G4VSM9_SCHMA Loading...

Putative ubiquitin specific protease 52 / poly(A) ribonuclease subunit pan2

AlphaFold DB , UniProt , Accession G4VSM9, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 671 aa.

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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	39	Very low	32.5	Very low	230 Å²	230	146.5 Å²	146.5	100%	1.133	82%	0.824	S	S	*	*				0	114.4	0	-66.8	-178.3	-160	0	0	106.6
2	S	32.8	Very low	32.5	Very low	114 Å²	114	150.1 Å²	150.1	80%	0.797	83%	0.828	S	S	*	*			trans	-87.3	119.2	-175.9	47	0	0	0	0	110.4
3	F	36.5	Very low	32.4	Very low	183 Å²	183	147.1 Å²	147.1	80%	0.803	82%	0.82	S	S	*	*			trans	-116	96.2	165.7	-80.6	-83.7	0	0	0	106.3
4	T	32.9	Very low	32	Very low	118 Å²	118	149.8 Å²	149.8	72%	0.724	82%	0.823	S	S	*	*				63.1	96.8	103.7	57	0	0	0	0	112.9
5	T	31.7	Very low	32.2	Very low	132 Å²	132	148 Å²	148	81%	0.81	82%	0.821	S	S	*	*			trans	-68.1	114	163.7	45.9	0	0	0	0	109.6
6	E	32.3	Very low	31.9	Very low	188 Å²	188	146.2 Å²	146.2	88%	0.879	82%	0.82	S	S	*	*			trans	-86.3	110.4	163.3	-85.1	177.8	163.7	0	0	108.7
7	T	29	Very low	31.7	Very low	122 Å²	122	146.4 Å²	146.4	75%	0.748	82%	0.819	S	S	*	*			trans	-87.7	104.3	164.5	46.5	0	0	0	0	107.5
8	D	33.8	Very low	31.6	Very low	156 Å²	156	148.2 Å²	148.2	83%	0.834	82%	0.82	S	S	*	*			trans	-112.4	100.6	162.4	-98.2	-20.2	0	0	0	109.3
9	S	28.6	Very low	31.4	Very low	108 Å²	108	149.4 Å²	149.4	76%	0.755	82%	0.818	S	S	*	*			trans	-75.8	116.1	162.3	49.9	0	0	0	0	109
10	S	33.9	Very low	31.2	Very low	112 Å²	112	149.7 Å²	149.7	78%	0.783	82%	0.817	S	S	*	*			trans	-129.2	99.4	160.6	63.5	0	0	0	0	109.2
11	D	27.5	Very low	31.1	Very low	149 Å²	149	147 Å²	147	80%	0.797	81%	0.81	S	S	*	*			trans	-54.2	126	163	-68.4	-51.9	0	0	0	110.7
12	H	32.4	Very low	30.8	Very low	189 Å²	189	141.8 Å²	141.8	88%	0.875	79%	0.793	S	S	*	*			trans	-155.4	145.7	146.6	-91.2	-50.7	0	0	0	110.8
13	P	31.1	Very low	30.6	Very low	111 Å²	111	140 Å²	140	72%	0.721	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-99.7	156.3	-137.1	36.7	-33.8	0	0	0	114.6
14	H	26.3	Very low	30.1	Very low	185 Å²	185	138.9 Å²	138.9	86%	0.856	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-47.6	125.2	167.8	-75.2	-82.1	0	0	0	112.8
15	P	34.8	Very low	30.1	Very low	123 Å²	123	142.1 Å²	142.1	80%	0.799	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-76.8	140.7	159.2	29.5	-24.6	0	0	0	109.5
16	C	28.4	Very low	30	Very low	119 Å²	119	143.1 Å²	143.1	80%	0.804	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-62	153.4	-165.8	-54.4	0	0	0	0	115.2	E18	C16-E18 PolarHBondContact O-N 3.23Å; C16-E18 VanDerWaalsContact O-N 3.15Å
17	D	28.7	Very low	29.9	Very low	149 Å²	149	142.1 Å²	142.1	80%	0.797	80%	0.802	S	S	*	*			trans	-50.1	105.7	161.6	-61.5	-59.3	0	0	0	111.7	H19	D17-H19 PolarHBondContact O-N 3.16Å
18	E	29.5	Very low	29.9	Very low	180 Å²	180	139.5 Å²	139.5	84%	0.841	80%	0.8	S	S	*	*			trans	-82.4	97.2	158	-84.9	-170.8	163.5	0	0	108.7	C16 I20	C16-E18 PolarHBondContact O-N 3.23Å; C16-E18 VanDerWaalsContact O-N 3.15Å; E18-I20 VanDerWaalsContact C-N 3.32Å; E18-I20 PolarHBondContact O-N 3.3Å
19	H	27.6	Very low	29.5	Very low	171 Å²	171	136.2 Å²	136.2	79%	0.792	80%	0.803	S	S	*	*			trans	-58.1	89.3	164.1	-89.2	-79.2	0	0	0	110.5	D17 S21	D17-H19 PolarHBondContact O-N 3.16Å; H19-S21 PolarHBondContact O-N 3.09Å; H19-S21 VanDerWaalsContact O-N 3.14Å
20	I	28	Very low	29.6	Very low	155 Å²	155	138.1 Å²	138.1	80%	0.795	80%	0.804	S	S	*	*			trans	-75.3	104.1	164.5	-60.7	173.7	0	0	0	107	E18	E18-I20 VanDerWaalsContact C-N 3.32Å; E18-I20 PolarHBondContact O-N 3.3Å
21	S	29.5	Very low	29.4	Very low	94 Å²	94	137.5 Å²	137.5	66%	0.657	80%	0.8	S	S	*	*			trans	-70.3	140.3	174	-52	0	0	0	0	109.1	H19 G23	H19-S21 PolarHBondContact O-N 3.09Å; H19-S21 VanDerWaalsContact O-N 3.14Å; S21-G23 PolarHBondContact O-N 3.29Å; S21-G23 VanDerWaalsContact O-N 3.09Å
22	P	30.8	Very low	29.5	Very low	120 Å²	120	134.9 Å²	134.9	78%	0.779	79%	0.793	S	S	*	*			trans	-69.4	109.9	-178.4	27.5	-31.5	0	0	0	109.6	N24	P22-N24 PolarHBondContact O-N 3.31Å
23	G	29.7	Very low	29.4	Very low	75 Å²	75	134.4 Å²	134.4	77%	0.773	80%	0.796	S	S	*	*			trans	-67.9	109.9	168.3	0	0	0	0	0	109.2	S21 E25	S21-G23 PolarHBondContact O-N 3.29Å; S21-G23 VanDerWaalsContact O-N 3.09Å; G23-E25 PolarHBondContact O-N 3.15Å
24	N	26.7	Very low	29.1	Very low	160 Å²	160	134.8 Å²	134.8	86%	0.856	80%	0.797	S	S	*	*			trans	-68.8	101.1	160.9	-74	-24.7	0	0	0	107.7	P22	P22-N24 PolarHBondContact O-N 3.31Å
25	E	31.9	Very low	29.2	Very low	187 Å²	187	133.3 Å²	133.3	87%	0.874	79%	0.794	S	S	*	*			trans	-131.4	127.8	157.7	-77.2	-170.3	164.1	0	0	109.4	G23	G23-E25 PolarHBondContact O-N 3.15Å
26	D	30.6	Very low	28.9	Very low	153 Å²	153	133 Å²	133	82%	0.818	79%	0.792	S	S	*	*			trans	-66.6	148.6	-172.7	-66.9	-53	0	0	0	113.2	G28	D26-G28 PolarHBondContact O-N 2.92Å
27	D	28.8	Very low	29.1	Very low	166 Å²	166	131.6 Å²	131.6	89%	0.888	79%	0.79	S	S	*	*			trans	30.6	84.2	141.8	-66.9	-22.5	0	0	0	118.1
28	G	30.3	Very low	29.4	Very low	68 Å²	68	132.8 Å²	132.8	70%	0.701	79%	0.79	S	S	*	*			trans	-125	83.1	158.9	0	0	0	0	0	109.8	D26 D30	D26-G28 PolarHBondContact O-N 2.92Å; G28-D30 PolarHBondContact O-N 3.14Å
29	G	24.9	Very low	29.8	Very low	87 Å²	87	128.5 Å²	128.5	90%	0.897	79%	0.786	S	S	*	*			trans	-67.8	83.5	169.4	0	0	0	0	0	110.4
30	D	29.8	Very low	29.9	Very low	148 Å²	148	129.2 Å²	129.2	79%	0.791	79%	0.79	S	S	*	*			trans	-102	113.5	173.9	-98.5	-16.8	0	0	0	111.3	G28	G28-D30 PolarHBondContact O-N 3.14Å
31	S	29.8	Very low	30.3	Very low	98 Å²	98	129.1 Å²	129.1	69%	0.685	78%	0.78	S	S	*	*			trans	42.5	107.8	152.8	62.1	0	0	0	0	117	L33	S31-L33 PolarHBondContact O-N 3.09Å
32	S	30.4	Very low	30.4	Very low	94 Å²	94	129.5 Å²	129.5	66%	0.657	78%	0.775	S	S	*	*			trans	-21.3	121.6	143.6	52	0	0	0	0	111.4	T34	S32-T34 PolarHBondContact O-N 3.34Å
33	L	28.9	Very low	30.6	Very low	179 Å²	179	129.7 Å²	129.7	94%	0.937	78%	0.776	S	S	*	*			trans	-52	89.7	162.1	-86.5	138.2	0	0	0	107.9	S31 L35	S31-L33 PolarHBondContact O-N 3.09Å; L33-L35 PolarHBondContact O-N 3.22Å
34	T	26.6	Very low	30.9	Very low	119 Å²	119	130.9 Å²	130.9	73%	0.73	77%	0.769	S	S	*	*			trans	-67.5	104.4	169.5	45.4	0	0	0	0	105.4	S32	S32-T34 PolarHBondContact O-N 3.34Å
35	L	27	Very low	31.4	Very low	154 Å²	154	129.6 Å²	129.6	81%	0.806	76%	0.761	S	S	*	*			trans	-43.6	140.1	156.8	-78.1	156.1	0	0	0	108.3	L33 A37	L33-L35 PolarHBondContact O-N 3.22Å; L35-A37 PolarHBondContact O-N 3.24Å
36	P	29.8	Very low	31.8	Very low	116 Å²	116	127.6 Å²	127.6	75%	0.753	76%	0.762	S	S	*	*			trans	-51.4	114	-175.6	-21.2	30.7	0	0	0	109.1	E38	P36-E38 PolarHBondContact O-N 3.4Å
37	A	32.6	Very low	32.3	Very low	91 Å²	91	122.5 Å²	122.5	75%	0.752	75%	0.745	S	S	*	*	S	Bend	trans	-57.1	115.9	171.2	0	0	0	0	0	106.4	L35	L35-A37 PolarHBondContact O-N 3.24Å
38	E	34.8	Very low	33.2	Very low	173 Å²	173	118.8 Å²	118.8	81%	0.808	74%	0.738	S	S	*	*			trans	49.3	87.8	166.1	-62.8	173.3	166.3	0	0	112.4	P36 Q40	P36-E38 PolarHBondContact O-N 3.4Å; E38-Q40 PolarHBondContact O-N 3.31Å
39	A	36.8	Very low	34.4	Very low	91 Å²	91	120.1 Å²	120.1	75%	0.752	73%	0.726	S	S	*	*			trans	-52.8	95.8	151.4	0	0	0	0	0	106.5	Y41	A39-Y41 PolarHBondContact O-N 3.32Å
40	Q	31	Very low	36.6	Very low	186 Å²	186	122.8 Å²	122.8	87%	0.869	71%	0.71	S	S	*	*			trans	-66.9	99.1	-170.2	-164.4	172.9	12.8	0	0	106.3	E38 D42	E38-Q40 PolarHBondContact O-N 3.31Å; Q40-D42 PolarHBondContact O-N 3.46Å
41	Y	35.4	Very low	39.2	Very low	152 Å²	152	118.5 Å²	118.5	60%	0.596	68%	0.683	S	S	*	*			trans	-61.4	119.7	-177.8	-125.6	-102.5	0	0	0	108.9	A39 P43 E49	A39-Y41 PolarHBondContact O-N 3.32Å; Y41-P43 VanDerWaalsContact O-CD 3.29Å; Y41-P43 WeakPolarHBondContact O-CD 3.43Å; Y41-E49 VanDerWaalsContact CE1-CD 3.49Å; Y41-E49 WeakPolarHBondContact CE1-OE1 3.29Å; Y41-E49 WeakPolarHBondContact CE1-OE2 3.48Å; Y41-E49 VanDerWaalsContact CZ-OE2 3.28Å; Y41-E49 VanDerWaalsContact OH-CD 3.3Å; Y41-E49 PolarHBondContact OH-OE2 2.67Å
42	D	31.3	Very low	41.9	Very low	102 Å²	102	118.4 Å²	118.4	55%	0.545	67%	0.672	S	S	.	*			trans	-75.4	111.5	174.3	-170.1	-21.6	0	0	0	108	Q40 T44	Q40-D42 PolarHBondContact O-N 3.46Å; D42-T44 PolarHBondContact O-N 2.74Å; D42-T44 PolarHBondContact OD1-N 3.33Å; D42-T44 PolarHBondContact OD1-OG1 2.78Å
43	P	35.7	Very low	44.7	Very low	124 Å²	124	115 Å²	115	81%	0.805	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.3	8.8	-172.3	32.2	-34.8	0	0	0	113.1	Y41	Y41-P43 VanDerWaalsContact O-CD 3.29Å; Y41-P43 WeakPolarHBondContact O-CD 3.43Å
44	T	36.8	Very low	47.5	Very low	101 Å²	101	106.7 Å²	106.7	62%	0.62	60%	0.604	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.3	0.3	-176.1	63.7	0	0	0	0	114.6	D42	D42-T44 PolarHBondContact O-N 2.74Å; D42-T44 PolarHBondContact OD1-N 3.33Å; D42-T44 PolarHBondContact OD1-OG1 2.78Å
45	L	36.5	Very low	50.5	Low	133 Å²	133	101.5 Å²	101.5	70%	0.696	57%	0.574	S	S	*	*			trans	-90.9	112.3	-177.8	-143.9	71.8	0	0	0	111.9
46	T	39.3	Very low	53.6	Low	144 Å²	144	94.5 Å²	94.5	88%	0.883	54%	0.537	S	S	*	.			trans	-98.5	22.2	-174.2	43.4	0	0	0	0	113.5
47	G	41.8	Very low	56.5	Low	46 Å²	46	92.1 Å²	92.1	47%	0.474	51%	0.513	S	S	.	.	S	Bend	trans	-86.5	139	171.6	0	0	0	0	0	109.8	E49	G47-E49 PolarHBondContact O-N 3.02Å
48	A	46.5	Very low	59.3	Low	88 Å²	88	89.1 Å²	89.1	73%	0.727	48%	0.483	S	S	*	.			trans	-52.6	107.6	167.9	0	0	0	0	0	108.2	Y50	A48-Y50 PolarHBondContact O-N 2.98Å
49	E	57	Low	61.8	Low	96 Å²	96	83.6 Å²	83.6	45%	0.449	46%	0.459	S	S	.	.			trans	-71.6	103.8	-175.8	-64.2	-171.1	158.9	0	0	108.3	Y41 G47 Y51	Y41-E49 VanDerWaalsContact CE1-CD 3.49Å; Y41-E49 WeakPolarHBondContact CE1-OE1 3.29Å; Y41-E49 WeakPolarHBondContact CE1-OE2 3.48Å; Y41-E49 VanDerWaalsContact CZ-OE2 3.28Å; Y41-E49 VanDerWaalsContact OH-CD 3.3Å; Y41-E49 PolarHBondContact OH-OE2 2.67Å; G47-E49 PolarHBondContact O-N 3.02Å; E49-Y51 PolarHBondContact O-N 3.37Å
50	Y	71.6	Confident	64.2	Low	144 Å²	144	80.1 Å²	80.1	57%	0.565	43%	0.432	S	S	*	.			trans	-71.5	117.1	163.5	-63.9	-80	0	0	0	107.4	A48 Q52 I401	A48-Y50 PolarHBondContact O-N 2.98Å; Y50-Q52 PolarHBondContact O-N 2.79Å; Y50-I401 HydrophobicContact CD1-CD1 4.46Å; Y50-I401 HydrophobicContact CE1-CD1 4.41Å
51	Y	83.3	Confident	66.9	Low	58 Å²	58	73.9 Å²	73.9	23%	0.227	41%	0.407	C	S	.	.			trans	-72	113.1	176.3	175.9	-114.5	0	0	0	109.8	E49 T53 H58 Q365 W367 Y397	E49-Y51 PolarHBondContact O-N 3.37Å; Y51-T53 HydrophobicContact CD1-CG2 4.2Å; Y51-T53 HydrophobicContact CE1-CG2 3.56Å; Y51-H58 HydrophobicContact CD1-CB 3.95Å; Y51-H58 HydrophobicContact CG-CB 4.5Å; Y51-H58 PolarHBondContact O-N 3.28Å; Y51-Q365 VanDerWaalsContact CE1-O 3.3Å; Y51-Q365 WeakPolarHBondContact CE1-O 3.38Å; Y51-Q365 PolarHBondContact OH-O 3.18Å; Y51-Q365 VanDerWaalsContact OH-O 3.04Å; Y51-W367 HydrophobicContact CD1-CB 3.61Å; Y51-W367 HydrophobicContact CD1-CD2 4.09Å; Y51-W367 AromaticContact CD1-CE3 3.56Å; Y51-W367 HydrophobicContact CD1-CE3 3.56Å; Y51-W367 HydrophobicContact CD1-CG 4.18Å; Y51-W367 HydrophobicContact CD1-CZ3 4.45Å; Y51-W367 HydrophobicContact CD2-CD2 4.3Å; Y51-W367 AromaticContact CD2-CE3 3.13Å; Y51-W367 HydrophobicContact CD2-CE3 3.13Å; Y51-W367 HydrophobicContact CD2-CH2 4.47Å; Y51-W367 AromaticContact CD2-CZ3 3.23Å; Y51-W367 HydrophobicContact CD2-CZ3 3.23Å; Y51-W367 HydrophobicContact CE1-CB 3.74Å; Y51-W367 AromaticContact CE1-CE3 3.88Å; Y51-W367 HydrophobicContact CE1-CE3 3.88Å; Y51-W367 AromaticContact CE2-CE3 3.5Å; Y51-W367 HydrophobicContact CE2-CE3 3.5Å; Y51-W367 AromaticContact CE2-CZ3 3.76Å; Y51-W367 HydrophobicContact CE2-CZ3 3.76Å; Y51-W367 HydrophobicContact CG-CB 4.35Å; Y51-W367 AromaticContact CG-CD2 3.93Å; Y51-W367 HydrophobicContact CG-CD2 3.93Å; Y51-W367 AromaticContact CG-CE3 3.14Å; Y51-W367 HydrophobicContact CG-CE3 3.14Å; Y51-W367 HydrophobicContact CG-CG 4.46Å; Y51-W367 AromaticContact CG-CZ3 3.62Å; Y51-W367 HydrophobicContact CG-CZ3 3.62Å; Y51-W367 AromaticContact CZ-CE3 3.85Å; Y51-Y397 HydrophobicContact CD1-CE1 4.23Å; Y51-Y397 HydrophobicContact CE1-CE1 4.41Å
52	Q	87.3	Confident	69.3	Low	96 Å²	96	69.4 Å²	69.4	45%	0.449	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	130.5	177.9	-162.5	-174.9	8.6	0	0	110.6	Y50 Y56 W57	Y50-Q52 PolarHBondContact O-N 2.79Å; Q52-Y56 CarbonylContact C-O 3.55Å; Q52-Y56 WeakPolarHBondContact CA-O 3.11Å; Q52-Y56 WeakPolarHBondContact CG-O 3.06Å; Q52-W57 HydrophobicContact CB-CD2 4.09Å; Q52-W57 HydrophobicContact CB-CE3 3.6Å; Q52-W57 HydrophobicContact CB-CH2 4.15Å; Q52-W57 HydrophobicContact CB-CZ3 3.65Å; Q52-W57 HydrophobicContact CG-CD2 3.78Å; Q52-W57 HydrophobicContact CG-CE3 3.83Å; Q52-W57 HydrophobicContact CG-CG 4.37Å; Q52-W57 HydrophobicContact CG-CH2 4.14Å; Q52-W57 HydrophobicContact CG-CZ2 4.06Å; Q52-W57 HydrophobicContact CG-CZ3 4.03Å; Q52-W57 VanDerWaalsContact OE1-CZ2 3.31Å
53	T	89.4	Confident	71.8	Confident	22 Å²	22	68.2 Å²	68.2	14%	0.135	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.2	139.3	-175.8	-164.6	0	0	0	0	110.2	Y51 G55 Y56 F348 G364 Q365 Y397	Y51-T53 HydrophobicContact CD1-CG2 4.2Å; Y51-T53 HydrophobicContact CE1-CG2 3.56Å; T53-G55 PolarHBondContact O-N 2.99Å; T53-Y56 PolarHBondContact N-O 2.79Å; T53-Y56 PolarHBondContact O-N 3.23Å; T53-Y56 VanDerWaalsContact O-O 3.11Å; T53-F348 HydrophobicContact CG2-CE1 3.89Å; T53-F348 HydrophobicContact CG2-CZ 3.57Å; T53-G364 VanDerWaalsContact OG1-CA 3.22Å; T53-G364 WeakPolarHBondContact OG1-CA 3.49Å; T53-Q365 WeakPolarHBondContact CG2-O 3.38Å; T53-Q365 PolarHBondContact OG1-N 2.86Å; T53-Y397 HydrophobicContact CG2-CD1 4.38Å; T53-Y397 HydrophobicContact CG2-CE1 3.71Å
54	G	88	Confident	73.8	Confident	4 Å²	4	62.3 Å²	62.3	4%	0.041	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	53.6	29	-179.3	0	0	0	0	0	115.2	Y56 N361 L363	G54-Y56 VanDerWaalsContact C-N 3.29Å; G54-Y56 WeakPolarHBondContact O-CD2 3.5Å; G54-Y56 PolarHBondContact O-N 3.37Å; G54-N361 CarbonylContact C-O 3.58Å; G54-N361 WeakPolarHBondContact CA-O 3.43Å; G54-L363 VanDerWaalsContact CA-O 3.28Å; G54-L363 WeakPolarHBondContact CA-O 3.22Å; G54-L363 PolarHBondContact N-O 2.83Å
55	G	88.5	Confident	75	Confident	10 Å²	10	62 Å²	62	10%	0.103	34%	0.34	C	S	.	.	T	Hydrogen-bonded Turn	trans	78.1	5.6	-177.1	0	0	0	0	0	115.1	T53 N361 H399	T53-G55 PolarHBondContact O-N 2.99Å; G55-N361 PolarHBondContact N-O 2.94Å; G55-H399 PolarHBondContact O-ND1 2.96Å
56	Y	92.2	Very high	75.7	Confident	8 Å²	8	57.4 Å²	57.4	3%	0.031	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	152.7	175.7	-62.1	-103.3	0	0	0	111.3	Q52 T53 G54 F348 V385 I398 H399	Q52-Y56 CarbonylContact C-O 3.55Å; Q52-Y56 WeakPolarHBondContact CA-O 3.11Å; Q52-Y56 WeakPolarHBondContact CG-O 3.06Å; T53-Y56 PolarHBondContact N-O 2.79Å; T53-Y56 PolarHBondContact O-N 3.23Å; T53-Y56 VanDerWaalsContact O-O 3.11Å; G54-Y56 VanDerWaalsContact C-N 3.29Å; G54-Y56 WeakPolarHBondContact O-CD2 3.5Å; G54-Y56 PolarHBondContact O-N 3.37Å; Y56-F348 AromaticContact CD2-CE2 3.76Å; Y56-F348 HydrophobicContact CD2-CE2 3.76Å; Y56-F348 HydrophobicContact CD2-CZ 4.43Å; Y56-F348 HydrophobicContact CE2-CE2 4.33Å; Y56-V385 HydrophobicContact CD1-CG2 4.19Å; Y56-V385 HydrophobicContact CE1-CG2 3.59Å; Y56-I398 CarbonylContact C-O 3.47Å; Y56-I398 WeakPolarHBondContact CA-O 3.07Å; Y56-H399 HydrophobicContact CD1-CB 3.8Å; Y56-H399 HydrophobicContact CE1-CB 3.7Å
57	W	91	Very high	76.2	Confident	66 Å²	66	56.1 Å²	56.1	25%	0.25	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	128.4	174.7	-59.1	91.4	0	0	0	109.7	Q52 I59 Y397 I398	Q52-W57 HydrophobicContact CB-CD2 4.09Å; Q52-W57 HydrophobicContact CB-CE3 3.6Å; Q52-W57 HydrophobicContact CB-CH2 4.15Å; Q52-W57 HydrophobicContact CB-CZ3 3.65Å; Q52-W57 HydrophobicContact CG-CD2 3.78Å; Q52-W57 HydrophobicContact CG-CE3 3.83Å; Q52-W57 HydrophobicContact CG-CG 4.37Å; Q52-W57 HydrophobicContact CG-CH2 4.14Å; Q52-W57 HydrophobicContact CG-CZ2 4.06Å; Q52-W57 HydrophobicContact CG-CZ3 4.03Å; Q52-W57 VanDerWaalsContact OE1-CZ2 3.31Å; W57-I59 HydrophobicContact CB-CD1 4.44Å; W57-I59 PolarHBondContact O-N 3.12Å; W57-Y397 CarbonylContact O-C 3.59Å; W57-Y397 VanDerWaalsContact O-CA 3.25Å; W57-Y397 WeakPolarHBondContact O-CA 3.06Å; W57-I398 PolarHBondContact N-O 2.73Å; W57-I398 PolarHBondContact O-N 3.33Å
58	H	90.9	Very high	76.6	Confident	27 Å²	27	59 Å²	59	13%	0.125	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	123.1	168.9	-179.8	-117.6	0	0	0	109.5	Y51 G60 T61 Y397	Y51-H58 HydrophobicContact CD1-CB 3.95Å; Y51-H58 HydrophobicContact CG-CB 4.5Å; Y51-H58 PolarHBondContact O-N 3.28Å; H58-G60 VanDerWaalsContact NE2-C 3.32Å; H58-G60 PolarHBondContact NE2-O 3.4Å; H58-T61 PolarHBondContact CE1-OG1 2.76Å; H58-T61 PolarHBondContact NE2-OG1 2.85Å; H58-Y397 HydrophobicContact CB-CD1 4.16Å; H58-Y397 HydrophobicContact CB-CE1 3.56Å; H58-Y397 HydrophobicContact CB-CE2 4.44Å; H58-Y397 AromaticContact CD2-CE2 3.61Å; H58-Y397 AromaticContact CD2-CZ 3.61Å; H58-Y397 AromaticContact CG-CZ 3.94Å
59	I	88.3	Confident	76.9	Confident	57 Å²	57	64.7 Å²	64.7	29%	0.292	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	-43.6	-178.9	-61.1	-56.9	0	0	0	111.1	W57 T100 L396 I398	W57-I59 HydrophobicContact CB-CD1 4.44Å; W57-I59 PolarHBondContact O-N 3.12Å; I59-T100 WeakPolarHBondContact CG2-O 3.38Å; I59-L396 PolarHBondContact N-O 3.35Å; I59-I398 HydrophobicContact CD1-CB 4.33Å; I59-I398 HydrophobicContact CD1-CD1 4.08Å; I59-I398 HydrophobicContact CD1-CG1 4.25Å; I59-I398 HydrophobicContact CG1-CB 4.04Å; I59-I398 HydrophobicContact CG1-CD1 3.55Å; I59-I398 HydrophobicContact CG1-CG1 3.54Å
60	G	86.7	Confident	76.7	Confident	19 Å²	19	65 Å²	65	20%	0.196	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-171.7	157.8	-175.3	0	0	0	0	0	112.4	H58 L396	H58-G60 VanDerWaalsContact NE2-C 3.32Å; H58-G60 PolarHBondContact NE2-O 3.4Å; G60-L396 PolarHBondContact O-N 3.03Å
61	T	88	Confident	76.1	Confident	55 Å²	55	58.3 Å²	58.3	34%	0.337	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	125.1	170	-56	0	0	0	0	107.4	H58 Q393 L394 H395	H58-T61 PolarHBondContact CE1-OG1 2.76Å; H58-T61 PolarHBondContact NE2-OG1 2.85Å; T61-Q393 HydrophobicContact CG2-CB 3.97Å; T61-Q393 HydrophobicContact CG2-CG 4.14Å; T61-L394 WeakPolarHBondContact CA-O 3.42Å; T61-H395 VanDerWaalsContact CG2-CE1 3.46Å; T61-H395 WeakPolarHBondContact CG2-CE1 3.14Å; T61-H395 PolarHBondContact OG1-ND1 2.88Å
62	Q	85.6	Confident	75.9	Confident	57 Å²	57	60.5 Å²	60.5	27%	0.266	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	132	178.4	-175.5	54.2	58	0	0	109.6	F97 M102 L394	Q62-F97 HydrophobicContact CB-CE1 4.45Å; Q62-F97 HydrophobicContact CG-CD1 3.75Å; Q62-F97 HydrophobicContact CG-CE1 3.3Å; Q62-F97 HydrophobicContact CG-CZ 3.94Å; Q62-M102 HydrophobicContact CB-CB 4.09Å; Q62-M102 HydrophobicContact CB-CE 3.92Å; Q62-L394 PolarHBondContact N-O 3.39Å; Q62-L394 PolarHBondContact O-N 2.9Å
63	M	83	Confident	76	Confident	77 Å²	77	56 Å²	56	38%	0.379	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	135.3	169	-66.9	-64.8	-56.9	0	0	108.9	D65 R104 A391 Q393	M63-D65 PolarHBondContact O-N 3.42Å; M63-R104 PolarHBondContact O-NH2 3.07Å; M63-A391 WeakPolarHBondContact CE-O 3.26Å; M63-Q393 HydrophobicContact CE-CG 4.34Å; M63-Q393 HydrophobicContact SD-CB 4.47Å; M63-Q393 HydrophobicContact SD-CG 3.24Å; M63-Q393 WeakPolarHBondContact SD-CG 3.24Å
64	M	77.4	Confident	76.1	Confident	1 Å²	1	55.6 Å²	55.6	1%	0.005	29%	0.285	C	S	.	.			trans	-66.9	119.2	153.3	-167.6	164	177.4	0	0	106.1	C66 I73 C87 T89 Q93 G392	M64-C66 PolarHBondContact O-N 2.62Å; M64-C66 PolarHBondContact O-SG 3.2Å; M64-I73 HydrophobicContact SD-CG1 4.09Å; M64-C87 HydrophobicContact SD-CB 4.4Å; M64-C87 PolarHBondContact SD-SG 3.1Å; M64-T89 HydrophobicContact CE-CG2 3.34Å; M64-T89 HydrophobicContact CG-CG2 4.4Å; M64-T89 HydrophobicContact SD-CG2 3.33Å; M64-T89 WeakPolarHBondContact SD-CG2 3.25Å; M64-Q93 HydrophobicContact CE-CB 3.72Å; M64-G392 PolarHBondContact N-O 2.92Å
65	D	62.5	Low	76.5	Confident	93 Å²	93	56.3 Å²	56.3	50%	0.497	29%	0.288	S	S	.	.			trans	-73.3	84.6	179.7	-76	7.2	0	0	0	107.6	M63 R104	M63-D65 PolarHBondContact O-N 3.42Å; D65-R104 VanDerWaalsContact CG-CZ 3.41Å; D65-R104 VanDerWaalsContact CG-NH1 3.27Å; D65-R104 IonicContact OD1-CZ 2.82Å; D65-R104 IonicContact OD1-NH1 3.5Å; D65-R104 IonicContact OD1-NH2 2.75Å; D65-R104 PolarHBondContact OD1-NH2 3.32Å; D65-R104 IonicContact OD2-CZ 2.72Å; D65-R104 VanDerWaalsContact OD2-CZ 3.28Å; D65-R104 IonicContact OD2-NH1 3.68Å; D65-R104 PolarHBondContact OD2-NH1 3.23Å; D65-R104 IonicContact OD2-NH2 3.72Å; D65-R104 PolarHBondContact OD2-NH2 2.84Å
66	C	51.7	Low	76.8	Confident	37 Å²	37	55.9 Å²	55.9	25%	0.25	28%	0.284	C	S	.	.			trans	-72.6	134.5	-176.9	-63.3	0	0	0	0	109.9	M64 F68 D71	M64-C66 PolarHBondContact O-N 2.62Å; M64-C66 PolarHBondContact O-SG 3.2Å; C66-F68 WeakPolarHBondContact CB-O 3.48Å; C66-F68 PolarHBondContact O-N 2.87Å; C66-D71 HydrophobicContact CB-CB 3.41Å; C66-D71 VanDerWaalsContact CB-CB 3.41Å; C66-D71 VanDerWaalsContact CB-OD2 3.24Å; C66-D71 WeakPolarHBondContact CB-OD2 3.32Å; C66-D71 WeakPolarHBondContact SG-CB 3.36Å
67	L	49.9	Very low	77	Confident	118 Å²	118	56 Å²	56	62%	0.618	29%	0.286	S	S	*	.	S	Bend	trans	-62.2	-25.5	169.8	-84.4	156.3	0	0	0	110.2	Q93 T109	L67-Q93 VanDerWaalsContact CD1-NE2 3.29Å; L67-Q93 VanDerWaalsContact CG-NE2 3.3Å; L67-T109 HydrophobicContact CD1-CG2 4.3Å
68	F	50.3	Low	77.2	Confident	106 Å²	106	53.5 Å²	53.5	47%	0.465	28%	0.277	S	S	.	.	S	Bend	trans	-118.2	141.2	-177.4	-51.8	-77	0	0	0	111.4	C66 T70 D71 T91	C66-F68 WeakPolarHBondContact CB-O 3.48Å; C66-F68 PolarHBondContact O-N 2.87Å; F68-T70 PolarHBondContact O-N 3.49Å; F68-D71 WeakPolarHBondContact CD2-OD1 3.42Å; F68-D71 PolarHBondContact O-N 3.27Å; F68-T91 HydrophobicContact CD2-CG2 4.45Å
69	Q	52	Low	77.3	Confident	207 Å²	207	52.2 Å²	52.2	97%	0.967	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-15.2	179.7	-72.2	179.3	-14.6	0	0	114.4
70	T	54.1	Low	77.3	Confident	104 Å²	104	50.8 Å²	50.8	64%	0.638	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-130.7	32.6	-173.9	58.5	0	0	0	0	112.8	F68 R72	F68-T70 PolarHBondContact O-N 3.49Å; T70-R72 PolarHBondContact O-N 3.37Å
71	D	58.5	Low	77.3	Confident	2 Å²	2	51.2 Å²	51.2	1%	0.011	26%	0.263	C	S	.	.			trans	-68	105	173.7	-86.1	-12.6	0	0	0	110.6	C66 F68 I73 T89 T91 Q93	C66-D71 HydrophobicContact CB-CB 3.41Å; C66-D71 VanDerWaalsContact CB-CB 3.41Å; C66-D71 VanDerWaalsContact CB-OD2 3.24Å; C66-D71 WeakPolarHBondContact CB-OD2 3.32Å; C66-D71 WeakPolarHBondContact SG-CB 3.36Å; F68-D71 WeakPolarHBondContact CD2-OD1 3.42Å; F68-D71 PolarHBondContact O-N 3.27Å; D71-I73 PolarHBondContact O-N 2.92Å; D71-T89 HydrophobicContact CB-CG2 3.89Å; D71-T91 WeakPolarHBondContact OD1-CB 3.37Å; D71-T91 WeakPolarHBondContact OD1-CG2 3.46Å; D71-T91 PolarHBondContact OD1-OG1 3.17Å; D71-T91 PolarHBondContact OD2-OG1 2.86Å; D71-Q93 PolarHBondContact OD2-OE1 3.25Å
72	R	78.8	Confident	77.3	Confident	105 Å²	105	48.7 Å²	48.7	40%	0.396	25%	0.248	S	C	.	.			trans	-77	113	175.3	-64	-172.9	-92	-123.3	-6.3	108.3	T70 A74 T89 R90 E390	T70-R72 PolarHBondContact O-N 3.37Å; R72-A74 PolarHBondContact O-N 2.87Å; R72-T89 WeakPolarHBondContact O-CA 3.35Å; R72-R90 PolarHBondContact O-N 3.14Å; R72-E390 WeakPolarHBondContact CA-O 3.29Å; R72-E390 HydrophobicContact CB-CG 4.36Å; R72-E390 WeakPolarHBondContact CD-OE1 3.24Å; R72-E390 HydrophobicContact CG-CG 3.7Å; R72-E390 IonicContact NH1-OE1 3.61Å
73	I	89.5	Confident	77.5	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-51.1	131.6	166.2	-66.5	169	0	0	0	107.3	M64 D71 V374 A388 G392 L394	M64-I73 HydrophobicContact SD-CG1 4.09Å; D71-I73 PolarHBondContact O-N 2.92Å; I73-V374 VanDerWaalsContact O-CG1 3.25Å; I73-V374 WeakPolarHBondContact O-CG1 3.28Å; I73-A388 HydrophobicContact CD1-CB 4.12Å; I73-A388 HydrophobicContact CG2-CB 3.84Å; I73-G392 VanDerWaalsContact CD1-CA 3.49Å; I73-L394 HydrophobicContact CD1-CD2 3.81Å; I73-L394 HydrophobicContact CD1-CG 4.29Å
74	A	91.8	Very high	78	Confident	14 Å²	14	43 Å²	43	12%	0.116	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	-46	175.2	0	0	0	0	0	110.4	R72 V88 R90 L128	R72-A74 PolarHBondContact O-N 2.87Å; A74-V88 HydrophobicContact CB-CG2 4.28Å; A74-V88 PolarHBondContact N-O 2.95Å; A74-R90 HydrophobicContact CB-CG 3.79Å; A74-L128 WeakPolarHBondContact CB-O 3.35Å
75	D	95.1	Very high	78.9	Confident	20 Å²	20	42.9 Å²	42.9	11%	0.107	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.6	159.8	-175.2	-169.6	29.9	0	0	0	112.1	C87 V88 Q130 V131	D75-C87 WeakPolarHBondContact O-CA 3.26Å; D75-V88 HydrophobicContact CB-CG2 3.9Å; D75-V88 PolarHBondContact N-O 2.85Å; D75-V88 PolarHBondContact O-N 2.93Å; D75-Q130 WeakPolarHBondContact OD2-CA 3.19Å; D75-Q130 WeakPolarHBondContact OD2-CG 3.48Å; D75-V131 HydrophobicContact CB-CG1 4.39Å; D75-V131 PolarHBondContact OD2-N 3.41Å
76	V	95.6	Very high	80.4	Confident	1 Å²	1	38.5 Å²	38.5	1%	0.006	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	139.4	175.5	68.3	0	0	0	0	109.4	I85 W86 C87 A375 D377 V386 A388 L394	V76-I85 HydrophobicContact CG2-CG2 3.67Å; V76-W86 CarbonylContact C-O 3.58Å; V76-W86 VanDerWaalsContact CA-O 3.26Å; V76-W86 WeakPolarHBondContact CA-O 3.28Å; V76-W86 WeakPolarHBondContact CG2-O 3.3Å; V76-C87 HydrophobicContact CG2-CB 4.31Å; V76-A375 HydrophobicContact CG1-CB 3.87Å; V76-D377 HydrophobicContact CG1-CB 4.44Å; V76-V386 HydrophobicContact CB-CG1 4.43Å; V76-V386 HydrophobicContact CG1-CG1 3.89Å; V76-V386 HydrophobicContact CG2-CB 4.49Å; V76-V386 HydrophobicContact CG2-CG1 3.63Å; V76-V386 HydrophobicContact CG2-CG2 4.02Å; V76-A388 HydrophobicContact CB-CB 4Å; V76-A388 HydrophobicContact CG1-CB 3.81Å; V76-L394 HydrophobicContact CB-CD2 4.42Å; V76-L394 HydrophobicContact CG2-CD2 3.98Å
77	A	95.8	Very high	82.4	Confident	11 Å²	11	36.7 Å²	36.7	9%	0.091	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	138.8	178.4	0	0	0	0	0	111.6	W86 V131 P133 D377	A77-W86 PolarHBondContact N-O 3.05Å; A77-W86 PolarHBondContact O-N 2.72Å; A77-V131 HydrophobicContact CB-CG1 4.01Å; A77-P133 HydrophobicContact CB-CG 4.23Å; A77-D377 WeakPolarHBondContact CA-OD2 3.19Å
78	F	96.3	Very high	84.5	Confident	13 Å²	13	31.1 Å²	31.1	6%	0.057	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	138.7	165.8	-76.5	-78.8	0	0	0	110.4	I85 P133 D377 C384 V386 L396 F406	F78-I85 HydrophobicContact CD1-CD1 4.38Å; F78-I85 HydrophobicContact CD1-CG1 3.61Å; F78-I85 HydrophobicContact CE1-CD1 3.73Å; F78-I85 HydrophobicContact CE1-CG1 3.47Å; F78-I85 VanDerWaalsContact CE1-CG1 3.47Å; F78-I85 HydrophobicContact CZ-CD1 4.38Å; F78-I85 HydrophobicContact CZ-CG1 4.35Å; F78-P133 WeakPolarHBondContact O-CG 3.42Å; F78-D377 HydrophobicContact CD2-CB 4.2Å; F78-D377 WeakPolarHBondContact CE2-O 3.4Å; F78-D377 PolarHBondContact N-OD2 2.82Å; F78-C384 HydrophobicContact CE1-CB 4.34Å; F78-C384 HydrophobicContact CZ-CB 4Å; F78-V386 HydrophobicContact CD2-CG1 4.06Å; F78-V386 HydrophobicContact CE2-CB 3.88Å; F78-V386 HydrophobicContact CE2-CG1 3.51Å; F78-V386 HydrophobicContact CZ-CB 3.79Å; F78-V386 HydrophobicContact CZ-CG1 3.89Å; F78-L396 HydrophobicContact CE1-CD1 4.3Å; F78-L396 HydrophobicContact CZ-CD1 3.96Å; F78-F406 HydrophobicContact CD1-CB 4Å; F78-F406 AromaticContact CD1-CD1 3.95Å; F78-F406 HydrophobicContact CD1-CD1 3.95Å; F78-F406 AromaticContact CD1-CD2 3.84Å; F78-F406 HydrophobicContact CD1-CD2 3.84Å; F78-F406 HydrophobicContact CD1-CE1 4.4Å; F78-F406 HydrophobicContact CD1-CE2 4.3Å; F78-F406 AromaticContact CD1-CG 3.66Å; F78-F406 HydrophobicContact CD1-CG 3.66Å; F78-F406 HydrophobicContact CE1-CB 4.37Å; F78-F406 AromaticContact CE1-CD1 3.45Å; F78-F406 HydrophobicContact CE1-CD1 3.45Å; F78-F406 VanDerWaalsContact CE1-CD1 3.45Å; F78-F406 AromaticContact CE1-CD2 3.99Å; F78-F406 HydrophobicContact CE1-CD2 3.99Å; F78-F406 AromaticContact CE1-CE1 3.6Å; F78-F406 HydrophobicContact CE1-CE1 3.6Å; F78-F406 HydrophobicContact CE1-CE2 4.12Å; F78-F406 AromaticContact CE1-CG 3.67Å; F78-F406 HydrophobicContact CE1-CG 3.67Å; F78-F406 AromaticContact CE1-CZ 3.93Å; F78-F406 HydrophobicContact CE1-CZ 3.93Å; F78-F406 HydrophobicContact CZ-CD1 4.38Å; F78-F406 HydrophobicContact CZ-CE1 4.46Å
79	D	92.8	Very high	86.3	Confident	0 Å²	0	26 Å²	26	0%	0	13%	0.132	C	C	.	.			trans	-70.4	125.2	169.3	-166.1	-67.9	0	0	0	109.7	L81 E82 L84 W86 P133 K155 N407	D79-L81 PolarHBondContact O-N 3.08Å; D79-L81 PolarHBondContact OD1-N 3.15Å; D79-E82 HydrophobicContact CB-CB 4.47Å; D79-E82 PolarHBondContact OD1-N 2.76Å; D79-L84 HydrophobicContact CB-CB 3.79Å; D79-L84 WeakPolarHBondContact CB-O 3.37Å; D79-L84 PolarHBondContact N-O 2.88Å; D79-W86 PolarHBondContact OD2-NE1 3.27Å; D79-W86 VanDerWaalsContact OD2-NE1 3.11Å; D79-P133 HydrophobicContact CB-CB 4.33Å; D79-K155 IonicContact OD1-NZ 2.79Å; D79-K155 PolarHBondContact OD1-NZ 3.3Å; D79-K155 WeakPolarHBondContact OD2-CD 3.29Å; D79-K155 WeakPolarHBondContact OD2-CE 3.48Å; D79-K155 IonicContact OD2-NZ 3.44Å; D79-K155 PolarHBondContact OD2-NZ 3.27Å; D79-N407 PolarHBondContact O-ND2 2.76Å; D79-N407 PolarHBondContact O-OD1 3.4Å
80	P	88.2	Confident	88	Confident	26 Å²	26	21.2 Å²	21.2	17%	0.169	11%	0.105	C	C	.	.	S	Bend	trans	-74.1	-7.2	-174.6	30	-37.7	0	0	0	113.8	P135 N407	P80-P135 HydrophobicContact CB-CB 4.19Å; P80-P135 HydrophobicContact CG-CB 3.74Å; P80-N407 PolarHBondContact O-OD1 2.96Å
81	L	86.7	Confident	89.3	Confident	29 Å²	29	19 Å²	19	15%	0.152	9%	0.091	C	C	.	.	S	Bend	trans	-125.4	-41.4	-175	-63.3	176.9	0	0	0	112.3	D79 P137 P410 L411	D79-L81 PolarHBondContact O-N 3.08Å; D79-L81 PolarHBondContact OD1-N 3.15Å; L81-P137 HydrophobicContact CD1-CB 4.46Å; L81-P137 HydrophobicContact CD1-CG 4.3Å; L81-P137 HydrophobicContact CD2-CG 4.4Å; L81-P410 CarbonylContact O-C 3.58Å; L81-P410 VanDerWaalsContact O-CA 3.28Å; L81-P410 WeakPolarHBondContact O-CA 3.37Å; L81-L411 HydrophobicContact CB-CD1 4.04Å; L81-L411 HydrophobicContact CB-CG 4.39Å; L81-L411 HydrophobicContact CD1-CD1 4.18Å; L81-L411 HydrophobicContact CG-CD1 4.49Å; L81-L411 PolarHBondContact O-N 3.06Å
82	E	87.9	Confident	90.5	Very high	2 Å²	2	19 Å²	19	1%	0.009	9%	0.092	C	C	.	.	S	Bend	trans	-104.4	161.8	-177.2	-70.3	168.6	-140.4	0	0	111	D79 L84 H140 K155 N407 L411	D79-E82 HydrophobicContact CB-CB 4.47Å; D79-E82 PolarHBondContact OD1-N 2.76Å; E82-L84 HydrophobicContact CB-CD1 4.17Å; E82-L84 HydrophobicContact CB-CG 4.16Å; E82-L84 PolarHBondContact O-N 2.82Å; E82-L84 VanDerWaalsContact OE2-CD1 3.31Å; E82-L84 WeakPolarHBondContact OE2-CD1 3.48Å; E82-H140 IonicContact OE1-CE1 3.81Å; E82-H140 IonicContact OE1-ND1 3.8Å; E82-H140 PolarHBondContact OE1-ND1 2.77Å; E82-K155 WeakPolarHBondContact OE1-CD 3.35Å; E82-K155 IonicContact OE1-NZ 4Å; E82-K155 PolarHBondContact OE1-NZ 2.82Å; E82-N407 PolarHBondContact O-ND2 3.21Å; E82-L411 HydrophobicContact CG-CB 4.35Å
83	E	89.9	Confident	90.9	Very high	13 Å²	13	14.2 Å²	14.2	6%	0.061	7%	0.074	C	C	.	.	S	Bend	trans	-80.4	60.1	176.1	-67.4	-66.3	131.6	0	0	110.1	Y98 S99 Q405 F406 N407 P410	E83-Y98 HydrophobicContact CB-CE2 4.15Å; E83-Y98 WeakPolarHBondContact O-CA 3.37Å; E83-Y98 WeakPolarHBondContact O-CD2 3.37Å; E83-S99 PolarHBondContact O-N 2.77Å; E83-Q405 WeakPolarHBondContact OE2-CA 3.15Å; E83-F406 HydrophobicContact CB-CD2 4.4Å; E83-F406 VanDerWaalsContact CD-N 3.34Å; E83-F406 PolarHBondContact OE1-N 3.49Å; E83-F406 VanDerWaalsContact OE1-N 3.12Å; E83-F406 WeakPolarHBondContact OE2-CD2 3.49Å; E83-F406 WeakPolarHBondContact OE2-CG 3.46Å; E83-F406 PolarHBondContact OE2-N 3.4Å; E83-N407 PolarHBondContact OE1-N 3.06Å; E83-P410 HydrophobicContact CG-CB 3.7Å; E83-P410 HydrophobicContact CG-CG 4.13Å; E83-P410 WeakPolarHBondContact OE1-CB 2.98Å
84	L	93.1	Very high	90.9	Very high	0 Å²	0	14.2 Å²	14.2	0%	0	7%	0.074	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	145.6	-177.8	-67.8	175.2	0	0	0	111.5	D79 E82 W86 F97 Y98 Y105 T413	D79-L84 HydrophobicContact CB-CB 3.79Å; D79-L84 WeakPolarHBondContact CB-O 3.37Å; D79-L84 PolarHBondContact N-O 2.88Å; E82-L84 HydrophobicContact CB-CD1 4.17Å; E82-L84 HydrophobicContact CB-CG 4.16Å; E82-L84 PolarHBondContact O-N 2.82Å; E82-L84 VanDerWaalsContact OE2-CD1 3.31Å; E82-L84 WeakPolarHBondContact OE2-CD1 3.48Å; L84-W86 HydrophobicContact CD1-CZ2 4.19Å; L84-F97 CarbonylContact C-O 3.45Å; L84-F97 VanDerWaalsContact CA-O 3.27Å; L84-F97 WeakPolarHBondContact CA-O 3.44Å; L84-Y98 HydrophobicContact CD2-CD2 4.2Å; L84-Y105 HydrophobicContact CD1-CD1 3.95Å; L84-Y105 HydrophobicContact CD1-CE1 3.98Å; L84-Y105 HydrophobicContact CD2-CD1 3.65Å; L84-Y105 HydrophobicContact CD2-CD2 4.47Å; L84-Y105 HydrophobicContact CD2-CE1 4.35Å; L84-Y105 HydrophobicContact CD2-CG 3.73Å; L84-Y105 HydrophobicContact CG-CD1 4.5Å; L84-T413 HydrophobicContact CD1-CG2 4.22Å; L84-T413 HydrophobicContact CD2-CG2 4.08Å; L84-T413 HydrophobicContact CG-CG2 4.23Å
85	I	95.4	Very high	90.8	Very high	0 Å²	0	13.6 Å²	13.6	0%	0	7%	0.069	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	119.4	167.5	-63.8	160.3	0	0	0	107.5	V76 F78 A96 F97 M102 V386 L396 F406	V76-I85 HydrophobicContact CG2-CG2 3.67Å; F78-I85 HydrophobicContact CD1-CD1 4.38Å; F78-I85 HydrophobicContact CD1-CG1 3.61Å; F78-I85 HydrophobicContact CE1-CD1 3.73Å; F78-I85 HydrophobicContact CE1-CG1 3.47Å; F78-I85 VanDerWaalsContact CE1-CG1 3.47Å; F78-I85 HydrophobicContact CZ-CD1 4.38Å; F78-I85 HydrophobicContact CZ-CG1 4.35Å; I85-A96 CarbonylContact O-C 3.45Å; I85-A96 VanDerWaalsContact O-CA 3.23Å; I85-A96 WeakPolarHBondContact O-CA 3.42Å; I85-F97 HydrophobicContact CB-CB 4.48Å; I85-F97 PolarHBondContact N-O 2.76Å; I85-F97 PolarHBondContact O-N 2.87Å; I85-M102 HydrophobicContact CD1-CE 4.37Å; I85-M102 HydrophobicContact CD1-SD 3.42Å; I85-M102 WeakPolarHBondContact CD1-SD 3.24Å; I85-V386 HydrophobicContact CG2-CG1 4.44Å; I85-V386 HydrophobicContact CG2-CG2 4.26Å; I85-L396 HydrophobicContact CD1-CD1 4.19Å; I85-F406 HydrophobicContact CD1-CE1 4.31Å; I85-F406 HydrophobicContact CD1-CE2 3.82Å; I85-F406 HydrophobicContact CD1-CZ 3.51Å; I85-F406 HydrophobicContact CG1-CD2 4.39Å; I85-F406 HydrophobicContact CG1-CE2 3.73Å; I85-F406 HydrophobicContact CG1-CZ 3.95Å
86	W	95.5	Very high	90.6	Very high	0 Å²	0	12.6 Å²	12.6	0%	0	6%	0.064	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	139.4	176.8	-70.1	90.6	0	0	0	110.6	V76 A77 D79 L84 M94 A96 I106 V131 P133 V142 K155	V76-W86 CarbonylContact C-O 3.58Å; V76-W86 VanDerWaalsContact CA-O 3.26Å; V76-W86 WeakPolarHBondContact CA-O 3.28Å; V76-W86 WeakPolarHBondContact CG2-O 3.3Å; A77-W86 PolarHBondContact N-O 3.05Å; A77-W86 PolarHBondContact O-N 2.72Å; D79-W86 PolarHBondContact OD2-NE1 3.27Å; D79-W86 VanDerWaalsContact OD2-NE1 3.11Å; L84-W86 HydrophobicContact CD1-CZ2 4.19Å; W86-M94 HydrophobicContact CE3-CG 3.95Å; W86-M94 HydrophobicContact CE3-SD 3.88Å; W86-M94 HydrophobicContact CZ3-CE 3.93Å; W86-M94 HydrophobicContact CZ3-CG 4.03Å; W86-M94 HydrophobicContact CZ3-SD 3.77Å; W86-A96 HydrophobicContact CD2-CB 3.95Å; W86-A96 HydrophobicContact CE3-CB 3.83Å; W86-A96 HydrophobicContact CH2-CB 3.92Å; W86-A96 HydrophobicContact CZ2-CB 4.04Å; W86-A96 HydrophobicContact CZ3-CB 3.83Å; W86-I106 HydrophobicContact CH2-CD1 3.77Å; W86-I106 HydrophobicContact CH2-CG1 4.32Å; W86-I106 HydrophobicContact CZ3-CD1 3.98Å; W86-I106 HydrophobicContact CZ3-CG1 4.39Å; W86-V131 HydrophobicContact CB-CG1 4.18Å; W86-V131 HydrophobicContact CB-CG2 3.89Å; W86-V131 HydrophobicContact CG-CG2 4.49Å; W86-P133 HydrophobicContact CG-CB 4.41Å; W86-V142 HydrophobicContact CD2-CB 4.47Å; W86-V142 HydrophobicContact CD2-CG2 3.93Å; W86-V142 HydrophobicContact CE3-CB 4.46Å; W86-V142 HydrophobicContact CE3-CG1 4.32Å; W86-V142 HydrophobicContact CE3-CG2 3.94Å; W86-V142 HydrophobicContact CG-CG2 4.4Å; W86-V142 HydrophobicContact CH2-CB 4.31Å; W86-V142 HydrophobicContact CH2-CG1 3.84Å; W86-V142 HydrophobicContact CZ2-CB 4.31Å; W86-V142 HydrophobicContact CZ2-CG1 4.32Å; W86-V142 HydrophobicContact CZ3-CB 4.37Å; W86-V142 HydrophobicContact CZ3-CG1 3.83Å; W86-V142 HydrophobicContact CZ3-CG2 4.3Å; W86-K155 HydrophobicContact CH2-CB 4.29Å; W86-K155 WeakPolarHBondContact CH2-O 3.48Å; W86-K155 HydrophobicContact CZ2-CB 3.8Å; W86-K155 HydrophobicContact CZ2-CD 4.48Å; W86-K155 HydrophobicContact CZ2-CG 3.74Å
87	C	93.3	Very high	90.3	Very high	0 Å²	0	12.6 Å²	12.6	0%	0	6%	0.063	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	150	171.2	69.7	0	0	0	0	111.1	M64 D75 V76 M94 S95 L394	M64-C87 HydrophobicContact SD-CB 4.4Å; M64-C87 PolarHBondContact SD-SG 3.1Å; D75-C87 WeakPolarHBondContact O-CA 3.26Å; V76-C87 HydrophobicContact CG2-CB 4.31Å; C87-M94 WeakPolarHBondContact O-CA 3.49Å; C87-S95 PolarHBondContact N-O 2.85Å; C87-S95 PolarHBondContact O-N 2.79Å; C87-L394 HydrophobicContact CB-CD1 4.08Å; C87-L394 HydrophobicContact CB-CD2 4.3Å
88	V	92.8	Very high	90	Very high	0 Å²	0	15.3 Å²	15.3	0%	0	7%	0.072	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	145.6	179.8	-73	0	0	0	0	110.8	A74 D75 Q93 M94 L128 V131 V144	A74-V88 HydrophobicContact CB-CG2 4.28Å; A74-V88 PolarHBondContact N-O 2.95Å; D75-V88 HydrophobicContact CB-CG2 3.9Å; D75-V88 PolarHBondContact N-O 2.85Å; D75-V88 PolarHBondContact O-N 2.93Å; V88-Q93 CarbonylContact C-O 3.44Å; V88-Q93 VanDerWaalsContact CA-O 3.25Å; V88-Q93 WeakPolarHBondContact CA-O 3.33Å; V88-M94 HydrophobicContact CG1-CB 3.91Å; V88-M94 HydrophobicContact CG1-CG 3.8Å; V88-M94 HydrophobicContact CG1-SD 4.46Å; V88-L128 HydrophobicContact CB-CB 4.27Å; V88-L128 HydrophobicContact CB-CD1 3.91Å; V88-L128 HydrophobicContact CG1-CD1 4.09Å; V88-V131 HydrophobicContact CB-CB 4.49Å; V88-V131 HydrophobicContact CG1-CB 3.8Å; V88-V131 HydrophobicContact CG1-CG1 4.45Å; V88-V131 HydrophobicContact CG1-CG2 4.13Å; V88-V131 HydrophobicContact CG2-CB 3.87Å; V88-V131 HydrophobicContact CG2-CG1 4.06Å; V88-V144 HydrophobicContact CG1-CG1 4.06Å; V88-V144 HydrophobicContact CG1-CG2 4.28Å
89	T	88.7	Confident	89.6	Confident	0 Å²	0	15.7 Å²	15.7	0%	0	8%	0.076	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	154.2	174.2	60.6	0	0	0	0	111.5	M64 D71 R72 T91 G92 Q93 L128	M64-T89 HydrophobicContact CE-CG2 3.34Å; M64-T89 HydrophobicContact CG-CG2 4.4Å; M64-T89 HydrophobicContact SD-CG2 3.33Å; M64-T89 WeakPolarHBondContact SD-CG2 3.25Å; D71-T89 HydrophobicContact CB-CG2 3.89Å; R72-T89 WeakPolarHBondContact O-CA 3.35Å; T89-T91 PolarHBondContact O-N 3.31Å; T89-T91 VanDerWaalsContact O-N 3.08Å; T89-T91 PolarHBondContact OG1-OG1 3.49Å; T89-G92 PolarHBondContact O-N 3.2Å; T89-Q93 HydrophobicContact CG2-CB 4.49Å; T89-Q93 PolarHBondContact N-O 2.79Å; T89-Q93 VanDerWaalsContact OG1-CB 3.29Å; T89-Q93 WeakPolarHBondContact OG1-CB 3.41Å; T89-Q93 PolarHBondContact OG1-N 2.8Å; T89-L128 VanDerWaalsContact O-CB 3.26Å; T89-L128 WeakPolarHBondContact O-CB 3.39Å; T89-L128 WeakPolarHBondContact O-CD1 3.29Å; T89-L128 VanDerWaalsContact O-CG 3.29Å; T89-L128 WeakPolarHBondContact O-CG 3.38Å
90	R	87.2	Confident	89.4	Confident	106 Å²	106	16.8 Å²	16.8	40%	0.4	8%	0.083	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-18.8	174.4	-64.9	-177.3	-177.6	178.3	-0.6	113.2	R72 A74 G127	R72-R90 PolarHBondContact O-N 3.14Å; A74-R90 HydrophobicContact CB-CG 3.79Å; R90-G127 WeakPolarHBondContact O-CA 3.26Å
91	T	82.1	Confident	89.3	Confident	56 Å²	56	19.3 Å²	19.3	34%	0.344	10%	0.098	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.8	4.7	-178.6	53.2	0	0	0	0	114.2	F68 D71 T89 L112	F68-T91 HydrophobicContact CD2-CG2 4.45Å; D71-T91 WeakPolarHBondContact OD1-CB 3.37Å; D71-T91 WeakPolarHBondContact OD1-CG2 3.46Å; D71-T91 PolarHBondContact OD1-OG1 3.17Å; D71-T91 PolarHBondContact OD2-OG1 2.86Å; T89-T91 PolarHBondContact O-N 3.31Å; T89-T91 VanDerWaalsContact O-N 3.08Å; T89-T91 PolarHBondContact OG1-OG1 3.49Å; T91-L112 WeakPolarHBondContact O-CD1 3.47Å
92	G	83.6	Confident	89.3	Confident	2 Å²	2	18.2 Å²	18.2	2%	0.021	9%	0.092	C	C	.	.	S	Bend	trans	94	26.8	174.7	0	0	0	0	0	113.7	T89 T109 V110	T89-G92 PolarHBondContact O-N 3.2Å; G92-T109 CarbonylContact O-C 3.12Å; G92-T109 VanDerWaalsContact O-CA 3.24Å; G92-T109 WeakPolarHBondContact O-CA 3.3Å; G92-V110 WeakPolarHBondContact CA-O 3.48Å; G92-V110 PolarHBondContact O-N 2.88Å
93	Q	87.1	Confident	89.1	Confident	6 Å²	6	23.9 Å²	23.9	3%	0.028	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	142.9	168.7	-57.3	-172.2	-31.2	0	0	111	M64 L67 D71 V88 T89	M64-Q93 HydrophobicContact CE-CB 3.72Å; L67-Q93 VanDerWaalsContact CD1-NE2 3.29Å; L67-Q93 VanDerWaalsContact CG-NE2 3.3Å; D71-Q93 PolarHBondContact OD2-OE1 3.25Å; V88-Q93 CarbonylContact C-O 3.44Å; V88-Q93 VanDerWaalsContact CA-O 3.25Å; V88-Q93 WeakPolarHBondContact CA-O 3.33Å; T89-Q93 HydrophobicContact CG2-CB 4.49Å; T89-Q93 PolarHBondContact N-O 2.79Å; T89-Q93 VanDerWaalsContact OG1-CB 3.29Å; T89-Q93 WeakPolarHBondContact OG1-CB 3.41Å; T89-Q93 PolarHBondContact OG1-N 2.8Å
