A0A096MUR6_PAPAN Loading...

Protocadherin-19

Calcium-dependent cell-adhesion protein.

AlphaFold DB , UniProt , Accession A0A096MUR6, Species PAPAN (Papio anubis, Olive baboon), Gene PCDH19, Length 1,148 aa.

						>A0A096MUR6_PAPAN|A0A096MUR6|PCDH19
MESLLLPVLLLLAVLWTQAAALINLKYSVEEEQRAGTVIANVAKDAREAGFALDPRQASAFRVVSNSAPHLVDINPSSGLLVTKQKIDRDLLCRQSPKCIISLEVMSSSMEICVIKVEIKDLNDNAPSFPAAQIELEISEAASPGTRIPLDSAYDPDSGSFGVQTYELTPNELFGLEIKTRGDGSRFAELVVEKSLDRETQSHYSFRITALDGGDPPRLGTVGLSIKVTDSNDNNPVFSESTYSVSVPENSPPNTPVIRLNASDPDEGTNGQVVYSFYGYVNDRTRELFQIDPHSGLVTVTGALDYEEGHVYELDVQAKDLGPNSIPAHCKVTVSVLDTNDNPPVINLLSVNSELVEVSESAPPGYVIALVRVSDRDSGLNGRVQCRLLGNVPFRLQEYESFSTILVDGRLDREQHDQYNLTIQARDGGVPMLQSAKSFTVLITDENDNHPHFSKPYYQVIVQENNTPGAYLLSVSARDPDLGLNGSVSYQIVPSQVRDMPVFTYVSINPNSGDIYALRSFNHEQTKAFEFKVLAKDGGLPSLQSNATVRVIILDVNDNTPVITAPPLINGTAEVYIPRNSGIGYLVTVVKAEDYDEGENGRVTYDMTEGDRGFFEIDQVNGEVRTTRTFGESSKSSYELIVVAHDHGKTSLSASALVLIYLSPALDAQESMGSVNLSLIFIIALGSIAGILFVTMIFVAIKCKRDNKEIRTYNCSNCLTITCLLGCFIKGQNSKCLHCISVSPISEEQDKKTEEKVSLRGKRIAEYSYGHQKKSSKKKKISKNDIRLVPRDVEETDKMNVVSCSSLTSSLNYFDYHQQTLPLGCRRSESTFLNVENQNTRNTSANHIYHHSFNSQGPQQPDLIINGVPLPETENYSFDSNYVNSRAHLIKSSSTFKDLEGNSLKDSGHEESDQTDSEHDVQRSLYCDTAVNDVLNTSVTSMGSQMPDHDQNEGFHCREECRILGHSDRCWMPRNPMPIRSKSPEHVRNIIALSIEATAADVEAYDDCGPTKRTFATFGKDVSDHPAEERPTLKGKRTVDVTICSPKVSSVIREAGNGCEAISPVTSPLHLKSPLPTKPSVSYTIALAPPARDLEQYVNNVNNGPARPSEAEPRGADSEKVMHEVNPILKEGRHKESPGVKRLKDIVL
					

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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	48.3	Very low	57.2	Low	220 Å²	220	131.2 Å²	131.2	100%	1.084	70%	0.704	S	S	*	*				0	68.5	0	-174.2	175.7	80.7	0	0	107.5
2	E	50.2	Low	57.4	Low	185 Å²	185	129.3 Å²	129.3	86%	0.864	69%	0.693	S	S	*	*			trans	-116.5	8.6	-157	-72.4	148.2	111	0	0	114
3	S	54	Low	57.5	Low	102 Å²	102	124 Å²	124	71%	0.713	68%	0.678	S	S	*	*	S	Bend	trans	-97.8	13.4	-168.3	48.3	0	0	0	0	115.6
4	L	57.8	Low	57.4	Low	139 Å²	139	122.6 Å²	122.6	73%	0.728	68%	0.675	S	S	*	*	S	Bend	trans	-134.1	-11.5	-175	-91.6	117.9	0	0	0	117.8
5	L	56	Low	57	Low	133 Å²	133	123.1 Å²	123.1	70%	0.696	68%	0.676	S	S	*	*	S	Bend	trans	-79.5	-33.9	175.8	-99.7	87.7	0	0	0	113.5	V8 L9	L5-V8 PolarHBondContact O-N 2.94Å; L5-L9 PolarHBondContact O-N 2.9Å
6	L	59.6	Low	56.2	Low	135 Å²	135	129.7 Å²	129.7	71%	0.707	69%	0.687	S	S	*	*	H	α-helix	trans	-58.3	-41	-171.7	-144.6	76	0	0	0	114.6	V8 L10	L6-V8 PolarHBondContact O-N 3.26Å; L6-L10 PolarHBondContact O-N 3.08Å
7	P	59.4	Low	55.4	Low	88 Å²	88	128.6 Å²	128.6	57%	0.571	69%	0.687	S	S	*	*	H	α-helix	trans	-67.1	-35	179.5	-21.3	34.2	0	0	0	113.7	L11	P7-L11 PolarHBondContact O-N 3.21Å
8	V	63.4	Low	54.7	Low	90 Å²	90	132.1 Å²	132.1	55%	0.545	70%	0.699	S	S	.	*	H	α-helix	trans	-74.2	-39.4	-176.9	-177	0	0	0	0	110.9	L5 L6 L11 L12	L5-V8 PolarHBondContact O-N 2.94Å; L6-V8 PolarHBondContact O-N 3.26Å; V8-L11 PolarHBondContact O-N 2.9Å; V8-L12 HydrophobicContact CG1-CD1 4.43Å; V8-L12 PolarHBondContact O-N 2.83Å
9	L	61.2	Low	53.9	Low	110 Å²	110	129.7 Å²	129.7	58%	0.576	70%	0.7	S	S	*	*	H	α-helix	trans	-66.1	-37	176.5	-115.5	152.3	0	0	0	112.3	L5 A13	L5-L9 PolarHBondContact O-N 2.9Å; L9-A13 WeakPolarHBondContact O-CB 3.3Å; L9-A13 PolarHBondContact O-N 2.82Å
10	L	60.6	Low	53.4	Low	117 Å²	117	128.4 Å²	128.4	61%	0.613	71%	0.707	S	S	*	*	H	α-helix	trans	-64.7	-41.1	173.2	-115.7	81	0	0	0	112.4	L6 L12 A13 V14	L6-L10 PolarHBondContact O-N 3.08Å; L10-L12 VanDerWaalsContact C-N 3.34Å; L10-L12 PolarHBondContact O-N 3.42Å; L10-A13 PolarHBondContact O-N 2.97Å; L10-V14 WeakPolarHBondContact O-CG2 3.3Å; L10-V14 PolarHBondContact O-N 3.46Å; L10-V14 VanDerWaalsContact O-N 3.1Å
11	L	58.9	Low	53.3	Low	124 Å²	124	126.5 Å²	126.5	65%	0.649	71%	0.709	S	S	*	*	H	α-helix	trans	-66.1	-37.6	-178.6	-155.5	77.8	0	0	0	112	P7 V8 L15	P7-L11 PolarHBondContact O-N 3.21Å; V8-L11 PolarHBondContact O-N 2.9Å; L11-L15 PolarHBondContact O-N 3.24Å
12	L	58.9	Low	53.7	Low	108 Å²	108	121.3 Å²	121.3	57%	0.565	68%	0.684	S	S	*	*	H	α-helix	trans	-69.7	-38.9	174.1	-74.2	166.3	0	0	0	112.3	V8 L10 V14 L15	V8-L12 HydrophobicContact CG1-CD1 4.43Å; V8-L12 PolarHBondContact O-N 2.83Å; L10-L12 VanDerWaalsContact C-N 3.34Å; L10-L12 PolarHBondContact O-N 3.42Å; L12-V14 VanDerWaalsContact C-N 3.32Å; L12-V14 PolarHBondContact O-N 3.23Å; L12-L15 PolarHBondContact O-N 2.81Å
13	A	58.8	Low	54.5	Low	61 Å²	61	114.1 Å²	114.1	50%	0.504	65%	0.652	S	S	.	*	H	α-helix	trans	-63.3	-35.4	176.8	0	0	0	0	0	113	L9 L10 L15	L9-A13 WeakPolarHBondContact O-CB 3.3Å; L9-A13 PolarHBondContact O-N 2.82Å; L10-A13 PolarHBondContact O-N 2.97Å; A13-L15 VanDerWaalsContact C-N 3.33Å
14	V	57	Low	55.5	Low	104 Å²	104	112.7 Å²	112.7	63%	0.63	64%	0.636	S	S	*	*	H	α-helix	trans	-74.2	-21.7	177.4	172.7	0	0	0	0	112.6	L10 L12 T17	L10-V14 WeakPolarHBondContact O-CG2 3.3Å; L10-V14 PolarHBondContact O-N 3.46Å; L10-V14 VanDerWaalsContact O-N 3.1Å; L12-V14 VanDerWaalsContact C-N 3.32Å; L12-V14 PolarHBondContact O-N 3.23Å; V14-T17 PolarHBondContact O-OG1 2.7Å
15	L	50.2	Low	56.6	Low	131 Å²	131	107 Å²	107	69%	0.686	61%	0.606	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.3	-0.5	179.8	-77.4	167.2	0	0	0	114.7	L11 L12 A13	L11-L15 PolarHBondContact O-N 3.24Å; L12-L15 PolarHBondContact O-N 2.81Å; A13-L15 VanDerWaalsContact C-N 3.33Å
16	W	44.2	Very low	58	Low	228 Å²	228	108.7 Å²	108.7	86%	0.864	61%	0.608	S	S	*	*	S	Bend	trans	-105.7	-2.9	177.8	-96.3	42.7	0	0	0	114.6
17	T	43.8	Very low	59.3	Low	111 Å²	111	104 Å²	104	68%	0.681	58%	0.581	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.3	14.1	-175	52.1	0	0	0	0	115	V14	V14-T17 PolarHBondContact O-OG1 2.7Å
18	Q	41.8	Very low	60.7	Low	192 Å²	192	102.1 Å²	102.1	90%	0.897	57%	0.57	S	S	*	*	T	Hydrogen-bonded Turn	trans	-128.7	33.9	178.3	-66.6	-164.3	-10.1	0	0	114.3
19	A	40.3	Very low	61.9	Low	87 Å²	87	98.3 Å²	98.3	72%	0.719	55%	0.547	S	S	*	.	S	Bend	trans	-84.1	118.6	157.1	0	0	0	0	0	109	A21	A19-A21 PolarHBondContact O-N 2.82Å
20	A	44.3	Very low	63.2	Low	102 Å²	102	97.5 Å²	97.5	84%	0.843	54%	0.541	S	S	*	.			trans	-63.4	126.4	177.4	0	0	0	0	0	110.5	L22	A20-L22 PolarHBondContact O-N 3.47Å
21	A	49.8	Very low	64.5	Low	90 Å²	90	92 Å²	92	74%	0.744	51%	0.512	S	S	*	.			trans	-73	109.9	-175	0	0	0	0	0	111.1	A19 I23	A19-A21 PolarHBondContact O-N 2.82Å; A21-I23 WeakPolarHBondContact O-CG1 3.41Å; A21-I23 PolarHBondContact O-N 3.43Å
22	L	58.4	Low	65.9	Low	110 Å²	110	88.9 Å²	88.9	58%	0.576	49%	0.494	S	S	*	.			trans	-77.5	91.1	-178.8	-163.3	140.5	0	0	0	110.4	A20 N24 V114	A20-L22 PolarHBondContact O-N 3.47Å; L22-N24 WeakPolarHBondContact CD2-ND2 3.33Å; L22-N24 PolarHBondContact O-N 2.86Å; L22-N24 VanDerWaalsContact O-N 3.16Å; L22-N24 PolarHBondContact O-ND2 2.76Å; L22-V114 HydrophobicContact CD2-CG2 3.72Å
23	I	66.6	Low	67.1	Low	34 Å²	34	86.6 Å²	86.6	17%	0.174	48%	0.48	C	S	.	.			trans	-64.8	115.8	-171.4	-54.7	-169.2	0	0	0	110.4	A21 L25 A49 F51 C113 V114	A21-I23 WeakPolarHBondContact O-CG1 3.41Å; A21-I23 PolarHBondContact O-N 3.43Å; I23-L25 HydrophobicContact CG2-CD2 4.23Å; I23-L25 HydrophobicContact CG2-CG 4.18Å; I23-A49 HydrophobicContact CG2-CB 4.25Å; I23-F51 HydrophobicContact CD1-CB 3.96Å; I23-F51 HydrophobicContact CD1-CD2 3.77Å; I23-F51 HydrophobicContact CD1-CG 4.3Å; I23-F51 HydrophobicContact CG1-CD2 4.48Å; I23-C113 WeakPolarHBondContact O-CA 3.42Å; I23-C113 PolarHBondContact O-SG 3.15Å; I23-V114 PolarHBondContact O-N 2.74Å
24	N	74.8	Confident	68.4	Low	72 Å²	72	93.7 Å²	93.7	39%	0.385	49%	0.494	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	106.3	173.3	-81.7	-114.2	0	0	0	108.9	L22 V114 K116	L22-N24 WeakPolarHBondContact CD2-ND2 3.33Å; L22-N24 PolarHBondContact O-N 2.86Å; L22-N24 VanDerWaalsContact O-N 3.16Å; L22-N24 PolarHBondContact O-ND2 2.76Å; N24-V114 CarbonylContact C-O 3.57Å; N24-V114 WeakPolarHBondContact CA-O 3.38Å; N24-K116 PolarHBondContact OD1-NZ 3.22Å
25	L	80.6	Confident	69.7	Low	20 Å²	20	91.9 Å²	91.9	11%	0.105	49%	0.49	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	139.6	171.1	-67	176.3	0	0	0	109.7	I23 Y27 V42 A46 A49 V114 K116	I23-L25 HydrophobicContact CG2-CD2 4.23Å; I23-L25 HydrophobicContact CG2-CG 4.18Å; L25-Y27 HydrophobicContact CB-CE2 4.05Å; L25-V42 HydrophobicContact CD1-CG1 3.65Å; L25-A46 HydrophobicContact CD1-CB 4.04Å; L25-A49 HydrophobicContact CD2-CB 4.42Å; L25-V114 PolarHBondContact N-O 2.72Å; L25-K116 PolarHBondContact O-N 2.82Å
26	K	85.3	Confident	71.2	Confident	168 Å²	168	88 Å²	88	73%	0.73	48%	0.481	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120.7	130.6	178.4	-68.3	-174.4	-179.5	-177.5	0	109.9	K116	K26-K116 WeakPolarHBondContact CA-O 3.41Å
27	Y	87.9	Confident	73.3	Confident	36 Å²	36	79.2 Å²	79.2	14%	0.141	45%	0.453	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	164.1	174.1	-59.2	-61.5	0	0	0	109.9	L25 A40 V42 D45 L81 I115 K116 V117 E118	L25-Y27 HydrophobicContact CB-CE2 4.05Å; Y27-A40 HydrophobicContact CD1-CB 3.38Å; Y27-A40 HydrophobicContact CD2-CB 3.84Å; Y27-A40 HydrophobicContact CE1-CB 3.27Å; Y27-A40 HydrophobicContact CE2-CB 3.75Å; Y27-A40 HydrophobicContact CG-CB 3.65Å; Y27-A40 VanDerWaalsContact CZ-CB 3.44Å; Y27-V42 HydrophobicContact CE2-CG2 4Å; Y27-D45 VanDerWaalsContact CE1-OD2 3.3Å; Y27-D45 WeakPolarHBondContact CE1-OD2 3.3Å; Y27-D45 WeakPolarHBondContact OH-CB 3.35Å; Y27-D45 PolarHBondContact OH-OD2 3.32Å; Y27-L81 HydrophobicContact CD2-CD2 3.94Å; Y27-I115 HydrophobicContact CD2-CG2 3.67Å; Y27-I115 HydrophobicContact CE2-CG2 3.97Å; Y27-K116 PolarHBondContact N-O 3.33Å; Y27-V117 WeakPolarHBondContact O-CA 3.28Å; Y27-E118 PolarHBondContact O-N 3.24Å
28	S	87.9	Confident	75.3	Confident	50 Å²	50	77.8 Å²	77.8	35%	0.35	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	139.6	169.2	66.9	0	0	0	0	110	E118 K120	S28-E118 WeakPolarHBondContact CA-O 3.39Å; S28-K120 WeakPolarHBondContact OG-CE 3.34Å; S28-K120 PolarHBondContact OG-NZ 2.69Å
29	V	89.4	Confident	77.5	Confident	10 Å²	10	70 Å²	70	6%	0.061	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	140.3	167.8	74	0	0	0	0	108	Q33 I39 T83 I87 V117 E118 I119 K120	V29-Q33 HydrophobicContact CG2-CG 4.37Å; V29-I39 HydrophobicContact CB-CD1 3.96Å; V29-I39 HydrophobicContact CB-CG1 4.06Å; V29-I39 HydrophobicContact CB-CG2 4.08Å; V29-I39 HydrophobicContact CG1-CD1 4.15Å; V29-I39 HydrophobicContact CG2-CD1 4.01Å; V29-I39 HydrophobicContact CG2-CG1 3.77Å; V29-T83 HydrophobicContact CG2-CG2 4.15Å; V29-I87 HydrophobicContact CG1-CD1 4.42Å; V29-V117 HydrophobicContact CB-CG1 4.2Å; V29-V117 HydrophobicContact CG1-CG1 3.79Å; V29-E118 PolarHBondContact N-O 2.94Å; V29-E118 VanDerWaalsContact N-O 3.09Å; V29-I119 HydrophobicContact CG1-CG1 4.44Å; V29-I119 CarbonylContact O-C 3.41Å; V29-I119 WeakPolarHBondContact O-CA 3.33Å; V29-K120 PolarHBondContact O-N 3.22Å
30	E	88.1	Confident	79.6	Confident	93 Å²	93	66.4 Å²	66.4	44%	0.435	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	148.3	165.1	-72.8	147.8	-156.5	0	0	109.5	Q33 K120 L122	E30-Q33 HydrophobicContact CB-CG 4.18Å; E30-Q33 WeakPolarHBondContact O-CG 3.27Å; E30-Q33 PolarHBondContact OE2-NE2 2.93Å; E30-K120 HydrophobicContact CG-CB 4.29Å; E30-K120 HydrophobicContact CG-CD 4.44Å; E30-L122 HydrophobicContact CB-CD1 4.4Å; E30-L122 HydrophobicContact CB-CD2 4.3Å; E30-L122 HydrophobicContact CB-CG 4.45Å; E30-L122 HydrophobicContact CG-CD2 4.18Å
31	E	88.6	Confident	81.5	Confident	1 Å²	1	64.5 Å²	64.5	1%	0.005	35%	0.354	C	S	.	.	S	Bend	trans	-71.7	-177.6	169.6	71.1	-177	103.9	0	0	112.4	Q33 I87 R89 I119 K120 D121 L122	E31-Q33 PolarHBondContact O-N 3.47Å; E31-I87 WeakPolarHBondContact CB-O 3.44Å; E31-R89 HydrophobicContact CB-CB 4.27Å; E31-R89 HydrophobicContact CG-CB 4.43Å; E31-R89 WeakPolarHBondContact OE1-CB 3.06Å; E31-R89 VanDerWaalsContact OE1-CD 3.24Å; E31-R89 WeakPolarHBondContact OE1-CD 3.28Å; E31-R89 IonicContact OE1-CZ 2.61Å; E31-R89 IonicContact OE1-NE 3.19Å; E31-R89 PolarHBondContact OE1-NE 3.09Å; E31-R89 WeakPolarHBondContact OE2-CA 3.36Å; E31-R89 WeakPolarHBondContact OE2-CB 3.31Å; E31-R89 PolarHBondContact OE2-N 3.08Å; E31-I119 HydrophobicContact CB-CG2 3.87Å; E31-K120 PolarHBondContact N-O 2.59Å; E31-K120 VanDerWaalsContact N-O 3.08Å; E31-D121 WeakPolarHBondContact OE1-CA 3.34Å; E31-L122 HydrophobicContact CG-CB 3.95Å; E31-L122 HydrophobicContact CG-CD1 3.99Å; E31-L122 HydrophobicContact CG-CG 3.87Å; E31-L122 VanDerWaalsContact O-CD1 3.28Å; E31-L122 WeakPolarHBondContact O-CD1 3.13Å; E31-L122 PolarHBondContact OE1-N 2.84Å
32	E	86.8	Confident	83	Confident	59 Å²	59	60.2 Å²	60.2	28%	0.276	32%	0.319	S	S	.	.	S	Bend	trans	59.7	-8.2	-176.2	-67.8	-67.8	85.1	0	0	116.5	K86 I87 L122 D124	E32-K86 VanDerWaalsContact CD-CE 3.44Å; E32-K86 WeakPolarHBondContact OE1-CE 3.46Å; E32-K86 IonicContact OE1-NZ 2.56Å; E32-K86 PolarHBondContact OE1-NZ 2.87Å; E32-K86 WeakPolarHBondContact OE2-CE 2.94Å; E32-K86 IonicContact OE2-NZ 2.72Å; E32-K86 PolarHBondContact OE2-NZ 3.31Å; E32-I87 PolarHBondContact N-O 2.78Å; E32-L122 HydrophobicContact CB-CD1 4.1Å; E32-L122 HydrophobicContact CG-CD1 4.45Å; E32-D124 WeakPolarHBondContact CG-OD1 3.2Å
33	Q	85.7	Confident	83.8	Confident	60 Å²	60	55.1 Å²	55.1	28%	0.28	29%	0.293	S	S	.	.	P	Polyproline II helix	trans	-57.5	137.3	-179.4	-70.2	-64.9	-20.2	0	0	111.7	V29 E30 E31 T37 T83	V29-Q33 HydrophobicContact CG2-CG 4.37Å; E30-Q33 HydrophobicContact CB-CG 4.18Å; E30-Q33 WeakPolarHBondContact O-CG 3.27Å; E30-Q33 PolarHBondContact OE2-NE2 2.93Å; E31-Q33 PolarHBondContact O-N 3.47Å; Q33-T37 HydrophobicContact CB-CG2 4.31Å; Q33-T37 HydrophobicContact CG-CG2 4.42Å; Q33-T83 HydrophobicContact CB-CG2 4.38Å
34	R	85.3	Confident	84.3	Confident	209 Å²	209	58 Å²	58	79%	0.789	30%	0.304	S	S	*	.	P	Polyproline II helix	trans	-62.6	152.4	-179.3	-62	-179.2	-176.4	176	2.2	110.8	G36 T37 T83	R34-G36 PolarHBondContact O-N 2.84Å; R34-T37 WeakPolarHBondContact O-CB 3.37Å; R34-T37 PolarHBondContact O-N 3.34Å; R34-T37 PolarHBondContact O-OG1 2.61Å; R34-T83 PolarHBondContact O-OG1 3.16Å
35	A	84.3	Confident	84.6	Confident	66 Å²	66	56.6 Å²	56.6	55%	0.545	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58	133.8	171.2	0	0	0	0	0	110.8	K84	A35-K84 WeakPolarHBondContact CB-O 3.31Å
36	G	82.1	Confident	84.2	Confident	49 Å²	49	55.7 Å²	55.7	51%	0.505	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	91.5	-0.9	-176.3	0	0	0	0	0	115.4	R34 V38 T83	R34-G36 PolarHBondContact O-N 2.84Å; G36-V38 PolarHBondContact O-N 3.24Å; G36-T83 PolarHBondContact N-O 3.4Å; G36-T83 PolarHBondContact N-OG1 3.02Å
37	T	87.3	Confident	83.5	Confident	44 Å²	44	53.9 Å²	53.9	27%	0.27	28%	0.28	S	S	.	.			trans	-61.3	125.7	171	-70.8	0	0	0	0	109.8	Q33 R34 I39 V82 T83	Q33-T37 HydrophobicContact CB-CG2 4.31Å; Q33-T37 HydrophobicContact CG-CG2 4.42Å; R34-T37 WeakPolarHBondContact O-CB 3.37Å; R34-T37 PolarHBondContact O-N 3.34Å; R34-T37 PolarHBondContact O-OG1 2.61Å; T37-I39 PolarHBondContact O-N 2.84Å; T37-V82 CarbonylContact O-C 3.59Å; T37-V82 VanDerWaalsContact O-CA 3.25Å; T37-V82 WeakPolarHBondContact O-CA 3.42Å; T37-T83 PolarHBondContact N-OG1 3.2Å; T37-T83 PolarHBondContact O-N 3.42Å; T37-T83 PolarHBondContact O-OG1 3.41Å
38	V	87	Confident	82.6	Confident	81 Å²	81	58.8 Å²	58.8	49%	0.491	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	120.1	179	-180	0	0	0	0	109.7	G36 L80 V82	G36-V38 PolarHBondContact O-N 3.24Å; V38-L80 HydrophobicContact CG1-CB 4.38Å; V38-L80 HydrophobicContact CG1-CD2 4.13Å; V38-L80 HydrophobicContact CG2-CD1 4.4Å; V38-V82 HydrophobicContact CG2-CG1 4.04Å
39	I	86.4	Confident	81.5	Confident	28 Å²	28	58.9 Å²	58.9	14%	0.144	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	-46.3	179.3	-54.1	-178.5	0	0	0	110.4	V29 T37 V72 L81 T83 V117	V29-I39 HydrophobicContact CB-CD1 3.96Å; V29-I39 HydrophobicContact CB-CG1 4.06Å; V29-I39 HydrophobicContact CB-CG2 4.08Å; V29-I39 HydrophobicContact CG1-CD1 4.15Å; V29-I39 HydrophobicContact CG2-CD1 4.01Å; V29-I39 HydrophobicContact CG2-CG1 3.77Å; T37-I39 PolarHBondContact O-N 2.84Å; I39-V72 HydrophobicContact CD1-CG1 3.63Å; I39-L81 HydrophobicContact CB-CB 4.4Å; I39-L81 HydrophobicContact CB-CD2 4.07Å; I39-L81 HydrophobicContact CB-CG 4.2Å; I39-L81 HydrophobicContact CD1-CD2 4.34Å; I39-L81 HydrophobicContact CD1-CG 4.27Å; I39-L81 HydrophobicContact CG2-CD2 4.05Å; I39-L81 PolarHBondContact N-O 2.95Å; I39-T83 HydrophobicContact CD1-CG2 4.08Å; I39-T83 HydrophobicContact CG1-CG2 4.31Å; I39-V117 HydrophobicContact CD1-CG1 4.41Å; I39-V117 HydrophobicContact CG2-CG1 4.37Å
40	A	84.9	Confident	80.2	Confident	13 Å²	13	61.5 Å²	61.5	11%	0.107	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.7	165.4	-175.1	0	0	0	0	0	113.3	Y27 L80 L81	Y27-A40 HydrophobicContact CD1-CB 3.38Å; Y27-A40 HydrophobicContact CD2-CB 3.84Å; Y27-A40 HydrophobicContact CE1-CB 3.27Å; Y27-A40 HydrophobicContact CE2-CB 3.75Å; Y27-A40 HydrophobicContact CG-CB 3.65Å; Y27-A40 VanDerWaalsContact CZ-CB 3.44Å; A40-L80 WeakPolarHBondContact O-CA 3.43Å; A40-L81 PolarHBondContact O-N 3.16Å
41	N	85.3	Confident	79.1	Confident	61 Å²	61	57.5 Å²	57.5	33%	0.326	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	80.4	171	-171	-22.2	0	0	0	110.6	A43 K44 D45 L80	N41-A43 PolarHBondContact O-N 2.84Å; N41-A43 PolarHBondContact OD1-N 2.89Å; N41-K44 HydrophobicContact CB-CB 4.22Å; N41-K44 WeakPolarHBondContact O-CB 3.48Å; N41-K44 PolarHBondContact O-N 2.91Å; N41-K44 PolarHBondContact OD1-N 2.85Å; N41-K44 VanDerWaalsContact OD1-N 3.08Å; N41-D45 VanDerWaalsContact O-CG 3.27Å; N41-D45 PolarHBondContact O-N 2.83Å; N41-L80 HydrophobicContact CB-CD2 3.78Å
42	V	80.9	Confident	77.7	Confident	0 Å²	0	60.2 Å²	60.2	0%	0	34%	0.341	C	S	.	.	H	α-helix	trans	-57	-33.6	-179.6	-161.4	0	0	0	0	111.5	L25 Y27 K44 A46 F61 I74 G79 L81 I115	L25-V42 HydrophobicContact CD1-CG1 3.65Å; Y27-V42 HydrophobicContact CE2-CG2 4Å; V42-K44 VanDerWaalsContact C-N 3.28Å; V42-K44 PolarHBondContact O-N 3.35Å; V42-A46 WeakPolarHBondContact O-CB 3.12Å; V42-A46 PolarHBondContact O-N 3.45Å; V42-F61 HydrophobicContact CB-CE2 4.05Å; V42-F61 HydrophobicContact CB-CZ 4.08Å; V42-F61 HydrophobicContact CG1-CE1 4.08Å; V42-F61 HydrophobicContact CG1-CE2 4.13Å; V42-F61 HydrophobicContact CG1-CZ 3.67Å; V42-I74 HydrophobicContact CB-CD1 3.96Å; V42-I74 HydrophobicContact CG1-CD1 4.27Å; V42-I74 HydrophobicContact CG2-CD1 3.85Å; V42-G79 WeakPolarHBondContact CB-O 3.37Å; V42-G79 PolarHBondContact N-O 3.28Å; V42-L81 HydrophobicContact CG2-CB 3.76Å; V42-I115 HydrophobicContact CG1-CD1 3.93Å; V42-I115 HydrophobicContact CG1-CG1 4.43Å; V42-I115 HydrophobicContact CG2-CD1 4.11Å
43	A	75.6	Confident	76.5	Confident	4 Å²	4	58.3 Å²	58.3	3%	0.033	33%	0.333	C	S	.	.	H	α-helix	trans	-68.7	-21.8	176.1	0	0	0	0	0	114	N41 R47 L53 F61 G79	N41-A43 PolarHBondContact O-N 2.84Å; N41-A43 PolarHBondContact OD1-N 2.89Å; A43-R47 VanDerWaalsContact O-CZ 3.23Å; A43-R47 PolarHBondContact O-NE 2.93Å; A43-R47 PolarHBondContact O-NH2 3.34Å; A43-L53 HydrophobicContact CB-CD1 4.18Å; A43-F61 HydrophobicContact CB-CE2 3.91Å; A43-G79 PolarHBondContact N-O 2.99Å
44	K	77.1	Confident	75.3	Confident	95 Å²	95	58.5 Å²	58.5	41%	0.413	34%	0.336	S	S	.	.	H	α-helix	trans	-83.9	-55.7	170	178.7	-175.8	165.8	-64.2	0	109.7	N41 V42 A46 R47 E48	N41-K44 HydrophobicContact CB-CB 4.22Å; N41-K44 WeakPolarHBondContact O-CB 3.48Å; N41-K44 PolarHBondContact O-N 2.91Å; N41-K44 PolarHBondContact OD1-N 2.85Å; N41-K44 VanDerWaalsContact OD1-N 3.08Å; V42-K44 VanDerWaalsContact C-N 3.28Å; V42-K44 PolarHBondContact O-N 3.35Å; K44-A46 PolarHBondContact O-N 3Å; K44-R47 WeakPolarHBondContact O-CB 3.48Å; K44-R47 PolarHBondContact O-N 2.68Å; K44-E48 WeakPolarHBondContact CE-OE1 3.32Å; K44-E48 IonicContact NZ-OE1 2.72Å; K44-E48 PolarHBondContact NZ-OE1 3.49Å; K44-E48 IonicContact NZ-OE2 2.79Å; K44-E48 PolarHBondContact NZ-OE2 2.96Å; K44-E48 PolarHBondContact O-N 2.67Å
45	D	79.7	Confident	73.9	Confident	42 Å²	42	53.9 Å²	53.9	23%	0.225	33%	0.333	C	S	.	.	H	α-helix	trans	-68.7	-34.8	-167.3	-48.1	-29	0	0	0	112	Y27 N41 R47 E48 A49	Y27-D45 VanDerWaalsContact CE1-OD2 3.3Å; Y27-D45 WeakPolarHBondContact CE1-OD2 3.3Å; Y27-D45 WeakPolarHBondContact OH-CB 3.35Å; Y27-D45 PolarHBondContact OH-OD2 3.32Å; N41-D45 VanDerWaalsContact O-CG 3.27Å; N41-D45 PolarHBondContact O-N 2.83Å; D45-R47 VanDerWaalsContact C-N 3.35Å; D45-R47 PolarHBondContact O-N 2.79Å; D45-E48 PolarHBondContact O-N 3.08Å; D45-A49 WeakPolarHBondContact O-CB 3.47Å; D45-A49 PolarHBondContact O-N 3.34Å
46	A	72.6	Confident	72.5	Confident	0 Å²	0	61.7 Å²	61.7	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-63.2	-40.2	172.8	0	0	0	0	0	111.7	L25 V42 K44 A49 G50 F51 F61	L25-A46 HydrophobicContact CD1-CB 4.04Å; V42-A46 WeakPolarHBondContact O-CB 3.12Å; V42-A46 PolarHBondContact O-N 3.45Å; K44-A46 PolarHBondContact O-N 3Å; A46-A49 CarbonylContact O-C 3.59Å; A46-A49 WeakPolarHBondContact O-CA 3.32Å; A46-A49 PolarHBondContact O-N 3.07Å; A46-G50 PolarHBondContact O-N 2.88Å; A46-G50 VanDerWaalsContact O-N 3.16Å; A46-F51 HydrophobicContact CB-CB 3.77Å; A46-F51 HydrophobicContact CB-CD1 3.76Å; A46-F51 HydrophobicContact CB-CG 4.08Å; A46-F51 WeakPolarHBondContact O-CB 3.48Å; A46-F51 PolarHBondContact O-N 2.92Å; A46-F61 HydrophobicContact CB-CE1 4.49Å; A46-F61 HydrophobicContact CB-CZ 4.07Å
47	R	70.1	Confident	71.4	Confident	131 Å²	131	64.2 Å²	64.2	49%	0.494	35%	0.347	S	S	.	.	H	α-helix	trans	-65.3	-39.6	176.2	-96.2	-179.8	-68.4	-168.6	-2	111.9	A43 K44 D45 A49 G50 L53	A43-R47 VanDerWaalsContact O-CZ 3.23Å; A43-R47 PolarHBondContact O-NE 2.93Å; A43-R47 PolarHBondContact O-NH2 3.34Å; K44-R47 WeakPolarHBondContact O-CB 3.48Å; K44-R47 PolarHBondContact O-N 2.68Å; D45-R47 VanDerWaalsContact C-N 3.35Å; D45-R47 PolarHBondContact O-N 2.79Å; R47-A49 VanDerWaalsContact C-N 3.29Å; R47-G50 PolarHBondContact O-N 2.82Å; R47-G50 VanDerWaalsContact O-N 3.11Å; R47-L53 HydrophobicContact CG-CB 4.03Å; R47-L53 HydrophobicContact CG-CD1 4.1Å; R47-L53 HydrophobicContact CG-CG 4.19Å
48	E	68.8	Low	69.6	Low	138 Å²	138	66.4 Å²	66.4	65%	0.645	37%	0.37	S	S	*	.	H	α-helix	trans	-68.5	-28.8	173.9	-72.8	171.5	-167.2	0	0	112.2	K44 D45 G50	K44-E48 WeakPolarHBondContact CE-OE1 3.32Å; K44-E48 IonicContact NZ-OE1 2.72Å; K44-E48 PolarHBondContact NZ-OE1 3.49Å; K44-E48 IonicContact NZ-OE2 2.79Å; K44-E48 PolarHBondContact NZ-OE2 2.96Å; K44-E48 PolarHBondContact O-N 2.67Å; D45-E48 PolarHBondContact O-N 3.08Å; E48-G50 VanDerWaalsContact C-N 3.26Å; E48-G50 PolarHBondContact O-N 3.16Å
49	A	64.8	Low	68.1	Low	53 Å²	53	65.5 Å²	65.5	44%	0.438	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.5	4.3	169.5	0	0	0	0	0	114.7	I23 L25 D45 A46 R47	I23-A49 HydrophobicContact CG2-CB 4.25Å; L25-A49 HydrophobicContact CD2-CB 4.42Å; D45-A49 WeakPolarHBondContact O-CB 3.47Å; D45-A49 PolarHBondContact O-N 3.34Å; A46-A49 CarbonylContact O-C 3.59Å; A46-A49 WeakPolarHBondContact O-CA 3.32Å; A46-A49 PolarHBondContact O-N 3.07Å; R47-A49 VanDerWaalsContact C-N 3.29Å
50	G	61.9	Low	67	Low	65 Å²	65	65.2 Å²	65.2	67%	0.67	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	91	8.7	175.6	0	0	0	0	0	116.5	A46 R47 E48	A46-G50 PolarHBondContact O-N 2.88Å; A46-G50 VanDerWaalsContact O-N 3.16Å; R47-G50 PolarHBondContact O-N 2.82Å; R47-G50 VanDerWaalsContact O-N 3.11Å; E48-G50 VanDerWaalsContact C-N 3.26Å; E48-G50 PolarHBondContact O-N 3.16Å
51	F	66.2	Low	66.3	Low	9 Å²	9	64.8 Å²	64.8	4%	0.039	36%	0.364	C	S	.	.			trans	-75	133.1	-178.9	-158.8	-123.2	0	0	0	112.4	I23 A46 L53 F61 E111 C113	I23-F51 HydrophobicContact CD1-CB 3.96Å; I23-F51 HydrophobicContact CD1-CD2 3.77Å; I23-F51 HydrophobicContact CD1-CG 4.3Å; I23-F51 HydrophobicContact CG1-CD2 4.48Å; A46-F51 HydrophobicContact CB-CB 3.77Å; A46-F51 HydrophobicContact CB-CD1 3.76Å; A46-F51 HydrophobicContact CB-CG 4.08Å; A46-F51 WeakPolarHBondContact O-CB 3.48Å; A46-F51 PolarHBondContact O-N 2.92Å; F51-L53 HydrophobicContact CD1-CD2 3.69Å; F51-L53 HydrophobicContact CD1-CG 4.05Å; F51-L53 HydrophobicContact CE1-CD2 3.92Å; F51-L53 PolarHBondContact O-N 3.47Å; F51-F61 HydrophobicContact CD1-CE1 4.14Å; F51-F61 HydrophobicContact CE1-CD1 4.27Å; F51-F61 AromaticContact CE1-CE1 3.61Å; F51-F61 HydrophobicContact CE1-CE1 3.61Å; F51-F61 HydrophobicContact CE1-CZ 4.48Å; F51-E111 HydrophobicContact CD2-CB 4.31Å; F51-E111 HydrophobicContact CE2-CB 3.51Å; F51-E111 HydrophobicContact CZ-CB 4.01Å; F51-C113 HydrophobicContact CE1-CB 4.42Å; F51-C113 HydrophobicContact CE2-CB 4.12Å; F51-C113 HydrophobicContact CZ-CB 3.86Å
52	A	59.3	Low	65.7	Low	58 Å²	58	70.7 Å²	70.7	48%	0.479	38%	0.382	S	S	.	.			trans	-84.3	72.5	-168.3	0	0	0	0	0	114	D54	A52-D54 PolarHBondContact O-N 2.56Å
53	L	61.9	Low	65.3	Low	19 Å²	19	73.2 Å²	73.2	10%	0.099	40%	0.397	C	S	.	.			trans	-81.1	112.8	174.8	-60	-177.4	0	0	0	112.3	A43 R47 F51 P55 A60 F61	A43-L53 HydrophobicContact CB-CD1 4.18Å; R47-L53 HydrophobicContact CG-CB 4.03Å; R47-L53 HydrophobicContact CG-CD1 4.1Å; R47-L53 HydrophobicContact CG-CG 4.19Å; F51-L53 HydrophobicContact CD1-CD2 3.69Å; F51-L53 HydrophobicContact CD1-CG 4.05Å; F51-L53 HydrophobicContact CE1-CD2 3.92Å; F51-L53 PolarHBondContact O-N 3.47Å; L53-P55 WeakPolarHBondContact O-CD 3.46Å; L53-A60 HydrophobicContact CD1-CB 4.32Å; L53-A60 HydrophobicContact CD2-CB 4.3Å; L53-F61 HydrophobicContact CD1-CE2 4.18Å; L53-F61 HydrophobicContact CD1-CZ 3.93Å; L53-F61 HydrophobicContact CD2-CE1 4.32Å; L53-F61 HydrophobicContact CD2-CZ 4.24Å
54	D	60.4	Low	64.9	Low	63 Å²	63	76.3 Å²	76.3	34%	0.337	42%	0.415	S	S	.	.			trans	-65	115.4	173.7	177.2	6.7	0	0	0	111.4	A52 R56 Q57	A52-D54 PolarHBondContact O-N 2.56Å; D54-R56 PolarHBondContact O-N 2.69Å; D54-R56 VanDerWaalsContact O-N 3.08Å; D54-R56 WeakPolarHBondContact OD1-CB 3.42Å; D54-R56 PolarHBondContact OD1-N 3.03Å; D54-Q57 PolarHBondContact O-N 2.91Å; D54-Q57 PolarHBondContact OD2-NE2 2.81Å
55	P	55	Low	64.1	Low	112 Å²	112	74.3 Å²	74.3	73%	0.727	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.1	-0.1	-179.2	31.7	-37.1	0	0	0	114.3	L53	L53-P55 WeakPolarHBondContact O-CD 3.46Å
56	R	55.3	Low	62.9	Low	231 Å²	231	78.3 Å²	78.3	87%	0.872	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.6	-6.3	179.6	-57.2	-176.6	-178	-174.4	2.2	114.1	D54	D54-R56 PolarHBondContact O-N 2.69Å; D54-R56 VanDerWaalsContact O-N 3.08Å; D54-R56 WeakPolarHBondContact OD1-CB 3.42Å; D54-R56 PolarHBondContact OD1-N 3.03Å
57	Q	58.9	Low	62.1	Low	102 Å²	102	81.3 Å²	81.3	48%	0.477	46%	0.456	S	S	.	.	S	Bend	trans	-103.9	138.4	178.9	-68.5	-176.5	33.6	0	0	112.1	D54 S59 S108	D54-Q57 PolarHBondContact O-N 2.91Å; D54-Q57 PolarHBondContact OD2-NE2 2.81Å; Q57-S59 PolarHBondContact O-N 3.37Å; Q57-S108 VanDerWaalsContact OE1-CB 3.22Å
58	A	50.5	Low	61.4	Low	90 Å²	90	75.7 Å²	75.7	74%	0.744	44%	0.437	S	S	*	.	S	Bend	trans	-79.7	4.8	-176.4	0	0	0	0	0	114.6	S77	A58-S77 VanDerWaalsContact O-CA 3.3Å; A58-S77 WeakPolarHBondContact O-CA 3.42Å; A58-S77 VanDerWaalsContact O-CB 3.3Å; A58-S77 WeakPolarHBondContact O-CB 3.08Å
59	S	55.5	Low	60.9	Low	62 Å²	62	70.2 Å²	70.2	43%	0.434	41%	0.414	S	S	.	.			trans	-138	107.7	175.8	58.3	0	0	0	0	110.1	Q57 P76	Q57-S59 PolarHBondContact O-N 3.37Å; S59-P76 CarbonylContact C-O 3.52Å; S59-P76 WeakPolarHBondContact CA-O 3.36Å
60	A	61.6	Low	61	Low	21 Å²	21	73.7 Å²	73.7	17%	0.174	42%	0.421	C	S	.	.			trans	-79.9	-29.2	-179.2	0	0	0	0	0	113	L53 P76	L53-A60 HydrophobicContact CD1-CB 4.32Å; L53-A60 HydrophobicContact CD2-CB 4.3Å; A60-P76 PolarHBondContact N-O 3.06Å
61	F	70.8	Confident	61.6	Low	5 Å²	5	72 Å²	72	2%	0.022	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	152	-176.1	-59.7	-82.2	0	0	0	113.2	V42 A43 A46 F51 L53 I74 P76 V105 M106	V42-F61 HydrophobicContact CB-CE2 4.05Å; V42-F61 HydrophobicContact CB-CZ 4.08Å; V42-F61 HydrophobicContact CG1-CE1 4.08Å; V42-F61 HydrophobicContact CG1-CE2 4.13Å; V42-F61 HydrophobicContact CG1-CZ 3.67Å; A43-F61 HydrophobicContact CB-CE2 3.91Å; A46-F61 HydrophobicContact CB-CE1 4.49Å; A46-F61 HydrophobicContact CB-CZ 4.07Å; F51-F61 HydrophobicContact CD1-CE1 4.14Å; F51-F61 HydrophobicContact CE1-CD1 4.27Å; F51-F61 AromaticContact CE1-CE1 3.61Å; F51-F61 HydrophobicContact CE1-CE1 3.61Å; F51-F61 HydrophobicContact CE1-CZ 4.48Å; L53-F61 HydrophobicContact CD1-CE2 4.18Å; L53-F61 HydrophobicContact CD1-CZ 3.93Å; L53-F61 HydrophobicContact CD2-CE1 4.32Å; L53-F61 HydrophobicContact CD2-CZ 4.24Å; F61-I74 HydrophobicContact CB-CD1 4.01Å; F61-I74 HydrophobicContact CD2-CD1 3.73Å; F61-I74 HydrophobicContact CE2-CD1 4.3Å; F61-I74 HydrophobicContact CG-CD1 3.85Å; F61-P76 WeakPolarHBondContact O-CB 3.46Å; F61-V105 HydrophobicContact CB-CB 4.39Å; F61-V105 HydrophobicContact CD1-CB 4.16Å; F61-V105 HydrophobicContact CD1-CG2 3.61Å; F61-V105 HydrophobicContact CE1-CG2 4.07Å; F61-V105 HydrophobicContact CG-CG2 4.4Å; F61-M106 CarbonylContact C-O 3.5Å; F61-M106 VanDerWaalsContact CA-O 3.27Å; F61-M106 WeakPolarHBondContact CA-O 3.4Å
62	R	72.3	Confident	62.3	Low	185 Å²	185	71.6 Å²	71.6	70%	0.698	39%	0.394	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-138.7	127.2	170.5	176.1	-179.8	176.9	175.4	0.6	109.6	V64 M106	R62-V64 PolarHBondContact O-N 3.18Å; R62-M106 PolarHBondContact N-O 2.88Å; R62-M106 PolarHBondContact O-N 2.95Å
63	V	72.3	Confident	63.4	Low	52 Å²	52	71.6 Å²	71.6	32%	0.315	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.9	133	177.2	-177.6	0	0	0	0	110.7	I74 L103 E104 V105	V63-I74 HydrophobicContact CG2-CG2 3.95Å; V63-L103 HydrophobicContact CG1-CD1 3.77Å; V63-L103 HydrophobicContact CG2-CD1 4.14Å; V63-E104 WeakPolarHBondContact CA-O 3.42Å; V63-V105 HydrophobicContact CG2-CG1 4.44Å
64	V	68.5	Low	64.3	Low	69 Å²	69	71 Å²	71	42%	0.418	38%	0.383	S	S	.	.			trans	-88.1	-52.1	-177.5	177.8	0	0	0	0	111.6	R62 E104 M106 I112	R62-V64 PolarHBondContact O-N 3.18Å; V64-E104 HydrophobicContact CB-CB 4.13Å; V64-E104 PolarHBondContact N-O 2.95Å; V64-M106 HydrophobicContact CG2-CB 3.62Å; V64-M106 HydrophobicContact CG2-CG 4.32Å; V64-I112 HydrophobicContact CG2-CG1 4.34Å
65	S	59.2	Low	65.2	Low	53 Å²	53	71.2 Å²	71.2	37%	0.371	38%	0.384	S	S	.	.	S	Bend	trans	-133.7	147.9	-163.1	-169.4	0	0	0	0	110.8	S67 E104	S65-S67 VanDerWaalsContact C-N 3.3Å; S65-S67 PolarHBondContact O-N 3.37Å; S65-S67 VanDerWaalsContact O-N 3.16Å; S65-E104 WeakPolarHBondContact CB-OE2 2.98Å
66	N	54.5	Low	66	Low	126 Å²	126	69 Å²	69	67%	0.674	37%	0.37	S	S	*	.			trans	-94.2	39.8	-160.3	-153.9	80.1	0	0	0	113.1	P69	N66-P69 HydrophobicContact CB-CG 4.34Å; N66-P69 VanDerWaalsContact CG-CG 3.43Å; N66-P69 WeakPolarHBondContact ND2-CG 3.15Å; N66-P69 VanDerWaalsContact OD1-CG 3.31Å; N66-P69 WeakPolarHBondContact OD1-CG 3.49Å
67	S	55.6	Low	66.7	Low	63 Å²	63	62.2 Å²	62.2	44%	0.441	36%	0.358	S	S	.	.	S	Bend	trans	-79.7	-30	-168.9	48	0	0	0	0	115.6	S65 S102	S65-S67 VanDerWaalsContact C-N 3.3Å; S65-S67 PolarHBondContact O-N 3.37Å; S65-S67 VanDerWaalsContact O-N 3.16Å; S67-S102 PolarHBondContact OG-O 2.89Å
68	A	56.5	Low	67.4	Low	13 Å²	13	59.6 Å²	59.6	11%	0.107	35%	0.351	C	S	.	.	S	Bend	trans	-149	39.2	176.6	0	0	0	0	0	115.7	H70 L71 I101	A68-H70 PolarHBondContact O-N 3.49Å; A68-H70 VanDerWaalsContact O-N 3.07Å; A68-L71 PolarHBondContact O-N 3.07Å; A68-I101 HydrophobicContact CB-CB 4.18Å
69	P	57.4	Low	68.6	Low	24 Å²	24	55.3 Å²	55.3	16%	0.156	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.4	8.5	-165.2	23.4	-9.5	0	0	0	114.7	N66 K84	N66-P69 HydrophobicContact CB-CG 4.34Å; N66-P69 VanDerWaalsContact CG-CG 3.43Å; N66-P69 WeakPolarHBondContact ND2-CG 3.15Å; N66-P69 VanDerWaalsContact OD1-CG 3.31Å; N66-P69 WeakPolarHBondContact OD1-CG 3.49Å; P69-K84 WeakPolarHBondContact O-CD 3.36Å; P69-K84 WeakPolarHBondContact O-CE 3.48Å; P69-K84 PolarHBondContact O-NZ 3.34Å
70	H	66.6	Low	70	Confident	126 Å²	126	54.8 Å²	54.8	58%	0.583	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101	-29.1	176.9	-65.8	-76.4	0	0	0	112.9	A68 K84 Q85	A68-H70 PolarHBondContact O-N 3.49Å; A68-H70 VanDerWaalsContact O-N 3.07Å; H70-K84 WeakPolarHBondContact O-CB 3.32Å; H70-Q85 WeakPolarHBondContact O-CG 3.48Å; H70-Q85 PolarHBondContact O-OE1 3.38Å
71	L	75.4	Confident	71.2	Confident	28 Å²	28	53.8 Å²	53.8	15%	0.147	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92	-40.7	-174.3	-61.9	175.2	0	0	0	112.7	A68 K84 Q85 I87 L92 I101	A68-L71 PolarHBondContact O-N 3.07Å; L71-K84 PolarHBondContact O-N 3.32Å; L71-Q85 HydrophobicContact CD2-CG 4.16Å; L71-I87 HydrophobicContact CB-CD1 4.1Å; L71-I87 HydrophobicContact CB-CG1 4.25Å; L71-I87 HydrophobicContact CD2-CG1 4.32Å; L71-L92 HydrophobicContact CD1-CD1 4.19Å; L71-L92 HydrophobicContact CD1-CD2 3.58Å; L71-I101 HydrophobicContact CB-CD1 4.15Å; L71-I101 HydrophobicContact CD1-CD1 4.38Å; L71-I101 HydrophobicContact CD1-CG2 4.13Å
72	V	81.9	Confident	71.9	Confident	1 Å²	1	55.1 Å²	55.1	1%	0.006	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	154.6	179	-65.7	0	0	0	0	110.9	I39 L81 V82 I87 I101 L103	I39-V72 HydrophobicContact CD1-CG1 3.63Å; V72-L81 HydrophobicContact CB-CD1 4.45Å; V72-V82 CarbonylContact C-O 3.5Å; V72-V82 VanDerWaalsContact CA-O 3.32Å; V72-V82 WeakPolarHBondContact CA-O 3.49Å; V72-I87 HydrophobicContact CG1-CD1 4.1Å; V72-I101 HydrophobicContact CG1-CD1 3.87Å; V72-I101 HydrophobicContact CG2-CD1 3.91Å; V72-L103 HydrophobicContact CG2-CD2 4.32Å
73	D	81.6	Confident	72.6	Confident	58 Å²	58	46.4 Å²	46.4	31%	0.31	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	157.6	175.3	-142.8	-41.2	0	0	0	110.2	V82 K84	D73-V82 HydrophobicContact CB-CG2 4.28Å; D73-V82 PolarHBondContact N-O 3.34Å; D73-V82 WeakPolarHBondContact O-CG2 3.05Å; D73-V82 PolarHBondContact O-N 3.19Å; D73-K84 HydrophobicContact CB-CB 4.37Å; D73-K84 HydrophobicContact CB-CD 4.16Å; D73-K84 HydrophobicContact CB-CG 4.47Å; D73-K84 VanDerWaalsContact OD2-CE 3.31Å; D73-K84 WeakPolarHBondContact OD2-CE 3.17Å; D73-K84 IonicContact OD2-NZ 2.7Å; D73-K84 PolarHBondContact OD2-NZ 2.61Å
74	I	81.2	Confident	73.2	Confident	7 Å²	7	48.4 Å²	48.4	4%	0.036	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	119.2	176.8	-170.4	172.5	0	0	0	109.6	V42 F61 V63 P76 L81 L103 V105 I115	V42-I74 HydrophobicContact CB-CD1 3.96Å; V42-I74 HydrophobicContact CG1-CD1 4.27Å; V42-I74 HydrophobicContact CG2-CD1 3.85Å; F61-I74 HydrophobicContact CB-CD1 4.01Å; F61-I74 HydrophobicContact CD2-CD1 3.73Å; F61-I74 HydrophobicContact CE2-CD1 4.3Å; F61-I74 HydrophobicContact CG-CD1 3.85Å; V63-I74 HydrophobicContact CG2-CG2 3.95Å; I74-P76 VanDerWaalsContact O-CD 3.28Å; I74-P76 WeakPolarHBondContact O-CD 3.39Å; I74-P76 VanDerWaalsContact O-N 3.16Å; I74-L81 HydrophobicContact CB-CD1 4.26Å; I74-L103 HydrophobicContact CG2-CD2 4.44Å; I74-V105 HydrophobicContact CD1-CG1 4.36Å; I74-V105 HydrophobicContact CG2-CG1 4.04Å; I74-I115 HydrophobicContact CD1-CD1 4.18Å
75	N	79.1	Confident	73.9	Confident	68 Å²	68	49.7 Å²	49.7	36%	0.364	28%	0.281	S	S	.	.			trans	-67.5	114.3	177.9	178.8	-62.2	0	0	0	108.9	S77 S78 G79 L80	N75-S77 VanDerWaalsContact C-N 3.28Å; N75-S77 PolarHBondContact O-N 3.19Å; N75-S77 PolarHBondContact OD1-N 2.86Å; N75-S77 PolarHBondContact OD1-OG 3.16Å; N75-S78 WeakPolarHBondContact CB-OG 3.25Å; N75-S78 PolarHBondContact O-N 2.87Å; N75-S78 PolarHBondContact OD1-N 2.86Å; N75-S78 PolarHBondContact OD1-OG 2.86Å; N75-G79 WeakPolarHBondContact O-CA 3.3Å; N75-G79 PolarHBondContact O-N 2.98Å; N75-L80 PolarHBondContact N-O 3.11Å
76	P	70.9	Confident	75.2	Confident	65 Å²	65	52.5 Å²	52.5	42%	0.422	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-28.6	-167.6	26	-35	0	0	0	112.9	S59 A60 F61 I74	S59-P76 CarbonylContact C-O 3.52Å; S59-P76 WeakPolarHBondContact CA-O 3.36Å; A60-P76 PolarHBondContact N-O 3.06Å; F61-P76 WeakPolarHBondContact O-CB 3.46Å; I74-P76 VanDerWaalsContact O-CD 3.28Å; I74-P76 WeakPolarHBondContact O-CD 3.39Å; I74-P76 VanDerWaalsContact O-N 3.16Å
77	S	70.6	Confident	76.8	Confident	88 Å²	88	46.7 Å²	46.7	62%	0.615	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.3	-27.1	-176.8	50.3	0	0	0	0	114.9	A58 N75	A58-S77 VanDerWaalsContact O-CA 3.3Å; A58-S77 WeakPolarHBondContact O-CA 3.42Å; A58-S77 VanDerWaalsContact O-CB 3.3Å; A58-S77 WeakPolarHBondContact O-CB 3.08Å; N75-S77 VanDerWaalsContact C-N 3.28Å; N75-S77 PolarHBondContact O-N 3.19Å; N75-S77 PolarHBondContact OD1-N 2.86Å; N75-S77 PolarHBondContact OD1-OG 3.16Å
78	S	73.2	Confident	78.3	Confident	47 Å²	47	46.9 Å²	46.9	33%	0.329	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.4	-18.9	178.1	59.2	0	0	0	0	113.5	N75 L80	N75-S78 WeakPolarHBondContact CB-OG 3.25Å; N75-S78 PolarHBondContact O-N 2.87Å; N75-S78 PolarHBondContact OD1-N 2.86Å; N75-S78 PolarHBondContact OD1-OG 2.86Å; S78-L80 PolarHBondContact O-N 3.01Å
79	G	76.6	Confident	79.8	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	25%	0.247	C	C	.	.			trans	66	17.7	-173.8	0	0	0	0	0	114.4	V42 A43 N75	V42-G79 WeakPolarHBondContact CB-O 3.37Å; V42-G79 PolarHBondContact N-O 3.28Å; A43-G79 PolarHBondContact N-O 2.99Å; N75-G79 WeakPolarHBondContact O-CA 3.3Å; N75-G79 PolarHBondContact O-N 2.98Å
80	L	83.8	Confident	81.2	Confident	51 Å²	51	46.2 Å²	46.2	27%	0.267	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	125.5	170.8	-61.8	-179.5	0	0	0	109.6	V38 A40 N41 N75 S78	V38-L80 HydrophobicContact CG1-CB 4.38Å; V38-L80 HydrophobicContact CG1-CD2 4.13Å; V38-L80 HydrophobicContact CG2-CD1 4.4Å; A40-L80 WeakPolarHBondContact O-CA 3.43Å; N41-L80 HydrophobicContact CB-CD2 3.78Å; N75-L80 PolarHBondContact N-O 3.11Å; S78-L80 PolarHBondContact O-N 3.01Å
81	L	86.5	Confident	82.1	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	129.7	167.9	-175.6	71.7	0	0	0	108.2	Y27 I39 A40 V42 V72 I74 L103 I115 V117	Y27-L81 HydrophobicContact CD2-CD2 3.94Å; I39-L81 HydrophobicContact CB-CB 4.4Å; I39-L81 HydrophobicContact CB-CD2 4.07Å; I39-L81 HydrophobicContact CB-CG 4.2Å; I39-L81 HydrophobicContact CD1-CD2 4.34Å; I39-L81 HydrophobicContact CD1-CG 4.27Å; I39-L81 HydrophobicContact CG2-CD2 4.05Å; I39-L81 PolarHBondContact N-O 2.95Å; A40-L81 PolarHBondContact O-N 3.16Å; V42-L81 HydrophobicContact CG2-CB 3.76Å; V72-L81 HydrophobicContact CB-CD1 4.45Å; I74-L81 HydrophobicContact CB-CD1 4.26Å; L81-L103 HydrophobicContact CD1-CD2 3.84Å; L81-I115 HydrophobicContact CD2-CG2 3.96Å; L81-V117 HydrophobicContact CD2-CG2 3.79Å
82	V	86.3	Confident	82.5	Confident	33 Å²	33	49.7 Å²	49.7	20%	0.2	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	153	-177.1	-66.1	0	0	0	0	111.7	T37 V38 V72 D73	T37-V82 CarbonylContact O-C 3.59Å; T37-V82 VanDerWaalsContact O-CA 3.25Å; T37-V82 WeakPolarHBondContact O-CA 3.42Å; V38-V82 HydrophobicContact CG2-CG1 4.04Å; V72-V82 CarbonylContact C-O 3.5Å; V72-V82 VanDerWaalsContact CA-O 3.32Å; V72-V82 WeakPolarHBondContact CA-O 3.49Å; D73-V82 HydrophobicContact CB-CG2 4.28Å; D73-V82 PolarHBondContact N-O 3.34Å; D73-V82 WeakPolarHBondContact O-CG2 3.05Å; D73-V82 PolarHBondContact O-N 3.19Å
83	T	87.4	Confident	82.6	Confident	3 Å²	3	51.2 Å²	51.2	2%	0.018	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.4	141.4	162.4	54.6	0	0	0	0	109.9	V29 Q33 R34 G36 T37 I39 I87	V29-T83 HydrophobicContact CG2-CG2 4.15Å; Q33-T83 HydrophobicContact CB-CG2 4.38Å; R34-T83 PolarHBondContact O-OG1 3.16Å; G36-T83 PolarHBondContact N-O 3.4Å; G36-T83 PolarHBondContact N-OG1 3.02Å; T37-T83 PolarHBondContact N-OG1 3.2Å; T37-T83 PolarHBondContact O-N 3.42Å; T37-T83 PolarHBondContact O-OG1 3.41Å; I39-T83 HydrophobicContact CD1-CG2 4.08Å; I39-T83 HydrophobicContact CG1-CG2 4.31Å; T83-I87 HydrophobicContact CG2-CD1 4.23Å
84	K	83.8	Confident	82.6	Confident	94 Å²	94	57 Å²	57	41%	0.409	29%	0.294	S	S	.	.	S	Bend	trans	-103.3	-31.1	-178.3	-171.8	173.8	-168.9	153.7	0	112.7	A35 P69 H70 L71 D73	A35-K84 WeakPolarHBondContact CB-O 3.31Å; P69-K84 WeakPolarHBondContact O-CD 3.36Å; P69-K84 WeakPolarHBondContact O-CE 3.48Å; P69-K84 PolarHBondContact O-NZ 3.34Å; H70-K84 WeakPolarHBondContact O-CB 3.32Å; L71-K84 PolarHBondContact O-N 3.32Å; D73-K84 HydrophobicContact CB-CB 4.37Å; D73-K84 HydrophobicContact CB-CD 4.16Å; D73-K84 HydrophobicContact CB-CG 4.47Å; D73-K84 VanDerWaalsContact OD2-CE 3.31Å; D73-K84 WeakPolarHBondContact OD2-CE 3.17Å; D73-K84 IonicContact OD2-NZ 2.7Å; D73-K84 PolarHBondContact OD2-NZ 2.61Å
85	Q	84.8	Confident	82.3	Confident	95 Å²	95	61 Å²	61	44%	0.444	31%	0.313	S	S	.	.	S	Bend	trans	-139.5	175	169.9	61.2	-178.9	58.9	0	0	108.7	H70 L71 I87	H70-Q85 WeakPolarHBondContact O-CG 3.48Å; H70-Q85 PolarHBondContact O-OE1 3.38Å; L71-Q85 HydrophobicContact CD2-CG 4.16Å; Q85-I87 PolarHBondContact O-N 2.75Å
86	K	86.3	Confident	82.4	Confident	113 Å²	113	60.3 Å²	60.3	49%	0.491	31%	0.313	S	S	.	.			trans	-60.5	127.7	165	-171.5	172.8	-177.2	-87.9	0	108.3	E32	E32-K86 VanDerWaalsContact CD-CE 3.44Å; E32-K86 WeakPolarHBondContact OE1-CE 3.46Å; E32-K86 IonicContact OE1-NZ 2.56Å; E32-K86 PolarHBondContact OE1-NZ 2.87Å; E32-K86 WeakPolarHBondContact OE2-CE 2.94Å; E32-K86 IonicContact OE2-NZ 2.72Å; E32-K86 PolarHBondContact OE2-NZ 3.31Å
87	I	87.1	Confident	82.7	Confident	3 Å²	3	62.3 Å²	62.3	2%	0.015	33%	0.326	C	S	.	.			trans	-99.2	122.6	177.7	-55.6	-178.8	0	0	0	106.9	V29 E31 E32 L71 V72 T83 Q85 I119	V29-I87 HydrophobicContact CG1-CD1 4.42Å; E31-I87 WeakPolarHBondContact CB-O 3.44Å; E32-I87 PolarHBondContact N-O 2.78Å; L71-I87 HydrophobicContact CB-CD1 4.1Å; L71-I87 HydrophobicContact CB-CG1 4.25Å; L71-I87 HydrophobicContact CD2-CG1 4.32Å; V72-I87 HydrophobicContact CG1-CD1 4.1Å; T83-I87 HydrophobicContact CG2-CD1 4.23Å; Q85-I87 PolarHBondContact O-N 2.75Å; I87-I119 HydrophobicContact CG2-CD1 3.69Å; I87-I119 HydrophobicContact CG2-CG1 4.23Å; I87-I119 HydrophobicContact CG2-CG2 4.2Å
88	D	87.6	Confident	83.3	Confident	68 Å²	68	64.7 Å²	64.7	36%	0.364	33%	0.325	S	S	.	.			trans	-107.6	117.6	173	162.3	-19.9	0	0	0	105	D90 L91 L92	D88-D90 PolarHBondContact OD1-N 3.08Å; D88-L91 WeakPolarHBondContact OD1-CB 3.06Å; D88-L91 PolarHBondContact OD1-N 2.83Å; D88-L91 WeakPolarHBondContact OD2-CB 3.33Å; D88-L92 WeakPolarHBondContact O-CB 3.43Å
89	R	88.1	Confident	83.9	Confident	3 Å²	3	62.7 Å²	62.7	1%	0.011	31%	0.311	C	S	.	.	H	α-helix	trans	-83.6	-32.6	-174.7	-170.2	-164.1	56	62.1	5	111.1	E31 L92 C93 R94 C99 I119 D121	E31-R89 HydrophobicContact CB-CB 4.27Å; E31-R89 HydrophobicContact CG-CB 4.43Å; E31-R89 WeakPolarHBondContact OE1-CB 3.06Å; E31-R89 VanDerWaalsContact OE1-CD 3.24Å; E31-R89 WeakPolarHBondContact OE1-CD 3.28Å; E31-R89 IonicContact OE1-CZ 2.61Å; E31-R89 IonicContact OE1-NE 3.19Å; E31-R89 PolarHBondContact OE1-NE 3.09Å; E31-R89 WeakPolarHBondContact OE2-CA 3.36Å; E31-R89 WeakPolarHBondContact OE2-CB 3.31Å; E31-R89 PolarHBondContact OE2-N 3.08Å; R89-L92 PolarHBondContact O-N 3.35Å; R89-C93 HydrophobicContact CG-CB 4.38Å; R89-C93 WeakPolarHBondContact O-CA 3.2Å; R89-C93 WeakPolarHBondContact O-CB 3.47Å; R89-C93 PolarHBondContact O-N 2.88Å; R89-R94 PolarHBondContact NH1-O 2.7Å; R89-R94 PolarHBondContact O-N 2.78Å; R89-C99 HydrophobicContact CG-CB 3.63Å; R89-I119 HydrophobicContact CB-CG2 3.94Å; R89-I119 HydrophobicContact CG-CB 4.44Å; R89-I119 HydrophobicContact CG-CG2 3.87Å; R89-D121 IonicContact CZ-OD1 3.38Å; R89-D121 IonicContact CZ-OD2 2.7Å; R89-D121 IonicContact NE-OD1 3.42Å; R89-D121 PolarHBondContact NE-OD1 3.04Å; R89-D121 IonicContact NE-OD2 2.69Å; R89-D121 IonicContact NH2-OD1 2.93Å; R89-D121 PolarHBondContact NH2-OD1 3.24Å; R89-D121 IonicContact NH2-OD2 2.8Å; R89-D121 PolarHBondContact NH2-OD2 2.8Å
90	D	86.8	Confident	84.4	Confident	20 Å²	20	66.8 Å²	66.8	11%	0.107	33%	0.332	C	S	.	.	H	α-helix	trans	-68.6	-42.9	-177	-59.7	-54.1	0	0	0	112.3	D88 L92 R94 N125 P156	D88-D90 PolarHBondContact OD1-N 3.08Å; D90-L92 VanDerWaalsContact C-N 3.27Å; D90-L92 PolarHBondContact O-N 2.81Å; D90-R94 WeakPolarHBondContact O-CA 3.49Å; D90-R94 WeakPolarHBondContact O-CG 3.13Å; D90-R94 PolarHBondContact O-N 3.25Å; D90-N125 PolarHBondContact OD2-ND2 3.26Å; D90-P156 HydrophobicContact CB-CB 3.85Å; D90-P156 VanDerWaalsContact OD1-O 3.11Å
91	L	85.7	Confident	84.5	Confident	145 Å²	145	65.2 Å²	65.2	76%	0.759	32%	0.324	S	S	*	.	H	α-helix	trans	-66.7	-32.9	174.4	-172.9	61.7	0	0	0	111.7	D88	D88-L91 WeakPolarHBondContact OD1-CB 3.06Å; D88-L91 PolarHBondContact OD1-N 2.83Å; D88-L91 WeakPolarHBondContact OD2-CB 3.33Å
92	L	83.9	Confident	84.3	Confident	81 Å²	81	67.4 Å²	67.4	42%	0.424	34%	0.339	S	S	.	.	H	α-helix	trans	-82.9	-42.8	-176	-177.7	65.5	0	0	0	113.7	L71 D88 R89 D90 I101 I119	L71-L92 HydrophobicContact CD1-CD1 4.19Å; L71-L92 HydrophobicContact CD1-CD2 3.58Å; D88-L92 WeakPolarHBondContact O-CB 3.43Å; R89-L92 PolarHBondContact O-N 3.35Å; D90-L92 VanDerWaalsContact C-N 3.27Å; D90-L92 PolarHBondContact O-N 2.81Å; L92-I101 HydrophobicContact CD2-CG2 4.09Å; L92-I119 HydrophobicContact CD2-CD1 3.63Å
93	C	83	Confident	84.1	Confident	33 Å²	33	66 Å²	66	22%	0.223	33%	0.331	C	S	.	.	H	α-helix	trans	-127.6	-16.4	-167.4	-74.4	0	0	0	0	113.5	R89 S96 C99	R89-C93 HydrophobicContact CG-CB 4.38Å; R89-C93 WeakPolarHBondContact O-CA 3.2Å; R89-C93 WeakPolarHBondContact O-CB 3.47Å; R89-C93 PolarHBondContact O-N 2.88Å; C93-S96 WeakPolarHBondContact O-CB 3.38Å; C93-S96 PolarHBondContact O-N 2.94Å; C93-C99 HydrophobicContact CB-CB 3.58Å; C93-C99 WeakPolarHBondContact CB-SG 3.38Å; C93-C99 WeakPolarHBondContact SG-CA 3.11Å; C93-C99 WeakPolarHBondContact SG-CB 3.35Å; C93-C99 CovalentContact SG-SG 2.04Å; C93-C99 PolarHBondContact SG-SG 2.74Å
94	R	81.6	Confident	83.8	Confident	181 Å²	181	68.9 Å²	68.9	68%	0.683	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.8	-153.2	-173.1	-51.7	177.7	-178.8	-179	-2.1	111	R89 D90 S96	R89-R94 PolarHBondContact NH1-O 2.7Å; R89-R94 PolarHBondContact O-N 2.78Å; D90-R94 WeakPolarHBondContact O-CA 3.49Å; D90-R94 WeakPolarHBondContact O-CG 3.13Å; D90-R94 PolarHBondContact O-N 3.25Å; R94-S96 PolarHBondContact O-N 3.43Å
95	Q	75.6	Confident	83.5	Confident	91 Å²	91	64.4 Å²	64.4	43%	0.425	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63	15.5	174.1	-62.7	166.1	-30.5	0	0	114.8	Y154 D155 P156	Q95-Y154 VanDerWaalsContact NE2-CE2 3.34Å; Q95-D155 PolarHBondContact NE2-O 3.26Å; Q95-P156 WeakPolarHBondContact CG-O 3.46Å
96	S	81.3	Confident	82.9	Confident	52 Å²	52	61.9 Å²	61.9	36%	0.364	31%	0.313	S	S	.	.			trans	-62.3	122.6	173.7	176.2	0	0	0	0	109.9	C93 R94 K98	C93-S96 WeakPolarHBondContact O-CB 3.38Å; C93-S96 PolarHBondContact O-N 2.94Å; R94-S96 PolarHBondContact O-N 3.43Å; S96-K98 PolarHBondContact O-N 2.86Å; S96-K98 PolarHBondContact OG-O 3.44Å
97	P	76	Confident	82.1	Confident	108 Å²	108	56.8 Å²	56.8	70%	0.701	29%	0.292	S	S	*	.	S	Bend	trans	-68.7	-0.1	-174.5	29.7	-37.5	0	0	0	114
98	K	83.2	Confident	81	Confident	138 Å²	138	58.8 Å²	58.8	60%	0.6	31%	0.306	S	S	*	.			trans	-142.4	128.7	166.1	-63.3	-164	177.3	-152.5	0	110	S96 I100	S96-K98 PolarHBondContact O-N 2.86Å; S96-K98 PolarHBondContact OG-O 3.44Å; K98-I100 HydrophobicContact CB-CD1 4.41Å; K98-I100 HydrophobicContact CB-CG1 4.44Å; K98-I100 HydrophobicContact CD-CD1 4.45Å
99	C	87.4	Confident	79.8	Confident	4 Å²	4	58.1 Å²	58.1	3%	0.027	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	104.2	170.2	-167.4	0	0	0	0	108.7	R89 C93 E118 I119	R89-C99 HydrophobicContact CG-CB 3.63Å; C93-C99 HydrophobicContact CB-CB 3.58Å; C93-C99 WeakPolarHBondContact CB-SG 3.38Å; C93-C99 WeakPolarHBondContact SG-CA 3.11Å; C93-C99 WeakPolarHBondContact SG-CB 3.35Å; C93-C99 CovalentContact SG-SG 2.04Å; C93-C99 PolarHBondContact SG-SG 2.74Å; C99-E118 CarbonylContact O-C 3.5Å; C99-E118 WeakPolarHBondContact O-CA 3.32Å; C99-I119 HydrophobicContact CB-CB 4.19Å; C99-I119 PolarHBondContact O-N 3.27Å
100	I	86.4	Confident	78.8	Confident	87 Å²	87	65 Å²	65	45%	0.446	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	116.8	-175.6	-57.8	174.7	0	0	0	109.2	K98 K116 V117 E118	K98-I100 HydrophobicContact CB-CD1 4.41Å; K98-I100 HydrophobicContact CB-CG1 4.44Å; K98-I100 HydrophobicContact CD-CD1 4.45Å; I100-K116 HydrophobicContact CG2-CB 4.05Å; I100-K116 HydrophobicContact CG2-CG 4.44Å; I100-V117 WeakPolarHBondContact CA-O 3.24Å; I100-E118 HydrophobicContact CG1-CB 4.29Å; I100-E118 HydrophobicContact CG1-CG 4.09Å
101	I	85.6	Confident	78	Confident	18 Å²	18	68 Å²	68	9%	0.092	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	144.5	170.1	62.2	174.3	0	0	0	109.9	A68 L71 V72 L92 V117 I119	A68-I101 HydrophobicContact CB-CB 4.18Å; L71-I101 HydrophobicContact CB-CD1 4.15Å; L71-I101 HydrophobicContact CD1-CD1 4.38Å; L71-I101 HydrophobicContact CD1-CG2 4.13Å; V72-I101 HydrophobicContact CG1-CD1 3.87Å; V72-I101 HydrophobicContact CG2-CD1 3.91Å; L92-I101 HydrophobicContact CD2-CG2 4.09Å; I101-V117 HydrophobicContact CD1-CB 4.37Å; I101-V117 HydrophobicContact CG1-CB 3.85Å; I101-V117 PolarHBondContact N-O 2.96Å; I101-V117 PolarHBondContact O-N 3.28Å; I101-I119 HydrophobicContact CD1-CD1 4.26Å; I101-I119 HydrophobicContact CG1-CD1 4.33Å; I101-I119 HydrophobicContact CG2-CD1 3.86Å
102	S	82.3	Confident	77.3	Confident	46 Å²	46	64.6 Å²	64.6	32%	0.322	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	128.4	179.6	57.8	0	0	0	0	111.9	S67 I115	S67-S102 PolarHBondContact OG-O 2.89Å; S102-I115 CarbonylContact C-O 3.48Å; S102-I115 VanDerWaalsContact CA-O 3.32Å; S102-I115 WeakPolarHBondContact CA-O 3.49Å
103	L	81.9	Confident	76.9	Confident	3 Å²	3	60.7 Å²	60.7	2%	0.016	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	121.5	175.6	-178.8	70.2	0	0	0	109	V63 V72 I74 L81 V105 I115	V63-L103 HydrophobicContact CG1-CD1 3.77Å; V63-L103 HydrophobicContact CG2-CD1 4.14Å; V72-L103 HydrophobicContact CG2-CD2 4.32Å; I74-L103 HydrophobicContact CG2-CD2 4.44Å; L81-L103 HydrophobicContact CD1-CD2 3.84Å; L103-V105 HydrophobicContact CD2-CG1 4.15Å; L103-V105 HydrophobicContact CG-CG1 4.07Å; L103-I115 HydrophobicContact CB-CB 4.43Å; L103-I115 HydrophobicContact CD2-CD1 4.47Å; L103-I115 PolarHBondContact N-O 3.44Å; L103-I115 WeakPolarHBondContact O-CB 3.04Å; L103-I115 PolarHBondContact O-N 3.43Å
104	E	80.9	Confident	76.9	Confident	63 Å²	63	59.8 Å²	59.8	29%	0.294	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	122.9	179.3	-60.3	-174.7	151.8	0	0	110	V63 V64 S65 V114	V63-E104 WeakPolarHBondContact CA-O 3.42Å; V64-E104 HydrophobicContact CB-CB 4.13Å; V64-E104 PolarHBondContact N-O 2.95Å; S65-E104 WeakPolarHBondContact CB-OE2 2.98Å; E104-V114 HydrophobicContact CG-CG2 4.38Å
105	V	77.4	Confident	77	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	137.9	-177.6	-56.3	0	0	0	0	111.2	F61 V63 I74 L103 C113 I115	F61-V105 HydrophobicContact CB-CB 4.39Å; F61-V105 HydrophobicContact CD1-CB 4.16Å; F61-V105 HydrophobicContact CD1-CG2 3.61Å; F61-V105 HydrophobicContact CE1-CG2 4.07Å; F61-V105 HydrophobicContact CG-CG2 4.4Å; V63-V105 HydrophobicContact CG2-CG1 4.44Å; I74-V105 HydrophobicContact CD1-CG1 4.36Å; I74-V105 HydrophobicContact CG2-CG1 4.04Å; L103-V105 HydrophobicContact CD2-CG1 4.15Å; L103-V105 HydrophobicContact CG-CG1 4.07Å; V105-C113 HydrophobicContact CG2-CB 3.98Å; V105-C113 PolarHBondContact N-O 2.04Å; V105-C113 PolarHBondContact O-N 3.42Å; V105-I115 HydrophobicContact CB-CD1 4.5Å; V105-I115 HydrophobicContact CG1-CD1 3.81Å; V105-I115 HydrophobicContact CG2-CD1 3.8Å; V105-I115 HydrophobicContact CG2-CG1 4.13Å
106	M	73.6	Confident	77.5	Confident	43 Å²	43	50.4 Å²	50.4	21%	0.212	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	139.7	175.6	-150.2	164.6	56.4	0	0	109.7	F61 R62 V64 M110 E111	F61-M106 CarbonylContact C-O 3.5Å; F61-M106 VanDerWaalsContact CA-O 3.27Å; F61-M106 WeakPolarHBondContact CA-O 3.4Å; R62-M106 PolarHBondContact N-O 2.88Å; R62-M106 PolarHBondContact O-N 2.95Å; V64-M106 HydrophobicContact CG2-CB 3.62Å; V64-M106 HydrophobicContact CG2-CG 4.32Å; M106-M110 HydrophobicContact SD-CB 4.43Å; M106-E111 CarbonylContact C-O 3.46Å; M106-E111 WeakPolarHBondContact CA-O 3.44Å
107	S	68.2	Low	77.7	Confident	6 Å²	6	48 Å²	48	4%	0.042	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	173.4	163.9	61.4	0	0	0	0	112.3	S109 M110 E111	S107-S109 VanDerWaalsContact CB-OG 3.3Å; S107-S109 WeakPolarHBondContact CB-OG 3.04Å; S107-S109 PolarHBondContact O-N 3.42Å; S107-S109 WeakPolarHBondContact OG-CA 3.46Å; S107-S109 PolarHBondContact OG-N 3.1Å; S107-S109 VanDerWaalsContact OG-N 3.08Å; S107-S109 PolarHBondContact OG-OG 3.06Å; S107-M110 PolarHBondContact O-N 3.42Å; S107-M110 PolarHBondContact OG-N 3.3Å; S107-E111 PolarHBondContact N-O 3.21Å; S107-E111 PolarHBondContact OG-N 3.47Å; S107-E111 PolarHBondContact OG-O 3.19Å
108	S	64.3	Low	78.3	Confident	45 Å²	45	46.5 Å²	46.5	32%	0.315	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-18.2	160.4	45.4	0	0	0	0	113.8	Q57 M110	Q57-S108 VanDerWaalsContact OE1-CB 3.22Å; S108-M110 VanDerWaalsContact C-N 3.28Å
109	S	63.5	Low	78.5	Confident	53 Å²	53	40.2 Å²	40.2	37%	0.371	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81	2.2	171.3	50.7	0	0	0	0	114.3	S107 E111	S107-S109 VanDerWaalsContact CB-OG 3.3Å; S107-S109 WeakPolarHBondContact CB-OG 3.04Å; S107-S109 PolarHBondContact O-N 3.42Å; S107-S109 WeakPolarHBondContact OG-CA 3.46Å; S107-S109 PolarHBondContact OG-N 3.1Å; S107-S109 VanDerWaalsContact OG-N 3.08Å; S107-S109 PolarHBondContact OG-OG 3.06Å; S109-E111 PolarHBondContact O-N 3.32Å; S109-E111 PolarHBondContact OG-OE2 3.25Å
110	M	66.1	Low	78.5	Confident	147 Å²	147	44.7 Å²	44.7	72%	0.724	23%	0.23	S	C	*	.	S	Bend	trans	64.3	19.7	-173.5	-51	-166.6	77.4	0	0	115	M106 S107 S108	M106-M110 HydrophobicContact SD-CB 4.43Å; S107-M110 PolarHBondContact O-N 3.42Å; S107-M110 PolarHBondContact OG-N 3.3Å; S108-M110 VanDerWaalsContact C-N 3.28Å
111	E	69.3	Low	78.6	Confident	84 Å²	84	41.9 Å²	41.9	39%	0.393	22%	0.216	S	C	.	.			trans	-85.9	138.5	173.1	-60.7	172.6	118.2	0	0	109.6	F51 M106 S107 S109	F51-E111 HydrophobicContact CD2-CB 4.31Å; F51-E111 HydrophobicContact CE2-CB 3.51Å; F51-E111 HydrophobicContact CZ-CB 4.01Å; M106-E111 CarbonylContact C-O 3.46Å; M106-E111 WeakPolarHBondContact CA-O 3.44Å; S107-E111 PolarHBondContact N-O 3.21Å; S107-E111 PolarHBondContact OG-N 3.47Å; S107-E111 PolarHBondContact OG-O 3.19Å; S109-E111 PolarHBondContact O-N 3.32Å; S109-E111 PolarHBondContact OG-OE2 3.25Å
112	I	72.8	Confident	78.8	Confident	73 Å²	73	43.4 Å²	43.4	37%	0.374	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	124.1	-179.2	-59.9	174	0	0	0	109.7	V64	V64-I112 HydrophobicContact CG2-CG1 4.34Å
113	C	75.6	Confident	79.1	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	131.2	167.3	-178.4	0	0	0	0	109.7	I23 F51 V105	I23-C113 WeakPolarHBondContact O-CA 3.42Å; I23-C113 PolarHBondContact O-SG 3.15Å; F51-C113 HydrophobicContact CE1-CB 4.42Å; F51-C113 HydrophobicContact CE2-CB 4.12Å; F51-C113 HydrophobicContact CZ-CB 3.86Å; V105-C113 HydrophobicContact CG2-CB 3.98Å; V105-C113 PolarHBondContact N-O 2.04Å; V105-C113 PolarHBondContact O-N 3.42Å
114	V	81.6	Confident	79.4	Confident	13 Å²	13	44.9 Å²	44.9	8%	0.079	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	110.6	175.9	-177.4	0	0	0	0	108.4	L22 I23 N24 L25 E104 K116	L22-V114 HydrophobicContact CD2-CG2 3.72Å; I23-V114 PolarHBondContact O-N 2.74Å; N24-V114 CarbonylContact C-O 3.57Å; N24-V114 WeakPolarHBondContact CA-O 3.38Å; L25-V114 PolarHBondContact N-O 2.72Å; E104-V114 HydrophobicContact CG-CG2 4.38Å; V114-K116 HydrophobicContact CG1-CG 4.3Å
115	I	83.3	Confident	79.8	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	123.2	175.2	-53.3	173	0	0	0	108	Y27 V42 I74 L81 S102 L103 V105 V117	Y27-I115 HydrophobicContact CD2-CG2 3.67Å; Y27-I115 HydrophobicContact CE2-CG2 3.97Å; V42-I115 HydrophobicContact CG1-CD1 3.93Å; V42-I115 HydrophobicContact CG1-CG1 4.43Å; V42-I115 HydrophobicContact CG2-CD1 4.11Å; I74-I115 HydrophobicContact CD1-CD1 4.18Å; L81-I115 HydrophobicContact CD2-CG2 3.96Å; S102-I115 CarbonylContact C-O 3.48Å; S102-I115 VanDerWaalsContact CA-O 3.32Å; S102-I115 WeakPolarHBondContact CA-O 3.49Å; L103-I115 HydrophobicContact CB-CB 4.43Å; L103-I115 HydrophobicContact CD2-CD1 4.47Å; L103-I115 PolarHBondContact N-O 3.44Å; L103-I115 WeakPolarHBondContact O-CB 3.04Å; L103-I115 PolarHBondContact O-N 3.43Å; V105-I115 HydrophobicContact CB-CD1 4.5Å; V105-I115 HydrophobicContact CG1-CD1 3.81Å; V105-I115 HydrophobicContact CG2-CD1 3.8Å; V105-I115 HydrophobicContact CG2-CG1 4.13Å; I115-V117 HydrophobicContact CG2-CG2 4.13Å
116	K	85.9	Confident	80.4	Confident	76 Å²	76	46 Å²	46	33%	0.33	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	116.7	172.6	-71.6	170.8	178.6	159.1	0	108.6	N24 L25 K26 Y27 I100 V114	N24-K116 PolarHBondContact OD1-NZ 3.22Å; L25-K116 PolarHBondContact O-N 2.82Å; K26-K116 WeakPolarHBondContact CA-O 3.41Å; Y27-K116 PolarHBondContact N-O 3.33Å; I100-K116 HydrophobicContact CG2-CB 4.05Å; I100-K116 HydrophobicContact CG2-CG 4.44Å; V114-K116 HydrophobicContact CG1-CG 4.3Å
117	V	86.8	Confident	81.4	Confident	1 Å²	1	44.3 Å²	44.3	1%	0.006	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	114.9	175.3	-170.3	0	0	0	0	107.7	Y27 V29 I39 L81 I100 I101 I115	Y27-V117 WeakPolarHBondContact O-CA 3.28Å; V29-V117 HydrophobicContact CB-CG1 4.2Å; V29-V117 HydrophobicContact CG1-CG1 3.79Å; I39-V117 HydrophobicContact CD1-CG1 4.41Å; I39-V117 HydrophobicContact CG2-CG1 4.37Å; L81-V117 HydrophobicContact CD2-CG2 3.79Å; I100-V117 WeakPolarHBondContact CA-O 3.24Å; I101-V117 HydrophobicContact CD1-CB 4.37Å; I101-V117 HydrophobicContact CG1-CB 3.85Å; I101-V117 PolarHBondContact N-O 2.96Å; I101-V117 PolarHBondContact O-N 3.28Å; I115-V117 HydrophobicContact CG2-CG2 4.13Å
118	E	87.7	Confident	82.5	Confident	77 Å²	77	46.7 Å²	46.7	36%	0.36	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	113.7	169.3	-166.6	157.1	-135.7	0	0	107.5	Y27 S28 V29 C99 I100 K120	Y27-E118 PolarHBondContact O-N 3.24Å; S28-E118 WeakPolarHBondContact CA-O 3.39Å; V29-E118 PolarHBondContact N-O 2.94Å; V29-E118 VanDerWaalsContact N-O 3.09Å; C99-E118 CarbonylContact O-C 3.5Å; C99-E118 WeakPolarHBondContact O-CA 3.32Å; I100-E118 HydrophobicContact CG1-CB 4.29Å; I100-E118 HydrophobicContact CG1-CG 4.09Å; E118-K120 PolarHBondContact O-N 3.33Å
