContact O-N 3.12Å
730	G	31.9	Very low	40.4	Very low	80 Å²	80	97 Å²	97	83%	0.825	60%	0.602	S	S	*	*			trans	-59.8	111.6	-176.3	0	0	0	0	0	113.5	L728	L728-G730 PolarHBondContact O-N 3.28Å
731	G	28.5	Very low	38.2	Very low	76 Å²	76	100.5 Å²	100.5	78%	0.784	63%	0.628	S	S	*	*			trans	-75.8	120.1	158.9	0	0	0	0	0	109.5	Q729 G733	Q729-G731 PolarHBondContact O-N 2.02Å; Q729-G731 VanDerWaalsContact O-N 3.12Å; G731-G733 PolarHBondContact O-N 2.72Å
732	S	28.2	Very low	36.6	Very low	124 Å²	124	106 Å²	106	87%	0.867	66%	0.655	S	S	*	*			trans	-70.7	119.3	178.3	52.3	0	0	0	0	111.7
733	G	26.5	Very low	34.9	Very low	69 Å²	69	113.9 Å²	113.9	71%	0.711	69%	0.687	S	S	*	*			trans	86.2	98.3	159.4	0	0	0	0	0	116.8	G731	G731-G733 PolarHBondContact O-N 2.72Å
734	Q	29.9	Very low	33.9	Very low	203 Å²	203	115.3 Å²	115.3	95%	0.949	70%	0.697	S	S	*	*				-174.2	127.1	123	-101.8	168.1	12.7	0	0	111
735	Q	25.5	Very low	32.5	Very low	197 Å²	197	122.3 Å²	122.3	92%	0.921	73%	0.729	S	S	*	*			trans	-86.2	122.1	162.1	-66.5	164.3	-53.5	0	0	108
736	A	26.2	Very low	31.4	Very low	91 Å²	91	126.2 Å²	126.2	75%	0.752	74%	0.742	S	S	*	*			trans	179.3	143.6	147.3	0	0	0	0	0	114.8
737	S	27.3	Very low	30.2	Very low	104 Å²	104	126.8 Å²	126.8	73%	0.727	75%	0.747	S	S	*	*			trans	38.7	106.3	144.8	63.8	0	0	0	0	122.6
738	I	26.7	Very low	29.3	Very low	140 Å²	140	127.6 Å²	127.6	72%	0.718	75%	0.75	S	S	*	*				15.2	133.3	115.5	-37.5	179.7	0	0	0	118.6
739	Y	26.1	Very low	28.6	Very low	187 Å²	187	128.2 Å²	128.2	73%	0.733	75%	0.753	S	S	*	*			trans	76.8	117.5	166.8	-78.9	-66.6	0	0	0	118.6
740	G	28.8	Very low	28.1	Very low	78 Å²	78	128.4 Å²	128.4	80%	0.804	76%	0.758	S	S	*	*			trans	179.5	122.1	167.9	0	0	0	0	0	112.1
741	S	27.5	Very low	27.9	Very low	102 Å²	102	132 Å²	132	71%	0.713	76%	0.758	S	S	*	*			trans	-75	143.9	177	168.7	0	0	0	0	111.7
742	N	31.7	Very low	27.9	Very low	153 Å²	153	131.9 Å²	131.9	82%	0.818	74%	0.744	S	S	*	*				179	142.3	119.3	-83.4	-19.5	0	0	0	114
743	K	27.5	Very low	28	Very low	196 Å²	196	131.6 Å²	131.6	85%	0.852	73%	0.733	S	S	*	*			trans	-77.3	-179.6	158.9	-82.6	-178.6	176.3	178.6	0	109.5
744	P	34.7	Very low	28.3	Very low	100 Å²	100	132.2 Å²	132.2	65%	0.649	73%	0.725	S	S	*	*			cis	-129.1	-176.7	-25.2	27.2	-6.5	0	0	0	112.4
745	H	27.6	Very low	28.4	Very low	168 Å²	168	125.1 Å²	125.1	78%	0.778	69%	0.693	S	S	*	*				163.5	160.6	125.5	-95.5	-86	0	0	0	112.9
746	H	27.4	Very low	28.6	Very low	129 Å²	129	119.3 Å²	119.3	60%	0.597	67%	0.668	S	S	*	*			trans	-93.9	125.9	-178.4	-106.8	-76.8	0	0	0	111.6	L1024	H746-L1024 WeakPolarHBondContact CE1-CD1 3.43Å
747	E	26.7	Very low	28.7	Very low	149 Å²	149	118.6 Å²	118.6	70%	0.696	66%	0.657	S	S	*	*			trans	-136.9	141.5	155.2	-91	-151.3	165.2	0	0	110.7	N749	E747-N749 PolarHBondContact O-N 2.88Å; E747-N749 PolarHBondContact OE2-ND2 2.84Å
748	P	26.3	Very low	28.9	Very low	130 Å²	130	120.6 Å²	120.6	84%	0.844	66%	0.659	S	S	*	*			trans	-94.5	62.5	176	38.5	-33.5	0	0	0	111.1
749	N	26.7	Very low	28.9	Very low	107 Å²	107	120.5 Å²	120.5	57%	0.572	66%	0.661	S	S	*	*			trans	-126.9	89.5	-176.4	-86.9	-37	0	0	0	112.1	E747	E747-N749 PolarHBondContact O-N 2.88Å; E747-N749 PolarHBondContact OE2-ND2 2.84Å
750	D	29.1	Very low	28.9	Very low	114 Å²	114	116.7 Å²	116.7	61%	0.61	66%	0.66	S	S	*	*			trans	-161.4	114.1	143.9	-95.5	-25.5	0	0	0	111.1	K726 S752	K726-D750 IonicContact NZ-OD1 3.45Å; K726-D750 PolarHBondContact NZ-OD1 2.92Å; D750-S752 PolarHBondContact O-N 2.83Å
751	L	28	Very low	28.7	Very low	156 Å²	156	121.9 Å²	121.9	82%	0.817	66%	0.663	S	S	*	*			trans	-69	82.6	158.2	-83	95.5	0	0	0	108.6	P723	P723-L751 HydrophobicContact CG-CB 4.39Å; P723-L751 WeakPolarHBondContact CG-O 3.38Å
752	S	26.5	Very low	28.6	Very low	72 Å²	72	122.7 Å²	122.7	50%	0.503	65%	0.651	S	S	.	*			trans	-152.9	156.7	171.5	71.4	0	0	0	0	114.1	D750 C754	D750-S752 PolarHBondContact O-N 2.83Å; S752-C754 PolarHBondContact O-N 3.25Å
753	L	32.3	Very low	28.3	Very low	118 Å²	118	122 Å²	122	62%	0.618	65%	0.645	S	S	*	*	S	Bend	trans	74.6	-6.8	162.3	-61.8	165.9	0	0	0	121.1	M755 L756	L753-M755 PolarHBondContact O-N 3.22Å; L753-L756 HydrophobicContact CD2-CB 4.16Å; L753-L756 HydrophobicContact CD2-CD1 3.89Å; L753-L756 PolarHBondContact O-N 3.47Å
754	C	30.9	Very low	28.3	Very low	82 Å²	82	118.2 Å²	118.2	55%	0.554	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.2	-11.4	163.8	-84.4	0	0	0	0	114	S752	S752-C754 PolarHBondContact O-N 3.25Å
755	M	32.5	Very low	27.9	Very low	55 Å²	55	118 Å²	118	27%	0.271	64%	0.64	S	S	.	*	T	Hydrogen-bonded Turn	trans	-89.7	-5.8	175.4	-68.5	-77.7	-74.3	0	0	113.6	R479 P480 V720 L722 L753	R479-M755 HydrophobicContact CB-SD 4.5Å; P480-M755 WeakPolarHBondContact O-CE 3.44Å; V720-M755 HydrophobicContact CG1-CE 3.91Å; L722-M755 HydrophobicContact CD2-CB 4.42Å; L722-M755 HydrophobicContact CD2-CE 4.26Å; L722-M755 HydrophobicContact CD2-CG 4Å; L753-M755 PolarHBondContact O-N 3.22Å
756	L	30.1	Very low	27.8	Very low	75 Å²	75	115.5 Å²	115.5	39%	0.393	63%	0.632	S	S	.	*	S	Bend	trans	-125	13.4	-175.4	-73.2	166.6	0	0	0	113	L753 N758	L753-L756 HydrophobicContact CD2-CB 4.16Å; L753-L756 HydrophobicContact CD2-CD1 3.89Å; L753-L756 PolarHBondContact O-N 3.47Å; L756-N758 PolarHBondContact O-N 3.12Å; L756-N758 VanDerWaalsContact O-N 3.14Å
757	S	28.9	Very low	27.9	Very low	76 Å²	76	116.8 Å²	116.8	53%	0.531	64%	0.643	S	S	.	*			trans	-78.4	95.7	-178.7	-174.9	0	0	0	0	112.1	N759	S757-N759 PolarHBondContact O-N 2.9Å
758	N	30.1	Very low	27.9	Very low	145 Å²	145	113.3 Å²	113.3	78%	0.775	65%	0.647	S	S	*	*			trans	-73.3	45.5	169.8	-82.8	-22.6	0	0	0	112.9	L756	L756-N758 PolarHBondContact O-N 3.12Å; L756-N758 VanDerWaalsContact O-N 3.14Å
759	N	27.3	Very low	28	Very low	139 Å²	139	110.6 Å²	110.6	74%	0.743	64%	0.643	S	S	*	*			trans	-125.6	47.2	178.5	-93.9	-30.4	0	0	0	112.7	S757	S757-N759 PolarHBondContact O-N 2.9Å
760	C	26.4	Very low	27.9	Very low	107 Å²	107	116.8 Å²	116.8	72%	0.723	66%	0.658	S	S	*	*			trans	-113.4	90.9	156.6	-90.4	0	0	0	0	108.5	R762	C760-R762 PolarHBondContact O-N 2.98Å
761	Q	24.6	Very low	27.7	Very low	186 Å²	186	117.4 Å²	117.4	87%	0.869	67%	0.669	S	S	*	*			trans	-65.2	83.2	165.5	-74.8	-172.5	-8.7	0	0	109.2
762	R	25.4	Very low	27.7	Very low	120 Å²	120	116.5 Å²	116.5	45%	0.453	67%	0.669	S	S	.	*			trans	-99	114.7	168.6	-162.8	172.4	-67.3	-138.7	-7.1	108.1	D473 C760 T764	D473-R762 VanDerWaalsContact CG-NH2 3.25Å; D473-R762 IonicContact OD1-NH2 3.24Å; D473-R762 IonicContact OD2-CZ 2.86Å; D473-R762 IonicContact OD2-NH1 2.74Å; D473-R762 IonicContact OD2-NH2 3.55Å; D473-R762 PolarHBondContact OD2-NH2 3.45Å; C760-R762 PolarHBondContact O-N 2.98Å; R762-T764 PolarHBondContact O-N 3.23Å
763	I	25.8	Very low	27.7	Very low	137 Å²	137	117 Å²	117	70%	0.703	67%	0.673	S	S	*	*			trans	-61.4	114.9	178.9	-64.1	162.1	0	0	0	108.8
764	T	27.5	Very low	27.5	Very low	118 Å²	118	118 Å²	118	72%	0.724	68%	0.679	S	S	*	*			trans	-138.9	93.9	163.8	52.4	0	0	0	0	108.1	R762 L766	R762-T764 PolarHBondContact O-N 3.23Å; T764-L766 PolarHBondContact O-N 3.08Å