94	M	88.9	Confident	88.8	Confident	0 Å²	0	27.4 Å²	27.4	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	131.9	169.3	-179.4	175.9	64.8	0	0	108.7	W86 C87 V88 T107 L108 V110 V142 V144 Y153	W86-M94 HydrophobicContact CE3-CG 3.95Å; W86-M94 HydrophobicContact CE3-SD 3.88Å; W86-M94 HydrophobicContact CZ3-CE 3.93Å; W86-M94 HydrophobicContact CZ3-CG 4.03Å; W86-M94 HydrophobicContact CZ3-SD 3.77Å; C87-M94 WeakPolarHBondContact O-CA 3.49Å; V88-M94 HydrophobicContact CG1-CB 3.91Å; V88-M94 HydrophobicContact CG1-CG 3.8Å; V88-M94 HydrophobicContact CG1-SD 4.46Å; M94-T107 WeakPolarHBondContact O-CA 3.31Å; M94-L108 HydrophobicContact CE-CD1 3.9Å; M94-L108 HydrophobicContact CE-CD2 3.77Å; M94-L108 HydrophobicContact CE-CG 4.01Å; M94-L108 PolarHBondContact N-O 2.99Å; M94-L108 PolarHBondContact O-N 2.85Å; M94-V110 HydrophobicContact CB-CG2 3.8Å; M94-V142 HydrophobicContact CE-CG1 3.9Å; M94-V142 HydrophobicContact SD-CG1 3.88Å; M94-V142 HydrophobicContact SD-CG2 4.18Å; M94-V144 HydrophobicContact SD-CG2 3.37Å; M94-V144 WeakPolarHBondContact SD-CG2 3.46Å; M94-Y153 HydrophobicContact CE-CD1 4.35Å; M94-Y153 HydrophobicContact CE-CD2 4.14Å; M94-Y153 HydrophobicContact CE-CG 3.91Å
95	S	89.8	Confident	88.4	Confident	0 Å²	0	29.3 Å²	29.3	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	153.4	175.7	-61.7	0	0	0	0	111.1	C87 I106 T107	C87-S95 PolarHBondContact N-O 2.85Å; C87-S95 PolarHBondContact O-N 2.79Å; S95-I106 CarbonylContact C-O 3.47Å; S95-I106 VanDerWaalsContact CA-O 3.25Å; S95-I106 WeakPolarHBondContact CA-O 3.5Å; S95-T107 WeakPolarHBondContact OG-CB 3.32Å; S95-T107 WeakPolarHBondContact OG-CG2 2.85Å; S95-T107 PolarHBondContact OG-OG1 3.45Å
96	A	91	Very high	87.8	Confident	0 Å²	0	30.7 Å²	30.7	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	142.2	170.9	0	0	0	0	0	110.1	I85 W86 Y105 I106	I85-A96 CarbonylContact O-C 3.45Å; I85-A96 VanDerWaalsContact O-CA 3.23Å; I85-A96 WeakPolarHBondContact O-CA 3.42Å; W86-A96 HydrophobicContact CD2-CB 3.95Å; W86-A96 HydrophobicContact CE3-CB 3.83Å; W86-A96 HydrophobicContact CH2-CB 3.92Å; W86-A96 HydrophobicContact CZ2-CB 4.04Å; W86-A96 HydrophobicContact CZ3-CB 3.83Å; A96-Y105 HydrophobicContact CB-CD1 3.96Å; A96-Y105 WeakPolarHBondContact O-CB 3.35Å; A96-Y105 PolarHBondContact O-N 2.77Å; A96-I106 HydrophobicContact CB-CG1 3.92Å; A96-I106 PolarHBondContact N-O 3.36Å; A96-I106 PolarHBondContact O-N 3Å
97	F	91	Very high	87.3	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	136.3	176.9	-61.5	-85.1	0	0	0	110.3	Q62 L84 I85 M102 E103 R104 L394	Q62-F97 HydrophobicContact CB-CE1 4.45Å; Q62-F97 HydrophobicContact CG-CD1 3.75Å; Q62-F97 HydrophobicContact CG-CE1 3.3Å; Q62-F97 HydrophobicContact CG-CZ 3.94Å; L84-F97 CarbonylContact C-O 3.45Å; L84-F97 VanDerWaalsContact CA-O 3.27Å; L84-F97 WeakPolarHBondContact CA-O 3.44Å; I85-F97 HydrophobicContact CB-CB 4.48Å; I85-F97 PolarHBondContact N-O 2.76Å; I85-F97 PolarHBondContact O-N 2.87Å; F97-M102 HydrophobicContact CB-SD 4.47Å; F97-M102 WeakPolarHBondContact CD1-O 3.43Å; F97-E103 CarbonylContact C-O 3.53Å; F97-E103 VanDerWaalsContact CA-O 3.29Å; F97-E103 WeakPolarHBondContact CA-O 3.33Å; F97-R104 HydrophobicContact CD1-CB 4.21Å; F97-R104 HydrophobicContact CE1-CB 4.1Å; F97-R104 HydrophobicContact CE1-CG 4.37Å; F97-L394 HydrophobicContact CD2-CD1 3.55Å; F97-L394 HydrophobicContact CE2-CD1 3.3Å; F97-L394 HydrophobicContact CZ-CD1 4.19Å
98	Y	89.6	Confident	86.9	Confident	69 Å²	69	35.1 Å²	35.1	27%	0.271	17%	0.172	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	127.9	-176.5	178.9	-112.1	0	0	0	111.7	E83 L84 T101 M102 E103 T413 F415	E83-Y98 HydrophobicContact CB-CE2 4.15Å; E83-Y98 WeakPolarHBondContact O-CA 3.37Å; E83-Y98 WeakPolarHBondContact O-CD2 3.37Å; L84-Y98 HydrophobicContact CD2-CD2 4.2Å; Y98-T101 PolarHBondContact O-OG1 2.78Å; Y98-T101 VanDerWaalsContact O-OG1 3.06Å; Y98-M102 PolarHBondContact O-N 3Å; Y98-E103 PolarHBondContact N-O 3.22Å; Y98-E103 PolarHBondContact O-N 3.23Å; Y98-T413 HydrophobicContact CD2-CG2 4.13Å; Y98-T413 HydrophobicContact CE2-CG2 4.29Å; Y98-F415 HydrophobicContact CD1-CE1 4.39Å; Y98-F415 AromaticContact CD1-CZ 3.89Å; Y98-F415 HydrophobicContact CD1-CZ 3.89Å; Y98-F415 HydrophobicContact CD2-CE1 4.49Å; Y98-F415 AromaticContact CD2-CZ 3.77Å; Y98-F415 HydrophobicContact CD2-CZ 3.77Å; Y98-F415 AromaticContact CE1-CZ 3.81Å; Y98-F415 HydrophobicContact CE1-CZ 3.81Å; Y98-F415 HydrophobicContact CE2-CE2 4.24Å; Y98-F415 AromaticContact CE2-CZ 3.69Å; Y98-F415 HydrophobicContact CE2-CZ 3.69Å; Y98-F415 HydrophobicContact CG-CE1 4.29Å; Y98-F415 AromaticContact CG-CZ 3.86Å; Y98-F415 HydrophobicContact CG-CZ 3.86Å; Y98-F415 AromaticContact CZ-CZ 3.7Å
99	S	87.6	Confident	86.5	Confident	21 Å²	21	39.6 Å²	39.6	15%	0.147	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	52.6	-168.2	169.8	-163.8	0	0	0	0	114	E83 T101 M102 F406	E83-S99 PolarHBondContact O-N 2.77Å; S99-T101 PolarHBondContact O-N 2.97Å; S99-M102 PolarHBondContact O-N 2.95Å; S99-F406 VanDerWaalsContact O-CZ 3.28Å; S99-F406 WeakPolarHBondContact O-CZ 3.41Å
100	T	87.8	Confident	86.3	Confident	23 Å²	23	39.7 Å²	39.7	14%	0.141	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70	-10.3	176.6	63.3	0	0	0	0	112.7	I59 M102 L396 I398 C404 F406	I59-T100 WeakPolarHBondContact CG2-O 3.38Å; T100-M102 PolarHBondContact O-N 2.64Å; T100-L396 HydrophobicContact CG2-CD2 4.43Å; T100-I398 HydrophobicContact CG2-CD1 3.5Å; T100-I398 VanDerWaalsContact CG2-CD1 3.5Å; T100-C404 HydrophobicContact CG2-CB 3.84Å; T100-F406 HydrophobicContact CG2-CE1 3.88Å; T100-F406 HydrophobicContact CG2-CZ 4.3Å
101	T	86.8	Confident	85.9	Confident	79 Å²	79	37.8 Å²	37.8	49%	0.485	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-16	173.5	57.9	0	0	0	0	112.2	Y98 S99 E103	Y98-T101 PolarHBondContact O-OG1 2.78Å; Y98-T101 VanDerWaalsContact O-OG1 3.06Å; S99-T101 PolarHBondContact O-N 2.97Å; T101-E103 PolarHBondContact O-N 3.34Å
102	M	85.2	Confident	85.8	Confident	5 Å²	5	37.8 Å²	37.8	3%	0.025	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.1	28.6	-177.8	-63.8	-72	-76.2	0	0	112.6	Q62 I85 F97 Y98 S99 T100 L394 L396	Q62-M102 HydrophobicContact CB-CB 4.09Å; Q62-M102 HydrophobicContact CB-CE 3.92Å; I85-M102 HydrophobicContact CD1-CE 4.37Å; I85-M102 HydrophobicContact CD1-SD 3.42Å; I85-M102 WeakPolarHBondContact CD1-SD 3.24Å; F97-M102 HydrophobicContact CB-SD 4.47Å; F97-M102 WeakPolarHBondContact CD1-O 3.43Å; Y98-M102 PolarHBondContact O-N 3Å; S99-M102 PolarHBondContact O-N 2.95Å; T100-M102 PolarHBondContact O-N 2.64Å; M102-L394 HydrophobicContact CE-CB 3.68Å; M102-L394 HydrophobicContact CE-CD1 4.35Å; M102-L396 HydrophobicContact CE-CB 4.43Å; M102-L396 HydrophobicContact CG-CB 4.23Å; M102-L396 HydrophobicContact CG-CD2 4Å; M102-L396 HydrophobicContact SD-CB 3.99Å; M102-L396 HydrophobicContact SD-CD2 3.92Å; M102-L396 HydrophobicContact SD-CG 4.47Å
103	E	84.3	Confident	85.2	Confident	122 Å²	122	40.4 Å²	40.4	57%	0.57	21%	0.212	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-72.4	135.7	177	-73.9	177.8	-178.1	0	0	109.7	F97 Y98 T101 Y105	F97-E103 CarbonylContact C-O 3.53Å; F97-E103 VanDerWaalsContact CA-O 3.29Å; F97-E103 WeakPolarHBondContact CA-O 3.33Å; Y98-E103 PolarHBondContact N-O 3.22Å; Y98-E103 PolarHBondContact O-N 3.23Å; T101-E103 PolarHBondContact O-N 3.34Å; E103-Y105 PolarHBondContact O-N 2.57Å
104	R	83.5	Confident	84.2	Confident	87 Å²	87	43.8 Å²	43.8	33%	0.328	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	121.1	-179.5	-174.8	171.9	-71.3	121.8	0.2	110.5	M63 D65 F97 T107	M63-R104 PolarHBondContact O-NH2 3.07Å; D65-R104 VanDerWaalsContact CG-CZ 3.41Å; D65-R104 VanDerWaalsContact CG-NH1 3.27Å; D65-R104 IonicContact OD1-CZ 2.82Å; D65-R104 IonicContact OD1-NH1 3.5Å; D65-R104 IonicContact OD1-NH2 2.75Å; D65-R104 PolarHBondContact OD1-NH2 3.32Å; D65-R104 IonicContact OD2-CZ 2.72Å; D65-R104 VanDerWaalsContact OD2-CZ 3.28Å; D65-R104 IonicContact OD2-NH1 3.68Å; D65-R104 PolarHBondContact OD2-NH1 3.23Å; D65-R104 IonicContact OD2-NH2 3.72Å; D65-R104 PolarHBondContact OD2-NH2 2.84Å; F97-R104 HydrophobicContact CD1-CB 4.21Å; F97-R104 HydrophobicContact CE1-CB 4.1Å; F97-R104 HydrophobicContact CE1-CG 4.37Å; R104-T107 VanDerWaalsContact CD-OG1 3.27Å; R104-T107 WeakPolarHBondContact CD-OG1 3.42Å
105	Y	84.3	Confident	82.6	Confident	39 Å²	39	47 Å²	47	15%	0.153	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	-57.2	176.9	176.8	-120.4	0	0	0	110.7	L84 A96 E103 K155 T413 E414 F415	L84-Y105 HydrophobicContact CD1-CD1 3.95Å; L84-Y105 HydrophobicContact CD1-CE1 3.98Å; L84-Y105 HydrophobicContact CD2-CD1 3.65Å; L84-Y105 HydrophobicContact CD2-CD2 4.47Å; L84-Y105 HydrophobicContact CD2-CE1 4.35Å; L84-Y105 HydrophobicContact CD2-CG 3.73Å; L84-Y105 HydrophobicContact CG-CD1 4.5Å; A96-Y105 HydrophobicContact CB-CD1 3.96Å; A96-Y105 WeakPolarHBondContact O-CB 3.35Å; A96-Y105 PolarHBondContact O-N 2.77Å; E103-Y105 PolarHBondContact O-N 2.57Å; Y105-K155 VanDerWaalsContact CE1-O 3.3Å; Y105-K155 WeakPolarHBondContact CE1-O 3.28Å; Y105-T413 HydrophobicContact CD2-CG2 4.29Å; Y105-T413 HydrophobicContact CE2-CG2 3.87Å; Y105-E414 WeakPolarHBondContact CE2-O 3.48Å; Y105-E414 PolarHBondContact OH-O 2.73Å; Y105-F415 HydrophobicContact CD2-CD1 4.07Å; Y105-F415 AromaticContact CD2-CE1 3.93Å; Y105-F415 HydrophobicContact CD2-CE1 3.93Å; Y105-F415 AromaticContact CE2-CD1 3.99Å; Y105-F415 HydrophobicContact CE2-CD1 3.99Å; Y105-F415 HydrophobicContact CE2-CE1 4.18Å
106	I	83.7	Confident	80.8	Confident	29 Å²	29	51.5 Å²	51.5	15%	0.149	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	156.6	174.3	64.1	165.2	0	0	0	111.1	W86 S95 A96 L108 K155	W86-I106 HydrophobicContact CH2-CD1 3.77Å; W86-I106 HydrophobicContact CH2-CG1 4.32Å; W86-I106 HydrophobicContact CZ3-CD1 3.98Å; W86-I106 HydrophobicContact CZ3-CG1 4.39Å; S95-I106 CarbonylContact C-O 3.47Å; S95-I106 VanDerWaalsContact CA-O 3.25Å; S95-I106 WeakPolarHBondContact CA-O 3.5Å; A96-I106 HydrophobicContact CB-CG1 3.92Å; A96-I106 PolarHBondContact N-O 3.36Å; A96-I106 PolarHBondContact O-N 3Å; I106-L108 HydrophobicContact CD1-CD2 3.55Å; I106-L108 HydrophobicContact CG1-CD2 4.37Å; I106-K155 VanDerWaalsContact CD1-O 3.26Å; I106-K155 WeakPolarHBondContact CD1-O 3.21Å
107	T	85.4	Confident	78.8	Confident	61 Å²	61	59.2 Å²	59.2	37%	0.374	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	131.4	165.1	-68.2	0	0	0	0	108.4	M94 S95 R104	M94-T107 WeakPolarHBondContact O-CA 3.31Å; S95-T107 WeakPolarHBondContact OG-CB 3.32Å; S95-T107 WeakPolarHBondContact OG-CG2 2.85Å; S95-T107 PolarHBondContact OG-OG1 3.45Å; R104-T107 VanDerWaalsContact CD-OG1 3.27Å; R104-T107 WeakPolarHBondContact CD-OG1 3.42Å
108	L	83.9	Confident	76.8	Confident	33 Å²	33	60.9 Å²	60.9	17%	0.173	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	167	175.1	62.4	128	0	0	0	111.4	M94 I106 Y153	M94-L108 HydrophobicContact CE-CD1 3.9Å; M94-L108 HydrophobicContact CE-CD2 3.77Å; M94-L108 HydrophobicContact CE-CG 4.01Å; M94-L108 PolarHBondContact N-O 2.99Å; M94-L108 PolarHBondContact O-N 2.85Å; I106-L108 HydrophobicContact CD1-CD2 3.55Å; I106-L108 HydrophobicContact CG1-CD2 4.37Å; L108-Y153 HydrophobicContact CD1-CD1 3.56Å; L108-Y153 HydrophobicContact CD1-CE1 3.29Å; L108-Y153 HydrophobicContact CD1-CG 4.41Å
109	T	84.6	Confident	74.8	Confident	93 Å²	93	65.5 Å²	65.5	57%	0.571	36%	0.362	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.9	132.4	174.3	52.3	0	0	0	0	110.8	L67 G92	L67-T109 HydrophobicContact CD1-CG2 4.3Å; G92-T109 CarbonylContact O-C 3.12Å; G92-T109 VanDerWaalsContact O-CA 3.24Å; G92-T109 WeakPolarHBondContact O-CA 3.3Å
110	V	84.9	Confident	72.9	Confident	3 Å²	3	73.7 Å²	73.7	2%	0.018	40%	0.398	C	S	.	.	P	Polyproline II helix	trans	-98.5	125.4	170.8	-178.5	0	0	0	0	107.4	G92 M94 L112 L128 V144 H151 Y153	G92-V110 WeakPolarHBondContact CA-O 3.48Å; G92-V110 PolarHBondContact O-N 2.88Å; M94-V110 HydrophobicContact CB-CG2 3.8Å; V110-L112 PolarHBondContact O-N 2.84Å; V110-L128 HydrophobicContact CB-CD1 3.98Å; V110-L128 HydrophobicContact CB-CD2 4.01Å; V110-L128 HydrophobicContact CG1-CD2 3.74Å; V110-L128 HydrophobicContact CG2-CD1 4.17Å; V110-V144 HydrophobicContact CG1-CG1 4.44Å; V110-H151 HydrophobicContact CG1-CB 4.15Å; V110-Y153 HydrophobicContact CB-CE2 4.47Å; V110-Y153 HydrophobicContact CG1-CE2 4.04Å; V110-Y153 HydrophobicContact CG2-CE2 3.92Å
111	P	79.9	Confident	70.8	Confident	66 Å²	66	76.8 Å²	76.8	43%	0.429	42%	0.417	S	S	.	.	P	Polyproline II helix	trans	-65.4	128.4	-175.3	26.6	-33	0	0	0	110.8	H151 Y153	P111-H151 PolarHBondContact O-CE1 3.41Å; P111-H151 PolarHBondContact O-NE2 3.15Å; P111-Y153 WeakPolarHBondContact CD-OH 3.15Å
112	L	79.7	Confident	68.6	Low	56 Å²	56	79.1 Å²	79.1	29%	0.293	43%	0.431	S	S	.	.			trans	-88.8	111.4	170.8	-59.4	180	0	0	0	108.6	T91 V110 S114 T126 L128	T91-L112 WeakPolarHBondContact O-CD1 3.47Å; V110-L112 PolarHBondContact O-N 2.84Å; L112-S114 PolarHBondContact O-N 3.32Å; L112-T126 WeakPolarHBondContact CD1-O 3.39Å; L112-L128 HydrophobicContact CD2-CD2 3.74Å; L112-L128 HydrophobicContact CD2-CG 4.13Å
113	I	71.1	Confident	66.6	Low	57 Å²	57	82.1 Å²	82.1	29%	0.292	45%	0.449	S	S	.	.			trans	-84.6	118	-175.8	-57.8	175.2	0	0	0	108.1	T126 N148 A149 V164	I113-T126 WeakPolarHBondContact O-CG2 3.37Å; I113-N148 PolarHBondContact O-ND2 2.86Å; I113-A149 HydrophobicContact CD1-CB 4.06Å; I113-V164 HydrophobicContact CD1-CG2 3.36Å; I113-V164 HydrophobicContact CG2-CG2 4.38Å
114	S	64.5	Low	64.7	Low	77 Å²	77	79.9 Å²	79.9	54%	0.538	45%	0.446	S	S	.	.			trans	-79.6	140	177.4	54.1	0	0	0	0	112.1	L112 V116	L112-S114 PolarHBondContact O-N 3.32Å; S114-V116 PolarHBondContact O-N 2.9Å
115	D	55.9	Low	63.3	Low	66 Å²	66	84.3 Å²	84.3	35%	0.353	46%	0.464	S	S	.	.			trans	-72.7	111.5	171.5	-85	-16.3	0	0	0	109.8	N117 S118 N148	D115-N117 PolarHBondContact O-N 3.23Å; D115-S118 PolarHBondContact O-OG 2.98Å; D115-N148 PolarHBondContact OD1-ND2 2.84Å
116	V	51.5	Low	62.5	Low	96 Å²	96	84.1 Å²	84.1	58%	0.582	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-23.6	174.2	-175	0	0	0	0	111.1	S114 C544	S114-V116 PolarHBondContact O-N 2.9Å; V116-C544 HydrophobicContact CG1-CB 4.43Å
117	N	49	Very low	62.7	Low	161 Å²	161	83 Å²	83	86%	0.861	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83	-13.9	-174.3	-65.5	-20.7	0	0	0	113.8	D115 L119	D115-N117 PolarHBondContact O-N 3.23Å; N117-L119 VanDerWaalsContact C-N 3.34Å; N117-L119 PolarHBondContact O-N 2.96Å
118	S	49.5	Very low	63	Low	36 Å²	36	80.1 Å²	80.1	25%	0.252	44%	0.444	S	S	.	.			trans	-94.7	56.3	179.5	72.6	0	0	0	0	111.3	D115 E120	D115-S118 PolarHBondContact O-OG 2.98Å; S118-E120 PolarHBondContact O-N 3.07Å
119	L	48.1	Very low	63.5	Low	166 Å²	166	80.7 Å²	80.7	87%	0.869	45%	0.445	S	S	*	.	S	Bend	trans	-68.8	-23.7	174.1	-162	70.1	0	0	0	111.8	N117	N117-L119 VanDerWaalsContact C-N 3.34Å; N117-L119 PolarHBondContact O-N 2.96Å
120	E	47.3	Very low	64	Low	193 Å²	193	78.2 Å²	78.2	90%	0.902	43%	0.427	S	S	*	.	S	Bend	trans	-101.5	-19	-173.7	-66.8	-169.2	154.7	0	0	114.4	S118	S118-E120 PolarHBondContact O-N 3.07Å
121	T	43.6	Very low	64.6	Low	88 Å²	88	78.2 Å²	78.2	54%	0.54	43%	0.427	S	S	.	.	S	Bend	trans	-120.2	102.9	174.1	54.4	0	0	0	0	107.9	T123	T121-T123 PolarHBondContact O-N 2.81Å
122	V	41.8	Very low	65.3	Low	127 Å²	127	76.7 Å²	76.7	77%	0.77	41%	0.414	S	S	*	.			trans	-61.6	87.2	163.9	-175.6	0	0	0	0	106.1	P124	V122-P124 VanDerWaalsContact C-CD 3.45Å; V122-P124 HydrophobicContact CG1-CB 3.89Å; V122-P124 HydrophobicContact CG1-CG 4.04Å; V122-P124 WeakPolarHBondContact O-CD 3.45Å
123	T	41.8	Very low	66	Low	68 Å²	68	74.3 Å²	74.3	42%	0.417	40%	0.402	S	S	.	.			trans	-93.6	84	157	41.6	0	0	0	0	104.6	T121 Y125	T121-T123 PolarHBondContact O-N 2.81Å; T123-Y125 PolarHBondContact O-N 3.28Å
124	P	44.6	Very low	66.9	Low	76 Å²	76	71.6 Å²	71.6	49%	0.494	39%	0.388	S	S	.	.			trans	-77.6	6.4	-170.6	36.3	-33.8	0	0	0	111.8	V122 T126	V122-P124 VanDerWaalsContact C-CD 3.45Å; V122-P124 HydrophobicContact CG1-CB 3.89Å; V122-P124 HydrophobicContact CG1-CG 4.04Å; V122-P124 WeakPolarHBondContact O-CD 3.45Å; P124-T126 PolarHBondContact O-N 3.18Å
125	Y	53.6	Low	67.8	Low	180 Å²	180	68.8 Å²	68.8	71%	0.706	37%	0.368	S	S	*	.			trans	-102.6	56.1	-171.7	-56.6	-64.9	0	0	0	110.4	T123 G127 N147	T123-Y125 PolarHBondContact O-N 3.28Å; Y125-G127 PolarHBondContact O-N 2.92Å; Y125-N147 PolarHBondContact O-ND2 2.87Å
126	T	68.9	Low	69	Low	35 Å²	35	66.6 Å²	66.6	22%	0.215	35%	0.354	C	S	.	.			trans	-68.9	125.4	154.3	58.3	0	0	0	0	107.1	L112 I113 P124 N147	L112-T126 WeakPolarHBondContact CD1-O 3.39Å; I113-T126 WeakPolarHBondContact O-CG2 3.37Å; P124-T126 PolarHBondContact O-N 3.18Å; T126-N147 WeakPolarHBondContact CA-ND2 3.41Å; T126-N147 VanDerWaalsContact CA-OD1 3.31Å; T126-N147 WeakPolarHBondContact CA-OD1 3.23Å
127	G	86.4	Confident	70	Confident	5 Å²	5	65.5 Å²	65.5	5%	0.052	35%	0.35	C	S	.	.			trans	-162.6	156.6	-176.7	0	0	0	0	0	112	R90 Y125 A146 N147	R90-G127 WeakPolarHBondContact O-CA 3.26Å; Y125-G127 PolarHBondContact O-N 2.92Å; G127-A146 WeakPolarHBondContact O-CA 3.06Å; G127-N147 PolarHBondContact N-OD1 2.76Å; G127-N147 PolarHBondContact O-N 3Å; G127-N147 VanDerWaalsContact O-N 3.11Å
128	L	92.4	Very high	71.1	Confident	0 Å²	0	65 Å²	65	0%	0	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	148.6	172	-45.5	-179.5	0	0	0	109.6	A74 V88 T89 V110 L112 V144 L145 A146	A74-L128 WeakPolarHBondContact CB-O 3.35Å; V88-L128 HydrophobicContact CB-CB 4.27Å; V88-L128 HydrophobicContact CB-CD1 3.91Å; V88-L128 HydrophobicContact CG1-CD1 4.09Å; T89-L128 VanDerWaalsContact O-CB 3.26Å; T89-L128 WeakPolarHBondContact O-CB 3.39Å; T89-L128 WeakPolarHBondContact O-CD1 3.29Å; T89-L128 VanDerWaalsContact O-CG 3.29Å; T89-L128 WeakPolarHBondContact O-CG 3.38Å; V110-L128 HydrophobicContact CB-CD1 3.98Å; V110-L128 HydrophobicContact CB-CD2 4.01Å; V110-L128 HydrophobicContact CG1-CD2 3.74Å; V110-L128 HydrophobicContact CG2-CD1 4.17Å; L112-L128 HydrophobicContact CD2-CD2 3.74Å; L112-L128 HydrophobicContact CD2-CG 4.13Å; L128-V144 HydrophobicContact CB-CG1 4.27Å; L128-V144 HydrophobicContact CD1-CG1 3.98Å; L128-V144 HydrophobicContact CD2-CG1 3.88Å; L128-V144 HydrophobicContact CG-CG1 4.25Å; L128-L145 WeakPolarHBondContact CA-O 3.04Å; L128-A146 HydrophobicContact CD2-CB 4.15Å
129	K	94	Very high	72.2	Confident	46 Å²	46	66.4 Å²	66.4	20%	0.2	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	-45.6	-169.8	-63.3	-63.4	-162.6	160.9	0	112.2	L145 L171 E172	K129-L145 HydrophobicContact CB-CB 4.48Å; K129-L145 HydrophobicContact CB-CD2 4.13Å; K129-L145 HydrophobicContact CB-CG 4.23Å; K129-L145 PolarHBondContact N-O 2.92Å; K129-L171 WeakPolarHBondContact CE-O 3.34Å; K129-L171 WeakPolarHBondContact CG-O 3.24Å; K129-E172 WeakPolarHBondContact CD-OE2 3.43Å; K129-E172 WeakPolarHBondContact CE-OE1 3.37Å; K129-E172 WeakPolarHBondContact CE-OE2 3.26Å; K129-E172 IonicContact NZ-OE1 3.03Å; K129-E172 PolarHBondContact NZ-OE1 3.03Å; K129-E172 IonicContact NZ-OE2 2.79Å; K129-E172 PolarHBondContact NZ-OE2 3.5Å
130	Q	95.9	Very high	73.6	Confident	41 Å²	41	60.5 Å²	60.5	19%	0.192	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	147.3	-174.5	-156.4	178.2	-7.3	0	0	111.2	D75 L145 L174	D75-Q130 WeakPolarHBondContact OD2-CA 3.19Å; D75-Q130 WeakPolarHBondContact OD2-CG 3.48Å; Q130-L145 HydrophobicContact CB-CB 4.05Å; Q130-L145 HydrophobicContact CB-CD2 4.33Å; Q130-L145 PolarHBondContact N-O 3.43Å; Q130-L145 PolarHBondContact O-N 2.93Å; Q130-L174 PolarHBondContact OE1-O 3.36Å
131	V	96.3	Very high	75.6	Confident	3 Å²	3	51.6 Å²	51.6	2%	0.018	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	137.3	171.9	62.3	0	0	0	0	110.3	D75 A77 W86 V88 V142 V144	D75-V131 HydrophobicContact CB-CG1 4.39Å; D75-V131 PolarHBondContact OD2-N 3.41Å; A77-V131 HydrophobicContact CB-CG1 4.01Å; W86-V131 HydrophobicContact CB-CG1 4.18Å; W86-V131 HydrophobicContact CB-CG2 3.89Å; W86-V131 HydrophobicContact CG-CG2 4.49Å; V88-V131 HydrophobicContact CB-CB 4.49Å; V88-V131 HydrophobicContact CG1-CB 3.8Å; V88-V131 HydrophobicContact CG1-CG1 4.45Å; V88-V131 HydrophobicContact CG1-CG2 4.13Å; V88-V131 HydrophobicContact CG2-CB 3.87Å; V88-V131 HydrophobicContact CG2-CG1 4.06Å; V131-V142 HydrophobicContact CG2-CG2 3.57Å; V131-V144 HydrophobicContact CG2-CG2 4.34Å
132	F	95.5	Very high	77.9	Confident	34 Å²	34	47.4 Å²	47.4	15%	0.149	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	96.4	-178.7	-179.5	-105.1	0	0	0	110.4	P135 F143 L174 V176 L196 F199 F202	F132-P135 HydrophobicContact CZ-CG 4.18Å; F132-F143 HydrophobicContact CB-CB 4.44Å; F132-F143 AromaticContact CD1-CD2 3.87Å; F132-F143 HydrophobicContact CD1-CD2 3.87Å; F132-F143 HydrophobicContact CE1-CD2 4.41Å; F132-F143 PolarHBondContact N-O 2.84Å; F132-F143 PolarHBondContact O-N 2.91Å; F132-L174 HydrophobicContact CB-CD2 3.37Å; F132-L174 HydrophobicContact CD1-CD2 4.23Å; F132-L174 HydrophobicContact CG-CD2 3.85Å; F132-V176 HydrophobicContact CD1-CG1 3.99Å; F132-V176 HydrophobicContact CE1-CB 4.37Å; F132-V176 HydrophobicContact CE1-CG1 3.57Å; F132-V176 HydrophobicContact CE1-CG2 3.91Å; F132-V176 HydrophobicContact CE2-CG2 4.07Å; F132-V176 HydrophobicContact CZ-CB 4.35Å; F132-V176 HydrophobicContact CZ-CG1 3.95Å; F132-V176 HydrophobicContact CZ-CG2 3.44Å; F132-V176 VanDerWaalsContact CZ-CG2 3.44Å; F132-L196 HydrophobicContact CE2-CD2 3.87Å; F132-L196 HydrophobicContact CZ-CD2 3.83Å; F132-F199 HydrophobicContact CE1-CE1 4.17Å; F132-F199 HydrophobicContact CE1-CZ 4.21Å; F132-F202 HydrophobicContact CD1-CE1 4.39Å
133	P	94.2	Very high	80.4	Confident	5 Å²	5	41.6 Å²	41.6	3%	0.032	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	134.3	172.1	26.5	-31.6	0	0	0	110.6	A77 F78 D79 W86 P135	A77-P133 HydrophobicContact CB-CG 4.23Å; F78-P133 WeakPolarHBondContact O-CG 3.42Å; D79-P133 HydrophobicContact CB-CB 4.33Å; W86-P133 HydrophobicContact CG-CB 4.41Å; P133-P135 WeakPolarHBondContact O-CD 3.45Å
134	S	89.9	Confident	83	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	19%	0.194	C	C	.	.			trans	-66.7	133	-175.9	124.7	0	0	0	0	111.3	R136 E139 S141	S134-R136 PolarHBondContact O-N 3.2Å; S134-R136 PolarHBondContact OG-N 3.11Å; S134-R136 VanDerWaalsContact OG-N 3.14Å; S134-R136 PolarHBondContact OG-O 3.14Å; S134-E139 PolarHBondContact OG-O 2.9Å; S134-S141 WeakPolarHBondContact CB-O 3.25Å; S134-S141 WeakPolarHBondContact CB-OG 3.34Å; S134-S141 PolarHBondContact N-O 2.96Å
135	P	83.8	Confident	85.5	Confident	18 Å²	18	34.8 Å²	34.8	12%	0.117	17%	0.17	C	C	.	.			trans	-84.9	9.7	169.9	32.8	-33.6	0	0	0	113.4	P80 F132 P133 P137 L196 F199	P80-P135 HydrophobicContact CB-CB 4.19Å; P80-P135 HydrophobicContact CG-CB 3.74Å; F132-P135 HydrophobicContact CZ-CG 4.18Å; P133-P135 WeakPolarHBondContact O-CD 3.45Å; P135-P137 WeakPolarHBondContact O-CD 3.31Å; P135-L196 HydrophobicContact CB-CB 4.44Å; P135-L196 HydrophobicContact CG-CB 3.63Å; P135-L196 WeakPolarHBondContact CG-O 3.45Å; P135-F199 HydrophobicContact CG-CD1 4.33Å
136	R	81.4	Confident	87.4	Confident	20 Å²	20	26.2 Å²	26.2	8%	0.075	14%	0.136	C	C	.	.			trans	-89.7	116.1	-179.6	-77.3	-174	-73.4	-170.7	-5.1	109.7	S134 I138 E139 G197 F199	S134-R136 PolarHBondContact O-N 3.2Å; S134-R136 PolarHBondContact OG-N 3.11Å; S134-R136 VanDerWaalsContact OG-N 3.14Å; S134-R136 PolarHBondContact OG-O 3.14Å; R136-I138 VanDerWaalsContact C-N 3.27Å; R136-I138 PolarHBondContact O-N 2.91Å; R136-I138 VanDerWaalsContact O-N 3.17Å; R136-E139 HydrophobicContact CB-CB 3.9Å; R136-E139 HydrophobicContact CB-CG 4.12Å; R136-E139 WeakPolarHBondContact CD-OE1 3.1Å; R136-E139 IonicContact CZ-OE1 2.87Å; R136-E139 IonicContact CZ-OE2 3.86Å; R136-E139 IonicContact NE-OE1 2.86Å; R136-E139 PolarHBondContact NE-OE1 2.52Å; R136-E139 IonicContact NE-OE2 2.91Å; R136-E139 PolarHBondContact NE-OE2 2.86Å; R136-E139 IonicContact NH1-OE1 3.3Å; R136-E139 PolarHBondContact NH1-OE1 3.41Å; R136-E139 IonicContact NH1-OE2 3.73Å; R136-E139 VanDerWaalsContact NH2-CD 3.34Å; R136-E139 IonicContact NH2-OE1 3.52Å; R136-E139 PolarHBondContact NH2-OE1 2.87Å; R136-E139 IonicContact NH2-OE2 3.28Å; R136-E139 PolarHBondContact NH2-OE2 3.38Å; R136-E139 CarbonylContact O-C 3.5Å; R136-E139 PolarHBondContact O-N 3.01Å; R136-E139 VanDerWaalsContact O-O 3.05Å; R136-G197 WeakPolarHBondContact CG-O 3.33Å; R136-F199 HydrophobicContact CG-CD1 4.31Å; R136-F199 HydrophobicContact CG-CE1 4.16Å
137	P	72.4	Confident	88.4	Confident	74 Å²	74	25.4 Å²	25.4	48%	0.481	13%	0.131	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-29	-174.9	-27.4	35.8	0	0	0	115.9	L81 P135 E139 L411	L81-P137 HydrophobicContact CD1-CB 4.46Å; L81-P137 HydrophobicContact CD1-CG 4.3Å; L81-P137 HydrophobicContact CD2-CG 4.4Å; P135-P137 WeakPolarHBondContact O-CD 3.31Å; P137-E139 VanDerWaalsContact C-N 3.31Å; P137-L411 HydrophobicContact CB-CD1 4.18Å
138	I	71.2	Confident	88.6	Confident	151 Å²	151	25.2 Å²	25.2	77%	0.774	13%	0.129	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.2	-20.5	179.3	-57.3	167.3	0	0	0	110.3	R136	R136-I138 VanDerWaalsContact C-N 3.27Å; R136-I138 PolarHBondContact O-N 2.91Å; R136-I138 VanDerWaalsContact O-N 3.17Å
139	E	72.2	Confident	88.6	Confident	64 Å²	64	25.2 Å²	25.2	30%	0.299	13%	0.129	S	C	.	.			trans	-106.7	95.7	-177	-61.6	-175.2	-159.1	0	0	110.6	S134 R136 P137 S141	S134-E139 PolarHBondContact OG-O 2.9Å; R136-E139 HydrophobicContact CB-CB 3.9Å; R136-E139 HydrophobicContact CB-CG 4.12Å; R136-E139 WeakPolarHBondContact CD-OE1 3.1Å; R136-E139 IonicContact CZ-OE1 2.87Å; R136-E139 IonicContact CZ-OE2 3.86Å; R136-E139 IonicContact NE-OE1 2.86Å; R136-E139 PolarHBondContact NE-OE1 2.52Å; R136-E139 IonicContact NE-OE2 2.91Å; R136-E139 PolarHBondContact NE-OE2 2.86Å; R136-E139 IonicContact NH1-OE1 3.3Å; R136-E139 PolarHBondContact NH1-OE1 3.41Å; R136-E139 IonicContact NH1-OE2 3.73Å; R136-E139 VanDerWaalsContact NH2-CD 3.34Å; R136-E139 IonicContact NH2-OE1 3.52Å; R136-E139 PolarHBondContact NH2-OE1 2.87Å; R136-E139 IonicContact NH2-OE2 3.28Å; R136-E139 PolarHBondContact NH2-OE2 3.38Å; R136-E139 CarbonylContact O-C 3.5Å; R136-E139 PolarHBondContact O-N 3.01Å; R136-E139 VanDerWaalsContact O-O 3.05Å; P137-E139 VanDerWaalsContact C-N 3.31Å; E139-S141 PolarHBondContact O-N 3.49Å
140	H	79.2	Confident	88.6	Confident	43 Å²	43	23 Å²	23	20%	0.199	12%	0.119	C	C	.	.			trans	-75	59.2	167.5	-64.9	-92.9	0	0	0	110.2	E82 T154 K155 L439	E82-H140 IonicContact OE1-CE1 3.81Å; E82-H140 IonicContact OE1-ND1 3.8Å; E82-H140 PolarHBondContact OE1-ND1 2.77Å; H140-T154 CarbonylContact O-C 3.6Å; H140-T154 WeakPolarHBondContact O-CA 3.43Å; H140-K155 HydrophobicContact CB-CD 4.44Å; H140-K155 PolarHBondContact O-N 3.36Å; H140-L439 HydrophobicContact CB-CD2 4.25Å
141	S	88	Confident	88.4	Confident	5 Å²	5	21.1 Å²	21.1	4%	0.035	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	155.7	-178.4	62.5	0	0	0	0	112.5	S134 E139 Y153	S134-S141 WeakPolarHBondContact CB-O 3.25Å; S134-S141 WeakPolarHBondContact CB-OG 3.34Å; S134-S141 PolarHBondContact N-O 2.96Å; E139-S141 PolarHBondContact O-N 3.49Å; S141-Y153 CarbonylContact C-O 3.21Å; S141-Y153 WeakPolarHBondContact CA-O 3.23Å; S141-Y153 WeakPolarHBondContact CB-O 3.39Å
142	V	92.5	Very high	88.1	Confident	0 Å²	0	21.1 Å²	21.1	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	133.4	171.8	61.5	0	0	0	0	107.8	W86 M94 V131 Y153	W86-V142 HydrophobicContact CD2-CB 4.47Å; W86-V142 HydrophobicContact CD2-CG2 3.93Å; W86-V142 HydrophobicContact CE3-CB 4.46Å; W86-V142 HydrophobicContact CE3-CG1 4.32Å; W86-V142 HydrophobicContact CE3-CG2 3.94Å; W86-V142 HydrophobicContact CG-CG2 4.4Å; W86-V142 HydrophobicContact CH2-CB 4.31Å; W86-V142 HydrophobicContact CH2-CG1 3.84Å; W86-V142 HydrophobicContact CZ2-CB 4.31Å; W86-V142 HydrophobicContact CZ2-CG1 4.32Å; W86-V142 HydrophobicContact CZ3-CB 4.37Å; W86-V142 HydrophobicContact CZ3-CG1 3.83Å; W86-V142 HydrophobicContact CZ3-CG2 4.3Å; M94-V142 HydrophobicContact CE-CG1 3.9Å; M94-V142 HydrophobicContact SD-CG1 3.88Å; M94-V142 HydrophobicContact SD-CG2 4.18Å; V131-V142 HydrophobicContact CG2-CG2 3.57Å; V142-Y153 PolarHBondContact N-O 2.77Å; V142-Y153 PolarHBondContact O-N 3.11Å
143	F	95	Very high	87.7	Confident	6 Å²	6	20 Å²	20	3%	0.026	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	137.8	179.6	-56.5	-77.3	0	0	0	109.5	F132 L150 H151 A152 F199 F202 W220	F132-F143 HydrophobicContact CB-CB 4.44Å; F132-F143 AromaticContact CD1-CD2 3.87Å; F132-F143 HydrophobicContact CD1-CD2 3.87Å; F132-F143 HydrophobicContact CE1-CD2 4.41Å; F132-F143 PolarHBondContact N-O 2.84Å; F132-F143 PolarHBondContact O-N 2.91Å; F143-L150 HydrophobicContact CB-CD1 4.49Å; F143-H151 CarbonylContact C-O 3.57Å; F143-H151 VanDerWaalsContact CA-O 3.31Å; F143-H151 WeakPolarHBondContact CA-O 3.49Å; F143-A152 HydrophobicContact CD1-CB 3.74Å; F143-A152 HydrophobicContact CE1-CB 3.74Å; F143-F199 HydrophobicContact CD2-CZ 4.45Å; F143-F199 AromaticContact CE2-CZ 3.71Å; F143-F199 HydrophobicContact CE2-CZ 3.71Å; F143-F199 HydrophobicContact CZ-CZ 4.25Å; F143-F202 HydrophobicContact CB-CE1 4.44Å; F143-F202 HydrophobicContact CB-CZ 4.43Å; F143-F202 HydrophobicContact CD1-CE1 4.49Å; F143-F202 HydrophobicContact CD1-CE2 4.33Å; F143-F202 AromaticContact CD1-CZ 3.68Å; F143-F202 HydrophobicContact CD1-CZ 3.68Å; F143-F202 HydrophobicContact CD2-CE1 4.11Å; F143-F202 AromaticContact CD2-CZ 3.78Å; F143-F202 HydrophobicContact CD2-CZ 3.78Å; F143-F202 HydrophobicContact CE1-CE2 4.26Å; F143-F202 AromaticContact CE1-CZ 3.79Å; F143-F202 HydrophobicContact CE1-CZ 3.79Å; F143-F202 AromaticContact CE2-CZ 3.86Å; F143-F202 HydrophobicContact CE2-CZ 3.86Å; F143-F202 HydrophobicContact CG-CE1 4.08Å; F143-F202 AromaticContact CG-CZ 3.67Å; F143-F202 HydrophobicContact CG-CZ 3.67Å; F143-F202 AromaticContact CZ-CZ 3.86Å; F143-F202 HydrophobicContact CZ-CZ 3.86Å; F143-W220 AromaticContact CE1-NE1 3.77Å
144	V	95.8	Very high	87.1	Confident	0 Å²	0	20.5 Å²	20.5	0%	0	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	122.5	-178.8	-177.6	0	0	0	0	108.9	V88 M94 V110 L128 V131 H151	V88-V144 HydrophobicContact CG1-CG1 4.06Å; V88-V144 HydrophobicContact CG1-CG2 4.28Å; M94-V144 HydrophobicContact SD-CG2 3.37Å; M94-V144 WeakPolarHBondContact SD-CG2 3.46Å; V110-V144 HydrophobicContact CG1-CG1 4.44Å; L128-V144 HydrophobicContact CB-CG1 4.27Å; L128-V144 HydrophobicContact CD1-CG1 3.98Å; L128-V144 HydrophobicContact CD2-CG1 3.88Å; L128-V144 HydrophobicContact CG-CG1 4.25Å; V131-V144 HydrophobicContact CG2-CG2 4.34Å; V144-H151 HydrophobicContact CB-CB 4.41Å; V144-H151 PolarHBondContact N-O 3.42Å; V144-H151 PolarHBondContact O-N 2.82Å
145	L	96.2	Very high	86.9	Confident	0 Å²	0	20.6 Å²	20.6	0%	0	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	126.1	174	-176.3	67	0	0	0	109.7	L128 K129 Q130 L171 L174 L204	L128-L145 WeakPolarHBondContact CA-O 3.04Å; K129-L145 HydrophobicContact CB-CB 4.48Å; K129-L145 HydrophobicContact CB-CD2 4.13Å; K129-L145 HydrophobicContact CB-CG 4.23Å; K129-L145 PolarHBondContact N-O 2.92Å; Q130-L145 HydrophobicContact CB-CB 4.05Å; Q130-L145 HydrophobicContact CB-CD2 4.33Å; Q130-L145 PolarHBondContact N-O 3.43Å; Q130-L145 PolarHBondContact O-N 2.93Å; L145-L171 HydrophobicContact CD1-CB 4.12Å; L145-L171 HydrophobicContact CD1-CD1 3.79Å; L145-L171 HydrophobicContact CD2-CB 4.34Å; L145-L171 HydrophobicContact CG-CB 4.4Å; L145-L174 HydrophobicContact CB-CB 4.44Å; L145-L174 HydrophobicContact CD2-CB 4.08Å; L145-L204 HydrophobicContact CD1-CD2 3.92Å
146	A	93.3	Very high	86.6	Confident	0 Å²	0	23.5 Å²	23.5	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	170.2	161.5	0	0	0	0	0	109.9	G127 L128 N148 A149	G127-A146 WeakPolarHBondContact O-CA 3.06Å; L128-A146 HydrophobicContact CD2-CB 4.15Å; A146-N148 PolarHBondContact O-N 2.79Å; A146-N148 VanDerWaalsContact O-N 3.16Å; A146-A149 HydrophobicContact CB-CB 4.26Å; A146-A149 PolarHBondContact N-O 3.25Å
147	N	91.6	Very high	86.3	Confident	18 Å²	18	23.5 Å²	23.5	10%	0.096	13%	0.128	C	C	.	.	S	Bend	trans	-60.7	-21	178.8	67.8	-49.3	0	0	0	114.7	Y125 T126 G127 E170 L171	Y125-N147 PolarHBondContact O-ND2 2.87Å; T126-N147 WeakPolarHBondContact CA-ND2 3.41Å; T126-N147 VanDerWaalsContact CA-OD1 3.31Å; T126-N147 WeakPolarHBondContact CA-OD1 3.23Å; G127-N147 PolarHBondContact N-OD1 2.76Å; G127-N147 PolarHBondContact O-N 3Å; G127-N147 VanDerWaalsContact O-N 3.11Å; N147-E170 PolarHBondContact O-N 3.31Å; N147-E170 VanDerWaalsContact O-N 3.12Å; N147-L171 PolarHBondContact O-N 3.34Å
148	N	90.3	Very high	86.6	Confident	2 Å²	2	26.2 Å²	26.2	1%	0.011	13%	0.129	C	C	.	.	S	Bend	trans	-137.5	6.7	-179.9	65.8	-9.9	0	0	0	114.1	I113 D115 A146 M168	I113-N148 PolarHBondContact O-ND2 2.86Å; D115-N148 PolarHBondContact OD1-ND2 2.84Å; A146-N148 PolarHBondContact O-N 2.79Å; A146-N148 VanDerWaalsContact O-N 3.16Å; N148-M168 WeakPolarHBondContact CA-O 3.22Å; N148-M168 WeakPolarHBondContact O-CB 3.18Å
149	A	91.9	Very high	87	Confident	0 Å²	0	22.9 Å²	22.9	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	154.8	-173.6	0	0	0	0	0	112.3	I113 A146 V163 V164	I113-A149 HydrophobicContact CD1-CB 4.06Å; A146-A149 HydrophobicContact CB-CB 4.26Å; A146-A149 PolarHBondContact N-O 3.25Å; A149-V163 CarbonylContact C-O 3.58Å; A149-V163 VanDerWaalsContact CA-O 3.23Å; A149-V163 WeakPolarHBondContact CA-O 3.19Å; A149-V163 WeakPolarHBondContact CB-O 3.38Å; A149-V164 HydrophobicContact CB-CG2 3.91Å
150	L	93.8	Very high	87.4	Confident	0 Å²	0	23.5 Å²	23.5	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	122.4	168.2	-178.5	64.7	0	0	0	108.8	F143 S162 V163 L174 F202	F143-L150 HydrophobicContact CB-CD1 4.49Å; L150-S162 WeakPolarHBondContact O-CA 3.39Å; L150-V163 PolarHBondContact N-O 2.85Å; L150-V163 PolarHBondContact O-N 2.9Å; L150-L174 HydrophobicContact CD1-CD1 3.9Å; L150-F202 HydrophobicContact CD2-CD2 3.84Å; L150-F202 HydrophobicContact CD2-CE2 4.15Å; L150-F202 HydrophobicContact CD2-CG 4.07Å
151	H	92.9	Very high	87.7	Confident	0 Å²	0	23.2 Å²	23.2	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	144.2	178	-55.1	-84.2	0	0	0	111	V110 P111 F143 V144 Y153 S162	V110-H151 HydrophobicContact CG1-CB 4.15Å; P111-H151 PolarHBondContact O-CE1 3.41Å; P111-H151 PolarHBondContact O-NE2 3.15Å; F143-H151 CarbonylContact C-O 3.57Å; F143-H151 VanDerWaalsContact CA-O 3.31Å; F143-H151 WeakPolarHBondContact CA-O 3.49Å; V144-H151 HydrophobicContact CB-CB 4.41Å; V144-H151 PolarHBondContact N-O 3.42Å; V144-H151 PolarHBondContact O-N 2.82Å; H151-Y153 HydrophobicContact CB-CD2 4.23Å; H151-Y153 HydrophobicContact CB-CE2 3.73Å; H151-S162 WeakPolarHBondContact ND1-CB 3.31Å; H151-S162 PolarHBondContact ND1-OG 3.13Å
152	A	90	Very high	87.7	Confident	3 Å²	3	25.9 Å²	25.9	3%	0.025	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	130.7	171.6	0	0	0	0	0	109.7	F143 L160 A161 W220	F143-A152 HydrophobicContact CD1-CB 3.74Å; F143-A152 HydrophobicContact CE1-CB 3.74Å; A152-L160 HydrophobicContact CB-CB 4.13Å; A152-L160 WeakPolarHBondContact O-CA 3.21Å; A152-L160 WeakPolarHBondContact O-CB 3.47Å; A152-L160 PolarHBondContact O-N 3.4Å; A152-A161 PolarHBondContact N-O 3.37Å; A152-A161 PolarHBondContact O-N 3.28Å; A152-W220 HydrophobicContact CB-CH2 4.16Å; A152-W220 HydrophobicContact CB-CZ2 3.48Å; A152-W220 VanDerWaalsContact CB-CZ2 3.48Å
153	Y	85.2	Confident	87.5	Confident	11 Å²	11	27 Å²	27	4%	0.043	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	157.5	175.1	-73.1	-99	0	0	0	109.6	M94 L108 V110 P111 S141 V142 H151 R158 P159	M94-Y153 HydrophobicContact CE-CD1 4.35Å; M94-Y153 HydrophobicContact CE-CD2 4.14Å; M94-Y153 HydrophobicContact CE-CG 3.91Å; L108-Y153 HydrophobicContact CD1-CD1 3.56Å; L108-Y153 HydrophobicContact CD1-CE1 3.29Å; L108-Y153 HydrophobicContact CD1-CG 4.41Å; V110-Y153 HydrophobicContact CB-CE2 4.47Å; V110-Y153 HydrophobicContact CG1-CE2 4.04Å; V110-Y153 HydrophobicContact CG2-CE2 3.92Å; P111-Y153 WeakPolarHBondContact CD-OH 3.15Å; S141-Y153 CarbonylContact C-O 3.21Å; S141-Y153 WeakPolarHBondContact CA-O 3.23Å; S141-Y153 WeakPolarHBondContact CB-O 3.39Å; V142-Y153 PolarHBondContact N-O 2.77Å; V142-Y153 PolarHBondContact O-N 3.11Å; H151-Y153 HydrophobicContact CB-CD2 4.23Å; H151-Y153 HydrophobicContact CB-CE2 3.73Å; Y153-R158 CarbonylContact C-O 3.5Å; Y153-R158 WeakPolarHBondContact CA-O 3.15Å; Y153-P159 VanDerWaalsContact CD1-CA 3.48Å; Y153-P159 HydrophobicContact CD1-CB 4Å; Y153-P159 HydrophobicContact CE1-CB 3.64Å; Y153-P159 HydrophobicContact CE1-CG 4.49Å
154	T	83.2	Confident	87.3	Confident	15 Å²	15	30.3 Å²	30.3	9%	0.092	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	154.4	160.2	63.9	0	0	0	0	109.5	H140 M156 G157 R158 L160	H140-T154 CarbonylContact O-C 3.6Å; H140-T154 WeakPolarHBondContact O-CA 3.43Å; T154-M156 PolarHBondContact O-N 2.74Å; T154-M156 VanDerWaalsContact O-N 3.13Å; T154-G157 PolarHBondContact O-N 2.96Å; T154-G157 PolarHBondContact OG1-N 2.78Å; T154-R158 HydrophobicContact CG2-CB 4.1Å; T154-R158 PolarHBondContact N-O 2.87Å; T154-R158 WeakPolarHBondContact OG1-CA 3.47Å; T154-R158 VanDerWaalsContact OG1-CB 3.28Å; T154-R158 WeakPolarHBondContact OG1-CB 3.34Å; T154-R158 PolarHBondContact OG1-N 2.83Å; T154-R158 PolarHBondContact OG1-O 2.94Å; T154-L160 HydrophobicContact CG2-CD1 3.97Å; T154-L160 HydrophobicContact CG2-CD2 3.53Å; T154-L160 HydrophobicContact CG2-CG 3.73Å
155	K	84.7	Confident	86.9	Confident	3 Å²	3	33.4 Å²	33.4	1%	0.013	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-20.5	172.4	-67.4	-176.3	-172.7	-175.3	0	112.8	D79 E82 W86 Y105 I106 H140 G157	D79-K155 IonicContact OD1-NZ 2.79Å; D79-K155 PolarHBondContact OD1-NZ 3.3Å; D79-K155 WeakPolarHBondContact OD2-CD 3.29Å; D79-K155 WeakPolarHBondContact OD2-CE 3.48Å; D79-K155 IonicContact OD2-NZ 3.44Å; D79-K155 PolarHBondContact OD2-NZ 3.27Å; E82-K155 WeakPolarHBondContact OE1-CD 3.35Å; E82-K155 IonicContact OE1-NZ 4Å; E82-K155 PolarHBondContact OE1-NZ 2.82Å; W86-K155 HydrophobicContact CH2-CB 4.29Å; W86-K155 WeakPolarHBondContact CH2-O 3.48Å; W86-K155 HydrophobicContact CZ2-CB 3.8Å; W86-K155 HydrophobicContact CZ2-CD 4.48Å; W86-K155 HydrophobicContact CZ2-CG 3.74Å; Y105-K155 VanDerWaalsContact CE1-O 3.3Å; Y105-K155 WeakPolarHBondContact CE1-O 3.28Å; I106-K155 VanDerWaalsContact CD1-O 3.26Å; I106-K155 WeakPolarHBondContact CD1-O 3.21Å; H140-K155 HydrophobicContact CB-CD 4.44Å; H140-K155 PolarHBondContact O-N 3.36Å; K155-G157 VanDerWaalsContact C-N 3.29Å; K155-G157 PolarHBondContact O-N 2.78Å
156	M	77.9	Confident	86.6	Confident	78 Å²	78	42.2 Å²	42.2	38%	0.384	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.8	4.6	174.2	-65.1	177.3	-89	0	0	114	T154 E414 L439	T154-M156 PolarHBondContact O-N 2.74Å; T154-M156 VanDerWaalsContact O-N 3.13Å; M156-E414 HydrophobicContact SD-CG 4.45Å; M156-L439 HydrophobicContact CE-CD2 3.71Å
157	G	74.9	Confident	86.4	Confident	20 Å²	20	43.3 Å²	43.3	21%	0.206	23%	0.233	C	C	.	.	S	Bend	trans	87.8	2.6	175.1	0	0	0	0	0	116	T154 K155	T154-G157 PolarHBondContact O-N 2.96Å; T154-G157 PolarHBondContact OG1-N 2.78Å; K155-G157 VanDerWaalsContact C-N 3.29Å; K155-G157 PolarHBondContact O-N 2.78Å
158	R	78.2	Confident	86.4	Confident	132 Å²	132	42.6 Å²	42.6	50%	0.498	23%	0.229	S	C	.	.			trans	-74.4	128.1	171.3	-176	-175.7	174.2	-175.2	-0.4	110.5	Y153 T154 L160	Y153-R158 CarbonylContact C-O 3.5Å; Y153-R158 WeakPolarHBondContact CA-O 3.15Å; T154-R158 HydrophobicContact CG2-CB 4.1Å; T154-R158 PolarHBondContact N-O 2.87Å; T154-R158 WeakPolarHBondContact OG1-CA 3.47Å; T154-R158 VanDerWaalsContact OG1-CB 3.28Å; T154-R158 WeakPolarHBondContact OG1-CB 3.34Å; T154-R158 PolarHBondContact OG1-N 2.83Å; T154-R158 PolarHBondContact OG1-O 2.94Å; R158-L160 PolarHBondContact O-N 3.13Å
159	P	79.3	Confident	86.3	Confident	81 Å²	81	46.6 Å²	46.6	53%	0.526	25%	0.25	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	131.8	171	26.6	-32.7	0	0	0	110.4	Y153	Y153-P159 VanDerWaalsContact CD1-CA 3.48Å; Y153-P159 HydrophobicContact CD1-CB 4Å; Y153-P159 HydrophobicContact CE1-CB 3.64Å; Y153-P159 HydrophobicContact CE1-CG 4.49Å
160	L	82.6	Confident	86.2	Confident	77 Å²	77	51.2 Å²	51.2	40%	0.403	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	-56.4	175.7	-69.1	174	0	0	0	110.6	A152 T154 R158 I441	A152-L160 HydrophobicContact CB-CB 4.13Å; A152-L160 WeakPolarHBondContact O-CA 3.21Å; A152-L160 WeakPolarHBondContact O-CB 3.47Å; A152-L160 PolarHBondContact O-N 3.4Å; T154-L160 HydrophobicContact CG2-CD1 3.97Å; T154-L160 HydrophobicContact CG2-CD2 3.53Å; T154-L160 HydrophobicContact CG2-CG 3.73Å; R158-L160 PolarHBondContact O-N 3.13Å; L160-I441 HydrophobicContact CD2-CD1 4.47Å