119	I	88.5	Confident	83.9	Confident	5 Å²	5	46.1 Å²	46.1	3%	0.026	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	113.8	173.7	-61.4	160.1	0	0	0	105.8	V29 E31 I87 R89 L92 C99 I101	V29-I119 HydrophobicContact CG1-CG1 4.44Å; V29-I119 CarbonylContact O-C 3.41Å; V29-I119 WeakPolarHBondContact O-CA 3.33Å; E31-I119 HydrophobicContact CB-CG2 3.87Å; I87-I119 HydrophobicContact CG2-CD1 3.69Å; I87-I119 HydrophobicContact CG2-CG1 4.23Å; I87-I119 HydrophobicContact CG2-CG2 4.2Å; R89-I119 HydrophobicContact CB-CG2 3.94Å; R89-I119 HydrophobicContact CG-CB 4.44Å; R89-I119 HydrophobicContact CG-CG2 3.87Å; L92-I119 HydrophobicContact CD2-CD1 3.63Å; C99-I119 HydrophobicContact CB-CB 4.19Å; C99-I119 PolarHBondContact O-N 3.27Å; I101-I119 HydrophobicContact CD1-CD1 4.26Å; I101-I119 HydrophobicContact CG1-CD1 4.33Å; I101-I119 HydrophobicContact CG2-CD1 3.86Å
120	K	87.3	Confident	85.1	Confident	99 Å²	99	48.3 Å²	48.3	43%	0.43	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	130.2	175.6	-80.8	172.3	169.8	175.6	0	109.3	S28 V29 E30 E31 E118	S28-K120 WeakPolarHBondContact OG-CE 3.34Å; S28-K120 PolarHBondContact OG-NZ 2.69Å; V29-K120 PolarHBondContact O-N 3.22Å; E30-K120 HydrophobicContact CG-CB 4.29Å; E30-K120 HydrophobicContact CG-CD 4.44Å; E31-K120 PolarHBondContact N-O 2.59Å; E31-K120 VanDerWaalsContact N-O 3.08Å; E118-K120 PolarHBondContact O-N 3.33Å
121	D	88.2	Confident	86.2	Confident	27 Å²	27	43.3 Å²	43.3	14%	0.144	24%	0.236	C	C	.	.			trans	-53.3	145.2	170.2	-143.5	-25.8	0	0	0	112.2	E31 R89 S158 F161	E31-D121 WeakPolarHBondContact OE1-CA 3.34Å; R89-D121 IonicContact CZ-OD1 3.38Å; R89-D121 IonicContact CZ-OD2 2.7Å; R89-D121 IonicContact NE-OD1 3.42Å; R89-D121 PolarHBondContact NE-OD1 3.04Å; R89-D121 IonicContact NE-OD2 2.69Å; R89-D121 IonicContact NH2-OD1 2.93Å; R89-D121 PolarHBondContact NH2-OD1 3.24Å; R89-D121 IonicContact NH2-OD2 2.8Å; R89-D121 PolarHBondContact NH2-OD2 2.8Å; D121-S158 VanDerWaalsContact OD2-CA 3.24Å; D121-S158 WeakPolarHBondContact OD2-CA 3.48Å; D121-S158 WeakPolarHBondContact OD2-CB 3.24Å; D121-S158 PolarHBondContact OD2-N 2.85Å; D121-S158 PolarHBondContact OD2-OG 2.83Å; D121-F161 HydrophobicContact CB-CD2 3.82Å; D121-F161 HydrophobicContact CB-CE2 4.13Å
122	L	89	Confident	87	Confident	51 Å²	51	44 Å²	44	27%	0.267	26%	0.257	S	S	.	.			trans	-127.2	149.5	166.4	-69.5	179.9	0	0	0	108.8	E30 E31 E32 D124	E30-L122 HydrophobicContact CB-CD1 4.4Å; E30-L122 HydrophobicContact CB-CD2 4.3Å; E30-L122 HydrophobicContact CB-CG 4.45Å; E30-L122 HydrophobicContact CG-CD2 4.18Å; E31-L122 HydrophobicContact CG-CB 3.95Å; E31-L122 HydrophobicContact CG-CD1 3.99Å; E31-L122 HydrophobicContact CG-CG 3.87Å; E31-L122 VanDerWaalsContact O-CD1 3.28Å; E31-L122 WeakPolarHBondContact O-CD1 3.13Å; E31-L122 PolarHBondContact OE1-N 2.84Å; E32-L122 HydrophobicContact CB-CD1 4.1Å; E32-L122 HydrophobicContact CG-CD1 4.45Å; L122-D124 PolarHBondContact O-N 2.89Å
123	N	89.4	Confident	87.9	Confident	27 Å²	27	44.8 Å²	44.8	14%	0.144	26%	0.259	C	S	.	.	S	Bend	trans	-83.6	61.3	178.8	-158.4	108.2	0	0	0	109.7	D157 F161 D212 G214 R218	N123-D157 WeakPolarHBondContact CA-OD2 3.04Å; N123-F161 HydrophobicContact CB-CB 4.14Å; N123-F161 HydrophobicContact CB-CD1 3.81Å; N123-F161 HydrophobicContact CB-CD2 4.22Å; N123-F161 HydrophobicContact CB-CE1 4.27Å; N123-F161 HydrophobicContact CB-CG 3.8Å; N123-F161 VanDerWaalsContact OD1-CB 3.31Å; N123-F161 WeakPolarHBondContact OD1-CB 3.34Å; N123-F161 WeakPolarHBondContact OD1-CD1 3.43Å; N123-F161 WeakPolarHBondContact OD1-CG 3.28Å; N123-D212 PolarHBondContact ND2-OD2 2.82Å; N123-D212 PolarHBondContact OD1-OD2 3.31Å; N123-G214 WeakPolarHBondContact OD1-CA 3.41Å; N123-G214 PolarHBondContact OD1-N 2.87Å; N123-R218 WeakPolarHBondContact ND2-CD 3.44Å; N123-R218 PolarHBondContact O-NE 2.92Å; N123-R218 PolarHBondContact O-NH2 2.82Å; N123-R218 VanDerWaalsContact O-NH2 3.15Å
124	D	88	Confident	88.7	Confident	52 Å²	52	45.3 Å²	45.3	28%	0.278	26%	0.262	S	S	.	.			trans	-104.9	-12.2	-173.7	80.8	-92.8	0	0	0	116.9	E32 L122 D157 R218	E32-D124 WeakPolarHBondContact CG-OD1 3.2Å; L122-D124 PolarHBondContact O-N 2.89Å; D124-D157 PolarHBondContact N-OD2 3.26Å; D124-R218 VanDerWaalsContact C-NH1 3.28Å; D124-R218 PolarHBondContact O-NH1 3.25Å; D124-R218 PolarHBondContact O-NH2 2.8Å
125	N	89.4	Confident	89.3	Confident	55 Å²	55	51.8 Å²	51.8	29%	0.294	29%	0.291	S	S	.	.	S	Bend	trans	-90.5	-161.8	158.9	-58.4	-86.7	0	0	0	110.8	D90 P156 D157 R218	D90-N125 PolarHBondContact OD2-ND2 3.26Å; N125-P156 HydrophobicContact CB-CB 4.29Å; N125-P156 HydrophobicContact CB-CG 3.88Å; N125-D157 VanDerWaalsContact CB-OD1 3.24Å; N125-D157 WeakPolarHBondContact CB-OD1 3.3Å; N125-D157 PolarHBondContact N-OD1 2.83Å; N125-D157 PolarHBondContact N-OD2 3.48Å; N125-D157 PolarHBondContact ND2-OD1 2.92Å; N125-R218 WeakPolarHBondContact O-CD 3.22Å; N125-R218 VanDerWaalsContact O-CZ 3.28Å; N125-R218 PolarHBondContact O-NE 2.83Å; N125-R218 PolarHBondContact O-NH1 3.45Å
126	A	90.6	Very high	89.8	Confident	33 Å²	33	53.1 Å²	53.1	27%	0.273	30%	0.298	S	S	.	.			trans	-161.5	157.6	178	0	0	0	0	0	109.6	S128 D155 R218	A126-S128 PolarHBondContact O-N 2.69Å; A126-D155 VanDerWaalsContact C-OD2 3.23Å; A126-R218 HydrophobicContact CB-CB 4Å
127	P	93.6	Very high	90.2	Very high	6 Å²	6	55.7 Å²	55.7	4%	0.039	31%	0.311	C	S	.	.			trans	-58.8	134.6	178.1	-25	33.8	0	0	0	111.6	A153 D155 V163 A210 D212 G220	P127-A153 HydrophobicContact CB-CB 4.29Å; P127-D155 WeakPolarHBondContact CD-OD2 3.22Å; P127-D155 VanDerWaalsContact CG-OD2 3.31Å; P127-D155 WeakPolarHBondContact CG-OD2 3.18Å; P127-V163 HydrophobicContact CB-CG2 4.13Å; P127-V163 HydrophobicContact CG-CG2 4.31Å; P127-A210 HydrophobicContact CB-CB 3.7Å; P127-A210 HydrophobicContact CG-CB 4.45Å; P127-D212 HydrophobicContact CG-CB 4.38Å; P127-G220 WeakPolarHBondContact O-CA 2.92Å
128	S	92.5	Very high	90.6	Very high	57 Å²	57	56 Å²	56	40%	0.399	31%	0.313	S	S	.	.	B	Isolated β-bridge	trans	-134.5	137.8	-178.7	66.7	0	0	0	0	111.2	A126 A153 Y154	A126-S128 PolarHBondContact O-N 2.69Å; S128-A153 CarbonylContact O-C 3.57Å; S128-A153 VanDerWaalsContact O-CA 3.31Å; S128-A153 WeakPolarHBondContact O-CA 3.42Å; S128-Y154 PolarHBondContact N-O 3.33Å; S128-Y154 PolarHBondContact O-N 3.39Å; S128-Y154 PolarHBondContact OG-O 2.52Å
129	F	92.4	Very high	90.9	Very high	32 Å²	32	54.4 Å²	54.4	14%	0.14	31%	0.31	C	S	.	.			trans	-94.9	143.9	176.9	-73.3	-87.5	0	0	0	110.7	A131 A153 Y166 I208 A210 V222	F129-A131 VanDerWaalsContact C-N 3.25Å; F129-A131 PolarHBondContact O-N 2.98Å; F129-A153 HydrophobicContact CD1-CB 4.14Å; F129-A153 HydrophobicContact CD2-CB 4.36Å; F129-A153 HydrophobicContact CE1-CB 3.89Å; F129-A153 HydrophobicContact CE2-CB 4.11Å; F129-A153 HydrophobicContact CG-CB 4.39Å; F129-A153 HydrophobicContact CZ-CB 3.88Å; F129-Y166 HydrophobicContact CE1-CE1 4.14Å; F129-Y166 HydrophobicContact CZ-CD1 4.2Å; F129-Y166 HydrophobicContact CZ-CE1 4.08Å; F129-I208 HydrophobicContact CE1-CG2 4.46Å; F129-I208 HydrophobicContact CZ-CG2 3.85Å; F129-A210 HydrophobicContact CE2-CB 3.82Å; F129-A210 HydrophobicContact CZ-CB 3.75Å; F129-V222 HydrophobicContact CB-CB 3.89Å; F129-V222 HydrophobicContact CB-CG1 4.35Å; F129-V222 HydrophobicContact CB-CG2 4.15Å; F129-V222 HydrophobicContact CD1-CB 4.12Å; F129-V222 HydrophobicContact CD1-CG1 3.63Å; F129-V222 HydrophobicContact CD2-CB 3.65Å; F129-V222 HydrophobicContact CD2-CG1 3.73Å; F129-V222 HydrophobicContact CE1-CG1 3.7Å; F129-V222 HydrophobicContact CE2-CB 4.16Å; F129-V222 HydrophobicContact CE2-CG1 3.8Å; F129-V222 HydrophobicContact CG-CB 3.62Å; F129-V222 HydrophobicContact CG-CG1 3.63Å; F129-V222 HydrophobicContact CG-CG2 4.32Å; F129-V222 HydrophobicContact CZ-CG1 3.78Å
130	P	88.9	Confident	91.2	Very high	100 Å²	100	54.7 Å²	54.7	65%	0.649	31%	0.312	S	S	*	.	S	Bend	trans	-70.6	-21	-178	28.9	-35.5	0	0	0	113.4	D151	P130-D151 HydrophobicContact CG-CB 4.15Å
131	A	89.5	Confident	91.4	Very high	41 Å²	41	53.4 Å²	53.4	34%	0.339	32%	0.319	S	S	.	.	S	Bend	trans	-121.4	152	176.7	0	0	0	0	0	110.7	F129 Q133 V222	F129-A131 VanDerWaalsContact C-N 3.25Å; F129-A131 PolarHBondContact O-N 2.98Å; A131-Q133 VanDerWaalsContact C-N 3.31Å; A131-Q133 WeakPolarHBondContact CB-O 3.08Å; A131-V222 WeakPolarHBondContact O-CG2 3.18Å
132	A	85.3	Confident	91.7	Very high	100 Å²	100	52.9 Å²	52.9	83%	0.826	32%	0.319	S	S	*	.	S	Bend	trans	-74.4	-22.5	176.3	0	0	0	0	0	113.2
133	Q	92.4	Very high	91.9	Very high	88 Å²	88	54.4 Å²	54.4	41%	0.411	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	141.2	177.1	-176.9	168.5	-41.1	0	0	108.1	A131 E135 G223 S225	A131-Q133 VanDerWaalsContact C-N 3.31Å; A131-Q133 WeakPolarHBondContact CB-O 3.08Å; Q133-E135 HydrophobicContact CG-CG 4.21Å; Q133-E135 PolarHBondContact NE2-OE1 3.37Å; Q133-G223 CarbonylContact C-O 3.6Å; Q133-G223 WeakPolarHBondContact CA-O 3.3Å; Q133-S225 PolarHBondContact NE2-OG 3.37Å
134	I	92.7	Very high	92.1	Very high	12 Å²	12	56.9 Å²	56.9	6%	0.062	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	129.5	168.2	-61.5	174.6	0	0	0	106.6	L136 L150 D151 I208 V222 G223 L224 S225	I134-L136 HydrophobicContact CG2-CD2 4.23Å; I134-L136 HydrophobicContact CG2-CG 4.22Å; I134-L150 HydrophobicContact CG2-CD2 4.37Å; I134-D151 HydrophobicContact CD1-CB 4.42Å; I134-I208 HydrophobicContact CD1-CD1 4.24Å; I134-V222 HydrophobicContact CD1-CG1 3.89Å; I134-V222 HydrophobicContact CG1-CG1 4.33Å; I134-V222 HydrophobicContact CG1-CG2 4.07Å; I134-G223 PolarHBondContact N-O 3.5Å; I134-L224 HydrophobicContact CB-CD1 3.93Å; I134-L224 HydrophobicContact CG2-CD1 3.74Å; I134-L224 WeakPolarHBondContact O-CA 3.34Å; I134-S225 PolarHBondContact O-N 3.08Å
135	E	93.3	Very high	92.2	Very high	148 Å²	148	56.5 Å²	56.5	69%	0.692	36%	0.359	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.5	126	176.9	-61	-172.9	160	0	0	108.7	Q133 S225	Q133-E135 HydrophobicContact CG-CG 4.21Å; Q133-E135 PolarHBondContact NE2-OE1 3.37Å; E135-S225 WeakPolarHBondContact CA-O 3.09Å
136	L	93.9	Very high	92.4	Very high	28 Å²	28	56.1 Å²	56.1	15%	0.147	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	141	177.8	-61.2	179.9	0	0	0	110.4	I134 I138 I148 L150 L190 L224 S225 I226 K227	I134-L136 HydrophobicContact CG2-CD2 4.23Å; I134-L136 HydrophobicContact CG2-CG 4.22Å; L136-I138 HydrophobicContact CB-CG1 4.3Å; L136-I148 HydrophobicContact CD1-CG2 4.18Å; L136-I148 HydrophobicContact CD2-CG2 4.14Å; L136-L150 HydrophobicContact CD1-CD2 3.98Å; L136-L190 HydrophobicContact CD1-CD2 3.7Å; L136-L224 HydrophobicContact CD1-CD1 3.91Å; L136-L224 HydrophobicContact CG-CD1 4.13Å; L136-S225 PolarHBondContact N-O 3.07Å; L136-I226 WeakPolarHBondContact O-CA 3.47Å; L136-K227 PolarHBondContact O-N 2.97Å
137	E	94.9	Very high	92.5	Very high	130 Å²	130	60.1 Å²	60.1	61%	0.607	37%	0.367	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.7	127.1	165.2	-69.4	-164.8	135.6	0	0	108.5	K227 T229	E137-K227 WeakPolarHBondContact CA-O 3.31Å; E137-K227 HydrophobicContact CG-CB 4.43Å; E137-K227 HydrophobicContact CG-CD 4.34Å; E137-K227 WeakPolarHBondContact OE1-CD 3.49Å; E137-K227 WeakPolarHBondContact OE1-CE 3.24Å; E137-K227 IonicContact OE1-NZ 3.04Å; E137-K227 PolarHBondContact OE1-NZ 2.8Å; E137-T229 HydrophobicContact CB-CG2 3.73Å; E137-T229 HydrophobicContact CG-CG2 4.15Å
138	I	95.1	Very high	92.5	Very high	7 Å²	7	61.5 Å²	61.5	4%	0.036	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	123.3	-176.1	-49.5	-178.2	0	0	0	108.8	L136 A142 I148 F174 L190 L196 I226 K227 V228 T229	L136-I138 HydrophobicContact CB-CG1 4.3Å; I138-A142 HydrophobicContact CG2-CB 3.88Å; I138-I148 HydrophobicContact CB-CD1 4.49Å; I138-I148 HydrophobicContact CD1-CD1 3.43Å; I138-I148 VanDerWaalsContact CD1-CD1 3.43Å; I138-I148 HydrophobicContact CG1-CD1 3.59Å; I138-I148 HydrophobicContact CG2-CD1 4.18Å; I138-F174 HydrophobicContact CD1-CE1 3.82Å; I138-F174 HydrophobicContact CD1-CZ 4.41Å; I138-L190 HydrophobicContact CD1-CD2 4.14Å; I138-L196 HydrophobicContact CB-CD1 4.3Å; I138-L196 HydrophobicContact CG2-CD1 3.82Å; I138-I226 HydrophobicContact CB-CG2 4.41Å; I138-I226 HydrophobicContact CD1-CD1 4.26Å; I138-I226 HydrophobicContact CD1-CG1 4.47Å; I138-I226 HydrophobicContact CD1-CG2 3.56Å; I138-I226 HydrophobicContact CG1-CG2 3.92Å; I138-K227 PolarHBondContact N-O 2.85Å; I138-V228 CarbonylContact O-C 3.52Å; I138-V228 VanDerWaalsContact O-CA 3.23Å; I138-V228 WeakPolarHBondContact O-CA 3.3Å; I138-T229 PolarHBondContact O-N 3Å
139	S	93.8	Very high	92.5	Very high	45 Å²	45	63.4 Å²	63.4	32%	0.315	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	142.8	173.5	160.5	0	0	0	0	111.3	A141 A142 T229 S231	S139-A141 PolarHBondContact O-N 3.36Å; S139-A141 PolarHBondContact OG-N 2.8Å; S139-A142 WeakPolarHBondContact O-CB 3.45Å; S139-A142 PolarHBondContact O-N 3.45Å; S139-T229 VanDerWaalsContact CA-O 3.29Å; S139-T229 WeakPolarHBondContact CA-O 3.05Å; S139-T229 VanDerWaalsContact CA-OG1 3.26Å; S139-T229 WeakPolarHBondContact CA-OG1 3.07Å; S139-T229 PolarHBondContact N-OG1 2.76Å; S139-S231 PolarHBondContact OG-OG 3.43Å
140	E	94.6	Very high	92.4	Very high	11 Å²	11	62.7 Å²	62.7	5%	0.051	38%	0.382	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-26.8	177.2	62.7	-112.6	104.2	0	0	114	A142 L196 R198 V228 T229 D230 S231	E140-A142 PolarHBondContact O-N 2.8Å; E140-L196 HydrophobicContact CB-CB 4.12Å; E140-R198 WeakPolarHBondContact OE2-CB 3.4Å; E140-R198 PolarHBondContact OE2-N 2.68Å; E140-V228 HydrophobicContact CB-CG1 3.92Å; E140-T229 VanDerWaalsContact OE1-O 3.07Å; E140-D230 VanDerWaalsContact OE1-C 3.26Å; E140-D230 VanDerWaalsContact OE1-CA 3.24Å; E140-D230 WeakPolarHBondContact OE1-CA 3.37Å; E140-S231 VanDerWaalsContact OE1-CB 3.3Å; E140-S231 WeakPolarHBondContact OE1-CB 3.31Å; E140-S231 PolarHBondContact OE1-N 3.36Å; E140-S231 PolarHBondContact OE1-OG 2.75Å
141	A	92.1	Very high	92.4	Very high	72 Å²	72	62.6 Å²	62.6	60%	0.595	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.1	1.6	170.1	0	0	0	0	0	113.4	S139 S143	S139-A141 PolarHBondContact O-N 3.36Å; S139-A141 PolarHBondContact OG-N 2.8Å; A141-S143 PolarHBondContact O-N 2.85Å
142	A	93.2	Very high	92.4	Very high	16 Å²	16	62.5 Å²	62.5	13%	0.132	37%	0.373	C	S	.	.			trans	-63.9	97.4	167.8	0	0	0	0	0	111.1	I138 S139 E140 T146	I138-A142 HydrophobicContact CG2-CB 3.88Å; S139-A142 WeakPolarHBondContact O-CB 3.45Å; S139-A142 PolarHBondContact O-N 3.45Å; E140-A142 PolarHBondContact O-N 2.8Å; A142-T146 HydrophobicContact CB-CG2 4.18Å
143	S	93.3	Very high	92.7	Very high	82 Å²	82	58.2 Å²	58.2	57%	0.573	34%	0.338	S	S	*	.			trans	-50.6	143.8	176.2	-60.9	0	0	0	0	113	A141 G145 T146	A141-S143 PolarHBondContact O-N 2.85Å; S143-G145 PolarHBondContact O-N 3.38Å; S143-T146 WeakPolarHBondContact O-CB 3.16Å; S143-T146 PolarHBondContact O-N 3.44Å; S143-T146 PolarHBondContact O-OG1 2.75Å
144	P	94.1	Very high	92.6	Very high	80 Å²	80	59.6 Å²	59.6	52%	0.519	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.8	137.2	168.7	-27.9	35.5	0	0	0	112.3	V192	P144-V192 CarbonylContact C-O 3.5Å; P144-V192 WeakPolarHBondContact CA-O 3.49Å
145	G	91.3	Very high	92.5	Very high	43 Å²	43	59.1 Å²	59.1	44%	0.443	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	88.6	-3.4	-168.5	0	0	0	0	0	114.7	S143 R147 V192	S143-G145 PolarHBondContact O-N 3.38Å; G145-R147 VanDerWaalsContact O-CG 3.29Å; G145-R147 WeakPolarHBondContact O-CG 3.31Å; G145-V192 PolarHBondContact N-O 2.9Å
146	T	93.3	Very high	92.2	Very high	48 Å²	48	53.2 Å²	53.2	29%	0.294	31%	0.312	S	S	.	.			trans	-59.5	138.3	169.6	-67.3	0	0	0	0	110.4	A142 S143 V191 V192	A142-T146 HydrophobicContact CB-CG2 4.18Å; S143-T146 WeakPolarHBondContact O-CB 3.16Å; S143-T146 PolarHBondContact O-N 3.44Å; S143-T146 PolarHBondContact O-OG1 2.75Å; T146-V191 WeakPolarHBondContact O-CA 3.36Å; T146-V192 HydrophobicContact CG2-CG2 4.37Å; T146-V192 PolarHBondContact O-N 2.9Å
147	R	93.2	Very high	92	Very high	117 Å²	117	52 Å²	52	44%	0.442	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	131.5	-172.4	-51.3	-178	171.4	-138.5	-8.6	111.2	G145 E177 E189 L190 V191	G145-R147 VanDerWaalsContact O-CG 3.29Å; G145-R147 WeakPolarHBondContact O-CG 3.31Å; R147-E177 IonicContact CZ-OE1 3.37Å; R147-E177 IonicContact CZ-OE2 3.63Å; R147-E177 IonicContact NH1-OE1 3.27Å; R147-E177 PolarHBondContact NH1-OE1 3.3Å; R147-E177 IonicContact NH1-OE2 2.68Å; R147-E177 PolarHBondContact NH1-OE2 2.76Å; R147-E177 IonicContact NH2-OE1 2.74Å; R147-E177 IonicContact NH2-OE2 3.87Å; R147-E177 PolarHBondContact NH2-OE2 3.12Å; R147-E189 WeakPolarHBondContact CD-OE2 3.38Å; R147-E189 IonicContact NH1-OE2 2.74Å; R147-L190 CarbonylContact C-O 3.55Å; R147-L190 WeakPolarHBondContact CA-O 3.4Å; R147-V191 HydrophobicContact CG-CG2 4.48Å
148	I	93.4	Very high	91.5	Very high	34 Å²	34	46.3 Å²	46.3	17%	0.174	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	121.4	-177.6	-57	172.3	0	0	0	108.2	L136 I138 L150 E189 L190	L136-I148 HydrophobicContact CD1-CG2 4.18Å; L136-I148 HydrophobicContact CD2-CG2 4.14Å; I138-I148 HydrophobicContact CB-CD1 4.49Å; I138-I148 HydrophobicContact CD1-CD1 3.43Å; I138-I148 VanDerWaalsContact CD1-CD1 3.43Å; I138-I148 HydrophobicContact CG1-CD1 3.59Å; I138-I148 HydrophobicContact CG2-CD1 4.18Å; I148-L150 PolarHBondContact O-N 3.41Å; I148-E189 CarbonylContact O-C 3.59Å; I148-E189 VanDerWaalsContact O-CA 3.32Å; I148-E189 WeakPolarHBondContact O-CA 3.4Å; I148-L190 HydrophobicContact CB-CB 4.37Å; I148-L190 PolarHBondContact N-O 2.67Å; I148-L190 PolarHBondContact O-N 2.92Å
149	P	91.1	Very high	90.9	Very high	97 Å²	97	48.8 Å²	48.8	63%	0.63	31%	0.308	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66.7	135.1	178.1	28.7	-34.1	0	0	0	110.6
150	L	91.8	Very high	90.5	Very high	17 Å²	17	49.7 Å²	49.7	9%	0.089	31%	0.314	C	S	.	.	P	Polyproline II helix	trans	-103.8	153.4	175.3	-63.2	167.5	0	0	0	110.8	I134 L136 I148 S152 L176 A188 L190 I208 L224	I134-L150 HydrophobicContact CG2-CD2 4.37Å; L136-L150 HydrophobicContact CD1-CD2 3.98Å; I148-L150 PolarHBondContact O-N 3.41Å; L150-S152 PolarHBondContact O-N 2.94Å; L150-L176 HydrophobicContact CD1-CD2 3.51Å; L150-A188 WeakPolarHBondContact CB-O 3.24Å; L150-A188 HydrophobicContact CD1-CB 4.08Å; L150-A188 PolarHBondContact N-O 2.9Å; L150-A188 VanDerWaalsContact N-O 3.12Å; L150-L190 HydrophobicContact CD1-CB 4.05Å; L150-L190 HydrophobicContact CD2-CB 4.21Å; L150-L190 HydrophobicContact CG-CB 4.15Å; L150-I208 HydrophobicContact CD1-CD1 3.92Å; L150-I208 HydrophobicContact CD2-CD1 4.41Å; L150-L224 HydrophobicContact CD2-CD1 4.37Å
151	D	88.4	Confident	90.1	Very high	99 Å²	99	51.6 Å²	51.6	53%	0.529	32%	0.322	S	S	.	.	P	Polyproline II helix	trans	-62.8	118.6	168.2	-79.1	-37.8	0	0	0	110.2	P130 I134	P130-D151 HydrophobicContact CG-CB 4.15Å; I134-D151 HydrophobicContact CD1-CB 4.42Å
152	S	89.4	Confident	89.9	Confident	39 Å²	39	48.6 Å²	48.6	27%	0.273	30%	0.298	S	S	.	.	P	Polyproline II helix	trans	-67	139.7	177.8	52.2	0	0	0	0	111.4	L150 Y166	L150-S152 PolarHBondContact O-N 2.94Å; S152-Y166 WeakPolarHBondContact CA-OH 3.15Å
153	A	91	Very high	89.8	Confident	9 Å²	9	48.6 Å²	48.6	7%	0.074	30%	0.296	C	S	.	.	P	Polyproline II helix	trans	-63.8	141.2	166.4	0	0	0	0	0	110	P127 S128 F129 V163 Y166 A210	P127-A153 HydrophobicContact CB-CB 4.29Å; S128-A153 CarbonylContact O-C 3.57Å; S128-A153 VanDerWaalsContact O-CA 3.31Å; S128-A153 WeakPolarHBondContact O-CA 3.42Å; F129-A153 HydrophobicContact CD1-CB 4.14Å; F129-A153 HydrophobicContact CD2-CB 4.36Å; F129-A153 HydrophobicContact CE1-CB 3.89Å; F129-A153 HydrophobicContact CE2-CB 4.11Å; F129-A153 HydrophobicContact CG-CB 4.39Å; F129-A153 HydrophobicContact CZ-CB 3.88Å; A153-V163 HydrophobicContact CB-CG2 4.14Å; A153-Y166 HydrophobicContact CB-CE1 3.91Å; A153-Y166 PolarHBondContact N-OH 2.96Å; A153-A210 HydrophobicContact CB-CB 3.51Å
154	Y	89.9	Confident	89.6	Confident	118 Å²	118	46.6 Å²	46.6	46%	0.463	28%	0.278	S	S	.	.	B	Isolated β-bridge	trans	-100.6	129.7	171.7	-177.1	-106.7	0	0	0	109.8	Q95 S128 P156	Q95-Y154 VanDerWaalsContact NE2-CE2 3.34Å; S128-Y154 PolarHBondContact N-O 3.33Å; S128-Y154 PolarHBondContact O-N 3.39Å; S128-Y154 PolarHBondContact OG-O 2.52Å; Y154-P156 HydrophobicContact CE1-CG 4.06Å
155	D	90.9	Very high	89.5	Confident	2 Å²	2	45 Å²	45	1%	0.011	27%	0.267	C	S	.	.			trans	-129.8	126.2	171.4	-156	-29.4	0	0	0	107.7	Q95 A126 P127 D157 V163	Q95-D155 PolarHBondContact NE2-O 3.26Å; A126-D155 VanDerWaalsContact C-OD2 3.23Å; P127-D155 WeakPolarHBondContact CD-OD2 3.22Å; P127-D155 VanDerWaalsContact CG-OD2 3.31Å; P127-D155 WeakPolarHBondContact CG-OD2 3.18Å; D155-D157 PolarHBondContact O-N 2.85Å; D155-D157 PolarHBondContact OD1-N 3Å; D155-V163 HydrophobicContact CB-CG2 3.67Å
156	P	88.2	Confident	89.6	Confident	24 Å²	24	43.5 Å²	43.5	16%	0.156	25%	0.248	C	C	.	.	S	Bend	trans	-59.4	-35.5	175.1	-24.2	34.7	0	0	0	113.3	D90 Q95 N125 Y154	D90-P156 HydrophobicContact CB-CB 3.85Å; D90-P156 VanDerWaalsContact OD1-O 3.11Å; Q95-P156 WeakPolarHBondContact CG-O 3.46Å; N125-P156 HydrophobicContact CB-CB 4.29Å; N125-P156 HydrophobicContact CB-CG 3.88Å; Y154-P156 HydrophobicContact CE1-CG 4.06Å
157	D	89.1	Confident	89.6	Confident	1 Å²	1	46.3 Å²	46.3	1%	0.005	26%	0.258	C	S	.	.			trans	-61.7	151.2	-172.1	-63.9	2.9	0	0	0	111.6	N123 D124 N125 D155 F161 G162	N123-D157 WeakPolarHBondContact CA-OD2 3.04Å; D124-D157 PolarHBondContact N-OD2 3.26Å; N125-D157 VanDerWaalsContact CB-OD1 3.24Å; N125-D157 WeakPolarHBondContact CB-OD1 3.3Å; N125-D157 PolarHBondContact N-OD1 2.83Å; N125-D157 PolarHBondContact N-OD2 3.48Å; N125-D157 PolarHBondContact ND2-OD1 2.92Å; D155-D157 PolarHBondContact O-N 2.85Å; D155-D157 PolarHBondContact OD1-N 3Å; D157-F161 HydrophobicContact CB-CB 3.74Å; D157-G162 WeakPolarHBondContact O-CA 3.1Å; D157-G162 PolarHBondContact O-N 3Å
158	S	84.6	Confident	89.6	Confident	12 Å²	12	42.1 Å²	42.1	8%	0.084	24%	0.244	C	C	.	.			trans	-111.7	167.7	-169.7	93	0	0	0	0	114.1	D121 S160 F161 G162	D121-S158 VanDerWaalsContact OD2-CA 3.24Å; D121-S158 WeakPolarHBondContact OD2-CA 3.48Å; D121-S158 WeakPolarHBondContact OD2-CB 3.24Å; D121-S158 PolarHBondContact OD2-N 2.85Å; D121-S158 PolarHBondContact OD2-OG 2.83Å; S158-S160 PolarHBondContact O-N 3.04Å; S158-F161 PolarHBondContact O-N 3.01Å; S158-G162 PolarHBondContact O-N 3.18Å
159	G	82.9	Confident	89.6	Confident	59 Å²	59	42.8 Å²	42.8	61%	0.608	25%	0.25	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.2	-103.7	172.2	0	0	0	0	0	114	Q164	G159-Q164 PolarHBondContact O-NE2 2.59Å
160	S	84.6	Confident	89.6	Confident	63 Å²	63	44.5 Å²	44.5	44%	0.441	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.3	-21	176.8	49.5	0	0	0	0	114.1	S158 Q164 G213	S158-S160 PolarHBondContact O-N 3.04Å; S160-Q164 WeakPolarHBondContact O-CG 3.42Å; S160-Q164 PolarHBondContact O-NE2 2.84Å; S160-G213 CarbonylContact O-C 3.56Å; S160-G213 WeakPolarHBondContact O-CA 3.26Å; S160-G213 PolarHBondContact O-N 2.97Å
161	F	87.4	Confident	89.6	Confident	51 Å²	51	46.1 Å²	46.1	22%	0.224	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93	-17.8	-176.5	-58.9	-33.2	0	0	0	112.8	D121 N123 D157 S158 D212	D121-F161 HydrophobicContact CB-CD2 3.82Å; D121-F161 HydrophobicContact CB-CE2 4.13Å; N123-F161 HydrophobicContact CB-CB 4.14Å; N123-F161 HydrophobicContact CB-CD1 3.81Å; N123-F161 HydrophobicContact CB-CD2 4.22Å; N123-F161 HydrophobicContact CB-CE1 4.27Å; N123-F161 HydrophobicContact CB-CG 3.8Å; N123-F161 VanDerWaalsContact OD1-CB 3.31Å; N123-F161 WeakPolarHBondContact OD1-CB 3.34Å; N123-F161 WeakPolarHBondContact OD1-CD1 3.43Å; N123-F161 WeakPolarHBondContact OD1-CG 3.28Å; D157-F161 HydrophobicContact CB-CB 3.74Å; S158-F161 PolarHBondContact O-N 3.01Å; F161-D212 WeakPolarHBondContact O-CB 3.36Å
162	G	87.2	Confident	89.8	Confident	9 Å²	9	48 Å²	48	9%	0.093	28%	0.275	C	S	.	.	S	Bend	trans	-67	169.6	161.3	0	0	0	0	0	112.6	D157 S158 Q164	D157-G162 WeakPolarHBondContact O-CA 3.1Å; D157-G162 PolarHBondContact O-N 3Å; S158-G162 PolarHBondContact O-N 3.18Å; G162-Q164 WeakPolarHBondContact O-CG 3.29Å; G162-Q164 PolarHBondContact O-N 2.76Å; G162-Q164 PolarHBondContact O-NE2 3.27Å
163	V	90.7	Very high	89.9	Confident	16 Å²	16	47.9 Å²	47.9	10%	0.097	27%	0.271	C	S	.	.			trans	-51.4	118.1	-175.6	-168.4	0	0	0	0	113.5	P127 A153 D155 Y166 R186 A210	P127-V163 HydrophobicContact CB-CG2 4.13Å; P127-V163 HydrophobicContact CG-CG2 4.31Å; A153-V163 HydrophobicContact CB-CG2 4.14Å; D155-V163 HydrophobicContact CB-CG2 3.67Å; V163-Y166 HydrophobicContact CG1-CD2 4.44Å; V163-Y166 HydrophobicContact CG1-CE1 4.41Å; V163-Y166 HydrophobicContact CG1-CE2 3.82Å; V163-R186 WeakPolarHBondContact O-CD 3.16Å; V163-A210 HydrophobicContact CG1-CB 4.09Å
164	Q	89.4	Confident	90.1	Very high	41 Å²	41	47.8 Å²	47.8	19%	0.192	27%	0.269	C	S	.	.			trans	-102.7	-31.3	179	-59.6	-54.5	-52.3	0	0	113.7	G159 S160 G162 R186 L211	G159-Q164 PolarHBondContact O-NE2 2.59Å; S160-Q164 WeakPolarHBondContact O-CG 3.42Å; S160-Q164 PolarHBondContact O-NE2 2.84Å; G162-Q164 WeakPolarHBondContact O-CG 3.29Å; G162-Q164 PolarHBondContact O-N 2.76Å; G162-Q164 PolarHBondContact O-NE2 3.27Å; Q164-R186 WeakPolarHBondContact O-CD 3.1Å; Q164-R186 PolarHBondContact O-NE 2.9Å; Q164-R186 PolarHBondContact O-NH1 3.21Å; Q164-R186 VanDerWaalsContact OE1-CZ 3.31Å; Q164-L211 PolarHBondContact N-O 2.68Å
165	T	91.2	Very high	90.2	Very high	47 Å²	47	42.9 Å²	42.9	29%	0.288	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	161.4	-178.6	-167.4	0	0	0	0	113.3	I178 A210 L211	T165-I178 VanDerWaalsContact OG1-CD1 3.25Å; T165-I178 WeakPolarHBondContact OG1-CD1 3.24Å; T165-A210 WeakPolarHBondContact O-CA 3.45Å; T165-L211 HydrophobicContact CG2-CB 3.91Å; T165-L211 HydrophobicContact CG2-CD1 3.96Å; T165-L211 HydrophobicContact CG2-CG 4.49Å; T165-L211 PolarHBondContact N-O 2.7Å; T165-L211 VanDerWaalsContact N-O 3.16Å; T165-L211 PolarHBondContact O-N 2.9Å
166	Y	93.5	Very high	90.4	Very high	10 Å²	10	44.6 Å²	44.6	4%	0.039	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	130.2	173.5	-64.2	-98.8	0	0	0	109.1	F129 S152 A153 V163 I178 R186 A188 I208 T209 A210	F129-Y166 HydrophobicContact CE1-CE1 4.14Å; F129-Y166 HydrophobicContact CZ-CD1 4.2Å; F129-Y166 HydrophobicContact CZ-CE1 4.08Å; S152-Y166 WeakPolarHBondContact CA-OH 3.15Å; A153-Y166 HydrophobicContact CB-CE1 3.91Å; A153-Y166 PolarHBondContact N-OH 2.96Å; V163-Y166 HydrophobicContact CG1-CD2 4.44Å; V163-Y166 HydrophobicContact CG1-CE1 4.41Å; V163-Y166 HydrophobicContact CG1-CE2 3.82Å; Y166-I178 HydrophobicContact CD2-CG1 4.38Å; Y166-I178 HydrophobicContact CD2-CG2 4.41Å; Y166-R186 HydrophobicContact CE2-CB 4.34Å; Y166-R186 WeakPolarHBondContact CE2-O 3.47Å; Y166-R186 PolarHBondContact OH-O 2.95Å; Y166-A188 HydrophobicContact CD1-CB 4.36Å; Y166-A188 HydrophobicContact CD2-CB 4.1Å; Y166-A188 HydrophobicContact CG-CB 3.96Å; Y166-I208 HydrophobicContact CD1-CG2 4.23Å; Y166-T209 CarbonylContact C-O 3.5Å; Y166-T209 WeakPolarHBondContact CA-O 3.48Å; Y166-A210 HydrophobicContact CD1-CB 3.88Å; Y166-A210 HydrophobicContact CE1-CB 3.86Å
167	E	92.8	Very high	90.6	Very high	108 Å²	108	46.7 Å²	46.7	51%	0.505	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	127.5	177.6	-64	-175.7	168.9	0	0	109.8	I208 T209 L211	E167-I208 CarbonylContact O-C 3.6Å; E167-I208 WeakPolarHBondContact O-CA 3.34Å; E167-T209 PolarHBondContact N-O 2.66Å; E167-T209 PolarHBondContact O-N 3.24Å; E167-L211 HydrophobicContact CB-CD1 4.39Å; E167-L211 HydrophobicContact CG-CD1 3.88Å
168	L	94.5	Very high	90.8	Very high	28 Å²	28	49.5 Å²	49.5	15%	0.147	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	154.2	170.6	-173.8	61.2	0	0	0	109.7	P170 F174 L176 L190 F206 I208 L224	L168-P170 WeakPolarHBondContact O-CD 3.32Å; L168-F174 HydrophobicContact CD2-CB 3.95Å; L168-F174 WeakPolarHBondContact CD2-O 3.48Å; L168-L176 HydrophobicContact CB-CD1 3.77Å; L168-L176 HydrophobicContact CB-CG 3.83Å; L168-L176 HydrophobicContact CD2-CG 4.43Å; L168-L190 HydrophobicContact CD2-CD1 3.94Å; L168-F206 HydrophobicContact CD1-CB 3.79Å; L168-F206 HydrophobicContact CD1-CG 4.42Å; L168-I208 HydrophobicContact CD1-CG1 3.74Å; L168-L224 HydrophobicContact CD1-CD2 4.04Å
169	T	93.3	Very high	90.9	Very high	49 Å²	49	51.9 Å²	51.9	30%	0.301	30%	0.295	S	S	.	.	P	Polyproline II helix	trans	-54.9	124.8	168.8	-59.3	0	0	0	0	109.8	N171 R207	T169-N171 PolarHBondContact O-N 3.21Å; T169-N171 PolarHBondContact O-ND2 2.81Å; T169-R207 PolarHBondContact N-O 2.87Å; T169-R207 PolarHBondContact OG1-N 2.97Å; T169-R207 PolarHBondContact OG1-O 2.88Å
170	P	91.4	Very high	91.2	Very high	133 Å²	133	53.2 Å²	53.2	86%	0.864	29%	0.291	S	S	*	.	S	Bend	trans	-55.4	123.2	-176	-29.1	36	0	0	0	112.4	L168	L168-P170 WeakPolarHBondContact O-CD 3.32Å
171	N	92.1	Very high	91	Very high	50 Å²	50	55.9 Å²	55.9	27%	0.267	29%	0.292	S	S	.	.			trans	-155.4	173.1	-177.3	79.6	95.5	0	0	0	108.9	T169 L173 F174 F206	T169-N171 PolarHBondContact O-N 3.21Å; T169-N171 PolarHBondContact O-ND2 2.81Å; N171-L173 PolarHBondContact OD1-N 2.92Å; N171-F174 PolarHBondContact ND2-O 2.81Å; N171-F174 PolarHBondContact OD1-N 2.97Å; N171-F174 PolarHBondContact OD1-O 2.79Å; N171-F206 HydrophobicContact CB-CD1 4.34Å; N171-F206 HydrophobicContact CB-CE1 3.6Å; N171-F206 HydrophobicContact CB-CZ 4.13Å
172	E	91	Very high	90.5	Very high	138 Å²	138	58 Å²	58	65%	0.645	33%	0.328	S	S	*	.	S	Bend	trans	-108.7	-2.2	-177.3	-59.7	-169.2	-174.9	0	0	114.9	K194	E172-K194 HydrophobicContact CB-CD 4.41Å; E172-K194 WeakPolarHBondContact O-CD 3.42Å; E172-K194 VanDerWaalsContact O-CE 3.29Å; E172-K194 WeakPolarHBondContact O-CE 3.45Å; E172-K194 VanDerWaalsContact O-CG 3.3Å; E172-K194 WeakPolarHBondContact O-CG 3.48Å; E172-K194 IonicContact OE2-NZ 2.9Å; E172-K194 PolarHBondContact OE2-NZ 2.86Å
173	L	92.4	Very high	89.8	Confident	38 Å²	38	63.1 Å²	63.1	20%	0.199	35%	0.353	C	S	.	.	S	Bend	trans	-102.6	-32.1	-172.7	-61.1	176.5	0	0	0	112.6	N171 E193 K194 L196 Y204	N171-L173 PolarHBondContact OD1-N 2.92Å; L173-E193 PolarHBondContact O-N 2.79Å; L173-K194 HydrophobicContact CD2-CB 4.02Å; L173-K194 HydrophobicContact CD2-CD 4.35Å; L173-K194 PolarHBondContact O-N 3.16Å; L173-L196 HydrophobicContact CB-CD2 4.25Å; L173-L196 HydrophobicContact CD1-CD2 4.43Å; L173-Y204 HydrophobicContact CD1-CD1 4.02Å; L173-Y204 HydrophobicContact CD1-CE1 3.29Å; L173-Y204 HydrophobicContact CD1-CE2 4.31Å; L173-Y204 VanDerWaalsContact CD1-CZ 3.46Å
174	F	94.6	Very high	89	Confident	6 Å²	6	64.7 Å²	64.7	3%	0.026	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	128.9	-173.3	-56.1	-82.6	0	0	0	112.1	I138 L168 N171 L190 V191 V192 L196 Y204 F206 I226	I138-F174 HydrophobicContact CD1-CE1 3.82Å; I138-F174 HydrophobicContact CD1-CZ 4.41Å; L168-F174 HydrophobicContact CD2-CB 3.95Å; L168-F174 WeakPolarHBondContact CD2-O 3.48Å; N171-F174 PolarHBondContact ND2-O 2.81Å; N171-F174 PolarHBondContact OD1-N 2.97Å; N171-F174 PolarHBondContact OD1-O 2.79Å; F174-L190 HydrophobicContact CB-CD1 3.94Å; F174-L190 HydrophobicContact CB-CG 4.36Å; F174-L190 HydrophobicContact CD1-CD1 4.49Å; F174-L190 HydrophobicContact CD1-CD2 3.83Å; F174-L190 HydrophobicContact CD1-CG 4.1Å; F174-L190 HydrophobicContact CE1-CD2 4.31Å; F174-L190 HydrophobicContact CG-CD1 4.49Å; F174-L190 HydrophobicContact CG-CD2 4.48Å; F174-V191 CarbonylContact C-O 3.55Å; F174-V191 VanDerWaalsContact CA-O 3.26Å; F174-V191 WeakPolarHBondContact CA-O 3.4Å; F174-V192 HydrophobicContact CD1-CG2 4.36Å; F174-V192 HydrophobicContact CE1-CG2 4.2Å; F174-L196 HydrophobicContact CE1-CD1 3.97Å; F174-L196 HydrophobicContact CE1-CD2 4.03Å; F174-L196 HydrophobicContact CE2-CD2 3.99Å; F174-L196 HydrophobicContact CZ-CD1 3.74Å; F174-L196 HydrophobicContact CZ-CD2 3.45Å; F174-L196 VanDerWaalsContact CZ-CD2 3.45Å; F174-L196 HydrophobicContact CZ-CG 4.25Å; F174-Y204 HydrophobicContact CE2-CD2 4.31Å; F174-Y204 HydrophobicContact CE2-CG 4.4Å; F174-F206 HydrophobicContact CD2-CD2 4.42Å; F174-F206 AromaticContact CD2-CE2 3.47Å; F174-F206 HydrophobicContact CD2-CE2 3.47Å; F174-F206 VanDerWaalsContact CD2-CE2 3.47Å; F174-F206 AromaticContact CD2-CZ 3.9Å; F174-F206 HydrophobicContact CD2-CZ 3.9Å; F174-F206 AromaticContact CE2-CE2 3.76Å; F174-F206 HydrophobicContact CE2-CE2 3.76Å; F174-F206 HydrophobicContact CE2-CZ 4.26Å; F174-F206 HydrophobicContact CG-CE2 4.49Å; F174-I226 HydrophobicContact CD1-CD1 4.01Å; F174-I226 HydrophobicContact CD2-CD1 3.94Å; F174-I226 HydrophobicContact CE1-CD1 3.76Å; F174-I226 HydrophobicContact CE2-CD1 3.69Å; F174-I226 HydrophobicContact CG-CD1 4.09Å; F174-I226 HydrophobicContact CZ-CD1 3.59Å; F174-I226 HydrophobicContact CZ-CG2 4.05Å
175	G	93.2	Very high	88.5	Confident	15 Å²	15	64.6 Å²	64.6	16%	0.155	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	175.5	169.7	0	0	0	0	0	112.2	V191	G175-V191 PolarHBondContact N-O 2.85Å; G175-V191 PolarHBondContact O-N 2.88Å
176	L	94.1	Very high	88.3	Confident	39 Å²	39	66.4 Å²	66.4	20%	0.204	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	128.1	167.2	-66.1	-179.3	0	0	0	109.8	L150 L168 A188 E189 L190 I208	L150-L176 HydrophobicContact CD1-CD2 3.51Å; L168-L176 HydrophobicContact CB-CD1 3.77Å; L168-L176 HydrophobicContact CB-CG 3.83Å; L168-L176 HydrophobicContact CD2-CG 4.43Å; L176-A188 HydrophobicContact CD2-CB 4.3Å; L176-E189 WeakPolarHBondContact CA-O 3.5Å; L176-L190 HydrophobicContact CD2-CD1 3.87Å; L176-I208 HydrophobicContact CD1-CG2 4.44Å
177	E	92.5	Very high	88.1	Confident	68 Å²	68	67.7 Å²	67.7	32%	0.318	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	118.7	165.5	-169.1	178.5	116.9	0	0	109.7	R147 K179 A188 E189 V191	R147-E177 IonicContact CZ-OE1 3.37Å; R147-E177 IonicContact CZ-OE2 3.63Å; R147-E177 IonicContact NH1-OE1 3.27Å; R147-E177 PolarHBondContact NH1-OE1 3.3Å; R147-E177 IonicContact NH1-OE2 2.68Å; R147-E177 PolarHBondContact NH1-OE2 2.76Å; R147-E177 IonicContact NH2-OE1 2.74Å; R147-E177 IonicContact NH2-OE2 3.87Å; R147-E177 PolarHBondContact NH2-OE2 3.12Å; E177-K179 WeakPolarHBondContact OE1-CE 3.23Å; E177-K179 IonicContact OE1-NZ 3.81Å; E177-A188 WeakPolarHBondContact O-CA 3.45Å; E177-E189 PolarHBondContact N-O 2.98Å; E177-E189 PolarHBondContact O-N 2.91Å; E177-V191 HydrophobicContact CB-CG2 3.87Å
178	I	92.5	Very high	88	Confident	60 Å²	60	62.6 Å²	62.6	31%	0.308	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	124.8	180	-56.7	164	0	0	0	109	T165 Y166 R186 F187	T165-I178 VanDerWaalsContact OG1-CD1 3.25Å; T165-I178 WeakPolarHBondContact OG1-CD1 3.24Å; Y166-I178 HydrophobicContact CD2-CG1 4.38Å; Y166-I178 HydrophobicContact CD2-CG2 4.41Å; I178-R186 HydrophobicContact CG2-CB 4.25Å; I178-F187 WeakPolarHBondContact CA-O 3.48Å
179	K	88.6	Confident	88	Confident	62 Å²	62	62.7 Å²	62.7	27%	0.27	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	145.5	178.4	-67.3	-174.8	-174.6	173.3	0	111.4	E177 R186 F187 E189	E177-K179 WeakPolarHBondContact OE1-CE 3.23Å; E177-K179 IonicContact OE1-NZ 3.81Å; K179-R186 WeakPolarHBondContact O-CA 3.33Å; K179-F187 HydrophobicContact CB-CD1 4.2Å; K179-F187 HydrophobicContact CB-CE1 3.61Å; K179-F187 HydrophobicContact CB-CE2 4.06Å; K179-F187 HydrophobicContact CB-CZ 3.54Å; K179-F187 HydrophobicContact CD-CE2 4.3Å; K179-F187 HydrophobicContact CD-CZ 4.02Å; K179-F187 HydrophobicContact CG-CZ 4.4Å; K179-F187 PolarHBondContact N-O 2.87Å; K179-F187 VanDerWaalsContact O-CD1 3.25Å; K179-F187 WeakPolarHBondContact O-CD1 3.27Å; K179-F187 PolarHBondContact O-N 2.87Å; K179-E189 WeakPolarHBondContact CD-OE1 3.02Å; K179-E189 VanDerWaalsContact CE-CD 3.49Å; K179-E189 WeakPolarHBondContact CE-OE1 3.45Å; K179-E189 WeakPolarHBondContact CE-OE2 3.25Å; K179-E189 IonicContact NZ-OE1 3.18Å; K179-E189 PolarHBondContact NZ-OE1 2.9Å; K179-E189 IonicContact NZ-OE2 2.74Å; K179-E189 PolarHBondContact NZ-OE2 3.46Å
180	T	87.3	Confident	88.1	Confident	87 Å²	87	60.3 Å²	60.3	53%	0.534	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	129.5	177.7	-45.2	0	0	0	0	109.7	G184 S185 R186	T180-G184 WeakPolarHBondContact CG2-O 3.45Å; T180-S185 CarbonylContact C-O 3.58Å; T180-S185 WeakPolarHBondContact CA-O 3.47Å; T180-R186 HydrophobicContact CG2-CG 4.38Å
181	R	81.9	Confident	88.2	Confident	119 Å²	119	54.5 Å²	54.5	45%	0.449	31%	0.307	S	S	.	.			trans	-77.1	166	172.7	-67.8	-176.5	-174	158.5	2.9	111	D183 G184 S185 F187	R181-D183 VanDerWaalsContact CB-OD1 3.27Å; R181-D183 WeakPolarHBondContact CB-OD1 3.35Å; R181-D183 PolarHBondContact O-N 3.5Å; R181-D183 VanDerWaalsContact O-N 3.11Å; R181-G184 PolarHBondContact O-N 2.92Å; R181-S185 PolarHBondContact N-O 2.84Å; R181-F187 HydrophobicContact CG-CD1 3.7Å; R181-F187 HydrophobicContact CG-CE1 3.59Å
182	G	75.4	Confident	88.4	Confident	95 Å²	95	52.1 Å²	52.1	98%	0.979	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-10	178.4	0	0	0	0	0	115.3
183	D	72.8	Confident	88.5	Confident	117 Å²	117	50.8 Å²	50.8	63%	0.626	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.4	-7.3	172	53.2	32.7	0	0	0	113.5	R181 S185	R181-D183 VanDerWaalsContact CB-OD1 3.27Å; R181-D183 WeakPolarHBondContact CB-OD1 3.35Å; R181-D183 PolarHBondContact O-N 3.5Å; R181-D183 VanDerWaalsContact O-N 3.11Å; D183-S185 VanDerWaalsContact OD1-CB 3.24Å; D183-S185 WeakPolarHBondContact OD1-CB 3.48Å; D183-S185 PolarHBondContact OD1-N 2.84Å; D183-S185 PolarHBondContact OD1-OG 3.11Å
184	G	74.3	Confident	88.5	Confident	49 Å²	49	53.2 Å²	53.2	51%	0.505	30%	0.297	S	S	.	.	S	Bend	trans	93.7	-9.4	-176.3	0	0	0	0	0	115	T180 R181	T180-G184 WeakPolarHBondContact CG2-O 3.45Å; R181-G184 PolarHBondContact O-N 2.92Å
185	S	79.2	Confident	88.4	Confident	38 Å²	38	57 Å²	57	27%	0.266	32%	0.324	S	S	.	.			trans	-69.2	146.1	176.7	67	0	0	0	0	111.8	T180 R181 D183	T180-S185 CarbonylContact C-O 3.58Å; T180-S185 WeakPolarHBondContact CA-O 3.47Å; R181-S185 PolarHBondContact N-O 2.84Å; D183-S185 VanDerWaalsContact OD1-CB 3.24Å; D183-S185 WeakPolarHBondContact OD1-CB 3.48Å; D183-S185 PolarHBondContact OD1-N 2.84Å; D183-S185 PolarHBondContact OD1-OG 3.11Å
186	R	86.9	Confident	88.5	Confident	86 Å²	86	56.8 Å²	56.8	33%	0.325	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	136.2	-179.3	-57.5	-174	-166.2	-146.7	2.5	111.5	V163 Q164 Y166 I178 K179 T180	V163-R186 WeakPolarHBondContact O-CD 3.16Å; Q164-R186 WeakPolarHBondContact O-CD 3.1Å; Q164-R186 PolarHBondContact O-NE 2.9Å; Q164-R186 PolarHBondContact O-NH1 3.21Å; Q164-R186 VanDerWaalsContact OE1-CZ 3.31Å; Y166-R186 HydrophobicContact CE2-CB 4.34Å; Y166-R186 WeakPolarHBondContact CE2-O 3.47Å; Y166-R186 PolarHBondContact OH-O 2.95Å; I178-R186 HydrophobicContact CG2-CB 4.25Å; K179-R186 WeakPolarHBondContact O-CA 3.33Å; T180-R186 HydrophobicContact CG2-CG 4.38Å
187	F	89.3	Confident	88.5	Confident	36 Å²	36	58 Å²	58	16%	0.158	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	163.5	173.5	68.1	-77.9	0	0	0	110	I178 K179 R181 E189	I178-F187 WeakPolarHBondContact CA-O 3.48Å; K179-F187 HydrophobicContact CB-CD1 4.2Å; K179-F187 HydrophobicContact CB-CE1 3.61Å; K179-F187 HydrophobicContact CB-CE2 4.06Å; K179-F187 HydrophobicContact CB-CZ 3.54Å; K179-F187 HydrophobicContact CD-CE2 4.3Å; K179-F187 HydrophobicContact CD-CZ 4.02Å; K179-F187 HydrophobicContact CG-CZ 4.4Å; K179-F187 PolarHBondContact N-O 2.87Å; K179-F187 VanDerWaalsContact O-CD1 3.25Å; K179-F187 WeakPolarHBondContact O-CD1 3.27Å; K179-F187 PolarHBondContact O-N 2.87Å; R181-F187 HydrophobicContact CG-CD1 3.7Å; R181-F187 HydrophobicContact CG-CE1 3.59Å; F187-E189 HydrophobicContact CE2-CG 4.3Å
188	A	91.8	Very high	88.6	Confident	2 Å²	2	56.2 Å²	56.2	2%	0.017	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	146	176.9	0	0	0	0	0	111.1	L150 Y166 L176 E177	L150-A188 WeakPolarHBondContact CB-O 3.24Å; L150-A188 HydrophobicContact CD1-CB 4.08Å; L150-A188 PolarHBondContact N-O 2.9Å; L150-A188 VanDerWaalsContact N-O 3.12Å; Y166-A188 HydrophobicContact CD1-CB 4.36Å; Y166-A188 HydrophobicContact CD2-CB 4.1Å; Y166-A188 HydrophobicContact CG-CB 3.96Å; L176-A188 HydrophobicContact CD2-CB 4.3Å; E177-A188 WeakPolarHBondContact O-CA 3.45Å
189	E	93.8	Very high	88.7	Confident	29 Å²	29	56.4 Å²	56.4	14%	0.136	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	132.4	159.6	-73.2	169.3	-163.6	0	0	108	R147 I148 L176 E177 K179 F187	R147-E189 WeakPolarHBondContact CD-OE2 3.38Å; R147-E189 IonicContact NH1-OE2 2.74Å; I148-E189 CarbonylContact O-C 3.59Å; I148-E189 VanDerWaalsContact O-CA 3.32Å; I148-E189 WeakPolarHBondContact O-CA 3.4Å; L176-E189 WeakPolarHBondContact CA-O 3.5Å; E177-E189 PolarHBondContact N-O 2.98Å; E177-E189 PolarHBondContact O-N 2.91Å; K179-E189 WeakPolarHBondContact CD-OE1 3.02Å; K179-E189 VanDerWaalsContact CE-CD 3.49Å; K179-E189 WeakPolarHBondContact CE-OE1 3.45Å; K179-E189 WeakPolarHBondContact CE-OE2 3.25Å; K179-E189 IonicContact NZ-OE1 3.18Å; K179-E189 PolarHBondContact NZ-OE1 2.9Å; K179-E189 IonicContact NZ-OE2 2.74Å; K179-E189 PolarHBondContact NZ-OE2 3.46Å; F187-E189 HydrophobicContact CE2-CG 4.3Å
190	L	94.8	Very high	88.9	Confident	0 Å²	0	58.6 Å²	58.6	0%	0	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71	128.2	166.7	-167.6	75	0	0	0	108.1	L136 I138 R147 I148 L150 L168 F174 L176 L224 I226	L136-L190 HydrophobicContact CD1-CD2 3.7Å; I138-L190 HydrophobicContact CD1-CD2 4.14Å; R147-L190 CarbonylContact C-O 3.55Å; R147-L190 WeakPolarHBondContact CA-O 3.4Å; I148-L190 HydrophobicContact CB-CB 4.37Å; I148-L190 PolarHBondContact N-O 2.67Å; I148-L190 PolarHBondContact O-N 2.92Å; L150-L190 HydrophobicContact CD1-CB 4.05Å; L150-L190 HydrophobicContact CD2-CB 4.21Å; L150-L190 HydrophobicContact CG-CB 4.15Å; L168-L190 HydrophobicContact CD2-CD1 3.94Å; F174-L190 HydrophobicContact CB-CD1 3.94Å; F174-L190 HydrophobicContact CB-CG 4.36Å; F174-L190 HydrophobicContact CD1-CD1 4.49Å; F174-L190 HydrophobicContact CD1-CD2 3.83Å; F174-L190 HydrophobicContact CD1-CG 4.1Å; F174-L190 HydrophobicContact CE1-CD2 4.31Å; F174-L190 HydrophobicContact CG-CD1 4.49Å; F174-L190 HydrophobicContact CG-CD2 4.48Å; L176-L190 HydrophobicContact CD2-CD1 3.87Å; L190-L224 HydrophobicContact CD1-CD2 4.05Å; L190-L224 HydrophobicContact CD2-CD2 4.43Å; L190-I226 HydrophobicContact CD2-CD1 3.76Å
191	V	94.7	Very high	89.2	Confident	11 Å²	11	58.9 Å²	58.9	7%	0.067	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	128.8	177.2	-176.2	0	0	0	0	108.8	T146 R147 F174 G175 E177 E193	T146-V191 WeakPolarHBondContact O-CA 3.36Å; R147-V191 HydrophobicContact CG-CG2 4.48Å; F174-V191 CarbonylContact C-O 3.55Å; F174-V191 VanDerWaalsContact CA-O 3.26Å; F174-V191 WeakPolarHBondContact CA-O 3.4Å; G175-V191 PolarHBondContact N-O 2.85Å; G175-V191 PolarHBondContact O-N 2.88Å; E177-V191 HydrophobicContact CB-CG2 3.87Å; V191-E193 PolarHBondContact O-N 2.82Å
192	V	94.9	Very high	89.7	Confident	0 Å²	0	56 Å²	56	0%	0	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	109.4	171	179	0	0	0	0	107.7	P144 G145 T146 F174 K194 L196	P144-V192 CarbonylContact C-O 3.5Å; P144-V192 WeakPolarHBondContact CA-O 3.49Å; G145-V192 PolarHBondContact N-O 2.9Å; T146-V192 HydrophobicContact CG2-CG2 4.37Å; T146-V192 PolarHBondContact O-N 2.9Å; F174-V192 HydrophobicContact CD1-CG2 4.36Å; F174-V192 HydrophobicContact CE1-CG2 4.2Å; V192-K194 WeakPolarHBondContact CG1-O 3.25Å; V192-L196 HydrophobicContact CG1-CG 4.43Å
193	E	93.2	Very high	90.7	Very high	109 Å²	109	55.6 Å²	55.6	51%	0.509	30%	0.301	S	S	.	.			trans	-90.5	-25.4	-175.2	-64.4	-70.5	174.9	0	0	112.5	L173 V191	L173-E193 PolarHBondContact O-N 2.79Å; V191-E193 PolarHBondContact O-N 2.82Å
194	K	93.1	Very high	91.7	Very high	89 Å²	89	51.1 Å²	51.1	39%	0.387	28%	0.275	S	S	.	.	S	Bend	trans	-134.7	157.6	175.6	-66.2	-175.7	-175.2	-174.1	0	110	E172 L173 V192	E172-K194 HydrophobicContact CB-CD 4.41Å; E172-K194 WeakPolarHBondContact O-CD 3.42Å; E172-K194 VanDerWaalsContact O-CE 3.29Å; E172-K194 WeakPolarHBondContact O-CE 3.45Å; E172-K194 VanDerWaalsContact O-CG 3.3Å; E172-K194 WeakPolarHBondContact O-CG 3.48Å; E172-K194 IonicContact OE2-NZ 2.9Å; E172-K194 PolarHBondContact OE2-NZ 2.86Å; L173-K194 HydrophobicContact CD2-CB 4.02Å; L173-K194 HydrophobicContact CD2-CD 4.35Å; L173-K194 PolarHBondContact O-N 3.16Å; V192-K194 WeakPolarHBondContact CG1-O 3.25Å
195	S	92.7	Very high	92.6	Very high	85 Å²	85	53 Å²	53	59%	0.594	28%	0.28	S	S	*	.			trans	-56	141.1	169.9	48.2	0	0	0	0	110.2
196	L	93.9	Very high	93.4	Very high	11 Å²	11	52.5 Å²	52.5	6%	0.058	27%	0.273	C	S	.	.			trans	-92.2	170.1	171.2	-51.4	176.8	0	0	0	109.1	I138 E140 L173 F174 V192 V228	I138-L196 HydrophobicContact CB-CD1 4.3Å; I138-L196 HydrophobicContact CG2-CD1 3.82Å; E140-L196 HydrophobicContact CB-CB 4.12Å; L173-L196 HydrophobicContact CB-CD2 4.25Å; L173-L196 HydrophobicContact CD1-CD2 4.43Å; F174-L196 HydrophobicContact CE1-CD1 3.97Å; F174-L196 HydrophobicContact CE1-CD2 4.03Å; F174-L196 HydrophobicContact CE2-CD2 3.99Å; F174-L196 HydrophobicContact CZ-CD1 3.74Å; F174-L196 HydrophobicContact CZ-CD2 3.45Å; F174-L196 VanDerWaalsContact CZ-CD2 3.45Å; F174-L196 HydrophobicContact CZ-CG 4.25Å; V192-L196 HydrophobicContact CG1-CG 4.43Å; L196-V228 HydrophobicContact CB-CG1 4.49Å
197	D	94.5	Very high	93.7	Very high	64 Å²	64	55.1 Å²	55.1	34%	0.342	28%	0.283	S	S	.	.			trans	-161.5	110.1	-172.5	166.2	-16.4	0	0	0	105.7	E199 T200 Q201	D197-E199 PolarHBondContact OD1-N 2.92Å; D197-T200 WeakPolarHBondContact OD1-CB 3.4Å; D197-T200 PolarHBondContact OD1-N 3.03Å; D197-T200 PolarHBondContact OD1-OG1 3.2Å; D197-T200 VanDerWaalsContact OD2-CB 3.29Å; D197-T200 WeakPolarHBondContact OD2-CB 3.32Å; D197-T200 PolarHBondContact OD2-OG1 2.85Å; D197-Q201 PolarHBondContact O-N 3.3Å; D197-Q201 VanDerWaalsContact O-N 3.1Å
198	R	95.3	Very high	93.9	Very high	31 Å²	31	53.5 Å²	53.5	12%	0.117	28%	0.276	C	S	.	.	H	α-helix	trans	-77.8	-33.2	-175.3	-176.7	-149.4	68.4	105.3	3.9	111.5	E140 T200 Q201 S202 V228 D230 P265 E267	E140-R198 WeakPolarHBondContact OE2-CB 3.4Å; E140-R198 PolarHBondContact OE2-N 2.68Å; R198-T200 VanDerWaalsContact C-N 3.31Å; R198-T200 PolarHBondContact O-N 2.85Å; R198-Q201 CarbonylContact O-C 3.46Å; R198-Q201 PolarHBondContact O-N 2.92Å; R198-S202 VanDerWaalsContact CG-CB 3.48Å; R198-S202 PolarHBondContact O-N 2.85Å; R198-V228 HydrophobicContact CB-CB 4.15Å; R198-V228 HydrophobicContact CB-CG1 3.84Å; R198-V228 HydrophobicContact CG-CB 4.28Å; R198-V228 HydrophobicContact CG-CG1 4.41Å; R198-D230 WeakPolarHBondContact CD-OD1 3.43Å; R198-D230 IonicContact CZ-OD1 3.65Å; R198-D230 IonicContact NE-OD1 2.73Å; R198-D230 PolarHBondContact NE-OD1 2.91Å; R198-D230 IonicContact NH2-OD1 3.94Å; R198-P265 PolarHBondContact NH2-O 3.16Å; R198-E267 IonicContact CZ-OE2 2.66Å; R198-E267 IonicContact NH1-OE2 3.08Å; R198-E267 PolarHBondContact NH1-OE2 2.85Å
199	E	95	Very high	94	Very high	64 Å²	64	54.4 Å²	54.4	30%	0.299	28%	0.282	S	S	.	.	H	α-helix	trans	-64.1	-39.1	-179.7	-67.6	57.5	-115.2	0	0	110.5	D197 P265	D197-E199 PolarHBondContact OD1-N 2.92Å; E199-P265 HydrophobicContact CG-CB 3.85Å; E199-P265 HydrophobicContact CG-CG 4Å
200	T	93.1	Very high	94	Very high	109 Å²	109	53 Å²	53	67%	0.669	28%	0.275	S	S	*	.	H	α-helix	trans	-72.1	-51.4	169.7	-68.9	0	0	0	0	111.1	D197 R198	D197-T200 WeakPolarHBondContact OD1-CB 3.4Å; D197-T200 PolarHBondContact OD1-N 3.03Å; D197-T200 PolarHBondContact OD1-OG1 3.2Å; D197-T200 VanDerWaalsContact OD2-CB 3.29Å; D197-T200 WeakPolarHBondContact OD2-CB 3.32Å; D197-T200 PolarHBondContact OD2-OG1 2.85Å; R198-T200 VanDerWaalsContact C-N 3.31Å; R198-T200 PolarHBondContact O-N 2.85Å
201	Q	93.1	Very high	94	Very high	92 Å²	92	54.3 Å²	54.3	43%	0.43	28%	0.282	S	S	.	.	H	α-helix	trans	-157.3	101.7	177.4	-178	171.4	-11	0	0	114.3	D197 R198 H203 Y204	D197-Q201 PolarHBondContact O-N 3.3Å; D197-Q201 VanDerWaalsContact O-N 3.1Å; R198-Q201 CarbonylContact O-C 3.46Å; R198-Q201 PolarHBondContact O-N 2.92Å; Q201-H203 VanDerWaalsContact C-N 3.33Å; Q201-H203 WeakPolarHBondContact CG-O 3.4Å; Q201-H203 PolarHBondContact NE2-O 2.84Å; Q201-H203 PolarHBondContact O-N 3.29Å; Q201-Y204 HydrophobicContact CB-CE1 4.18Å; Q201-Y204 HydrophobicContact CB-CE2 4.47Å; Q201-Y204 HydrophobicContact CG-CD1 4.29Å; Q201-Y204 HydrophobicContact CG-CE1 3.81Å; Q201-Y204 HydrophobicContact CG-CE2 4.25Å; Q201-Y204 WeakPolarHBondContact O-CE2 3.45Å
202	S	93.1	Very high	93.8	Very high	58 Å²	58	54.1 Å²	54.1	41%	0.406	28%	0.28	S	S	.	.	S	Bend	trans	-71.6	-11.8	-179.1	66.1	0	0	0	0	116.7	R198 V228	R198-S202 VanDerWaalsContact CG-CB 3.48Å; R198-S202 PolarHBondContact O-N 2.85Å; S202-V228 PolarHBondContact O-N 2.97Å
203	H	95.3	Very high	93.5	Very high	87 Å²	87	55.9 Å²	55.9	40%	0.403	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	132.5	-178.9	-175.4	-85.1	0	0	0	113.2	Q201 I226	Q201-H203 VanDerWaalsContact C-N 3.33Å; Q201-H203 WeakPolarHBondContact CG-O 3.4Å; Q201-H203 PolarHBondContact NE2-O 2.84Å; Q201-H203 PolarHBondContact O-N 3.29Å; H203-I226 CarbonylContact C-O 3.6Å; H203-I226 WeakPolarHBondContact CA-O 3.48Å; H203-I226 PolarHBondContact CD2-O 2.72Å
204	Y	93.8	Very high	93.2	Very high	24 Å²	24	51.2 Å²	51.2	9%	0.094	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	148.2	175.7	-58	-90.7	0	0	0	111	L173 F174 Q201 F206 I226 V228	L173-Y204 HydrophobicContact CD1-CD1 4.02Å; L173-Y204 HydrophobicContact CD1-CE1 3.29Å; L173-Y204 HydrophobicContact CD1-CE2 4.31Å; L173-Y204 VanDerWaalsContact CD1-CZ 3.46Å; F174-Y204 HydrophobicContact CE2-CD2 4.31Å; F174-Y204 HydrophobicContact CE2-CG 4.4Å; Q201-Y204 HydrophobicContact CB-CE1 4.18Å; Q201-Y204 HydrophobicContact CB-CE2 4.47Å; Q201-Y204 HydrophobicContact CG-CD1 4.29Å; Q201-Y204 HydrophobicContact CG-CE1 3.81Å; Q201-Y204 HydrophobicContact CG-CE2 4.25Å; Q201-Y204 WeakPolarHBondContact O-CE2 3.45Å; Y204-F206 HydrophobicContact CD1-CE2 4.5Å; Y204-F206 HydrophobicContact CD1-CZ 4.12Å; Y204-F206 HydrophobicContact CG-CE2 4.22Å; Y204-F206 HydrophobicContact CG-CZ 4.29Å; Y204-I226 PolarHBondContact N-O 3.01Å; Y204-I226 PolarHBondContact O-N 3.38Å; Y204-V228 HydrophobicContact CD2-CG2 4.08Å; Y204-V228 HydrophobicContact CE2-CG2 3.72Å
205	S	94.2	Very high	92.8	Very high	87 Å²	87	54.9 Å²	54.9	61%	0.608	30%	0.304	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-132.3	122.8	173.6	-168.7	0	0	0	0	110.1	L224	S205-L224 WeakPolarHBondContact CA-O 3.2Å
206	F	94.3	Very high	92.6	Very high	28 Å²	28	55.8 Å²	55.8	12%	0.123	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	173.3	179.4	-56.8	-69.5	0	0	0	110.1	L168 N171 F174 Y204 L224 I226	L168-F206 HydrophobicContact CD1-CB 3.79Å; L168-F206 HydrophobicContact CD1-CG 4.42Å; N171-F206 HydrophobicContact CB-CD1 4.34Å; N171-F206 HydrophobicContact CB-CE1 3.6Å; N171-F206 HydrophobicContact CB-CZ 4.13Å; F174-F206 HydrophobicContact CD2-CD2 4.42Å; F174-F206 AromaticContact CD2-CE2 3.47Å; F174-F206 HydrophobicContact CD2-CE2 3.47Å; F174-F206 VanDerWaalsContact CD2-CE2 3.47Å; F174-F206 AromaticContact CD2-CZ 3.9Å; F174-F206 HydrophobicContact CD2-CZ 3.9Å; F174-F206 AromaticContact CE2-CE2 3.76Å; F174-F206 HydrophobicContact CE2-CE2 3.76Å; F174-F206 HydrophobicContact CE2-CZ 4.26Å; F174-F206 HydrophobicContact CG-CE2 4.49Å; Y204-F206 HydrophobicContact CD1-CE2 4.5Å; Y204-F206 HydrophobicContact CD1-CZ 4.12Å; Y204-F206 HydrophobicContact CG-CE2 4.22Å; Y204-F206 HydrophobicContact CG-CZ 4.29Å; F206-L224 HydrophobicContact CB-CB 4.37Å; F206-L224 HydrophobicContact CB-CD2 4.47Å; F206-L224 HydrophobicContact CD2-CD2 4.43Å; F206-L224 PolarHBondContact N-O 3.3Å; F206-L224 PolarHBondContact O-N 2.82Å; F206-I226 HydrophobicContact CD2-CD1 4.12Å; F206-I226 HydrophobicContact CE2-CD1 4.09Å
207	R	93.9	Very high	92.4	Very high	141 Å²	141	58.5 Å²	58.5	53%	0.532	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	132.3	168.3	-175.2	175.8	66.4	-134.6	-3.6	109.6	T169 T221 V222	T169-R207 PolarHBondContact N-O 2.87Å; T169-R207 PolarHBondContact OG1-N 2.97Å; T169-R207 PolarHBondContact OG1-O 2.88Å; R207-T221 HydrophobicContact CG-CG2 4.37Å; R207-V222 WeakPolarHBondContact CA-O 3.21Å
208	I	94.6	Very high	92.3	Very high	2 Å²	2	60.4 Å²	60.4	1%	0.01	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	139.2	167.6	-61	161.6	0	0	0	107.7	F129 I134 L150 Y166 E167 L168 L176 T221 V222 L224	F129-I208 HydrophobicContact CE1-CG2 4.46Å; F129-I208 HydrophobicContact CZ-CG2 3.85Å; I134-I208 HydrophobicContact CD1-CD1 4.24Å; L150-I208 HydrophobicContact CD1-CD1 3.92Å; L150-I208 HydrophobicContact CD2-CD1 4.41Å; Y166-I208 HydrophobicContact CD1-CG2 4.23Å; E167-I208 CarbonylContact O-C 3.6Å; E167-I208 WeakPolarHBondContact O-CA 3.34Å; L168-I208 HydrophobicContact CD1-CG1 3.74Å; L176-I208 HydrophobicContact CD1-CG2 4.44Å; I208-T221 VanDerWaalsContact O-CA 3.28Å; I208-T221 WeakPolarHBondContact O-CA 2.87Å; I208-V222 HydrophobicContact CB-CG1 3.96Å; I208-V222 HydrophobicContact CD1-CG1 4.4Å; I208-V222 PolarHBondContact N-O 2.93Å; I208-V222 PolarHBondContact O-N 3.48Å; I208-L224 HydrophobicContact CD1-CB 4.23Å; I208-L224 HydrophobicContact CD1-CD1 4.36Å; I208-L224 HydrophobicContact CD1-CD2 4.12Å; I208-L224 HydrophobicContact CD1-CG 4.48Å; I208-L224 HydrophobicContact CG1-CB 4.41Å; I208-L224 HydrophobicContact CG1-CD2 4.4Å
209	T	93.8	Very high	92.2	Very high	21 Å²	21	63.8 Å²	63.8	13%	0.129	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	122.2	174.1	-46.2	0	0	0	0	108.2	Y166 E167 L211 L219 G220 T221	Y166-T209 CarbonylContact C-O 3.5Å; Y166-T209 WeakPolarHBondContact CA-O 3.48Å; E167-T209 PolarHBondContact N-O 2.66Å; E167-T209 PolarHBondContact O-N 3.24Å; T209-L211 HydrophobicContact CG2-CD1 3.93Å; T209-L211 HydrophobicContact CG2-CG 4.28Å; T209-L219 HydrophobicContact CG2-CB 3.88Å; T209-L219 HydrophobicContact CG2-CD1 4.27Å; T209-L219 HydrophobicContact CG2-CG 4.49Å; T209-G220 CarbonylContact C-O 3.59Å; T209-G220 VanDerWaalsContact CA-O 3.29Å; T209-G220 WeakPolarHBondContact CA-O 2.97Å; T209-T221 HydrophobicContact CG2-CG2 3.94Å
210	A	93.8	Very high	92.1	Very high	0 Å²	0	61.2 Å²	61.2	0%	0	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	136.5	168.1	0	0	0	0	0	108.6	P127 F129 A153 V163 T165 Y166 L219 G220	P127-A210 HydrophobicContact CB-CB 3.7Å; P127-A210 HydrophobicContact CG-CB 4.45Å; F129-A210 HydrophobicContact CE2-CB 3.82Å; F129-A210 HydrophobicContact CZ-CB 3.75Å; A153-A210 HydrophobicContact CB-CB 3.51Å; V163-A210 HydrophobicContact CG1-CB 4.09Å; T165-A210 WeakPolarHBondContact O-CA 3.45Å; Y166-A210 HydrophobicContact CD1-CB 3.88Å; Y166-A210 HydrophobicContact CE1-CB 3.86Å; A210-L219 CarbonylContact O-C 3.5Å; A210-L219 VanDerWaalsContact O-CA 3.22Å; A210-L219 WeakPolarHBondContact O-CA 3.29Å; A210-G220 PolarHBondContact N-O 3.26Å; A210-G220 PolarHBondContact O-N 2.99Å
211	L	92.8	Very high	92.1	Very high	27 Å²	27	59.6 Å²	59.6	14%	0.141	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	143.3	178	-59.2	93.7	0	0	0	111	Q164 T165 E167 T209 R218 L219	Q164-L211 PolarHBondContact N-O 2.68Å; T165-L211 HydrophobicContact CG2-CB 3.91Å; T165-L211 HydrophobicContact CG2-CD1 3.96Å; T165-L211 HydrophobicContact CG2-CG 4.49Å; T165-L211 PolarHBondContact N-O 2.7Å; T165-L211 VanDerWaalsContact N-O 3.16Å; T165-L211 PolarHBondContact O-N 2.9Å; E167-L211 HydrophobicContact CB-CD1 4.39Å; E167-L211 HydrophobicContact CG-CD1 3.88Å; T209-L211 HydrophobicContact CG2-CD1 3.93Å; T209-L211 HydrophobicContact CG2-CG 4.28Å; L211-R218 WeakPolarHBondContact CA-O 3.26Å; L211-L219 HydrophobicContact CG-CB 4.24Å
212	D	91.9	Very high	92.2	Very high	7 Å²	7	55.4 Å²	55.4	4%	0.037	31%	0.31	C	S	.	.			trans	-76.6	-169.3	167.6	64.2	39.4	0	0	0	111.8	N123 P127 F161 G214 P217 R218	N123-D212 PolarHBondContact ND2-OD2 2.82Å; N123-D212 PolarHBondContact OD1-OD2 3.31Å; P127-D212 HydrophobicContact CG-CB 4.38Å; F161-D212 WeakPolarHBondContact O-CB 3.36Å; D212-G214 PolarHBondContact OD1-N 2.7Å; D212-P217 WeakPolarHBondContact OD1-CA 3.27Å; D212-P217 VanDerWaalsContact OD1-CB 3.23Å; D212-P217 WeakPolarHBondContact OD1-CB 3.23Å; D212-R218 PolarHBondContact N-O 3.28Å; D212-R218 PolarHBondContact OD1-N 2.72Å; D212-R218 VanDerWaalsContact OD2-CA 3.3Å; D212-R218 WeakPolarHBondContact OD2-CA 3.42Å; D212-R218 WeakPolarHBondContact OD2-CB 3.35Å; D212-R218 PolarHBondContact OD2-N 3.1Å
213	G	88.1	Confident	92.2	Very high	37 Å²	37	53.8 Å²	53.8	38%	0.381	30%	0.302	S	S	.	.	S	Bend	trans	-116.1	28.4	173	0	0	0	0	0	113.6	S160	S160-G213 CarbonylContact O-C 3.56Å; S160-G213 WeakPolarHBondContact O-CA 3.26Å; S160-G213 PolarHBondContact O-N 2.97Å
214	G	87.2	Confident	92.2	Very high	12 Å²	12	49.7 Å²	49.7	12%	0.124	28%	0.283	C	S	.	.			trans	-70.6	169	173.5	0	0	0	0	0	113.4	N123 D212 P216 P217	N123-G214 WeakPolarHBondContact OD1-CA 3.41Å; N123-G214 PolarHBondContact OD1-N 2.87Å; D212-G214 PolarHBondContact OD1-N 2.7Å; G214-P216 VanDerWaalsContact C-C 3.46Å; G214-P216 CarbonylContact C-O 3.59Å; G214-P216 CarbonylContact O-C 3.5Å; G214-P217 WeakPolarHBondContact O-CA 3.29Å; G214-P217 WeakPolarHBondContact O-CD 3.41Å; G214-P217 VanDerWaalsContact O-N 3.17Å
215	D	84.8	Confident	92.2	Very high	165 Å²	165	49.2 Å²	49.2	88%	0.882	28%	0.283	S	S	*	.	S	Bend	trans	-131.5	101.3	168.9	-175.2	15.4	0	0	0	109.4
216	P	87.7	Confident	92.2	Very high	105 Å²	105	45 Å²	45	68%	0.682	25%	0.254	S	S	*	.	S	Bend	cis	-71.1	151.7	-3.2	32.3	-36.3	0	0	0	112.2	G214	G214-P216 VanDerWaalsContact C-C 3.46Å; G214-P216 CarbonylContact C-O 3.59Å; G214-P216 CarbonylContact O-C 3.5Å
217	P	90.1	Very high	92.3	Very high	68 Å²	68	48.2 Å²	48.2	44%	0.442	27%	0.268	S	S	.	.	P	Polyproline II helix	trans	-74.3	148.3	176.6	30.8	-35.2	0	0	0	111.6	D212 G214	D212-P217 WeakPolarHBondContact OD1-CA 3.27Å; D212-P217 VanDerWaalsContact OD1-CB 3.23Å; D212-P217 WeakPolarHBondContact OD1-CB 3.23Å; G214-P217 WeakPolarHBondContact O-CA 3.29Å; G214-P217 WeakPolarHBondContact O-CD 3.41Å; G214-P217 VanDerWaalsContact O-N 3.17Å