765	S	25.5	Very low	27.4	Very low	96 Å²	96	122.2 Å²	122.2	67%	0.671	69%	0.693	S	S	*	*			trans	-73	110.9	166.8	50.8	0	0	0	0	108.9
766	L	26.3	Very low	27.2	Very low	114 Å²	114	126 Å²	126	60%	0.597	71%	0.714	S	S	*	*			trans	-142.8	136.7	169	-101.8	163	0	0	0	106.6	T764	T764-L766 PolarHBondContact O-N 3.08Å
767	D	29.2	Very low	26.9	Very low	156 Å²	156	127.5 Å²	127.5	83%	0.834	73%	0.731	S	S	*	*			trans	59	143.8	-166.4	-65.5	-40.3	0	0	0	115.2
768	G	26.1	Very low	26.8	Very low	76 Å²	76	128.9 Å²	128.9	78%	0.784	74%	0.74	S	S	*	*			cis	127.7	103.8	7.6	0	0	0	0	0	109.9
769	G	27.9	Very low	26.7	Very low	74 Å²	74	129.2 Å²	129.2	76%	0.763	74%	0.741	S	S	*	*			trans	176.1	115.3	-179.5	0	0	0	0	0	113.2
770	R	25.5	Very low	26.6	Very low	236 Å²	236	129.3 Å²	129.3	89%	0.891	74%	0.74	S	S	*	*			trans	-75.5	148.5	173.3	-66.6	177.7	176.2	-171.3	-1.9	110.4
771	P	25	Very low	26.7	Very low	128 Å²	128	130.9 Å²	130.9	83%	0.831	74%	0.742	S	S	*	*			trans	-74	133.1	161.9	32.5	-31.5	0	0	0	109.3
772	V	28.8	Very low	26.7	Very low	136 Å²	136	129.3 Å²	129.3	82%	0.824	73%	0.734	S	S	*	*			trans	-130.3	119.1	162.2	179.7	0	0	0	0	106.4
773	S	26.5	Very low	26.7	Very low	83 Å²	83	128 Å²	128	58%	0.58	74%	0.74	S	S	*	*			trans	-76.8	174.6	173.4	49.3	0	0	0	0	111.1
774	D	27.1	Very low	26.7	Very low	138 Å²	138	127.9 Å²	127.9	74%	0.738	74%	0.741	S	S	*	*			trans	70.4	98.6	159.4	-41.5	-48.2	0	0	0	116.7
775	M	28.4	Very low	26.6	Very low	172 Å²	172	129.2 Å²	129.2	85%	0.847	74%	0.742	S	S	*	*				-177	135.9	94.7	-94.5	-175.7	175.1	0	0	113.3
776	D	28.8	Very low	26.5	Very low	135 Å²	135	129.1 Å²	129.1	72%	0.722	74%	0.742	S	S	*	*			trans	48.8	104.3	146.4	-58.7	-11.8	0	0	0	121.9
777	S	24.3	Very low	26.5	Very low	106 Å²	106	133 Å²	133	74%	0.741	76%	0.757	S	S	*	*				1.5	130.8	125.5	56	0	0	0	0	119
778	S	27.5	Very low	26.3	Very low	105 Å²	105	128.9 Å²	128.9	73%	0.734	75%	0.752	S	S	*	*				-175.9	147.5	115.7	41.8	0	0	0	0	113.2
779	L	27.8	Very low	26.2	Very low	151 Å²	151	133.9 Å²	133.9	79%	0.791	76%	0.757	S	S	*	*			trans	57.9	106.6	155	-60.3	156	0	0	0	117.2
780	I	24.7	Very low	26.1	Very low	141 Å²	141	135.1 Å²	135.1	72%	0.723	75%	0.754	S	S	*	*				62.3	94.7	54	-50.2	175.9	0	0	0	113.6
781	N	27.3	Very low	26.2	Very low	141 Å²	141	129 Å²	129	75%	0.754	75%	0.747	S	S	*	*				167.3	114.6	128.1	-90.9	-24.5	0	0	0	109.3
782	E	25	Very low	26.3	Very low	153 Å²	153	127.6 Å²	127.6	72%	0.715	74%	0.74	S	S	*	*				80.3	108.9	82.9	-81.6	-84.5	117.6	0	0	113.3
783	T	25.7	Very low	26.2	Very low	92 Å²	92	129.4 Å²	129.4	56%	0.564	74%	0.737	S	S	*	*			trans	49.7	124.7	141	68.9	0	0	0	0	119.3
784	N	26.5	Very low	26.2	Very low	135 Å²	135	132.3 Å²	132.3	72%	0.722	74%	0.742	S	S	*	*				-178.5	160.4	77	-95.3	-56.7	0	0	0	114.7
785	L	24.4	Very low	26.1	Very low	145 Å²	145	132.6 Å²	132.6	76%	0.759	74%	0.742	S	S	*	*			trans	27.3	121.9	151	-83.9	68.8	0	0	0	122.2
786	S	23.9	Very low	26.1	Very low	95 Å²	95	131.8 Å²	131.8	66%	0.664	74%	0.74	S	S	*	*				4.1	126.7	129.8	58.4	0	0	0	0	120.4
787	Q	25.7	Very low	25.9	Very low	194 Å²	194	132.8 Å²	132.8	91%	0.907	75%	0.745	S	S	*	*				169.5	158	121.8	-94.1	178	19.9	0	0	112.3
788	G	25.4	Very low	25.9	Very low	71 Å²	71	133.4 Å²	133.4	73%	0.732	75%	0.75	S	S	*	*			trans	74.9	111.2	163.8	0	0	0	0	0	116.3
789	M	23.6	Very low	26	Very low	180 Å²	180	133.4 Å²	133.4	89%	0.887	75%	0.75	S	S	*	*				70.3	96.3	66.2	-69.5	-166.2	71.1	0	0	117.3
790	S	25.5	Very low	26	Very low	101 Å²	101	132.9 Å²	132.9	71%	0.706	75%	0.748	S	S	*	*			trans	75.8	151.2	139.8	89.5	0	0	0	0	121
791	S	28.1	Very low	26.3	Very low	107 Å²	107	133.8 Å²	133.8	75%	0.748	75%	0.754	S	S	*	*			trans	73.3	148.5	156.9	-56.4	0	0	0	0	117.5
792	S	26.5	Very low	26.3	Very low	98 Å²	98	131.7 Å²	131.7	69%	0.685	75%	0.75	S	S	*	*			cis	-172.9	150.9	-28.9	-108.1	0	0	0	0	108
793	K	27.9	Very low	26.5	Very low	174 Å²	174	132.8 Å²	132.8	76%	0.757	75%	0.753	S	S	*	*			trans	63.1	123.5	149	-74.8	-177.7	174.7	-178.3	0	120.8
794	Q	26.6	Very low	26.6	Very low	145 Å²	145	134.8 Å²	134.8	68%	0.678	76%	0.76	S	S	*	*				97.8	136.9	116.9	-85.5	177.6	-32.6	0	0	121.9
795	L	25.2	Very low	26.8	Very low	144 Å²	144	136.8 Å²	136.8	75%	0.754	77%	0.769	S	S	*	*			trans	73.3	140.2	147.2	-66.9	161.7	0	0	0	115.6
796	L	27.5	Very low	27	Very low	154 Å²	154	139.2 Å²	139.2	81%	0.806	77%	0.774	S	S	*	*			cis	-148.5	165	19	-116.4	143.3	0	0	0	113.1
797	L	23.9	Very low	27.4	Very low	156 Å²	156	140.4 Å²	140.4	82%	0.817	78%	0.779	S	S	*	*			trans	-83	176.6	169.6	-84.8	117.7	0	0	0	112.8
798	S	26.2	Very low	27.6	Very low	120 Å²	120	137 Å²	137	84%	0.839	78%	0.777	S	S	*	*			trans	82.3	150.9	175.4	82.5	0	0	0	0	114.9
799	S	28.7	Very low	27.6	Very low	105 Å²	105	138.9 Å²	138.9	73%	0.734	77%	0.774	S	S	*	*			cis	-145.6	158.3	11.1	176.1	0	0	0	0	111.9
800	N	26.9	Very low	27.9	Very low	140 Å²	140	140.3 Å²	140.3	75%	0.749	78%	0.776	S	S	*	*			trans	-54.2	149.6	164	-57.8	-55.6	0	0	0	111.9
801	N	31	Very low	28	Very low	160 Å²	160	143.3 Å²	143.3	86%	0.856	78%	0.779	S	S	*	*				-167	151.8	112.3	-97.8	-30.5	0	0	0	113.6
802	S	27.5	Very low	28	Very low	96 Å²	96	143.6 Å²	143.6	67%	0.671	78%	0.776	S	S	*	*			trans	-86.6	156.8	176.6	50	0	0	0	0	112.2
803	K	30.5	Very low	28.1	Very low	177 Å²	177	148 Å²	148	77%	0.77	78%	0.782	S	S	*	*				172.6	134.8	111.5	-91	172.3	-178	177.5	0	113.1
804	D	28	Very low	28	Very low	133 Å²	133	144.9 Å²	144.9	71%	0.711	78%	0.783	S	S	*	*			trans	38.4	120.8	136.3	-47.7	-40.3	0	0	0	120.5
805	L	30.5	Very low	28.2	Very low	177 Å²	177	150.1 Å²	150.1	93%	0.927	80%	0.796	S	S	*	*				-165.8	167.7	102.8	-99.4	156.3	0	0	0	112.8
806	K	27.3	Very low	28.1	Very low	197 Å²	197	148.1 Å²	148.1	86%	0.857	79%	0.794	S	S	*	*			trans	-103.9	169.1	-150.1	-98.9	-177.4	177.2	175.8	0	115.4
807	P	32.6	Very low	28.1	Very low	119 Å²	119	152.2 Å²	152.2	77%	0.773	80%	0.801	S	S	*	*			trans	-100.7	176	-161.3	40.6	-38.2	0	0	0	114.7
808	S	30	Very low	28.3	Very low	122 Å²	122	149 Å²	149	85%	0.853	80%	0.797	S	S	*	*			trans	-128.7	136.4	158.7	58.4	0	0	0	0	112.1
809	T	26.4	Very low	28.2	Very low	111 Å²	111	150.6 Å²	150.6	68%	0.681	79%	0.791	S	S	*	*			trans	-97.1	148.8	-177	43	0	0	0	0	112.2
810	F	29.3	Very low	28.3	Very low	211 Å²	211	151.8 Å²	151.8	93%	0.925	79%	0.794	S	S	*	*			trans	-146.7	138.7	138.2	-108.4	-77.6	0	0	0	112.1
811	H	27	Very low	28.3	Very low	164 Å²	164	150.3 Å²	150.3	76%	0.759	79%	0.79	S	S	*	*			trans	-75.2	165.8	-178.2	-66.8	-90.5	0	0	0	111.7
812	T	27.7	Very low	28.2	Very low	113 Å²	113	149 Å²	149	69%	0.693	79%	0.788	S	S	*	*				-169.8	150.5	51.6	18.9	0	0	0	0	114.3
813	K	29.4	Very low	28.2	Very low	189 Å²	189	153.5 Å²	153.5	82%	0.822	79%	0.79	S	S	*	*			trans	59.7	104	147.3	-63.5	170.8	-178.1	177	0	118.5
814	S	25.8	Very low	27.9	Very low	109 Å²	109	149 Å²	149	76%	0.762	79%	0.794	S	S	*	*			cis	91.6	103.7	48.5	75.2	0	0	0	0	116.3
