A0A096MWL7_PAPAN Loading...

Pleckstrin homology domain-containing family M member 3

Involved in skeletal muscle differentiation. May act as a scaffold protein for AKT1 during muscle differentiation.

AlphaFold DB , UniProt , Accession A0A096MWL7, Species PAPAN (Papio anubis, Olive baboon), Gene PLEKHM3, Length 761 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	34	Very low	31.6	Very low	238 Å²	238	147.2 Å²	147.2	100%	1.172	81%	0.806	S	S	*	*				0	112	0	-66.5	-174.7	-68.8	0	0	105.3
2	E	30	Very low	31.6	Very low	180 Å²	180	141.1 Å²	141.1	84%	0.841	79%	0.79	S	S	*	*			trans	-64.7	147.8	177.3	-65.6	101.5	142.2	0	0	111.7
3	A	27.7	Very low	32	Very low	95 Å²	95	136.8 Å²	136.8	79%	0.785	76%	0.763	S	S	*	*			trans	-84.7	126.9	162.2	0	0	0	0	0	107.9
4	L	31.3	Very low	32.4	Very low	163 Å²	163	136.4 Å²	136.4	85%	0.853	75%	0.753	S	S	*	*			trans	-87.5	109	170.2	-76.3	167.8	0	0	0	108.8
5	E	34.9	Very low	32.7	Very low	186 Å²	186	133.7 Å²	133.7	87%	0.869	74%	0.742	S	S	*	*			trans	-67.5	139.5	164.5	-63	177.2	146.6	0	0	108.9
6	V	32.5	Very low	33.6	Very low	129 Å²	129	127.8 Å²	127.8	78%	0.782	71%	0.71	S	S	*	*			trans	-132.7	69.4	-178.7	-170.8	0	0	0	0	109.4
7	D	32.5	Very low	34.2	Very low	162 Å²	162	122 Å²	122	87%	0.866	68%	0.676	S	S	*	*			trans	-89.7	95.5	163.8	-95.8	-38.3	0	0	0	109.1
8	D	31.4	Very low	34.5	Very low	145 Å²	145	123 Å²	123	78%	0.775	68%	0.675	S	S	*	*			trans	-156.1	66.4	169.6	-137.5	-16.3	0	0	0	112.2
9	I	31.3	Very low	35.1	Very low	146 Å²	146	121.3 Å²	121.3	75%	0.749	66%	0.661	S	S	*	*			trans	-89	109.9	172.8	-59.3	-179.2	0	0	0	108.8	L13	I9-L13 HydrophobicContact CG2-CD1 3.98Å
10	S	31.1	Very low	35.7	Very low	76 Å²	76	115.6 Å²	115.6	53%	0.531	63%	0.629	S	S	.	*			trans	-64.8	144.2	-168.8	-44.6	0	0	0	0	114.2	A12 L13	S10-A12 PolarHBondContact O-N 3.28Å; S10-L13 PolarHBondContact O-N 3.36Å
11	P	31	Very low	36	Very low	99 Å²	99	112.2 Å²	112.2	64%	0.643	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.5	-13.3	179.6	-27.9	35.3	0	0	0	116.4	L13 E14	P11-L13 PolarHBondContact O-N 3.06Å; P11-E14 PolarHBondContact O-N 3.25Å
12	A	31.8	Very low	36.2	Very low	74 Å²	74	106 Å²	106	61%	0.612	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.9	-20.2	-179.1	0	0	0	0	0	114.2	S10	S10-A12 PolarHBondContact O-N 3.28Å
13	L	37	Very low	37	Very low	85 Å²	85	99.5 Å²	99.5	45%	0.445	56%	0.56	S	S	.	*	T	Hydrogen-bonded Turn	trans	-76	-45.7	176.3	-74.9	169.5	0	0	0	112	I9 S10 P11 V15 T16 E17	I9-L13 HydrophobicContact CG2-CD1 3.98Å; S10-L13 PolarHBondContact O-N 3.36Å; P11-L13 PolarHBondContact O-N 3.06Å; L13-V15 VanDerWaalsContact C-N 3.28Å; L13-V15 PolarHBondContact O-N 3.39Å; L13-T16 PolarHBondContact O-N 3.44Å; L13-T16 PolarHBondContact O-OG1 2.97Å; L13-E17 PolarHBondContact O-N 3.26Å
14	E	37	Very low	37.7	Very low	131 Å²	131	97.3 Å²	97.3	61%	0.612	54%	0.535	S	S	*	.	H	α-helix	trans	-60.8	-37	-176.8	-59.9	-163.4	125.2	0	0	112.2	P11 T16 E17 E18	P11-E14 PolarHBondContact O-N 3.25Å; E14-T16 PolarHBondContact O-N 3.44Å; E14-E17 WeakPolarHBondContact O-CA 3.47Å; E14-E17 WeakPolarHBondContact O-CB 3.48Å; E14-E17 PolarHBondContact O-N 3.09Å; E14-E18 PolarHBondContact O-N 3.21Å
15	V	36.8	Very low	37.7	Very low	97 Å²	97	93.4 Å²	93.4	59%	0.588	52%	0.522	S	S	*	.	H	α-helix	trans	-59.7	-30.5	174.9	179.9	0	0	0	0	112.3	L13 F19	L13-V15 VanDerWaalsContact C-N 3.28Å; L13-V15 PolarHBondContact O-N 3.39Å; V15-F19 WeakPolarHBondContact O-CB 3.3Å; V15-F19 PolarHBondContact O-N 2.87Å
16	T	46.8	Very low	37.7	Very low	38 Å²	38	92.4 Å²	92.4	23%	0.233	51%	0.514	C	S	.	.	H	α-helix	trans	-77.3	-31.1	174.5	70.8	0	0	0	0	112	L13 E14 F19 F20	L13-T16 PolarHBondContact O-N 3.44Å; L13-T16 PolarHBondContact O-OG1 2.97Å; E14-T16 PolarHBondContact O-N 3.44Å; T16-F19 PolarHBondContact O-N 3.02Å; T16-F20 WeakPolarHBondContact O-CD2 3.41Å; T16-F20 PolarHBondContact O-N 3.5Å
17	E	45	Very low	38	Very low	30 Å²	30	89.9 Å²	89.9	14%	0.14	50%	0.496	C	S	.	.	H	α-helix	trans	-71.4	-37.5	175.7	-59.7	-169.7	-178.5	0	0	112.8	L13 E14 F20 S21 R724	L13-E17 PolarHBondContact O-N 3.26Å; E14-E17 WeakPolarHBondContact O-CA 3.47Å; E14-E17 WeakPolarHBondContact O-CB 3.48Å; E14-E17 PolarHBondContact O-N 3.09Å; E17-F20 PolarHBondContact O-N 2.73Å; E17-S21 WeakPolarHBondContact O-CB 3.46Å; E17-S21 PolarHBondContact O-N 2.96Å; E17-S21 PolarHBondContact O-OG 2.98Å; E17-R724 VanDerWaalsContact CD-NH2 3.33Å; E17-R724 IonicContact OE1-CZ 3.97Å; E17-R724 IonicContact OE1-NH1 2.72Å; E17-R724 PolarHBondContact OE1-NH1 3.41Å; E17-R724 IonicContact OE1-NH2 3.16Å; E17-R724 PolarHBondContact OE1-NH2 3.42Å; E17-R724 IonicContact OE2-CZ 3.79Å; E17-R724 VanDerWaalsContact OE2-CZ 3.27Å; E17-R724 IonicContact OE2-NH1 3.11Å; E17-R724 PolarHBondContact OE2-NH1 2.87Å; E17-R724 IonicContact OE2-NH2 3.27Å; E17-R724 PolarHBondContact OE2-NH2 2.84Å; E17-R724 VanDerWaalsContact OE2-NH2 3.11Å
18	E	39.1	Very low	38.1	Very low	140 Å²	140	86.3 Å²	86.3	65%	0.654	47%	0.474	S	S	*	.	H	α-helix	trans	-64.8	-41	170.4	-68.2	-155.6	135.8	0	0	111.9	E14 F20 S21 T22	E14-E18 PolarHBondContact O-N 3.21Å; E18-F20 VanDerWaalsContact C-N 3.27Å; E18-F20 PolarHBondContact O-N 3.33Å; E18-S21 WeakPolarHBondContact CA-OG 3.4Å; E18-S21 PolarHBondContact O-OG 3.45Å; E18-T22 PolarHBondContact O-N 3.27Å; E18-T22 PolarHBondContact O-OG1 3.18Å
19	F	45.6	Very low	38.1	Very low	91 Å²	91	87 Å²	87	40%	0.399	47%	0.47	S	S	.	.	H	α-helix	trans	-60.8	-36.3	174.3	-175.8	-86.9	0	0	0	112.2	V15 T16 T22 L23 A613	V15-F19 WeakPolarHBondContact O-CB 3.3Å; V15-F19 PolarHBondContact O-N 2.87Å; T16-F19 PolarHBondContact O-N 3.02Å; F19-T22 PolarHBondContact O-OG1 2.82Å; F19-L23 WeakPolarHBondContact O-CD1 3.02Å; F19-A613 HydrophobicContact CD1-CB 3.93Å; F19-A613 HydrophobicContact CE1-CB 3.59Å; F19-A613 HydrophobicContact CZ-CB 4.28Å
20	F	48.1	Very low	38.2	Very low	7 Å²	7	84.2 Å²	84.2	3%	0.031	47%	0.469	C	S	.	.	H	α-helix	trans	-83.5	-35.8	179.8	-75.4	-55.4	0	0	0	114.2	T16 E17 E18 T22 L23 A613 Y614 F682 P695 R703	T16-F20 WeakPolarHBondContact O-CD2 3.41Å; T16-F20 PolarHBondContact O-N 3.5Å; E17-F20 PolarHBondContact O-N 2.73Å; E18-F20 VanDerWaalsContact C-N 3.27Å; E18-F20 PolarHBondContact O-N 3.33Å; F20-T22 VanDerWaalsContact C-N 3.32Å; F20-T22 PolarHBondContact O-N 2.98Å; F20-L23 HydrophobicContact CD1-CD1 4.46Å; F20-L23 VanDerWaalsContact O-CD1 3.23Å; F20-L23 WeakPolarHBondContact O-CD1 3.45Å; F20-L23 PolarHBondContact O-N 2.95Å; F20-A613 HydrophobicContact CE1-CB 4.33Å; F20-A613 HydrophobicContact CZ-CB 3.99Å; F20-Y614 AromaticContact CZ-CE2 3.93Å; F20-Y614 HydrophobicContact CZ-CE2 3.93Å; F20-F682 HydrophobicContact CD2-CZ 4.42Å; F20-P695 HydrophobicContact CE1-CB 4.41Å; F20-P695 HydrophobicContact CE1-CG 4.3Å; F20-P695 HydrophobicContact CE2-CG 4.34Å; F20-P695 HydrophobicContact CZ-CG 4.14Å; F20-R703 PolarHBondContact O-NH1 3.13Å
21	S	40.3	Very low	38.4	Very low	45 Å²	45	85.8 Å²	85.8	32%	0.315	48%	0.475	S	S	.	.	H	α-helix	trans	-72.5	-22	-177.7	52.3	0	0	0	0	114	E17 E18 L23	E17-S21 WeakPolarHBondContact O-CB 3.46Å; E17-S21 PolarHBondContact O-N 2.96Å; E17-S21 PolarHBondContact O-OG 2.98Å; E18-S21 WeakPolarHBondContact CA-OG 3.4Å; E18-S21 PolarHBondContact O-OG 3.45Å; S21-L23 PolarHBondContact O-N 3.29Å
22	T	40.1	Very low	38.3	Very low	107 Å²	107	88.2 Å²	88.2	66%	0.656	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.5	-0.1	176.1	45	0	0	0	0	115	E18 F19 F20	E18-T22 PolarHBondContact O-N 3.27Å; E18-T22 PolarHBondContact O-OG1 3.18Å; F19-T22 PolarHBondContact O-OG1 2.82Å; F20-T22 VanDerWaalsContact C-N 3.32Å; F20-T22 PolarHBondContact O-N 2.98Å
23	L	46.5	Very low	38.1	Very low	43 Å²	43	93.3 Å²	93.3	23%	0.225	49%	0.489	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.4	-47.7	-178	-83.8	92.6	0	0	0	115.2	F19 F20 S21 K609	F19-L23 WeakPolarHBondContact O-CD1 3.02Å; F20-L23 HydrophobicContact CD1-CD1 4.46Å; F20-L23 VanDerWaalsContact O-CD1 3.23Å; F20-L23 WeakPolarHBondContact O-CD1 3.45Å; F20-L23 PolarHBondContact O-N 2.95Å; S21-L23 PolarHBondContact O-N 3.29Å; L23-K609 HydrophobicContact CD2-CD 3.94Å
24	D	41.8	Very low	37.8	Very low	49 Å²	49	93.1 Å²	93.1	26%	0.262	50%	0.5	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106	-18.4	-157.9	-60.1	-6.9	0	0	0	114.4	K26 L27 R703	D24-K26 PolarHBondContact O-N 3.02Å; D24-L27 PolarHBondContact O-N 2.9Å; D24-R703 IonicContact OD1-NH2 2.9Å; D24-R703 PolarHBondContact OD1-NH2 3.19Å; D24-R703 IonicContact OD2-CZ 2.65Å; D24-R703 IonicContact OD2-NE 3.86Å; D24-R703 IonicContact OD2-NH2 2.69Å; D24-R703 PolarHBondContact OD2-NH2 3.43Å
25	S	31.8	Very low	37.3	Very low	81 Å²	81	94.5 Å²	94.5	57%	0.566	51%	0.506	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-3.6	-172.9	59.9	0	0	0	0	115.9
26	K	35	Very low	36.9	Very low	165 Å²	165	96.4 Å²	96.4	72%	0.717	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.8	-12.8	171.5	-69	-170.4	175.4	-173.2	0	114.6	D24	D24-K26 PolarHBondContact O-N 3.02Å
27	L	37.8	Very low	36	Very low	77 Å²	77	104.1 Å²	104.1	40%	0.403	54%	0.544	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.3	-46.9	-173.6	-170.7	61.2	0	0	0	112	D24	D24-L27 PolarHBondContact O-N 2.9Å
28	E	34.3	Very low	35.2	Very low	86 Å²	86	105.9 Å²	105.9	40%	0.402	57%	0.57	S	S	.	*	G	3₁₀ helix	trans	-84.4	-19.4	-172.6	-64.9	-179.9	128.6	0	0	114.2	A30 V31 Q32	E28-A30 PolarHBondContact O-N 3.33Å; E28-V31 PolarHBondContact O-N 2.99Å; E28-Q32 PolarHBondContact O-N 3.21Å; E28-Q32 VanDerWaalsContact O-N 3.15Å
29	K	31	Very low	34.8	Very low	160 Å²	160	107.5 Å²	107.5	70%	0.696	58%	0.581	S	S	*	*	G	3₁₀ helix	trans	-63.3	-18.1	171.5	-76.2	-170.5	172.5	-174.5	0	113.4
30	A	35	Very low	33.8	Very low	87 Å²	87	111.9 Å²	111.9	72%	0.719	60%	0.603	S	S	*	*	G	3₁₀ helix	trans	-83.6	-14.7	170.8	0	0	0	0	0	113.5	E28	E28-A30 PolarHBondContact O-N 3.33Å
31	V	35.6	Very low	32.8	Very low	110 Å²	110	120.2 Å²	120.2	67%	0.667	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99	-29.7	-175.9	-176.7	0	0	0	0	111.7	E28	E28-V31 PolarHBondContact O-N 2.99Å
32	Q	27.5	Very low	32.2	Very low	149 Å²	149	124.6 Å²	124.6	70%	0.696	67%	0.667	S	S	*	*	S	Bend	trans	-88	-4.5	-175.1	-67	177.5	-2.4	0	0	115	E28	E28-Q32 PolarHBondContact O-N 3.21Å; E28-Q32 VanDerWaalsContact O-N 3.15Å
33	Q	28.9	Very low	31.7	Very low	182 Å²	182	124.9 Å²	124.9	85%	0.85	67%	0.67	S	S	*	*			trans	-101.4	60.8	173.1	-70.5	-162.3	-66.1	0	0	112.4
34	A	29.1	Very low	30.8	Very low	80 Å²	80	131.8 Å²	131.8	66%	0.661	70%	0.701	S	S	*	*			trans	-117.8	75.8	166	0	0	0	0	0	109.1	V36	A34-V36 PolarHBondContact O-N 2.87Å