218	R	92.3	Very high	92.4	Very high	103 Å²	103	41.6 Å²	41.6	39%	0.389	24%	0.243	S	C	.	.	P	Polyproline II helix	trans	-100.5	167.1	169.7	-48.4	170.3	168.2	-152.2	3.7	110.2	N123 D124 N125 A126 L211 D212	N123-R218 WeakPolarHBondContact ND2-CD 3.44Å; N123-R218 PolarHBondContact O-NE 2.92Å; N123-R218 PolarHBondContact O-NH2 2.82Å; N123-R218 VanDerWaalsContact O-NH2 3.15Å; D124-R218 VanDerWaalsContact C-NH1 3.28Å; D124-R218 PolarHBondContact O-NH1 3.25Å; D124-R218 PolarHBondContact O-NH2 2.8Å; N125-R218 WeakPolarHBondContact O-CD 3.22Å; N125-R218 VanDerWaalsContact O-CZ 3.28Å; N125-R218 PolarHBondContact O-NE 2.83Å; N125-R218 PolarHBondContact O-NH1 3.45Å; A126-R218 HydrophobicContact CB-CB 4Å; L211-R218 WeakPolarHBondContact CA-O 3.26Å; D212-R218 PolarHBondContact N-O 3.28Å; D212-R218 PolarHBondContact OD1-N 2.72Å; D212-R218 VanDerWaalsContact OD2-CA 3.3Å; D212-R218 WeakPolarHBondContact OD2-CA 3.42Å; D212-R218 WeakPolarHBondContact OD2-CB 3.35Å; D212-R218 PolarHBondContact OD2-N 3.1Å
219	L	93.4	Very high	92.4	Very high	103 Å²	103	43.3 Å²	43.3	54%	0.539	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	145.5	-171.8	63.3	92.8	0	0	0	112.9	T209 A210 L211 T221	T209-L219 HydrophobicContact CG2-CB 3.88Å; T209-L219 HydrophobicContact CG2-CD1 4.27Å; T209-L219 HydrophobicContact CG2-CG 4.49Å; A210-L219 CarbonylContact O-C 3.5Å; A210-L219 VanDerWaalsContact O-CA 3.22Å; A210-L219 WeakPolarHBondContact O-CA 3.29Å; L211-L219 HydrophobicContact CG-CB 4.24Å; L219-T221 HydrophobicContact CD1-CG2 3.92Å
220	G	92.8	Very high	92.5	Very high	9 Å²	9	44 Å²	44	9%	0.093	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	147.9	164.5	0	0	0	0	0	110.4	P127 T209 A210	P127-G220 WeakPolarHBondContact O-CA 2.92Å; T209-G220 CarbonylContact C-O 3.59Å; T209-G220 VanDerWaalsContact CA-O 3.29Å; T209-G220 WeakPolarHBondContact CA-O 2.97Å; A210-G220 PolarHBondContact N-O 3.26Å; A210-G220 PolarHBondContact O-N 2.99Å
221	T	93.3	Very high	92.5	Very high	76 Å²	76	44.9 Å²	44.9	47%	0.466	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	143.3	177.3	58.2	0	0	0	0	112.3	R207 I208 T209 L219	R207-T221 HydrophobicContact CG-CG2 4.37Å; I208-T221 VanDerWaalsContact O-CA 3.28Å; I208-T221 WeakPolarHBondContact O-CA 2.87Å; T209-T221 HydrophobicContact CG2-CG2 3.94Å; L219-T221 HydrophobicContact CD1-CG2 3.92Å
222	V	94.8	Very high	92.6	Very high	3 Å²	3	44.9 Å²	44.9	2%	0.018	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	145	172.6	67.7	0	0	0	0	110.4	F129 A131 I134 R207 I208	F129-V222 HydrophobicContact CB-CB 3.89Å; F129-V222 HydrophobicContact CB-CG1 4.35Å; F129-V222 HydrophobicContact CB-CG2 4.15Å; F129-V222 HydrophobicContact CD1-CB 4.12Å; F129-V222 HydrophobicContact CD1-CG1 3.63Å; F129-V222 HydrophobicContact CD2-CB 3.65Å; F129-V222 HydrophobicContact CD2-CG1 3.73Å; F129-V222 HydrophobicContact CE1-CG1 3.7Å; F129-V222 HydrophobicContact CE2-CB 4.16Å; F129-V222 HydrophobicContact CE2-CG1 3.8Å; F129-V222 HydrophobicContact CG-CB 3.62Å; F129-V222 HydrophobicContact CG-CG1 3.63Å; F129-V222 HydrophobicContact CG-CG2 4.32Å; F129-V222 HydrophobicContact CZ-CG1 3.78Å; A131-V222 WeakPolarHBondContact O-CG2 3.18Å; I134-V222 HydrophobicContact CD1-CG1 3.89Å; I134-V222 HydrophobicContact CG1-CG1 4.33Å; I134-V222 HydrophobicContact CG1-CG2 4.07Å; R207-V222 WeakPolarHBondContact CA-O 3.21Å; I208-V222 HydrophobicContact CB-CG1 3.96Å; I208-V222 HydrophobicContact CD1-CG1 4.4Å; I208-V222 PolarHBondContact N-O 2.93Å; I208-V222 PolarHBondContact O-N 3.48Å
223	G	93.6	Very high	92.6	Very high	25 Å²	25	49.5 Å²	49.5	26%	0.258	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	141.8	170.5	0	0	0	0	0	110.8	Q133 I134	Q133-G223 CarbonylContact C-O 3.6Å; Q133-G223 WeakPolarHBondContact CA-O 3.3Å; I134-G223 PolarHBondContact N-O 3.5Å
224	L	94.4	Very high	92.9	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	112.7	173.4	178.5	67.8	0	0	0	108.1	I134 L136 L150 L168 L190 S205 F206 I208 I226	I134-L224 HydrophobicContact CB-CD1 3.93Å; I134-L224 HydrophobicContact CG2-CD1 3.74Å; I134-L224 WeakPolarHBondContact O-CA 3.34Å; L136-L224 HydrophobicContact CD1-CD1 3.91Å; L136-L224 HydrophobicContact CG-CD1 4.13Å; L150-L224 HydrophobicContact CD2-CD1 4.37Å; L168-L224 HydrophobicContact CD1-CD2 4.04Å; L190-L224 HydrophobicContact CD1-CD2 4.05Å; L190-L224 HydrophobicContact CD2-CD2 4.43Å; S205-L224 WeakPolarHBondContact CA-O 3.2Å; F206-L224 HydrophobicContact CB-CB 4.37Å; F206-L224 HydrophobicContact CB-CD2 4.47Å; F206-L224 HydrophobicContact CD2-CD2 4.43Å; F206-L224 PolarHBondContact N-O 3.3Å; F206-L224 PolarHBondContact O-N 2.82Å; I208-L224 HydrophobicContact CD1-CB 4.23Å; I208-L224 HydrophobicContact CD1-CD1 4.36Å; I208-L224 HydrophobicContact CD1-CD2 4.12Å; I208-L224 HydrophobicContact CD1-CG 4.48Å; I208-L224 HydrophobicContact CG1-CB 4.41Å; I208-L224 HydrophobicContact CG1-CD2 4.4Å; L224-I226 HydrophobicContact CD1-CG1 4.48Å; L224-I226 HydrophobicContact CD2-CD1 4.02Å; L224-I226 HydrophobicContact CD2-CG1 4.24Å; L224-I226 HydrophobicContact CG-CD1 4.39Å; L224-I226 HydrophobicContact CG-CG1 4.04Å
225	S	94.5	Very high	93.2	Very high	14 Å²	14	52.2 Å²	52.2	10%	0.098	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	129	166.8	-76.7	0	0	0	0	109.1	Q133 I134 E135 L136	Q133-S225 PolarHBondContact NE2-OG 3.37Å; I134-S225 PolarHBondContact O-N 3.08Å; E135-S225 WeakPolarHBondContact CA-O 3.09Å; L136-S225 PolarHBondContact N-O 3.07Å
226	I	95.2	Very high	93.7	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	114.4	172.9	-59.5	177.7	0	0	0	106.8	L136 I138 F174 L190 H203 Y204 F206 L224	L136-I226 WeakPolarHBondContact O-CA 3.47Å; I138-I226 HydrophobicContact CB-CG2 4.41Å; I138-I226 HydrophobicContact CD1-CD1 4.26Å; I138-I226 HydrophobicContact CD1-CG1 4.47Å; I138-I226 HydrophobicContact CD1-CG2 3.56Å; I138-I226 HydrophobicContact CG1-CG2 3.92Å; F174-I226 HydrophobicContact CD1-CD1 4.01Å; F174-I226 HydrophobicContact CD2-CD1 3.94Å; F174-I226 HydrophobicContact CE1-CD1 3.76Å; F174-I226 HydrophobicContact CE2-CD1 3.69Å; F174-I226 HydrophobicContact CG-CD1 4.09Å; F174-I226 HydrophobicContact CZ-CD1 3.59Å; F174-I226 HydrophobicContact CZ-CG2 4.05Å; L190-I226 HydrophobicContact CD2-CD1 3.76Å; H203-I226 CarbonylContact C-O 3.6Å; H203-I226 WeakPolarHBondContact CA-O 3.48Å; H203-I226 PolarHBondContact CD2-O 2.72Å; Y204-I226 PolarHBondContact N-O 3.01Å; Y204-I226 PolarHBondContact O-N 3.38Å; F206-I226 HydrophobicContact CD2-CD1 4.12Å; F206-I226 HydrophobicContact CE2-CD1 4.09Å; L224-I226 HydrophobicContact CD1-CG1 4.48Å; L224-I226 HydrophobicContact CD2-CD1 4.02Å; L224-I226 HydrophobicContact CD2-CG1 4.24Å; L224-I226 HydrophobicContact CG-CD1 4.39Å; L224-I226 HydrophobicContact CG-CG1 4.04Å
227	K	95.3	Very high	94.1	Very high	94 Å²	94	43.7 Å²	43.7	41%	0.409	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	124.7	165.9	175	-176.1	161	-154.1	0	107.9	L136 E137 I138	L136-K227 PolarHBondContact O-N 2.97Å; E137-K227 WeakPolarHBondContact CA-O 3.31Å; E137-K227 HydrophobicContact CG-CB 4.43Å; E137-K227 HydrophobicContact CG-CD 4.34Å; E137-K227 WeakPolarHBondContact OE1-CD 3.49Å; E137-K227 WeakPolarHBondContact OE1-CE 3.24Å; E137-K227 IonicContact OE1-NZ 3.04Å; E137-K227 PolarHBondContact OE1-NZ 2.8Å; I138-K227 PolarHBondContact N-O 2.85Å
228	V	95.8	Very high	94.4	Very high	2 Å²	2	41.4 Å²	41.4	1%	0.012	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	132.8	169.3	-168.9	0	0	0	0	107.8	I138 E140 L196 R198 S202 Y204	I138-V228 CarbonylContact O-C 3.52Å; I138-V228 VanDerWaalsContact O-CA 3.23Å; I138-V228 WeakPolarHBondContact O-CA 3.3Å; E140-V228 HydrophobicContact CB-CG1 3.92Å; L196-V228 HydrophobicContact CB-CG1 4.49Å; R198-V228 HydrophobicContact CB-CB 4.15Å; R198-V228 HydrophobicContact CB-CG1 3.84Å; R198-V228 HydrophobicContact CG-CB 4.28Å; R198-V228 HydrophobicContact CG-CG1 4.41Å; S202-V228 PolarHBondContact O-N 2.97Å; Y204-V228 HydrophobicContact CD2-CG2 4.08Å; Y204-V228 HydrophobicContact CE2-CG2 3.72Å
229	T	95.1	Very high	94.4	Very high	38 Å²	38	40.5 Å²	40.5	23%	0.233	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	124.5	177.6	59.3	0	0	0	0	110.9	E137 I138 S139 E140 S231	E137-T229 HydrophobicContact CB-CG2 3.73Å; E137-T229 HydrophobicContact CG-CG2 4.15Å; I138-T229 PolarHBondContact O-N 3Å; S139-T229 VanDerWaalsContact CA-O 3.29Å; S139-T229 WeakPolarHBondContact CA-O 3.05Å; S139-T229 VanDerWaalsContact CA-OG1 3.26Å; S139-T229 WeakPolarHBondContact CA-OG1 3.07Å; S139-T229 PolarHBondContact N-OG1 2.76Å; E140-T229 VanDerWaalsContact OE1-O 3.07Å; T229-S231 PolarHBondContact O-OG 3.34Å
230	D	95.1	Very high	94.3	Very high	36 Å²	36	41 Å²	41	19%	0.193	24%	0.235	C	C	.	.			trans	-47.3	141.3	-177.5	-166.4	86.4	0	0	0	115.8	E140 R198 E267 N270	E140-D230 VanDerWaalsContact OE1-C 3.26Å; E140-D230 VanDerWaalsContact OE1-CA 3.24Å; E140-D230 WeakPolarHBondContact OE1-CA 3.37Å; R198-D230 WeakPolarHBondContact CD-OD1 3.43Å; R198-D230 IonicContact CZ-OD1 3.65Å; R198-D230 IonicContact NE-OD1 2.73Å; R198-D230 PolarHBondContact NE-OD1 2.91Å; R198-D230 IonicContact NH2-OD1 3.94Å; D230-E267 HydrophobicContact CB-CB 3.7Å; D230-E267 VanDerWaalsContact CG-CB 3.44Å; D230-E267 VanDerWaalsContact OD1-CB 3.27Å; D230-E267 WeakPolarHBondContact OD1-CB 3.49Å; D230-E267 PolarHBondContact OD1-N 2.51Å; D230-E267 PolarHBondContact OD2-N 3.18Å; D230-N270 WeakPolarHBondContact OD2-CB 2.87Å; D230-N270 PolarHBondContact OD2-ND2 2.78Å
231	S	93.8	Very high	94.3	Very high	18 Å²	18	45.1 Å²	45.1	13%	0.126	26%	0.263	C	S	.	.			trans	-142.6	123.9	-176.9	-40.9	0	0	0	0	108.1	S139 E140 T229 D233	S139-S231 PolarHBondContact OG-OG 3.43Å; E140-S231 VanDerWaalsContact OE1-CB 3.3Å; E140-S231 WeakPolarHBondContact OE1-CB 3.31Å; E140-S231 PolarHBondContact OE1-N 3.36Å; E140-S231 PolarHBondContact OE1-OG 2.75Å; T229-S231 PolarHBondContact O-OG 3.34Å; S231-D233 VanDerWaalsContact C-N 3.32Å; S231-D233 PolarHBondContact O-N 3.15Å
232	N	94.7	Very high	94.4	Very high	28 Å²	28	44.9 Å²	44.9	15%	0.15	26%	0.261	C	S	.	.	S	Bend	trans	-66.2	81.8	-174.9	-155.2	79.2	0	0	0	112.1	D266 N270 D320 P323	N232-D266 WeakPolarHBondContact CA-OD2 3.12Å; N232-N270 HydrophobicContact CB-CB 4.18Å; N232-N270 PolarHBondContact N-ND2 2.97Å; N232-N270 WeakPolarHBondContact OD1-CA 3.23Å; N232-N270 WeakPolarHBondContact OD1-CB 3.45Å; N232-N270 VanDerWaalsContact OD1-CG 3.22Å; N232-D320 PolarHBondContact ND2-OD1 2.87Å; N232-D320 PolarHBondContact OD1-OD1 2.89Å; N232-P323 HydrophobicContact CB-CG 4.31Å; N232-P323 PolarHBondContact ND2-O 3.26Å; N232-P323 VanDerWaalsContact ND2-O 3.15Å
233	D	93.1	Very high	94.4	Very high	104 Å²	104	45.6 Å²	45.6	56%	0.556	26%	0.264	S	S	*	.			trans	-121	-22.4	-175.1	99.5	-30	0	0	0	113.3	S231 D266	S231-D233 VanDerWaalsContact C-N 3.32Å; S231-D233 PolarHBondContact O-N 3.15Å; D233-D266 PolarHBondContact N-OD2 2.76Å
234	N	93.7	Very high	94.6	Very high	56 Å²	56	49.3 Å²	49.3	30%	0.299	29%	0.286	S	S	.	.	S	Bend	trans	-77.8	171.8	157.5	-61.2	-80	0	0	0	110.3	P265 D266	N234-P265 HydrophobicContact CB-CG 3.65Å; N234-P265 VanDerWaalsContact CG-CG 3.47Å; N234-D266 VanDerWaalsContact CB-OD1 3.29Å; N234-D266 WeakPolarHBondContact CB-OD1 2.78Å; N234-D266 PolarHBondContact N-OD2 3.35Å; N234-D266 PolarHBondContact ND2-OD1 2.88Å
235	N	94.1	Very high	94.7	Very high	49 Å²	49	50.6 Å²	50.6	26%	0.262	29%	0.293	S	S	.	.			trans	-147.1	154.6	177.2	-61.4	-99.9	0	0	0	108	V237 D264 I326	N235-V237 WeakPolarHBondContact O-CG2 3.47Å; N235-V237 PolarHBondContact O-N 3.46Å; N235-D264 WeakPolarHBondContact CA-OD2 3.02Å; N235-I326 WeakPolarHBondContact OD1-CA 3.3Å; N235-I326 WeakPolarHBondContact OD1-CB 3.37Å; N235-I326 WeakPolarHBondContact OD1-CG1 2.99Å; N235-I326 PolarHBondContact OD1-N 3.21Å; N235-I326 PolarHBondContact OD1-O 3.02Å
236	P	96.1	Very high	94.8	Very high	1 Å²	1	53.2 Å²	53.2	1%	0.006	31%	0.311	C	S	.	.			trans	-64	132.3	-169.2	-25.4	34.3	0	0	0	112.8	A262 D264 V273 A318 D320 A328	P236-A262 HydrophobicContact CB-CB 4.21Å; P236-D264 WeakPolarHBondContact CA-OD2 3.36Å; P236-D264 HydrophobicContact CB-CB 4.41Å; P236-D264 WeakPolarHBondContact CD-OD2 3.49Å; P236-D264 HydrophobicContact CG-CB 4.31Å; P236-D264 WeakPolarHBondContact CG-OD2 3.43Å; P236-V273 HydrophobicContact CB-CG1 4.07Å; P236-V273 HydrophobicContact CB-CG2 3.87Å; P236-V273 HydrophobicContact CG-CG1 4.3Å; P236-V273 HydrophobicContact CG-CG2 3.98Å; P236-A318 HydrophobicContact CB-CB 4.1Å; P236-D320 HydrophobicContact CG-CB 4.12Å; P236-A328 WeakPolarHBondContact O-CB 3.12Å
237	V	95.3	Very high	94.9	Very high	91 Å²	91	53.5 Å²	53.5	55%	0.552	31%	0.313	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.6	118.4	179.9	-175.4	0	0	0	0	111.3	N235 A262 S263	N235-V237 WeakPolarHBondContact O-CG2 3.47Å; N235-V237 PolarHBondContact O-N 3.46Å; V237-A262 CarbonylContact O-C 3.58Å; V237-A262 VanDerWaalsContact O-CA 3.23Å; V237-A262 WeakPolarHBondContact O-CA 3.03Å; V237-S263 PolarHBondContact N-O 3.39Å; V237-S263 PolarHBondContact O-N 3.3Å; V237-S263 PolarHBondContact O-OG 2.75Å
238	F	96	Very high	94.9	Very high	19 Å²	19	51.9 Å²	51.9	8%	0.083	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	143.2	170.6	-73.1	-75.6	0	0	0	111.8	E240 L260 A262 Y275 V316 A318 A328 C330	F238-E240 VanDerWaalsContact C-N 3.28Å; F238-E240 WeakPolarHBondContact CB-O 3.21Å; F238-E240 PolarHBondContact O-N 2.68Å; F238-L260 HydrophobicContact CE1-CB 4.3Å; F238-A262 HydrophobicContact CD1-CB 3.78Å; F238-A262 HydrophobicContact CE1-CB 4.02Å; F238-A262 HydrophobicContact CG-CB 4.07Å; F238-Y275 HydrophobicContact CE1-CD1 4.11Å; F238-Y275 AromaticContact CE1-CE1 3.93Å; F238-Y275 HydrophobicContact CE1-CE1 3.93Å; F238-Y275 HydrophobicContact CZ-CD1 4.4Å; F238-V316 HydrophobicContact CZ-CG1 4.18Å; F238-A318 HydrophobicContact CD2-CB 4.4Å; F238-A318 HydrophobicContact CE1-CB 3.97Å; F238-A318 HydrophobicContact CE2-CB 3.59Å; F238-A318 HydrophobicContact CZ-CB 3.34Å; F238-A328 HydrophobicContact CD2-CB 4.35Å; F238-C330 HydrophobicContact CB-CB 4.16Å; F238-C330 HydrophobicContact CD1-CB 4.2Å; F238-C330 VanDerWaalsContact CD1-SG 3.55Å; F238-C330 HydrophobicContact CD2-CB 3.64Å; F238-C330 WeakPolarHBondContact CE1-SG 3.11Å; F238-C330 HydrophobicContact CE2-CB 3.98Å; F238-C330 HydrophobicContact CG-CB 3.76Å; F238-C330 HydrophobicContact CZ-CB 4.39Å; F238-C330 WeakPolarHBondContact CZ-SG 3.27Å
239	S	91.8	Very high	94.8	Very high	84 Å²	84	52 Å²	52	59%	0.587	31%	0.313	S	S	*	.	S	Bend	trans	-61.6	-31	177.3	40.9	0	0	0	0	114.6	Y243 N261	S239-Y243 PolarHBondContact N-OH 2.8Å; S239-Y243 PolarHBondContact OG-OH 3.31Å; S239-N261 PolarHBondContact N-O 3.15Å
240	E	92.9	Very high	94.7	Very high	114 Å²	114	54.9 Å²	54.9	53%	0.533	33%	0.327	S	S	.	.			trans	-137.7	148.6	173.9	-54.3	-179.1	175.5	0	0	109.3	F238 Y243	F238-E240 VanDerWaalsContact C-N 3.28Å; F238-E240 WeakPolarHBondContact CB-O 3.21Å; F238-E240 PolarHBondContact O-N 2.68Å; E240-Y243 HydrophobicContact CB-CD1 4.19Å; E240-Y243 HydrophobicContact CB-CE1 3.68Å; E240-Y243 HydrophobicContact CB-CE2 4.29Å; E240-Y243 HydrophobicContact CG-CE1 3.97Å; E240-Y243 PolarHBondContact N-OH 2.99Å; E240-Y243 WeakPolarHBondContact O-CE2 3.2Å; E240-Y243 PolarHBondContact O-OH 2.66Å
241	S	91.8	Very high	94.7	Very high	96 Å²	96	53.8 Å²	53.8	67%	0.671	32%	0.322	S	S	*	.	S	Bend	trans	-82.8	-18.5	178.4	56	0	0	0	0	113.5	C330 K331	S241-C330 WeakPolarHBondContact O-CA 3.29Å; S241-K331 PolarHBondContact O-N 3.44Å; S241-K331 VanDerWaalsContact O-N 3.08Å
242	T	94.9	Very high	94.7	Very high	71 Å²	71	57 Å²	57	44%	0.436	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	125.3	175.7	-60.8	0	0	0	0	110.4	K331	T242-K331 CarbonylContact C-O 3.58Å; T242-K331 VanDerWaalsContact CA-O 3.24Å; T242-K331 WeakPolarHBondContact CA-O 3.4Å; T242-K331 HydrophobicContact CG2-CB 4.3Å
243	Y	96.1	Very high	94.7	Very high	18 Å²	18	59.3 Å²	59.3	7%	0.071	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	141	176.3	-55.2	-91.9	0	0	0	109.8	S239 E240 I258 L260 C330 K331 V332 T333	S239-Y243 PolarHBondContact N-OH 2.8Å; S239-Y243 PolarHBondContact OG-OH 3.31Å; E240-Y243 HydrophobicContact CB-CD1 4.19Å; E240-Y243 HydrophobicContact CB-CE1 3.68Å; E240-Y243 HydrophobicContact CB-CE2 4.29Å; E240-Y243 HydrophobicContact CG-CE1 3.97Å; E240-Y243 PolarHBondContact N-OH 2.99Å; E240-Y243 WeakPolarHBondContact O-CE2 3.2Å; E240-Y243 PolarHBondContact O-OH 2.66Å; Y243-I258 HydrophobicContact CD1-CD1 3.85Å; Y243-I258 HydrophobicContact CG-CD1 3.93Å; Y243-L260 HydrophobicContact CD1-CD2 4.47Å; Y243-L260 HydrophobicContact CD2-CD2 3.63Å; Y243-L260 HydrophobicContact CE1-CD2 4.45Å; Y243-L260 HydrophobicContact CE2-CD2 3.64Å; Y243-L260 HydrophobicContact CG-CD2 4.08Å; Y243-C330 HydrophobicContact CD2-CB 4.39Å; Y243-C330 HydrophobicContact CE2-CB 3.92Å; Y243-K331 PolarHBondContact N-O 2.84Å; Y243-V332 HydrophobicContact CD2-CG2 4.13Å; Y243-V332 WeakPolarHBondContact O-CA 3.36Å; Y243-T333 PolarHBondContact O-N 2.87Å
244	S	96.4	Very high	94.8	Very high	103 Å²	103	60.7 Å²	60.7	72%	0.72	37%	0.366	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.2	129.1	172.3	-66	0	0	0	0	109.8
245	V	96.9	Very high	94.9	Very high	26 Å²	26	59.6 Å²	59.6	16%	0.158	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	152.3	-176.1	63.9	0	0	0	0	110.6	V257 V332 T333 V334 S335	V245-V257 HydrophobicContact CG1-CG1 3.67Å; V245-V257 HydrophobicContact CG2-CG1 4.28Å; V245-V257 WeakPolarHBondContact CG2-O 3.29Å; V245-V332 HydrophobicContact CG1-CG1 3.96Å; V245-T333 PolarHBondContact N-O 2.75Å; V245-V334 HydrophobicContact CG1-CB 4.28Å; V245-V334 HydrophobicContact CG1-CG1 4.34Å; V245-V334 HydrophobicContact CG1-CG2 3.89Å; V245-S335 PolarHBondContact O-N 2.89Å; V245-S335 PolarHBondContact O-OG 2.83Å
246	S	96.8	Very high	95.1	Very high	69 Å²	69	61.4 Å²	61.4	48%	0.483	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	130.9	179.7	-56	0	0	0	0	110.8	S335	S246-S335 CarbonylContact C-O 3.6Å; S246-S335 VanDerWaalsContact CA-O 3.28Å; S246-S335 WeakPolarHBondContact CA-O 3.1Å; S246-S335 WeakPolarHBondContact CA-OG 3.44Å; S246-S335 WeakPolarHBondContact CB-OG 3.4Å; S246-S335 PolarHBondContact OG-OG 2.97Å
247	V	96.9	Very high	95.1	Very high	6 Å²	6	62.1 Å²	62.1	4%	0.036	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	128.2	-176.3	-177.4	0	0	0	0	108.1	S251 V257 V300 L304 V334 S335 V336 L337	V247-S251 WeakPolarHBondContact CG1-OG 3.43Å; V247-V257 HydrophobicContact CG2-CB 4.35Å; V247-V257 HydrophobicContact CG2-CG1 3.86Å; V247-V257 HydrophobicContact CG2-CG2 4.13Å; V247-V300 HydrophobicContact CG1-CG2 4.11Å; V247-L304 HydrophobicContact CB-CD1 4.49Å; V247-L304 HydrophobicContact CG1-CD1 3.93Å; V247-V334 HydrophobicContact CB-CG1 4.4Å; V247-V334 HydrophobicContact CG2-CG1 3.97Å; V247-S335 PolarHBondContact N-O 2.68Å; V247-V336 CarbonylContact O-C 3.59Å; V247-V336 VanDerWaalsContact O-CA 3.27Å; V247-V336 WeakPolarHBondContact O-CA 3.43Å; V247-L337 PolarHBondContact O-N 2.72Å
248	P	95.6	Very high	95.2	Very high	60 Å²	60	59.5 Å²	59.5	39%	0.39	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.2	143.6	172.4	-22.9	34.1	0	0	0	111.7	S251 T339	P248-S251 VanDerWaalsContact O-CB 3.27Å; P248-S251 WeakPolarHBondContact O-CB 3.18Å; P248-S251 PolarHBondContact O-OG 2.61Å; P248-T339 HydrophobicContact CB-CG2 3.96Å
249	E	93.9	Very high	95.2	Very high	5 Å²	5	65.6 Å²	65.6	2%	0.023	39%	0.385	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	172	158.8	75.9	-169.3	128.7	0	0	110.7	S251 L304 Y306 V336 L337 D338 T339	E249-S251 PolarHBondContact O-N 3.19Å; E249-L304 HydrophobicContact CB-CB 4.46Å; E249-Y306 VanDerWaalsContact CD-CB 3.45Å; E249-Y306 WeakPolarHBondContact OE1-CB 3.29Å; E249-Y306 WeakPolarHBondContact OE2-CB 3.47Å; E249-Y306 PolarHBondContact OE2-N 2.85Å; E249-V336 HydrophobicContact CB-CG1 3.58Å; E249-L337 PolarHBondContact N-O 2.77Å; E249-D338 VanDerWaalsContact OE1-CA 3.27Å; E249-D338 WeakPolarHBondContact OE1-CA 3.33Å; E249-T339 HydrophobicContact CG-CG2 4.03Å; E249-T339 WeakPolarHBondContact CG-OG1 3.26Å; E249-T339 PolarHBondContact OE1-N 2.93Å
250	N	92.8	Very high	95.4	Very high	98 Å²	98	61.7 Å²	61.7	52%	0.524	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.3	6.8	-169.6	-72.1	-69.3	0	0	0	114.9	L304 T339 D341	N250-L304 PolarHBondContact N-O 2.83Å; N250-T339 PolarHBondContact ND2-OG1 2.74Å; N250-D341 PolarHBondContact ND2-OD2 3.4Å
251	S	94.9	Very high	95.4	Very high	13 Å²	13	61 Å²	61	9%	0.091	36%	0.358	C	S	.	.	P	Polyproline II helix	trans	-58.5	125.2	173.2	-76.2	0	0	0	0	110.2	V247 P248 E249	V247-S251 WeakPolarHBondContact CG1-OG 3.43Å; P248-S251 VanDerWaalsContact O-CB 3.27Å; P248-S251 WeakPolarHBondContact O-CB 3.18Å; P248-S251 PolarHBondContact O-OG 2.61Å; E249-S251 PolarHBondContact O-N 3.19Å
252	P	94.9	Very high	95.6	Very high	85 Å²	85	56.7 Å²	56.7	55%	0.552	33%	0.328	S	S	*	.	P	Polyproline II helix	trans	-68.1	153.8	-174.4	26.6	-34.6	0	0	0	112.1	T255	P252-T255 WeakPolarHBondContact CD-OG1 3.48Å; P252-T255 VanDerWaalsContact O-CB 3.26Å; P252-T255 WeakPolarHBondContact O-CB 3.33Å; P252-T255 PolarHBondContact O-N 3.05Å; P252-T255 PolarHBondContact O-OG1 3.17Å
253	P	94.4	Very high	95.6	Very high	78 Å²	78	56.8 Å²	56.8	51%	0.506	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.3	144.2	173.9	-28	36	0	0	0	112.6	T255	P253-T255 VanDerWaalsContact C-N 3.31Å
254	N	94.5	Very high	95.6	Very high	133 Å²	133	57 Å²	57	71%	0.711	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.6	9.9	-167.8	-43.8	-94.6	0	0	0	115.3	P256 V300	N254-P256 WeakPolarHBondContact O-CD 3.45Å; N254-V300 PolarHBondContact N-O 2.74Å
255	T	96.6	Very high	95.5	Very high	32 Å²	32	55.3 Å²	55.3	20%	0.196	32%	0.32	C	S	.	.			trans	-61.8	124.9	169.6	-67.2	0	0	0	0	109.8	P252 P253 V257 T299 V300	P252-T255 WeakPolarHBondContact CD-OG1 3.48Å; P252-T255 VanDerWaalsContact O-CB 3.26Å; P252-T255 WeakPolarHBondContact O-CB 3.33Å; P252-T255 PolarHBondContact O-N 3.05Å; P252-T255 PolarHBondContact O-OG1 3.17Å; P253-T255 VanDerWaalsContact C-N 3.31Å; T255-V257 PolarHBondContact O-N 2.59Å; T255-T299 CarbonylContact O-C 3.52Å; T255-T299 VanDerWaalsContact O-CA 3.27Å; T255-T299 WeakPolarHBondContact O-CA 3.33Å; T255-V300 HydrophobicContact CG2-CG2 4.45Å; T255-V300 PolarHBondContact O-N 2.74Å
256	P	96.7	Very high	95.5	Very high	88 Å²	88	54.5 Å²	54.5	57%	0.571	32%	0.315	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.7	127.5	178.7	29.6	-34	0	0	0	110.7	N254 L297	N254-P256 WeakPolarHBondContact O-CD 3.45Å; P256-L297 HydrophobicContact CB-CD1 4.1Å
257	V	96.9	Very high	95.3	Very high	16 Å²	16	56.1 Å²	56.1	10%	0.097	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	-64.1	179.5	177.6	0	0	0	0	109.6	V245 V247 T255 F289 V298 V300 V334	V245-V257 HydrophobicContact CG1-CG1 3.67Å; V245-V257 HydrophobicContact CG2-CG1 4.28Å; V245-V257 WeakPolarHBondContact CG2-O 3.29Å; V247-V257 HydrophobicContact CG2-CB 4.35Å; V247-V257 HydrophobicContact CG2-CG1 3.86Å; V247-V257 HydrophobicContact CG2-CG2 4.13Å; T255-V257 PolarHBondContact O-N 2.59Å; V257-F289 HydrophobicContact CG2-CD1 4.08Å; V257-F289 HydrophobicContact CG2-CE1 4.04Å; V257-V298 HydrophobicContact CB-CB 4.25Å; V257-V298 HydrophobicContact CB-CG1 4.08Å; V257-V298 HydrophobicContact CG1-CG1 4.44Å; V257-V298 HydrophobicContact CG2-CG1 4.39Å; V257-V298 PolarHBondContact N-O 2.94Å; V257-V300 HydrophobicContact CG2-CG2 3.68Å; V257-V334 HydrophobicContact CG1-CG1 4.34Å; V257-V334 HydrophobicContact CG1-CG2 3.98Å
258	I	96.6	Very high	95.1	Very high	35 Å²	35	58.8 Å²	58.8	18%	0.179	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	147.7	178.1	-170.7	166.5	0	0	0	109.5	Y243 L260 V298 V332	Y243-I258 HydrophobicContact CD1-CD1 3.85Å; Y243-I258 HydrophobicContact CG-CD1 3.93Å; I258-L260 HydrophobicContact CD1-CD2 4.16Å; I258-L260 HydrophobicContact CG1-CD2 4.35Å; I258-L260 HydrophobicContact CG2-CD2 4.11Å; I258-L260 HydrophobicContact CG2-CG 4.26Å; I258-V298 HydrophobicContact CG2-CB 4.04Å; I258-V298 HydrophobicContact CG2-CG2 3.99Å; I258-V298 PolarHBondContact O-N 2.83Å; I258-V332 HydrophobicContact CG2-CG1 4Å
259	R	96.4	Very high	95	Very high	148 Å²	148	59.7 Å²	59.7	56%	0.558	35%	0.349	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100	112.2	164.8	-177.7	-178.1	-64	-77.5	0.8	108.3	S295 L297	R259-S295 WeakPolarHBondContact CG-O 3.28Å; R259-S295 PolarHBondContact NH1-O 2.84Å; R259-S295 PolarHBondContact NH1-OG 3.19Å; R259-L297 HydrophobicContact CB-CD1 4.1Å
260	L	96	Very high	95	Very high	2 Å²	2	60.2 Å²	60.2	1%	0.01	35%	0.352	C	S	.	.			trans	-79.3	152.6	173	-59.2	174.2	0	0	0	110.2	F238 Y243 I258 I291 G296 V298 V316 V332	F238-L260 HydrophobicContact CE1-CB 4.3Å; Y243-L260 HydrophobicContact CD1-CD2 4.47Å; Y243-L260 HydrophobicContact CD2-CD2 3.63Å; Y243-L260 HydrophobicContact CE1-CD2 4.45Å; Y243-L260 HydrophobicContact CE2-CD2 3.64Å; Y243-L260 HydrophobicContact CG-CD2 4.08Å; I258-L260 HydrophobicContact CD1-CD2 4.16Å; I258-L260 HydrophobicContact CG1-CD2 4.35Å; I258-L260 HydrophobicContact CG2-CD2 4.11Å; I258-L260 HydrophobicContact CG2-CG 4.26Å; L260-I291 HydrophobicContact CD1-CD1 4.1Å; L260-G296 PolarHBondContact N-O 3.05Å; L260-V298 HydrophobicContact CD1-CG2 4.12Å; L260-V298 HydrophobicContact CG-CG2 4.48Å; L260-V316 HydrophobicContact CD1-CB 4Å; L260-V316 HydrophobicContact CD1-CG1 3.72Å; L260-V316 HydrophobicContact CD1-CG2 3.83Å; L260-V332 HydrophobicContact CD1-CG2 3.99Å; L260-V332 HydrophobicContact CD2-CG2 3.79Å; L260-V332 HydrophobicContact CG-CG2 4.45Å
261	N	93.8	Very high	95	Very high	98 Å²	98	56.5 Å²	56.5	52%	0.524	34%	0.337	S	S	.	.			trans	-140	118.7	176.4	-171.7	63.9	0	0	0	108.8	S239	S239-N261 PolarHBondContact N-O 3.15Å
262	A	95.4	Very high	95	Very high	6 Å²	6	60 Å²	60	5%	0.05	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	133	164.3	0	0	0	0	0	108.4	P236 V237 F238 V273 Y275 A318	P236-A262 HydrophobicContact CB-CB 4.21Å; V237-A262 CarbonylContact O-C 3.58Å; V237-A262 VanDerWaalsContact O-CA 3.23Å; V237-A262 WeakPolarHBondContact O-CA 3.03Å; F238-A262 HydrophobicContact CD1-CB 3.78Å; F238-A262 HydrophobicContact CE1-CB 4.02Å; F238-A262 HydrophobicContact CG-CB 4.07Å; A262-V273 HydrophobicContact CB-CG1 4.21Å; A262-Y275 HydrophobicContact CB-CE1 3.98Å; A262-Y275 PolarHBondContact N-OH 2.85Å; A262-Y275 PolarHBondContact O-OH 3.23Å; A262-A318 HydrophobicContact CB-CB 3.57Å
263	S	94.4	Very high	95.1	Very high	73 Å²	73	57 Å²	57	51%	0.51	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	133.4	177.9	52.9	0	0	0	0	110.1	V237	V237-S263 PolarHBondContact N-O 3.39Å; V237-S263 PolarHBondContact O-N 3.3Å; V237-S263 PolarHBondContact O-OG 2.75Å
264	D	96.3	Very high	95.1	Very high	23 Å²	23	55.1 Å²	55.1	12%	0.123	32%	0.319	C	S	.	.			trans	-124.3	132.3	168.9	-162.9	-61.5	0	0	0	107.5	N235 P236 D266 V273	N235-D264 WeakPolarHBondContact CA-OD2 3.02Å; P236-D264 WeakPolarHBondContact CA-OD2 3.36Å; P236-D264 HydrophobicContact CB-CB 4.41Å; P236-D264 WeakPolarHBondContact CD-OD2 3.49Å; P236-D264 HydrophobicContact CG-CB 4.31Å; P236-D264 WeakPolarHBondContact CG-OD2 3.43Å; D264-D266 PolarHBondContact OD1-N 3.12Å; D264-D266 VanDerWaalsContact OD1-N 3.16Å; D264-V273 HydrophobicContact CB-CG2 3.7Å
265	P	95.3	Very high	95.3	Very high	67 Å²	67	49.4 Å²	49.4	44%	0.435	29%	0.287	S	S	.	.			trans	-86.7	-13.4	-174.5	36.5	-37.3	0	0	0	114.3	R198 E199 N234	R198-P265 PolarHBondContact NH2-O 3.16Å; E199-P265 HydrophobicContact CG-CB 3.85Å; E199-P265 HydrophobicContact CG-CG 4Å; N234-P265 HydrophobicContact CB-CG 3.65Å; N234-P265 VanDerWaalsContact CG-CG 3.47Å
266	D	95.8	Very high	95.2	Very high	10 Å²	10	49.9 Å²	49.9	5%	0.053	29%	0.292	C	S	.	.	S	Bend	trans	-70	169.6	-170.6	-65.6	3.7	0	0	0	112.3	N232 D233 N234 D264 N270 G271	N232-D266 WeakPolarHBondContact CA-OD2 3.12Å; D233-D266 PolarHBondContact N-OD2 2.76Å; N234-D266 VanDerWaalsContact CB-OD1 3.29Å; N234-D266 WeakPolarHBondContact CB-OD1 2.78Å; N234-D266 PolarHBondContact N-OD2 3.35Å; N234-D266 PolarHBondContact ND2-OD1 2.88Å; D264-D266 PolarHBondContact OD1-N 3.12Å; D264-D266 VanDerWaalsContact OD1-N 3.16Å; D266-N270 HydrophobicContact CB-CB 3.55Å; D266-G271 WeakPolarHBondContact O-CA 3.44Å; D266-G271 PolarHBondContact O-N 3.29Å
267	E	93.4	Very high	95.2	Very high	102 Å²	102	47.2 Å²	47.2	48%	0.477	27%	0.271	S	S	.	.	S	Bend	trans	-91.3	143.5	-171.9	-148.8	169.3	129.9	0	0	114	R198 D230 T269 N270	R198-E267 IonicContact CZ-OE2 2.66Å; R198-E267 IonicContact NH1-OE2 3.08Å; R198-E267 PolarHBondContact NH1-OE2 2.85Å; D230-E267 HydrophobicContact CB-CB 3.7Å; D230-E267 VanDerWaalsContact CG-CB 3.44Å; D230-E267 VanDerWaalsContact OD1-CB 3.27Å; D230-E267 WeakPolarHBondContact OD1-CB 3.49Å; D230-E267 PolarHBondContact OD1-N 2.51Å; D230-E267 PolarHBondContact OD2-N 3.18Å; E267-T269 PolarHBondContact O-N 3.01Å; E267-T269 VanDerWaalsContact O-N 3.07Å; E267-N270 WeakPolarHBondContact O-CB 3.48Å; E267-N270 PolarHBondContact O-N 3.06Å; E267-N270 VanDerWaalsContact O-N 3.08Å
268	G	92.6	Very high	94.9	Very high	63 Å²	63	50 Å²	50	65%	0.649	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.4	-111.9	168.6	0	0	0	0	0	113	Q272	G268-Q272 WeakPolarHBondContact O-CB 3.47Å
269	T	93.8	Very high	94.2	Very high	78 Å²	78	50.9 Å²	50.9	48%	0.479	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.3	-23.7	178.9	45.8	0	0	0	0	113.5	E267 Q272 L321 G322	E267-T269 PolarHBondContact O-N 3.01Å; E267-T269 VanDerWaalsContact O-N 3.07Å; T269-Q272 PolarHBondContact O-N 3.05Å; T269-L321 CarbonylContact O-C 3.58Å; T269-L321 WeakPolarHBondContact O-CB 3.5Å; T269-L321 PolarHBondContact O-N 2.91Å; T269-G322 PolarHBondContact O-N 3.15Å
270	N	93.3	Very high	93.7	Very high	16 Å²	16	52.4 Å²	52.4	9%	0.086	31%	0.305	C	S	.	.	S	Bend	trans	-74.6	-46.4	-176.8	-64.6	0.2	0	0	0	108.9	D230 N232 D266 E267 Q272 D320 G322	D230-N270 WeakPolarHBondContact OD2-CB 2.87Å; D230-N270 PolarHBondContact OD2-ND2 2.78Å; N232-N270 HydrophobicContact CB-CB 4.18Å; N232-N270 PolarHBondContact N-ND2 2.97Å; N232-N270 WeakPolarHBondContact OD1-CA 3.23Å; N232-N270 WeakPolarHBondContact OD1-CB 3.45Å; N232-N270 VanDerWaalsContact OD1-CG 3.22Å; D266-N270 HydrophobicContact CB-CB 3.55Å; E267-N270 WeakPolarHBondContact O-CB 3.48Å; E267-N270 PolarHBondContact O-N 3.06Å; E267-N270 VanDerWaalsContact O-N 3.08Å; N270-Q272 PolarHBondContact O-N 3.43Å; N270-Q272 VanDerWaalsContact O-N 3.15Å; N270-D320 WeakPolarHBondContact O-CB 3.29Å; N270-G322 VanDerWaalsContact OD1-CA 3.3Å; N270-G322 WeakPolarHBondContact OD1-CA 3.38Å
271	G	93	Very high	93.4	Very high	21 Å²	21	52.6 Å²	52.6	22%	0.216	31%	0.307	C	S	.	.	S	Bend	trans	-71.6	-1.2	167.4	0	0	0	0	0	116.1	D266 V273	D266-G271 WeakPolarHBondContact O-CA 3.44Å; D266-G271 PolarHBondContact O-N 3.29Å; G271-V273 PolarHBondContact O-N 3.42Å; G271-V273 VanDerWaalsContact O-N 3.15Å
272	Q	95.2	Very high	93.1	Very high	87 Å²	87	52.3 Å²	52.3	41%	0.407	31%	0.305	S	S	.	.			trans	-88.2	86.5	-173.3	-169.1	175.3	-9.1	0	0	112.6	G268 T269 N270 D320 L321	G268-Q272 WeakPolarHBondContact O-CB 3.47Å; T269-Q272 PolarHBondContact O-N 3.05Å; N270-Q272 PolarHBondContact O-N 3.43Å; N270-Q272 VanDerWaalsContact O-N 3.15Å; Q272-D320 WeakPolarHBondContact O-CA 3.34Å; Q272-L321 HydrophobicContact CB-CD1 4.3Å; Q272-L321 HydrophobicContact CG-CD1 4.01Å; Q272-L321 PolarHBondContact O-N 2.83Å
273	V	95.8	Very high	92.8	Very high	21 Å²	21	57.2 Å²	57.2	13%	0.127	33%	0.331	C	S	.	.			trans	-66.3	135.1	177.2	-169.8	0	0	0	0	113.1	P236 A262 D264 G271 Y275 A318	P236-V273 HydrophobicContact CB-CG1 4.07Å; P236-V273 HydrophobicContact CB-CG2 3.87Å; P236-V273 HydrophobicContact CG-CG1 4.3Å; P236-V273 HydrophobicContact CG-CG2 3.98Å; A262-V273 HydrophobicContact CB-CG1 4.21Å; D264-V273 HydrophobicContact CB-CG2 3.7Å; G271-V273 PolarHBondContact O-N 3.42Å; G271-V273 VanDerWaalsContact O-N 3.15Å; V273-Y275 HydrophobicContact CG1-CE1 4.24Å; V273-Y275 HydrophobicContact CG1-CE2 4.18Å; V273-A318 HydrophobicContact CG1-CB 3.74Å
274	V	96.4	Very high	92.5	Very high	38 Å²	38	60.5 Å²	60.5	23%	0.23	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	138.2	169	179.1	0	0	0	0	109.9	P293 K319 L321	V274-P293 CarbonylContact C-O 3.55Å; V274-P293 WeakPolarHBondContact CA-O 3.29Å; V274-P293 HydrophobicContact CG1-CB 3.81Å; V274-K319 PolarHBondContact N-O 3.4Å; V274-K319 PolarHBondContact O-N 2.72Å; V274-L321 HydrophobicContact CG2-CD1 4.09Å; V274-L321 HydrophobicContact CG2-CD2 3.88Å; V274-L321 HydrophobicContact CG2-CG 3.96Å
275	Y	97	Very high	92.3	Very high	13 Å²	13	59.5 Å²	59.5	5%	0.051	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	143.4	-176.7	-56.2	-92.4	0	0	0	112.1	F238 A262 V273 P293 Q317 A318	F238-Y275 HydrophobicContact CE1-CD1 4.11Å; F238-Y275 AromaticContact CE1-CE1 3.93Å; F238-Y275 HydrophobicContact CE1-CE1 3.93Å; F238-Y275 HydrophobicContact CZ-CD1 4.4Å; A262-Y275 HydrophobicContact CB-CE1 3.98Å; A262-Y275 PolarHBondContact N-OH 2.85Å; A262-Y275 PolarHBondContact O-OH 3.23Å; V273-Y275 HydrophobicContact CG1-CE1 4.24Å; V273-Y275 HydrophobicContact CG1-CE2 4.18Å; Y275-P293 WeakPolarHBondContact CD2-O 3.4Å; Y275-P293 PolarHBondContact N-O 2.93Å; Y275-P293 WeakPolarHBondContact O-CA 3.34Å; Y275-P293 WeakPolarHBondContact O-CB 3.22Å; Y275-Q317 WeakPolarHBondContact CA-O 3.42Å; Y275-A318 HydrophobicContact CD1-CB 4.12Å; Y275-A318 HydrophobicContact CE1-CB 4.14Å
276	S	95.7	Very high	92.1	Very high	42 Å²	42	60.6 Å²	60.6	29%	0.294	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153	163.9	165.5	80.7	0	0	0	0	111.8	V316 Q317	S276-V316 WeakPolarHBondContact O-CG1 3.21Å; S276-Q317 PolarHBondContact N-O 3.35Å; S276-Q317 WeakPolarHBondContact O-CG 3.16Å; S276-Q317 PolarHBondContact O-N 3.33Å; S276-Q317 VanDerWaalsContact OG-CG 3.27Å; S276-Q317 WeakPolarHBondContact OG-CG 3.46Å; S276-Q317 PolarHBondContact OG-NE2 2.9Å
277	F	95.7	Very high	91.9	Very high	32 Å²	32	66.4 Å²	66.4	14%	0.14	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.8	146.2	162.9	-62.2	-54.1	0	0	0	110.4	V281 F289 I291 L314 V316	F277-V281 HydrophobicContact CB-CB 4.46Å; F277-V281 HydrophobicContact CB-CG2 4.12Å; F277-V281 HydrophobicContact CD1-CG2 4.48Å; F277-F289 VanDerWaalsContact CE2-O 3.29Å; F277-F289 WeakPolarHBondContact CE2-O 3.42Å; F277-F289 HydrophobicContact CZ-CB 4.11Å; F277-I291 HydrophobicContact CD1-CG2 4.37Å; F277-I291 HydrophobicContact CD2-CG2 4.06Å; F277-I291 HydrophobicContact CE1-CB 4.22Å; F277-I291 HydrophobicContact CE1-CG2 4.21Å; F277-I291 HydrophobicContact CE2-CB 4.26Å; F277-I291 HydrophobicContact CE2-CG2 3.92Å; F277-I291 HydrophobicContact CG-CG2 4.27Å; F277-I291 HydrophobicContact CZ-CB 3.92Å; F277-I291 HydrophobicContact CZ-CG2 3.99Å; F277-L314 HydrophobicContact CD1-CB 4.35Å; F277-L314 HydrophobicContact CD1-CD2 4.46Å; F277-L314 HydrophobicContact CE1-CB 4.09Å; F277-L314 HydrophobicContact CE1-CD1 4.09Å; F277-L314 HydrophobicContact CE1-CD2 3.96Å; F277-L314 HydrophobicContact CE1-CG 4.28Å; F277-L314 HydrophobicContact CZ-CD2 4.38Å; F277-V316 HydrophobicContact CD1-CG2 3.98Å; F277-V316 HydrophobicContact CE1-CG2 4.13Å
278	Y	90.6	Very high	92	Very high	74 Å²	74	62.6 Å²	62.6	29%	0.29	33%	0.332	S	S	.	.			trans	-79.7	167.1	173	-166.8	-106.1	0	0	0	111.2	Y280 V281 R286 D315 Q317 H329	Y278-Y280 VanDerWaalsContact C-N 3.28Å; Y278-Y280 AromaticContact CD1-CD2 3.61Å; Y278-Y280 HydrophobicContact CD1-CD2 3.61Å; Y278-Y280 HydrophobicContact CD1-CE2 4.06Å; Y278-Y280 AromaticContact CD1-CG 3.88Å; Y278-Y280 HydrophobicContact CD1-CG 3.88Å; Y278-Y280 HydrophobicContact CE1-CD1 4.27Å; Y278-Y280 AromaticContact CE1-CD2 3.52Å; Y278-Y280 HydrophobicContact CE1-CD2 3.52Å; Y278-Y280 HydrophobicContact CE1-CE1 4.22Å; Y278-Y280 AromaticContact CE1-CE2 3.48Å; Y278-Y280 HydrophobicContact CE1-CE2 3.48Å; Y278-Y280 VanDerWaalsContact CE1-CE2 3.48Å; Y278-Y280 AromaticContact CE1-CG 3.92Å; Y278-Y280 HydrophobicContact CE1-CG 3.92Å; Y278-Y280 AromaticContact CE1-CZ 3.83Å; Y278-Y280 PolarHBondContact O-N 2.9Å; Y278-V281 PolarHBondContact O-N 3.39Å; Y278-R286 PolarHBondContact O-NH2 2.76Å; Y278-D315 WeakPolarHBondContact CB-O 3.42Å; Y278-D315 PolarHBondContact N-O 2.86Å; Y278-Q317 HydrophobicContact CD2-CB 4.33Å; Y278-H329 AromaticContact CD2-CE1 3.43Å; Y278-H329 VanDerWaalsContact CD2-CE1 3.43Å; Y278-H329 WeakPolarHBondContact CD2-CE1 3.26Å; Y278-H329 AromaticContact CD2-ND1 3.86Å; Y278-H329 AromaticContact CE2-CE1 3.51Å
279	G	82.8	Confident	92.2	Very high	54 Å²	54	59.7 Å²	59.7	56%	0.557	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-30.5	-177	0	0	0	0	0	114.7	V281 R286	G279-V281 PolarHBondContact O-N 3.43Å; G279-R286 VanDerWaalsContact C-NH2 3.3Å; G279-R286 PolarHBondContact O-NH2 3.01Å
280	Y	84.7	Confident	92.3	Very high	180 Å²	180	61.3 Å²	61.3	71%	0.706	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.3	-15.9	-175.3	-59	-34.4	0	0	0	115.5	Y278 N282	Y278-Y280 VanDerWaalsContact C-N 3.28Å; Y278-Y280 AromaticContact CD1-CD2 3.61Å; Y278-Y280 HydrophobicContact CD1-CD2 3.61Å; Y278-Y280 HydrophobicContact CD1-CE2 4.06Å; Y278-Y280 AromaticContact CD1-CG 3.88Å; Y278-Y280 HydrophobicContact CD1-CG 3.88Å; Y278-Y280 HydrophobicContact CE1-CD1 4.27Å; Y278-Y280 AromaticContact CE1-CD2 3.52Å; Y278-Y280 HydrophobicContact CE1-CD2 3.52Å; Y278-Y280 HydrophobicContact CE1-CE1 4.22Å; Y278-Y280 AromaticContact CE1-CE2 3.48Å; Y278-Y280 HydrophobicContact CE1-CE2 3.48Å; Y278-Y280 VanDerWaalsContact CE1-CE2 3.48Å; Y278-Y280 AromaticContact CE1-CG 3.92Å; Y278-Y280 HydrophobicContact CE1-CG 3.92Å; Y278-Y280 AromaticContact CE1-CZ 3.83Å; Y278-Y280 PolarHBondContact O-N 2.9Å; Y280-N282 PolarHBondContact O-N 2.9Å
281	V	90	Very high	92.5	Very high	6 Å²	6	61.1 Å²	61.1	4%	0.036	30%	0.302	C	S	.	.	S	Bend	trans	-59	134.4	170.3	-177.7	0	0	0	0	108.7	F277 Y278 G279 T285 R286 L314 D315	F277-V281 HydrophobicContact CB-CB 4.46Å; F277-V281 HydrophobicContact CB-CG2 4.12Å; F277-V281 HydrophobicContact CD1-CG2 4.48Å; Y278-V281 PolarHBondContact O-N 3.39Å; G279-V281 PolarHBondContact O-N 3.43Å; V281-T285 HydrophobicContact CG1-CG2 3.95Å; V281-R286 HydrophobicContact CG1-CG 4.03Å; V281-R286 PolarHBondContact O-NH1 2.99Å; V281-R286 PolarHBondContact O-NH2 2.79Å; V281-L314 HydrophobicContact CG1-CD2 4.38Å; V281-D315 HydrophobicContact CG2-CB 4.18Å; V281-D315 WeakPolarHBondContact CG2-O 3.24Å
282	N	88.7	Confident	92.7	Very high	93 Å²	93	62.8 Å²	62.8	50%	0.497	31%	0.306	S	S	.	.			trans	-78.1	155.2	178.7	71	62.3	0	0	0	111.4	Y280 R284 T285 R286	Y280-N282 PolarHBondContact O-N 2.9Å; N282-R284 PolarHBondContact O-N 2.9Å; N282-R284 WeakPolarHBondContact OD1-CB 3.27Å; N282-R284 PolarHBondContact OD1-N 2.95Å; N282-T285 PolarHBondContact ND2-OG1 3Å; N282-T285 VanDerWaalsContact ND2-OG1 3.09Å; N282-T285 WeakPolarHBondContact O-CB 3.33Å; N282-T285 PolarHBondContact O-N 3.01Å; N282-T285 WeakPolarHBondContact OD1-CB 3.37Å; N282-T285 PolarHBondContact OD1-N 2.93Å; N282-T285 PolarHBondContact OD1-OG1 3.38Å; N282-R286 PolarHBondContact O-N 2.87Å; N282-R286 VanDerWaalsContact O-N 3.16Å
283	D	88.2	Confident	92.7	Very high	109 Å²	109	61 Å²	61	58%	0.583	30%	0.302	S	S	*	.	H	α-helix	trans	-66.1	-35.2	-171.8	-61.9	-48.3	0	0	0	113.3	T285 R286 E287	D283-T285 PolarHBondContact O-N 3.36Å; D283-R286 CarbonylContact O-C 3.47Å; D283-R286 WeakPolarHBondContact O-CA 3.27Å; D283-R286 WeakPolarHBondContact O-CB 3.26Å; D283-R286 PolarHBondContact O-N 3.44Å; D283-R286 IonicContact OD1-CZ 2.68Å; D283-R286 IonicContact OD1-NH1 3.66Å; D283-R286 PolarHBondContact OD1-NH1 3.47Å; D283-E287 WeakPolarHBondContact O-CG 3.47Å; D283-E287 PolarHBondContact O-N 3.25Å
284	R	88.3	Confident	92.6	Very high	141 Å²	141	66.5 Å²	66.5	53%	0.532	33%	0.326	S	S	.	.	H	α-helix	trans	-54	-42.1	170	-113.4	-177.7	169.6	-156	-11.7	111.9	N282 R286 E287 L288 E308	N282-R284 PolarHBondContact O-N 2.9Å; N282-R284 WeakPolarHBondContact OD1-CB 3.27Å; N282-R284 PolarHBondContact OD1-N 2.95Å; R284-R286 VanDerWaalsContact C-N 3.31Å; R284-R286 PolarHBondContact O-N 3.44Å; R284-E287 WeakPolarHBondContact O-CB 3.42Å; R284-E287 PolarHBondContact O-N 3.31Å; R284-L288 WeakPolarHBondContact O-CG 3.46Å; R284-L288 PolarHBondContact O-N 2.63Å; R284-E308 IonicContact CZ-OE1 2.73Å; R284-E308 IonicContact CZ-OE2 3.73Å; R284-E308 IonicContact NH1-OE1 3.36Å; R284-E308 PolarHBondContact NH1-OE1 2.88Å; R284-E308 IonicContact NH1-OE2 3.93Å; R284-E308 PolarHBondContact NH1-OE2 3.09Å; R284-E308 IonicContact NH2-OE1 2.98Å; R284-E308 PolarHBondContact NH2-OE1 2.79Å; R284-E308 IonicContact NH2-OE2 3.98Å; R284-E308 PolarHBondContact NH2-OE2 3.46Å
285	T	91.6	Very high	92.6	Very high	3 Å²	3	66.9 Å²	66.9	2%	0.018	33%	0.331	C	S	.	.	H	α-helix	trans	-71.6	-27.6	178.8	-50.6	0	0	0	0	111.8	V281 N282 D283 L288 F289 Y312 L314	V281-T285 HydrophobicContact CG1-CG2 3.95Å; N282-T285 PolarHBondContact ND2-OG1 3Å; N282-T285 VanDerWaalsContact ND2-OG1 3.09Å; N282-T285 WeakPolarHBondContact O-CB 3.33Å; N282-T285 PolarHBondContact O-N 3.01Å; N282-T285 WeakPolarHBondContact OD1-CB 3.37Å; N282-T285 PolarHBondContact OD1-N 2.93Å; N282-T285 PolarHBondContact OD1-OG1 3.38Å; D283-T285 PolarHBondContact O-N 3.36Å; T285-L288 PolarHBondContact O-N 2.91Å; T285-F289 HydrophobicContact CG2-CD2 3.89Å; T285-F289 HydrophobicContact CG2-CE2 4.34Å; T285-F289 PolarHBondContact O-N 3.48Å; T285-Y312 HydrophobicContact CG2-CD1 4.13Å; T285-Y312 HydrophobicContact CG2-CG 4.45Å; T285-L314 HydrophobicContact CG2-CD2 3.34Å
286	R	91.4	Very high	92.5	Very high	89 Å²	89	66.3 Å²	66.3	34%	0.336	33%	0.328	S	S	.	.	H	α-helix	trans	-74.6	-23	170.1	-61.4	-177.2	178.2	108.1	9.6	113.6	Y278 G279 V281 N282 D283 R284	Y278-R286 PolarHBondContact O-NH2 2.76Å; G279-R286 VanDerWaalsContact C-NH2 3.3Å; G279-R286 PolarHBondContact O-NH2 3.01Å; V281-R286 HydrophobicContact CG1-CG 4.03Å; V281-R286 PolarHBondContact O-NH1 2.99Å; V281-R286 PolarHBondContact O-NH2 2.79Å; N282-R286 PolarHBondContact O-N 2.87Å; N282-R286 VanDerWaalsContact O-N 3.16Å; D283-R286 CarbonylContact O-C 3.47Å; D283-R286 WeakPolarHBondContact O-CA 3.27Å; D283-R286 WeakPolarHBondContact O-CB 3.26Å; D283-R286 PolarHBondContact O-N 3.44Å; D283-R286 IonicContact OD1-CZ 2.68Å; D283-R286 IonicContact OD1-NH1 3.66Å; D283-R286 PolarHBondContact OD1-NH1 3.47Å; R284-R286 VanDerWaalsContact C-N 3.31Å; R284-R286 PolarHBondContact O-N 3.44Å
287	E	92.7	Very high	92.6	Very high	132 Å²	132	66.3 Å²	66.3	62%	0.617	33%	0.325	S	S	*	.	H	α-helix	trans	-76.1	-35.3	169.6	-65.7	168.6	161.3	0	0	111	D283 R284 G302	D283-E287 WeakPolarHBondContact O-CG 3.47Å; D283-E287 PolarHBondContact O-N 3.25Å; R284-E287 WeakPolarHBondContact O-CB 3.42Å; R284-E287 PolarHBondContact O-N 3.31Å; E287-G302 PolarHBondContact O-N 2.64Å
288	L	95.3	Very high	92.7	Very high	23 Å²	23	64.8 Å²	64.8	12%	0.12	32%	0.318	C	S	.	.	H	α-helix	trans	-78.5	-35.5	-179.8	-67	178	0	0	0	114.1	R284 T285 T301 G302 A303 L304 Y312	R284-L288 WeakPolarHBondContact O-CG 3.46Å; R284-L288 PolarHBondContact O-N 2.63Å; T285-L288 PolarHBondContact O-N 2.91Å; L288-T301 PolarHBondContact O-N 3.27Å; L288-G302 PolarHBondContact O-N 2.95Å; L288-G302 VanDerWaalsContact O-N 3.15Å; L288-A303 WeakPolarHBondContact CD2-O 3.27Å; L288-L304 HydrophobicContact CB-CD2 4.29Å; L288-L304 HydrophobicContact CD1-CD2 4.38Å; L288-L304 HydrophobicContact CD2-CD2 4.39Å; L288-Y312 HydrophobicContact CD1-CD1 4.22Å; L288-Y312 HydrophobicContact CD1-CE1 3.4Å; L288-Y312 VanDerWaalsContact CD1-CE1 3.4Å; L288-Y312 HydrophobicContact CD1-CE2 4.13Å; L288-Y312 VanDerWaalsContact CD1-OH 3.29Å; L288-Y312 WeakPolarHBondContact CD1-OH 3.27Å
289	F	96.7	Very high	93	Very high	1 Å²	1	62.3 Å²	62.3	0%	0.004	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	143	-176.3	-58.9	-84.4	0	0	0	112.5	V257 F277 T285 V298 T299 V300 L304 Y312 L314 V334	V257-F289 HydrophobicContact CG2-CD1 4.08Å; V257-F289 HydrophobicContact CG2-CE1 4.04Å; F277-F289 VanDerWaalsContact CE2-O 3.29Å; F277-F289 WeakPolarHBondContact CE2-O 3.42Å; F277-F289 HydrophobicContact CZ-CB 4.11Å; T285-F289 HydrophobicContact CG2-CD2 3.89Å; T285-F289 HydrophobicContact CG2-CE2 4.34Å; T285-F289 PolarHBondContact O-N 3.48Å; F289-V298 HydrophobicContact CB-CG1 4.49Å; F289-V298 HydrophobicContact CD1-CG1 4.48Å; F289-T299 WeakPolarHBondContact CA-O 3.41Å; F289-V300 HydrophobicContact CE1-CG2 4.24Å; F289-L304 HydrophobicContact CE1-CD1 4.36Å; F289-L304 HydrophobicContact CE1-CD2 4.2Å; F289-L304 HydrophobicContact CE2-CD2 4.06Å; F289-L304 HydrophobicContact CZ-CD1 4.28Å; F289-L304 HydrophobicContact CZ-CD2 3.6Å; F289-Y312 HydrophobicContact CE2-CD1 4.38Å; F289-Y312 AromaticContact CE2-CD2 3.7Å; F289-Y312 HydrophobicContact CE2-CD2 3.7Å; F289-Y312 HydrophobicContact CE2-CE2 4.34Å; F289-Y312 AromaticContact CE2-CG 3.72Å; F289-Y312 HydrophobicContact CE2-CG 3.72Å; F289-Y312 AromaticContact CZ-CD2 3.94Å; F289-Y312 HydrophobicContact CZ-CD2 3.94Å; F289-Y312 HydrophobicContact CZ-CG 4.36Å; F289-L314 HydrophobicContact CB-CD1 4.49Å; F289-L314 HydrophobicContact CB-CD2 4.32Å; F289-L314 HydrophobicContact CD2-CD2 4.07Å; F289-L314 HydrophobicContact CG-CD1 4.35Å; F289-L314 HydrophobicContact CG-CD2 4.35Å; F289-V334 HydrophobicContact CE1-CG1 4.06Å; F289-V334 HydrophobicContact CE1-CG2 4.38Å; F289-V334 HydrophobicContact CZ-CB 4.25Å; F289-V334 HydrophobicContact CZ-CG1 3.89Å; F289-V334 HydrophobicContact CZ-CG2 4.4Å
290	Q	95.8	Very high	93.7	Very high	112 Å²	112	59.7 Å²	59.7	52%	0.523	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	145.6	170.4	-178	173.7	-4.4	0	0	110	V298 T299 T301	Q290-V298 CarbonylContact O-C 3.58Å; Q290-V298 WeakPolarHBondContact O-CA 3.46Å; Q290-T299 PolarHBondContact N-O 2.82Å; Q290-T299 PolarHBondContact O-N 2.86Å; Q290-T299 PolarHBondContact O-OG1 3.45Å; Q290-T301 VanDerWaalsContact CB-OG1 3.26Å; Q290-T301 WeakPolarHBondContact CB-OG1 3.49Å; Q290-T301 PolarHBondContact N-OG1 2.88Å
291	I	97.1	Very high	94.2	Very high	12 Å²	12	54 Å²	54	6%	0.062	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	134.2	167.7	-171.9	168	0	0	0	110.1	L260 F277 P293 L297 V298 V316	L260-I291 HydrophobicContact CD1-CD1 4.1Å; F277-I291 HydrophobicContact CD1-CG2 4.37Å; F277-I291 HydrophobicContact CD2-CG2 4.06Å; F277-I291 HydrophobicContact CE1-CB 4.22Å; F277-I291 HydrophobicContact CE1-CG2 4.21Å; F277-I291 HydrophobicContact CE2-CB 4.26Å; F277-I291 HydrophobicContact CE2-CG2 3.92Å; F277-I291 HydrophobicContact CG-CG2 4.27Å; F277-I291 HydrophobicContact CZ-CB 3.92Å; F277-I291 HydrophobicContact CZ-CG2 3.99Å; I291-P293 WeakPolarHBondContact O-CD 3.48Å; I291-L297 WeakPolarHBondContact CA-O 3.44Å; I291-V298 HydrophobicContact CB-CG2 4.3Å; I291-V298 HydrophobicContact CD1-CG2 3.99Å; I291-V298 HydrophobicContact CG1-CG2 4.06Å; I291-V316 HydrophobicContact CD1-CG1 3.65Å
292	D	96.9	Very high	94.3	Very high	57 Å²	57	54.6 Å²	54.6	31%	0.305	28%	0.276	S	S	.	.			trans	-75.8	119.9	170.1	169.2	50.2	0	0	0	110.4	H294 S295 G296 L297	D292-H294 PolarHBondContact O-N 2.78Å; D292-H294 VanDerWaalsContact O-N 3.12Å; D292-S295 WeakPolarHBondContact OD2-CA 3.43Å; D292-S295 WeakPolarHBondContact OD2-CB 3.48Å; D292-S295 PolarHBondContact OD2-N 2.98Å; D292-S295 PolarHBondContact OD2-OG 2.98Å; D292-G296 PolarHBondContact O-N 3.44Å; D292-L297 HydrophobicContact CB-CB 4.5Å; D292-L297 PolarHBondContact N-O 2.82Å
293	P	96.3	Very high	94.5	Very high	49 Å²	49	54.3 Å²	54.3	32%	0.318	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-17.8	-172.2	-24.4	35	0	0	0	115.9	V274 Y275 I291	V274-P293 CarbonylContact C-O 3.55Å; V274-P293 WeakPolarHBondContact CA-O 3.29Å; V274-P293 HydrophobicContact CG1-CB 3.81Å; Y275-P293 WeakPolarHBondContact CD2-O 3.4Å; Y275-P293 PolarHBondContact N-O 2.93Å; Y275-P293 WeakPolarHBondContact O-CA 3.34Å; Y275-P293 WeakPolarHBondContact O-CB 3.22Å; I291-P293 WeakPolarHBondContact O-CD 3.48Å
294	H	94	Very high	94.9	Very high	137 Å²	137	49.4 Å²	49.4	63%	0.634	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.2	-34.6	-175.1	-58.3	92.4	0	0	0	113.5	D292	D292-H294 PolarHBondContact O-N 2.78Å; D292-H294 VanDerWaalsContact O-N 3.12Å
295	S	95.4	Very high	95.2	Very high	46 Å²	46	45.5 Å²	45.5	32%	0.322	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	-110.2	2.1	-172.6	83	0	0	0	0	114.3	R259 D292 L297	R259-S295 WeakPolarHBondContact CG-O 3.28Å; R259-S295 PolarHBondContact NH1-O 2.84Å; R259-S295 PolarHBondContact NH1-OG 3.19Å; D292-S295 WeakPolarHBondContact OD2-CA 3.43Å; D292-S295 WeakPolarHBondContact OD2-CB 3.48Å; D292-S295 PolarHBondContact OD2-N 2.98Å; D292-S295 PolarHBondContact OD2-OG 2.98Å; S295-L297 PolarHBondContact O-N 3.15Å
296	G	94.9	Very high	95.4	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	26%	0.258	C	S	.	.			trans	67.9	11.1	176.2	0	0	0	0	0	114.3	L260 D292 V298	L260-G296 PolarHBondContact N-O 3.05Å; D292-G296 PolarHBondContact O-N 3.44Å; G296-V298 PolarHBondContact O-N 3.19Å
297	L	97.6	Very high	95.6	Very high	42 Å²	42	45.8 Å²	45.8	22%	0.22	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	116	-176.6	-174.4	68.7	0	0	0	110.7	P256 R259 I291 D292 S295 T299	P256-L297 HydrophobicContact CB-CD1 4.1Å; R259-L297 HydrophobicContact CB-CD1 4.1Å; I291-L297 WeakPolarHBondContact CA-O 3.44Å; D292-L297 HydrophobicContact CB-CB 4.5Å; D292-L297 PolarHBondContact N-O 2.82Å; S295-L297 PolarHBondContact O-N 3.15Å; L297-T299 HydrophobicContact CD2-CG2 3.98Å; L297-T299 HydrophobicContact CG-CG2 3.97Å
298	V	97.5	Very high	95.6	Very high	0 Å²	0	45 Å²	45	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	134	168.2	-176.2	0	0	0	0	109.1	V257 I258 L260 F289 Q290 I291 G296 L314	V257-V298 HydrophobicContact CB-CB 4.25Å; V257-V298 HydrophobicContact CB-CG1 4.08Å; V257-V298 HydrophobicContact CG1-CG1 4.44Å; V257-V298 HydrophobicContact CG2-CG1 4.39Å; V257-V298 PolarHBondContact N-O 2.94Å; I258-V298 HydrophobicContact CG2-CB 4.04Å; I258-V298 HydrophobicContact CG2-CG2 3.99Å; I258-V298 PolarHBondContact O-N 2.83Å; L260-V298 HydrophobicContact CD1-CG2 4.12Å; L260-V298 HydrophobicContact CG-CG2 4.48Å; F289-V298 HydrophobicContact CB-CG1 4.49Å; F289-V298 HydrophobicContact CD1-CG1 4.48Å; Q290-V298 CarbonylContact O-C 3.58Å; Q290-V298 WeakPolarHBondContact O-CA 3.46Å; I291-V298 HydrophobicContact CB-CG2 4.3Å; I291-V298 HydrophobicContact CD1-CG2 3.99Å; I291-V298 HydrophobicContact CG1-CG2 4.06Å; G296-V298 PolarHBondContact O-N 3.19Å; V298-L314 HydrophobicContact CG1-CD1 3.9Å
299	T	97.3	Very high	95.4	Very high	22 Å²	22	44.5 Å²	44.5	14%	0.135	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	147.3	-179.2	56.7	0	0	0	0	111.8	T255 F289 Q290 L297	T255-T299 CarbonylContact O-C 3.52Å; T255-T299 VanDerWaalsContact O-CA 3.27Å; T255-T299 WeakPolarHBondContact O-CA 3.33Å; F289-T299 WeakPolarHBondContact CA-O 3.41Å; Q290-T299 PolarHBondContact N-O 2.82Å; Q290-T299 PolarHBondContact O-N 2.86Å; Q290-T299 PolarHBondContact O-OG1 3.45Å; L297-T299 HydrophobicContact CD2-CG2 3.98Å; L297-T299 HydrophobicContact CG-CG2 3.97Å
300	V	97.2	Very high	95.2	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	137	168.9	-176.4	0	0	0	0	109.1	V247 N254 T255 V257 F289 G302 L304	V247-V300 HydrophobicContact CG1-CG2 4.11Å; N254-V300 PolarHBondContact N-O 2.74Å; T255-V300 HydrophobicContact CG2-CG2 4.45Å; T255-V300 PolarHBondContact O-N 2.74Å; V257-V300 HydrophobicContact CG2-CG2 3.68Å; F289-V300 HydrophobicContact CE1-CG2 4.24Å; V300-G302 VanDerWaalsContact CG1-O 3.27Å; V300-G302 WeakPolarHBondContact CG1-O 3.39Å; V300-L304 HydrophobicContact CG1-CD1 4.08Å; V300-L304 HydrophobicContact CG1-CG 3.95Å; V300-L304 HydrophobicContact CG2-CD1 3.92Å
301	T	94.9	Very high	95.2	Very high	59 Å²	59	47.6 Å²	47.6	36%	0.362	27%	0.269	S	S	.	.			trans	-127.9	-46.7	-177.7	-57.1	0	0	0	0	111.8	L288 Q290	L288-T301 PolarHBondContact O-N 3.27Å; Q290-T301 VanDerWaalsContact CB-OG1 3.26Å; Q290-T301 WeakPolarHBondContact CB-OG1 3.49Å; Q290-T301 PolarHBondContact N-OG1 2.88Å
302	G	92.6	Very high	95.1	Very high	20 Å²	20	48.3 Å²	48.3	21%	0.206	27%	0.271	C	S	.	.	S	Bend	trans	-86.1	-176.9	170.1	0	0	0	0	0	112.8	E287 L288 V300	E287-G302 PolarHBondContact O-N 2.64Å; L288-G302 PolarHBondContact O-N 2.95Å; L288-G302 VanDerWaalsContact O-N 3.15Å; V300-G302 VanDerWaalsContact CG1-O 3.27Å; V300-G302 WeakPolarHBondContact CG1-O 3.39Å
303	A	93.8	Very high	95	Very high	87 Å²	87	50.2 Å²	50.2	72%	0.719	28%	0.278	S	S	*	.			trans	-83.6	128.4	171.6	0	0	0	0	0	110	L288	L288-A303 WeakPolarHBondContact CD2-O 3.27Å
304	L	95.4	Very high	94.9	Very high	5 Å²	5	47.9 Å²	47.9	3%	0.026	26%	0.263	C	S	.	.			trans	-87.9	133.1	171.1	-58.9	179	0	0	0	109.2	V247 E249 N250 L288 F289 V300 Y312	V247-L304 HydrophobicContact CB-CD1 4.49Å; V247-L304 HydrophobicContact CG1-CD1 3.93Å; E249-L304 HydrophobicContact CB-CB 4.46Å; N250-L304 PolarHBondContact N-O 2.83Å; L288-L304 HydrophobicContact CB-CD2 4.29Å; L288-L304 HydrophobicContact CD1-CD2 4.38Å; L288-L304 HydrophobicContact CD2-CD2 4.39Å; F289-L304 HydrophobicContact CE1-CD1 4.36Å; F289-L304 HydrophobicContact CE1-CD2 4.2Å; F289-L304 HydrophobicContact CE2-CD2 4.06Å; F289-L304 HydrophobicContact CZ-CD1 4.28Å; F289-L304 HydrophobicContact CZ-CD2 3.6Å; V300-L304 HydrophobicContact CG1-CD1 4.08Å; V300-L304 HydrophobicContact CG1-CG 3.95Å; V300-L304 HydrophobicContact CG2-CD1 3.92Å; L304-Y312 HydrophobicContact CD2-CE2 4.14Å
305	D	95.4	Very high	95	Very high	59 Å²	59	43.8 Å²	43.8	32%	0.316	25%	0.246	S	C	.	.			trans	-135.4	115.2	-177.4	172.2	-36.6	0	0	0	106.4	E307 E308 G309	D305-E307 PolarHBondContact OD1-N 3.31Å; D305-E307 VanDerWaalsContact OD1-N 3.11Å; D305-E308 HydrophobicContact CB-CB 4.29Å; D305-E308 PolarHBondContact OD1-N 3.31Å; D305-G309 PolarHBondContact O-N 3.08Å
306	Y	96.1	Very high	95	Very high	50 Å²	50	41.6 Å²	41.6	20%	0.196	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-34.7	-174.1	178.1	-85	0	0	0	111.7	E249 E308 G309 H310 V336 D338	E249-Y306 VanDerWaalsContact CD-CB 3.45Å; E249-Y306 WeakPolarHBondContact OE1-CB 3.29Å; E249-Y306 WeakPolarHBondContact OE2-CB 3.47Å; E249-Y306 PolarHBondContact OE2-N 2.85Å; Y306-E308 VanDerWaalsContact C-N 3.35Å; Y306-G309 PolarHBondContact O-N 2.85Å; Y306-H310 HydrophobicContact CD1-CB 4.34Å; Y306-H310 HydrophobicContact CD2-CB 3.41Å; Y306-H310 VanDerWaalsContact CD2-CB 3.41Å; Y306-H310 HydrophobicContact CE1-CB 4.28Å; Y306-H310 HydrophobicContact CE2-CB 3.34Å; Y306-H310 HydrophobicContact CG-CB 3.93Å; Y306-H310 PolarHBondContact O-N 3.16Å; Y306-V336 HydrophobicContact CD2-CB 4.13Å; Y306-V336 HydrophobicContact CD2-CG1 4.23Å; Y306-V336 WeakPolarHBondContact CD2-O 3.05Å; Y306-V336 WeakPolarHBondContact CE2-O 3.27Å; Y306-D338 HydrophobicContact CD1-CB 4.19Å; Y306-D338 HydrophobicContact CD2-CB 4.02Å; Y306-D338 HydrophobicContact CE1-CB 4.15Å; Y306-D338 HydrophobicContact CE2-CB 3.96Å; Y306-D338 HydrophobicContact CG-CB 4.15Å
307	E	95.3	Very high	95.1	Very high	48 Å²	48	43.8 Å²	43.8	22%	0.224	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-30.1	176.3	-79.1	66	-115.7	0	0	113.5	D305 N342 R376	D305-E307 PolarHBondContact OD1-N 3.31Å; D305-E307 VanDerWaalsContact OD1-N 3.11Å; E307-N342 PolarHBondContact OE2-ND2 3.44Å; E307-R376 HydrophobicContact CG-CB 4Å
308	E	92.4	Very high	95	Very high	116 Å²	116	41.8 Å²	41.8	54%	0.542	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.3	-39.1	170.3	178.5	156.4	-118.7	0	0	112.1	R284 D305 Y306	R284-E308 IonicContact CZ-OE1 2.73Å; R284-E308 IonicContact CZ-OE2 3.73Å; R284-E308 IonicContact NH1-OE1 3.36Å; R284-E308 PolarHBondContact NH1-OE1 2.88Å; R284-E308 IonicContact NH1-OE2 3.93Å; R284-E308 PolarHBondContact NH1-OE2 3.09Å; R284-E308 IonicContact NH2-OE1 2.98Å; R284-E308 PolarHBondContact NH2-OE1 2.79Å; R284-E308 IonicContact NH2-OE2 3.98Å; R284-E308 PolarHBondContact NH2-OE2 3.46Å; D305-E308 HydrophobicContact CB-CB 4.29Å; D305-E308 PolarHBondContact OD1-N 3.31Å; Y306-E308 VanDerWaalsContact C-N 3.35Å
309	G	91.4	Very high	94.9	Very high	12 Å²	12	45.9 Å²	45.9	12%	0.124	25%	0.248	C	C	.	.			trans	-162.6	99.1	-176.8	0	0	0	0	0	115.7	D305 Y306 Y312 V336	D305-G309 PolarHBondContact O-N 3.08Å; Y306-G309 PolarHBondContact O-N 2.85Å; G309-Y312 WeakPolarHBondContact O-CE2 3.47Å; G309-Y312 PolarHBondContact O-OH 2.97Å; G309-V336 WeakPolarHBondContact O-CG2 3.13Å
310	H	92.9	Very high	94.9	Very high	103 Å²	103	45 Å²	45	48%	0.477	24%	0.243	S	C	.	.	S	Bend	trans	-86.2	-9	-179.3	56.8	-85.8	0	0	0	116	Y306 V336	Y306-H310 HydrophobicContact CD1-CB 4.34Å; Y306-H310 HydrophobicContact CD2-CB 3.41Å; Y306-H310 VanDerWaalsContact CD2-CB 3.41Å; Y306-H310 HydrophobicContact CE1-CB 4.28Å; Y306-H310 HydrophobicContact CE2-CB 3.34Å; Y306-H310 HydrophobicContact CG-CB 3.93Å; Y306-H310 PolarHBondContact O-N 3.16Å; H310-V336 PolarHBondContact O-N 2.79Å
311	V	95.4	Very high	94.8	Very high	75 Å²	75	49.5 Å²	49.5	46%	0.455	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	127.9	174.5	180	0	0	0	0	110.7	T333 V334	V311-T333 HydrophobicContact CG1-CG2 3.76Å; V311-V334 WeakPolarHBondContact CA-O 3.06Å