815	R	29.9	Very low	27.9	Very low	256 Å²	256	151.1 Å²	151.1	97%	0.966	79%	0.793	S	S	*	*				-163.4	151	116	-114.2	177.3	176.6	172.4	-1.3	111.5
816	S	25.1	Very low	27.6	Very low	102 Å²	102	150.2 Å²	150.2	71%	0.713	79%	0.788	S	S	*	*			trans	-111.1	149.8	-160.5	51.7	0	0	0	0	113.7
817	Y	27.1	Very low	27.6	Very low	239 Å²	239	146.8 Å²	146.8	94%	0.937	78%	0.783	S	S	*	*			trans	-142.7	139.4	133.7	-117.7	-86.5	0	0	0	108.6
818	A	26.9	Very low	27.4	Very low	89 Å²	89	146.4 Å²	146.4	74%	0.736	78%	0.779	S	S	*	*			trans	-98.2	133.4	-164.5	0	0	0	0	0	112.9
819	E	25.7	Very low	27.3	Very low	154 Å²	154	147.2 Å²	147.2	72%	0.72	78%	0.781	S	S	*	*			trans	-87.7	127.3	162.3	-68.2	176.7	129.4	0	0	109.1
820	T	29.3	Very low	27.3	Very low	130 Å²	130	145.3 Å²	145.3	80%	0.798	78%	0.784	S	S	*	*			trans	-99.3	95.7	170.1	-48.3	0	0	0	0	109.4	T822	T820-T822 PolarHBondContact O-N 2.88Å
821	V	26.9	Very low	27.1	Very low	109 Å²	109	142 Å²	142	66%	0.661	78%	0.78	S	S	*	*			trans	-63	122.4	167.4	174.8	0	0	0	0	109.3	R823	V821-R823 HydrophobicContact CG1-CG 4.27Å
822	T	28.6	Very low	27.1	Very low	133 Å²	133	142.8 Å²	142.8	82%	0.816	78%	0.784	S	S	*	*			trans	-109.3	95.7	162	22.5	0	0	0	0	110	T820	T820-T822 PolarHBondContact O-N 2.88Å
823	R	27.8	Very low	26.8	Very low	189 Å²	189	142.6 Å²	142.6	71%	0.713	79%	0.788	S	S	*	*			trans	-54.7	143.1	165.5	-79	175	166.8	160.3	-4.6	109.8	V821 Y825	V821-R823 HydrophobicContact CG1-CG 4.27Å; R823-Y825 HydrophobicContact CB-CD2 4.23Å; R823-Y825 HydrophobicContact CB-CE2 3.83Å; R823-Y825 WeakPolarHBondContact O-CD2 3.34Å; R823-Y825 PolarHBondContact O-N 3.38Å
824	G	24.5	Very low	26.7	Very low	82 Å²	82	141.5 Å²	141.5	85%	0.845	79%	0.789	S	S	*	*			trans	-61.8	122.7	165.9	0	0	0	0	0	109.9
825	Y	28.2	Very low	26.6	Very low	178 Å²	178	141.3 Å²	141.3	70%	0.698	79%	0.788	S	S	*	*			trans	-112.5	126.8	169.3	-83.3	-83.8	0	0	0	109.6	R823 V827	R823-Y825 HydrophobicContact CB-CD2 4.23Å; R823-Y825 HydrophobicContact CB-CE2 3.83Å; R823-Y825 WeakPolarHBondContact O-CD2 3.34Å; R823-Y825 PolarHBondContact O-N 3.38Å; Y825-V827 PolarHBondContact O-N 3.21Å
826	I	25.1	Very low	26.4	Very low	159 Å²	159	137.4 Å²	137.4	82%	0.815	78%	0.782	S	S	*	*			trans	-66.2	121.7	165.4	-61.8	164.3	0	0	0	106.5
827	V	27.4	Very low	26.5	Very low	125 Å²	125	138 Å²	138	76%	0.758	78%	0.778	S	S	*	*			trans	-129	105.3	172.2	-177.2	0	0	0	0	108.9	Y825	Y825-V827 PolarHBondContact O-N 3.21Å
828	T	27.1	Very low	26.4	Very low	111 Å²	111	134.2 Å²	134.2	68%	0.681	77%	0.766	S	S	*	*			trans	-66.2	145.3	162.6	44.5	0	0	0	0	110.1	G830	T828-G830 PolarHBondContact O-N 3.15Å
829	P	27.9	Very low	26.4	Very low	138 Å²	138	140.2 Å²	140.2	90%	0.896	78%	0.776	S	S	*	*			trans	-66.8	121.8	176.2	28.7	-33.2	0	0	0	109.9
830	G	26.6	Very low	26.4	Very low	72 Å²	72	138.8 Å²	138.8	74%	0.742	77%	0.773	S	S	*	*			trans	-147.3	139.9	-179.9	0	0	0	0	0	109.5	T828	T828-G830 PolarHBondContact O-N 3.15Å
831	V	25.7	Very low	26.3	Very low	141 Å²	141	144 Å²	144	86%	0.855	78%	0.78	S	S	*	*			trans	-79.9	164.2	-165.3	-164.9	0	0	0	0	111.6
832	E	26.7	Very low	26.4	Very low	181 Å²	181	148.2 Å²	148.2	85%	0.846	78%	0.784	S	S	*	*			trans	104.6	121.1	158.4	-56.6	-167.5	163.5	0	0	118.6
833	S	22.2	Very low	26.4	Very low	109 Å²	109	150.6 Å²	150.6	76%	0.762	79%	0.786	S	S	*	*			trans	-71.3	144.5	169.1	51.9	0	0	0	0	112.5
834	I	26.7	Very low	26.6	Very low	165 Å²	165	147.3 Å²	147.3	85%	0.846	79%	0.792	S	S	*	*			trans	-157.3	132.9	139.9	-96.2	138	0	0	0	108.2
835	S	23.2	Very low	26.8	Very low	105 Å²	105	149.3 Å²	149.3	73%	0.734	78%	0.782	S	S	*	*			trans	-85.2	146.1	177.1	69.9	0	0	0	0	111.9
836	M	26.5	Very low	26.9	Very low	174 Å²	174	149.5 Å²	149.5	86%	0.857	79%	0.792	S	S	*	*			trans	-143.3	105.1	148	-81.3	-144.3	-175.4	0	0	114.1
837	N	25.7	Very low	27.1	Very low	115 Å²	115	148 Å²	148	62%	0.615	78%	0.782	S	S	*	*				49.2	117.5	129.1	-78.1	-52.3	0	0	0	122.5
838	K	24.9	Very low	27.4	Very low	159 Å²	159	149.1 Å²	149.1	69%	0.691	78%	0.776	S	S	*	*				60.4	114.3	122.5	-64	172.7	-178.1	171.8	0	119.3
839	F	27.8	Very low	27.7	Very low	215 Å²	215	153.1 Å²	153.1	94%	0.943	78%	0.779	S	S	*	*				-130.2	124.7	120.2	-110.5	-87.8	0	0	0	110
840	N	25.7	Very low	27.8	Very low	125 Å²	125	152 Å²	152	67%	0.668	77%	0.765	S	S	*	*			trans	-83	145	176.2	-81.4	-31.4	0	0	0	110.4
841	Y	28.1	Very low	28.1	Very low	240 Å²	240	158.3 Å²	158.3	94%	0.941	77%	0.768	S	S	*	*			trans	-126.6	137.4	137.7	-132.7	-96.9	0	0	0	107.7
842	R	27.3	Very low	28.4	Very low	196 Å²	196	156.7 Å²	156.7	74%	0.74	76%	0.759	S	S	*	*			trans	-131.1	167.9	-166.8	-158.1	-175.2	-174.9	-170.4	1.5	109.8
843	E	30.1	Very low	28.5	Very low	184 Å²	184	153 Å²	153	86%	0.86	75%	0.753	S	S	*	*			trans	91.9	135.7	175.8	-54.5	-175.2	178.5	0	0	114
844	S	31.3	Very low	28.8	Very low	120 Å²	120	152.3 Å²	152.3	84%	0.839	75%	0.748	S	S	*	*			cis	-124.9	159.4	15.4	54.6	0	0	0	0	115.2
845	L	28.4	Very low	29	Very low	123 Å²	123	150.6 Å²	150.6	64%	0.644	75%	0.745	S	S	*	*			trans	-93	162.6	177.6	-77.7	127.1	0	0	0	112.1
846	M	30.8	Very low	29.2	Very low	182 Å²	182	150 Å²	150	90%	0.897	75%	0.747	S	S	*	*				-167.3	72.1	124.6	-95.7	-69.1	174.6	0	0	111.6
847	E	29.9	Very low	29.7	Very low	129 Å²	129	147.3 Å²	147.3	60%	0.603	74%	0.742	S	S	*	*			trans	14.7	130.4	132.8	-150.6	-173.2	-109	0	0	120.6
848	K	33.4	Very low	29.8	Very low	148 Å²	148	150.1 Å²	150.1	64%	0.643	76%	0.756	S	S	*	*				-179.1	117.4	108	-95.8	164.1	-175	164.2	0	116.9
849	R	32.8	Very low	29.9	Very low	194 Å²	194	146.8 Å²	146.8	73%	0.732	76%	0.759	S	S	*	*			trans	65.9	146.2	131.6	-64.8	174.9	-176.5	176.2	-2	120.3
850	N	29.6	Very low	30	Very low	115 Å²	115	140.1 Å²	140.1	62%	0.615	75%	0.75	S	S	*	*			cis	-173	170.5	-19.6	-109.8	7.2	0	0	0	108.9
851	Y	33.7	Very low	30.1	Very low	204 Å²	204	138.2 Å²	138.2	80%	0.8	75%	0.752	S	S	*	*			trans	73.6	135.6	161.9	-65	-71.6	0	0	0	118.2
852	T	31.5	Very low	30.2	Very low	107 Å²	107	136.4 Å²	136.4	66%	0.656	75%	0.745	S	S	*	*			cis	-173.6	148.4	-27.5	14.6	0	0	0	0	109.2
853	S	29	Very low	30.2	Very low	104 Å²	104	134.7 Å²	134.7	73%	0.727	75%	0.745	S	S	*	*			trans	50.2	144.5	143.3	67.1	0	0	0	0	122
854	S	29	Very low	30	Very low	94 Å²	94	131.4 Å²	131.4	66%	0.657	74%	0.741	S	S	*	*			cis	-172.4	164.6	-11.8	52.6	0	0	0	0	109.5
855	T	29.7	Very low	29.9	Very low	129 Å²	129	131 Å²	131	79%	0.791	74%	0.739	S	S	*	*			trans	38.8	133.8	142.3	56.2	0	0	0	0	119.8
856	A	28.6	Very low	29.8	Very low	92 Å²	92	133.8 Å²	133.8	76%	0.76	75%	0.751	S	S	*	*			cis	171	171.9	12.7	0	0	0	0	0	106.2
857	P	36.3	Very low	29.9	Very low	118 Å²	118	130.7 Å²	130.7	77%	0.766	75%	0.747	S	S	*	*			trans	-118.3	166.4	-165.1	41.3	-30.6	0	0	0	115.3
858	L	28.7	Very low	30	Very low	174 Å²	174	132.5 Å²	132.5	91%	0.911	76%	0.761	S	S	*	*			trans	-171.1	149	154.6	-90.2	131.2	0	0	0	105.1
859	A	26.8	Very low	30.3	Very low	90 Å²	90	130.6 Å²	130.6	74%	0.744	76%	0.764	S	S	*	*			cis	146.2	147.8	2.1	0	0	0	0	0	105.5