35	E	26.5	Very low	30.2	Very low	160 Å²	160	137.7 Å²	137.7	75%	0.748	73%	0.732	S	S	*	*			trans	-65.1	122.9	175.4	-71.9	-171.8	146.8	0	0	110.4	Y37	E35-Y37 HydrophobicContact CB-CE2 4.39Å; E35-Y37 PolarHBondContact O-N 3.32Å
36	V	29.2	Very low	29.9	Very low	137 Å²	137	140 Å²	140	83%	0.83	74%	0.743	S	S	*	*			trans	-77	95.6	-178.3	-179.7	0	0	0	0	109.5	A34 G38	A34-V36 PolarHBondContact O-N 2.87Å; V36-G38 PolarHBondContact O-N 2.97Å; V36-G38 VanDerWaalsContact O-N 3.16Å
37	Y	28.4	Very low	29.6	Very low	201 Å²	201	135.9 Å²	135.9	79%	0.788	75%	0.747	S	S	*	*			trans	-70.3	106.1	164.8	-82.5	-95	0	0	0	109.2	E35	E35-Y37 HydrophobicContact CB-CE2 4.39Å; E35-Y37 PolarHBondContact O-N 3.32Å
38	G	27.5	Very low	29.1	Very low	67 Å²	67	140.4 Å²	140.4	69%	0.691	77%	0.765	S	S	*	*			trans	-63.3	132.8	176.6	0	0	0	0	0	111.6	V36 Q40	V36-G38 PolarHBondContact O-N 2.97Å; V36-G38 VanDerWaalsContact O-N 3.16Å; G38-Q40 PolarHBondContact O-N 3.41Å
39	I	29.9	Very low	28.8	Very low	173 Å²	173	144.2 Å²	144.2	89%	0.887	78%	0.783	S	S	*	*			trans	-73.9	112.6	172.8	-61.2	168.5	0	0	0	107.6
40	Q	25.7	Very low	28.6	Very low	183 Å²	183	143.6 Å²	143.6	86%	0.855	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-94.9	148	171.1	-166.2	157.7	8.1	0	0	110.7	G38	G38-Q40 PolarHBondContact O-N 3.41Å
41	E	27.3	Very low	28.2	Very low	183 Å²	183	146.9 Å²	146.9	86%	0.855	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-71.9	151.8	-163.1	-61.3	171.8	130.4	0	0	113.9
42	V	26.7	Very low	27.8	Very low	137 Å²	137	147.3 Å²	147.3	83%	0.83	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-87.8	125	178.4	180	0	0	0	0	109.8
43	P	30.3	Very low	27.7	Very low	112 Å²	112	146.9 Å²	146.9	73%	0.727	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-70.9	130.1	172.5	-17.9	32.1	0	0	0	112
44	E	26.6	Very low	27.7	Very low	188 Å²	188	146 Å²	146	88%	0.879	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-68.8	141.2	164.7	-66.5	-175.7	118.5	0	0	110.5
45	L	29	Very low	27.5	Very low	174 Å²	174	147.3 Å²	147.3	91%	0.911	81%	0.807	S	S	*	*			trans	-124.7	115.2	167.9	-79.5	174.7	0	0	0	110.2
46	V	27	Very low	27.5	Very low	130 Å²	130	145.6 Å²	145.6	79%	0.788	80%	0.803	S	S	*	*			trans	-76	130.3	178.8	178.2	0	0	0	0	110.1
47	G	27.3	Very low	27.4	Very low	77 Å²	77	146 Å²	146	79%	0.794	80%	0.801	S	S	*	*			trans	-115.5	115.9	169.8	0	0	0	0	0	110.8
48	H	27.6	Very low	27.4	Very low	172 Å²	172	139.5 Å²	139.5	80%	0.796	79%	0.794	S	S	*	*			trans	-88	161.1	179.2	-113.8	-87	0	0	0	113.1
49	E	28.3	Very low	27.5	Very low	167 Å²	167	141.1 Å²	141.1	78%	0.78	80%	0.801	S	S	*	*			trans	-70	146.3	-173.5	-48.5	165.7	134.5	0	0	114.5
50	V	26.6	Very low	27.3	Very low	147 Å²	147	140.7 Å²	140.7	89%	0.891	80%	0.797	S	S	*	*			trans	-144	135.9	145.5	-177.9	0	0	0	0	109.1
51	L	26.8	Very low	27.5	Very low	155 Å²	155	143 Å²	143	81%	0.812	80%	0.798	S	S	*	*			trans	-91.3	145.8	174.4	-73.5	121.8	0	0	0	112.5
52	S	27.5	Very low	27.5	Very low	119 Å²	119	140.9 Å²	140.9	83%	0.832	79%	0.793	S	S	*	*			trans	-156.9	128.9	140	59.7	0	0	0	0	113.9
53	N	26	Very low	27.5	Very low	140 Å²	140	139.8 Å²	139.8	75%	0.749	79%	0.786	S	S	*	*			trans	-40	160.2	169.8	-48	-35.3	0	0	0	115
54	I	27.5	Very low	27.4	Very low	164 Å²	164	140.4 Å²	140.4	84%	0.841	79%	0.788	S	S	*	*				-159.6	157.4	83.7	-91.8	158.5	0	0	0	112.6
55	T	26.1	Very low	27.5	Very low	107 Å²	107	136.4 Å²	136.4	66%	0.656	78%	0.781	S	S	*	*			trans	-66.7	170.8	176.4	51.3	0	0	0	0	112.8
56	D	26.5	Very low	27.5	Very low	124 Å²	124	135.8 Å²	135.8	66%	0.663	78%	0.778	S	S	*	*			cis	-149.2	148.9	38.3	-97	-68.8	0	0	0	111.8
57	N	26	Very low	27.5	Very low	147 Å²	147	133 Å²	133	79%	0.786	78%	0.775	S	S	*	*				44.2	132.8	92.9	-63.5	-52	0	0	0	115.5
58	G	29.5	Very low	27.7	Very low	64 Å²	64	139.3 Å²	139.3	66%	0.66	78%	0.781	S	S	*	*			cis	-155.9	162.7	0.8	0	0	0	0	0	111
59	A	28.4	Very low	27.6	Very low	100 Å²	100	134.7 Å²	134.7	83%	0.826	78%	0.78	S	S	*	*				65.8	134.4	86.3	0	0	0	0	0	113.9
60	M	26.1	Very low	27.4	Very low	165 Å²	165	130.5 Å²	130.5	81%	0.813	78%	0.782	S	S	*	*			cis	-167.9	178.7	1.6	-120.1	-68.9	-177	0	0	109.5
61	R	30.1	Very low	27.5	Very low	230 Å²	230	132.7 Å²	132.7	87%	0.868	78%	0.784	S	S	*	*			trans	91.6	143.9	168.4	-57.6	175.4	179.8	-177.7	0.6	117.8
62	N	27.4	Very low	27.6	Very low	140 Å²	140	132.9 Å²	132.9	75%	0.749	79%	0.785	S	S	*	*			cis	-168.8	167.9	-34	-128.3	-3.6	0	0	0	112.6
63	V	27	Very low	27.4	Very low	114 Å²	114	136.9 Å²	136.9	69%	0.691	78%	0.782	S	S	*	*			trans	73.9	94.9	151.4	171.6	0	0	0	0	118.6
64	T	27.4	Very low	27.3	Very low	124 Å²	124	135.6 Å²	135.6	76%	0.761	78%	0.775	S	S	*	*			trans	42.5	144.1	131.9	61.3	0	0	0	0	121.9
65	S	29.7	Very low	27.2	Very low	104 Å²	104	135.3 Å²	135.3	73%	0.727	77%	0.77	S	S	*	*			cis	-176.5	-165.8	-2.1	52.7	0	0	0	0	108.1
66	L	29.2	Very low	27	Very low	162 Å²	162	135.4 Å²	135.4	85%	0.848	77%	0.773	S	S	*	*			cis	-159.2	120.1	8.2	-177.6	64.3	0	0	0	112.2
67	G	27	Very low	26.8	Very low	72 Å²	72	139 Å²	139	74%	0.742	78%	0.783	S	S	*	*			trans	74.4	153.3	164.5	0	0	0	0	0	116.9
68	K	30.2	Very low	26.6	Very low	208 Å²	208	137.7 Å²	137.7	90%	0.904	79%	0.786	S	S	*	*			cis	-135.4	151.7	-1.5	-68.2	177.5	176.7	177.4	0	109.7
69	G	25.7	Very low	26.3	Very low	76 Å²	76	145.7 Å²	145.7	78%	0.784	80%	0.796	S	S	*	*			trans	-75.9	172.8	165.4	0	0	0	0	0	112.3
70	G	24.3	Very low	26	Very low	79 Å²	79	147.9 Å²	147.9	81%	0.814	79%	0.793	S	S	*	*			cis	101.6	109.5	2.4	0	0	0	0	0	113.5
71	M	28.9	Very low	25.9	Very low	192 Å²	192	146.5 Å²	146.5	95%	0.946	79%	0.788	S	S	*	*			trans	-166.7	139.4	166.3	-128.6	174.4	176.9	0	0	111.8
72	I	28.5	Very low	25.6	Very low	160 Å²	160	143 Å²	143	82%	0.821	78%	0.781	S	S	*	*			trans	-148.5	162	166.9	-41.4	179.1	0	0	0	106.6
73	W	23.8	Very low	25.4	Very low	202 Å²	202	141.5 Å²	141.5	77%	0.765	78%	0.778	S	S	*	*			trans	86	86.2	171.7	-87.1	73.2	0	0	0	119.7
74	D	24.9	Very low	25.2	Very low	113 Å²	113	145 Å²	145	60%	0.604	78%	0.784	S	S	*	*				76.8	151.6	104.7	-66.3	13.6	0	0	0	125.8
75	H	24.8	Very low	25.1	Very low	159 Å²	159	143.5 Å²	143.5	74%	0.736	78%	0.784	S	S	*	*			trans	69.2	119.3	159.1	-72.3	-57.5	0	0	0	122.6
76	C	21.7	Very low	24.8	Very low	108 Å²	108	146.4 Å²	146.4	73%	0.73	79%	0.786	S	S	*	*				-163.1	124.4	118.5	-110.8	0	0	0	0	116.9
77	K	23.4	Very low	24.5	Very low	200 Å²	200	145.1 Å²	145.1	87%	0.87	78%	0.78	S	S	*	*			trans	57.8	157.4	134.2	-66.6	178	-179.4	175.3	0	122.5
78	S	21.8	Very low	24.3	Very low	120 Å²	120	148.3 Å²	148.3	84%	0.839	79%	0.785	S	S	*	*			trans	-120.9	166.8	-173.6	41.9	0	0	0	0	112.3
79	R	21.3	Very low	23.9	Very low	231 Å²	231	147.4 Å²	147.4	87%	0.872	78%	0.781	S	S	*	*			trans	165.1	108.3	134.5	-179.5	175.6	-81.6	-160.2	-5.1	113.9
80	L	23.2	Very low	24.5	Very low	147 Å²	147	149 Å²	149	77%	0.77	78%	0.778	S	S	*	*				33.6	123.5	124.1	-111.8	164.9	0	0	0	120.3
81	L	24.1	Very low	24.5	Very low	136 Å²	136	149 Å²	149	71%	0.712	77%	0.77	S	S	*	*				171.4	133	111.8	-92.4	167.7	0	0	0	117.6
82	E	22.7	Very low	24.3	Very low	155 Å²	155	148.4 Å²	148.4	72%	0.724	76%	0.762	S	S	*	*			trans	76.9	137.3	133.8	-98.2	175.6	-146.3	0	0	129
83	T	24.4	Very low	24.1	Very low	109 Å²	109	146.4 Å²	146.4	67%	0.669	75%	0.749	S	S	*	*			trans	71.1	150.8	153	63.9	0	0	0	0	120.1
84	K	23.4	Very low	24.1	Very low	188 Å²	188	144.2 Å²	144.2	82%	0.817	75%	0.747	S	S	*	*			cis	-161.9	145.8	-7.7	-122.3	166.9	-177.5	170.7	0	111
85	A	24.3	Very low	24	Very low	92 Å²	92	147.2 Å²	147.2	76%	0.76	76%	0.755	S	S	*	*			trans	56.7	173.1	147.5	0	0	0	0	0	119.9
86	Q	23	Very low	23.9	Very low	166 Å²	166	146.6 Å²	146.6	78%	0.776	76%	0.755	S	S	*	*			cis	-165.2	149.2	-46.6	-175	167.5	12.3	0	0	108.4
87	N	23.2	Very low	24.1	Very low	135 Å²	135	147.5 Å²	147.5	72%	0.722	76%	0.757	S	S	*	*			trans	6.6	137.2	166.9	-52.3	-10.2	0	0	0	121.3
88	V	22.3	Very low	24.1	Very low	139 Å²	139	147.4 Å²	147.4	84%	0.842	76%	0.759	S	S	*	*				179.6	150.4	113.9	147.1	0	0	0	0	114.2
89	F	22.6	Very low	24.2	Very low	188 Å²	188	153.4 Å²	153.4	83%	0.825	76%	0.763	S	S	*	*			trans	-67.9	-173.4	175.5	-74.4	-77.3	0	0	0	115.7
90	P	38.3	Very low	24.2	Very low	110 Å²	110	145.4 Å²	145.4	71%	0.714	75%	0.753	S	S	*	*			cis	-144.4	-174.3	-41.9	39.8	-21.6	0	0	0	116.1
91	A	23.5	Very low	24.3	Very low	80 Å²	80	145.2 Å²	145.2	66%	0.661	76%	0.759	S	S	*	*			trans	83	140.3	132.7	0	0	0	0	0	124.5
92	K	25.2	Very low	24.4	Very low	179 Å²	179	144.3 Å²	144.3	78%	0.778	76%	0.759	S	S	*	*			trans	70.6	143.4	142.9	-80.3	-179.9	172.2	-124.9	0	118.4
93	E	23.9	Very low	24.8	Very low	117 Å²	117	142.8 Å²	142.8	55%	0.547	76%	0.762	S	S	.	*			cis	-165.3	177.2	1.4	-140	169	-123.2	0	0	112.7
94	Q	24.5	Very low	24.8	Very low	156 Å²	156	144 Å²	144	73%	0.729	77%	0.765	S	S	*	*			trans	72.1	150.9	153	-69.5	167.8	41.2	0	0	121.7
95	F	22.4	Very low	25	Very low	176 Å²	176	141.7 Å²	141.7	77%	0.772	76%	0.761	S	S	*	*			cis	-162.9	154	-39.3	-136	-96.6	0	0	0	111
96	M	22.9	Very low	25.2	Very low	146 Å²	146	144.4 Å²	144.4	72%	0.719	76%	0.762	S	S	*	*			trans	26.1	115.6	164.7	-78.2	173.5	59.8	0	0	125.1
97	V	25.6	Very low	25.2	Very low	127 Å²	127	140.7 Å²	140.7	77%	0.77	75%	0.754	S	S	*	*				42.3	128.4	106.7	179.5	0	0	0	0	121.5
98	Q	23.4	Very low	25.3	Very low	199 Å²	199	146.3 Å²	146.3	93%	0.93	77%	0.766	S	S	*	*			trans	-149.4	176.7	135.2	-113.9	-173.5	35	0	0	113.2
99	R	23.2	Very low	25.3	Very low	245 Å²	245	147.4 Å²	147.4	93%	0.925	76%	0.763	S	S	*	*			trans	-146	140.3	-161.8	173.7	-156.8	-80.1	-165.7	-3.8	111.5
100	G	22.8	Very low	25.6	Very low	64 Å²	64	145.5 Å²	145.5	66%	0.66	76%	0.757	S	S	*	*			trans	-178.6	99	167.6	0	0	0	0	0	119
101	T	23.7	Very low	24.9	Very low	143 Å²	143	147.1 Å²	147.1	88%	0.877	76%	0.755	S	S	*	*			trans	50	153.4	133.8	-31.7	0	0	0	0	123.6
102	T	26.9	Very low	25	Very low	116 Å²	116	152.3 Å²	152.3	71%	0.712	76%	0.763	S	S	*	*			trans	-88.3	174.6	-178.8	50.4	0	0	0	0	114.7
103	P	30.6	Very low	25	Very low	124 Å²	124	153.3 Å²	153.3	81%	0.805	77%	0.77	S	S	*	*				-140.8	177.1	110.2	40.5	-28.9	0	0	0	115.4
104	D	24.8	Very low	25	Very low	135 Å²	135	152.3 Å²	152.3	72%	0.722	78%	0.782	S	S	*	*			trans	-92.4	169.9	-171.2	-54.8	-84.5	0	0	0	116.4
105	N	27.7	Very low	25	Very low	138 Å²	138	150 Å²	150	74%	0.738	78%	0.784	S	S	*	*				128.2	127.8	127	-84.7	-50.2	0	0	0	118.9
106	L	28.3	Very low	25.1	Very low	150 Å²	150	146.9 Å²	146.9	79%	0.785	78%	0.779	S	S	*	*			trans	61.8	155.1	141.1	-60.3	170.1	0	0	0	119.3
107	S	23.6	Very low	25.3	Very low	87 Å²	87	149.1 Å²	149.1	61%	0.608	79%	0.785	S	S	*	*			cis	-176.9	144.8	-29.1	54.1	0	0	0	0	108.4