161	A	84.3	Confident	86.3	Confident	37 Å²	37	51.2 Å²	51.2	31%	0.306	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.5	163.6	-176.8	0	0	0	0	0	111.2	A152 W220	A152-A161 PolarHBondContact N-O 3.37Å; A152-A161 PolarHBondContact O-N 3.28Å; A161-W220 VanDerWaalsContact C-CH2 3.43Å; A161-W220 HydrophobicContact CB-CD2 4.16Å; A161-W220 HydrophobicContact CB-CE3 3.46Å; A161-W220 VanDerWaalsContact CB-CE3 3.46Å; A161-W220 HydrophobicContact CB-CH2 3.59Å; A161-W220 HydrophobicContact CB-CZ2 4.26Å; A161-W220 HydrophobicContact CB-CZ3 3.11Å
162	S	88.5	Confident	86.3	Confident	61 Å²	61	53.8 Å²	53.8	43%	0.427	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	136.4	174.7	-63.1	0	0	0	0	108.8	L150 H151	L150-S162 WeakPolarHBondContact O-CA 3.39Å; H151-S162 WeakPolarHBondContact ND1-CB 3.31Å; H151-S162 PolarHBondContact ND1-OG 3.13Å
163	V	88.9	Confident	86.6	Confident	22 Å²	22	53.9 Å²	53.9	13%	0.133	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	134.2	-179.4	162.7	0	0	0	0	109.8	A149 L150 M168 W220 G221	A149-V163 CarbonylContact C-O 3.58Å; A149-V163 VanDerWaalsContact CA-O 3.23Å; A149-V163 WeakPolarHBondContact CA-O 3.19Å; A149-V163 WeakPolarHBondContact CB-O 3.38Å; L150-V163 PolarHBondContact N-O 2.85Å; L150-V163 PolarHBondContact O-N 2.9Å; V163-M168 HydrophobicContact CG1-CE 3.74Å; V163-M168 HydrophobicContact CG1-SD 4.47Å; V163-W220 HydrophobicContact CB-CH2 4.14Å; V163-W220 HydrophobicContact CB-CZ3 3.97Å; V163-W220 HydrophobicContact CG2-CD2 4.48Å; V163-W220 HydrophobicContact CG2-CE3 3.51Å; V163-W220 HydrophobicContact CG2-CH2 3.73Å; V163-W220 HydrophobicContact CG2-CZ3 3.08Å; V163-G221 WeakPolarHBondContact CG1-O 3.49Å
164	V	89.2	Confident	87.1	Confident	77 Å²	77	53.6 Å²	53.6	47%	0.467	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	136.1	170.7	-177.5	0	0	0	0	106.9	I113 A149	I113-V164 HydrophobicContact CD1-CG2 3.36Å; I113-V164 HydrophobicContact CG2-CG2 4.38Å; A149-V164 HydrophobicContact CB-CG2 3.91Å
165	H	89	Confident	87.6	Confident	64 Å²	64	53.2 Å²	53.2	30%	0.296	28%	0.282	S	S	.	.			trans	-135.4	147.1	174.9	-177	-98.6	0	0	0	110	S167 M168 V223	H165-S167 PolarHBondContact CE1-OG 3.19Å; H165-S167 VanDerWaalsContact CE1-OG 3.27Å; H165-S167 WeakPolarHBondContact ND1-CB 3.16Å; H165-S167 PolarHBondContact ND1-N 3.04Å; H165-S167 VanDerWaalsContact ND1-N 3.18Å; H165-S167 PolarHBondContact ND1-OG 2.84Å; H165-S167 PolarHBondContact O-N 3.47Å; H165-M168 HydrophobicContact CB-CE 3.89Å; H165-M168 HydrophobicContact CB-CG 4.01Å; H165-M168 HydrophobicContact CB-SD 4.05Å; H165-M168 WeakPolarHBondContact O-CB 3.24Å; H165-M168 PolarHBondContact O-N 3.3Å; H165-V223 HydrophobicContact CB-CG2 4.1Å
166	K	88.7	Confident	87.9	Confident	185 Å²	185	53.2 Å²	53.2	80%	0.804	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-20	-178.3	63.7	-179.2	178.4	-176.9	0	115
167	S	89.9	Confident	88.4	Confident	24 Å²	24	49.5 Å²	49.5	17%	0.168	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.4	2.4	178	73.6	0	0	0	0	113.6	H165 L169 Q208 L212	H165-S167 PolarHBondContact CE1-OG 3.19Å; H165-S167 VanDerWaalsContact CE1-OG 3.27Å; H165-S167 WeakPolarHBondContact ND1-CB 3.16Å; H165-S167 PolarHBondContact ND1-N 3.04Å; H165-S167 VanDerWaalsContact ND1-N 3.18Å; H165-S167 PolarHBondContact ND1-OG 2.84Å; H165-S167 PolarHBondContact O-N 3.47Å; S167-L169 PolarHBondContact O-N 3.24Å; S167-Q208 PolarHBondContact O-NE2 3.44Å; S167-Q208 VanDerWaalsContact O-NE2 3.13Å; S167-Q208 PolarHBondContact O-OE1 3.41Å; S167-L212 WeakPolarHBondContact O-CD1 3.36Å; S167-L212 WeakPolarHBondContact OG-CD1 3.38Å; S167-L212 WeakPolarHBondContact OG-CD2 3.47Å
168	M	90.5	Very high	88.9	Confident	2 Å²	2	48.6 Å²	48.6	1%	0.01	26%	0.255	C	S	.	.			trans	-88.9	89.8	175	-68	179.9	-176.4	0	0	108.2	N148 V163 H165 L171 L204 L212 V214	N148-M168 WeakPolarHBondContact CA-O 3.22Å; N148-M168 WeakPolarHBondContact O-CB 3.18Å; V163-M168 HydrophobicContact CG1-CE 3.74Å; V163-M168 HydrophobicContact CG1-SD 4.47Å; H165-M168 HydrophobicContact CB-CE 3.89Å; H165-M168 HydrophobicContact CB-CG 4.01Å; H165-M168 HydrophobicContact CB-SD 4.05Å; H165-M168 WeakPolarHBondContact O-CB 3.24Å; H165-M168 PolarHBondContact O-N 3.3Å; M168-L171 HydrophobicContact CB-CD1 3.81Å; M168-L171 HydrophobicContact CB-CG 4.34Å; M168-L171 HydrophobicContact CG-CD1 3.93Å; M168-L171 HydrophobicContact SD-CD1 4.39Å; M168-L204 HydrophobicContact CE-CD1 3.61Å; M168-L204 HydrophobicContact CG-CD1 4.48Å; M168-L204 HydrophobicContact SD-CD1 4.23Å; M168-L212 HydrophobicContact CB-CD1 4.41Å; M168-L212 HydrophobicContact CG-CD1 3.55Å; M168-V214 HydrophobicContact CE-CG2 4.34Å
169	L	89.1	Confident	88.8	Confident	86 Å²	86	45.3 Å²	45.3	45%	0.45	25%	0.25	S	S	.	.			trans	-123.2	130.5	-179.5	-53.5	171.9	0	0	0	108.9	S167 L171 Q208	S167-L169 PolarHBondContact O-N 3.24Å; L169-L171 PolarHBondContact O-N 3.19Å; L169-Q208 VanDerWaalsContact O-CD 3.24Å; L169-Q208 WeakPolarHBondContact O-CG 3.47Å; L169-Q208 PolarHBondContact O-OE1 3.4Å
170	E	90.4	Very high	88.5	Confident	97 Å²	97	45 Å²	45	45%	0.453	25%	0.247	S	C	.	.	S	Bend	trans	45.8	43.3	176	-56.7	-171.2	155.2	0	0	113.8	N147 G206 L207	N147-E170 PolarHBondContact O-N 3.31Å; N147-E170 VanDerWaalsContact O-N 3.12Å; E170-G206 CarbonylContact O-C 3.5Å; E170-G206 WeakPolarHBondContact O-CA 2.77Å; E170-L207 HydrophobicContact CB-CB 4.02Å; E170-L207 PolarHBondContact O-N 2.88Å
171	L	94.5	Very high	87.7	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.3	141.9	175.1	-60.1	179.3	0	0	0	110.1	K129 L145 N147 M168 L169 L204 G205	K129-L171 WeakPolarHBondContact CE-O 3.34Å; K129-L171 WeakPolarHBondContact CG-O 3.24Å; L145-L171 HydrophobicContact CD1-CB 4.12Å; L145-L171 HydrophobicContact CD1-CD1 3.79Å; L145-L171 HydrophobicContact CD2-CB 4.34Å; L145-L171 HydrophobicContact CG-CB 4.4Å; N147-L171 PolarHBondContact O-N 3.34Å; M168-L171 HydrophobicContact CB-CD1 3.81Å; M168-L171 HydrophobicContact CB-CG 4.34Å; M168-L171 HydrophobicContact CG-CD1 3.93Å; M168-L171 HydrophobicContact SD-CD1 4.39Å; L169-L171 PolarHBondContact O-N 3.19Å; L171-L204 HydrophobicContact CD1-CB 4.18Å; L171-L204 HydrophobicContact CD1-CD1 4.04Å; L171-L204 HydrophobicContact CD2-CB 3.98Å; L171-G205 CarbonylContact C-O 3.5Å; L171-G205 WeakPolarHBondContact CA-O 3.45Å
172	E	94.2	Very high	86.8	Confident	54 Å²	54	40.6 Å²	40.6	25%	0.252	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	-29.9	-179.9	-67	-63.9	161.8	0	0	112	K129 G205 L207	K129-E172 WeakPolarHBondContact CD-OE2 3.43Å; K129-E172 WeakPolarHBondContact CE-OE1 3.37Å; K129-E172 WeakPolarHBondContact CE-OE2 3.26Å; K129-E172 IonicContact NZ-OE1 3.03Å; K129-E172 PolarHBondContact NZ-OE1 3.03Å; K129-E172 IonicContact NZ-OE2 2.79Å; K129-E172 PolarHBondContact NZ-OE2 3.5Å; E172-G205 PolarHBondContact N-O 2.98Å; E172-L207 HydrophobicContact CG-CG 4.1Å
173	C	95.1	Very high	85.7	Confident	5 Å²	5	38.2 Å²	38.2	3%	0.034	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	152	-174.4	59.6	0	0	0	0	113.9	G205 S234 V235 L237	C173-G205 PolarHBondContact N-O 2.81Å; C173-G205 PolarHBondContact O-N 2.9Å; C173-S234 PolarHBondContact SG-O 2.75Å; C173-V235 VanDerWaalsContact CB-O 3.28Å; C173-V235 WeakPolarHBondContact CB-O 3.28Å; C173-V235 PolarHBondContact SG-O 3.28Å; C173-V235 VanDerWaalsContact SG-O 3.4Å; C173-L237 HydrophobicContact CB-CG 4.41Å; C173-L237 WeakPolarHBondContact SG-CG 3.44Å
174	L	96.1	Very high	83.8	Confident	6 Å²	6	41.1 Å²	41.1	3%	0.031	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	134.5	-179	174.3	97.3	0	0	0	108	Q130 F132 L145 L150 F202 F203 L204	Q130-L174 PolarHBondContact OE1-O 3.36Å; F132-L174 HydrophobicContact CB-CD2 3.37Å; F132-L174 HydrophobicContact CD1-CD2 4.23Å; F132-L174 HydrophobicContact CG-CD2 3.85Å; L145-L174 HydrophobicContact CB-CB 4.44Å; L145-L174 HydrophobicContact CD2-CB 4.08Å; L150-L174 HydrophobicContact CD1-CD1 3.9Å; L174-F202 HydrophobicContact CD1-CB 4.26Å; L174-F202 HydrophobicContact CD1-CD1 3.52Å; L174-F202 HydrophobicContact CD1-CE1 4.21Å; L174-F202 HydrophobicContact CD1-CG 4.18Å; L174-F202 HydrophobicContact CD2-CD1 4.5Å; L174-F202 HydrophobicContact CG-CD1 4.27Å; L174-F203 WeakPolarHBondContact CA-O 3.14Å; L174-L204 HydrophobicContact CB-CD2 4.47Å; L174-L204 HydrophobicContact CD1-CD2 3.27Å; L174-L204 HydrophobicContact CG-CD2 4.39Å
175	A	93.2	Very high	81.8	Confident	6 Å²	6	42.2 Å²	42.2	5%	0.05	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	159.2	162.9	0	0	0	0	0	110.5	F202 F203 L237 L244	A175-F202 CarbonylContact O-C 3.52Å; A175-F203 PolarHBondContact N-O 2.88Å; A175-F203 PolarHBondContact O-N 2.87Å; A175-L237 HydrophobicContact CB-CB 3.64Å; A175-L237 HydrophobicContact CB-CD1 4.24Å; A175-L244 HydrophobicContact CB-CD1 3.71Å
176	V	91.6	Very high	79.4	Confident	3 Å²	3	42 Å²	42	2%	0.018	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	148.5	173.9	-58.9	0	0	0	0	111.5	F132 L196 F199 R201 F202 P239	F132-V176 HydrophobicContact CD1-CG1 3.99Å; F132-V176 HydrophobicContact CE1-CB 4.37Å; F132-V176 HydrophobicContact CE1-CG1 3.57Å; F132-V176 HydrophobicContact CE1-CG2 3.91Å; F132-V176 HydrophobicContact CE2-CG2 4.07Å; F132-V176 HydrophobicContact CZ-CB 4.35Å; F132-V176 HydrophobicContact CZ-CG1 3.95Å; F132-V176 HydrophobicContact CZ-CG2 3.44Å; F132-V176 VanDerWaalsContact CZ-CG2 3.44Å; V176-L196 HydrophobicContact CG2-CB 4.28Å; V176-L196 HydrophobicContact CG2-CD2 3.16Å; V176-L196 HydrophobicContact CG2-CG 3.75Å; V176-F199 HydrophobicContact CB-CB 3.88Å; V176-F199 HydrophobicContact CB-CD2 3.67Å; V176-F199 HydrophobicContact CB-CE2 4.34Å; V176-F199 HydrophobicContact CB-CG 3.83Å; V176-F199 HydrophobicContact CG1-CD2 3.75Å; V176-F199 HydrophobicContact CG1-CE2 3.92Å; V176-F199 HydrophobicContact CG1-CG 4.25Å; V176-F199 HydrophobicContact CG2-CB 3.98Å; V176-F199 HydrophobicContact CG2-CD1 4.46Å; V176-F199 HydrophobicContact CG2-CD2 4.34Å; V176-F199 HydrophobicContact CG2-CG 4.02Å; V176-R201 WeakPolarHBondContact CA-O 3.47Å; V176-F202 HydrophobicContact CG1-CD1 3.39Å; V176-F202 HydrophobicContact CG1-CE1 3.43Å; V176-F202 VanDerWaalsContact CG1-CE1 3.43Å; V176-F202 HydrophobicContact CG1-CG 4.48Å; V176-P239 WeakPolarHBondContact O-CB 3.27Å
177	T	88.6	Confident	76.7	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	168.1	179.8	65.2	0	0	0	0	110.9	G181 F199 A200 R201 F203 P239	T177-G181 WeakPolarHBondContact CG2-O 3.48Å; T177-G181 WeakPolarHBondContact OG1-CA 3.25Å; T177-F199 CarbonylContact O-C 3.45Å; T177-F199 VanDerWaalsContact O-CA 3.25Å; T177-F199 WeakPolarHBondContact O-CA 3.46Å; T177-F199 WeakPolarHBondContact O-CB 3.31Å; T177-A200 PolarHBondContact O-N 2.73Å; T177-R201 PolarHBondContact N-O 2.75Å; T177-R201 PolarHBondContact O-N 3.32Å; T177-R201 VanDerWaalsContact O-N 3.14Å; T177-F203 HydrophobicContact CG2-CD2 3.85Å; T177-F203 HydrophobicContact CG2-CE2 3.87Å; T177-F203 VanDerWaalsContact OG1-CE2 3.28Å; T177-F203 WeakPolarHBondContact OG1-CE2 3.43Å; T177-P239 HydrophobicContact CG2-CB 4.03Å
178	G	84.5	Confident	73.8	Confident	2 Å²	2	40.5 Å²	40.5	2%	0.021	26%	0.264	C	S	.	.			trans	-70.5	-177.4	176.2	0	0	0	0	0	113.5	T180 G181 T182 R201	G178-T180 PolarHBondContact O-N 3.14Å; G178-T180 VanDerWaalsContact O-N 3.11Å; G178-G181 PolarHBondContact O-N 2.84Å; G178-T182 WeakPolarHBondContact CA-O 3.35Å; G178-T182 PolarHBondContact N-O 2.98Å; G178-R201 WeakPolarHBondContact O-CG 3.36Å
179	P	77.3	Confident	70.9	Confident	62 Å²	62	47.5 Å²	47.5	40%	0.403	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-30	-175.7	-25.5	33.8	0	0	0	115	G181 A200 R201	P179-G181 VanDerWaalsContact C-N 3.34Å; P179-A200 HydrophobicContact CB-CB 4.25Å; P179-A200 HydrophobicContact CG-CB 3.89Å; P179-R201 PolarHBondContact O-NE 3.27Å
180	T	72.7	Confident	68	Low	75 Å²	75	53.8 Å²	53.8	46%	0.46	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90	7.7	179.6	52.3	0	0	0	0	113.7	G178 T182 R259	G178-T180 PolarHBondContact O-N 3.14Å; G178-T180 VanDerWaalsContact O-N 3.11Å; T180-T182 PolarHBondContact O-N 3.14Å; T180-T182 PolarHBondContact OG1-OG1 3.01Å; T180-R259 WeakPolarHBondContact O-CG 3.23Å
181	G	65.1	Low	65.1	Low	1 Å²	1	53.9 Å²	53.9	1%	0.01	35%	0.345	C	S	.	.	S	Bend	trans	75.3	6	-175.6	0	0	0	0	0	114.8	T177 G178 P179 S258	T177-G181 WeakPolarHBondContact CG2-O 3.48Å; T177-G181 WeakPolarHBondContact OG1-CA 3.25Å; G178-G181 PolarHBondContact O-N 2.84Å; P179-G181 VanDerWaalsContact C-N 3.34Å; G181-S258 WeakPolarHBondContact CA-OG 3.28Å
182	T	66.8	Low	62.2	Low	20 Å²	20	56.6 Å²	56.6	12%	0.123	37%	0.367	C	S	.	.	S	Bend	trans	-115	152.5	177.1	59.8	0	0	0	0	109.7	G178 T180 M184	G178-T182 WeakPolarHBondContact CA-O 3.35Å; G178-T182 PolarHBondContact N-O 2.98Å; T180-T182 PolarHBondContact O-N 3.14Å; T180-T182 PolarHBondContact OG1-OG1 3.01Å; T182-M184 PolarHBondContact O-N 2.9Å
183	L	63.5	Low	59.7	Low	12 Å²	12	56.3 Å²	56.3	6%	0.063	38%	0.379	C	S	.	.			trans	-68.8	130.8	171	-163.6	72.4	0	0	0	109.4	S185 L196 F240 S241	L183-S185 PolarHBondContact O-N 2.95Å; L183-L196 HydrophobicContact CD1-CB 4.5Å; L183-L196 HydrophobicContact CD1-CD1 3.63Å; L183-L196 HydrophobicContact CD1-CG 3.78Å; L183-L196 HydrophobicContact CD2-CD1 4.36Å; L183-F240 VanDerWaalsContact CB-O 3.29Å; L183-F240 WeakPolarHBondContact CB-O 3.5Å; L183-F240 PolarHBondContact N-O 2.82Å; L183-F240 VanDerWaalsContact N-O 3.14Å; L183-S241 WeakPolarHBondContact O-CA 2.97Å
184	M	50.1	Low	57.4	Low	82 Å²	82	60.8 Å²	60.8	40%	0.404	40%	0.402	S	S	.	.			trans	-69.3	104.9	175.2	-76.5	-97.6	-74	0	0	109.3	T182 G186	T182-M184 PolarHBondContact O-N 2.9Å; M184-G186 PolarHBondContact O-N 3.04Å
185	S	46.4	Very low	55.2	Low	100 Å²	100	62 Å²	62	70%	0.699	42%	0.416	S	S	*	.			trans	-82.1	88.5	168.4	-161.7	0	0	0	0	108.1	L183	L183-S185 PolarHBondContact O-N 2.95Å
186	G	38.2	Very low	53.4	Low	61 Å²	61	62.4 Å²	62.4	63%	0.629	42%	0.417	S	S	*	.			trans	130.3	89.4	177.6	0	0	0	0	0	113.7	M184	M184-G186 PolarHBondContact O-N 3.04Å
187	S	32.2	Very low	51.8	Low	115 Å²	115	64.1 Å²	64.1	80%	0.804	44%	0.435	S	S	*	.			trans	-147.1	90	148.6	-178.6	0	0	0	0	108.6
188	G	29.7	Very low	51.1	Low	61 Å²	61	68.8 Å²	68.8	63%	0.629	46%	0.46	S	S	*	.	S	Bend	trans	73.2	104.6	148.9	0	0	0	0	0	118.5
189	I	28.8	Very low	51.1	Low	149 Å²	149	68.7 Å²	68.7	76%	0.764	46%	0.459	S	S	*	.	S	Bend	trans	72.7	106.1	139.3	-52.1	156.8	0	0	0	115.8
190	R	28.4	Very low	51.6	Low	218 Å²	218	66.3 Å²	66.3	82%	0.823	45%	0.445	S	S	*	.	S	Bend	trans	67.6	94.5	166.2	-56	164.2	-164.6	-92.8	0.9	114.7	A192	R190-A192 WeakPolarHBondContact O-CA 3.31Å; R190-A192 WeakPolarHBondContact O-CB 3.37Å; R190-A192 PolarHBondContact O-N 2.77Å
191	G	31	Very low	52.4	Low	99 Å²	99	65.6 Å²	65.6	100%	1.021	43%	0.433	S	S	*	.	S	Bend	trans	36.3	15.1	142	0	0	0	0	0	122.5
192	A	32.5	Very low	53.8	Low	58 Å²	58	65.5 Å²	65.5	48%	0.479	43%	0.433	S	S	.	.			trans	-144.9	132.6	-167.7	0	0	0	0	0	107.4	R190	R190-A192 WeakPolarHBondContact O-CA 3.31Å; R190-A192 WeakPolarHBondContact O-CB 3.37Å; R190-A192 PolarHBondContact O-N 2.77Å
193	G	42.4	Very low	55.2	Low	47 Å²	47	64.6 Å²	64.6	49%	0.485	43%	0.427	S	S	.	.	S	Bend	trans	91.2	90.9	-175.1	0	0	0	0	0	111.3	G195	G193-G195 PolarHBondContact O-N 2.8Å
194	N	46.7	Very low	56.7	Low	100 Å²	100	64 Å²	64	54%	0.535	42%	0.424	S	S	.	.			trans	-37.1	130	154.3	-149.7	-10.4	0	0	0	107.8	L196	N194-L196 HydrophobicContact CB-CD1 3.41Å; N194-L196 VanDerWaalsContact CB-CD1 3.41Å; N194-L196 VanDerWaalsContact ND2-CD1 3.26Å; N194-L196 WeakPolarHBondContact ND2-CD1 3.48Å; N194-L196 PolarHBondContact O-N 2.78Å; N194-L196 WeakPolarHBondContact OD1-CD1 3.37Å
195	G	49.9	Very low	58.9	Low	30 Å²	30	60.1 Å²	60.1	31%	0.309	41%	0.405	S	S	.	.	G	3₁₀ helix	trans	-59.6	11.5	-172	0	0	0	0	0	115.9	G193 G197	G193-G195 PolarHBondContact O-N 2.8Å; G195-G197 PolarHBondContact O-N 3.1Å
196	L	55.6	Low	61.2	Low	16 Å²	16	55.4 Å²	55.4	8%	0.084	37%	0.372	C	S	.	.	G	3₁₀ helix	trans	-67.1	-13.8	172.5	-70.7	86.8	0	0	0	113.1	F132 P135 V176 L183 N194 N198 F199	F132-L196 HydrophobicContact CE2-CD2 3.87Å; F132-L196 HydrophobicContact CZ-CD2 3.83Å; P135-L196 HydrophobicContact CB-CB 4.44Å; P135-L196 HydrophobicContact CG-CB 3.63Å; P135-L196 WeakPolarHBondContact CG-O 3.45Å; V176-L196 HydrophobicContact CG2-CB 4.28Å; V176-L196 HydrophobicContact CG2-CD2 3.16Å; V176-L196 HydrophobicContact CG2-CG 3.75Å; L183-L196 HydrophobicContact CD1-CB 4.5Å; L183-L196 HydrophobicContact CD1-CD1 3.63Å; L183-L196 HydrophobicContact CD1-CG 3.78Å; L183-L196 HydrophobicContact CD2-CD1 4.36Å; N194-L196 HydrophobicContact CB-CD1 3.41Å; N194-L196 VanDerWaalsContact CB-CD1 3.41Å; N194-L196 VanDerWaalsContact ND2-CD1 3.26Å; N194-L196 WeakPolarHBondContact ND2-CD1 3.48Å; N194-L196 PolarHBondContact O-N 2.78Å; N194-L196 WeakPolarHBondContact OD1-CD1 3.37Å; L196-N198 PolarHBondContact O-N 3.4Å; L196-F199 WeakPolarHBondContact O-CD1 3.26Å; L196-F199 PolarHBondContact O-N 2.94Å
197	G	57.4	Low	63.8	Low	39 Å²	39	56.3 Å²	56.3	40%	0.402	36%	0.362	S	S	.	.	G	3₁₀ helix	trans	-57.9	-11.1	179.9	0	0	0	0	0	115	R136 G195	R136-G197 WeakPolarHBondContact CG-O 3.33Å; G195-G197 PolarHBondContact O-N 3.1Å
198	N	73.2	Confident	66.7	Low	97 Å²	97	51.3 Å²	51.3	52%	0.519	33%	0.326	S	S	.	.	G	3₁₀ helix	trans	-136.1	50.9	171.1	-166.2	13.6	0	0	0	111.2	L196	L196-N198 PolarHBondContact O-N 3.4Å
199	F	85.2	Confident	69.7	Low	1 Å²	1	51.4 Å²	51.4	0%	0.004	32%	0.316	C	S	.	.			trans	-70.7	147.3	171.9	81	-87	0	0	0	110.5	F132 P135 R136 F143 V176 T177 L196 F202 A216	F132-F199 HydrophobicContact CE1-CE1 4.17Å; F132-F199 HydrophobicContact CE1-CZ 4.21Å; P135-F199 HydrophobicContact CG-CD1 4.33Å; R136-F199 HydrophobicContact CG-CD1 4.31Å; R136-F199 HydrophobicContact CG-CE1 4.16Å; F143-F199 HydrophobicContact CD2-CZ 4.45Å; F143-F199 AromaticContact CE2-CZ 3.71Å; F143-F199 HydrophobicContact CE2-CZ 3.71Å; F143-F199 HydrophobicContact CZ-CZ 4.25Å; V176-F199 HydrophobicContact CB-CB 3.88Å; V176-F199 HydrophobicContact CB-CD2 3.67Å; V176-F199 HydrophobicContact CB-CE2 4.34Å; V176-F199 HydrophobicContact CB-CG 3.83Å; V176-F199 HydrophobicContact CG1-CD2 3.75Å; V176-F199 HydrophobicContact CG1-CE2 3.92Å; V176-F199 HydrophobicContact CG1-CG 4.25Å; V176-F199 HydrophobicContact CG2-CB 3.98Å; V176-F199 HydrophobicContact CG2-CD1 4.46Å; V176-F199 HydrophobicContact CG2-CD2 4.34Å; V176-F199 HydrophobicContact CG2-CG 4.02Å; T177-F199 CarbonylContact O-C 3.45Å; T177-F199 VanDerWaalsContact O-CA 3.25Å; T177-F199 WeakPolarHBondContact O-CA 3.46Å; T177-F199 WeakPolarHBondContact O-CB 3.31Å; L196-F199 WeakPolarHBondContact O-CD1 3.26Å; L196-F199 PolarHBondContact O-N 2.94Å; F199-F202 HydrophobicContact CE2-CD1 4.39Å; F199-F202 AromaticContact CE2-CE1 3.67Å; F199-F202 HydrophobicContact CE2-CE1 3.67Å; F199-F202 HydrophobicContact CE2-CE2 4.07Å; F199-F202 AromaticContact CE2-CZ 3.48Å; F199-F202 HydrophobicContact CE2-CZ 3.48Å; F199-F202 VanDerWaalsContact CE2-CZ 3.48Å; F199-F202 HydrophobicContact CZ-CE1 4.23Å; F199-F202 AromaticContact CZ-CZ 3.95Å; F199-F202 HydrophobicContact CZ-CZ 3.95Å; F199-A216 HydrophobicContact CD2-CB 3.95Å; F199-A216 HydrophobicContact CE2-CB 3.6Å
200	A	87.3	Confident	72.8	Confident	11 Å²	11	46.4 Å²	46.4	9%	0.091	29%	0.292	C	S	.	.			trans	-133.9	-6.2	178.6	0	0	0	0	0	113.6	T177 P179 A216 V217	T177-A200 PolarHBondContact O-N 2.73Å; P179-A200 HydrophobicContact CB-CB 4.25Å; P179-A200 HydrophobicContact CG-CB 3.89Å; A200-A216 WeakPolarHBondContact O-CB 3.48Å; A200-A216 PolarHBondContact O-N 2.82Å; A200-V217 HydrophobicContact CB-CG2 3.68Å
201	R	90.9	Very high	76	Confident	60 Å²	60	36 Å²	36	23%	0.226	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	136	-179.3	-50.8	-69.8	-175.6	-174.1	3.2	110.2	V176 T177 G178 P179 F203 E213 V214 I224	V176-R201 WeakPolarHBondContact CA-O 3.47Å; T177-R201 PolarHBondContact N-O 2.75Å; T177-R201 PolarHBondContact O-N 3.32Å; T177-R201 VanDerWaalsContact O-N 3.14Å; G178-R201 WeakPolarHBondContact O-CG 3.36Å; P179-R201 PolarHBondContact O-NE 3.27Å; R201-F203 HydrophobicContact CB-CE2 4.33Å; R201-E213 HydrophobicContact CB-CG 4.48Å; R201-E213 IonicContact NE-OE1 3.2Å; R201-V214 CarbonylContact C-O 3.44Å; R201-V214 WeakPolarHBondContact CA-O 3.28Å; R201-I224 VanDerWaalsContact CD-CD1 3.45Å
202	F	94.1	Very high	79.1	Confident	0 Å²	0	31.3 Å²	31.3	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	140.6	163.6	-69.5	-69.7	0	0	0	109.5	F132 F143 L150 L174 A175 V176 F199 L204 E213 V214 A216	F132-F202 HydrophobicContact CD1-CE1 4.39Å; F143-F202 HydrophobicContact CB-CE1 4.44Å; F143-F202 HydrophobicContact CB-CZ 4.43Å; F143-F202 HydrophobicContact CD1-CE1 4.49Å; F143-F202 HydrophobicContact CD1-CE2 4.33Å; F143-F202 AromaticContact CD1-CZ 3.68Å; F143-F202 HydrophobicContact CD1-CZ 3.68Å; F143-F202 HydrophobicContact CD2-CE1 4.11Å; F143-F202 AromaticContact CD2-CZ 3.78Å; F143-F202 HydrophobicContact CD2-CZ 3.78Å; F143-F202 HydrophobicContact CE1-CE2 4.26Å; F143-F202 AromaticContact CE1-CZ 3.79Å; F143-F202 HydrophobicContact CE1-CZ 3.79Å; F143-F202 AromaticContact CE2-CZ 3.86Å; F143-F202 HydrophobicContact CE2-CZ 3.86Å; F143-F202 HydrophobicContact CG-CE1 4.08Å; F143-F202 AromaticContact CG-CZ 3.67Å; F143-F202 HydrophobicContact CG-CZ 3.67Å; F143-F202 AromaticContact CZ-CZ 3.86Å; F143-F202 HydrophobicContact CZ-CZ 3.86Å; L150-F202 HydrophobicContact CD2-CD2 3.84Å; L150-F202 HydrophobicContact CD2-CE2 4.15Å; L150-F202 HydrophobicContact CD2-CG 4.07Å; L174-F202 HydrophobicContact CD1-CB 4.26Å; L174-F202 HydrophobicContact CD1-CD1 3.52Å; L174-F202 HydrophobicContact CD1-CE1 4.21Å; L174-F202 HydrophobicContact CD1-CG 4.18Å; L174-F202 HydrophobicContact CD2-CD1 4.5Å; L174-F202 HydrophobicContact CG-CD1 4.27Å; A175-F202 CarbonylContact O-C 3.52Å; V176-F202 HydrophobicContact CG1-CD1 3.39Å; V176-F202 HydrophobicContact CG1-CE1 3.43Å; V176-F202 VanDerWaalsContact CG1-CE1 3.43Å; V176-F202 HydrophobicContact CG1-CG 4.48Å; F199-F202 HydrophobicContact CE2-CD1 4.39Å; F199-F202 AromaticContact CE2-CE1 3.67Å; F199-F202 HydrophobicContact CE2-CE1 3.67Å; F199-F202 HydrophobicContact CE2-CE2 4.07Å; F199-F202 AromaticContact CE2-CZ 3.48Å; F199-F202 HydrophobicContact CE2-CZ 3.48Å; F199-F202 VanDerWaalsContact CE2-CZ 3.48Å; F199-F202 HydrophobicContact CZ-CE1 4.23Å; F199-F202 AromaticContact CZ-CZ 3.95Å; F199-F202 HydrophobicContact CZ-CZ 3.95Å; F202-L204 HydrophobicContact CB-CD2 4.48Å; F202-E213 CarbonylContact O-C 3.6Å; F202-E213 WeakPolarHBondContact O-CA 3.32Å; F202-V214 HydrophobicContact CB-CB 4.12Å; F202-V214 PolarHBondContact N-O 3.35Å; F202-V214 PolarHBondContact O-N 2.92Å; F202-A216 HydrophobicContact CD2-CB 3.49Å; F202-A216 VanDerWaalsContact CD2-CB 3.49Å; F202-A216 HydrophobicContact CE2-CB 3.33Å; F202-A216 HydrophobicContact CG-CB 4.35Å; F202-A216 HydrophobicContact CZ-CB 4.08Å
203	F	95.1	Very high	82	Confident	1 Å²	1	29 Å²	29	0%	0.004	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	123.8	167	-79.4	-88.6	0	0	0	108.9	L174 A175 T177 R201 L211 L212 E213 I227 L237 L244	L174-F203 WeakPolarHBondContact CA-O 3.14Å; A175-F203 PolarHBondContact N-O 2.88Å; A175-F203 PolarHBondContact O-N 2.87Å; T177-F203 HydrophobicContact CG2-CD2 3.85Å; T177-F203 HydrophobicContact CG2-CE2 3.87Å; T177-F203 VanDerWaalsContact OG1-CE2 3.28Å; T177-F203 WeakPolarHBondContact OG1-CE2 3.43Å; R201-F203 HydrophobicContact CB-CE2 4.33Å; F203-L211 HydrophobicContact CD1-CD2 3.75Å; F203-L211 HydrophobicContact CD1-CG 4.09Å; F203-L211 HydrophobicContact CE1-CD2 4.37Å; F203-L212 CarbonylContact C-O 3.56Å; F203-L212 VanDerWaalsContact CA-O 3.26Å; F203-L212 WeakPolarHBondContact CA-O 3.35Å; F203-E213 HydrophobicContact CD1-CB 4.21Å; F203-E213 HydrophobicContact CE1-CB 3.72Å; F203-E213 HydrophobicContact CE1-CG 3.84Å; F203-E213 HydrophobicContact CE2-CG 4.17Å; F203-E213 HydrophobicContact CZ-CB 4.07Å; F203-E213 HydrophobicContact CZ-CG 3.64Å; F203-I227 HydrophobicContact CE1-CD1 4.16Å; F203-L237 HydrophobicContact CB-CD1 4.25Å; F203-L244 HydrophobicContact CB-CD2 3.68Å; F203-L244 HydrophobicContact CD1-CD2 3.74Å; F203-L244 HydrophobicContact CD2-CD2 4.03Å; F203-L244 HydrophobicContact CE1-CD2 4.37Å; F203-L244 HydrophobicContact CG-CD2 3.53Å
204	L	96.8	Very high	84.5	Confident	0 Å²	0	26.8 Å²	26.8	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	117.9	-178.6	-49.1	-179.1	0	0	0	109.7	L145 M168 L171 L174 F202 L211 L212 V214	L145-L204 HydrophobicContact CD1-CD2 3.92Å; M168-L204 HydrophobicContact CE-CD1 3.61Å; M168-L204 HydrophobicContact CG-CD1 4.48Å; M168-L204 HydrophobicContact SD-CD1 4.23Å; L171-L204 HydrophobicContact CD1-CB 4.18Å; L171-L204 HydrophobicContact CD1-CD1 4.04Å; L171-L204 HydrophobicContact CD2-CB 3.98Å; L174-L204 HydrophobicContact CB-CD2 4.47Å; L174-L204 HydrophobicContact CD1-CD2 3.27Å; L174-L204 HydrophobicContact CG-CD2 4.39Å; F202-L204 HydrophobicContact CB-CD2 4.48Å; L204-L211 WeakPolarHBondContact O-CD1 3.36Å; L204-L212 HydrophobicContact CB-CB 4.24Å; L204-L212 PolarHBondContact N-O 3.18Å; L204-L212 PolarHBondContact O-N 3.12Å; L204-V214 HydrophobicContact CD1-CG2 3.91Å; L204-V214 HydrophobicContact CG-CG2 4.23Å
205	G	95.1	Very high	86.6	Confident	0 Å²	0	22.8 Å²	22.8	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	158.4	177	0	0	0	0	0	111.5	L171 E172 C173 S234	L171-G205 CarbonylContact C-O 3.5Å; L171-G205 WeakPolarHBondContact CA-O 3.45Å; E172-G205 PolarHBondContact N-O 2.98Å; C173-G205 PolarHBondContact N-O 2.81Å; C173-G205 PolarHBondContact O-N 2.9Å; G205-S234 CarbonylContact C-O 3.51Å
206	G	94.2	Very high	88.5	Confident	0 Å²	0	21.5 Å²	21.5	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-168.5	-162.5	178.1	0	0	0	0	0	112.9	E170 Q208 G233 S234	E170-G206 CarbonylContact O-C 3.5Å; E170-G206 WeakPolarHBondContact O-CA 2.77Å; G206-Q208 PolarHBondContact O-N 2.91Å; G206-G233 CarbonylContact O-C 3.53Å; G206-G233 VanDerWaalsContact O-CA 3.31Å; G206-G233 WeakPolarHBondContact O-CA 3.42Å; G206-S234 WeakPolarHBondContact CA-O 3.32Å; G206-S234 PolarHBondContact N-O 3.02Å; G206-S234 PolarHBondContact O-N 3.41Å
207	L	92.7	Very high	89.9	Confident	81 Å²	81	24.7 Å²	24.7	42%	0.424	15%	0.145	S	C	.	.	S	Bend	trans	-77.7	39	172.3	-59.7	178.7	0	0	0	112.2	E170 E172 V235 T249	E170-L207 HydrophobicContact CB-CB 4.02Å; E170-L207 PolarHBondContact O-N 2.88Å; E172-L207 HydrophobicContact CG-CG 4.1Å; L207-V235 HydrophobicContact CD2-CG2 3.93Å; L207-T249 HydrophobicContact CD2-CG2 3.76Å
208	Q	94	Very high	91.1	Very high	9 Å²	9	31.2 Å²	31.2	4%	0.042	17%	0.166	C	C	.	.	S	Bend	trans	-125.8	152.1	177.7	60.6	170	24.8	0	0	109.9	S167 L169 G206 T210 G233	S167-Q208 PolarHBondContact O-NE2 3.44Å; S167-Q208 VanDerWaalsContact O-NE2 3.13Å; S167-Q208 PolarHBondContact O-OE1 3.41Å; L169-Q208 VanDerWaalsContact O-CD 3.24Å; L169-Q208 WeakPolarHBondContact O-CG 3.47Å; L169-Q208 PolarHBondContact O-OE1 3.4Å; G206-Q208 PolarHBondContact O-N 2.91Å; Q208-T210 WeakPolarHBondContact CG-O 3.34Å; Q208-T210 PolarHBondContact NE2-O 2.83Å; Q208-T210 PolarHBondContact NE2-OG1 2.87Å; Q208-T210 PolarHBondContact O-N 3.07Å; Q208-T210 VanDerWaalsContact O-N 3.13Å; Q208-G233 WeakPolarHBondContact O-CA 3.46Å
209	P	92.9	Very high	91.8	Very high	64 Å²	64	34 Å²	34	42%	0.416	17%	0.169	S	C	.	.	S	Bend	trans	-70.7	-9.9	-176.4	29.2	-35.5	0	0	0	114	V229 G230	P209-V229 PolarHBondContact O-N 3.29Å; P209-G230 VanDerWaalsContact CA-O 3.28Å; P209-G230 WeakPolarHBondContact CA-O 3.37Å; P209-G230 PolarHBondContact O-N 2.63Å
210	T	94	Very high	91.9	Very high	43 Å²	43	37 Å²	37	26%	0.264	18%	0.18	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	132.8	-176.3	55.4	0	0	0	0	112.5	Q208 I227	Q208-T210 WeakPolarHBondContact CG-O 3.34Å; Q208-T210 PolarHBondContact NE2-O 2.83Å; Q208-T210 PolarHBondContact NE2-OG1 2.87Å; Q208-T210 PolarHBondContact O-N 3.07Å; Q208-T210 VanDerWaalsContact O-N 3.13Å; T210-I227 CarbonylContact C-O 3.59Å; T210-I227 WeakPolarHBondContact CA-O 3.41Å
211	L	95.2	Very high	91.8	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	130.9	165.4	-178.1	77	0	0	0	109.4	F203 L204 T226 I227 V229 L237 L244 I256	F203-L211 HydrophobicContact CD1-CD2 3.75Å; F203-L211 HydrophobicContact CD1-CG 4.09Å; F203-L211 HydrophobicContact CE1-CD2 4.37Å; L204-L211 WeakPolarHBondContact O-CD1 3.36Å; L211-T226 WeakPolarHBondContact O-CA 3.47Å; L211-I227 HydrophobicContact CB-CB 4.32Å; L211-I227 HydrophobicContact CD2-CD1 4.5Å; L211-I227 PolarHBondContact N-O 2.7Å; L211-I227 PolarHBondContact O-N 3.05Å; L211-V229 HydrophobicContact CB-CG2 3.63Å; L211-L237 HydrophobicContact CD1-CD1 3.76Å; L211-L237 HydrophobicContact CD1-CD2 3.98Å; L211-L237 HydrophobicContact CD1-CG 4.43Å; L211-L244 HydrophobicContact CD2-CD2 3.9Å; L211-I256 HydrophobicContact CD2-CD1 3.46Å; L211-I256 VanDerWaalsContact CD2-CD1 3.46Å
212	L	95.4	Very high	91.9	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	129.5	-177.4	-48.1	178.5	0	0	0	110.7	S167 M168 F203 L204 V214 T226	S167-L212 WeakPolarHBondContact O-CD1 3.36Å; S167-L212 WeakPolarHBondContact OG-CD1 3.38Å; S167-L212 WeakPolarHBondContact OG-CD2 3.47Å; M168-L212 HydrophobicContact CB-CD1 4.41Å; M168-L212 HydrophobicContact CG-CD1 3.55Å; F203-L212 CarbonylContact C-O 3.56Å; F203-L212 VanDerWaalsContact CA-O 3.26Å; F203-L212 WeakPolarHBondContact CA-O 3.35Å; L204-L212 HydrophobicContact CB-CB 4.24Å; L204-L212 PolarHBondContact N-O 3.18Å; L204-L212 PolarHBondContact O-N 3.12Å; L212-V214 HydrophobicContact CB-CG2 4.23Å; L212-T226 HydrophobicContact CD2-CG2 3.78Å
213	E	94.2	Very high	91.9	Very high	11 Å²	11	39.5 Å²	39.5	5%	0.051	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	122.7	167.1	-173.5	177.6	176.4	0	0	108.7	R201 F202 F203 V223 I224 N225 S258	R201-E213 HydrophobicContact CB-CG 4.48Å; R201-E213 IonicContact NE-OE1 3.2Å; F202-E213 CarbonylContact O-C 3.6Å; F202-E213 WeakPolarHBondContact O-CA 3.32Å; F203-E213 HydrophobicContact CD1-CB 4.21Å; F203-E213 HydrophobicContact CE1-CB 3.72Å; F203-E213 HydrophobicContact CE1-CG 3.84Å; F203-E213 HydrophobicContact CE2-CG 4.17Å; F203-E213 HydrophobicContact CZ-CB 4.07Å; F203-E213 HydrophobicContact CZ-CG 3.64Å; E213-V223 CarbonylContact O-C 3.56Å; E213-V223 WeakPolarHBondContact O-CA 3.42Å; E213-I224 HydrophobicContact CG-CB 4.44Å; E213-I224 HydrophobicContact CG-CD1 4Å; E213-I224 PolarHBondContact O-N 3.32Å; E213-N225 HydrophobicContact CB-CB 3.99Å; E213-N225 PolarHBondContact N-O 2.79Å; E213-N225 PolarHBondContact O-N 2.75Å; E213-S258 WeakPolarHBondContact OE2-CB 3.41Å
214	V	94.3	Very high	91.7	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	140.4	-171.4	178.2	0	0	0	0	110.4	M168 R201 F202 L204 L212 G221 E222 V223	M168-V214 HydrophobicContact CE-CG2 4.34Å; R201-V214 CarbonylContact C-O 3.44Å; R201-V214 WeakPolarHBondContact CA-O 3.28Å; F202-V214 HydrophobicContact CB-CB 4.12Å; F202-V214 PolarHBondContact N-O 3.35Å; F202-V214 PolarHBondContact O-N 2.92Å; L204-V214 HydrophobicContact CD1-CG2 3.91Å; L204-V214 HydrophobicContact CG-CG2 4.23Å; L212-V214 HydrophobicContact CB-CG2 4.23Å; V214-G221 VanDerWaalsContact CG1-CA 3.46Å; V214-E222 CarbonylContact C-O 3.53Å; V214-E222 WeakPolarHBondContact CA-O 3.18Å; V214-V223 HydrophobicContact CG2-CG2 4.11Å
215	D	92.1	Very high	91.5	Very high	15 Å²	15	45.8 Å²	45.8	8%	0.08	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	135.9	179.7	-171.3	7.9	0	0	0	111.6	V217 E218 R219 W220 G221 E222 I224	D215-V217 PolarHBondContact OD1-N 2.88Å; D215-E218 PolarHBondContact OD2-N 2.97Å; D215-R219 PolarHBondContact OD2-N 3.28Å; D215-W220 WeakPolarHBondContact O-CA 3.42Å; D215-G221 PolarHBondContact O-N 2.97Å; D215-E222 PolarHBondContact N-O 2.75Å; D215-I224 HydrophobicContact CB-CD1 3.84Å; D215-I224 HydrophobicContact CB-CG1 4.09Å; D215-I224 VanDerWaalsContact N-CD1 3.26Å
216	A	88.9	Confident	91.4	Very high	4 Å²	4	49.5 Å²	49.5	3%	0.033	25%	0.252	C	S	.	.	S	Bend	trans	-110.4	0	179.9	0	0	0	0	0	114	F199 A200 F202	F199-A216 HydrophobicContact CD2-CB 3.95Å; F199-A216 HydrophobicContact CE2-CB 3.6Å; A200-A216 WeakPolarHBondContact O-CB 3.48Å; A200-A216 PolarHBondContact O-N 2.82Å; F202-A216 HydrophobicContact CD2-CB 3.49Å; F202-A216 VanDerWaalsContact CD2-CB 3.49Å; F202-A216 HydrophobicContact CE2-CB 3.33Å; F202-A216 HydrophobicContact CG-CB 4.35Å; F202-A216 HydrophobicContact CZ-CB 4.08Å
217	V	85.2	Confident	91.3	Very high	82 Å²	82	49.8 Å²	49.8	50%	0.497	25%	0.254	S	S	.	.	S	Bend	trans	-126.7	-76.1	-172	-170.7	0	0	0	0	112.8	A200 D215	A200-V217 HydrophobicContact CB-CG2 3.68Å; D215-V217 PolarHBondContact OD1-N 2.88Å
218	E	83	Confident	91.3	Very high	177 Å²	177	51 Å²	51	83%	0.827	26%	0.261	S	S	*	.	S	Bend	trans	-78.4	-46.1	-167.9	-66.3	-175.6	178.1	0	0	111.6	D215	D215-E218 PolarHBondContact OD2-N 2.97Å
219	R	86.8	Confident	91.3	Very high	154 Å²	154	51.2 Å²	51.2	58%	0.581	26%	0.262	S	S	*	.	S	Bend	trans	-123.8	63.6	-177.3	-56.2	-170.7	-177	-169.4	-0.7	109.6	D215 G221 E222	D215-R219 PolarHBondContact OD2-N 3.28Å; R219-G221 PolarHBondContact O-N 2.87Å; R219-G221 VanDerWaalsContact O-N 3.09Å; R219-E222 HydrophobicContact CB-CB 3.98Å; R219-E222 WeakPolarHBondContact CD-OE2 3.14Å; R219-E222 IonicContact CZ-OE2 3.54Å; R219-E222 IonicContact NE-OE2 2.96Å; R219-E222 IonicContact NH1-OE1 3.27Å; R219-E222 PolarHBondContact NH1-OE1 3.41Å; R219-E222 IonicContact NH1-OE2 3.87Å; R219-E222 PolarHBondContact NH1-OE2 2.98Å; R219-E222 WeakPolarHBondContact O-CB 3.31Å; R219-E222 PolarHBondContact O-N 3.45Å
220	W	87.6	Confident	91.1	Very high	65 Å²	65	49.4 Å²	49.4	25%	0.246	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-43.4	118.4	-175	-176.1	85.4	0	0	0	111.9	F143 A152 A161 V163 D215	F143-W220 AromaticContact CE1-NE1 3.77Å; A152-W220 HydrophobicContact CB-CH2 4.16Å; A152-W220 HydrophobicContact CB-CZ2 3.48Å; A152-W220 VanDerWaalsContact CB-CZ2 3.48Å; A161-W220 VanDerWaalsContact C-CH2 3.43Å; A161-W220 HydrophobicContact CB-CD2 4.16Å; A161-W220 HydrophobicContact CB-CE3 3.46Å; A161-W220 VanDerWaalsContact CB-CE3 3.46Å; A161-W220 HydrophobicContact CB-CH2 3.59Å; A161-W220 HydrophobicContact CB-CZ2 4.26Å; A161-W220 HydrophobicContact CB-CZ3 3.11Å; V163-W220 HydrophobicContact CB-CH2 4.14Å; V163-W220 HydrophobicContact CB-CZ3 3.97Å; V163-W220 HydrophobicContact CG2-CD2 4.48Å; V163-W220 HydrophobicContact CG2-CE3 3.51Å; V163-W220 HydrophobicContact CG2-CH2 3.73Å; V163-W220 HydrophobicContact CG2-CZ3 3.08Å; D215-W220 WeakPolarHBondContact O-CA 3.42Å
221	G	85.5	Confident	91	Very high	8 Å²	8	55.2 Å²	55.2	8%	0.082	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	89.5	-6.1	178.7	0	0	0	0	0	117.1	V163 V214 D215 R219 V223	V163-G221 WeakPolarHBondContact CG1-O 3.49Å; V214-G221 VanDerWaalsContact CG1-CA 3.46Å; D215-G221 PolarHBondContact O-N 2.97Å; R219-G221 PolarHBondContact O-N 2.87Å; R219-G221 VanDerWaalsContact O-N 3.09Å; G221-V223 PolarHBondContact O-N 2.72Å
222	E	93.1	Very high	90.6	Very high	88 Å²	88	55.5 Å²	55.5	41%	0.411	29%	0.286	S	S	.	.			trans	-67.7	128.7	173.3	-173.5	174.8	160.4	0	0	110.2	V214 D215 R219 I224	V214-E222 CarbonylContact C-O 3.53Å; V214-E222 WeakPolarHBondContact CA-O 3.18Å; D215-E222 PolarHBondContact N-O 2.75Å; R219-E222 HydrophobicContact CB-CB 3.98Å; R219-E222 WeakPolarHBondContact CD-OE2 3.14Å; R219-E222 IonicContact CZ-OE2 3.54Å; R219-E222 IonicContact NE-OE2 2.96Å; R219-E222 IonicContact NH1-OE1 3.27Å; R219-E222 PolarHBondContact NH1-OE1 3.41Å; R219-E222 IonicContact NH1-OE2 3.87Å; R219-E222 PolarHBondContact NH1-OE2 2.98Å; R219-E222 WeakPolarHBondContact O-CB 3.31Å; R219-E222 PolarHBondContact O-N 3.45Å; E222-I224 PolarHBondContact O-N 3.09Å
223	V	93.4	Very high	90.5	Very high	28 Å²	28	55.5 Å²	55.5	17%	0.17	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	111.1	172.2	-178.7	0	0	0	0	108.5	H165 E213 V214 G221 T226	H165-V223 HydrophobicContact CB-CG2 4.1Å; E213-V223 CarbonylContact O-C 3.56Å; E213-V223 WeakPolarHBondContact O-CA 3.42Å; V214-V223 HydrophobicContact CG2-CG2 4.11Å; G221-V223 PolarHBondContact O-N 2.72Å; V223-T226 HydrophobicContact CG1-CG2 3.9Å
224	I	91.6	Very high	90.5	Very high	71 Å²	71	55 Å²	55	36%	0.364	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	-43	-178.4	-57	140.1	0	0	0	110.5	R201 E213 D215 E222	R201-I224 VanDerWaalsContact CD-CD1 3.45Å; E213-I224 HydrophobicContact CG-CB 4.44Å; E213-I224 HydrophobicContact CG-CD1 4Å; E213-I224 PolarHBondContact O-N 3.32Å; D215-I224 HydrophobicContact CB-CD1 3.84Å; D215-I224 HydrophobicContact CB-CG1 4.09Å; D215-I224 VanDerWaalsContact N-CD1 3.26Å; E222-I224 PolarHBondContact O-N 3.09Å
225	N	91.4	Very high	90.5	Very high	62 Å²	62	56.4 Å²	56.4	33%	0.332	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	157.1	-173.4	-166.6	15.7	0	0	0	111	E213	E213-N225 HydrophobicContact CB-CB 3.99Å; E213-N225 PolarHBondContact N-O 2.79Å; E213-N225 PolarHBondContact O-N 2.75Å
226	T	93.1	Very high	90.6	Very high	77 Å²	77	56.4 Å²	56.4	47%	0.472	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	122.2	176.8	58.3	0	0	0	0	109.2	L211 L212 V223	L211-T226 WeakPolarHBondContact O-CA 3.47Å; L212-T226 HydrophobicContact CD2-CG2 3.78Å; V223-T226 HydrophobicContact CG1-CG2 3.9Å
227	I	93.6	Very high	90.9	Very high	6 Å²	6	56.5 Å²	56.5	3%	0.031	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	127.6	-177	-59.4	170	0	0	0	108.1	F203 T210 L211 V229 I256 I264	F203-I227 HydrophobicContact CE1-CD1 4.16Å; T210-I227 CarbonylContact C-O 3.59Å; T210-I227 WeakPolarHBondContact CA-O 3.41Å; L211-I227 HydrophobicContact CB-CB 4.32Å; L211-I227 HydrophobicContact CD2-CD1 4.5Å; L211-I227 PolarHBondContact N-O 2.7Å; L211-I227 PolarHBondContact O-N 3.05Å; I227-V229 HydrophobicContact CG2-CG2 4.5Å; I227-V229 PolarHBondContact O-N 3.22Å; I227-I256 HydrophobicContact CD1-CG2 3.6Å; I227-I264 HydrophobicContact CG2-CG1 4.35Å
228	D	93.1	Very high	91.3	Very high	108 Å²	108	55 Å²	55	58%	0.578	28%	0.278	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80	109.8	176.3	-175.2	9.8	0	0	0	110.3	G230 I264	D228-G230 PolarHBondContact OD1-N 2.8Å; D228-I264 WeakPolarHBondContact O-CD1 3.21Å
229	V	92	Very high	91.7	Very high	12 Å²	12	48 Å²	48	7%	0.073	25%	0.248	C	C	.	.			trans	-95.3	-10.8	177.9	-173.9	0	0	0	0	111.4	P209 L211 I227 N248 M254 I256	P209-V229 PolarHBondContact O-N 3.29Å; L211-V229 HydrophobicContact CB-CG2 3.63Å; I227-V229 HydrophobicContact CG2-CG2 4.5Å; I227-V229 PolarHBondContact O-N 3.22Å; V229-N248 WeakPolarHBondContact CG1-ND2 3.38Å; V229-M254 HydrophobicContact CG1-CG 4.02Å; V229-I256 HydrophobicContact CG2-CD1 4.27Å
230	G	90.7	Very high	91.7	Very high	26 Å²	26	41.5 Å²	41.5	27%	0.268	22%	0.224	S	C	.	.			trans	83	176.9	-178.9	0	0	0	0	0	114.1	P209 D228 G232 G233	P209-G230 VanDerWaalsContact CA-O 3.28Å; P209-G230 WeakPolarHBondContact CA-O 3.37Å; P209-G230 PolarHBondContact O-N 2.63Å; D228-G230 PolarHBondContact OD1-N 2.8Å; G230-G232 PolarHBondContact O-N 2.91Å; G230-G233 PolarHBondContact O-N 2.76Å
231	I	90	Very high	91.3	Very high	166 Å²	166	40 Å²	40	85%	0.851	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.1	-26	-167.2	-58.8	165.7	0	0	0	113.8	G233	I231-G233 PolarHBondContact O-N 2.89Å
232	G	88	Confident	91.1	Very high	5 Å²	5	41.3 Å²	41.3	5%	0.052	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-11.3	179.4	0	0	0	0	0	114.8	G230 T249	G230-G232 PolarHBondContact O-N 2.91Å; G232-T249 WeakPolarHBondContact CA-OG1 3.39Å; G232-T249 PolarHBondContact O-N 2.93Å; G232-T249 VanDerWaalsContact O-N 3.15Å; G232-T249 PolarHBondContact O-OG1 2.81Å
233	G	93.5	Very high	90.8	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	22%	0.217	C	C	.	.			trans	59.7	-167.6	-177.5	0	0	0	0	0	113.7	G206 Q208 G230 I231 N248	G206-G233 CarbonylContact O-C 3.53Å; G206-G233 VanDerWaalsContact O-CA 3.31Å; G206-G233 WeakPolarHBondContact O-CA 3.42Å; Q208-G233 WeakPolarHBondContact O-CA 3.46Å; G230-G233 PolarHBondContact O-N 2.76Å; I231-G233 PolarHBondContact O-N 2.89Å; G233-N248 WeakPolarHBondContact O-CB 3.35Å; G233-N248 PolarHBondContact O-ND2 2.9Å; G233-N248 PolarHBondContact O-OD1 3.09Å
234	S	93.7	Very high	90.7	Very high	2 Å²	2	35.9 Å²	35.9	1%	0.014	21%	0.21	C	C	.	.			trans	-130.1	107.5	175.5	173.2	0	0	0	0	109	C173 G205 G206 L237 G247	C173-S234 PolarHBondContact SG-O 2.75Å; G205-S234 CarbonylContact C-O 3.51Å; G206-S234 WeakPolarHBondContact CA-O 3.32Å; G206-S234 PolarHBondContact N-O 3.02Å; G206-S234 PolarHBondContact O-N 3.41Å; S234-L237 WeakPolarHBondContact OG-CD2 3.26Å; S234-G247 CarbonylContact C-O 3.45Å
235	V	93.4	Very high	90.8	Very high	29 Å²	29	32.5 Å²	32.5	18%	0.176	19%	0.192	C	C	.	.	S	Bend	trans	-93.3	-29.7	-176.3	-176.1	0	0	0	0	111.6	C173 L207 G247 T249	C173-V235 VanDerWaalsContact CB-O 3.28Å; C173-V235 WeakPolarHBondContact CB-O 3.28Å; C173-V235 PolarHBondContact SG-O 3.28Å; C173-V235 VanDerWaalsContact SG-O 3.4Å; L207-V235 HydrophobicContact CD2-CG2 3.93Å; V235-G247 PolarHBondContact N-O 3.1Å; V235-T249 HydrophobicContact CG2-CG2 3.57Å