312	Y	94.8	Very high	94.6	Very high	27 Å²	27	47.3 Å²	47.3	11%	0.106	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	140.5	172.3	-59.8	-80.9	0	0	0	110.7	T285 L288 F289 L304 G309 V334 V336	T285-Y312 HydrophobicContact CG2-CD1 4.13Å; T285-Y312 HydrophobicContact CG2-CG 4.45Å; L288-Y312 HydrophobicContact CD1-CD1 4.22Å; L288-Y312 HydrophobicContact CD1-CE1 3.4Å; L288-Y312 VanDerWaalsContact CD1-CE1 3.4Å; L288-Y312 HydrophobicContact CD1-CE2 4.13Å; L288-Y312 VanDerWaalsContact CD1-OH 3.29Å; L288-Y312 WeakPolarHBondContact CD1-OH 3.27Å; F289-Y312 HydrophobicContact CE2-CD1 4.38Å; F289-Y312 AromaticContact CE2-CD2 3.7Å; F289-Y312 HydrophobicContact CE2-CD2 3.7Å; F289-Y312 HydrophobicContact CE2-CE2 4.34Å; F289-Y312 AromaticContact CE2-CG 3.72Å; F289-Y312 HydrophobicContact CE2-CG 3.72Å; F289-Y312 AromaticContact CZ-CD2 3.94Å; F289-Y312 HydrophobicContact CZ-CD2 3.94Å; F289-Y312 HydrophobicContact CZ-CG 4.36Å; L304-Y312 HydrophobicContact CD2-CE2 4.14Å; G309-Y312 WeakPolarHBondContact O-CE2 3.47Å; G309-Y312 PolarHBondContact O-OH 2.97Å; Y312-V334 PolarHBondContact N-O 3.27Å; Y312-V334 PolarHBondContact O-N 2.76Å; Y312-V336 HydrophobicContact CD2-CG2 3.98Å; Y312-V336 HydrophobicContact CE2-CG2 3.7Å
313	E	94.1	Very high	94.4	Very high	98 Å²	98	50.3 Å²	50.3	46%	0.458	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	116.8	178.4	-55.7	-157.8	125.2	0	0	109.5	K331	E313-K331 WeakPolarHBondContact OE1-CE 3.27Å; E313-K331 IonicContact OE1-NZ 2.7Å; E313-K331 PolarHBondContact OE1-NZ 2.86Å; E313-K331 VanDerWaalsContact OE2-CE 3.27Å; E313-K331 WeakPolarHBondContact OE2-CE 3.16Å; E313-K331 IonicContact OE2-NZ 3.79Å; E313-K331 PolarHBondContact OE2-NZ 2.79Å
314	L	95.4	Very high	94.2	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	100.6	-179.9	-51.5	171.4	0	0	0	108.7	F277 V281 T285 F289 V298 V316 V332 V334	F277-L314 HydrophobicContact CD1-CB 4.35Å; F277-L314 HydrophobicContact CD1-CD2 4.46Å; F277-L314 HydrophobicContact CE1-CB 4.09Å; F277-L314 HydrophobicContact CE1-CD1 4.09Å; F277-L314 HydrophobicContact CE1-CD2 3.96Å; F277-L314 HydrophobicContact CE1-CG 4.28Å; F277-L314 HydrophobicContact CZ-CD2 4.38Å; V281-L314 HydrophobicContact CG1-CD2 4.38Å; T285-L314 HydrophobicContact CG2-CD2 3.34Å; F289-L314 HydrophobicContact CB-CD1 4.49Å; F289-L314 HydrophobicContact CB-CD2 4.32Å; F289-L314 HydrophobicContact CD2-CD2 4.07Å; F289-L314 HydrophobicContact CG-CD1 4.35Å; F289-L314 HydrophobicContact CG-CD2 4.35Å; V298-L314 HydrophobicContact CG1-CD1 3.9Å; L314-V316 HydrophobicContact CB-CG2 4.26Å; L314-V316 PolarHBondContact O-N 3.27Å; L314-V332 HydrophobicContact CB-CB 4.16Å; L314-V332 HydrophobicContact CD1-CB 4.43Å; L314-V332 PolarHBondContact N-O 3.05Å; L314-V332 PolarHBondContact O-N 2.83Å; L314-V334 HydrophobicContact CD1-CG2 3.72Å; L314-V334 HydrophobicContact CG-CG2 4.32Å
315	D	95.1	Very high	94	Very high	51 Å²	51	54 Å²	54	27%	0.273	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	113.4	163.6	-66.9	-33.9	0	0	0	108.1	Y278 V281	Y278-D315 WeakPolarHBondContact CB-O 3.42Å; Y278-D315 PolarHBondContact N-O 2.86Å; V281-D315 HydrophobicContact CG2-CB 4.18Å; V281-D315 WeakPolarHBondContact CG2-O 3.24Å
316	V	96.5	Very high	93.9	Very high	0 Å²	0	56.5 Å²	56.5	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	137	-179.8	-178	0	0	0	0	109.1	F238 L260 S276 F277 I291 L314 H329 C330 V332	F238-V316 HydrophobicContact CZ-CG1 4.18Å; L260-V316 HydrophobicContact CD1-CB 4Å; L260-V316 HydrophobicContact CD1-CG1 3.72Å; L260-V316 HydrophobicContact CD1-CG2 3.83Å; S276-V316 WeakPolarHBondContact O-CG1 3.21Å; F277-V316 HydrophobicContact CD1-CG2 3.98Å; F277-V316 HydrophobicContact CE1-CG2 4.13Å; I291-V316 HydrophobicContact CD1-CG1 3.65Å; L314-V316 HydrophobicContact CB-CG2 4.26Å; L314-V316 PolarHBondContact O-N 3.27Å; V316-H329 WeakPolarHBondContact O-CA 3.4Å; V316-C330 PolarHBondContact N-O 2.88Å; V316-C330 PolarHBondContact O-N 3.02Å; V316-V332 HydrophobicContact CG2-CG2 4.27Å
317	Q	95.6	Very high	93.8	Very high	45 Å²	45	55.9 Å²	55.9	21%	0.21	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	144	168.4	65.1	173.2	20.7	0	0	111.5	Y275 S276 Y278 P327 A328 H329	Y275-Q317 WeakPolarHBondContact CA-O 3.42Å; S276-Q317 PolarHBondContact N-O 3.35Å; S276-Q317 WeakPolarHBondContact O-CG 3.16Å; S276-Q317 PolarHBondContact O-N 3.33Å; S276-Q317 VanDerWaalsContact OG-CG 3.27Å; S276-Q317 WeakPolarHBondContact OG-CG 3.46Å; S276-Q317 PolarHBondContact OG-NE2 2.9Å; Y278-Q317 HydrophobicContact CD2-CB 4.33Å; Q317-P327 HydrophobicContact CB-CB 4.44Å; Q317-A328 CarbonylContact C-O 3.5Å; Q317-A328 WeakPolarHBondContact CA-O 3.46Å; Q317-H329 WeakPolarHBondContact CB-ND1 3.28Å
318	A	96.7	Very high	93.8	Very high	0 Å²	0	54.9 Å²	54.9	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	133.1	163.6	0	0	0	0	0	107.6	P236 F238 A262 V273 Y275 P327 A328	P236-A318 HydrophobicContact CB-CB 4.1Å; F238-A318 HydrophobicContact CD2-CB 4.4Å; F238-A318 HydrophobicContact CE1-CB 3.97Å; F238-A318 HydrophobicContact CE2-CB 3.59Å; F238-A318 HydrophobicContact CZ-CB 3.34Å; A262-A318 HydrophobicContact CB-CB 3.57Å; V273-A318 HydrophobicContact CG1-CB 3.74Å; Y275-A318 HydrophobicContact CD1-CB 4.12Å; Y275-A318 HydrophobicContact CE1-CB 4.14Å; A318-P327 WeakPolarHBondContact O-CA 3.48Å; A318-A328 PolarHBondContact N-O 3.37Å; A318-A328 PolarHBondContact O-N 2.92Å
319	K	95.4	Very high	93.9	Very high	86 Å²	86	53.9 Å²	53.9	37%	0.374	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	132.7	-177.6	-166.8	-177.7	177	175.2	0	110	V274 S325 P327	V274-K319 PolarHBondContact N-O 3.4Å; V274-K319 PolarHBondContact O-N 2.72Å; K319-S325 WeakPolarHBondContact CE-O 3.1Å; K319-S325 WeakPolarHBondContact CE-OG 3.39Å; K319-S325 WeakPolarHBondContact CG-OG 3.45Å; K319-S325 PolarHBondContact NZ-O 3.46Å; K319-P327 HydrophobicContact CB-CB 4.11Å; K319-P327 HydrophobicContact CD-CB 4.39Å; K319-P327 HydrophobicContact CG-CB 4.14Å
320	D	96.1	Very high	94.1	Very high	5 Å²	5	53.6 Å²	53.6	3%	0.027	29%	0.285	C	S	.	.			trans	-69.9	176.3	171.9	59.2	94.4	0	0	0	113.1	N232 P236 N270 Q272 G322 S325	N232-D320 PolarHBondContact ND2-OD1 2.87Å; N232-D320 PolarHBondContact OD1-OD1 2.89Å; P236-D320 HydrophobicContact CG-CB 4.12Å; N270-D320 WeakPolarHBondContact O-CB 3.29Å; Q272-D320 WeakPolarHBondContact O-CA 3.34Å; D320-G322 WeakPolarHBondContact OD1-CA 3.33Å; D320-G322 PolarHBondContact OD1-N 3.47Å; D320-S325 WeakPolarHBondContact OD1-CB 3.49Å; D320-S325 PolarHBondContact OD1-OG 2.78Å; D320-S325 VanDerWaalsContact OD1-OG 3.06Å; D320-S325 VanDerWaalsContact OD2-CB 3.28Å; D320-S325 WeakPolarHBondContact OD2-CB 3.43Å; D320-S325 PolarHBondContact OD2-OG 3.46Å
321	L	94.6	Very high	94.2	Very high	93 Å²	93	51.5 Å²	51.5	49%	0.487	27%	0.274	S	S	.	.	S	Bend	trans	-103.9	11.4	175.8	-63.6	178	0	0	0	112.7	T269 Q272 V274	T269-L321 CarbonylContact O-C 3.58Å; T269-L321 WeakPolarHBondContact O-CB 3.5Å; T269-L321 PolarHBondContact O-N 2.91Å; Q272-L321 HydrophobicContact CB-CD1 4.3Å; Q272-L321 HydrophobicContact CG-CD1 4.01Å; Q272-L321 PolarHBondContact O-N 2.83Å; V274-L321 HydrophobicContact CG2-CD1 4.09Å; V274-L321 HydrophobicContact CG2-CD2 3.88Å; V274-L321 HydrophobicContact CG2-CG 3.96Å
322	G	91.5	Very high	94.3	Very high	14 Å²	14	48 Å²	48	14%	0.144	25%	0.253	C	S	.	.	S	Bend	trans	-80.2	168.4	179.9	0	0	0	0	0	114.4	T269 N270 D320 S325	T269-G322 PolarHBondContact O-N 3.15Å; N270-G322 VanDerWaalsContact OD1-CA 3.3Å; N270-G322 WeakPolarHBondContact OD1-CA 3.38Å; D320-G322 WeakPolarHBondContact OD1-CA 3.33Å; D320-G322 PolarHBondContact OD1-N 3.47Å; G322-S325 WeakPolarHBondContact O-CB 3.38Å
323	P	89.1	Confident	94.4	Very high	82 Å²	82	48.1 Å²	48.1	53%	0.532	26%	0.256	S	S	.	.	S	Bend	trans	-69.1	144.2	171.6	30.7	-34.4	0	0	0	110.9	N232 S325	N232-P323 HydrophobicContact CB-CG 4.31Å; N232-P323 PolarHBondContact ND2-O 3.26Å; N232-P323 VanDerWaalsContact ND2-O 3.15Å; P323-S325 PolarHBondContact O-N 2.81Å
324	N	89.6	Confident	94.5	Very high	161 Å²	161	43.4 Å²	43.4	86%	0.861	24%	0.235	S	C	*	.	S	Bend	trans	64	-7.8	178.4	-50	-45	0	0	0	117.3	I326	N324-I326 PolarHBondContact O-N 2.77Å
325	S	91.7	Very high	94.6	Very high	9 Å²	9	45.1 Å²	45.1	6%	0.063	25%	0.246	C	C	.	.			trans	-15.3	116.7	165.9	178.8	0	0	0	0	117	K319 D320 G322 P323	K319-S325 WeakPolarHBondContact CE-O 3.1Å; K319-S325 WeakPolarHBondContact CE-OG 3.39Å; K319-S325 WeakPolarHBondContact CG-OG 3.45Å; K319-S325 PolarHBondContact NZ-O 3.46Å; D320-S325 WeakPolarHBondContact OD1-CB 3.49Å; D320-S325 PolarHBondContact OD1-OG 2.78Å; D320-S325 VanDerWaalsContact OD1-OG 3.06Å; D320-S325 VanDerWaalsContact OD2-CB 3.28Å; D320-S325 WeakPolarHBondContact OD2-CB 3.43Å; D320-S325 PolarHBondContact OD2-OG 3.46Å; G322-S325 WeakPolarHBondContact O-CB 3.38Å; P323-S325 PolarHBondContact O-N 2.81Å
326	I	92.8	Very high	94.6	Very high	111 Å²	111	42.9 Å²	42.9	57%	0.569	24%	0.235	S	C	*	.	P	Polyproline II helix	trans	-101.5	118.9	173.6	-46.4	176.2	0	0	0	108.7	N235 N324	N235-I326 WeakPolarHBondContact OD1-CA 3.3Å; N235-I326 WeakPolarHBondContact OD1-CB 3.37Å; N235-I326 WeakPolarHBondContact OD1-CG1 2.99Å; N235-I326 PolarHBondContact OD1-N 3.21Å; N235-I326 PolarHBondContact OD1-O 3.02Å; N324-I326 PolarHBondContact O-N 2.77Å
327	P	93.5	Very high	94.6	Very high	38 Å²	38	46.9 Å²	46.9	25%	0.247	26%	0.256	C	S	.	.	P	Polyproline II helix	trans	-68.8	139.8	179.3	29.6	-34.7	0	0	0	111.2	Q317 A318 K319	Q317-P327 HydrophobicContact CB-CB 4.44Å; A318-P327 WeakPolarHBondContact O-CA 3.48Å; K319-P327 HydrophobicContact CB-CB 4.11Å; K319-P327 HydrophobicContact CD-CB 4.39Å; K319-P327 HydrophobicContact CG-CB 4.14Å
328	A	95	Very high	94.6	Very high	26 Å²	26	46.5 Å²	46.5	22%	0.215	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	161.5	164.9	0	0	0	0	0	111.3	P236 F238 Q317 A318	P236-A328 WeakPolarHBondContact O-CB 3.12Å; F238-A328 HydrophobicContact CD2-CB 4.35Å; Q317-A328 CarbonylContact C-O 3.5Å; Q317-A328 WeakPolarHBondContact CA-O 3.46Å; A318-A328 PolarHBondContact N-O 3.37Å; A318-A328 PolarHBondContact O-N 2.92Å
329	H	94.6	Very high	94.6	Very high	96 Å²	96	48.5 Å²	48.5	44%	0.444	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	141.9	-174.8	-58.3	-59.7	0	0	0	111.6	Y278 V316 Q317	Y278-H329 AromaticContact CD2-CE1 3.43Å; Y278-H329 VanDerWaalsContact CD2-CE1 3.43Å; Y278-H329 WeakPolarHBondContact CD2-CE1 3.26Å; Y278-H329 AromaticContact CD2-ND1 3.86Å; Y278-H329 AromaticContact CE2-CE1 3.51Å; V316-H329 WeakPolarHBondContact O-CA 3.4Å; Q317-H329 WeakPolarHBondContact CB-ND1 3.28Å
330	C	95.4	Very high	94.6	Very high	5 Å²	5	45.1 Å²	45.1	3%	0.034	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	157.5	164.3	69.1	0	0	0	0	110	F238 S241 Y243 V316	F238-C330 HydrophobicContact CB-CB 4.16Å; F238-C330 HydrophobicContact CD1-CB 4.2Å; F238-C330 VanDerWaalsContact CD1-SG 3.55Å; F238-C330 HydrophobicContact CD2-CB 3.64Å; F238-C330 WeakPolarHBondContact CE1-SG 3.11Å; F238-C330 HydrophobicContact CE2-CB 3.98Å; F238-C330 HydrophobicContact CG-CB 3.76Å; F238-C330 HydrophobicContact CZ-CB 4.39Å; F238-C330 WeakPolarHBondContact CZ-SG 3.27Å; S241-C330 WeakPolarHBondContact O-CA 3.29Å; Y243-C330 HydrophobicContact CD2-CB 4.39Å; Y243-C330 HydrophobicContact CE2-CB 3.92Å; V316-C330 PolarHBondContact N-O 2.88Å; V316-C330 PolarHBondContact O-N 3.02Å
331	K	95.7	Very high	94.5	Very high	60 Å²	60	48.3 Å²	48.3	26%	0.261	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	132.4	177.5	-174.9	171.7	-176.6	174	0	110.2	S241 T242 Y243 E313	S241-K331 PolarHBondContact O-N 3.44Å; S241-K331 VanDerWaalsContact O-N 3.08Å; T242-K331 CarbonylContact C-O 3.58Å; T242-K331 VanDerWaalsContact CA-O 3.24Å; T242-K331 WeakPolarHBondContact CA-O 3.4Å; T242-K331 HydrophobicContact CG2-CB 4.3Å; Y243-K331 PolarHBondContact N-O 2.84Å; E313-K331 WeakPolarHBondContact OE1-CE 3.27Å; E313-K331 IonicContact OE1-NZ 2.7Å; E313-K331 PolarHBondContact OE1-NZ 2.86Å; E313-K331 VanDerWaalsContact OE2-CE 3.27Å; E313-K331 WeakPolarHBondContact OE2-CE 3.16Å; E313-K331 IonicContact OE2-NZ 3.79Å; E313-K331 PolarHBondContact OE2-NZ 2.79Å
332	V	96.6	Very high	94.5	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	112.1	169.3	-172.4	0	0	0	0	108.8	Y243 V245 I258 L260 L314 V316 V334	Y243-V332 HydrophobicContact CD2-CG2 4.13Å; Y243-V332 WeakPolarHBondContact O-CA 3.36Å; V245-V332 HydrophobicContact CG1-CG1 3.96Å; I258-V332 HydrophobicContact CG2-CG1 4Å; L260-V332 HydrophobicContact CD1-CG2 3.99Å; L260-V332 HydrophobicContact CD2-CG2 3.79Å; L260-V332 HydrophobicContact CG-CG2 4.45Å; L314-V332 HydrophobicContact CB-CB 4.16Å; L314-V332 HydrophobicContact CD1-CB 4.43Å; L314-V332 PolarHBondContact N-O 3.05Å; L314-V332 PolarHBondContact O-N 2.83Å; V316-V332 HydrophobicContact CG2-CG2 4.27Å; V332-V334 HydrophobicContact CG1-CG2 4.17Å
333	T	96.7	Very high	94.7	Very high	30 Å²	30	47.7 Å²	47.7	18%	0.184	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	107.6	171.4	-61.9	0	0	0	0	108.5	Y243 V245 V311	Y243-T333 PolarHBondContact O-N 2.87Å; V245-T333 PolarHBondContact N-O 2.75Å; V311-T333 HydrophobicContact CG1-CG2 3.76Å
334	V	96.9	Very high	95	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90	113.7	173.3	-173.3	0	0	0	0	108.1	V245 V247 V257 F289 V311 Y312 L314 V332	V245-V334 HydrophobicContact CG1-CB 4.28Å; V245-V334 HydrophobicContact CG1-CG1 4.34Å; V245-V334 HydrophobicContact CG1-CG2 3.89Å; V247-V334 HydrophobicContact CB-CG1 4.4Å; V247-V334 HydrophobicContact CG2-CG1 3.97Å; V257-V334 HydrophobicContact CG1-CG1 4.34Å; V257-V334 HydrophobicContact CG1-CG2 3.98Å; F289-V334 HydrophobicContact CE1-CG1 4.06Å; F289-V334 HydrophobicContact CE1-CG2 4.38Å; F289-V334 HydrophobicContact CZ-CB 4.25Å; F289-V334 HydrophobicContact CZ-CG1 3.89Å; F289-V334 HydrophobicContact CZ-CG2 4.4Å; V311-V334 WeakPolarHBondContact CA-O 3.06Å; Y312-V334 PolarHBondContact N-O 3.27Å; Y312-V334 PolarHBondContact O-N 2.76Å; L314-V334 HydrophobicContact CD1-CG2 3.72Å; L314-V334 HydrophobicContact CG-CG2 4.32Å; V332-V334 HydrophobicContact CG1-CG2 4.17Å
335	S	96.8	Very high	95.3	Very high	35 Å²	35	39.7 Å²	39.7	25%	0.245	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	127.2	167.7	51.4	0	0	0	0	109.3	V245 S246 V247	V245-S335 PolarHBondContact O-N 2.89Å; V245-S335 PolarHBondContact O-OG 2.83Å; S246-S335 CarbonylContact C-O 3.6Å; S246-S335 VanDerWaalsContact CA-O 3.28Å; S246-S335 WeakPolarHBondContact CA-O 3.1Å; S246-S335 WeakPolarHBondContact CA-OG 3.44Å; S246-S335 WeakPolarHBondContact CB-OG 3.4Å; S246-S335 PolarHBondContact OG-OG 2.97Å; V247-S335 PolarHBondContact N-O 2.68Å
336	V	96.9	Very high	95.4	Very high	5 Å²	5	39.8 Å²	39.8	3%	0.03	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	139.3	170	-171.7	0	0	0	0	108.1	V247 E249 Y306 G309 H310 Y312	V247-V336 CarbonylContact O-C 3.59Å; V247-V336 VanDerWaalsContact O-CA 3.27Å; V247-V336 WeakPolarHBondContact O-CA 3.43Å; E249-V336 HydrophobicContact CB-CG1 3.58Å; Y306-V336 HydrophobicContact CD2-CB 4.13Å; Y306-V336 HydrophobicContact CD2-CG1 4.23Å; Y306-V336 WeakPolarHBondContact CD2-O 3.05Å; Y306-V336 WeakPolarHBondContact CE2-O 3.27Å; G309-V336 WeakPolarHBondContact O-CG2 3.13Å; H310-V336 PolarHBondContact O-N 2.79Å; Y312-V336 HydrophobicContact CD2-CG2 3.98Å; Y312-V336 HydrophobicContact CE2-CG2 3.7Å
337	L	95.6	Very high	95.2	Very high	84 Å²	84	37.8 Å²	37.8	44%	0.44	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	119.8	172.1	-57.4	176.3	0	0	0	109.6	V247 E249 T339	V247-L337 PolarHBondContact O-N 2.72Å; E249-L337 PolarHBondContact N-O 2.77Å; L337-T339 PolarHBondContact O-N 3.42Å
338	D	95.9	Very high	95	Very high	37 Å²	37	36.5 Å²	36.5	20%	0.198	20%	0.204	C	C	.	.			trans	-43.9	123.2	167.3	173.3	-8.3	0	0	0	112	E249 Y306 S378 N381	E249-D338 VanDerWaalsContact OE1-CA 3.27Å; E249-D338 WeakPolarHBondContact OE1-CA 3.33Å; Y306-D338 HydrophobicContact CD1-CB 4.19Å; Y306-D338 HydrophobicContact CD2-CB 4.02Å; Y306-D338 HydrophobicContact CE1-CB 4.15Å; Y306-D338 HydrophobicContact CE2-CB 3.96Å; Y306-D338 HydrophobicContact CG-CB 4.15Å; D338-S378 WeakPolarHBondContact OD2-CA 3.47Å; D338-S378 WeakPolarHBondContact OD2-CB 3.16Å; D338-S378 PolarHBondContact OD2-N 2.94Å; D338-S378 VanDerWaalsContact OD2-O 3.04Å; D338-N381 PolarHBondContact OD1-ND2 3.36Å
339	T	95.3	Very high	94.1	Very high	41 Å²	41	39.7 Å²	39.7	25%	0.252	22%	0.217	S	C	.	.			trans	-123.4	133	173	68.2	0	0	0	0	110.1	P248 E249 N250 L337 D341	P248-T339 HydrophobicContact CB-CG2 3.96Å; E249-T339 HydrophobicContact CG-CG2 4.03Å; E249-T339 WeakPolarHBondContact CG-OG1 3.26Å; E249-T339 PolarHBondContact OE1-N 2.93Å; N250-T339 PolarHBondContact ND2-OG1 2.74Å; L337-T339 PolarHBondContact O-N 3.42Å; T339-D341 PolarHBondContact O-N 2.74Å
340	N	95.5	Very high	93	Very high	16 Å²	16	36.9 Å²	36.9	9%	0.086	21%	0.208	C	C	.	.	S	Bend	trans	-67	87.9	-171.2	-163.5	113.7	0	0	0	113.4	D377 N381 D427 G429 L433	N340-D377 WeakPolarHBondContact CA-OD2 3.17Å; N340-N381 HydrophobicContact CB-CB 3.86Å; N340-N381 PolarHBondContact N-ND2 2.89Å; N340-N381 WeakPolarHBondContact OD1-CA 3.16Å; N340-N381 VanDerWaalsContact OD1-CB 3.23Å; N340-N381 WeakPolarHBondContact OD1-CB 3.23Å; N340-D427 PolarHBondContact ND2-OD2 2.98Å; N340-D427 VanDerWaalsContact OD1-CG 3.28Å; N340-D427 PolarHBondContact OD1-OD2 2.84Å; N340-G429 VanDerWaalsContact OD1-CA 3.26Å; N340-G429 WeakPolarHBondContact OD1-CA 3.36Å; N340-L433 WeakPolarHBondContact ND2-CD1 3.29Å; N340-L433 WeakPolarHBondContact ND2-CG 3.26Å
341	D	94.6	Very high	91.5	Very high	71 Å²	71	43.5 Å²	43.5	38%	0.38	25%	0.248	S	C	.	.			trans	-123.5	-24.8	-172.5	99.4	-17.2	0	0	0	114.7	N250 T339 D377	N250-D341 PolarHBondContact ND2-OD2 3.4Å; T339-D341 PolarHBondContact O-N 2.74Å; D341-D377 PolarHBondContact N-OD2 3.05Å
342	N	95	Very high	90.3	Very high	27 Å²	27	45 Å²	45	14%	0.144	26%	0.259	C	S	.	.	S	Bend	trans	-83.4	129.5	169.2	-57.6	-97.1	0	0	0	109.3	E307 R376 D377	E307-N342 PolarHBondContact OE2-ND2 3.44Å; N342-R376 HydrophobicContact CB-CB 3.87Å; N342-R376 WeakPolarHBondContact OD1-CD 3.44Å; N342-R376 PolarHBondContact OD1-NH1 2.99Å; N342-D377 WeakPolarHBondContact CB-OD1 3.2Å; N342-D377 PolarHBondContact N-OD1 2.95Å; N342-D377 VanDerWaalsContact N-OD1 3.13Å; N342-D377 PolarHBondContact ND2-OD1 3.31Å
343	P	95.5	Very high	89.1	Confident	67 Å²	67	48.2 Å²	48.2	44%	0.435	28%	0.281	S	S	.	.	P	Polyproline II helix	trans	-85.4	145.4	173.2	32	-33.4	0	0	0	111.7	V345 L433	P343-V345 PolarHBondContact O-N 2.71Å; P343-L433 HydrophobicContact CB-CB 4.16Å; P343-L433 HydrophobicContact CB-CD1 4.26Å
344	P	96.3	Very high	88.4	Confident	1 Å²	1	54.4 Å²	54.4	1%	0.006	31%	0.308	C	S	.	.	P	Polyproline II helix	trans	-58.7	127.9	-174.5	16.6	-30.9	0	0	0	113.9	V373 D375 V384 A425 S435	P344-V373 HydrophobicContact CB-CG1 3.92Å; P344-D375 WeakPolarHBondContact CA-OD2 3.45Å; P344-D375 WeakPolarHBondContact CB-OD2 3.15Å; P344-D375 WeakPolarHBondContact CD-OD2 3.38Å; P344-V384 HydrophobicContact CB-CG1 3.71Å; P344-A425 HydrophobicContact CB-CB 3.9Å; P344-A425 HydrophobicContact CG-CB 4.03Å; P344-S435 WeakPolarHBondContact O-CB 3.14Å; P344-S435 PolarHBondContact O-OG 3.45Å
345	V	94.8	Very high	87.9	Confident	75 Å²	75	57.2 Å²	57.2	46%	0.455	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	119.4	-175.7	-175.5	0	0	0	0	111.8	P343 V373 S374	P343-V345 PolarHBondContact O-N 2.71Å; V345-V373 WeakPolarHBondContact O-CA 3.38Å; V345-S374 WeakPolarHBondContact CB-O 3.24Å; V345-S374 PolarHBondContact N-O 2.93Å; V345-S374 PolarHBondContact O-N 3.03Å
346	I	93.4	Very high	87.7	Confident	10 Å²	10	55.7 Å²	55.7	5%	0.051	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	107.1	-179	-53.1	169.9	0	0	0	111.4	V371 V373 I423 A425 S435 K437	I346-V371 HydrophobicContact CG2-CG1 3.94Å; I346-V373 HydrophobicContact CB-CG2 4.44Å; I346-V373 HydrophobicContact CG1-CG2 4.03Å; I346-V373 HydrophobicContact CG2-CG2 4.3Å; I346-I423 HydrophobicContact CD1-CB 4.37Å; I346-I423 HydrophobicContact CD1-CG2 4.18Å; I346-I423 HydrophobicContact CG2-CD1 4.11Å; I346-I423 HydrophobicContact CG2-CG2 4.42Å; I346-A425 HydrophobicContact CD1-CB 3.91Å; I346-A425 HydrophobicContact CG1-CB 3.84Å; I346-S435 WeakPolarHBondContact CD1-OG 3.28Å; I346-S435 WeakPolarHBondContact CG1-OG 3.29Å; I346-K437 HydrophobicContact CB-CB 4.06Å; I346-K437 HydrophobicContact CB-CD 4.09Å; I346-K437 HydrophobicContact CD1-CB 4.03Å; I346-K437 HydrophobicContact CG2-CB 4.03Å; I346-K437 HydrophobicContact CG2-CD 4.02Å; I346-K437 WeakPolarHBondContact O-CD 3.34Å; I346-K437 PolarHBondContact O-NZ 2.74Å
347	N	90.1	Very high	87.5	Confident	70 Å²	70	61.3 Å²	61.3	37%	0.374	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	121	174.3	-69.8	-59.4	0	0	0	110.6	R372	N347-R372 WeakPolarHBondContact CA-O 3.36Å; N347-R372 WeakPolarHBondContact CB-O 3.15Å; N347-R372 PolarHBondContact N-O 3.45Å; N347-R372 PolarHBondContact O-N 3.25Å; N347-R372 VanDerWaalsContact O-O 3.11Å
348	L	87.7	Confident	87.4	Confident	11 Å²	11	57.5 Å²	57.5	6%	0.058	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	119.8	178.2	-148.9	79.7	0	0	0	108.5	V371 I423 F439	L348-V371 HydrophobicContact CD1-CG2 3.98Å; L348-I423 HydrophobicContact CD1-CD1 3.47Å; L348-I423 VanDerWaalsContact CD1-CD1 3.47Å; L348-F439 HydrophobicContact CD1-CD1 4.33Å; L348-F439 HydrophobicContact CD1-CE1 4.2Å; L348-F439 HydrophobicContact CD2-CB 4.15Å; L348-F439 HydrophobicContact CD2-CD1 3.92Å; L348-F439 HydrophobicContact CD2-CD2 3.99Å; L348-F439 HydrophobicContact CD2-CE1 4.31Å; L348-F439 HydrophobicContact CD2-CE2 4.36Å; L348-F439 HydrophobicContact CD2-CG 3.75Å
349	L	77.7	Confident	87.4	Confident	93 Å²	93	56.8 Å²	56.8	49%	0.487	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	91.1	176.5	-66.1	173.4	0	0	0	107.7	L370	L349-L370 HydrophobicContact CB-CB 3.99Å; L349-L370 HydrophobicContact CB-CD2 4.1Å; L349-L370 HydrophobicContact CB-CG 4.17Å; L349-L370 HydrophobicContact CD1-CD2 3.74Å; L349-L370 HydrophobicContact CD1-CG 4.2Å; L349-L370 PolarHBondContact N-O 3.27Å; L349-L370 PolarHBondContact O-N 3.33Å
350	S	70.7	Confident	87.4	Confident	36 Å²	36	55.7 Å²	55.7	25%	0.252	31%	0.309	S	S	.	.	S	Bend	trans	-135.8	166.1	176.8	171.9	0	0	0	0	108.2	N352	S350-N352 VanDerWaalsContact C-N 3.28Å; S350-N352 WeakPolarHBondContact CB-O 3.23Å; S350-N352 PolarHBondContact O-N 2.69Å; S350-N352 PolarHBondContact OG-O 3.23Å
351	V	63.3	Low	87.3	Confident	144 Å²	144	58.9 Å²	58.9	87%	0.873	33%	0.332	S	S	*	.	S	Bend	trans	-59.1	-42.7	174.2	-177	0	0	0	0	110.6
352	N	71.3	Confident	87.4	Confident	91 Å²	91	56 Å²	56	49%	0.487	32%	0.318	S	S	.	.	S	Bend	trans	-120.6	133.8	168.5	-66.2	-39.6	0	0	0	108.9	S350 E354 L355	S350-N352 VanDerWaalsContact C-N 3.28Å; S350-N352 WeakPolarHBondContact CB-O 3.23Å; S350-N352 PolarHBondContact O-N 2.69Å; S350-N352 PolarHBondContact OG-O 3.23Å; N352-E354 VanDerWaalsContact C-N 3.27Å; N352-E354 PolarHBondContact O-N 2.96Å; N352-L355 HydrophobicContact CB-CB 4.37Å; N352-L355 WeakPolarHBondContact CB-O 3.46Å
353	S	70.3	Confident	87.4	Confident	68 Å²	68	58.5 Å²	58.5	48%	0.476	34%	0.336	S	S	.	.	S	Bend	trans	-72.8	-15	-173	-55.5	0	0	0	0	115.1
354	E	82.1	Confident	87.3	Confident	160 Å²	160	59.4 Å²	59.4	75%	0.748	34%	0.342	S	S	*	.	S	Bend	trans	-117.3	-17.1	-174.5	-60.4	-177	163.7	0	0	113.2	N352 T440	N352-E354 VanDerWaalsContact C-N 3.27Å; N352-E354 PolarHBondContact O-N 2.96Å; E354-T440 PolarHBondContact O-N 3.5Å
355	L	87.6	Confident	87.2	Confident	59 Å²	59	61.3 Å²	61.3	31%	0.309	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	129.8	-176.5	-175.5	65.9	0	0	0	109.9	N352 T440 L442	N352-L355 HydrophobicContact CB-CB 4.37Å; N352-L355 WeakPolarHBondContact CB-O 3.46Å; L355-T440 CarbonylContact C-O 3.49Å; L355-T440 WeakPolarHBondContact CA-O 3.03Å; L355-T440 HydrophobicContact CD1-CG2 4.22Å; L355-L442 HydrophobicContact CD1-CB 3.98Å
356	V	91.4	Very high	87.2	Confident	4 Å²	4	63.5 Å²	63.5	2%	0.024	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	129.2	176.1	179.2	0	0	0	0	107.9	I368 A369 F439 T440 V441 L442	V356-I368 HydrophobicContact CG1-CB 3.88Å; V356-I368 HydrophobicContact CG1-CD1 4.3Å; V356-I368 HydrophobicContact CG1-CG1 4.44Å; V356-I368 VanDerWaalsContact CG1-O 3.29Å; V356-I368 WeakPolarHBondContact CG1-O 3.17Å; V356-A369 HydrophobicContact CG2-CB 4.44Å; V356-F439 HydrophobicContact CB-CD2 4.41Å; V356-F439 HydrophobicContact CB-CE2 4.29Å; V356-F439 HydrophobicContact CG2-CD2 3.67Å; V356-F439 HydrophobicContact CG2-CE2 3.68Å; V356-T440 PolarHBondContact N-O 3.43Å; V356-V441 HydrophobicContact CB-CG2 4.28Å; V356-V441 CarbonylContact O-C 3.43Å; V356-V441 VanDerWaalsContact O-CA 3.26Å; V356-V441 WeakPolarHBondContact O-CA 3.23Å; V356-L442 PolarHBondContact O-N 3.22Å
357	E	92.6	Very high	87.2	Confident	122 Å²	122	66.4 Å²	66.4	57%	0.57	38%	0.381	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.3	136.9	178.2	-72.6	168.3	-167.3	0	0	109.8	L442 T444	E357-L442 WeakPolarHBondContact CA-O 3.21Å; E357-L442 HydrophobicContact CG-CB 4.43Å; E357-L442 HydrophobicContact CG-CD2 4.39Å; E357-T444 HydrophobicContact CB-CG2 3.93Å; E357-T444 HydrophobicContact CG-CG2 4.26Å
358	V	94.6	Very high	87.3	Confident	4 Å²	4	64 Å²	64	2%	0.024	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	132.2	176.6	63.4	0	0	0	0	110.9	A362 Y366 I368 V407 L411 V441 L442 I443 T444	V358-A362 HydrophobicContact CG2-CB 3.65Å; V358-Y366 HydrophobicContact CG2-CD1 4.02Å; V358-Y366 HydrophobicContact CG2-CE1 4.03Å; V358-I368 HydrophobicContact CB-CG2 3.87Å; V358-I368 HydrophobicContact CG1-CG2 4.4Å; V358-I368 HydrophobicContact CG2-CG2 3.62Å; V358-V407 HydrophobicContact CG2-CG2 4.33Å; V358-L411 HydrophobicContact CG1-CD1 3.9Å; V358-L411 HydrophobicContact CG2-CD1 4.06Å; V358-V441 HydrophobicContact CG1-CG1 3.47Å; V358-V441 VanDerWaalsContact CG1-CG1 3.47Å; V358-L442 PolarHBondContact N-O 2.76Å; V358-I443 HydrophobicContact CG1-CD1 3.63Å; V358-I443 CarbonylContact O-C 3.45Å; V358-I443 WeakPolarHBondContact O-CA 3.45Å; V358-T444 PolarHBondContact O-N 3.01Å; V358-T444 PolarHBondContact O-OG1 2.74Å
359	S	94.9	Very high	87.4	Confident	23 Å²	23	63.7 Å²	63.7	16%	0.161	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.8	140.2	172.9	166	0	0	0	0	111.1	S361 A362 T444 E446	S359-S361 PolarHBondContact O-N 3.11Å; S359-S361 PolarHBondContact OG-N 3.43Å; S359-S361 PolarHBondContact OG-OG 3.07Å; S359-A362 WeakPolarHBondContact O-CB 3.47Å; S359-A362 PolarHBondContact O-N 3.42Å; S359-T444 WeakPolarHBondContact CA-OG1 3.1Å; S359-T444 PolarHBondContact N-OG1 3.13Å; S359-E446 WeakPolarHBondContact CB-OE1 3.21Å; S359-E446 VanDerWaalsContact OG-CD 3.27Å; S359-E446 WeakPolarHBondContact OG-CG 3.42Å; S359-E446 PolarHBondContact OG-OE1 3.46Å
360	E	95.9	Very high	88.1	Confident	18 Å²	18	62.2 Å²	62.2	8%	0.084	36%	0.359	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-25.6	174.3	62.4	-156.3	121.4	0	0	113.7	A362 L411 R413 I443 T444 D445 E446	E360-A362 PolarHBondContact O-N 3.03Å; E360-A362 VanDerWaalsContact O-N 3.14Å; E360-L411 HydrophobicContact CB-CB 4.16Å; E360-R413 WeakPolarHBondContact OE2-CB 3.14Å; E360-R413 PolarHBondContact OE2-N 3.3Å; E360-I443 HydrophobicContact CB-CG2 3.68Å; E360-T444 PolarHBondContact N-O 3.2Å; E360-D445 VanDerWaalsContact OE1-CA 3.3Å; E360-D445 WeakPolarHBondContact OE1-CA 3.11Å; E360-E446 HydrophobicContact CG-CB 4.1Å; E360-E446 HydrophobicContact CG-CG 4.04Å; E360-E446 PolarHBondContact OE1-N 3.31Å
361	S	94.1	Very high	89.1	Confident	83 Å²	83	60.5 Å²	60.5	58%	0.58	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.3	-7.4	171.7	77.5	0	0	0	0	113.7	S359 P363	S359-S361 PolarHBondContact O-N 3.11Å; S359-S361 PolarHBondContact OG-N 3.43Å; S359-S361 PolarHBondContact OG-OG 3.07Å; S361-P363 WeakPolarHBondContact O-CD 3.46Å
362	A	95.8	Very high	90.5	Very high	10 Å²	10	59.8 Å²	59.8	8%	0.083	33%	0.329	C	S	.	.	P	Polyproline II helix	trans	-59	119.3	-177.4	0	0	0	0	0	111.7	V358 S359 E360 Y366 V407 L411	V358-A362 HydrophobicContact CG2-CB 3.65Å; S359-A362 WeakPolarHBondContact O-CB 3.47Å; S359-A362 PolarHBondContact O-N 3.42Å; E360-A362 PolarHBondContact O-N 3.03Å; E360-A362 VanDerWaalsContact O-N 3.14Å; A362-Y366 HydrophobicContact CB-CD1 4.04Å; A362-Y366 HydrophobicContact CB-CG 3.96Å; A362-V407 HydrophobicContact CB-CG2 4.29Å; A362-L411 HydrophobicContact CB-CD1 4.49Å
363	P	94.8	Very high	91.6	Very high	80 Å²	80	56.7 Å²	56.7	52%	0.519	31%	0.313	S	S	.	.	P	Polyproline II helix	trans	-73.5	152.2	-176	29.6	-35.5	0	0	0	111.8	S361 G365 Y366	S361-P363 WeakPolarHBondContact O-CD 3.46Å; P363-G365 PolarHBondContact O-N 2.94Å; P363-Y366 VanDerWaalsContact O-CB 3.23Å; P363-Y366 WeakPolarHBondContact O-CB 3.14Å; P363-Y366 PolarHBondContact O-N 3.24Å
364	P	94.7	Very high	92.7	Very high	85 Å²	85	55.8 Å²	55.8	55%	0.552	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.9	126.2	169.8	-25.5	32.6	0	0	0	111.6	V407	P364-V407 CarbonylContact C-O 3.5Å; P364-V407 VanDerWaalsContact CA-O 3.29Å; P364-V407 WeakPolarHBondContact CA-O 3.42Å
365	G	93.3	Very high	93.3	Very high	42 Å²	42	49.6 Å²	49.6	43%	0.433	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	106.7	-15.1	-167.7	0	0	0	0	0	114.7	P363 V367 V407	P363-G365 PolarHBondContact O-N 2.94Å; G365-V367 PolarHBondContact O-N 3.28Å; G365-V407 PolarHBondContact N-O 2.88Å
366	Y	94.3	Very high	93.6	Very high	120 Å²	120	53.2 Å²	53.2	47%	0.471	29%	0.288	S	S	.	.			trans	-66.5	127.7	177.2	-173.2	-89.4	0	0	0	111.4	V358 A362 P363 I368 L406 V407	V358-Y366 HydrophobicContact CG2-CD1 4.02Å; V358-Y366 HydrophobicContact CG2-CE1 4.03Å; A362-Y366 HydrophobicContact CB-CD1 4.04Å; A362-Y366 HydrophobicContact CB-CG 3.96Å; P363-Y366 VanDerWaalsContact O-CB 3.23Å; P363-Y366 WeakPolarHBondContact O-CB 3.14Å; P363-Y366 PolarHBondContact O-N 3.24Å; Y366-I368 HydrophobicContact CD1-CG2 3.84Å; Y366-I368 HydrophobicContact CE1-CG2 4.1Å; Y366-L406 CarbonylContact O-C 3Å; Y366-L406 WeakPolarHBondContact O-CA 3.46Å; Y366-L406 VanDerWaalsContact O-CB 3.28Å; Y366-L406 WeakPolarHBondContact O-CB 3.11Å; Y366-V407 HydrophobicContact CD1-CG2 4.45Å; Y366-V407 PolarHBondContact O-N 3.1Å
367	V	93.2	Very high	93.9	Very high	72 Å²	72	53.5 Å²	53.5	44%	0.436	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	123	-177.6	174.7	0	0	0	0	109.9	G365 T404 L406	G365-V367 PolarHBondContact O-N 3.28Å; V367-T404 HydrophobicContact CG1-CG2 4.08Å; V367-L406 HydrophobicContact CG2-CB 4.19Å
368	I	92.3	Very high	93.9	Very high	20 Å²	20	49.9 Å²	49.9	10%	0.103	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	-27.9	-178.1	62.9	159.7	0	0	0	113.3	V356 V358 Y366 F394 I405 V407 L421 V441	V356-I368 HydrophobicContact CG1-CB 3.88Å; V356-I368 HydrophobicContact CG1-CD1 4.3Å; V356-I368 HydrophobicContact CG1-CG1 4.44Å; V356-I368 VanDerWaalsContact CG1-O 3.29Å; V356-I368 WeakPolarHBondContact CG1-O 3.17Å; V358-I368 HydrophobicContact CB-CG2 3.87Å; V358-I368 HydrophobicContact CG1-CG2 4.4Å; V358-I368 HydrophobicContact CG2-CG2 3.62Å; Y366-I368 HydrophobicContact CD1-CG2 3.84Å; Y366-I368 HydrophobicContact CE1-CG2 4.1Å; I368-F394 HydrophobicContact CD1-CD1 3.7Å; I368-F394 HydrophobicContact CD1-CE1 3.71Å; I368-F394 HydrophobicContact CG1-CD1 4.46Å; I368-I405 HydrophobicContact CD1-CG2 3.87Å; I368-I405 HydrophobicContact CG1-CB 4.14Å; I368-I405 HydrophobicContact CG1-CG2 3.83Å; I368-I405 WeakPolarHBondContact CG1-O 3.33Å; I368-I405 PolarHBondContact N-O 2.82Å; I368-V407 HydrophobicContact CG2-CG2 4.04Å; I368-L421 HydrophobicContact CD1-CD1 4.2Å; I368-V441 HydrophobicContact CD1-CG1 4.21Å; I368-V441 HydrophobicContact CD1-CG2 3.66Å
369	A	91.2	Very high	93.8	Very high	4 Å²	4	53 Å²	53	3%	0.033	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	149.2	-178.8	0	0	0	0	0	112.2	V356 T404 I405	V356-A369 HydrophobicContact CG2-CB 4.44Å; A369-T404 WeakPolarHBondContact O-CA 3.4Å; A369-I405 HydrophobicContact CB-CB 4.41Å; A369-I405 PolarHBondContact N-O 2.83Å; A369-I405 PolarHBondContact O-N 2.89Å
370	L	91.8	Very high	93.7	Very high	61 Å²	61	57.3 Å²	57.3	32%	0.319	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	132.4	170.5	176.7	67.3	0	0	0	109.1	L349 F402 T404	L349-L370 HydrophobicContact CB-CB 3.99Å; L349-L370 HydrophobicContact CB-CD2 4.1Å; L349-L370 HydrophobicContact CB-CG 4.17Å; L349-L370 HydrophobicContact CD1-CD2 3.74Å; L349-L370 HydrophobicContact CD1-CG 4.2Å; L349-L370 PolarHBondContact N-O 3.27Å; L349-L370 PolarHBondContact O-N 3.33Å; L370-F402 HydrophobicContact CD1-CB 3.89Å; L370-F402 HydrophobicContact CD1-CD2 3.37Å; L370-F402 HydrophobicContact CD1-CE2 4.04Å; L370-F402 HydrophobicContact CD1-CG 3.77Å; L370-T404 HydrophobicContact CD1-CG2 4.05Å
371	V	92.7	Very high	93.5	Very high	0 Å²	0	57.8 Å²	57.8	0%	0	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	121.5	-179.1	-170.3	0	0	0	0	108.5	I346 L348 V373 L396 F402 S403 I405 I423	I346-V371 HydrophobicContact CG2-CG1 3.94Å; L348-V371 HydrophobicContact CD1-CG2 3.98Å; V371-V373 HydrophobicContact CG1-CG2 4.06Å; V371-L396 HydrophobicContact CG2-CD1 4.17Å; V371-F402 WeakPolarHBondContact O-CA 3.35Å; V371-S403 PolarHBondContact N-O 2.84Å; V371-S403 PolarHBondContact O-N 2.92Å; V371-I405 HydrophobicContact CG2-CD1 3.7Å; V371-I405 HydrophobicContact CG2-CG1 3.78Å; V371-I423 HydrophobicContact CG1-CD1 3.97Å; V371-I423 HydrophobicContact CG2-CD1 3.79Å
372	R	92.6	Very high	93.5	Very high	130 Å²	130	54.9 Å²	54.9	49%	0.491	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	121.9	163.8	177.5	171.6	-73.4	168.6	-1.5	107.9	N347	N347-R372 WeakPolarHBondContact CA-O 3.36Å; N347-R372 WeakPolarHBondContact CB-O 3.15Å; N347-R372 PolarHBondContact N-O 3.45Å; N347-R372 PolarHBondContact O-N 3.25Å; N347-R372 VanDerWaalsContact O-O 3.11Å
373	V	93.3	Very high	93.3	Very high	26 Å²	26	62.7 Å²	62.7	16%	0.158	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	135.5	165.2	-174.7	0	0	0	0	107.4	P344 V345 I346 V371 V384 C386 A425	P344-V373 HydrophobicContact CB-CG1 3.92Å; V345-V373 WeakPolarHBondContact O-CA 3.38Å; I346-V373 HydrophobicContact CB-CG2 4.44Å; I346-V373 HydrophobicContact CG1-CG2 4.03Å; I346-V373 HydrophobicContact CG2-CG2 4.3Å; V371-V373 HydrophobicContact CG1-CG2 4.06Å; V373-V384 HydrophobicContact CB-CG2 4.11Å; V373-V384 HydrophobicContact CG1-CB 4.06Å; V373-V384 HydrophobicContact CG1-CG1 3.95Å; V373-V384 HydrophobicContact CG1-CG2 3.94Å; V373-C386 WeakPolarHBondContact CG2-SG 3.14Å; V373-A425 HydrophobicContact CG1-CB 3.75Å; V373-A425 HydrophobicContact CG2-CB 4.25Å
374	S	92.9	Very high	93.2	Very high	48 Å²	48	61 Å²	61	34%	0.336	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	124.2	177.7	50	0	0	0	0	107.9	V345	V345-S374 WeakPolarHBondContact CB-O 3.24Å; V345-S374 PolarHBondContact N-O 2.93Å; V345-S374 PolarHBondContact O-N 3.03Å
375	D	95.4	Very high	93.1	Very high	30 Å²	30	61.4 Å²	61.4	16%	0.16	33%	0.328	C	S	.	.			trans	-93.6	170.4	162.4	-127.4	-50.6	0	0	0	111	P344 V384	P344-D375 WeakPolarHBondContact CA-OD2 3.45Å; P344-D375 WeakPolarHBondContact CB-OD2 3.15Å; P344-D375 WeakPolarHBondContact CD-OD2 3.38Å; D375-V384 HydrophobicContact CB-CG1 3.92Å; D375-V384 WeakPolarHBondContact OD2-CG1 3.45Å
376	R	95.2	Very high	93.1	Very high	136 Å²	136	60.1 Å²	60.1	51%	0.513	31%	0.312	S	S	.	.	S	Bend	trans	-104.7	-38.5	172.8	-75.6	-170.8	67.6	-142.5	3.8	112.5	E307 N342	E307-R376 HydrophobicContact CG-CB 4Å; N342-R376 HydrophobicContact CB-CB 3.87Å; N342-R376 WeakPolarHBondContact OD1-CD 3.44Å; N342-R376 PolarHBondContact OD1-NH1 2.99Å
377	D	96.4	Very high	93.1	Very high	9 Å²	9	60.5 Å²	60.5	5%	0.048	31%	0.313	C	S	.	.	S	Bend	trans	-54	168.9	174.7	-56.2	2.4	0	0	0	112.3	N340 D341 N342 N381 G382	N340-D377 WeakPolarHBondContact CA-OD2 3.17Å; D341-D377 PolarHBondContact N-OD2 3.05Å; N342-D377 WeakPolarHBondContact CB-OD1 3.2Å; N342-D377 PolarHBondContact N-OD1 2.95Å; N342-D377 VanDerWaalsContact N-OD1 3.13Å; N342-D377 PolarHBondContact ND2-OD1 3.31Å; D377-N381 HydrophobicContact CB-CB 3.62Å; D377-G382 WeakPolarHBondContact O-CA 3.43Å
378	S	93.3	Very high	93.1	Very high	46 Å²	46	58.7 Å²	58.7	32%	0.322	30%	0.301	S	S	.	.			trans	-115.6	176.9	-176.1	-78.8	0	0	0	0	114	D338 L380 N381 G382	D338-S378 WeakPolarHBondContact OD2-CA 3.47Å; D338-S378 WeakPolarHBondContact OD2-CB 3.16Å; D338-S378 PolarHBondContact OD2-N 2.94Å; D338-S378 VanDerWaalsContact OD2-O 3.04Å; S378-L380 PolarHBondContact O-N 2.88Å; S378-N381 WeakPolarHBondContact O-CA 3.5Å; S378-N381 WeakPolarHBondContact O-CB 3.37Å; S378-N381 PolarHBondContact O-N 2.56Å; S378-G382 PolarHBondContact O-N 2.79Å
379	G	92.1	Very high	93.2	Very high	71 Å²	71	60 Å²	60	73%	0.732	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.6	-107.3	170.5	0	0	0	0	0	115.6
380	L	92.1	Very high	93	Very high	112 Å²	112	63.3 Å²	63.3	59%	0.586	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.2	-25.3	174.1	-73	177.1	0	0	0	112.6	S378 R383 G428	S378-L380 PolarHBondContact O-N 2.88Å; L380-R383 WeakPolarHBondContact O-CB 3.16Å; L380-R383 PolarHBondContact O-N 2.9Å; L380-G428 CarbonylContact O-C 3.52Å; L380-G428 WeakPolarHBondContact O-CA 3.36Å; L380-G428 PolarHBondContact O-N 3.5Å
381	N	93.1	Very high	92.8	Very high	28 Å²	28	68.4 Å²	68.4	15%	0.15	37%	0.37	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-51.1	178.7	-60.9	-7.4	0	0	0	108.2	D338 N340 D377 S378 R383 D427	D338-N381 PolarHBondContact OD1-ND2 3.36Å; N340-N381 HydrophobicContact CB-CB 3.86Å; N340-N381 PolarHBondContact N-ND2 2.89Å; N340-N381 WeakPolarHBondContact OD1-CA 3.16Å; N340-N381 VanDerWaalsContact OD1-CB 3.23Å; N340-N381 WeakPolarHBondContact OD1-CB 3.23Å; D377-N381 HydrophobicContact CB-CB 3.62Å; S378-N381 WeakPolarHBondContact O-CA 3.5Å; S378-N381 WeakPolarHBondContact O-CB 3.37Å; S378-N381 PolarHBondContact O-N 2.56Å; N381-R383 PolarHBondContact O-N 2.82Å; N381-D427 WeakPolarHBondContact O-CB 3.44Å
382	G	92.4	Very high	92.8	Very high	23 Å²	23	70.4 Å²	70.4	24%	0.237	38%	0.382	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.4	1.7	171.6	0	0	0	0	0	116.7	D377 S378 V384	D377-G382 WeakPolarHBondContact O-CA 3.43Å; S378-G382 PolarHBondContact O-N 2.79Å; G382-V384 PolarHBondContact O-N 2.86Å
383	R	92.3	Very high	92.9	Very high	173 Å²	173	65.3 Å²	65.3	65%	0.653	37%	0.366	S	S	*	.			trans	-93.5	86.2	-171.4	-166.6	-177.3	176.1	165.3	3.1	112.7	L380 N381 D427 G428	L380-R383 WeakPolarHBondContact O-CB 3.16Å; L380-R383 PolarHBondContact O-N 2.9Å; N381-R383 PolarHBondContact O-N 2.82Å; R383-D427 CarbonylContact O-C 3.52Å; R383-G428 PolarHBondContact O-N 2.81Å
384	V	93.1	Very high	93	Very high	46 Å²	46	64.6 Å²	64.6	28%	0.279	36%	0.36	S	S	.	.			trans	-70.3	145.3	-179.7	-50.4	0	0	0	0	114.5	P344 V373 D375 G382 R426	P344-V384 HydrophobicContact CB-CG1 3.71Å; V373-V384 HydrophobicContact CB-CG2 4.11Å; V373-V384 HydrophobicContact CG1-CB 4.06Å; V373-V384 HydrophobicContact CG1-CG1 3.95Å; V373-V384 HydrophobicContact CG1-CG2 3.94Å; D375-V384 HydrophobicContact CB-CG1 3.92Å; D375-V384 WeakPolarHBondContact OD2-CG1 3.45Å; G382-V384 PolarHBondContact O-N 2.86Å; V384-R426 CarbonylContact C-O 3.58Å; V384-R426 VanDerWaalsContact CA-O 3.26Å; V384-R426 WeakPolarHBondContact CA-O 3.25Å
385	Q	92.3	Very high	93.1	Very high	93 Å²	93	67 Å²	67	44%	0.435	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	137.6	161.7	-176.9	176.9	34.3	0	0	109.8	R426	Q385-R426 HydrophobicContact CB-CG 4.36Å; Q385-R426 PolarHBondContact N-O 2.84Å; Q385-R426 PolarHBondContact O-N 3.46Å
386	C	93.4	Very high	93	Very high	15 Å²	15	67 Å²	67	10%	0.101	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	154.2	-177.1	-60.5	0	0	0	0	112.2	V373 L396 E398 Q424	V373-C386 WeakPolarHBondContact CG2-SG 3.14Å; C386-L396 HydrophobicContact CB-CD2 3.35Å; C386-E398 PolarHBondContact N-OE1 3.06Å; C386-E398 VanDerWaalsContact N-OE1 3.09Å; C386-Q424 CarbonylContact C-O 3.51Å; C386-Q424 WeakPolarHBondContact CA-O 3.47Å
387	R	93.1	Very high	93	Very high	128 Å²	128	63.6 Å²	63.6	48%	0.483	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.6	148.5	166.8	64.5	-175.7	-172.1	122.2	-1	112	L389 Q424	R387-L389 HydrophobicContact CG-CD2 4.04Å; R387-Q424 HydrophobicContact CG-CB 4.13Å; R387-Q424 PolarHBondContact N-O 3.26Å; R387-Q424 PolarHBondContact O-N 2.83Å
388	L	94.4	Very high	92.7	Very high	33 Å²	33	68 Å²	68	17%	0.173	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	142.4	165.3	-158.9	66.5	0	0	0	109.2	V392 F394 I405 L421 I423	L388-V392 HydrophobicContact CD2-CG2 3.67Å; L388-V392 HydrophobicContact CG-CG2 4.36Å; L388-F394 HydrophobicContact CD2-CB 4.03Å; L388-F394 WeakPolarHBondContact CD2-O 3.47Å; L388-I405 HydrophobicContact CD1-CD1 4.39Å; L388-L421 HydrophobicContact CD1-CB 4.34Å; L388-I423 HydrophobicContact CD1-CG1 4.2Å
389	L	93.6	Very high	92.5	Very high	49 Å²	49	71.1 Å²	71.1	26%	0.257	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	150.1	177.1	-56.6	-173.4	0	0	0	111.4	R387 T422 Q424	R387-L389 HydrophobicContact CG-CD2 4.04Å; L389-T422 WeakPolarHBondContact CB-O 3.46Å; L389-T422 HydrophobicContact CD1-CG2 3.96Å; L389-T422 PolarHBondContact N-O 3.03Å; L389-Q424 HydrophobicContact CD1-CB 4.11Å; L389-Q424 HydrophobicContact CD2-CB 4.08Å; L389-Q424 HydrophobicContact CG-CB 4.11Å
390	G	87.2	Confident	92.1	Very high	73 Å²	73	77.7 Å²	77.7	75%	0.753	39%	0.389	S	S	*	.	S	Bend	trans	93.6	179.9	-179.2	0	0	0	0	0	113.5
391	N	88.2	Confident	91.5	Very high	168 Å²	168	76.2 Å²	76.2	90%	0.898	39%	0.388	S	S	*	.	S	Bend	trans	-111.4	98.3	171.6	179	69.2	0	0	0	107.7
392	V	92.1	Very high	91.4	Very high	41 Å²	41	78.5 Å²	78.5	25%	0.248	40%	0.397	C	S	.	.			trans	-138	152.6	-166.6	-67.3	0	0	0	0	109.6	L388 F394 L421	L388-V392 HydrophobicContact CD2-CG2 3.67Å; L388-V392 HydrophobicContact CG-CG2 4.36Å; V392-F394 HydrophobicContact CB-CD2 4.27Å; V392-F394 PolarHBondContact O-N 3.26Å; V392-L421 HydrophobicContact CB-CD2 3.93Å; V392-L421 HydrophobicContact CG1-CD2 3.92Å; V392-L421 HydrophobicContact CG2-CD2 3.88Å
393	P	94.9	Very high	91.4	Very high	24 Å²	24	77.8 Å²	77.8	16%	0.156	39%	0.388	C	S	.	.	S	Bend	trans	-76.7	27.8	-175.8	32.9	-36.8	0	0	0	113.9	D408 G409 L411 Y419	P393-D408 PolarHBondContact O-N 2.75Å; P393-G409 PolarHBondContact O-N 2.8Å; P393-L411 HydrophobicContact CB-CD2 4.15Å; P393-L411 HydrophobicContact CG-CD2 3.63Å; P393-Y419 HydrophobicContact CG-CD1 4.27Å; P393-Y419 HydrophobicContact CG-CE1 3.66Å; P393-Y419 HydrophobicContact CG-CE2 4.26Å
394	F	95.6	Very high	91.5	Very high	10 Å²	10	70.1 Å²	70.1	4%	0.044	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	148.4	-177.7	-53.2	-89.7	0	0	0	109.9	I368 L388 V392 I405 L406 V407 L411 Y419 L421 V441 I443	I368-F394 HydrophobicContact CD1-CD1 3.7Å; I368-F394 HydrophobicContact CD1-CE1 3.71Å; I368-F394 HydrophobicContact CG1-CD1 4.46Å; L388-F394 HydrophobicContact CD2-CB 4.03Å; L388-F394 WeakPolarHBondContact CD2-O 3.47Å; V392-F394 HydrophobicContact CB-CD2 4.27Å; V392-F394 PolarHBondContact O-N 3.26Å; F394-I405 HydrophobicContact CB-CG2 4.21Å; F394-L406 CarbonylContact C-O 3.59Å; F394-L406 VanDerWaalsContact CA-O 3.27Å; F394-L406 WeakPolarHBondContact CA-O 3.46Å; F394-V407 HydrophobicContact CD1-CG2 4.21Å; F394-V407 HydrophobicContact CE1-CG2 4.04Å; F394-L411 HydrophobicContact CE1-CD1 4.27Å; F394-L411 HydrophobicContact CE1-CD2 4.16Å; F394-L411 HydrophobicContact CE2-CD2 4.23Å; F394-L411 HydrophobicContact CZ-CD1 4.35Å; F394-L411 HydrophobicContact CZ-CD2 3.68Å; F394-Y419 HydrophobicContact CE2-CD1 4.27Å; F394-Y419 AromaticContact CE2-CD2 3.92Å; F394-Y419 HydrophobicContact CE2-CD2 3.92Å; F394-Y419 HydrophobicContact CE2-CE2 4.49Å; F394-Y419 AromaticContact CE2-CG 3.79Å; F394-Y419 HydrophobicContact CE2-CG 3.79Å; F394-Y419 HydrophobicContact CZ-CD2 4.29Å; F394-L421 HydrophobicContact CB-CD1 4.21Å; F394-L421 HydrophobicContact CD2-CD1 3.87Å; F394-L421 HydrophobicContact CD2-CD2 3.8Å; F394-L421 HydrophobicContact CD2-CG 4.39Å; F394-L421 HydrophobicContact CE2-CD1 4.35Å; F394-L421 HydrophobicContact CE2-CD2 4.26Å; F394-L421 HydrophobicContact CG-CD1 3.95Å; F394-V441 HydrophobicContact CE1-CG1 4.26Å; F394-V441 HydrophobicContact CZ-CB 4.41Å; F394-V441 HydrophobicContact CZ-CG1 3.84Å; F394-I443 HydrophobicContact CZ-CD1 4.47Å
395	R	94.4	Very high	91.5	Very high	99 Å²	99	68 Å²	68	37%	0.374	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	155.8	171	73.9	171	-165	-112.9	-0.1	111.9	I405 L406 D408	R395-I405 WeakPolarHBondContact O-CA 3.26Å; R395-L406 HydrophobicContact CG-CD1 3.62Å; R395-L406 HydrophobicContact CG-CD2 4.44Å; R395-L406 HydrophobicContact CG-CG 3.85Å; R395-L406 PolarHBondContact N-O 2.9Å; R395-L406 PolarHBondContact O-N 2.91Å; R395-D408 HydrophobicContact CB-CB 4.18Å; R395-D408 WeakPolarHBondContact CD-OD1 3.4Å; R395-D408 HydrophobicContact CG-CB 4.12Å; R395-D408 IonicContact CZ-OD1 3.26Å; R395-D408 IonicContact NE-OD1 3.75Å; R395-D408 IonicContact NH1-OD1 3.41Å; R395-D408 PolarHBondContact NH1-OD1 2.9Å
396	L	94.6	Very high	91.6	Very high	30 Å²	30	63.7 Å²	63.7	16%	0.157	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	138	164.6	-166.8	73.7	0	0	0	109	V371 C386 E398 T404 I405	V371-L396 HydrophobicContact CG2-CD1 4.17Å; C386-L396 HydrophobicContact CB-CD2 3.35Å; L396-E398 HydrophobicContact CD2-CG 4.38Å; L396-T404 CarbonylContact C-O 3.58Å; L396-T404 WeakPolarHBondContact CA-O 3.36Å; L396-I405 HydrophobicContact CD1-CD1 4.42Å; L396-I405 HydrophobicContact CD1-CG1 3.62Å
397	Q	93.7	Very high	91.7	Very high	64 Å²	64	63 Å²	63	30%	0.299	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	114	171.4	-177.9	162.9	-32.8	0	0	109.6	Y399 S403 T404 L406	Q397-Y399 HydrophobicContact CB-CE2 4.45Å; Q397-Y399 HydrophobicContact CG-CE2 4Å; Q397-Y399 PolarHBondContact NE2-OH 2.81Å; Q397-Y399 WeakPolarHBondContact O-CD2 3.42Å; Q397-S403 CarbonylContact O-C 3.35Å; Q397-S403 VanDerWaalsContact O-CA 3.25Å; Q397-S403 WeakPolarHBondContact O-CA 3.24Å; Q397-T404 PolarHBondContact N-O 3.27Å; Q397-T404 PolarHBondContact O-N 2.89Å; Q397-L406 HydrophobicContact CB-CD2 3.79Å
398	E	91.8	Very high	91.8	Very high	103 Å²	103	60.8 Å²	60.8	48%	0.481	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	142.9	-176.1	-55.6	-175.2	129.2	0	0	111.7	C386 L396	C386-E398 PolarHBondContact N-OE1 3.06Å; C386-E398 VanDerWaalsContact N-OE1 3.09Å; L396-E398 HydrophobicContact CD2-CG 4.38Å
399	Y	88.9	Confident	91.6	Very high	111 Å²	111	60.5 Å²	60.5	44%	0.435	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	172.3	171.7	-59.8	-99.1	0	0	0	109.1	Q397 S401 F402 T404	Q397-Y399 HydrophobicContact CB-CE2 4.45Å; Q397-Y399 HydrophobicContact CG-CE2 4Å; Q397-Y399 PolarHBondContact NE2-OH 2.81Å; Q397-Y399 WeakPolarHBondContact O-CD2 3.42Å; Y399-S401 PolarHBondContact O-N 2.93Å; Y399-F402 CarbonylContact C-O 3.54Å; Y399-F402 WeakPolarHBondContact CA-O 3.44Å; Y399-F402 WeakPolarHBondContact CB-O 3.45Å; Y399-F402 HydrophobicContact CD1-CE2 4.47Å; Y399-F402 AromaticContact CD2-CD2 3.87Å; Y399-F402 HydrophobicContact CD2-CD2 3.87Å; Y399-F402 AromaticContact CD2-CE2 3.5Å; Y399-F402 HydrophobicContact CD2-CE2 3.5Å; Y399-F402 HydrophobicContact CD2-CZ 4.31Å; Y399-F402 HydrophobicContact CE2-CE2 4.03Å; Y399-F402 HydrophobicContact CG-CD2 4.29Å; Y399-F402 AromaticContact CG-CE2 3.77Å; Y399-F402 HydrophobicContact CG-CE2 3.77Å; Y399-F402 HydrophobicContact CG-CZ 4.13Å; Y399-F402 PolarHBondContact N-O 3.09Å; Y399-F402 VanDerWaalsContact O-O 3.06Å; Y399-T404 HydrophobicContact CE2-CG2 4.14Å
400	E	83.3	Confident	91.5	Very high	208 Å²	208	69 Å²	69	97%	0.972	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-20	-171.6	-62	-179.1	156.3	0	0	115.9
401	S	80.1	Confident	91.9	Very high	82 Å²	82	66.1 Å²	66.1	57%	0.573	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-142.7	6.7	-176.2	56.7	0	0	0	0	115.2	Y399	Y399-S401 PolarHBondContact O-N 2.93Å
402	F	90.3	Very high	92.3	Very high	75 Å²	75	61.4 Å²	61.4	33%	0.329	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-167.5	169.6	177.8	59	-94.5	0	0	0	110	L370 V371 Y399 T404	L370-F402 HydrophobicContact CD1-CB 3.89Å; L370-F402 HydrophobicContact CD1-CD2 3.37Å; L370-F402 HydrophobicContact CD1-CE2 4.04Å; L370-F402 HydrophobicContact CD1-CG 3.77Å; V371-F402 WeakPolarHBondContact O-CA 3.35Å; Y399-F402 CarbonylContact C-O 3.54Å; Y399-F402 WeakPolarHBondContact CA-O 3.44Å; Y399-F402 WeakPolarHBondContact CB-O 3.45Å; Y399-F402 HydrophobicContact CD1-CE2 4.47Å; Y399-F402 AromaticContact CD2-CD2 3.87Å; Y399-F402 HydrophobicContact CD2-CD2 3.87Å; Y399-F402 AromaticContact CD2-CE2 3.5Å; Y399-F402 HydrophobicContact CD2-CE2 3.5Å; Y399-F402 HydrophobicContact CD2-CZ 4.31Å; Y399-F402 HydrophobicContact CE2-CE2 4.03Å; Y399-F402 HydrophobicContact CG-CD2 4.29Å; Y399-F402 AromaticContact CG-CE2 3.77Å; Y399-F402 HydrophobicContact CG-CE2 3.77Å; Y399-F402 HydrophobicContact CG-CZ 4.13Å; Y399-F402 PolarHBondContact N-O 3.09Å; Y399-F402 VanDerWaalsContact O-O 3.06Å; F402-T404 HydrophobicContact CD2-CG2 4.28Å; F402-T404 HydrophobicContact CE2-CG2 4.16Å
403	S	92.6	Very high	92.5	Very high	8 Å²	8	60.9 Å²	60.9	6%	0.056	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	153.7	166.5	-60.5	0	0	0	0	110.2	V371 Q397	V371-S403 PolarHBondContact N-O 2.84Å; V371-S403 PolarHBondContact O-N 2.92Å; Q397-S403 CarbonylContact O-C 3.35Å; Q397-S403 VanDerWaalsContact O-CA 3.25Å; Q397-S403 WeakPolarHBondContact O-CA 3.24Å
404	T	93.3	Very high	92.5	Very high	13 Å²	13	62.7 Å²	62.7	8%	0.08	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	146.9	169.2	57.9	0	0	0	0	110.8	V367 A369 L370 L396 Q397 Y399 F402	V367-T404 HydrophobicContact CG1-CG2 4.08Å; A369-T404 WeakPolarHBondContact O-CA 3.4Å; L370-T404 HydrophobicContact CD1-CG2 4.05Å; L396-T404 CarbonylContact C-O 3.58Å; L396-T404 WeakPolarHBondContact CA-O 3.36Å; Q397-T404 PolarHBondContact N-O 3.27Å; Q397-T404 PolarHBondContact O-N 2.89Å; Y399-T404 HydrophobicContact CE2-CG2 4.14Å; F402-T404 HydrophobicContact CD2-CG2 4.28Å; F402-T404 HydrophobicContact CE2-CG2 4.16Å
405	I	94.3	Very high	92.4	Very high	0 Å²	0	68.3 Å²	68.3	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	129.6	167.8	-59.8	174.4	0	0	0	107.4	I368 A369 V371 L388 F394 R395 L396 L421 I423 F439	I368-I405 HydrophobicContact CD1-CG2 3.87Å; I368-I405 HydrophobicContact CG1-CB 4.14Å; I368-I405 HydrophobicContact CG1-CG2 3.83Å; I368-I405 WeakPolarHBondContact CG1-O 3.33Å; I368-I405 PolarHBondContact N-O 2.82Å; A369-I405 HydrophobicContact CB-CB 4.41Å; A369-I405 PolarHBondContact N-O 2.83Å; A369-I405 PolarHBondContact O-N 2.89Å; V371-I405 HydrophobicContact CG2-CD1 3.7Å; V371-I405 HydrophobicContact CG2-CG1 3.78Å; L388-I405 HydrophobicContact CD1-CD1 4.39Å; F394-I405 HydrophobicContact CB-CG2 4.21Å; R395-I405 WeakPolarHBondContact O-CA 3.26Å; L396-I405 HydrophobicContact CD1-CD1 4.42Å; L396-I405 HydrophobicContact CD1-CG1 3.62Å; I405-L421 HydrophobicContact CG2-CD1 4.19Å; I405-I423 HydrophobicContact CD1-CD1 3.77Å; I405-I423 HydrophobicContact CD1-CG1 3.9Å; I405-F439 HydrophobicContact CD1-CE1 3.78Å; I405-F439 HydrophobicContact CD1-CZ 3.56Å
406	L	94.5	Very high	92.4	Very high	4 Å²	4	67.6 Å²	67.6	2%	0.021	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	153.1	-173.6	68.2	89.2	0	0	0	112.2	Y366 V367 F394 R395 Q397 D408	Y366-L406 CarbonylContact O-C 3Å; Y366-L406 WeakPolarHBondContact O-CA 3.46Å; Y366-L406 VanDerWaalsContact O-CB 3.28Å; Y366-L406 WeakPolarHBondContact O-CB 3.11Å; V367-L406 HydrophobicContact CG2-CB 4.19Å; F394-L406 CarbonylContact C-O 3.59Å; F394-L406 VanDerWaalsContact CA-O 3.27Å; F394-L406 WeakPolarHBondContact CA-O 3.46Å; R395-L406 HydrophobicContact CG-CD1 3.62Å; R395-L406 HydrophobicContact CG-CD2 4.44Å; R395-L406 HydrophobicContact CG-CG 3.85Å; R395-L406 PolarHBondContact N-O 2.9Å; R395-L406 PolarHBondContact O-N 2.91Å; Q397-L406 HydrophobicContact CB-CD2 3.79Å; L406-D408 PolarHBondContact O-N 2.88Å
407	V	96.1	Very high	92.4	Very high	0 Å²	0	70.6 Å²	70.6	0%	0	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.2	126.6	177	-177.4	0	0	0	0	109.6	V358 A362 P364 G365 Y366 I368 F394 G409 L411	V358-V407 HydrophobicContact CG2-CG2 4.33Å; A362-V407 HydrophobicContact CB-CG2 4.29Å; P364-V407 CarbonylContact C-O 3.5Å; P364-V407 VanDerWaalsContact CA-O 3.29Å; P364-V407 WeakPolarHBondContact CA-O 3.42Å; G365-V407 PolarHBondContact N-O 2.88Å; Y366-V407 HydrophobicContact CD1-CG2 4.45Å; Y366-V407 PolarHBondContact O-N 3.1Å; I368-V407 HydrophobicContact CG2-CG2 4.04Å; F394-V407 HydrophobicContact CD1-CG2 4.21Å; F394-V407 HydrophobicContact CE1-CG2 4.04Å; V407-G409 VanDerWaalsContact CG1-O 3.28Å; V407-G409 WeakPolarHBondContact CG1-O 3.42Å; V407-L411 HydrophobicContact CG1-CD1 4.1Å; V407-L411 HydrophobicContact CG1-CG 4.09Å; V407-L411 HydrophobicContact CG2-CD1 3.93Å
408	D	94.6	Very high	92.5	Very high	82 Å²	82	72 Å²	72	44%	0.439	35%	0.346	S	S	.	.			trans	-118.6	-31.7	-179.1	-155.8	56.3	0	0	0	112	P393 R395 L406	P393-D408 PolarHBondContact O-N 2.75Å; R395-D408 HydrophobicContact CB-CB 4.18Å; R395-D408 WeakPolarHBondContact CD-OD1 3.4Å; R395-D408 HydrophobicContact CG-CB 4.12Å; R395-D408 IonicContact CZ-OD1 3.26Å; R395-D408 IonicContact NE-OD1 3.75Å; R395-D408 IonicContact NH1-OD1 3.41Å; R395-D408 PolarHBondContact NH1-OD1 2.9Å; L406-D408 PolarHBondContact O-N 2.88Å
409	G	90.6	Very high	92.6	Very high	26 Å²	26	68.7 Å²	68.7	27%	0.268	33%	0.33	S	S	.	.	S	Bend	trans	-91.3	-169.3	169.8	0	0	0	0	0	113.1	P393 V407	P393-G409 PolarHBondContact O-N 2.8Å; V407-G409 VanDerWaalsContact CG1-O 3.28Å; V407-G409 WeakPolarHBondContact CG1-O 3.42Å
410	R	91.6	Very high	92.9	Very high	227 Å²	227	68.6 Å²	68.6	86%	0.857	34%	0.337	S	S	*	.			trans	-86.5	154.7	156.3	-70.5	-173.9	176.8	-157	-3.9	109.1
411	L	95.6	Very high	93.4	Very high	13 Å²	13	58.7 Å²	58.7	7%	0.068	29%	0.29	C	S	.	.			trans	-107.5	155.3	169.4	-58.3	174.5	0	0	0	108	V358 E360 A362 P393 F394 V407 Y419 I443	V358-L411 HydrophobicContact CG1-CD1 3.9Å; V358-L411 HydrophobicContact CG2-CD1 4.06Å; E360-L411 HydrophobicContact CB-CB 4.16Å; A362-L411 HydrophobicContact CB-CD1 4.49Å; P393-L411 HydrophobicContact CB-CD2 4.15Å; P393-L411 HydrophobicContact CG-CD2 3.63Å; F394-L411 HydrophobicContact CE1-CD1 4.27Å; F394-L411 HydrophobicContact CE1-CD2 4.16Å; F394-L411 HydrophobicContact CE2-CD2 4.23Å; F394-L411 HydrophobicContact CZ-CD1 4.35Å; F394-L411 HydrophobicContact CZ-CD2 3.68Å; V407-L411 HydrophobicContact CG1-CD1 4.1Å; V407-L411 HydrophobicContact CG1-CG 4.09Å; V407-L411 HydrophobicContact CG2-CD1 3.93Å; L411-Y419 HydrophobicContact CD2-CE2 4.28Å; L411-I443 HydrophobicContact CD1-CD1 4.12Å; L411-I443 HydrophobicContact CD2-CD1 4.18Å
412	D	95.4	Very high	94.1	Very high	69 Å²	69	56.2 Å²	56.2	37%	0.369	27%	0.272	S	S	.	.			trans	-166.5	107.9	-168.6	176	-42.2	0	0	0	105.3	E414 Q415 H416	D412-E414 PolarHBondContact OD1-N 2.9Å; D412-Q415 HydrophobicContact CB-CB 4.27Å; D412-Q415 WeakPolarHBondContact OD1-CB 3.45Å; D412-Q415 PolarHBondContact OD1-N 2.9Å; D412-H416 PolarHBondContact O-N 3Å
413	R	96.3	Very high	94.3	Very high	31 Å²	31	52.6 Å²	52.6	12%	0.117	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.3	-32.8	-171.4	-169	-155.1	61.6	67.1	-1.2	111.4	E360 Q415 H416 D417 I443 D445 P480	E360-R413 WeakPolarHBondContact OE2-CB 3.14Å; E360-R413 PolarHBondContact OE2-N 3.3Å; R413-Q415 PolarHBondContact O-N 2.83Å; R413-H416 CarbonylContact O-C 3.57Å; R413-H416 PolarHBondContact O-N 2.88Å; R413-D417 HydrophobicContact CG-CB 4.23Å; R413-D417 PolarHBondContact O-N 2.85Å; R413-I443 HydrophobicContact CB-CB 4.37Å; R413-I443 HydrophobicContact CB-CG2 3.82Å; R413-I443 HydrophobicContact CG-CB 4.21Å; R413-I443 HydrophobicContact CG-CG2 4.14Å; R413-D445 IonicContact CZ-OD1 3.27Å; R413-D445 IonicContact NE-OD1 2.7Å; R413-D445 PolarHBondContact NE-OD1 2.92Å; R413-D445 IonicContact NH2-OD1 3.69Å; R413-D445 PolarHBondContact NH2-OD1 3.39Å; R413-P480 PolarHBondContact NH2-O 3.47Å
414	E	95.3	Very high	94.4	Very high	61 Å²	61	53.3 Å²	53.3	29%	0.285	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65	-31.5	176.6	-68.8	62.2	-126.7	0	0	111.2	D412 P480	D412-E414 PolarHBondContact OD1-N 2.9Å; E414-P480 HydrophobicContact CG-CB 3.7Å; E414-P480 HydrophobicContact CG-CG 3.91Å
415	Q	94.3	Very high	94.5	Very high	129 Å²	129	52.7 Å²	52.7	60%	0.603	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.5	-50.6	168.6	-164.2	-169.3	-62.5	0	0	111.9	D412 R413	D412-Q415 HydrophobicContact CB-CB 4.27Å; D412-Q415 WeakPolarHBondContact OD1-CB 3.45Å; D412-Q415 PolarHBondContact OD1-N 2.9Å; R413-Q415 PolarHBondContact O-N 2.83Å
416	H	93.9	Very high	94.5	Very high	84 Å²	84	57.6 Å²	57.6	39%	0.389	27%	0.273	S	S	.	.			trans	-145.5	99.5	-173.8	-68.6	-35.4	0	0	0	112.9	D412 R413 Y419 I443	D412-H416 PolarHBondContact O-N 3Å; R413-H416 CarbonylContact O-C 3.57Å; R413-H416 PolarHBondContact O-N 2.88Å; H416-Y419 HydrophobicContact CB-CE1 4.35Å; H416-Y419 HydrophobicContact CB-CE2 3.84Å; H416-Y419 WeakPolarHBondContact CB-OH 3.35Å; H416-Y419 PolarHBondContact CD2-OH 2.95Å; H416-I443 WeakPolarHBondContact O-CG1 3.47Å
417	D	94.2	Very high	94.6	Very high	92 Å²	92	57.7 Å²	57.7	49%	0.492	27%	0.273	S	S	.	.	S	Bend	trans	-68.7	-28.6	178.9	60.2	-12.9	0	0	0	114.7	R413 I443	R413-D417 HydrophobicContact CG-CB 4.23Å; R413-D417 PolarHBondContact O-N 2.85Å; D417-I443 WeakPolarHBondContact O-CB 3.38Å; D417-I443 PolarHBondContact O-N 3.14Å
418	Q	95.5	Very high	94.4	Very high	94 Å²	94	59.5 Å²	59.5	44%	0.439	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	151.7	176.8	56.8	162.5	96.8	0	0	115	N420 T440 V441	Q418-N420 PolarHBondContact NE2-OD1 3.04Å; Q418-N420 VanDerWaalsContact NE2-OD1 3.1Å; Q418-T440 HydrophobicContact CB-CG2 4.2Å; Q418-V441 CarbonylContact C-O 3.26Å; Q418-V441 VanDerWaalsContact CA-O 3.27Å; Q418-V441 WeakPolarHBondContact CA-O 3.2Å