108	W	24.1	Very low	25.4	Very low	253 Å²	253	150 Å²	150	96%	0.958	79%	0.785	S	S	*	*			trans	-157.8	149.1	142.7	-103.5	98.5	0	0	0	109.5
109	M	23.7	Very low	25.4	Very low	162 Å²	162	149.9 Å²	149.9	80%	0.798	78%	0.782	S	S	*	*			trans	-150.1	-174.8	-170.5	-164.1	174.1	179.1	0	0	108.6
110	E	27.8	Very low	25.7	Very low	148 Å²	148	146.9 Å²	146.9	69%	0.692	78%	0.776	S	S	*	*			trans	79.2	146.6	168.5	-50.2	-141.3	103	0	0	115.4
111	Q	24.8	Very low	26	Very low	145 Å²	145	150 Å²	150	68%	0.678	78%	0.777	S	S	*	*			cis	-145.2	141.3	-12.8	-110.7	159.7	23.8	0	0	105.1
112	K	25.5	Very low	26.1	Very low	188 Å²	188	150.8 Å²	150.8	82%	0.817	78%	0.775	S	S	*	*			cis	70.4	103.6	40.7	-170.3	-158.3	-177.9	-171	0	113.5
113	E	23.9	Very low	26.1	Very low	200 Å²	200	150.3 Å²	150.3	94%	0.935	78%	0.775	S	S	*	*			trans	-150.3	163.4	142.1	-130.4	174.1	-149.2	0	0	111.5
114	A	25.1	Very low	26.2	Very low	97 Å²	97	153.3 Å²	153.3	80%	0.802	78%	0.778	S	S	*	*			trans	-158.1	156.3	-165.7	0	0	0	0	0	113.7
115	S	23.4	Very low	26.3	Very low	108 Å²	108	157.5 Å²	157.5	76%	0.755	78%	0.784	S	S	*	*			trans	-151.7	94.9	167	177.8	0	0	0	0	108.2
116	T	26.1	Very low	26.2	Very low	109 Å²	109	162 Å²	162	67%	0.669	79%	0.791	S	S	*	*				60.5	111.9	94.4	52.7	0	0	0	0	116.4
117	F	25.4	Very low	26.6	Very low	194 Å²	194	165.4 Å²	165.4	85%	0.851	79%	0.793	S	S	*	*				-149.1	146.4	113.5	-105.4	-74.6	0	0	0	110.1
118	N	27.9	Very low	26.7	Very low	145 Å²	145	169.1 Å²	169.1	78%	0.775	81%	0.806	S	S	*	*			trans	-134.8	143.3	179.3	-96.1	-42.9	0	0	0	109.1
119	F	24.9	Very low	27	Very low	197 Å²	197	168.4 Å²	168.4	86%	0.864	80%	0.803	S	S	*	*			trans	-143.5	151.2	161.6	-98.7	-79.5	0	0	0	111.5
120	F	28.7	Very low	27.8	Very low	181 Å²	181	165.5 Å²	165.5	79%	0.794	80%	0.796	S	S	*	*			trans	-82.4	144.1	-172.1	-84.3	-118.5	0	0	0	111
121	N	28.3	Very low	27.7	Very low	129 Å²	129	169.3 Å²	169.3	69%	0.69	81%	0.805	S	S	*	*			cis	81.7	106.1	47.3	-177.5	13.8	0	0	0	113.5
122	I	27.1	Very low	27.9	Very low	161 Å²	161	167.4 Å²	167.4	83%	0.826	81%	0.807	S	S	*	*			trans	-173.3	140	166.7	-103.4	156.9	0	0	0	106.2
123	C	26.8	Very low	27.8	Very low	106 Å²	106	164.1 Å²	164.1	72%	0.716	80%	0.803	S	S	*	*			cis	-141.1	138.8	7.8	-145.7	0	0	0	0	113.3
124	Q	31.8	Very low	27.9	Very low	187 Å²	187	160.9 Å²	160.9	87%	0.874	79%	0.791	S	S	*	*			trans	-124	128.4	152.1	-79.7	-170.8	-0.7	0	0	108.5
125	R	27	Very low	28	Very low	222 Å²	222	161.5 Å²	161.5	84%	0.838	78%	0.782	S	S	*	*			trans	171.3	150.4	165.6	-99.5	165.2	-140.4	-150	8.1	108.1
126	R	26.4	Very low	28.2	Very low	234 Å²	234	163 Å²	163	88%	0.883	78%	0.78	S	S	*	*			cis	-159.4	178.7	-21.5	-126.4	-176.9	-162.9	-163.3	3.7	107.9
127	R	37	Very low	28.3	Very low	221 Å²	221	164.1 Å²	164.1	83%	0.834	78%	0.782	S	S	*	*			trans	-71.8	158.1	173.4	-58.4	172.7	-178.3	159.9	-0.6	111.4
128	D	24.2	Very low	28.5	Very low	164 Å²	164	159.1 Å²	159.1	88%	0.877	76%	0.764	S	S	*	*				-174.5	179.6	108.2	-85.3	-26.2	0	0	0	113
129	R	31	Very low	28.6	Very low	238 Å²	238	156.7 Å²	156.7	90%	0.898	75%	0.748	S	S	*	*			trans	-133.6	178.3	-172.5	-130	-177.3	178.7	174.5	-0	107.2
130	P	41.2	Very low	28.6	Very low	101 Å²	101	151.2 Å²	151.2	66%	0.656	73%	0.731	S	S	*	*			cis	-139.5	-150.5	-4.4	39.9	-16.8	0	0	0	113.8
131	R	24.9	Very low	28.4	Very low	229 Å²	229	145.1 Å²	145.1	86%	0.864	71%	0.71	S	S	*	*			trans	89.9	125.4	173.8	-57	-176.1	-179.8	-171.2	-1	113.7
132	S	28.4	Very low	28.2	Very low	105 Å²	105	140.9 Å²	140.9	73%	0.734	69%	0.689	S	S	*	*				69.7	126.7	61.6	-167.7	0	0	0	0	110.3
133	V	25.1	Very low	27.9	Very low	119 Å²	119	138.4 Å²	138.4	72%	0.721	67%	0.673	S	S	*	*			cis	-125	148.9	45.2	-175.9	0	0	0	0	109
134	N	25.5	Very low	28.2	Very low	131 Å²	131	137 Å²	137	70%	0.701	65%	0.654	S	S	*	*				39.1	149.6	89	-90.7	60.5	0	0	0	113.5
135	D	26.6	Very low	28.2	Very low	111 Å²	111	132.6 Å²	132.6	59%	0.594	64%	0.642	S	S	*	*			cis	-171.3	161.8	38.2	-137.7	-11.6	0	0	0	113
136	L	28.6	Very low	28	Very low	138 Å²	138	125.7 Å²	125.7	72%	0.723	64%	0.639	S	S	*	*			trans	63.1	157.7	156.3	-51.8	169.4	0	0	0	119.6
137	L	28.1	Very low	28.3	Very low	134 Å²	134	121.2 Å²	121.2	70%	0.702	63%	0.628	S	S	*	*			cis	-145	145.7	-40.6	-86.5	169.7	0	0	0	104.2
138	D	28.2	Very low	27.9	Very low	89 Å²	89	115.6 Å²	115.6	48%	0.476	63%	0.629	S	S	.	*			cis	73.9	155.4	46.5	-144.8	14.1	0	0	0	113.9	N211	D138-N211 PolarHBondContact OD1-ND2 3.13Å; D138-N211 PolarHBondContact OD2-ND2 2.88Å; D138-N211 VanDerWaalsContact OD2-ND2 3.16Å
139	E	30	Very low	28	Very low	94 Å²	94	119.3 Å²	119.3	44%	0.439	63%	0.631	S	S	.	*			trans	70.9	119.2	162.6	-65.1	-71.3	113.2	0	0	122.1	Y238	E139-Y238 HydrophobicContact CB-CE2 4.36Å; E139-Y238 HydrophobicContact CG-CE2 4.33Å; E139-Y238 WeakPolarHBondContact OE1-CE2 3.47Å; E139-Y238 PolarHBondContact OE1-OH 3.36Å; E139-Y238 PolarHBondContact OE2-OH 2.91Å; E139-Y238 VanDerWaalsContact OE2-OH 3.11Å
140	T	25.2	Very low	27.9	Very low	82 Å²	82	113 Å²	113	50%	0.503	62%	0.623	S	S	.	*			trans	80.4	142.4	146.5	62	0	0	0	0	120	Y238	T140-Y238 VanDerWaalsContact CA-CE1 3.41Å; T140-Y238 HydrophobicContact CG2-CE1 4.12Å; T140-Y238 VanDerWaalsContact N-CZ 3.34Å
141	S	25.4	Very low	27.3	Very low	53 Å²	53	120 Å²	120	37%	0.371	64%	0.636	S	S	.	*			cis	179.9	179.6	-4.6	69.3	0	0	0	0	111.6
142	T	24.1	Very low	28.1	Very low	40 Å²	40	112.6 Å²	112.6	25%	0.245	62%	0.62	C	S	.	*			cis	149.9	0	-14.8	-136.4	0	0	0	0	110.4	A309 A310 V311 P312	T142-A309 PolarHBondContact OG1-O 3.32Å; T142-A310 HydrophobicContact CG2-CB 3.47Å; T142-A310 VanDerWaalsContact CG2-CB 3.47Å; T142-A310 WeakPolarHBondContact OG1-CA 3.41Å; T142-A310 WeakPolarHBondContact OG1-CB 3.32Å; T142-V311 WeakPolarHBondContact O-CA 3.48Å; T142-P312 WeakPolarHBondContact O-CD 3.38Å
143	F	21.2	Very low	28	Very low	109 Å²	109	114.8 Å²	114.8	48%	0.478	62%	0.623	S	S	.	*				0	173	0	-105.3	-61.7	0	0	0	109.8	V307 H308 A310 V311	F143-V307 WeakPolarHBondContact CA-O 3.49Å; F143-H308 HydrophobicContact CD1-CB 3.99Å; F143-H308 WeakPolarHBondContact CD1-O 3.34Å; F143-H308 WeakPolarHBondContact CE1-O 3.19Å; F143-A310 HydrophobicContact CB-CB 3.3Å; F143-A310 HydrophobicContact CD1-CB 3.46Å; F143-A310 VanDerWaalsContact CD1-CB 3.46Å; F143-A310 HydrophobicContact CD2-CB 3.85Å; F143-A310 VanDerWaalsContact CD2-O 3.3Å; F143-A310 WeakPolarHBondContact CD2-O 3.43Å; F143-A310 HydrophobicContact CE1-CB 4.25Å; F143-A310 WeakPolarHBondContact CE2-O 3.32Å; F143-A310 HydrophobicContact CG-CB 3.12Å; F143-V311 HydrophobicContact CB-CB 3.64Å; F143-V311 HydrophobicContact CB-CG1 4.09Å; F143-V311 HydrophobicContact CD2-CB 3.97Å; F143-V311 HydrophobicContact CD2-CG1 3.67Å; F143-V311 HydrophobicContact CG-CB 4.29Å; F143-V311 HydrophobicContact CG-CG1 4.38Å
144	K	32.8	Very low	28.3	Very low	77 Å²	77	114.9 Å²	114.9	34%	0.335	62%	0.618	S	S	.	*				-43.8	-161.6	128.3	-106.1	177	-167.1	141.2	0	117.5	H308	K144-H308 VanDerWaalsContact CD-NE2 3.33Å; K144-H308 WeakPolarHBondContact CD-NE2 3.48Å; K144-H308 WeakPolarHBondContact CE-NE2 3.4Å; K144-H308 PolarHBondContact N-ND1 3.24Å; K144-H308 PolarHBondContact NZ-CD2 3.24Å; K144-H308 PolarHBondContact NZ-NE2 3.21Å
145	P	32	Very low	28.5	Very low	94 Å²	94	113 Å²	113	61%	0.61	61%	0.612	S	S	*	*			cis	-126.4	169.4	-1.3	42.9	-27.6	0	0	0	116.6
146	G	23	Very low	28.8	Very low	76 Å²	76	113 Å²	113	78%	0.784	61%	0.609	S	S	*	*			trans	167.4	105.5	161.7	0	0	0	0	0	114.3
147	H	32	Very low	29.2	Very low	141 Å²	141	109.6 Å²	109.6	65%	0.653	59%	0.593	S	S	*	*			trans	-104.3	146.1	173	-81.1	-81	0	0	0	111.6
148	A	28.7	Very low	29.7	Very low	103 Å²	103	106.8 Å²	106.8	85%	0.851	58%	0.579	S	S	*	*			trans	-149.1	103.1	154.2	0	0	0	0	0	112.3
149	R	26.5	Very low	30.4	Very low	242 Å²	242	105 Å²	105	91%	0.913	57%	0.565	S	S	*	*			trans	-13.8	133.8	163.6	-62.6	166.7	172.3	168.3	-4.6	118.2
150	S	28.6	Very low	30.7	Very low	104 Å²	104	108.5 Å²	108.5	73%	0.727	58%	0.575	S	S	*	*				163	114.5	110.9	-177	0	0	0	0	112.5
151	R	29.3	Very low	31.4	Very low	249 Å²	249	110 Å²	110	94%	0.94	58%	0.583	S	S	*	*	S	Bend	trans	-174.1	-8.1	134.2	-107.9	175.7	178.6	-154.2	-5.6	119.6
152	S	40.7	Very low	32.1	Very low	74 Å²	74	111.9 Å²	111.9	52%	0.517	59%	0.592	S	S	.	*			cis	-148.8	169	-8.7	-53.1	0	0	0	0	108
153	D	27.1	Very low	32.7	Very low	150 Å²	150	117 Å²	117	80%	0.802	62%	0.617	S	S	*	*			trans	65	62.6	154.2	-45	-23.5	0	0	0	116.2
154	I	31	Very low	33	Very low	121 Å²	121	120.2 Å²	120.2	62%	0.621	63%	0.631	S	S	*	*				-42.5	138.6	129.2	-70.6	171.1	0	0	0	107.7	Q156	I154-Q156 HydrophobicContact CG2-CG 4.22Å; I154-Q156 PolarHBondContact O-N 2.93Å
155	T	29.2	Very low	32.8	Very low	93 Å²	93	123.4 Å²	123.4	57%	0.571	66%	0.657	S	S	*	*			trans	-70.1	53	175.7	38.7	0	0	0	0	113.1	V157 G269	T155-V157 PolarHBondContact O-N 3.01Å; T155-G269 WeakPolarHBondContact OG1-CA 3.49Å; T155-G269 PolarHBondContact OG1-O 3.17Å
156	Q	32.9	Very low	32.4	Very low	111 Å²	111	125.1 Å²	125.1	52%	0.519	67%	0.666	S	S	.	*			trans	-62.6	125.1	157	-78.1	-172.3	-7.8	0	0	108	I154 D158	I154-Q156 HydrophobicContact CG2-CG 4.22Å; I154-Q156 PolarHBondContact O-N 2.93Å; Q156-D158 PolarHBondContact O-N 3.21Å; Q156-D158 VanDerWaalsContact O-N 3.1Å
157	V	36.3	Very low	32.5	Very low	66 Å²	66	127.5 Å²	127.5	40%	0.4	67%	0.668	S	S	.	*			trans	-68.6	106.4	174.1	-179.1	0	0	0	0	109	T155 W159 V162	T155-V157 PolarHBondContact O-N 3.01Å; V157-W159 HydrophobicContact CB-CZ2 4.23Å; V157-W159 HydrophobicContact CG1-CD2 3.74Å; V157-W159 HydrophobicContact CG1-CE3 3.86Å; V157-W159 HydrophobicContact CG1-CG 4.32Å; V157-W159 HydrophobicContact CG1-CH2 4.11Å; V157-W159 HydrophobicContact CG1-CZ2 3.99Å; V157-W159 HydrophobicContact CG1-CZ3 4.05Å; V157-W159 PolarHBondContact O-N 2.66Å; V157-W159 VanDerWaalsContact O-N 3.08Å; V157-V162 HydrophobicContact CG1-CG2 4.4Å
158	D	39.5	Very low	32.2	Very low	75 Å²	75	128.4 Å²	128.4	40%	0.401	68%	0.677	S	S	.	*			trans	-77.3	90.2	166	-175.3	4.3	0	0	0	109.7	Q156 R160 V161	Q156-D158 PolarHBondContact O-N 3.21Å; Q156-D158 VanDerWaalsContact O-N 3.1Å; D158-R160 PolarHBondContact O-N 3.46Å; D158-R160 WeakPolarHBondContact OD1-CB 3.44Å; D158-R160 PolarHBondContact OD1-N 3.49Å; D158-V161 PolarHBondContact O-N 3.04Å