860	G	30.3	Very low	30.1	Very low	74 Å²	74	126.1 Å²	126.1	76%	0.763	76%	0.762	S	S	*	*			trans	111.9	100	-176.8	0	0	0	0	0	111.5
861	A	26.8	Very low	30.2	Very low	85 Å²	85	126.6 Å²	126.6	70%	0.702	77%	0.769	S	S	*	*				96.1	155.6	53.7	0	0	0	0	0	112.7
862	Y	30.5	Very low	30.2	Very low	202 Å²	202	123 Å²	123	79%	0.792	76%	0.76	S	S	*	*			trans	90.2	85.6	175.9	-55	-72.2	0	0	0	118.9
863	E	26.8	Very low	30.3	Very low	160 Å²	160	124.5 Å²	124.5	75%	0.748	76%	0.759	S	S	*	*				55.4	135.6	111.8	-70.2	-175.8	135.1	0	0	123.2
864	C	26.7	Very low	30.4	Very low	115 Å²	115	125 Å²	125	78%	0.777	76%	0.758	S	S	*	*			trans	69.6	138	141.6	-69.8	0	0	0	0	118.4
865	S	29.4	Very low	30.5	Very low	113 Å²	113	126.1 Å²	126.1	79%	0.79	76%	0.761	S	S	*	*			cis	-154.7	169	12.3	-81.9	0	0	0	0	112.9
866	M	26.6	Very low	30.5	Very low	180 Å²	180	127.6 Å²	127.6	89%	0.887	76%	0.763	S	S	*	*			trans	-39.3	147.2	168.8	-54.4	168.8	176.9	0	0	116.5
867	S	32	Very low	30.6	Very low	118 Å²	118	127.2 Å²	127.2	83%	0.825	76%	0.76	S	S	*	*				163.4	122.8	96.4	61	0	0	0	0	115.4
868	D	31.1	Very low	30.4	Very low	167 Å²	167	127.3 Å²	127.3	89%	0.893	76%	0.759	S	S	*	*			trans	3.6	166.7	151	-88	-13.3	0	0	0	125.8
869	P	39.6	Very low	30.4	Very low	108 Å²	108	124.8 Å²	124.8	70%	0.701	75%	0.751	S	S	*	*			trans	-118.7	-175	-149.9	45.1	-35.6	0	0	0	115.5
870	S	30.1	Very low	30.8	Very low	100 Å²	100	125.3 Å²	125.3	70%	0.699	75%	0.749	S	S	*	*				160.5	144.7	125.1	54.8	0	0	0	0	115.3
871	T	31.8	Very low	30.9	Very low	124 Å²	124	129.4 Å²	129.4	76%	0.761	75%	0.753	S	S	*	*			trans	62.2	159.5	152.5	21.4	0	0	0	0	119.4
872	E	33.2	Very low	31.2	Very low	128 Å²	128	128.5 Å²	128.5	60%	0.598	75%	0.752	S	S	*	*			cis	-157	162.1	14.4	-125.2	-170.2	158.8	0	0	112.4
873	Q	33.1	Very low	31.4	Very low	140 Å²	140	125.7 Å²	125.7	65%	0.654	76%	0.756	S	S	*	*			trans	53	122.9	148.4	-60.3	-176.5	30.6	0	0	123
874	T	31.2	Very low	31.5	Very low	113 Å²	113	126.7 Å²	126.7	69%	0.693	76%	0.761	S	S	*	*				88.4	119.6	72.5	-44.6	0	0	0	0	115.1
875	T	32.1	Very low	31.8	Very low	119 Å²	119	127 Å²	127	73%	0.73	77%	0.765	S	S	*	*				148.4	126.4	129.1	46.4	0	0	0	0	117.5
876	L	29.4	Very low	31.9	Very low	159 Å²	159	129.1 Å²	129.1	83%	0.832	77%	0.767	S	S	*	*			trans	66.6	126.8	133.5	-67.6	164.3	0	0	0	125.1
877	A	29.6	Very low	32.2	Very low	84 Å²	84	132.6 Å²	132.6	69%	0.694	77%	0.77	S	S	*	*			trans	71.7	155.2	139.5	0	0	0	0	0	119
878	T	32.4	Very low	32.1	Very low	121 Å²	121	136.1 Å²	136.1	74%	0.742	77%	0.774	S	S	*	*			cis	-158.5	136	14.1	-18.9	0	0	0	0	112.7
879	T	29.7	Very low	32.3	Very low	120 Å²	120	132.6 Å²	132.6	74%	0.736	77%	0.768	S	S	*	*			trans	44.2	146.6	140.2	54	0	0	0	0	126.6
880	S	34.8	Very low	32	Very low	101 Å²	101	132.8 Å²	132.8	71%	0.706	77%	0.772	S	S	*	*			trans	84	152.8	143.7	81.5	0	0	0	0	119.2
881	N	31.2	Very low	32.2	Very low	160 Å²	160	134.5 Å²	134.5	86%	0.856	78%	0.778	S	S	*	*			cis	-167.3	153.2	-20.9	-106	-11.3	0	0	0	110.6
882	G	34.2	Very low	32.4	Very low	66 Å²	66	136.9 Å²	136.9	68%	0.68	78%	0.778	S	S	*	*			trans	73.3	167.4	157	0	0	0	0	0	118.7
883	T	33.5	Very low	32.4	Very low	143 Å²	143	137.3 Å²	137.3	88%	0.877	78%	0.783	S	S	*	*			cis	-164.6	160.3	-22.1	1.4	0	0	0	0	109.7
884	E	29.2	Very low	32.5	Very low	181 Å²	181	139 Å²	139	85%	0.846	79%	0.789	S	S	*	*			trans	-50.6	155.7	-178.4	-54.9	165.6	119.2	0	0	117.3
885	S	34.4	Very low	32.6	Very low	123 Å²	123	138.1 Å²	138.1	86%	0.86	79%	0.787	S	S	*	*				-178.3	148.4	117.9	42.5	0	0	0	0	114.9
886	N	30.1	Very low	32.7	Very low	157 Å²	157	143.2 Å²	143.2	84%	0.84	79%	0.793	S	S	*	*			trans	-81.7	158.8	-178.6	-70.9	-63.6	0	0	0	114.1
887	R	33.6	Very low	32.8	Very low	253 Å²	253	140.2 Å²	140.2	96%	0.955	79%	0.785	S	S	*	*			trans	-160.6	138.2	139.3	-110.6	162.3	-167	-177.2	4.6	113.8
888	Q	30	Very low	33	Very low	191 Å²	191	143.7 Å²	143.7	89%	0.893	79%	0.79	S	S	*	*			trans	-105.1	149	178.8	-66.3	172.1	-36.8	0	0	112.2
889	A	34.9	Very low	33	Very low	93 Å²	93	146.8 Å²	146.8	77%	0.769	80%	0.797	S	S	*	*			trans	-164.2	124.5	144.9	0	0	0	0	0	107.6
890	S	32.6	Very low	33.1	Very low	112 Å²	112	144.3 Å²	144.3	78%	0.783	80%	0.795	S	S	*	*			cis	95.1	136.1	43.7	-71.9	0	0	0	0	113.5
891	V	34.9	Very low	33	Very low	137 Å²	137	146.5 Å²	146.5	83%	0.83	80%	0.798	S	S	*	*			trans	106.7	129.8	174.3	176.5	0	0	0	0	114
892	K	35.8	Very low	33.1	Very low	173 Å²	173	143.5 Å²	143.5	75%	0.752	79%	0.786	S	S	*	*			cis	171.2	134.2	-27.5	-115.5	176.4	169.6	178.1	0	108.1
893	L	34.7	Very low	32.9	Very low	138 Å²	138	148 Å²	148	72%	0.723	79%	0.79	S	S	*	*			trans	68.3	142.2	137.3	-77.5	166.4	0	0	0	120.1
894	K	33.9	Very low	32.9	Very low	176 Å²	176	147.6 Å²	147.6	77%	0.765	78%	0.782	S	S	*	*			cis	-148.4	140.6	27	-93.4	156.1	-174.5	177.4	0	109.3
895	S	34.3	Very low	32.9	Very low	94 Å²	94	149.7 Å²	149.7	66%	0.657	78%	0.782	S	S	*	*				58.4	131.7	73.2	88.1	0	0	0	0	114.5
896	R	33.9	Very low	32.7	Very low	225 Å²	225	149.6 Å²	149.6	85%	0.849	78%	0.776	S	S	*	*			cis	-159.1	145.1	33.4	-85.8	177.6	172.1	164.8	-6.2	108.3
897	S	32.2	Very low	32.8	Very low	96 Å²	96	148.1 Å²	148.1	67%	0.671	77%	0.768	S	S	*	*				79.8	144	56.7	83.5	0	0	0	0	116.9
898	I	33.6	Very low	32.7	Very low	157 Å²	157	144.5 Å²	144.5	81%	0.805	76%	0.76	S	S	*	*			trans	105.9	135.4	175.3	-59.2	157.3	0	0	0	113.4
899	Q	31	Very low	32.8	Very low	187 Å²	187	140.9 Å²	140.9	87%	0.874	75%	0.75	S	S	*	*			cis	158.5	133.4	-38.1	176.5	176.7	15.9	0	0	109.2
900	G	32.5	Very low	32.7	Very low	68 Å²	68	142 Å²	142	70%	0.701	75%	0.748	S	S	*	*			trans	92.6	160	167.7	0	0	0	0	0	116.6
901	N	33.2	Very low	32.5	Very low	146 Å²	146	144 Å²	144	78%	0.781	75%	0.75	S	S	*	*			cis	-164.7	158	-19.1	-143.7	19.2	0	0	0	111.1
902	T	33	Very low	32.4	Very low	97 Å²	97	142.6 Å²	142.6	60%	0.595	75%	0.745	S	S	*	*			trans	53.4	113.9	149.8	50.3	0	0	0	0	123.4
903	E	29.7	Very low	32.2	Very low	162 Å²	162	139.6 Å²	139.6	76%	0.757	74%	0.742	S	S	*	*				79.5	142.7	117.5	-67.6	-173.4	-170.9	0	0	125.6
904	N	33.1	Very low	32	Very low	134 Å²	134	140.3 Å²	140.3	72%	0.717	75%	0.747	S	S	*	*			trans	102.4	122.2	135.2	-79.7	-36	0	0	0	123
905	R	30.4	Very low	31.8	Very low	224 Å²	224	135.8 Å²	135.8	85%	0.845	74%	0.742	S	S	*	*			trans	76.8	106.4	138.4	-141.6	167.3	-176.5	155.6	-0.1	117.3
906	V	29.7	Very low	31.6	Very low	122 Å²	122	138.1 Å²	138.1	74%	0.739	75%	0.747	S	S	*	*				59.3	98.3	72	-177.6	0	0	0	0	113.6
907	D	32.4	Very low	31.4	Very low	126 Å²	126	134 Å²	134	67%	0.674	74%	0.741	S	S	*	*				175.4	146.6	116.8	-110.3	-27.5	0	0	0	113.7
908	K	32.2	Very low	31.4	Very low	177 Å²	177	136.9 Å²	136.9	77%	0.77	74%	0.744	S	S	*	*			trans	64	154.7	147.2	-74	170.7	-176.2	166.8	0	120.7
909	V	31.1	Very low	31.2	Very low	114 Å²	114	137.6 Å²	137.6	69%	0.691	74%	0.743	S	S	*	*			cis	-171.1	164.9	-28.6	117.8	0	0	0	0	107.5
910	T	32.5	Very low	31.2	Very low	118 Å²	118	140.4 Å²	140.4	72%	0.724	75%	0.746	S	S	*	*			trans	62.8	118.4	172.1	40.7	0	0	0	0	117.4