419	Y	94.5	Very high	94.3	Very high	34 Å²	34	55.7 Å²	55.7	13%	0.133	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	122.8	176	-66.3	-95.3	0	0	0	111.5	P393 F394 L411 H416 L421 V441 I443	P393-Y419 HydrophobicContact CG-CD1 4.27Å; P393-Y419 HydrophobicContact CG-CE1 3.66Å; P393-Y419 HydrophobicContact CG-CE2 4.26Å; F394-Y419 HydrophobicContact CE2-CD1 4.27Å; F394-Y419 AromaticContact CE2-CD2 3.92Å; F394-Y419 HydrophobicContact CE2-CD2 3.92Å; F394-Y419 HydrophobicContact CE2-CE2 4.49Å; F394-Y419 AromaticContact CE2-CG 3.79Å; F394-Y419 HydrophobicContact CE2-CG 3.79Å; F394-Y419 HydrophobicContact CZ-CD2 4.29Å; L411-Y419 HydrophobicContact CD2-CE2 4.28Å; H416-Y419 HydrophobicContact CB-CE1 4.35Å; H416-Y419 HydrophobicContact CB-CE2 3.84Å; H416-Y419 WeakPolarHBondContact CB-OH 3.35Å; H416-Y419 PolarHBondContact CD2-OH 2.95Å; Y419-L421 PolarHBondContact O-N 2.89Å; Y419-V441 PolarHBondContact N-O 3.28Å; Y419-V441 PolarHBondContact O-N 3.36Å; Y419-I443 HydrophobicContact CD2-CD1 3.9Å; Y419-I443 HydrophobicContact CD2-CG1 4.05Å; Y419-I443 HydrophobicContact CE2-CD1 3.99Å; Y419-I443 HydrophobicContact CE2-CG1 3.94Å
420	N	94	Very high	94.3	Very high	108 Å²	108	61.1 Å²	61.1	58%	0.578	30%	0.3	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.3	96.2	174.8	-64.5	2.8	0	0	0	109.3	Q418	Q418-N420 PolarHBondContact NE2-OD1 3.04Å; Q418-N420 VanDerWaalsContact NE2-OD1 3.1Å
421	L	93.9	Very high	94.3	Very high	0 Å²	0	54.9 Å²	54.9	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	136.5	-178.2	-63.1	-164	0	0	0	110.8	I368 L388 V392 F394 I405 Y419 S438 F439 V441	I368-L421 HydrophobicContact CD1-CD1 4.2Å; L388-L421 HydrophobicContact CD1-CB 4.34Å; V392-L421 HydrophobicContact CB-CD2 3.93Å; V392-L421 HydrophobicContact CG1-CD2 3.92Å; V392-L421 HydrophobicContact CG2-CD2 3.88Å; F394-L421 HydrophobicContact CB-CD1 4.21Å; F394-L421 HydrophobicContact CD2-CD1 3.87Å; F394-L421 HydrophobicContact CD2-CD2 3.8Å; F394-L421 HydrophobicContact CD2-CG 4.39Å; F394-L421 HydrophobicContact CE2-CD1 4.35Å; F394-L421 HydrophobicContact CE2-CD2 4.26Å; F394-L421 HydrophobicContact CG-CD1 3.95Å; I405-L421 HydrophobicContact CG2-CD1 4.19Å; Y419-L421 PolarHBondContact O-N 2.89Å; L421-S438 CarbonylContact O-C 3.53Å; L421-S438 VanDerWaalsContact O-CA 3.24Å; L421-S438 WeakPolarHBondContact O-CA 3.2Å; L421-F439 HydrophobicContact CB-CD1 4.27Å; L421-F439 HydrophobicContact CB-CE1 3.74Å; L421-F439 HydrophobicContact CB-CE2 4.18Å; L421-F439 HydrophobicContact CB-CZ 3.7Å; L421-F439 HydrophobicContact CD1-CE2 4.16Å; L421-F439 HydrophobicContact CD1-CZ 3.78Å; L421-F439 HydrophobicContact CG-CZ 4.27Å; L421-F439 PolarHBondContact N-O 2.78Å; L421-F439 PolarHBondContact O-N 2.86Å; L421-V441 HydrophobicContact CD1-CG2 3.49Å; L421-V441 VanDerWaalsContact CD1-CG2 3.49Å; L421-V441 HydrophobicContact CG-CG2 3.74Å
422	T	94.4	Very high	94.2	Very high	30 Å²	30	60.1 Å²	60.1	18%	0.184	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	119.4	174.2	-57.1	0	0	0	0	110.4	L389 A436 K437 S438	L389-T422 WeakPolarHBondContact CB-O 3.46Å; L389-T422 HydrophobicContact CD1-CG2 3.96Å; L389-T422 PolarHBondContact N-O 3.03Å; T422-A436 HydrophobicContact CG2-CB 4.15Å; T422-K437 WeakPolarHBondContact CA-O 3.27Å; T422-S438 WeakPolarHBondContact CG2-OG 3.15Å; T422-S438 PolarHBondContact OG1-OG 2.85Å
423	I	94.4	Very high	94.2	Very high	0 Å²	0	59.3 Å²	59.3	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	136.5	170.4	-52.2	158.7	0	0	0	107.2	I346 L348 V371 L388 I405 A436 K437 F439	I346-I423 HydrophobicContact CD1-CB 4.37Å; I346-I423 HydrophobicContact CD1-CG2 4.18Å; I346-I423 HydrophobicContact CG2-CD1 4.11Å; I346-I423 HydrophobicContact CG2-CG2 4.42Å; L348-I423 HydrophobicContact CD1-CD1 3.47Å; L348-I423 VanDerWaalsContact CD1-CD1 3.47Å; V371-I423 HydrophobicContact CG1-CD1 3.97Å; V371-I423 HydrophobicContact CG2-CD1 3.79Å; L388-I423 HydrophobicContact CD1-CG1 4.2Å; I405-I423 HydrophobicContact CD1-CD1 3.77Å; I405-I423 HydrophobicContact CD1-CG1 3.9Å; I423-A436 CarbonylContact O-C 3.54Å; I423-A436 VanDerWaalsContact O-CA 3.23Å; I423-A436 WeakPolarHBondContact O-CA 3.13Å; I423-K437 PolarHBondContact N-O 3.27Å; I423-K437 PolarHBondContact O-N 2.89Å; I423-F439 HydrophobicContact CD1-CD1 4.44Å; I423-F439 HydrophobicContact CD1-CE1 3.9Å; I423-F439 HydrophobicContact CG1-CE1 4.07Å
424	Q	95.1	Very high	94.2	Very high	22 Å²	22	63.8 Å²	63.8	10%	0.103	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	133.6	162.4	172	170	81.5	0	0	109.6	C386 R387 L389 S435	C386-Q424 CarbonylContact C-O 3.51Å; C386-Q424 WeakPolarHBondContact CA-O 3.47Å; R387-Q424 HydrophobicContact CG-CB 4.13Å; R387-Q424 PolarHBondContact N-O 3.26Å; R387-Q424 PolarHBondContact O-N 2.83Å; L389-Q424 HydrophobicContact CD1-CB 4.11Å; L389-Q424 HydrophobicContact CD2-CB 4.08Å; L389-Q424 HydrophobicContact CG-CB 4.11Å; Q424-S435 WeakPolarHBondContact CA-O 3.28Å
425	A	95.5	Very high	94.2	Very high	0 Å²	0	62.3 Å²	62.3	0%	0	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	147.3	162	0	0	0	0	0	109.2	P344 I346 V373 Q434 S435	P344-A425 HydrophobicContact CB-CB 3.9Å; P344-A425 HydrophobicContact CG-CB 4.03Å; I346-A425 HydrophobicContact CD1-CB 3.91Å; I346-A425 HydrophobicContact CG1-CB 3.84Å; V373-A425 HydrophobicContact CG1-CB 3.75Å; V373-A425 HydrophobicContact CG2-CB 4.25Å; A425-Q434 CarbonylContact O-C 3.51Å; A425-Q434 VanDerWaalsContact O-CA 3.24Å; A425-Q434 WeakPolarHBondContact O-CA 3.45Å; A425-Q434 WeakPolarHBondContact O-CB 3.36Å; A425-S435 PolarHBondContact N-O 2.89Å; A425-S435 PolarHBondContact O-N 2.76Å
426	R	94.9	Very high	94.2	Very high	104 Å²	104	59.3 Å²	59.3	39%	0.392	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	149.4	168.7	62.7	178.4	179.2	-176.4	2.8	108.6	V384 Q385 L433 Q434	V384-R426 CarbonylContact C-O 3.58Å; V384-R426 VanDerWaalsContact CA-O 3.26Å; V384-R426 WeakPolarHBondContact CA-O 3.25Å; Q385-R426 HydrophobicContact CB-CG 4.36Å; Q385-R426 PolarHBondContact N-O 2.84Å; Q385-R426 PolarHBondContact O-N 3.46Å; R426-L433 WeakPolarHBondContact CA-O 3.49Å; R426-Q434 HydrophobicContact CB-CB 4.24Å
427	D	95.5	Very high	94.2	Very high	5 Å²	5	58.6 Å²	58.6	3%	0.027	32%	0.322	C	S	.	.			trans	-78.3	-169.9	169.9	57.2	50.2	0	0	0	112.3	N340 N381 R383 G429 M432 L433	N340-D427 PolarHBondContact ND2-OD2 2.98Å; N340-D427 VanDerWaalsContact OD1-CG 3.28Å; N340-D427 PolarHBondContact OD1-OD2 2.84Å; N381-D427 WeakPolarHBondContact O-CB 3.44Å; R383-D427 CarbonylContact O-C 3.52Å; D427-G429 PolarHBondContact OD1-N 2.88Å; D427-M432 WeakPolarHBondContact OD1-CA 3.34Å; D427-M432 WeakPolarHBondContact OD1-CB 3.44Å; D427-L433 PolarHBondContact N-O 3.48Å; D427-L433 PolarHBondContact OD1-N 2.68Å; D427-L433 WeakPolarHBondContact OD2-CA 3.27Å; D427-L433 WeakPolarHBondContact OD2-CB 3.41Å; D427-L433 PolarHBondContact OD2-N 2.78Å
428	G	93.2	Very high	94.1	Very high	38 Å²	38	58 Å²	58	39%	0.392	33%	0.325	S	S	.	.	S	Bend	trans	-113.2	14.4	168.7	0	0	0	0	0	114.1	L380 R383	L380-G428 CarbonylContact O-C 3.52Å; L380-G428 WeakPolarHBondContact O-CA 3.36Å; L380-G428 PolarHBondContact O-N 3.5Å; R383-G428 PolarHBondContact O-N 2.81Å
429	G	92.2	Very high	94	Very high	3 Å²	3	53.8 Å²	53.8	3%	0.031	31%	0.305	C	S	.	.	S	Bend	trans	-82.9	-175	-174.3	0	0	0	0	0	114.8	N340 D427 M432	N340-G429 VanDerWaalsContact OD1-CA 3.26Å; N340-G429 WeakPolarHBondContact OD1-CA 3.36Å; D427-G429 PolarHBondContact OD1-N 2.88Å; G429-M432 WeakPolarHBondContact O-CG 3.5Å; G429-M432 PolarHBondContact O-N 3.42Å
430	V	89.6	Confident	93.9	Very high	140 Å²	140	54.2 Å²	54.2	85%	0.848	31%	0.311	S	S	*	.	S	Bend	trans	-141.4	106.9	179.1	-175.5	0	0	0	0	109.7
431	P	92.9	Very high	94	Very high	95 Å²	95	49 Å²	49	62%	0.617	28%	0.284	S	S	*	.	S	Bend	cis	-67.1	148.2	0.4	31.1	-36.3	0	0	0	112.5	L433	P431-L433 PolarHBondContact O-N 3.23Å
432	M	93.6	Very high	94	Very high	123 Å²	123	52.1 Å²	52.1	61%	0.606	30%	0.3	S	S	*	.	P	Polyproline II helix	trans	-71.7	125.6	171.7	-67.5	171.1	-74	0	0	110.3	D427 G429	D427-M432 WeakPolarHBondContact OD1-CA 3.34Å; D427-M432 WeakPolarHBondContact OD1-CB 3.44Å; G429-M432 WeakPolarHBondContact O-CG 3.5Å; G429-M432 PolarHBondContact O-N 3.42Å
433	L	95.3	Very high	94.1	Very high	52 Å²	52	50.9 Å²	50.9	27%	0.272	29%	0.292	S	S	.	.	P	Polyproline II helix	trans	-89.9	164.8	164.4	-52.8	175.3	0	0	0	110.1	N340 P343 R426 D427 P431	N340-L433 WeakPolarHBondContact ND2-CD1 3.29Å; N340-L433 WeakPolarHBondContact ND2-CG 3.26Å; P343-L433 HydrophobicContact CB-CB 4.16Å; P343-L433 HydrophobicContact CB-CD1 4.26Å; R426-L433 WeakPolarHBondContact CA-O 3.49Å; D427-L433 PolarHBondContact N-O 3.48Å; D427-L433 PolarHBondContact OD1-N 2.68Å; D427-L433 WeakPolarHBondContact OD2-CA 3.27Å; D427-L433 WeakPolarHBondContact OD2-CB 3.41Å; D427-L433 PolarHBondContact OD2-N 2.78Å; P431-L433 PolarHBondContact O-N 3.23Å
434	Q	95.4	Very high	94.1	Very high	125 Å²	125	53.2 Å²	53.2	58%	0.584	31%	0.307	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-156.2	148.3	-177.3	56.4	177.5	-10.1	0	0	110	A425 R426	A425-Q434 CarbonylContact O-C 3.51Å; A425-Q434 VanDerWaalsContact O-CA 3.24Å; A425-Q434 WeakPolarHBondContact O-CA 3.45Å; A425-Q434 WeakPolarHBondContact O-CB 3.36Å; R426-Q434 HydrophobicContact CB-CB 4.24Å
435	S	96	Very high	94.1	Very high	30 Å²	30	53.9 Å²	53.9	21%	0.21	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	158.7	169.9	71.6	0	0	0	0	110.4	P344 I346 Q424 A425	P344-S435 WeakPolarHBondContact O-CB 3.14Å; P344-S435 PolarHBondContact O-OG 3.45Å; I346-S435 WeakPolarHBondContact CD1-OG 3.28Å; I346-S435 WeakPolarHBondContact CG1-OG 3.29Å; Q424-S435 WeakPolarHBondContact CA-O 3.28Å; A425-S435 PolarHBondContact N-O 2.89Å; A425-S435 PolarHBondContact O-N 2.76Å
436	A	94.9	Very high	94.1	Very high	67 Å²	67	57.6 Å²	57.6	55%	0.554	33%	0.328	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-135	140.3	173.8	0	0	0	0	0	109.8	T422 I423	T422-A436 HydrophobicContact CG2-CB 4.15Å; I423-A436 CarbonylContact O-C 3.54Å; I423-A436 VanDerWaalsContact O-CA 3.23Å; I423-A436 WeakPolarHBondContact O-CA 3.13Å
437	K	92.4	Very high	94.1	Very high	68 Å²	68	53.7 Å²	53.7	30%	0.296	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	119.9	176.8	-173.5	161.6	-177.1	160	0	109.7	I346 T422 I423	I346-K437 HydrophobicContact CB-CB 4.06Å; I346-K437 HydrophobicContact CB-CD 4.09Å; I346-K437 HydrophobicContact CD1-CB 4.03Å; I346-K437 HydrophobicContact CG2-CB 4.03Å; I346-K437 HydrophobicContact CG2-CD 4.02Å; I346-K437 WeakPolarHBondContact O-CD 3.34Å; I346-K437 PolarHBondContact O-NZ 2.74Å; T422-K437 WeakPolarHBondContact CA-O 3.27Å; I423-K437 PolarHBondContact N-O 3.27Å; I423-K437 PolarHBondContact O-N 2.89Å
438	S	93.3	Very high	94	Very high	81 Å²	81	58.8 Å²	58.8	57%	0.566	34%	0.342	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.3	143.6	176.4	-55.3	0	0	0	0	110.7	L421 T422	L421-S438 CarbonylContact O-C 3.53Å; L421-S438 VanDerWaalsContact O-CA 3.24Å; L421-S438 WeakPolarHBondContact O-CA 3.2Å; T422-S438 WeakPolarHBondContact CG2-OG 3.15Å; T422-S438 PolarHBondContact OG1-OG 2.85Å
439	F	92.4	Very high	94	Very high	5 Å²	5	59.3 Å²	59.3	2%	0.022	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149	158.4	173.4	68.3	-81.5	0	0	0	109.6	L348 V356 I405 L421 I423 V441	L348-F439 HydrophobicContact CD1-CD1 4.33Å; L348-F439 HydrophobicContact CD1-CE1 4.2Å; L348-F439 HydrophobicContact CD2-CB 4.15Å; L348-F439 HydrophobicContact CD2-CD1 3.92Å; L348-F439 HydrophobicContact CD2-CD2 3.99Å; L348-F439 HydrophobicContact CD2-CE1 4.31Å; L348-F439 HydrophobicContact CD2-CE2 4.36Å; L348-F439 HydrophobicContact CD2-CG 3.75Å; V356-F439 HydrophobicContact CB-CD2 4.41Å; V356-F439 HydrophobicContact CB-CE2 4.29Å; V356-F439 HydrophobicContact CG2-CD2 3.67Å; V356-F439 HydrophobicContact CG2-CE2 3.68Å; I405-F439 HydrophobicContact CD1-CE1 3.78Å; I405-F439 HydrophobicContact CD1-CZ 3.56Å; L421-F439 HydrophobicContact CB-CD1 4.27Å; L421-F439 HydrophobicContact CB-CE1 3.74Å; L421-F439 HydrophobicContact CB-CE2 4.18Å; L421-F439 HydrophobicContact CB-CZ 3.7Å; L421-F439 HydrophobicContact CD1-CE2 4.16Å; L421-F439 HydrophobicContact CD1-CZ 3.78Å; L421-F439 HydrophobicContact CG-CZ 4.27Å; L421-F439 PolarHBondContact N-O 2.78Å; L421-F439 PolarHBondContact O-N 2.86Å; I423-F439 HydrophobicContact CD1-CD1 4.44Å; I423-F439 HydrophobicContact CD1-CE1 3.9Å; I423-F439 HydrophobicContact CG1-CE1 4.07Å; F439-V441 HydrophobicContact CD2-CG2 4.2Å; F439-V441 HydrophobicContact CE2-CG2 3.6Å; F439-V441 HydrophobicContact CZ-CG2 4.42Å
440	T	93.8	Very high	94.1	Very high	42 Å²	42	63.4 Å²	63.4	26%	0.258	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	133.1	-179.4	-50.5	0	0	0	0	109.7	E354 L355 V356 Q418	E354-T440 PolarHBondContact O-N 3.5Å; L355-T440 CarbonylContact C-O 3.49Å; L355-T440 WeakPolarHBondContact CA-O 3.03Å; L355-T440 HydrophobicContact CD1-CG2 4.22Å; V356-T440 PolarHBondContact N-O 3.43Å; Q418-T440 HydrophobicContact CB-CG2 4.2Å
441	V	94.3	Very high	94.5	Very high	0 Å²	0	56.8 Å²	56.8	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	116.8	163.8	-178.8	0	0	0	0	107.8	V356 V358 I368 F394 Q418 Y419 L421 F439 I443	V356-V441 HydrophobicContact CB-CG2 4.28Å; V356-V441 CarbonylContact O-C 3.43Å; V356-V441 VanDerWaalsContact O-CA 3.26Å; V356-V441 WeakPolarHBondContact O-CA 3.23Å; V358-V441 HydrophobicContact CG1-CG1 3.47Å; V358-V441 VanDerWaalsContact CG1-CG1 3.47Å; I368-V441 HydrophobicContact CD1-CG1 4.21Å; I368-V441 HydrophobicContact CD1-CG2 3.66Å; F394-V441 HydrophobicContact CE1-CG1 4.26Å; F394-V441 HydrophobicContact CZ-CB 4.41Å; F394-V441 HydrophobicContact CZ-CG1 3.84Å; Q418-V441 CarbonylContact C-O 3.26Å; Q418-V441 VanDerWaalsContact CA-O 3.27Å; Q418-V441 WeakPolarHBondContact CA-O 3.2Å; Y419-V441 PolarHBondContact N-O 3.28Å; Y419-V441 PolarHBondContact O-N 3.36Å; L421-V441 HydrophobicContact CD1-CG2 3.49Å; L421-V441 VanDerWaalsContact CD1-CG2 3.49Å; L421-V441 HydrophobicContact CG-CG2 3.74Å; F439-V441 HydrophobicContact CD2-CG2 4.2Å; F439-V441 HydrophobicContact CE2-CG2 3.6Å; F439-V441 HydrophobicContact CZ-CG2 4.42Å; V441-I443 HydrophobicContact CG1-CD1 4.22Å
442	L	94.5	Very high	94.6	Very high	64 Å²	64	58.4 Å²	58.4	34%	0.335	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	130.3	173	-180	66.2	0	0	0	108.9	L355 V356 E357 V358	L355-L442 HydrophobicContact CD1-CB 3.98Å; V356-L442 PolarHBondContact O-N 3.22Å; E357-L442 WeakPolarHBondContact CA-O 3.21Å; E357-L442 HydrophobicContact CG-CB 4.43Å; E357-L442 HydrophobicContact CG-CD2 4.39Å; V358-L442 PolarHBondContact N-O 2.76Å
443	I	96.1	Very high	94.7	Very high	5 Å²	5	53 Å²	53	3%	0.026	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	122	174.7	-51.6	-51.7	0	0	0	108.3	V358 E360 F394 L411 R413 H416 D417 Y419 V441	V358-I443 HydrophobicContact CG1-CD1 3.63Å; V358-I443 CarbonylContact O-C 3.45Å; V358-I443 WeakPolarHBondContact O-CA 3.45Å; E360-I443 HydrophobicContact CB-CG2 3.68Å; F394-I443 HydrophobicContact CZ-CD1 4.47Å; L411-I443 HydrophobicContact CD1-CD1 4.12Å; L411-I443 HydrophobicContact CD2-CD1 4.18Å; R413-I443 HydrophobicContact CB-CB 4.37Å; R413-I443 HydrophobicContact CB-CG2 3.82Å; R413-I443 HydrophobicContact CG-CB 4.21Å; R413-I443 HydrophobicContact CG-CG2 4.14Å; H416-I443 WeakPolarHBondContact O-CG1 3.47Å; D417-I443 WeakPolarHBondContact O-CB 3.38Å; D417-I443 PolarHBondContact O-N 3.14Å; Y419-I443 HydrophobicContact CD2-CD1 3.9Å; Y419-I443 HydrophobicContact CD2-CG1 4.05Å; Y419-I443 HydrophobicContact CE2-CD1 3.99Å; Y419-I443 HydrophobicContact CE2-CG1 3.94Å; V441-I443 HydrophobicContact CG1-CD1 4.22Å
444	T	95.3	Very high	94.7	Very high	49 Å²	49	54.2 Å²	54.2	30%	0.301	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	131.6	178.5	66.1	0	0	0	0	110.7	E357 V358 S359 E360	E357-T444 HydrophobicContact CB-CG2 3.93Å; E357-T444 HydrophobicContact CG-CG2 4.26Å; V358-T444 PolarHBondContact O-N 3.01Å; V358-T444 PolarHBondContact O-OG1 2.74Å; S359-T444 WeakPolarHBondContact CA-OG1 3.1Å; S359-T444 PolarHBondContact N-OG1 3.13Å; E360-T444 PolarHBondContact N-O 3.2Å
445	D	95.3	Very high	94.6	Very high	35 Å²	35	54 Å²	54	19%	0.187	30%	0.296	C	S	.	.	P	Polyproline II helix	trans	-59.9	133.1	-175.7	-169.3	85.1	0	0	0	114.2	E360 R413 L482 N485	E360-D445 VanDerWaalsContact OE1-CA 3.3Å; E360-D445 WeakPolarHBondContact OE1-CA 3.11Å; R413-D445 IonicContact CZ-OD1 3.27Å; R413-D445 IonicContact NE-OD1 2.7Å; R413-D445 PolarHBondContact NE-OD1 2.92Å; R413-D445 IonicContact NH2-OD1 3.69Å; R413-D445 PolarHBondContact NH2-OD1 3.39Å; D445-L482 HydrophobicContact CB-CB 3.86Å; D445-L482 VanDerWaalsContact CG-CB 3.42Å; D445-L482 VanDerWaalsContact CG-N 3.3Å; D445-L482 WeakPolarHBondContact OD1-CB 3.07Å; D445-L482 PolarHBondContact OD1-N 2.81Å; D445-L482 PolarHBondContact OD2-N 3.36Å; D445-N485 WeakPolarHBondContact OD2-CB 3.49Å; D445-N485 PolarHBondContact OD2-ND2 3.12Å
446	E	94.8	Very high	94.5	Very high	79 Å²	79	57.8 Å²	57.8	37%	0.369	32%	0.32	S	S	.	.			trans	-119.4	146.9	168.4	-64.1	-76.2	171.4	0	0	109.9	S359 E360 D448	S359-E446 WeakPolarHBondContact CB-OE1 3.21Å; S359-E446 VanDerWaalsContact OG-CD 3.27Å; S359-E446 WeakPolarHBondContact OG-CG 3.42Å; S359-E446 PolarHBondContact OG-OE1 3.46Å; E360-E446 HydrophobicContact CG-CB 4.1Å; E360-E446 HydrophobicContact CG-CG 4.04Å; E360-E446 PolarHBondContact OE1-N 3.31Å; E446-D448 PolarHBondContact O-N 2.91Å
447	N	95.1	Very high	94.5	Very high	21 Å²	21	58.9 Å²	58.9	11%	0.112	31%	0.311	C	S	.	.	S	Bend	trans	-78.9	72	-178.4	-161.4	108.3	0	0	0	111.4	D481 N485 D537 G539 L543	N447-D481 WeakPolarHBondContact CA-OD2 3.3Å; N447-N485 HydrophobicContact CB-CB 4.08Å; N447-N485 WeakPolarHBondContact OD1-CA 3.25Å; N447-N485 WeakPolarHBondContact OD1-CB 3.32Å; N447-N485 PolarHBondContact OD1-OD1 3.01Å; N447-D537 PolarHBondContact ND2-OD2 2.72Å; N447-D537 PolarHBondContact OD1-OD2 3.05Å; N447-G539 VanDerWaalsContact OD1-CA 3.25Å; N447-G539 WeakPolarHBondContact OD1-CA 3.33Å; N447-L543 WeakPolarHBondContact ND2-CG 3.34Å; N447-L543 VanDerWaalsContact O-CD1 3.29Å; N447-L543 WeakPolarHBondContact O-CD1 3.3Å
448	D	93.6	Very high	94.7	Very high	113 Å²	113	56.5 Å²	56.5	60%	0.604	30%	0.3	S	S	*	.			trans	-99.5	-31.5	-171	159.2	-74.8	0	0	0	112.3	E446 D481	E446-D448 PolarHBondContact O-N 2.91Å; D448-D481 PolarHBondContact N-OD2 3.07Å
449	N	94.2	Very high	94.8	Very high	48 Å²	48	57 Å²	57	26%	0.257	29%	0.294	S	S	.	.	S	Bend	trans	-89.1	-174.4	174.2	-62.7	-85.4	0	0	0	111.6	P480 D481 L543	N449-P480 HydrophobicContact CB-CG 3.57Å; N449-P480 VanDerWaalsContact CG-CG 3.47Å; N449-D481 WeakPolarHBondContact CB-OD1 3.43Å; N449-D481 PolarHBondContact N-OD2 3.01Å; N449-D481 VanDerWaalsContact N-OD2 3.15Å; N449-D481 PolarHBondContact ND2-OD1 3.26Å; N449-L543 WeakPolarHBondContact O-CD1 3.21Å
450	H	94.1	Very high	95	Very high	90 Å²	90	57.8 Å²	57.8	42%	0.417	30%	0.298	S	S	.	.			trans	-153.3	154.2	-179.7	62.1	-79.7	0	0	0	111.1	H452 D479 L543	H450-H452 PolarHBondContact O-N 2.98Å; H450-D479 WeakPolarHBondContact CA-OD2 3.29Å; H450-L543 HydrophobicContact CB-CB 3.84Å
451	P	96.5	Very high	95.1	Very high	0 Å²	0	60.5 Å²	60.5	0%	0	31%	0.311	C	S	.	.			trans	-67.3	105.9	-167.5	-27.4	36.6	0	0	0	112.5	A477 R478 D479 V488 A535 D537 S545	P451-A477 HydrophobicContact CB-CB 4.12Å; P451-R478 CarbonylContact C-O 3.58Å; P451-D479 WeakPolarHBondContact CA-OD2 3.14Å; P451-D479 HydrophobicContact CB-CB 4.47Å; P451-D479 WeakPolarHBondContact CD-OD2 3.11Å; P451-D479 HydrophobicContact CG-CB 4.28Å; P451-D479 VanDerWaalsContact CG-OD2 3.29Å; P451-D479 WeakPolarHBondContact CG-OD2 3.4Å; P451-V488 HydrophobicContact CB-CG1 4.01Å; P451-V488 HydrophobicContact CB-CG2 3.88Å; P451-V488 HydrophobicContact CG-CG1 4.49Å; P451-V488 HydrophobicContact CG-CG2 4.16Å; P451-A535 HydrophobicContact CB-CB 3.83Å; P451-D537 HydrophobicContact CG-CB 4.35Å; P451-S545 VanDerWaalsContact O-CB 3.22Å; P451-S545 WeakPolarHBondContact O-CB 3.49Å; P451-S545 PolarHBondContact O-OG 2.97Å
452	H	95.1	Very high	95.2	Very high	130 Å²	130	61.5 Å²	61.5	60%	0.602	32%	0.316	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.7	115	-175.6	-173.2	-75.6	0	0	0	111.4	H450 A477 R478	H450-H452 PolarHBondContact O-N 2.98Å; H452-A477 CarbonylContact O-C 3.43Å; H452-A477 VanDerWaalsContact O-CA 3.25Å; H452-A477 WeakPolarHBondContact O-CA 3.09Å; H452-R478 PolarHBondContact N-O 3.12Å; H452-R478 PolarHBondContact O-N 3.48Å
453	F	96.7	Very high	95.1	Very high	9 Å²	9	64.5 Å²	64.5	4%	0.039	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.4	137.8	175.9	-77.7	-80.8	0	0	0	112.6	K455 Y458 V475 S476 A477 Y490 V533 A535 S545 A547	F453-K455 WeakPolarHBondContact CB-O 3.46Å; F453-K455 PolarHBondContact O-N 3.15Å; F453-K455 VanDerWaalsContact O-N 3.07Å; F453-Y458 HydrophobicContact CD1-CE2 4.12Å; F453-V475 HydrophobicContact CD1-CB 4.36Å; F453-V475 HydrophobicContact CE1-CB 4.07Å; F453-V475 HydrophobicContact CE1-CG2 3.91Å; F453-S476 CarbonylContact C-O 3.54Å; F453-S476 WeakPolarHBondContact CA-O 3.29Å; F453-A477 HydrophobicContact CB-CB 4.47Å; F453-A477 HydrophobicContact CD1-CB 3.87Å; F453-A477 HydrophobicContact CD2-CB 4.43Å; F453-A477 HydrophobicContact CE1-CB 4.22Å; F453-A477 HydrophobicContact CG-CB 4Å; F453-Y490 HydrophobicContact CE1-CD1 4.07Å; F453-Y490 AromaticContact CE1-CE1 3.94Å; F453-Y490 HydrophobicContact CE1-CE1 3.94Å; F453-Y490 HydrophobicContact CZ-CD1 4.34Å; F453-Y490 HydrophobicContact CZ-CE1 4.5Å; F453-V533 HydrophobicContact CE1-CG1 4.41Å; F453-V533 HydrophobicContact CZ-CB 4.33Å; F453-V533 HydrophobicContact CZ-CG1 4.07Å; F453-A535 HydrophobicContact CD2-CB 4.34Å; F453-A535 HydrophobicContact CE1-CB 4.08Å; F453-A535 HydrophobicContact CE2-CB 3.52Å; F453-A535 HydrophobicContact CZ-CB 3.38Å; F453-S545 WeakPolarHBondContact CD2-OG 3.02Å; F453-S545 WeakPolarHBondContact CE2-OG 3.49Å; F453-A547 HydrophobicContact CB-CB 4.03Å; F453-A547 HydrophobicContact CD1-CB 3.92Å; F453-A547 HydrophobicContact CD2-CB 3.61Å; F453-A547 HydrophobicContact CE1-CB 4.23Å; F453-A547 HydrophobicContact CE2-CB 3.96Å; F453-A547 HydrophobicContact CG-CB 3.58Å; F453-A547 HydrophobicContact CZ-CB 4.24Å
454	S	94.8	Very high	94.9	Very high	78 Å²	78	64.6 Å²	64.6	55%	0.545	33%	0.329	S	S	.	.	S	Bend	trans	-59.2	-21.2	176	67.6	0	0	0	0	114	Y458 S476	S454-Y458 PolarHBondContact OG-OH 2.78Å; S454-S476 PolarHBondContact N-O 3.24Å; S454-S476 PolarHBondContact OG-O 3.23Å
455	K	93.4	Very high	94.7	Very high	119 Å²	119	66.4 Å²	66.4	52%	0.517	34%	0.337	S	S	.	.			trans	-143.9	141	170.8	-57.6	177.1	-174.5	172.3	0	109.2	F453 Y457 Y458	F453-K455 WeakPolarHBondContact CB-O 3.46Å; F453-K455 PolarHBondContact O-N 3.15Å; F453-K455 VanDerWaalsContact O-N 3.07Å; K455-Y457 WeakPolarHBondContact CB-O 3.19Å; K455-Y457 PolarHBondContact O-N 3.2Å; K455-Y458 HydrophobicContact CB-CE1 4.18Å; K455-Y458 HydrophobicContact CB-CE2 4.14Å; K455-Y458 HydrophobicContact CD-CD1 4.3Å; K455-Y458 HydrophobicContact CD-CE1 4.22Å; K455-Y458 HydrophobicContact CG-CE1 4.39Å; K455-Y458 WeakPolarHBondContact O-CE2 3.48Å
456	P	93.4	Very high	94.6	Very high	111 Å²	111	65.7 Å²	65.7	72%	0.721	33%	0.333	S	S	*	.	S	Bend	trans	-72.6	-17.9	172	30.9	-35.7	0	0	0	112.6	A547 T548	P456-A547 WeakPolarHBondContact O-CA 3.1Å; P456-T548 PolarHBondContact O-N 2.84Å
457	Y	95.5	Very high	94.6	Very high	90 Å²	90	66.8 Å²	66.8	35%	0.353	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	132.5	-177.2	-170.3	-103.3	0	0	0	110.4	K455 Q459 E530 T548 R550	K455-Y457 WeakPolarHBondContact CB-O 3.19Å; K455-Y457 PolarHBondContact O-N 3.2Å; Y457-Q459 HydrophobicContact CE1-CB 4.07Å; Y457-E530 WeakPolarHBondContact CE2-OE1 2.99Å; Y457-E530 PolarHBondContact OH-OE1 2.93Å; Y457-T548 CarbonylContact C-O 3.52Å; Y457-T548 WeakPolarHBondContact CA-O 3.27Å; Y457-T548 HydrophobicContact CD2-CG2 4.1Å; Y457-T548 HydrophobicContact CE2-CG2 4.01Å; Y457-R550 HydrophobicContact CE2-CB 4.3Å; Y457-R550 VanDerWaalsContact OH-CB 3.26Å; Y457-R550 WeakPolarHBondContact OH-CB 3.3Å; Y457-R550 WeakPolarHBondContact OH-CD 3.41Å
458	Y	96.4	Very high	94.5	Very high	17 Å²	17	70 Å²	70	7%	0.067	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	140.7	172.5	-60.5	-101.1	0	0	0	108.8	F453 S454 K455 L473 V475 S476 A547 T548 V549 R550	F453-Y458 HydrophobicContact CD1-CE2 4.12Å; S454-Y458 PolarHBondContact OG-OH 2.78Å; K455-Y458 HydrophobicContact CB-CE1 4.18Å; K455-Y458 HydrophobicContact CB-CE2 4.14Å; K455-Y458 HydrophobicContact CD-CD1 4.3Å; K455-Y458 HydrophobicContact CD-CE1 4.22Å; K455-Y458 HydrophobicContact CG-CE1 4.39Å; K455-Y458 WeakPolarHBondContact O-CE2 3.48Å; Y458-L473 HydrophobicContact CD1-CD1 4.41Å; Y458-V475 HydrophobicContact CD1-CG1 4Å; Y458-V475 HydrophobicContact CD2-CG1 3.72Å; Y458-V475 HydrophobicContact CE1-CB 4.21Å; Y458-V475 HydrophobicContact CE1-CG1 4.02Å; Y458-V475 HydrophobicContact CE2-CB 4.06Å; Y458-V475 HydrophobicContact CE2-CG1 3.74Å; Y458-V475 HydrophobicContact CG-CG1 3.86Å; Y458-S476 PolarHBondContact OH-N 2.54Å; Y458-S476 PolarHBondContact OH-O 2.78Å; Y458-A547 HydrophobicContact CD2-CB 4.08Å; Y458-A547 HydrophobicContact CE2-CB 3.76Å; Y458-T548 PolarHBondContact N-O 2.91Å; Y458-V549 CarbonylContact O-C 3.59Å; Y458-V549 WeakPolarHBondContact O-CA 3.13Å; Y458-R550 PolarHBondContact O-N 3.4Å
459	Q	96.5	Very high	94.5	Very high	93 Å²	93	67.1 Å²	67.1	44%	0.435	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	132.4	175.2	-169.9	179.6	-85.2	0	0	109.2	Y457 R550 I552	Y457-Q459 HydrophobicContact CE1-CB 4.07Å; Q459-R550 WeakPolarHBondContact CA-O 3.44Å; Q459-R550 HydrophobicContact CG-CB 4.34Å; Q459-I552 VanDerWaalsContact CD-CD1 3.45Å; Q459-I552 HydrophobicContact CG-CD1 4Å; Q459-I552 HydrophobicContact CG-CG1 4.27Å
460	V	96.4	Very high	94.5	Very high	20 Å²	20	66 Å²	66	12%	0.121	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	146.5	167.3	60.9	0	0	0	0	109.2	V462 L472 L473 R550 V551 I552	V460-V462 HydrophobicContact CG1-CG2 4.12Å; V460-V462 HydrophobicContact CG2-CG2 3.79Å; V460-L472 HydrophobicContact CG1-CB 4.38Å; V460-L472 HydrophobicContact CG2-CB 4.48Å; V460-L472 WeakPolarHBondContact CG2-O 3.25Å; V460-L473 HydrophobicContact CB-CB 4.45Å; V460-L473 HydrophobicContact CB-CD2 3.82Å; V460-L473 HydrophobicContact CG1-CD2 3.99Å; V460-R550 PolarHBondContact N-O 3.31Å; V460-V551 HydrophobicContact CG1-CB 4.25Å; V460-V551 HydrophobicContact CG1-CG1 4.25Å; V460-V551 HydrophobicContact CG1-CG2 3.85Å; V460-I552 PolarHBondContact O-N 2.76Å
461	I	96.2	Very high	94.6	Very high	100 Å²	100	67.8 Å²	67.8	51%	0.513	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	122.2	174.7	-57.5	177.9	0	0	0	105.9	I552 L554	I461-I552 WeakPolarHBondContact CA-O 3.41Å; I461-I552 HydrophobicContact CG1-CB 4.38Å; I461-L554 HydrophobicContact CG2-CD1 3.49Å; I461-L554 VanDerWaalsContact CG2-CD1 3.49Å; I461-L554 HydrophobicContact CG2-CD2 3.72Å; I461-L554 HydrophobicContact CG2-CG 3.42Å; I461-L554 VanDerWaalsContact CG2-CG 3.42Å
462	V	95.5	Very high	94.6	Very high	20 Å²	20	68.5 Å²	68.5	12%	0.121	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	139.3	-173.6	-163.5	0	0	0	0	106.9	V460 N466 L472 F521 V551 I552 I553 L554	V460-V462 HydrophobicContact CG1-CG2 4.12Å; V460-V462 HydrophobicContact CG2-CG2 3.79Å; V462-N466 HydrophobicContact CG1-CB 4.17Å; V462-L472 HydrophobicContact CG1-CD2 4.14Å; V462-L472 HydrophobicContact CG2-CD2 3.71Å; V462-F521 HydrophobicContact CG1-CD2 4.47Å; V462-V551 HydrophobicContact CG2-CG1 3.89Å; V462-I552 PolarHBondContact N-O 3.3Å; V462-I553 CarbonylContact O-C 3.51Å; V462-I553 WeakPolarHBondContact O-CA 3.32Å; V462-L554 PolarHBondContact O-N 2.66Å
463	Q	92.4	Very high	94.6	Very high	128 Å²	128	63.3 Å²	63.3	60%	0.598	35%	0.346	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.1	148.6	167.7	-61.1	-175.4	-89.4	0	0	109.3	V556	Q463-V556 HydrophobicContact CB-CG2 4.08Å
464	E	92.3	Very high	94.6	Very high	6 Å²	6	65.2 Å²	65.2	3%	0.028	36%	0.36	C	S	.	.	S	Bend	trans	-66.5	176.9	166.8	77.5	-172.8	114	0	0	112.5	N466 N522 H523 I553 L554 D555 V556	E464-N466 PolarHBondContact O-N 3.31Å; E464-N466 VanDerWaalsContact O-N 3.11Å; E464-N522 WeakPolarHBondContact OE2-CA 3.49Å; E464-N522 PolarHBondContact OE2-ND2 2.81Å; E464-H523 VanDerWaalsContact OE1-CB 3.23Å; E464-H523 WeakPolarHBondContact OE1-CB 3.12Å; E464-H523 PolarHBondContact OE2-N 3.28Å; E464-I553 HydrophobicContact CB-CG2 3.71Å; E464-L554 PolarHBondContact N-O 3.31Å; E464-D555 VanDerWaalsContact OE1-CA 3.23Å; E464-D555 WeakPolarHBondContact OE1-CA 3.48Å; E464-V556 HydrophobicContact CG-CB 3.89Å; E464-V556 HydrophobicContact CG-CG2 4.03Å; E464-V556 PolarHBondContact OE1-N 3.35Å
465	N	91.3	Very high	94.7	Very high	88 Å²	88	61.5 Å²	61.5	47%	0.471	33%	0.334	S	S	.	.	S	Bend	trans	56.1	25.5	-171.7	-71.8	-51.7	0	0	0	113.2	S520 F521 D558	N465-S520 WeakPolarHBondContact CA-OG 3.33Å; N465-F521 PolarHBondContact N-O 3.09Å; N465-D558 PolarHBondContact ND2-OD2 3.42Å
466	N	92.8	Very high	94.8	Very high	19 Å²	19	58.2 Å²	58.2	10%	0.102	33%	0.326	C	S	.	.	P	Polyproline II helix	trans	-65.5	150.4	177.2	70.4	-87.8	0	0	0	111.6	V462 E464 R519 S520 F521	V462-N466 HydrophobicContact CG1-CB 4.17Å; E464-N466 PolarHBondContact O-N 3.31Å; E464-N466 VanDerWaalsContact O-N 3.11Å; N466-R519 PolarHBondContact ND2-O 2.93Å; N466-S520 VanDerWaalsContact O-CA 3.32Å; N466-S520 WeakPolarHBondContact O-CA 3.39Å; N466-S520 WeakPolarHBondContact O-CB 3.05Å; N466-S520 PolarHBondContact O-OG 2.77Å; N466-F521 WeakPolarHBondContact OD1-CB 3.4Å; N466-F521 WeakPolarHBondContact OD1-CD2 3.47Å; N466-F521 WeakPolarHBondContact OD1-CG 3.29Å; N466-F521 PolarHBondContact OD1-N 2.73Å
467	T	93.8	Very high	94.9	Very high	102 Å²	102	53.3 Å²	53.3	63%	0.626	30%	0.295	S	S	*	.	P	Polyproline II helix	trans	-65.2	134	173.8	47.6	0	0	0	0	111.1	G469 A470	T467-G469 PolarHBondContact O-N 3.06Å; T467-A470 WeakPolarHBondContact O-CB 3.45Å; T467-A470 PolarHBondContact O-N 3.03Å; T467-A470 VanDerWaalsContact O-N 3.13Å
468	P	94	Very high	94.9	Very high	89 Å²	89	58.6 Å²	58.6	58%	0.578	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	135.8	162.5	-21.9	32.9	0	0	0	109.9
469	G	92.6	Very high	94.9	Very high	52 Å²	52	58.7 Å²	58.7	54%	0.536	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	89	-2.3	-171	0	0	0	0	0	114.8	T467 Y471 A517	T467-G469 PolarHBondContact O-N 3.06Å; G469-Y471 PolarHBondContact O-N 3.19Å; G469-A517 WeakPolarHBondContact CA-O 3.12Å; G469-A517 PolarHBondContact N-O 2.82Å
470	A	94.4	Very high	94.9	Very high	24 Å²	24	57.4 Å²	57.4	20%	0.198	32%	0.316	C	S	.	.			trans	-61.5	133.5	177.1	0	0	0	0	0	112.3	T467 Y516 A517	T467-A470 WeakPolarHBondContact O-CB 3.45Å; T467-A470 PolarHBondContact O-N 3.03Å; T467-A470 VanDerWaalsContact O-N 3.13Å; A470-Y516 CarbonylContact O-C 3.5Å; A470-Y516 VanDerWaalsContact O-CA 3.29Å; A470-Y516 WeakPolarHBondContact O-CA 3.4Å; A470-A517 PolarHBondContact O-N 3.2Å
471	Y	96.2	Very high	94.9	Very high	128 Å²	128	57 Å²	57	50%	0.502	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	138.8	168.8	169.1	-92.8	0	0	0	110.6	G469 S474 D514 Y516	G469-Y471 PolarHBondContact O-N 3.19Å; Y471-S474 WeakPolarHBondContact OH-CB 3.22Å; Y471-S474 PolarHBondContact OH-N 3.43Å; Y471-S474 VanDerWaalsContact OH-N 3.12Å; Y471-D514 HydrophobicContact CD2-CB 4.32Å; Y471-D514 HydrophobicContact CE2-CB 4.04Å; Y471-Y516 HydrophobicContact CD2-CE1 4.09Å
472	L	96	Very high	94.8	Very high	16 Å²	16	57.3 Å²	57.3	8%	0.084	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	-65.5	-178.1	-62	-174.2	0	0	0	112	V460 V462 V506 I515 A517 F521 V551	V460-L472 HydrophobicContact CG1-CB 4.38Å; V460-L472 HydrophobicContact CG2-CB 4.48Å; V460-L472 WeakPolarHBondContact CG2-O 3.25Å; V462-L472 HydrophobicContact CG1-CD2 4.14Å; V462-L472 HydrophobicContact CG2-CD2 3.71Å; L472-V506 HydrophobicContact CD1-CG1 3.7Å; L472-I515 WeakPolarHBondContact CB-O 3.46Å; L472-I515 HydrophobicContact CD1-CG2 4.23Å; L472-I515 PolarHBondContact N-O 3.37Å; L472-A517 HydrophobicContact CD1-CB 4.2Å; L472-A517 HydrophobicContact CD2-CB 4.08Å; L472-A517 HydrophobicContact CG-CB 4.24Å; L472-F521 HydrophobicContact CD1-CE2 4.44Å; L472-F521 HydrophobicContact CD1-CZ 4.47Å; L472-F521 HydrophobicContact CD2-CE2 4.47Å; L472-V551 HydrophobicContact CD1-CG2 4.38Å
473	L	96.6	Very high	94.7	Very high	21 Å²	21	59.3 Å²	59.3	11%	0.11	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158	166.6	179.2	71.2	80.6	0	0	0	109.5	Y458 V460 V475 I515 V549	Y458-L473 HydrophobicContact CD1-CD1 4.41Å; V460-L473 HydrophobicContact CB-CB 4.45Å; V460-L473 HydrophobicContact CB-CD2 3.82Å; V460-L473 HydrophobicContact CG1-CD2 3.99Å; L473-V475 HydrophobicContact CD1-CG1 3.49Å; L473-V475 VanDerWaalsContact CD1-CG1 3.49Å; L473-I515 HydrophobicContact CD1-CD1 3.77Å; L473-I515 HydrophobicContact CD1-CG1 4.28Å; L473-I515 HydrophobicContact CG-CD1 4.28Å; L473-I515 WeakPolarHBondContact O-CB 3.05Å; L473-I515 PolarHBondContact O-N 3.42Å; L473-V549 HydrophobicContact CD2-CG1 3.87Å
474	S	96.3	Very high	94.7	Very high	48 Å²	48	59 Å²	59	34%	0.336	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	134.6	169.3	-161.7	0	0	0	0	109.9	Y471 S512 D514	Y471-S474 WeakPolarHBondContact OH-CB 3.22Å; Y471-S474 PolarHBondContact OH-N 3.43Å; Y471-S474 VanDerWaalsContact OH-N 3.12Å; S474-S512 PolarHBondContact OG-O 3.04Å; S474-D514 WeakPolarHBondContact CB-OD1 3.44Å; S474-D514 PolarHBondContact OG-OD1 2.71Å
475	V	96.8	Very high	94.8	Very high	1 Å²	1	60.1 Å²	60.1	1%	0.006	35%	0.347	C	S	.	.			trans	-100.5	144.5	169.5	-61.1	0	0	0	0	109.9	F453 Y458 L473 Y490 I508 G513 I515 V533 V549	F453-V475 HydrophobicContact CD1-CB 4.36Å; F453-V475 HydrophobicContact CE1-CB 4.07Å; F453-V475 HydrophobicContact CE1-CG2 3.91Å; Y458-V475 HydrophobicContact CD1-CG1 4Å; Y458-V475 HydrophobicContact CD2-CG1 3.72Å; Y458-V475 HydrophobicContact CE1-CB 4.21Å; Y458-V475 HydrophobicContact CE1-CG1 4.02Å; Y458-V475 HydrophobicContact CE2-CB 4.06Å; Y458-V475 HydrophobicContact CE2-CG1 3.74Å; Y458-V475 HydrophobicContact CG-CG1 3.86Å; L473-V475 HydrophobicContact CD1-CG1 3.49Å; L473-V475 VanDerWaalsContact CD1-CG1 3.49Å; V475-Y490 HydrophobicContact CG2-CD1 4.03Å; V475-Y490 HydrophobicContact CG2-CE1 4.26Å; V475-I508 HydrophobicContact CG2-CD1 3.93Å; V475-G513 WeakPolarHBondContact CG2-O 3.17Å; V475-G513 PolarHBondContact N-O 3.09Å; V475-I515 HydrophobicContact CG1-CD1 4.06Å; V475-V533 HydrophobicContact CG2-CG1 4.05Å; V475-V549 HydrophobicContact CG1-CG2 4.08Å
476	S	95.7	Very high	94.9	Very high	50 Å²	50	56.9 Å²	56.9	35%	0.35	34%	0.335	S	S	.	.			trans	-130.7	130.8	174.8	173.9	0	0	0	0	109.8	F453 S454 Y458	F453-S476 CarbonylContact C-O 3.54Å; F453-S476 WeakPolarHBondContact CA-O 3.29Å; S454-S476 PolarHBondContact N-O 3.24Å; S454-S476 PolarHBondContact OG-O 3.23Å; Y458-S476 PolarHBondContact OH-N 2.54Å; Y458-S476 PolarHBondContact OH-O 2.78Å
477	A	96.1	Very high	95	Very high	7 Å²	7	58.7 Å²	58.7	6%	0.058	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	160.8	161.1	0	0	0	0	0	109.8	P451 H452 F453 V488 Y490 A535	P451-A477 HydrophobicContact CB-CB 4.12Å; H452-A477 CarbonylContact O-C 3.43Å; H452-A477 VanDerWaalsContact O-CA 3.25Å; H452-A477 WeakPolarHBondContact O-CA 3.09Å; F453-A477 HydrophobicContact CB-CB 4.47Å; F453-A477 HydrophobicContact CD1-CB 3.87Å; F453-A477 HydrophobicContact CD2-CB 4.43Å; F453-A477 HydrophobicContact CE1-CB 4.22Å; F453-A477 HydrophobicContact CG-CB 4Å; A477-V488 HydrophobicContact CB-CG1 4.15Å; A477-Y490 HydrophobicContact CB-CE1 4.05Å; A477-Y490 PolarHBondContact N-OH 3.17Å; A477-Y490 PolarHBondContact O-OH 2.56Å; A477-A535 HydrophobicContact CB-CB 3.75Å
478	R	95.1	Very high	95.1	Very high	201 Å²	201	55.2 Å²	55.2	76%	0.758	33%	0.328	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-133.1	141.1	174.8	-68.3	-176.2	174.6	-138.3	-3.7	109.1	P451 H452	P451-R478 CarbonylContact C-O 3.58Å; H452-R478 PolarHBondContact N-O 3.12Å; H452-R478 PolarHBondContact O-N 3.48Å
479	D	96.8	Very high	95.3	Very high	19 Å²	19	52.4 Å²	52.4	10%	0.102	31%	0.31	C	S	.	.			trans	-120.7	133.9	172	-157.3	-58.8	0	0	0	106.9	H450 P451 D481 V488	H450-D479 WeakPolarHBondContact CA-OD2 3.29Å; P451-D479 WeakPolarHBondContact CA-OD2 3.14Å; P451-D479 HydrophobicContact CB-CB 4.47Å; P451-D479 WeakPolarHBondContact CD-OD2 3.11Å; P451-D479 HydrophobicContact CG-CB 4.28Å; P451-D479 VanDerWaalsContact CG-OD2 3.29Å; P451-D479 WeakPolarHBondContact CG-OD2 3.4Å; D479-D481 WeakPolarHBondContact OD1-CB 3.5Å; D479-D481 PolarHBondContact OD1-N 3.41Å; D479-V488 HydrophobicContact CB-CG2 3.81Å
480	P	95.4	Very high	95.5	Very high	67 Å²	67	50.9 Å²	50.9	44%	0.435	29%	0.288	S	S	.	.			trans	-84.9	-13.6	-177.6	37.2	-39.2	0	0	0	113.8	R413 E414 N449	R413-P480 PolarHBondContact NH2-O 3.47Å; E414-P480 HydrophobicContact CG-CB 3.7Å; E414-P480 HydrophobicContact CG-CG 3.91Å; N449-P480 HydrophobicContact CB-CG 3.57Å; N449-P480 VanDerWaalsContact CG-CG 3.47Å
481	D	96.7	Very high	95.6	Very high	10 Å²	10	54.3 Å²	54.3	5%	0.053	30%	0.3	C	S	.	.	S	Bend	trans	-67	168.9	-177.5	-61.6	1.7	0	0	0	111.4	N447 D448 N449 D479 N485 G486	N447-D481 WeakPolarHBondContact CA-OD2 3.3Å; D448-D481 PolarHBondContact N-OD2 3.07Å; N449-D481 WeakPolarHBondContact CB-OD1 3.43Å; N449-D481 PolarHBondContact N-OD2 3.01Å; N449-D481 VanDerWaalsContact N-OD2 3.15Å; N449-D481 PolarHBondContact ND2-OD1 3.26Å; D479-D481 WeakPolarHBondContact OD1-CB 3.5Å; D479-D481 PolarHBondContact OD1-N 3.41Å; D481-N485 HydrophobicContact CB-CB 3.57Å; D481-G486 WeakPolarHBondContact O-CA 3.49Å; D481-G486 PolarHBondContact O-N 2.93Å
482	L	94.4	Very high	95.6	Very high	107 Å²	107	49.3 Å²	49.3	56%	0.56	28%	0.282	S	S	*	.			trans	-96.8	149.1	-170.7	-164.2	61.7	0	0	0	113.4	D445 L484 N485 G486	D445-L482 HydrophobicContact CB-CB 3.86Å; D445-L482 VanDerWaalsContact CG-CB 3.42Å; D445-L482 VanDerWaalsContact CG-N 3.3Å; D445-L482 WeakPolarHBondContact OD1-CB 3.07Å; D445-L482 PolarHBondContact OD1-N 2.81Å; D445-L482 PolarHBondContact OD2-N 3.36Å; L482-L484 PolarHBondContact O-N 2.92Å; L482-L484 VanDerWaalsContact O-N 3.09Å; L482-N485 WeakPolarHBondContact O-CB 3.42Å; L482-N485 PolarHBondContact O-N 2.57Å; L482-G486 PolarHBondContact O-N 3.18Å
483	G	93.2	Very high	95.6	Very high	62 Å²	62	50.8 Å²	50.8	64%	0.639	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.6	-112.4	167.8	0	0	0	0	0	113.8	S487	G483-S487 WeakPolarHBondContact O-CB 3.44Å
484	L	93.3	Very high	95.5	Very high	121 Å²	121	54.8 Å²	54.8	63%	0.634	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.8	-26.7	178.3	-69.2	179	0	0	0	112.9	L482 S487 G538	L482-L484 PolarHBondContact O-N 2.92Å; L482-L484 VanDerWaalsContact O-N 3.09Å; L484-S487 WeakPolarHBondContact O-CB 3.33Å; L484-S487 PolarHBondContact O-N 3.38Å; L484-G538 CarbonylContact O-C 3.54Å; L484-G538 WeakPolarHBondContact O-CA 3.12Å; L484-G538 PolarHBondContact O-N 2.81Å
485	N	94.1	Very high	95.3	Very high	30 Å²	30	54.5 Å²	54.5	16%	0.16	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-47.3	177.3	-60.9	-12.5	0	0	0	108.7	D445 N447 D481 L482 S487 D537	D445-N485 WeakPolarHBondContact OD2-CB 3.49Å; D445-N485 PolarHBondContact OD2-ND2 3.12Å; N447-N485 HydrophobicContact CB-CB 4.08Å; N447-N485 WeakPolarHBondContact OD1-CA 3.25Å; N447-N485 WeakPolarHBondContact OD1-CB 3.32Å; N447-N485 PolarHBondContact OD1-OD1 3.01Å; D481-N485 HydrophobicContact CB-CB 3.57Å; L482-N485 WeakPolarHBondContact O-CB 3.42Å; L482-N485 PolarHBondContact O-N 2.57Å; N485-S487 PolarHBondContact O-N 2.77Å; N485-D537 WeakPolarHBondContact O-CB 3.4Å
486	G	93.6	Very high	95	Very high	20 Å²	20	60.8 Å²	60.8	21%	0.206	35%	0.346	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-6.3	169.6	0	0	0	0	0	116.8	D481 L482 V488	D481-G486 WeakPolarHBondContact O-CA 3.49Å; D481-G486 PolarHBondContact O-N 2.93Å; L482-G486 PolarHBondContact O-N 3.18Å; G486-V488 PolarHBondContact O-N 3.34Å
487	S	94.9	Very high	94.7	Very high	57 Å²	57	59 Å²	59	40%	0.399	33%	0.333	S	S	.	.			trans	-86.2	79.2	-166.9	178	0	0	0	0	113.4	G483 L484 N485 S489 D537 G538	G483-S487 WeakPolarHBondContact O-CB 3.44Å; L484-S487 WeakPolarHBondContact O-CB 3.33Å; L484-S487 PolarHBondContact O-N 3.38Å; N485-S487 PolarHBondContact O-N 2.77Å; S487-S489 PolarHBondContact O-N 2.9Å; S487-D537 CarbonylContact O-C 3.53Å; S487-G538 PolarHBondContact O-N 2.72Å
488	V	95.9	Very high	94.1	Very high	29 Å²	29	65.6 Å²	65.6	18%	0.176	36%	0.357	C	S	.	.			trans	-59.6	131.1	179.3	-172.5	0	0	0	0	113.6	P451 A477 D479 G486 Y490 A535 K536	P451-V488 HydrophobicContact CB-CG1 4.01Å; P451-V488 HydrophobicContact CB-CG2 3.88Å; P451-V488 HydrophobicContact CG-CG1 4.49Å; P451-V488 HydrophobicContact CG-CG2 4.16Å; A477-V488 HydrophobicContact CB-CG1 4.15Å; D479-V488 HydrophobicContact CB-CG2 3.81Å; G486-V488 PolarHBondContact O-N 3.34Å; V488-Y490 HydrophobicContact CG1-CE1 3.92Å; V488-Y490 HydrophobicContact CG1-CE2 4.16Å; V488-A535 HydrophobicContact CG1-CB 3.99Å; V488-K536 CarbonylContact C-O 3.54Å; V488-K536 WeakPolarHBondContact CA-O 3.22Å
489	S	96.4	Very high	93.6	Very high	31 Å²	31	62.7 Å²	62.7	22%	0.217	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	145.9	168.1	63.7	0	0	0	0	112	S487 P510 A535 K536	S487-S489 PolarHBondContact O-N 2.9Å; S489-P510 CarbonylContact C-O 3.58Å; S489-P510 WeakPolarHBondContact CA-O 3.36Å; S489-A535 WeakPolarHBondContact O-CA 3.34Å; S489-K536 PolarHBondContact N-O 2.99Å; S489-K536 PolarHBondContact O-N 2.85Å; S489-K536 WeakPolarHBondContact OG-CE 3.32Å; S489-K536 WeakPolarHBondContact OG-CG 3.49Å; S489-K536 PolarHBondContact OG-O 2.88Å
490	Y	97.3	Very high	93.3	Very high	19 Å²	19	66.1 Å²	66.1	8%	0.075	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	143.1	-172.3	-55.1	-83.4	0	0	0	113.5	F453 V475 A477 V488 I508 P510 V533 L534 A535	F453-Y490 HydrophobicContact CE1-CD1 4.07Å; F453-Y490 AromaticContact CE1-CE1 3.94Å; F453-Y490 HydrophobicContact CE1-CE1 3.94Å; F453-Y490 HydrophobicContact CZ-CD1 4.34Å; F453-Y490 HydrophobicContact CZ-CE1 4.5Å; V475-Y490 HydrophobicContact CG2-CD1 4.03Å; V475-Y490 HydrophobicContact CG2-CE1 4.26Å; A477-Y490 HydrophobicContact CB-CE1 4.05Å; A477-Y490 PolarHBondContact N-OH 3.17Å; A477-Y490 PolarHBondContact O-OH 2.56Å; V488-Y490 HydrophobicContact CG1-CE1 3.92Å; V488-Y490 HydrophobicContact CG1-CE2 4.16Å; Y490-I508 HydrophobicContact CG-CD1 4.49Å; Y490-P510 WeakPolarHBondContact CD2-O 3.15Å; Y490-P510 PolarHBondContact N-O 3.02Å; Y490-P510 WeakPolarHBondContact O-CA 3.21Å; Y490-V533 HydrophobicContact CD1-CG1 4.49Å; Y490-L534 WeakPolarHBondContact CA-O 3.33Å; Y490-A535 HydrophobicContact CD1-CB 4.04Å; Y490-A535 HydrophobicContact CE1-CB 4.07Å
491	Q	96.6	Very high	93.2	Very high	96 Å²	96	64.7 Å²	64.7	45%	0.449	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	140.3	177.1	-176.6	175.5	-5.8	0	0	111.7	L534	Q491-L534 HydrophobicContact CB-CB 4.43Å; Q491-L534 PolarHBondContact N-O 2.78Å; Q491-L534 WeakPolarHBondContact O-CB 3.41Å; Q491-L534 PolarHBondContact O-N 3.37Å
492	I	96.6	Very high	93	Very high	23 Å²	23	64.2 Å²	64.2	12%	0.118	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	128.1	170	-70.2	158.5	0	0	0	109.5	V502 V506 I508 F531	I492-V502 HydrophobicContact CG2-CB 4.43Å; I492-V502 HydrophobicContact CG2-CG1 3.71Å; I492-V506 HydrophobicContact CD1-CG2 4.05Å; I492-I508 HydrophobicContact CD1-CB 4.01Å; I492-I508 HydrophobicContact CD1-CG2 3.97Å; I492-I508 HydrophobicContact CG1-CB 4.1Å; I492-I508 HydrophobicContact CG1-CG2 3.79Å; I492-F531 HydrophobicContact CG1-CD2 4.34Å; I492-F531 HydrophobicContact CG1-CE2 4.19Å; I492-F531 HydrophobicContact CG2-CD2 4.24Å
493	V	95.6	Very high	93	Very high	47 Å²	47	65.4 Å²	65.4	29%	0.285	36%	0.362	S	S	.	.	P	Polyproline II helix	trans	-71	126.7	176.8	-179.9	0	0	0	0	109.6	S495 K532 L534	V493-S495 PolarHBondContact O-N 2.84Å; V493-S495 VanDerWaalsContact O-N 3.12Å; V493-S495 PolarHBondContact O-OG 2.8Å; V493-K532 HydrophobicContact CB-CB 3.98Å; V493-K532 WeakPolarHBondContact CB-O 3.38Å; V493-K532 HydrophobicContact CG2-CB 3.84Å; V493-K532 PolarHBondContact N-O 2.7Å; V493-L534 HydrophobicContact CG2-CB 3.96Å
494	P	93.9	Very high	93	Very high	106 Å²	106	64.2 Å²	64.2	69%	0.688	34%	0.342	S	S	*	.	P	Polyproline II helix	trans	-52.5	118.6	177.7	-29.1	36.6	0	0	0	112.7
495	S	92.9	Very high	93	Very high	41 Å²	41	59.3 Å²	59.3	29%	0.287	32%	0.315	S	S	.	.			trans	-158.4	167.1	-174.2	42.6	0	0	0	0	109.5	V493 P501 V502	V493-S495 PolarHBondContact O-N 2.84Å; V493-S495 VanDerWaalsContact O-N 3.12Å; V493-S495 PolarHBondContact O-OG 2.8Å; S495-P501 WeakPolarHBondContact O-CA 3.49Å; S495-V502 PolarHBondContact O-N 2.93Å; S495-V502 WeakPolarHBondContact OG-CG2 3.38Å
496	Q	91.1	Very high	93.1	Very high	134 Å²	134	57.9 Å²	57.9	63%	0.626	31%	0.308	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-124	146.4	-174.8	-70.9	172.1	-73.9	0	0	112.4	D499 M500	Q496-D499 PolarHBondContact NE2-O 3.18Å; Q496-M500 CarbonylContact C-O 3.55Å; Q496-M500 VanDerWaalsContact CA-O 3.3Å; Q496-M500 WeakPolarHBondContact CA-O 3.38Å
497	V	89.4	Confident	93.2	Very high	13 Å²	13	58.8 Å²	58.8	8%	0.079	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	114.1	172.7	174.8	0	0	0	0	107.4	D499 M500 V502 Y505 T526 F529	V497-D499 PolarHBondContact O-N 3.01Å; V497-M500 PolarHBondContact N-O 2.83Å; V497-M500 PolarHBondContact O-N 3.33Å; V497-V502 HydrophobicContact CG2-CG2 3.7Å; V497-Y505 HydrophobicContact CB-CD2 4.25Å; V497-Y505 HydrophobicContact CB-CE2 3.77Å; V497-Y505 HydrophobicContact CG1-CE1 4.09Å; V497-Y505 HydrophobicContact CG1-CE2 4.1Å; V497-Y505 WeakPolarHBondContact O-CE2 3.38Å; V497-Y505 PolarHBondContact O-OH 2.97Å; V497-T526 HydrophobicContact CG1-CG2 4.47Å; V497-F529 HydrophobicContact CB-CB 4.44Å; V497-F529 HydrophobicContact CG1-CB 3.73Å; V497-F529 HydrophobicContact CG1-CG 4.15Å; V497-F529 HydrophobicContact CG2-CB 3.75Å; V497-F529 HydrophobicContact CG2-CD2 3.92Å; V497-F529 HydrophobicContact CG2-CG 4.07Å
498	R	84.1	Confident	93.4	Very high	144 Å²	144	57.4 Å²	57.4	54%	0.543	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	46.8	59.2	-171.4	-60.9	-167.6	179.3	-153.5	5.7	111.7	M500 E524 Q525 T526	R498-M500 PolarHBondContact O-N 2.88Å; R498-E524 PolarHBondContact NH2-O 2.99Å; R498-Q525 VanDerWaalsContact CD-O 3.31Å; R498-Q525 WeakPolarHBondContact CD-O 3.33Å; R498-Q525 PolarHBondContact NE-O 2.82Å; R498-Q525 PolarHBondContact NH1-O 2.91Å; R498-Q525 PolarHBondContact NH2-O 2.84Å; R498-T526 WeakPolarHBondContact CD-OG1 3.21Å; R498-T526 PolarHBondContact NE-OG1 3.31Å
499	D	84.5	Confident	93.4	Very high	140 Å²	140	58.7 Å²	58.7	75%	0.749	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.6	-13.4	-178.3	-54.9	-53.9	0	0	0	116.9	Q496 V497	Q496-D499 PolarHBondContact NE2-O 3.18Å; V497-D499 PolarHBondContact O-N 3.01Å
500	M	88.5	Confident	93.4	Very high	92 Å²	92	60.3 Å²	60.3	45%	0.453	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	142.5	174.7	-73.5	-64.1	-71.2	0	0	111.8	Q496 V497 R498 Y505	Q496-M500 CarbonylContact C-O 3.55Å; Q496-M500 VanDerWaalsContact CA-O 3.3Å; Q496-M500 WeakPolarHBondContact CA-O 3.38Å; V497-M500 PolarHBondContact N-O 2.83Å; V497-M500 PolarHBondContact O-N 3.33Å; R498-M500 PolarHBondContact O-N 2.88Å; M500-Y505 HydrophobicContact CB-CE2 3.85Å
501	P	93.4	Very high	93.2	Very high	37 Å²	37	65.8 Å²	65.8	24%	0.24	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	142.8	-179.4	-19.9	32.2	0	0	0	113.4	S495 F503 T504	S495-P501 WeakPolarHBondContact O-CA 3.49Å; P501-F503 HydrophobicContact CB-CD1 3.66Å; P501-F503 HydrophobicContact CB-CD2 4.24Å; P501-F503 HydrophobicContact CB-CE1 3.29Å; P501-F503 HydrophobicContact CB-CE2 3.9Å; P501-F503 HydrophobicContact CB-CG 4.13Å; P501-F503 HydrophobicContact CB-CZ 3.42Å; P501-F503 VanDerWaalsContact CB-CZ 3.42Å; P501-F503 HydrophobicContact CG-CE1 3.99Å; P501-F503 HydrophobicContact CG-CE2 4.23Å; P501-F503 HydrophobicContact CG-CZ 3.68Å; P501-F503 PolarHBondContact O-N 3.06Å; P501-T504 HydrophobicContact CB-CG2 4.36Å; P501-T504 HydrophobicContact CG-CG2 4.5Å; P501-T504 WeakPolarHBondContact O-CB 3.47Å; P501-T504 PolarHBondContact O-N 3.47Å; P501-T504 PolarHBondContact O-OG1 3.42Å
502	V	94.4	Very high	93.2	Very high	0 Å²	0	63.3 Å²	63.3	0%	0	34%	0.338	C	S	.	.	G	3₁₀ helix	trans	-55.2	-36.6	179.3	166.7	0	0	0	0	112.8	I492 S495 V497 T504 Y505 V506 F531	I492-V502 HydrophobicContact CG2-CB 4.43Å; I492-V502 HydrophobicContact CG2-CG1 3.71Å; S495-V502 PolarHBondContact O-N 2.93Å; S495-V502 WeakPolarHBondContact OG-CG2 3.38Å; V497-V502 HydrophobicContact CG2-CG2 3.7Å; V502-T504 PolarHBondContact O-N 3.46Å; V502-Y505 PolarHBondContact O-N 2.97Å; V502-V506 HydrophobicContact CG1-CG2 3.56Å; V502-V506 PolarHBondContact O-N 2.88Å; V502-F531 HydrophobicContact CB-CB 4.38Å; V502-F531 HydrophobicContact CG1-CB 3.59Å; V502-F531 HydrophobicContact CG1-CD1 4.14Å; V502-F531 HydrophobicContact CG1-CD2 4.15Å; V502-F531 HydrophobicContact CG1-CG 3.72Å; V502-F531 HydrophobicContact CG2-CB 3.94Å
503	F	93	Very high	93.1	Very high	131 Å²	131	62.2 Å²	62.2	58%	0.575	33%	0.333	S	S	*	.	G	3₁₀ helix	trans	-64.8	-2.8	176.8	63.4	-108.8	0	0	0	114.2	P501 V506 L518	P501-F503 HydrophobicContact CB-CD1 3.66Å; P501-F503 HydrophobicContact CB-CD2 4.24Å; P501-F503 HydrophobicContact CB-CE1 3.29Å; P501-F503 HydrophobicContact CB-CE2 3.9Å; P501-F503 HydrophobicContact CB-CG 4.13Å; P501-F503 HydrophobicContact CB-CZ 3.42Å; P501-F503 VanDerWaalsContact CB-CZ 3.42Å; P501-F503 HydrophobicContact CG-CE1 3.99Å; P501-F503 HydrophobicContact CG-CE2 4.23Å; P501-F503 HydrophobicContact CG-CZ 3.68Å; P501-F503 PolarHBondContact O-N 3.06Å; F503-V506 WeakPolarHBondContact CA-O 3.22Å; F503-L518 WeakPolarHBondContact O-CD1 3.42Å
504	T	92.9	Very high	93.2	Very high	37 Å²	37	61.7 Å²	61.7	23%	0.227	33%	0.328	C	S	.	.	G	3₁₀ helix	trans	-98.5	-9.8	170.5	72.7	0	0	0	0	112.9	P501 V502 R519	P501-T504 HydrophobicContact CB-CG2 4.36Å; P501-T504 HydrophobicContact CG-CG2 4.5Å; P501-T504 WeakPolarHBondContact O-CB 3.47Å; P501-T504 PolarHBondContact O-N 3.47Å; P501-T504 PolarHBondContact O-OG1 3.42Å; V502-T504 PolarHBondContact O-N 3.46Å; T504-R519 VanDerWaalsContact CB-NH2 3.33Å; T504-R519 VanDerWaalsContact O-CZ 3.25Å; T504-R519 PolarHBondContact O-NE 2.99Å; T504-R519 PolarHBondContact O-NH2 3.13Å; T504-R519 PolarHBondContact OG1-NH2 3.49Å
505	Y	93.9	Very high	93.4	Very high	19 Å²	19	56.7 Å²	56.7	8%	0.075	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.1	-39.1	173.5	-71.1	-102.4	0	0	0	111.7	V497 M500 V502 L518 R519 F521 F529	V497-Y505 HydrophobicContact CB-CD2 4.25Å; V497-Y505 HydrophobicContact CB-CE2 3.77Å; V497-Y505 HydrophobicContact CG1-CE1 4.09Å; V497-Y505 HydrophobicContact CG1-CE2 4.1Å; V497-Y505 WeakPolarHBondContact O-CE2 3.38Å; V497-Y505 PolarHBondContact O-OH 2.97Å; M500-Y505 HydrophobicContact CB-CE2 3.85Å; V502-Y505 PolarHBondContact O-N 2.97Å; Y505-L518 PolarHBondContact O-N 2.93Å; Y505-R519 HydrophobicContact CD1-CG 4.46Å; Y505-F521 HydrophobicContact CD1-CD1 4.28Å; Y505-F521 HydrophobicContact CD1-CE1 4.06Å; Y505-F529 HydrophobicContact CD1-CE1 4.37Å; Y505-F529 HydrophobicContact CD1-CZ 4.47Å
506	V	96.2	Very high	93.6	Very high	0 Å²	0	58.3 Å²	58.3	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	151	-173.8	-71.4	0	0	0	0	112.5	L472 I492 V502 F503 I515 Y516 F521 F529 F531	L472-V506 HydrophobicContact CD1-CG1 3.7Å; I492-V506 HydrophobicContact CD1-CG2 4.05Å; V502-V506 HydrophobicContact CG1-CG2 3.56Å; V502-V506 PolarHBondContact O-N 2.88Å; F503-V506 WeakPolarHBondContact CA-O 3.22Å; V506-I515 HydrophobicContact CB-CG2 4.23Å; V506-I515 HydrophobicContact CG1-CG2 4.38Å; V506-Y516 CarbonylContact C-O 3.49Å; V506-Y516 WeakPolarHBondContact CA-O 3.46Å; V506-Y516 WeakPolarHBondContact CB-O 3.31Å; V506-F521 HydrophobicContact CG1-CZ 4.28Å; V506-F529 HydrophobicContact CG1-CE2 4.33Å; V506-F529 HydrophobicContact CG1-CZ 4.15Å; V506-F531 HydrophobicContact CB-CZ 4.48Å; V506-F531 HydrophobicContact CG1-CE1 4.4Å; V506-F531 HydrophobicContact CG2-CD1 4.24Å; V506-F531 HydrophobicContact CG2-CE1 3.85Å; V506-F531 HydrophobicContact CG2-CE2 4.2Å; V506-F531 HydrophobicContact CG2-CZ 3.84Å
507	S	96.4	Very high	93.8	Very high	39 Å²	39	51.9 Å²	51.9	27%	0.273	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	164.9	166.8	58.9	0	0	0	0	110.7	I515 Y516	S507-I515 WeakPolarHBondContact O-CA 3.33Å; S507-I515 WeakPolarHBondContact O-CG2 3.44Å; S507-Y516 PolarHBondContact N-O 2.97Å; S507-Y516 PolarHBondContact O-N 2.58Å
508	I	97.5	Very high	94.1	Very high	27 Å²	27	55.1 Å²	55.1	14%	0.138	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	142.4	171.3	-168	164.7	0	0	0	109.9	V475 Y490 I492 D514 I515 V533	V475-I508 HydrophobicContact CG2-CD1 3.93Å; Y490-I508 HydrophobicContact CG-CD1 4.49Å; I492-I508 HydrophobicContact CD1-CB 4.01Å; I492-I508 HydrophobicContact CD1-CG2 3.97Å; I492-I508 HydrophobicContact CG1-CB 4.1Å; I492-I508 HydrophobicContact CG1-CG2 3.79Å; I508-D514 CarbonylContact C-O 3.58Å; I508-D514 VanDerWaalsContact CA-O 3.32Å; I508-D514 WeakPolarHBondContact CA-O 3.2Å; I508-I515 HydrophobicContact CB-CG1 4.44Å; I508-I515 HydrophobicContact CD1-CD1 4.34Å; I508-I515 HydrophobicContact CD1-CG1 3.95Å; I508-I515 HydrophobicContact CG1-CG1 4.01Å; I508-V533 HydrophobicContact CD1-CB 4.46Å; I508-V533 HydrophobicContact CD1-CG1 3.47Å; I508-V533 VanDerWaalsContact CD1-CG1 3.47Å; I508-V533 HydrophobicContact CD1-CG2 4.09Å
509	N	96.9	Very high	94.5	Very high	57 Å²	57	51.8 Å²	51.8	31%	0.305	27%	0.27	S	S	.	.			trans	-76.7	119.9	167.3	-178.4	-29.8	0	0	0	108.9	N511 S512 G513 D514	N509-N511 PolarHBondContact O-N 2.87Å; N509-N511 PolarHBondContact OD1-N 2.99Å; N509-S512 VanDerWaalsContact CB-OG 3.3Å; N509-S512 WeakPolarHBondContact CB-OG 3.38Å; N509-S512 PolarHBondContact ND2-OG 2.77Å; N509-S512 VanDerWaalsContact ND2-OG 3.12Å; N509-S512 PolarHBondContact OD1-N 2.87Å; N509-G513 WeakPolarHBondContact O-CA 3.42Å; N509-G513 PolarHBondContact O-N 2.95Å; N509-D514 HydrophobicContact CB-CB 4.3Å; N509-D514 PolarHBondContact N-O 2.97Å
510	P	95.8	Very high	95	Very high	65 Å²	65	47.4 Å²	47.4	42%	0.422	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-16.9	-174.3	28.4	-36	0	0	0	114	S489 Y490	S489-P510 CarbonylContact C-O 3.58Å; S489-P510 WeakPolarHBondContact CA-O 3.36Å; Y490-P510 WeakPolarHBondContact CD2-O 3.15Å; Y490-P510 PolarHBondContact N-O 3.02Å; Y490-P510 WeakPolarHBondContact O-CA 3.21Å
511	N	94.3	Very high	95.2	Very high	133 Å²	133	43.4 Å²	43.4	71%	0.711	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-102.3	-39.5	-176.3	-61.3	3.4	0	0	0	112.2	N509	N509-N511 PolarHBondContact O-N 2.87Å; N509-N511 PolarHBondContact OD1-N 2.99Å
512	S	95.2	Very high	95.2	Very high	45 Å²	45	42.9 Å²	42.9	32%	0.315	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97	-18.5	-178.1	63.9	0	0	0	0	114.7	S474 N509 D514	S474-S512 PolarHBondContact OG-O 3.04Å; N509-S512 VanDerWaalsContact CB-OG 3.3Å; N509-S512 WeakPolarHBondContact CB-OG 3.38Å; N509-S512 PolarHBondContact ND2-OG 2.77Å; N509-S512 VanDerWaalsContact ND2-OG 3.12Å; N509-S512 PolarHBondContact OD1-N 2.87Å; S512-D514 VanDerWaalsContact C-N 3.26Å; S512-D514 VanDerWaalsContact CB-OD2 3.27Å; S512-D514 WeakPolarHBondContact CB-OD2 3.32Å; S512-D514 PolarHBondContact O-N 3.15Å; S512-D514 PolarHBondContact OG-N 2.91Å; S512-D514 PolarHBondContact OG-OD2 3.22Å
513	G	95.5	Very high	95.1	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	23%	0.227	C	C	.	.			trans	77.6	6.3	-174.5	0	0	0	0	0	114.5	V475 N509	V475-G513 WeakPolarHBondContact CG2-O 3.17Å; V475-G513 PolarHBondContact N-O 3.09Å; N509-G513 WeakPolarHBondContact O-CA 3.42Å; N509-G513 PolarHBondContact O-N 2.95Å
514	D	97.7	Very high	95	Very high	35 Å²	35	39.4 Å²	39.4	19%	0.187	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	129.7	177.6	-59.2	-41	0	0	0	111.8	Y471 S474 I508 N509 S512 Y516	Y471-D514 HydrophobicContact CD2-CB 4.32Å; Y471-D514 HydrophobicContact CE2-CB 4.04Å; S474-D514 WeakPolarHBondContact CB-OD1 3.44Å; S474-D514 PolarHBondContact OG-OD1 2.71Å; I508-D514 CarbonylContact C-O 3.58Å; I508-D514 VanDerWaalsContact CA-O 3.32Å; I508-D514 WeakPolarHBondContact CA-O 3.2Å; N509-D514 HydrophobicContact CB-CB 4.3Å; N509-D514 PolarHBondContact N-O 2.97Å; S512-D514 VanDerWaalsContact C-N 3.26Å; S512-D514 VanDerWaalsContact CB-OD2 3.27Å; S512-D514 WeakPolarHBondContact CB-OD2 3.32Å; S512-D514 PolarHBondContact O-N 3.15Å; S512-D514 PolarHBondContact OG-N 2.91Å; S512-D514 PolarHBondContact OG-OD2 3.22Å; D514-Y516 HydrophobicContact CB-CE2 3.55Å; D514-Y516 WeakPolarHBondContact O-CE2 3.49Å
515	I	97.6	Very high	94.9	Very high	1 Å²	1	43.6 Å²	43.6	1%	0.005	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	133.7	-178.5	-53.8	-176.2	0	0	0	109.7	L472 L473 V475 V506 S507 I508 F531 V533 V549	L472-I515 WeakPolarHBondContact CB-O 3.46Å; L472-I515 HydrophobicContact CD1-CG2 4.23Å; L472-I515 PolarHBondContact N-O 3.37Å; L473-I515 HydrophobicContact CD1-CD1 3.77Å; L473-I515 HydrophobicContact CD1-CG1 4.28Å; L473-I515 HydrophobicContact CG-CD1 4.28Å; L473-I515 WeakPolarHBondContact O-CB 3.05Å; L473-I515 PolarHBondContact O-N 3.42Å; V475-I515 HydrophobicContact CG1-CD1 4.06Å; V506-I515 HydrophobicContact CB-CG2 4.23Å; V506-I515 HydrophobicContact CG1-CG2 4.38Å; S507-I515 WeakPolarHBondContact O-CA 3.33Å; S507-I515 WeakPolarHBondContact O-CG2 3.44Å; I508-I515 HydrophobicContact CB-CG1 4.44Å; I508-I515 HydrophobicContact CD1-CD1 4.34Å; I508-I515 HydrophobicContact CD1-CG1 3.95Å; I508-I515 HydrophobicContact CG1-CG1 4.01Å; I515-F531 HydrophobicContact CD1-CE2 4.13Å; I515-F531 HydrophobicContact CD1-CZ 4.06Å; I515-F531 HydrophobicContact CG2-CZ 4.05Å; I515-V533 HydrophobicContact CD1-CG2 4.03Å; I515-V549 HydrophobicContact CD1-CG1 4.28Å; I515-V549 HydrophobicContact CD1-CG2 3.91Å
516	Y	97.1	Very high	94.7	Very high	75 Å²	75	43.1 Å²	43.1	29%	0.294	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	145.3	-179.3	-56.7	-97.6	0	0	0	111	A470 Y471 V506 S507 D514	A470-Y516 CarbonylContact O-C 3.5Å; A470-Y516 VanDerWaalsContact O-CA 3.29Å; A470-Y516 WeakPolarHBondContact O-CA 3.4Å; Y471-Y516 HydrophobicContact CD2-CE1 4.09Å; V506-Y516 CarbonylContact C-O 3.49Å; V506-Y516 WeakPolarHBondContact CA-O 3.46Å; V506-Y516 WeakPolarHBondContact CB-O 3.31Å; S507-Y516 PolarHBondContact N-O 2.97Å; S507-Y516 PolarHBondContact O-N 2.58Å; D514-Y516 HydrophobicContact CB-CE2 3.55Å; D514-Y516 WeakPolarHBondContact O-CE2 3.49Å