236	V	95.3	Very high	91	Very high	14 Å²	14	29.6 Å²	29.6	9%	0.085	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	134.7	179.2	-170	0	0	0	0	109.2	A246 G247 M278	V236-A246 WeakPolarHBondContact O-CA 3.38Å; V236-G247 PolarHBondContact N-O 3.26Å; V236-G247 PolarHBondContact O-N 2.9Å; V236-M278 HydrophobicContact CB-CE 4.22Å; V236-M278 HydrophobicContact CB-CG 4.33Å; V236-M278 HydrophobicContact CG1-CE 4.11Å; V236-M278 HydrophobicContact CG1-CG 3.78Å; V236-M278 WeakPolarHBondContact O-CE 3.45Å
237	L	95.7	Very high	91.2	Very high	7 Å²	7	25.9 Å²	25.9	4%	0.037	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	133.3	177.5	-73.8	174.2	0	0	0	110.8	C173 A175 F203 L211 S234 L244 C245 A246	C173-L237 HydrophobicContact CB-CG 4.41Å; C173-L237 WeakPolarHBondContact SG-CG 3.44Å; A175-L237 HydrophobicContact CB-CB 3.64Å; A175-L237 HydrophobicContact CB-CD1 4.24Å; F203-L237 HydrophobicContact CB-CD1 4.25Å; L211-L237 HydrophobicContact CD1-CD1 3.76Å; L211-L237 HydrophobicContact CD1-CD2 3.98Å; L211-L237 HydrophobicContact CD1-CG 4.43Å; S234-L237 WeakPolarHBondContact OG-CD2 3.26Å; L237-L244 HydrophobicContact CB-CD1 4.28Å; L237-L244 HydrophobicContact CD2-CD1 4.24Å; L237-L244 HydrophobicContact CD2-CD2 3.82Å; L237-L244 HydrophobicContact CD2-CG 4.01Å; L237-C245 WeakPolarHBondContact CA-O 3Å; L237-A246 HydrophobicContact CD2-CB 3.58Å
238	R	93	Very high	91.2	Very high	51 Å²	51	26 Å²	26	19%	0.192	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	113.7	174.6	-65.8	-63.3	177.8	-163.9	-11.9	111.3	C245 D277 M278 V280 R330	R238-C245 HydrophobicContact CB-CB 4.48Å; R238-C245 PolarHBondContact N-O 3.42Å; R238-C245 PolarHBondContact O-N 2.79Å; R238-D277 IonicContact CZ-OD1 2.79Å; R238-D277 IonicContact NE-OD1 2.76Å; R238-D277 IonicContact NH2-OD1 2.77Å; R238-D277 PolarHBondContact NH2-OD1 2.97Å; R238-D277 IonicContact NH2-OD2 2.82Å; R238-M278 HydrophobicContact CB-CE 3.96Å; R238-M278 WeakPolarHBondContact CD-O 3.28Å; R238-M278 HydrophobicContact CG-CE 3.88Å; R238-M278 HydrophobicContact CG-CG 3.73Å; R238-M278 VanDerWaalsContact CG-O 3.27Å; R238-M278 WeakPolarHBondContact CG-O 3.29Å; R238-M278 PolarHBondContact NE-O 3.16Å; R238-V280 HydrophobicContact CB-CG2 3.9Å; R238-R330 VanDerWaalsContact NH2-CZ 3.29Å
239	P	90.7	Very high	91.2	Very high	30 Å²	30	22.8 Å²	22.8	20%	0.195	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	153.2	176.8	32.1	-34.4	0	0	0	111	V176 T177 L244	V176-P239 WeakPolarHBondContact O-CB 3.27Å; T177-P239 HydrophobicContact CG2-CB 4.03Å; P239-L244 HydrophobicContact CB-CD1 4.16Å
240	F	87	Confident	91.2	Very high	17 Å²	17	27 Å²	27	8%	0.075	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	174.9	171.2	73.8	-76.7	0	0	0	110.3	L183 G242 G243 I255 V280 L311	L183-F240 VanDerWaalsContact CB-O 3.29Å; L183-F240 WeakPolarHBondContact CB-O 3.5Å; L183-F240 PolarHBondContact N-O 2.82Å; L183-F240 VanDerWaalsContact N-O 3.14Å; F240-G242 VanDerWaalsContact CD2-N 3.27Å; F240-G242 VanDerWaalsContact CE2-CA 3.47Å; F240-G242 PolarHBondContact O-N 2.87Å; F240-G242 VanDerWaalsContact O-N 3.11Å; F240-G243 VanDerWaalsContact CD1-C 3.42Å; F240-G243 WeakPolarHBondContact CD1-O 3.39Å; F240-G243 PolarHBondContact N-O 2.79Å; F240-G243 PolarHBondContact O-N 3.04Å; F240-I255 HydrophobicContact CE1-CG2 4.14Å; F240-I255 HydrophobicContact CZ-CG2 3.94Å; F240-V280 HydrophobicContact CB-CG1 3.84Å; F240-L311 HydrophobicContact CB-CD1 4.36Å; F240-L311 HydrophobicContact CD1-CD1 4.14Å; F240-L311 HydrophobicContact CD2-CD1 3.9Å; F240-L311 HydrophobicContact CE1-CD1 4.43Å; F240-L311 HydrophobicContact CE2-CB 4.3Å; F240-L311 HydrophobicContact CE2-CD1 4.2Å; F240-L311 HydrophobicContact CG-CD1 3.88Å; F240-L311 HydrophobicContact CZ-CD1 4.47Å
241	S	80.3	Confident	91.3	Very high	34 Å²	34	25.7 Å²	25.7	24%	0.238	15%	0.148	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-26.3	-174.1	62.1	0	0	0	0	114.7	L183 H285	L183-S241 WeakPolarHBondContact O-CA 2.97Å; S241-H285 PolarHBondContact OG-CE1 3.12Å; S241-H285 PolarHBondContact OG-ND1 3.5Å
242	G	80.9	Confident	91.5	Very high	35 Å²	35	21.1 Å²	21.1	36%	0.361	12%	0.122	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.3	-2	-177.9	0	0	0	0	0	114.7	F240	F240-G242 VanDerWaalsContact CD2-N 3.27Å; F240-G242 VanDerWaalsContact CE2-CA 3.47Å; F240-G242 PolarHBondContact O-N 2.87Å; F240-G242 VanDerWaalsContact O-N 3.11Å
243	G	86.7	Confident	91.9	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	152.4	-144.5	-175.6	0	0	0	0	0	113.3	F240 I256	F240-G243 VanDerWaalsContact CD1-C 3.42Å; F240-G243 WeakPolarHBondContact CD1-O 3.39Å; F240-G243 PolarHBondContact N-O 2.79Å; F240-G243 PolarHBondContact O-N 3.04Å; G243-I256 CarbonylContact C-O 3.56Å; G243-I256 VanDerWaalsContact CA-O 3.3Å; G243-I256 WeakPolarHBondContact CA-O 3.47Å
244	L	91.5	Very high	92	Very high	2 Å²	2	21.4 Å²	21.4	1%	0.01	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	133.5	-175.1	-178.7	66.1	0	0	0	110.2	A175 F203 L211 L237 P239 I256	A175-L244 HydrophobicContact CB-CD1 3.71Å; F203-L244 HydrophobicContact CB-CD2 3.68Å; F203-L244 HydrophobicContact CD1-CD2 3.74Å; F203-L244 HydrophobicContact CD2-CD2 4.03Å; F203-L244 HydrophobicContact CE1-CD2 4.37Å; F203-L244 HydrophobicContact CG-CD2 3.53Å; L211-L244 HydrophobicContact CD2-CD2 3.9Å; L237-L244 HydrophobicContact CB-CD1 4.28Å; L237-L244 HydrophobicContact CD2-CD1 4.24Å; L237-L244 HydrophobicContact CD2-CD2 3.82Å; L237-L244 HydrophobicContact CD2-CG 4.01Å; P239-L244 HydrophobicContact CB-CD1 4.16Å; L244-I256 HydrophobicContact CB-CB 4.3Å; L244-I256 PolarHBondContact N-O 3.25Å; L244-I256 PolarHBondContact O-N 3.49Å
245	C	93.7	Very high	92	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	132.6	167.7	-59.1	0	0	0	0	108.4	L237 R238 V253 M254 I255 M278	L237-C245 WeakPolarHBondContact CA-O 3Å; R238-C245 HydrophobicContact CB-CB 4.48Å; R238-C245 PolarHBondContact N-O 3.42Å; R238-C245 PolarHBondContact O-N 2.79Å; C245-V253 HydrophobicContact CB-CG1 3.98Å; C245-M254 CarbonylContact C-O 3.54Å; C245-M254 WeakPolarHBondContact CA-O 3.37Å; C245-I255 HydrophobicContact CB-CD1 4.3Å; C245-I255 VanDerWaalsContact SG-CD1 3.56Å; C245-M278 VanDerWaalsContact C-CE 3.48Å; C245-M278 HydrophobicContact CB-CE 3.82Å; C245-M278 HydrophobicContact CB-SD 4.1Å; C245-M278 WeakPolarHBondContact O-CE 3.47Å
246	A	95.7	Very high	92	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	118.8	175.4	0	0	0	0	0	110.2	V236 L237 V253 M254 I256	V236-A246 WeakPolarHBondContact O-CA 3.38Å; L237-A246 HydrophobicContact CD2-CB 3.58Å; A246-V253 CarbonylContact O-C 3.54Å; A246-V253 WeakPolarHBondContact O-CA 3.49Å; A246-M254 HydrophobicContact CB-CB 4.35Å; A246-M254 PolarHBondContact N-O 3.38Å; A246-M254 PolarHBondContact O-N 2.8Å; A246-I256 HydrophobicContact CB-CD1 3.74Å
247	G	95.9	Very high	91.7	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	131.1	178.6	0	0	0	0	0	111.2	S234 V235 V236	S234-G247 CarbonylContact C-O 3.45Å; V235-G247 PolarHBondContact N-O 3.1Å; V236-G247 PolarHBondContact N-O 3.26Å; V236-G247 PolarHBondContact O-N 2.9Å
248	N	94.1	Very high	91.2	Very high	9 Å²	9	21.2 Å²	21.2	5%	0.048	12%	0.121	C	C	.	.			trans	-107	163.5	-174.7	-60.9	12.6	0	0	0	112	V229 G233 N250 G251 K252	V229-N248 WeakPolarHBondContact CG1-ND2 3.38Å; G233-N248 WeakPolarHBondContact O-CB 3.35Å; G233-N248 PolarHBondContact O-ND2 2.9Å; G233-N248 PolarHBondContact O-OD1 3.09Å; N248-N250 PolarHBondContact O-N 2.62Å; N248-N250 VanDerWaalsContact O-N 3.17Å; N248-G251 PolarHBondContact O-N 2.94Å; N248-G251 VanDerWaalsContact O-N 3.14Å; N248-K252 PolarHBondContact N-O 3.11Å
249	T	92.8	Very high	90.7	Very high	40 Å²	40	27 Å²	27	25%	0.245	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-19	174	53.9	0	0	0	0	114.1	L207 G232 V235 G251 E274	L207-T249 HydrophobicContact CD2-CG2 3.76Å; G232-T249 WeakPolarHBondContact CA-OG1 3.39Å; G232-T249 PolarHBondContact O-N 2.93Å; G232-T249 VanDerWaalsContact O-N 3.15Å; G232-T249 PolarHBondContact O-OG1 2.81Å; V235-T249 HydrophobicContact CG2-CG2 3.57Å; T249-G251 VanDerWaalsContact C-N 3.3Å; T249-G251 PolarHBondContact O-N 3.16Å; T249-E274 WeakPolarHBondContact O-CA 3.45Å; T249-E274 WeakPolarHBondContact O-CB 3.35Å; T249-E274 PolarHBondContact O-N 2.76Å
250	N	92.4	Very high	90.5	Very high	99 Å²	99	27.8 Å²	27.8	53%	0.529	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.7	4.3	178.2	-67.4	-14	0	0	0	113.7	N248	N248-N250 PolarHBondContact O-N 2.62Å; N248-N250 VanDerWaalsContact O-N 3.17Å
251	G	92.8	Very high	90.1	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	18%	0.183	C	C	.	.	S	Bend	trans	84.9	8.2	178.3	0	0	0	0	0	115.5	N248 T249 A270 H271 G273	N248-G251 PolarHBondContact O-N 2.94Å; N248-G251 VanDerWaalsContact O-N 3.14Å; T249-G251 VanDerWaalsContact C-N 3.3Å; T249-G251 PolarHBondContact O-N 3.16Å; G251-A270 WeakPolarHBondContact O-CA 3.47Å; G251-A270 WeakPolarHBondContact O-CB 3.34Å; G251-A270 PolarHBondContact O-N 3.48Å; G251-A270 VanDerWaalsContact O-N 3.1Å; G251-H271 CarbonylContact C-O 3.59Å; G251-H271 WeakPolarHBondContact CA-O 3.28Å; G251-H271 PolarHBondContact O-N 2.99Å; G251-G273 WeakPolarHBondContact CA-O 3.4Å; G251-G273 PolarHBondContact N-O 3.07Å
252	K	95.4	Very high	90.2	Very high	70 Å²	70	38.3 Å²	38.3	30%	0.304	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	141.6	-177.8	-70.1	169.1	162.3	-164.1	0	110.8	N248 E267 L268 D269 I275	N248-K252 PolarHBondContact N-O 3.11Å; K252-E267 HydrophobicContact CB-CG 4.43Å; K252-E267 HydrophobicContact CD-CG 4.29Å; K252-E267 WeakPolarHBondContact CD-OE1 3.39Å; K252-E267 WeakPolarHBondContact CE-OE1 3.37Å; K252-E267 IonicContact NZ-OE1 2.83Å; K252-E267 PolarHBondContact NZ-OE1 3.25Å; K252-L268 CarbonylContact C-O 3.48Å; K252-L268 WeakPolarHBondContact CA-O 3.49Å; K252-D269 WeakPolarHBondContact CE-OD1 3.15Å; K252-D269 IonicContact NZ-OD1 3.04Å; K252-I275 VanDerWaalsContact O-CD1 3.23Å; K252-I275 WeakPolarHBondContact O-CD1 3.37Å
253	V	96.2	Very high	90.3	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	116.2	169.8	-175.6	0	0	0	0	109.3	C245 A246 I255 L268 A270 I275 M278 L287 T289	C245-V253 HydrophobicContact CB-CG1 3.98Å; A246-V253 CarbonylContact O-C 3.54Å; A246-V253 WeakPolarHBondContact O-CA 3.49Å; V253-I255 HydrophobicContact CG1-CD1 4.05Å; V253-L268 HydrophobicContact CB-CB 4.28Å; V253-L268 PolarHBondContact N-O 2.91Å; V253-L268 PolarHBondContact O-N 2.91Å; V253-A270 HydrophobicContact CG2-CB 4.1Å; V253-I275 HydrophobicContact CG2-CD1 3.56Å; V253-M278 HydrophobicContact CG1-SD 4.16Å; V253-M278 HydrophobicContact CG2-SD 4.38Å; V253-L287 HydrophobicContact CB-CD2 4.37Å; V253-L287 HydrophobicContact CG1-CD2 3.89Å; V253-L287 HydrophobicContact CG2-CD2 4.35Å; V253-T289 HydrophobicContact CG2-CG2 3.88Å
254	M	94.8	Very high	90.5	Very high	11 Å²	11	39 Å²	39	5%	0.054	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	126.3	173.9	-52.4	-53.9	-75	0	0	109.1	V229 C245 A246 I256 I264 E267	V229-M254 HydrophobicContact CG1-CG 4.02Å; C245-M254 CarbonylContact C-O 3.54Å; C245-M254 WeakPolarHBondContact CA-O 3.37Å; A246-M254 HydrophobicContact CB-CB 4.35Å; A246-M254 PolarHBondContact N-O 3.38Å; A246-M254 PolarHBondContact O-N 2.8Å; M254-I256 HydrophobicContact CB-CG1 4.38Å; M254-I264 HydrophobicContact CE-CB 4.43Å; M254-I264 HydrophobicContact CE-CD1 3.65Å; M254-I264 HydrophobicContact CE-CG1 4.13Å; M254-I264 HydrophobicContact CE-CG2 3.5Å; M254-I264 VanDerWaalsContact CE-CG2 3.5Å; M254-E267 HydrophobicContact CE-CB 4.04Å; M254-E267 HydrophobicContact CE-CG 4.18Å; M254-E267 HydrophobicContact SD-CB 3.83Å; M254-E267 HydrophobicContact SD-CG 3.53Å; M254-E267 VanDerWaalsContact SD-CG 3.53Å
255	I	94.3	Very high	90.5	Very high	11 Å²	11	43 Å²	43	6%	0.056	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	117.9	173.4	-51.9	-56.4	0	0	0	107.7	F240 C245 V253 V265 R266 L268 L311	F240-I255 HydrophobicContact CE1-CG2 4.14Å; F240-I255 HydrophobicContact CZ-CG2 3.94Å; C245-I255 HydrophobicContact CB-CD1 4.3Å; C245-I255 VanDerWaalsContact SG-CD1 3.56Å; V253-I255 HydrophobicContact CG1-CD1 4.05Å; I255-V265 PolarHBondContact O-N 3.31Å; I255-R266 HydrophobicContact CB-CB 4.08Å; I255-R266 HydrophobicContact CG1-CB 4.14Å; I255-R266 PolarHBondContact N-O 2.81Å; I255-R266 PolarHBondContact O-N 3.44Å; I255-L268 HydrophobicContact CD1-CD1 4.09Å; I255-L268 HydrophobicContact CG1-CD1 4.24Å; I255-L268 HydrophobicContact CG1-CG 4.45Å; I255-L311 HydrophobicContact CD1-CD2 3.68Å
256	I	92.1	Very high	90.4	Very high	2 Å²	2	47.1 Å²	47.1	1%	0.01	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	133.5	-170.7	-59.8	175.3	0	0	0	109.4	L211 I227 V229 G243 L244 A246 M254 G263 I264	L211-I256 HydrophobicContact CD2-CD1 3.46Å; L211-I256 VanDerWaalsContact CD2-CD1 3.46Å; I227-I256 HydrophobicContact CD1-CG2 3.6Å; V229-I256 HydrophobicContact CG2-CD1 4.27Å; G243-I256 CarbonylContact C-O 3.56Å; G243-I256 VanDerWaalsContact CA-O 3.3Å; G243-I256 WeakPolarHBondContact CA-O 3.47Å; L244-I256 HydrophobicContact CB-CB 4.3Å; L244-I256 PolarHBondContact N-O 3.25Å; L244-I256 PolarHBondContact O-N 3.49Å; A246-I256 HydrophobicContact CB-CD1 3.74Å; M254-I256 HydrophobicContact CB-CG1 4.38Å; I256-G263 CarbonylContact C-O 3.56Å; I256-G263 VanDerWaalsContact CA-O 3.26Å; I256-G263 WeakPolarHBondContact CA-O 3.35Å; I256-I264 HydrophobicContact CG1-CG1 4.27Å
257	D	89.6	Confident	90.3	Very high	15 Å²	15	51.5 Å²	51.5	8%	0.08	26%	0.261	C	S	.	.			trans	-130.8	107	170.3	-178.2	-7.1	0	0	0	107.6	R259 T260 G263 V265	D257-R259 PolarHBondContact O-N 3.37Å; D257-R259 VanDerWaalsContact O-N 3.08Å; D257-R259 VanDerWaalsContact OD1-CB 3.28Å; D257-R259 WeakPolarHBondContact OD1-CB 3.45Å; D257-R259 VanDerWaalsContact OD1-CG 3.24Å; D257-R259 WeakPolarHBondContact OD1-CG 3.47Å; D257-R259 IonicContact OD1-CZ 3.27Å; D257-R259 PolarHBondContact OD1-N 2.75Å; D257-R259 VanDerWaalsContact OD1-N 3.15Å; D257-R259 IonicContact OD1-NE 2.88Å; D257-R259 PolarHBondContact OD1-NE 3.42Å; D257-R259 IonicContact OD1-NH2 3.87Å; D257-R259 IonicContact OD2-CZ 3.49Å; D257-R259 IonicContact OD2-NE 3.83Å; D257-R259 PolarHBondContact OD2-NE 3.46Å; D257-R259 IonicContact OD2-NH2 2.67Å; D257-R259 PolarHBondContact OD2-NH2 2.72Å; D257-T260 HydrophobicContact CB-CG2 4.09Å; D257-T260 WeakPolarHBondContact O-CB 3.46Å; D257-T260 PolarHBondContact O-N 3.41Å; D257-T260 PolarHBondContact O-OG1 2.93Å; D257-G263 PolarHBondContact N-O 3.3Å; D257-V265 HydrophobicContact CB-CG2 3.55Å
258	S	84.5	Confident	90.2	Very high	20 Å²	20	52 Å²	52	14%	0.14	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66	-12.3	-175.1	69	0	0	0	0	113.6	G181 E213 T260	G181-S258 WeakPolarHBondContact CA-OG 3.28Å; E213-S258 WeakPolarHBondContact OE2-CB 3.41Å; S258-T260 PolarHBondContact O-N 3.34Å
259	R	83.8	Confident	90.2	Very high	172 Å²	172	56.8 Å²	56.8	65%	0.649	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.9	-15.4	173.7	-51	175.7	-51	116.7	5.2	112.2	T180 D257	T180-R259 WeakPolarHBondContact O-CG 3.23Å; D257-R259 PolarHBondContact O-N 3.37Å; D257-R259 VanDerWaalsContact O-N 3.08Å; D257-R259 VanDerWaalsContact OD1-CB 3.28Å; D257-R259 WeakPolarHBondContact OD1-CB 3.45Å; D257-R259 VanDerWaalsContact OD1-CG 3.24Å; D257-R259 WeakPolarHBondContact OD1-CG 3.47Å; D257-R259 IonicContact OD1-CZ 3.27Å; D257-R259 PolarHBondContact OD1-N 2.75Å; D257-R259 VanDerWaalsContact OD1-N 3.15Å; D257-R259 IonicContact OD1-NE 2.88Å; D257-R259 PolarHBondContact OD1-NE 3.42Å; D257-R259 IonicContact OD1-NH2 3.87Å; D257-R259 IonicContact OD2-CZ 3.49Å; D257-R259 IonicContact OD2-NE 3.83Å; D257-R259 PolarHBondContact OD2-NE 3.46Å; D257-R259 IonicContact OD2-NH2 2.67Å; D257-R259 PolarHBondContact OD2-NH2 2.72Å
260	T	85.6	Confident	90.3	Very high	46 Å²	46	54.9 Å²	54.9	28%	0.282	28%	0.277	S	S	.	.	S	Bend	trans	-92.4	147.5	178.3	70.9	0	0	0	0	110.9	D257 S258 H262 G263 V265	D257-T260 HydrophobicContact CB-CG2 4.09Å; D257-T260 WeakPolarHBondContact O-CB 3.46Å; D257-T260 PolarHBondContact O-N 3.41Å; D257-T260 PolarHBondContact O-OG1 2.93Å; S258-T260 PolarHBondContact O-N 3.34Å; T260-H262 VanDerWaalsContact C-N 3.28Å; T260-H262 PolarHBondContact O-N 3.18Å; T260-G263 PolarHBondContact O-N 3.48Å; T260-G263 VanDerWaalsContact O-N 3.12Å; T260-G263 WeakPolarHBondContact OG1-CA 3.17Å; T260-G263 PolarHBondContact OG1-N 2.59Å; T260-G263 PolarHBondContact OG1-O 3.24Å; T260-V265 HydrophobicContact CG2-CG2 4.07Å
261	S	79.9	Confident	90.4	Very high	119 Å²	119	50.7 Å²	50.7	83%	0.832	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.6	-28.8	-174.3	67.1	0	0	0	0	114.3
262	H	81	Confident	90.4	Very high	153 Å²	153	55.1 Å²	55.1	71%	0.708	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.8	-10.7	177.5	-67.9	79.8	0	0	0	112.2	T260 I264	T260-H262 VanDerWaalsContact C-N 3.28Å; T260-H262 PolarHBondContact O-N 3.18Å; H262-I264 PolarHBondContact O-N 2.87Å
263	G	84.8	Confident	90.3	Very high	1 Å²	1	52 Å²	52	1%	0.01	27%	0.269	C	S	.	.	S	Bend	trans	71.4	-49.5	-171.5	0	0	0	0	0	113.4	I256 D257 T260	I256-G263 CarbonylContact C-O 3.56Å; I256-G263 VanDerWaalsContact CA-O 3.26Å; I256-G263 WeakPolarHBondContact CA-O 3.35Å; D257-G263 PolarHBondContact N-O 3.3Å; T260-G263 PolarHBondContact O-N 3.48Å; T260-G263 VanDerWaalsContact O-N 3.12Å; T260-G263 WeakPolarHBondContact OG1-CA 3.17Å; T260-G263 PolarHBondContact OG1-N 2.59Å; T260-G263 PolarHBondContact OG1-O 3.24Å
264	I	90.4	Very high	90.1	Very high	50 Å²	50	55.3 Å²	55.3	26%	0.256	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	124.5	-178	-64.4	162.6	0	0	0	111	I227 D228 M254 I256 H262	I227-I264 HydrophobicContact CG2-CG1 4.35Å; D228-I264 WeakPolarHBondContact O-CD1 3.21Å; M254-I264 HydrophobicContact CE-CB 4.43Å; M254-I264 HydrophobicContact CE-CD1 3.65Å; M254-I264 HydrophobicContact CE-CG1 4.13Å; M254-I264 HydrophobicContact CE-CG2 3.5Å; M254-I264 VanDerWaalsContact CE-CG2 3.5Å; I256-I264 HydrophobicContact CG1-CG1 4.27Å; H262-I264 PolarHBondContact O-N 2.87Å
265	V	90.8	Very high	90.1	Very high	84 Å²	84	54.8 Å²	54.8	51%	0.509	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	-38.8	177.4	179.5	0	0	0	0	111.9	I255 D257 T260	I255-V265 PolarHBondContact O-N 3.31Å; D257-V265 HydrophobicContact CB-CG2 3.55Å; T260-V265 HydrophobicContact CG2-CG2 4.07Å
266	R	91.6	Very high	90.2	Very high	88 Å²	88	55.7 Å²	55.7	33%	0.332	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	154.6	-175.5	-174	178.7	-65.9	143.5	-7	110.8	I255 L268 L311 G314	I255-R266 HydrophobicContact CB-CB 4.08Å; I255-R266 HydrophobicContact CG1-CB 4.14Å; I255-R266 PolarHBondContact N-O 2.81Å; I255-R266 PolarHBondContact O-N 3.44Å; R266-L268 HydrophobicContact CG-CD2 4.08Å; R266-L311 PolarHBondContact NH1-O 3.44Å; R266-G314 VanDerWaalsContact NH1-N 3.15Å
267	E	93.4	Very high	90.4	Very high	91 Å²	91	55.9 Å²	55.9	43%	0.425	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	132.2	172.5	179.4	172.3	152.6	0	0	108.7	K252 M254	K252-E267 HydrophobicContact CB-CG 4.43Å; K252-E267 HydrophobicContact CD-CG 4.29Å; K252-E267 WeakPolarHBondContact CD-OE1 3.39Å; K252-E267 WeakPolarHBondContact CE-OE1 3.37Å; K252-E267 IonicContact NZ-OE1 2.83Å; K252-E267 PolarHBondContact NZ-OE1 3.25Å; M254-E267 HydrophobicContact CE-CB 4.04Å; M254-E267 HydrophobicContact CE-CG 4.18Å; M254-E267 HydrophobicContact SD-CB 3.83Å; M254-E267 HydrophobicContact SD-CG 3.53Å; M254-E267 VanDerWaalsContact SD-CG 3.53Å
268	L	94.9	Very high	90.6	Very high	10 Å²	10	55.2 Å²	55.2	5%	0.052	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	122.4	179.4	-57.5	176	0	0	0	109.5	K252 V253 I255 R266 A270 L287 Y309	K252-L268 CarbonylContact C-O 3.48Å; K252-L268 WeakPolarHBondContact CA-O 3.49Å; V253-L268 HydrophobicContact CB-CB 4.28Å; V253-L268 PolarHBondContact N-O 2.91Å; V253-L268 PolarHBondContact O-N 2.91Å; I255-L268 HydrophobicContact CD1-CD1 4.09Å; I255-L268 HydrophobicContact CG1-CD1 4.24Å; I255-L268 HydrophobicContact CG1-CG 4.45Å; R266-L268 HydrophobicContact CG-CD2 4.08Å; L268-A270 PolarHBondContact O-N 3.49Å; L268-L287 HydrophobicContact CD1-CD2 4.08Å; L268-Y309 HydrophobicContact CB-CE1 4.36Å; L268-Y309 HydrophobicContact CD1-CD1 4.05Å; L268-Y309 HydrophobicContact CD1-CD2 4.5Å; L268-Y309 HydrophobicContact CD1-CG 4.02Å; L268-Y309 HydrophobicContact CD2-CD1 4.25Å; L268-Y309 HydrophobicContact CD2-CE1 4.44Å
269	D	94.1	Very high	91.1	Very high	110 Å²	110	54.8 Å²	54.8	59%	0.588	28%	0.283	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79	84.3	175.9	-66.2	-55.7	0	0	0	110.7	K252 Y309	K252-D269 WeakPolarHBondContact CE-OD1 3.15Å; K252-D269 IonicContact NZ-OD1 3.04Å; D269-Y309 PolarHBondContact O-OH 3.14Å
270	A	94.5	Very high	91.4	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	26%	0.259	C	S	.	.			trans	-77.7	-53.6	-177	0	0	0	0	0	112.5	G251 V253 L268 T289 R307 Y309	G251-A270 WeakPolarHBondContact O-CA 3.47Å; G251-A270 WeakPolarHBondContact O-CB 3.34Å; G251-A270 PolarHBondContact O-N 3.48Å; G251-A270 VanDerWaalsContact O-N 3.1Å; V253-A270 HydrophobicContact CG2-CB 4.1Å; L268-A270 PolarHBondContact O-N 3.49Å; A270-T289 HydrophobicContact CB-CG2 4.29Å; A270-R307 WeakPolarHBondContact O-CG 3.41Å; A270-R307 PolarHBondContact O-NH1 2.85Å; A270-Y309 WeakPolarHBondContact CA-OH 3.18Å; A270-Y309 HydrophobicContact CB-CE2 4.14Å
271	H	94.8	Very high	91.6	Very high	11 Å²	11	46.3 Å²	46.3	5%	0.051	25%	0.25	C	S	.	.			trans	-133.6	160.7	-175.3	-61.7	-80.7	0	0	0	110.2	G251 G273 T289 W292 D303	G251-H271 CarbonylContact C-O 3.59Å; G251-H271 WeakPolarHBondContact CA-O 3.28Å; G251-H271 PolarHBondContact O-N 2.99Å; H271-G273 WeakPolarHBondContact CB-O 3.16Å; H271-T289 PolarHBondContact NE2-OG1 3.45Å; H271-W292 WeakPolarHBondContact CB-O 3.22Å; H271-D303 IonicContact CE1-OD2 2.86Å; H271-D303 IonicContact CG-OD2 2.63Å; H271-D303 IonicContact ND1-OD2 3.63Å; H271-D303 PolarHBondContact ND1-OD2 2.87Å
272	T	92.4	Very high	91.2	Very high	93 Å²	93	42.5 Å²	42.5	57%	0.571	23%	0.226	S	C	*	.	S	Bend	trans	-90.5	-15	176.4	57.5	0	0	0	0	112.8	S293 R294	T272-S293 VanDerWaalsContact OG1-CA 3.31Å; T272-S293 WeakPolarHBondContact OG1-CA 3.4Å; T272-R294 PolarHBondContact OG1-N 3.12Å
273	G	92.1	Very high	91	Very high	4 Å²	4	41.4 Å²	41.4	4%	0.041	23%	0.225	C	C	.	.	S	Bend	trans	-116.7	-166	165.7	0	0	0	0	0	110.5	G251 H271 W292	G251-G273 WeakPolarHBondContact CA-O 3.4Å; G251-G273 PolarHBondContact N-O 3.07Å; H271-G273 WeakPolarHBondContact CB-O 3.16Å; G273-W292 CarbonylContact C-O 3.53Å; G273-W292 WeakPolarHBondContact CA-O 3.25Å; G273-W292 PolarHBondContact N-O 3.03Å
274	E	92.2	Very high	90.8	Very high	70 Å²	70	43 Å²	43	33%	0.327	24%	0.236	S	C	.	.			trans	-60.7	148	-173.1	177	167.1	-160.1	0	0	114.1	T249 G291 W292	T249-E274 WeakPolarHBondContact O-CA 3.45Å; T249-E274 WeakPolarHBondContact O-CB 3.35Å; T249-E274 PolarHBondContact O-N 2.76Å; E274-G291 CarbonylContact O-C 3.58Å; E274-G291 WeakPolarHBondContact O-CA 3.45Å; E274-W292 PolarHBondContact O-N 3.42Å
275	I	95.8	Very high	90.6	Very high	1 Å²	1	42.3 Å²	42.3	1%	0.005	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82	125.1	168.1	-71.4	155.7	0	0	0	108.3	K252 V253	K252-I275 VanDerWaalsContact O-CD1 3.23Å; K252-I275 WeakPolarHBondContact O-CD1 3.37Å; V253-I275 HydrophobicContact CG2-CD1 3.56Å
276	S	95	Very high	90.6	Very high	30 Å²	30	39.5 Å²	39.5	21%	0.21	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	-46	178	56.9	0	0	0	0	112.2	C290 G291 C327	S276-C290 PolarHBondContact N-O 2.79Å; S276-C290 VanDerWaalsContact OG-C 3.29Å; S276-C290 PolarHBondContact OG-O 2.85Å; S276-C290 PolarHBondContact OG-SG 2.87Å; S276-G291 PolarHBondContact OG-N 2.79Å; S276-C327 WeakPolarHBondContact CB-O 3.47Å; S276-C327 PolarHBondContact OG-O 3.13Å
277	D	96.4	Very high	90.8	Very high	6 Å²	6	35.3 Å²	35.3	3%	0.032	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.3	162.7	174.4	-165.3	9.4	0	0	0	109	R238 C290 C327 F328 V329 R330	R238-D277 IonicContact CZ-OD1 2.79Å; R238-D277 IonicContact NE-OD1 2.76Å; R238-D277 IonicContact NH2-OD1 2.77Å; R238-D277 PolarHBondContact NH2-OD1 2.97Å; R238-D277 IonicContact NH2-OD2 2.82Å; D277-C290 PolarHBondContact O-N 2.77Å; D277-C290 PolarHBondContact O-SG 2.84Å; D277-C327 VanDerWaalsContact CB-O 3.31Å; D277-C327 WeakPolarHBondContact CB-O 3.36Å; D277-F328 HydrophobicContact CB-CD1 4.39Å; D277-V329 HydrophobicContact CB-CG2 4.28Å; D277-V329 PolarHBondContact OD2-N 3.34Å; D277-V329 VanDerWaalsContact OD2-N 3.12Å; D277-R330 IonicContact OD1-NH1 3.95Å; D277-R330 IonicContact OD2-NH1 3.91Å; D277-R330 PolarHBondContact OD2-NH1 2.8Å
278	M	95.5	Very high	90.9	Very high	0 Å²	0	31 Å²	31	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147	154.5	172.3	62.8	178.8	-176.6	0	0	109.6	V236 R238 C245 V253 L287 V288 T289	V236-M278 HydrophobicContact CB-CE 4.22Å; V236-M278 HydrophobicContact CB-CG 4.33Å; V236-M278 HydrophobicContact CG1-CE 4.11Å; V236-M278 HydrophobicContact CG1-CG 3.78Å; V236-M278 WeakPolarHBondContact O-CE 3.45Å; R238-M278 HydrophobicContact CB-CE 3.96Å; R238-M278 WeakPolarHBondContact CD-O 3.28Å; R238-M278 HydrophobicContact CG-CE 3.88Å; R238-M278 HydrophobicContact CG-CG 3.73Å; R238-M278 VanDerWaalsContact CG-O 3.27Å; R238-M278 WeakPolarHBondContact CG-O 3.29Å; R238-M278 PolarHBondContact NE-O 3.16Å; C245-M278 VanDerWaalsContact C-CE 3.48Å; C245-M278 HydrophobicContact CB-CE 3.82Å; C245-M278 HydrophobicContact CB-SD 4.1Å; C245-M278 WeakPolarHBondContact O-CE 3.47Å; V253-M278 HydrophobicContact CG1-SD 4.16Å; V253-M278 HydrophobicContact CG2-SD 4.38Å; M278-L287 HydrophobicContact CB-CD1 4.06Å; M278-L287 HydrophobicContact CG-CD1 4.42Å; M278-L287 HydrophobicContact SD-CD1 4.15Å; M278-V288 CarbonylContact C-O 3.53Å; M278-V288 VanDerWaalsContact CA-O 3.25Å; M278-V288 WeakPolarHBondContact CA-O 3.45Å; M278-V288 WeakPolarHBondContact CB-O 3.31Å; M278-T289 HydrophobicContact CB-CG2 3.92Å
279	T	93.4	Very high	91	Very high	11 Å²	11	30.5 Å²	30.5	7%	0.067	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	150.9	177.1	-169.9	0	0	0	0	110.1	V288 V329 F331 L339	T279-V288 HydrophobicContact CG2-CB 4.25Å; T279-V288 PolarHBondContact N-O 2.86Å; T279-V288 PolarHBondContact O-N 2.93Å; T279-V329 WeakPolarHBondContact CB-O 3.4Å; T279-V329 HydrophobicContact CG2-CB 4.08Å; T279-V329 HydrophobicContact CG2-CG2 3.9Å; T279-F331 HydrophobicContact CG2-CD2 3.45Å; T279-F331 VanDerWaalsContact CG2-CD2 3.45Å; T279-F331 HydrophobicContact CG2-CE2 3.72Å; T279-F331 HydrophobicContact CG2-CG 4.3Å; T279-F331 PolarHBondContact OG1-N 2.82Å; T279-L339 HydrophobicContact CG2-CD1 3.51Å
280	V	91.7	Very high	91.1	Very high	23 Å²	23	25.3 Å²	25.3	14%	0.139	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	129.1	-178.1	-179	0	0	0	0	108.5	R238 F240 T286 L287 L311	R238-V280 HydrophobicContact CB-CG2 3.9Å; F240-V280 HydrophobicContact CB-CG1 3.84Å; V280-T286 WeakPolarHBondContact CA-O 3.33Å; V280-L287 HydrophobicContact CG2-CB 4.34Å; V280-L287 HydrophobicContact CG2-CD1 3.61Å; V280-L311 HydrophobicContact CG1-CD1 3.68Å; V280-L311 HydrophobicContact CG2-CD1 4.24Å
281	D	88.4	Confident	91.1	Very high	18 Å²	18	25.3 Å²	25.3	10%	0.096	15%	0.148	C	C	.	.			trans	-81.8	122.1	168.1	174.4	35.6	0	0	0	109.7	N283 S284 H285 T286 F331 S336	D281-N283 PolarHBondContact O-N 3.04Å; D281-N283 PolarHBondContact OD1-N 2.86Å; D281-S284 WeakPolarHBondContact CB-OG 3.36Å; D281-S284 WeakPolarHBondContact OD2-CB 3.36Å; D281-S284 PolarHBondContact OD2-N 2.92Å; D281-S284 PolarHBondContact OD2-OG 2.84Å; D281-H285 WeakPolarHBondContact O-CA 3.41Å; D281-H285 PolarHBondContact O-N 2.91Å; D281-T286 PolarHBondContact N-O 2.79Å; D281-F331 HydrophobicContact CB-CD1 4.16Å; D281-F331 HydrophobicContact CB-CD2 3.86Å; D281-F331 HydrophobicContact CB-CE1 4.09Å; D281-F331 HydrophobicContact CB-CE2 3.82Å; D281-F331 HydrophobicContact CB-CG 4.03Å; D281-F331 HydrophobicContact CB-CZ 3.92Å; D281-F331 VanDerWaalsContact N-CE2 3.33Å; D281-S336 WeakPolarHBondContact OD2-CB 3.37Å
282	A	72.3	Confident	91.1	Very high	39 Å²	39	27.6 Å²	27.6	32%	0.322	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-28.9	-177.5	0	0	0	0	0	112.6	H285	A282-H285 PolarHBondContact O-CE1 2.63Å; A282-H285 VanDerWaalsContact O-CE1 3.23Å
283	N	77.1	Confident	91.2	Very high	129 Å²	129	23.8 Å²	23.8	69%	0.69	13%	0.134	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87	-49.5	-173.8	-65	-32.1	0	0	0	112.5	D281	D281-N283 PolarHBondContact O-N 3.04Å; D281-N283 PolarHBondContact OD1-N 2.86Å
284	S	79.1	Confident	91.1	Very high	34 Å²	34	29.5 Å²	29.5	24%	0.238	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.9	-11	-178.8	66.1	0	0	0	0	113.8	D281 T286	D281-S284 WeakPolarHBondContact CB-OG 3.36Å; D281-S284 WeakPolarHBondContact OD2-CB 3.36Å; D281-S284 PolarHBondContact OD2-N 2.92Å; D281-S284 PolarHBondContact OD2-OG 2.84Å; S284-T286 WeakPolarHBondContact CB-OG1 3.33Å; S284-T286 PolarHBondContact O-N 3.25Å; S284-T286 VanDerWaalsContact OG-CB 3.3Å; S284-T286 WeakPolarHBondContact OG-CB 3.48Å; S284-T286 PolarHBondContact OG-N 3.48Å; S284-T286 PolarHBondContact OG-OG1 2.87Å
285	H	86.8	Confident	91	Very high	36 Å²	36	30.1 Å²	30.1	17%	0.167	16%	0.162	C	C	.	.			trans	55.6	33.4	-171	-56.3	-55.7	0	0	0	112.7	S241 D281 A282 L311 R312	S241-H285 PolarHBondContact OG-CE1 3.12Å; S241-H285 PolarHBondContact OG-ND1 3.5Å; D281-H285 WeakPolarHBondContact O-CA 3.41Å; D281-H285 PolarHBondContact O-N 2.91Å; A282-H285 PolarHBondContact O-CE1 2.63Å; A282-H285 VanDerWaalsContact O-CE1 3.23Å; H285-L311 HydrophobicContact CB-CB 4.36Å; H285-L311 VanDerWaalsContact O-CB 3.32Å; H285-L311 WeakPolarHBondContact O-CB 3.5Å; H285-L311 WeakPolarHBondContact O-CG 3.43Å; H285-L311 PolarHBondContact O-N 3.05Å; H285-R312 HydrophobicContact CB-CG 3.96Å
286	T	91.7	Very high	90.4	Very high	26 Å²	26	33.3 Å²	33.3	16%	0.16	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	123.8	177.9	-54.9	0	0	0	0	109.1	V280 D281 S284 V288 V308 Y309 F331 W353	V280-T286 WeakPolarHBondContact CA-O 3.33Å; D281-T286 PolarHBondContact N-O 2.79Å; S284-T286 WeakPolarHBondContact CB-OG1 3.33Å; S284-T286 PolarHBondContact O-N 3.25Å; S284-T286 VanDerWaalsContact OG-CB 3.3Å; S284-T286 WeakPolarHBondContact OG-CB 3.48Å; S284-T286 PolarHBondContact OG-N 3.48Å; S284-T286 PolarHBondContact OG-OG1 2.87Å; T286-V288 HydrophobicContact CG2-CG2 4.29Å; T286-V308 HydrophobicContact CG2-CG1 3.44Å; T286-V308 VanDerWaalsContact CG2-CG1 3.44Å; T286-Y309 WeakPolarHBondContact CA-O 3.41Å; T286-F331 HydrophobicContact CG2-CZ 4.32Å; T286-W353 HydrophobicContact CG2-CZ2 4.46Å
287	L	95	Very high	89.7	Confident	0 Å²	0	39 Å²	39	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	130.8	170.4	168.1	71.4	0	0	0	108.8	V253 L268 M278 V280 T289 V308 Y309 L311	V253-L287 HydrophobicContact CB-CD2 4.37Å; V253-L287 HydrophobicContact CG1-CD2 3.89Å; V253-L287 HydrophobicContact CG2-CD2 4.35Å; L268-L287 HydrophobicContact CD1-CD2 4.08Å; M278-L287 HydrophobicContact CB-CD1 4.06Å; M278-L287 HydrophobicContact CG-CD1 4.42Å; M278-L287 HydrophobicContact SD-CD1 4.15Å; V280-L287 HydrophobicContact CG2-CB 4.34Å; V280-L287 HydrophobicContact CG2-CD1 3.61Å; L287-T289 HydrophobicContact CD1-CG2 4.13Å; L287-T289 HydrophobicContact CD2-CG2 4.16Å; L287-T289 HydrophobicContact CG-CG2 4Å; L287-V308 CarbonylContact O-C 2.85Å; L287-V308 WeakPolarHBondContact O-CA 3.39Å; L287-Y309 HydrophobicContact CD2-CD2 4.35Å; L287-Y309 PolarHBondContact N-O 2.89Å; L287-Y309 PolarHBondContact O-N 2.78Å; L287-L311 HydrophobicContact CB-CD1 4.13Å; L287-L311 HydrophobicContact CB-CD2 3.75Å; L287-L311 HydrophobicContact CB-CG 3.85Å; L287-L311 HydrophobicContact CD2-CD2 3.96Å; L287-L311 HydrophobicContact CG-CD2 4.47Å
288	V	95.8	Very high	88.8	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	133.3	170.7	-177.3	0	0	0	0	109.5	M278 T279 T286 L306 R307 V308 F331 L339 W353	M278-V288 CarbonylContact C-O 3.53Å; M278-V288 VanDerWaalsContact CA-O 3.25Å; M278-V288 WeakPolarHBondContact CA-O 3.45Å; M278-V288 WeakPolarHBondContact CB-O 3.31Å; T279-V288 HydrophobicContact CG2-CB 4.25Å; T279-V288 PolarHBondContact N-O 2.86Å; T279-V288 PolarHBondContact O-N 2.93Å; T286-V288 HydrophobicContact CG2-CG2 4.29Å; V288-L306 HydrophobicContact CG1-CB 3.84Å; V288-L306 HydrophobicContact CG1-CD1 4.29Å; V288-R307 CarbonylContact C-O 3.58Å; V288-R307 VanDerWaalsContact CA-O 3.26Å; V288-R307 WeakPolarHBondContact CA-O 3.35Å; V288-V308 HydrophobicContact CG2-CG1 4.41Å; V288-V308 HydrophobicContact CG2-CG2 4.24Å; V288-F331 HydrophobicContact CB-CE2 4.42Å; V288-F331 HydrophobicContact CB-CZ 4.47Å; V288-F331 HydrophobicContact CG2-CE2 3.96Å; V288-F331 HydrophobicContact CG2-CZ 3.56Å; V288-L339 HydrophobicContact CG1-CD2 3.86Å; V288-W353 HydrophobicContact CG2-CH2 3.96Å; V288-W353 HydrophobicContact CG2-CZ2 4.09Å
289	T	97.2	Very high	88.5	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	143.3	179.1	69.6	0	0	0	0	111.3	V253 A270 H271 M278 L287 L306 R307	V253-T289 HydrophobicContact CG2-CG2 3.88Å; A270-T289 HydrophobicContact CB-CG2 4.29Å; H271-T289 PolarHBondContact NE2-OG1 3.45Å; M278-T289 HydrophobicContact CB-CG2 3.92Å; L287-T289 HydrophobicContact CD1-CG2 4.13Å; L287-T289 HydrophobicContact CD2-CG2 4.16Å; L287-T289 HydrophobicContact CG-CG2 4Å; T289-L306 WeakPolarHBondContact O-CA 3.43Å; T289-R307 PolarHBondContact N-O 3.05Å; T289-R307 PolarHBondContact O-N 2.61Å; T289-R307 WeakPolarHBondContact OG1-CB 3.4Å
290	C	96.1	Very high	88.4	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	157.9	162.6	55.9	0	0	0	0	109.9	S276 D277 L306 P326 C327 V329	S276-C290 PolarHBondContact N-O 2.79Å; S276-C290 VanDerWaalsContact OG-C 3.29Å; S276-C290 PolarHBondContact OG-O 2.85Å; S276-C290 PolarHBondContact OG-SG 2.87Å; D277-C290 PolarHBondContact O-N 2.77Å; D277-C290 PolarHBondContact O-SG 2.84Å; C290-L306 HydrophobicContact CB-CD2 3.56Å; C290-P326 HydrophobicContact CB-CB 4.2Å; C290-P326 HydrophobicContact CB-CG 4.18Å; C290-C327 PolarHBondContact SG-O 3.46Å; C290-V329 HydrophobicContact CB-CG1 4.15Å
291	G	95.3	Very high	88.4	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	173.3	-156.3	-176.4	0	0	0	0	0	112.4	E274 S276 D303	E274-G291 CarbonylContact O-C 3.58Å; E274-G291 WeakPolarHBondContact O-CA 3.45Å; S276-G291 PolarHBondContact OG-N 2.79Å; G291-D303 WeakPolarHBondContact O-CB 3.46Å; G291-D303 PolarHBondContact O-N 3.07Å
292	W	94.9	Very high	88.7	Confident	60 Å²	60	55.1 Å²	55.1	23%	0.227	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	144.6	-169.9	-57.1	77.8	0	0	0	110.9	H271 G273 E274 L300 R301 V302	H271-W292 WeakPolarHBondContact CB-O 3.22Å; G273-W292 CarbonylContact C-O 3.53Å; G273-W292 WeakPolarHBondContact CA-O 3.25Å; G273-W292 PolarHBondContact N-O 3.03Å; E274-W292 PolarHBondContact O-N 3.42Å; W292-L300 HydrophobicContact CB-CB 4.37Å; W292-L300 HydrophobicContact CB-CD2 4.27Å; W292-L300 HydrophobicContact CD2-CB 4.49Å; W292-L300 HydrophobicContact CE3-CB 3.87Å; W292-R301 CarbonylContact C-O 3.54Å; W292-R301 VanDerWaalsContact CA-O 3.23Å; W292-R301 WeakPolarHBondContact CA-O 3.43Å; W292-V302 HydrophobicContact CD2-CG2 4.02Å; W292-V302 HydrophobicContact CE3-CB 4.41Å; W292-V302 HydrophobicContact CE3-CG2 3.6Å; W292-V302 HydrophobicContact CH2-CG2 3.4Å; W292-V302 HydrophobicContact CZ2-CG2 3.82Å; W292-V302 HydrophobicContact CZ3-CB 4.47Å; W292-V302 HydrophobicContact CZ3-CG2 3.28Å
293	S	93.2	Very high	89.6	Confident	12 Å²	12	53.6 Å²	53.6	8%	0.084	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	139.8	165	-82.6	0	0	0	0	110.6	T272 L300 R301 D303	T272-S293 VanDerWaalsContact OG1-CA 3.31Å; T272-S293 WeakPolarHBondContact OG1-CA 3.4Å; S293-L300 WeakPolarHBondContact O-CA 3.48Å; S293-R301 PolarHBondContact N-O 2.87Å; S293-R301 PolarHBondContact O-N 3.39Å; S293-D303 WeakPolarHBondContact CB-OD1 2.96Å; S293-D303 PolarHBondContact N-OD1 3.2Å; S293-D303 VanDerWaalsContact OG-CG 3.28Å; S293-D303 PolarHBondContact OG-OD1 3.49Å; S293-D303 PolarHBondContact OG-OD2 2.8Å
294	R	90.7	Very high	90.4	Very high	125 Å²	125	53.3 Å²	53.3	47%	0.472	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	128.7	172.1	-153.7	169.4	-172.7	84.4	-9.3	111	T272 D297 G299 L300	T272-R294 PolarHBondContact OG1-N 3.12Å; R294-D297 PolarHBondContact NE-O 3.42Å; R294-D297 PolarHBondContact NH2-O 3.27Å; R294-G299 CarbonylContact C-O 3.51Å; R294-G299 WeakPolarHBondContact CA-O 3.11Å; R294-G299 WeakPolarHBondContact CG-O 3.4Å; R294-L300 HydrophobicContact CB-CD2 4.33Å; R294-L300 HydrophobicContact CG-CD2 4.26Å
295	V	89.1	Confident	91.1	Very high	83 Å²	83	56 Å²	56	50%	0.503	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	107.3	175.2	-176.6	0	0	0	0	107.9	G299 R301	V295-G299 PolarHBondContact N-O 3.44Å; V295-G299 WeakPolarHBondContact O-CA 3.17Å; V295-G299 PolarHBondContact O-N 3.34Å; V295-R301 HydrophobicContact CG2-CB 3.96Å; V295-R301 HydrophobicContact CG2-CG 3.66Å
296	G	84.9	Confident	91.5	Very high	67 Å²	67	54.2 Å²	54.2	69%	0.691	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	68	-149.9	-172.8	0	0	0	0	0	112.3
297	D	79.7	Confident	91.7	Very high	151 Å²	151	56 Å²	56	81%	0.807	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.2	-27.4	-170.6	-163.1	38.4	0	0	0	114.1	R294	R294-D297 PolarHBondContact NE-O 3.42Å; R294-D297 PolarHBondContact NH2-O 3.27Å
298	S	78	Confident	91.8	Very high	104 Å²	104	56.2 Å²	56.2	73%	0.727	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-133.3	-11.5	-177.5	64.8	0	0	0	0	115.6
299	G	88.4	Confident	91.7	Very high	29 Å²	29	57.1 Å²	57.1	30%	0.299	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	139.5	-178.2	0	0	0	0	0	111.9	R294 V295	R294-G299 CarbonylContact C-O 3.51Å; R294-G299 WeakPolarHBondContact CA-O 3.11Å; R294-G299 WeakPolarHBondContact CG-O 3.4Å; V295-G299 PolarHBondContact N-O 3.44Å; V295-G299 WeakPolarHBondContact O-CA 3.17Å; V295-G299 PolarHBondContact O-N 3.34Å
300	L	90.6	Very high	91.6	Very high	80 Å²	80	58.3 Å²	58.3	42%	0.419	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	139.4	167	-66.3	174.9	0	0	0	108.9	W292 S293 R294	W292-L300 HydrophobicContact CB-CB 4.37Å; W292-L300 HydrophobicContact CB-CD2 4.27Å; W292-L300 HydrophobicContact CD2-CB 4.49Å; W292-L300 HydrophobicContact CE3-CB 3.87Å; S293-L300 WeakPolarHBondContact O-CA 3.48Å; R294-L300 HydrophobicContact CB-CD2 4.33Å; R294-L300 HydrophobicContact CG-CD2 4.26Å
301	R	93.4	Very high	91.3	Very high	153 Å²	153	58.8 Å²	58.8	58%	0.577	31%	0.309	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.1	145.2	168.5	72.4	174.1	-176.3	152.2	3.5	109	W292 S293 V295	W292-R301 CarbonylContact C-O 3.54Å; W292-R301 VanDerWaalsContact CA-O 3.23Å; W292-R301 WeakPolarHBondContact CA-O 3.43Å; S293-R301 PolarHBondContact N-O 2.87Å; S293-R301 PolarHBondContact O-N 3.39Å; V295-R301 HydrophobicContact CG2-CB 3.96Å; V295-R301 HydrophobicContact CG2-CG 3.66Å
302	V	93	Very high	90.9	Very high	29 Å²	29	67 Å²	67	18%	0.176	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	137.7	173.9	-176.4	0	0	0	0	109.7	W292 R304 D325	W292-V302 HydrophobicContact CD2-CG2 4.02Å; W292-V302 HydrophobicContact CE3-CB 4.41Å; W292-V302 HydrophobicContact CE3-CG2 3.6Å; W292-V302 HydrophobicContact CH2-CG2 3.4Å; W292-V302 HydrophobicContact CZ2-CG2 3.82Å; W292-V302 HydrophobicContact CZ3-CB 4.47Å; W292-V302 HydrophobicContact CZ3-CG2 3.28Å; V302-R304 PolarHBondContact O-N 3.03Å; V302-D325 HydrophobicContact CB-CB 4.1Å; V302-D325 HydrophobicContact CG1-CB 3.92Å; V302-D325 HydrophobicContact CG2-CB 4.39Å
303	D	92.9	Very high	90.7	Very high	7 Å²	7	66.5 Å²	66.5	4%	0.037	35%	0.346	C	S	.	.			trans	-81.1	114.8	173	-83	-2.7	0	0	0	110.7	H271 G291 S293 L305 R307 P326	H271-D303 IonicContact CE1-OD2 2.86Å; H271-D303 IonicContact CG-OD2 2.63Å; H271-D303 IonicContact ND1-OD2 3.63Å; H271-D303 PolarHBondContact ND1-OD2 2.87Å; G291-D303 WeakPolarHBondContact O-CB 3.46Å; G291-D303 PolarHBondContact O-N 3.07Å; S293-D303 WeakPolarHBondContact CB-OD1 2.96Å; S293-D303 PolarHBondContact N-OD1 3.2Å; S293-D303 VanDerWaalsContact OG-CG 3.28Å; S293-D303 PolarHBondContact OG-OD1 3.49Å; S293-D303 PolarHBondContact OG-OD2 2.8Å; D303-L305 PolarHBondContact O-N 3.42Å; D303-R307 IonicContact OD2-CZ 3.35Å; D303-R307 IonicContact OD2-NH2 3.8Å; D303-R307 PolarHBondContact OD2-NH2 2.75Å; D303-P326 WeakPolarHBondContact O-CD 3.44Å; D303-P326 VanDerWaalsContact O-CG 3.31Å; D303-P326 WeakPolarHBondContact O-CG 3.31Å
304	R	93.5	Very high	90.3	Very high	123 Å²	123	66.7 Å²	66.7	46%	0.464	35%	0.349	S	S	.	.	S	Bend	trans	-80.2	9	169.9	-61.1	-177.2	61.1	156.7	-2.9	113.7	V302 S322 S323 D325	V302-R304 PolarHBondContact O-N 3.03Å; R304-S322 WeakPolarHBondContact CA-OG 3.38Å; R304-S322 PolarHBondContact NE-O 3.04Å; R304-S322 PolarHBondContact NH2-O 3.17Å; R304-S322 PolarHBondContact O-N 3.32Å; R304-S322 PolarHBondContact O-OG 3.21Å; R304-S323 VanDerWaalsContact NH2-CA 3.32Å; R304-S323 PolarHBondContact NH2-O 2.95Å; R304-D325 VanDerWaalsContact CD-OD1 3.28Å; R304-D325 WeakPolarHBondContact CD-OD1 3.4Å; R304-D325 VanDerWaalsContact CG-OD1 3.31Å; R304-D325 WeakPolarHBondContact CG-OD1 3.48Å