911	N	29	Very low	31	Very low	154 Å²	154	145.3 Å²	145.3	82%	0.824	75%	0.751	S	S	*	*				55.5	105.9	80.5	-75.5	-7.7	0	0	0	114.7
912	S	31.4	Very low	31	Very low	106 Å²	106	145.3 Å²	145.3	74%	0.741	75%	0.751	S	S	*	*				178	138.6	104.7	60.9	0	0	0	0	114.4
913	T	32.2	Very low	30.7	Very low	111 Å²	111	148.2 Å²	148.2	68%	0.681	76%	0.757	S	S	*	*			trans	47.6	117.3	140.9	56.2	0	0	0	0	122.6
914	N	29.8	Very low	30.8	Very low	153 Å²	153	146.9 Å²	146.9	82%	0.818	75%	0.754	S	S	*	*				70	132	122.6	-66.8	-18.8	0	0	0	122.7
915	A	31.6	Very low	30.6	Very low	80 Å²	80	149 Å²	149	66%	0.661	76%	0.76	S	S	*	*			trans	80.8	107.8	135.5	0	0	0	0	0	119.7
916	N	30.1	Very low	30.9	Very low	143 Å²	143	144 Å²	144	77%	0.765	76%	0.757	S	S	*	*				81.3	116.8	124	-71.2	-15.6	0	0	0	121
917	L	28.9	Very low	31.2	Very low	140 Å²	140	144.6 Å²	144.6	73%	0.733	76%	0.763	S	S	*	*				88.9	122.3	127.1	-72.2	167.9	0	0	0	120.3
918	Q	31.7	Very low	31.1	Very low	156 Å²	156	143.6 Å²	143.6	73%	0.729	77%	0.765	S	S	*	*			trans	93.4	106.4	139.8	-72	172.6	4.6	0	0	120.6
919	H	30.2	Very low	31	Very low	171 Å²	171	139.1 Å²	139.1	79%	0.792	76%	0.756	S	S	*	*			trans	52.8	118.5	134	-71.1	-54	0	0	0	120.4
920	R	29.9	Very low	31	Very low	247 Å²	247	140.3 Å²	140.3	93%	0.932	76%	0.759	S	S	*	*				-153.2	154.1	106.3	-110.3	170.8	-174.5	-166.7	1.3	112.8
921	Q	28.9	Very low	30.9	Very low	170 Å²	170	143.1 Å²	143.1	79%	0.794	76%	0.762	S	S	*	*			trans	-83.2	155.6	-177.2	-63.1	154.2	-56.4	0	0	111.8
922	N	32.5	Very low	30.8	Very low	146 Å²	146	140.4 Å²	140.4	78%	0.781	75%	0.753	S	S	*	*			trans	162.7	145.1	137.2	-84.3	-16.5	0	0	0	107.7
923	Q	27.7	Very low	30.6	Very low	158 Å²	158	142.2 Å²	142.2	74%	0.738	75%	0.754	S	S	*	*			cis	173.8	160.5	-18.6	-128.7	-171.8	34.8	0	0	104
924	I	32.1	Very low	30.4	Very low	135 Å²	135	143.3 Å²	143.3	69%	0.692	76%	0.756	S	S	*	*			trans	90	94.5	161.3	-57.1	148.7	0	0	0	119.2
925	Q	29.1	Very low	30.3	Very low	179 Å²	179	140.8 Å²	140.8	84%	0.836	75%	0.746	S	S	*	*				61	127.6	127.5	-61.6	-178.8	-7.1	0	0	124
926	P	35.4	Very low	30	Very low	119 Å²	119	144.1 Å²	144.1	77%	0.773	75%	0.752	S	S	*	*			trans	-106.8	168.7	149.1	39.8	-30.8	0	0	0	112.5
927	P	36.4	Very low	30	Very low	134 Å²	134	143.8 Å²	143.8	87%	0.87	75%	0.749	S	S	*	*			trans	-131.9	169.4	151.7	36.9	-23.5	0	0	0	114.4
928	S	30.6	Very low	30	Very low	104 Å²	104	148 Å²	148	73%	0.727	76%	0.755	S	S	*	*			trans	-110.4	164.4	-164.2	57.2	0	0	0	0	114.9
929	S	29.6	Very low	30	Very low	83 Å²	83	147 Å²	147	58%	0.58	76%	0.755	S	S	*	*			trans	42.8	123.8	142.4	63	0	0	0	0	120.4
930	N	31.7	Very low	30.1	Very low	139 Å²	139	145.7 Å²	145.7	74%	0.743	75%	0.749	S	S	*	*				171.2	147.5	108.1	-90.2	-36.1	0	0	0	114.9
931	F	30.1	Very low	30.2	Very low	178 Å²	178	141 Å²	141	78%	0.781	74%	0.743	S	S	*	*			trans	59.4	131.9	141	-90.3	-112.8	0	0	0	124.3
932	C	27.4	Very low	30.3	Very low	96 Å²	96	136.7 Å²	136.7	65%	0.649	74%	0.743	S	S	*	*			trans	69.2	125	136	-88.3	0	0	0	0	123.3
933	L	26.4	Very low	30.3	Very low	144 Å²	144	136 Å²	136	75%	0.754	75%	0.745	S	S	*	*				55	142.3	126.9	-106.1	79.9	0	0	0	121.6
934	D	28.6	Very low	30.5	Very low	134 Å²	134	138.3 Å²	138.3	72%	0.717	75%	0.752	S	S	*	*			trans	65.3	150.9	156.7	-77.8	-27.7	0	0	0	118.4
935	T	27.5	Very low	30.4	Very low	101 Å²	101	135.9 Å²	135.9	62%	0.62	75%	0.752	S	S	*	*			cis	173.1	119.2	-25.5	-99.2	0	0	0	0	103.1
936	L	25.8	Very low	30.5	Very low	149 Å²	149	135 Å²	135	78%	0.78	75%	0.753	S	S	*	*			trans	68	146.2	152.3	-78	174.6	0	0	0	123
937	L	29.1	Very low	30.3	Very low	136 Å²	136	133.1 Å²	133.1	71%	0.712	74%	0.744	S	S	*	*			trans	75.7	110.9	157.7	-60.8	154.9	0	0	0	116.8
938	R	29.3	Very low	29.9	Very low	229 Å²	229	136.5 Å²	136.5	86%	0.864	74%	0.74	S	S	*	*				70.3	113.4	66.7	-79.4	-168.3	172.4	168.1	-2.3	114.3
939	D	32.7	Very low	30	Very low	134 Å²	134	139.5 Å²	139.5	72%	0.717	74%	0.74	S	S	*	*				-160.5	120.4	128.5	-115.6	14.9	0	0	0	108.5
940	Q	31.4	Very low	29.9	Very low	145 Å²	145	140.9 Å²	140.9	68%	0.678	75%	0.745	S	S	*	*				83.7	106.6	80	-82.2	-162.5	77.9	0	0	114.8
941	N	32.5	Very low	29.6	Very low	149 Å²	149	142.7 Å²	142.7	80%	0.797	75%	0.754	S	S	*	*				170.5	138.6	103.2	-91.5	-58.7	0	0	0	111.5
942	G	31.4	Very low	29.7	Very low	78 Å²	78	137.5 Å²	137.5	80%	0.804	75%	0.751	S	S	*	*			trans	163.9	78.7	-179.5	0	0	0	0	0	113.5
943	T	30.6	Very low	29.6	Very low	132 Å²	132	143.9 Å²	143.9	81%	0.81	76%	0.763	S	S	*	*			trans	-75.2	136.5	-170.9	40.1	0	0	0	0	115.2
944	K	32.9	Very low	29.8	Very low	206 Å²	206	146.1 Å²	146.1	90%	0.896	77%	0.769	S	S	*	*			trans	-179.5	97.3	147.9	-99.8	162.2	-172	-178.7	0	107.6
945	A	30.3	Very low	29.7	Very low	84 Å²	84	146.1 Å²	146.1	69%	0.694	77%	0.769	S	S	*	*				82.4	125.6	77.2	0	0	0	0	0	113.7
946	N	31.7	Very low	29.8	Very low	160 Å²	160	149.4 Å²	149.4	86%	0.856	78%	0.775	S	S	*	*			trans	75.7	141	171.6	-55.6	-14	0	0	0	118
947	S	30.2	Very low	30	Very low	81 Å²	81	148 Å²	148	57%	0.566	78%	0.777	S	S	*	*			cis	-177.9	137.7	-17.3	53.3	0	0	0	0	112.1
948	Y	28.7	Very low	30.1	Very low	204 Å²	204	145.8 Å²	145.8	80%	0.8	77%	0.774	S	S	*	*			trans	61.9	159.2	155.3	-54	-45.8	0	0	0	118.3
949	K	31.5	Very low	30.3	Very low	167 Å²	167	140.8 Å²	140.8	73%	0.726	76%	0.764	S	S	*	*			cis	-156.8	125.7	-14.9	-110.1	163.5	-175.1	178.8	0	105.2
950	T	27.3	Very low	30.4	Very low	113 Å²	113	142.8 Å²	142.8	69%	0.693	77%	0.769	S	S	*	*				40.5	126.1	95.4	16.3	0	0	0	0	118.3
951	L	27.4	Very low	30.4	Very low	176 Å²	176	140.8 Å²	140.8	92%	0.921	76%	0.763	S	S	*	*			trans	62.7	146.2	142.4	-70.7	157.1	0	0	0	120
952	G	30.4	Very low	30.5	Very low	70 Å²	70	140 Å²	140	72%	0.722	76%	0.759	S	S	*	*			trans	145.2	93.8	152.2	0	0	0	0	0	116.1	H954	G952-H954 PolarHBondContact O-N 3Å
953	Y	25.1	Very low	30.4	Very low	229 Å²	229	143.3 Å²	143.3	90%	0.898	75%	0.751	S	S	*	*			trans	-53.6	130.8	137.3	-97.2	-111.1	0	0	0	107.9
954	H	32.1	Very low	30.4	Very low	191 Å²	191	145 Å²	145	88%	0.884	75%	0.747	S	S	*	*			trans	-163.9	134.4	134.3	-116.2	-75.3	0	0	0	113	G952	G952-H954 PolarHBondContact O-N 3Å
955	D	26.1	Very low	30.3	Very low	135 Å²	135	141.6 Å²	141.6	72%	0.722	74%	0.738	S	S	*	*			trans	-90.3	168.9	175.7	-178.9	26.7	0	0	0	111.1
956	K	30.4	Very low	30.3	Very low	170 Å²	170	141.2 Å²	141.2	74%	0.739	73%	0.734	S	S	*	*			trans	97.6	109.1	162.3	-56.1	178.8	-178.7	177.7	0	120.3
957	S	29.4	Very low	30.3	Very low	118 Å²	118	140.7 Å²	140.7	83%	0.825	73%	0.731	S	S	*	*			trans	74.8	151.7	133.9	85.3	0	0	0	0	117.7
958	S	31.6	Very low	30.3	Very low	91 Å²	91	140.9 Å²	140.9	64%	0.636	73%	0.732	S	S	*	*			cis	-155.7	166	10.9	61.5	0	0	0	0	112.1
959	N	32.3	Very low	30.4	Very low	124 Å²	124	136.2 Å²	136.2	66%	0.663	73%	0.725	S	S	*	*			trans	49.9	112.8	153.6	-59	-24.5	0	0	0	118.6
960	H	35.9	Very low	30.5	Very low	176 Å²	176	132.9 Å²	132.9	82%	0.815	72%	0.718	S	S	*	*				-145.9	123	70	-96.2	-87.7	0	0	0	114.6
961	N	31.8	Very low	30.6	Very low	103 Å²	103	134.7 Å²	134.7	55%	0.551	72%	0.724	S	S	*	*			trans	19.3	127.3	134.5	-58.7	-20.3	0	0	0	117.9