517	A	96.6	Very high	94.6	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76	130.7	169	0	0	0	0	0	110.2	G469 A470 L472 F521	G469-A517 WeakPolarHBondContact CA-O 3.12Å; G469-A517 PolarHBondContact N-O 2.82Å; A470-A517 PolarHBondContact O-N 3.2Å; L472-A517 HydrophobicContact CD1-CB 4.2Å; L472-A517 HydrophobicContact CD2-CB 4.08Å; L472-A517 HydrophobicContact CG-CB 4.24Å; A517-F521 HydrophobicContact CB-CE2 3.89Å; A517-F521 HydrophobicContact CB-CZ 3.68Å
518	L	94.9	Very high	94.5	Very high	81 Å²	81	46.9 Å²	46.9	42%	0.424	25%	0.246	S	C	.	.	S	Bend	trans	-93.2	-4.6	176.9	-67	176.7	0	0	0	113.4	F503 Y505	F503-L518 WeakPolarHBondContact O-CD1 3.42Å; Y505-L518 PolarHBondContact O-N 2.93Å
519	R	92.1	Very high	94.4	Very high	74 Å²	74	46 Å²	46	28%	0.279	24%	0.242	S	C	.	.	S	Bend	trans	-146.2	167.2	-179.5	63.7	175.4	66.8	-177.1	-1.3	110.6	N466 T504 Y505 F521	N466-R519 PolarHBondContact ND2-O 2.93Å; T504-R519 VanDerWaalsContact CB-NH2 3.33Å; T504-R519 VanDerWaalsContact O-CZ 3.25Å; T504-R519 PolarHBondContact O-NE 2.99Å; T504-R519 PolarHBondContact O-NH2 3.13Å; T504-R519 PolarHBondContact OG1-NH2 3.49Å; Y505-R519 HydrophobicContact CD1-CG 4.46Å; R519-F521 HydrophobicContact CG-CD1 3.96Å; R519-F521 HydrophobicContact CG-CE1 3.87Å
520	S	94.2	Very high	94.3	Very high	48 Å²	48	48.1 Å²	48.1	34%	0.336	25%	0.249	S	C	.	.			trans	-67.8	135.5	155.6	-171	0	0	0	0	109.5	N465 N466	N465-S520 WeakPolarHBondContact CA-OG 3.33Å; N466-S520 VanDerWaalsContact O-CA 3.32Å; N466-S520 WeakPolarHBondContact O-CA 3.39Å; N466-S520 WeakPolarHBondContact O-CB 3.05Å; N466-S520 PolarHBondContact O-OG 2.77Å
521	F	94.1	Very high	94.3	Very high	8 Å²	8	45.2 Å²	45.2	4%	0.035	23%	0.23	C	C	.	.			trans	-87.2	162.3	164.4	-53.7	-43.7	0	0	0	110.3	V462 N465 N466 L472 Y505 V506 A517 R519 F529 V551 I553	V462-F521 HydrophobicContact CG1-CD2 4.47Å; N465-F521 PolarHBondContact N-O 3.09Å; N466-F521 WeakPolarHBondContact OD1-CB 3.4Å; N466-F521 WeakPolarHBondContact OD1-CD2 3.47Å; N466-F521 WeakPolarHBondContact OD1-CG 3.29Å; N466-F521 PolarHBondContact OD1-N 2.73Å; L472-F521 HydrophobicContact CD1-CE2 4.44Å; L472-F521 HydrophobicContact CD1-CZ 4.47Å; L472-F521 HydrophobicContact CD2-CE2 4.47Å; Y505-F521 HydrophobicContact CD1-CD1 4.28Å; Y505-F521 HydrophobicContact CD1-CE1 4.06Å; V506-F521 HydrophobicContact CG1-CZ 4.28Å; A517-F521 HydrophobicContact CB-CE2 3.89Å; A517-F521 HydrophobicContact CB-CZ 3.68Å; R519-F521 HydrophobicContact CG-CD1 3.96Å; R519-F521 HydrophobicContact CG-CE1 3.87Å; F521-F529 HydrophobicContact CD1-CE1 4.17Å; F521-F529 AromaticContact CE1-CE1 3.84Å; F521-F529 HydrophobicContact CE1-CE1 3.84Å; F521-F529 AromaticContact CE1-CZ 3.88Å; F521-F529 HydrophobicContact CE1-CZ 3.88Å; F521-F529 HydrophobicContact CE2-CE1 4.45Å; F521-F529 AromaticContact CZ-CE1 4Å; F521-F529 HydrophobicContact CZ-CE1 4Å; F521-F529 AromaticContact CZ-CZ 3.81Å; F521-F529 HydrophobicContact CZ-CZ 3.81Å; F521-V551 HydrophobicContact CD2-CG1 4.48Å; F521-V551 HydrophobicContact CE2-CG1 4.07Å; F521-I553 HydrophobicContact CB-CD1 3.62Å; F521-I553 HydrophobicContact CB-CG1 3.83Å; F521-I553 HydrophobicContact CB-CG2 4.17Å; F521-I553 HydrophobicContact CD1-CD1 4.37Å; F521-I553 HydrophobicContact CD2-CD1 4.16Å; F521-I553 HydrophobicContact CD2-CG1 3.98Å; F521-I553 HydrophobicContact CG-CD1 3.8Å; F521-I553 HydrophobicContact CG-CG1 4.05Å
522	N	92.4	Very high	94.4	Very high	26 Å²	26	43.2 Å²	43.2	14%	0.139	22%	0.215	C	C	.	.			trans	-143.7	138.5	176	162.8	-95.9	0	0	0	107.2	E464 E524 Q525 T526	E464-N522 WeakPolarHBondContact OE2-CA 3.49Å; E464-N522 PolarHBondContact OE2-ND2 2.81Å; N522-E524 PolarHBondContact ND2-OE1 2.9Å; N522-E524 PolarHBondContact ND2-OE2 3.16Å; N522-Q525 WeakPolarHBondContact OD1-CG 3.41Å; N522-Q525 PolarHBondContact OD1-N 2.97Å; N522-Q525 PolarHBondContact OD1-NE2 2.62Å; N522-T526 PolarHBondContact O-N 2.95Å
523	H	92.8	Very high	94.5	Very high	8 Å²	8	41.1 Å²	41.1	4%	0.037	20%	0.2	C	C	.	.	S	Bend	trans	-80	-47.3	-166.4	178.7	86.3	0	0	0	111.9	E464 Q525 T526 K527 I553 D555 E597	E464-H523 VanDerWaalsContact OE1-CB 3.23Å; E464-H523 WeakPolarHBondContact OE1-CB 3.12Å; E464-H523 PolarHBondContact OE2-N 3.28Å; H523-Q525 VanDerWaalsContact C-N 3.27Å; H523-Q525 PolarHBondContact O-N 3.4Å; H523-T526 CarbonylContact O-C 3.58Å; H523-T526 WeakPolarHBondContact O-CA 3.19Å; H523-T526 PolarHBondContact O-N 3.48Å; H523-K527 PolarHBondContact CD2-NZ 3.27Å; H523-K527 VanDerWaalsContact NE2-CD 3.33Å; H523-K527 WeakPolarHBondContact NE2-CD 3.33Å; H523-K527 VanDerWaalsContact NE2-CE 3.34Å; H523-K527 WeakPolarHBondContact NE2-CE 3.4Å; H523-K527 WeakPolarHBondContact NE2-CG 3.17Å; H523-K527 PolarHBondContact NE2-NZ 2.82Å; H523-K527 VanDerWaalsContact O-CG 3.24Å; H523-K527 WeakPolarHBondContact O-CG 3.38Å; H523-K527 PolarHBondContact O-N 3.49Å; H523-I553 HydrophobicContact CB-CG2 4.09Å; H523-I553 PolarHBondContact CE1-O 3.19Å; H523-I553 PolarHBondContact ND1-O 2.8Å; H523-D555 IonicContact CD2-OD1 2.73Å; H523-D555 PolarHBondContact CD2-OD1 3.1Å; H523-D555 IonicContact CG-OD1 2.71Å; H523-D555 IonicContact NE2-OD1 3.81Å; H523-D555 PolarHBondContact NE2-OD1 2.83Å; H523-E597 IonicContact CE1-OE2 2.95Å; H523-E597 IonicContact NE2-OE2 3.25Å; H523-E597 PolarHBondContact NE2-OE2 2.83Å
524	E	91.6	Very high	94.6	Very high	50 Å²	50	42.4 Å²	42.4	23%	0.234	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-42.5	-179.5	-47.5	82	-91.2	0	0	110.4	R498 N522 N559	R498-E524 PolarHBondContact NH2-O 2.99Å; N522-E524 PolarHBondContact ND2-OE1 2.9Å; N522-E524 PolarHBondContact ND2-OE2 3.16Å; E524-N559 VanDerWaalsContact CD-ND2 3.34Å; E524-N559 PolarHBondContact OE2-ND2 3.26Å
525	Q	89.8	Confident	94.6	Very high	124 Å²	124	40.8 Å²	40.8	58%	0.579	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	-101.7	16.3	172.2	39.2	89.1	26.3	0	0	117.7	R498 N522 H523	R498-Q525 VanDerWaalsContact CD-O 3.31Å; R498-Q525 WeakPolarHBondContact CD-O 3.33Å; R498-Q525 PolarHBondContact NE-O 2.82Å; R498-Q525 PolarHBondContact NH1-O 2.91Å; R498-Q525 PolarHBondContact NH2-O 2.84Å; N522-Q525 WeakPolarHBondContact OD1-CG 3.41Å; N522-Q525 PolarHBondContact OD1-N 2.97Å; N522-Q525 PolarHBondContact OD1-NE2 2.62Å; H523-Q525 VanDerWaalsContact C-N 3.27Å; H523-Q525 PolarHBondContact O-N 3.4Å
526	T	90.8	Very high	94.5	Very high	10 Å²	10	44.3 Å²	44.3	6%	0.061	21%	0.214	C	C	.	.			trans	-174.7	107.9	138.4	-74.9	0	0	0	0	112.8	V497 R498 N522 H523 A528 F529 I553	V497-T526 HydrophobicContact CG1-CG2 4.47Å; R498-T526 WeakPolarHBondContact CD-OG1 3.21Å; R498-T526 PolarHBondContact NE-OG1 3.31Å; N522-T526 PolarHBondContact O-N 2.95Å; H523-T526 CarbonylContact O-C 3.58Å; H523-T526 WeakPolarHBondContact O-CA 3.19Å; H523-T526 PolarHBondContact O-N 3.48Å; T526-A528 WeakPolarHBondContact CG2-O 3.49Å; T526-A528 PolarHBondContact O-N 3.23Å; T526-F529 HydrophobicContact CG2-CB 4.14Å; T526-F529 HydrophobicContact CG2-CD1 3.98Å; T526-I553 HydrophobicContact CG2-CD1 4.21Å; T526-I553 WeakPolarHBondContact O-CD1 3.35Å
527	K	92.4	Very high	94.4	Very high	77 Å²	77	40.8 Å²	40.8	34%	0.335	20%	0.2	S	C	.	.	S	Bend	trans	-69.1	-31.9	177.4	-54.7	-166.4	174.6	-122.5	0	114.5	H523 I553 E597	H523-K527 PolarHBondContact CD2-NZ 3.27Å; H523-K527 VanDerWaalsContact NE2-CD 3.33Å; H523-K527 WeakPolarHBondContact NE2-CD 3.33Å; H523-K527 VanDerWaalsContact NE2-CE 3.34Å; H523-K527 WeakPolarHBondContact NE2-CE 3.4Å; H523-K527 WeakPolarHBondContact NE2-CG 3.17Å; H523-K527 PolarHBondContact NE2-NZ 2.82Å; H523-K527 VanDerWaalsContact O-CG 3.24Å; H523-K527 WeakPolarHBondContact O-CG 3.38Å; H523-K527 PolarHBondContact O-N 3.49Å; K527-I553 PolarHBondContact O-N 2.82Å; K527-E597 IonicContact NZ-OE1 3.86Å; K527-E597 PolarHBondContact NZ-OE1 3.45Å; K527-E597 IonicContact NZ-OE2 2.69Å; K527-E597 PolarHBondContact NZ-OE2 3.01Å
528	A	95	Very high	94.3	Very high	40 Å²	40	42.6 Å²	42.6	33%	0.331	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.8	152.8	173.3	0	0	0	0	0	111.1	T526 V551 I552	T526-A528 WeakPolarHBondContact CG2-O 3.49Å; T526-A528 PolarHBondContact O-N 3.23Å; A528-V551 CarbonylContact C-O 3.48Å; A528-V551 WeakPolarHBondContact CA-O 3.16Å; A528-V551 WeakPolarHBondContact CB-O 3.48Å; A528-I552 HydrophobicContact CB-CG1 4.48Å
529	F	95	Very high	94.1	Very high	10 Å²	10	39 Å²	39	4%	0.044	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	154.9	169.8	65.1	-89	0	0	0	112	V497 Y505 V506 F521 T526 F531 R550 V551 I553	V497-F529 HydrophobicContact CB-CB 4.44Å; V497-F529 HydrophobicContact CG1-CB 3.73Å; V497-F529 HydrophobicContact CG1-CG 4.15Å; V497-F529 HydrophobicContact CG2-CB 3.75Å; V497-F529 HydrophobicContact CG2-CD2 3.92Å; V497-F529 HydrophobicContact CG2-CG 4.07Å; Y505-F529 HydrophobicContact CD1-CE1 4.37Å; Y505-F529 HydrophobicContact CD1-CZ 4.47Å; V506-F529 HydrophobicContact CG1-CE2 4.33Å; V506-F529 HydrophobicContact CG1-CZ 4.15Å; F521-F529 HydrophobicContact CD1-CE1 4.17Å; F521-F529 AromaticContact CE1-CE1 3.84Å; F521-F529 HydrophobicContact CE1-CE1 3.84Å; F521-F529 AromaticContact CE1-CZ 3.88Å; F521-F529 HydrophobicContact CE1-CZ 3.88Å; F521-F529 HydrophobicContact CE2-CE1 4.45Å; F521-F529 AromaticContact CZ-CE1 4Å; F521-F529 HydrophobicContact CZ-CE1 4Å; F521-F529 AromaticContact CZ-CZ 3.81Å; F521-F529 HydrophobicContact CZ-CZ 3.81Å; T526-F529 HydrophobicContact CG2-CB 4.14Å; T526-F529 HydrophobicContact CG2-CD1 3.98Å; F529-F531 HydrophobicContact CD2-CD1 4Å; F529-F531 HydrophobicContact CD2-CE1 4.48Å; F529-F531 AromaticContact CE2-CD1 3.8Å; F529-F531 HydrophobicContact CE2-CD1 3.8Å; F529-F531 AromaticContact CE2-CE1 3.9Å; F529-F531 HydrophobicContact CE2-CE1 3.9Å; F529-R550 WeakPolarHBondContact O-CA 3.44Å; F529-V551 HydrophobicContact CD1-CB 4.11Å; F529-V551 HydrophobicContact CD2-CB 4.47Å; F529-V551 HydrophobicContact CD2-CG2 4.47Å; F529-V551 HydrophobicContact CE1-CB 3.74Å; F529-V551 HydrophobicContact CE1-CG1 3.85Å; F529-V551 HydrophobicContact CE1-CG2 4.2Å; F529-V551 HydrophobicContact CE2-CB 4.13Å; F529-V551 HydrophobicContact CE2-CG2 3.82Å; F529-V551 HydrophobicContact CG-CB 4.47Å; F529-V551 HydrophobicContact CZ-CB 3.75Å; F529-V551 HydrophobicContact CZ-CG1 4.07Å; F529-V551 HydrophobicContact CZ-CG2 3.66Å; F529-V551 PolarHBondContact N-O 3.03Å; F529-V551 PolarHBondContact O-N 3.17Å; F529-I553 HydrophobicContact CD1-CD1 4.02Å; F529-I553 HydrophobicContact CE1-CD1 3.96Å
530	E	95.9	Very high	93.9	Very high	100 Å²	100	43.3 Å²	43.3	47%	0.467	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	144.2	176.6	-62.7	-162	149.6	0	0	110.6	Y457 T548 V549 R550	Y457-E530 WeakPolarHBondContact CE2-OE1 2.99Å; Y457-E530 PolarHBondContact OH-OE1 2.93Å; E530-T548 HydrophobicContact CB-CG2 4.24Å; E530-V549 VanDerWaalsContact CA-O 3.32Å; E530-V549 WeakPolarHBondContact CA-O 3.38Å; E530-R550 HydrophobicContact CG-CB 3.8Å; E530-R550 HydrophobicContact CG-CG 3.79Å; E530-R550 WeakPolarHBondContact OE1-CD 3.32Å
531	F	95.8	Very high	93.7	Very high	5 Å²	5	45.9 Å²	45.9	2%	0.022	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	165.5	171.8	61.4	-85.8	0	0	0	110.4	I492 V502 V506 I515 F529 V533 V549 V551	I492-F531 HydrophobicContact CG1-CD2 4.34Å; I492-F531 HydrophobicContact CG1-CE2 4.19Å; I492-F531 HydrophobicContact CG2-CD2 4.24Å; V502-F531 HydrophobicContact CB-CB 4.38Å; V502-F531 HydrophobicContact CG1-CB 3.59Å; V502-F531 HydrophobicContact CG1-CD1 4.14Å; V502-F531 HydrophobicContact CG1-CD2 4.15Å; V502-F531 HydrophobicContact CG1-CG 3.72Å; V502-F531 HydrophobicContact CG2-CB 3.94Å; V506-F531 HydrophobicContact CB-CZ 4.48Å; V506-F531 HydrophobicContact CG1-CE1 4.4Å; V506-F531 HydrophobicContact CG2-CD1 4.24Å; V506-F531 HydrophobicContact CG2-CE1 3.85Å; V506-F531 HydrophobicContact CG2-CE2 4.2Å; V506-F531 HydrophobicContact CG2-CZ 3.84Å; I515-F531 HydrophobicContact CD1-CE2 4.13Å; I515-F531 HydrophobicContact CD1-CZ 4.06Å; I515-F531 HydrophobicContact CG2-CZ 4.05Å; F529-F531 HydrophobicContact CD2-CD1 4Å; F529-F531 HydrophobicContact CD2-CE1 4.48Å; F529-F531 AromaticContact CE2-CD1 3.8Å; F529-F531 HydrophobicContact CE2-CD1 3.8Å; F529-F531 AromaticContact CE2-CE1 3.9Å; F529-F531 HydrophobicContact CE2-CE1 3.9Å; F531-V533 HydrophobicContact CD2-CG2 4.17Å; F531-V533 HydrophobicContact CE2-CG2 3.76Å; F531-V549 HydrophobicContact CD1-CB 4.4Å; F531-V549 HydrophobicContact CD2-CB 4.28Å; F531-V549 HydrophobicContact CE1-CB 3.97Å; F531-V549 HydrophobicContact CE1-CG1 3.74Å; F531-V549 HydrophobicContact CE2-CB 3.83Å; F531-V549 HydrophobicContact CE2-CG1 4.18Å; F531-V549 HydrophobicContact CE2-CG2 4.12Å; F531-V549 HydrophobicContact CZ-CB 3.65Å; F531-V549 HydrophobicContact CZ-CG1 3.5Å; F531-V549 HydrophobicContact CZ-CG2 4.27Å; F531-V549 PolarHBondContact N-O 3.48Å; F531-V549 PolarHBondContact O-N 3.36Å; F531-V551 HydrophobicContact CE1-CG2 3.97Å
532	K	96.6	Very high	93.7	Very high	91 Å²	91	48.1 Å²	48.1	40%	0.396	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	136.8	176.2	-70.1	-171.9	168	-153	0	110.9	V493 N546 A547	V493-K532 HydrophobicContact CB-CB 3.98Å; V493-K532 WeakPolarHBondContact CB-O 3.38Å; V493-K532 HydrophobicContact CG2-CB 3.84Å; V493-K532 PolarHBondContact N-O 2.7Å; K532-N546 WeakPolarHBondContact CD-OD1 3.26Å; K532-N546 PolarHBondContact NZ-OD1 3.39Å; K532-A547 WeakPolarHBondContact CA-O 3.21Å
533	V	97.3	Very high	93.9	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	130.5	165	-177.2	0	0	0	0	107.9	F453 V475 Y490 I508 I515 F531 N546 A547 V549	F453-V533 HydrophobicContact CE1-CG1 4.41Å; F453-V533 HydrophobicContact CZ-CB 4.33Å; F453-V533 HydrophobicContact CZ-CG1 4.07Å; V475-V533 HydrophobicContact CG2-CG1 4.05Å; Y490-V533 HydrophobicContact CD1-CG1 4.49Å; I508-V533 HydrophobicContact CD1-CB 4.46Å; I508-V533 HydrophobicContact CD1-CG1 3.47Å; I508-V533 VanDerWaalsContact CD1-CG1 3.47Å; I508-V533 HydrophobicContact CD1-CG2 4.09Å; I515-V533 HydrophobicContact CD1-CG2 4.03Å; F531-V533 HydrophobicContact CD2-CG2 4.17Å; F531-V533 HydrophobicContact CE2-CG2 3.76Å; V533-N546 WeakPolarHBondContact O-CA 3.41Å; V533-A547 PolarHBondContact N-O 2.98Å; V533-A547 PolarHBondContact O-N 2.73Å; V533-V549 HydrophobicContact CG2-CG2 3.76Å
534	L	96.6	Very high	94	Very high	28 Å²	28	55 Å²	55	15%	0.147	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	136.5	168.4	-166.1	80	0	0	0	108.6	Y490 Q491 V493 Q544 S545	Y490-L534 WeakPolarHBondContact CA-O 3.33Å; Q491-L534 HydrophobicContact CB-CB 4.43Å; Q491-L534 PolarHBondContact N-O 2.78Å; Q491-L534 WeakPolarHBondContact O-CB 3.41Å; Q491-L534 PolarHBondContact O-N 3.37Å; V493-L534 HydrophobicContact CG2-CB 3.96Å; L534-Q544 HydrophobicContact CD1-CB 4.17Å; L534-Q544 HydrophobicContact CD1-CG 4.43Å; L534-Q544 HydrophobicContact CG-CB 4.44Å; L534-S545 WeakPolarHBondContact CA-O 3.23Å; L534-S545 WeakPolarHBondContact CD1-O 3.23Å
535	A	97.2	Very high	94.2	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	136.7	158.2	0	0	0	0	0	107.4	P451 F453 A477 V488 S489 Y490 Q544 S545	P451-A535 HydrophobicContact CB-CB 3.83Å; F453-A535 HydrophobicContact CD2-CB 4.34Å; F453-A535 HydrophobicContact CE1-CB 4.08Å; F453-A535 HydrophobicContact CE2-CB 3.52Å; F453-A535 HydrophobicContact CZ-CB 3.38Å; A477-A535 HydrophobicContact CB-CB 3.75Å; V488-A535 HydrophobicContact CG1-CB 3.99Å; S489-A535 WeakPolarHBondContact O-CA 3.34Å; Y490-A535 HydrophobicContact CD1-CB 4.04Å; Y490-A535 HydrophobicContact CE1-CB 4.07Å; A535-Q544 CarbonylContact O-C 3.53Å; A535-Q544 WeakPolarHBondContact O-CA 3.23Å; A535-Q544 WeakPolarHBondContact O-CB 3.49Å; A535-S545 PolarHBondContact N-O 3.43Å; A535-S545 PolarHBondContact O-N 2.97Å
536	K	95.7	Very high	94.5	Very high	75 Å²	75	51.5 Å²	51.5	33%	0.326	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	153	176.8	64.4	169	-168.5	166.2	0	110.1	V488 S489 L543 Q544	V488-K536 CarbonylContact C-O 3.54Å; V488-K536 WeakPolarHBondContact CA-O 3.22Å; S489-K536 PolarHBondContact N-O 2.99Å; S489-K536 PolarHBondContact O-N 2.85Å; S489-K536 WeakPolarHBondContact OG-CE 3.32Å; S489-K536 WeakPolarHBondContact OG-CG 3.49Å; S489-K536 PolarHBondContact OG-O 2.88Å; K536-L543 VanDerWaalsContact CA-O 3.31Å; K536-L543 WeakPolarHBondContact CA-O 3.4Å; K536-Q544 HydrophobicContact CB-CB 3.93Å
537	D	96.2	Very high	94.8	Very high	2 Å²	2	51 Å²	51	1%	0.011	28%	0.279	C	S	.	.			trans	-74	-171.7	173	55.1	35.7	0	0	0	112.4	N447 P451 N485 S487 G539 S542 L543	N447-D537 PolarHBondContact ND2-OD2 2.72Å; N447-D537 PolarHBondContact OD1-OD2 3.05Å; P451-D537 HydrophobicContact CG-CB 4.35Å; N485-D537 WeakPolarHBondContact O-CB 3.4Å; S487-D537 CarbonylContact O-C 3.53Å; D537-G539 PolarHBondContact OD1-N 3.43Å; D537-S542 WeakPolarHBondContact OD1-CA 3.03Å; D537-S542 WeakPolarHBondContact OD1-CB 3.49Å; D537-S542 PolarHBondContact OD1-OG 3.04Å; D537-L543 VanDerWaalsContact CG-N 3.32Å; D537-L543 PolarHBondContact N-O 2.76Å; D537-L543 PolarHBondContact OD1-N 3.43Å; D537-L543 VanDerWaalsContact OD2-CA 3.3Å; D537-L543 WeakPolarHBondContact OD2-CA 3.5Å; D537-L543 VanDerWaalsContact OD2-CB 3.32Å; D537-L543 WeakPolarHBondContact OD2-CB 3.21Å; D537-L543 PolarHBondContact OD2-N 3.11Å
538	G	93.1	Very high	95	Very high	38 Å²	38	48.9 Å²	48.9	39%	0.392	27%	0.273	S	S	.	.	S	Bend	trans	-103.1	13.8	162.9	0	0	0	0	0	113.8	L484 S487	L484-G538 CarbonylContact O-C 3.54Å; L484-G538 WeakPolarHBondContact O-CA 3.12Å; L484-G538 PolarHBondContact O-N 2.81Å; S487-G538 PolarHBondContact O-N 2.72Å
539	G	91	Very high	95.1	Very high	4 Å²	4	47 Å²	47	4%	0.041	26%	0.257	C	S	.	.			trans	-77.6	174.8	-170.3	0	0	0	0	0	115.8	N447 D537 S542	N447-G539 VanDerWaalsContact OD1-CA 3.25Å; N447-G539 WeakPolarHBondContact OD1-CA 3.33Å; D537-G539 PolarHBondContact OD1-N 3.43Å; G539-S542 WeakPolarHBondContact O-CA 3.1Å; G539-S542 WeakPolarHBondContact O-CB 3.49Å; G539-S542 PolarHBondContact O-N 2.83Å
540	L	87.4	Confident	95.2	Very high	165 Å²	165	50.5 Å²	50.5	86%	0.864	27%	0.27	S	S	*	.	S	Bend	trans	-139.4	101.3	178.8	-69.7	176.9	0	0	0	110.8
541	P	91.4	Very high	95.2	Very high	102 Å²	102	45.8 Å²	45.8	66%	0.662	25%	0.248	S	C	*	.	S	Bend	cis	-72.2	142.5	3	31.7	-35.7	0	0	0	112.4	L543	P541-L543 PolarHBondContact O-N 2.91Å
542	S	93.9	Very high	95.2	Very high	56 Å²	56	47.1 Å²	47.1	39%	0.392	26%	0.255	S	S	.	.	P	Polyproline II helix	trans	-72.3	125.2	177.6	178.6	0	0	0	0	111.6	D537 G539	D537-S542 WeakPolarHBondContact OD1-CA 3.03Å; D537-S542 WeakPolarHBondContact OD1-CB 3.49Å; D537-S542 PolarHBondContact OD1-OG 3.04Å; G539-S542 WeakPolarHBondContact O-CA 3.1Å; G539-S542 WeakPolarHBondContact O-CB 3.49Å; G539-S542 PolarHBondContact O-N 2.83Å
543	L	95.5	Very high	95.2	Very high	58 Å²	58	42.9 Å²	42.9	30%	0.304	24%	0.237	S	C	.	.	P	Polyproline II helix	trans	-98.9	155.6	175.4	-58	-179.6	0	0	0	110.6	N447 N449 H450 K536 D537 P541	N447-L543 WeakPolarHBondContact ND2-CG 3.34Å; N447-L543 VanDerWaalsContact O-CD1 3.29Å; N447-L543 WeakPolarHBondContact O-CD1 3.3Å; N449-L543 WeakPolarHBondContact O-CD1 3.21Å; H450-L543 HydrophobicContact CB-CB 3.84Å; K536-L543 VanDerWaalsContact CA-O 3.31Å; K536-L543 WeakPolarHBondContact CA-O 3.4Å; D537-L543 VanDerWaalsContact CG-N 3.32Å; D537-L543 PolarHBondContact N-O 2.76Å; D537-L543 PolarHBondContact OD1-N 3.43Å; D537-L543 VanDerWaalsContact OD2-CA 3.3Å; D537-L543 WeakPolarHBondContact OD2-CA 3.5Å; D537-L543 VanDerWaalsContact OD2-CB 3.32Å; D537-L543 WeakPolarHBondContact OD2-CB 3.21Å; D537-L543 PolarHBondContact OD2-N 3.11Å; P541-L543 PolarHBondContact O-N 2.91Å
544	Q	95.5	Very high	95	Very high	119 Å²	119	46.7 Å²	46.7	56%	0.556	26%	0.257	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-157.3	149.3	-163.5	59.1	176.9	2.3	0	0	112.9	L534 A535 K536	L534-Q544 HydrophobicContact CD1-CB 4.17Å; L534-Q544 HydrophobicContact CD1-CG 4.43Å; L534-Q544 HydrophobicContact CG-CB 4.44Å; A535-Q544 CarbonylContact O-C 3.53Å; A535-Q544 WeakPolarHBondContact O-CA 3.23Å; A535-Q544 WeakPolarHBondContact O-CB 3.49Å; K536-Q544 HydrophobicContact CB-CB 3.93Å
545	S	96.3	Very high	94.8	Very high	20 Å²	20	46.7 Å²	46.7	14%	0.14	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	172.6	171.8	86.4	0	0	0	0	111.4	P451 F453 L534 A535	P451-S545 VanDerWaalsContact O-CB 3.22Å; P451-S545 WeakPolarHBondContact O-CB 3.49Å; P451-S545 PolarHBondContact O-OG 2.97Å; F453-S545 WeakPolarHBondContact CD2-OG 3.02Å; F453-S545 WeakPolarHBondContact CE2-OG 3.49Å; L534-S545 WeakPolarHBondContact CA-O 3.23Å; L534-S545 WeakPolarHBondContact CD1-O 3.23Å; A535-S545 PolarHBondContact N-O 3.43Å; A535-S545 PolarHBondContact O-N 2.97Å
546	N	96.1	Very high	94.5	Very high	81 Å²	81	48.8 Å²	48.8	43%	0.433	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	143.9	172.4	59	104.5	0	0	0	112.4	K532 V533	K532-N546 WeakPolarHBondContact CD-OD1 3.26Å; K532-N546 PolarHBondContact NZ-OD1 3.39Å; V533-N546 WeakPolarHBondContact O-CA 3.41Å
547	A	96.6	Very high	94.3	Very high	1 Å²	1	45.9 Å²	45.9	1%	0.008	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	151.1	166.5	0	0	0	0	0	110	F453 P456 Y458 K532 V533	F453-A547 HydrophobicContact CB-CB 4.03Å; F453-A547 HydrophobicContact CD1-CB 3.92Å; F453-A547 HydrophobicContact CD2-CB 3.61Å; F453-A547 HydrophobicContact CE1-CB 4.23Å; F453-A547 HydrophobicContact CE2-CB 3.96Å; F453-A547 HydrophobicContact CG-CB 3.58Å; F453-A547 HydrophobicContact CZ-CB 4.24Å; P456-A547 WeakPolarHBondContact O-CA 3.1Å; Y458-A547 HydrophobicContact CD2-CB 4.08Å; Y458-A547 HydrophobicContact CE2-CB 3.76Å; K532-A547 WeakPolarHBondContact CA-O 3.21Å; V533-A547 PolarHBondContact N-O 2.98Å; V533-A547 PolarHBondContact O-N 2.73Å
548	T	97	Very high	94	Very high	31 Å²	31	49 Å²	49	19%	0.19	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	134.3	175.9	-59.7	0	0	0	0	110	P456 Y457 Y458 E530	P456-T548 PolarHBondContact O-N 2.84Å; Y457-T548 CarbonylContact C-O 3.52Å; Y457-T548 WeakPolarHBondContact CA-O 3.27Å; Y457-T548 HydrophobicContact CD2-CG2 4.1Å; Y457-T548 HydrophobicContact CE2-CG2 4.01Å; Y458-T548 PolarHBondContact N-O 2.91Å; E530-T548 HydrophobicContact CB-CG2 4.24Å
549	V	97.1	Very high	93.9	Very high	1 Å²	1	49.3 Å²	49.3	1%	0.006	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	123.5	173.4	178.7	0	0	0	0	108.6	Y458 L473 V475 I515 E530 F531 V533	Y458-V549 CarbonylContact O-C 3.59Å; Y458-V549 WeakPolarHBondContact O-CA 3.13Å; L473-V549 HydrophobicContact CD2-CG1 3.87Å; V475-V549 HydrophobicContact CG1-CG2 4.08Å; I515-V549 HydrophobicContact CD1-CG1 4.28Å; I515-V549 HydrophobicContact CD1-CG2 3.91Å; E530-V549 VanDerWaalsContact CA-O 3.32Å; E530-V549 WeakPolarHBondContact CA-O 3.38Å; F531-V549 HydrophobicContact CD1-CB 4.4Å; F531-V549 HydrophobicContact CD2-CB 4.28Å; F531-V549 HydrophobicContact CE1-CB 3.97Å; F531-V549 HydrophobicContact CE1-CG1 3.74Å; F531-V549 HydrophobicContact CE2-CB 3.83Å; F531-V549 HydrophobicContact CE2-CG1 4.18Å; F531-V549 HydrophobicContact CE2-CG2 4.12Å; F531-V549 HydrophobicContact CZ-CB 3.65Å; F531-V549 HydrophobicContact CZ-CG1 3.5Å; F531-V549 HydrophobicContact CZ-CG2 4.27Å; F531-V549 PolarHBondContact N-O 3.48Å; F531-V549 PolarHBondContact O-N 3.36Å; V533-V549 HydrophobicContact CG2-CG2 3.76Å
550	R	97	Very high	93.9	Very high	84 Å²	84	51.9 Å²	51.9	32%	0.317	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	128.3	169.4	-176.2	175.9	-179.8	-159.9	6.9	110.9	Y457 Y458 Q459 V460 F529 E530 I552	Y457-R550 HydrophobicContact CE2-CB 4.3Å; Y457-R550 VanDerWaalsContact OH-CB 3.26Å; Y457-R550 WeakPolarHBondContact OH-CB 3.3Å; Y457-R550 WeakPolarHBondContact OH-CD 3.41Å; Y458-R550 PolarHBondContact O-N 3.4Å; Q459-R550 WeakPolarHBondContact CA-O 3.44Å; Q459-R550 HydrophobicContact CG-CB 4.34Å; V460-R550 PolarHBondContact N-O 3.31Å; F529-R550 WeakPolarHBondContact O-CA 3.44Å; E530-R550 HydrophobicContact CG-CB 3.8Å; E530-R550 HydrophobicContact CG-CG 3.79Å; E530-R550 WeakPolarHBondContact OE1-CD 3.32Å; R550-I552 HydrophobicContact CG-CG1 4.06Å
551	V	96.4	Very high	94.2	Very high	0 Å²	0	44 Å²	44	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	120.5	166.1	-175.9	0	0	0	0	107.3	V460 V462 L472 F521 A528 F529 F531 I553	V460-V551 HydrophobicContact CG1-CB 4.25Å; V460-V551 HydrophobicContact CG1-CG1 4.25Å; V460-V551 HydrophobicContact CG1-CG2 3.85Å; V462-V551 HydrophobicContact CG2-CG1 3.89Å; L472-V551 HydrophobicContact CD1-CG2 4.38Å; F521-V551 HydrophobicContact CD2-CG1 4.48Å; F521-V551 HydrophobicContact CE2-CG1 4.07Å; A528-V551 CarbonylContact C-O 3.48Å; A528-V551 WeakPolarHBondContact CA-O 3.16Å; A528-V551 WeakPolarHBondContact CB-O 3.48Å; F529-V551 HydrophobicContact CD1-CB 4.11Å; F529-V551 HydrophobicContact CD2-CB 4.47Å; F529-V551 HydrophobicContact CD2-CG2 4.47Å; F529-V551 HydrophobicContact CE1-CB 3.74Å; F529-V551 HydrophobicContact CE1-CG1 3.85Å; F529-V551 HydrophobicContact CE1-CG2 4.2Å; F529-V551 HydrophobicContact CE2-CB 4.13Å; F529-V551 HydrophobicContact CE2-CG2 3.82Å; F529-V551 HydrophobicContact CG-CB 4.47Å; F529-V551 HydrophobicContact CZ-CB 3.75Å; F529-V551 HydrophobicContact CZ-CG1 4.07Å; F529-V551 HydrophobicContact CZ-CG2 3.66Å; F529-V551 PolarHBondContact N-O 3.03Å; F529-V551 PolarHBondContact O-N 3.17Å; F531-V551 HydrophobicContact CE1-CG2 3.97Å; V551-I553 HydrophobicContact CG1-CG1 4.19Å
552	I	95.9	Very high	94.2	Very high	33 Å²	33	42.6 Å²	42.6	17%	0.169	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	127.7	168.2	-58.7	-178.3	0	0	0	107.2	Q459 V460 I461 V462 A528 R550	Q459-I552 VanDerWaalsContact CD-CD1 3.45Å; Q459-I552 HydrophobicContact CG-CD1 4Å; Q459-I552 HydrophobicContact CG-CG1 4.27Å; V460-I552 PolarHBondContact O-N 2.76Å; I461-I552 WeakPolarHBondContact CA-O 3.41Å; I461-I552 HydrophobicContact CG1-CB 4.38Å; V462-I552 PolarHBondContact N-O 3.3Å; A528-I552 HydrophobicContact CB-CG1 4.48Å; R550-I552 HydrophobicContact CG-CG1 4.06Å
553	I	95.6	Very high	94.1	Very high	2 Å²	2	40.6 Å²	40.6	1%	0.01	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	116.6	179.9	-67.8	151.7	0	0	0	107	V462 E464 F521 H523 T526 K527 F529 V551	V462-I553 CarbonylContact O-C 3.51Å; V462-I553 WeakPolarHBondContact O-CA 3.32Å; E464-I553 HydrophobicContact CB-CG2 3.71Å; F521-I553 HydrophobicContact CB-CD1 3.62Å; F521-I553 HydrophobicContact CB-CG1 3.83Å; F521-I553 HydrophobicContact CB-CG2 4.17Å; F521-I553 HydrophobicContact CD1-CD1 4.37Å; F521-I553 HydrophobicContact CD2-CD1 4.16Å; F521-I553 HydrophobicContact CD2-CG1 3.98Å; F521-I553 HydrophobicContact CG-CD1 3.8Å; F521-I553 HydrophobicContact CG-CG1 4.05Å; H523-I553 HydrophobicContact CB-CG2 4.09Å; H523-I553 PolarHBondContact CE1-O 3.19Å; H523-I553 PolarHBondContact ND1-O 2.8Å; T526-I553 HydrophobicContact CG2-CD1 4.21Å; T526-I553 WeakPolarHBondContact O-CD1 3.35Å; K527-I553 PolarHBondContact O-N 2.82Å; F529-I553 HydrophobicContact CD1-CD1 4.02Å; F529-I553 HydrophobicContact CE1-CD1 3.96Å; V551-I553 HydrophobicContact CG1-CG1 4.19Å
554	L	93.3	Very high	93.9	Very high	81 Å²	81	40.8 Å²	40.8	42%	0.424	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	132.7	174.9	-62.7	-176.9	0	0	0	110.2	I461 V462 E464	I461-L554 HydrophobicContact CG2-CD1 3.49Å; I461-L554 VanDerWaalsContact CG2-CD1 3.49Å; I461-L554 HydrophobicContact CG2-CD2 3.72Å; I461-L554 HydrophobicContact CG2-CG 3.42Å; I461-L554 VanDerWaalsContact CG2-CG 3.42Å; V462-L554 PolarHBondContact O-N 2.66Å; E464-L554 PolarHBondContact N-O 3.31Å
555	D	92.4	Very high	93.6	Very high	28 Å²	28	36.7 Å²	36.7	15%	0.15	21%	0.205	C	C	.	.	P	Polyproline II helix	trans	-55.9	136	171.1	-165.2	99.2	0	0	0	112.4	E464 H523 E597 N600	E464-D555 VanDerWaalsContact OE1-CA 3.23Å; E464-D555 WeakPolarHBondContact OE1-CA 3.48Å; H523-D555 IonicContact CD2-OD1 2.73Å; H523-D555 PolarHBondContact CD2-OD1 3.1Å; H523-D555 IonicContact CG-OD1 2.71Å; H523-D555 IonicContact NE2-OD1 3.81Å; H523-D555 PolarHBondContact NE2-OD1 2.83Å; D555-E597 HydrophobicContact CB-CB 4.42Å; D555-E597 VanDerWaalsContact CG-N 3.29Å; D555-E597 WeakPolarHBondContact OD1-CB 3.47Å; D555-E597 PolarHBondContact OD1-N 2.86Å; D555-E597 PolarHBondContact OD2-N 3.19Å; D555-N600 WeakPolarHBondContact OD2-CB 3.32Å; D555-N600 PolarHBondContact OD2-ND2 2.96Å
556	V	91.6	Very high	93.2	Very high	44 Å²	44	36.5 Å²	36.5	27%	0.267	20%	0.203	S	C	.	.			trans	-137.1	124.5	176.4	175.7	0	0	0	0	108.7	Q463 E464 D558	Q463-V556 HydrophobicContact CB-CG2 4.08Å; E464-V556 HydrophobicContact CG-CB 3.89Å; E464-V556 HydrophobicContact CG-CG2 4.03Å; E464-V556 PolarHBondContact OE1-N 3.35Å; V556-D558 WeakPolarHBondContact O-CB 3.32Å; V556-D558 PolarHBondContact O-N 3.45Å
557	N	91.6	Very high	92.7	Very high	14 Å²	14	37.9 Å²	37.9	8%	0.075	22%	0.217	C	C	.	.	S	Bend	trans	-54.2	89.5	-177.3	-152.1	106.4	0	0	0	113.5	D596 N600 D646 G648 L652	N557-D596 VanDerWaalsContact CA-OD2 3.23Å; N557-D596 WeakPolarHBondContact CA-OD2 3.43Å; N557-N600 HydrophobicContact CB-CB 4.01Å; N557-N600 PolarHBondContact N-ND2 3Å; N557-N600 WeakPolarHBondContact OD1-CA 3.22Å; N557-N600 WeakPolarHBondContact OD1-CB 3.35Å; N557-N600 PolarHBondContact OD1-O 3.01Å; N557-D646 PolarHBondContact ND2-OD2 2.74Å; N557-D646 PolarHBondContact OD1-OD2 3.34Å; N557-G648 WeakPolarHBondContact OD1-CA 3.44Å; N557-L652 WeakPolarHBondContact ND2-CD1 3.27Å; N557-L652 WeakPolarHBondContact ND2-CG 3.46Å
558	D	89.4	Confident	92.4	Very high	68 Å²	68	40.7 Å²	40.7	36%	0.364	23%	0.231	S	C	.	.			trans	-130.1	-21.7	-174.3	105.8	-30	0	0	0	113.2	N465 V556 D596	N465-D558 PolarHBondContact ND2-OD2 3.42Å; V556-D558 WeakPolarHBondContact O-CB 3.32Å; V556-D558 PolarHBondContact O-N 3.45Å; D558-D596 PolarHBondContact N-OD2 2.89Å; D558-D596 VanDerWaalsContact N-OD2 3.09Å
559	N	90.8	Very high	91.8	Very high	43 Å²	43	45.5 Å²	45.5	23%	0.23	25%	0.254	C	S	.	.	S	Bend	trans	-78.2	166.8	161.4	-66.8	-78.8	0	0	0	110.3	E524 D596 L652	E524-N559 VanDerWaalsContact CD-ND2 3.34Å; E524-N559 PolarHBondContact OE2-ND2 3.26Å; N559-D596 WeakPolarHBondContact CB-OD1 3.33Å; N559-D596 PolarHBondContact N-OD2 3.11Å; N559-D596 PolarHBondContact ND2-OD1 2.93Å; N559-L652 WeakPolarHBondContact O-CD1 3.3Å
560	T	91.3	Very high	91.2	Very high	58 Å²	58	53.2 Å²	53.2	36%	0.356	30%	0.296	S	S	.	.			trans	-132.3	137.9	-178.6	-62.5	0	0	0	0	108.8	V562 L652	T560-V562 WeakPolarHBondContact O-CG2 3.17Å; T560-V562 PolarHBondContact O-N 3.41Å; T560-V562 VanDerWaalsContact O-N 3.15Å; T560-L652 HydrophobicContact CG2-CB 4.14Å
561	P	93.6	Very high	90.5	Very high	1 Å²	1	51 Å²	51	1%	0.006	30%	0.298	C	S	.	.			trans	-58	119.8	-171.5	-29.8	34.9	0	0	0	112.9	A592 D594 V603 A644 D646 A654	P561-A592 HydrophobicContact CB-CB 4.27Å; P561-D594 VanDerWaalsContact CA-OD2 3.25Å; P561-D594 WeakPolarHBondContact CA-OD2 3.49Å; P561-D594 WeakPolarHBondContact CD-OD2 3.47Å; P561-D594 WeakPolarHBondContact CG-OD2 3.4Å; P561-V603 HydrophobicContact CB-CG1 3.92Å; P561-V603 HydrophobicContact CB-CG2 3.85Å; P561-V603 HydrophobicContact CG-CG1 4.24Å; P561-V603 HydrophobicContact CG-CG2 3.99Å; P561-A644 HydrophobicContact CB-CB 4.19Å; P561-D646 HydrophobicContact CG-CB 4.04Å; P561-A654 WeakPolarHBondContact O-CB 3.37Å
562	V	92	Very high	90.2	Very high	72 Å²	72	52.9 Å²	52.9	44%	0.436	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	114.2	-178.5	-176.5	0	0	0	0	109.9	T560 T564 A592 E593	T560-V562 WeakPolarHBondContact O-CG2 3.17Å; T560-V562 PolarHBondContact O-N 3.41Å; T560-V562 VanDerWaalsContact O-N 3.15Å; V562-T564 PolarHBondContact O-N 3.43Å; V562-T564 VanDerWaalsContact O-N 3.16Å; V562-A592 CarbonylContact O-C 3.54Å; V562-A592 WeakPolarHBondContact O-CA 3.22Å; V562-E593 PolarHBondContact N-O 2.81Å; V562-E593 PolarHBondContact O-N 2.92Å
563	I	91.5	Very high	89.9	Confident	14 Å²	14	51.4 Å²	51.4	7%	0.072	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	111.2	174.6	-64.2	169	0	0	0	109.5	A565 L568 V590 K591 A592 A644 A656	I563-A565 WeakPolarHBondContact CG2-O 3.1Å; I563-L568 HydrophobicContact CB-CD1 3.89Å; I563-L568 HydrophobicContact CG2-CD1 3.86Å; I563-L568 HydrophobicContact CG2-CG 4.36Å; I563-V590 HydrophobicContact CG1-CG1 4.5Å; I563-V590 HydrophobicContact CG2-CG1 4.02Å; I563-K591 CarbonylContact C-O 3.54Å; I563-K591 WeakPolarHBondContact CA-O 3.2Å; I563-A592 HydrophobicContact CG1-CB 4.09Å; I563-A644 HydrophobicContact CD1-CB 4.02Å; I563-A644 HydrophobicContact CG1-CB 3.76Å; I563-A656 HydrophobicContact CD1-CB 3.63Å; I563-A656 HydrophobicContact CG2-CB 4.44Å
564	T	90.2	Very high	89.6	Confident	62 Å²	62	56.6 Å²	56.6	38%	0.38	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	-23.6	-177	52.9	0	0	0	0	113.4	V562 K591 E593	V562-T564 PolarHBondContact O-N 3.43Å; V562-T564 VanDerWaalsContact O-N 3.16Å; T564-K591 PolarHBondContact N-O 2.85Å; T564-K591 PolarHBondContact OG1-O 2.97Å; T564-E593 HydrophobicContact CG2-CB 4.24Å; T564-E593 HydrophobicContact CG2-CG 4.07Å
565	A	89.6	Confident	89.4	Confident	33 Å²	33	53.5 Å²	53.5	27%	0.273	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	146.3	172.6	0	0	0	0	0	111	I563 V590 K591	I563-A565 WeakPolarHBondContact CG2-O 3.1Å; A565-V590 CarbonylContact O-C 3.5Å; A565-V590 VanDerWaalsContact O-CA 3.29Å; A565-V590 WeakPolarHBondContact O-CA 3.36Å; A565-K591 HydrophobicContact CB-CB 3.98Å; A565-K591 PolarHBondContact N-O 2.86Å; A565-K591 VanDerWaalsContact N-O 3.09Å; A565-K591 PolarHBondContact O-N 3.2Å
566	P	88.3	Confident	89.2	Confident	16 Å²	16	58.8 Å²	58.8	10%	0.104	33%	0.331	C	S	.	.	S	Bend	cis	-59	154.3	-14.9	28	-35.6	0	0	0	111.6	L568 A573 T588	P566-L568 PolarHBondContact O-N 3.47Å; P566-A573 HydrophobicContact CB-CB 3.97Å; P566-A573 HydrophobicContact CG-CB 3.56Å; P566-T588 HydrophobicContact CG-CG2 4.42Å
567	P	86.7	Confident	88.9	Confident	110 Å²	110	56.8 Å²	56.8	71%	0.714	32%	0.318	S	S	*	.	P	Polyproline II helix	trans	-63.6	121.2	-173.8	25.5	-34.5	0	0	0	111.4
568	L	88.4	Confident	88.5	Confident	59 Å²	59	57.8 Å²	57.8	31%	0.309	33%	0.326	S	S	.	.	P	Polyproline II helix	trans	-87.9	135.4	-175.4	-60	173.5	0	0	0	112.1	I563 P566 T572 A573 A656	I563-L568 HydrophobicContact CB-CD1 3.89Å; I563-L568 HydrophobicContact CG2-CD1 3.86Å; I563-L568 HydrophobicContact CG2-CG 4.36Å; P566-L568 PolarHBondContact O-N 3.47Å; L568-T572 WeakPolarHBondContact CA-O 3.34Å; L568-A573 HydrophobicContact CD2-CB 3.81Å; L568-A656 HydrophobicContact CD1-CB 3.88Å; L568-A656 HydrophobicContact CD2-CB 3.64Å; L568-A656 HydrophobicContact CG-CB 4.43Å
569	I	84.8	Confident	88	Confident	132 Å²	132	58.3 Å²	58.3	68%	0.677	32%	0.322	S	S	*	.	B	Isolated β-bridge	trans	-114.4	115.9	167.5	-57.6	177.6	0	0	0	106.6	G571 T572	I569-G571 VanDerWaalsContact C-N 3.27Å; I569-G571 PolarHBondContact O-N 3.48Å; I569-T572 PolarHBondContact N-O 2.91Å; I569-T572 PolarHBondContact O-N 2.95Å
570	N	84.6	Confident	87.4	Confident	164 Å²	164	62.1 Å²	62.1	88%	0.877	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.7	44.3	-175.9	-59.6	-17	0	0	0	113.4	T572	N570-T572 PolarHBondContact O-N 2.99Å
571	G	83.6	Confident	86.9	Confident	36 Å²	36	59.6 Å²	59.6	37%	0.371	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.3	4.6	-178.9	0	0	0	0	0	115.4	I569 L657	I569-G571 VanDerWaalsContact C-N 3.27Å; I569-G571 PolarHBondContact O-N 3.48Å; G571-L657 PolarHBondContact O-N 3.08Å
572	T	89	Confident	86.2	Confident	41 Å²	41	61.1 Å²	61.1	25%	0.252	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	139	-178.7	-51.9	0	0	0	0	111.1	L568 I569 N570 L657 L659	L568-T572 WeakPolarHBondContact CA-O 3.34Å; I569-T572 PolarHBondContact N-O 2.91Å; I569-T572 PolarHBondContact O-N 2.95Å; N570-T572 PolarHBondContact O-N 2.99Å; T572-L657 CarbonylContact C-O 3.57Å; T572-L657 VanDerWaalsContact CA-O 3.24Å; T572-L657 WeakPolarHBondContact CA-O 3.13Å; T572-L657 HydrophobicContact CG2-CB 4.32Å; T572-L657 HydrophobicContact CG2-CD2 4.23Å; T572-L657 HydrophobicContact CG2-CG 4.25Å; T572-L657 WeakPolarHBondContact CG2-O 3.32Å; T572-L659 HydrophobicContact CG2-CD1 3.66Å; T572-L659 HydrophobicContact CG2-CG 3.8Å
573	A	90.1	Very high	85.9	Confident	2 Å²	2	63.5 Å²	63.5	2%	0.017	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	136.4	166.8	0	0	0	0	0	110.4	P566 L568 L657 V658 L659	P566-A573 HydrophobicContact CB-CB 3.97Å; P566-A573 HydrophobicContact CG-CB 3.56Å; L568-A573 HydrophobicContact CD2-CB 3.81Å; A573-L657 PolarHBondContact N-O 3.32Å; A573-V658 WeakPolarHBondContact O-CA 3.34Å; A573-L659 PolarHBondContact O-N 3.28Å
574	E	89.4	Confident	85.6	Confident	110 Å²	110	64.5 Å²	64.5	51%	0.514	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	132.3	169.4	-60.6	-172.2	-177.9	0	0	110.4	Y576 L659 Y661	E574-Y576 HydrophobicContact CB-CE2 3.85Å; E574-Y576 PolarHBondContact OE2-OH 3.12Å; E574-L659 WeakPolarHBondContact CA-O 3.26Å; E574-Y661 HydrophobicContact CB-CE2 4.23Å; E574-Y661 HydrophobicContact CG-CE2 3.99Å
575	V	88.9	Confident	85.5	Confident	17 Å²	17	65.9 Å²	65.9	10%	0.103	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	135.6	177.3	-176.1	0	0	0	0	109	I577 V587 T588 V658 L659 I660 Y661	V575-I577 HydrophobicContact CG1-CG2 4.32Å; V575-V587 HydrophobicContact CB-CG1 4.45Å; V575-V587 HydrophobicContact CG1-CG1 3.77Å; V575-V587 WeakPolarHBondContact CG1-O 3.45Å; V575-T588 HydrophobicContact CG2-CG2 4.36Å; V575-V658 HydrophobicContact CB-CG1 4.45Å; V575-V658 HydrophobicContact CG2-CG1 3.76Å; V575-L659 PolarHBondContact N-O 2.95Å; V575-I660 CarbonylContact O-C 3.54Å; V575-I660 VanDerWaalsContact O-CA 3.32Å; V575-I660 WeakPolarHBondContact O-CA 3.47Å; V575-Y661 PolarHBondContact O-N 3.35Å
576	Y	86.9	Confident	85.5	Confident	139 Å²	139	67.6 Å²	67.6	55%	0.545	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	118.7	-175.5	-67.6	-98.8	0	0	0	109.4	E574 Y661	E574-Y576 HydrophobicContact CB-CE2 3.85Å; E574-Y576 PolarHBondContact OE2-OH 3.12Å; Y576-Y661 HydrophobicContact CD1-CD2 4.42Å; Y576-Y661 HydrophobicContact CD1-CG 4.37Å; Y576-Y661 AromaticContact CE1-CD2 3.86Å; Y576-Y661 HydrophobicContact CE1-CD2 3.86Å; Y576-Y661 AromaticContact CE1-CG 3.95Å; Y576-Y661 HydrophobicContact CE1-CG 3.95Å; Y576-Y661 HydrophobicContact CE2-CD2 4.23Å; Y576-Y661 AromaticContact CZ-CD2 3.74Å
577	I	86.9	Confident	85.5	Confident	1 Å²	1	67.6 Å²	67.6	1%	0.005	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	142.9	179.5	68.1	175.2	0	0	0	111.8	V575 Y585 V587 F615 T626 F630 I660 Y661 L662 S663	V575-I577 HydrophobicContact CG1-CG2 4.32Å; I577-Y585 HydrophobicContact CB-CE1 4Å; I577-Y585 HydrophobicContact CG2-CE1 3.86Å; I577-V587 HydrophobicContact CD1-CG2 4.3Å; I577-V587 HydrophobicContact CG2-CB 4.27Å; I577-V587 HydrophobicContact CG2-CG1 3.87Å; I577-V587 HydrophobicContact CG2-CG2 4.27Å; I577-F615 HydrophobicContact CD1-CE1 4.06Å; I577-F615 HydrophobicContact CD1-CZ 4.41Å; I577-T626 HydrophobicContact CD1-CG2 4.14Å; I577-F630 HydrophobicContact CD1-CE2 3.7Å; I577-F630 HydrophobicContact CD1-CZ 4.05Å; I577-I660 HydrophobicContact CD1-CG2 3.61Å; I577-I660 HydrophobicContact CG1-CG2 3.75Å; I577-I660 HydrophobicContact CG2-CG2 4.3Å; I577-Y661 PolarHBondContact N-O 2.78Å; I577-L662 HydrophobicContact CD1-CD2 3.9Å; I577-L662 HydrophobicContact CG1-CD2 3.67Å; I577-L662 WeakPolarHBondContact O-CA 3.33Å; I577-S663 PolarHBondContact O-N 3.35Å; I577-S663 PolarHBondContact O-OG 3.13Å
578	P	81.8	Confident	85.7	Confident	36 Å²	36	63.4 Å²	63.4	23%	0.234	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.7	138.4	175.1	-23.8	34.9	0	0	0	112.7	N580 S581 Y585 S663	P578-N580 WeakPolarHBondContact CB-OD1 3.49Å; P578-N580 PolarHBondContact O-N 3.09Å; P578-N580 VanDerWaalsContact O-N 3.13Å; P578-S581 VanDerWaalsContact O-CB 3.3Å; P578-S581 WeakPolarHBondContact O-CB 3.24Å; P578-S581 PolarHBondContact O-N 2.73Å; P578-S581 PolarHBondContact O-OG 3.36Å; P578-S581 VanDerWaalsContact O-OG 3.1Å; P578-Y585 WeakPolarHBondContact CD-OH 3.32Å; P578-S663 WeakPolarHBondContact CA-OG 3.44Å
579	R	79.3	Confident	85.9	Confident	78 Å²	78	63.6 Å²	63.6	29%	0.294	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-24.7	174.2	-176.5	173.3	-68.6	-107.4	1.1	113.7	S581 F630 G631 S663	R579-S581 VanDerWaalsContact C-N 3.3Å; R579-S581 PolarHBondContact O-N 3Å; R579-F630 HydrophobicContact CG-CB 4.44Å; R579-G631 PolarHBondContact NH1-O 2.79Å; R579-S663 WeakPolarHBondContact CB-O 3.48Å; R579-S663 PolarHBondContact N-O 2.85Å
580	N	78	Confident	86.2	Confident	124 Å²	124	57.3 Å²	57.3	66%	0.663	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.3	8.4	176	67.3	-24.9	0	0	0	114.4	P578 G582	P578-N580 WeakPolarHBondContact CB-OD1 3.49Å; P578-N580 PolarHBondContact O-N 3.09Å; P578-N580 VanDerWaalsContact O-N 3.13Å; N580-G582 PolarHBondContact O-N 3.28Å; N580-G582 VanDerWaalsContact O-N 3.17Å
581	S	81	Confident	86.6	Confident	4 Å²	4	54.1 Å²	54.1	3%	0.028	29%	0.291	C	S	.	.			trans	-57.6	117.4	172.2	-74.4	0	0	0	0	111.7	P578 R579 Y585	P578-S581 VanDerWaalsContact O-CB 3.3Å; P578-S581 WeakPolarHBondContact O-CB 3.24Å; P578-S581 PolarHBondContact O-N 2.73Å; P578-S581 PolarHBondContact O-OG 3.36Å; P578-S581 VanDerWaalsContact O-OG 3.1Å; R579-S581 VanDerWaalsContact C-N 3.3Å; R579-S581 PolarHBondContact O-N 3Å; S581-Y585 WeakPolarHBondContact OG-CD1 3.32Å; S581-Y585 VanDerWaalsContact OG-CD2 3.31Å; S581-Y585 WeakPolarHBondContact OG-CD2 3.38Å; S581-Y585 WeakPolarHBondContact OG-CE1 3.4Å; S581-Y585 WeakPolarHBondContact OG-CE2 3.34Å
582	G	79.6	Confident	87	Confident	34 Å²	34	52.9 Å²	52.9	35%	0.351	28%	0.277	S	S	.	.			trans	-77	174.9	173.3	0	0	0	0	0	113	N580 G584 Y585 T626	N580-G582 PolarHBondContact O-N 3.28Å; N580-G582 VanDerWaalsContact O-N 3.17Å; G582-G584 PolarHBondContact O-N 2.96Å; G582-Y585 VanDerWaalsContact O-CB 3.28Å; G582-Y585 WeakPolarHBondContact O-CB 3.34Å; G582-Y585 PolarHBondContact O-N 3.12Å; G582-T626 PolarHBondContact O-OG1 3.03Å
583	I	84.9	Confident	87.1	Confident	122 Å²	122	54.7 Å²	54.7	63%	0.626	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	134.8	174.7	-55.9	176.2	0	0	0	109.5	T629	I583-T629 HydrophobicContact CG1-CG2 4.21Å
584	G	84.8	Confident	87.3	Confident	35 Å²	35	55.8 Å²	55.8	36%	0.361	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	86.8	2.1	-177.1	0	0	0	0	0	115	G582 L586 R625 T626	G582-G584 PolarHBondContact O-N 2.96Å; G584-L586 PolarHBondContact O-N 2.79Å; G584-R625 WeakPolarHBondContact O-CD 3.18Å; G584-T626 PolarHBondContact N-O 2.74Å; G584-T626 PolarHBondContact N-OG1 2.88Å
585	Y	88.3	Confident	87.4	Confident	91 Å²	91	57.7 Å²	57.7	36%	0.357	29%	0.292	S	S	.	.			trans	-65.3	128	175.4	179.6	-87.1	0	0	0	110.6	I577 P578 S581 G582 V587 R625 T626	I577-Y585 HydrophobicContact CB-CE1 4Å; I577-Y585 HydrophobicContact CG2-CE1 3.86Å; P578-Y585 WeakPolarHBondContact CD-OH 3.32Å; S581-Y585 WeakPolarHBondContact OG-CD1 3.32Å; S581-Y585 VanDerWaalsContact OG-CD2 3.31Å; S581-Y585 WeakPolarHBondContact OG-CD2 3.38Å; S581-Y585 WeakPolarHBondContact OG-CE1 3.4Å; S581-Y585 WeakPolarHBondContact OG-CE2 3.34Å; G582-Y585 VanDerWaalsContact O-CB 3.28Å; G582-Y585 WeakPolarHBondContact O-CB 3.34Å; G582-Y585 PolarHBondContact O-N 3.12Å; Y585-V587 PolarHBondContact O-N 2.71Å; Y585-R625 WeakPolarHBondContact O-CA 3.34Å; Y585-T626 WeakPolarHBondContact CB-OG1 3.45Å; Y585-T626 HydrophobicContact CD1-CG2 4.47Å; Y585-T626 PolarHBondContact N-OG1 3.36Å; Y585-T626 PolarHBondContact O-N 2.94Å; Y585-T626 PolarHBondContact O-OG1 3.09Å
586	L	89.6	Confident	87.6	Confident	69 Å²	69	57.5 Å²	57.5	36%	0.361	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	117.2	177.8	-179.1	67.2	0	0	0	110.2	G584 T588 V589 E623 R625	G584-L586 PolarHBondContact O-N 2.79Å; L586-T588 WeakPolarHBondContact CD1-O 3.34Å; L586-V589 HydrophobicContact CD1-CG2 4.31Å; L586-V589 HydrophobicContact CD2-CG2 4.31Å; L586-E623 HydrophobicContact CD1-CB 3.71Å; L586-E623 HydrophobicContact CD1-CG 3.81Å; L586-R625 HydrophobicContact CD1-CG 4.46Å
587	V	89.7	Confident	87.8	Confident	15 Å²	15	55.8 Å²	55.8	9%	0.091	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	-55	179.6	176.2	0	0	0	0	110.5	V575 I577 Y585 F615 V624 T626 I660	V575-V587 HydrophobicContact CB-CG1 4.45Å; V575-V587 HydrophobicContact CG1-CG1 3.77Å; V575-V587 WeakPolarHBondContact CG1-O 3.45Å; I577-V587 HydrophobicContact CD1-CG2 4.3Å; I577-V587 HydrophobicContact CG2-CB 4.27Å; I577-V587 HydrophobicContact CG2-CG1 3.87Å; I577-V587 HydrophobicContact CG2-CG2 4.27Å; Y585-V587 PolarHBondContact O-N 2.71Å; V587-F615 HydrophobicContact CG2-CD1 3.81Å; V587-F615 HydrophobicContact CG2-CE1 3.76Å; V587-V624 HydrophobicContact CB-CB 4.31Å; V587-V624 HydrophobicContact CB-CG1 4.07Å; V587-V624 WeakPolarHBondContact CB-O 3.33Å; V587-V624 HydrophobicContact CG1-CG1 4.47Å; V587-V624 HydrophobicContact CG2-CG1 4.36Å; V587-V624 PolarHBondContact N-O 2.85Å; V587-T626 HydrophobicContact CG2-CG2 3.8Å; V587-I660 HydrophobicContact CG1-CD1 3.75Å; V587-I660 HydrophobicContact CG1-CG1 3.95Å; V587-I660 HydrophobicContact CG1-CG2 4.27Å
588	T	90.6	Very high	87.9	Confident	23 Å²	23	58.3 Å²	58.3	14%	0.141	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.1	169	179.7	-169.6	0	0	0	0	109	P566 V575 L586 V590 V624	P566-T588 HydrophobicContact CG-CG2 4.42Å; V575-T588 HydrophobicContact CG2-CG2 4.36Å; L586-T588 WeakPolarHBondContact CD1-O 3.34Å; T588-V590 HydrophobicContact CG2-CG2 4.26Å; T588-V624 HydrophobicContact CG2-CB 4.08Å; T588-V624 HydrophobicContact CG2-CG2 4.03Å; T588-V624 PolarHBondContact O-N 2.7Å
589	V	92.1	Very high	88.3	Confident	62 Å²	62	61.5 Å²	61.5	38%	0.376	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	118.7	166.7	-173.6	0	0	0	0	107.1	L586 N621 E623	L586-V589 HydrophobicContact CD1-CG2 4.31Å; L586-V589 HydrophobicContact CD2-CG2 4.31Å; V589-N621 WeakPolarHBondContact CG1-O 3.44Å; V589-E623 HydrophobicContact CG2-CG 4.14Å
590	V	92.2	Very high	88.7	Confident	1 Å²	1	59.1 Å²	59.1	1%	0.006	32%	0.319	C	S	.	.			trans	-83.5	120.3	171.4	-178.4	0	0	0	0	107.9	I563 A565 T588 Y605 I617 G622 V624 V642	I563-V590 HydrophobicContact CG1-CG1 4.5Å; I563-V590 HydrophobicContact CG2-CG1 4.02Å; A565-V590 CarbonylContact O-C 3.5Å; A565-V590 VanDerWaalsContact O-CA 3.29Å; A565-V590 WeakPolarHBondContact O-CA 3.36Å; T588-V590 HydrophobicContact CG2-CG2 4.26Å; V590-Y605 HydrophobicContact CB-CD1 4.47Å; V590-Y605 HydrophobicContact CG1-CD1 4.03Å; V590-Y605 HydrophobicContact CG1-CE1 4.11Å; V590-I617 HydrophobicContact CB-CD1 4.42Å; V590-I617 HydrophobicContact CG2-CD1 4.44Å; V590-G622 PolarHBondContact N-O 2.84Å; V590-G622 WeakPolarHBondContact O-CA 3.47Å; V590-V624 HydrophobicContact CG2-CG2 3.98Å; V590-V642 HydrophobicContact CB-CG1 4.25Å; V590-V642 HydrophobicContact CG1-CG1 3.94Å; V590-V642 HydrophobicContact CG2-CB 4.44Å; V590-V642 HydrophobicContact CG2-CG1 4.05Å; V590-V642 HydrophobicContact CG2-CG2 4.19Å
591	K	92.6	Very high	89.3	Confident	97 Å²	97	54.3 Å²	54.3	42%	0.422	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	128.6	173.9	-165.2	-162	178.3	-166.6	0	108.5	I563 T564 A565 E593	I563-K591 CarbonylContact C-O 3.54Å; I563-K591 WeakPolarHBondContact CA-O 3.2Å; T564-K591 PolarHBondContact N-O 2.85Å; T564-K591 PolarHBondContact OG1-O 2.97Å; A565-K591 HydrophobicContact CB-CB 3.98Å; A565-K591 PolarHBondContact N-O 2.86Å; A565-K591 VanDerWaalsContact N-O 3.09Å; A565-K591 PolarHBondContact O-N 3.2Å; K591-E593 IonicContact NZ-OE1 3.84Å; K591-E593 PolarHBondContact NZ-OE1 2.68Å
592	A	92	Very high	89.8	Confident	9 Å²	9	58.9 Å²	58.9	7%	0.074	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	155.9	163.7	0	0	0	0	0	110.7	P561 V562 I563 V603 Y605 A644	P561-A592 HydrophobicContact CB-CB 4.27Å; V562-A592 CarbonylContact O-C 3.54Å; V562-A592 WeakPolarHBondContact O-CA 3.22Å; I563-A592 HydrophobicContact CG1-CB 4.09Å; A592-V603 HydrophobicContact CB-CG1 3.98Å; A592-Y605 HydrophobicContact CB-CE1 3.94Å; A592-Y605 PolarHBondContact N-OH 2.98Å; A592-A644 HydrophobicContact CB-CB 3.6Å
593	E	91.3	Very high	90.4	Very high	80 Å²	80	58.4 Å²	58.4	37%	0.374	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	130.2	171.4	-62.3	-175.1	161.6	0	0	107.3	V562 T564 K591	V562-E593 PolarHBondContact N-O 2.81Å; V562-E593 PolarHBondContact O-N 2.92Å; T564-E593 HydrophobicContact CG2-CB 4.24Å; T564-E593 HydrophobicContact CG2-CG 4.07Å; K591-E593 IonicContact NZ-OE1 3.84Å; K591-E593 PolarHBondContact NZ-OE1 2.68Å
594	D	93.3	Very high	90.8	Very high	24 Å²	24	53.2 Å²	53.2	13%	0.128	28%	0.279	C	S	.	.			trans	-110.2	160.2	169	-156.3	-71.2	0	0	0	108.7	P561 D596 V603	P561-D594 VanDerWaalsContact CA-OD2 3.25Å; P561-D594 WeakPolarHBondContact CA-OD2 3.49Å; P561-D594 WeakPolarHBondContact CD-OD2 3.47Å; P561-D594 WeakPolarHBondContact CG-OD2 3.4Å; D594-D596 PolarHBondContact OD1-N 2.81Å; D594-V603 HydrophobicContact CB-CG2 3.87Å
595	Y	91.6	Very high	91.2	Very high	150 Å²	150	52.4 Å²	52.4	59%	0.588	27%	0.265	S	S	*	.			trans	-101.6	-17	-178.3	-66.5	-62.4	0	0	0	113.6
596	D	93.1	Very high	91.3	Very high	13 Å²	13	50.4 Å²	50.4	7%	0.07	26%	0.261	C	S	.	.	S	Bend	trans	-74.5	172.5	-179	-63	-5.8	0	0	0	111.8	N557 D558 N559 D594 N600 G601	N557-D596 VanDerWaalsContact CA-OD2 3.23Å; N557-D596 WeakPolarHBondContact CA-OD2 3.43Å; D558-D596 PolarHBondContact N-OD2 2.89Å; D558-D596 VanDerWaalsContact N-OD2 3.09Å; N559-D596 WeakPolarHBondContact CB-OD1 3.33Å; N559-D596 PolarHBondContact N-OD2 3.11Å; N559-D596 PolarHBondContact ND2-OD1 2.93Å; D594-D596 PolarHBondContact OD1-N 2.81Å; D596-N600 HydrophobicContact CB-CB 3.7Å; D596-G601 VanDerWaalsContact O-CA 3.27Å; D596-G601 WeakPolarHBondContact O-CA 3.47Å
597	E	90.6	Very high	91.3	Very high	103 Å²	103	47.4 Å²	47.4	48%	0.481	25%	0.245	S	C	.	.			trans	-114.7	151.2	-174.5	-172	157	-97.3	0	0	113.8	H523 K527 D555 E599 N600	H523-E597 IonicContact CE1-OE2 2.95Å; H523-E597 IonicContact NE2-OE2 3.25Å; H523-E597 PolarHBondContact NE2-OE2 2.83Å; K527-E597 IonicContact NZ-OE1 3.86Å; K527-E597 PolarHBondContact NZ-OE1 3.45Å; K527-E597 IonicContact NZ-OE2 2.69Å; K527-E597 PolarHBondContact NZ-OE2 3.01Å; D555-E597 HydrophobicContact CB-CB 4.42Å; D555-E597 VanDerWaalsContact CG-N 3.29Å; D555-E597 WeakPolarHBondContact OD1-CB 3.47Å; D555-E597 PolarHBondContact OD1-N 2.86Å; D555-E597 PolarHBondContact OD2-N 3.19Å; E597-E599 PolarHBondContact O-N 3.05Å; E597-N600 PolarHBondContact O-N 3.44Å
598	G	89.2	Confident	91	Very high	54 Å²	54	49.9 Å²	49.9	56%	0.557	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.2	-130.5	177.6	0	0	0	0	0	111.9	N600 R602	G598-N600 VanDerWaalsContact C-N 3.34Å; G598-R602 WeakPolarHBondContact O-CB 3.4Å; G598-R602 PolarHBondContact O-N 2.87Å
599	E	89.9	Confident	90.4	Very high	104 Å²	104	55 Å²	55	49%	0.486	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.1	-22.2	178.6	-64	-62.2	129	0	0	112.9	E597 R602 H647	E597-E599 PolarHBondContact O-N 3.05Å; E599-R602 PolarHBondContact O-N 3.34Å; E599-R602 WeakPolarHBondContact OE2-CD 3.38Å; E599-R602 IonicContact OE2-CZ 3.47Å; E599-R602 IonicContact OE2-NE 3Å; E599-R602 IonicContact OE2-NH1 3.88Å; E599-R602 PolarHBondContact OE2-NH1 2.79Å; E599-H647 HydrophobicContact CB-CB 4.11Å; E599-H647 CarbonylContact O-C 3.54Å; E599-H647 VanDerWaalsContact O-C 3.26Å; E599-H647 WeakPolarHBondContact O-CA 3.24Å; E599-H647 WeakPolarHBondContact O-CB 3.48Å; E599-H647 PolarHBondContact O-N 2.83Å; E599-H647 VanDerWaalsContact O-N 3.16Å; E599-H647 IonicContact OE2-CG 3.76Å
600	N	89.4	Confident	89.8	Confident	28 Å²	28	54.4 Å²	54.4	15%	0.15	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-50.4	175.1	-62.9	-13.6	0	0	0	109.6	D555 N557 D596 E597 G598 R602 D646	D555-N600 WeakPolarHBondContact OD2-CB 3.32Å; D555-N600 PolarHBondContact OD2-ND2 2.96Å; N557-N600 HydrophobicContact CB-CB 4.01Å; N557-N600 PolarHBondContact N-ND2 3Å; N557-N600 WeakPolarHBondContact OD1-CA 3.22Å; N557-N600 WeakPolarHBondContact OD1-CB 3.35Å; N557-N600 PolarHBondContact OD1-O 3.01Å; D596-N600 HydrophobicContact CB-CB 3.7Å; E597-N600 PolarHBondContact O-N 3.44Å; G598-N600 VanDerWaalsContact C-N 3.34Å; N600-R602 PolarHBondContact O-N 2.91Å; N600-R602 VanDerWaalsContact O-N 3.1Å; N600-D646 WeakPolarHBondContact O-CB 3.48Å
601	G	88.7	Confident	89.4	Confident	23 Å²	23	55.8 Å²	55.8	24%	0.237	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.2	1	171.7	0	0	0	0	0	116	D596 V603	D596-G601 VanDerWaalsContact O-CA 3.27Å; D596-G601 WeakPolarHBondContact O-CA 3.47Å; G601-V603 PolarHBondContact O-N 2.85Å
602	R	92	Very high	88.8	Confident	100 Å²	100	56.3 Å²	56.3	38%	0.377	30%	0.296	S	S	.	.			trans	-92.3	93.5	-172	-173.3	173.4	155.7	-86	-35.7	111.5	G598 E599 N600 D646 H647	G598-R602 WeakPolarHBondContact O-CB 3.4Å; G598-R602 PolarHBondContact O-N 2.87Å; E599-R602 PolarHBondContact O-N 3.34Å; E599-R602 WeakPolarHBondContact OE2-CD 3.38Å; E599-R602 IonicContact OE2-CZ 3.47Å; E599-R602 IonicContact OE2-NE 3Å; E599-R602 IonicContact OE2-NH1 3.88Å; E599-R602 PolarHBondContact OE2-NH1 2.79Å; N600-R602 PolarHBondContact O-N 2.91Å; N600-R602 VanDerWaalsContact O-N 3.1Å; R602-D646 CarbonylContact O-C 3.54Å; R602-D646 WeakPolarHBondContact O-CA 3.23Å; R602-H647 PolarHBondContact NH1-CD2 2.83Å; R602-H647 PolarHBondContact NH1-NE2 2.93Å; R602-H647 PolarHBondContact NH2-CD2 2.93Å; R602-H647 PolarHBondContact NH2-NE2 2.82Å; R602-H647 PolarHBondContact O-CD2 2.85Å; R602-H647 VanDerWaalsContact O-CD2 3.31Å; R602-H647 PolarHBondContact O-N 2.84Å
603	V	92.3	Very high	88.2	Confident	24 Å²	24	57.7 Å²	57.7	15%	0.145	31%	0.31	C	S	.	.			trans	-77.9	141.7	179.7	-164.1	0	0	0	0	113	P561 A592 D594 G601 Y605 A644 H645	P561-V603 HydrophobicContact CB-CG1 3.92Å; P561-V603 HydrophobicContact CB-CG2 3.85Å; P561-V603 HydrophobicContact CG-CG1 4.24Å; P561-V603 HydrophobicContact CG-CG2 3.99Å; A592-V603 HydrophobicContact CB-CG1 3.98Å; D594-V603 HydrophobicContact CB-CG2 3.87Å; G601-V603 PolarHBondContact O-N 2.85Å; V603-Y605 HydrophobicContact CG1-CE1 4.33Å; V603-A644 HydrophobicContact CG1-CB 3.8Å; V603-H645 CarbonylContact C-O 3.37Å; V603-H645 WeakPolarHBondContact CA-O 3.39Å
604	T	93	Very high	88	Confident	13 Å²	13	56.5 Å²	56.5	8%	0.08	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	162.3	164.6	47.7	0	0	0	0	110.9	Q619 H645 H647	T604-Q619 WeakPolarHBondContact CA-O 3.01Å; T604-Q619 VanDerWaalsContact CB-O 3.32Å; T604-Q619 WeakPolarHBondContact CB-O 3.44Å; T604-Q619 WeakPolarHBondContact CG2-O 3.4Å; T604-H645 PolarHBondContact N-O 3.04Å; T604-H645 PolarHBondContact O-N 3.15Å; T604-H645 PolarHBondContact OG1-CE1 3.38Å; T604-H645 PolarHBondContact OG1-NE2 2.59Å; T604-H647 VanDerWaalsContact CG2-NE2 3.35Å; T604-H647 WeakPolarHBondContact CG2-NE2 3.47Å; T604-H647 PolarHBondContact OG1-NE2 3.3Å
605	Y	93.1	Very high	87.8	Confident	18 Å²	18	55.6 Å²	55.6	7%	0.071	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	134.4	-171	-49.8	-86.1	0	0	0	112.1	V590 A592 V603 Q619 V643 A644	V590-Y605 HydrophobicContact CB-CD1 4.47Å; V590-Y605 HydrophobicContact CG1-CD1 4.03Å; V590-Y605 HydrophobicContact CG1-CE1 4.11Å; A592-Y605 HydrophobicContact CB-CE1 3.94Å; A592-Y605 PolarHBondContact N-OH 2.98Å; V603-Y605 HydrophobicContact CG1-CE1 4.33Å; Y605-Q619 PolarHBondContact N-O 3.32Å; Y605-Q619 WeakPolarHBondContact O-CA 3.47Å; Y605-Q619 WeakPolarHBondContact O-CG 3.14Å; Y605-V643 WeakPolarHBondContact CA-O 3.33Å; Y605-A644 HydrophobicContact CD1-CB 4.05Å; Y605-A644 HydrophobicContact CE1-CB 4.1Å
606	D	91.8	Very high	87.7	Confident	48 Å²	48	53.1 Å²	53.1	26%	0.257	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	168	162.3	-170.7	21.5	0	0	0	109.2	R612 V643	D606-R612 IonicContact OD1-NH2 2.97Å; D606-R612 PolarHBondContact OD1-NH2 3.01Å; D606-R612 IonicContact OD2-NH2 2.72Å; D606-R612 PolarHBondContact OD2-NH2 3.49Å; D606-V643 PolarHBondContact N-O 2.97Å; D606-V643 PolarHBondContact O-N 3.41Å
607	M	89.1	Confident	87.7	Confident	7 Å²	7	53.5 Å²	53.5	3%	0.034	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	123.7	162.6	-66.2	173.6	-65	0	0	107.3	R612 F615 I617 L640 I641 V642	M607-R612 HydrophobicContact CB-CG 4.05Å; M607-R612 WeakPolarHBondContact O-CD 3.32Å; M607-R612 PolarHBondContact O-NE 2.98Å; M607-R612 PolarHBondContact O-NH1 3.07Å; M607-R612 PolarHBondContact O-NH2 3.24Å; M607-F615 WeakPolarHBondContact CE-O 3.25Å; M607-F615 HydrophobicContact SD-CB 4.48Å; M607-I617 HydrophobicContact CE-CB 4.06Å; M607-I617 HydrophobicContact CE-CG2 4.03Å; M607-I617 HydrophobicContact CG-CB 4.23Å; M607-I617 HydrophobicContact CG-CG2 3.96Å; M607-I617 HydrophobicContact SD-CB 4.3Å; M607-L640 HydrophobicContact SD-CD1 3.77Å; M607-L640 HydrophobicContact SD-CD2 3.9Å; M607-L640 HydrophobicContact SD-CG 4.29Å; M607-I641 CarbonylContact C-O 3.54Å; M607-I641 VanDerWaalsContact CA-O 3.23Å; M607-I641 WeakPolarHBondContact CA-O 3.48Å; M607-V642 HydrophobicContact CG-CG2 4.07Å
608	T	82.4	Confident	87.7	Confident	66 Å²	66	51.8 Å²	51.8	41%	0.405	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	-53.1	178.6	46.1	0	0	0	0	111.2	R612 I641 V643	T608-R612 WeakPolarHBondContact O-CD 3.35Å; T608-R612 PolarHBondContact O-NH1 2.96Å; T608-I641 PolarHBondContact N-O 2.72Å; T608-V643 HydrophobicContact CG2-CB 4.23Å; T608-V643 HydrophobicContact CG2-CG2 3.54Å; T608-V643 WeakPolarHBondContact OG1-CG2 3.16Å
609	E	78.4	Confident	87.8	Confident	131 Å²	131	55.1 Å²	55.1	61%	0.612	29%	0.29	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129.5	172.8	-170.5	-57.9	-168.7	161.3	0	0	113	I641	E609-I641 HydrophobicContact CB-CB 4.31Å; E609-I641 HydrophobicContact CB-CD1 4.16Å; E609-I641 HydrophobicContact CB-CG1 4.33Å; E609-I641 PolarHBondContact O-N 3.49Å