305	L	93.7	Very high	90.4	Very high	90 Å²	90	69.3 Å²	69.3	47%	0.471	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	110.4	174.2	-66.5	176.3	0	0	0	108.2	D303 P319 L320	D303-L305 PolarHBondContact O-N 3.42Å; L305-P319 HydrophobicContact CB-CB 4.41Å; L305-L320 CarbonylContact C-O 3.56Å; L305-L320 WeakPolarHBondContact CA-O 3.46Å
306	L	95.2	Very high	90.6	Very high	0 Å²	0	68.7 Å²	68.7	0%	0	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	126.8	173.2	-55.6	176.9	0	0	0	108.8	V288 T289 C290 P319 L320 P326 V329 L339 A341 I351	V288-L306 HydrophobicContact CG1-CB 3.84Å; V288-L306 HydrophobicContact CG1-CD1 4.29Å; T289-L306 WeakPolarHBondContact O-CA 3.43Å; C290-L306 HydrophobicContact CB-CD2 3.56Å; L306-P319 VanDerWaalsContact O-CA 3.29Å; L306-P319 WeakPolarHBondContact O-CA 3.43Å; L306-P319 WeakPolarHBondContact O-CB 2.94Å; L306-L320 HydrophobicContact CB-CB 4.21Å; L306-L320 HydrophobicContact CD1-CB 4.46Å; L306-L320 PolarHBondContact N-O 3.47Å; L306-L320 PolarHBondContact O-N 2.9Å; L306-P326 HydrophobicContact CD2-CB 3.88Å; L306-P326 HydrophobicContact CD2-CG 3.59Å; L306-V329 HydrophobicContact CD1-CG1 4.3Å; L306-V329 HydrophobicContact CD2-CG1 3.96Å; L306-L339 HydrophobicContact CD1-CD2 3.54Å; L306-A341 HydrophobicContact CD1-CB 4.4Å; L306-I351 HydrophobicContact CD1-CD1 3.83Å
307	R	96.2	Very high	91	Very high	64 Å²	64	69.9 Å²	69.9	24%	0.242	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	138	178.5	-50.2	-61.7	171.3	85.5	10.9	109.2	A270 V288 T289 D303 Y309	A270-R307 WeakPolarHBondContact O-CG 3.41Å; A270-R307 PolarHBondContact O-NH1 2.85Å; V288-R307 CarbonylContact C-O 3.58Å; V288-R307 VanDerWaalsContact CA-O 3.26Å; V288-R307 WeakPolarHBondContact CA-O 3.35Å; T289-R307 PolarHBondContact N-O 3.05Å; T289-R307 PolarHBondContact O-N 2.61Å; T289-R307 WeakPolarHBondContact OG1-CB 3.4Å; D303-R307 IonicContact OD2-CZ 3.35Å; D303-R307 IonicContact OD2-NH2 3.8Å; D303-R307 PolarHBondContact OD2-NH2 2.75Å; R307-Y309 HydrophobicContact CB-CD2 4.33Å; R307-Y309 HydrophobicContact CB-CE2 3.62Å
308	V	95.6	Very high	91.7	Very high	4 Å²	4	68.5 Å²	68.5	2%	0.024	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	132.1	-177.7	-173.2	0	0	0	0	108.4	T286 L287 V288 Q317 L320 W353	T286-V308 HydrophobicContact CG2-CG1 3.44Å; T286-V308 VanDerWaalsContact CG2-CG1 3.44Å; L287-V308 CarbonylContact O-C 2.85Å; L287-V308 WeakPolarHBondContact O-CA 3.39Å; V288-V308 HydrophobicContact CG2-CG1 4.41Å; V288-V308 HydrophobicContact CG2-CG2 4.24Å; V308-Q317 HydrophobicContact CB-CB 4.07Å; V308-Q317 HydrophobicContact CG1-CB 3.97Å; V308-Q317 HydrophobicContact CG1-CG 4.4Å; V308-Q317 PolarHBondContact O-N 2.87Å; V308-L320 HydrophobicContact CG2-CD1 4.33Å; V308-L320 HydrophobicContact CG2-CG 3.96Å; V308-W353 HydrophobicContact CG1-CZ2 4.37Å; V308-W353 HydrophobicContact CG2-CZ2 4.49Å
309	Y	95.4	Very high	92.3	Very high	19 Å²	19	66.4 Å²	66.4	8%	0.075	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	138.3	179.7	-66.5	-87.7	0	0	0	110.4	L268 D269 A270 T286 L287 R307 R315 A316	L268-Y309 HydrophobicContact CB-CE1 4.36Å; L268-Y309 HydrophobicContact CD1-CD1 4.05Å; L268-Y309 HydrophobicContact CD1-CD2 4.5Å; L268-Y309 HydrophobicContact CD1-CG 4.02Å; L268-Y309 HydrophobicContact CD2-CD1 4.25Å; L268-Y309 HydrophobicContact CD2-CE1 4.44Å; D269-Y309 PolarHBondContact O-OH 3.14Å; A270-Y309 WeakPolarHBondContact CA-OH 3.18Å; A270-Y309 HydrophobicContact CB-CE2 4.14Å; T286-Y309 WeakPolarHBondContact CA-O 3.41Å; L287-Y309 HydrophobicContact CD2-CD2 4.35Å; L287-Y309 PolarHBondContact N-O 2.89Å; L287-Y309 PolarHBondContact O-N 2.78Å; R307-Y309 HydrophobicContact CB-CD2 4.33Å; R307-Y309 HydrophobicContact CB-CE2 3.62Å; Y309-R315 WeakPolarHBondContact CA-O 3.35Å; Y309-A316 HydrophobicContact CD1-CB 3.99Å; Y309-A316 HydrophobicContact CE1-CB 3.64Å
310	D	93.1	Very high	92.5	Very high	25 Å²	25	66.1 Å²	66.1	13%	0.134	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	112.4	164.8	-179.9	-33.2	0	0	0	108	R312 S313 G314 R315 Q317	D310-R312 VanDerWaalsContact C-N 3.27Å; D310-R312 PolarHBondContact O-N 2.9Å; D310-R312 WeakPolarHBondContact OD1-CA 3.42Å; D310-R312 VanDerWaalsContact OD1-CB 3.25Å; D310-R312 WeakPolarHBondContact OD1-CB 3.45Å; D310-R312 PolarHBondContact OD1-N 2.87Å; D310-R312 IonicContact OD1-NE 3.99Å; D310-R312 PolarHBondContact OD1-NE 3.42Å; D310-R312 IonicContact OD1-NH2 3.63Å; D310-R312 IonicContact OD2-CZ 3.99Å; D310-R312 IonicContact OD2-NE 2.87Å; D310-R312 PolarHBondContact OD2-NE 2.92Å; D310-R312 IonicContact OD2-NH2 2.62Å; D310-R312 PolarHBondContact OD2-NH2 2.91Å; D310-S313 PolarHBondContact O-N 2.99Å; D310-S313 PolarHBondContact OD1-N 3.03Å; D310-G314 VanDerWaalsContact O-CA 3.29Å; D310-G314 WeakPolarHBondContact O-CA 3.3Å; D310-G314 PolarHBondContact O-N 3.43Å; D310-R315 PolarHBondContact N-O 2.83Å; D310-R315 PolarHBondContact O-N 3.14Å; D310-Q317 HydrophobicContact CB-CG 4.47Å
311	L	90.3	Very high	92.6	Very high	10 Å²	10	66.5 Å²	66.5	5%	0.052	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-27.3	-175.5	-68.5	175.1	0	0	0	113.2	F240 I255 R266 V280 H285 L287	F240-L311 HydrophobicContact CB-CD1 4.36Å; F240-L311 HydrophobicContact CD1-CD1 4.14Å; F240-L311 HydrophobicContact CD2-CD1 3.9Å; F240-L311 HydrophobicContact CE1-CD1 4.43Å; F240-L311 HydrophobicContact CE2-CB 4.3Å; F240-L311 HydrophobicContact CE2-CD1 4.2Å; F240-L311 HydrophobicContact CG-CD1 3.88Å; F240-L311 HydrophobicContact CZ-CD1 4.47Å; I255-L311 HydrophobicContact CD1-CD2 3.68Å; R266-L311 PolarHBondContact NH1-O 3.44Å; V280-L311 HydrophobicContact CG1-CD1 3.68Å; V280-L311 HydrophobicContact CG2-CD1 4.24Å; H285-L311 HydrophobicContact CB-CB 4.36Å; H285-L311 VanDerWaalsContact O-CB 3.32Å; H285-L311 WeakPolarHBondContact O-CB 3.5Å; H285-L311 WeakPolarHBondContact O-CG 3.43Å; H285-L311 PolarHBondContact O-N 3.05Å; L287-L311 HydrophobicContact CB-CD1 4.13Å; L287-L311 HydrophobicContact CB-CD2 3.75Å; L287-L311 HydrophobicContact CB-CG 3.85Å; L287-L311 HydrophobicContact CD2-CD2 3.96Å; L287-L311 HydrophobicContact CG-CD2 4.47Å
312	R	87.8	Confident	92.5	Very high	171 Å²	171	59.5 Å²	59.5	65%	0.645	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.8	-48.1	178.8	-56.9	171.2	-68.8	-171.3	1.9	110.4	H285 D310	H285-R312 HydrophobicContact CB-CG 3.96Å; D310-R312 VanDerWaalsContact C-N 3.27Å; D310-R312 PolarHBondContact O-N 2.9Å; D310-R312 WeakPolarHBondContact OD1-CA 3.42Å; D310-R312 VanDerWaalsContact OD1-CB 3.25Å; D310-R312 WeakPolarHBondContact OD1-CB 3.45Å; D310-R312 PolarHBondContact OD1-N 2.87Å; D310-R312 IonicContact OD1-NE 3.99Å; D310-R312 PolarHBondContact OD1-NE 3.42Å; D310-R312 IonicContact OD1-NH2 3.63Å; D310-R312 IonicContact OD2-CZ 3.99Å; D310-R312 IonicContact OD2-NE 2.87Å; D310-R312 PolarHBondContact OD2-NE 2.92Å; D310-R312 IonicContact OD2-NH2 2.62Å; D310-R312 PolarHBondContact OD2-NH2 2.91Å
313	S	89.3	Confident	92.4	Very high	51 Å²	51	60.9 Å²	60.9	36%	0.357	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.5	-22.5	-179.4	69.3	0	0	0	0	113.4	D310 R315	D310-S313 PolarHBondContact O-N 2.99Å; D310-S313 PolarHBondContact OD1-N 3.03Å; S313-R315 WeakPolarHBondContact OG-CB 3.3Å; S313-R315 PolarHBondContact OG-N 2.83Å
314	G	86.5	Confident	92.3	Very high	16 Å²	16	61.1 Å²	61.1	17%	0.165	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	71.2	16.7	-171.1	0	0	0	0	0	114.1	R266 D310	R266-G314 VanDerWaalsContact NH1-N 3.15Å; D310-G314 VanDerWaalsContact O-CA 3.29Å; D310-G314 WeakPolarHBondContact O-CA 3.3Å; D310-G314 PolarHBondContact O-N 3.43Å
315	R	92.2	Very high	92.4	Very high	180 Å²	180	58.8 Å²	58.8	68%	0.679	32%	0.315	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.5	136	-175.2	-65.5	-177.6	174.8	-174.2	-1.6	110.6	Y309 D310 S313	Y309-R315 WeakPolarHBondContact CA-O 3.35Å; D310-R315 PolarHBondContact N-O 2.83Å; D310-R315 PolarHBondContact O-N 3.14Å; S313-R315 WeakPolarHBondContact OG-CB 3.3Å; S313-R315 PolarHBondContact OG-N 2.83Å
316	A	93.8	Very high	92.5	Very high	69 Å²	69	54.5 Å²	54.5	57%	0.57	29%	0.293	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-61.5	135.5	166.4	0	0	0	0	0	109.8	Y309	Y309-A316 HydrophobicContact CD1-CB 3.99Å; Y309-A316 HydrophobicContact CE1-CB 3.64Å
317	Q	93.2	Very high	92.4	Very high	93 Å²	93	54.7 Å²	54.7	44%	0.435	29%	0.294	S	S	.	.			trans	-103.8	177.7	172.8	-58.5	-59.9	-37.4	0	0	109.4	V308 D310 P319	V308-Q317 HydrophobicContact CB-CB 4.07Å; V308-Q317 HydrophobicContact CG1-CB 3.97Å; V308-Q317 HydrophobicContact CG1-CG 4.4Å; V308-Q317 PolarHBondContact O-N 2.87Å; D310-Q317 HydrophobicContact CB-CG 4.47Å; Q317-P319 WeakPolarHBondContact O-CD 3.41Å
318	V	92.5	Very high	92.4	Very high	122 Å²	122	53.3 Å²	53.3	74%	0.739	29%	0.29	S	S	*	.	P	Polyproline II helix	trans	-60.1	123.8	175.2	179.6	0	0	0	0	109.3
319	P	92.5	Very high	92.4	Very high	60 Å²	60	53.1 Å²	53.1	39%	0.39	29%	0.289	S	S	.	.	P	Polyproline II helix	trans	-62.8	152.4	177.6	-23.2	34.5	0	0	0	112.7	L305 L306 Q317	L305-P319 HydrophobicContact CB-CB 4.41Å; L306-P319 VanDerWaalsContact O-CA 3.29Å; L306-P319 WeakPolarHBondContact O-CA 3.43Å; L306-P319 WeakPolarHBondContact O-CB 2.94Å; Q317-P319 WeakPolarHBondContact O-CD 3.41Å
320	L	91.9	Very high	92.3	Very high	23 Å²	23	53.8 Å²	53.8	12%	0.12	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	138.7	171.8	-60.5	173.7	0	0	0	110.5	L305 L306 V308 I351 W353	L305-L320 CarbonylContact C-O 3.56Å; L305-L320 WeakPolarHBondContact CA-O 3.46Å; L306-L320 HydrophobicContact CB-CB 4.21Å; L306-L320 HydrophobicContact CD1-CB 4.46Å; L306-L320 PolarHBondContact N-O 3.47Å; L306-L320 PolarHBondContact O-N 2.9Å; V308-L320 HydrophobicContact CG2-CD1 4.33Å; V308-L320 HydrophobicContact CG2-CG 3.96Å; L320-I351 HydrophobicContact CB-CG2 4.38Å; L320-I351 HydrophobicContact CD1-CG2 4.08Å; L320-W353 HydrophobicContact CD1-CD2 4.13Å; L320-W353 HydrophobicContact CD1-CE3 4.13Å; L320-W353 HydrophobicContact CD1-CH2 3.65Å; L320-W353 HydrophobicContact CD1-CZ2 3.56Å; L320-W353 HydrophobicContact CD1-CZ3 3.94Å; L320-W353 HydrophobicContact CD2-CD2 4.28Å; L320-W353 HydrophobicContact CD2-CG 4.42Å; L320-W353 HydrophobicContact CG-CZ2 4.39Å
321	S	91.9	Very high	92.3	Very high	87 Å²	87	53.6 Å²	53.6	61%	0.608	29%	0.289	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.1	127.9	176.2	55.5	0	0	0	0	111.9
322	S	91.4	Very high	92.4	Very high	7 Å²	7	54.1 Å²	54.1	5%	0.049	29%	0.292	C	S	.	.	P	Polyproline II helix	trans	-99.6	143	173.1	64.9	0	0	0	0	112.5	R304 L324 P326	R304-S322 WeakPolarHBondContact CA-OG 3.38Å; R304-S322 PolarHBondContact NE-O 3.04Å; R304-S322 PolarHBondContact NH2-O 3.17Å; R304-S322 PolarHBondContact O-N 3.32Å; R304-S322 PolarHBondContact O-OG 3.21Å; S322-L324 VanDerWaalsContact C-N 3.3Å; S322-L324 PolarHBondContact OG-O 2.98Å; S322-P326 WeakPolarHBondContact OG-CD 3.26Å
323	S	90.7	Very high	92.3	Very high	58 Å²	58	48.4 Å²	48.4	41%	0.406	28%	0.277	S	S	.	.	S	Bend	trans	-82	-10.2	174.5	-60.3	0	0	0	0	112.9	R304 Q349	R304-S323 VanDerWaalsContact NH2-CA 3.32Å; R304-S323 PolarHBondContact NH2-O 2.95Å; S323-Q349 PolarHBondContact OG-NE2 3.22Å
324	L	91.9	Very high	91.9	Very high	12 Å²	12	49.7 Å²	49.7	6%	0.063	30%	0.298	C	S	.	.	S	Bend	trans	-117.8	177.6	173.6	58.1	75.4	0	0	0	111.3	S322 P326 A347 Q349 L363	S322-L324 VanDerWaalsContact C-N 3.3Å; S322-L324 PolarHBondContact OG-O 2.98Å; L324-P326 VanDerWaalsContact CD1-CA 3.5Å; L324-P326 HydrophobicContact CD1-CB 3.8Å; L324-P326 VanDerWaalsContact O-CD 3.26Å; L324-P326 WeakPolarHBondContact O-CD 3.36Å; L324-A347 HydrophobicContact CB-CB 4.36Å; L324-A347 HydrophobicContact CD2-CB 4Å; L324-A347 WeakPolarHBondContact CD2-O 3.41Å; L324-Q349 HydrophobicContact CD2-CB 3.68Å; L324-Q349 HydrophobicContact CG-CB 4.23Å; L324-L363 HydrophobicContact CD2-CD1 4.37Å
325	D	94.8	Very high	91.7	Very high	73 Å²	73	51.5 Å²	51.5	39%	0.39	31%	0.307	S	S	.	.			trans	-90.7	98.3	171.7	-64.8	-25.9	0	0	0	109.1	V302 R304 S343	V302-D325 HydrophobicContact CB-CB 4.1Å; V302-D325 HydrophobicContact CG1-CB 3.92Å; V302-D325 HydrophobicContact CG2-CB 4.39Å; R304-D325 VanDerWaalsContact CD-OD1 3.28Å; R304-D325 WeakPolarHBondContact CD-OD1 3.4Å; R304-D325 VanDerWaalsContact CG-OD1 3.31Å; R304-D325 WeakPolarHBondContact CG-OD1 3.48Å; D325-S343 VanDerWaalsContact O-CA 3.28Å; D325-S343 WeakPolarHBondContact O-CA 3.41Å; D325-S343 VanDerWaalsContact O-CB 3.29Å; D325-S343 WeakPolarHBondContact O-CB 3.36Å; D325-S343 PolarHBondContact O-OG 2.85Å
326	P	95.6	Very high	91.2	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	29%	0.294	C	S	.	.			trans	-79.8	130.1	-167.8	32	-33.5	0	0	0	111.1	C290 D303 L306 S322 L324 A341	C290-P326 HydrophobicContact CB-CB 4.2Å; C290-P326 HydrophobicContact CB-CG 4.18Å; D303-P326 WeakPolarHBondContact O-CD 3.44Å; D303-P326 VanDerWaalsContact O-CG 3.31Å; D303-P326 WeakPolarHBondContact O-CG 3.31Å; L306-P326 HydrophobicContact CD2-CB 3.88Å; L306-P326 HydrophobicContact CD2-CG 3.59Å; S322-P326 WeakPolarHBondContact OG-CD 3.26Å; L324-P326 VanDerWaalsContact CD1-CA 3.5Å; L324-P326 HydrophobicContact CD1-CB 3.8Å; L324-P326 VanDerWaalsContact O-CD 3.26Å; L324-P326 WeakPolarHBondContact O-CD 3.36Å; P326-A341 HydrophobicContact CB-CB 4.33Å
327	C	94.5	Very high	91	Very high	4 Å²	4	45.3 Å²	45.3	3%	0.027	28%	0.282	C	S	.	.			trans	-114.6	-33.8	173.9	-63.8	0	0	0	0	112.3	S276 D277 C290 T342 Q344	S276-C327 WeakPolarHBondContact CB-O 3.47Å; S276-C327 PolarHBondContact OG-O 3.13Å; D277-C327 VanDerWaalsContact CB-O 3.31Å; D277-C327 WeakPolarHBondContact CB-O 3.36Å; C290-C327 PolarHBondContact SG-O 3.46Å; C327-T342 PolarHBondContact N-O 2.59Å; C327-Q344 HydrophobicContact CB-CG 3.94Å; C327-Q344 VanDerWaalsContact SG-CG 3.52Å
328	F	96	Very high	90.8	Very high	36 Å²	36	41.4 Å²	41.4	16%	0.158	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	144.5	177	-54.7	-74.4	0	0	0	110.7	D277 A341 T342 L373 V374	D277-F328 HydrophobicContact CB-CD1 4.39Å; F328-A341 CarbonylContact O-C 3.54Å; F328-A341 WeakPolarHBondContact O-CA 3.37Å; F328-T342 PolarHBondContact N-O 2.82Å; F328-T342 PolarHBondContact O-N 2.93Å; F328-L373 HydrophobicContact CD2-CD2 3.8Å; F328-L373 HydrophobicContact CD2-CG 4.35Å; F328-L373 HydrophobicContact CE2-CD2 4Å; F328-L373 HydrophobicContact CE2-CG 4.09Å; F328-V374 WeakPolarHBondContact CE1-O 3.4Å; F328-V374 VanDerWaalsContact CZ-C 3.48Å; F328-V374 WeakPolarHBondContact CZ-O 2.95Å
329	V	95.5	Very high	90.9	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	136.4	178	-71.6	0	0	0	0	111.1	D277 T279 C290 L306 L339 L340 A341	D277-V329 HydrophobicContact CB-CG2 4.28Å; D277-V329 PolarHBondContact OD2-N 3.34Å; D277-V329 VanDerWaalsContact OD2-N 3.12Å; T279-V329 WeakPolarHBondContact CB-O 3.4Å; T279-V329 HydrophobicContact CG2-CB 4.08Å; T279-V329 HydrophobicContact CG2-CG2 3.9Å; C290-V329 HydrophobicContact CB-CG1 4.15Å; L306-V329 HydrophobicContact CD1-CG1 4.3Å; L306-V329 HydrophobicContact CD2-CG1 3.96Å; V329-L339 HydrophobicContact CB-CD1 4.3Å; V329-L339 HydrophobicContact CB-CD2 4.47Å; V329-L339 HydrophobicContact CG1-CD2 4.3Å; V329-L340 WeakPolarHBondContact CA-O 2.96Å; V329-A341 HydrophobicContact CG1-CB 4.2Å
330	R	93.5	Very high	91	Very high	33 Å²	33	32.8 Å²	32.8	13%	0.125	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	127.6	178.1	-71.9	-70.2	-170.7	-78.1	-3.8	110.2	R238 D277 L339 L340 T376 D377	R238-R330 VanDerWaalsContact NH2-CZ 3.29Å; D277-R330 IonicContact OD1-NH1 3.95Å; D277-R330 IonicContact OD2-NH1 3.91Å; D277-R330 PolarHBondContact OD2-NH1 2.8Å; R330-L339 VanDerWaalsContact C-CD1 3.41Å; R330-L339 WeakPolarHBondContact O-CD1 3.44Å; R330-L340 PolarHBondContact N-O 2.84Å; R330-L340 PolarHBondContact O-N 2.92Å; R330-T376 PolarHBondContact NH2-O 2.83Å; R330-T376 VanDerWaalsContact NH2-O 3.16Å; R330-D377 IonicContact NE-OD1 2.9Å; R330-D377 PolarHBondContact NE-OD1 3.2Å
331	F	93.1	Very high	91.2	Very high	20 Å²	20	31.7 Å²	31.7	9%	0.088	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.2	140.5	167.9	-82.8	-75.5	0	0	0	110.4	T279 D281 T286 V288 P333 L339 W353 L378	T279-F331 HydrophobicContact CG2-CD2 3.45Å; T279-F331 VanDerWaalsContact CG2-CD2 3.45Å; T279-F331 HydrophobicContact CG2-CE2 3.72Å; T279-F331 HydrophobicContact CG2-CG 4.3Å; T279-F331 PolarHBondContact OG1-N 2.82Å; D281-F331 HydrophobicContact CB-CD1 4.16Å; D281-F331 HydrophobicContact CB-CD2 3.86Å; D281-F331 HydrophobicContact CB-CE1 4.09Å; D281-F331 HydrophobicContact CB-CE2 3.82Å; D281-F331 HydrophobicContact CB-CG 4.03Å; D281-F331 HydrophobicContact CB-CZ 3.92Å; D281-F331 VanDerWaalsContact N-CE2 3.33Å; T286-F331 HydrophobicContact CG2-CZ 4.32Å; V288-F331 HydrophobicContact CB-CE2 4.42Å; V288-F331 HydrophobicContact CB-CZ 4.47Å; V288-F331 HydrophobicContact CG2-CE2 3.96Å; V288-F331 HydrophobicContact CG2-CZ 3.56Å; F331-P333 WeakPolarHBondContact O-CD 3.15Å; F331-L339 HydrophobicContact CD1-CD1 4.14Å; F331-L339 HydrophobicContact CD2-CD1 4.27Å; F331-L339 HydrophobicContact CE1-CD1 4.41Å; F331-L339 HydrophobicContact CG-CD1 4.08Å; F331-W353 HydrophobicContact CD1-CH2 4.42Å; F331-W353 HydrophobicContact CD1-CZ3 4.49Å; F331-W353 AromaticContact CE1-CH2 3.35Å; F331-W353 HydrophobicContact CE1-CH2 3.35Å; F331-W353 HydrophobicContact CE1-CZ2 4.32Å; F331-W353 AromaticContact CE1-CZ3 3.75Å; F331-W353 HydrophobicContact CE1-CZ3 3.75Å; F331-W353 AromaticContact CZ-CH2 3.75Å; F331-W353 HydrophobicContact CZ-CH2 3.75Å; F331-W353 HydrophobicContact CZ-CZ2 4.46Å; F331-L378 WeakPolarHBondContact O-CD2 3.45Å
332	I	91.4	Very high	91.3	Very high	22 Å²	22	27.7 Å²	27.7	11%	0.113	18%	0.178	C	C	.	.	P	Polyproline II helix	trans	-76.1	120.2	174.5	-59.7	-176.8	0	0	0	108.9	G334 C335 S338 T350 L378	I332-G334 PolarHBondContact O-N 2.95Å; I332-C335 HydrophobicContact CB-CB 4.31Å; I332-C335 HydrophobicContact CG2-CB 4.42Å; I332-C335 PolarHBondContact O-N 3.45Å; I332-S338 PolarHBondContact N-O 2.81Å; I332-S338 VanDerWaalsContact N-O 3.09Å; I332-T350 HydrophobicContact CD1-CG2 3.89Å; I332-L378 HydrophobicContact CB-CD2 4.35Å; I332-L378 HydrophobicContact CG1-CD2 4.15Å
333	P	85.1	Confident	91.5	Very high	51 Å²	51	27.5 Å²	27.5	33%	0.331	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.2	132.2	179.2	-29.4	35.8	0	0	0	111.9	F331 C335 L378 Q380	F331-P333 WeakPolarHBondContact O-CD 3.15Å; P333-C335 VanDerWaalsContact C-N 3.27Å; P333-C335 PolarHBondContact O-N 2.79Å; P333-L378 HydrophobicContact CG-CD2 4.35Å; P333-Q380 WeakPolarHBondContact CB-O 3.31Å
334	G	81.5	Confident	91.5	Very high	77 Å²	77	27.7 Å²	27.7	79%	0.794	17%	0.172	S	C	*	.	T	Hydrogen-bonded Turn	trans	85.2	-15	-177.4	0	0	0	0	0	115.1	I332	I332-G334 PolarHBondContact O-N 2.95Å
335	C	83.7	Confident	91.5	Very high	54 Å²	54	31.6 Å²	31.6	37%	0.365	20%	0.196	S	C	.	.			trans	-118.8	92.8	-179.7	-61.4	0	0	0	0	110.7	I332 P333 D337 S338	I332-C335 HydrophobicContact CB-CB 4.31Å; I332-C335 HydrophobicContact CG2-CB 4.42Å; I332-C335 PolarHBondContact O-N 3.45Å; P333-C335 VanDerWaalsContact C-N 3.27Å; P333-C335 PolarHBondContact O-N 2.79Å; C335-D337 PolarHBondContact O-N 2.98Å; C335-S338 PolarHBondContact O-N 2.85Å
336	S	81.5	Confident	91.2	Very high	58 Å²	58	28.3 Å²	28.3	41%	0.406	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-15.5	179.7	56.4	0	0	0	0	114	D281	D281-S336 WeakPolarHBondContact OD2-CB 3.37Å
337	D	87.8	Confident	91.1	Very high	61 Å²	61	28.9 Å²	28.9	33%	0.326	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.9	10.8	-179.9	71.5	-39.8	0	0	0	112.6	C335 Q352 W353	C335-D337 PolarHBondContact O-N 2.98Å; D337-Q352 CarbonylContact O-C 3.39Å; D337-Q352 VanDerWaalsContact O-CA 3.24Å; D337-Q352 WeakPolarHBondContact O-CA 3.25Å; D337-Q352 VanDerWaalsContact O-CG 3.24Å; D337-Q352 WeakPolarHBondContact O-CG 3.36Å; D337-Q352 PolarHBondContact OD2-NE2 3.4Å; D337-W353 HydrophobicContact CB-CB 4.22Å; D337-W353 PolarHBondContact O-N 3.11Å
338	S	91	Very high	91.1	Very high	12 Å²	12	28.7 Å²	28.7	8%	0.084	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	135.4	-178.9	-164.1	0	0	0	0	112.5	I332 C335 T350	I332-S338 PolarHBondContact N-O 2.81Å; I332-S338 VanDerWaalsContact N-O 3.09Å; C335-S338 PolarHBondContact O-N 2.85Å; S338-T350 WeakPolarHBondContact OG-CG2 3.45Å
339	L	92.7	Very high	91	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	133.4	-174.1	-179.2	80.4	0	0	0	110.2	T279 V288 L306 V329 R330 F331 T350 I351 W353	T279-L339 HydrophobicContact CG2-CD1 3.51Å; V288-L339 HydrophobicContact CG1-CD2 3.86Å; L306-L339 HydrophobicContact CD1-CD2 3.54Å; V329-L339 HydrophobicContact CB-CD1 4.3Å; V329-L339 HydrophobicContact CB-CD2 4.47Å; V329-L339 HydrophobicContact CG1-CD2 4.3Å; R330-L339 VanDerWaalsContact C-CD1 3.41Å; R330-L339 WeakPolarHBondContact O-CD1 3.44Å; F331-L339 HydrophobicContact CD1-CD1 4.14Å; F331-L339 HydrophobicContact CD2-CD1 4.27Å; F331-L339 HydrophobicContact CE1-CD1 4.41Å; F331-L339 HydrophobicContact CG-CD1 4.08Å; L339-T350 CarbonylContact O-C 3.52Å; L339-T350 WeakPolarHBondContact O-CA 3.48Å; L339-I351 PolarHBondContact N-O 2.73Å; L339-I351 PolarHBondContact O-N 3.4Å; L339-W353 HydrophobicContact CB-CH2 4.33Å; L339-W353 HydrophobicContact CB-CZ3 3.87Å
340	L	95	Very high	91	Very high	1 Å²	1	28.5 Å²	28.5	1%	0.005	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90	125.1	166	-174.6	70.3	0	0	0	109.4	V329 R330 F348 V385	V329-L340 WeakPolarHBondContact CA-O 2.96Å; R330-L340 PolarHBondContact N-O 2.84Å; R330-L340 PolarHBondContact O-N 2.92Å; L340-F348 HydrophobicContact CD1-CB 4.31Å; L340-F348 HydrophobicContact CD1-CD2 4.14Å; L340-V385 HydrophobicContact CD2-CG1 3.81Å; L340-V385 HydrophobicContact CD2-CG2 3.79Å
341	A	95.7	Very high	90.9	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	134.4	173.2	0	0	0	0	0	109.9	L306 P326 F328 V329 F348 Q349 I351	L306-A341 HydrophobicContact CD1-CB 4.4Å; P326-A341 HydrophobicContact CB-CB 4.33Å; F328-A341 CarbonylContact O-C 3.54Å; F328-A341 WeakPolarHBondContact O-CA 3.37Å; V329-A341 HydrophobicContact CG1-CB 4.2Å; A341-F348 CarbonylContact O-C 3.51Å; A341-F348 WeakPolarHBondContact O-CA 3.41Å; A341-Q349 PolarHBondContact N-O 3.27Å; A341-Q349 PolarHBondContact O-N 2.76Å; A341-I351 HydrophobicContact CB-CD1 4.06Å
342	T	95.7	Very high	90.8	Very high	2 Å²	2	30.6 Å²	30.6	1%	0.012	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	139	-174.4	-45.6	0	0	0	0	111.8	C327 F328 A347 F348 L373 F387	C327-T342 PolarHBondContact N-O 2.59Å; F328-T342 PolarHBondContact N-O 2.82Å; F328-T342 PolarHBondContact O-N 2.93Å; T342-A347 WeakPolarHBondContact CA-O 3.49Å; T342-A347 WeakPolarHBondContact CG2-O 3.26Å; T342-F348 HydrophobicContact CG2-CB 3.97Å; T342-L373 HydrophobicContact CG2-CD2 3.13Å; T342-F387 HydrophobicContact CG2-CD1 4.02Å; T342-F387 HydrophobicContact CG2-CE1 3.66Å
343	S	94.4	Very high	90.5	Very high	4 Å²	4	33.1 Å²	33.1	3%	0.028	20%	0.204	C	C	.	.			trans	-91.3	151.5	175.5	173.4	0	0	0	0	112	D325 T345 G346 A347 L373	D325-S343 VanDerWaalsContact O-CA 3.28Å; D325-S343 WeakPolarHBondContact O-CA 3.41Å; D325-S343 VanDerWaalsContact O-CB 3.29Å; D325-S343 WeakPolarHBondContact O-CB 3.36Å; D325-S343 PolarHBondContact O-OG 2.85Å; S343-T345 PolarHBondContact O-N 3.27Å; S343-T345 VanDerWaalsContact O-N 3.13Å; S343-T345 PolarHBondContact OG-N 2.94Å; S343-T345 VanDerWaalsContact OG-N 3.1Å; S343-T345 PolarHBondContact OG-OG1 2.78Å; S343-G346 PolarHBondContact O-N 3.06Å; S343-G346 VanDerWaalsContact O-N 3.07Å; S343-A347 PolarHBondContact N-O 3.48Å; S343-L373 WeakPolarHBondContact O-CD2 3.42Å
344	Q	91.6	Very high	90.2	Very high	62 Å²	62	34.4 Å²	34.4	29%	0.29	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.1	-23.5	168.3	-85.1	173.1	15.5	0	0	113.8	C327 G346 R372 L373	C327-Q344 HydrophobicContact CB-CG 3.94Å; C327-Q344 VanDerWaalsContact SG-CG 3.52Å; Q344-G346 VanDerWaalsContact C-N 3.25Å; Q344-G346 PolarHBondContact O-N 2.88Å; Q344-R372 HydrophobicContact CB-CG 4.14Å; Q344-R372 HydrophobicContact CG-CG 4.21Å; Q344-R372 WeakPolarHBondContact O-CA 3.25Å; Q344-L373 PolarHBondContact O-N 2.83Å
345	T	90.8	Very high	90.1	Very high	93 Å²	93	34.7 Å²	34.7	57%	0.571	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.8	4	178.5	63.8	0	0	0	0	113.9	S343 A347 Q365	S343-T345 PolarHBondContact O-N 3.27Å; S343-T345 VanDerWaalsContact O-N 3.13Å; S343-T345 PolarHBondContact OG-N 2.94Å; S343-T345 VanDerWaalsContact OG-N 3.1Å; S343-T345 PolarHBondContact OG-OG1 2.78Å; T345-A347 VanDerWaalsContact C-N 3.35Å; T345-Q365 PolarHBondContact O-NE2 2.87Å
346	G	89.9	Confident	89.5	Confident	4 Å²	4	40.4 Å²	40.4	4%	0.041	23%	0.231	C	C	.	.	S	Bend	trans	80.8	8.9	-177.4	0	0	0	0	0	115	S343 Q344 Q365 L366	S343-G346 PolarHBondContact O-N 3.06Å; S343-G346 VanDerWaalsContact O-N 3.07Å; Q344-G346 VanDerWaalsContact C-N 3.25Å; Q344-G346 PolarHBondContact O-N 2.88Å; G346-Q365 PolarHBondContact O-OE1 3.01Å; G346-L366 WeakPolarHBondContact O-CG 3.29Å; G346-L366 PolarHBondContact O-N 2.94Å
347	A	93	Very high	89.2	Confident	13 Å²	13	41.1 Å²	41.1	11%	0.107	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	139.1	167.1	0	0	0	0	0	109.2	L324 T342 S343 T345 G364 Q365	L324-A347 HydrophobicContact CB-CB 4.36Å; L324-A347 HydrophobicContact CD2-CB 4Å; L324-A347 WeakPolarHBondContact CD2-O 3.41Å; T342-A347 WeakPolarHBondContact CA-O 3.49Å; T342-A347 WeakPolarHBondContact CG2-O 3.26Å; S343-A347 PolarHBondContact N-O 3.48Å; T345-A347 VanDerWaalsContact C-N 3.35Å; A347-G364 WeakPolarHBondContact CA-O 3.46Å; A347-Q365 VanDerWaalsContact CB-OE1 3.28Å; A347-Q365 VanDerWaalsContact N-OE1 3.17Å
348	F	94.5	Very high	88.7	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	145.7	173.8	61.9	-93.6	0	0	0	110.8	T53 Y56 L340 A341 T342 G364 L366 F387 Y397	T53-F348 HydrophobicContact CG2-CE1 3.89Å; T53-F348 HydrophobicContact CG2-CZ 3.57Å; Y56-F348 AromaticContact CD2-CE2 3.76Å; Y56-F348 HydrophobicContact CD2-CE2 3.76Å; Y56-F348 HydrophobicContact CD2-CZ 4.43Å; Y56-F348 HydrophobicContact CE2-CE2 4.33Å; L340-F348 HydrophobicContact CD1-CB 4.31Å; L340-F348 HydrophobicContact CD1-CD2 4.14Å; A341-F348 CarbonylContact O-C 3.51Å; A341-F348 WeakPolarHBondContact O-CA 3.41Å; T342-F348 HydrophobicContact CG2-CB 3.97Å; F348-G364 PolarHBondContact N-O 3.5Å; F348-G364 PolarHBondContact O-N 3.34Å; F348-L366 HydrophobicContact CD1-CD2 4.35Å; F348-L366 HydrophobicContact CE1-CD2 4.25Å; F348-F387 HydrophobicContact CB-CE1 4.08Å; F348-F387 HydrophobicContact CB-CZ 3.97Å; F348-F387 HydrophobicContact CD1-CE1 4.31Å; F348-F387 HydrophobicContact CD1-CE2 4.2Å; F348-F387 AromaticContact CD1-CZ 3.7Å; F348-F387 HydrophobicContact CD1-CZ 3.7Å; F348-F387 HydrophobicContact CD2-CZ 4.38Å; F348-F387 HydrophobicContact CE1-CE2 4.29Å; F348-F387 HydrophobicContact CE1-CZ 4.21Å; F348-F387 HydrophobicContact CG-CE1 4.35Å; F348-F387 AromaticContact CG-CZ 3.77Å; F348-F387 HydrophobicContact CG-CZ 3.77Å; F348-Y397 HydrophobicContact CZ-CD1 4.42Å
349	Q	94.5	Very high	88.4	Confident	11 Å²	11	44.8 Å²	44.8	5%	0.051	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	130.3	-175.5	-175.4	-179.2	9.7	0	0	110.7	S323 L324 A341 I351 D362 L363	S323-Q349 PolarHBondContact OG-NE2 3.22Å; L324-Q349 HydrophobicContact CD2-CB 3.68Å; L324-Q349 HydrophobicContact CG-CB 4.23Å; A341-Q349 PolarHBondContact N-O 3.27Å; A341-Q349 PolarHBondContact O-N 2.76Å; Q349-I351 HydrophobicContact CG-CG1 3.93Å; Q349-D362 CarbonylContact C-O 3.55Å; Q349-D362 WeakPolarHBondContact CA-O 3.47Å; Q349-D362 WeakPolarHBondContact CG-O 3.12Å; Q349-L363 HydrophobicContact CB-CD1 4.02Å; Q349-L363 HydrophobicContact CG-CD1 4.38Å
350	T	93.9	Very high	87.6	Confident	21 Å²	21	49.6 Å²	49.6	13%	0.129	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	120.2	166.8	-55.6	0	0	0	0	109.1	I332 S338 L339 D362	I332-T350 HydrophobicContact CD1-CG2 3.89Å; S338-T350 WeakPolarHBondContact OG-CG2 3.45Å; L339-T350 CarbonylContact O-C 3.52Å; L339-T350 WeakPolarHBondContact O-CA 3.48Å; T350-D362 PolarHBondContact N-O 3.27Å
351	I	92.6	Very high	87.3	Confident	16 Å²	16	54.2 Å²	54.2	8%	0.082	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	118.2	179.9	-56.9	174.2	0	0	0	107.7	L306 L320 L339 A341 Q349	L306-I351 HydrophobicContact CD1-CD1 3.83Å; L320-I351 HydrophobicContact CB-CG2 4.38Å; L320-I351 HydrophobicContact CD1-CG2 4.08Å; L339-I351 PolarHBondContact N-O 2.73Å; L339-I351 PolarHBondContact O-N 3.4Å; A341-I351 HydrophobicContact CB-CD1 4.06Å; Q349-I351 HydrophobicContact CG-CG1 3.93Å
352	Q	90.1	Very high	87	Confident	81 Å²	81	55.2 Å²	55.2	38%	0.379	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	135.2	177.3	-167.8	-179	0.8	0	0	110.8	D337 K355	D337-Q352 CarbonylContact O-C 3.39Å; D337-Q352 VanDerWaalsContact O-CA 3.24Å; D337-Q352 WeakPolarHBondContact O-CA 3.25Å; D337-Q352 VanDerWaalsContact O-CG 3.24Å; D337-Q352 WeakPolarHBondContact O-CG 3.36Å; D337-Q352 PolarHBondContact OD2-NE2 3.4Å; Q352-K355 HydrophobicContact CB-CB 4.03Å; Q352-K355 HydrophobicContact CB-CD 4.22Å; Q352-K355 PolarHBondContact O-N 2.81Å
353	W	84.8	Confident	86.8	Confident	75 Å²	75	58.2 Å²	58.2	28%	0.284	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	140.2	176	-84.3	-108.8	0	0	0	110.9	T286 V288 V308 L320 F331 D337 L339 K355	T286-W353 HydrophobicContact CG2-CZ2 4.46Å; V288-W353 HydrophobicContact CG2-CH2 3.96Å; V288-W353 HydrophobicContact CG2-CZ2 4.09Å; V308-W353 HydrophobicContact CG1-CZ2 4.37Å; V308-W353 HydrophobicContact CG2-CZ2 4.49Å; L320-W353 HydrophobicContact CD1-CD2 4.13Å; L320-W353 HydrophobicContact CD1-CE3 4.13Å; L320-W353 HydrophobicContact CD1-CH2 3.65Å; L320-W353 HydrophobicContact CD1-CZ2 3.56Å; L320-W353 HydrophobicContact CD1-CZ3 3.94Å; L320-W353 HydrophobicContact CD2-CD2 4.28Å; L320-W353 HydrophobicContact CD2-CG 4.42Å; L320-W353 HydrophobicContact CG-CZ2 4.39Å; F331-W353 HydrophobicContact CD1-CH2 4.42Å; F331-W353 HydrophobicContact CD1-CZ3 4.49Å; F331-W353 AromaticContact CE1-CH2 3.35Å; F331-W353 HydrophobicContact CE1-CH2 3.35Å; F331-W353 HydrophobicContact CE1-CZ2 4.32Å; F331-W353 AromaticContact CE1-CZ3 3.75Å; F331-W353 HydrophobicContact CE1-CZ3 3.75Å; F331-W353 AromaticContact CZ-CH2 3.75Å; F331-W353 HydrophobicContact CZ-CH2 3.75Å; F331-W353 HydrophobicContact CZ-CZ2 4.46Å; D337-W353 HydrophobicContact CB-CB 4.22Å; D337-W353 PolarHBondContact O-N 3.11Å; L339-W353 HydrophobicContact CB-CH2 4.33Å; L339-W353 HydrophobicContact CB-CZ3 3.87Å; W353-K355 PolarHBondContact O-N 3.31Å
354	G	79.4	Confident	86.7	Confident	77 Å²	77	58.2 Å²	58.2	79%	0.794	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.6	-6.9	177.6	0	0	0	0	0	115	I356	G354-I356 PolarHBondContact O-N 3.43Å
355	K	79.4	Confident	86.7	Confident	83 Å²	83	58.9 Å²	58.9	36%	0.361	34%	0.337	S	S	.	.			trans	-75.7	108.3	173	-169.3	-179.9	-176	-179.5	0	109.5	Q352 W353 A357 D362	Q352-K355 HydrophobicContact CB-CB 4.03Å; Q352-K355 HydrophobicContact CB-CD 4.22Å; Q352-K355 PolarHBondContact O-N 2.81Å; W353-K355 PolarHBondContact O-N 3.31Å; K355-A357 WeakPolarHBondContact CE-O 3.15Å; K355-D362 WeakPolarHBondContact CE-OD2 3.43Å; K355-D362 IonicContact NZ-OD1 3.74Å; K355-D362 PolarHBondContact NZ-OD1 2.87Å; K355-D362 IonicContact NZ-OD2 3.03Å; K355-D362 PolarHBondContact NZ-OD2 3.33Å
356	I	71.7	Confident	86.7	Confident	174 Å²	174	55.2 Å²	55.2	89%	0.892	31%	0.314	S	S	*	.			trans	-83.6	-33.8	-178	-61.1	150.7	0	0	0	111.3	G354	G354-I356 PolarHBondContact O-N 3.43Å
357	A	74.3	Confident	86.2	Confident	73 Å²	73	59.5 Å²	59.5	60%	0.603	33%	0.328	S	S	*	.	S	Bend	trans	-91.7	122.1	-176.1	0	0	0	0	0	111.4	K355 S359	K355-A357 WeakPolarHBondContact CE-O 3.15Å; A357-S359 PolarHBondContact O-N 3.48Å
358	F	77.5	Confident	84.9	Confident	117 Å²	117	64.9 Å²	64.9	51%	0.513	36%	0.355	S	S	.	.	P	Polyproline II helix	trans	-67.5	124.1	172.2	-176.9	-95.6	0	0	0	110.3	L363	F358-L363 HydrophobicContact CE2-CB 4.36Å; F358-L363 HydrophobicContact CZ-CB 3.78Å; F358-L363 HydrophobicContact CZ-CD2 4.09Å
359	S	83.9	Confident	83.3	Confident	34 Å²	34	67.1 Å²	67.1	24%	0.238	38%	0.378	C	S	.	.	P	Polyproline II helix	trans	-98.1	141.3	171.1	-170.5	0	0	0	0	110.1	A357 N361 D362	A357-S359 PolarHBondContact O-N 3.48Å; S359-N361 PolarHBondContact O-N 2.84Å; S359-N361 PolarHBondContact OG-N 2.84Å; S359-D362 WeakPolarHBondContact CB-OD2 2.95Å; S359-D362 PolarHBondContact N-OD2 2.98Å; S359-D362 VanDerWaalsContact O-CB 3.31Å; S359-D362 WeakPolarHBondContact O-CB 3.35Å; S359-D362 PolarHBondContact O-N 3.18Å
360	P	78	Confident	81.8	Confident	100 Å²	100	78.9 Å²	78.9	65%	0.649	42%	0.423	S	S	*	.	G	3₁₀ helix	trans	-60.2	-24.1	170.2	26.4	-35.1	0	0	0	112.3	D362 L363	P360-D362 PolarHBondContact O-N 3.08Å; P360-L363 PolarHBondContact O-N 3.19Å
361	N	86.9	Confident	81	Confident	98 Å²	98	79.5 Å²	79.5	52%	0.524	43%	0.426	S	S	.	.	G	3₁₀ helix	trans	-76.1	-4.4	174.6	-66.1	-15.5	0	0	0	113.2	G54 G55 S359	G54-N361 CarbonylContact C-O 3.58Å; G54-N361 WeakPolarHBondContact CA-O 3.43Å; G55-N361 PolarHBondContact N-O 2.94Å; S359-N361 PolarHBondContact O-N 2.84Å; S359-N361 PolarHBondContact OG-N 2.84Å
362	D	89.9	Confident	80.8	Confident	21 Å²	21	83.9 Å²	83.9	11%	0.112	44%	0.441	C	S	.	.	G	3₁₀ helix	trans	-87	-17.8	175.9	-62.2	-30.2	0	0	0	111.8	Q349 T350 K355 S359 P360	Q349-D362 CarbonylContact C-O 3.55Å; Q349-D362 WeakPolarHBondContact CA-O 3.47Å; Q349-D362 WeakPolarHBondContact CG-O 3.12Å; T350-D362 PolarHBondContact N-O 3.27Å; K355-D362 WeakPolarHBondContact CE-OD2 3.43Å; K355-D362 IonicContact NZ-OD1 3.74Å; K355-D362 PolarHBondContact NZ-OD1 2.87Å; K355-D362 IonicContact NZ-OD2 3.03Å; K355-D362 PolarHBondContact NZ-OD2 3.33Å; S359-D362 WeakPolarHBondContact CB-OD2 2.95Å; S359-D362 PolarHBondContact N-OD2 2.98Å; S359-D362 VanDerWaalsContact O-CB 3.31Å; S359-D362 WeakPolarHBondContact O-CB 3.35Å; S359-D362 PolarHBondContact O-N 3.18Å; P360-D362 PolarHBondContact O-N 3.08Å
363	L	92.5	Very high	80.9	Confident	66 Å²	66	80.1 Å²	80.1	35%	0.346	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	125.5	-176.4	-176.1	69.8	0	0	0	110.6	G54 L324 Q349 F358 P360	G54-L363 VanDerWaalsContact CA-O 3.28Å; G54-L363 WeakPolarHBondContact CA-O 3.22Å; G54-L363 PolarHBondContact N-O 2.83Å; L324-L363 HydrophobicContact CD2-CD1 4.37Å; Q349-L363 HydrophobicContact CB-CD1 4.02Å; Q349-L363 HydrophobicContact CG-CD1 4.38Å; F358-L363 HydrophobicContact CE2-CB 4.36Å; F358-L363 HydrophobicContact CZ-CB 3.78Å; F358-L363 HydrophobicContact CZ-CD2 4.09Å; P360-L363 PolarHBondContact O-N 3.19Å
364	G	91.7	Very high	81.2	Confident	4 Å²	4	77.7 Å²	77.7	4%	0.041	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	169.3	177.7	0	0	0	0	0	112.7	T53 A347 F348	T53-G364 VanDerWaalsContact OG1-CA 3.22Å; T53-G364 WeakPolarHBondContact OG1-CA 3.49Å; A347-G364 WeakPolarHBondContact CA-O 3.46Å; F348-G364 PolarHBondContact N-O 3.5Å; F348-G364 PolarHBondContact O-N 3.34Å
365	Q	92.2	Very high	81.9	Confident	76 Å²	76	74.2 Å²	74.2	36%	0.355	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	139.1	178.8	179.5	64.9	28.2	0	0	108.6	Y51 T53 T345 G346 A347 W367	Y51-Q365 VanDerWaalsContact CE1-O 3.3Å; Y51-Q365 WeakPolarHBondContact CE1-O 3.38Å; Y51-Q365 PolarHBondContact OH-O 3.18Å; Y51-Q365 VanDerWaalsContact OH-O 3.04Å; T53-Q365 WeakPolarHBondContact CG2-O 3.38Å; T53-Q365 PolarHBondContact OG1-N 2.86Å; T345-Q365 PolarHBondContact O-NE2 2.87Å; G346-Q365 PolarHBondContact O-OE1 3.01Å; A347-Q365 VanDerWaalsContact CB-OE1 3.28Å; A347-Q365 VanDerWaalsContact N-OE1 3.17Å; Q365-W367 PolarHBondContact O-N 2.87Å
366	L	89.5	Confident	82.6	Confident	16 Å²	16	70.4 Å²	70.4	8%	0.084	37%	0.365	C	S	.	.			trans	-63	135.1	174	-62	176.2	0	0	0	111.4	G346 F348 L368 L373 F387 H395 Y397	G346-L366 WeakPolarHBondContact O-CG 3.29Å; G346-L366 PolarHBondContact O-N 2.94Å; F348-L366 HydrophobicContact CD1-CD2 4.35Å; F348-L366 HydrophobicContact CE1-CD2 4.25Å; L366-L368 PolarHBondContact O-N 3.16Å; L366-L373 HydrophobicContact CD1-CD1 4.17Å; L366-F387 HydrophobicContact CD1-CB 3.81Å; L366-F387 HydrophobicContact CD1-CD1 4.46Å; L366-F387 HydrophobicContact CD1-CG 4.12Å; L366-F387 HydrophobicContact CD2-CB 3.86Å; L366-F387 HydrophobicContact CD2-CD1 4.22Å; L366-F387 HydrophobicContact CD2-CD2 3.33Å; L366-F387 HydrophobicContact CD2-CE2 3.76Å; L366-F387 HydrophobicContact CD2-CG 3.55Å; L366-F387 HydrophobicContact CD2-CZ 4.36Å; L366-F387 HydrophobicContact CG-CG 4.41Å; L366-H395 HydrophobicContact CD2-CB 4.45Å; L366-Y397 HydrophobicContact CD2-CD2 4.03Å; L366-Y397 HydrophobicContact CD2-CE2 3.4Å
367	W	80	Confident	83.7	Confident	93 Å²	93	63.5 Å²	63.5	35%	0.352	33%	0.33	S	S	.	.	S	Bend	trans	-58	114.3	169.5	-174.3	-103.9	0	0	0	110.6	Y51 Q365 Y397	Y51-W367 HydrophobicContact CD1-CB 3.61Å; Y51-W367 HydrophobicContact CD1-CD2 4.09Å; Y51-W367 AromaticContact CD1-CE3 3.56Å; Y51-W367 HydrophobicContact CD1-CE3 3.56Å; Y51-W367 HydrophobicContact CD1-CG 4.18Å; Y51-W367 HydrophobicContact CD1-CZ3 4.45Å; Y51-W367 HydrophobicContact CD2-CD2 4.3Å; Y51-W367 AromaticContact CD2-CE3 3.13Å; Y51-W367 HydrophobicContact CD2-CE3 3.13Å; Y51-W367 HydrophobicContact CD2-CH2 4.47Å; Y51-W367 AromaticContact CD2-CZ3 3.23Å; Y51-W367 HydrophobicContact CD2-CZ3 3.23Å; Y51-W367 HydrophobicContact CE1-CB 3.74Å; Y51-W367 AromaticContact CE1-CE3 3.88Å; Y51-W367 HydrophobicContact CE1-CE3 3.88Å; Y51-W367 AromaticContact CE2-CE3 3.5Å; Y51-W367 HydrophobicContact CE2-CE3 3.5Å; Y51-W367 AromaticContact CE2-CZ3 3.76Å; Y51-W367 HydrophobicContact CE2-CZ3 3.76Å; Y51-W367 HydrophobicContact CG-CB 4.35Å; Y51-W367 AromaticContact CG-CD2 3.93Å; Y51-W367 HydrophobicContact CG-CD2 3.93Å; Y51-W367 AromaticContact CG-CE3 3.14Å; Y51-W367 HydrophobicContact CG-CE3 3.14Å; Y51-W367 HydrophobicContact CG-CG 4.46Å; Y51-W367 AromaticContact CG-CZ3 3.62Å; Y51-W367 HydrophobicContact CG-CZ3 3.62Å; Y51-W367 AromaticContact CZ-CE3 3.85Å; Q365-W367 PolarHBondContact O-N 2.87Å; W367-Y397 WeakPolarHBondContact CB-OH 3.37Å; W367-Y397 PolarHBondContact N-OH 3.32Å
368	L	65.5	Low	84.7	Confident	127 Å²	127	60.8 Å²	60.8	67%	0.665	31%	0.305	S	S	*	.	S	Bend	trans	49.4	102.1	166.3	-59.1	176.5	0	0	0	115.4	L366	L366-L368 PolarHBondContact O-N 3.16Å
369	G	61.9	Low	85.4	Confident	46 Å²	46	55.2 Å²	55.2	47%	0.474	28%	0.281	S	S	.	.			trans	173.4	116.7	163.6	0	0	0	0	0	110.5	D371	G369-D371 PolarHBondContact O-N 3.06Å
370	Y	62.4	Low	85.4	Confident	258 Å²	258	56.3 Å²	56.3	100%	1.012	28%	0.282	S	S	*	.			trans	-77.7	51.3	163.2	-70.4	-80.5	0	0	0	109.3
371	D	77.1	Confident	85.8	Confident	35 Å²	35	53.4 Å²	53.4	19%	0.187	26%	0.261	C	S	.	.			trans	-123	144.4	-174.1	-165	13.9	0	0	0	110.1	G369 T389 E390 A391	G369-D371 PolarHBondContact O-N 3.06Å; D371-T389 WeakPolarHBondContact OD2-CB 3.33Å; D371-T389 PolarHBondContact OD2-OG1 2.85Å; D371-E390 WeakPolarHBondContact OD1-CB 3.41Å; D371-E390 PolarHBondContact OD2-N 3.45Å; D371-A391 PolarHBondContact OD1-N 2.95Å; D371-A391 WeakPolarHBondContact OD2-CA 3.38Å; D371-A391 WeakPolarHBondContact OD2-CB 3.39Å; D371-A391 PolarHBondContact OD2-N 2.79Å
372	R	88.2	Confident	85.8	Confident	107 Å²	107	49.1 Å²	49.1	40%	0.404	24%	0.24	S	C	.	.			trans	-80.5	128.5	-176.2	-177.2	168.8	59.4	142.9	-1.8	108.8	Q344 V374 T389 E390	Q344-R372 HydrophobicContact CB-CG 4.14Å; Q344-R372 HydrophobicContact CG-CG 4.21Å; Q344-R372 WeakPolarHBondContact O-CA 3.25Å; R372-V374 PolarHBondContact O-N 2.69Å; R372-T389 CarbonylContact O-C 3.49Å; R372-T389 WeakPolarHBondContact O-CA 3.43Å; R372-E390 HydrophobicContact CB-CB 4.31Å; R372-E390 IonicContact CZ-OE2 3.66Å; R372-E390 IonicContact NE-OE2 2.68Å; R372-E390 PolarHBondContact NE-OE2 3.13Å; R372-E390 IonicContact NH2-OE1 2.76Å; R372-E390 PolarHBondContact NH2-OE1 2.8Å; R372-E390 IonicContact NH2-OE2 3.64Å; R372-E390 PolarHBondContact NH2-OE2 3.47Å; R372-E390 PolarHBondContact O-N 3.22Å
373	L	91.9	Very high	85.9	Confident	3 Å²	3	48.7 Å²	48.7	2%	0.016	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	129.4	170.7	-174.9	76.8	0	0	0	110.2	F328 T342 S343 Q344 L366 T376 F387 A388	F328-L373 HydrophobicContact CD2-CD2 3.8Å; F328-L373 HydrophobicContact CD2-CG 4.35Å; F328-L373 HydrophobicContact CE2-CD2 4Å; F328-L373 HydrophobicContact CE2-CG 4.09Å; T342-L373 HydrophobicContact CG2-CD2 3.13Å; S343-L373 WeakPolarHBondContact O-CD2 3.42Å; Q344-L373 PolarHBondContact O-N 2.83Å; L366-L373 HydrophobicContact CD1-CD1 4.17Å; L373-T376 WeakPolarHBondContact CD2-OG1 3.46Å; L373-F387 HydrophobicContact CD1-CB 3.63Å; L373-F387 HydrophobicContact CD1-CD1 4.01Å; L373-F387 HydrophobicContact CD1-CG 4.31Å; L373-F387 HydrophobicContact CD2-CD1 4.21Å; L373-A388 WeakPolarHBondContact CD1-O 3.33Å
374	V	91.7	Very high	85.9	Confident	23 Å²	23	45.6 Å²	45.6	14%	0.139	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	-34.4	-177.5	-177.3	0	0	0	0	112.5	I73 F328 R372 A388 E390	I73-V374 VanDerWaalsContact O-CG1 3.25Å; I73-V374 WeakPolarHBondContact O-CG1 3.28Å; F328-V374 WeakPolarHBondContact CE1-O 3.4Å; F328-V374 VanDerWaalsContact CZ-C 3.48Å; F328-V374 WeakPolarHBondContact CZ-O 2.95Å; R372-V374 PolarHBondContact O-N 2.69Å; V374-A388 PolarHBondContact N-O 3Å; V374-E390 HydrophobicContact CG2-CB 3.65Å; V374-E390 HydrophobicContact CG2-CG 4.31Å