962	N	33	Very low	30.9	Very low	133 Å²	133	129.6 Å²	129.6	71%	0.711	71%	0.707	S	S	*	*			cis	-141.3	142.2	25.8	-83.3	-47.6	0	0	0	110.6
963	K	30.9	Very low	30.9	Very low	146 Å²	146	132.9 Å²	132.9	64%	0.635	71%	0.708	S	S	*	*				55.4	138.1	70.2	-74.4	176.9	167.2	179.3	0	112.1
964	F	28.5	Very low	31.1	Very low	167 Å²	167	129.2 Å²	129.2	73%	0.732	70%	0.704	S	S	*	*			cis	-149.6	176.6	4.7	-98.5	-44.1	0	0	0	106.8
965	I	32.6	Very low	31	Very low	136 Å²	136	124.6 Å²	124.6	70%	0.697	69%	0.693	S	S	*	*			cis	-146.6	150.5	7.2	-133.4	158.4	0	0	0	107.3
966	A	29.6	Very low	31.3	Very low	75 Å²	75	123.8 Å²	123.8	62%	0.62	69%	0.689	S	S	*	*				39.9	146.5	102.9	0	0	0	0	0	116.4
967	L	31.6	Very low	31.3	Very low	150 Å²	150	123.2 Å²	123.2	79%	0.785	69%	0.689	S	S	*	*			cis	-131.8	136.5	31.7	-72.2	157	0	0	0	108.4
968	S	30.6	Very low	31.5	Very low	85 Å²	85	127.2 Å²	127.2	59%	0.594	69%	0.692	S	S	*	*				61.2	147.4	73.8	95.3	0	0	0	0	112.1
969	T	31.3	Very low	31.5	Very low	106 Å²	106	126.6 Å²	126.6	65%	0.65	70%	0.699	S	S	*	*			cis	-163	135.5	31.9	-13.9	0	0	0	0	109.7
970	T	31.9	Very low	31.6	Very low	96 Å²	96	125.7 Å²	125.7	59%	0.589	70%	0.703	S	S	*	*				62.4	120.2	129.8	59	0	0	0	0	119.9
971	N	30.6	Very low	31.4	Very low	151 Å²	151	125.2 Å²	125.2	81%	0.807	70%	0.701	S	S	*	*				95.7	152.4	94.6	-74.4	4	0	0	0	111.4
972	A	33.8	Very low	31.4	Very low	70 Å²	70	127 Å²	127	58%	0.579	71%	0.709	S	S	*	*			cis	-161.4	161.3	-19.6	0	0	0	0	0	108.3
973	N	29.5	Very low	31.3	Very low	138 Å²	138	125.8 Å²	125.8	74%	0.738	71%	0.706	S	S	*	*			trans	28.7	134.2	140.5	-54.6	-6.8	0	0	0	120.3
974	N	30.1	Very low	31.4	Very low	152 Å²	152	124.2 Å²	124.2	81%	0.813	71%	0.711	S	S	*	*			trans	72.9	141.7	151.3	-55.2	-11	0	0	0	115.1
975	S	30.2	Very low	31.5	Very low	94 Å²	94	125.4 Å²	125.4	66%	0.657	72%	0.717	S	S	*	*			cis	-162	-177.2	-5.2	40.2	0	0	0	0	109.6
976	D	31.5	Very low	31.2	Very low	118 Å²	118	125.2 Å²	125.2	63%	0.631	72%	0.717	S	S	*	*			trans	85.5	110.2	152.2	-62.1	-59.9	0	0	0	121.5
977	Q	30.3	Very low	31.2	Very low	158 Å²	158	129.1 Å²	129.1	74%	0.738	72%	0.717	S	S	*	*				64.8	97.2	122.8	-59.7	175	36.2	0	0	119.8
978	K	34.3	Very low	31.1	Very low	203 Å²	203	128 Å²	128	88%	0.883	71%	0.711	S	S	*	*				-179.4	123.6	106.3	-90.8	151.3	-174.6	175.8	0	107.4
979	G	32.1	Very low	31	Very low	77 Å²	77	132.9 Å²	132.9	79%	0.794	73%	0.725	S	S	*	*				78.2	118.6	91.9	0	0	0	0	0	109.4
980	S	33.8	Very low	31	Very low	106 Å²	106	132.2 Å²	132.2	74%	0.741	73%	0.73	S	S	*	*			cis	-150.8	143	22.3	39.3	0	0	0	0	109
981	H	31.7	Very low	30.8	Very low	166 Å²	166	136.2 Å²	136.2	77%	0.769	74%	0.742	S	S	*	*				47.1	126.5	92.3	-81	-71.2	0	0	0	113.2
982	L	31	Very low	30.8	Very low	139 Å²	139	134 Å²	134	73%	0.728	74%	0.738	S	S	*	*			cis	-157.8	136.8	17.6	-88.8	143.3	0	0	0	109.7
983	V	31	Very low	30.6	Very low	108 Å²	108	140 Å²	140	66%	0.655	75%	0.751	S	S	*	*				79.5	134.7	108.2	170.7	0	0	0	0	116.5
984	P	33.3	Very low	30.5	Very low	114 Å²	114	139 Å²	139	74%	0.74	75%	0.752	S	S	*	*			trans	-83.5	154.5	-174.9	35.1	-37.6	0	0	0	112.7
985	F	30.3	Very low	30.5	Very low	192 Å²	192	139.8 Å²	139.8	84%	0.842	76%	0.755	S	S	*	*			trans	-139.8	145	167	-103.7	-84.4	0	0	0	114.4
986	N	26.8	Very low	30.5	Very low	131 Å²	131	143.1 Å²	143.1	70%	0.701	76%	0.76	S	S	*	*			trans	-93.6	-173.4	174.8	-166	8.7	0	0	0	109.6
987	Y	29.8	Very low	30.2	Very low	158 Å²	158	142 Å²	142	62%	0.62	76%	0.761	S	S	*	*			trans	92.7	104.6	167.1	-71.1	-87.8	0	0	0	120.5
988	N	28.8	Very low	30	Very low	125 Å²	125	143.9 Å²	143.9	67%	0.668	77%	0.767	S	S	*	*				46.8	132.7	114.5	-65.4	-5.5	0	0	0	123
989	H	29.6	Very low	29.6	Very low	189 Å²	189	139.5 Å²	139.5	88%	0.875	76%	0.762	S	S	*	*			trans	4.8	128.8	140	-71.8	-80.9	0	0	0	119.4
990	A	30.1	Very low	29.3	Very low	92 Å²	92	145 Å²	145	76%	0.76	76%	0.764	S	S	*	*				-165.5	145.9	114.2	0	0	0	0	0	113.5
991	H	29.1	Very low	28.9	Very low	180 Å²	180	147.5 Å²	147.5	83%	0.833	77%	0.769	S	S	*	*			trans	-16	138.1	164.2	-55.3	-90.6	0	0	0	119.4
992	S	29.7	Very low	28.5	Very low	104 Å²	104	144.4 Å²	144.4	73%	0.727	77%	0.767	S	S	*	*				163.5	123.9	91.1	55	0	0	0	0	114.6
993	K	28.8	Very low	28.2	Very low	196 Å²	196	147 Å²	147	85%	0.852	77%	0.772	S	S	*	*				156	123.2	119.6	-86.6	179.7	-179.1	177.6	0	111.7
994	P	28.1	Very low	27.8	Very low	118 Å²	118	146.8 Å²	146.8	77%	0.766	78%	0.775	S	S	*	*			trans	-87.7	147.1	170.9	35.4	-32.3	0	0	0	111
995	L	30.9	Very low	27.5	Very low	168 Å²	168	147 Å²	147	88%	0.88	78%	0.775	S	S	*	*			trans	-139.3	92.3	165.1	-94	172.6	0	0	0	112
996	H	29.9	Very low	27.2	Very low	164 Å²	164	142.7 Å²	142.7	76%	0.759	77%	0.768	S	S	*	*			trans	31.2	111	138.3	-89.2	-80.1	0	0	0	120.5
997	S	24.3	Very low	27.2	Very low	93 Å²	93	145.5 Å²	145.5	65%	0.65	78%	0.78	S	S	*	*				31.7	114.8	121.2	65.3	0	0	0	0	119
998	K	27.8	Very low	27	Very low	198 Å²	198	143.5 Å²	143.5	86%	0.861	78%	0.784	S	S	*	*			trans	-147.6	107.4	132.3	-111.3	169.4	-170.1	177.8	0	110.3
999	S	24	Very low	27	Very low	111 Å²	111	146.8 Å²	146.8	78%	0.776	80%	0.795	S	S	*	*			trans	-63.2	131.4	163.8	51	0	0	0	0	110
1000	F	27.5	Very low	26.9	Very low	192 Å²	192	143.3 Å²	143.3	84%	0.842	79%	0.787	S	S	*	*			trans	-139.2	110.7	153.6	-108	-81.5	0	0	0	110.6
1001	N	23.7	Very low	26.8	Very low	159 Å²	159	148 Å²	148	85%	0.85	80%	0.795	S	S	*	*			trans	-64.4	126.9	159.8	-82.6	-41.1	0	0	0	109.1
1002	S	25.2	Very low	26.7	Very low	102 Å²	102	144.8 Å²	144.8	71%	0.713	79%	0.791	S	S	*	*			trans	-177.6	121.8	134.1	46.2	0	0	0	0	114.5
1003	K	23.8	Very low	26.5	Very low	192 Å²	192	150.2 Å²	150.2	84%	0.835	80%	0.797	S	S	*	*				40.3	112.8	128.3	-60.9	-178.8	177	178.8	0	120
1004	S	23.3	Very low	26.4	Very low	104 Å²	104	146.7 Å²	146.7	73%	0.727	80%	0.797	S	S	*	*				71.1	164.8	124.3	69.2	0	0	0	0	122
1005	T	25.4	Very low	26.3	Very low	120 Å²	120	144.2 Å²	144.2	74%	0.736	79%	0.793	S	S	*	*			trans	72.4	98.7	158.8	33.1	0	0	0	0	118.6
1006	S	24.7	Very low	26.1	Very low	100 Å²	100	142.4 Å²	142.4	70%	0.699	79%	0.794	S	S	*	*				35.1	121.4	124.6	60.5	0	0	0	0	119.3
1007	M	27.3	Very low	25.9	Very low	191 Å²	191	138.4 Å²	138.4	94%	0.941	80%	0.797	S	S	*	*			trans	-127.5	122.6	141.6	-104.5	-179.7	164.6	0	0	111.1
1008	V	26.1	Very low	26	Very low	116 Å²	116	139 Å²	139	70%	0.703	80%	0.801	S	S	*	*			trans	-86.3	129.8	166	169	0	0	0	0	106.7	T1010	V1008-T1010 HydrophobicContact CG1-CG2 3.89Å
1009	E	28.8	Very low	25.9	Very low	194 Å²	194	135.1 Å²	135.1	91%	0.907	79%	0.794	S	S	*	*			trans	-119.3	102.2	159.3	-77.7	-164.4	145.2	0	0	110.1
1010	T	26.2	Very low	26	Very low	115 Å²	115	137.1 Å²	137.1	71%	0.706	80%	0.796	S	S	*	*			trans	-91.2	133	166.2	43.8	0	0	0	0	110	V1008	V1008-T1010 HydrophobicContact CG1-CG2 3.89Å
1011	M	27.7	Very low	25.8	Very low	190 Å²	190	135.4 Å²	135.4	94%	0.936	80%	0.796	S	S	*	*			trans	-152	157.7	152.9	-88.7	-118.1	174.8	0	0	110.6
1012	P	27.7	Very low	25.9	Very low	113 Å²	113	138.2 Å²	138.2	73%	0.734	80%	0.795	S	S	*	*				-117.3	175.7	-129.4	41.6	-36	0	0	0	118.4