610	G	79.9	Confident	87.8	Confident	50 Å²	50	55.9 Å²	55.9	52%	0.515	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	96.9	-159.4	-179.5	0	0	0	0	0	114.3	R612 E639	G610-R612 PolarHBondContact O-N 3Å; G610-E639 CarbonylContact C-O 3.52Å; G610-E639 WeakPolarHBondContact CA-O 3.12Å
611	D	83.4	Confident	87.8	Confident	29 Å²	29	57.9 Å²	57.9	16%	0.155	31%	0.312	C	S	.	.	S	Bend	trans	-75.5	41.8	-174.2	-76.6	-62.7	0	0	0	114.1	G613 F614 K635 Y638 E639	D611-G613 PolarHBondContact O-N 2.82Å; D611-F614 HydrophobicContact CB-CD2 4.37Å; D611-F614 PolarHBondContact O-N 2.69Å; D611-K635 IonicContact OD1-NZ 2.59Å; D611-K635 PolarHBondContact OD1-NZ 3.46Å; D611-K635 IonicContact OD2-NZ 2.8Å; D611-K635 PolarHBondContact OD2-NZ 3.47Å; D611-Y638 HydrophobicContact CB-CD1 3.72Å; D611-Y638 HydrophobicContact CB-CG 4.47Å; D611-E639 PolarHBondContact N-O 3.03Å; D611-E639 PolarHBondContact OD2-N 3.29Å
612	R	79.8	Confident	87.9	Confident	109 Å²	109	56.8 Å²	56.8	41%	0.411	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.3	-15.5	177.5	-65.7	179.1	72.1	166.9	15.1	114.6	D606 M607 T608 G610 F614 F615	D606-R612 IonicContact OD1-NH2 2.97Å; D606-R612 PolarHBondContact OD1-NH2 3.01Å; D606-R612 IonicContact OD2-NH2 2.72Å; D606-R612 PolarHBondContact OD2-NH2 3.49Å; M607-R612 HydrophobicContact CB-CG 4.05Å; M607-R612 WeakPolarHBondContact O-CD 3.32Å; M607-R612 PolarHBondContact O-NE 2.98Å; M607-R612 PolarHBondContact O-NH1 3.07Å; M607-R612 PolarHBondContact O-NH2 3.24Å; T608-R612 WeakPolarHBondContact O-CD 3.35Å; T608-R612 PolarHBondContact O-NH1 2.96Å; G610-R612 PolarHBondContact O-N 3Å; R612-F614 VanDerWaalsContact C-N 3.27Å; R612-F614 PolarHBondContact O-N 2.8Å; R612-F615 VanDerWaalsContact O-O 3.05Å
613	G	80.1	Confident	87.9	Confident	37 Å²	37	54.1 Å²	54.1	38%	0.381	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68	-20.7	172.9	0	0	0	0	0	114.7	D611 T627 R628	D611-G613 PolarHBondContact O-N 2.82Å; G613-T627 PolarHBondContact O-OG1 2.8Å; G613-R628 WeakPolarHBondContact O-CD 3.47Å; G613-R628 PolarHBondContact O-NE 2.71Å; G613-R628 PolarHBondContact O-NH2 3.32Å
614	F	86.1	Confident	87.9	Confident	56 Å²	56	53 Å²	53	25%	0.246	29%	0.286	C	S	.	.	S	Bend	trans	-109.4	-9.9	-174.9	-68.8	-94.7	0	0	0	114.2	D611 R612 T627 R628 F630 Y638	D611-F614 HydrophobicContact CB-CD2 4.37Å; D611-F614 PolarHBondContact O-N 2.69Å; R612-F614 VanDerWaalsContact C-N 3.27Å; R612-F614 PolarHBondContact O-N 2.8Å; F614-T627 WeakPolarHBondContact CA-OG1 3.46Å; F614-T627 PolarHBondContact O-N 3.29Å; F614-T627 PolarHBondContact O-OG1 2.88Å; F614-R628 HydrophobicContact CD1-CB 4.05Å; F614-R628 HydrophobicContact CD1-CG 4.49Å; F614-F630 HydrophobicContact CB-CE1 4.27Å; F614-F630 HydrophobicContact CD1-CD1 4.28Å; F614-F630 AromaticContact CD1-CE1 3.83Å; F614-F630 HydrophobicContact CD1-CE1 3.83Å; F614-F630 HydrophobicContact CG-CE1 4.38Å; F614-Y638 HydrophobicContact CB-CE1 4.45Å; F614-Y638 AromaticContact CD1-CE1 3.98Å; F614-Y638 HydrophobicContact CD1-CE1 3.98Å; F614-Y638 HydrophobicContact CD2-CD1 4.1Å; F614-Y638 AromaticContact CD2-CE1 3.7Å; F614-Y638 HydrophobicContact CD2-CE1 3.7Å; F614-Y638 HydrophobicContact CE1-CE1 4.1Å; F614-Y638 AromaticContact CE2-CE1 3.83Å; F614-Y638 HydrophobicContact CE2-CE1 3.83Å; F614-Y638 HydrophobicContact CG-CD1 4.24Å; F614-Y638 AromaticContact CG-CE1 3.79Å; F614-Y638 HydrophobicContact CG-CE1 3.79Å; F614-Y638 HydrophobicContact CZ-CE1 4.03Å
615	F	89.9	Confident	87.8	Confident	4 Å²	4	55.7 Å²	55.7	2%	0.018	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	151.4	-173.2	-55.2	-84.1	0	0	0	111.4	I577 V587 M607 R612 V624 R625 T626 T627 F630 Y638 L640 I660	I577-F615 HydrophobicContact CD1-CE1 4.06Å; I577-F615 HydrophobicContact CD1-CZ 4.41Å; V587-F615 HydrophobicContact CG2-CD1 3.81Å; V587-F615 HydrophobicContact CG2-CE1 3.76Å; M607-F615 WeakPolarHBondContact CE-O 3.25Å; M607-F615 HydrophobicContact SD-CB 4.48Å; R612-F615 VanDerWaalsContact O-O 3.05Å; F615-V624 HydrophobicContact CB-CG1 4.35Å; F615-R625 CarbonylContact C-O 3.54Å; F615-R625 WeakPolarHBondContact CA-O 3.18Å; F615-T626 HydrophobicContact CD1-CG2 4.12Å; F615-T626 HydrophobicContact CE1-CG2 3.89Å; F615-T627 PolarHBondContact N-OG1 3.16Å; F615-F630 AromaticContact CE1-CZ 3.88Å; F615-F630 HydrophobicContact CE1-CZ 3.88Å; F615-F630 HydrophobicContact CZ-CE1 4.14Å; F615-F630 AromaticContact CZ-CZ 3.66Å; F615-F630 HydrophobicContact CZ-CZ 3.66Å; F615-Y638 HydrophobicContact CE2-CD1 4.09Å; F615-Y638 HydrophobicContact CE2-CD2 4.49Å; F615-Y638 AromaticContact CE2-CG 3.83Å; F615-Y638 HydrophobicContact CE2-CG 3.83Å; F615-Y638 HydrophobicContact CZ-CD2 4.41Å; F615-Y638 HydrophobicContact CZ-CG 4.19Å; F615-L640 HydrophobicContact CB-CD1 3.85Å; F615-L640 HydrophobicContact CB-CD2 4.33Å; F615-L640 HydrophobicContact CD2-CD1 3.91Å; F615-L640 HydrophobicContact CD2-CD2 3.96Å; F615-L640 HydrophobicContact CD2-CG 4.2Å; F615-L640 HydrophobicContact CG-CD1 3.83Å; F615-L640 HydrophobicContact CG-CD2 4.48Å; F615-I660 HydrophobicContact CD1-CD1 4.03Å; F615-I660 HydrophobicContact CD2-CD1 4.3Å; F615-I660 HydrophobicContact CE1-CD1 3.69Å; F615-I660 HydrophobicContact CE1-CG2 4.24Å; F615-I660 HydrophobicContact CE2-CD1 4Å; F615-I660 HydrophobicContact CG-CD1 4.32Å; F615-I660 HydrophobicContact CZ-CB 4.33Å; F615-I660 HydrophobicContact CZ-CD1 3.67Å; F615-I660 HydrophobicContact CZ-CG2 3.96Å
616	E	89.7	Confident	87.6	Confident	99 Å²	99	54.8 Å²	54.8	46%	0.463	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	154.4	170.6	62.1	-169.3	-176.7	0	0	109.1	V624 R625 T627	E616-V624 CarbonylContact O-C 3.5Å; E616-V624 WeakPolarHBondContact O-CA 3.43Å; E616-R625 HydrophobicContact CG-CB 3.89Å; E616-R625 PolarHBondContact N-O 2.85Å; E616-R625 PolarHBondContact O-N 2.96Å; E616-T627 HydrophobicContact CB-CG2 3.61Å; E616-T627 HydrophobicContact CG-CG2 3.66Å
617	I	92.1	Very high	87.4	Confident	21 Å²	21	54.5 Å²	54.5	11%	0.108	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	135.9	171.2	-164.2	168.6	0	0	0	108.7	V590 M607 E623 V624 V642	V590-I617 HydrophobicContact CB-CD1 4.42Å; V590-I617 HydrophobicContact CG2-CD1 4.44Å; M607-I617 HydrophobicContact CE-CB 4.06Å; M607-I617 HydrophobicContact CE-CG2 4.03Å; M607-I617 HydrophobicContact CG-CB 4.23Å; M607-I617 HydrophobicContact CG-CG2 3.96Å; M607-I617 HydrophobicContact SD-CB 4.3Å; I617-E623 WeakPolarHBondContact CA-O 3.31Å; I617-V624 HydrophobicContact CB-CG2 4.38Å; I617-V624 HydrophobicContact CD1-CG2 3.8Å; I617-V624 HydrophobicContact CG1-CG2 3.9Å; I617-V642 HydrophobicContact CD1-CG1 3.52Å; I617-V642 HydrophobicContact CD1-CG2 4.49Å
618	D	91.8	Very high	87.2	Confident	67 Å²	67	60.6 Å²	60.6	36%	0.358	31%	0.314	S	S	.	.			trans	-76.7	125.3	168.8	-179.6	-69.5	0	0	0	109.6	V620 N621 G622 E623	D618-V620 PolarHBondContact O-N 2.85Å; D618-V620 WeakPolarHBondContact OD1-CA 3.47Å; D618-V620 PolarHBondContact OD1-N 2.87Å; D618-N621 WeakPolarHBondContact CB-OD1 3.3Å; D618-N621 PolarHBondContact OD1-N 3.23Å; D618-N621 PolarHBondContact OD1-OD1 3.28Å; D618-G622 WeakPolarHBondContact O-CA 3.2Å; D618-G622 PolarHBondContact O-N 2.95Å; D618-E623 PolarHBondContact N-O 2.82Å; D618-E623 VanDerWaalsContact N-O 3.11Å
619	Q	91.2	Very high	87.1	Confident	123 Å²	123	62 Å²	62	58%	0.575	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.9	-14.8	-171.2	-57.8	-172.2	-52.2	0	0	114.1	T604 Y605	T604-Q619 WeakPolarHBondContact CA-O 3.01Å; T604-Q619 VanDerWaalsContact CB-O 3.32Å; T604-Q619 WeakPolarHBondContact CB-O 3.44Å; T604-Q619 WeakPolarHBondContact CG2-O 3.4Å; Y605-Q619 PolarHBondContact N-O 3.32Å; Y605-Q619 WeakPolarHBondContact O-CA 3.47Å; Y605-Q619 WeakPolarHBondContact O-CG 3.14Å
620	V	89.1	Confident	87.3	Confident	120 Å²	120	56.2 Å²	56.2	73%	0.727	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.3	-40.5	-172.7	-177.3	0	0	0	0	111.6	D618	D618-V620 PolarHBondContact O-N 2.85Å; D618-V620 WeakPolarHBondContact OD1-CA 3.47Å; D618-V620 PolarHBondContact OD1-N 2.87Å
621	N	90.1	Very high	86.9	Confident	71 Å²	71	55.8 Å²	55.8	38%	0.38	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.8	-9.5	-177.3	82.5	12.3	0	0	0	114.4	V589 D618 E623	V589-N621 WeakPolarHBondContact CG1-O 3.44Å; D618-N621 WeakPolarHBondContact CB-OD1 3.3Å; D618-N621 PolarHBondContact OD1-N 3.23Å; D618-N621 PolarHBondContact OD1-OD1 3.28Å; N621-E623 VanDerWaalsContact C-N 3.27Å; N621-E623 PolarHBondContact ND2-OE2 2.88Å; N621-E623 PolarHBondContact O-N 2.91Å; N621-E623 WeakPolarHBondContact OD1-CB 3.48Å; N621-E623 WeakPolarHBondContact OD1-CG 3.17Å; N621-E623 PolarHBondContact OD1-N 3.2Å
622	G	90.2	Very high	86	Confident	0 Å²	0	63.7 Å²	63.7	0%	0	33%	0.326	C	S	.	.			trans	72.4	10.5	176	0	0	0	0	0	115.4	V590 D618 V624	V590-G622 PolarHBondContact N-O 2.84Å; V590-G622 WeakPolarHBondContact O-CA 3.47Å; D618-G622 WeakPolarHBondContact O-CA 3.2Å; D618-G622 PolarHBondContact O-N 2.95Å; G622-V624 PolarHBondContact O-N 2.93Å
623	E	93.1	Very high	85.4	Confident	44 Å²	44	64.6 Å²	64.6	21%	0.206	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65	114.3	174.6	-73.8	-178.4	122.4	0	0	110.7	L586 V589 I617 D618 N621 R625	L586-E623 HydrophobicContact CD1-CB 3.71Å; L586-E623 HydrophobicContact CD1-CG 3.81Å; V589-E623 HydrophobicContact CG2-CG 4.14Å; I617-E623 WeakPolarHBondContact CA-O 3.31Å; D618-E623 PolarHBondContact N-O 2.82Å; D618-E623 VanDerWaalsContact N-O 3.11Å; N621-E623 VanDerWaalsContact C-N 3.27Å; N621-E623 PolarHBondContact ND2-OE2 2.88Å; N621-E623 PolarHBondContact O-N 2.91Å; N621-E623 WeakPolarHBondContact OD1-CB 3.48Å; N621-E623 WeakPolarHBondContact OD1-CG 3.17Å; N621-E623 PolarHBondContact OD1-N 3.2Å; E623-R625 IonicContact OE1-CZ 2.97Å; E623-R625 IonicContact OE1-NH1 3.33Å; E623-R625 IonicContact OE1-NH2 2.61Å; E623-R625 PolarHBondContact OE1-NH2 2.77Å; E623-R625 IonicContact OE2-CZ 3.68Å; E623-R625 VanDerWaalsContact OE2-CZ 3.25Å; E623-R625 IonicContact OE2-NH1 3.69Å; E623-R625 PolarHBondContact OE2-NH1 2.73Å; E623-R625 IonicContact OE2-NH2 2.78Å; E623-R625 PolarHBondContact OE2-NH2 3.34Å
624	V	91.4	Very high	85.2	Confident	1 Å²	1	64 Å²	64	1%	0.006	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	118.3	171.7	-179.5	0	0	0	0	108.6	V587 T588 V590 F615 E616 I617 G622 L640	V587-V624 HydrophobicContact CB-CB 4.31Å; V587-V624 HydrophobicContact CB-CG1 4.07Å; V587-V624 WeakPolarHBondContact CB-O 3.33Å; V587-V624 HydrophobicContact CG1-CG1 4.47Å; V587-V624 HydrophobicContact CG2-CG1 4.36Å; V587-V624 PolarHBondContact N-O 2.85Å; T588-V624 HydrophobicContact CG2-CB 4.08Å; T588-V624 HydrophobicContact CG2-CG2 4.03Å; T588-V624 PolarHBondContact O-N 2.7Å; V590-V624 HydrophobicContact CG2-CG2 3.98Å; F615-V624 HydrophobicContact CB-CG1 4.35Å; E616-V624 CarbonylContact O-C 3.5Å; E616-V624 WeakPolarHBondContact O-CA 3.43Å; I617-V624 HydrophobicContact CB-CG2 4.38Å; I617-V624 HydrophobicContact CD1-CG2 3.8Å; I617-V624 HydrophobicContact CG1-CG2 3.9Å; G622-V624 PolarHBondContact O-N 2.93Å; V624-L640 HydrophobicContact CG1-CD1 4.07Å
625	R	91.3	Very high	84.9	Confident	68 Å²	68	66.5 Å²	66.5	26%	0.257	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	156.5	179.1	-75.3	-171.9	171.1	88.9	12.5	112.6	G584 Y585 L586 F615 E616 E623	G584-R625 WeakPolarHBondContact O-CD 3.18Å; Y585-R625 WeakPolarHBondContact O-CA 3.34Å; L586-R625 HydrophobicContact CD1-CG 4.46Å; F615-R625 CarbonylContact C-O 3.54Å; F615-R625 WeakPolarHBondContact CA-O 3.18Å; E616-R625 HydrophobicContact CG-CB 3.89Å; E616-R625 PolarHBondContact N-O 2.85Å; E616-R625 PolarHBondContact O-N 2.96Å; E623-R625 IonicContact OE1-CZ 2.97Å; E623-R625 IonicContact OE1-NH1 3.33Å; E623-R625 IonicContact OE1-NH2 2.61Å; E623-R625 PolarHBondContact OE1-NH2 2.77Å; E623-R625 IonicContact OE2-CZ 3.68Å; E623-R625 VanDerWaalsContact OE2-CZ 3.25Å; E623-R625 IonicContact OE2-NH1 3.69Å; E623-R625 PolarHBondContact OE2-NH1 2.73Å; E623-R625 IonicContact OE2-NH2 2.78Å; E623-R625 PolarHBondContact OE2-NH2 3.34Å
626	T	89.6	Confident	84.4	Confident	0 Å²	0	70.4 Å²	70.4	0%	0	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	130.1	173.3	53.2	0	0	0	0	111.5	I577 G582 G584 Y585 V587 F615 F630	I577-T626 HydrophobicContact CD1-CG2 4.14Å; G582-T626 PolarHBondContact O-OG1 3.03Å; G584-T626 PolarHBondContact N-O 2.74Å; G584-T626 PolarHBondContact N-OG1 2.88Å; Y585-T626 WeakPolarHBondContact CB-OG1 3.45Å; Y585-T626 HydrophobicContact CD1-CG2 4.47Å; Y585-T626 PolarHBondContact N-OG1 3.36Å; Y585-T626 PolarHBondContact O-N 2.94Å; Y585-T626 PolarHBondContact O-OG1 3.09Å; V587-T626 HydrophobicContact CG2-CG2 3.8Å; F615-T626 HydrophobicContact CD1-CG2 4.12Å; F615-T626 HydrophobicContact CE1-CG2 3.89Å; T626-F630 HydrophobicContact CG2-CE2 3.76Å; T626-F630 HydrophobicContact CG2-CZ 4.06Å
627	T	87.3	Confident	84.2	Confident	41 Å²	41	67.3 Å²	67.3	25%	0.252	37%	0.367	S	S	.	.	S	Bend	trans	-97.2	-10.3	174.7	58.3	0	0	0	0	113.2	G613 F614 F615 E616	G613-T627 PolarHBondContact O-OG1 2.8Å; F614-T627 WeakPolarHBondContact CA-OG1 3.46Å; F614-T627 PolarHBondContact O-N 3.29Å; F614-T627 PolarHBondContact O-OG1 2.88Å; F615-T627 PolarHBondContact N-OG1 3.16Å; E616-T627 HydrophobicContact CB-CG2 3.61Å; E616-T627 HydrophobicContact CG-CG2 3.66Å
628	R	83.4	Confident	84	Confident	136 Å²	136	66.4 Å²	66.4	51%	0.513	36%	0.362	S	S	.	.	S	Bend	trans	-139.9	159.2	-178.6	-56.6	-170.4	-166.6	-156	3.1	112.1	G613 F614	G613-R628 WeakPolarHBondContact O-CD 3.47Å; G613-R628 PolarHBondContact O-NE 2.71Å; G613-R628 PolarHBondContact O-NH2 3.32Å; F614-R628 HydrophobicContact CD1-CB 4.05Å; F614-R628 HydrophobicContact CD1-CG 4.49Å
629	T	80.6	Confident	83.9	Confident	94 Å²	94	68.2 Å²	68.2	58%	0.577	37%	0.368	S	S	*	.			trans	-87.7	139.8	172.9	53.9	0	0	0	0	111.9	I583 G631	I583-T629 HydrophobicContact CG1-CG2 4.21Å; T629-G631 PolarHBondContact O-N 3.01Å
630	F	82.5	Confident	83.8	Confident	11 Å²	11	62.3 Å²	62.3	5%	0.048	34%	0.341	C	S	.	.			trans	-92.8	91.8	-177.1	-55.3	-75.7	0	0	0	113.4	I577 R579 F614 F615 T626 S634 Y638 L662	I577-F630 HydrophobicContact CD1-CE2 3.7Å; I577-F630 HydrophobicContact CD1-CZ 4.05Å; R579-F630 HydrophobicContact CG-CB 4.44Å; F614-F630 HydrophobicContact CB-CE1 4.27Å; F614-F630 HydrophobicContact CD1-CD1 4.28Å; F614-F630 AromaticContact CD1-CE1 3.83Å; F614-F630 HydrophobicContact CD1-CE1 3.83Å; F614-F630 HydrophobicContact CG-CE1 4.38Å; F615-F630 AromaticContact CE1-CZ 3.88Å; F615-F630 HydrophobicContact CE1-CZ 3.88Å; F615-F630 HydrophobicContact CZ-CE1 4.14Å; F615-F630 AromaticContact CZ-CZ 3.66Å; F615-F630 HydrophobicContact CZ-CZ 3.66Å; T626-F630 HydrophobicContact CG2-CE2 3.76Å; T626-F630 HydrophobicContact CG2-CZ 4.06Å; F630-S634 VanDerWaalsContact C-OG 3.22Å; F630-S634 VanDerWaalsContact CA-OG 3.31Å; F630-S634 WeakPolarHBondContact CA-OG 3.49Å; F630-Y638 AromaticContact CD1-CE2 3.77Å; F630-Y638 HydrophobicContact CD1-CE2 3.77Å; F630-Y638 AromaticContact CD1-CZ 3.8Å; F630-Y638 HydrophobicContact CE1-CD2 4.23Å; F630-Y638 HydrophobicContact CE1-CE1 4.36Å; F630-Y638 AromaticContact CE1-CE2 3.68Å; F630-Y638 HydrophobicContact CE1-CE2 3.68Å; F630-Y638 AromaticContact CE1-CZ 3.75Å; F630-L662 HydrophobicContact CB-CD1 3.62Å; F630-L662 HydrophobicContact CB-CD2 4.4Å; F630-L662 HydrophobicContact CD1-CD1 3.93Å; F630-L662 HydrophobicContact CD1-CD2 4.11Å; F630-L662 HydrophobicContact CD2-CD2 3.84Å; F630-L662 HydrophobicContact CE1-CD2 4.35Å; F630-L662 HydrophobicContact CE2-CD2 4.11Å; F630-L662 HydrophobicContact CG-CD1 3.79Å; F630-L662 HydrophobicContact CG-CD2 3.84Å; F630-L662 HydrophobicContact CG-CG 4.49Å; F630-L662 HydrophobicContact CZ-CD2 4.36Å
631	G	71.6	Confident	83.9	Confident	40 Å²	40	59 Å²	59	41%	0.412	32%	0.318	S	S	.	.			trans	-67.8	177.9	174.5	0	0	0	0	0	114.6	R579 T629 S633 S634	R579-G631 PolarHBondContact NH1-O 2.79Å; T629-G631 PolarHBondContact O-N 3.01Å; G631-S633 VanDerWaalsContact C-N 3.31Å; G631-S633 PolarHBondContact O-N 2.97Å; G631-S634 PolarHBondContact N-OG 3.26Å; G631-S634 WeakPolarHBondContact O-CB 3.29Å; G631-S634 PolarHBondContact O-N 2.81Å; G631-S634 VanDerWaalsContact O-N 3.08Å; G631-S634 PolarHBondContact O-OG 3.41Å
632	E	65.8	Low	84	Confident	195 Å²	195	55.6 Å²	55.6	91%	0.911	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	-37.2	-176.6	-63.6	-174.1	143.8	0	0	113.6	S634	E632-S634 PolarHBondContact O-N 3.05Å
633	S	67.4	Low	84.1	Confident	128 Å²	128	56.3 Å²	56.3	90%	0.895	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.3	10.3	177.7	58.2	0	0	0	0	115.1	G631	G631-S633 VanDerWaalsContact C-N 3.31Å; G631-S633 PolarHBondContact O-N 2.97Å
634	S	75.6	Confident	84.1	Confident	24 Å²	24	54.2 Å²	54.2	17%	0.168	30%	0.295	C	S	.	.	S	Bend	trans	-70.4	149.7	177.7	-62.2	0	0	0	0	112.6	F630 G631 E632 Y638	F630-S634 VanDerWaalsContact C-OG 3.22Å; F630-S634 VanDerWaalsContact CA-OG 3.31Å; F630-S634 WeakPolarHBondContact CA-OG 3.49Å; G631-S634 PolarHBondContact N-OG 3.26Å; G631-S634 WeakPolarHBondContact O-CB 3.29Å; G631-S634 PolarHBondContact O-N 2.81Å; G631-S634 VanDerWaalsContact O-N 3.08Å; G631-S634 PolarHBondContact O-OG 3.41Å; E632-S634 PolarHBondContact O-N 3.05Å; S634-Y638 WeakPolarHBondContact CB-OH 3.39Å
635	K	79.1	Confident	84.1	Confident	110 Å²	110	57 Å²	57	48%	0.478	31%	0.308	S	S	.	.			trans	-53.6	149.3	167.8	-63	178	170.3	177.5	0	110.6	D611 S637 Y638 L662	D611-K635 IonicContact OD1-NZ 2.59Å; D611-K635 PolarHBondContact OD1-NZ 3.46Å; D611-K635 IonicContact OD2-NZ 2.8Å; D611-K635 PolarHBondContact OD2-NZ 3.47Å; K635-S637 VanDerWaalsContact C-N 3.34Å; K635-S637 WeakPolarHBondContact CB-O 3.49Å; K635-S637 WeakPolarHBondContact CD-O 3.19Å; K635-Y638 HydrophobicContact CB-CD2 4.48Å; K635-Y638 HydrophobicContact CB-CE1 4.14Å; K635-Y638 HydrophobicContact CB-CE2 3.97Å; K635-Y638 HydrophobicContact CD-CD1 4.03Å; K635-Y638 HydrophobicContact CD-CE1 3.94Å; K635-Y638 HydrophobicContact CG-CE1 4.26Å; K635-Y638 PolarHBondContact N-OH 2.81Å; K635-Y638 WeakPolarHBondContact O-CE2 3.28Å; K635-L662 WeakPolarHBondContact O-CD1 3.46Å
636	S	79	Confident	84.2	Confident	85 Å²	85	53.9 Å²	53.9	59%	0.594	30%	0.296	S	S	*	.	S	Bend	trans	-72.5	-28.8	171.5	47.7	0	0	0	0	113.1	L662	S636-L662 PolarHBondContact O-N 2.84Å
637	S	85.7	Confident	84.2	Confident	35 Å²	35	57.6 Å²	57.6	25%	0.245	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	150.8	178.3	52.5	0	0	0	0	110.5	K635 I660	K635-S637 VanDerWaalsContact C-N 3.34Å; K635-S637 WeakPolarHBondContact CB-O 3.49Å; K635-S637 WeakPolarHBondContact CD-O 3.19Å; S637-I660 CarbonylContact C-O 3.55Å; S637-I660 VanDerWaalsContact CA-O 3.26Å; S637-I660 WeakPolarHBondContact CA-O 3.07Å
638	Y	88.3	Confident	84.2	Confident	2 Å²	2	56.1 Å²	56.1	1%	0.008	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	149.1	174.7	-66.3	-94.6	0	0	0	109	D611 F614 F615 F630 S634 K635 I660 L662	D611-Y638 HydrophobicContact CB-CD1 3.72Å; D611-Y638 HydrophobicContact CB-CG 4.47Å; F614-Y638 HydrophobicContact CB-CE1 4.45Å; F614-Y638 AromaticContact CD1-CE1 3.98Å; F614-Y638 HydrophobicContact CD1-CE1 3.98Å; F614-Y638 HydrophobicContact CD2-CD1 4.1Å; F614-Y638 AromaticContact CD2-CE1 3.7Å; F614-Y638 HydrophobicContact CD2-CE1 3.7Å; F614-Y638 HydrophobicContact CE1-CE1 4.1Å; F614-Y638 AromaticContact CE2-CE1 3.83Å; F614-Y638 HydrophobicContact CE2-CE1 3.83Å; F614-Y638 HydrophobicContact CG-CD1 4.24Å; F614-Y638 AromaticContact CG-CE1 3.79Å; F614-Y638 HydrophobicContact CG-CE1 3.79Å; F614-Y638 HydrophobicContact CZ-CE1 4.03Å; F615-Y638 HydrophobicContact CE2-CD1 4.09Å; F615-Y638 HydrophobicContact CE2-CD2 4.49Å; F615-Y638 AromaticContact CE2-CG 3.83Å; F615-Y638 HydrophobicContact CE2-CG 3.83Å; F615-Y638 HydrophobicContact CZ-CD2 4.41Å; F615-Y638 HydrophobicContact CZ-CG 4.19Å; F630-Y638 AromaticContact CD1-CE2 3.77Å; F630-Y638 HydrophobicContact CD1-CE2 3.77Å; F630-Y638 AromaticContact CD1-CZ 3.8Å; F630-Y638 HydrophobicContact CE1-CD2 4.23Å; F630-Y638 HydrophobicContact CE1-CE1 4.36Å; F630-Y638 AromaticContact CE1-CE2 3.68Å; F630-Y638 HydrophobicContact CE1-CE2 3.68Å; F630-Y638 AromaticContact CE1-CZ 3.75Å; S634-Y638 WeakPolarHBondContact CB-OH 3.39Å; K635-Y638 HydrophobicContact CB-CD2 4.48Å; K635-Y638 HydrophobicContact CB-CE1 4.14Å; K635-Y638 HydrophobicContact CB-CE2 3.97Å; K635-Y638 HydrophobicContact CD-CD1 4.03Å; K635-Y638 HydrophobicContact CD-CE1 3.94Å; K635-Y638 HydrophobicContact CG-CE1 4.26Å; K635-Y638 PolarHBondContact N-OH 2.81Å; K635-Y638 WeakPolarHBondContact O-CE2 3.28Å; Y638-I660 PolarHBondContact N-O 2.97Å; Y638-I660 PolarHBondContact O-N 3.25Å; Y638-L662 HydrophobicContact CD2-CG 4.41Å; Y638-L662 HydrophobicContact CE2-CD1 3.95Å; Y638-L662 HydrophobicContact CE2-CD2 4.34Å; Y638-L662 HydrophobicContact CE2-CG 4Å
639	E	89.1	Confident	84.1	Confident	104 Å²	104	59.6 Å²	59.6	49%	0.486	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	131.5	-176.3	-54.1	-175.5	167	0	0	108.7	G610 D611 L657 L659	G610-E639 CarbonylContact C-O 3.52Å; G610-E639 WeakPolarHBondContact CA-O 3.12Å; D611-E639 PolarHBondContact N-O 3.03Å; D611-E639 PolarHBondContact OD2-N 3.29Å; E639-L657 HydrophobicContact CB-CD1 4.3Å; E639-L659 HydrophobicContact CB-CD2 4.33Å; E639-L659 HydrophobicContact CG-CD2 3.76Å
640	L	90.1	Very high	84.4	Confident	0 Å²	0	60 Å²	60	0%	0	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	131	174	-64.1	175.7	0	0	0	109.4	M607 F615 V624 V658 I660	M607-L640 HydrophobicContact SD-CD1 3.77Å; M607-L640 HydrophobicContact SD-CD2 3.9Å; M607-L640 HydrophobicContact SD-CG 4.29Å; F615-L640 HydrophobicContact CB-CD1 3.85Å; F615-L640 HydrophobicContact CB-CD2 4.33Å; F615-L640 HydrophobicContact CD2-CD1 3.91Å; F615-L640 HydrophobicContact CD2-CD2 3.96Å; F615-L640 HydrophobicContact CD2-CG 4.2Å; F615-L640 HydrophobicContact CG-CD1 3.83Å; F615-L640 HydrophobicContact CG-CD2 4.48Å; V624-L640 HydrophobicContact CG1-CD1 4.07Å; L640-V658 HydrophobicContact CB-CB 4.44Å; L640-V658 PolarHBondContact N-O 3.5Å; L640-V658 PolarHBondContact O-N 2.78Å; L640-I660 HydrophobicContact CD1-CD1 3.44Å; L640-I660 VanDerWaalsContact CD1-CD1 3.44Å; L640-I660 HydrophobicContact CG-CD1 4.09Å
641	I	90.3	Very high	84.7	Confident	49 Å²	49	62.5 Å²	62.5	25%	0.251	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	103.7	165.2	-57.9	-171.4	0	0	0	107.4	M607 T608 E609 V643 A656 L657	M607-I641 CarbonylContact C-O 3.54Å; M607-I641 VanDerWaalsContact CA-O 3.23Å; M607-I641 WeakPolarHBondContact CA-O 3.48Å; T608-I641 PolarHBondContact N-O 2.72Å; E609-I641 HydrophobicContact CB-CB 4.31Å; E609-I641 HydrophobicContact CB-CD1 4.16Å; E609-I641 HydrophobicContact CB-CG1 4.33Å; E609-I641 PolarHBondContact O-N 3.49Å; I641-V643 HydrophobicContact CG2-CG2 4.31Å; I641-A656 WeakPolarHBondContact CA-O 3.4Å; I641-L657 HydrophobicContact CG1-CD1 4.15Å
642	V	91.7	Very high	85.7	Confident	0 Å²	0	63.3 Å²	63.3	0%	0	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	134.8	172.6	-173.4	0	0	0	0	108.2	V590 M607 I617 S655 A656 V658	V590-V642 HydrophobicContact CB-CG1 4.25Å; V590-V642 HydrophobicContact CG1-CG1 3.94Å; V590-V642 HydrophobicContact CG2-CB 4.44Å; V590-V642 HydrophobicContact CG2-CG1 4.05Å; V590-V642 HydrophobicContact CG2-CG2 4.19Å; M607-V642 HydrophobicContact CG-CG2 4.07Å; I617-V642 HydrophobicContact CD1-CG1 3.52Å; I617-V642 HydrophobicContact CD1-CG2 4.49Å; V642-S655 CarbonylContact O-C 3.57Å; V642-S655 WeakPolarHBondContact O-CA 3.31Å; V642-A656 PolarHBondContact N-O 3.39Å; V642-A656 PolarHBondContact O-N 3.01Å; V642-V658 HydrophobicContact CG2-CG2 3.82Å
643	V	92.4	Very high	87	Confident	16 Å²	16	57.2 Å²	57.2	10%	0.097	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	123.5	176.3	-179.2	0	0	0	0	108.8	Y605 D606 T608 I641 A654	Y605-V643 WeakPolarHBondContact CA-O 3.33Å; D606-V643 PolarHBondContact N-O 2.97Å; D606-V643 PolarHBondContact O-N 3.41Å; T608-V643 HydrophobicContact CG2-CB 4.23Å; T608-V643 HydrophobicContact CG2-CG2 3.54Å; T608-V643 WeakPolarHBondContact OG1-CG2 3.16Å; I641-V643 HydrophobicContact CG2-CG2 4.31Å; V643-A654 WeakPolarHBondContact CA-O 3.36Å
644	A	93	Very high	88.2	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	121.2	164.9	0	0	0	0	0	107.5	P561 I563 A592 V603 Y605 S653 A654	P561-A644 HydrophobicContact CB-CB 4.19Å; I563-A644 HydrophobicContact CD1-CB 4.02Å; I563-A644 HydrophobicContact CG1-CB 3.76Å; A592-A644 HydrophobicContact CB-CB 3.6Å; V603-A644 HydrophobicContact CG1-CB 3.8Å; Y605-A644 HydrophobicContact CD1-CB 4.05Å; Y605-A644 HydrophobicContact CE1-CB 4.1Å; A644-S653 CarbonylContact O-C 3.48Å; A644-S653 WeakPolarHBondContact O-CA 3.47Å; A644-S653 WeakPolarHBondContact O-CB 3.32Å; A644-A654 PolarHBondContact N-O 2.81Å; A644-A654 PolarHBondContact O-N 2.69Å
645	H	92.6	Very high	88.9	Confident	60 Å²	60	55 Å²	55	28%	0.278	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	147.3	175.9	73.3	78.3	0	0	0	110.6	V603 T604 L652	V603-H645 CarbonylContact C-O 3.37Å; V603-H645 WeakPolarHBondContact CA-O 3.39Å; T604-H645 PolarHBondContact N-O 3.04Å; T604-H645 PolarHBondContact O-N 3.15Å; T604-H645 PolarHBondContact OG1-CE1 3.38Å; T604-H645 PolarHBondContact OG1-NE2 2.59Å; H645-L652 WeakPolarHBondContact CA-O 3.19Å
646	D	93.6	Very high	89.5	Confident	1 Å²	1	50 Å²	50	1%	0.005	29%	0.285	C	S	.	.			trans	-77.5	-171.6	177	61.3	44.1	0	0	0	112.8	N557 P561 N600 R602 G648 S651 L652	N557-D646 PolarHBondContact ND2-OD2 2.74Å; N557-D646 PolarHBondContact OD1-OD2 3.34Å; P561-D646 HydrophobicContact CG-CB 4.04Å; N600-D646 WeakPolarHBondContact O-CB 3.48Å; R602-D646 CarbonylContact O-C 3.54Å; R602-D646 WeakPolarHBondContact O-CA 3.23Å; D646-G648 PolarHBondContact OD1-N 2.97Å; D646-S651 PolarHBondContact O-OG 3.29Å; D646-S651 WeakPolarHBondContact OD1-CA 3.34Å; D646-S651 WeakPolarHBondContact OD1-CB 3.31Å; D646-S651 PolarHBondContact OD1-OG 3.5Å; D646-L652 PolarHBondContact N-O 3.1Å; D646-L652 VanDerWaalsContact N-O 3.12Å; D646-L652 PolarHBondContact OD1-N 2.83Å; D646-L652 VanDerWaalsContact OD2-CA 3.32Å; D646-L652 WeakPolarHBondContact OD2-CA 3.19Å; D646-L652 WeakPolarHBondContact OD2-CB 3.46Å; D646-L652 PolarHBondContact OD2-N 3.22Å; D646-L652 VanDerWaalsContact OD2-O 3.1Å
647	H	90.3	Very high	90.1	Very high	78 Å²	78	48.5 Å²	48.5	36%	0.361	27%	0.27	S	S	.	.			trans	-114.7	24.3	166.8	-81	-79.2	0	0	0	112.7	E599 R602 T604	E599-H647 HydrophobicContact CB-CB 4.11Å; E599-H647 CarbonylContact O-C 3.54Å; E599-H647 VanDerWaalsContact O-C 3.26Å; E599-H647 WeakPolarHBondContact O-CA 3.24Å; E599-H647 WeakPolarHBondContact O-CB 3.48Å; E599-H647 PolarHBondContact O-N 2.83Å; E599-H647 VanDerWaalsContact O-N 3.16Å; E599-H647 IonicContact OE2-CG 3.76Å; R602-H647 PolarHBondContact NH1-CD2 2.83Å; R602-H647 PolarHBondContact NH1-NE2 2.93Å; R602-H647 PolarHBondContact NH2-CD2 2.93Å; R602-H647 PolarHBondContact NH2-NE2 2.82Å; R602-H647 PolarHBondContact O-CD2 2.85Å; R602-H647 VanDerWaalsContact O-CD2 3.31Å; R602-H647 PolarHBondContact O-N 2.84Å; T604-H647 VanDerWaalsContact CG2-NE2 3.35Å; T604-H647 WeakPolarHBondContact CG2-NE2 3.47Å; T604-H647 PolarHBondContact OG1-NE2 3.3Å
648	G	87.2	Confident	90.3	Very high	10 Å²	10	47 Å²	47	10%	0.103	26%	0.259	C	S	.	.			trans	-59.9	152.8	176.7	0	0	0	0	0	113.8	N557 D646 T650 S651	N557-G648 WeakPolarHBondContact OD1-CA 3.44Å; D646-G648 PolarHBondContact OD1-N 2.97Å; G648-T650 PolarHBondContact O-N 3.26Å; G648-T650 VanDerWaalsContact O-N 3.15Å; G648-S651 PolarHBondContact O-N 3.17Å
649	K	81.3	Confident	90.3	Very high	209 Å²	209	48 Å²	48	91%	0.909	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	-31.9	177.9	-176.5	-177.9	173.8	-171	0	112.7
650	T	86.2	Confident	90.3	Very high	104 Å²	104	43.1 Å²	43.1	64%	0.638	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-122.6	86.7	166.9	42.2	0	0	0	0	106.7	G648 L652	G648-T650 PolarHBondContact O-N 3.26Å; G648-T650 VanDerWaalsContact O-N 3.15Å; T650-L652 PolarHBondContact O-N 3Å
651	S	89	Confident	90.2	Very high	63 Å²	63	46.4 Å²	46.4	44%	0.441	26%	0.255	S	S	.	.			trans	-63.8	132.2	-166.8	-177.2	0	0	0	0	112.9	D646 G648	D646-S651 PolarHBondContact O-OG 3.29Å; D646-S651 WeakPolarHBondContact OD1-CA 3.34Å; D646-S651 WeakPolarHBondContact OD1-CB 3.31Å; D646-S651 PolarHBondContact OD1-OG 3.5Å; G648-S651 PolarHBondContact O-N 3.17Å
652	L	92.6	Very high	89.8	Confident	57 Å²	57	44.7 Å²	44.7	30%	0.298	25%	0.246	S	C	.	.			trans	-105.2	156.9	175.4	-57.5	176.3	0	0	0	109.4	N557 N559 T560 H645 D646 T650	N557-L652 WeakPolarHBondContact ND2-CD1 3.27Å; N557-L652 WeakPolarHBondContact ND2-CG 3.46Å; N559-L652 WeakPolarHBondContact O-CD1 3.3Å; T560-L652 HydrophobicContact CG2-CB 4.14Å; H645-L652 WeakPolarHBondContact CA-O 3.19Å; D646-L652 PolarHBondContact N-O 3.1Å; D646-L652 VanDerWaalsContact N-O 3.12Å; D646-L652 PolarHBondContact OD1-N 2.83Å; D646-L652 VanDerWaalsContact OD2-CA 3.32Å; D646-L652 WeakPolarHBondContact OD2-CA 3.19Å; D646-L652 WeakPolarHBondContact OD2-CB 3.46Å; D646-L652 PolarHBondContact OD2-N 3.22Å; D646-L652 VanDerWaalsContact OD2-O 3.1Å; T650-L652 PolarHBondContact O-N 3Å
653	S	92.6	Very high	89	Confident	66 Å²	66	46.6 Å²	46.6	46%	0.462	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.9	145.1	-172.2	67.3	0	0	0	0	113	A644	A644-S653 CarbonylContact O-C 3.48Å; A644-S653 WeakPolarHBondContact O-CA 3.47Å; A644-S653 WeakPolarHBondContact O-CB 3.32Å
654	A	91.9	Very high	87.5	Confident	28 Å²	28	50.6 Å²	50.6	23%	0.231	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	143	167.5	0	0	0	0	0	111.4	P561 V643 A644	P561-A654 WeakPolarHBondContact O-CB 3.37Å; V643-A654 WeakPolarHBondContact CA-O 3.36Å; A644-A654 PolarHBondContact N-O 2.81Å; A644-A654 PolarHBondContact O-N 2.69Å
655	S	92	Very high	85.4	Confident	79 Å²	79	53.7 Å²	53.7	55%	0.552	31%	0.311	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.4	140.3	177.4	60	0	0	0	0	111.7	V642	V642-S655 CarbonylContact O-C 3.57Å; V642-S655 WeakPolarHBondContact O-CA 3.31Å
656	A	91	Very high	83.2	Confident	3 Å²	3	58.7 Å²	58.7	3%	0.025	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	136.1	173.6	0	0	0	0	0	111.1	I563 L568 I641 V642	I563-A656 HydrophobicContact CD1-CB 3.63Å; I563-A656 HydrophobicContact CG2-CB 4.44Å; L568-A656 HydrophobicContact CD1-CB 3.88Å; L568-A656 HydrophobicContact CD2-CB 3.64Å; L568-A656 HydrophobicContact CG-CB 4.43Å; I641-A656 WeakPolarHBondContact CA-O 3.4Å; V642-A656 PolarHBondContact N-O 3.39Å; V642-A656 PolarHBondContact O-N 3.01Å
657	L	90.8	Very high	80.6	Confident	55 Å²	55	66.3 Å²	66.3	29%	0.288	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	113.2	171.8	179.9	62.7	0	0	0	109.4	G571 T572 A573 E639 I641 L659	G571-L657 PolarHBondContact O-N 3.08Å; T572-L657 CarbonylContact C-O 3.57Å; T572-L657 VanDerWaalsContact CA-O 3.24Å; T572-L657 WeakPolarHBondContact CA-O 3.13Å; T572-L657 HydrophobicContact CG2-CB 4.32Å; T572-L657 HydrophobicContact CG2-CD2 4.23Å; T572-L657 HydrophobicContact CG2-CG 4.25Å; T572-L657 WeakPolarHBondContact CG2-O 3.32Å; A573-L657 PolarHBondContact N-O 3.32Å; E639-L657 HydrophobicContact CB-CD1 4.3Å; I641-L657 HydrophobicContact CG1-CD1 4.15Å; L657-L659 HydrophobicContact CD1-CD2 4.21Å; L657-L659 HydrophobicContact CD2-CD2 4.05Å; L657-L659 HydrophobicContact CD2-CG 4.42Å; L657-L659 HydrophobicContact CG-CD2 3.97Å; L657-L659 HydrophobicContact CG-CG 4.26Å
658	V	90.4	Very high	78.1	Confident	2 Å²	2	67.5 Å²	67.5	1%	0.012	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	109.8	174.6	-171.5	0	0	0	0	108.7	A573 V575 L640 V642 I660	A573-V658 WeakPolarHBondContact O-CA 3.34Å; V575-V658 HydrophobicContact CB-CG1 4.45Å; V575-V658 HydrophobicContact CG2-CG1 3.76Å; L640-V658 HydrophobicContact CB-CB 4.44Å; L640-V658 PolarHBondContact N-O 3.5Å; L640-V658 PolarHBondContact O-N 2.78Å; V642-V658 HydrophobicContact CG2-CG2 3.82Å; V658-I660 HydrophobicContact CG1-CG1 4.04Å
659	L	88.9	Confident	75.8	Confident	25 Å²	25	74.3 Å²	74.3	13%	0.131	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	113	175.3	-62.5	-179.3	0	0	0	109.2	T572 A573 E574 V575 E639 L657 Y661	T572-L659 HydrophobicContact CG2-CD1 3.66Å; T572-L659 HydrophobicContact CG2-CG 3.8Å; A573-L659 PolarHBondContact O-N 3.28Å; E574-L659 WeakPolarHBondContact CA-O 3.26Å; V575-L659 PolarHBondContact N-O 2.95Å; E639-L659 HydrophobicContact CB-CD2 4.33Å; E639-L659 HydrophobicContact CG-CD2 3.76Å; L657-L659 HydrophobicContact CD1-CD2 4.21Å; L657-L659 HydrophobicContact CD2-CD2 4.05Å; L657-L659 HydrophobicContact CD2-CG 4.42Å; L657-L659 HydrophobicContact CG-CD2 3.97Å; L657-L659 HydrophobicContact CG-CG 4.26Å; L659-Y661 HydrophobicContact CB-CE2 3.94Å
660	I	88.7	Confident	73.9	Confident	0 Å²	0	72.3 Å²	72.3	0%	0	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	110	-176.2	-60	165.8	0	0	0	109.4	V575 I577 V587 F615 S637 Y638 L640 V658	V575-I660 CarbonylContact O-C 3.54Å; V575-I660 VanDerWaalsContact O-CA 3.32Å; V575-I660 WeakPolarHBondContact O-CA 3.47Å; I577-I660 HydrophobicContact CD1-CG2 3.61Å; I577-I660 HydrophobicContact CG1-CG2 3.75Å; I577-I660 HydrophobicContact CG2-CG2 4.3Å; V587-I660 HydrophobicContact CG1-CD1 3.75Å; V587-I660 HydrophobicContact CG1-CG1 3.95Å; V587-I660 HydrophobicContact CG1-CG2 4.27Å; F615-I660 HydrophobicContact CD1-CD1 4.03Å; F615-I660 HydrophobicContact CD2-CD1 4.3Å; F615-I660 HydrophobicContact CE1-CD1 3.69Å; F615-I660 HydrophobicContact CE1-CG2 4.24Å; F615-I660 HydrophobicContact CE2-CD1 4Å; F615-I660 HydrophobicContact CG-CD1 4.32Å; F615-I660 HydrophobicContact CZ-CB 4.33Å; F615-I660 HydrophobicContact CZ-CD1 3.67Å; F615-I660 HydrophobicContact CZ-CG2 3.96Å; S637-I660 CarbonylContact C-O 3.55Å; S637-I660 VanDerWaalsContact CA-O 3.26Å; S637-I660 WeakPolarHBondContact CA-O 3.07Å; Y638-I660 PolarHBondContact N-O 2.97Å; Y638-I660 PolarHBondContact O-N 3.25Å; L640-I660 HydrophobicContact CD1-CD1 3.44Å; L640-I660 VanDerWaalsContact CD1-CD1 3.44Å; L640-I660 HydrophobicContact CG-CD1 4.09Å; V658-I660 HydrophobicContact CG1-CG1 4.04Å
661	Y	86.9	Confident	71.5	Confident	69 Å²	69	73.2 Å²	73.2	27%	0.271	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	132.1	178.6	-65.9	-78.6	0	0	0	111.6	E574 V575 Y576 I577 L659 S663	E574-Y661 HydrophobicContact CB-CE2 4.23Å; E574-Y661 HydrophobicContact CG-CE2 3.99Å; V575-Y661 PolarHBondContact O-N 3.35Å; Y576-Y661 HydrophobicContact CD1-CD2 4.42Å; Y576-Y661 HydrophobicContact CD1-CG 4.37Å; Y576-Y661 AromaticContact CE1-CD2 3.86Å; Y576-Y661 HydrophobicContact CE1-CD2 3.86Å; Y576-Y661 AromaticContact CE1-CG 3.95Å; Y576-Y661 HydrophobicContact CE1-CG 3.95Å; Y576-Y661 HydrophobicContact CE2-CD2 4.23Å; Y576-Y661 AromaticContact CZ-CD2 3.74Å; I577-Y661 PolarHBondContact N-O 2.78Å; L659-Y661 HydrophobicContact CB-CE2 3.94Å; Y661-S663 PolarHBondContact O-N 2.84Å
662	L	83.8	Confident	69	Low	14 Å²	14	79.1 Å²	79.1	7%	0.073	46%	0.46	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	103.5	172.7	-64.9	-167.7	0	0	0	110.7	I577 F630 K635 S636 Y638	I577-L662 HydrophobicContact CD1-CD2 3.9Å; I577-L662 HydrophobicContact CG1-CD2 3.67Å; I577-L662 WeakPolarHBondContact O-CA 3.33Å; F630-L662 HydrophobicContact CB-CD1 3.62Å; F630-L662 HydrophobicContact CB-CD2 4.4Å; F630-L662 HydrophobicContact CD1-CD1 3.93Å; F630-L662 HydrophobicContact CD1-CD2 4.11Å; F630-L662 HydrophobicContact CD2-CD2 3.84Å; F630-L662 HydrophobicContact CE1-CD2 4.35Å; F630-L662 HydrophobicContact CE2-CD2 4.11Å; F630-L662 HydrophobicContact CG-CD1 3.79Å; F630-L662 HydrophobicContact CG-CD2 3.84Å; F630-L662 HydrophobicContact CG-CG 4.49Å; F630-L662 HydrophobicContact CZ-CD2 4.36Å; K635-L662 WeakPolarHBondContact O-CD1 3.46Å; S636-L662 PolarHBondContact O-N 2.84Å; Y638-L662 HydrophobicContact CD2-CG 4.41Å; Y638-L662 HydrophobicContact CE2-CD1 3.95Å; Y638-L662 HydrophobicContact CE2-CD2 4.34Å; Y638-L662 HydrophobicContact CE2-CG 4Å
663	S	73.5	Confident	66.5	Low	40 Å²	40	79.3 Å²	79.3	28%	0.28	48%	0.475	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	143.7	172.3	60.4	0	0	0	0	111.1	I577 P578 R579 Y661	I577-S663 PolarHBondContact O-N 3.35Å; I577-S663 PolarHBondContact O-OG 3.13Å; P578-S663 WeakPolarHBondContact CA-OG 3.44Å; R579-S663 WeakPolarHBondContact CB-O 3.48Å; R579-S663 PolarHBondContact N-O 2.85Å; Y661-S663 PolarHBondContact O-N 2.84Å
664	P	62.3	Low	64.1	Low	99 Å²	99	81.2 Å²	81.2	64%	0.643	49%	0.489	S	S	*	.			trans	-62	141.8	168.9	28.6	-34	0	0	0	109	L666	P664-L666 PolarHBondContact O-N 3.03Å
665	A	48.3	Very low	62.1	Low	65 Å²	65	84.7 Å²	84.7	54%	0.537	51%	0.507	S	S	.	.			trans	-63.2	112.1	-179.9	0	0	0	0	0	110
666	L	45.3	Very low	60.5	Low	165 Å²	165	85.8 Å²	85.8	86%	0.864	51%	0.507	S	S	*	.			trans	-94.5	122.4	168.4	-81.6	164.1	0	0	0	108.2	P664	P664-L666 PolarHBondContact O-N 3.03Å
667	D	39.3	Very low	58.9	Low	161 Å²	161	91.1 Å²	91.1	86%	0.861	53%	0.534	S	S	*	.			trans	-60.7	147.5	172.7	-75.1	-54.6	0	0	0	111.2	Q669	D667-Q669 PolarHBondContact O-N 3.2Å
668	A	38.6	Very low	57.4	Low	103 Å²	103	92 Å²	92	85%	0.851	55%	0.545	S	S	*	.			trans	-75.5	96.9	-172.2	0	0	0	0	0	112.5
669	Q	39.3	Very low	56.1	Low	154 Å²	154	96.8 Å²	96.8	72%	0.72	57%	0.57	S	S	*	*			trans	-142.1	116.5	164.8	-165.1	77.8	23.6	0	0	111.3	D667	D667-Q669 PolarHBondContact O-N 3.2Å
670	E	39.9	Very low	55	Low	166 Å²	166	100.2 Å²	100.2	78%	0.776	59%	0.587	S	S	*	*			trans	41.9	96.7	156.3	-63.6	176.4	117.7	0	0	120.2
671	S	36.7	Very low	53.8	Low	123 Å²	123	106.5 Å²	106.5	86%	0.86	62%	0.615	S	S	*	*			trans	-131.4	40.4	144.9	66.7	0	0	0	0	112.6	G673	S671-G673 PolarHBondContact O-N 2.9Å
672	M	36.3	Very low	53	Low	188 Å²	188	108.5 Å²	108.5	93%	0.926	63%	0.629	S	S	*	*			trans	-66.7	81.7	164.8	-76.7	-165.4	72.7	0	0	110.1	S674	M672-S674 PolarHBondContact O-N 2.63Å
673	G	40.3	Very low	52.3	Low	60 Å²	60	112.7 Å²	112.7	62%	0.619	65%	0.651	S	S	*	*			trans	-52.5	125.1	169.9	0	0	0	0	0	109.3	S671 V675	S671-G673 PolarHBondContact O-N 2.9Å; G673-V675 VanDerWaalsContact C-N 3.35Å; G673-V675 PolarHBondContact O-N 3.21Å
674	S	42.3	Very low	52.1	Low	106 Å²	106	112.9 Å²	112.9	74%	0.741	65%	0.654	S	S	*	*			trans	-70	87.7	-168.2	56.6	0	0	0	0	111.7	M672 N676	M672-S674 PolarHBondContact O-N 2.63Å; S674-N676 PolarHBondContact O-N 3.04Å
675	V	50.3	Low	52.8	Low	102 Å²	102	113.1 Å²	113.1	62%	0.618	65%	0.65	S	S	*	*			trans	-58.9	105.5	169.7	-179.5	0	0	0	0	107.5	G673 L677 I680	G673-V675 VanDerWaalsContact C-N 3.35Å; G673-V675 PolarHBondContact O-N 3.21Å; V675-L677 VanDerWaalsContact C-N 3.35Å; V675-L677 PolarHBondContact O-N 3.25Å; V675-I680 HydrophobicContact CG1-CD1 3.59Å
676	N	57.5	Low	54.1	Low	102 Å²	102	112.1 Å²	112.1	55%	0.545	65%	0.645	S	S	.	*			trans	-64.9	95.8	178.2	-104.3	-77.1	0	0	0	108.7	S674 S678 L679 I680	S674-N676 PolarHBondContact O-N 3.04Å; N676-S678 PolarHBondContact O-N 3.49Å; N676-S678 VanDerWaalsContact O-N 3.14Å; N676-L679 HydrophobicContact CB-CB 4Å; N676-L679 WeakPolarHBondContact O-CA 3.23Å; N676-L679 WeakPolarHBondContact O-CB 3.35Å; N676-L679 PolarHBondContact O-N 2.71Å; N676-I680 PolarHBondContact O-N 2.83Å
677	L	58.1	Low	55.5	Low	115 Å²	115	107.3 Å²	107.3	60%	0.602	63%	0.626	S	S	*	*	H	α-helix	trans	-54	-33.6	174.3	-117.9	70.8	0	0	0	110.9	V675 L679 I680 F681	V675-L677 VanDerWaalsContact C-N 3.35Å; V675-L677 PolarHBondContact O-N 3.25Å; L677-L679 VanDerWaalsContact C-N 3.31Å; L677-L679 PolarHBondContact O-N 3.32Å; L677-I680 PolarHBondContact O-N 3.27Å; L677-F681 WeakPolarHBondContact O-CB 3.34Å; L677-F681 PolarHBondContact O-N 2.78Å
678	S	59.6	Low	57.3	Low	74 Å²	74	104.3 Å²	104.3	52%	0.517	61%	0.609	S	S	.	*	H	α-helix	trans	-51.9	-43.6	169.1	-44.5	0	0	0	0	113.2	N676 I682	N676-S678 PolarHBondContact O-N 3.49Å; N676-S678 VanDerWaalsContact O-N 3.14Å; S678-I682 WeakPolarHBondContact O-CB 3.36Å; S678-I682 WeakPolarHBondContact O-CD1 3.42Å; S678-I682 WeakPolarHBondContact O-CG1 3.3Å; S678-I682 PolarHBondContact O-N 2.8Å
679	L	62.5	Low	59.2	Low	102 Å²	102	102 Å²	102	53%	0.534	59%	0.589	S	S	.	*	H	α-helix	trans	-72.2	-40	-179.8	-164	80.7	0	0	0	111.2	N676 L677 I682 I683	N676-L679 HydrophobicContact CB-CB 4Å; N676-L679 WeakPolarHBondContact O-CA 3.23Å; N676-L679 WeakPolarHBondContact O-CB 3.35Å; N676-L679 PolarHBondContact O-N 2.71Å; L677-L679 VanDerWaalsContact C-N 3.31Å; L677-L679 PolarHBondContact O-N 3.32Å; L679-I682 PolarHBondContact O-N 3.48Å; L679-I683 HydrophobicContact CD2-CD1 4.22Å; L679-I683 HydrophobicContact CG-CD1 4.02Å; L679-I683 WeakPolarHBondContact O-CB 3.43Å; L679-I683 VanDerWaalsContact O-CG1 3.29Å; L679-I683 WeakPolarHBondContact O-CG1 3.31Å; L679-I683 PolarHBondContact O-N 3.05Å
680	I	65	Low	61.1	Low	97 Å²	97	96.1 Å²	96.1	50%	0.497	57%	0.571	S	S	.	*	H	α-helix	trans	-65.2	-40.7	174.9	-64.6	178.4	0	0	0	110.4	V675 N676 L677 I683 A684	V675-I680 HydrophobicContact CG1-CD1 3.59Å; N676-I680 PolarHBondContact O-N 2.83Å; L677-I680 PolarHBondContact O-N 3.27Å; I680-I683 PolarHBondContact O-N 2.83Å; I680-A684 WeakPolarHBondContact O-CB 3.24Å; I680-A684 PolarHBondContact O-N 2.85Å
681	F	63.6	Low	63	Low	132 Å²	132	93.7 Å²	93.7	58%	0.579	56%	0.562	S	S	*	*	H	α-helix	trans	-64.5	-40.1	172.2	-96.7	-83	0	0	0	112.6	L677 L685	L677-F681 WeakPolarHBondContact O-CB 3.34Å; L677-F681 PolarHBondContact O-N 2.78Å; F681-L685 WeakPolarHBondContact O-CB 3.21Å; F681-L685 WeakPolarHBondContact O-CD1 3.45Å; F681-L685 WeakPolarHBondContact O-CG 3.4Å; F681-L685 PolarHBondContact O-N 3.29Å
682	I	70.4	Confident	65	Low	111 Å²	111	92.6 Å²	92.6	57%	0.569	55%	0.546	S	S	*	.	H	α-helix	trans	-66.8	-40.5	176.3	-73.7	163.5	0	0	0	111.3	S678 L679 G686	S678-I682 WeakPolarHBondContact O-CB 3.36Å; S678-I682 WeakPolarHBondContact O-CD1 3.42Å; S678-I682 WeakPolarHBondContact O-CG1 3.3Å; S678-I682 PolarHBondContact O-N 2.8Å; L679-I682 PolarHBondContact O-N 3.48Å; I682-G686 WeakPolarHBondContact O-CA 3.48Å; I682-G686 PolarHBondContact O-N 3.07Å
683	I	70.1	Confident	67.1	Low	102 Å²	102	90.6 Å²	90.6	52%	0.523	53%	0.532	S	S	.	.	H	α-helix	trans	-68.5	-45.3	176	-68.8	167.3	0	0	0	110	L679 I680 G686 S687	L679-I683 HydrophobicContact CD2-CD1 4.22Å; L679-I683 HydrophobicContact CG-CD1 4.02Å; L679-I683 WeakPolarHBondContact O-CB 3.43Å; L679-I683 VanDerWaalsContact O-CG1 3.29Å; L679-I683 WeakPolarHBondContact O-CG1 3.31Å; L679-I683 PolarHBondContact O-N 3.05Å; I680-I683 PolarHBondContact O-N 2.83Å; I683-G686 CarbonylContact O-C 3.58Å; I683-G686 PolarHBondContact O-N 3.31Å; I683-S687 PolarHBondContact O-N 2.86Å; I683-S687 PolarHBondContact O-OG 2.97Å; I683-S687 VanDerWaalsContact O-OG 3.07Å
684	A	69.4	Low	68.9	Low	43 Å²	43	92.1 Å²	92.1	36%	0.355	53%	0.529	S	S	.	.	H	α-helix	trans	-63.6	-44.6	177	0	0	0	0	0	112.4	I680 G686 S687 I688	I680-A684 WeakPolarHBondContact O-CB 3.24Å; I680-A684 PolarHBondContact O-N 2.85Å; A684-G686 VanDerWaalsContact C-N 3.31Å; A684-G686 PolarHBondContact O-N 3.28Å; A684-S687 PolarHBondContact O-N 2.78Å; A684-I688 WeakPolarHBondContact O-CB 3.47Å; A684-I688 WeakPolarHBondContact O-CD1 3.46Å; A684-I688 VanDerWaalsContact O-CG1 3.23Å; A684-I688 WeakPolarHBondContact O-CG1 3.21Å; A684-I688 PolarHBondContact O-N 3.28Å
685	L	75.5	Confident	70.4	Confident	105 Å²	105	90.3 Å²	90.3	55%	0.55	51%	0.514	S	S	.	.	H	α-helix	trans	-64.4	-36	172.8	-74.2	166.7	0	0	0	111.5	F681 A689	F681-L685 WeakPolarHBondContact O-CB 3.21Å; F681-L685 WeakPolarHBondContact O-CD1 3.45Å; F681-L685 WeakPolarHBondContact O-CG 3.4Å; F681-L685 PolarHBondContact O-N 3.29Å; L685-A689 WeakPolarHBondContact O-CB 3.37Å; L685-A689 PolarHBondContact O-N 3.42Å
686	G	76.9	Confident	71.7	Confident	43 Å²	43	91.5 Å²	91.5	44%	0.443	51%	0.514	S	S	.	.	H	α-helix	trans	-66.4	-40.7	173.7	0	0	0	0	0	113	I682 I683 A684 G690	I682-G686 WeakPolarHBondContact O-CA 3.48Å; I682-G686 PolarHBondContact O-N 3.07Å; I683-G686 CarbonylContact O-C 3.58Å; I683-G686 PolarHBondContact O-N 3.31Å; A684-G686 VanDerWaalsContact C-N 3.31Å; A684-G686 PolarHBondContact O-N 3.28Å; G686-G690 PolarHBondContact O-N 3Å
687	S	73.8	Confident	72.7	Confident	65 Å²	65	90.2 Å²	90.2	46%	0.455	51%	0.506	S	S	.	.	H	α-helix	trans	-66.2	-45.4	172.8	-61.3	0	0	0	0	111.3	I683 A684 G690 I691	I683-S687 PolarHBondContact O-N 2.86Å; I683-S687 PolarHBondContact O-OG 2.97Å; I683-S687 VanDerWaalsContact O-OG 3.07Å; A684-S687 PolarHBondContact O-N 2.78Å; S687-G690 PolarHBondContact O-N 3.05Å; S687-I691 WeakPolarHBondContact O-CB 3.47Å; S687-I691 WeakPolarHBondContact O-CG1 3.4Å; S687-I691 PolarHBondContact O-N 2.82Å
688	I	78.3	Confident	73.3	Confident	97 Å²	97	92 Å²	92	50%	0.497	51%	0.51	S	S	.	.	H	α-helix	trans	-64.6	-44.5	177.3	-69.2	164.2	0	0	0	110.4	A684 I691 L692	A684-I688 WeakPolarHBondContact O-CB 3.47Å; A684-I688 WeakPolarHBondContact O-CD1 3.46Å; A684-I688 VanDerWaalsContact O-CG1 3.23Å; A684-I688 WeakPolarHBondContact O-CG1 3.21Å; A684-I688 PolarHBondContact O-N 3.28Å; I688-I691 PolarHBondContact O-N 2.96Å; I688-L692 HydrophobicContact CG2-CD1 3.91Å; I688-L692 HydrophobicContact CG2-CG 4.49Å; I688-L692 VanDerWaalsContact O-CB 3.32Å; I688-L692 WeakPolarHBondContact O-CB 3.49Å; I688-L692 VanDerWaalsContact O-CG 3.24Å; I688-L692 WeakPolarHBondContact O-CG 3.2Å; I688-L692 PolarHBondContact O-N 2.86Å
689	A	78.5	Confident	73.8	Confident	54 Å²	54	92.2 Å²	92.2	45%	0.446	51%	0.508	S	S	.	.	H	α-helix	trans	-64.8	-38.2	174.7	0	0	0	0	0	112.1	L685 L692 F693	L685-A689 WeakPolarHBondContact O-CB 3.37Å; L685-A689 PolarHBondContact O-N 3.42Å; A689-L692 PolarHBondContact O-N 3.35Å; A689-F693 WeakPolarHBondContact O-CB 3.2Å; A689-F693 PolarHBondContact O-N 2.85Å
690	G	79.2	Confident	74.1	Confident	32 Å²	32	90 Å²	90	33%	0.33	51%	0.505	S	S	.	.	H	α-helix	trans	-64.5	-44.6	174.4	0	0	0	0	0	112.3	G686 S687 F693 V694	G686-G690 PolarHBondContact O-N 3Å; S687-G690 PolarHBondContact O-N 3.05Å; G690-F693 PolarHBondContact O-N 3.38Å; G690-V694 WeakPolarHBondContact O-CB 3.47Å; G690-V694 WeakPolarHBondContact O-CG2 3.17Å; G690-V694 PolarHBondContact O-N 3.27Å
691	I	79.3	Confident	74.2	Confident	114 Å²	114	90.5 Å²	90.5	59%	0.585	51%	0.507	S	S	*	.	H	α-helix	trans	-65.6	-40.7	174.9	-68.4	165.9	0	0	0	110.5	S687 I688 F693 T695	S687-I691 WeakPolarHBondContact O-CB 3.47Å; S687-I691 WeakPolarHBondContact O-CG1 3.4Å; S687-I691 PolarHBondContact O-N 2.82Å; I688-I691 PolarHBondContact O-N 2.96Å; I691-F693 VanDerWaalsContact C-N 3.34Å; I691-T695 WeakPolarHBondContact O-CB 3.37Å; I691-T695 WeakPolarHBondContact O-CG2 3.29Å; I691-T695 PolarHBondContact O-N 2.79Å; I691-T695 PolarHBondContact O-OG1 3.38Å
692	L	78.3	Confident	74	Confident	101 Å²	101	90.7 Å²	90.7	53%	0.529	51%	0.507	S	S	.	.	H	α-helix	trans	-65.4	-34.9	173.1	-73.9	170.6	0	0	0	112.4	I688 A689 T695 M696	I688-L692 HydrophobicContact CG2-CD1 3.91Å; I688-L692 HydrophobicContact CG2-CG 4.49Å; I688-L692 VanDerWaalsContact O-CB 3.32Å; I688-L692 WeakPolarHBondContact O-CB 3.49Å; I688-L692 VanDerWaalsContact O-CG 3.24Å; I688-L692 WeakPolarHBondContact O-CG 3.2Å; I688-L692 PolarHBondContact O-N 2.86Å; A689-L692 PolarHBondContact O-N 3.35Å; L692-T695 WeakPolarHBondContact CA-OG1 3.43Å; L692-T695 PolarHBondContact O-OG1 3.37Å; L692-M696 WeakPolarHBondContact O-CB 3.24Å; L692-M696 WeakPolarHBondContact O-CG 3.32Å; L692-M696 PolarHBondContact O-N 3.49Å
693	F	80.3	Confident	73.4	Confident	145 Å²	145	89.1 Å²	89.1	64%	0.636	51%	0.505	S	S	*	.	H	α-helix	trans	-73.9	-42	176.9	-171.6	-110.4	0	0	0	111.9	A689 G690 I691 M696 I697	A689-F693 WeakPolarHBondContact O-CB 3.2Å; A689-F693 PolarHBondContact O-N 2.85Å; G690-F693 PolarHBondContact O-N 3.38Å; I691-F693 VanDerWaalsContact C-N 3.34Å; F693-M696 PolarHBondContact O-N 3.23Å; F693-I697 HydrophobicContact CD1-CD1 3.78Å; F693-I697 HydrophobicContact CE1-CD1 3.46Å; F693-I697 VanDerWaalsContact CE1-CD1 3.46Å; F693-I697 HydrophobicContact CE1-CG1 4.49Å; F693-I697 HydrophobicContact CG-CD1 4.48Å; F693-I697 HydrophobicContact CZ-CD1 3.9Å; F693-I697 WeakPolarHBondContact O-CB 3.18Å; F693-I697 WeakPolarHBondContact O-CG1 3.37Å; F693-I697 PolarHBondContact O-N 2.84Å
694	V	77.8	Confident	72.7	Confident	92 Å²	92	93 Å²	93	56%	0.558	52%	0.518	S	S	*	.	H	α-helix	trans	-65.6	-42.9	174.1	170.3	0	0	0	0	111	G690 I697 F698	G690-V694 WeakPolarHBondContact O-CB 3.47Å; G690-V694 WeakPolarHBondContact O-CG2 3.17Å; G690-V694 PolarHBondContact O-N 3.27Å; V694-I697 PolarHBondContact O-N 3.42Å; V694-F698 WeakPolarHBondContact O-CB 3.22Å; V694-F698 PolarHBondContact O-N 2.81Å
695	T	74.9	Confident	71.9	Confident	69 Å²	69	101 Å²	101	42%	0.423	54%	0.54	S	S	.	.	H	α-helix	trans	-68.6	-36.5	174.6	51.7	0	0	0	0	112	I691 L692 F698 V699	I691-T695 WeakPolarHBondContact O-CB 3.37Å; I691-T695 WeakPolarHBondContact O-CG2 3.29Å; I691-T695 PolarHBondContact O-N 2.79Å; I691-T695 PolarHBondContact O-OG1 3.38Å; L692-T695 WeakPolarHBondContact CA-OG1 3.43Å; L692-T695 PolarHBondContact O-OG1 3.37Å; T695-F698 PolarHBondContact O-N 3.4Å; T695-V699 WeakPolarHBondContact O-CB 3.35Å; T695-V699 VanDerWaalsContact O-CG2 3.3Å; T695-V699 WeakPolarHBondContact O-CG2 3.12Å; T695-V699 PolarHBondContact O-N 2.86Å
696	M	77.8	Confident	70.7	Confident	126 Å²	126	100.4 Å²	100.4	62%	0.621	54%	0.537	S	S	*	.	H	α-helix	trans	-65.3	-35.8	170.3	-81.4	-70.6	157.8	0	0	112.8	L692 F693 A700	L692-M696 WeakPolarHBondContact O-CB 3.24Å; L692-M696 WeakPolarHBondContact O-CG 3.32Å; L692-M696 PolarHBondContact O-N 3.49Å; F693-M696 PolarHBondContact O-N 3.23Å; M696-A700 WeakPolarHBondContact O-CB 3.46Å; M696-A700 PolarHBondContact O-N 2.79Å
697	I	78.3	Confident	69.3	Low	75 Å²	75	104 Å²	104	39%	0.385	55%	0.546	S	S	.	.	H	α-helix	trans	-65.5	-42.9	170.9	-77.1	171.1	0	0	0	110.4	F693 V694 A700 I701	F693-I697 HydrophobicContact CD1-CD1 3.78Å; F693-I697 HydrophobicContact CE1-CD1 3.46Å; F693-I697 VanDerWaalsContact CE1-CD1 3.46Å; F693-I697 HydrophobicContact CE1-CG1 4.49Å; F693-I697 HydrophobicContact CG-CD1 4.48Å; F693-I697 HydrophobicContact CZ-CD1 3.9Å; F693-I697 WeakPolarHBondContact O-CB 3.18Å; F693-I697 WeakPolarHBondContact O-CG1 3.37Å; F693-I697 PolarHBondContact O-N 2.84Å; V694-I697 PolarHBondContact O-N 3.42Å; I697-A700 PolarHBondContact O-N 2.95Å; I697-I701 HydrophobicContact CG2-CD1 3.65Å; I697-I701 HydrophobicContact CG2-CG1 4.33Å; I697-I701 WeakPolarHBondContact O-CB 3.11Å; I697-I701 VanDerWaalsContact O-CG1 3.24Å; I697-I701 WeakPolarHBondContact O-CG1 3.33Å; I697-I701 PolarHBondContact O-N 2.83Å
698	F	70.8	Confident	67.8	Low	153 Å²	153	110.2 Å²	110.2	67%	0.671	57%	0.565	S	S	*	*	H	α-helix	trans	-64.7	-41.5	178.3	-150.1	-89.7	0	0	0	111.9	V694 T695 K702	V694-F698 WeakPolarHBondContact O-CB 3.22Å; V694-F698 PolarHBondContact O-N 2.81Å; T695-F698 PolarHBondContact O-N 3.4Å; F698-K702 WeakPolarHBondContact O-CB 3.38Å; F698-K702 PolarHBondContact O-N 3.45Å
699	V	68.5	Low	65.8	Low	78 Å²	78	114.6 Å²	114.6	47%	0.473	58%	0.583	S	S	.	*	H	α-helix	trans	-65.5	-43.8	172.2	169.7	0	0	0	0	111	T695 I701 K702 C703	T695-V699 WeakPolarHBondContact O-CB 3.35Å; T695-V699 VanDerWaalsContact O-CG2 3.3Å; T695-V699 WeakPolarHBondContact O-CG2 3.12Å; T695-V699 PolarHBondContact O-N 2.86Å; V699-I701 PolarHBondContact O-N 3.28Å; V699-K702 PolarHBondContact O-N 3.27Å; V699-C703 VanDerWaalsContact O-CB 3.31Å; V699-C703 WeakPolarHBondContact O-CB 3.43Å; V699-C703 PolarHBondContact O-N 2.82Å; V699-C703 PolarHBondContact O-SG 2.83Å
700	A	68.9	Low	64	Low	57 Å²	57	118 Å²	118	47%	0.471	59%	0.593	S	S	.	*	H	α-helix	trans	-66.3	-36.5	177.8	0	0	0	0	0	112.5	M696 I697 K704	M696-A700 WeakPolarHBondContact O-CB 3.46Å; M696-A700 PolarHBondContact O-N 2.79Å; I697-A700 PolarHBondContact O-N 2.95Å; A700-K704 WeakPolarHBondContact O-CB 3.03Å; A700-K704 PolarHBondContact O-N 2.76Å
701	I	68.4	Low	61.9	Low	107 Å²	107	127.7 Å²	127.7	55%	0.549	62%	0.619	S	S	.	*	H	α-helix	trans	-65	-44.6	172.9	-73.3	167.7	0	0	0	110.1	I697 V699 K704 R705	I697-I701 HydrophobicContact CG2-CD1 3.65Å; I697-I701 HydrophobicContact CG2-CG1 4.33Å; I697-I701 WeakPolarHBondContact O-CB 3.11Å; I697-I701 VanDerWaalsContact O-CG1 3.24Å; I697-I701 WeakPolarHBondContact O-CG1 3.33Å; I697-I701 PolarHBondContact O-N 2.83Å; V699-I701 PolarHBondContact O-N 3.28Å; I701-K704 PolarHBondContact O-N 3.19Å; I701-R705 WeakPolarHBondContact O-CB 3.36Å; I701-R705 PolarHBondContact O-N 3.25Å
702	K	59.3	Low	59.8	Low	135 Å²	135	127.3 Å²	127.3	59%	0.587	62%	0.622	S	S	*	*	H	α-helix	trans	-63.9	-52.8	177.2	-163.5	172.5	-176.4	-180	0	111.4	F698 V699 K704 R705 D706	F698-K702 WeakPolarHBondContact O-CB 3.38Å; F698-K702 PolarHBondContact O-N 3.45Å; V699-K702 PolarHBondContact O-N 3.27Å; K702-K704 VanDerWaalsContact C-N 3.28Å; K702-K704 PolarHBondContact O-N 2.8Å; K702-R705 PolarHBondContact O-N 2.78Å; K702-D706 VanDerWaalsContact O-CG 3.31Å; K702-D706 PolarHBondContact O-N 2.79Å
703	C	56.5	Low	57.6	Low	78 Å²	78	132.4 Å²	132.4	53%	0.527	64%	0.636	S	S	.	*	H	α-helix	trans	-62.7	-29	176.5	-67.2	0	0	0	0	113.5	V699 N707	V699-C703 VanDerWaalsContact O-CB 3.31Å; V699-C703 WeakPolarHBondContact O-CB 3.43Å; V699-C703 PolarHBondContact O-N 2.82Å; V699-C703 PolarHBondContact O-SG 2.83Å; C703-N707 WeakPolarHBondContact O-CB 3.16Å; C703-N707 PolarHBondContact O-N 2.82Å
704	K	57.3	Low	55.3	Low	183 Å²	183	132.8 Å²	132.8	80%	0.796	64%	0.644	S	S	*	*	H	α-helix	trans	-76.7	-28.7	173.4	-174.1	174.7	-179.3	-179	0	112.4	A700 I701 K702	A700-K704 WeakPolarHBondContact O-CB 3.03Å; A700-K704 PolarHBondContact O-N 2.76Å; I701-K704 PolarHBondContact O-N 3.19Å; K702-K704 VanDerWaalsContact C-N 3.28Å; K702-K704 PolarHBondContact O-N 2.8Å
705	R	52.6	Low	53.1	Low	213 Å²	213	134.9 Å²	134.9	80%	0.804	66%	0.662	S	S	*	*	H	α-helix	trans	-75.8	-29.9	172.7	-158.1	167.9	81.7	164	6.5	112.3	I701 K702	I701-R705 WeakPolarHBondContact O-CB 3.36Å; I701-R705 PolarHBondContact O-N 3.25Å; K702-R705 PolarHBondContact O-N 2.78Å
706	D	50.2	Low	51.1	Low	91 Å²	91	136.1 Å²	136.1	49%	0.487	67%	0.673	S	S	.	*	S	Bend	trans	-94.5	5.6	-176.3	-60.2	-17.2	0	0	0	113.9	K702 K708	K702-D706 VanDerWaalsContact O-CG 3.31Å; K702-D706 PolarHBondContact O-N 2.79Å; D706-K708 PolarHBondContact O-N 2.8Å
707	N	46.6	Very low	49	Very low	120 Å²	120	137.5 Å²	137.5	64%	0.642	68%	0.683	S	S	*	*			trans	-99.6	39.4	-178.8	-157.6	16	0	0	0	114.6	C703	C703-N707 WeakPolarHBondContact O-CB 3.16Å; C703-N707 PolarHBondContact O-N 2.82Å
708	K	41.6	Very low	46.6	Very low	194 Å²	194	140 Å²	140	84%	0.843	71%	0.706	S	S	*	*	S	Bend	trans	-153.8	100.8	161.4	-89.6	-165.6	175.3	-172.3	0	108.1	D706	D706-K708 PolarHBondContact O-N 2.8Å
709	E	37.7	Very low	44.9	Very low	190 Å²	190	140.3 Å²	140.3	89%	0.888	71%	0.714	S	S	*	*			cis	-135.5	161.6	-7.2	-72.8	-173.7	110.5	0	0	109.9
710	I	39.3	Very low	43.2	Very low	125 Å²	125	141.7 Å²	141.7	64%	0.641	72%	0.723	S	S	*	*			trans	-117.2	131.4	-173.6	-62.6	169.1	0	0	0	110.8
711	R	36	Very low	41.3	Very low	236 Å²	236	147.1 Å²	147.1	89%	0.891	74%	0.742	S	S	*	*			trans	170.9	132.8	146.5	-93.3	150.5	-169.9	-154.7	2.1	109
712	T	34	Very low	39.5	Very low	106 Å²	106	147.9 Å²	147.9	65%	0.65	75%	0.751	S	S	*	*			cis	-153.6	148.7	2.3	31.7	0	0	0	0	111.2
713	Y	32.4	Very low	38.1	Very low	208 Å²	208	147.6 Å²	147.6	82%	0.816	77%	0.765	S	S	*	*			trans	26	132.9	144.2	-56.3	-65.9	0	0	0	119.8
714	N	33	Very low	36.9	Very low	152 Å²	152	152.4 Å²	152.4	81%	0.813	79%	0.785	S	S	*	*			cis	-160.8	148.7	26.7	-103.8	-21.7	0	0	0	110.8
715	C	30.2	Very low	35.7	Very low	136 Å²	136	152 Å²	152	92%	0.919	79%	0.79	S	S	*	*			trans	-155	151.1	155.8	-154.9	0	0	0	0	110.1
716	S	34.1	Very low	34.5	Very low	95 Å²	95	145.5 Å²	145.5	66%	0.664	79%	0.79	S	S	*	*			trans	-130.1	134.4	-174.3	-174.6	0	0	0	0	111.8
717	N	33	Very low	33.5	Very low	155 Å²	155	147 Å²	147	83%	0.829	81%	0.806	S	S	*	*			trans	55.6	104.5	159.9	-61.2	-1.7	0	0	0	118.7
718	C	29.1	Very low	32.5	Very low	128 Å²	128	150.5 Å²	150.5	87%	0.865	82%	0.816	S	S	*	*			trans	-107.2	112.3	147.9	-179.7	0	0	0	0	108.7
719	L	33.8	Very low	31.9	Very low	160 Å²	160	148.3 Å²	148.3	84%	0.838	81%	0.812	S	S	*	*			trans	-173.5	147.7	168.8	-129.1	70.8	0	0	0	105.4
720	T	33.1	Very low	31.5	Very low	107 Å²	107	148.8 Å²	148.8	66%	0.656	81%	0.811	S	S	*	*			cis	-141.1	158	21	41.2	0	0	0	0	112.8
721	I	28.5	Very low	30.9	Very low	170 Å²	170	146 Å²	146	87%	0.872	81%	0.814	S	S	*	*			trans	-122.5	105.6	147.7	-66.3	178	0	0	0	106.8
722	T	31.6	Very low	30.7	Very low	123 Å²	123	143.8 Å²	143.8	76%	0.755	81%	0.813	S	S	*	*			trans	179.4	105.3	160	11.3	0	0	0	0	110.1
723	C	30.3	Very low	30.5	Very low	130 Å²	130	145.2 Å²	145.2	88%	0.878	82%	0.817	S	S	*	*			trans	179.6	95.9	149.8	-98.2	0	0	0	0	110.4
724	L	30.6	Very low	30.6	Very low	178 Å²	178	140.8 Å²	140.8	93%	0.932	82%	0.816	S	S	*	*			trans	-120.5	75	160.5	-99.5	174.7	0	0	0	108.5
725	L	31.3	Very low	30.6	Very low	174 Å²	174	141.8 Å²	141.8	91%	0.911	81%	0.813	S	S	*	*			trans	-162.9	139.8	164	-135.6	74.5	0	0	0	109.2
726	G	27.5	Very low	30.6	Very low	78 Å²	78	140.2 Å²	140.2	80%	0.804	80%	0.803	S	S	*	*			trans	99	91.1	172.5	0	0	0	0	0	115.8
727	C	30	Very low	30.4	Very low	122 Å²	122	143.4 Å²	143.4	82%	0.824	81%	0.811	S	S	*	*			trans	-84.8	179.3	157.1	-78.6	0	0	0	0	111
728	F	25.8	Very low	30.2	Very low	193 Å²	193	144 Å²	144	85%	0.846	81%	0.809	S	S	*	*			trans	71.9	101.9	167.8	-83.3	-87.7	0	0	0	118.4
729	I	29.8	Very low	30.2	Very low	149 Å²	149	142.4 Å²	142.4	76%	0.764	80%	0.798	S	S	*	*				176.9	150.3	105.1	-91.5	156.8	0	0	0	111.3
730	K	28.2	Very low	29.9	Very low	200 Å²	200	141.5 Å²	141.5	87%	0.87	79%	0.792	S	S	*	*			trans	1.4	140.9	165	-56.7	164.2	-175	172.8	0	118.5
731	G	26.5	Very low	29.7	Very low	67 Å²	67	141.1 Å²	141.1	69%	0.691	79%	0.794	S	S	*	*			cis	121	148.1	9.9	0	0	0	0	0	112.6
732	Q	31	Very low	29.8	Very low	189 Å²	189	139.5 Å²	139.5	88%	0.883	79%	0.792	S	S	*	*			trans	83.6	158.3	-170.1	-57.8	-173.9	-16.3	0	0	116.6
733	N	31.1	Very low	29.7	Very low	136 Å²	136	138.6 Å²	138.6	73%	0.727	79%	0.791	S	S	*	*				176.9	109.9	-56	-106.8	-29.9	0	0	0	111.1