159	W	42.3	Very low	32.1	Very low	50 Å²	50	132 Å²	132	19%	0.189	68%	0.676	C	S	.	*	H	α-helix	trans	-50.8	-18.4	175.6	-59.2	106.2	0	0	0	114.3	V157 V161 V162 Q301 W304	V157-W159 HydrophobicContact CB-CZ2 4.23Å; V157-W159 HydrophobicContact CG1-CD2 3.74Å; V157-W159 HydrophobicContact CG1-CE3 3.86Å; V157-W159 HydrophobicContact CG1-CG 4.32Å; V157-W159 HydrophobicContact CG1-CH2 4.11Å; V157-W159 HydrophobicContact CG1-CZ2 3.99Å; V157-W159 HydrophobicContact CG1-CZ3 4.05Å; V157-W159 PolarHBondContact O-N 2.66Å; V157-W159 VanDerWaalsContact O-N 3.08Å; W159-V161 VanDerWaalsContact C-N 3.33Å; W159-V161 PolarHBondContact O-N 3.3Å; W159-V162 PolarHBondContact O-N 2.99Å; W159-Q301 HydrophobicContact CH2-CB 3.82Å; W159-Q301 HydrophobicContact CH2-CG 3.69Å; W159-Q301 HydrophobicContact CZ2-CB 3.72Å; W159-Q301 HydrophobicContact CZ2-CG 3.81Å; W159-Q301 HydrophobicContact CZ3-CG 4.13Å; W159-W304 HydrophobicContact CB-CH2 4.18Å; W159-W304 HydrophobicContact CB-CZ2 4.46Å; W159-W304 HydrophobicContact CB-CZ3 4.44Å; W159-W304 AromaticContact CD1-CD2 3.69Å; W159-W304 AromaticContact CD1-CE2 3.48Å; W159-W304 VanDerWaalsContact CD1-CE2 3.48Å; W159-W304 AromaticContact CD1-CZ2 3.71Å; W159-W304 AromaticContact CD1-NE1 3.78Å; W159-W304 HydrophobicContact CG-CH2 4.46Å; W159-W304 HydrophobicContact CG-CZ2 4.45Å
160	R	36.9	Very low	32.1	Very low	169 Å²	169	129.4 Å²	129.4	64%	0.638	67%	0.674	S	S	*	*	H	α-helix	trans	-76.2	-17.1	179.6	-148.8	-174.5	-57.5	-136	-0.5	113.9	D158	D158-R160 PolarHBondContact O-N 3.46Å; D158-R160 WeakPolarHBondContact OD1-CB 3.44Å; D158-R160 PolarHBondContact OD1-N 3.49Å
161	V	39	Very low	32.1	Very low	113 Å²	113	130.5 Å²	130.5	69%	0.685	68%	0.679	S	S	*	*	H	α-helix	trans	-85.3	-36	172.3	-179.5	0	0	0	0	111.1	D158 W159 L163	D158-V161 PolarHBondContact O-N 3.04Å; W159-V161 VanDerWaalsContact C-N 3.33Å; W159-V161 PolarHBondContact O-N 3.3Å; V161-L163 PolarHBondContact O-N 2.95Å
162	V	41.7	Very low	31.8	Very low	93 Å²	93	127.9 Å²	127.9	56%	0.564	68%	0.677	S	S	*	*	H	α-helix	trans	-62.9	-24.2	-174.1	-176.5	0	0	0	0	113.4	V157 W159	V157-V162 HydrophobicContact CG1-CG2 4.4Å; W159-V162 PolarHBondContact O-N 2.99Å
163	L	36.9	Very low	31.2	Very low	147 Å²	147	133.4 Å²	133.4	77%	0.77	70%	0.695	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.4	25.4	-169.4	-66.6	172.1	0	0	0	115.1	V161	V161-L163 PolarHBondContact O-N 2.95Å
164	K	26.3	Very low	31.1	Very low	177 Å²	177	135.3 Å²	135.3	77%	0.77	70%	0.699	S	S	*	*			trans	-108.9	78.5	174.8	-87	-160.9	172.9	-171.3	0	114.3	T166	K164-T166 PolarHBondContact O-N 3.15Å
165	T	28	Very low	30.7	Very low	143 Å²	143	138.2 Å²	138.2	88%	0.877	71%	0.71	S	S	*	*			trans	-89.1	91.8	157.7	51.6	0	0	0	0	110.3
166	T	24.6	Very low	30.7	Very low	131 Å²	131	138.8 Å²	138.8	80%	0.804	72%	0.715	S	S	*	*			trans	-68	143.2	165	11.2	0	0	0	0	110.3	K164	K164-T166 PolarHBondContact O-N 3.15Å
167	P	26.1	Very low	30.2	Very low	125 Å²	125	137.9 Å²	137.9	81%	0.812	72%	0.721	S	S	*	*			trans	-79.6	139.8	-164.1	31.1	-35.6	0	0	0	113.3
168	L	25.1	Very low	29.7	Very low	160 Å²	160	141.3 Å²	141.3	84%	0.838	74%	0.736	S	S	*	*			trans	-103.1	108.5	172.8	-117.8	162	0	0	0	110.3
169	Q	25.9	Very low	29.1	Very low	178 Å²	178	146.2 Å²	146.2	83%	0.832	76%	0.757	S	S	*	*			trans	10.2	111.7	161	-63.5	171.6	-6.5	0	0	118.3
170	Q	27.6	Very low	28.1	Very low	189 Å²	189	147.1 Å²	147.1	88%	0.883	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-81.1	137.7	146.9	-74.4	-179.1	-25.5	0	0	109.4
171	P	27.1	Very low	28	Very low	127 Å²	127	144.2 Å²	144.2	83%	0.825	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-71.1	155.2	169.4	30.5	-34	0	0	0	111.4
172	Q	23.4	Very low	27.3	Very low	194 Å²	194	147.2 Å²	147.2	91%	0.907	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-73.6	138.2	-175.1	-59.1	167.5	-57.6	0	0	112.7
173	Q	27.7	Very low	26.5	Very low	190 Å²	190	149.9 Å²	149.9	89%	0.888	81%	0.807	S	S	*	*			trans	-146.8	98	146.4	-114.8	171.1	26.6	0	0	112.6
174	Q	25.8	Very low	25.9	Very low	190 Å²	190	148.8 Å²	148.8	89%	0.888	81%	0.807	S	S	*	*			trans	50	116.2	147.5	-64.4	175.9	-3.7	0	0	121.5
175	Q	22.7	Very low	25.9	Very low	182 Å²	182	150.7 Å²	150.7	85%	0.85	81%	0.809	S	S	*	*			trans	-58.8	171.7	156.1	-98.5	-176.9	7.2	0	0	113
176	P	28.8	Very low	26	Very low	105 Å²	105	149.8 Å²	149.8	68%	0.682	81%	0.806	S	S	*	*			cis	-149.4	163.1	37.7	44.1	-24.1	0	0	0	121.1
177	S	21.8	Very low	26	Very low	91 Å²	91	147.1 Å²	147.1	64%	0.636	79%	0.792	S	S	*	*			trans	42.6	133.2	141.9	67.7	0	0	0	0	121
178	L	26.7	Very low	25.9	Very low	139 Å²	139	150.3 Å²	150.3	73%	0.728	79%	0.794	S	S	*	*				-168	150.2	78.1	-92.9	160.7	0	0	0	113.4
179	Q	26.2	Very low	26	Very low	177 Å²	177	150.1 Å²	150.1	83%	0.827	79%	0.793	S	S	*	*			trans	39.8	131.6	146.5	-69.4	168.1	-12.3	0	0	122.1
180	G	21	Very low	25.8	Very low	70 Å²	70	149.6 Å²	149.6	72%	0.722	80%	0.795	S	S	*	*			trans	-83.9	-151.9	151.6	0	0	0	0	0	111.7
181	P	35.7	Very low	25.8	Very low	108 Å²	108	146.3 Å²	146.3	70%	0.701	79%	0.79	S	S	*	*			cis	-140.8	-171.4	14.2	45.3	-27.5	0	0	0	115.6
182	H	24.1	Very low	25.7	Very low	176 Å²	176	145.9 Å²	145.9	82%	0.815	79%	0.79	S	S	*	*			trans	44.2	129.6	154.9	-56	-53.6	0	0	0	121.7
183	V	25.8	Very low	26.3	Very low	148 Å²	148	142.3 Å²	142.3	90%	0.897	78%	0.784	S	S	*	*				-167.1	156.1	108	140.4	0	0	0	0	110.4
184	T	23.8	Very low	26.3	Very low	125 Å²	125	141.4 Å²	141.4	77%	0.767	79%	0.785	S	S	*	*			trans	-101.1	140.4	-167.7	-21.4	0	0	0	0	113.7
185	R	25.5	Very low	26.4	Very low	217 Å²	217	140.8 Å²	140.8	82%	0.819	78%	0.779	S	S	*	*			trans	17	125.6	141	-167.3	170.1	-169	-163.4	4	117
186	P	31.7	Very low	26.6	Very low	123 Å²	123	140.3 Å²	140.3	80%	0.799	78%	0.781	S	S	*	*				-145.9	170.4	75.2	40.3	-22.8	0	0	0	118.8
187	S	23.3	Very low	26.5	Very low	75 Å²	75	142.3 Å²	142.3	52%	0.524	78%	0.781	S	S	.	*			trans	-65.1	154.7	173.1	-38.2	0	0	0	0	112.9
188	F	24.7	Very low	26.6	Very low	192 Å²	192	146 Å²	146	84%	0.842	79%	0.793	S	S	*	*				177.7	143	104.1	-96.5	-64.4	0	0	0	113.9
189	L	26.3	Very low	27	Very low	157 Å²	157	143.1 Å²	143.1	82%	0.822	79%	0.79	S	S	*	*			trans	62.7	125.3	155.6	-60.4	170.9	0	0	0	120.9
190	L	22.9	Very low	27.3	Very low	166 Å²	166	143.6 Å²	143.6	87%	0.869	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-85.1	144.7	159.8	-78.4	75.2	0	0	0	110.8
191	P	26.2	Very low	27.6	Very low	121 Å²	121	144 Å²	144	79%	0.786	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-79.7	156.5	153.7	-10.6	28.6	0	0	0	112.1
192	S	25.3	Very low	27.4	Very low	118 Å²	118	146.5 Å²	146.5	83%	0.825	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-83.2	143.9	175.7	-167.3	0	0	0	0	112
193	P	37.4	Very low	27.7	Very low	119 Å²	119	144.9 Å²	144.9	77%	0.773	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-83.6	143.4	-174.5	32.7	-35.5	0	0	0	113.8
194	N	26.6	Very low	27.8	Very low	170 Å²	170	146.6 Å²	146.6	91%	0.909	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-94.2	156	163.1	-100.8	-30.2	0	0	0	111
195	K	28.9	Very low	28.1	Very low	177 Å²	177	150 Å²	150	77%	0.77	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-71.3	142.4	179.8	-61.1	-176.8	174.8	-166.1	0	112.7
196	I	26.9	Very low	28.2	Very low	172 Å²	172	148.9 Å²	148.9	88%	0.882	81%	0.813	S	S	*	*			trans	-131.4	138.1	139.1	-62	-177.9	0	0	0	106
197	E	26.2	Very low	28.2	Very low	148 Å²	148	152.3 Å²	152.3	69%	0.692	82%	0.818	S	S	*	*			trans	-101.5	144.3	172.3	-66.8	171.2	154.7	0	0	107.8
198	D	24.1	Very low	28.5	Very low	167 Å²	167	153.7 Å²	153.7	89%	0.893	82%	0.824	S	S	*	*			trans	-160.9	161.3	132.8	-118.8	-33.7	0	0	0	115.3	Q200	D198-Q200 PolarHBondContact O-N 3.25Å
199	A	35.2	Very low	29.1	Very low	80 Å²	80	151.7 Å²	151.7	66%	0.661	82%	0.815	S	S	*	*	S	Bend	trans	-61.5	101.1	-160.9	0	0	0	0	0	118.9
200	Q	32.4	Very low	30.2	Very low	186 Å²	186	149.9 Å²	149.9	87%	0.869	81%	0.813	S	S	*	*			trans	-151.9	88.8	142.5	-138.7	83.1	70.7	0	0	111.5	D198 N202	D198-Q200 PolarHBondContact O-N 3.25Å; Q200-N202 VanDerWaalsContact C-N 3.31Å; Q200-N202 PolarHBondContact O-N 3.08Å
201	G	26.9	Very low	31.7	Very low	80 Å²	80	145.2 Å²	145.2	83%	0.825	79%	0.789	S	S	*	*			trans	-76	45.7	-162.9	0	0	0	0	0	118.7
202	N	30.8	Very low	33.8	Very low	160 Å²	160	142 Å²	142	86%	0.856	76%	0.764	S	S	*	*			trans	-87.9	111.7	158.2	-90.1	-6.4	0	0	0	108.5	Q200	Q200-N202 VanDerWaalsContact C-N 3.31Å; Q200-N202 PolarHBondContact O-N 3.08Å
203	T	30.3	Very low	35.8	Very low	141 Å²	141	139.6 Å²	139.6	87%	0.865	74%	0.742	S	S	*	*			trans	-113.5	110.1	172.9	35.6	0	0	0	0	111.6
204	E	27.6	Very low	37.8	Very low	184 Å²	184	135.4 Å²	135.4	86%	0.86	71%	0.712	S	S	*	*			trans	-57.4	154.5	-177.3	-57.7	158.5	136.7	0	0	113	K206	E204-K206 PolarHBondContact O-N 3.46Å
205	H	31.3	Very low	40.4	Very low	197 Å²	197	132.7 Å²	132.7	91%	0.912	69%	0.692	S	S	*	*			trans	-64.5	103.1	172.3	-83.2	-61.2	0	0	0	111.1	Q207	H205-Q207 PolarHBondContact O-N 3.36Å; H205-Q207 VanDerWaalsContact O-N 3.16Å
206	K	27.2	Very low	42.7	Very low	193 Å²	193	124.8 Å²	124.8	84%	0.839	66%	0.661	S	S	*	*			trans	-61.9	115.1	156.8	-85.6	-172.9	172.1	-179	0	108.9	E204	E204-K206 PolarHBondContact O-N 3.46Å
207	Q	31.2	Very low	45.2	Very low	195 Å²	195	123.3 Å²	123.3	91%	0.911	65%	0.645	S	S	*	*			trans	-55.8	139.2	163.7	-70.4	179.3	-16.8	0	0	109.4	H205	H205-Q207 PolarHBondContact O-N 3.36Å; H205-Q207 VanDerWaalsContact O-N 3.16Å
208	T	30.9	Very low	47.8	Very low	104 Å²	104	116.5 Å²	116.5	64%	0.638	61%	0.613	S	S	*	*			trans	-123	138.1	179.9	-11.6	0	0	0	0	108.9
209	F	36.5	Very low	50.5	Low	150 Å²	150	111.4 Å²	111.4	66%	0.658	58%	0.584	S	S	*	*			trans	73.8	96.1	178.7	-40.7	-66.2	0	0	0	115.6	I212	F209-I212 HydrophobicContact CB-CD1 4Å; F209-I212 HydrophobicContact CB-CG1 4.4Å; F209-I212 HydrophobicContact CG-CD1 4.45Å
210	P	49.1	Very low	52.6	Low	120 Å²	120	107.6 Å²	107.6	78%	0.779	55%	0.553	S	S	*	*	S	Bend	trans	-79.4	-21.7	176.3	-13.3	29.9	0	0	0	115.1
211	N	54.4	Low	54.8	Low	68 Å²	68	101.1 Å²	101.1	36%	0.364	52%	0.52	S	S	.	.	S	Bend	trans	-98	13.5	-165.1	-61.2	34.9	0	0	0	114.5	D138 P237	D138-N211 PolarHBondContact OD1-ND2 3.13Å; D138-N211 PolarHBondContact OD2-ND2 2.88Å; D138-N211 VanDerWaalsContact OD2-ND2 3.16Å; N211-P237 WeakPolarHBondContact O-CD 3.41Å
212	I	70.1	Confident	56.4	Low	53 Å²	53	100.9 Å²	100.9	27%	0.272	50%	0.496	S	S	.	.			trans	-110.9	114.2	-180	-49.9	175.4	0	0	0	109.2	F209 K215 E234	F209-I212 HydrophobicContact CB-CD1 4Å; F209-I212 HydrophobicContact CB-CG1 4.4Å; F209-I212 HydrophobicContact CG-CD1 4.45Å; I212-K215 HydrophobicContact CG2-CB 4.27Å; I212-K215 HydrophobicContact CG2-CD 4.13Å; I212-E234 WeakPolarHBondContact CD1-OE1 3.15Å; I212-E234 WeakPolarHBondContact CG1-OE1 3.5Å; I212-E234 HydrophobicContact CG2-CG 3.79Å