1013	Y	25	Very low	25.9	Very low	218 Å²	218	138.1 Å²	138.1	86%	0.855	79%	0.794	S	S	*	*			trans	-32	140.9	171.8	-83.7	-104.3	0	0	0	118.7
1014	S	26.3	Very low	25.9	Very low	123 Å²	123	135 Å²	135	86%	0.86	79%	0.786	S	S	*	*				-175	159.7	120.4	46.6	0	0	0	0	112.7
1015	G	27.5	Very low	26	Very low	66 Å²	66	136.5 Å²	136.5	68%	0.68	79%	0.791	S	S	*	*			trans	80.2	90	167.4	0	0	0	0	0	116.7
1016	S	25.6	Very low	25.8	Very low	129 Å²	129	134.9 Å²	134.9	90%	0.902	79%	0.789	S	S	*	*				54.3	98.7	89.7	73.2	0	0	0	0	115.6
1017	G	26.3	Very low	25.8	Very low	80 Å²	80	140.7 Å²	140.7	83%	0.825	80%	0.798	S	S	*	*			trans	-175.3	108.3	176.3	0	0	0	0	0	114.2
1018	S	25.7	Very low	25.6	Very low	105 Å²	105	143.2 Å²	143.2	73%	0.734	80%	0.797	S	S	*	*			trans	-41.7	144.2	-177.4	-171.9	0	0	0	0	118.9
1019	T	25.9	Very low	25.4	Very low	117 Å²	117	144.9 Å²	144.9	72%	0.718	80%	0.801	S	S	*	*			trans	73.9	125.1	146.6	38.6	0	0	0	0	122.5
1020	N	25.1	Very low	25.2	Very low	153 Å²	153	143.4 Å²	143.4	82%	0.818	80%	0.796	S	S	*	*			trans	75.4	67.5	149	-59.9	-9.4	0	0	0	119.2
1021	N	24.3	Very low	25.2	Very low	156 Å²	156	145.6 Å²	145.6	83%	0.834	80%	0.798	S	S	*	*			trans	-139.6	126	153.4	-110.2	-35.6	0	0	0	110.5
1022	R	26.3	Very low	25.2	Very low	218 Å²	218	141.8 Å²	141.8	82%	0.823	79%	0.786	S	S	*	*				166.9	102.8	129.4	-91.2	169.4	-172.6	-168.6	2.4	112.8
1023	S	24.1	Very low	25.1	Very low	100 Å²	100	140.6 Å²	140.6	70%	0.699	80%	0.795	S	S	*	*			trans	-52.1	149	145.8	43.9	0	0	0	0	111.7
1024	L	23.9	Very low	25.2	Very low	126 Å²	126	133.7 Å²	133.7	66%	0.66	79%	0.79	S	S	*	*			trans	141.4	108	152.3	-86.8	136.4	0	0	0	111.2	H746	H746-L1024 WeakPolarHBondContact CE1-CD1 3.43Å
1025	T	25.4	Very low	25.2	Very low	136 Å²	136	131.3 Å²	131.3	83%	0.834	79%	0.785	S	S	*	*			trans	-174	138.1	130.7	-67.4	0	0	0	0	106.7
1026	A	22.6	Very low	25.2	Very low	86 Å²	86	134.4 Å²	134.4	71%	0.711	79%	0.79	S	S	*	*			trans	-68.6	151.4	178.7	0	0	0	0	0	112.1
1027	Y	23.8	Very low	25.3	Very low	223 Å²	223	136.1 Å²	136.1	88%	0.875	79%	0.789	S	S	*	*			trans	-156.6	124	139.9	-109.1	-72	0	0	0	111.4
1028	W	22.6	Very low	25.2	Very low	244 Å²	244	137.8 Å²	137.8	92%	0.924	79%	0.788	S	S	*	*			trans	-76.9	113.9	161.5	-113.2	84.7	0	0	0	108
1029	L	23.2	Very low	25.3	Very low	150 Å²	150	140.1 Å²	140.1	79%	0.785	79%	0.791	S	S	*	*			trans	-178.9	150.9	150.3	-106.3	149.1	0	0	0	111.4
1030	M	24.2	Very low	25.2	Very low	164 Å²	164	138.2 Å²	138.2	81%	0.808	80%	0.795	S	S	*	*			trans	73.1	111.9	175.2	-53.5	-169.3	-176.8	0	0	118.1
1031	E	26.5	Very low	25.2	Very low	160 Å²	160	141 Å²	141	75%	0.748	80%	0.795	S	S	*	*			trans	-147.8	61.8	132.7	-126.3	175	-157.5	0	0	108.5	K607 G1033	K607-E1031 IonicContact NZ-OE1 2.65Å; K607-E1031 IonicContact NZ-OE2 3.98Å; K607-E1031 PolarHBondContact NZ-OE2 2.8Å; E1031-G1033 PolarHBondContact O-N 2.79Å
1032	T	27.4	Very low	25.2	Very low	110 Å²	110	142.5 Å²	142.5	68%	0.675	80%	0.797	S	S	*	*			trans	-68.9	121.8	154.3	32.9	0	0	0	0	107.2	G1034	T1032-G1034 PolarHBondContact O-N 3.47Å; T1032-G1034 VanDerWaalsContact O-N 3.13Å
1033	G	25.7	Very low	25.1	Very low	89 Å²	89	143.9 Å²	143.9	92%	0.918	80%	0.802	S	S	*	*			trans	-67.9	110.8	-170.3	0	0	0	0	0	113.4	E1031	E1031-G1033 PolarHBondContact O-N 2.79Å
1034	G	26.3	Very low	25.2	Very low	73 Å²	73	144.6 Å²	144.6	75%	0.753	80%	0.804	S	S	*	*			trans	-129.1	105.4	163.4	0	0	0	0	0	108.5	T1032	T1032-G1034 PolarHBondContact O-N 3.47Å; T1032-G1034 VanDerWaalsContact O-N 3.13Å
1035	G	27.7	Very low	25.2	Very low	73 Å²	73	144.1 Å²	144.1	75%	0.753	81%	0.812	S	S	*	*			trans	-68.1	151	-179.5	0	0	0	0	0	112.5
1036	V	25.9	Very low	25.2	Very low	131 Å²	131	144.7 Å²	144.7	79%	0.794	81%	0.809	S	S	*	*			trans	-20.3	130.2	156.4	-81.8	0	0	0	0	115.4
1037	D	28.8	Very low	25.4	Very low	165 Å²	165	148.3 Å²	148.3	88%	0.882	82%	0.815	S	S	*	*				-148.2	127.2	120.7	-99.1	-32.2	0	0	0	110.3	L1039	D1037-L1039 PolarHBondContact O-N 3.44Å
1038	S	24.9	Very low	25.4	Very low	114 Å²	114	148 Å²	148	80%	0.797	81%	0.812	S	S	*	*			trans	-96.3	89	-177	53.7	0	0	0	0	110.9
1039	L	27.2	Very low	25.7	Very low	155 Å²	155	142.1 Å²	142.1	81%	0.812	80%	0.803	S	S	*	*			trans	-138.2	119.3	161.1	-86.5	173.6	0	0	0	109.3	D1037 Y1041	D1037-L1039 PolarHBondContact O-N 3.44Å; L1039-Y1041 PolarHBondContact O-N 2.85Å
1040	G	23.4	Very low	25.8	Very low	76 Å²	76	139.4 Å²	139.4	78%	0.784	80%	0.797	S	S	*	*			trans	-73	122.8	176.1	0	0	0	0	0	110.7
1041	Y	25.9	Very low	25.9	Very low	213 Å²	213	141 Å²	141	84%	0.835	80%	0.799	S	S	*	*			trans	-137.6	125.1	160.5	-94.5	-80.3	0	0	0	109.8	L1039 R1043	L1039-Y1041 PolarHBondContact O-N 2.85Å; Y1041-R1043 PolarHBondContact O-N 2.95Å
1042	E	23.7	Very low	26	Very low	186 Å²	186	138.7 Å²	138.7	87%	0.869	80%	0.798	S	S	*	*			trans	-59.8	130.8	167.4	-58.8	176.8	136.3	0	0	109.1	P1044	E1042-P1044 WeakPolarHBondContact O-CD 3.42Å
1043	R	25.1	Very low	25.8	Very low	248 Å²	248	138.7 Å²	138.7	94%	0.936	80%	0.803	S	S	*	*			trans	-101.4	105.2	159.1	-97.4	-171.4	174	-174.9	-1.2	108.3	Y1041	Y1041-R1043 PolarHBondContact O-N 2.95Å
1044	P	25.6	Very low	25.9	Very low	114 Å²	114	143.7 Å²	143.7	74%	0.74	80%	0.802	S	S	*	*			trans	-69.2	137.3	175.7	28.1	-33.2	0	0	0	110.3	E1042 L1046	E1042-P1044 WeakPolarHBondContact O-CD 3.42Å; P1044-L1046 PolarHBondContact O-N 3.33Å; P1044-L1046 VanDerWaalsContact O-N 3.13Å
1045	S	23.5	Very low	25.8	Very low	117 Å²	117	146.2 Å²	146.2	82%	0.818	80%	0.803	S	S	*	*			trans	-66.5	101.4	167.9	50.4	0	0	0	0	110.3
1046	L	24.7	Very low	25.9	Very low	148 Å²	148	150.4 Å²	150.4	78%	0.775	81%	0.809	S	S	*	*			trans	-166.1	93	166.5	-107.7	171.1	0	0	0	111.4	P1044	P1044-L1046 PolarHBondContact O-N 3.33Å; P1044-L1046 VanDerWaalsContact O-N 3.13Å
1047	I	28.3	Very low	25.8	Very low	161 Å²	161	149 Å²	149	83%	0.826	80%	0.804	S	S	*	*			trans	-129.8	110.2	144.6	-63.4	-173.7	0	0	0	106.8	T1049	I1047-T1049 HydrophobicContact CG2-CG2 4.23Å
1048	R	23.3	Very low	25.9	Very low	218 Å²	218	148.1 Å²	148.1	82%	0.823	81%	0.805	S	S	*	*			trans	-111.5	104.8	173.9	180	-169.5	-168.3	-170	5.2	106.5
1049	T	29.3	Very low	25.9	Very low	120 Å²	120	149.5 Å²	149.5	74%	0.736	80%	0.803	S	S	*	*			trans	-124.9	90	170.1	46.6	0	0	0	0	109.5	I1047	I1047-T1049 HydrophobicContact CG2-CG2 4.23Å
1050	S	24.1	Very low	26.1	Very low	93 Å²	93	147.7 Å²	147.7	65%	0.65	80%	0.803	S	S	*	*			trans	-75.8	133.9	164.6	48.3	0	0	0	0	110.6
1051	F	27.4	Very low	26.2	Very low	196 Å²	196	153 Å²	153	86%	0.86	81%	0.807	S	S	*	*			trans	-141.7	157.4	154.9	-86.6	-66.9	0	0	0	108.6
1052	P	27.3	Very low	26.4	Very low	113 Å²	113	146.1 Å²	146.1	73%	0.734	80%	0.801	S	S	*	*			trans	-107.5	171.9	-137.3	6.4	17.2	0	0	0	113.3	Q1054	P1052-Q1054 PolarHBondContact O-N 2.87Å
1053	S	23.7	Very low	26.6	Very low	110 Å²	110	145.1 Å²	145.1	77%	0.769	80%	0.797	S	S	*	*			trans	-53.8	129.8	164.8	50.9	0	0	0	0	112.6