375	A	93.5	Very high	86	Confident	5 Å²	5	45.4 Å²	45.4	4%	0.041	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	155.1	178.4	0	0	0	0	0	111.4	V76 A388	V76-A375 HydrophobicContact CG1-CB 3.87Å; A375-A388 HydrophobicContact CB-CB 4.24Å; A375-A388 PolarHBondContact N-O 2.83Å; A375-A388 PolarHBondContact O-N 2.74Å
376	T	94.9	Very high	86.2	Confident	3 Å²	3	41.8 Å²	41.8	2%	0.018	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	137.4	176.4	-60	0	0	0	0	108.7	R330 L373 V385 V386 F387	R330-T376 PolarHBondContact NH2-O 2.83Å; R330-T376 VanDerWaalsContact NH2-O 3.16Å; L373-T376 WeakPolarHBondContact CD2-OG1 3.46Å; T376-V385 HydrophobicContact CG2-CG1 3.86Å; T376-V386 WeakPolarHBondContact CA-O 3.49Å; T376-F387 HydrophobicContact CG2-CD1 3.71Å; T376-F387 HydrophobicContact CG2-CE1 3.7Å; T376-F387 WeakPolarHBondContact OG1-CD1 3.28Å
377	D	95.2	Very high	86.4	Confident	29 Å²	29	41.1 Å²	41.1	16%	0.155	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	158.2	172	-160.1	35.4	0	0	0	111.6	V76 A77 F78 R330 V386	V76-D377 HydrophobicContact CG1-CB 4.44Å; A77-D377 WeakPolarHBondContact CA-OD2 3.19Å; F78-D377 HydrophobicContact CD2-CB 4.2Å; F78-D377 WeakPolarHBondContact CE2-O 3.4Å; F78-D377 PolarHBondContact N-OD2 2.82Å; R330-D377 IonicContact NE-OD1 2.9Å; R330-D377 PolarHBondContact NE-OD1 3.2Å; D377-V386 HydrophobicContact CB-CG1 4.08Å; D377-V386 PolarHBondContact N-O 2.89Å; D377-V386 VanDerWaalsContact N-O 3.12Å; D377-V386 PolarHBondContact O-N 2.76Å
378	L	93.5	Very high	87	Confident	15 Å²	15	36.7 Å²	36.7	8%	0.079	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	132.6	-175.5	179.8	69	0	0	0	108.8	F331 I332 P333 C384 V385	F331-L378 WeakPolarHBondContact O-CD2 3.45Å; I332-L378 HydrophobicContact CB-CD2 4.35Å; I332-L378 HydrophobicContact CG1-CD2 4.15Å; P333-L378 HydrophobicContact CG-CD2 4.35Å; L378-C384 WeakPolarHBondContact CD1-O 3.27Å; L378-V385 HydrophobicContact CD1-CB 4.45Å; L378-V385 HydrophobicContact CD1-CG2 3.38Å
379	S	92.9	Very high	88.1	Confident	0 Å²	0	30.9 Å²	30.9	0%	0	15%	0.152	C	C	.	.			trans	-65.6	157.1	-177.3	66.6	0	0	0	0	111.8	N381 G382 N383 C384 F406	S379-N381 VanDerWaalsContact C-N 3.25Å; S379-N381 PolarHBondContact O-N 2.9Å; S379-N381 PolarHBondContact OG-OD1 3.12Å; S379-G382 WeakPolarHBondContact O-CA 3.23Å; S379-G382 PolarHBondContact O-N 2.87Å; S379-N383 PolarHBondContact OG-N 3.03Å; S379-C384 WeakPolarHBondContact CB-O 3.42Å; S379-C384 PolarHBondContact N-O 3.44Å; S379-C384 WeakPolarHBondContact OG-CA 3.32Å; S379-C384 WeakPolarHBondContact OG-CB 3.19Å; S379-C384 PolarHBondContact OG-N 2.87Å; S379-C384 PolarHBondContact OG-O 3.21Å; S379-C384 VanDerWaalsContact OG-O 3.14Å; S379-F406 WeakPolarHBondContact CB-O 3.3Å
380	Q	84.5	Confident	89.2	Confident	57 Å²	57	30.7 Å²	30.7	27%	0.266	14%	0.139	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62	-31.8	-173.5	-168.8	-174.3	56.4	0	0	113.5	P333 G382 F406 N407	P333-Q380 WeakPolarHBondContact CB-O 3.31Å; Q380-G382 VanDerWaalsContact C-N 3.26Å; Q380-F406 PolarHBondContact N-O 2.87Å; Q380-N407 WeakPolarHBondContact CB-OD1 3.46Å
381	N	85.4	Confident	90.1	Very high	39 Å²	39	21 Å²	21	21%	0.209	11%	0.113	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.2	-4.7	175.1	66	-2.3	0	0	0	113.8	S379 N383 Q405 F406	S379-N381 VanDerWaalsContact C-N 3.25Å; S379-N381 PolarHBondContact O-N 2.9Å; S379-N381 PolarHBondContact OG-OD1 3.12Å; N381-N383 PolarHBondContact O-N 2.77Å; N381-N383 WeakPolarHBondContact OD1-CB 3.24Å; N381-N383 PolarHBondContact OD1-N 2.87Å; N381-Q405 PolarHBondContact ND2-O 2.78Å; N381-F406 PolarHBondContact N-O 3.25Å; N381-F406 PolarHBondContact OD1-O 2.99Å; N381-F406 VanDerWaalsContact OD1-O 3.05Å
382	G	87.7	Confident	90.3	Very high	9 Å²	9	19.3 Å²	19.3	9%	0.093	10%	0.104	C	C	.	.	S	Bend	trans	70.6	8.9	-176.2	0	0	0	0	0	114.9	S379 Q380	S379-G382 WeakPolarHBondContact O-CA 3.23Å; S379-G382 PolarHBondContact O-N 2.87Å; Q380-G382 VanDerWaalsContact C-N 3.26Å
383	N	90.7	Very high	90.3	Very high	12 Å²	12	16.7 Å²	16.7	6%	0.064	10%	0.096	C	C	.	.	S	Bend	trans	-90	-28	-175.8	-162.8	41.6	0	0	0	113.1	S379 N381 I398 H399 D400 L403	S379-N383 PolarHBondContact OG-N 3.03Å; N381-N383 PolarHBondContact O-N 2.77Å; N381-N383 WeakPolarHBondContact OD1-CB 3.24Å; N381-N383 PolarHBondContact OD1-N 2.87Å; N383-I398 WeakPolarHBondContact ND2-CG2 3.47Å; N383-I398 CarbonylContact O-C 3.56Å; N383-I398 WeakPolarHBondContact O-CA 3.28Å; N383-H399 PolarHBondContact O-N 2.53Å; N383-H399 WeakPolarHBondContact OD1-CB 3.42Å; N383-D400 PolarHBondContact ND2-O 3.49Å; N383-D400 WeakPolarHBondContact OD1-CB 3.34Å; N383-D400 PolarHBondContact OD1-N 3.37Å; N383-L403 WeakPolarHBondContact ND2-CB 3.5Å; N383-L403 PolarHBondContact ND2-O 2.6Å
384	C	93	Very high	90.2	Very high	0 Å²	0	16.6 Å²	16.6	0%	0	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	135.5	-171.9	-54.8	0	0	0	0	110.6	F78 L378 S379 L396 Y397 I398 F406	F78-C384 HydrophobicContact CE1-CB 4.34Å; F78-C384 HydrophobicContact CZ-CB 4Å; L378-C384 WeakPolarHBondContact CD1-O 3.27Å; S379-C384 WeakPolarHBondContact CB-O 3.42Å; S379-C384 PolarHBondContact N-O 3.44Å; S379-C384 WeakPolarHBondContact OG-CA 3.32Å; S379-C384 WeakPolarHBondContact OG-CB 3.19Å; S379-C384 PolarHBondContact OG-N 2.87Å; S379-C384 PolarHBondContact OG-O 3.21Å; S379-C384 VanDerWaalsContact OG-O 3.14Å; C384-L396 HydrophobicContact CB-CD1 4.27Å; C384-Y397 CarbonylContact C-O 3.54Å; C384-Y397 VanDerWaalsContact CA-O 3.3Å; C384-Y397 WeakPolarHBondContact CA-O 3.1Å; C384-I398 HydrophobicContact CB-CG1 4.38Å; C384-F406 HydrophobicContact CB-CD1 3.82Å; C384-F406 HydrophobicContact CB-CE1 4.14Å
385	V	94.9	Very high	90.2	Very high	1 Å²	1	15.6 Å²	15.6	1%	0.006	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	135.4	174.7	-175.1	0	0	0	0	108.4	Y56 L340 T376 L378 F387 Y397	Y56-V385 HydrophobicContact CD1-CG2 4.19Å; Y56-V385 HydrophobicContact CE1-CG2 3.59Å; L340-V385 HydrophobicContact CD2-CG1 3.81Å; L340-V385 HydrophobicContact CD2-CG2 3.79Å; T376-V385 HydrophobicContact CG2-CG1 3.86Å; L378-V385 HydrophobicContact CD1-CB 4.45Å; L378-V385 HydrophobicContact CD1-CG2 3.38Å; V385-F387 HydrophobicContact CB-CE2 3.9Å; V385-F387 HydrophobicContact CB-CZ 4.17Å; V385-F387 HydrophobicContact CG1-CD1 4.34Å; V385-F387 HydrophobicContact CG1-CD2 3.93Å; V385-F387 HydrophobicContact CG1-CE1 3.81Å; V385-F387 HydrophobicContact CG1-CE2 3.38Å; V385-F387 HydrophobicContact CG1-CG 4.41Å; V385-F387 HydrophobicContact CG1-CZ 3.33Å; V385-Y397 PolarHBondContact N-O 2.99Å; V385-Y397 PolarHBondContact O-N 2.83Å
386	V	94.8	Very high	90.3	Very high	0 Å²	0	15.4 Å²	15.4	0%	0	9%	0.087	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	133.5	171.4	68	0	0	0	0	109.9	V76 F78 I85 T376 D377 L394 H395	V76-V386 HydrophobicContact CB-CG1 4.43Å; V76-V386 HydrophobicContact CG1-CG1 3.89Å; V76-V386 HydrophobicContact CG2-CB 4.49Å; V76-V386 HydrophobicContact CG2-CG1 3.63Å; V76-V386 HydrophobicContact CG2-CG2 4.02Å; F78-V386 HydrophobicContact CD2-CG1 4.06Å; F78-V386 HydrophobicContact CE2-CB 3.88Å; F78-V386 HydrophobicContact CE2-CG1 3.51Å; F78-V386 HydrophobicContact CZ-CB 3.79Å; F78-V386 HydrophobicContact CZ-CG1 3.89Å; I85-V386 HydrophobicContact CG2-CG1 4.44Å; I85-V386 HydrophobicContact CG2-CG2 4.26Å; T376-V386 WeakPolarHBondContact CA-O 3.49Å; D377-V386 HydrophobicContact CB-CG1 4.08Å; D377-V386 PolarHBondContact N-O 2.89Å; D377-V386 VanDerWaalsContact N-O 3.12Å; D377-V386 PolarHBondContact O-N 2.76Å; V386-L394 HydrophobicContact CG2-CB 4.45Å; V386-H395 WeakPolarHBondContact CA-O 3.26Å
387	F	94.5	Very high	90.2	Very high	1 Å²	1	15.2 Å²	15.2	0%	0.004	9%	0.086	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	123.6	178	-61.5	-83.7	0	0	0	109.1	T342 F348 L366 L373 T376 V385 L394 H395 Y397	T342-F387 HydrophobicContact CG2-CD1 4.02Å; T342-F387 HydrophobicContact CG2-CE1 3.66Å; F348-F387 HydrophobicContact CB-CE1 4.08Å; F348-F387 HydrophobicContact CB-CZ 3.97Å; F348-F387 HydrophobicContact CD1-CE1 4.31Å; F348-F387 HydrophobicContact CD1-CE2 4.2Å; F348-F387 AromaticContact CD1-CZ 3.7Å; F348-F387 HydrophobicContact CD1-CZ 3.7Å; F348-F387 HydrophobicContact CD2-CZ 4.38Å; F348-F387 HydrophobicContact CE1-CE2 4.29Å; F348-F387 HydrophobicContact CE1-CZ 4.21Å; F348-F387 HydrophobicContact CG-CE1 4.35Å; F348-F387 AromaticContact CG-CZ 3.77Å; F348-F387 HydrophobicContact CG-CZ 3.77Å; L366-F387 HydrophobicContact CD1-CB 3.81Å; L366-F387 HydrophobicContact CD1-CD1 4.46Å; L366-F387 HydrophobicContact CD1-CG 4.12Å; L366-F387 HydrophobicContact CD2-CB 3.86Å; L366-F387 HydrophobicContact CD2-CD1 4.22Å; L366-F387 HydrophobicContact CD2-CD2 3.33Å; L366-F387 HydrophobicContact CD2-CE2 3.76Å; L366-F387 HydrophobicContact CD2-CG 3.55Å; L366-F387 HydrophobicContact CD2-CZ 4.36Å; L366-F387 HydrophobicContact CG-CG 4.41Å; L373-F387 HydrophobicContact CD1-CB 3.63Å; L373-F387 HydrophobicContact CD1-CD1 4.01Å; L373-F387 HydrophobicContact CD1-CG 4.31Å; L373-F387 HydrophobicContact CD2-CD1 4.21Å; T376-F387 HydrophobicContact CG2-CD1 3.71Å; T376-F387 HydrophobicContact CG2-CE1 3.7Å; T376-F387 WeakPolarHBondContact OG1-CD1 3.28Å; V385-F387 HydrophobicContact CB-CE2 3.9Å; V385-F387 HydrophobicContact CB-CZ 4.17Å; V385-F387 HydrophobicContact CG1-CD1 4.34Å; V385-F387 HydrophobicContact CG1-CD2 3.93Å; V385-F387 HydrophobicContact CG1-CE1 3.81Å; V385-F387 HydrophobicContact CG1-CE2 3.38Å; V385-F387 HydrophobicContact CG1-CG 4.41Å; V385-F387 HydrophobicContact CG1-CZ 3.33Å; F387-L394 WeakPolarHBondContact O-CA 3.46Å; F387-H395 HydrophobicContact CB-CB 4.4Å; F387-H395 PolarHBondContact N-O 3.02Å; F387-H395 PolarHBondContact O-N 2.86Å; F387-Y397 AromaticContact CD2-CD2 3.73Å; F387-Y397 HydrophobicContact CD2-CD2 3.73Å; F387-Y397 HydrophobicContact CD2-CE2 4.28Å; F387-Y397 AromaticContact CE2-CD2 3.84Å; F387-Y397 HydrophobicContact CE2-CD2 3.84Å; F387-Y397 HydrophobicContact CE2-CG 4.18Å
388	A	92.6	Very high	90.1	Very high	0 Å²	0	13.9 Å²	13.9	0%	0	8%	0.079	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	127.6	-179.7	0	0	0	0	0	111.1	I73 V76 L373 V374 A375 Q393 L394	I73-A388 HydrophobicContact CD1-CB 4.12Å; I73-A388 HydrophobicContact CG2-CB 3.84Å; V76-A388 HydrophobicContact CB-CB 4Å; V76-A388 HydrophobicContact CG1-CB 3.81Å; L373-A388 WeakPolarHBondContact CD1-O 3.33Å; V374-A388 PolarHBondContact N-O 3Å; A375-A388 HydrophobicContact CB-CB 4.24Å; A375-A388 PolarHBondContact N-O 2.83Å; A375-A388 PolarHBondContact O-N 2.74Å; A388-Q393 WeakPolarHBondContact CA-O 3.25Å; A388-L394 HydrophobicContact CB-CD2 3.57Å
389	T	89	Confident	90	Very high	5 Å²	5	18 Å²	18	3%	0.031	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	164.4	-176	75.8	0	0	0	0	112.4	D371 R372 A391 G392 Q393	D371-T389 WeakPolarHBondContact OD2-CB 3.33Å; D371-T389 PolarHBondContact OD2-OG1 2.85Å; R372-T389 CarbonylContact O-C 3.49Å; R372-T389 WeakPolarHBondContact O-CA 3.43Å; T389-A391 VanDerWaalsContact C-N 3.31Å; T389-A391 PolarHBondContact O-N 2.93Å; T389-G392 PolarHBondContact O-N 2.95Å; T389-Q393 HydrophobicContact CG2-CB 4.47Å; T389-Q393 PolarHBondContact N-O 2.84Å; T389-Q393 WeakPolarHBondContact OG1-CB 3.46Å; T389-Q393 PolarHBondContact OG1-N 2.87Å; T389-Q393 PolarHBondContact OG1-O 3.42Å
390	E	85	Confident	89.9	Confident	42 Å²	42	20.6 Å²	20.6	20%	0.196	11%	0.112	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-28	-176.8	-173.8	171.3	-170.4	0	0	113.3	R72 D371 R372 V374 G392	R72-E390 WeakPolarHBondContact CA-O 3.29Å; R72-E390 HydrophobicContact CB-CG 4.36Å; R72-E390 WeakPolarHBondContact CD-OE1 3.24Å; R72-E390 HydrophobicContact CG-CG 3.7Å; R72-E390 IonicContact NH1-OE1 3.61Å; D371-E390 WeakPolarHBondContact OD1-CB 3.41Å; D371-E390 PolarHBondContact OD2-N 3.45Å; R372-E390 HydrophobicContact CB-CB 4.31Å; R372-E390 IonicContact CZ-OE2 3.66Å; R372-E390 IonicContact NE-OE2 2.68Å; R372-E390 PolarHBondContact NE-OE2 3.13Å; R372-E390 IonicContact NH2-OE1 2.76Å; R372-E390 PolarHBondContact NH2-OE1 2.8Å; R372-E390 IonicContact NH2-OE2 3.64Å; R372-E390 PolarHBondContact NH2-OE2 3.47Å; R372-E390 PolarHBondContact O-N 3.22Å; V374-E390 HydrophobicContact CG2-CB 3.65Å; V374-E390 HydrophobicContact CG2-CG 4.31Å; E390-G392 VanDerWaalsContact C-N 3.26Å; E390-G392 PolarHBondContact O-N 2.93Å
391	A	81	Confident	89.8	Confident	55 Å²	55	20.7 Å²	20.7	46%	0.455	11%	0.113	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.7	5	177	0	0	0	0	0	114.1	M63 D371 T389	M63-A391 WeakPolarHBondContact CE-O 3.26Å; D371-A391 PolarHBondContact OD1-N 2.95Å; D371-A391 WeakPolarHBondContact OD2-CA 3.38Å; D371-A391 WeakPolarHBondContact OD2-CB 3.39Å; D371-A391 PolarHBondContact OD2-N 2.79Å; T389-A391 VanDerWaalsContact C-N 3.31Å; T389-A391 PolarHBondContact O-N 2.93Å
392	G	82.3	Confident	89.8	Confident	0 Å²	0	25.3 Å²	25.3	0%	0	14%	0.138	C	C	.	.	S	Bend	trans	93.8	15.1	175.4	0	0	0	0	0	115.3	M64 I73 T389 E390	M64-G392 PolarHBondContact N-O 2.92Å; I73-G392 VanDerWaalsContact CD1-CA 3.49Å; T389-G392 PolarHBondContact O-N 2.95Å; E390-G392 VanDerWaalsContact C-N 3.26Å; E390-G392 PolarHBondContact O-N 2.93Å
393	Q	86.7	Confident	89.6	Confident	52 Å²	52	29 Å²	29	24%	0.243	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	135.2	177.7	-68	175.7	11.2	0	0	111.5	T61 M63 A388 T389 H395	T61-Q393 HydrophobicContact CG2-CB 3.97Å; T61-Q393 HydrophobicContact CG2-CG 4.14Å; M63-Q393 HydrophobicContact CE-CG 4.34Å; M63-Q393 HydrophobicContact SD-CB 4.47Å; M63-Q393 HydrophobicContact SD-CG 3.24Å; M63-Q393 WeakPolarHBondContact SD-CG 3.24Å; A388-Q393 WeakPolarHBondContact CA-O 3.25Å; T389-Q393 HydrophobicContact CG2-CB 4.47Å; T389-Q393 PolarHBondContact N-O 2.84Å; T389-Q393 WeakPolarHBondContact OG1-CB 3.46Å; T389-Q393 PolarHBondContact OG1-N 2.87Å; T389-Q393 PolarHBondContact OG1-O 3.42Å; Q393-H395 PolarHBondContact OE1-NE2 2.93Å
394	L	91.1	Very high	89.2	Confident	0 Å²	0	31.2 Å²	31.2	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	115.9	168.5	-61.7	177.5	0	0	0	108.8	T61 Q62 I73 V76 C87 F97 M102 V386 F387 A388	T61-L394 WeakPolarHBondContact CA-O 3.42Å; Q62-L394 PolarHBondContact N-O 3.39Å; Q62-L394 PolarHBondContact O-N 2.9Å; I73-L394 HydrophobicContact CD1-CD2 3.81Å; I73-L394 HydrophobicContact CD1-CG 4.29Å; V76-L394 HydrophobicContact CB-CD2 4.42Å; V76-L394 HydrophobicContact CG2-CD2 3.98Å; C87-L394 HydrophobicContact CB-CD1 4.08Å; C87-L394 HydrophobicContact CB-CD2 4.3Å; F97-L394 HydrophobicContact CD2-CD1 3.55Å; F97-L394 HydrophobicContact CE2-CD1 3.3Å; F97-L394 HydrophobicContact CZ-CD1 4.19Å; M102-L394 HydrophobicContact CE-CB 3.68Å; M102-L394 HydrophobicContact CE-CD1 4.35Å; V386-L394 HydrophobicContact CG2-CB 4.45Å; F387-L394 WeakPolarHBondContact O-CA 3.46Å; A388-L394 HydrophobicContact CB-CD2 3.57Å
395	H	92.1	Very high	88.9	Confident	3 Å²	3	34.3 Å²	34.3	1%	0.014	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	121.2	175.2	-55.8	-98	0	0	0	110.2	T61 L366 V386 F387 Q393 Y397	T61-H395 VanDerWaalsContact CG2-CE1 3.46Å; T61-H395 WeakPolarHBondContact CG2-CE1 3.14Å; T61-H395 PolarHBondContact OG1-ND1 2.88Å; L366-H395 HydrophobicContact CD2-CB 4.45Å; V386-H395 WeakPolarHBondContact CA-O 3.26Å; F387-H395 HydrophobicContact CB-CB 4.4Å; F387-H395 PolarHBondContact N-O 3.02Å; F387-H395 PolarHBondContact O-N 2.86Å; Q393-H395 PolarHBondContact OE1-NE2 2.93Å; H395-Y397 HydrophobicContact CB-CD2 4.29Å; H395-Y397 HydrophobicContact CB-CE2 3.84Å
396	L	93.7	Very high	88.7	Confident	0 Å²	0	34.3 Å²	34.3	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	127.6	177	-178.6	64.8	0	0	0	110.6	I59 G60 F78 I85 T100 M102 C384 F406	I59-L396 PolarHBondContact N-O 3.35Å; G60-L396 PolarHBondContact O-N 3.03Å; F78-L396 HydrophobicContact CE1-CD1 4.3Å; F78-L396 HydrophobicContact CZ-CD1 3.96Å; I85-L396 HydrophobicContact CD1-CD1 4.19Å; T100-L396 HydrophobicContact CG2-CD2 4.43Å; M102-L396 HydrophobicContact CE-CB 4.43Å; M102-L396 HydrophobicContact CG-CB 4.23Å; M102-L396 HydrophobicContact CG-CD2 4Å; M102-L396 HydrophobicContact SD-CB 3.99Å; M102-L396 HydrophobicContact SD-CD2 3.92Å; M102-L396 HydrophobicContact SD-CG 4.47Å; C384-L396 HydrophobicContact CB-CD1 4.27Å; L396-F406 HydrophobicContact CD1-CE1 4.05Å; L396-F406 HydrophobicContact CD2-CE1 4.05Å; L396-F406 HydrophobicContact CD2-CZ 4.11Å
397	Y	93.7	Very high	88.3	Confident	0 Å²	0	34.3 Å²	34.3	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	140.8	177	-79.7	-99.2	0	0	0	110.6	Y51 T53 W57 H58 F348 L366 W367 C384 V385 F387 H395	Y51-Y397 HydrophobicContact CD1-CE1 4.23Å; Y51-Y397 HydrophobicContact CE1-CE1 4.41Å; T53-Y397 HydrophobicContact CG2-CD1 4.38Å; T53-Y397 HydrophobicContact CG2-CE1 3.71Å; W57-Y397 CarbonylContact O-C 3.59Å; W57-Y397 VanDerWaalsContact O-CA 3.25Å; W57-Y397 WeakPolarHBondContact O-CA 3.06Å; H58-Y397 HydrophobicContact CB-CD1 4.16Å; H58-Y397 HydrophobicContact CB-CE1 3.56Å; H58-Y397 HydrophobicContact CB-CE2 4.44Å; H58-Y397 AromaticContact CD2-CE2 3.61Å; H58-Y397 AromaticContact CD2-CZ 3.61Å; H58-Y397 AromaticContact CG-CZ 3.94Å; F348-Y397 HydrophobicContact CZ-CD1 4.42Å; L366-Y397 HydrophobicContact CD2-CD2 4.03Å; L366-Y397 HydrophobicContact CD2-CE2 3.4Å; W367-Y397 WeakPolarHBondContact CB-OH 3.37Å; W367-Y397 PolarHBondContact N-OH 3.32Å; C384-Y397 CarbonylContact C-O 3.54Å; C384-Y397 VanDerWaalsContact CA-O 3.3Å; C384-Y397 WeakPolarHBondContact CA-O 3.1Å; V385-Y397 PolarHBondContact N-O 2.99Å; V385-Y397 PolarHBondContact O-N 2.83Å; F387-Y397 AromaticContact CD2-CD2 3.73Å; F387-Y397 HydrophobicContact CD2-CD2 3.73Å; F387-Y397 HydrophobicContact CD2-CE2 4.28Å; F387-Y397 AromaticContact CE2-CD2 3.84Å; F387-Y397 HydrophobicContact CE2-CD2 3.84Å; F387-Y397 HydrophobicContact CE2-CG 4.18Å; H395-Y397 HydrophobicContact CB-CD2 4.29Å; H395-Y397 HydrophobicContact CB-CE2 3.84Å
398	I	93.5	Very high	87.9	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	133.8	-178.7	-59.5	-172.5	0	0	0	110.2	Y56 W57 I59 T100 N383 C384 D400	Y56-I398 CarbonylContact C-O 3.47Å; Y56-I398 WeakPolarHBondContact CA-O 3.07Å; W57-I398 PolarHBondContact N-O 2.73Å; W57-I398 PolarHBondContact O-N 3.33Å; I59-I398 HydrophobicContact CD1-CB 4.33Å; I59-I398 HydrophobicContact CD1-CD1 4.08Å; I59-I398 HydrophobicContact CD1-CG1 4.25Å; I59-I398 HydrophobicContact CG1-CB 4.04Å; I59-I398 HydrophobicContact CG1-CD1 3.55Å; I59-I398 HydrophobicContact CG1-CG1 3.54Å; T100-I398 HydrophobicContact CG2-CD1 3.5Å; T100-I398 VanDerWaalsContact CG2-CD1 3.5Å; N383-I398 WeakPolarHBondContact ND2-CG2 3.47Å; N383-I398 CarbonylContact O-C 3.56Å; N383-I398 WeakPolarHBondContact O-CA 3.28Å; C384-I398 HydrophobicContact CB-CG1 4.38Å; I398-D400 VanDerWaalsContact CG2-O 3.22Å; I398-D400 WeakPolarHBondContact CG2-O 3.37Å
399	H	91.3	Very high	87.4	Confident	102 Å²	102	43 Å²	43	47%	0.472	24%	0.243	S	C	.	.	S	Bend	trans	-73.9	-56.5	179.5	-173.4	57.1	0	0	0	111.5	G55 Y56 N383	G55-H399 PolarHBondContact O-ND1 2.96Å; Y56-H399 HydrophobicContact CD1-CB 3.8Å; Y56-H399 HydrophobicContact CE1-CB 3.7Å; N383-H399 PolarHBondContact O-N 2.53Å; N383-H399 WeakPolarHBondContact OD1-CB 3.42Å
400	D	89.5	Confident	87.2	Confident	55 Å²	55	45.2 Å²	45.2	29%	0.294	26%	0.257	S	S	.	.			trans	-105.9	108.4	174	-173.5	-0.4	0	0	0	111.2	N383 I398 N402 L403	N383-D400 PolarHBondContact ND2-O 3.49Å; N383-D400 WeakPolarHBondContact OD1-CB 3.34Å; N383-D400 PolarHBondContact OD1-N 3.37Å; I398-D400 VanDerWaalsContact CG2-O 3.22Å; I398-D400 WeakPolarHBondContact CG2-O 3.37Å; D400-N402 PolarHBondContact O-N 3.12Å; D400-N402 VanDerWaalsContact O-N 3.16Å; D400-N402 WeakPolarHBondContact OD1-CB 3.5Å; D400-N402 PolarHBondContact OD1-N 3.17Å; D400-N402 PolarHBondContact OD1-ND2 3.34Å; D400-L403 HydrophobicContact CB-CB 4.4Å; D400-L403 HydrophobicContact CB-CD1 4.46Å; D400-L403 PolarHBondContact O-N 3.01Å
401	I	84.3	Confident	87	Confident	59 Å²	59	46.1 Å²	46.1	30%	0.303	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63	-16.8	178.4	-161.4	166.9	0	0	0	113.3	Y50 L403 C404	Y50-I401 HydrophobicContact CD1-CD1 4.46Å; Y50-I401 HydrophobicContact CE1-CD1 4.41Å; I401-L403 VanDerWaalsContact C-N 3.28Å; I401-C404 PolarHBondContact O-SG 3.25Å
402	N	84.9	Confident	86.8	Confident	136 Å²	136	48.9 Å²	48.9	73%	0.727	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.6	-13.3	175.9	-54	-68.5	0	0	0	112.2	D400	D400-N402 PolarHBondContact O-N 3.12Å; D400-N402 VanDerWaalsContact O-N 3.16Å; D400-N402 WeakPolarHBondContact OD1-CB 3.5Å; D400-N402 PolarHBondContact OD1-N 3.17Å; D400-N402 PolarHBondContact OD1-ND2 3.34Å
403	L	83.5	Confident	86.6	Confident	85 Å²	85	49.7 Å²	49.7	45%	0.445	28%	0.281	S	S	.	.			trans	-117	63.7	-177.3	-67.2	178	0	0	0	111.2	N383 D400 I401 Q405	N383-L403 WeakPolarHBondContact ND2-CB 3.5Å; N383-L403 PolarHBondContact ND2-O 2.6Å; D400-L403 HydrophobicContact CB-CB 4.4Å; D400-L403 HydrophobicContact CB-CD1 4.46Å; D400-L403 PolarHBondContact O-N 3.01Å; I401-L403 VanDerWaalsContact C-N 3.28Å; L403-Q405 PolarHBondContact O-N 3.24Å
404	C	82.3	Confident	85.8	Confident	59 Å²	59	50 Å²	50	40%	0.399	28%	0.283	S	S	.	.			trans	-74.5	59.3	178.8	-63.1	0	0	0	0	113.5	T100 I401	T100-C404 HydrophobicContact CG2-CB 3.84Å; I401-C404 PolarHBondContact O-SG 3.25Å
405	Q	87.2	Confident	84.9	Confident	66 Å²	66	55.1 Å²	55.1	31%	0.308	31%	0.305	S	S	.	.			trans	-141.2	149.1	175	63.5	-176.1	35.4	0	0	110.1	E83 N381 L403 N407	E83-Q405 WeakPolarHBondContact OE2-CA 3.15Å; N381-Q405 PolarHBondContact ND2-O 2.78Å; L403-Q405 PolarHBondContact O-N 3.24Å; Q405-N407 VanDerWaalsContact CD-O 3.23Å; Q405-N407 WeakPolarHBondContact CG-O 3.29Å; Q405-N407 PolarHBondContact NE2-O 3.03Å
406	F	89	Confident	83.5	Confident	0 Å²	0	59.6 Å²	59.6	0%	0	34%	0.343	C	S	.	.	S	Bend	trans	-85.4	-36.8	177	-54.4	-33.3	0	0	0	111.6	F78 E83 I85 S99 T100 S379 Q380 N381 C384 L396	F78-F406 HydrophobicContact CD1-CB 4Å; F78-F406 AromaticContact CD1-CD1 3.95Å; F78-F406 HydrophobicContact CD1-CD1 3.95Å; F78-F406 AromaticContact CD1-CD2 3.84Å; F78-F406 HydrophobicContact CD1-CD2 3.84Å; F78-F406 HydrophobicContact CD1-CE1 4.4Å; F78-F406 HydrophobicContact CD1-CE2 4.3Å; F78-F406 AromaticContact CD1-CG 3.66Å; F78-F406 HydrophobicContact CD1-CG 3.66Å; F78-F406 HydrophobicContact CE1-CB 4.37Å; F78-F406 AromaticContact CE1-CD1 3.45Å; F78-F406 HydrophobicContact CE1-CD1 3.45Å; F78-F406 VanDerWaalsContact CE1-CD1 3.45Å; F78-F406 AromaticContact CE1-CD2 3.99Å; F78-F406 HydrophobicContact CE1-CD2 3.99Å; F78-F406 AromaticContact CE1-CE1 3.6Å; F78-F406 HydrophobicContact CE1-CE1 3.6Å; F78-F406 HydrophobicContact CE1-CE2 4.12Å; F78-F406 AromaticContact CE1-CG 3.67Å; F78-F406 HydrophobicContact CE1-CG 3.67Å; F78-F406 AromaticContact CE1-CZ 3.93Å; F78-F406 HydrophobicContact CE1-CZ 3.93Å; F78-F406 HydrophobicContact CZ-CD1 4.38Å; F78-F406 HydrophobicContact CZ-CE1 4.46Å; E83-F406 HydrophobicContact CB-CD2 4.4Å; E83-F406 VanDerWaalsContact CD-N 3.34Å; E83-F406 PolarHBondContact OE1-N 3.49Å; E83-F406 VanDerWaalsContact OE1-N 3.12Å; E83-F406 WeakPolarHBondContact OE2-CD2 3.49Å; E83-F406 WeakPolarHBondContact OE2-CG 3.46Å; E83-F406 PolarHBondContact OE2-N 3.4Å; I85-F406 HydrophobicContact CD1-CE1 4.31Å; I85-F406 HydrophobicContact CD1-CE2 3.82Å; I85-F406 HydrophobicContact CD1-CZ 3.51Å; I85-F406 HydrophobicContact CG1-CD2 4.39Å; I85-F406 HydrophobicContact CG1-CE2 3.73Å; I85-F406 HydrophobicContact CG1-CZ 3.95Å; S99-F406 VanDerWaalsContact O-CZ 3.28Å; S99-F406 WeakPolarHBondContact O-CZ 3.41Å; T100-F406 HydrophobicContact CG2-CE1 3.88Å; T100-F406 HydrophobicContact CG2-CZ 4.3Å; S379-F406 WeakPolarHBondContact CB-O 3.3Å; Q380-F406 PolarHBondContact N-O 2.87Å; N381-F406 PolarHBondContact N-O 3.25Å; N381-F406 PolarHBondContact OD1-O 2.99Å; N381-F406 VanDerWaalsContact OD1-O 3.05Å; C384-F406 HydrophobicContact CB-CD1 3.82Å; C384-F406 HydrophobicContact CB-CE1 4.14Å; L396-F406 HydrophobicContact CD1-CE1 4.05Å; L396-F406 HydrophobicContact CD2-CE1 4.05Å; L396-F406 HydrophobicContact CD2-CZ 4.11Å
407	N	87.5	Confident	81.6	Confident	1 Å²	1	62.1 Å²	62.1	1%	0.005	36%	0.361	C	S	.	.	S	Bend	trans	-111.1	154.2	-176.5	-63.7	-48.6	0	0	0	111.5	D79 P80 E82 E83 Q380 Q405 P410	D79-N407 PolarHBondContact O-ND2 2.76Å; D79-N407 PolarHBondContact O-OD1 3.4Å; P80-N407 PolarHBondContact O-OD1 2.96Å; E82-N407 PolarHBondContact O-ND2 3.21Å; E83-N407 PolarHBondContact OE1-N 3.06Å; Q380-N407 WeakPolarHBondContact CB-OD1 3.46Å; Q405-N407 VanDerWaalsContact CD-O 3.23Å; Q405-N407 WeakPolarHBondContact CG-O 3.29Å; Q405-N407 PolarHBondContact NE2-O 3.03Å; N407-P410 HydrophobicContact CB-CB 4.24Å
408	T	84.9	Confident	79.5	Confident	86 Å²	86	66.8 Å²	66.8	53%	0.528	39%	0.391	S	S	.	.	S	Bend	trans	-71.8	-34.2	177.1	-52.9	0	0	0	0	112
409	S	83.5	Confident	77.3	Confident	98 Å²	98	69.1 Å²	69.1	69%	0.685	40%	0.401	S	S	*	.	S	Bend	trans	-138.9	77.2	177.5	57.6	0	0	0	0	109.4
410	P	84.1	Confident	75.2	Confident	50 Å²	50	65.5 Å²	65.5	33%	0.325	39%	0.387	S	S	.	.	P	Polyproline II helix	trans	-65.9	138.2	-177.3	25.1	-31.9	0	0	0	111.4	L81 E83 N407	L81-P410 CarbonylContact O-C 3.58Å; L81-P410 VanDerWaalsContact O-CA 3.28Å; L81-P410 WeakPolarHBondContact O-CA 3.37Å; E83-P410 HydrophobicContact CG-CB 3.7Å; E83-P410 HydrophobicContact CG-CG 4.13Å; E83-P410 WeakPolarHBondContact OE1-CB 2.98Å; N407-P410 HydrophobicContact CB-CB 4.24Å
411	L	81.8	Confident	73.3	Confident	61 Å²	61	69.1 Å²	69.1	32%	0.319	40%	0.402	S	S	.	.	P	Polyproline II helix	trans	-70.8	145.3	163	-65.7	-178.6	0	0	0	109	L81 E82 P137 T413	L81-L411 HydrophobicContact CB-CD1 4.04Å; L81-L411 HydrophobicContact CB-CG 4.39Å; L81-L411 HydrophobicContact CD1-CD1 4.18Å; L81-L411 HydrophobicContact CG-CD1 4.49Å; L81-L411 PolarHBondContact O-N 3.06Å; E82-L411 HydrophobicContact CG-CB 4.35Å; P137-L411 HydrophobicContact CB-CD1 4.18Å; L411-T413 PolarHBondContact O-N 3.22Å
412	P	76.8	Confident	71.6	Confident	114 Å²	114	69.6 Å²	69.6	74%	0.74	41%	0.411	S	S	*	.	P	Polyproline II helix	trans	-58.6	125.6	174.5	-22.3	33.1	0	0	0	111
413	T	76.6	Confident	69.8	Low	16 Å²	16	63.4 Å²	63.4	10%	0.098	38%	0.377	C	S	.	.	P	Polyproline II helix	trans	-70	129.7	169.2	-57	0	0	0	0	109.2	L84 Y98 Y105 L411 F415	L84-T413 HydrophobicContact CD1-CG2 4.22Å; L84-T413 HydrophobicContact CD2-CG2 4.08Å; L84-T413 HydrophobicContact CG-CG2 4.23Å; Y98-T413 HydrophobicContact CD2-CG2 4.13Å; Y98-T413 HydrophobicContact CE2-CG2 4.29Å; Y105-T413 HydrophobicContact CD2-CG2 4.29Å; Y105-T413 HydrophobicContact CE2-CG2 3.87Å; L411-T413 PolarHBondContact O-N 3.22Å; T413-F415 HydrophobicContact CG2-CE2 4.21Å; T413-F415 HydrophobicContact CG2-CZ 4.14Å; T413-F415 WeakPolarHBondContact O-CD2 3.27Å; T413-F415 WeakPolarHBondContact O-CE2 3.41Å
414	E	71.4	Confident	68	Low	59 Å²	59	65.6 Å²	65.6	28%	0.276	38%	0.38	S	S	.	.	P	Polyproline II helix	trans	-82.6	131.5	177.6	-175.9	172	-169.8	0	0	110.4	Y105 M156 L439	Y105-E414 WeakPolarHBondContact CE2-O 3.48Å; Y105-E414 PolarHBondContact OH-O 2.73Å; M156-E414 HydrophobicContact SD-CG 4.45Å; E414-L439 WeakPolarHBondContact OE2-CD1 2.98Å
415	F	70.4	Confident	66.2	Low	107 Å²	107	65.9 Å²	65.9	47%	0.469	38%	0.381	S	S	.	.			trans	-110.8	154.6	176.6	-66.3	-89.2	0	0	0	110.6	Y98 Y105 T413 S417	Y98-F415 HydrophobicContact CD1-CE1 4.39Å; Y98-F415 AromaticContact CD1-CZ 3.89Å; Y98-F415 HydrophobicContact CD1-CZ 3.89Å; Y98-F415 HydrophobicContact CD2-CE1 4.49Å; Y98-F415 AromaticContact CD2-CZ 3.77Å; Y98-F415 HydrophobicContact CD2-CZ 3.77Å; Y98-F415 AromaticContact CE1-CZ 3.81Å; Y98-F415 HydrophobicContact CE1-CZ 3.81Å; Y98-F415 HydrophobicContact CE2-CE2 4.24Å; Y98-F415 AromaticContact CE2-CZ 3.69Å; Y98-F415 HydrophobicContact CE2-CZ 3.69Å; Y98-F415 HydrophobicContact CG-CE1 4.29Å; Y98-F415 AromaticContact CG-CZ 3.86Å; Y98-F415 HydrophobicContact CG-CZ 3.86Å; Y98-F415 AromaticContact CZ-CZ 3.7Å; Y105-F415 HydrophobicContact CD2-CD1 4.07Å; Y105-F415 AromaticContact CD2-CE1 3.93Å; Y105-F415 HydrophobicContact CD2-CE1 3.93Å; Y105-F415 AromaticContact CE2-CD1 3.99Å; Y105-F415 HydrophobicContact CE2-CD1 3.99Å; Y105-F415 HydrophobicContact CE2-CE1 4.18Å; T413-F415 HydrophobicContact CG2-CE2 4.21Å; T413-F415 HydrophobicContact CG2-CZ 4.14Å; T413-F415 WeakPolarHBondContact O-CD2 3.27Å; T413-F415 WeakPolarHBondContact O-CE2 3.41Å; F415-S417 PolarHBondContact O-N 3.21Å
416	A	62.9	Low	64.2	Low	98 Å²	98	64.4 Å²	64.4	81%	0.81	38%	0.376	S	S	*	.			trans	-54.8	133.2	171.9	0	0	0	0	0	110.1
417	S	53.5	Low	62	Low	53 Å²	53	72 Å²	72	37%	0.371	42%	0.417	S	S	.	.			trans	-58.8	133	177.2	-179.8	0	0	0	0	109.7	F415 F419	F415-S417 PolarHBondContact O-N 3.21Å; S417-F419 PolarHBondContact O-N 3.05Å; S417-F419 PolarHBondContact OG-N 2.98Å
418	P	49.7	Very low	59.7	Low	97 Å²	97	75.2 Å²	75.2	63%	0.63	44%	0.437	S	S	*	.	S	Bend	trans	-72.2	-5.3	172.7	31.9	-35.6	0	0	0	112.3
419	F	49.1	Very low	57.8	Low	50 Å²	50	76.4 Å²	76.4	22%	0.219	44%	0.439	C	S	.	.	S	Bend	trans	-99	151.9	-175.6	-55.1	-60.6	0	0	0	112.4	S417 L423 P425 Y506	S417-F419 PolarHBondContact O-N 3.05Å; S417-F419 PolarHBondContact OG-N 2.98Å; F419-L423 HydrophobicContact CB-CB 4.01Å; F419-L423 WeakPolarHBondContact CD2-O 3.33Å; F419-P425 HydrophobicContact CD2-CG 4.35Å; F419-P425 HydrophobicContact CE2-CG 3.71Å; F419-Y506 HydrophobicContact CD1-CD1 4.05Å; F419-Y506 AromaticContact CE1-CD1 3.46Å; F419-Y506 HydrophobicContact CE1-CD1 3.46Å; F419-Y506 VanDerWaalsContact CE1-CD1 3.46Å; F419-Y506 HydrophobicContact CE1-CE1 4.16Å; F419-Y506 HydrophobicContact CE1-CG 4.47Å; F419-Y506 HydrophobicContact CE2-CD1 4.37Å; F419-Y506 HydrophobicContact CE2-CE1 4.26Å; F419-Y506 AromaticContact CZ-CD1 3.63Å; F419-Y506 HydrophobicContact CZ-CD1 3.63Å; F419-Y506 AromaticContact CZ-CE1 3.88Å; F419-Y506 HydrophobicContact CZ-CE1 3.88Å
420	P	47.1	Very low	55.9	Low	26 Å²	26	80.4 Å²	80.4	17%	0.169	45%	0.447	C	S	.	.	G	3₁₀ helix	trans	-51.3	151.2	168.1	-16.3	23.3	0	0	0	111.7	S422 L423 I509	P420-S422 PolarHBondContact O-N 2.55Å; P420-L423 HydrophobicContact CB-CD1 4.32Å; P420-L423 VanDerWaalsContact O-CB 3.3Å; P420-L423 WeakPolarHBondContact O-CB 3.45Å; P420-L423 WeakPolarHBondContact O-CD1 3.2Å; P420-L423 WeakPolarHBondContact O-CG 3.16Å; P420-L423 PolarHBondContact O-N 3.18Å; P420-I509 HydrophobicContact CB-CD1 3.89Å; P420-I509 HydrophobicContact CG-CD1 3.74Å; P420-I509 HydrophobicContact CG-CG1 3.84Å
421	E	49.2	Very low	53.8	Low	130 Å²	130	82 Å²	82	61%	0.607	46%	0.456	S	S	*	.	G	3₁₀ helix	trans	55	25.6	165.1	-72.1	166.6	160.8	0	0	116.1	L423	E421-L423 HydrophobicContact CB-CG 4.33Å; E421-L423 PolarHBondContact O-N 2.8Å
422	S	48.2	Very low	51.9	Low	70 Å²	70	85.5 Å²	85.5	49%	0.49	48%	0.48	S	S	.	.	G	3₁₀ helix	trans	53.3	35	-173.5	-56.4	0	0	0	0	112.5	P420 W424	P420-S422 PolarHBondContact O-N 2.55Å; S422-W424 VanDerWaalsContact O-CD1 3.31Å; S422-W424 PolarHBondContact O-N 3.38Å
423	L	47.9	Very low	50.2	Low	6 Å²	6	83.1 Å²	83.1	3%	0.031	46%	0.461	C	S	.	.			trans	-61.3	122.2	177.1	-73	170	0	0	0	109.8	F419 P420 E421 N453 L454 I457 A505	F419-L423 HydrophobicContact CB-CB 4.01Å; F419-L423 WeakPolarHBondContact CD2-O 3.33Å; P420-L423 HydrophobicContact CB-CD1 4.32Å; P420-L423 VanDerWaalsContact O-CB 3.3Å; P420-L423 WeakPolarHBondContact O-CB 3.45Å; P420-L423 WeakPolarHBondContact O-CD1 3.2Å; P420-L423 WeakPolarHBondContact O-CG 3.16Å; P420-L423 PolarHBondContact O-N 3.18Å; E421-L423 HydrophobicContact CB-CG 4.33Å; E421-L423 PolarHBondContact O-N 2.8Å; L423-N453 HydrophobicContact CD2-CB 3.48Å; L423-N453 VanDerWaalsContact CD2-CB 3.48Å; L423-L454 HydrophobicContact CB-CD1 3.64Å; L423-L454 HydrophobicContact CD1-CD1 4.08Å; L423-L454 HydrophobicContact CD2-CD1 3.91Å; L423-L454 HydrophobicContact CG-CD1 4.05Å; L423-I457 HydrophobicContact CD2-CD1 4.15Å; L423-A505 HydrophobicContact CD1-CB 4.28Å
424	W	45.7	Very low	48.3	Very low	130 Å²	130	87.2 Å²	87.2	49%	0.492	49%	0.488	S	S	.	.			trans	-85.7	137	178.6	-67.4	94.1	0	0	0	111	S422 T426	S422-W424 VanDerWaalsContact O-CD1 3.31Å; S422-W424 PolarHBondContact O-N 3.38Å; W424-T426 PolarHBondContact O-N 2.83Å
425	P	44.7	Very low	46.8	Very low	65 Å²	65	91.5 Å²	91.5	42%	0.422	52%	0.517	S	S	.	.			trans	-65	101.7	169.8	-18.5	31.1	0	0	0	110.3	F419 N427 Y506	F419-P425 HydrophobicContact CD2-CG 4.35Å; F419-P425 HydrophobicContact CE2-CG 3.71Å; P425-N427 PolarHBondContact O-N 2.9Å; P425-Y506 VanDerWaalsContact CA-OH 3.29Å; P425-Y506 WeakPolarHBondContact CA-OH 3.48Å; P425-Y506 HydrophobicContact CB-CE1 4.24Å; P425-Y506 HydrophobicContact CG-CE1 4.49Å
426	T	44	Very low	45.2	Very low	35 Å²	35	93.1 Å²	93.1	22%	0.215	53%	0.531	C	S	.	.			trans	-82.6	116.1	170.7	75.6	0	0	0	0	108	W424 T428 L454	W424-T426 PolarHBondContact O-N 2.83Å; T426-T428 PolarHBondContact O-N 2.73Å; T426-T428 VanDerWaalsContact O-N 3.15Å; T426-L454 HydrophobicContact CG2-CB 4.33Å
427	N	42.2	Very low	43.8	Very low	159 Å²	159	91.6 Å²	91.6	85%	0.85	51%	0.505	S	S	*	.	S	Bend	trans	-65.1	-16.1	178.2	-76.9	-23.8	0	0	0	113	P425	P425-N427 PolarHBondContact O-N 2.9Å
428	T	40.9	Very low	42.9	Very low	70 Å²	70	93.4 Å²	93.4	43%	0.429	52%	0.517	S	S	.	.	S	Bend	trans	-148.8	148.3	171.7	65.7	0	0	0	0	111.5	T426 Q430 T431	T426-T428 PolarHBondContact O-N 2.73Å; T426-T428 VanDerWaalsContact O-N 3.15Å; T428-Q430 PolarHBondContact O-N 3.3Å; T428-T431 PolarHBondContact O-N 2.86Å; T428-T431 PolarHBondContact O-OG1 3.39Å; T428-T431 WeakPolarHBondContact OG1-CB 3.29Å; T428-T431 WeakPolarHBondContact OG1-CG2 2.94Å; T428-T431 PolarHBondContact OG1-N 2.77Å; T428-T431 VanDerWaalsContact OG1-N 3.14Å; T428-T431 PolarHBondContact OG1-OG1 2.93Å; T428-T431 VanDerWaalsContact OG1-OG1 3.09Å
429	L	43.7	Very low	42.4	Very low	110 Å²	110	91.7 Å²	91.7	58%	0.576	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-12.2	173.6	-79.7	154.3	0	0	0	114
430	Q	43.3	Very low	41.7	Very low	183 Å²	183	93.7 Å²	93.7	86%	0.855	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.7	-2.2	-172.4	-73.1	-175	-26.5	0	0	114.4	T428 T432	T428-Q430 PolarHBondContact O-N 3.3Å; Q430-T432 PolarHBondContact O-N 2.8Å
431	T	40.8	Very low	41.1	Very low	82 Å²	82	98.1 Å²	98.1	50%	0.503	54%	0.535	S	S	.	.	P	Polyproline II helix	trans	-71.6	117.2	176.1	36.7	0	0	0	0	110.1	T428 I433	T428-T431 PolarHBondContact O-N 2.86Å; T428-T431 PolarHBondContact O-OG1 3.39Å; T428-T431 WeakPolarHBondContact OG1-CB 3.29Å; T428-T431 WeakPolarHBondContact OG1-CG2 2.94Å; T428-T431 PolarHBondContact OG1-N 2.77Å; T428-T431 VanDerWaalsContact OG1-N 3.14Å; T428-T431 PolarHBondContact OG1-OG1 2.93Å; T428-T431 VanDerWaalsContact OG1-OG1 3.09Å; T431-I433 PolarHBondContact O-N 3.12Å
432	T	41.9	Very low	40.5	Very low	136 Å²	136	97.6 Å²	97.6	83%	0.834	53%	0.531	S	S	*	.	P	Polyproline II helix	trans	-50.1	127.4	160	15.3	0	0	0	0	109.1	Q430	Q430-T432 PolarHBondContact O-N 2.8Å
433	I	41.5	Very low	39.8	Very low	63 Å²	63	101.8 Å²	101.8	32%	0.323	55%	0.548	S	S	.	.	P	Polyproline II helix	trans	-55.6	135.9	175.8	-57.1	155.1	0	0	0	107.5	T431 V435 Y437 Y450	T431-I433 PolarHBondContact O-N 3.12Å; I433-V435 PolarHBondContact O-N 2.58Å; I433-Y437 HydrophobicContact CG2-CD1 4.49Å; I433-Y450 WeakPolarHBondContact CD1-O 3.21Å
434	P	36.7	Very low	39.4	Very low	103 Å²	103	105.6 Å²	105.6	67%	0.669	57%	0.568	S	S	*	*	P	Polyproline II helix	trans	-56.9	118.4	168.5	-17.2	29.1	0	0	0	107.8	N436	P434-N436 PolarHBondContact O-N 3.32Å
435	V	39.5	Very low	39.1	Very low	148 Å²	148	104.9 Å²	104.9	90%	0.897	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.2	-9.1	-174.9	-166.9	0	0	0	0	112.5	I433	I433-V435 PolarHBondContact O-N 2.58Å
436	N	36	Very low	39	Very low	141 Å²	141	106.9 Å²	106.9	75%	0.754	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-134	44.5	-163.8	-125.7	22.7	0	0	0	113.1	P434 S438	P434-N436 PolarHBondContact O-N 3.32Å; N436-S438 PolarHBondContact O-N 3.15Å
437	Y	34	Very low	38.8	Very low	66 Å²	66	107.4 Å²	107.4	26%	0.259	60%	0.597	S	S	.	*			trans	-73.5	92.2	157.3	77.1	-96.9	0	0	0	107.1	I433 L439 M440 Y450	I433-Y437 HydrophobicContact CG2-CD1 4.49Å; Y437-L439 PolarHBondContact O-N 2.99Å; Y437-M440 HydrophobicContact CD2-CG 4.47Å; Y437-M440 HydrophobicContact CE2-CB 3.97Å; Y437-M440 HydrophobicContact CE2-CG 3.66Å; Y437-Y450 HydrophobicContact CD1-CD1 4.5Å; Y437-Y450 HydrophobicContact CD1-CE1 4.45Å; Y437-Y450 AromaticContact CE1-CD1 3.33Å; Y437-Y450 HydrophobicContact CE1-CD1 3.33Å; Y437-Y450 AromaticContact CE1-CE1 3.44Å; Y437-Y450 HydrophobicContact CE1-CE1 3.44Å; Y437-Y450 VanDerWaalsContact CE1-CE1 3.44Å; Y437-Y450 HydrophobicContact CE1-CG 4.43Å; Y437-Y450 HydrophobicContact CE2-CE1 4.15Å; Y437-Y450 AromaticContact CZ-CD1 3.44Å; Y437-Y450 VanDerWaalsContact CZ-CD1 3.44Å; Y437-Y450 AromaticContact CZ-CE1 3.23Å; Y437-Y450 WeakPolarHBondContact OH-CD1 3.44Å; Y437-Y450 WeakPolarHBondContact OH-CE1 3.44Å
438	S	35	Very low	38.7	Very low	91 Å²	91	105.5 Å²	105.5	64%	0.636	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76	11.1	-166.9	-165	0	0	0	0	114.6	N436	N436-S438 PolarHBondContact O-N 3.15Å
439	L	39.8	Very low	38.6	Very low	62 Å²	62	108 Å²	108	33%	0.325	60%	0.601	S	S	.	*	T	Hydrogen-bonded Turn	trans	-99	-15.2	-164.8	-101.2	150.8	0	0	0	114.8	H140 M156 E414 Y437	H140-L439 HydrophobicContact CB-CD2 4.25Å; M156-L439 HydrophobicContact CE-CD2 3.71Å; E414-L439 WeakPolarHBondContact OE2-CD1 2.98Å; Y437-L439 PolarHBondContact O-N 2.99Å
440	M	33.7	Very low	38.4	Very low	91 Å²	91	105.5 Å²	105.5	45%	0.448	58%	0.584	S	S	.	*			trans	-89.5	108	164.5	-70.5	-66.3	-154.4	0	0	107.2	Y437 F442	Y437-M440 HydrophobicContact CD2-CG 4.47Å; Y437-M440 HydrophobicContact CE2-CB 3.97Å; Y437-M440 HydrophobicContact CE2-CG 3.66Å; M440-F442 HydrophobicContact CB-CB 4.42Å; M440-F442 HydrophobicContact CB-CD2 4.26Å; M440-F442 PolarHBondContact O-N 3.15Å; M440-F442 HydrophobicContact SD-CD2 4.27Å
441	I	35.2	Very low	38.3	Very low	120 Å²	120	97.4 Å²	97.4	62%	0.615	55%	0.549	S	S	*	.			trans	-67.4	37.5	167.2	-49.3	168.8	0	0	0	109.9	L160	L160-I441 HydrophobicContact CD2-CD1 4.47Å
442	F	35.9	Very low	38.6	Very low	119 Å²	119	95.9 Å²	95.9	52%	0.522	54%	0.542	S	S	.	.			trans	-106	82	168.4	-74.4	-77.2	0	0	0	105.7	M440 D444 Y450	M440-F442 HydrophobicContact CB-CB 4.42Å; M440-F442 HydrophobicContact CB-CD2 4.26Å; M440-F442 PolarHBondContact O-N 3.15Å; M440-F442 HydrophobicContact SD-CD2 4.27Å; F442-D444 PolarHBondContact O-N 3.26Å; F442-Y450 PolarHBondContact O-OH 3.27Å
443	D	34.3	Very low	39.1	Very low	158 Å²	158	91.6 Å²	91.6	85%	0.845	51%	0.514	S	S	*	.			trans	-64.3	26.7	171	-82.1	-27.7	0	0	0	113	P445	D443-P445 WeakPolarHBondContact O-CD 3.17Å
444	D	37.8	Very low	39.7	Very low	85 Å²	85	88.9 Å²	88.9	46%	0.455	50%	0.5	S	S	.	.			trans	-103.5	86.2	170.2	-155.1	-11.6	0	0	0	110.5	F442 T446 S447	F442-D444 PolarHBondContact O-N 3.26Å; D444-T446 PolarHBondContact O-N 3.14Å; D444-T446 WeakPolarHBondContact OD1-CB 2.92Å; D444-T446 WeakPolarHBondContact OD1-CG2 3.03Å; D444-T446 PolarHBondContact OD1-N 2.99Å; D444-T446 VanDerWaalsContact OD1-N 3.15Å; D444-T446 PolarHBondContact OD1-OG1 2.78Å; D444-T446 PolarHBondContact OD2-OG1 3.28Å; D444-S447 PolarHBondContact O-N 3.22Å; D444-S447 VanDerWaalsContact O-N 3.15Å
445	P	40	Very low	40.9	Very low	115 Å²	115	85.3 Å²	85.3	75%	0.747	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-3.9	174.4	27.6	-35.2	0	0	0	112.7	D443	D443-P445 WeakPolarHBondContact O-CD 3.17Å
446	T	43.5	Very low	42.1	Very low	108 Å²	108	79.5 Å²	79.5	66%	0.663	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.5	-9.8	175.7	74.7	0	0	0	0	113.9	D444 T448	D444-T446 PolarHBondContact O-N 3.14Å; D444-T446 WeakPolarHBondContact OD1-CB 2.92Å; D444-T446 WeakPolarHBondContact OD1-CG2 3.03Å; D444-T446 PolarHBondContact OD1-N 2.99Å; D444-T446 VanDerWaalsContact OD1-N 3.15Å; D444-T446 PolarHBondContact OD1-OG1 2.78Å; D444-T446 PolarHBondContact OD2-OG1 3.28Å; T446-T448 PolarHBondContact O-N 2.81Å
447	S	39.5	Very low	43.6	Very low	46 Å²	46	75.2 Å²	75.2	32%	0.322	43%	0.426	S	S	.	.			trans	-69.8	116.6	177.9	-175.4	0	0	0	0	111.1	D444 L449 Y450	D444-S447 PolarHBondContact O-N 3.22Å; D444-S447 VanDerWaalsContact O-N 3.15Å; S447-L449 PolarHBondContact O-N 3Å; S447-L449 VanDerWaalsContact O-N 3.07Å; S447-Y450 WeakPolarHBondContact O-CD2 3.13Å
448	T	40.4	Very low	45.3	Very low	119 Å²	119	72.1 Å²	72.1	73%	0.73	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72	2.5	-179.6	52.3	0	0	0	0	114.3	T446 Y450 S452	T446-T448 PolarHBondContact O-N 2.81Å; T448-Y450 VanDerWaalsContact C-N 3.26Å; T448-Y450 PolarHBondContact O-N 2.72Å; T448-S452 PolarHBondContact O-OG 2.68Å