213	L	67.9	Low	57.9	Low	67 Å²	67	96.9 Å²	96.9	35%	0.351	48%	0.475	S	S	.	.			trans	-89.7	-36.5	-173.8	-62.7	-180	0	0	0	113.2	L235 P237 K302 V306	L213-L235 HydrophobicContact CB-CG 4.41Å; L213-L235 PolarHBondContact N-O 2.97Å; L213-P237 HydrophobicContact CD1-CB 3.84Å; L213-P237 HydrophobicContact CD1-CG 3.82Å; L213-P237 HydrophobicContact CD2-CG 4.48Å; L213-P237 HydrophobicContact CG-CG 4.06Å; L213-K302 HydrophobicContact CB-CG 4.34Å; L213-V306 HydrophobicContact CD1-CG1 4.48Å; L213-V306 HydrophobicContact CD1-CG2 3.27Å
214	K	79.1	Confident	59	Low	32 Å²	32	95.6 Å²	95.6	14%	0.139	46%	0.459	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.6	146.9	169.8	-170.7	167	167.3	69.3	0	109.9	L235 D298 W299 K302	K214-L235 HydrophobicContact CB-CB 4.41Å; K214-L235 PolarHBondContact N-O 3.49Å; K214-L235 PolarHBondContact O-N 2.86Å; K214-D298 WeakPolarHBondContact CD-OD2 3.46Å; K214-D298 WeakPolarHBondContact CE-OD2 3.31Å; K214-D298 IonicContact NZ-OD2 3.77Å; K214-D298 PolarHBondContact NZ-OD2 3.12Å; K214-W299 HydrophobicContact CB-CE3 4.38Å; K214-W299 HydrophobicContact CB-CH2 4.39Å; K214-W299 HydrophobicContact CB-CZ3 4.11Å; K214-W299 HydrophobicContact CD-CD2 3.68Å; K214-W299 HydrophobicContact CD-CE3 3.87Å; K214-W299 HydrophobicContact CD-CG 4.02Å; K214-W299 HydrophobicContact CD-CZ2 4.44Å; K214-W299 HydrophobicContact CD-CZ3 4.33Å; K214-W299 VanDerWaalsContact CE-NE1 3.29Å; K214-W299 HydrophobicContact CG-CD2 4.16Å; K214-W299 HydrophobicContact CG-CE3 4.09Å; K214-W299 HydrophobicContact CG-CH2 4.03Å; K214-W299 HydrophobicContact CG-CZ2 4.08Å; K214-W299 HydrophobicContact CG-CZ3 4.04Å; K214-K302 HydrophobicContact CB-CG 4.42Å
215	K	81.4	Confident	60	Low	112 Å²	112	94.6 Å²	94.6	49%	0.487	46%	0.46	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	148.2	174.4	70.4	-165.6	-168.6	-177.8	0	110.1	I212 Y232 A233 E234	I212-K215 HydrophobicContact CG2-CB 4.27Å; I212-K215 HydrophobicContact CG2-CD 4.13Å; K215-Y232 VanDerWaalsContact CD-OH 3.31Å; K215-Y232 WeakPolarHBondContact CD-OH 3.48Å; K215-Y232 WeakPolarHBondContact CG-OH 3.23Å; K215-A233 VanDerWaalsContact CA-O 3.27Å; K215-A233 WeakPolarHBondContact CA-O 3.3Å; K215-E234 HydrophobicContact CB-CG 4.33Å
216	G	78	Confident	61.3	Low	12 Å²	12	87.1 Å²	87.1	12%	0.124	43%	0.43	C	S	.	.	E	Extended strand (participates in β ladder)	trans	168.7	-175.2	-174.2	0	0	0	0	0	112.5	Y232 A233	G216-Y232 WeakPolarHBondContact O-CD2 3.35Å; G216-A233 PolarHBondContact N-O 3.28Å; G216-A233 VanDerWaalsContact N-O 3.08Å; G216-A233 PolarHBondContact O-N 3.16Å
217	Y	79	Confident	62.8	Low	141 Å²	141	85 Å²	85	55%	0.553	42%	0.417	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.8	132.1	178.9	-67.7	-80.6	0	0	0	110.5	Y232 L245	Y217-Y232 HydrophobicContact CD1-CD2 4.04Å; Y217-Y232 HydrophobicContact CD2-CD2 4.37Å; Y217-Y232 AromaticContact CE1-CD2 3.79Å; Y217-Y232 HydrophobicContact CE1-CD2 3.79Å; Y217-Y232 HydrophobicContact CE1-CG 4.38Å; Y217-Y232 HydrophobicContact CE2-CD2 4.14Å; Y217-Y232 HydrophobicContact CE2-CE2 4.46Å; Y217-Y232 HydrophobicContact CG-CD2 4.33Å; Y217-Y232 AromaticContact CZ-CD2 3.84Å; Y217-L245 HydrophobicContact CE1-CD1 3.83Å
218	L	80.8	Confident	64.8	Low	5 Å²	5	79.5 Å²	79.5	3%	0.026	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	149.1	177.1	-72.2	-178.1	0	0	0	110.1	I220 C231 A233 L288 K289 A290 W299	L218-I220 HydrophobicContact CB-CG2 4.45Å; L218-C231 PolarHBondContact N-O 2.95Å; L218-C231 PolarHBondContact O-N 3.06Å; L218-C231 PolarHBondContact O-SG 3.31Å; L218-C231 VanDerWaalsContact O-SG 3.38Å; L218-A233 HydrophobicContact CB-CB 4.24Å; L218-A233 HydrophobicContact CD1-CB 3.69Å; L218-A233 HydrophobicContact CG-CB 4.03Å; L218-L288 HydrophobicContact CD1-CB 4.46Å; L218-L288 HydrophobicContact CD1-CD1 4.44Å; L218-K289 WeakPolarHBondContact CA-O 3.48Å; L218-K289 WeakPolarHBondContact CD2-O 3.24Å; L218-A290 HydrophobicContact CD2-CB 3.72Å; L218-W299 HydrophobicContact CD1-CD2 3.89Å; L218-W299 HydrophobicContact CD1-CE3 4.16Å; L218-W299 HydrophobicContact CD1-CG 4.37Å; L218-W299 HydrophobicContact CD1-CH2 4.32Å; L218-W299 HydrophobicContact CD1-CZ2 4.07Å; L218-W299 HydrophobicContact CD1-CZ3 4.36Å; L218-W299 HydrophobicContact CD2-CD2 4.33Å; L218-W299 HydrophobicContact CD2-CG 4.17Å; L218-W299 HydrophobicContact CG-CD2 4.38Å; L218-W299 HydrophobicContact CG-CZ2 4.08Å
219	E	81.2	Confident	66.9	Low	59 Å²	59	77.2 Å²	77.2	28%	0.276	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	135.6	158.6	-60.7	-179.9	150.7	0	0	108.7	W228 Q229 L288 K289	E219-W228 HydrophobicContact CB-CB 4.47Å; E219-W228 HydrophobicContact CB-CE3 3.84Å; E219-W228 WeakPolarHBondContact O-CZ3 3.32Å; E219-Q229 CarbonylContact C-O 3.54Å; E219-Q229 WeakPolarHBondContact CA-O 3.46Å; E219-L288 CarbonylContact O-C 3.56Å; E219-K289 HydrophobicContact CB-CB 4.26Å; E219-K289 PolarHBondContact N-O 2.88Å; E219-K289 PolarHBondContact O-N 3.37Å; E219-K289 WeakPolarHBondContact OE2-CD 3.36Å; E219-K289 WeakPolarHBondContact OE2-CE 3.45Å; E219-K289 IonicContact OE2-NZ 2.65Å; E219-K289 PolarHBondContact OE2-NZ 3.33Å
220	I	79.1	Confident	68.9	Low	1 Å²	1	73.6 Å²	73.6	1%	0.005	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	155.1	178	74.9	167.1	0	0	0	112.3	L218 W228 Q229 F242 Y254 L286 Q287 L288	L218-I220 HydrophobicContact CB-CG2 4.45Å; I220-W228 CarbonylContact O-C 3.58Å; I220-W228 WeakPolarHBondContact O-CA 3.43Å; I220-Q229 HydrophobicContact CG1-CB 4.45Å; I220-Q229 PolarHBondContact N-O 2.91Å; I220-Q229 PolarHBondContact O-N 3.01Å; I220-F242 HydrophobicContact CD1-CD1 4.41Å; I220-F242 HydrophobicContact CD1-CD2 3.81Å; I220-F242 HydrophobicContact CD1-CE2 4Å; I220-F242 HydrophobicContact CD1-CG 4Å; I220-F242 HydrophobicContact CD1-CZ 4.39Å; I220-F242 HydrophobicContact CG2-CD1 4.04Å; I220-F242 HydrophobicContact CG2-CE1 3.58Å; I220-F242 HydrophobicContact CG2-CE2 4.45Å; I220-F242 HydrophobicContact CG2-CZ 3.8Å; I220-Y254 HydrophobicContact CD1-CE2 4.37Å; I220-Y254 WeakPolarHBondContact CD1-OH 3.46Å; I220-Y254 WeakPolarHBondContact CG1-OH 3.27Å; I220-L286 HydrophobicContact CB-CD1 4.2Å; I220-L286 HydrophobicContact CD1-CD1 4.34Å; I220-Q287 CarbonylContact C-O 3.5Å; I220-Q287 WeakPolarHBondContact CA-O 3.18Å; I220-L288 HydrophobicContact CB-CD2 4.14Å; I220-L288 HydrophobicContact CG2-CD2 3.55Å
221	R	78.1	Confident	70.3	Confident	49 Å²	49	68.2 Å²	68.2	19%	0.185	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	128.8	-179.4	-164.4	-169.3	-160.7	-142	-10.8	109.9	D223 H224 S226 W228 L286 Q287	R221-D223 WeakPolarHBondContact CG-O 3.34Å; R221-D223 PolarHBondContact NE-O 2.91Å; R221-H224 VanDerWaalsContact CZ-O 3.22Å; R221-H224 PolarHBondContact NH1-O 3.44Å; R221-H224 VanDerWaalsContact NH2-C 3.32Å; R221-H224 PolarHBondContact NH2-O 3.32Å; R221-S226 VanDerWaalsContact CZ-O 3.28Å; R221-S226 PolarHBondContact NE-O 2.76Å; R221-S226 PolarHBondContact NH2-O 3.29Å; R221-W228 HydrophobicContact CB-CD2 3.88Å; R221-W228 HydrophobicContact CB-CE3 3.73Å; R221-W228 HydrophobicContact CB-CH2 4.23Å; R221-W228 HydrophobicContact CB-CZ2 4.35Å; R221-W228 HydrophobicContact CB-CZ3 3.9Å; R221-W228 HydrophobicContact CG-CD2 4.4Å; R221-L286 CarbonylContact O-C 3.57Å; R221-L286 WeakPolarHBondContact O-CA 3.07Å; R221-Q287 HydrophobicContact CB-CB 4.18Å; R221-Q287 VanDerWaalsContact CD-OE1 3.32Å; R221-Q287 PolarHBondContact N-O 3.36Å; R221-Q287 PolarHBondContact O-N 3.29Å
222	K	60.9	Low	71.5	Confident	75 Å²	75	66.4 Å²	66.4	33%	0.326	32%	0.317	S	S	.	.	S	Bend	trans	-94.8	-13.3	-171	-57.2	-169.6	-179.3	-154.6	0	115.3	Y257 Q285 L286	K222-Y257 VanDerWaalsContact CD-OH 3.31Å; K222-Y257 WeakPolarHBondContact CD-OH 3.45Å; K222-Y257 WeakPolarHBondContact CE-OH 3.44Å; K222-Y257 PolarHBondContact NZ-OH 3.05Å; K222-Q285 CarbonylContact C-O 3.55Å; K222-L286 HydrophobicContact CG-CD1 4.43Å
223	D	61.9	Low	72.1	Confident	76 Å²	76	63.9 Å²	63.9	41%	0.406	30%	0.304	S	S	.	.	S	Bend	trans	-155.2	162.1	-176.7	-44.7	-95.3	0	0	0	110.4	R221 D225 S226	R221-D223 WeakPolarHBondContact CG-O 3.34Å; R221-D223 PolarHBondContact NE-O 2.91Å; D223-D225 PolarHBondContact O-N 2.99Å; D223-S226 PolarHBondContact O-N 3.2Å; D223-S226 WeakPolarHBondContact OD2-CB 3.19Å; D223-S226 PolarHBondContact OD2-OG 3.33Å
224	H	52.6	Low	72.8	Confident	114 Å²	114	62.4 Å²	62.4	53%	0.528	30%	0.296	S	S	.	.	S	Bend	trans	-63.8	-16.7	173.4	-69.6	-28.1	0	0	0	115	R221 Q285	R221-H224 VanDerWaalsContact CZ-O 3.22Å; R221-H224 PolarHBondContact NH1-O 3.44Å; R221-H224 VanDerWaalsContact NH2-C 3.32Å; R221-H224 PolarHBondContact NH2-O 3.32Å; H224-Q285 PolarHBondContact CE1-OE1 2.76Å; H224-Q285 PolarHBondContact NE2-OE1 2.79Å
225	D	49.3	Very low	72.7	Confident	164 Å²	164	60.9 Å²	60.9	88%	0.877	29%	0.289	S	S	*	.	S	Bend	trans	-108.9	-10.5	174.9	-73.2	-42.2	0	0	0	113.8	D223	D223-D225 PolarHBondContact O-N 2.99Å
226	S	58.3	Low	72.5	Confident	40 Å²	40	56.2 Å²	56.2	28%	0.28	27%	0.271	S	S	.	.	S	Bend	trans	-71	160.1	176.4	-84	0	0	0	0	111.8	R221 D223	R221-S226 VanDerWaalsContact CZ-O 3.28Å; R221-S226 PolarHBondContact NE-O 2.76Å; R221-S226 PolarHBondContact NH2-O 3.29Å; D223-S226 PolarHBondContact O-N 3.2Å; D223-S226 WeakPolarHBondContact OD2-CB 3.19Å; D223-S226 PolarHBondContact OD2-OG 3.33Å
227	Y	59	Low	72	Confident	148 Å²	148	57.1 Å²	57.1	58%	0.58	27%	0.274	S	S	*	.	P	Polyproline II helix	trans	-85.5	159.3	176.9	61.8	-90.5	0	0	0	112.1	Q229	Y227-Q229 HydrophobicContact CD2-CB 4.34Å; Y227-Q229 HydrophobicContact CE2-CB 4.01Å; Y227-Q229 HydrophobicContact CE2-CG 4.38Å
228	W	73.9	Confident	71.3	Confident	79 Å²	79	52.7 Å²	52.7	30%	0.299	26%	0.257	S	S	.	.	P	Polyproline II helix	trans	-78.4	124.3	170.4	-73	100.5	0	0	0	109.9	E219 I220 R221 M275 Q287 K289	E219-W228 HydrophobicContact CB-CB 4.47Å; E219-W228 HydrophobicContact CB-CE3 3.84Å; E219-W228 WeakPolarHBondContact O-CZ3 3.32Å; I220-W228 CarbonylContact O-C 3.58Å; I220-W228 WeakPolarHBondContact O-CA 3.43Å; R221-W228 HydrophobicContact CB-CD2 3.88Å; R221-W228 HydrophobicContact CB-CE3 3.73Å; R221-W228 HydrophobicContact CB-CH2 4.23Å; R221-W228 HydrophobicContact CB-CZ2 4.35Å; R221-W228 HydrophobicContact CB-CZ3 3.9Å; R221-W228 HydrophobicContact CG-CD2 4.4Å; W228-M275 HydrophobicContact CH2-SD 4.19Å; W228-M275 HydrophobicContact CZ2-SD 3.94Å; W228-Q287 HydrophobicContact CH2-CB 3.54Å; W228-Q287 HydrophobicContact CZ2-CB 4.22Å; W228-Q287 HydrophobicContact CZ3-CB 4.15Å; W228-Q287 WeakPolarHBondContact CZ3-O 3.36Å; W228-K289 HydrophobicContact CE3-CB 4.05Å; W228-K289 HydrophobicContact CH2-CB 3.72Å; W228-K289 HydrophobicContact CZ3-CB 3.45Å; W228-K289 VanDerWaalsContact CZ3-CB 3.45Å