1054	Q	27.7	Very low	26.8	Very low	194 Å²	194	139.7 Å²	139.7	91%	0.907	79%	0.786	S	S	*	*			trans	-122.1	120.4	142.1	-76.9	-164.2	-2.8	0	0	109.4	P1052	P1052-Q1054 PolarHBondContact O-N 2.87Å
1055	T	24	Very low	27.1	Very low	125 Å²	125	140.5 Å²	140.5	77%	0.767	79%	0.789	S	S	*	*			trans	-71.7	140.1	165.9	46.5	0	0	0	0	109.8
1056	N	29.5	Very low	27.3	Very low	162 Å²	162	141.7 Å²	141.7	87%	0.866	79%	0.787	S	S	*	*			trans	-148.7	141.1	140.2	-103.3	-26.4	0	0	0	111.1
1057	S	24.7	Very low	27.6	Very low	101 Å²	101	142.3 Å²	142.3	71%	0.706	79%	0.789	S	S	*	*			trans	-77.6	147.8	-172.7	51.8	0	0	0	0	113.8
1058	V	29.9	Very low	27.6	Very low	147 Å²	147	138.6 Å²	138.6	89%	0.891	78%	0.777	S	S	*	*				-143.7	141.9	128.8	-177.5	0	0	0	0	108.8
1059	N	25.4	Very low	27.8	Very low	143 Å²	143	133.2 Å²	133.2	77%	0.765	77%	0.769	S	S	*	*			trans	-81.1	149.4	-178.2	-56.7	-46.7	0	0	0	113.3
1060	S	30.8	Very low	27.8	Very low	116 Å²	116	137.8 Å²	137.8	81%	0.811	78%	0.779	S	S	*	*				-165.9	123.2	129.9	49.9	0	0	0	0	114.3
1061	H	27.4	Very low	27.9	Very low	188 Å²	188	139 Å²	139	87%	0.87	78%	0.777	S	S	*	*			trans	-11.9	153.5	163.4	-63.9	-85.7	0	0	0	123.2
1062	G	29.4	Very low	28	Very low	69 Å²	69	135.5 Å²	135.5	71%	0.711	77%	0.767	S	S	*	*			trans	131.2	62.2	161.5	0	0	0	0	0	113.5
1063	E	27.7	Very low	28	Very low	165 Å²	165	138.3 Å²	138.3	77%	0.771	77%	0.77	S	S	*	*				73.4	131.1	91.9	-78.2	-160.4	178	0	0	117.2
1064	N	28.4	Very low	28.3	Very low	134 Å²	134	141.2 Å²	141.2	72%	0.717	78%	0.777	S	S	*	*			trans	71.6	133.8	160.5	-56.6	-38	0	0	0	117.9
1065	T	32	Very low	28.3	Very low	131 Å²	131	137.1 Å²	137.1	80%	0.804	77%	0.769	S	S	*	*			cis	-153.5	159.9	7	-3.4	0	0	0	0	114
1066	N	28	Very low	28.6	Very low	142 Å²	142	137.9 Å²	137.9	76%	0.759	77%	0.768	S	S	*	*			trans	-51	151.5	-177.5	-68.5	-57.2	0	0	0	119
1067	I	30.4	Very low	28.5	Very low	160 Å²	160	137.4 Å²	137.4	82%	0.821	77%	0.766	S	S	*	*				178.3	88.1	116.2	-90.8	159.2	0	0	0	106.7
1068	S	28.3	Very low	28.8	Very low	84 Å²	84	139 Å²	139	59%	0.587	77%	0.767	S	S	*	*				76.5	93.1	84.4	75	0	0	0	0	115.2
1069	T	28.1	Very low	28.9	Very low	105 Å²	105	140.4 Å²	140.4	64%	0.644	76%	0.761	S	S	*	*				58.1	117	125.7	56.8	0	0	0	0	120.9	I1071	T1069-I1071 HydrophobicContact CG2-CD1 4.11Å
1070	F	29.1	Very low	29.1	Very low	215 Å²	215	141.8 Å²	141.8	94%	0.943	77%	0.767	S	S	*	*				-134.4	134.4	114	-124.9	-88	0	0	0	109.6
1071	I	26.8	Very low	29.2	Very low	120 Å²	120	144.8 Å²	144.8	62%	0.615	77%	0.769	S	S	*	*			trans	-118.8	175.7	-167.3	-84	173.1	0	0	0	108.9	T1069	T1069-I1071 HydrophobicContact CG2-CD1 4.11Å
1072	D	28.7	Very low	29.4	Very low	122 Å²	122	145.2 Å²	145.2	65%	0.652	76%	0.762	S	S	*	*			trans	86.7	105.7	171.6	-67	-21.4	0	0	0	117.2
1073	Q	27.8	Very low	29.5	Very low	171 Å²	171	148.2 Å²	148.2	80%	0.799	77%	0.767	S	S	*	*				85.5	97	66.3	-79.9	-171.7	62.3	0	0	111
1074	N	29.9	Very low	29.7	Very low	172 Å²	172	147.5 Å²	147.5	92%	0.92	77%	0.767	S	S	*	*			trans	-154.8	129.4	133.4	-112.1	-32.7	0	0	0	110.9
1075	C	28.1	Very low	29.7	Very low	107 Å²	107	146.2 Å²	146.2	72%	0.723	77%	0.767	S	S	*	*			trans	-79.7	143.9	177.2	-60.3	0	0	0	0	110.4
1076	N	30.5	Very low	29.6	Very low	142 Å²	142	146.8 Å²	146.8	76%	0.759	77%	0.765	S	S	*	*				176.4	122.1	108.7	-88.4	-25.7	0	0	0	113.3
1077	N	27.9	Very low	29.8	Very low	152 Å²	152	147 Å²	147	81%	0.813	76%	0.761	S	S	*	*			trans	6	111.9	137.5	-52.1	-30.1	0	0	0	117.8
1078	D	31.3	Very low	29.8	Very low	135 Å²	135	149.5 Å²	149.5	72%	0.722	77%	0.77	S	S	*	*			trans	-163.8	26	145.5	-149.2	14.1	0	0	0	117.4
1079	F	30.2	Very low	29.9	Very low	175 Å²	175	148.7 Å²	148.7	77%	0.768	76%	0.764	S	S	*	*	S	Bend	trans	-140.8	-2.5	-176.2	-140.4	-99.8	0	0	0	118.9
1080	L	30.9	Very low	30	Very low	172 Å²	172	151.7 Å²	151.7	90%	0.901	78%	0.775	S	S	*	*	S	Bend	trans	-94.6	2.3	-178.6	-116.3	134	0	0	0	114.8
1081	E	32.1	Very low	30	Very low	180 Å²	180	151.1 Å²	151.1	84%	0.841	77%	0.772	S	S	*	*	S	Bend	trans	-99.9	-6	-178.4	-121.4	-172	-176.5	0	0	115.5
1082	R	31.3	Very low	30.1	Very low	196 Å²	196	155 Å²	155	74%	0.74	78%	0.784	S	S	*	*	S	Bend	trans	-97.1	11.5	-173.7	-64.5	-167.4	-166.5	-169.6	7.8	116.6
1083	V	31.8	Very low	30.2	Very low	133 Å²	133	154.7 Å²	154.7	81%	0.806	79%	0.787	S	S	*	*	S	Bend	trans	-116.9	2.7	-178.8	-172.4	0	0	0	0	113.1
1084	I	32	Very low	30.4	Very low	149 Å²	149	150.8 Å²	150.8	76%	0.764	78%	0.779	S	S	*	*	S	Bend	trans	-107.7	-12.9	-177.9	-69.4	177.8	0	0	0	113.6
1085	C	29.6	Very low	30.4	Very low	107 Å²	107	148.3 Å²	148.3	72%	0.723	77%	0.77	S	S	*	*	S	Bend	trans	-126.1	66.4	-176.8	-70.1	0	0	0	0	114.1
1086	N	29.6	Very low	30.6	Very low	144 Å²	144	150.5 Å²	150.5	77%	0.77	78%	0.775	S	S	*	*	S	Bend	trans	-178.8	124.3	156.5	-97.5	-22	0	0	0	107.6
1087	H	31.5	Very low	30.7	Very low	145 Å²	145	151.1 Å²	151.1	67%	0.671	78%	0.776	S	S	*	*			cis	-135.2	118.8	13.3	-108.6	-94.8	0	0	0	111.2	S1089	H1087-S1089 PolarHBondContact ND1-OG 2.8Å; H1087-S1089 PolarHBondContact O-N 2.91Å
1088	Q	30.4	Very low	30.6	Very low	214 Å²	214	151.8 Å²	151.8	100%	1	78%	0.779	S	S	*	*			trans	-80.5	52.7	164.2	-75	-175.7	-28.2	0	0	111.3
1089	S	30.9	Very low	30.7	Very low	67 Å²	67	151 Å²	151	47%	0.469	78%	0.78	S	S	.	*			trans	-144.1	85.6	179.3	65.5	0	0	0	0	112.1	H1087	H1087-S1089 PolarHBondContact ND1-OG 2.8Å; H1087-S1089 PolarHBondContact O-N 2.91Å
1090	L	28.8	Very low	30.6	Very low	168 Å²	168	153.5 Å²	153.5	88%	0.88	81%	0.809	S	S	*	*			trans	-171.9	40.4	142.7	-98.7	161.9	0	0	0	111.5
1091	K	29.2	Very low	30.6	Very low	203 Å²	203	152.6 Å²	152.6	88%	0.883	81%	0.805	S	S	*	*			trans	-100.3	91.1	154.4	-88.6	-173.5	174	179.9	0	107.8
1092	K	28.7	Very low	30.5	Very low	200 Å²	200	151.1 Å²	151.1	87%	0.87	80%	0.803	S	S	*	*			trans	159.3	80.9	157	-92.7	171.4	177.9	-177.6	0	111.9
1093	T	31.9	Very low	30.5	Very low	117 Å²	117	148.6 Å²	148.6	72%	0.718	81%	0.806	S	S	*	*			trans	-165.7	86.1	148.1	17.3	0	0	0	0	105.3
1094	S	32	Very low	30.4	Very low	88 Å²	88	149.5 Å²	149.5	62%	0.615	81%	0.806	S	S	*	*				72.8	94.8	95.5	64.8	0	0	0	0	111.2
1095	T	29.9	Very low	30.3	Very low	121 Å²	121	149.6 Å²	149.6	74%	0.742	81%	0.809	S	S	*	*				58.7	134.2	86.6	61.7	0	0	0	0	113.5
1096	N	31.5	Very low	30.3	Very low	152 Å²	152	152.4 Å²	152.4	81%	0.813	81%	0.814	S	S	*	*			trans	76	128.5	-158.1	-46	-32	0	0	0	109.9
1097	I	32.1	Very low	30.4	Very low	155 Å²	155	153 Å²	153	80%	0.795	82%	0.818	S	S	*	*			cis	-126.1	116.8	29.8	-69.8	155.4	0	0	0	111.5
1098	L	27.6	Very low	30.3	Very low	166 Å²	166	153.6 Å²	153.6	87%	0.869	83%	0.829	S	S	*	*			trans	-74.1	132.5	144.7	-94.6	153.1	0	0	0	107.3
1099	T	31.6	Very low	30.3	Very low	120 Å²	120	148.6 Å²	148.6	74%	0.736	82%	0.815	S	S	*	*			trans	133.8	78.7	154.3	63	0	0	0	0	114.1
1100	T	29.2	Very low	30.2	Very low	226 Å²	226	156 Å²	156	100%	1.387	85%	0.846	S	S	*	*				-168.3	0	122	31.8	0	0	0	0	108.2

Retrieved 1,100 of 1,100 residues in 264.2 ms (Link to these results)

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