449	L	37.5	Very low	47.1	Very low	123 Å²	123	73.8 Å²	73.8	64%	0.644	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78	-9.4	177.8	-72.5	161	0	0	0	113.1	S447 G451 N453	S447-L449 PolarHBondContact O-N 3Å; S447-L449 VanDerWaalsContact O-N 3.07Å; L449-G451 PolarHBondContact O-N 2.88Å; L449-N453 PolarHBondContact O-ND2 3.44Å
450	Y	40.8	Very low	48.6	Very low	57 Å²	57	74.9 Å²	74.9	22%	0.224	42%	0.419	C	S	.	.	S	Bend	trans	-71.6	105.8	-176.3	-92.7	-104	0	0	0	113.2	I433 Y437 F442 S447 T448 S452	I433-Y450 WeakPolarHBondContact CD1-O 3.21Å; Y437-Y450 HydrophobicContact CD1-CD1 4.5Å; Y437-Y450 HydrophobicContact CD1-CE1 4.45Å; Y437-Y450 AromaticContact CE1-CD1 3.33Å; Y437-Y450 HydrophobicContact CE1-CD1 3.33Å; Y437-Y450 AromaticContact CE1-CE1 3.44Å; Y437-Y450 HydrophobicContact CE1-CE1 3.44Å; Y437-Y450 VanDerWaalsContact CE1-CE1 3.44Å; Y437-Y450 HydrophobicContact CE1-CG 4.43Å; Y437-Y450 HydrophobicContact CE2-CE1 4.15Å; Y437-Y450 AromaticContact CZ-CD1 3.44Å; Y437-Y450 VanDerWaalsContact CZ-CD1 3.44Å; Y437-Y450 AromaticContact CZ-CE1 3.23Å; Y437-Y450 WeakPolarHBondContact OH-CD1 3.44Å; Y437-Y450 WeakPolarHBondContact OH-CE1 3.44Å; F442-Y450 PolarHBondContact O-OH 3.27Å; S447-Y450 WeakPolarHBondContact O-CD2 3.13Å; T448-Y450 VanDerWaalsContact C-N 3.26Å; T448-Y450 PolarHBondContact O-N 2.72Å; Y450-S452 WeakPolarHBondContact O-CB 3.48Å; Y450-S452 PolarHBondContact O-N 3.34Å; Y450-S452 PolarHBondContact O-OG 3.23Å
451	G	40.9	Very low	50.6	Low	12 Å²	12	71.3 Å²	71.3	12%	0.124	40%	0.404	C	S	.	.	S	Bend	trans	58.9	-18.5	158.6	0	0	0	0	0	118.4	L449 N453	L449-G451 PolarHBondContact O-N 2.88Å; G451-N453 PolarHBondContact O-N 3.17Å
452	S	46.5	Very low	52.6	Low	50 Å²	50	66.6 Å²	66.6	35%	0.35	38%	0.383	S	S	.	.	H	α-helix	trans	-81.2	-5.2	176.4	51.7	0	0	0	0	111	T448 Y450 G456	T448-S452 PolarHBondContact O-OG 2.68Å; Y450-S452 WeakPolarHBondContact O-CB 3.48Å; Y450-S452 PolarHBondContact O-N 3.34Å; Y450-S452 PolarHBondContact O-OG 3.23Å; S452-G456 WeakPolarHBondContact O-CA 3.48Å; S452-G456 PolarHBondContact O-N 3.4Å
453	N	52.5	Low	54.8	Low	47 Å²	47	65.8 Å²	65.8	25%	0.251	38%	0.381	S	S	.	.	H	α-helix	trans	-64.6	-45.4	-177.7	-81.6	-12.7	0	0	0	111.4	L423 L449 G451 G456 I457	L423-N453 HydrophobicContact CD2-CB 3.48Å; L423-N453 VanDerWaalsContact CD2-CB 3.48Å; L449-N453 PolarHBondContact O-ND2 3.44Å; G451-N453 PolarHBondContact O-N 3.17Å; N453-G456 CarbonylContact O-C 3.58Å; N453-G456 PolarHBondContact O-N 3.26Å; N453-I457 WeakPolarHBondContact O-CB 3.24Å; N453-I457 WeakPolarHBondContact O-CD1 3.11Å; N453-I457 WeakPolarHBondContact O-CG1 3.11Å; N453-I457 PolarHBondContact O-N 3.07Å
454	L	55.3	Low	57	Low	5 Å²	5	60.4 Å²	60.4	3%	0.026	36%	0.356	C	S	.	.	H	α-helix	trans	-71.2	-45.9	-179.7	-129.3	105.1	0	0	0	112.5	L423 T426 G456 I457 G458 V502 Y506	L423-L454 HydrophobicContact CB-CD1 3.64Å; L423-L454 HydrophobicContact CD1-CD1 4.08Å; L423-L454 HydrophobicContact CD2-CD1 3.91Å; L423-L454 HydrophobicContact CG-CD1 4.05Å; T426-L454 HydrophobicContact CG2-CB 4.33Å; L454-G456 PolarHBondContact O-N 3.23Å; L454-I457 PolarHBondContact O-N 2.75Å; L454-G458 PolarHBondContact O-N 2.64Å; L454-V502 HydrophobicContact CD2-CB 4.43Å; L454-V502 HydrophobicContact CD2-CG1 3.61Å; L454-V502 HydrophobicContact CD2-CG2 4.27Å; L454-Y506 HydrophobicContact CD2-CD2 4.38Å; L454-Y506 HydrophobicContact CD2-CE2 3.62Å
455	A	60.4	Low	59.1	Low	28 Å²	28	57 Å²	57	23%	0.231	34%	0.338	C	S	.	.	H	α-helix	trans	-62.7	-34.8	175.1	0	0	0	0	0	111.3	G458 K459	A455-G458 PolarHBondContact O-N 3.01Å; A455-K459 WeakPolarHBondContact O-CB 3.09Å; A455-K459 PolarHBondContact O-N 3.47Å
456	G	65.3	Low	60.9	Low	26 Å²	26	52.7 Å²	52.7	27%	0.268	31%	0.314	S	S	.	.	H	α-helix	trans	-67.9	-41.5	174.3	0	0	0	0	0	112.4	S452 N453 L454 K459 T460	S452-G456 WeakPolarHBondContact O-CA 3.48Å; S452-G456 PolarHBondContact O-N 3.4Å; N453-G456 CarbonylContact O-C 3.58Å; N453-G456 PolarHBondContact O-N 3.26Å; L454-G456 PolarHBondContact O-N 3.23Å; G456-K459 PolarHBondContact O-N 2.91Å; G456-T460 WeakPolarHBondContact O-CB 3.49Å; G456-T460 VanDerWaalsContact O-CG2 3.26Å; G456-T460 WeakPolarHBondContact O-CG2 3.18Å; G456-T460 PolarHBondContact O-N 2.75Å; G456-T460 PolarHBondContact O-OG1 3.04Å
457	I	66.9	Low	62.6	Low	51 Å²	51	53.2 Å²	53.2	26%	0.262	31%	0.313	S	S	.	.	H	α-helix	trans	-61.1	-46.5	171.4	-71.1	160.8	0	0	0	109.8	L423 N453 L454 T460 A461 A501 A505	L423-I457 HydrophobicContact CD2-CD1 4.15Å; N453-I457 WeakPolarHBondContact O-CB 3.24Å; N453-I457 WeakPolarHBondContact O-CD1 3.11Å; N453-I457 WeakPolarHBondContact O-CG1 3.11Å; N453-I457 PolarHBondContact O-N 3.07Å; L454-I457 PolarHBondContact O-N 2.75Å; I457-T460 WeakPolarHBondContact CA-OG1 3.41Å; I457-T460 PolarHBondContact O-OG1 3.37Å; I457-A461 VanDerWaalsContact O-CB 3.27Å; I457-A461 WeakPolarHBondContact O-CB 3.06Å; I457-A461 PolarHBondContact O-N 3.21Å; I457-A501 HydrophobicContact CG2-CB 3.94Å; I457-A505 HydrophobicContact CD1-CB 4.36Å
458	G	69.4	Low	64.5	Low	1 Å²	1	57.3 Å²	57.3	1%	0.01	33%	0.327	C	S	.	.	H	α-helix	trans	-62.4	-43.4	175.9	0	0	0	0	0	112.6	L454 A455 A461 A462 A498	L454-G458 PolarHBondContact O-N 2.64Å; A455-G458 PolarHBondContact O-N 3.01Å; G458-A461 PolarHBondContact O-N 2.69Å; G458-A462 PolarHBondContact O-N 3.48Å; G458-A498 VanDerWaalsContact O-CB 3.28Å; G458-A498 WeakPolarHBondContact O-CB 3.34Å
459	K	72.6	Confident	66.2	Low	127 Å²	127	52.6 Å²	52.6	55%	0.552	30%	0.297	S	S	*	.	H	α-helix	trans	-66.6	-47	179.5	-178.5	177.5	173.3	-177	0	111.8	A455 G456 A461 A462 E463	A455-K459 WeakPolarHBondContact O-CB 3.09Å; A455-K459 PolarHBondContact O-N 3.47Å; G456-K459 PolarHBondContact O-N 2.91Å; K459-A461 VanDerWaalsContact C-N 3.3Å; K459-A461 PolarHBondContact O-N 2.81Å; K459-A462 WeakPolarHBondContact O-CB 3.13Å; K459-A462 PolarHBondContact O-N 2.59Å; K459-E463 WeakPolarHBondContact CE-OE1 3.3Å; K459-E463 HydrophobicContact CG-CG 4.46Å; K459-E463 WeakPolarHBondContact O-CB 3.4Å; K459-E463 WeakPolarHBondContact O-CG 3.08Å; K459-E463 PolarHBondContact O-N 2.98Å
460	T	72.5	Confident	67.9	Low	84 Å²	84	51.9 Å²	51.9	52%	0.515	29%	0.293	S	S	.	.	H	α-helix	trans	-63.8	-37.1	176.9	50.5	0	0	0	0	111.4	G456 I457 E463 S464	G456-T460 WeakPolarHBondContact O-CB 3.49Å; G456-T460 VanDerWaalsContact O-CG2 3.26Å; G456-T460 WeakPolarHBondContact O-CG2 3.18Å; G456-T460 PolarHBondContact O-N 2.75Å; G456-T460 PolarHBondContact O-OG1 3.04Å; I457-T460 WeakPolarHBondContact CA-OG1 3.41Å; I457-T460 PolarHBondContact O-OG1 3.37Å; T460-E463 PolarHBondContact O-N 3.31Å; T460-S464 WeakPolarHBondContact O-CB 3.29Å; T460-S464 PolarHBondContact O-N 3.5Å
461	A	74.9	Confident	69.6	Low	16 Å²	16	51.8 Å²	51.8	13%	0.132	30%	0.304	C	S	.	.	H	α-helix	trans	-63	-45.4	171.6	0	0	0	0	0	111.9	I457 G458 K459 S464 V465 A501	I457-A461 VanDerWaalsContact O-CB 3.27Å; I457-A461 WeakPolarHBondContact O-CB 3.06Å; I457-A461 PolarHBondContact O-N 3.21Å; G458-A461 PolarHBondContact O-N 2.69Å; K459-A461 VanDerWaalsContact C-N 3.3Å; K459-A461 PolarHBondContact O-N 2.81Å; A461-S464 PolarHBondContact O-N 3.43Å; A461-S464 PolarHBondContact O-OG 3.21Å; A461-V465 PolarHBondContact O-N 3.04Å; A461-A501 HydrophobicContact CB-CB 3.5Å; A461-A501 VanDerWaalsContact CB-CB 3.5Å
462	A	77.3	Confident	71.1	Confident	21 Å²	21	53.6 Å²	53.6	17%	0.174	32%	0.317	C	S	.	.	H	α-helix	trans	-62.3	-42.7	175	0	0	0	0	0	112.6	G458 K459 S464 V465 G466 K494 A498	G458-A462 PolarHBondContact O-N 3.48Å; K459-A462 WeakPolarHBondContact O-CB 3.13Å; K459-A462 PolarHBondContact O-N 2.59Å; A462-S464 VanDerWaalsContact C-N 3.3Å; A462-S464 PolarHBondContact O-N 3.49Å; A462-V465 PolarHBondContact O-N 3.24Å; A462-G466 PolarHBondContact O-N 3.17Å; A462-K494 HydrophobicContact CB-CB 4.03Å; A462-K494 HydrophobicContact CB-CG 4.43Å; A462-K494 WeakPolarHBondContact O-CG 3.42Å; A462-A498 HydrophobicContact CB-CB 4.35Å
463	E	82	Confident	72.2	Confident	103 Å²	103	52.2 Å²	52.2	48%	0.481	31%	0.308	S	S	.	.	H	α-helix	trans	-63.5	-37.1	176.4	-73.9	174.1	176	0	0	111.5	K459 T460 V465 G466 L467	K459-E463 WeakPolarHBondContact CE-OE1 3.3Å; K459-E463 HydrophobicContact CG-CG 4.46Å; K459-E463 WeakPolarHBondContact O-CB 3.4Å; K459-E463 WeakPolarHBondContact O-CG 3.08Å; K459-E463 PolarHBondContact O-N 2.98Å; T460-E463 PolarHBondContact O-N 3.31Å; E463-V465 VanDerWaalsContact C-N 3.32Å; E463-V465 PolarHBondContact O-N 3.21Å; E463-G466 WeakPolarHBondContact O-CA 3.18Å; E463-G466 PolarHBondContact O-N 3.44Å; E463-G466 VanDerWaalsContact O-N 3.08Å; E463-L467 PolarHBondContact O-N 2.84Å
464	S	80.7	Confident	73.1	Confident	45 Å²	45	56.6 Å²	56.6	32%	0.315	33%	0.33	S	S	.	.	H	α-helix	trans	-63	-35.9	176.2	81.9	0	0	0	0	112.9	T460 A461 A462 G466 L467 Q468	T460-S464 WeakPolarHBondContact O-CB 3.29Å; T460-S464 PolarHBondContact O-N 3.5Å; A461-S464 PolarHBondContact O-N 3.43Å; A461-S464 PolarHBondContact O-OG 3.21Å; A462-S464 VanDerWaalsContact C-N 3.3Å; A462-S464 PolarHBondContact O-N 3.49Å; S464-G466 VanDerWaalsContact C-N 3.34Å; S464-L467 PolarHBondContact O-N 3.14Å; S464-Q468 WeakPolarHBondContact O-CB 3.49Å; S464-Q468 VanDerWaalsContact O-CG 3.32Å; S464-Q468 WeakPolarHBondContact O-CG 3.41Å; S464-Q468 PolarHBondContact O-N 3.3Å
465	V	81.8	Confident	73.7	Confident	12 Å²	12	64.7 Å²	64.7	7%	0.073	37%	0.368	C	S	.	.	H	α-helix	trans	-63.9	-42.2	172.4	174.3	0	0	0	0	110.4	A461 A462 E463 L467 Q468 M469 R493 K494 A497	A461-V465 PolarHBondContact O-N 3.04Å; A462-V465 PolarHBondContact O-N 3.24Å; E463-V465 VanDerWaalsContact C-N 3.32Å; E463-V465 PolarHBondContact O-N 3.21Å; V465-L467 VanDerWaalsContact C-N 3.31Å; V465-L467 PolarHBondContact O-N 2.87Å; V465-Q468 PolarHBondContact O-N 2.97Å; V465-M469 HydrophobicContact CG1-CG 4.27Å; V465-M469 HydrophobicContact CG1-SD 4.2Å; V465-M469 WeakPolarHBondContact O-CB 3.28Å; V465-M469 WeakPolarHBondContact O-CG 3.3Å; V465-M469 PolarHBondContact O-N 3Å; V465-R493 HydrophobicContact CG1-CB 3.77Å; V465-K494 HydrophobicContact CB-CG 4.1Å; V465-K494 HydrophobicContact CG1-CG 4.06Å; V465-A497 HydrophobicContact CG2-CB 3.35Å
466	G	78.4	Confident	74.1	Confident	25 Å²	25	67.7 Å²	67.7	26%	0.258	38%	0.377	S	S	.	.	H	α-helix	trans	-55.9	-46.5	174.3	0	0	0	0	0	112.1	A462 E463 S464 M469 L470	A462-G466 PolarHBondContact O-N 3.17Å; E463-G466 WeakPolarHBondContact O-CA 3.18Å; E463-G466 PolarHBondContact O-N 3.44Å; E463-G466 VanDerWaalsContact O-N 3.08Å; S464-G466 VanDerWaalsContact C-N 3.34Å; G466-M469 PolarHBondContact O-N 3.14Å; G466-L470 WeakPolarHBondContact O-CB 3.47Å; G466-L470 PolarHBondContact O-N 3.03Å
467	L	78.9	Confident	74	Confident	120 Å²	120	70.7 Å²	70.7	63%	0.628	39%	0.392	S	S	*	.	H	α-helix	trans	-66.9	-40.8	177.2	-68.5	173.6	0	0	0	112.8	E463 S464 V465 L470 A471	E463-L467 PolarHBondContact O-N 2.84Å; S464-L467 PolarHBondContact O-N 3.14Å; V465-L467 VanDerWaalsContact C-N 3.31Å; V465-L467 PolarHBondContact O-N 2.87Å; L467-L470 PolarHBondContact O-N 3Å; L467-A471 WeakPolarHBondContact O-CB 3.16Å; L467-A471 PolarHBondContact O-N 3.06Å
468	Q	79.7	Confident	73.8	Confident	132 Å²	132	73.3 Å²	73.3	62%	0.617	41%	0.412	S	S	*	.	H	α-helix	trans	-64.1	-40	176.3	-74.7	176.6	10.7	0	0	112	S464 V465 A471 A472	S464-Q468 WeakPolarHBondContact O-CB 3.49Å; S464-Q468 VanDerWaalsContact O-CG 3.32Å; S464-Q468 WeakPolarHBondContact O-CG 3.41Å; S464-Q468 PolarHBondContact O-N 3.3Å; V465-Q468 PolarHBondContact O-N 2.97Å; Q468-A471 PolarHBondContact O-N 2.99Å; Q468-A472 WeakPolarHBondContact O-CB 3.35Å; Q468-A472 PolarHBondContact O-N 3.21Å
469	M	76.4	Confident	73.3	Confident	20 Å²	20	81.4 Å²	81.4	10%	0.099	45%	0.45	C	S	.	.	H	α-helix	trans	-73.4	-35.7	177.7	-67.8	-161.3	69.2	0	0	112.1	V465 G466 A471 A472 S473 F486 V490	V465-M469 HydrophobicContact CG1-CG 4.27Å; V465-M469 HydrophobicContact CG1-SD 4.2Å; V465-M469 WeakPolarHBondContact O-CB 3.28Å; V465-M469 WeakPolarHBondContact O-CG 3.3Å; V465-M469 PolarHBondContact O-N 3Å; G466-M469 PolarHBondContact O-N 3.14Å; M469-A471 VanDerWaalsContact C-N 3.35Å; M469-A472 PolarHBondContact O-N 2.86Å; M469-S473 WeakPolarHBondContact O-CB 3.23Å; M469-S473 PolarHBondContact O-N 3.11Å; M469-F486 HydrophobicContact CE-CD2 4.34Å; M469-F486 HydrophobicContact CE-CE1 4.29Å; M469-F486 HydrophobicContact CE-CE2 3.5Å; M469-F486 HydrophobicContact CE-CZ 3.48Å; M469-F486 VanDerWaalsContact CE-CZ 3.48Å; M469-V490 HydrophobicContact CE-CB 4.37Å; M469-V490 HydrophobicContact CE-CG2 3.34Å; M469-V490 HydrophobicContact SD-CB 3.92Å; M469-V490 HydrophobicContact SD-CG1 4.05Å; M469-V490 HydrophobicContact SD-CG2 3.45Å; M469-V490 WeakPolarHBondContact SD-CG2 3.27Å
470	L	73.5	Confident	72.7	Confident	108 Å²	108	77.6 Å²	77.6	57%	0.565	44%	0.439	S	S	*	.	H	α-helix	trans	-60.4	-45.3	169.5	-176.2	71.8	0	0	0	110.9	G466 L467 A472 S473 L474	G466-L470 WeakPolarHBondContact O-CB 3.47Å; G466-L470 PolarHBondContact O-N 3.03Å; L467-L470 PolarHBondContact O-N 3Å; L470-A472 PolarHBondContact O-N 3.18Å; L470-S473 WeakPolarHBondContact O-CB 3.18Å; L470-S473 PolarHBondContact O-N 3.14Å; L470-S473 PolarHBondContact O-OG 3.04Å; L470-L474 PolarHBondContact O-N 3.27Å
471	A	75.1	Confident	72.2	Confident	54 Å²	54	76.3 Å²	76.3	45%	0.446	43%	0.429	S	S	.	.	H	α-helix	trans	-60.9	-43.5	175.8	0	0	0	0	0	112.2	L467 Q468 M469 S473 L474	L467-A471 WeakPolarHBondContact O-CB 3.16Å; L467-A471 PolarHBondContact O-N 3.06Å; Q468-A471 PolarHBondContact O-N 2.99Å; M469-A471 VanDerWaalsContact C-N 3.35Å; A471-S473 VanDerWaalsContact C-N 3.31Å; A471-S473 PolarHBondContact O-N 3.09Å; A471-L474 PolarHBondContact O-N 2.97Å
472	A	72.5	Confident	71.8	Confident	50 Å²	50	80.5 Å²	80.5	41%	0.413	46%	0.457	S	S	.	.	H	α-helix	trans	-66.2	-32.2	175.8	0	0	0	0	0	112.8	Q468 M469 L470 L474 H475	Q468-A472 WeakPolarHBondContact O-CB 3.35Å; Q468-A472 PolarHBondContact O-N 3.21Å; M469-A472 PolarHBondContact O-N 2.86Å; L470-A472 PolarHBondContact O-N 3.18Å; A472-L474 VanDerWaalsContact C-N 3.29Å; A472-L474 PolarHBondContact O-N 2.92Å; A472-H475 PolarHBondContact O-N 2.69Å
473	S	70.5	Confident	71.6	Confident	21 Å²	21	81.4 Å²	81.4	15%	0.147	46%	0.462	C	S	.	.	H	α-helix	trans	-66	-28.2	179.7	76.7	0	0	0	0	113.7	M469 L470 A471 H475 Q476	M469-S473 WeakPolarHBondContact O-CB 3.23Å; M469-S473 PolarHBondContact O-N 3.11Å; L470-S473 WeakPolarHBondContact O-CB 3.18Å; L470-S473 PolarHBondContact O-N 3.14Å; L470-S473 PolarHBondContact O-OG 3.04Å; A471-S473 VanDerWaalsContact C-N 3.31Å; A471-S473 PolarHBondContact O-N 3.09Å; S473-H475 PolarHBondContact O-N 3.15Å; S473-H475 VanDerWaalsContact O-N 3.09Å; S473-Q476 PolarHBondContact O-N 3.44Å
474	L	70.6	Confident	71.4	Confident	139 Å²	139	80.8 Å²	80.8	73%	0.728	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-20.2	176.7	-82.9	141.3	0	0	0	113.1	L470 A471 A472	L470-L474 PolarHBondContact O-N 3.27Å; A471-L474 PolarHBondContact O-N 2.97Å; A472-L474 VanDerWaalsContact C-N 3.29Å; A472-L474 PolarHBondContact O-N 2.92Å
475	H	69.1	Low	71.3	Confident	175 Å²	175	84.4 Å²	84.4	81%	0.81	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.3	-0.3	177.1	-63.1	-48.9	0	0	0	113.7	A472 S473	A472-H475 PolarHBondContact O-N 2.69Å; S473-H475 PolarHBondContact O-N 3.15Å; S473-H475 VanDerWaalsContact O-N 3.09Å
476	Q	67.7	Low	71.1	Confident	92 Å²	92	86.1 Å²	86.1	43%	0.43	49%	0.49	S	S	.	.	S	Bend	trans	-107.6	149.9	-177.8	-69.8	-172.6	-7.2	0	0	112	S473	S473-Q476 PolarHBondContact O-N 3.44Å
477	P	64.1	Low	71.1	Confident	88 Å²	88	90 Å²	90	57%	0.571	50%	0.504	S	S	*	.			trans	-63.9	141.8	173.9	25.2	-31.8	0	0	0	111	E479 S480	P477-E479 PolarHBondContact O-N 3.38Å; P477-E479 VanDerWaalsContact O-N 3.11Å; P477-S480 PolarHBondContact O-N 2.78Å; P477-S480 PolarHBondContact O-OG 3.46Å; P477-S480 VanDerWaalsContact O-OG 3.05Å
478	P	61.2	Low	71.1	Confident	107 Å²	107	89.2 Å²	89.2	70%	0.695	50%	0.5	S	S	*	.	G	3₁₀ helix	trans	-62	-25.4	-170.9	22.4	-33.2	0	0	0	114.2	S480 L481	P478-S480 VanDerWaalsContact C-N 3.29Å; P478-S480 PolarHBondContact O-N 2.68Å; P478-L481 PolarHBondContact O-N 3.38Å
479	E	59.3	Low	71.1	Confident	170 Å²	170	86.7 Å²	86.7	79%	0.794	49%	0.491	S	S	*	.	G	3₁₀ helix	trans	-62.9	-32.3	-179.1	-68	-178.2	172.4	0	0	112.8	P477 L481 S482	P477-E479 PolarHBondContact O-N 3.38Å; P477-E479 VanDerWaalsContact O-N 3.11Å; E479-L481 VanDerWaalsContact C-N 3.32Å; E479-L481 PolarHBondContact O-N 3.23Å; E479-S482 PolarHBondContact O-OG 3.31Å
480	S	61.3	Low	71.3	Confident	47 Å²	47	86.4 Å²	86.4	33%	0.329	49%	0.49	S	S	.	.	G	3₁₀ helix	trans	-73.5	-22.5	-178.1	64.7	0	0	0	0	113.7	P477 P478	P477-S480 PolarHBondContact O-N 2.78Å; P477-S480 PolarHBondContact O-OG 3.46Å; P477-S480 VanDerWaalsContact O-OG 3.05Å; P478-S480 VanDerWaalsContact C-N 3.29Å; P478-S480 PolarHBondContact O-N 2.68Å
481	L	61	Low	71.5	Confident	57 Å²	57	85.8 Å²	85.8	30%	0.298	48%	0.484	S	S	.	.	G	3₁₀ helix	trans	-78.1	-25.9	-173.2	-61.4	170.7	0	0	0	113.2	P478 E479 S483 F486	P478-L481 PolarHBondContact O-N 3.38Å; E479-L481 VanDerWaalsContact C-N 3.32Å; E479-L481 PolarHBondContact O-N 3.23Å; L481-S483 VanDerWaalsContact C-N 3.33Å; L481-F486 HydrophobicContact CD2-CE1 3.81Å; L481-F486 HydrophobicContact CD2-CZ 3.82Å
482	S	65.8	Low	71.7	Confident	104 Å²	104	91.1 Å²	91.1	73%	0.727	49%	0.493	S	S	*	.	G	3₁₀ helix	trans	-86.2	-2.5	-178.8	67.9	0	0	0	0	114	E479	E479-S482 PolarHBondContact O-OG 3.31Å
483	S	74.6	Confident	72.1	Confident	41 Å²	41	94.8 Å²	94.8	29%	0.287	50%	0.496	S	S	.	.			trans	-67.1	132.6	179.2	177.1	0	0	0	0	111	L481 D485 F486 L487	L481-S483 VanDerWaalsContact C-N 3.33Å; S483-D485 PolarHBondContact O-N 3.07Å; S483-D485 PolarHBondContact OG-N 2.86Å; S483-F486 WeakPolarHBondContact O-CB 3.28Å; S483-F486 PolarHBondContact O-N 3.23Å; S483-L487 PolarHBondContact O-N 3.4Å
484	P	77.6	Confident	72.6	Confident	90 Å²	90	96.3 Å²	96.3	58%	0.584	50%	0.5	S	S	*	.	H	α-helix	trans	-58.4	-30.6	175.3	25.3	-34.4	0	0	0	112.2	F486 L487 N488	P484-F486 VanDerWaalsContact C-N 3.33Å; P484-F486 PolarHBondContact O-N 3.02Å; P484-L487 PolarHBondContact O-N 3.3Å; P484-N488 PolarHBondContact O-N 3.19Å; P484-N488 PolarHBondContact O-ND2 3.11Å
485	D	78	Confident	72.8	Confident	120 Å²	120	92.7 Å²	92.7	64%	0.642	49%	0.49	S	S	*	.	H	α-helix	trans	-67.6	-34.9	177.9	-64.7	-27.2	0	0	0	112	S483 L489	S483-D485 PolarHBondContact O-N 3.07Å; S483-D485 PolarHBondContact OG-N 2.86Å; D485-L489 WeakPolarHBondContact O-CB 3.42Å; D485-L489 PolarHBondContact O-N 3.08Å
486	F	77.6	Confident	73.3	Confident	49 Å²	49	88.8 Å²	88.8	22%	0.215	47%	0.472	C	S	.	.	H	α-helix	trans	-68.2	-43.8	176.6	-178.2	-99.6	0	0	0	110.9	M469 L481 S483 P484 N488 L489 V490	M469-F486 HydrophobicContact CE-CD2 4.34Å; M469-F486 HydrophobicContact CE-CE1 4.29Å; M469-F486 HydrophobicContact CE-CE2 3.5Å; M469-F486 HydrophobicContact CE-CZ 3.48Å; M469-F486 VanDerWaalsContact CE-CZ 3.48Å; L481-F486 HydrophobicContact CD2-CE1 3.81Å; L481-F486 HydrophobicContact CD2-CZ 3.82Å; S483-F486 WeakPolarHBondContact O-CB 3.28Å; S483-F486 PolarHBondContact O-N 3.23Å; P484-F486 VanDerWaalsContact C-N 3.33Å; P484-F486 PolarHBondContact O-N 3.02Å; F486-N488 PolarHBondContact O-N 3.39Å; F486-L489 WeakPolarHBondContact O-CB 3.43Å; F486-L489 PolarHBondContact O-N 2.77Å; F486-V490 HydrophobicContact CD1-CG2 4.02Å; F486-V490 HydrophobicContact CE1-CG2 3.76Å; F486-V490 HydrophobicContact CZ-CG2 4.13Å; F486-V490 WeakPolarHBondContact O-CG2 3.47Å; F486-V490 PolarHBondContact O-N 3.42Å
487	L	78.3	Confident	73.8	Confident	105 Å²	105	85.6 Å²	85.6	55%	0.55	46%	0.461	S	S	.	.	H	α-helix	trans	-61.1	-44.3	176.2	-175.2	63.2	0	0	0	111.6	S483 P484 L489 V490 E491	S483-L487 PolarHBondContact O-N 3.4Å; P484-L487 PolarHBondContact O-N 3.3Å; L487-L489 VanDerWaalsContact C-N 3.31Å; L487-L489 PolarHBondContact O-N 3.35Å; L487-V490 WeakPolarHBondContact O-CB 2.97Å; L487-V490 PolarHBondContact O-N 3.38Å; L487-E491 PolarHBondContact O-N 2.91Å
488	N	78.9	Confident	74.2	Confident	105 Å²	105	81.7 Å²	81.7	56%	0.561	44%	0.436	S	S	*	.	H	α-helix	trans	-61.8	-38.9	175.5	-75.8	-30.1	0	0	0	112.3	P484 F486 R492	P484-N488 PolarHBondContact O-N 3.19Å; P484-N488 PolarHBondContact O-ND2 3.11Å; F486-N488 PolarHBondContact O-N 3.39Å; N488-R492 WeakPolarHBondContact O-CB 3.42Å; N488-R492 PolarHBondContact O-N 3.41Å
489	L	79.9	Confident	74.8	Confident	78 Å²	78	85.1 Å²	85.1	41%	0.408	44%	0.436	S	S	.	.	H	α-helix	trans	-65	-41.1	175.3	-179.2	66.2	0	0	0	112	D485 F486 L487 R492 R493	D485-L489 WeakPolarHBondContact O-CB 3.42Å; D485-L489 PolarHBondContact O-N 3.08Å; F486-L489 WeakPolarHBondContact O-CB 3.43Å; F486-L489 PolarHBondContact O-N 2.77Å; L487-L489 VanDerWaalsContact C-N 3.31Å; L487-L489 PolarHBondContact O-N 3.35Å; L489-R492 PolarHBondContact O-N 3.31Å; L489-R493 WeakPolarHBondContact O-CG 3.26Å; L489-R493 PolarHBondContact O-N 3.17Å
490	V	80.3	Confident	75.5	Confident	15 Å²	15	83.6 Å²	83.6	9%	0.091	43%	0.428	C	S	.	.	H	α-helix	trans	-60.6	-51.6	176.5	174.4	0	0	0	0	110.1	M469 F486 L487 R492 R493 K494	M469-V490 HydrophobicContact CE-CB 4.37Å; M469-V490 HydrophobicContact CE-CG2 3.34Å; M469-V490 HydrophobicContact SD-CB 3.92Å; M469-V490 HydrophobicContact SD-CG1 4.05Å; M469-V490 HydrophobicContact SD-CG2 3.45Å; M469-V490 WeakPolarHBondContact SD-CG2 3.27Å; F486-V490 HydrophobicContact CD1-CG2 4.02Å; F486-V490 HydrophobicContact CE1-CG2 3.76Å; F486-V490 HydrophobicContact CZ-CG2 4.13Å; F486-V490 WeakPolarHBondContact O-CG2 3.47Å; F486-V490 PolarHBondContact O-N 3.42Å; L487-V490 WeakPolarHBondContact O-CB 2.97Å; L487-V490 PolarHBondContact O-N 3.38Å; V490-R492 VanDerWaalsContact C-N 3.31Å; V490-R492 PolarHBondContact O-N 3.14Å; V490-R493 PolarHBondContact O-N 3.01Å; V490-K494 HydrophobicContact CG1-CD 4.33Å; V490-K494 HydrophobicContact CG1-CG 4.45Å; V490-K494 WeakPolarHBondContact O-CG 3.32Å; V490-K494 PolarHBondContact O-N 3.43Å
491	E	78.4	Confident	76	Confident	94 Å²	94	82.6 Å²	82.6	44%	0.439	42%	0.423	S	S	.	.	H	α-helix	trans	-62.3	-39.5	-179.4	-70.9	-54.9	131.7	0	0	112	L487 K494 A495	L487-E491 PolarHBondContact O-N 2.91Å; E491-K494 PolarHBondContact O-N 3.25Å; E491-K494 IonicContact OE1-NZ 2.92Å; E491-K494 PolarHBondContact OE1-NZ 3.39Å; E491-A495 PolarHBondContact O-N 3.01Å
492	R	78.3	Confident	76.4	Confident	167 Å²	167	81 Å²	81	63%	0.63	42%	0.416	S	S	*	.	H	α-helix	trans	-61.8	-44.8	173.6	-176.2	175	177.1	157.7	3.6	112.3	N488 L489 V490 A495 E496	N488-R492 WeakPolarHBondContact O-CB 3.42Å; N488-R492 PolarHBondContact O-N 3.41Å; L489-R492 PolarHBondContact O-N 3.31Å; V490-R492 VanDerWaalsContact C-N 3.31Å; V490-R492 PolarHBondContact O-N 3.14Å; R492-A495 PolarHBondContact O-N 2.79Å; R492-E496 WeakPolarHBondContact CG-OE1 3.29Å; R492-E496 IonicContact CZ-OE1 3.34Å; R492-E496 IonicContact NE-OE1 2.82Å; R492-E496 PolarHBondContact NE-OE1 3.44Å; R492-E496 IonicContact NH2-OE1 2.84Å; R492-E496 WeakPolarHBondContact O-CG 3.37Å; R492-E496 PolarHBondContact O-N 3.48Å
493	R	81.1	Confident	76.4	Confident	126 Å²	126	80.4 Å²	80.4	48%	0.475	40%	0.404	S	S	.	.	H	α-helix	trans	-66.1	-37.3	177.5	-77.9	-171	173	179.5	-0.8	112.9	V465 L489 V490 A495 E496 A497	V465-R493 HydrophobicContact CG1-CB 3.77Å; L489-R493 WeakPolarHBondContact O-CG 3.26Å; L489-R493 PolarHBondContact O-N 3.17Å; V490-R493 PolarHBondContact O-N 3.01Å; R493-A495 VanDerWaalsContact C-N 3.33Å; R493-E496 PolarHBondContact O-N 2.98Å; R493-A497 VanDerWaalsContact O-CB 3.32Å; R493-A497 WeakPolarHBondContact O-CB 3.19Å; R493-A497 PolarHBondContact O-N 3.18Å
494	K	80.4	Confident	76	Confident	54 Å²	54	82.8 Å²	82.8	24%	0.235	42%	0.417	C	S	.	.	H	α-helix	trans	-59.1	-46.2	172.4	-73.1	-180	-178.1	166.9	0	110.9	A462 V465 V490 E491 A497 A498	A462-K494 HydrophobicContact CB-CB 4.03Å; A462-K494 HydrophobicContact CB-CG 4.43Å; A462-K494 WeakPolarHBondContact O-CG 3.42Å; V465-K494 HydrophobicContact CB-CG 4.1Å; V465-K494 HydrophobicContact CG1-CG 4.06Å; V490-K494 HydrophobicContact CG1-CD 4.33Å; V490-K494 HydrophobicContact CG1-CG 4.45Å; V490-K494 WeakPolarHBondContact O-CG 3.32Å; V490-K494 PolarHBondContact O-N 3.43Å; E491-K494 PolarHBondContact O-N 3.25Å; E491-K494 IonicContact OE1-NZ 2.92Å; E491-K494 PolarHBondContact OE1-NZ 3.39Å; K494-A497 PolarHBondContact O-N 2.73Å; K494-A498 VanDerWaalsContact O-CB 3.31Å; K494-A498 WeakPolarHBondContact O-CB 3.33Å; K494-A498 PolarHBondContact O-N 2.97Å
495	A	76.7	Confident	75.3	Confident	62 Å²	62	79.4 Å²	79.4	51%	0.512	40%	0.397	S	S	.	.	H	α-helix	trans	-64.6	-42.7	178	0	0	0	0	0	112.4	E491 R492 R493 R499	E491-A495 PolarHBondContact O-N 3.01Å; R492-A495 PolarHBondContact O-N 2.79Å; R493-A495 VanDerWaalsContact C-N 3.33Å; A495-R499 WeakPolarHBondContact O-CB 3.36Å; A495-R499 PolarHBondContact O-N 2.97Å
496	E	78.8	Confident	74.3	Confident	93 Å²	93	76.9 Å²	76.9	44%	0.435	38%	0.378	S	S	.	.	H	α-helix	trans	-63.3	-45.7	176.4	-73.5	169.1	-177.3	0	0	111.5	R492 R493 R499 E500	R492-E496 WeakPolarHBondContact CG-OE1 3.29Å; R492-E496 IonicContact CZ-OE1 3.34Å; R492-E496 IonicContact NE-OE1 2.82Å; R492-E496 PolarHBondContact NE-OE1 3.44Å; R492-E496 IonicContact NH2-OE1 2.84Å; R492-E496 WeakPolarHBondContact O-CG 3.37Å; R492-E496 PolarHBondContact O-N 3.48Å; R493-E496 PolarHBondContact O-N 2.98Å; E496-R499 PolarHBondContact O-N 3.45Å; E496-E500 PolarHBondContact O-N 3.26Å
497	A	77.3	Confident	73.3	Confident	25 Å²	25	81.3 Å²	81.3	21%	0.207	40%	0.398	C	S	.	.	H	α-helix	trans	-67.1	-41.4	178.6	0	0	0	0	0	113.1	V465 R493 K494 R499 E500 A501	V465-A497 HydrophobicContact CG2-CB 3.35Å; R493-A497 VanDerWaalsContact O-CB 3.32Å; R493-A497 WeakPolarHBondContact O-CB 3.19Å; R493-A497 PolarHBondContact O-N 3.18Å; K494-A497 PolarHBondContact O-N 2.73Å; A497-R499 VanDerWaalsContact C-N 3.3Å; A497-R499 PolarHBondContact O-N 3.46Å; A497-E500 PolarHBondContact O-N 2.82Å; A497-A501 WeakPolarHBondContact O-CB 3.07Å; A497-A501 PolarHBondContact O-N 2.66Å
498	A	73.5	Confident	72.1	Confident	6 Å²	6	81 Å²	81	5%	0.05	40%	0.402	C	S	.	.	H	α-helix	trans	-59.1	-44.4	174.1	0	0	0	0	0	111	G458 A462 K494 A501 V502	G458-A498 VanDerWaalsContact O-CB 3.28Å; G458-A498 WeakPolarHBondContact O-CB 3.34Å; A462-A498 HydrophobicContact CB-CB 4.35Å; K494-A498 VanDerWaalsContact O-CB 3.31Å; K494-A498 WeakPolarHBondContact O-CB 3.33Å; K494-A498 PolarHBondContact O-N 2.97Å; A498-A501 PolarHBondContact O-N 3.37Å; A498-V502 WeakPolarHBondContact O-CB 3.31Å; A498-V502 VanDerWaalsContact O-CG2 3.28Å; A498-V502 WeakPolarHBondContact O-CG2 3.42Å; A498-V502 PolarHBondContact O-N 3.12Å
499	R	73.5	Confident	70.8	Confident	180 Å²	180	79 Å²	79	68%	0.679	39%	0.39	S	S	*	.	H	α-helix	trans	-62.8	-46	177.2	178.8	179.8	173.6	153.7	1.2	112.1	A495 E496 A497 V502 L503	A495-R499 WeakPolarHBondContact O-CB 3.36Å; A495-R499 PolarHBondContact O-N 2.97Å; E496-R499 PolarHBondContact O-N 3.45Å; A497-R499 VanDerWaalsContact C-N 3.3Å; A497-R499 PolarHBondContact O-N 3.46Å; R499-V502 PolarHBondContact O-N 2.91Å; R499-L503 HydrophobicContact CG-CD1 3.94Å; R499-L503 HydrophobicContact CG-CG 4.45Å; R499-L503 WeakPolarHBondContact O-CB 3.48Å; R499-L503 WeakPolarHBondContact O-CG 3.38Å; R499-L503 PolarHBondContact O-N 2.99Å
500	E	74.3	Confident	69.3	Low	137 Å²	137	84 Å²	84	64%	0.64	41%	0.412	S	S	*	.	H	α-helix	trans	-65.1	-40.1	178.8	-77.2	-157.7	158.5	0	0	112.8	E496 A497 L503 T504	E496-E500 PolarHBondContact O-N 3.26Å; A497-E500 PolarHBondContact O-N 2.82Å; E500-L503 PolarHBondContact O-N 3.04Å; E500-T504 WeakPolarHBondContact O-CB 3.49Å; E500-T504 PolarHBondContact O-N 3.32Å; E500-T504 PolarHBondContact O-OG1 3.11Å
501	A	71.6	Confident	67.6	Low	26 Å²	26	91.7 Å²	91.7	22%	0.215	44%	0.44	C	S	.	.	H	α-helix	trans	-62.3	-45	176.9	0	0	0	0	0	111.4	I457 A461 A497 A498 T504 A505	I457-A501 HydrophobicContact CG2-CB 3.94Å; A461-A501 HydrophobicContact CB-CB 3.5Å; A461-A501 VanDerWaalsContact CB-CB 3.5Å; A497-A501 WeakPolarHBondContact O-CB 3.07Å; A497-A501 PolarHBondContact O-N 2.66Å; A498-A501 PolarHBondContact O-N 3.37Å; A501-T504 PolarHBondContact O-N 2.91Å; A501-A505 PolarHBondContact O-N 3.07Å
502	V	68.5	Low	66.2	Low	25 Å²	25	90.9 Å²	90.9	15%	0.152	44%	0.439	C	S	.	.	H	α-helix	trans	-61.8	-48.5	175	164.8	0	0	0	0	111.3	L454 A498 R499 T504 A505 Y506	L454-V502 HydrophobicContact CD2-CB 4.43Å; L454-V502 HydrophobicContact CD2-CG1 3.61Å; L454-V502 HydrophobicContact CD2-CG2 4.27Å; A498-V502 WeakPolarHBondContact O-CB 3.31Å; A498-V502 VanDerWaalsContact O-CG2 3.28Å; A498-V502 WeakPolarHBondContact O-CG2 3.42Å; A498-V502 PolarHBondContact O-N 3.12Å; R499-V502 PolarHBondContact O-N 2.91Å; V502-T504 VanDerWaalsContact C-N 3.25Å; V502-T504 PolarHBondContact O-N 3.36Å; V502-A505 WeakPolarHBondContact O-CB 3.28Å; V502-A505 PolarHBondContact O-N 3.16Å; V502-A505 VanDerWaalsContact O-N 3.14Å; V502-Y506 HydrophobicContact CG1-CD2 3.68Å; V502-Y506 HydrophobicContact CG1-CE2 3.42Å; V502-Y506 VanDerWaalsContact CG1-CE2 3.42Å; V502-Y506 WeakPolarHBondContact O-CD2 3.39Å; V502-Y506 PolarHBondContact O-N 3.45Å
503	L	66.3	Low	64.9	Low	91 Å²	91	89.3 Å²	89.3	48%	0.476	44%	0.443	S	S	.	.	H	α-helix	trans	-61.6	-33.9	177.7	-76.4	171.1	0	0	0	112.9	R499 E500 Y506 K507	R499-L503 HydrophobicContact CG-CD1 3.94Å; R499-L503 HydrophobicContact CG-CG 4.45Å; R499-L503 WeakPolarHBondContact O-CB 3.48Å; R499-L503 WeakPolarHBondContact O-CG 3.38Å; R499-L503 PolarHBondContact O-N 2.99Å; E500-L503 PolarHBondContact O-N 3.04Å; L503-Y506 PolarHBondContact O-N 3.24Å; L503-K507 PolarHBondContact O-N 3.44Å
504	T	67.4	Low	63.3	Low	91 Å²	91	91.2 Å²	91.2	56%	0.558	45%	0.451	S	S	*	.	H	α-helix	trans	-70.4	-38.8	175.9	-55.6	0	0	0	0	111.1	E500 A501 V502 Y506 K507	E500-T504 WeakPolarHBondContact O-CB 3.49Å; E500-T504 PolarHBondContact O-N 3.32Å; E500-T504 PolarHBondContact O-OG1 3.11Å; A501-T504 PolarHBondContact O-N 2.91Å; V502-T504 VanDerWaalsContact C-N 3.25Å; V502-T504 PolarHBondContact O-N 3.36Å; T504-Y506 PolarHBondContact O-N 3.27Å; T504-K507 WeakPolarHBondContact O-CB 3.34Å; T504-K507 PolarHBondContact O-N 2.94Å; T504-K507 VanDerWaalsContact O-N 3.17Å
505	A	61.9	Low	61.8	Low	19 Å²	19	95.9 Å²	95.9	16%	0.157	47%	0.468	C	S	.	.	H	α-helix	trans	-65.7	-28	174	0	0	0	0	0	112.8	L423 I457 A501 V502 K507	L423-A505 HydrophobicContact CD1-CB 4.28Å; I457-A505 HydrophobicContact CD1-CB 4.36Å; A501-A505 PolarHBondContact O-N 3.07Å; V502-A505 WeakPolarHBondContact O-CB 3.28Å; V502-A505 PolarHBondContact O-N 3.16Å; V502-A505 VanDerWaalsContact O-N 3.14Å; A505-K507 VanDerWaalsContact C-N 3.3Å
506	Y	57	Low	60.4	Low	66 Å²	66	93.5 Å²	93.5	26%	0.259	45%	0.446	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.3	-14.3	173.6	-85.2	-66.4	0	0	0	114.3	F419 P425 L454 V502 L503 T504	F419-Y506 HydrophobicContact CD1-CD1 4.05Å; F419-Y506 AromaticContact CE1-CD1 3.46Å; F419-Y506 HydrophobicContact CE1-CD1 3.46Å; F419-Y506 VanDerWaalsContact CE1-CD1 3.46Å; F419-Y506 HydrophobicContact CE1-CE1 4.16Å; F419-Y506 HydrophobicContact CE1-CG 4.47Å; F419-Y506 HydrophobicContact CE2-CD1 4.37Å; F419-Y506 HydrophobicContact CE2-CE1 4.26Å; F419-Y506 AromaticContact CZ-CD1 3.63Å; F419-Y506 HydrophobicContact CZ-CD1 3.63Å; F419-Y506 AromaticContact CZ-CE1 3.88Å; F419-Y506 HydrophobicContact CZ-CE1 3.88Å; P425-Y506 VanDerWaalsContact CA-OH 3.29Å; P425-Y506 WeakPolarHBondContact CA-OH 3.48Å; P425-Y506 HydrophobicContact CB-CE1 4.24Å; P425-Y506 HydrophobicContact CG-CE1 4.49Å; L454-Y506 HydrophobicContact CD2-CD2 4.38Å; L454-Y506 HydrophobicContact CD2-CE2 3.62Å; V502-Y506 HydrophobicContact CG1-CD2 3.68Å; V502-Y506 HydrophobicContact CG1-CE2 3.42Å; V502-Y506 VanDerWaalsContact CG1-CE2 3.42Å; V502-Y506 WeakPolarHBondContact O-CD2 3.39Å; V502-Y506 PolarHBondContact O-N 3.45Å; L503-Y506 PolarHBondContact O-N 3.24Å; T504-Y506 PolarHBondContact O-N 3.27Å
507	K	57.4	Low	58.9	Low	143 Å²	143	91 Å²	91	62%	0.622	44%	0.438	S	S	*	.	S	Bend	trans	-67.6	128	177.7	-72.2	-174.9	177.2	-178.1	0	108.8	L503 T504 A505 I509	L503-K507 PolarHBondContact O-N 3.44Å; T504-K507 WeakPolarHBondContact O-CB 3.34Å; T504-K507 PolarHBondContact O-N 2.94Å; T504-K507 VanDerWaalsContact O-N 3.17Å; A505-K507 VanDerWaalsContact C-N 3.3Å; K507-I509 PolarHBondContact O-N 3.5Å
508	P	53.6	Low	57.4	Low	97 Å²	97	93.7 Å²	93.7	63%	0.63	45%	0.449	S	S	*	.			trans	-56.2	142.6	170.8	23.3	-30.8	0	0	0	108.8	E510	P508-E510 PolarHBondContact O-N 3.18Å
509	I	51.3	Low	56	Low	64 Å²	64	95.5 Å²	95.5	33%	0.328	46%	0.464	S	S	.	.			trans	-64.5	108.4	176.1	-66.6	162.3	0	0	0	107	P420 K507 Y511	P420-I509 HydrophobicContact CB-CD1 3.89Å; P420-I509 HydrophobicContact CG-CD1 3.74Å; P420-I509 HydrophobicContact CG-CG1 3.84Å; K507-I509 PolarHBondContact O-N 3.5Å; I509-Y511 HydrophobicContact CB-CE2 4.46Å; I509-Y511 HydrophobicContact CG2-CD1 4Å; I509-Y511 HydrophobicContact CG2-CD2 4.21Å; I509-Y511 HydrophobicContact CG2-CE1 4.05Å; I509-Y511 HydrophobicContact CG2-CE2 4.25Å; I509-Y511 HydrophobicContact CG2-CG 4.09Å; I509-Y511 PolarHBondContact O-N 2.94Å
510	E	48.6	Very low	54.6	Low	183 Å²	183	89.6 Å²	89.6	86%	0.855	45%	0.446	S	S	*	.			trans	-69.8	105.3	157.2	-73.9	179.1	-176	0	0	106.2	P508 D512	P508-E510 PolarHBondContact O-N 3.18Å; E510-D512 PolarHBondContact O-N 3.45Å
511	Y	44.9	Very low	53.3	Low	177 Å²	177	85 Å²	85	69%	0.694	43%	0.427	S	S	*	.			trans	-66.3	99.2	172.5	-69.5	-83.4	0	0	0	108.3	I509	I509-Y511 HydrophobicContact CB-CE2 4.46Å; I509-Y511 HydrophobicContact CG2-CD1 4Å; I509-Y511 HydrophobicContact CG2-CD2 4.21Å; I509-Y511 HydrophobicContact CG2-CE1 4.05Å; I509-Y511 HydrophobicContact CG2-CE2 4.25Å; I509-Y511 HydrophobicContact CG2-CG 4.09Å; I509-Y511 PolarHBondContact O-N 2.94Å
512	D	47.1	Very low	51.8	Low	77 Å²	77	88.7 Å²	88.7	41%	0.412	45%	0.449	S	S	.	.			trans	-91.2	103.3	166.6	-168.7	6.7	0	0	0	106.3	E510 Y514 R515	E510-D512 PolarHBondContact O-N 3.45Å; D512-Y514 PolarHBondContact O-N 3.45Å; D512-R515 PolarHBondContact O-N 3.06Å; D512-R515 VanDerWaalsContact O-N 3.1Å; D512-R515 IonicContact OD2-CZ 3.89Å; D512-R515 IonicContact OD2-NE 2.62Å; D512-R515 IonicContact OD2-NH1 2.76Å; D512-R515 PolarHBondContact OD2-NH1 3Å
513	D	51.1	Low	50.5	Low	133 Å²	133	94 Å²	94	71%	0.711	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50	-13.1	-168.9	-73.5	-27.5	0	0	0	115.3
514	Y	48.8	Very low	49.4	Very low	166 Å²	166	92.4 Å²	92.4	65%	0.651	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.6	-2.2	-173.9	-54.3	-70	0	0	0	115.4	D512	D512-Y514 PolarHBondContact O-N 3.45Å
515	R	48.5	Very low	48.2	Very low	153 Å²	153	91.6 Å²	91.6	58%	0.577	46%	0.464	S	S	*	.	B	Isolated β-bridge	trans	-116.3	131	-174.5	-70	-176.8	171.7	135	-11.3	113.5	D512 N520 A586	D512-R515 PolarHBondContact O-N 3.06Å; D512-R515 VanDerWaalsContact O-N 3.1Å; D512-R515 IonicContact OD2-CZ 3.89Å; D512-R515 IonicContact OD2-NE 2.62Å; D512-R515 IonicContact OD2-NH1 2.76Å; D512-R515 PolarHBondContact OD2-NH1 3Å; R515-N520 PolarHBondContact O-ND2 2.94Å; R515-A586 HydrophobicContact CB-CB 4.27Å; R515-A586 HydrophobicContact CG-CB 4.46Å
516	F	47.1	Very low	47	Very low	12 Å²	12	100.3 Å²	100.3	5%	0.053	49%	0.494	C	S	.	.			trans	-76.8	137.7	175.7	179.4	-84	0	0	0	112.4	L578 A581 A586 V587 W597	F516-L578 HydrophobicContact CZ-CD1 4.23Å; F516-A581 HydrophobicContact CD1-CB 3.17Å; F516-A581 HydrophobicContact CE1-CB 3.04Å; F516-A581 HydrophobicContact CG-CB 4.13Å; F516-A581 HydrophobicContact CZ-CB 3.89Å; F516-A586 WeakPolarHBondContact O-CA 3.43Å; F516-V587 WeakPolarHBondContact CB-O 3.46Å; F516-V587 PolarHBondContact N-O 3.48Å; F516-W597 HydrophobicContact CB-CH2 3.68Å; F516-W597 HydrophobicContact CB-CZ2 4.45Å; F516-W597 HydrophobicContact CB-CZ3 4.33Å; F516-W597 HydrophobicContact CD2-CE3 4.3Å; F516-W597 AromaticContact CD2-CH2 3.7Å; F516-W597 HydrophobicContact CD2-CH2 3.7Å; F516-W597 AromaticContact CD2-CZ3 3.51Å; F516-W597 HydrophobicContact CD2-CZ3 3.51Å; F516-W597 HydrophobicContact CE2-CZ3 4.36Å; F516-W597 HydrophobicContact CG-CH2 4.17Å; F516-W597 HydrophobicContact CG-CZ3 4.4Å
517	S	48.5	Very low	46.2	Very low	40 Å²	40	100.4 Å²	100.4	28%	0.28	50%	0.503	S	S	.	.			trans	-147.4	156.6	155.5	89.9	0	0	0	0	109.9	A519 N520	S517-A519 PolarHBondContact O-N 3.33Å; S517-A519 WeakPolarHBondContact OG-CB 3.37Å; S517-A519 PolarHBondContact OG-N 3.49Å; S517-N520 WeakPolarHBondContact O-CB 3.22Å; S517-N520 PolarHBondContact O-N 2.97Å; S517-N520 PolarHBondContact OG-OD1 2.91Å
518	L	45.1	Very low	45.2	Very low	81 Å²	81	97.9 Å²	97.9	42%	0.424	50%	0.501	S	S	.	.	G	3₁₀ helix	trans	-57.6	-27	175.7	-102.1	146.2	0	0	0	112.8	N520 V521 I524 N582	L518-N520 PolarHBondContact O-N 3.37Å; L518-V521 PolarHBondContact O-N 2.88Å; L518-I524 HydrophobicContact CD2-CG2 3.81Å; L518-N582 VanDerWaalsContact CD1-OD1 3.28Å; L518-N582 WeakPolarHBondContact CD1-OD1 3.22Å
519	A	42.9	Very low	44.4	Very low	45 Å²	45	98.4 Å²	98.4	37%	0.372	51%	0.505	S	S	.	.	G	3₁₀ helix	trans	-66.2	-17.8	176.4	0	0	0	0	0	113.3	S517 V521	S517-A519 PolarHBondContact O-N 3.33Å; S517-A519 WeakPolarHBondContact OG-CB 3.37Å; S517-A519 PolarHBondContact OG-N 3.49Å; A519-V521 VanDerWaalsContact C-N 3.29Å; A519-V521 PolarHBondContact O-N 3.37Å
520	N	45.8	Very low	43.9	Very low	56 Å²	56	101.6 Å²	101.6	30%	0.299	52%	0.521	S	S	.	.	G	3₁₀ helix	trans	-81.6	-6.2	-179.4	-61.2	26.8	0	0	0	113	R515 S517 L518	R515-N520 PolarHBondContact O-ND2 2.94Å; S517-N520 WeakPolarHBondContact O-CB 3.22Å; S517-N520 PolarHBondContact O-N 2.97Å; S517-N520 PolarHBondContact OG-OD1 2.91Å; L518-N520 PolarHBondContact O-N 3.37Å
521	V	45.8	Very low	43.2	Very low	40 Å²	40	101.7 Å²	101.7	24%	0.242	52%	0.519	C	S	.	.			trans	-136.9	78.1	-177	-166.4	0	0	0	0	110.1	L518 A519 F523 I524	L518-V521 PolarHBondContact O-N 2.88Å; A519-V521 VanDerWaalsContact C-N 3.29Å; A519-V521 PolarHBondContact O-N 3.37Å; V521-F523 PolarHBondContact O-N 2.77Å; V521-I524 HydrophobicContact CB-CB 4.19Å; V521-I524 HydrophobicContact CB-CD1 4.02Å; V521-I524 HydrophobicContact CB-CG1 4.29Å; V521-I524 HydrophobicContact CG1-CB 3.88Å; V521-I524 HydrophobicContact CG1-CD1 4.01Å; V521-I524 HydrophobicContact CG1-CG1 3.84Å; V521-I524 HydrophobicContact CG2-CD1 4.33Å; V521-I524 PolarHBondContact O-N 3.27Å; V521-I524 VanDerWaalsContact O-N 3.14Å
522	P	41.2	Very low	42.7	Very low	103 Å²	103	97.2 Å²	97.2	67%	0.669	51%	0.507	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-20.7	-178	20.6	-30	0	0	0	113.4
523	F	41.4	Very low	42.1	Very low	136 Å²	136	99.3 Å²	99.3	60%	0.596	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.4	6.7	-177.9	-49.7	-68.1	0	0	0	114.3	V521 A525 Y526 P527	V521-F523 PolarHBondContact O-N 2.77Å; F523-A525 VanDerWaalsContact C-N 3.34Å; F523-A525 PolarHBondContact O-N 2.92Å; F523-Y526 CarbonylContact O-C 3.59Å; F523-Y526 PolarHBondContact O-N 2.82Å; F523-P527 VanDerWaalsContact O-CA 3.24Å; F523-P527 WeakPolarHBondContact O-CA 3.34Å
524	I	42.9	Very low	41.6	Very low	59 Å²	59	98.4 Å²	98.4	30%	0.303	52%	0.524	S	S	.	.	S	Bend	trans	-67.9	-34.9	-176.3	-126.3	168.2	0	0	0	112.4	L518 V521	L518-I524 HydrophobicContact CD2-CG2 3.81Å; V521-I524 HydrophobicContact CB-CB 4.19Å; V521-I524 HydrophobicContact CB-CD1 4.02Å; V521-I524 HydrophobicContact CB-CG1 4.29Å; V521-I524 HydrophobicContact CG1-CB 3.88Å; V521-I524 HydrophobicContact CG1-CD1 4.01Å; V521-I524 HydrophobicContact CG1-CG1 3.84Å; V521-I524 HydrophobicContact CG2-CD1 4.33Å; V521-I524 PolarHBondContact O-N 3.27Å; V521-I524 VanDerWaalsContact O-N 3.14Å
525	A	41.1	Very low	41	Very low	74 Å²	74	96.6 Å²	96.6	61%	0.612	53%	0.526	S	S	*	.	S	Bend	trans	-78	-30.8	-179.5	0	0	0	0	0	112.1	F523	F523-A525 VanDerWaalsContact C-N 3.34Å; F523-A525 PolarHBondContact O-N 2.92Å
526	Y	37.9	Very low	40.4	Very low	202 Å²	202	95.4 Å²	95.4	79%	0.792	53%	0.531	S	S	*	.	S	Bend	trans	-141.4	81.9	179.4	-61.6	-78.2	0	0	0	108.6	F523	F523-Y526 CarbonylContact O-C 3.59Å; F523-Y526 PolarHBondContact O-N 2.82Å
527	P	39	Very low	39.6	Very low	68 Å²	68	103.6 Å²	103.6	44%	0.442	57%	0.569	S	S	.	*	P	Polyproline II helix	trans	-58.9	144.9	172.7	23.7	-31.9	0	0	0	108.6	F523	F523-P527 VanDerWaalsContact O-CA 3.24Å; F523-P527 WeakPolarHBondContact O-CA 3.34Å
528	P	36.4	Very low	38.9	Very low	90 Å²	90	107.4 Å²	107.4	58%	0.584	59%	0.585	S	S	*	*	P	Polyproline II helix	trans	-52.4	139.9	173.5	21.5	-31.1	0	0	0	109.1	I530	P528-I530 PolarHBondContact O-N 3.44Å; P528-I530 VanDerWaalsContact O-N 3.14Å
529	P	37.2	Very low	38.1	Very low	108 Å²	108	112.8 Å²	112.8	70%	0.701	61%	0.608	S	S	*	*	P	Polyproline II helix	trans	-54.3	124.2	-176.5	20.7	-31.4	0	0	0	109.9	F531	P529-F531 PolarHBondContact O-N 3.45Å
530	I	40.6	Very low	37.5	Very low	130 Å²	130	116.6 Å²	116.6	67%	0.667	62%	0.622	S	S	*	*			trans	-71.2	111.3	173.9	-60.5	166.9	0	0	0	106.2	P528 D532	P528-I530 PolarHBondContact O-N 3.44Å; P528-I530 VanDerWaalsContact O-N 3.14Å; I530-D532 VanDerWaalsContact C-N 3.34Å; I530-D532 PolarHBondContact O-N 2.67Å
531	F	33.6	Very low	36.7	Very low	186 Å²	186	123.4 Å²	123.4	82%	0.816	65%	0.652	S	S	*	*			trans	-69.3	97.7	166	-82	-87.1	0	0	0	107.5	P529 P533	P529-F531 PolarHBondContact O-N 3.45Å; F531-P533 WeakPolarHBondContact O-CD 3.28Å