229	Q	73.8	Confident	71.1	Confident	56 Å²	56	54.2 Å²	54.2	26%	0.262	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	116	-179.8	-175	174.5	8.6	0	0	109.9	E219 I220 Y227	E219-Q229 CarbonylContact C-O 3.54Å; E219-Q229 WeakPolarHBondContact CA-O 3.46Å; I220-Q229 HydrophobicContact CG1-CB 4.45Å; I220-Q229 PolarHBondContact N-O 2.91Å; I220-Q229 PolarHBondContact O-N 3.01Å; Y227-Q229 HydrophobicContact CD2-CB 4.34Å; Y227-Q229 HydrophobicContact CE2-CB 4.01Å; Y227-Q229 HydrophobicContact CE2-CG 4.38Å
230	S	78.7	Confident	71.1	Confident	75 Å²	75	51.4 Å²	51.4	52%	0.524	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	131.7	173.6	-43.4	0	0	0	0	110.5
231	C	78.9	Confident	71.1	Confident	7 Å²	7	54.2 Å²	54.2	5%	0.047	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	164.7	179.1	61.8	0	0	0	0	111.7	L218 F242 Y243 Y254	L218-C231 PolarHBondContact N-O 2.95Å; L218-C231 PolarHBondContact O-N 3.06Å; L218-C231 PolarHBondContact O-SG 3.31Å; L218-C231 VanDerWaalsContact O-SG 3.38Å; C231-F242 VanDerWaalsContact SG-CD1 3.56Å; C231-Y243 WeakPolarHBondContact CA-O 3.38Å; C231-Y243 VanDerWaalsContact CB-O 3.31Å; C231-Y243 WeakPolarHBondContact CB-O 3.43Å; C231-Y254 HydrophobicContact CB-CE1 3.71Å; C231-Y254 WeakPolarHBondContact CB-OH 3.34Å
232	Y	80.6	Confident	71.2	Confident	29 Å²	29	51.9 Å²	51.9	11%	0.114	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	126.8	164.6	-175.2	-104.2	0	0	0	108.3	K215 G216 Y217 Y243	K215-Y232 VanDerWaalsContact CD-OH 3.31Å; K215-Y232 WeakPolarHBondContact CD-OH 3.48Å; K215-Y232 WeakPolarHBondContact CG-OH 3.23Å; G216-Y232 WeakPolarHBondContact O-CD2 3.35Å; Y217-Y232 HydrophobicContact CD1-CD2 4.04Å; Y217-Y232 HydrophobicContact CD2-CD2 4.37Å; Y217-Y232 AromaticContact CE1-CD2 3.79Å; Y217-Y232 HydrophobicContact CE1-CD2 3.79Å; Y217-Y232 HydrophobicContact CE1-CG 4.38Å; Y217-Y232 HydrophobicContact CE2-CD2 4.14Å; Y217-Y232 HydrophobicContact CE2-CE2 4.46Å; Y217-Y232 HydrophobicContact CG-CD2 4.33Å; Y217-Y232 AromaticContact CZ-CD2 3.84Å; Y232-Y243 AromaticContact CD1-CD2 3.98Å; Y232-Y243 HydrophobicContact CD1-CD2 3.98Å; Y232-Y243 PolarHBondContact N-O 3.24Å; Y232-Y243 PolarHBondContact O-N 3.23Å
233	A	81.3	Confident	72	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	141.3	-176.8	0	0	0	0	0	110.7	K215 G216 L218 Y241 F242 W299	K215-A233 VanDerWaalsContact CA-O 3.27Å; K215-A233 WeakPolarHBondContact CA-O 3.3Å; G216-A233 PolarHBondContact N-O 3.28Å; G216-A233 VanDerWaalsContact N-O 3.08Å; G216-A233 PolarHBondContact O-N 3.16Å; L218-A233 HydrophobicContact CB-CB 4.24Å; L218-A233 HydrophobicContact CD1-CB 3.69Å; L218-A233 HydrophobicContact CG-CB 4.03Å; A233-Y241 WeakPolarHBondContact CA-O 3.44Å; A233-F242 HydrophobicContact CB-CD1 3.79Å; A233-F242 HydrophobicContact CB-CE1 3.78Å; A233-W299 HydrophobicContact CB-CH2 3.73Å; A233-W299 HydrophobicContact CB-CZ2 4.15Å; A233-W299 HydrophobicContact CB-CZ3 4.36Å
234	E	82.6	Confident	72.3	Confident	37 Å²	37	48.4 Å²	48.4	17%	0.173	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	121.2	174.5	-169.9	168	146.3	0	0	110.4	I212 K215 Y241 Y243	I212-E234 WeakPolarHBondContact CD1-OE1 3.15Å; I212-E234 WeakPolarHBondContact CG1-OE1 3.5Å; I212-E234 HydrophobicContact CG2-CG 3.79Å; K215-E234 HydrophobicContact CB-CG 4.33Å; E234-Y241 PolarHBondContact N-O 3.36Å; E234-Y241 PolarHBondContact O-N 2.73Å; E234-Y243 HydrophobicContact CB-CE2 3.92Å
235	L	77.6	Confident	72.7	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	108.1	176	178	62.9	0	0	0	109.2	L213 K214 L240 L259 W299 K302 L303 V306	L213-L235 HydrophobicContact CB-CG 4.41Å; L213-L235 PolarHBondContact N-O 2.97Å; K214-L235 HydrophobicContact CB-CB 4.41Å; K214-L235 PolarHBondContact N-O 3.49Å; K214-L235 PolarHBondContact O-N 2.86Å; L235-L240 HydrophobicContact CB-CD1 4.24Å; L235-L240 HydrophobicContact CD1-CD1 4.37Å; L235-L259 HydrophobicContact CD1-CD1 3.56Å; L235-L259 HydrophobicContact CD1-CD2 4.17Å; L235-L259 HydrophobicContact CD1-CG 4.47Å; L235-W299 HydrophobicContact CB-CZ3 3.98Å; L235-K302 HydrophobicContact CD2-CB 3.76Å; L235-K302 HydrophobicContact CD2-CG 3.74Å; L235-L303 HydrophobicContact CD1-CD2 3.66Å; L235-L303 HydrophobicContact CD2-CD2 4.19Å; L235-L303 HydrophobicContact CD2-CG 4.27Å; L235-V306 HydrophobicContact CD2-CG2 4.44Å
236	S	77.9	Confident	73	Confident	14 Å²	14	41.6 Å²	41.6	10%	0.098	21%	0.206	C	C	.	.			trans	-86.1	174.6	160.6	84.8	0	0	0	0	109.6	Y238 N239	S236-Y238 PolarHBondContact O-N 3.13Å; S236-Y238 VanDerWaalsContact O-N 3.08Å; S236-Y238 PolarHBondContact OG-N 3.31Å; S236-N239 PolarHBondContact N-O 3.41Å; S236-N239 PolarHBondContact OG-N 3.15Å; S236-N239 VanDerWaalsContact OG-N 3.09Å; S236-N239 PolarHBondContact OG-O 2.92Å
237	P	66	Low	72.5	Confident	31 Å²	31	45.8 Å²	45.8	20%	0.201	24%	0.235	C	C	.	.	S	Bend	trans	-68.1	-3.6	177.3	-12.2	26	0	0	0	114.4	N211 L213 V306	N211-P237 WeakPolarHBondContact O-CD 3.41Å; L213-P237 HydrophobicContact CD1-CB 3.84Å; L213-P237 HydrophobicContact CD1-CG 3.82Å; L213-P237 HydrophobicContact CD2-CG 4.48Å; L213-P237 HydrophobicContact CG-CG 4.06Å; P237-V306 WeakPolarHBondContact O-CG1 3.42Å
238	Y	64.2	Low	71.8	Confident	47 Å²	47	42.8 Å²	42.8	18%	0.184	24%	0.236	C	C	.	.	S	Bend	trans	-137.8	-21.4	-172.7	-44.7	-62.1	0	0	0	114.9	E139 T140 S236 L259	E139-Y238 HydrophobicContact CB-CE2 4.36Å; E139-Y238 HydrophobicContact CG-CE2 4.33Å; E139-Y238 WeakPolarHBondContact OE1-CE2 3.47Å; E139-Y238 PolarHBondContact OE1-OH 3.36Å; E139-Y238 PolarHBondContact OE2-OH 2.91Å; E139-Y238 VanDerWaalsContact OE2-OH 3.11Å; T140-Y238 VanDerWaalsContact CA-CE1 3.41Å; T140-Y238 HydrophobicContact CG2-CE1 4.12Å; T140-Y238 VanDerWaalsContact N-CZ 3.34Å; S236-Y238 PolarHBondContact O-N 3.13Å; S236-Y238 VanDerWaalsContact O-N 3.08Å; S236-Y238 PolarHBondContact OG-N 3.31Å; Y238-L259 WeakPolarHBondContact O-CB 3.48Å; Y238-L259 PolarHBondContact O-N 3.34Å
239	N	78.1	Confident	70.5	Confident	38 Å²	38	41.4 Å²	41.4	20%	0.203	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	144.4	-178.6	-68.2	-57.8	0	0	0	110.6	S236 Y241 T256 Q258	S236-N239 PolarHBondContact N-O 3.41Å; S236-N239 PolarHBondContact OG-N 3.15Å; S236-N239 VanDerWaalsContact OG-N 3.09Å; S236-N239 PolarHBondContact OG-O 2.92Å; N239-Y241 HydrophobicContact CB-CD2 4.18Å; N239-Y241 HydrophobicContact CB-CE1 4.05Å; N239-Y241 HydrophobicContact CB-CE2 3.55Å; N239-Y241 VanDerWaalsContact CB-CZ 3.46Å; N239-Y241 PolarHBondContact ND2-OH 2.72Å; N239-Y241 VanDerWaalsContact ND2-OH 3.1Å; N239-T256 HydrophobicContact CB-CG2 4.13Å; N239-Q258 WeakPolarHBondContact OD1-CA 3.21Å
240	L	81	Confident	69.5	Low	0 Å²	0	43.3 Å²	43.3	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	113.8	164.4	-176.8	60.6	0	0	0	108.5	L235 F242 T256 Y257 L259 F262 L288 W299 L303	L235-L240 HydrophobicContact CB-CD1 4.24Å; L235-L240 HydrophobicContact CD1-CD1 4.37Å; L240-F242 HydrophobicContact CD1-CE1 4.31Å; L240-F242 HydrophobicContact CD1-CZ 4.35Å; L240-F242 HydrophobicContact CD2-CE1 4.08Å; L240-F242 HydrophobicContact CD2-CE2 3.93Å; L240-F242 HydrophobicContact CD2-CZ 3.35Å; L240-F242 HydrophobicContact CG-CE1 4.01Å; L240-F242 HydrophobicContact CG-CE2 4Å; L240-F242 HydrophobicContact CG-CZ 3.59Å; L240-T256 WeakPolarHBondContact O-CA 3.43Å; L240-Y257 PolarHBondContact N-O 3.4Å; L240-Y257 PolarHBondContact O-N 3.11Å; L240-L259 HydrophobicContact CB-CD2 4.1Å; L240-F262 HydrophobicContact CD2-CZ 4.07Å; L240-L288 HydrophobicContact CD2-CD1 4.22Å; L240-W299 HydrophobicContact CD1-CZ3 4.4Å; L240-L303 HydrophobicContact CD1-CD2 4.4Å; L240-L303 HydrophobicContact CD2-CD2 3.96Å
241	Y	78.6	Confident	68.7	Low	60 Å²	60	44 Å²	44	24%	0.235	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	137.6	179.8	-58.6	-82.4	0	0	0	110.4	A233 E234 N239 L253 T256	A233-Y241 WeakPolarHBondContact CA-O 3.44Å; E234-Y241 PolarHBondContact N-O 3.36Å; E234-Y241 PolarHBondContact O-N 2.73Å; N239-Y241 HydrophobicContact CB-CD2 4.18Å; N239-Y241 HydrophobicContact CB-CE1 4.05Å; N239-Y241 HydrophobicContact CB-CE2 3.55Å; N239-Y241 VanDerWaalsContact CB-CZ 3.46Å; N239-Y241 PolarHBondContact ND2-OH 2.72Å; N239-Y241 VanDerWaalsContact ND2-OH 3.1Å; Y241-L253 HydrophobicContact CD1-CD1 3.95Å; Y241-L253 HydrophobicContact CD1-CD2 4.31Å; Y241-L253 HydrophobicContact CG-CD1 4.39Å; Y241-T256 HydrophobicContact CD1-CG2 3.61Å; Y241-T256 HydrophobicContact CE1-CG2 3.58Å
242	F	80.4	Confident	68	Low	0 Å²	0	47.2 Å²	47.2	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	118.9	174.1	-61.8	-62.6	0	0	0	111	I220 C231 A233 L240 Y254 A255 Y257 L286 L288	I220-F242 HydrophobicContact CD1-CD1 4.41Å; I220-F242 HydrophobicContact CD1-CD2 3.81Å; I220-F242 HydrophobicContact CD1-CE2 4Å; I220-F242 HydrophobicContact CD1-CG 4Å; I220-F242 HydrophobicContact CD1-CZ 4.39Å; I220-F242 HydrophobicContact CG2-CD1 4.04Å; I220-F242 HydrophobicContact CG2-CE1 3.58Å; I220-F242 HydrophobicContact CG2-CE2 4.45Å; I220-F242 HydrophobicContact CG2-CZ 3.8Å; C231-F242 VanDerWaalsContact SG-CD1 3.56Å; A233-F242 HydrophobicContact CB-CD1 3.79Å; A233-F242 HydrophobicContact CB-CE1 3.78Å; L240-F242 HydrophobicContact CD1-CE1 4.31Å; L240-F242 HydrophobicContact CD1-CZ 4.35Å; L240-F242 HydrophobicContact CD2-CE1 4.08Å; L240-F242 HydrophobicContact CD2-CE2 3.93Å; L240-F242 HydrophobicContact CD2-CZ 3.35Å; L240-F242 HydrophobicContact CG-CE1 4.01Å; L240-F242 HydrophobicContact CG-CE2 4Å; L240-F242 HydrophobicContact CG-CZ 3.59Å; F242-Y254 HydrophobicContact CB-CD1 4.3Å; F242-Y254 HydrophobicContact CB-CE1 3.64Å; F242-Y254 WeakPolarHBondContact O-CD1 3.37Å; F242-Y254 WeakPolarHBondContact O-CE1 3.16Å; F242-Y254 PolarHBondContact O-N 2.7Å; F242-A255 HydrophobicContact CB-CB 4.35Å; F242-A255 HydrophobicContact CD2-CB 4.19Å; F242-A255 PolarHBondContact N-O 2.75Å; F242-A255 PolarHBondContact O-N 2.91Å; F242-Y257 AromaticContact CD2-CD2 3.81Å; F242-Y257 HydrophobicContact CD2-CD2 3.81Å; F242-Y257 AromaticContact CD2-CE2 3.89Å; F242-Y257 HydrophobicContact CD2-CE2 3.89Å; F242-Y257 AromaticContact CE2-CD2 3.57Å; F242-Y257 HydrophobicContact CE2-CD2 3.57Å; F242-Y257 AromaticContact CE2-CE2 3.78Å; F242-Y257 HydrophobicContact CE2-CE2 3.78Å; F242-L286 HydrophobicContact CE2-CD2 4.1Å; F242-L286 HydrophobicContact CZ-CD2 4.4Å; F242-L288 HydrophobicContact CE1-CD2 4.26Å; F242-L288 HydrophobicContact CZ-CD2 3.68Å