734	S	34.3	Very low	30.5	Very low	114 Å²	114	137.9 Å²	137.9	80%	0.797	78%	0.784	S	S	*	*			trans	-162.9	115.4	153.9	40.6	0	0	0	0	107.1
735	K	33.8	Very low	30.4	Very low	174 Å²	174	137.1 Å²	137.1	76%	0.757	78%	0.78	S	S	*	*			cis	65.1	129.9	39.6	-61.3	-161.5	173.2	-172.2	0	113.1
736	C	29.2	Very low	30.2	Very low	103 Å²	103	132.9 Å²	132.9	70%	0.696	76%	0.764	S	S	*	*			cis	-160	-172	1.5	-120.8	0	0	0	0	112.9
737	L	30	Very low	30.3	Very low	161 Å²	161	137.4 Å²	137.4	84%	0.843	76%	0.764	S	S	*	*			trans	84	127.9	-175.8	-69.3	86.7	0	0	0	114.6
738	H	28.7	Very low	30.2	Very low	169 Å²	169	140.4 Å²	140.4	78%	0.782	77%	0.766	S	S	*	*			cis	-171.4	153.7	-11.7	-145.7	-114.1	0	0	0	108.9
739	C	28.5	Very low	30.1	Very low	93 Å²	93	140.2 Å²	140.2	63%	0.628	77%	0.768	S	S	*	*			cis	-168.1	168	-41.3	-127.3	0	0	0	0	109.4
740	I	28.9	Very low	30	Very low	141 Å²	141	139.1 Å²	139.1	72%	0.723	76%	0.764	S	S	*	*			trans	66.5	109.6	160.2	-62.6	160.7	0	0	0	115.7
741	S	28.5	Very low	30.1	Very low	100 Å²	100	137.5 Å²	137.5	70%	0.699	76%	0.757	S	S	*	*			cis	84.7	136.7	41.7	84.8	0	0	0	0	113.9
742	V	29.5	Very low	30.2	Very low	136 Å²	136	143.8 Å²	143.8	82%	0.824	77%	0.765	S	S	*	*			cis	-146.6	161.2	15.5	-176.3	0	0	0	0	110.9
743	S	30.8	Very low	30.1	Very low	103 Å²	103	141.2 Å²	141.2	72%	0.72	76%	0.763	S	S	*	*			trans	-71.8	175.8	172.2	-37.3	0	0	0	0	114.3
744	P	46	Very low	30	Very low	115 Å²	115	143.2 Å²	143.2	75%	0.747	77%	0.767	S	S	*	*				-123.7	158.7	61	1.1	25	0	0	0	115.3
745	I	29.6	Very low	29.6	Very low	163 Å²	163	144.5 Å²	144.5	84%	0.836	76%	0.761	S	S	*	*				61.3	126.8	86.4	-51	173	0	0	0	113
746	S	26.8	Very low	29.2	Very low	84 Å²	84	143.9 Å²	143.9	59%	0.587	76%	0.758	S	S	*	*			cis	-145.1	178.7	5.8	49	0	0	0	0	113.2
747	E	28.9	Very low	29	Very low	173 Å²	173	145.6 Å²	145.6	81%	0.808	77%	0.765	S	S	*	*			trans	50.1	107.1	155	-67.4	140.9	149.3	0	0	118.2
748	E	27.8	Very low	29	Very low	185 Å²	185	142.5 Å²	142.5	86%	0.864	76%	0.757	S	S	*	*			cis	80.4	78.9	34.1	-160	170.5	-133.7	0	0	116.4
749	Q	25.1	Very low	28.9	Very low	190 Å²	190	141.3 Å²	141.3	89%	0.888	76%	0.756	S	S	*	*				-170.3	125.5	122.8	-103.4	-176	28.9	0	0	110.3
750	D	26.8	Very low	28.9	Very low	125 Å²	125	148.2 Å²	148.2	67%	0.668	77%	0.768	S	S	*	*				171.8	153.6	122	-157.8	9.7	0	0	0	113.5
751	K	30.6	Very low	28.8	Very low	167 Å²	167	145 Å²	145	73%	0.726	77%	0.77	S	S	*	*			trans	49	116.9	158.5	-80.3	160.4	-172	113.4	0	122.6
752	K	28.2	Very low	29.1	Very low	199 Å²	199	149.8 Å²	149.8	87%	0.865	78%	0.779	S	S	*	*				-169.2	164.4	117	-102.8	163.6	-176.7	174.1	0	109.8
753	T	28.4	Very low	29.2	Very low	135 Å²	135	154.6 Å²	154.6	83%	0.828	78%	0.782	S	S	*	*			cis	-151.9	161.1	32.6	-38.9	0	0	0	0	111.9
754	E	28.8	Very low	29.2	Very low	177 Å²	177	157.3 Å²	157.3	83%	0.827	79%	0.787	S	S	*	*			trans	-88.4	154.1	175	-69.5	174.8	106.8	0	0	114.7
755	E	27	Very low	28.4	Very low	141 Å²	141	155.8 Å²	155.8	66%	0.659	78%	0.784	S	S	*	*			trans	45.6	127.7	144	-71.9	-138.2	110	0	0	124.6
756	K	24.3	Very low	28.5	Very low	162 Å²	162	155.6 Å²	155.6	70%	0.704	78%	0.779	S	S	*	*				99.9	130.6	124.1	-90.8	174.4	178.7	130	0	122.5
757	V	25.6	Very low	28.6	Very low	138 Å²	138	163.1 Å²	163.1	84%	0.836	80%	0.797	S	S	*	*			trans	81.1	107.1	155.8	-178.8	0	0	0	0	118.6
758	S	29.4	Very low	28.7	Very low	96 Å²	96	159 Å²	159	67%	0.671	79%	0.786	S	S	*	*			trans	-71.9	157.7	167.7	176.3	0	0	0	0	113.3
759	L	28.1	Very low	28.8	Very low	145 Å²	145	161.7 Å²	161.7	76%	0.759	79%	0.791	S	S	*	*				176.1	131.7	115.7	-89.5	161.3	0	0	0	116
760	R	27.1	Very low	29	Very low	237 Å²	237	156 Å²	156	89%	0.894	78%	0.783	S	S	*	*			trans	78.7	118.3	140.7	-76	170.7	168.2	-154.1	-8.2	124.1
761	G	28.6	Very low	29.1	Very low	74 Å²	74	159 Å²	159	76%	0.763	79%	0.793	S	S	*	*			trans	174.9	150.8	143.5	0	0	0	0	0	110.3
762	K	34.1	Very low	29.1	Very low	201 Å²	201	159.8 Å²	159.8	87%	0.874	80%	0.799	S	S	*	*			cis	-162.4	163.6	-4.9	-106.8	179.4	178.4	176	0	109.3
763	R	31.5	Very low	29.1	Very low	236 Å²	236	159.2 Å²	159.2	89%	0.891	80%	0.797	S	S	*	*			trans	71	133	-175.3	-61.3	-173.6	-89.5	-158.2	-3.4	113.6
764	I	30.8	Very low	29.1	Very low	160 Å²	160	162.6 Å²	162.6	82%	0.821	80%	0.8	S	S	*	*			cis	77.3	91.9	9.8	-44.7	178.8	0	0	0	116.3
765	A	28.6	Very low	29.3	Very low	83 Å²	83	159.4 Å²	159.4	69%	0.686	80%	0.797	S	S	*	*				-121.7	154.4	105.8	0	0	0	0	0	105.8
766	E	31.5	Very low	29.2	Very low	159 Å²	159	157.6 Å²	157.6	74%	0.743	80%	0.8	S	S	*	*				51.7	111.3	59.6	-67.7	-175.7	166.1	0	0	111.1
767	Y	29.8	Very low	29.5	Very low	243 Å²	243	158.8 Å²	158.8	95%	0.953	81%	0.805	S	S	*	*			cis	-61	158.2	11.3	-60.8	-93.5	0	0	0	116.5
768	S	30.8	Very low	29.8	Very low	85 Å²	85	161.8 Å²	161.8	59%	0.594	81%	0.807	S	S	*	*			trans	-156.8	135.4	-161.5	55.6	0	0	0	0	114.4
769	Y	30	Very low	29.8	Very low	242 Å²	242	166.7 Å²	166.7	95%	0.949	82%	0.816	S	S	*	*			trans	-167.9	148.4	144.8	-112.7	-72.7	0	0	0	111.5
770	G	28.5	Very low	29.8	Very low	71 Å²	71	168.4 Å²	168.4	73%	0.732	82%	0.817	S	S	*	*			trans	83.5	87.8	150.6	0	0	0	0	0	119.8
771	H	29	Very low	29.9	Very low	188 Å²	188	163.2 Å²	163.2	87%	0.87	81%	0.806	S	S	*	*			trans	-52.3	161.1	149.2	-80.3	-72.7	0	0	0	111.2
772	Q	31.1	Very low	29.9	Very low	183 Å²	183	164.7 Å²	164.7	86%	0.855	81%	0.805	S	S	*	*				-176.9	161.2	57	-152.2	168.9	63.7	0	0	113.2
773	K	27.5	Very low	29.9	Very low	188 Å²	188	163.6 Å²	163.6	82%	0.817	80%	0.8	S	S	*	*			trans	-85.8	136.3	159.2	-77.2	-173	177.3	-174	0	110.2
774	K	29.5	Very low	30.2	Very low	205 Å²	205	158.3 Å²	158.3	89%	0.891	79%	0.789	S	S	*	*				160	151.2	122.6	-91.2	177	178.8	-178.3	0	112.2
775	S	31.8	Very low	30.2	Very low	111 Å²	111	156.9 Å²	156.9	78%	0.776	78%	0.783	S	S	*	*			trans	-73	145.5	159.9	58.1	0	0	0	0	111.4
776	S	26.6	Very low	30.4	Very low	102 Å²	102	159.1 Å²	159.1	71%	0.713	78%	0.783	S	S	*	*				170.5	153.3	119.5	58.8	0	0	0	0	114.6
777	K	29.6	Very low	30.5	Very low	187 Å²	187	162.1 Å²	162.1	81%	0.813	79%	0.787	S	S	*	*			trans	68.3	97.9	153.7	-69.4	164.5	-178	177.2	0	120.7
778	K	31.9	Very low	30.6	Very low	201 Å²	201	157.1 Å²	157.1	87%	0.874	78%	0.776	S	S	*	*				37.3	113.4	117.3	-62.9	-177.5	176.3	-175.9	0	119.6
779	K	29	Very low	30.6	Very low	199 Å²	199	158.6 Å²	158.6	87%	0.865	78%	0.781	S	S	*	*				-178.9	121.4	124.1	-100.1	168.8	-178.6	-177.8	0	109.5
780	K	29.1	Very low	31.6	Very low	181 Å²	181	152 Å²	152	79%	0.787	77%	0.768	S	S	*	*				76.1	115.2	90.3	-97.2	-161.2	164.9	-163.6	0	115.7
781	I	27.9	Very low	32.1	Very low	129 Å²	129	158.4 Å²	158.4	66%	0.662	77%	0.77	S	S	*	*			trans	63.8	106.5	134.4	-58.7	175.1	0	0	0	116
782	S	29.6	Very low	32.3	Very low	105 Å²	105	154.4 Å²	154.4	73%	0.734	76%	0.755	S	S	*	*				63.3	145.7	88.2	104.6	0	0	0	0	115.2
783	K	34.3	Very low	32.5	Very low	178 Å²	178	151 Å²	151	77%	0.774	75%	0.747	S	S	*	*			cis	-164.3	174.9	9.4	-155.1	-169.3	165.6	-172.9	0	109.9
784	N	38.5	Very low	32.9	Very low	124 Å²	124	149.3 Å²	149.3	66%	0.663	74%	0.742	S	S	*	*			trans	71.7	153.3	162.9	-68.7	10.8	0	0	0	116.8
785	D	29.3	Very low	33.1	Very low	130 Å²	130	147.5 Å²	147.5	70%	0.695	74%	0.736	S	S	*	*			cis	-147.7	178.1	27.3	-113.3	1.1	0	0	0	109.4
786	I	34.3	Very low	33.1	Very low	131 Å²	131	147.9 Å²	147.9	67%	0.672	73%	0.734	S	S	*	*			cis	-177	174	-30.2	-164.4	164.9	0	0	0	109.3
787	R	31.9	Very low	33.3	Very low	221 Å²	221	148.3 Å²	148.3	83%	0.834	73%	0.729	S	S	*	*			trans	82.5	141	179.2	-57.2	-167.4	173	174.3	-1.7	116.1
788	L	31.8	Very low	33.4	Very low	138 Å²	138	146.6 Å²	146.6	72%	0.723	72%	0.721	S	S	*	*			cis	-156.9	122	-9.9	-111.8	170.2	0	0	0	112.1
789	V	31.6	Very low	33.3	Very low	116 Å²	116	144.4 Å²	144.4	70%	0.703	72%	0.716	S	S	*	*				13.2	132.6	129.5	-176.6	0	0	0	0	116.9
790	P	51.9	Low	33.3	Very low	105 Å²	105	141.8 Å²	141.8	68%	0.682	71%	0.712	S	S	*	*				-140.2	140.1	57.9	43	-25.9	0	0	0	117.4
791	R	38.8	Very low	33.3	Very low	204 Å²	204	138.9 Å²	138.9	77%	0.77	71%	0.709	S	S	*	*				82.6	145	102.7	-72.9	-172.8	160.5	-117.2	4.8	115
792	D	33.3	Very low	33.3	Very low	105 Å²	105	138.7 Å²	138.7	56%	0.561	71%	0.713	S	S	*	*			cis	-156.9	154	4.5	-108.1	-20.7	0	0	0	111.3
793	V	33.8	Very low	33.2	Very low	111 Å²	111	138.4 Å²	138.4	67%	0.673	71%	0.711	S	S	*	*			trans	63	139.2	137	170.9	0	0	0	0	120.7
794	E	35.6	Very low	32.9	Very low	152 Å²	152	135.8 Å²	135.8	71%	0.71	71%	0.714	S	S	*	*			cis	-170.3	155.5	-19.3	-111.2	161.8	-170.5	0	0	110
795	E	34.9	Very low	32.4	Very low	167 Å²	167	134.7 Å²	134.7	78%	0.78	72%	0.716	S	S	*	*			trans	50.7	169.8	146.1	-67	-167.1	163	0	0	121.4
796	T	31.2	Very low	32.5	Very low	119 Å²	119	133.1 Å²	133.1	73%	0.73	72%	0.715	S	S	*	*			cis	-156.4	175.8	-5.1	14.6	0	0	0	0	107.7
797	D	31.1	Very low	32.2	Very low	112 Å²	112	134 Å²	134	60%	0.599	72%	0.72	S	S	*	*			cis	-175.5	166.7	-42.9	-173.8	21.3	0	0	0	110.3
798	K	31.7	Very low	32.1	Very low	150 Å²	150	129 Å²	129	65%	0.652	72%	0.715	S	S	*	*			trans	64.8	114.2	159.1	-78.2	160.9	-171.4	118.6	0	124.2
799	M	29.9	Very low	31.9	Very low	155 Å²	155	127.4 Å²	127.4	76%	0.764	72%	0.715	S	S	*	*				82	153.2	117.3	-71.7	-179.5	173.5	0	0	124.6
800	N	29	Very low	31.9	Very low	145 Å²	145	126.9 Å²	126.9	78%	0.775	72%	0.717	S	S	*	*			trans	78.7	152.4	151.4	-72.4	-6.8	0	0	0	120.8
801	V	27.9	Very low	30.8	Very low	120 Å²	120	129 Å²	129	73%	0.727	72%	0.721	S	S	*	*			cis	-167.6	143.4	-36.3	103	0	0	0	0	111.9
802	V	27.9	Very low	30.4	Very low	124 Å²	124	126.2 Å²	126.2	75%	0.752	72%	0.722	S	S	*	*			trans	70.4	154.2	155.9	169.8	0	0	0	0	121.9
803	S	29.1	Very low	30.3	Very low	100 Å²	100	130.9 Å²	130.9	70%	0.699	73%	0.733	S	S	*	*			trans	76.7	115.3	160.3	44	0	0	0	0	122.5
804	C	26.8	Very low	30.1	Very low	123 Å²	123	135.2 Å²	135.2	83%	0.831	74%	0.743	S	S	*	*				17.6	148.5	114.4	-54.8	0	0	0	0	120.1
805	S	29.5	Very low	29.8	Very low	100 Å²	100	133.5 Å²	133.5	70%	0.699	74%	0.739	S	S	*	*			cis	-173.7	172.9	-8.5	49.7	0	0	0	0	111.2
806	S	29.5	Very low	29.5	Very low	97 Å²	97	136 Å²	136	68%	0.678	74%	0.742	S	S	*	*			trans	70.2	134.7	145.8	47.8	0	0	0	0	121.9
807	L	29.5	Very low	29.6	Very low	149 Å²	149	137.5 Å²	137.5	78%	0.78	74%	0.741	S	S	*	*			trans	86.9	119.7	149.2	-67.4	162	0	0	0	122.4
808	T	28.5	Very low	29.6	Very low	117 Å²	117	139.5 Å²	139.5	72%	0.718	75%	0.747	S	S	*	*			trans	78.2	152.7	132.7	51.1	0	0	0	0	124.3
809	S	29.1	Very low	29.8	Very low	104 Å²	104	139.5 Å²	139.5	73%	0.727	75%	0.749	S	S	*	*			trans	65.5	106.8	157.9	47.6	0	0	0	0	119.5
810	S	30.5	Very low	29.8	Very low	106 Å²	106	139.1 Å²	139.1	74%	0.741	76%	0.756	S	S	*	*			trans	-22.3	141.5	139.7	51.9	0	0	0	0	117.2
811	L	29.7	Very low	30.3	Very low	149 Å²	149	139.7 Å²	139.7	78%	0.78	76%	0.758	S	S	*	*				-159.2	150.9	125.1	-135.1	77.5	0	0	0	113.3
812	N	30.6	Very low	31.1	Very low	145 Å²	145	139.3 Å²	139.3	78%	0.775	76%	0.758	S	S	*	*			trans	24.8	141.4	151.4	-64	-3	0	0	0	124
813	Y	29.5	Very low	31.4	Very low	203 Å²	203	142 Å²	142	80%	0.796	77%	0.767	S	S	*	*			trans	-66.4	136.1	161.1	-168	-88.9	0	0	0	112.2
814	F	29.8	Very low	31.5	Very low	203 Å²	203	140.5 Å²	140.5	89%	0.89	77%	0.767	S	S	*	*			trans	-162.2	157.9	137.9	-120.7	-79.1	0	0	0	112.3
815	D	30.7	Very low	31.7	Very low	115 Å²	115	140.5 Å²	140.5	62%	0.615	77%	0.767	S	S	*	*			trans	-95.3	159.9	-168.9	-173.3	17.4	0	0	0	113.4
816	Y	28.3	Very low	31.8	Very low	219 Å²	219	145 Å²	145	86%	0.859	77%	0.769	S	S	*	*			trans	-152.4	148.4	158.8	-130.9	-85	0	0	0	114.1
817	H	32.3	Very low	32	Very low	152 Å²	152	149.6 Å²	149.6	70%	0.704	77%	0.771	S	S	*	*			trans	-73.2	161.1	-157.8	-93.5	-109.1	0	0	0	118.7
818	Q	32.3	Very low	32.2	Very low	153 Å²	153	146.5 Å²	146.5	72%	0.715	76%	0.762	S	S	*	*			trans	-44.6	174	154.9	-52.3	174.6	-0.9	0	0	113
819	Q	35.3	Very low	32.4	Very low	150 Å²	150	149.1 Å²	149.1	70%	0.701	77%	0.766	S	S	*	*			cis	178.6	152.9	46.9	-157.2	171	80.6	0	0	112.3
820	T	30.2	Very low	32.5	Very low	147 Å²	147	149 Å²	149	90%	0.902	77%	0.766	S	S	*	*			trans	-171.9	157.4	140.9	11.4	0	0	0	0	113.1
821	L	38.7	Very low	32.4	Very low	157 Å²	157	149 Å²	149	82%	0.822	76%	0.761	S	S	*	*			trans	-115.4	167.7	-175.7	-73.8	158.9	0	0	0	111.9
822	P	45.8	Very low	32.3	Very low	112 Å²	112	150.2 Å²	150.2	73%	0.727	76%	0.76	S	S	*	*			trans	-145.7	134.3	136.1	33.5	-16.2	0	0	0	117.9
823	L	34.1	Very low	32.1	Very low	182 Å²	182	149.7 Å²	149.7	95%	0.953	76%	0.757	S	S	*	*			trans	69.4	149.8	137.5	-60.2	171.7	0	0	0	122.6
824	G	30.5	Very low	32	Very low	68 Å²	68	146.1 Å²	146.1	70%	0.701	75%	0.751	S	S	*	*			trans	-162	-177.4	174.4	0	0	0	0	0	112.3
825	C	30.6	Very low	31.9	Very low	122 Å²	122	141.3 Å²	141.3	82%	0.824	74%	0.739	S	S	*	*			trans	-169	149.7	-179.3	-97.2	0	0	0	0	109.2
826	R	32.4	Very low	31.6	Very low	195 Å²	195	143.5 Å²	143.5	74%	0.736	75%	0.745	S	S	*	*			cis	-159.7	163.9	-2.8	-92.3	-179.9	177.6	-171.5	-0.8	105.4
827	R	34	Very low	31.5	Very low	194 Å²	194	138.3 Å²	138.3	73%	0.732	73%	0.732	S	S	*	*			cis	-163.8	167.5	-6.8	-114.8	174.5	-176.7	-175.4	-4.4	105.2
828	S	34.1	Very low	31.2	Very low	83 Å²	83	138.1 Å²	138.1	58%	0.58	73%	0.732	S	S	*	*			cis	-161.4	149.1	23.1	40.4	0	0	0	0	111.7
829	E	31.9	Very low	31	Very low	172 Å²	172	136.8 Å²	136.8	80%	0.804	73%	0.729	S	S	*	*			trans	59.3	146.4	148	-70.5	143.6	-126.3	0	0	120
830	S	30.3	Very low	30.5	Very low	103 Å²	103	135 Å²	135	72%	0.72	73%	0.729	S	S	*	*			cis	-146.9	125.1	-7.3	44.6	0	0	0	0	110.6
831	T	28.6	Very low	30.5	Very low	105 Å²	105	138.5 Å²	138.5	64%	0.644	73%	0.725	S	S	*	*				74.4	125	86.9	-8.9	0	0	0	0	117.9
832	F	27.8	Very low	30	Very low	174 Å²	174	137 Å²	137	76%	0.763	72%	0.719	S	S	*	*			trans	86	119.8	146.6	-69.2	-41.3	0	0	0	123.6
833	L	27.6	Very low	29.2	Very low	135 Å²	135	137.3 Å²	137.3	71%	0.707	72%	0.718	S	S	*	*				68	154.6	124.7	-58.3	172.8	0	0	0	118.4
834	N	26.7	Very low	28.8	Very low	127 Å²	127	133.7 Å²	133.7	68%	0.679	71%	0.708	S	S	*	*			cis	-158.5	177.7	-2	-136.7	-8	0	0	0	112.6
835	V	27	Very low	28.8	Very low	103 Å²	103	134.6 Å²	134.6	62%	0.624	71%	0.709	S	S	*	*			trans	59.5	105.2	142.4	166.5	0	0	0	0	118.6
836	E	25	Very low	28.9	Very low	160 Å²	160	135.2 Å²	135.2	75%	0.748	70%	0.704	S	S	*	*				44.3	149.7	104.1	-126.5	-179.6	-136.2	0	0	121.9
837	N	26.2	Very low	28.9	Very low	111 Å²	111	133.8 Å²	133.8	59%	0.594	71%	0.705	S	S	*	*			trans	83.2	126.2	149.4	-92.6	-58.9	0	0	0	121.3
838	Q	26.2	Very low	28.9	Very low	148 Å²	148	130.8 Å²	130.8	69%	0.692	70%	0.703	S	S	*	*			trans	82.2	111.5	137.8	-73.9	176.9	46.2	0	0	122.7
839	N	27.1	Very low	28.8	Very low	124 Å²	124	136.4 Å²	136.4	66%	0.663	71%	0.713	S	S	*	*				84.9	131.6	118.7	-74.6	-28.5	0	0	0	121.8
840	T	26.8	Very low	28.7	Very low	112 Å²	112	134.9 Å²	134.9	69%	0.687	71%	0.705	S	S	*	*			trans	69.7	111.8	140.8	53	0	0	0	0	120.8
841	R	29.6	Very low	28.7	Very low	221 Å²	221	137.2 Å²	137.2	83%	0.834	70%	0.704	S	S	*	*				82.8	140.9	123.1	-81.4	-177.2	169.4	159.9	-2.5	120.6
842	N	28.7	Very low	28.8	Very low	127 Å²	127	136.2 Å²	136.2	68%	0.679	70%	0.702	S	S	*	*			trans	87.7	94.8	141.6	-72.5	16	0	0	0	120.9
843	T	27.2	Very low	29	Very low	118 Å²	118	137.2 Å²	137.2	72%	0.724	71%	0.706	S	S	*	*				75.8	143.3	119.5	55.5	0	0	0	0	122.7
844	S	26	Very low	29.2	Very low	105 Å²	105	137.7 Å²	137.7	73%	0.734	71%	0.709	S	S	*	*			trans	68.2	92.4	146	53.9	0	0	0	0	120.5
845	A	31.3	Very low	29.3	Very low	87 Å²	87	136.1 Å²	136.1	72%	0.719	71%	0.708	S	S	*	*				48.8	131.6	110.2	0	0	0	0	0	122
846	N	32.7	Very low	29.6	Very low	135 Å²	135	140.3 Å²	140.3	72%	0.722	72%	0.721	S	S	*	*			trans	53.5	125.4	149.1	-56.9	-9.8	0	0	0	118.4
847	H	32.7	Very low	30	Very low	165 Å²	165	135.8 Å²	135.8	76%	0.764	72%	0.717	S	S	*	*				-167.6	123.5	74.6	-100.2	-85.8	0	0	0	114.4
848	I	32.8	Very low	31.3	Very low	131 Å²	131	136.6 Å²	136.6	67%	0.672	73%	0.728	S	S	*	*				28.5	131.8	118.7	-66.7	172.3	0	0	0	120.6
849	Y	33.2	Very low	31.9	Very low	202 Å²	202	137.1 Å²	137.1	79%	0.792	73%	0.731	S	S	*	*			trans	105.7	132.8	145.9	-91.1	-42.1	0	0	0	124.4
850	H	29.3	Very low	31.9	Very low	139 Å²	139	140.1 Å²	140.1	64%	0.644	74%	0.741	S	S	*	*			trans	97.5	112.4	145.2	-72.1	-57	0	0	0	124.3
851	H	30.5	Very low	33.1	Very low	153 Å²	153	140.2 Å²	140.2	71%	0.708	74%	0.743	S	S	*	*				83.4	104.5	127.2	-74.8	-44.1	0	0	0	125.9
852	S	30.4	Very low	33	Very low	84 Å²	84	135.3 Å²	135.3	59%	0.587	73%	0.734	S	S	*	*				97.2	139.8	107.2	-63	0	0	0	0	124
853	F	32	Very low	33.2	Very low	194 Å²	194	137.5 Å²	137.5	85%	0.851	75%	0.745	S	S	*	*			trans	66.5	143.2	166.6	-62.2	-68.5	0	0	0	117
854	N	31.5	Very low	33.4	Very low	146 Å²	146	138.5 Å²	138.5	78%	0.781	74%	0.744	S	S	*	*			cis	-155.8	-174.3	7	-138.4	4	0	0	0	109.1
855	S	28.3	Very low	33.8	Very low	94 Å²	94	140.3 Å²	140.3	66%	0.657	74%	0.744	S	S	*	*			cis	-151.1	-101.8	3.5	52.4	0	0	0	0	114.5
856	Q	33.2	Very low	33.9	Very low	191 Å²	191	143.7 Å²	143.7	89%	0.893	75%	0.75	S	S	*	*			trans	-158	172.1	-158.3	-77.2	173.8	-29.9	0	0	110.3
857	G	33.7	Very low	33.7	Very low	65 Å²	65	140.8 Å²	140.8	67%	0.67	75%	0.752	S	S	*	*			cis	151.9	162.5	7.9	0	0	0	0	0	109
858	P	54.9	Low	33.8	Very low	127 Å²	127	139.3 Å²	139.3	83%	0.825	75%	0.754	S	S	*	*				-140.4	-119.8	66.6	39.6	-19.9	0	0	0	114.3
859	Q	38.5	Very low	33.9	Very low	160 Å²	160	138.9 Å²	138.9	75%	0.748	76%	0.76	S	S	*	*			trans	-148.1	158.8	-152.7	-66.6	152.8	-96.2	0	0	114.5
860	Q	27.1	Very low	33.9	Very low	187 Å²	187	136.9 Å²	136.9	87%	0.874	76%	0.762	S	S	*	*			trans	-121.1	163.4	140.3	-109.7	-165	-21.8	0	0	108
861	P	51.1	Low	35.3	Very low	113 Å²	113	135.1 Å²	135.1	73%	0.734	76%	0.763	S	S	*	*			trans	-94.2	164.6	-144	36	-39.1	0	0	0	118.3
862	D	28.9	Very low	35.2	Very low	119 Å²	119	135.8 Å²	135.8	64%	0.636	77%	0.766	S	S	*	*			trans	-86.9	167.9	-172.7	-40.2	-101.1	0	0	0	115.6
863	L	31.7	Very low	35.1	Very low	172 Å²	172	137.5 Å²	137.5	90%	0.901	77%	0.774	S	S	*	*				-170.7	159.4	110.7	-99	165.8	0	0	0	112.8
864	I	31.2	Very low	35	Very low	140 Å²	140	135.8 Å²	135.8	72%	0.718	77%	0.768	S	S	*	*			trans	-148.4	148.1	-164.7	-37.7	174.6	0	0	0	110
865	I	35	Very low	34.9	Very low	143 Å²	143	135.5 Å²	135.5	73%	0.733	77%	0.767	S	S	*	*				157.7	124.5	126.9	-84.5	173.1	0	0	0	116
866	N	33.5	Very low	34.9	Very low	157 Å²	157	140.6 Å²	140.6	84%	0.84	77%	0.773	S	S	*	*			trans	47.6	136.1	149.1	-59.6	-1.4	0	0	0	124.9
867	G	29.3	Very low	34.8	Very low	74 Å²	74	135.7 Å²	135.7	76%	0.763	76%	0.76	S	S	*	*			trans	-178.4	106.5	150.5	0	0	0	0	0	113.2
868	V	34.4	Very low	34.7	Very low	135 Å²	135	142 Å²	142	82%	0.818	77%	0.769	S	S	*	*			trans	-143.1	130.8	173.9	178.9	0	0	0	0	110.1
869	P	33.4	Very low	33.4	Very low	122 Å²	122	142.2 Å²	142.2	79%	0.792	76%	0.763	S	S	*	*			trans	-137	154	134	36.7	-24.6	0	0	0	114.3
870	L	33.6	Very low	33	Very low	159 Å²	159	138.8 Å²	138.8	83%	0.832	76%	0.757	S	S	*	*			trans	-110	177.5	157.3	-71	168.8	0	0	0	107
871	P	59.7	Low	33.2	Very low	102 Å²	102	136.4 Å²	136.4	66%	0.662	75%	0.751	S	S	*	*			cis	-134.1	-152.6	5.3	28	-1	0	0	0	113
872	E	27.7	Very low	32.2	Very low	167 Å²	167	140.7 Å²	140.7	78%	0.78	75%	0.754	S	S	*	*			trans	76.6	147.3	160	-60.9	-179.6	-156.9	0	0	117.8
873	T	28.6	Very low	32.5	Very low	120 Å²	120	140.3 Å²	140.3	74%	0.736	76%	0.755	S	S	*	*			cis	-149.1	169.7	-10.7	7.1	0	0	0	0	111.9
874	E	30.1	Very low	32.5	Very low	158 Å²	158	139.1 Å²	139.1	74%	0.738	75%	0.75	S	S	*	*			trans	-18.8	145.7	165.9	-54.7	173.7	160.8	0	0	119.6
875	N	28.3	Very low	32.6	Very low	141 Å²	141	137.5 Å²	137.5	75%	0.754	75%	0.751	S	S	*	*				-172.2	132	105.7	-102.6	-73.1	0	0	0	116.4
876	Y	29.2	Very low	32.6	Very low	200 Å²	200	142.2 Å²	142.2	78%	0.784	76%	0.759	S	S	*	*			trans	25.4	140.8	149.9	-82.3	-95.3	0	0	0	125.7
877	S	31.7	Very low	32.6	Very low	89 Å²	89	138 Å²	138	62%	0.622	75%	0.746	S	S	*	*			trans	-84.1	154.4	165.2	54.6	0	0	0	0	114.6
878	F	30.3	Very low	33	Very low	197 Å²	197	142.6 Å²	142.6	86%	0.864	75%	0.748	S	S	*	*			trans	-161.3	121.7	139.5	-92.7	-72.5	0	0	0	107.1
879	D	27.8	Very low	32.9	Very low	131 Å²	131	143.2 Å²	143.2	70%	0.701	75%	0.746	S	S	*	*			cis	98.8	136.7	20.9	-165.5	30.9	0	0	0	115.4
880	S	30.3	Very low	32.9	Very low	89 Å²	89	144 Å²	144	62%	0.622	74%	0.742	S	S	*	*			trans	69.6	153.3	171	87.1	0	0	0	0	117.6
881	N	31	Very low	32.7	Very low	137 Å²	137	145.8 Å²	145.8	73%	0.733	74%	0.743	S	S	*	*			cis	-162.1	160.9	-9.1	-124.9	-21.6	0	0	0	113.9
882	Y	30.8	Very low	31.6	Very low	203 Å²	203	145.8 Å²	145.8	80%	0.796	75%	0.745	S	S	*	*			trans	15	153.7	133.7	-95.9	-95.3	0	0	0	121.6
883	V	34.8	Very low	31.9	Very low	111 Å²	111	142.4 Å²	142.4	67%	0.673	74%	0.74	S	S	*	*			cis	-155.8	171.9	30.9	-163.8	0	0	0	0	112.1
884	N	31.8	Very low	32	Very low	147 Å²	147	141.3 Å²	141.3	79%	0.786	74%	0.737	S	S	*	*			trans	93	136.3	153.2	-82.9	-25.2	0	0	0	118.6
885	S	33.7	Very low	32.2	Very low	106 Å²	106	139.5 Å²	139.5	74%	0.741	74%	0.737	S	S	*	*			cis	-147.7	163.9	9.5	-79.5	0	0	0	0	115
886	R	33.7	Very low	32.3	Very low	241 Å²	241	141.1 Å²	141.1	91%	0.909	74%	0.738	S	S	*	*			trans	-34.9	161.3	157	-79.9	179.7	159.5	136.4	-7.9	117.2
887	A	34.7	Very low	32.3	Very low	68 Å²	68	139.4 Å²	139.4	56%	0.562	73%	0.734	S	S	*	*			cis	-176.4	161.4	-10.5	0	0	0	0	0	115.4
888	H	37	Very low	32.4	Very low	172 Å²	172	141.5 Å²	141.5	80%	0.796	74%	0.739	S	S	*	*			trans	65.1	154.4	155.9	-59.7	-50.8	0	0	0	118.4
889	L	32.8	Very low	32.5	Very low	147 Å²	147	139.6 Å²	139.6	77%	0.77	74%	0.737	S	S	*	*			cis	-131.6	145.8	20.1	-92.9	85.9	0	0	0	115.2
890	I	32.5	Very low	32.9	Very low	140 Å²	140	142.3 Å²	142.3	72%	0.718	75%	0.745	S	S	*	*			trans	47	114.8	131.5	-57.2	-170.8	0	0	0	118.2
891	K	31.3	Very low	33	Very low	196 Å²	196	141.3 Å²	141.3	85%	0.852	75%	0.749	S	S	*	*			cis	66.5	162.1	36.1	-78.3	-164.3	175.9	-173.3	0	116.1
892	S	35.5	Very low	33	Very low	102 Å²	102	142.8 Å²	142.8	71%	0.713	76%	0.757	S	S	*	*			cis	-124.5	-129	-4.8	37	0	0	0	0	109.8
893	S	33.9	Very low	32.9	Very low	96 Å²	96	137.6 Å²	137.6	67%	0.671	75%	0.75	S	S	*	*			cis	-178.2	157.7	-9.7	17.6	0	0	0	0	106.8
894	S	30.4	Very low	32.7	Very low	96 Å²	96	139.8 Å²	139.8	67%	0.671	76%	0.757	S	S	*	*			cis	-175.8	124.5	-21.5	45.4	0	0	0	0	106.4
895	T	34.4	Very low	32.8	Very low	121 Å²	121	141 Å²	141	74%	0.742	76%	0.755	S	S	*	*				43.6	145.7	92.7	45.3	0	0	0	0	118.1
896	F	30.3	Very low	32.6	Very low	175 Å²	175	142 Å²	142	77%	0.768	75%	0.752	S	S	*	*			trans	80.1	150.8	172.3	-71.8	-60.8	0	0	0	117.9
897	K	29.3	Very low	32.8	Very low	163 Å²	163	136.2 Å²	136.2	71%	0.709	75%	0.749	S	S	*	*			cis	-154.8	165.3	0.9	-149	141.8	-172.1	166.2	0	113.7
898	D	33.4	Very low	32.6	Very low	134 Å²	134	136.2 Å²	136.2	72%	0.717	76%	0.755	S	S	*	*			trans	-89.4	163.7	170.1	-18.2	-106.5	0	0	0	113.5
899	L	33.8	Very low	32.5	Very low	157 Å²	157	136 Å²	136	82%	0.822	76%	0.755	S	S	*	*				-174.4	174.4	120.4	-130.8	76.3	0	0	0	114.9
900	E	35.4	Very low	32.6	Very low	188 Å²	188	136.7 Å²	136.7	88%	0.879	75%	0.754	S	S	*	*			trans	72	122.9	171.7	-58.9	-171.3	179.2	0	0	118.1
901	G	31.6	Very low	32.7	Very low	67 Å²	67	138.3 Å²	138.3	69%	0.691	76%	0.758	S	S	*	*			cis	131.1	90	-22.6	0	0	0	0	0	117.1
902	N	31.8	Very low	32.8	Very low	169 Å²	169	132.9 Å²	132.9	90%	0.904	75%	0.745	S	S	*	*			trans	168.7	162.8	157.5	-90.7	-38.3	0	0	0	109.9
903	S	28.4	Very low	32.8	Very low	93 Å²	93	133.9 Å²	133.9	65%	0.65	74%	0.742	S	S	*	*			cis	-170.4	126.2	-37	-170.8	0	0	0	0	111
904	L	30.6	Very low	32.8	Very low	157 Å²	157	137.1 Å²	137.1	82%	0.822	75%	0.747	S	S	*	*			trans	34	117.5	151.5	-71.7	162.2	0	0	0	122.3
905	K	33.6	Very low	33.1	Very low	174 Å²	174	138.2 Å²	138.2	76%	0.757	75%	0.75	S	S	*	*				171.1	157.6	108.3	-100.5	170.7	159.9	-82.2	0	116.4
906	D	30.1	Very low	33.1	Very low	125 Å²	125	139.6 Å²	139.6	67%	0.668	75%	0.752	S	S	*	*			trans	21.6	144.2	144.6	-47.8	-36.1	0	0	0	120
907	S	37.3	Very low	33.5	Very low	120 Å²	120	135.8 Å²	135.8	84%	0.839	75%	0.747	S	S	*	*			cis	-178.9	168.7	-4.3	48.7	0	0	0	0	107.6
908	G	31.2	Very low	33.7	Very low	68 Å²	68	136.8 Å²	136.8	70%	0.701	76%	0.755	S	S	*	*			cis	154.6	146.6	0.6	0	0	0	0	0	110.8
909	H	36.1	Very low	33.8	Very low	169 Å²	169	139.2 Å²	139.2	78%	0.782	76%	0.762	S	S	*	*			trans	63.9	150.6	-170.8	-70.1	-39	0	0	0	115.4
910	E	34.1	Very low	33.7	Very low	161 Å²	161	139.3 Å²	139.3	75%	0.752	76%	0.763	S	S	*	*			cis	72.9	142.7	33.5	-58.7	163.2	147.9	0	0	112.3
911	E	33.8	Very low	33.5	Very low	173 Å²	173	135.6 Å²	135.6	81%	0.808	75%	0.753	S	S	*	*			cis	-151.8	152.2	5.1	-135.8	179.1	-179.8	0	0	110.2
912	S	34.5	Very low	33.6	Very low	83 Å²	83	140.2 Å²	140.2	58%	0.58	76%	0.756	S	S	*	*			trans	57.3	148	136.2	-120.3	0	0	0	0	126.5
913	D	34.3	Very low	33.5	Very low	122 Å²	122	142.4 Å²	142.4	65%	0.652	75%	0.752	S	S	*	*			trans	65.6	155.1	141.7	-64.8	-33.6	0	0	0	121.5
914	Q	34.8	Very low	33.5	Very low	165 Å²	165	143.8 Å²	143.8	77%	0.771	76%	0.762	S	S	*	*			cis	-155.6	178.8	-23.1	-121.3	167.8	44.4	0	0	111.9
915	T	36.6	Very low	33.6	Very low	119 Å²	119	143.1 Å²	143.1	73%	0.73	76%	0.758	S	S	*	*			trans	-68.6	157	-179.3	51.3	0	0	0	0	117.3
916	D	33.3	Very low	33.5	Very low	149 Å²	149	144.6 Å²	144.6	80%	0.797	76%	0.76	S	S	*	*			trans	-159.3	120.9	146.3	-113.6	-39	0	0	0	108.5
917	S	38.5	Very low	33.4	Very low	95 Å²	95	143.4 Å²	143.4	66%	0.664	76%	0.761	S	S	*	*				83.8	158.3	86.5	75.4	0	0	0	0	113.2
918	E	35.5	Very low	33	Very low	185 Å²	185	144.3 Å²	144.3	86%	0.864	76%	0.756	S	S	*	*			cis	-133.9	-170.5	32.4	-61.8	-178.5	112.6	0	0	115.3
919	H	34.9	Very low	32.9	Very low	185 Å²	185	146.5 Å²	146.5	86%	0.856	76%	0.756	S	S	*	*			trans	-118.9	158.3	178.2	-104.4	35.2	0	0	0	110.6
920	D	30.4	Very low	32.8	Very low	159 Å²	159	142.8 Å²	142.8	85%	0.85	75%	0.754	S	S	*	*			trans	-156.9	171.7	136.6	-136.8	-23.1	0	0	0	115.2
921	V	32.2	Very low	32.7	Very low	110 Å²	110	141.2 Å²	141.2	67%	0.667	76%	0.756	S	S	*	*			trans	-97.3	144.1	-147.8	171.6	0	0	0	0	117.5
922	Q	33.4	Very low	32.7	Very low	164 Å²	164	139.1 Å²	139.1	77%	0.766	75%	0.75	S	S	*	*			trans	-4.3	150.5	151.5	-47.2	171.9	-19.7	0	0	118.5
923	R	30.8	Very low	32.5	Very low	214 Å²	214	141.8 Å²	141.8	81%	0.808	76%	0.758	S	S	*	*				162	130.1	71.6	-168.5	178.9	-163.6	171.5	5.8	112.4
924	S	28.4	Very low	32.5	Very low	123 Å²	123	141 Å²	141	86%	0.86	76%	0.757	S	S	*	*			trans	-171	177.3	154.4	9.1	0	0	0	0	112.1
925	L	31.5	Very low	32.4	Very low	142 Å²	142	139.7 Å²	139.7	74%	0.743	76%	0.755	S	S	*	*			trans	-127.1	148	-156.8	-93.6	72.1	0	0	0	116.2
926	Y	31	Very low	32.1	Very low	205 Å²	205	139.6 Å²	139.6	80%	0.804	75%	0.75	S	S	*	*			trans	65.7	136.8	145.9	-87.6	-111.9	0	0	0	122.5
927	C	29.1	Very low	31.9	Very low	101 Å²	101	137.6 Å²	137.6	68%	0.682	74%	0.743	S	S	*	*			trans	29.9	153.4	140.8	-51.1	0	0	0	0	121.5
928	D	28.2	Very low	31.6	Very low	139 Å²	139	137.9 Å²	137.9	74%	0.743	75%	0.745	S	S	*	*			cis	-163.3	179.4	26.1	-143.9	-33.1	0	0	0	113.6
929	T	30.4	Very low	31.3	Very low	114 Å²	114	135.1 Å²	135.1	70%	0.699	74%	0.741	S	S	*	*			trans	60.5	101.2	155.4	49.8	0	0	0	0	122.5
930	A	33	Very low	31	Very low	90 Å²	90	132.4 Å²	132.4	74%	0.744	74%	0.737	S	S	*	*				52.2	128	103.6	0	0	0	0	0	124.3
931	V	32.6	Very low	31	Very low	128 Å²	128	129.5 Å²	129.5	78%	0.776	73%	0.73	S	S	*	*				91.4	114.2	129.8	167.4	0	0	0	0	122.4
932	N	32.3	Very low	30.8	Very low	129 Å²	129	133.4 Å²	133.4	69%	0.69	74%	0.743	S	S	*	*			trans	66.4	152.3	142.4	-71.5	23.8	0	0	0	125.5
933	D	31.6	Very low	30.5	Very low	139 Å²	139	129.5 Å²	129.5	74%	0.743	75%	0.747	S	S	*	*			trans	74.5	142.1	142.8	-76.1	3.8	0	0	0	120.9
934	V	33.8	Very low	30.5	Very low	106 Å²	106	124.3 Å²	124.3	64%	0.642	74%	0.743	S	S	*	*			cis	-169.3	162.6	-12	72.1	0	0	0	0	111.9
935	L	33.3	Very low	30.5	Very low	137 Å²	137	127.5 Å²	127.5	72%	0.717	74%	0.744	S	S	*	*			trans	66.8	163.7	159.9	-61	179.3	0	0	0	117.8
936	N	29	Very low	30.4	Very low	118 Å²	118	129.2 Å²	129.2	63%	0.631	75%	0.751	S	S	*	*			cis	-157.5	169.2	-4.3	-133.6	-15.6	0	0	0	114.9
937	T	30.8	Very low	31.1	Very low	106 Å²	106	124.6 Å²	124.6	65%	0.65	75%	0.746	S	S	*	*			trans	36.9	122.2	151	55.1	0	0	0	0	121
938	S	30.6	Very low	31.2	Very low	102 Å²	102	126.5 Å²	126.5	71%	0.713	75%	0.749	S	S	*	*				70.8	133.7	51.8	82.2	0	0	0	0	116.3
939	V	29.1	Very low	31.3	Very low	127 Å²	127	127.9 Å²	127.9	77%	0.77	75%	0.751	S	S	*	*			trans	168.9	113.2	146.6	146.2	0	0	0	0	113.7
940	T	29.5	Very low	31.4	Very low	128 Å²	128	127.6 Å²	127.6	79%	0.785	75%	0.745	S	S	*	*			trans	43.6	158	143.7	61.8	0	0	0	0	124.3
941	S	29.8	Very low	31.3	Very low	98 Å²	98	131.5 Å²	131.5	69%	0.685	75%	0.748	S	S	*	*			cis	-178.6	170.8	-14	178.5	0	0	0	0	111.5
942	M	28.9	Very low	31.1	Very low	192 Å²	192	131.9 Å²	131.9	95%	0.946	75%	0.746	S	S	*	*			trans	75.1	147.1	162.1	-61.7	-149.3	-175	0	0	121.4
943	G	27.2	Very low	31.2	Very low	82 Å²	82	134.3 Å²	134.3	85%	0.845	75%	0.753	S	S	*	*			trans	146.9	92.6	161.7	0	0	0	0	0	115.2
944	S	30.1	Very low	31	Very low	105 Å²	105	131.1 Å²	131.1	73%	0.734	75%	0.753	S	S	*	*			trans	-97.7	165.9	-174.3	56.4	0	0	0	0	115.8
945	Q	28.3	Very low	30.9	Very low	190 Å²	190	135.3 Å²	135.3	89%	0.888	76%	0.763	S	S	*	*			trans	91.3	140.5	154.2	-72.1	173.7	-36	0	0	121.8
946	M	28.9	Very low	30.9	Very low	177 Å²	177	137.5 Å²	137.5	87%	0.872	77%	0.769	S	S	*	*			trans	-71.6	169.1	160.4	-108.7	175.8	161.9	0	0	111
947	P	46.1	Very low	31	Very low	108 Å²	108	136.2 Å²	136.2	70%	0.701	77%	0.769	S	S	*	*			cis	-150.9	-179	44.6	43.5	-22.3	0	0	0	118.8
948	D	31.8	Very low	31.2	Very low	142 Å²	142	140.9 Å²	140.9	76%	0.759	77%	0.774	S	S	*	*			trans	42	128	144.8	-67.5	-18.8	0	0	0	125.6
949	H	30.9	Very low	31.6	Very low	167 Å²	167	142.8 Å²	142.8	77%	0.773	77%	0.772	S	S	*	*			trans	57.5	122.6	138.4	-106.5	-50.7	0	0	0	124.4
950	D	31.5	Very low	31.9	Very low	109 Å²	109	142.9 Å²	142.9	58%	0.583	76%	0.764	S	S	*	*			trans	76.8	129.7	132.6	-99	41.8	0	0	0	124.8
951	Q	31.1	Very low	31.9	Very low	171 Å²	171	140.9 Å²	140.9	80%	0.799	75%	0.754	S	S	*	*			trans	69.4	157.7	149.1	-62.6	169.7	47.3	0	0	119.8
952	N	29	Very low	32.1	Very low	137 Å²	137	144.7 Å²	144.7	73%	0.733	75%	0.754	S	S	*	*			cis	-165.5	166.9	-40.8	-165	16.3	0	0	0	109.8
953	E	33.2	Very low	32.3	Very low	179 Å²	179	142.6 Å²	142.6	84%	0.836	75%	0.745	S	S	*	*			trans	73	155.5	161	-50.1	-160.3	142.7	0	0	122.5
954	G	28.1	Very low	32.5	Very low	73 Å²	73	147.2 Å²	147.2	75%	0.753	75%	0.749	S	S	*	*			trans	101.9	67.2	161.2	0	0	0	0	0	118
955	F	31.6	Very low	32.5	Very low	194 Å²	194	145.4 Å²	145.4	85%	0.851	75%	0.747	S	S	*	*				72.4	103.7	53.1	-111.9	-64.5	0	0	0	117.7
956	H	34.1	Very low	32.6	Very low	182 Å²	182	145.1 Å²	145.1	84%	0.843	75%	0.745	S	S	*	*			trans	170.4	155.3	145.8	-92.5	-26	0	0	0	111.2
957	C	30.4	Very low	32.6	Very low	92 Å²	92	141.3 Å²	141.3	62%	0.622	74%	0.736	S	S	*	*			cis	-174.1	168.5	-37.6	-113.8	0	0	0	0	110.4
958	R	35.8	Very low	31.9	Very low	203 Å²	203	141.9 Å²	141.9	77%	0.766	73%	0.733	S	S	*	*			trans	80.5	145.6	169.9	-46.9	-175.4	97.2	123.1	20.1	117
959	E	39.1	Very low	32	Very low	142 Å²	142	145.4 Å²	145.4	66%	0.664	74%	0.736	S	S	*	*			cis	-168.1	158.2	-15.2	-111.3	154.7	-172	0	0	107.3
960	E	33.6	Very low	31.8	Very low	130 Å²	130	142.1 Å²	142.1	61%	0.607	73%	0.731	S	S	*	*			cis	-133.8	-85.6	-6.4	-162.5	-93.2	153.8	0	0	110.5	R962	E960-R962 IonicContact OE1-CZ 3.4Å; E960-R962 VanDerWaalsContact OE1-CZ 3.27Å; E960-R962 IonicContact OE1-NH1 2.67Å; E960-R962 PolarHBondContact OE1-NH1 2.77Å; E960-R962 IonicContact OE1-NH2 2.84Å; E960-R962 PolarHBondContact OE1-NH2 3.14Å; E960-R962 IonicContact OE2-CZ 3.24Å; E960-R962 IonicContact OE2-NH1 2.68Å; E960-R962 PolarHBondContact OE2-NH1 2.82Å; E960-R962 IonicContact OE2-NH2 3.55Å
961	C	31.2	Very low	31.6	Very low	86 Å²	86	148.7 Å²	148.7	58%	0.581	75%	0.747	S	S	*	*			trans	-153.2	-167.7	-172.5	-66	0	0	0	0	112.6
962	R	32.4	Very low	31.5	Very low	177 Å²	177	148.7 Å²	148.7	67%	0.668	75%	0.749	S	S	*	*			cis	-163.9	169.8	13	-139.7	166.3	-120.4	93.9	12.5	107.1	E960	E960-R962 IonicContact OE1-CZ 3.4Å; E960-R962 VanDerWaalsContact OE1-CZ 3.27Å; E960-R962 IonicContact OE1-NH1 2.67Å; E960-R962 PolarHBondContact OE1-NH1 2.77Å; E960-R962 IonicContact OE1-NH2 2.84Å; E960-R962 PolarHBondContact OE1-NH2 3.14Å; E960-R962 IonicContact OE2-CZ 3.24Å; E960-R962 IonicContact OE2-NH1 2.68Å; E960-R962 PolarHBondContact OE2-NH1 2.82Å; E960-R962 IonicContact OE2-NH2 3.55Å
963	I	34.4	Very low	32.7	Very low	148 Å²	148	147.2 Å²	147.2	76%	0.759	75%	0.748	S	S	*	*			cis	-150.5	155.2	11.2	-31.1	161.7	0	0	0	108.8
964	L	31.7	Very low	32.5	Very low	179 Å²	179	150.2 Å²	150.2	94%	0.937	75%	0.751	S	S	*	*			trans	128	138.2	159.2	-74.9	176.2	0	0	0	111.1
965	G	29.4	Very low	32.8	Very low	67 Å²	67	154.3 Å²	154.3	69%	0.691	76%	0.756	S	S	*	*			trans	172	-166.4	-178.6	0	0	0	0	0	118
966	H	30.1	Very low	33.3	Very low	185 Å²	185	150.9 Å²	150.9	86%	0.856	75%	0.753	S	S	*	*			trans	73.2	138.7	-178	-63.5	-71.9	0	0	0	116.7
967	S	30.3	Very low	33	Very low	97 Å²	97	150.8 Å²	150.8	68%	0.678	76%	0.755	S	S	*	*			cis	-158.7	137.7	-2.8	49.9	0	0	0	0	115.1
968	D	31.3	Very low	33.7	Very low	119 Å²	119	151.4 Å²	151.4	64%	0.636	76%	0.758	S	S	*	*			trans	51.5	114.6	134.1	-62.1	-73.2	0	0	0	125.2
969	R	32.1	Very low	33.4	Very low	216 Å²	216	148.7 Å²	148.7	82%	0.815	76%	0.757	S	S	*	*				67.7	119.4	117.5	-66.2	-176.8	-171.7	-118	0.9	124.1
970	C	27.5	Very low	32.9	Very low	99 Å²	99	153 Å²	153	67%	0.669	77%	0.768	S	S	*	*				86	127.6	121.1	-68.6	0	0	0	0	124.1
971	W	27.4	Very low	32.6	Very low	246 Å²	246	152.1 Å²	152.1	93%	0.932	78%	0.776	S	S	*	*			trans	84.6	141.3	134.8	-83.6	33.6	0	0	0	122.6
972	M	28.1	Very low	32.5	Very low	171 Å²	171	157 Å²	157	84%	0.842	79%	0.787	S	S	*	*			trans	-114.9	176.8	161.9	-81.2	-171.9	175.7	0	0	108
973	P	55.6	Low	32.4	Very low	107 Å²	107	153.4 Å²	153.4	70%	0.695	79%	0.789	S	S	*	*			cis	-130.2	174.3	-33.9	35	-19.5	0	0	0	112.6
974	R	28.5	Very low	33.3	Very low	242 Å²	242	151.1 Å²	151.1	91%	0.913	78%	0.784	S	S	*	*			trans	162.8	164	137.5	-90.4	168.3	-179.4	-159.5	0	114
975	N	33.7	Very low	33.4	Very low	158 Å²	158	150.3 Å²	150.3	85%	0.845	78%	0.775	S	S	*	*			trans	-67	161.5	-177	-61.8	-15.6	0	0	0	114.6
976	P	42.6	Very low	33.5	Very low	122 Å²	122	153.9 Å²	153.9	79%	0.792	77%	0.773	S	S	*	*				-144.2	146.3	122.6	37.2	-23.3	0	0	0	116.9
977	M	28.5	Very low	33.5	Very low	181 Å²	181	149.3 Å²	149.3	89%	0.892	76%	0.758	S	S	*	*			trans	-96.6	170	135.4	-68.3	-166.4	178.2	0	0	107.2
978	P	45.1	Very low	33.6	Very low	104 Å²	104	154.1 Å²	154.1	68%	0.675	76%	0.761	S	S	*	*			cis	-148.3	179.9	17.1	44.5	-24.3	0	0	0	118.7
979	I	28.7	Very low	33.5	Very low	147 Å²	147	154.3 Å²	154.3	75%	0.754	76%	0.762	S	S	*	*			trans	69.2	125.8	139.8	-77.4	161.4	0	0	0	123.1
980	R	28	Very low	33.4	Very low	233 Å²	233	151 Å²	151	88%	0.879	76%	0.759	S	S	*	*			trans	58.6	130.5	154.3	-78	173.7	172.7	173.7	-1.2	119.2
981	S	29	Very low	33.6	Very low	111 Å²	111	153.5 Å²	153.5	78%	0.776	76%	0.764	S	S	*	*				-166.9	143.9	63.6	40.9	0	0	0	0	116.5
982	K	27.7	Very low	33.5	Very low	189 Å²	189	145.6 Å²	145.6	82%	0.822	75%	0.752	S	S	*	*			trans	27.8	112.1	141.4	-72.1	-173.9	177.2	-174.5	0	119.4
983	S	30.1	Very low	33.5	Very low	100 Å²	100	145.1 Å²	145.1	70%	0.699	75%	0.752	S	S	*	*				81.1	149.5	70.5	78.4	0	0	0	0	113.7
984	P	53.3	Low	32.1	Very low	101 Å²	101	144.6 Å²	144.6	66%	0.656	75%	0.751	S	S	*	*			cis	-148	-174.1	35.9	46.6	-27.4	0	0	0	118.6
985	E	33.7	Very low	32	Very low	161 Å²	161	140.2 Å²	140.2	75%	0.752	74%	0.744	S	S	*	*			trans	74.1	145.1	160.5	-72.9	173.8	-130.9	0	0	118.5
986	H	32.3	Very low	31.9	Very low	143 Å²	143	141 Å²	141	66%	0.662	74%	0.742	S	S	*	*			cis	-146.1	130.7	11	-146	85.5	0	0	0	111.7
987	V	29.2	Very low	31.3	Very low	88 Å²	88	139.4 Å²	139.4	53%	0.533	74%	0.739	S	S	.	*			trans	54.9	136.5	145.7	165.2	0	0	0	0	120.1
988	R	32.6	Very low	31.5	Very low	198 Å²	198	137.2 Å²	137.2	75%	0.747	74%	0.737	S	S	*	*			cis	-174.2	175.4	-5.6	-94.7	-177.1	-157.1	111.2	4.9	105.4
989	N	30.1	Very low	31	Very low	123 Å²	123	137 Å²	137	66%	0.658	74%	0.743	S	S	*	*			cis	-165.3	165.6	-9.3	-116.3	18.1	0	0	0	108.5
990	I	29.4	Very low	31.2	Very low	146 Å²	146	133.9 Å²	133.9	75%	0.749	74%	0.739	S	S	*	*			trans	67	125.3	161.2	-62.7	152.8	0	0	0	115.1
991	I	31.5	Very low	31.4	Very low	152 Å²	152	129.4 Å²	129.4	78%	0.779	73%	0.733	S	S	*	*			cis	99.2	108.5	29.4	-61.8	170.6	0	0	0	114.5
992	A	26.5	Very low	31.6	Very low	81 Å²	81	129.3 Å²	129.3	67%	0.669	73%	0.728	S	S	*	*			trans	16.2	139.9	150.1	0	0	0	0	0	124.5
993	L	27	Very low	32	Very low	161 Å²	161	128.8 Å²	128.8	84%	0.843	73%	0.728	S	S	*	*			trans	64.2	139.9	133.8	-76.2	168.6	0	0	0	122.9
994	S	25.6	Very low	32.2	Very low	95 Å²	95	127.4 Å²	127.4	66%	0.664	72%	0.723	S	S	*	*			trans	89.6	129.9	147	-60.9	0	0	0	0	121.4
995	I	28.3	Very low	31.2	Very low	150 Å²	150	132.5 Å²	132.5	77%	0.769	73%	0.73	S	S	*	*			trans	71.2	143.8	154.5	-59.6	157.1	0	0	0	113.6
996	E	29.6	Very low	31.2	Very low	175 Å²	175	130.8 Å²	130.8	82%	0.818	73%	0.726	S	S	*	*			cis	-143.5	143.8	19.9	-136.4	144.9	-129.8	0	0	107
997	A	30.9	Very low	31.1	Very low	88 Å²	88	130.4 Å²	130.4	73%	0.727	73%	0.729	S	S	*	*			cis	87.5	83.6	39	0	0	0	0	0	116.5
998	T	32.8	Very low	31.1	Very low	136 Å²	136	131.2 Å²	131.2	83%	0.834	74%	0.738	S	S	*	*			trans	-147.7	120	148.6	35.6	0	0	0	0	106.7
999	A	33.6	Very low	31.1	Very low	98 Å²	98	125 Å²	125	81%	0.81	74%	0.735	S	S	*	*				67.3	123	68.2	0	0	0	0	0	112.4
1000	A	34.3	Very low	32.1	Very low	82 Å²	82	124.4 Å²	124.4	68%	0.678	74%	0.738	S	S	*	*			cis	-145.8	-176.4	-1	0	0	0	0	0	108.9
1001	D	31.6	Very low	32.2	Very low	139 Å²	139	122.8 Å²	122.8	74%	0.743	74%	0.735	S	S	*	*			cis	-154.2	140.2	21.3	-107.5	-40.7	0	0	0	108.2
1002	V	34.1	Very low	32.1	Very low	110 Å²	110	123.5 Å²	123.5	67%	0.667	73%	0.732	S	S	*	*				60.4	127.9	102.6	164.1	0	0	0	0	114.2
1003	E	35.7	Very low	32.3	Very low	177 Å²	177	130.3 Å²	130.3	83%	0.827	74%	0.741	S	S	*	*			cis	-168.1	171.3	-1.2	-101.6	177.8	175.5	0	0	106.5
1004	A	33.5	Very low	32.6	Very low	71 Å²	71	128.6 Å²	128.6	59%	0.587	74%	0.737	S	S	*	*			cis	-173.9	153.4	-24.7	0	0	0	0	0	110.2
1005	Y	33.4	Very low	32.8	Very low	209 Å²	209	133.4 Å²	133.4	82%	0.82	75%	0.747	S	S	*	*			trans	61.2	158.5	141.5	-83.6	-125.7	0	0	0	120.4
1006	D	32.7	Very low	33	Very low	124 Å²	124	130 Å²	130	66%	0.663	74%	0.74	S	S	*	*			cis	177.8	166.5	-29.3	-103.3	15.1	0	0	0	105.6
1007	D	31.4	Very low	33.1	Very low	136 Å²	136	127.6 Å²	127.6	73%	0.727	74%	0.738	S	S	*	*			cis	-169.1	-165.3	-17.3	172.9	42.5	0	0	0	106.1
1008	C	28.3	Very low	33.1	Very low	105 Å²	105	133.7 Å²	133.7	71%	0.709	75%	0.749	S	S	*	*			trans	86	117.1	153.9	-81.6	0	0	0	0	119
1009	G	32.8	Very low	32.9	Very low	68 Å²	68	130.7 Å²	130.7	70%	0.701	75%	0.745	S	S	*	*			trans	-78.7	-138.8	144.4	0	0	0	0	0	110.7
1010	P	50.2	Low	32.8	Very low	110 Å²	110	134.9 Å²	134.9	71%	0.714	75%	0.745	S	S	*	*			cis	-141.4	-169.6	6.6	42.6	-23.6	0	0	0	114.9
1011	T	31.4	Very low	32.5	Very low	112 Å²	112	136.4 Å²	136.4	69%	0.687	74%	0.742	S	S	*	*			trans	67.5	160.8	157.7	62	0	0	0	0	118.7
1012	K	31.1	Very low	32.4	Very low	166 Å²	166	136 Å²	136	72%	0.722	74%	0.744	S	S	*	*			cis	-165.2	137.7	-15.6	-111.4	164.1	-173.6	169.5	0	109.5
1013	R	30.9	Very low	32.1	Very low	224 Å²	224	136.3 Å²	136.3	85%	0.845	75%	0.751	S	S	*	*			trans	60.5	171.4	155	-55.3	177.2	171.1	173.4	-5.9	114.8
1014	T	31.4	Very low	31.8	Very low	126 Å²	126	134.5 Å²	134.5	77%	0.773	75%	0.747	S	S	*	*			cis	-148	167.2	8.7	-29.9	0	0	0	0	112
1015	F	31.1	Very low	31.7	Very low	196 Å²	196	138.9 Å²	138.9	86%	0.86	76%	0.755	S	S	*	*			trans	-35.5	134.1	176.2	-81.2	-110.8	0	0	0	120.7
1016	A	32.6	Very low	32.6	Very low	77 Å²	77	134.4 Å²	134.4	64%	0.636	75%	0.751	S	S	*	*				76.6	155.6	114.5	0	0	0	0	0	125.3
1017	T	31.8	Very low	32.5	Very low	126 Å²	126	133.4 Å²	133.4	77%	0.773	76%	0.76	S	S	*	*			trans	73.7	111.8	154.1	35	0	0	0	0	122.5
1018	F	30.9	Very low	32.4	Very low	216 Å²	216	135.9 Å²	135.9	95%	0.947	77%	0.768	S	S	*	*			trans	12.4	137.8	133.7	-71.4	-93.5	0	0	0	120
1019	G	28.7	Very low	32.4	Very low	73 Å²	73	140.1 Å²	140.1	75%	0.753	78%	0.777	S	S	*	*			trans	-158.5	-15.3	179.4	0	0	0	0	0	124
1020	K	30.4	Very low	32.3	Very low	186 Å²	186	148 Å²	148	81%	0.809	79%	0.786	S	S	*	*			trans	63.8	176	164	-135.6	-168.2	165.1	-141.1	0	119.3
1021	D	28.8	Very low	31.8	Very low	114 Å²	114	147.9 Å²	147.9	61%	0.61	78%	0.784	S	S	*	*			trans	57.2	117.2	168.1	-54.6	-27.4	0	0	0	118.2
1022	V	29.1	Very low	31.7	Very low	130 Å²	130	149 Å²	149	79%	0.788	79%	0.791	S	S	*	*			cis	84.3	101.6	48.8	176.7	0	0	0	0	113.7
1023	S	27.6	Very low	31.6	Very low	117 Å²	117	148.4 Å²	148.4	82%	0.818	80%	0.795	S	S	*	*				-178.1	145.2	124.5	31.4	0	0	0	0	113.9
1024	D	29.3	Very low	31.7	Very low	139 Å²	139	146.8 Å²	146.8	74%	0.743	80%	0.795	S	S	*	*			trans	-74.5	167	168.3	-72.1	-57.6	0	0	0	111.4
1025	H	32.3	Very low	31.6	Very low	163 Å²	163	144.7 Å²	144.7	76%	0.755	80%	0.798	S	S	*	*			cis	-172.1	-161.4	6.9	-119.3	31.6	0	0	0	105.6
1026	P	52.8	Low	31.8	Very low	115 Å²	115	144.8 Å²	144.8	75%	0.747	80%	0.798	S	S	*	*			cis	-127.4	174.4	-49.7	38	-23.3	0	0	0	112.6
1027	A	29.9	Very low	31.8	Very low	103 Å²	103	152 Å²	152	85%	0.851	81%	0.808	S	S	*	*			trans	-155.5	155.2	155.5	0	0	0	0	0	112
1028	E	29.7	Very low	31.8	Very low	188 Å²	188	151.8 Å²	151.8	88%	0.879	81%	0.808	S	S	*	*			trans	-86.8	144.1	-171	-59.8	166	108.1	0	0	113.3
1029	E	28.5	Very low	31.9	Very low	194 Å²	194	147.9 Å²	147.9	91%	0.907	80%	0.801	S	S	*	*				177.6	168.7	104.7	-90.3	-151.9	122.3	0	0	112.7
1030	R	30.7	Very low	32.1	Very low	234 Å²	234	151.2 Å²	151.2	88%	0.883	80%	0.801	S	S	*	*			trans	-97.8	166	174.5	-85.4	177.6	171.2	170.6	-1.3	109.1
1031	P	39.4	Very low	32.1	Very low	106 Å²	106	147.4 Å²	147.4	69%	0.688	79%	0.794	S	S	*	*			cis	-154.9	-165.6	36	44.5	-22.2	0	0	0	118.4
1032	T	28.8	Very low	32.1	Very low	136 Å²	136	147.4 Å²	147.4	83%	0.834	80%	0.798	S	S	*	*			trans	84.4	154.3	154	51	0	0	0	0	121.8
1033	L	30	Very low	32.1	Very low	153 Å²	153	148.4 Å²	148.4	80%	0.801	80%	0.797	S	S	*	*			trans	-102.6	147.6	-171.2	-106.5	71.8	0	0	0	112.5
1034	K	31.6	Very low	32	Very low	191 Å²	191	148.4 Å²	148.4	83%	0.83	80%	0.796	S	S	*	*			trans	28	96.2	137	-60.7	-175.5	177.5	-176.1	0	116.9
1035	G	28.9	Very low	32.1	Very low	82 Å²	82	147.3 Å²	147.3	85%	0.845	80%	0.799	S	S	*	*			trans	-59.8	158	161.1	0	0	0	0	0	113
1036	K	35.4	Very low	32.8	Very low	197 Å²	197	145.2 Å²	145.2	86%	0.857	80%	0.8	S	S	*	*			trans	-130.3	136.1	-176	-95.6	177.2	175	171.5	0	111
1037	R	34.3	Very low	31.6	Very low	228 Å²	228	148.9 Å²	148.9	86%	0.86	80%	0.804	S	S	*	*			trans	50	123	130.7	-165.5	-165.6	-142.5	-176.6	6.8	118.9
1038	T	31.4	Very low	31.7	Very low	123 Å²	123	150.1 Å²	150.1	76%	0.755	80%	0.801	S	S	*	*			trans	168.7	126.5	133	30.6	0	0	0	0	110.4
1039	V	33.5	Very low	31.6	Very low	134 Å²	134	146.3 Å²	146.3	81%	0.812	80%	0.795	S	S	*	*				73.4	132.4	96.8	166.7	0	0	0	0	112.8
1040	D	31.7	Very low	31.6	Very low	142 Å²	142	142.1 Å²	142.1	76%	0.759	79%	0.787	S	S	*	*			cis	-176	-166.7	-4.8	-179.7	20.9	0	0	0	108.7
1041	V	29.6	Very low	31.7	Very low	106 Å²	106	137.1 Å²	137.1	64%	0.642	78%	0.783	S	S	*	*			trans	97.5	83.4	153.8	-171.2	0	0	0	0	119.8
1042	T	30.3	Very low	31.3	Very low	115 Å²	115	138.8 Å²	138.8	71%	0.706	78%	0.784	S	S	*	*			trans	64.7	145.6	131	68.8	0	0	0	0	125.7
1043	I	28.5	Very low	31.4	Very low	150 Å²	150	142 Å²	142	77%	0.769	78%	0.781	S	S	*	*				124.7	131.8	118	-108.8	162.8	0	0	0	120.6
1044	C	24.9	Very low	31.6	Very low	118 Å²	118	141.1 Å²	141.1	80%	0.797	77%	0.773	S	S	*	*			trans	62.1	120.3	158.5	-72.6	0	0	0	0	124.8
1045	S	32.9	Very low	31.7	Very low	116 Å²	116	137 Å²	137	81%	0.811	77%	0.774	S	S	*	*			trans	-81.3	161.3	154.5	-31.5	0	0	0	0	113.1
1046	P	46.9	Very low	31.7	Very low	118 Å²	118	136.1 Å²	136.1	77%	0.766	77%	0.765	S	S	*	*				-145.9	176.2	120.7	32.9	-15.3	0	0	0	112.6
1047	K	27.5	Very low	31.6	Very low	192 Å²	192	135.3 Å²	135.3	84%	0.835	77%	0.77	S	S	*	*			cis	-158.6	132.7	-21	-106.3	172.9	177.1	176.5	0	106.4
1048	V	30.5	Very low	31.4	Very low	130 Å²	130	127.7 Å²	127.7	79%	0.788	76%	0.762	S	S	*	*				63.8	108.3	87.7	-179.2	0	0	0	0	116.8
1049	S	27.5	Very low	31.4	Very low	107 Å²	107	127.4 Å²	127.4	75%	0.748	76%	0.764	S	S	*	*			trans	157.8	129.6	132.2	57.7	0	0	0	0	110.5
1050	S	30.3	Very low	31.4	Very low	107 Å²	107	129 Å²	129	75%	0.748	76%	0.763	S	S	*	*			cis	95.9	121.7	22.3	77.5	0	0	0	0	115.9
1051	V	31.2	Very low	31.4	Very low	129 Å²	129	127 Å²	127	78%	0.782	77%	0.766	S	S	*	*			trans	169.8	105.2	155.1	144.6	0	0	0	0	107.4
1052	I	31.7	Very low	31.5	Very low	140 Å²	140	129.7 Å²	129.7	72%	0.718	78%	0.775	S	S	*	*				66.3	118.2	95.4	-63.1	162.1	0	0	0	112.1
1053	R	31	Very low	31.7	Very low	203 Å²	203	129.4 Å²	129.4	77%	0.766	78%	0.778	S	S	*	*				-178.5	160.7	76	-157.6	162.6	-170.7	124	23.1	109.9
1054	E	34.2	Very low	32.7	Very low	136 Å²	136	127.6 Å²	127.6	64%	0.636	78%	0.776	S	S	*	*			cis	179.1	159.9	-28.9	-177.6	178.4	-101.8	0	0	109.9
1055	A	32.8	Very low	32.9	Very low	104 Å²	104	128 Å²	128	86%	0.86	78%	0.775	S	S	*	*			trans	63.9	155.9	173.7	0	0	0	0	0	118.4
1056	G	29.8	Very low	32.8	Very low	63 Å²	63	128.2 Å²	128.2	65%	0.649	77%	0.771	S	S	*	*			cis	168	138.1	-11.5	0	0	0	0	0	113.9
1057	N	33	Very low	32.1	Very low	180 Å²	180	127.9 Å²	127.9	96%	0.963	77%	0.771	S	S	*	*			trans	67.6	146.9	178.9	-52	-18.4	0	0	0	116.8
1058	G	31.3	Very low	32.9	Very low	68 Å²	68	124.5 Å²	124.5	70%	0.701	77%	0.769	S	S	*	*			cis	163.8	134.8	-12.3	0	0	0	0	0	113.6
1059	C	31.5	Very low	32.9	Very low	117 Å²	117	125.6 Å²	125.6	79%	0.791	77%	0.77	S	S	*	*			trans	62.2	151.6	173.5	-64.7	0	0	0	0	117
1060	E	31.5	Very low	33	Very low	167 Å²	167	130 Å²	130	78%	0.78	78%	0.778	S	S	*	*			cis	-157.4	142.4	-13.6	-122.8	164.9	-132.3	0	0	109.7
1061	A	32.2	Very low	33.1	Very low	101 Å²	101	131.6 Å²	131.6	84%	0.835	78%	0.777	S	S	*	*			trans	-155.8	132.8	167.2	0	0	0	0	0	110.5
1062	I	32	Very low	33	Very low	163 Å²	163	135.2 Å²	135.2	84%	0.836	78%	0.783	S	S	*	*			trans	-100.9	127.5	-167.5	-68.8	165.6	0	0	0	110.8
1063	S	35.1	Very low	33.1	Very low	108 Å²	108	133.5 Å²	133.5	76%	0.755	78%	0.783	S	S	*	*			trans	-76.8	161.5	166.7	-45.1	0	0	0	0	111.1
1064	P	48.8	Very low	34	Very low	112 Å²	112	130 Å²	130	73%	0.727	79%	0.787	S	S	*	*				-153.7	159.5	106.1	40	-23.8	0	0	0	117.2
1065	V	29.3	Very low	34	Very low	128 Å²	128	130.5 Å²	130.5	78%	0.776	79%	0.793	S	S	*	*			trans	68	141.4	135.1	157.7	0	0	0	0	120.6
1066	T	31.5	Very low	34.9	Very low	119 Å²	119	130.8 Å²	130.8	73%	0.73	79%	0.786	S	S	*	*			cis	-164	165	-48.3	21	0	0	0	0	110.2
1067	S	31.7	Very low	34.8	Very low	111 Å²	111	133.8 Å²	133.8	78%	0.776	79%	0.792	S	S	*	*			trans	-27.1	153.2	169.8	-46.3	0	0	0	0	120.5
1068	P	43.7	Very low	34.6	Very low	121 Å²	121	134.1 Å²	134.1	79%	0.786	79%	0.785	S	S	*	*			trans	-89.2	154	178.1	36.9	-36.4	0	0	0	114.3
1069	L	30.3	Very low	35.3	Very low	154 Å²	154	136.4 Å²	136.4	81%	0.806	79%	0.787	S	S	*	*			trans	-171.2	133.8	161.4	-114.3	167.7	0	0	0	111.3
1070	H	31.1	Very low	35.3	Very low	198 Å²	198	135.6 Å²	135.6	92%	0.917	78%	0.783	S	S	*	*			trans	-157.9	145.6	158.8	-118	-85	0	0	0	111.6
1071	L	32.4	Very low	35.2	Very low	141 Å²	141	133.2 Å²	133.2	74%	0.738	78%	0.78	S	S	*	*			trans	-161.1	117.5	-166.5	-152.5	177.4	0	0	0	112.3
1072	K	28.3	Very low	35.2	Very low	205 Å²	205	132.9 Å²	132.9	89%	0.891	77%	0.771	S	S	*	*			trans	166	161.2	142.2	-94	167.4	-176.6	178.6	0	113.9
1073	S	33.5	Very low	35.1	Very low	104 Å²	104	135.3 Å²	135.3	73%	0.727	77%	0.771	S	S	*	*			trans	-114.8	-179	-178.6	57.3	0	0	0	0	112.1
1074	P	49.4	Very low	34.9	Very low	130 Å²	130	136 Å²	136	84%	0.844	77%	0.771	S	S	*	*				-143.2	-177	93.5	37.5	-20.5	0	0	0	116.3
1075	L	34.5	Very low	34	Very low	147 Å²	147	138.2 Å²	138.2	77%	0.77	78%	0.775	S	S	*	*			trans	-111.1	162.9	-170.2	-110.5	150.6	0	0	0	111.7
1076	P	51.8	Low	34.1	Very low	110 Å²	110	136.3 Å²	136.3	71%	0.714	77%	0.773	S	S	*	*				-140	-172	80.4	38.1	-18.7	0	0	0	112.6
1077	T	27.1	Very low	34	Very low	125 Å²	125	139.3 Å²	139.3	77%	0.767	78%	0.783	S	S	*	*			cis	-150.5	-160.9	16.2	-29.5	0	0	0	0	110.9
1078	K	30.4	Very low	33.8	Very low	187 Å²	187	138.2 Å²	138.2	81%	0.813	78%	0.781	S	S	*	*			trans	-157.8	159.6	173.5	-111.6	176.4	-176.7	176.8	0	109.7
1079	P	45	Very low	34.6	Very low	116 Å²	116	138.2 Å²	138.2	75%	0.753	78%	0.781	S	S	*	*				-132.8	146.2	84.3	8.7	15.8	0	0	0	113.5
1080	S	31.6	Very low	35.8	Very low	100 Å²	100	136.7 Å²	136.7	70%	0.699	78%	0.781	S	S	*	*				60.4	137.7	76	74.8	0	0	0	0	115
1081	V	29.1	Very low	35.8	Very low	118 Å²	118	131.4 Å²	131.4	72%	0.715	77%	0.771	S	S	*	*				-156.6	125.9	56.3	176.6	0	0	0	0	108.8
1082	S	32.1	Very low	36.2	Very low	94 Å²	94	134.9 Å²	134.9	66%	0.657	77%	0.774	S	S	*	*				36.3	153.9	104	59.1	0	0	0	0	118.3
1083	Y	29.5	Very low	36.7	Very low	213 Å²	213	130.4 Å²	130.4	84%	0.835	76%	0.76	S	S	*	*			cis	-148.5	177.6	30.8	-117.9	-84	0	0	0	113.9
1084	T	32.1	Very low	36.5	Very low	122 Å²	122	132.6 Å²	132.6	75%	0.748	76%	0.763	S	S	*	*			trans	-120	151.7	173.2	-44	0	0	0	0	110.7
1085	I	29.3	Very low	35.8	Very low	160 Å²	160	133.5 Å²	133.5	82%	0.821	76%	0.756	S	S	*	*			trans	179.5	157.1	142.8	-96.6	154.6	0	0	0	110.8
1086	A	32.3	Very low	35.8	Very low	87 Å²	87	133 Å²	133	72%	0.719	75%	0.75	S	S	*	*			trans	-119.8	169.4	-179.3	0	0	0	0	0	112.3
1087	L	28.1	Very low	34.9	Very low	182 Å²	182	137.1 Å²	137.1	95%	0.953	75%	0.752	S	S	*	*			trans	-171.1	166.9	155.3	-104.2	160.5	0	0	0	111.7
1088	A	28.5	Very low	35.2	Very low	88 Å²	88	136.9 Å²	136.9	73%	0.727	75%	0.75	S	S	*	*			trans	-139.5	-132.9	-169.7	0	0	0	0	0	115.5
1089	P	61.2	Low	35.3	Very low	121 Å²	121	133.7 Å²	133.7	79%	0.786	74%	0.742	S	S	*	*				-92.9	-170.2	-119.8	44.3	-34.1	0	0	0	114.6
1090	P	54.5	Low	34.7	Very low	123 Å²	123	134.8 Å²	134.8	80%	0.799	74%	0.742	S	S	*	*			cis	-149.2	-151.5	19.2	47	-23.9	0	0	0	117.5
1091	A	31.7	Very low	34.8	Very low	86 Å²	86	135.4 Å²	135.4	71%	0.711	74%	0.741	S	S	*	*			trans	84.3	139.5	165.2	0	0	0	0	0	118.8
1092	R	39.7	Very low	34.9	Very low	214 Å²	214	136.4 Å²	136.4	81%	0.808	74%	0.742	S	S	*	*			cis	83	141.8	30.4	-74.7	-171.5	161	-126.1	9.1	114.8
1093	D	38.8	Very low	35	Very low	112 Å²	112	139.3 Å²	139.3	60%	0.599	75%	0.751	S	S	*	*			cis	-153	162.1	4.1	-96.1	-34.8	0	0	0	110.9
1094	L	30.6	Very low	34.9	Very low	149 Å²	149	132.3 Å²	132.3	78%	0.78	74%	0.743	S	S	*	*			trans	173.1	115.3	139.2	-112.9	64.5	0	0	0	110.9
1095	E	34.9	Very low	36.1	Very low	150 Å²	150	133 Å²	133	70%	0.701	75%	0.749	S	S	*	*				75.1	142.1	87.2	-64	-152.9	134.5	0	0	116.8
1096	Q	34.6	Very low	36.1	Very low	136 Å²	136	130.4 Å²	130.4	64%	0.636	75%	0.752	S	S	*	*			cis	-168.1	147.5	-11.1	-109.5	-164.7	39.5	0	0	112
1097	Y	33	Very low	36	Very low	196 Å²	196	137.6 Å²	137.6	77%	0.769	76%	0.761	S	S	*	*			trans	51.9	164.8	155	-77.4	-86.6	0	0	0	121.7
1098	V	31.4	Very low	36.9	Very low	120 Å²	120	134 Å²	134	73%	0.727	75%	0.748	S	S	*	*			cis	-144.3	153	13.7	-175.9	0	0	0	0	112.1
1099	N	33.8	Very low	36.9	Very low	121 Å²	121	134 Å²	134	65%	0.647	74%	0.743	S	S	*	*			trans	-1.5	165.9	160.2	-40.9	-8	0	0	0	122.9
1100	N	31.4	Very low	35.3	Very low	138 Å²	138	137.3 Å²	137.3	74%	0.738	75%	0.748	S	S	*	*			cis	-146.3	160.5	30.5	-78.2	-55.9	0	0	0	111.8
1101	V	33.9	Very low	34.2	Very low	114 Å²	114	136 Å²	136	69%	0.691	75%	0.748	S	S	*	*			cis	80.2	133.2	31.4	-179.8	0	0	0	0	112.7
1102	N	31.6	Very low	34.3	Very low	138 Å²	138	140.5 Å²	140.5	74%	0.738	75%	0.754	S	S	*	*			cis	-124.1	177.4	8.9	-95.8	-39.7	0	0	0	110.5
1103	N	33.7	Very low	34.8	Very low	156 Å²	156	134.8 Å²	134.8	83%	0.834	74%	0.744	S	S	*	*			cis	92.6	136.9	13.2	-162.1	20.2	0	0	0	118.4
1104	G	28.8	Very low	34.4	Very low	66 Å²	66	141.2 Å²	141.2	68%	0.68	76%	0.76	S	S	*	*			trans	132.7	143.3	165.8	0	0	0	0	0	118.6
1105	P	57	Low	34.4	Very low	135 Å²	135	137.4 Å²	137.4	88%	0.877	76%	0.757	S	S	*	*			trans	-115.9	161.3	178.6	41	-32.6	0	0	0	116
1106	A	29.4	Very low	34.5	Very low	106 Å²	106	134.5 Å²	134.5	88%	0.876	76%	0.759	S	S	*	*			trans	-159.5	146.6	163.5	0	0	0	0	0	115.5
1107	R	29.7	Very low	34.4	Very low	239 Å²	239	135 Å²	135	90%	0.902	77%	0.766	S	S	*	*			trans	-116.1	167	154.8	-127.3	-175	178.8	-177.6	0.5	105.3
1108	P	46.3	Very low	34.4	Very low	106 Å²	106	130.9 Å²	130.9	69%	0.688	77%	0.765	S	S	*	*			cis	-141.3	-141.6	11.4	44	-21.8	0	0	0	113.8
1109	S	28.4	Very low	34.6	Very low	87 Å²	87	132.2 Å²	132.2	61%	0.608	76%	0.764	S	S	*	*			trans	73.6	98.3	155.2	61.4	0	0	0	0	121.8
1110	E	29.3	Very low	34.5	Very low	191 Å²	191	134.8 Å²	134.8	89%	0.893	77%	0.769	S	S	*	*				71.4	157.8	114.6	-69	172.5	143.8	0	0	123.5
1111	A	31.1	Very low	34.4	Very low	97 Å²	97	134.3 Å²	134.3	80%	0.802	77%	0.771	S	S	*	*			trans	82.4	94.4	160.1	0	0	0	0	0	120.6
1112	E	33.2	Very low	34.3	Very low	180 Å²	180	135.7 Å²	135.7	84%	0.841	77%	0.772	S	S	*	*				-26.8	162.3	126.7	-84.2	-169.7	-175.7	0	0	115.9
1113	P	50.4	Low	34.3	Very low	93 Å²	93	136.5 Å²	136.5	60%	0.604	77%	0.771	S	S	*	*			cis	-155.4	170.2	41.8	43.9	-23.2	0	0	0	120.6
1114	R	30.6	Very low	34.2	Very low	248 Å²	248	137 Å²	137	94%	0.936	77%	0.768	S	S	*	*			trans	62.8	151.3	154.5	-63.8	151.1	-164.6	-156.8	3.5	118.2
1115	G	30.9	Very low	34.3	Very low	68 Å²	68	140.5 Å²	140.5	70%	0.701	78%	0.776	S	S	*	*			cis	145	147.1	-6.8	0	0	0	0	0	112.9
1116	A	35.3	Very low	33.1	Very low	90 Å²	90	140.6 Å²	140.6	74%	0.744	77%	0.769	S	S	*	*			trans	66.5	155.3	170.5	0	0	0	0	0	117.8
1117	D	33.7	Very low	34.1	Very low	147 Å²	147	140.6 Å²	140.6	79%	0.786	76%	0.76	S	S	*	*			cis	-166.8	176.9	-20.7	-103.5	-31.9	0	0	0	111.9
1118	S	32.8	Very low	34.2	Very low	108 Å²	108	136 Å²	136	76%	0.755	75%	0.752	S	S	*	*			trans	84.9	101.4	151.3	67.8	0	0	0	0	123.2
1119	E	34.6	Very low	33.5	Very low	149 Å²	149	137.6 Å²	137.6	70%	0.696	75%	0.754	S	S	*	*				39.4	134.5	124.5	-58.2	-153	107.8	0	0	126.3
1120	K	31.6	Very low	33.5	Very low	174 Å²	174	142.2 Å²	142.2	76%	0.757	76%	0.763	S	S	*	*				46.5	144.9	127.1	-54.7	172.6	-177.4	155.6	0	120
1121	V	31.2	Very low	33.5	Very low	129 Å²	129	142.4 Å²	142.4	78%	0.782	76%	0.764	S	S	*	*				-163.8	164.3	64.5	160.5	0	0	0	0	112.1
1122	M	30.1	Very low	33.4	Very low	143 Å²	143	141 Å²	141	70%	0.704	76%	0.759	S	S	*	*			trans	-37.7	157.8	168.8	-58.7	159.6	75.2	0	0	115.9
1123	H	31.8	Very low	33.2	Very low	155 Å²	155	144.2 Å²	144.2	72%	0.718	76%	0.764	S	S	*	*				-162.3	168.3	57.9	-113.8	-76.7	0	0	0	115.5
1124	E	32.7	Very low	32.2	Very low	165 Å²	165	148 Å²	148	77%	0.771	77%	0.773	S	S	*	*			trans	-74	166.4	172.8	-52.9	161.3	95	0	0	114
1125	V	30.4	Very low	32.3	Very low	141 Å²	141	144.2 Å²	144.2	86%	0.855	76%	0.763	S	S	*	*				-174.2	140.8	113.6	145.5	0	0	0	0	110.7
1126	N	31.2	Very low	32.2	Very low	137 Å²	137	148.5 Å²	148.5	73%	0.733	77%	0.765	S	S	*	*			trans	-92	149.5	179.1	-148.4	-32.3	0	0	0	110.2	I1128	N1126-I1128 PolarHBondContact OD1-N 2.86Å
1127	P	50.1	Low	32	Very low	105 Å²	105	149.5 Å²	149.5	68%	0.682	77%	0.767	S	S	*	*				-155.5	125.5	108.8	34.4	-13.8	0	0	0	118
1128	I	33.1	Very low	32.7	Very low	142 Å²	142	148.5 Å²	148.5	73%	0.728	77%	0.768	S	S	*	*				64.3	146.4	112.6	-65.7	168.4	0	0	0	121.6	N1126	N1126-I1128 PolarHBondContact OD1-N 2.86Å
1129	L	30.8	Very low	32.5	Very low	140 Å²	140	146.8 Å²	146.8	73%	0.733	77%	0.768	S	S	*	*			trans	90.2	89.8	159.4	-86.8	165.3	0	0	0	122
1130	K	29.5	Very low	32.4	Very low	185 Å²	185	146 Å²	146	80%	0.804	77%	0.773	S	S	*	*				56.2	159.3	119.9	-74.4	-169.6	-177.6	177.9	0	124.1
1131	E	28.9	Very low	32.4	Very low	194 Å²	194	146.6 Å²	146.6	91%	0.907	78%	0.775	S	S	*	*			trans	73.4	131.9	168.4	-48.4	-159.4	156.8	0	0	116.7
1132	G	27.9	Very low	32.4	Very low	69 Å²	69	150.8 Å²	150.8	71%	0.711	78%	0.777	S	S	*	*			cis	130.2	107.5	-16.7	0	0	0	0	0	115.1
1133	R	30.2	Very low	32.5	Very low	246 Å²	246	151 Å²	151	93%	0.928	78%	0.78	S	S	*	*			trans	-171	147.5	155.9	-110.7	160.6	-167.7	-169	4.9	115.1
1134	H	29.4	Very low	32.5	Very low	172 Å²	172	150.8 Å²	150.8	80%	0.796	78%	0.777	S	S	*	*			trans	-32.5	144.8	165.5	-56.1	-97.1	0	0	0	117.4
1135	K	31.9	Very low	32.4	Very low	170 Å²	170	148.9 Å²	148.9	74%	0.739	77%	0.772	S	S	*	*				-179	156.9	96.6	-106.8	161.3	168.6	-98.9	0	115.1
1136	E	29.6	Very low	32.6	Very low	158 Å²	158	149.4 Å²	149.4	74%	0.738	77%	0.769	S	S	*	*			trans	58	135	147.4	-76.9	143.9	-143.9	0	0	122.6
1137	S	30.4	Very low	32.6	Very low	111 Å²	111	148.6 Å²	148.6	78%	0.776	77%	0.769	S	S	*	*			trans	-135.9	176.7	169	64.2	0	0	0	0	107.5
1138	P	48.3	Very low	31.7	Very low	125 Å²	125	155 Å²	155	81%	0.812	80%	0.796	S	S	*	*			cis	-124.8	173.3	-4.9	39.8	-25	0	0	0	114
1139	G	29.5	Very low	31.7	Very low	73 Å²	73	155.7 Å²	155.7	75%	0.753	80%	0.799	S	S	*	*			trans	-152.4	11.9	-168.8	0	0	0	0	0	121.3
1140	V	31.4	Very low	31.7	Very low	132 Å²	132	156.5 Å²	156.5	80%	0.8	80%	0.803	S	S	*	*			trans	44.8	108.8	162.1	-161.8	0	0	0	0	119.5
1141	K	32	Very low	31.9	Very low	186 Å²	186	154.9 Å²	154.9	81%	0.809	80%	0.803	S	S	*	*				177.4	129.9	123.2	-101.7	164.5	-172.3	172.5	0	116
1142	R	30.9	Very low	32	Very low	218 Å²	218	152.6 Å²	152.6	82%	0.823	80%	0.797	S	S	*	*			trans	53.9	133.5	136.4	-80.4	-175	168.4	-171	-4.3	122.3
1143	L	31.9	Very low	32.3	Very low	146 Å²	146	157.9 Å²	157.9	76%	0.764	80%	0.802	S	S	*	*			trans	68.5	147.7	149	-89.9	80.8	0	0	0	116.2
1144	K	31.7	Very low	32.4	Very low	152 Å²	152	152 Å²	152	66%	0.661	79%	0.793	S	S	*	*			cis	-159.3	172.2	-16.1	-151	175.5	157.6	-79.6	0	108
1145	D	32.4	Very low	32.6	Very low	124 Å²	124	150.6 Å²	150.6	66%	0.663	79%	0.793	S	S	*	*			trans	69.6	156.4	169.6	-43	-42.1	0	0	0	112.5
1146	I	33.1	Very low	32.7	Very low	153 Å²	153	149.1 Å²	149.1	79%	0.785	80%	0.797	S	S	*	*			cis	-146.1	140.6	47.1	-88	173.2	0	0	0	111.8
1147	V	32.7	Very low	33	Very low	120 Å²	120	148.3 Å²	148.3	73%	0.727	80%	0.802	S	S	*	*			trans	34.9	118.7	143.6	-173.6	0	0	0	0	119.7
1148	L	31.2	Very low	33.2	Very low	240 Å²	240	151.7 Å²	151.7	100%	1.257	81%	0.805	S	S	*	*				-105.3	0	105.8	-81.7	172	0	0	0	107.8

Retrieved 1,148 of 1,148 residues in 4514.3 ms (Link to these results)

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