532	D	34.6	Very low	35.9	Very low	82 Å²	82	127 Å²	127	44%	0.439	68%	0.68	S	S	.	*			trans	-85.9	104	172.3	-164.1	-16	0	0	0	108.2	I530 T534 N535	I530-D532 VanDerWaalsContact C-N 3.34Å; I530-D532 PolarHBondContact O-N 2.67Å; D532-T534 PolarHBondContact O-N 3.26Å; D532-T534 VanDerWaalsContact O-N 3.12Å; D532-T534 PolarHBondContact OD1-N 2.82Å; D532-T534 PolarHBondContact OD1-OG1 2.86Å; D532-N535 PolarHBondContact O-N 2.97Å
533	P	35.3	Very low	35.1	Very low	121 Å²	121	126.5 Å²	126.5	79%	0.786	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.4	-11	-177.1	29.3	-34.8	0	0	0	112.3	F531	F531-P533 WeakPolarHBondContact O-CD 3.28Å
534	T	41	Very low	34.2	Very low	114 Å²	114	125.3 Å²	125.3	70%	0.699	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.2	-22.5	-176.1	65.3	0	0	0	0	113.9	D532	D532-T534 PolarHBondContact O-N 3.26Å; D532-T534 VanDerWaalsContact O-N 3.12Å; D532-T534 PolarHBondContact OD1-N 2.82Å; D532-T534 PolarHBondContact OD1-OG1 2.86Å
535	N	34.9	Very low	33.7	Very low	128 Å²	128	128.2 Å²	128.2	68%	0.684	70%	0.701	S	S	*	*	S	Bend	trans	-101.1	3.5	-168	-150.5	14.3	0	0	0	115.4	D532 Q537	D532-N535 PolarHBondContact O-N 2.97Å; N535-Q537 PolarHBondContact O-N 3.1Å
536	N	35.3	Very low	33.3	Very low	128 Å²	128	134.8 Å²	134.8	68%	0.684	71%	0.709	S	S	*	*			trans	-95.8	78.7	169.8	-76.8	-8.3	0	0	0	110.3	I538	N536-I538 PolarHBondContact O-N 2.74Å
537	Q	31.6	Very low	32.7	Very low	185 Å²	185	135 Å²	135	86%	0.864	72%	0.715	S	S	*	*			trans	-79.5	49	155	-71.7	-167.9	-11.1	0	0	110.4	N535	N535-Q537 PolarHBondContact O-N 3.1Å
538	I	33.7	Very low	32.2	Very low	120 Å²	120	138.1 Å²	138.1	62%	0.615	73%	0.733	S	S	*	*			trans	-97.4	112	172.6	-60.6	177.5	0	0	0	106.5	N536 D540	N536-I538 PolarHBondContact O-N 2.74Å; I538-D540 HydrophobicContact CG2-CB 4.45Å; I538-D540 PolarHBondContact O-N 2.91Å
539	E	28.9	Very low	31.9	Very low	193 Å²	193	142.7 Å²	142.7	90%	0.902	74%	0.743	S	S	*	*			trans	-65.3	29.2	-176.1	-63.5	-179.6	136.8	0	0	114.8
540	D	29.7	Very low	31.5	Very low	125 Å²	125	142.2 Å²	142.2	67%	0.668	73%	0.734	S	S	*	*			trans	-100.2	108.9	176.6	-76.5	-36.1	0	0	0	109.7	I538 S542	I538-D540 HydrophobicContact CG2-CB 4.45Å; I538-D540 PolarHBondContact O-N 2.91Å; D540-S542 PolarHBondContact O-N 3.34Å
541	E	28.1	Very low	31	Very low	200 Å²	200	143 Å²	143	94%	0.935	74%	0.74	S	S	*	*	S	Bend	trans	-62.8	42.9	-179	-66.9	-173.2	136.5	0	0	114.4
542	S	28.6	Very low	30.9	Very low	116 Å²	116	139.4 Å²	139.4	81%	0.811	73%	0.733	S	S	*	*			trans	-146.2	48	-174.2	-62.8	0	0	0	0	113.5	D540	D540-S542 PolarHBondContact O-N 3.34Å
543	S	24.6	Very low	30.7	Very low	92 Å²	92	143.6 Å²	143.6	64%	0.643	75%	0.752	S	S	*	*			trans	-155.5	72.4	162.4	64.2	0	0	0	0	111.9	I545	S543-I545 PolarHBondContact O-N 3.36Å
544	C	23.6	Very low	30.4	Very low	111 Å²	111	142.3 Å²	142.3	75%	0.75	75%	0.745	S	S	*	*			trans	-80.2	89.4	167	-86.1	0	0	0	0	109.4	V116	V116-C544 HydrophobicContact CG1-CB 4.43Å
545	I	31.5	Very low	30.1	Very low	120 Å²	120	141.8 Å²	141.8	62%	0.615	74%	0.742	S	S	*	*			trans	-120.9	109.7	-179.1	-69.5	179.2	0	0	0	108.6	S543	S543-I545 PolarHBondContact O-N 3.36Å
546	W	32.3	Very low	30.1	Very low	211 Å²	211	138.3 Å²	138.3	80%	0.799	73%	0.728	S	S	*	*			trans	76.2	73.6	146.9	-52.9	5.9	0	0	0	118.7
547	K	27.1	Very low	30.2	Very low	207 Å²	207	140.6 Å²	140.6	90%	0.9	74%	0.74	S	S	*	*			trans	-114.9	5.8	170	-107.8	-179.8	-177.7	173.8	0	117.3
548	T	27.8	Very low	30.4	Very low	134 Å²	134	138.5 Å²	138.5	82%	0.822	72%	0.724	S	S	*	*	S	Bend	trans	-150.9	119.4	-177.8	25.4	0	0	0	0	112.1
549	K	29.3	Very low	30.5	Very low	185 Å²	185	136.1 Å²	136.1	80%	0.804	72%	0.717	S	S	*	*			trans	79.4	70	175.5	-72.6	179.4	161.8	-179.7	0	117
550	L	28.5	Very low	31	Very low	98 Å²	98	135 Å²	135	51%	0.513	71%	0.711	S	S	.	*			trans	-87.6	-11.6	157.5	-145	90.4	0	0	0	112.6	T552	L550-T552 PolarHBondContact O-N 3.43Å
551	D	30.5	Very low	31.5	Very low	148 Å²	148	135.4 Å²	135.4	79%	0.791	71%	0.713	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72	26.6	-172.5	-63.6	-16.5	0	0	0	114.9
552	T	32.4	Very low	32	Very low	110 Å²	110	131.1 Å²	131.1	68%	0.675	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	-147.2	6	176.6	-8.6	0	0	0	0	115.5	L550	L550-T552 PolarHBondContact O-N 3.43Å
553	M	29.2	Very low	32.4	Very low	169 Å²	169	128.3 Å²	128.3	83%	0.833	67%	0.672	S	S	*	*	S	Bend	trans	-103.6	6.2	-170.9	-87.6	-173.6	142.5	0	0	117
554	C	30	Very low	32.9	Very low	94 Å²	94	130.4 Å²	130.4	64%	0.635	67%	0.672	S	S	*	*			trans	-131.6	95.6	168.7	-80.3	0	0	0	0	110	N563	C554-N563 PolarHBondContact O-ND2 3.38Å
555	T	35.1	Very low	33.7	Very low	104 Å²	104	128.7 Å²	128.7	64%	0.638	66%	0.661	S	S	*	*			trans	-113.9	57.1	166.5	66.4	0	0	0	0	109.1
556	S	34.7	Very low	34.2	Very low	54 Å²	54	126.8 Å²	126.8	38%	0.378	65%	0.65	S	S	.	*			trans	-64.2	145.4	152.2	45.4	0	0	0	0	108.6	W558	S556-W558 VanDerWaalsContact CB-CD1 3.49Å; S556-W558 PolarHBondContact O-N 2.77Å; S556-W558 VanDerWaalsContact OG-CD1 3.27Å
557	D	37.4	Very low	34.7	Very low	176 Å²	176	125 Å²	125	94%	0.941	65%	0.649	S	S	*	*	S	Bend	trans	-63.1	19.3	174.8	-70	-28.2	0	0	0	114.3
558	W	35.4	Very low	35.5	Very low	142 Å²	142	119 Å²	119	54%	0.538	62%	0.624	S	S	.	*	S	Bend	trans	-69.3	135.8	164.3	-65.4	110	0	0	0	108.4	S556 L562	S556-W558 VanDerWaalsContact CB-CD1 3.49Å; S556-W558 PolarHBondContact O-N 2.77Å; S556-W558 VanDerWaalsContact OG-CD1 3.27Å; W558-L562 HydrophobicContact CB-CB 4.21Å; W558-L562 HydrophobicContact CB-CD1 4.39Å; W558-L562 HydrophobicContact CE3-CD1 3.86Å
559	P	35.5	Very low	36.4	Very low	70 Å²	70	117.9 Å²	117.9	46%	0.455	62%	0.616	S	S	.	*			trans	-59.4	148.9	179.8	29.3	-37.1	0	0	0	110.6	D561 L562	P559-D561 VanDerWaalsContact C-OD1 3.31Å; P559-D561 WeakPolarHBondContact CB-OD1 3.21Å; P559-D561 PolarHBondContact O-N 2.88Å; P559-L562 HydrophobicContact CG-CD1 4.26Å; P559-L562 PolarHBondContact O-N 3.45Å
560	E	40.3	Very low	37.2	Very low	170 Å²	170	113.5 Å²	113.5	79%	0.794	60%	0.6	S	S	*	*	G	3₁₀ helix	trans	-54.8	-26.4	-167.2	-74.5	-166.2	166	0	0	114.3	L562 N563	E560-L562 PolarHBondContact O-N 2.84Å; E560-N563 PolarHBondContact O-N 3.31Å
561	D	39.7	Very low	38.5	Very low	132 Å²	132	113.8 Å²	113.8	71%	0.706	60%	0.597	S	S	*	*	G	3₁₀ helix	trans	-61.7	-17.7	174	48.5	-47	0	0	0	114	P559	P559-D561 VanDerWaalsContact C-OD1 3.31Å; P559-D561 WeakPolarHBondContact CB-OD1 3.21Å; P559-D561 PolarHBondContact O-N 2.88Å
562	L	38.4	Very low	39.8	Very low	111 Å²	111	115.6 Å²	115.6	58%	0.581	60%	0.6	S	S	*	*	G	3₁₀ helix	trans	-99.5	-12.1	172	-76.9	160.4	0	0	0	113.8	W558 P559 E560	W558-L562 HydrophobicContact CB-CB 4.21Å; W558-L562 HydrophobicContact CB-CD1 4.39Å; W558-L562 HydrophobicContact CE3-CD1 3.86Å; P559-L562 HydrophobicContact CG-CD1 4.26Å; P559-L562 PolarHBondContact O-N 3.45Å; E560-L562 PolarHBondContact O-N 2.84Å
563	N	36.4	Very low	41.2	Very low	57 Å²	57	111.9 Å²	111.9	31%	0.305	58%	0.577	S	S	.	*	T	Hydrogen-bonded Turn	trans	-89.7	-9.9	-178.6	-79.4	-16.9	0	0	0	113.6	C554 E560 S565	C554-N563 PolarHBondContact O-ND2 3.38Å; E560-N563 PolarHBondContact O-N 3.31Å; N563-S565 PolarHBondContact O-N 2.94Å
564	E	36.4	Very low	43	Very low	136 Å²	136	108 Å²	108	64%	0.636	56%	0.56	S	S	*	*	S	Bend	trans	-60.5	113.8	166.9	-77.4	-169.5	171.6	0	0	108.7	Q566	E564-Q566 HydrophobicContact CB-CG 4.24Å; E564-Q566 PolarHBondContact O-N 3.44Å; E564-Q566 PolarHBondContact OE2-NE2 2.82Å
565	S	40.2	Very low	44.6	Very low	74 Å²	74	107.5 Å²	107.5	52%	0.517	56%	0.556	S	S	.	*			trans	-68.5	64.6	171.9	64.4	0	0	0	0	109.5	N563 H567	N563-S565 PolarHBondContact O-N 2.94Å; S565-H567 VanDerWaalsContact C-N 3.29Å; S565-H567 PolarHBondContact O-N 3.08Å
566	Q	40.8	Very low	46.2	Very low	81 Å²	81	107.5 Å²	107.5	38%	0.379	55%	0.552	S	S	.	*			trans	-65.5	102.9	164.5	-64.5	-163.4	-1	0	0	104.3	E564 K568	E564-Q566 HydrophobicContact CB-CG 4.24Å; E564-Q566 PolarHBondContact O-N 3.44Å; E564-Q566 PolarHBondContact OE2-NE2 2.82Å; Q566-K568 HydrophobicContact CB-CD 4.28Å; Q566-K568 HydrophobicContact CB-CG 3.89Å; Q566-K568 PolarHBondContact O-N 3.36Å; Q566-K568 VanDerWaalsContact OE1-NZ 3.12Å
567	H	42.9	Very low	47.7	Very low	172 Å²	172	106.1 Å²	106.1	80%	0.796	54%	0.54	S	S	*	.			trans	-58	78.2	167	-102	-81.3	0	0	0	107.5	S565 V569	S565-H567 VanDerWaalsContact C-N 3.29Å; S565-H567 PolarHBondContact O-N 3.08Å; H567-V569 PolarHBondContact O-N 2.76Å
568	K	44.5	Very low	49	Very low	83 Å²	83	100.3 Å²	100.3	36%	0.361	51%	0.509	S	S	.	.			trans	-87	114.3	176.1	-69	-177.7	-174.2	178.5	0	105.2	Q566 M570 Y600	Q566-K568 HydrophobicContact CB-CD 4.28Å; Q566-K568 HydrophobicContact CB-CG 3.89Å; Q566-K568 PolarHBondContact O-N 3.36Å; Q566-K568 VanDerWaalsContact OE1-NZ 3.12Å; K568-M570 PolarHBondContact O-N 3.05Å; K568-Y600 HydrophobicContact CB-CD1 3.26Å; K568-Y600 HydrophobicContact CB-CD2 3.89Å; K568-Y600 HydrophobicContact CB-CE1 3.87Å; K568-Y600 HydrophobicContact CB-CE2 4.34Å; K568-Y600 HydrophobicContact CB-CG 3.31Å; K568-Y600 HydrophobicContact CD-CD2 3.97Å; K568-Y600 HydrophobicContact CD-CG 3.89Å; K568-Y600 HydrophobicContact CG-CG 4.18Å; K568-Y600 WeakPolarHBondContact O-CD1 3.18Å; K568-Y600 WeakPolarHBondContact O-CE1 3.48Å
569	V	47.7	Very low	50.3	Low	109 Å²	109	97.2 Å²	97.2	66%	0.661	50%	0.503	S	S	*	.			trans	-61.4	123.6	169.6	179.5	0	0	0	0	106.9	H567 K571	H567-V569 PolarHBondContact O-N 2.76Å; V569-K571 PolarHBondContact O-N 3.18Å; V569-K571 VanDerWaalsContact O-N 3.11Å
570	M	45.4	Very low	51.6	Low	93 Å²	93	97 Å²	97	46%	0.458	50%	0.498	S	S	.	.	B	Isolated β-bridge	trans	-62.3	114.9	174.5	-167.3	169.4	90.5	0	0	107.4	K568 P599 Y600	K568-M570 PolarHBondContact O-N 3.05Å; M570-P599 HydrophobicContact CG-CG 4.39Å; M570-Y600 HydrophobicContact CB-CD1 4.32Å; M570-Y600 HydrophobicContact CB-CE1 3.97Å; M570-Y600 HydrophobicContact CG-CE1 4.48Å
571	K	56.3	Low	52.4	Low	104 Å²	104	89 Å²	89	45%	0.452	46%	0.461	S	S	.	.	P	Polyproline II helix	trans	-67.7	148.1	171.6	-66.9	-176.7	172.4	171.9	0	107.9	V569 V573 P599 S601	V569-K571 PolarHBondContact O-N 3.18Å; V569-K571 VanDerWaalsContact O-N 3.11Å; K571-V573 PolarHBondContact O-N 3.46Å; K571-P599 WeakPolarHBondContact CA-O 3.37Å; K571-P599 HydrophobicContact CB-CB 4.49Å; K571-P599 VanDerWaalsContact CB-O 3.23Å; K571-P599 WeakPolarHBondContact CB-O 3.45Å; K571-P599 PolarHBondContact N-O 2.97Å; K571-P599 WeakPolarHBondContact O-CG 3.47Å; K571-S601 VanDerWaalsContact CE-CB 3.5Å; K571-S601 VanDerWaalsContact CE-OG 3.3Å; K571-S601 WeakPolarHBondContact CE-OG 3.37Å; K571-S601 PolarHBondContact NZ-OG 3.35Å; K571-S601 VanDerWaalsContact NZ-OG 3.08Å
572	E	57.6	Low	53	Low	186 Å²	186	87.2 Å²	87.2	87%	0.869	45%	0.451	S	S	*	.	P	Polyproline II helix	trans	-56.8	136.2	168.8	-160	169.3	-173.5	0	0	108.9	D574	E572-D574 PolarHBondContact O-N 3.4Å
573	V	61.4	Low	53.8	Low	32 Å²	32	91.7 Å²	91.7	19%	0.194	46%	0.461	C	S	.	.	P	Polyproline II helix	trans	-61.8	132.9	177.2	178.1	0	0	0	0	107.6	K571 P575 W593 P599	K571-V573 PolarHBondContact O-N 3.46Å; V573-P575 WeakPolarHBondContact O-CD 3.32Å; V573-W593 HydrophobicContact CG1-CH2 4.41Å; V573-P599 HydrophobicContact CG2-CG 4.25Å
574	D	66.4	Low	54.8	Low	87 Å²	87	96 Å²	96	47%	0.465	48%	0.477	S	S	.	.	P	Polyproline II helix	trans	-49.2	118.3	178	-176.2	-12.7	0	0	0	109.9	E572 D576 L577 L578	E572-D574 PolarHBondContact O-N 3.4Å; D574-D576 PolarHBondContact O-N 3.38Å; D574-D576 VanDerWaalsContact O-N 3.12Å; D574-D576 PolarHBondContact OD1-N 3.02Å; D574-D576 VanDerWaalsContact OD1-N 3.07Å; D574-L577 HydrophobicContact CB-CB 4.16Å; D574-L577 WeakPolarHBondContact O-CA 3.36Å; D574-L577 WeakPolarHBondContact O-CB 3.45Å; D574-L577 PolarHBondContact O-N 3Å; D574-L578 PolarHBondContact O-N 3.01Å; D574-L578 VanDerWaalsContact O-N 3.11Å
575	P	64.6	Low	55.4	Low	84 Å²	84	100.2 Å²	100.2	55%	0.545	49%	0.487	S	S	.	.	H	α-helix	trans	-60.3	-25.8	-174.9	23.3	-34.5	0	0	0	112.1	V573 N579	V573-P575 WeakPolarHBondContact O-CD 3.32Å; P575-N579 WeakPolarHBondContact O-CB 3.45Å; P575-N579 VanDerWaalsContact O-CG 3.25Å; P575-N579 PolarHBondContact O-N 2.9Å; P575-N579 PolarHBondContact O-ND2 2.91Å
576	D	68.1	Low	56	Low	104 Å²	104	98.7 Å²	98.7	56%	0.556	48%	0.478	S	S	*	.	H	α-helix	trans	-71.2	-32.3	175	-80.8	-15.3	0	0	0	112.2	D574 N580	D574-D576 PolarHBondContact O-N 3.38Å; D574-D576 VanDerWaalsContact O-N 3.12Å; D574-D576 PolarHBondContact OD1-N 3.02Å; D574-D576 VanDerWaalsContact OD1-N 3.07Å; D576-N580 WeakPolarHBondContact O-CB 3.49Å; D576-N580 VanDerWaalsContact O-CG 3.24Å; D576-N580 PolarHBondContact O-N 3.41Å; D576-N580 PolarHBondContact O-ND2 2.89Å
577	L	67.2	Low	56.9	Low	25 Å²	25	96.2 Å²	96.2	13%	0.131	47%	0.469	C	S	.	.	H	α-helix	trans	-72.5	-41.6	175.9	-152.7	149.7	0	0	0	110.2	D574 N580 A581 V587 P590 W593	D574-L577 HydrophobicContact CB-CB 4.16Å; D574-L577 WeakPolarHBondContact O-CA 3.36Å; D574-L577 WeakPolarHBondContact O-CB 3.45Å; D574-L577 PolarHBondContact O-N 3Å; L577-N580 PolarHBondContact O-N 3.26Å; L577-A581 VanDerWaalsContact O-CB 3.29Å; L577-A581 WeakPolarHBondContact O-CB 3.4Å; L577-A581 PolarHBondContact O-N 3.42Å; L577-V587 HydrophobicContact CD2-CG1 4.29Å; L577-V587 HydrophobicContact CG-CG1 4.38Å; L577-P590 HydrophobicContact CD1-CG 3.59Å; L577-W593 HydrophobicContact CD1-CH2 3.75Å; L577-W593 HydrophobicContact CD1-CZ2 4.35Å; L577-W593 HydrophobicContact CD1-CZ3 4.27Å; L577-W593 HydrophobicContact CD2-CH2 4.25Å; L577-W593 HydrophobicContact CD2-CZ3 4.3Å
578	L	63.5	Low	57.7	Low	55 Å²	55	98.5 Å²	98.5	29%	0.288	47%	0.47	S	S	.	.	H	α-helix	trans	-63.4	-44.3	173	-168.9	67.3	0	0	0	111.5	F516 D574 A581 N582	F516-L578 HydrophobicContact CZ-CD1 4.23Å; D574-L578 PolarHBondContact O-N 3.01Å; D574-L578 VanDerWaalsContact O-N 3.11Å; L578-A581 PolarHBondContact O-N 3.31Å; L578-N582 WeakPolarHBondContact O-CB 3.48Å; L578-N582 PolarHBondContact O-N 3.01Å; L578-N582 PolarHBondContact O-ND2 3.46Å
579	N	62.1	Low	58.2	Low	76 Å²	76	96.2 Å²	96.2	41%	0.406	46%	0.46	S	S	.	.	H	α-helix	trans	-63.3	-42.7	174.7	-83.1	-30.9	0	0	0	112	P575 A581 N582 R583	P575-N579 WeakPolarHBondContact O-CB 3.45Å; P575-N579 VanDerWaalsContact O-CG 3.25Å; P575-N579 PolarHBondContact O-N 2.9Å; P575-N579 PolarHBondContact O-ND2 2.91Å; N579-A581 VanDerWaalsContact C-N 3.32Å; N579-N582 PolarHBondContact O-N 2.92Å; N579-R583 WeakPolarHBondContact O-CB 3.19Å; N579-R583 WeakPolarHBondContact O-CG 3.46Å; N579-R583 PolarHBondContact O-N 3.08Å
580	N	64.6	Low	59	Low	65 Å²	65	92 Å²	92	35%	0.348	44%	0.435	S	S	.	.	H	α-helix	trans	-66.1	-36.8	176.6	-84.1	-47	0	0	0	111.9	D576 L577 R583 K584 V587	D576-N580 WeakPolarHBondContact O-CB 3.49Å; D576-N580 VanDerWaalsContact O-CG 3.24Å; D576-N580 PolarHBondContact O-N 3.41Å; D576-N580 PolarHBondContact O-ND2 2.89Å; L577-N580 PolarHBondContact O-N 3.26Å; N580-R583 PolarHBondContact O-N 2.88Å; N580-K584 VanDerWaalsContact O-CB 3.28Å; N580-K584 WeakPolarHBondContact O-CB 3.32Å; N580-K584 PolarHBondContact O-N 3.4Å; N580-V587 VanDerWaalsContact C-CG2 3.5Å; N580-V587 HydrophobicContact CB-CG2 3.83Å
581	A	56.1	Low	59.8	Low	4 Å²	4	93.7 Å²	93.7	3%	0.033	45%	0.453	C	S	.	.	H	α-helix	trans	-67.6	-44.8	175.4	0	0	0	0	0	112.4	F516 L577 L578 N579 R583 K584 R585 V587	F516-A581 HydrophobicContact CD1-CB 3.17Å; F516-A581 HydrophobicContact CE1-CB 3.04Å; F516-A581 HydrophobicContact CG-CB 4.13Å; F516-A581 HydrophobicContact CZ-CB 3.89Å; L577-A581 VanDerWaalsContact O-CB 3.29Å; L577-A581 WeakPolarHBondContact O-CB 3.4Å; L577-A581 PolarHBondContact O-N 3.42Å; L578-A581 PolarHBondContact O-N 3.31Å; N579-A581 VanDerWaalsContact C-N 3.32Å; A581-R583 PolarHBondContact O-N 3.28Å; A581-K584 PolarHBondContact O-N 2.88Å; A581-R585 CarbonylContact O-C 3.57Å; A581-R585 WeakPolarHBondContact O-CA 3.36Å; A581-R585 PolarHBondContact O-N 2.79Å; A581-V587 HydrophobicContact CB-CG2 4.1Å
582	N	52.2	Low	59.9	Low	93 Å²	93	95.6 Å²	95.6	50%	0.497	46%	0.464	S	S	.	.	H	α-helix	trans	-58.9	-38.3	172.6	-76.1	-20.3	0	0	0	111.4	L518 L578 N579	L518-N582 VanDerWaalsContact CD1-OD1 3.28Å; L518-N582 WeakPolarHBondContact CD1-OD1 3.22Å; L578-N582 WeakPolarHBondContact O-CB 3.48Å; L578-N582 PolarHBondContact O-N 3.01Å; L578-N582 PolarHBondContact O-ND2 3.46Å; N579-N582 PolarHBondContact O-N 2.92Å
583	R	55.8	Low	59.8	Low	206 Å²	206	88.5 Å²	88.5	78%	0.777	43%	0.429	S	S	*	.	H	α-helix	trans	-76.2	-41.6	178.9	-73.5	176.6	-176.5	-170.9	3.5	114	N579 N580 A581	N579-R583 WeakPolarHBondContact O-CB 3.19Å; N579-R583 WeakPolarHBondContact O-CG 3.46Å; N579-R583 PolarHBondContact O-N 3.08Å; N580-R583 PolarHBondContact O-N 2.88Å; A581-R583 PolarHBondContact O-N 3.28Å
584	K	57.4	Low	59.2	Low	148 Å²	148	89.7 Å²	89.7	64%	0.643	45%	0.448	S	S	*	.	H	α-helix	trans	-99.5	-0.8	-172.4	-65.4	-176.4	179.3	176	0	113.8	N580 A581 A586	N580-K584 VanDerWaalsContact O-CB 3.28Å; N580-K584 WeakPolarHBondContact O-CB 3.32Å; N580-K584 PolarHBondContact O-N 3.4Å; A581-K584 PolarHBondContact O-N 2.88Å; K584-A586 PolarHBondContact O-N 3.31Å
585	R	48.7	Very low	58.1	Low	224 Å²	224	91.3 Å²	91.3	85%	0.845	46%	0.461	S	S	*	.	S	Bend	trans	61.5	-32.5	-170.1	-68.4	-176.2	172.6	-163.8	-3.1	115.4	A581	A581-R585 CarbonylContact O-C 3.57Å; A581-R585 WeakPolarHBondContact O-CA 3.36Å; A581-R585 PolarHBondContact O-N 2.79Å
586	A	51.9	Low	57	Low	41 Å²	41	91.3 Å²	91.3	34%	0.339	46%	0.459	S	S	.	.			trans	-140.8	133.1	173.8	0	0	0	0	0	110.5	R515 F516 K584	R515-A586 HydrophobicContact CB-CB 4.27Å; R515-A586 HydrophobicContact CG-CB 4.46Å; F516-A586 WeakPolarHBondContact O-CA 3.43Å; K584-A586 PolarHBondContact O-N 3.31Å
587	V	59.9	Low	56.1	Low	29 Å²	29	89.6 Å²	89.6	18%	0.176	45%	0.445	C	S	.	.			trans	-119.3	142	171.5	172.7	0	0	0	0	107.8	F516 L577 N580 A581 K589	F516-V587 WeakPolarHBondContact CB-O 3.46Å; F516-V587 PolarHBondContact N-O 3.48Å; L577-V587 HydrophobicContact CD2-CG1 4.29Å; L577-V587 HydrophobicContact CG-CG1 4.38Å; N580-V587 VanDerWaalsContact C-CG2 3.5Å; N580-V587 HydrophobicContact CB-CG2 3.83Å; A581-V587 HydrophobicContact CB-CG2 4.1Å; V587-K589 PolarHBondContact O-N 3.05Å
588	R	60.1	Low	55.5	Low	221 Å²	221	91.2 Å²	91.2	83%	0.834	45%	0.452	S	S	*	.	B	Isolated β-bridge	trans	-64.4	132.3	173.5	-93.9	-166.5	175.2	-136.4	-1.2	109
589	K	54.7	Low	54.9	Low	34 Å²	34	89.5 Å²	89.5	15%	0.148	44%	0.444	C	S	.	.	P	Polyproline II helix	trans	-55.1	129.2	171.1	-171.5	174.2	-178	178.4	0	109.7	V587 W593 G594 T595 V596 W597	V587-K589 PolarHBondContact O-N 3.05Å; K589-W593 HydrophobicContact CD-CB 4.25Å; K589-W593 WeakPolarHBondContact CE-O 3.47Å; K589-W593 HydrophobicContact CG-CB 3.99Å; K589-W593 HydrophobicContact CG-CE3 4.17Å; K589-W593 PolarHBondContact NZ-O 3.21Å; K589-G594 WeakPolarHBondContact CE-O 3.39Å; K589-G594 PolarHBondContact NZ-O 3.47Å; K589-T595 PolarHBondContact NZ-O 3.23Å; K589-V596 VanDerWaalsContact NZ-C 3.31Å; K589-V596 PolarHBondContact NZ-O 3.29Å; K589-W597 HydrophobicContact CB-CH2 4.05Å; K589-W597 HydrophobicContact CB-CZ3 4.41Å; K589-W597 HydrophobicContact CD-CH2 4.37Å; K589-W597 HydrophobicContact CD-CZ2 4.36Å; K589-W597 HydrophobicContact CD-CZ3 4.47Å; K589-W597 HydrophobicContact CG-CH2 4.19Å; K589-W597 HydrophobicContact CG-CZ3 4.15Å
590	P	65.5	Low	54.4	Low	21 Å²	21	90 Å²	90	14%	0.136	44%	0.441	C	S	.	.	P	Polyproline II helix	trans	-53.3	135.5	170.2	-25.7	33.9	0	0	0	110.5	L577 Q592 W593	L577-P590 HydrophobicContact CD1-CG 3.59Å; P590-Q592 HydrophobicContact CB-CG 4.38Å; P590-Q592 PolarHBondContact O-N 3.4Å; P590-Q592 VanDerWaalsContact O-N 3.08Å; P590-W593 HydrophobicContact CB-CD2 4.19Å; P590-W593 HydrophobicContact CB-CG 4.29Å; P590-W593 VanDerWaalsContact CD-CE3 3.48Å; P590-W593 HydrophobicContact CG-CD2 3.88Å; P590-W593 HydrophobicContact CG-CE3 3.97Å; P590-W593 HydrophobicContact CG-CG 4.5Å; P590-W593 HydrophobicContact CG-CH2 4.16Å; P590-W593 HydrophobicContact CG-CZ2 4.1Å; P590-W593 HydrophobicContact CG-CZ3 4.1Å; P590-W593 PolarHBondContact O-N 2.92Å
591	P	62.7	Low	53.9	Low	128 Å²	128	88 Å²	88	83%	0.831	43%	0.433	S	S	*	.	G	3₁₀ helix	trans	-60.4	-24.5	-173.7	21.7	-31.2	0	0	0	113.2	W593	P591-W593 VanDerWaalsContact C-N 3.27Å; P591-W593 PolarHBondContact O-N 3.43Å
592	Q	57.6	Low	53.7	Low	144 Å²	144	93.8 Å²	93.8	67%	0.673	47%	0.467	S	S	*	.	G	3₁₀ helix	trans	-72.5	-12.2	177.9	67.1	-93.1	26.5	0	0	115	P590 G594	P590-Q592 HydrophobicContact CB-CG 4.38Å; P590-Q592 PolarHBondContact O-N 3.4Å; P590-Q592 VanDerWaalsContact O-N 3.08Å; Q592-G594 VanDerWaalsContact C-N 3.34Å; Q592-G594 PolarHBondContact O-N 2.98Å
593	W	55.5	Low	53.4	Low	37 Å²	37	95 Å²	95	14%	0.14	47%	0.474	C	S	.	.	G	3₁₀ helix	trans	-86.9	13.4	-172.3	-71.2	-6.8	0	0	0	114.6	V573 L577 K589 P590 P591 W597 H598 P599	V573-W593 HydrophobicContact CG1-CH2 4.41Å; L577-W593 HydrophobicContact CD1-CH2 3.75Å; L577-W593 HydrophobicContact CD1-CZ2 4.35Å; L577-W593 HydrophobicContact CD1-CZ3 4.27Å; L577-W593 HydrophobicContact CD2-CH2 4.25Å; L577-W593 HydrophobicContact CD2-CZ3 4.3Å; K589-W593 HydrophobicContact CD-CB 4.25Å; K589-W593 WeakPolarHBondContact CE-O 3.47Å; K589-W593 HydrophobicContact CG-CB 3.99Å; K589-W593 HydrophobicContact CG-CE3 4.17Å; K589-W593 PolarHBondContact NZ-O 3.21Å; P590-W593 HydrophobicContact CB-CD2 4.19Å; P590-W593 HydrophobicContact CB-CG 4.29Å; P590-W593 VanDerWaalsContact CD-CE3 3.48Å; P590-W593 HydrophobicContact CG-CD2 3.88Å; P590-W593 HydrophobicContact CG-CE3 3.97Å; P590-W593 HydrophobicContact CG-CG 4.5Å; P590-W593 HydrophobicContact CG-CH2 4.16Å; P590-W593 HydrophobicContact CG-CZ2 4.1Å; P590-W593 HydrophobicContact CG-CZ3 4.1Å; P590-W593 PolarHBondContact O-N 2.92Å; P591-W593 VanDerWaalsContact C-N 3.27Å; P591-W593 PolarHBondContact O-N 3.43Å; W593-W597 HydrophobicContact CE3-CE3 4.1Å; W593-W597 HydrophobicContact CE3-CZ3 4.14Å; W593-W597 HydrophobicContact CZ3-CE3 4.21Å; W593-W597 HydrophobicContact CZ3-CZ3 4.1Å; W593-H598 VanDerWaalsContact CD1-O 3.31Å; W593-P599 HydrophobicContact CZ2-CB 4.06Å
594	G	49.1	Very low	52.7	Low	58 Å²	58	92 Å²	92	60%	0.598	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.2	-154.5	175.2	0	0	0	0	0	114.7	K589 Q592	K589-G594 WeakPolarHBondContact CE-O 3.39Å; K589-G594 PolarHBondContact NZ-O 3.47Å; Q592-G594 VanDerWaalsContact C-N 3.34Å; Q592-G594 PolarHBondContact O-N 2.98Å
595	T	43.6	Very low	51.8	Low	121 Å²	121	90.7 Å²	90.7	74%	0.742	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.3	-38.1	175.4	46.3	0	0	0	0	112.2	K589	K589-T595 PolarHBondContact NZ-O 3.23Å
596	V	39.9	Very low	51	Low	83 Å²	83	85.7 Å²	85.7	50%	0.503	47%	0.467	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.1	142.6	177.2	-175.2	0	0	0	0	111	K589 H598	K589-V596 VanDerWaalsContact NZ-C 3.31Å; K589-V596 PolarHBondContact NZ-O 3.29Å; V596-H598 PolarHBondContact O-N 2.93Å; V596-H598 VanDerWaalsContact O-N 3.07Å
597	W	51.1	Low	49.8	Very low	68 Å²	68	91.5 Å²	91.5	26%	0.258	49%	0.489	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77	91.7	-178.1	-75.8	87	0	0	0	111.7	F516 K589 W593	F516-W597 HydrophobicContact CB-CH2 3.68Å; F516-W597 HydrophobicContact CB-CZ2 4.45Å; F516-W597 HydrophobicContact CB-CZ3 4.33Å; F516-W597 HydrophobicContact CD2-CE3 4.3Å; F516-W597 AromaticContact CD2-CH2 3.7Å; F516-W597 HydrophobicContact CD2-CH2 3.7Å; F516-W597 AromaticContact CD2-CZ3 3.51Å; F516-W597 HydrophobicContact CD2-CZ3 3.51Å; F516-W597 HydrophobicContact CE2-CZ3 4.36Å; F516-W597 HydrophobicContact CG-CH2 4.17Å; F516-W597 HydrophobicContact CG-CZ3 4.4Å; K589-W597 HydrophobicContact CB-CH2 4.05Å; K589-W597 HydrophobicContact CB-CZ3 4.41Å; K589-W597 HydrophobicContact CD-CH2 4.37Å; K589-W597 HydrophobicContact CD-CZ2 4.36Å; K589-W597 HydrophobicContact CD-CZ3 4.47Å; K589-W597 HydrophobicContact CG-CH2 4.19Å; K589-W597 HydrophobicContact CG-CZ3 4.15Å; W593-W597 HydrophobicContact CE3-CE3 4.1Å; W593-W597 HydrophobicContact CE3-CZ3 4.14Å; W593-W597 HydrophobicContact CZ3-CE3 4.21Å; W593-W597 HydrophobicContact CZ3-CZ3 4.1Å
598	H	53.9	Low	48.2	Very low	59 Å²	59	97 Å²	97	27%	0.273	52%	0.518	S	S	.	.			trans	-136.1	119.4	-178.8	-93.4	-44.5	0	0	0	116.2	W593 V596 Y600	W593-H598 VanDerWaalsContact CD1-O 3.31Å; V596-H598 PolarHBondContact O-N 2.93Å; V596-H598 VanDerWaalsContact O-N 3.07Å; H598-Y600 HydrophobicContact CB-CD2 3.65Å; H598-Y600 HydrophobicContact CB-CE2 4.05Å; H598-Y600 HydrophobicContact CB-CG 4.25Å; H598-Y600 AromaticContact CD2-CD2 3.61Å; H598-Y600 AromaticContact CD2-CE2 3.09Å; H598-Y600 WeakPolarHBondContact CD2-CE2 3.45Å; H598-Y600 AromaticContact CD2-CZ 3.84Å; H598-Y600 AromaticContact CE1-CD2 3.96Å; H598-Y600 AromaticContact CE1-CE1 3.77Å; H598-Y600 AromaticContact CE1-CE2 3.11Å; H598-Y600 WeakPolarHBondContact CE1-CE2 3.47Å; H598-Y600 AromaticContact CE1-CZ 2.95Å; H598-Y600 PolarHBondContact CE1-OH 2.61Å; H598-Y600 AromaticContact CG-CD2 3.27Å; H598-Y600 AromaticContact CG-CE2 3.15Å; H598-Y600 AromaticContact CG-CZ 3.79Å; H598-Y600 AromaticContact ND1-CD2 3.48Å; H598-Y600 WeakPolarHBondContact ND1-CD2 3.35Å; H598-Y600 AromaticContact ND1-CE1 3.7Å; H598-Y600 AromaticContact ND1-CE2 3.11Å; H598-Y600 WeakPolarHBondContact ND1-CE2 3.4Å; H598-Y600 AromaticContact ND1-CG 3.97Å; H598-Y600 AromaticContact ND1-CZ 3.21Å; H598-Y600 AromaticContact NE2-CE2 3.06Å; H598-Y600 WeakPolarHBondContact NE2-CE2 3.38Å; H598-Y600 AromaticContact NE2-CZ 3.33Å; H598-Y600 VanDerWaalsContact NE2-CZ 3.33Å; H598-Y600 PolarHBondContact NE2-OH 3.42Å; H598-Y600 VanDerWaalsContact NE2-OH 3.14Å
599	P	51.6	Low	46.6	Very low	19 Å²	19	91 Å²	91	12%	0.123	51%	0.509	C	S	.	.			trans	-94.4	66.9	156.7	37	-31.2	0	0	0	109.5	M570 K571 V573 W593	M570-P599 HydrophobicContact CG-CG 4.39Å; K571-P599 WeakPolarHBondContact CA-O 3.37Å; K571-P599 HydrophobicContact CB-CB 4.49Å; K571-P599 VanDerWaalsContact CB-O 3.23Å; K571-P599 WeakPolarHBondContact CB-O 3.45Å; K571-P599 PolarHBondContact N-O 2.97Å; K571-P599 WeakPolarHBondContact O-CG 3.47Å; V573-P599 HydrophobicContact CG2-CG 4.25Å; W593-P599 HydrophobicContact CZ2-CB 4.06Å
600	Y	51.4	Low	45.2	Very low	86 Å²	86	100.9 Å²	100.9	34%	0.337	55%	0.548	S	S	.	.	B	Isolated β-bridge	trans	-81.5	152.7	170	-78	-44.6	0	0	0	111.1	K568 M570 H598 T602	K568-Y600 HydrophobicContact CB-CD1 3.26Å; K568-Y600 HydrophobicContact CB-CD2 3.89Å; K568-Y600 HydrophobicContact CB-CE1 3.87Å; K568-Y600 HydrophobicContact CB-CE2 4.34Å; K568-Y600 HydrophobicContact CB-CG 3.31Å; K568-Y600 HydrophobicContact CD-CD2 3.97Å; K568-Y600 HydrophobicContact CD-CG 3.89Å; K568-Y600 HydrophobicContact CG-CG 4.18Å; K568-Y600 WeakPolarHBondContact O-CD1 3.18Å; K568-Y600 WeakPolarHBondContact O-CE1 3.48Å; M570-Y600 HydrophobicContact CB-CD1 4.32Å; M570-Y600 HydrophobicContact CB-CE1 3.97Å; M570-Y600 HydrophobicContact CG-CE1 4.48Å; H598-Y600 HydrophobicContact CB-CD2 3.65Å; H598-Y600 HydrophobicContact CB-CE2 4.05Å; H598-Y600 HydrophobicContact CB-CG 4.25Å; H598-Y600 AromaticContact CD2-CD2 3.61Å; H598-Y600 AromaticContact CD2-CE2 3.09Å; H598-Y600 WeakPolarHBondContact CD2-CE2 3.45Å; H598-Y600 AromaticContact CD2-CZ 3.84Å; H598-Y600 AromaticContact CE1-CD2 3.96Å; H598-Y600 AromaticContact CE1-CE1 3.77Å; H598-Y600 AromaticContact CE1-CE2 3.11Å; H598-Y600 WeakPolarHBondContact CE1-CE2 3.47Å; H598-Y600 AromaticContact CE1-CZ 2.95Å; H598-Y600 PolarHBondContact CE1-OH 2.61Å; H598-Y600 AromaticContact CG-CD2 3.27Å; H598-Y600 AromaticContact CG-CE2 3.15Å; H598-Y600 AromaticContact CG-CZ 3.79Å; H598-Y600 AromaticContact ND1-CD2 3.48Å; H598-Y600 WeakPolarHBondContact ND1-CD2 3.35Å; H598-Y600 AromaticContact ND1-CE1 3.7Å; H598-Y600 AromaticContact ND1-CE2 3.11Å; H598-Y600 WeakPolarHBondContact ND1-CE2 3.4Å; H598-Y600 AromaticContact ND1-CG 3.97Å; H598-Y600 AromaticContact ND1-CZ 3.21Å; H598-Y600 AromaticContact NE2-CE2 3.06Å; H598-Y600 WeakPolarHBondContact NE2-CE2 3.38Å; H598-Y600 AromaticContact NE2-CZ 3.33Å; H598-Y600 VanDerWaalsContact NE2-CZ 3.33Å; H598-Y600 PolarHBondContact NE2-OH 3.42Å; H598-Y600 VanDerWaalsContact NE2-OH 3.14Å; Y600-T602 PolarHBondContact O-N 2.88Å
601	S	52.7	Low	43.3	Very low	25 Å²	25	105.1 Å²	105.1	18%	0.175	57%	0.573	C	S	.	*			trans	-59.3	133.4	168.5	-156	0	0	0	0	110.3	K571 D603	K571-S601 VanDerWaalsContact CE-CB 3.5Å; K571-S601 VanDerWaalsContact CE-OG 3.3Å; K571-S601 WeakPolarHBondContact CE-OG 3.37Å; K571-S601 PolarHBondContact NZ-OG 3.35Å; K571-S601 VanDerWaalsContact NZ-OG 3.08Å; S601-D603 VanDerWaalsContact C-N 3.26Å; S601-D603 PolarHBondContact OG-OD2 2.94Å; S601-D603 VanDerWaalsContact OG-OD2 3.11Å
602	T	51.5	Low	41.5	Very low	125 Å²	125	105 Å²	105	77%	0.767	57%	0.57	S	S	*	*			trans	-82.9	-6.9	171.1	49.7	0	0	0	0	112.5	Y600 E604	Y600-T602 PolarHBondContact O-N 2.88Å; T602-E604 PolarHBondContact O-N 3.42Å
603	D	46.9	Very low	39.8	Very low	119 Å²	119	106.4 Å²	106.4	64%	0.636	58%	0.576	S	S	*	*			trans	-67.1	100.6	176	-56.9	-37.9	0	0	0	107.4	S601 V605	S601-D603 VanDerWaalsContact C-N 3.26Å; S601-D603 PolarHBondContact OG-OD2 2.94Å; S601-D603 VanDerWaalsContact OG-OD2 3.11Å; D603-V605 PolarHBondContact O-N 2.89Å
604	E	41.4	Very low	38.4	Very low	143 Å²	143	112.6 Å²	112.6	67%	0.668	61%	0.612	S	S	*	*			trans	-51.2	117.5	162.4	-74	-178.8	171.7	0	0	106	T602 T606	T602-E604 PolarHBondContact O-N 3.42Å; E604-T606 PolarHBondContact O-N 3.47Å
605	V	37.2	Very low	37.2	Very low	120 Å²	120	116.8 Å²	116.8	73%	0.727	62%	0.621	S	S	*	*			trans	-60.9	94.2	169.9	178.9	0	0	0	0	105.1	D603 M607	D603-V605 PolarHBondContact O-N 2.89Å; V605-M607 HydrophobicContact CG1-CG 4.32Å; V605-M607 PolarHBondContact O-N 3.35Å
606	T	32	Very low	36.5	Very low	118 Å²	118	118.8 Å²	118.8	72%	0.724	63%	0.627	S	S	*	*			trans	-68	83.9	173.2	34.8	0	0	0	0	106	E604 N608	E604-T606 PolarHBondContact O-N 3.47Å; T606-N608 PolarHBondContact O-N 3.4Å
607	M	27.4	Very low	35.7	Very low	164 Å²	164	122.1 Å²	122.1	81%	0.808	64%	0.642	S	S	*	*			trans	-63.7	77.6	161	-87.3	-72.7	-168.6	0	0	107	V605	V605-M607 HydrophobicContact CG1-CG 4.32Å; V605-M607 PolarHBondContact O-N 3.35Å
608	N	26.4	Very low	34.8	Very low	144 Å²	144	126.5 Å²	126.5	77%	0.77	67%	0.669	S	S	*	*			trans	169.5	104.7	164.7	-83.8	-21.8	0	0	0	105.2	T606	T606-N608 PolarHBondContact O-N 3.4Å
609	S	27.3	Very low	33.4	Very low	94 Å²	94	130.7 Å²	130.7	66%	0.657	69%	0.693	S	S	*	*				170.6	131.5	65	38.3	0	0	0	0	108.4	T611	S609-T611 VanDerWaalsContact C-N 3.31Å; S609-T611 PolarHBondContact O-N 3.19Å
610	Y	24.1	Very low	32.4	Very low	243 Å²	243	137.5 Å²	137.5	95%	0.953	73%	0.729	S	S	*	*			trans	-66.9	91.6	156.9	-76.8	-94	0	0	0	108.1
611	T	26.6	Very low	31.1	Very low	109 Å²	109	140.9 Å²	140.9	67%	0.669	75%	0.753	S	S	*	*			trans	-140.1	103.1	163.8	30.8	0	0	0	0	110.9	S609	S609-T611 VanDerWaalsContact C-N 3.31Å; S609-T611 PolarHBondContact O-N 3.19Å
612	T	23.7	Very low	30	Very low	125 Å²	125	145.3 Å²	145.3	77%	0.767	78%	0.784	S	S	*	*			trans	-12.7	129.6	152.8	35.8	0	0	0	0	117.4
613	H	22.2	Very low	28.8	Very low	174 Å²	174	145.9 Å²	145.9	81%	0.806	78%	0.781	S	S	*	*			trans	32	111.7	142.5	-76.4	-66.6	0	0	0	118.4
614	N	26.3	Very low	27.6	Very low	168 Å²	168	147.8 Å²	147.8	90%	0.898	79%	0.787	S	S	*	*				-161.6	124.4	122.8	-100.4	-23.3	0	0	0	111.6
615	N	23.2	Very low	27	Very low	146 Å²	146	147.8 Å²	147.8	78%	0.781	80%	0.796	S	S	*	*			trans	-57	138.8	162.5	-78.1	-26.1	0	0	0	109.9
616	N	29.3	Very low	26.4	Very low	162 Å²	162	145.9 Å²	145.9	87%	0.866	80%	0.801	S	S	*	*				-174.1	131.1	127	-88.8	-24	0	0	0	111
617	N	24.1	Very low	26	Very low	153 Å²	153	147 Å²	147	82%	0.818	81%	0.812	S	S	*	*			trans	-46.2	148.5	165	-71.4	-27.6	0	0	0	112.4
618	I	31.4	Very low	25.8	Very low	160 Å²	160	145 Å²	145	82%	0.821	82%	0.815	S	S	*	*				-170.5	123.7	124.7	-89.2	145.6	0	0	0	107.6
619	D	24.9	Very low	25.8	Very low	147 Å²	147	143.2 Å²	143.2	79%	0.786	81%	0.813	S	S	*	*			trans	-64.4	140.8	168.5	-59.7	-54.1	0	0	0	110.4
620	D	31.6	Very low	25.8	Very low	163 Å²	163	145 Å²	145	87%	0.872	82%	0.823	S	S	*	*			trans	-159.6	119.4	145	-99	-28.7	0	0	0	112
621	N	22.5	Very low	25.9	Very low	156 Å²	156	141.7 Å²	141.7	83%	0.834	82%	0.821	S	S	*	*			trans	-76.4	131.4	171.4	-70.8	-57.2	0	0	0	110.1
622	S	30.5	Very low	25.9	Very low	119 Å²	119	145.7 Å²	145.7	83%	0.832	83%	0.831	S	S	*	*			trans	-155.5	133.7	148.1	52.9	0	0	0	0	112.8
623	L	25.5	Very low	25.9	Very low	136 Å²	136	148 Å²	148	71%	0.712	84%	0.839	S	S	*	*			trans	-77.4	150.7	-175.8	-92.5	74.8	0	0	0	113
624	E	22.6	Very low	26.1	Very low	160 Å²	160	142.5 Å²	142.5	75%	0.748	83%	0.829	S	S	*	*			trans	54.7	125.2	134.4	-60.1	174.3	174.6	0	0	120.1
625	T	27.4	Very low	25.9	Very low	142 Å²	142	146 Å²	146	87%	0.871	83%	0.829	S	S	*	*				166.1	128	111.6	39	0	0	0	0	113.3
626	G	25.5	Very low	25.9	Very low	81 Å²	81	149.1 Å²	149.1	84%	0.835	84%	0.836	S	S	*	*			trans	72	89.1	139	0	0	0	0	0	120.2
627	C	23.6	Very low	25.6	Very low	140 Å²	140	149.6 Å²	149.6	95%	0.946	83%	0.833	S	S	*	*			trans	-117.5	112.5	158.2	-86.1	0	0	0	0	110.3
628	S	24.2	Very low	25.5	Very low	124 Å²	124	151.3 Å²	151.3	87%	0.867	84%	0.836	S	S	*	*			trans	-153.9	100.2	159.9	63.7	0	0	0	0	109.6
629	S	25.2	Very low	25.2	Very low	106 Å²	106	149.5 Å²	149.5	74%	0.741	83%	0.832	S	S	*	*			trans	-138	127.5	158.1	51.4	0	0	0	0	108.7
630	P	27.3	Very low	25	Very low	132 Å²	132	146.8 Å²	146.8	86%	0.857	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-78.6	127.6	179.4	15.7	-5.5	0	0	0	110.2
631	L	27	Very low	24.8	Very low	173 Å²	173	147.8 Å²	147.8	91%	0.906	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-69.4	128.1	-179.5	-73.8	164.2	0	0	0	111.1
632	Q	25.1	Very low	24.8	Very low	192 Å²	192	150 Å²	150	90%	0.897	83%	0.834	S	S	*	*	P	Polyproline II helix	trans	-84.3	122.6	-175	-159.3	166.5	9.3	0	0	109.4	G634	Q632-G634 PolarHBondContact O-N 3.34Å; Q632-G634 VanDerWaalsContact O-N 3.16Å
633	L	24.8	Very low	24.5	Very low	175 Å²	175	148 Å²	148	92%	0.916	83%	0.825	S	S	*	*			trans	-56	114.5	178.6	-99.4	99.8	0	0	0	111.3
634	G	26.2	Very low	24.4	Very low	58 Å²	58	147.7 Å²	147.7	60%	0.598	83%	0.829	S	S	*	*			trans	-77.7	130	174.8	0	0	0	0	0	112.2	Q632 F636	Q632-G634 PolarHBondContact O-N 3.34Å; Q632-G634 VanDerWaalsContact O-N 3.16Å; G634-F636 PolarHBondContact O-N 3.05Å
635	R	22	Very low	24.6	Very low	242 Å²	242	146.3 Å²	146.3	91%	0.913	83%	0.831	S	S	*	*			trans	-56.9	122.3	168.9	-109.3	176.2	171.8	-179.3	-2.7	110.3
636	F	23.6	Very low	24.5	Very low	211 Å²	211	145.6 Å²	145.6	93%	0.925	83%	0.827	S	S	*	*			trans	-84.6	114.6	168	-83.9	-90.3	0	0	0	110	G634	G634-F636 PolarHBondContact O-N 3.05Å
637	E	22.7	Very low	24.7	Very low	171 Å²	171	148.4 Å²	148.4	80%	0.799	82%	0.821	S	S	*	*			trans	-85.8	139.1	169.8	-76.7	-175.7	164.4	0	0	110.8	V639	E637-V639 PolarHBondContact O-N 3.34Å
638	H	21.3	Very low	24.7	Very low	189 Å²	189	148.8 Å²	148.8	88%	0.875	81%	0.814	S	S	*	*			trans	-70.8	101.1	-173.7	-145.6	-91.3	0	0	0	110.6	A640	H638-A640 PolarHBondContact O-N 2.98Å
639	V	26	Very low	24.9	Very low	122 Å²	122	149 Å²	149	74%	0.739	81%	0.81	S	S	*	*			trans	-83.6	98.3	174.5	-178.4	0	0	0	0	109.3	E637 M641	E637-V639 PolarHBondContact O-N 3.34Å; V639-M641 HydrophobicContact CG1-CG 4.35Å; V639-M641 PolarHBondContact O-N 3.33Å
640	A	21.4	Very low	25	Very low	91 Å²	91	150.1 Å²	150.1	75%	0.752	81%	0.813	S	S	*	*			trans	-69.9	107.4	166.6	0	0	0	0	0	109.7	H638	H638-A640 PolarHBondContact O-N 2.98Å
641	M	25.4	Very low	24.8	Very low	184 Å²	184	150.5 Å²	150.5	91%	0.906	81%	0.806	S	S	*	*			trans	-85.9	129	170.7	-88.8	-169.7	160.7	0	0	111.9	V639	V639-M641 HydrophobicContact CG1-CG 4.35Å; V639-M641 PolarHBondContact O-N 3.33Å
642	K	23.5	Very low	24.8	Very low	203 Å²	203	148.6 Å²	148.6	88%	0.883	80%	0.802	S	S	*	*			trans	-69	134.9	-176.6	-106.4	169.1	166.6	174.1	0	113.4
643	A	24.3	Very low	24.8	Very low	77 Å²	77	144.9 Å²	144.9	64%	0.636	79%	0.793	S	S	*	*				52	116.2	119.9	0	0	0	0	0	120.8
644	T	23.3	Very low	25	Very low	129 Å²	129	143.5 Å²	143.5	79%	0.791	79%	0.786	S	S	*	*			trans	50.9	117.4	133.5	44.8	0	0	0	0	119.6
645	T	27.4	Very low	25	Very low	130 Å²	130	147.2 Å²	147.2	80%	0.798	80%	0.797	S	S	*	*				-153.5	108.9	126.5	-45.1	0	0	0	0	110.4	I647	T645-I647 PolarHBondContact O-N 3.09Å
646	T	24.6	Very low	25.4	Very low	127 Å²	127	143.2 Å²	143.2	78%	0.779	79%	0.792	S	S	*	*			trans	-60.9	120.5	162.1	25.6	0	0	0	0	110.1
647	I	29.2	Very low	25.6	Very low	140 Å²	140	139.1 Å²	139.1	72%	0.718	79%	0.785	S	S	*	*			trans	-100	101.9	166.7	-60.7	176.3	0	0	0	107.3	T645 T649	T645-I647 PolarHBondContact O-N 3.09Å; I647-T649 HydrophobicContact CG2-CG2 4Å; I647-T649 PolarHBondContact O-N 3.45Å
648	N	23.7	Very low	25.8	Very low	148 Å²	148	135.7 Å²	135.7	79%	0.791	79%	0.785	S	S	*	*			trans	-76.8	107.5	163.6	-79.6	-17.8	0	0	0	108
649	T	29.6	Very low	26.1	Very low	128 Å²	128	131.9 Å²	131.9	79%	0.785	78%	0.78	S	S	*	*			trans	-111	107.5	162.7	37	0	0	0	0	109.6	I647	I647-T649 HydrophobicContact CG2-CG2 4Å; I647-T649 PolarHBondContact O-N 3.45Å
650	T	26	Very low	26.2	Very low	130 Å²	130	132.9 Å²	132.9	80%	0.798	79%	0.787	S	S	*	*			trans	-69.1	141.4	178.9	-21.2	0	0	0	0	111.1
651	I	23.8	Very low	26.6	Very low	140 Å²	140	133.5 Å²	133.5	72%	0.718	79%	0.786	S	S	*	*			trans	-44.8	135.6	175.3	-64.2	148.4	0	0	0	113.7	T653	I651-T653 HydrophobicContact CG2-CG2 3.88Å
652	T	26.6	Very low	26.7	Very low	133 Å²	133	130.3 Å²	130.3	82%	0.816	78%	0.781	S	S	*	*			trans	-131.7	99.3	149.7	15.4	0	0	0	0	109.3	N654	T652-N654 PolarHBondContact O-N 3.19Å
653	T	25.7	Very low	27.1	Very low	115 Å²	115	126.6 Å²	126.6	71%	0.706	78%	0.776	S	S	*	*			trans	-72.1	104.2	168	42	0	0	0	0	109.3	I651	I651-T653 HydrophobicContact CG2-CG2 3.88Å
654	N	29.7	Very low	27.3	Very low	146 Å²	146	128.7 Å²	128.7	78%	0.781	79%	0.786	S	S	*	*			trans	-91.6	103	165.5	-84.7	-10.9	0	0	0	109.1	T652 I656	T652-N654 PolarHBondContact O-N 3.19Å; N654-I656 PolarHBondContact O-N 3.28Å
655	T	26	Very low	27.7	Very low	135 Å²	135	128.5 Å²	128.5	83%	0.828	79%	0.785	S	S	*	*			trans	-65.4	102	165.8	33.3	0	0	0	0	109.5
656	I	30.1	Very low	27.9	Very low	159 Å²	159	126.6 Å²	126.6	82%	0.815	78%	0.782	S	S	*	*			trans	-90	109.1	167.8	-59.9	176.7	0	0	0	107.6	N654	N654-I656 PolarHBondContact O-N 3.28Å
657	T	27.8	Very low	28.3	Very low	124 Å²	124	127.1 Å²	127.1	76%	0.761	79%	0.785	S	S	*	*			trans	-58	126.9	173.3	34.9	0	0	0	0	111.8	S659	T657-S659 PolarHBondContact O-N 3.39Å
658	A	26.1	Very low	28.5	Very low	99 Å²	99	125.7 Å²	125.7	82%	0.818	78%	0.783	S	S	*	*			trans	-56.3	122	168.5	0	0	0	0	0	110.9
659	S	28.5	Very low	28.8	Very low	110 Å²	110	126.6 Å²	126.6	77%	0.769	79%	0.788	S	S	*	*			trans	-107.3	103.3	163	53.6	0	0	0	0	108.4	T657 S661	T657-S659 PolarHBondContact O-N 3.39Å; S659-S661 PolarHBondContact O-N 3.44Å
660	T	27.3	Very low	29	Very low	142 Å²	142	127.4 Å²	127.4	87%	0.871	79%	0.787	S	S	*	*			trans	-69.4	109.8	167.4	48.3	0	0	0	0	108.4
661	S	29.9	Very low	29.4	Very low	104 Å²	104	134.9 Å²	134.9	73%	0.727	81%	0.809	S	S	*	*			trans	-123.5	103.9	162	61.8	0	0	0	0	109.2	S659	S659-S661 PolarHBondContact O-N 3.44Å
662	S	28.5	Very low	29.7	Very low	117 Å²	117	134.6 Å²	134.6	82%	0.818	81%	0.813	S	S	*	*			trans	-78.3	114.6	170	51.8	0	0	0	0	109
663	T	30.7	Very low	29.9	Very low	126 Å²	126	134.7 Å²	134.7	77%	0.773	81%	0.813	S	S	*	*			trans	-127.9	91.2	162.9	33.9	0	0	0	0	108.6	T665	T663-T665 PolarHBondContact O-N 3.41Å
664	S	28.4	Very low	30.1	Very low	120 Å²	120	135.8 Å²	135.8	84%	0.839	82%	0.819	S	S	*	*			trans	-74	105.3	164.8	70.1	0	0	0	0	108.5
665	T	31.9	Very low	30.1	Very low	125 Å²	125	135.2 Å²	135.2	77%	0.767	82%	0.821	S	S	*	*			trans	-96.8	97.8	163.5	37.8	0	0	0	0	108.1	T663 V667	T663-T665 PolarHBondContact O-N 3.41Å; T665-V667 PolarHBondContact O-N 3.11Å; T665-V667 VanDerWaalsContact O-N 3.09Å
666	A	31	Very low	30.4	Very low	90 Å²	90	135.2 Å²	135.2	74%	0.744	82%	0.821	S	S	*	*			trans	-62	106.8	167.6	0	0	0	0	0	108.7	T668	A666-T668 PolarHBondContact O-N 3.05Å
667	V	34.7	Very low	30.4	Very low	138 Å²	138	133.6 Å²	133.6	84%	0.836	82%	0.821	S	S	*	*			trans	-73.4	110.9	168.4	177.8	0	0	0	0	106.9	T665	T665-V667 PolarHBondContact O-N 3.11Å; T665-V667 VanDerWaalsContact O-N 3.09Å
668	T	33.2	Very low	30.6	Very low	110 Å²	110	134.3 Å²	134.3	68%	0.675	83%	0.825	S	S	*	*			trans	-76.2	120.4	178.4	29.1	0	0	0	0	109.1	A666 N670	A666-T668 PolarHBondContact O-N 3.05Å; T668-N670 PolarHBondContact O-N 3.25Å; T668-N670 VanDerWaalsContact O-N 3.16Å
669	N	28.9	Very low	30.9	Very low	167 Å²	167	137 Å²	137	89%	0.893	83%	0.826	S	S	*	*			trans	-55.6	113.7	163.9	-84.8	-21	0	0	0	109.4
670	N	34.2	Very low	31.2	Very low	145 Å²	145	139.3 Å²	139.3	78%	0.775	83%	0.831	S	S	*	*			trans	-131.5	105.9	167.7	-96.5	-28.5	0	0	0	109	T668	T668-N670 PolarHBondContact O-N 3.25Å; T668-N670 VanDerWaalsContact O-N 3.16Å
671	K	35.1	Very low	31.5	Very low	287 Å²	287	139 Å²	139	100%	1.248	83%	0.827	S	S	*	*			trans	73.1	0	166.8	-70.9	-176.8	175.1	179.5	0	118.8

Retrieved 671 of 671 residues in 116.7 ms (Link to these results)

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