243	Y	77.3	Confident	67.2	Low	41 Å²	41	50 Å²	50	16%	0.161	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	129.6	178.4	-53.6	-91.6	0	0	0	110.3	C231 Y232 E234 Q251 N252 L253	C231-Y243 WeakPolarHBondContact CA-O 3.38Å; C231-Y243 VanDerWaalsContact CB-O 3.31Å; C231-Y243 WeakPolarHBondContact CB-O 3.43Å; Y232-Y243 AromaticContact CD1-CD2 3.98Å; Y232-Y243 HydrophobicContact CD1-CD2 3.98Å; Y232-Y243 PolarHBondContact N-O 3.24Å; Y232-Y243 PolarHBondContact O-N 3.23Å; E234-Y243 HydrophobicContact CB-CE2 3.92Å; Y243-Q251 HydrophobicContact CD1-CB 3.96Å; Y243-Q251 HydrophobicContact CG-CB 4.11Å; Y243-N252 CarbonylContact C-O 3.57Å; Y243-N252 WeakPolarHBondContact CA-O 3.45Å; Y243-L253 HydrophobicContact CD1-CB 3.93Å; Y243-L253 HydrophobicContact CD1-CD1 4.07Å; Y243-L253 HydrophobicContact CE1-CB 3.99Å; Y243-L253 HydrophobicContact CE1-CD1 3.87Å; Y243-L253 HydrophobicContact CE1-CG 4.46Å
244	S	68.6	Low	66.5	Low	36 Å²	36	53.2 Å²	53.2	25%	0.252	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	140.3	164.5	57.2	0	0	0	0	108.1	N252 Y254	S244-N252 PolarHBondContact N-O 3.44Å; S244-N252 PolarHBondContact O-N 3.31Å; S244-N252 PolarHBondContact OG-O 3.13Å; S244-Y254 VanDerWaalsContact N-CD1 3.3Å
245	L	60.9	Low	66	Low	81 Å²	81	52 Å²	52	42%	0.424	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	121.3	172.8	-77.7	165	0	0	0	108.3	Y217 Q251	Y217-L245 HydrophobicContact CE1-CD1 3.83Å; L245-Q251 HydrophobicContact CD2-CG 3.64Å
246	D	55.7	Low	66	Low	55 Å²	55	55.1 Å²	55.1	29%	0.294	32%	0.315	S	S	.	.	P	Polyproline II helix	trans	-77.2	172	169.6	66.8	34.8	0	0	0	111.9	S248 G249 N250 N252	D246-S248 VanDerWaalsContact CG-OG 3.31Å; D246-S248 PolarHBondContact O-N 2.82Å; D246-S248 VanDerWaalsContact O-N 3.09Å; D246-S248 VanDerWaalsContact OD1-CA 3.28Å; D246-S248 WeakPolarHBondContact OD1-CA 3.34Å; D246-S248 WeakPolarHBondContact OD1-CB 3.47Å; D246-S248 PolarHBondContact OD1-N 3.36Å; D246-S248 PolarHBondContact OD1-OG 2.99Å; D246-S248 PolarHBondContact OD2-OG 2.79Å; D246-G249 PolarHBondContact O-N 2.84Å; D246-G249 PolarHBondContact OD1-N 3.15Å; D246-N250 PolarHBondContact N-O 3.31Å; D246-N250 VanDerWaalsContact N-O 3.16Å; D246-N250 PolarHBondContact OD1-N 2.89Å; D246-N250 WeakPolarHBondContact OD2-CB 3.48Å; D246-N252 PolarHBondContact OD2-ND2 2.77Å
247	S	47.5	Very low	66	Low	127 Å²	127	56.3 Å²	56.3	89%	0.888	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-5.2	178.9	49.6	0	0	0	0	114.5
248	S	43.9	Very low	66.4	Low	85 Å²	85	58.7 Å²	58.7	59%	0.594	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.8	-0.9	170.5	69.1	0	0	0	0	113.7	D246 N250	D246-S248 VanDerWaalsContact CG-OG 3.31Å; D246-S248 PolarHBondContact O-N 2.82Å; D246-S248 VanDerWaalsContact O-N 3.09Å; D246-S248 VanDerWaalsContact OD1-CA 3.28Å; D246-S248 WeakPolarHBondContact OD1-CA 3.34Å; D246-S248 WeakPolarHBondContact OD1-CB 3.47Å; D246-S248 PolarHBondContact OD1-N 3.36Å; D246-S248 PolarHBondContact OD1-OG 2.99Å; D246-S248 PolarHBondContact OD2-OG 2.79Å; S248-N250 PolarHBondContact OG-ND2 3.32Å
249	G	48.1	Very low	66.8	Low	50 Å²	50	56.8 Å²	56.8	52%	0.515	32%	0.319	S	S	.	.			trans	81.8	9.9	179.3	0	0	0	0	0	114.6	D246	D246-G249 PolarHBondContact O-N 2.84Å; D246-G249 PolarHBondContact OD1-N 3.15Å
250	N	52.8	Low	66.1	Low	97 Å²	97	57.1 Å²	57.1	52%	0.519	32%	0.324	S	S	.	.			trans	-80.4	143.6	174.5	-66.6	-65.5	0	0	0	110.6	D246 S248 N252	D246-N250 PolarHBondContact N-O 3.31Å; D246-N250 VanDerWaalsContact N-O 3.16Å; D246-N250 PolarHBondContact OD1-N 2.89Å; D246-N250 WeakPolarHBondContact OD2-CB 3.48Å; S248-N250 PolarHBondContact OG-ND2 3.32Å; N250-N252 PolarHBondContact O-N 3.17Å
251	Q	61.1	Low	65.5	Low	89 Å²	89	61.8 Å²	61.8	42%	0.416	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	96.9	-178.9	-73	-176	-4	0	0	110.3	Y243 L245	Y243-Q251 HydrophobicContact CD1-CB 3.96Å; Y243-Q251 HydrophobicContact CG-CB 4.11Å; L245-Q251 HydrophobicContact CD2-CG 3.64Å
252	N	64.1	Low	65.3	Low	75 Å²	75	59.2 Å²	59.2	40%	0.401	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	113.2	177.7	-64.2	-62.1	0	0	0	109.6	Y243 S244 D246 N250 Y254	Y243-N252 CarbonylContact C-O 3.57Å; Y243-N252 WeakPolarHBondContact CA-O 3.45Å; S244-N252 PolarHBondContact N-O 3.44Å; S244-N252 PolarHBondContact O-N 3.31Å; S244-N252 PolarHBondContact OG-O 3.13Å; D246-N252 PolarHBondContact OD2-ND2 2.77Å; N250-N252 PolarHBondContact O-N 3.17Å; N252-Y254 PolarHBondContact O-N 2.89Å
253	L	63	Low	64.4	Low	86 Å²	86	64.1 Å²	64.1	45%	0.45	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	119	177	-177.4	69.5	0	0	0	109.8	Y241 Y243	Y241-L253 HydrophobicContact CD1-CD1 3.95Å; Y241-L253 HydrophobicContact CD1-CD2 4.31Å; Y241-L253 HydrophobicContact CG-CD1 4.39Å; Y243-L253 HydrophobicContact CD1-CB 3.93Å; Y243-L253 HydrophobicContact CD1-CD1 4.07Å; Y243-L253 HydrophobicContact CE1-CB 3.99Å; Y243-L253 HydrophobicContact CE1-CD1 3.87Å; Y243-L253 HydrophobicContact CE1-CG 4.46Å
254	Y	67.1	Low	63.8	Low	68 Å²	68	64.6 Å²	64.6	27%	0.267	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	-15.7	-177.1	78.8	-79.6	0	0	0	114	I220 C231 F242 S244 N252	I220-Y254 HydrophobicContact CD1-CE2 4.37Å; I220-Y254 WeakPolarHBondContact CD1-OH 3.46Å; I220-Y254 WeakPolarHBondContact CG1-OH 3.27Å; C231-Y254 HydrophobicContact CB-CE1 3.71Å; C231-Y254 WeakPolarHBondContact CB-OH 3.34Å; F242-Y254 HydrophobicContact CB-CD1 4.3Å; F242-Y254 HydrophobicContact CB-CE1 3.64Å; F242-Y254 WeakPolarHBondContact O-CD1 3.37Å; F242-Y254 WeakPolarHBondContact O-CE1 3.16Å; F242-Y254 PolarHBondContact O-N 2.7Å; S244-Y254 VanDerWaalsContact N-CD1 3.3Å; N252-Y254 PolarHBondContact O-N 2.89Å
255	A	72.9	Confident	64	Low	11 Å²	11	63.5 Å²	63.5	9%	0.091	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	142.3	169.6	0	0	0	0	0	111.3	F242 Y257	F242-A255 HydrophobicContact CB-CB 4.35Å; F242-A255 HydrophobicContact CD2-CB 4.19Å; F242-A255 PolarHBondContact N-O 2.75Å; F242-A255 PolarHBondContact O-N 2.91Å; A255-Y257 HydrophobicContact CB-CD2 4.42Å; A255-Y257 HydrophobicContact CB-CE2 3.83Å
256	T	77.3	Confident	64.4	Low	67 Å²	67	61.3 Å²	61.3	41%	0.411	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	129.5	171.3	-54.9	0	0	0	0	107.5	N239 L240 Y241	N239-T256 HydrophobicContact CB-CG2 4.13Å; L240-T256 WeakPolarHBondContact O-CA 3.43Å; Y241-T256 HydrophobicContact CD1-CG2 3.61Å; Y241-T256 HydrophobicContact CE1-CG2 3.58Å
257	Y	76.9	Confident	64.8	Low	38 Å²	38	60 Å²	60	15%	0.149	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	120.2	174.8	-67.1	-96.5	0	0	0	109.2	K222 L240 F242 A255 F262 L280 L286	K222-Y257 VanDerWaalsContact CD-OH 3.31Å; K222-Y257 WeakPolarHBondContact CD-OH 3.45Å; K222-Y257 WeakPolarHBondContact CE-OH 3.44Å; K222-Y257 PolarHBondContact NZ-OH 3.05Å; L240-Y257 PolarHBondContact N-O 3.4Å; L240-Y257 PolarHBondContact O-N 3.11Å; F242-Y257 AromaticContact CD2-CD2 3.81Å; F242-Y257 HydrophobicContact CD2-CD2 3.81Å; F242-Y257 AromaticContact CD2-CE2 3.89Å; F242-Y257 HydrophobicContact CD2-CE2 3.89Å; F242-Y257 AromaticContact CE2-CD2 3.57Å; F242-Y257 HydrophobicContact CE2-CD2 3.57Å; F242-Y257 AromaticContact CE2-CE2 3.78Å; F242-Y257 HydrophobicContact CE2-CE2 3.78Å; A255-Y257 HydrophobicContact CB-CD2 4.42Å; A255-Y257 HydrophobicContact CB-CE2 3.83Å; Y257-F262 HydrophobicContact CG-CZ 4.47Å; Y257-L280 HydrophobicContact CD1-CD1 3.65Å; Y257-L280 HydrophobicContact CD1-CD2 4.18Å; Y257-L280 HydrophobicContact CE1-CD1 3.51Å; Y257-L286 HydrophobicContact CD1-CD2 4.31Å; Y257-L286 HydrophobicContact CD2-CD2 4.11Å; Y257-L286 HydrophobicContact CE1-CD2 4.3Å; Y257-L286 HydrophobicContact CE2-CD2 4.08Å; Y257-L286 HydrophobicContact CG-CD2 4.22Å
258	Q	74.6	Confident	65.2	Low	82 Å²	82	57.7 Å²	57.7	38%	0.383	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	132.6	175.2	-159	175.9	0.8	0	0	109.1	N239 S260 H261 F262	N239-Q258 WeakPolarHBondContact OD1-CA 3.21Å; Q258-S260 VanDerWaalsContact CG-OG 3.3Å; Q258-S260 WeakPolarHBondContact CG-OG 3.41Å; Q258-S260 PolarHBondContact O-N 2.8Å; Q258-H261 WeakPolarHBondContact O-CB 3.23Å; Q258-H261 PolarHBondContact O-N 3.35Å; Q258-F262 WeakPolarHBondContact O-CD2 3.13Å
259	L	73.4	Confident	65.4	Low	7 Å²	7	55.1 Å²	55.1	4%	0.037	31%	0.308	C	S	.	.	G	3₁₀ helix	trans	-69.8	-20.5	-171.5	-67.5	174.1	0	0	0	112.8	L235 Y238 L240 H261 F262 L303 V306 V307	L235-L259 HydrophobicContact CD1-CD1 3.56Å; L235-L259 HydrophobicContact CD1-CD2 4.17Å; L235-L259 HydrophobicContact CD1-CG 4.47Å; Y238-L259 WeakPolarHBondContact O-CB 3.48Å; Y238-L259 PolarHBondContact O-N 3.34Å; L240-L259 HydrophobicContact CB-CD2 4.1Å; L259-H261 PolarHBondContact O-N 3.41Å; L259-F262 HydrophobicContact CD2-CD2 4.01Å; L259-F262 HydrophobicContact CD2-CE2 3.82Å; L259-F262 HydrophobicContact CD2-CZ 4.4Å; L259-F262 PolarHBondContact O-N 3Å; L259-L303 HydrophobicContact CD2-CD2 3.9Å; L259-V306 HydrophobicContact CD1-CB 4.23Å; L259-V306 HydrophobicContact CD1-CG1 3.32Å; L259-V307 HydrophobicContact CB-CG2 4.04Å; L259-V307 HydrophobicContact CD2-CG2 4.23Å
260	S	62.1	Low	65.3	Low	45 Å²	45	58.2 Å²	58.2	32%	0.315	31%	0.313	S	S	.	.	G	3₁₀ helix	trans	-60.4	-21.2	166.2	54.4	0	0	0	0	114	Q258 Y281	Q258-S260 VanDerWaalsContact CG-OG 3.3Å; Q258-S260 WeakPolarHBondContact CG-OG 3.41Å; Q258-S260 PolarHBondContact O-N 2.8Å; S260-Y281 WeakPolarHBondContact O-CE2 3.04Å
261	H	69.6	Low	65	Low	97 Å²	97	61.4 Å²	61.4	45%	0.449	33%	0.329	S	S	.	.	G	3₁₀ helix	trans	-87.4	-4	179.8	-60.7	167.5	0	0	0	113.5	Q258 L259 Q263 L280 Y281	Q258-H261 WeakPolarHBondContact O-CB 3.23Å; Q258-H261 PolarHBondContact O-N 3.35Å; L259-H261 PolarHBondContact O-N 3.41Å; H261-Q263 PolarHBondContact O-N 2.89Å; H261-L280 HydrophobicContact CB-CD2 4.12Å; H261-L280 CarbonylContact O-C 3.14Å; H261-L280 WeakPolarHBondContact O-CA 3.44Å; H261-L280 WeakPolarHBondContact O-CD2 3.41Å; H261-Y281 WeakPolarHBondContact O-CD2 3.23Å; H261-Y281 PolarHBondContact O-N 3.44Å
262	F	73.8	Confident	64.3	Low	7 Å²	7	65.3 Å²	65.3	3%	0.031	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	107.6	178.3	-71.8	-109.2	0	0	0	110.7	L240 Y257 Q258 L259 I265 T278 L280 L286 V307	L240-F262 HydrophobicContact CD2-CZ 4.07Å; Y257-F262 HydrophobicContact CG-CZ 4.47Å; Q258-F262 WeakPolarHBondContact O-CD2 3.13Å; L259-F262 HydrophobicContact CD2-CD2 4.01Å; L259-F262 HydrophobicContact CD2-CE2 3.82Å; L259-F262 HydrophobicContact CD2-CZ 4.4Å; L259-F262 PolarHBondContact O-N 3Å; F262-I265 HydrophobicContact CD1-CG1 4.42Å; F262-T278 HydrophobicContact CD1-CG2 4.15Å; F262-T278 HydrophobicContact CE1-CG2 4.13Å; F262-T278 WeakPolarHBondContact CE1-OG1 3.48Å; F262-L280 HydrophobicContact CD1-CD2 4.18Å; F262-L280 HydrophobicContact CD2-CD2 3.79Å; F262-L280 HydrophobicContact CE1-CD2 4.26Å; F262-L280 HydrophobicContact CE2-CD2 3.92Å; F262-L280 HydrophobicContact CG-CD2 3.95Å; F262-L280 HydrophobicContact CZ-CD2 4.14Å; F262-L286 HydrophobicContact CE1-CD2 4.13Å; F262-L286 HydrophobicContact CZ-CD2 4.02Å; F262-V307 HydrophobicContact CB-CG1 4.37Å; F262-V307 HydrophobicContact CB-CG2 4.1Å
263	Q	61.6	Low	64	Low	103 Å²	103	62.6 Å²	62.6	48%	0.481	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	-35.8	-179	-166.1	-174.8	28.7	0	0	112.1	H261 V279 Y281	H261-Q263 PolarHBondContact O-N 2.89Å; Q263-V279 PolarHBondContact N-O 2.78Å; Q263-Y281 HydrophobicContact CB-CD2 4.11Å; Q263-Y281 HydrophobicContact CB-CE2 4.24Å; Q263-Y281 HydrophobicContact CB-CG 4.44Å; Q263-Y281 HydrophobicContact CG-CE2 4.5Å
264	S	64.3	Low	64.5	Low	50 Å²	50	64.3 Å²	64.3	35%	0.35	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	152	172.7	75.4	0	0	0	0	112.7	T278 V279	S264-T278 WeakPolarHBondContact O-CA 3.44Å; S264-V279 PolarHBondContact N-O 3.09Å; S264-V279 PolarHBondContact O-N 3.28Å; S264-V279 WeakPolarHBondContact OG-CG2 3.25Å
265	I	73.8	Confident	64.9	Low	13 Å²	13	63.5 Å²	63.5	7%	0.067	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	126.8	175.4	-63.6	159.9	0	0	0	106.5	F262 V276 T278 L303 V307	F262-I265 HydrophobicContact CD1-CG1 4.42Å; I265-V276 HydrophobicContact CG2-CG1 3.79Å; I265-T278 HydrophobicContact CB-CG2 4.38Å; I265-T278 HydrophobicContact CG1-CG2 3.91Å; I265-T278 HydrophobicContact CG2-CG2 4.24Å; I265-L303 HydrophobicContact CD1-CB 3.82Å; I265-V307 HydrophobicContact CD1-CB 4.28Å; I265-V307 HydrophobicContact CD1-CG2 3.84Å
266	S	69.1	Low	65.1	Low	36 Å²	36	63 Å²	63	25%	0.252	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	121.3	176.4	50.2	0	0	0	0	110.8	D277	S266-D277 PolarHBondContact N-O 3.03Å; S266-D277 PolarHBondContact O-N 2.84Å
267	V	64.6	Low	65	Low	28 Å²	28	61.3 Å²	61.3	17%	0.17	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	127.4	164	-171.4	0	0	0	0	107.3	G269 V276 L297	V267-G269 PolarHBondContact O-N 3.48Å; V267-V276 HydrophobicContact CG2-CG1 4.35Å; V267-V276 HydrophobicContact CG2-CG2 4.27Å; V267-L297 HydrophobicContact CB-CD2 4.4Å; V267-L297 HydrophobicContact CG1-CD2 3.93Å; V267-L297 HydrophobicContact CG1-CG 4.38Å
268	L	54.3	Low	64.9	Low	77 Å²	77	59.6 Å²	59.6	40%	0.403	31%	0.313	S	S	.	.			trans	-77.8	103.9	-178.5	-175.1	63.2	0	0	0	109.3	N270 A273	L268-N270 PolarHBondContact O-N 3.27Å; L268-A273 WeakPolarHBondContact O-CB 3.33Å
269	G	48.1	Very low	64.8	Low	31 Å²	31	57.3 Å²	57.3	32%	0.32	31%	0.305	S	S	.	.			trans	-71.1	39.8	-161.1	0	0	0	0	0	118.9	T155 V267	T155-G269 WeakPolarHBondContact OG1-CA 3.49Å; T155-G269 PolarHBondContact OG1-O 3.17Å; V267-G269 PolarHBondContact O-N 3.48Å
270	N	47.2	Very low	64.9	Low	116 Å²	116	57.3 Å²	57.3	62%	0.62	31%	0.305	S	S	*	.			trans	-91.4	136.8	161.5	-77.1	1.3	0	0	0	109.5	L268 E272 A273	L268-N270 PolarHBondContact O-N 3.27Å; N270-E272 PolarHBondContact O-N 3Å; N270-A273 HydrophobicContact CB-CB 4.19Å; N270-A273 WeakPolarHBondContact O-CB 3.45Å; N270-A273 PolarHBondContact O-N 2.69Å
271	L	45.2	Very low	64.9	Low	163 Å²	163	62.5 Å²	62.5	85%	0.853	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-13.2	-177.1	-78.2	153.7	0	0	0	115.2	P293	L271-P293 WeakPolarHBondContact O-CB 3.38Å; L271-P293 VanDerWaalsContact O-CG 3.31Å; L271-P293 WeakPolarHBondContact O-CG 3.27Å
272	E	48.2	Very low	64.7	Low	171 Å²	171	62.8 Å²	62.8	80%	0.799	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.2	-15	175.2	-58.1	-175.8	137.4	0	0	113.6	N270 R274	N270-E272 PolarHBondContact O-N 3Å; E272-R274 PolarHBondContact O-N 3.48Å; E272-R274 VanDerWaalsContact O-N 3.14Å
273	A	57.8	Low	64	Low	19 Å²	19	68.5 Å²	68.5	16%	0.157	35%	0.354	C	S	.	.			trans	-79.1	101.3	-170.9	0	0	0	0	0	111.4	L268 N270 M275	L268-A273 WeakPolarHBondContact O-CB 3.33Å; N270-A273 HydrophobicContact CB-CB 4.19Å; N270-A273 WeakPolarHBondContact O-CB 3.45Å; N270-A273 PolarHBondContact O-N 2.69Å; A273-M275 PolarHBondContact O-N 2.76Å
274	R	71.7	Confident	64.5	Low	122 Å²	122	66 Å²	66	46%	0.46	35%	0.347	S	S	.	.			trans	-75.3	28.4	176.6	-47.2	-173.6	-174.1	-178.1	6.1	113.5	E272 K289 A290 E291 P293 A296	E272-R274 PolarHBondContact O-N 3.48Å; E272-R274 VanDerWaalsContact O-N 3.14Å; R274-K289 HydrophobicContact CB-CG 4.37Å; R274-K289 CarbonylContact O-C 3.59Å; R274-K289 VanDerWaalsContact O-CA 3.24Å; R274-K289 WeakPolarHBondContact O-CA 3.49Å; R274-A290 WeakPolarHBondContact CB-O 3.4Å; R274-A290 PolarHBondContact O-N 3.03Å; R274-E291 WeakPolarHBondContact CD-O 3.33Å; R274-E291 VanDerWaalsContact CZ-O 3.31Å; R274-E291 PolarHBondContact NH1-O 3.03Å; R274-P293 HydrophobicContact CG-CG 4.12Å; R274-A296 VanDerWaalsContact C-CB 3.4Å
275	M	76.1	Confident	64.9	Low	50 Å²	50	67.2 Å²	67.2	25%	0.246	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	140.4	-163.6	-58	-170.2	-53.3	0	0	113.8	W228 A273 L288 K289	W228-M275 HydrophobicContact CH2-SD 4.19Å; W228-M275 HydrophobicContact CZ2-SD 3.94Å; A273-M275 PolarHBondContact O-N 2.76Å; M275-L288 CarbonylContact C-O 3.58Å; M275-L288 VanDerWaalsContact CA-O 3.3Å; M275-L288 WeakPolarHBondContact CA-O 3.38Å; M275-K289 HydrophobicContact CG-CB 4.19Å; M275-K289 HydrophobicContact CG-CD 4.42Å; M275-K289 HydrophobicContact CG-CG 4.19Å
276	V	76.6	Confident	65.2	Low	2 Å²	2	66.7 Å²	66.7	1%	0.012	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	111.5	172.2	-171.3	0	0	0	0	107.5	I265 V267 T278 L288 A296	I265-V276 HydrophobicContact CG2-CG1 3.79Å; V267-V276 HydrophobicContact CG2-CG1 4.35Å; V267-V276 HydrophobicContact CG2-CG2 4.27Å; V276-T278 HydrophobicContact CG1-CG2 4.14Å; V276-L288 HydrophobicContact CB-CB 4.29Å; V276-L288 PolarHBondContact N-O 3.45Å; V276-L288 PolarHBondContact O-N 3.28Å; V276-A296 HydrophobicContact CG2-CB 4.24Å; V276-A296 WeakPolarHBondContact CG2-O 3.48Å
277	D	75.9	Confident	65.8	Low	30 Å²	30	66 Å²	66	16%	0.16	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	133.1	175.4	-67.5	-51.5	0	0	0	109.6	S266 Q287	S266-D277 PolarHBondContact N-O 3.03Å; S266-D277 PolarHBondContact O-N 2.84Å; D277-Q287 WeakPolarHBondContact OD1-CG 3.2Å; D277-Q287 PolarHBondContact OD1-NE2 2.95Å
278	T	76	Confident	66.6	Low	2 Å²	2	64.8 Å²	64.8	1%	0.012	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	143.1	178.1	74.3	0	0	0	0	111.6	F262 S264 I265 V276 Q285 L286	F262-T278 HydrophobicContact CD1-CG2 4.15Å; F262-T278 HydrophobicContact CE1-CG2 4.13Å; F262-T278 WeakPolarHBondContact CE1-OG1 3.48Å; S264-T278 WeakPolarHBondContact O-CA 3.44Å; I265-T278 HydrophobicContact CB-CG2 4.38Å; I265-T278 HydrophobicContact CG1-CG2 3.91Å; I265-T278 HydrophobicContact CG2-CG2 4.24Å; V276-T278 HydrophobicContact CG1-CG2 4.14Å; T278-Q285 CarbonylContact O-C 3.58Å; T278-Q285 WeakPolarHBondContact O-CA 3.42Å; T278-L286 WeakPolarHBondContact CB-O 3.42Å; T278-L286 PolarHBondContact N-O 2.85Å; T278-L286 PolarHBondContact O-N 2.54Å; T278-L286 WeakPolarHBondContact OG1-CB 3.44Å; T278-L286 PolarHBondContact OG1-O 2.86Å
279	V	71.8	Confident	67.9	Low	35 Å²	35	64.3 Å²	64.3	21%	0.212	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	129.1	-179.9	-172.8	0	0	0	0	109	Q263 S264 Q285	Q263-V279 PolarHBondContact N-O 2.78Å; S264-V279 PolarHBondContact N-O 3.09Å; S264-V279 PolarHBondContact O-N 3.28Å; S264-V279 WeakPolarHBondContact OG-CG2 3.25Å; V279-Q285 HydrophobicContact CG2-CG 4.42Å
280	L	75.3	Confident	69.6	Low	7 Å²	7	63.2 Å²	63.2	4%	0.037	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	158.5	-179.2	-66.3	163.2	0	0	0	111.1	Y257 H261 F262 D282 N283 T284 L286	Y257-L280 HydrophobicContact CD1-CD1 3.65Å; Y257-L280 HydrophobicContact CD1-CD2 4.18Å; Y257-L280 HydrophobicContact CE1-CD1 3.51Å; H261-L280 HydrophobicContact CB-CD2 4.12Å; H261-L280 CarbonylContact O-C 3.14Å; H261-L280 WeakPolarHBondContact O-CA 3.44Å; H261-L280 WeakPolarHBondContact O-CD2 3.41Å; F262-L280 HydrophobicContact CD1-CD2 4.18Å; F262-L280 HydrophobicContact CD2-CD2 3.79Å; F262-L280 HydrophobicContact CE1-CD2 4.26Å; F262-L280 HydrophobicContact CE2-CD2 3.92Å; F262-L280 HydrophobicContact CG-CD2 3.95Å; F262-L280 HydrophobicContact CZ-CD2 4.14Å; L280-D282 WeakPolarHBondContact CB-OD1 3.4Å; L280-D282 PolarHBondContact O-N 3.09Å; L280-N283 WeakPolarHBondContact O-CA 3.46Å; L280-N283 PolarHBondContact O-N 3.16Å; L280-T284 WeakPolarHBondContact CD1-OG1 3.38Å; L280-T284 PolarHBondContact N-O 3.23Å; L280-L286 HydrophobicContact CD1-CB 4.25Å
281	Y	62.7	Low	70.9	Confident	153 Å²	153	65 Å²	65	60%	0.6	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-14.4	-176.4	-95	-89.7	0	0	0	115.3	S260 H261 Q263 N283	S260-Y281 WeakPolarHBondContact O-CE2 3.04Å; H261-Y281 WeakPolarHBondContact O-CD2 3.23Å; H261-Y281 PolarHBondContact O-N 3.44Å; Q263-Y281 HydrophobicContact CB-CD2 4.11Å; Q263-Y281 HydrophobicContact CB-CE2 4.24Å; Q263-Y281 HydrophobicContact CB-CG 4.44Å; Q263-Y281 HydrophobicContact CG-CE2 4.5Å; Y281-N283 VanDerWaalsContact C-N 3.32Å
282	D	64.6	Low	72.4	Confident	103 Å²	103	59.3 Å²	59.3	55%	0.551	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.7	1.8	171.9	58.9	7.2	0	0	0	113.4	L280 T284	L280-D282 WeakPolarHBondContact CB-OD1 3.4Å; L280-D282 PolarHBondContact O-N 3.09Å; D282-T284 VanDerWaalsContact C-N 3.32Å; D282-T284 WeakPolarHBondContact OD1-CB 3.29Å; D282-T284 WeakPolarHBondContact OD1-CG2 3.37Å; D282-T284 PolarHBondContact OD1-N 3.45Å; D282-T284 PolarHBondContact OD1-OG1 2.65Å; D282-T284 PolarHBondContact OD2-OG1 2.94Å
283	N	59.2	Low	73.6	Confident	127 Å²	127	52.7 Å²	52.7	68%	0.679	26%	0.262	S	S	*	.	S	Bend	trans	71	11.4	-170.9	-47	-91.8	0	0	0	115.2	L280 Y281	L280-N283 WeakPolarHBondContact O-CA 3.46Å; L280-N283 PolarHBondContact O-N 3.16Å; Y281-N283 VanDerWaalsContact C-N 3.32Å
284	T	71.5	Confident	74.3	Confident	52 Å²	52	61.4 Å²	61.4	32%	0.319	29%	0.291	S	S	.	.			trans	-71.7	148.2	169.5	62.8	0	0	0	0	110.9	L280 D282	L280-T284 WeakPolarHBondContact CD1-OG1 3.38Å; L280-T284 PolarHBondContact N-O 3.23Å; D282-T284 VanDerWaalsContact C-N 3.32Å; D282-T284 WeakPolarHBondContact OD1-CB 3.29Å; D282-T284 WeakPolarHBondContact OD1-CG2 3.37Å; D282-T284 PolarHBondContact OD1-N 3.45Å; D282-T284 PolarHBondContact OD1-OG1 2.65Å; D282-T284 PolarHBondContact OD2-OG1 2.94Å
285	Q	74.3	Confident	74.7	Confident	75 Å²	75	57.3 Å²	57.3	35%	0.35	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	103.7	-175.6	-68.7	-167.2	30.5	0	0	111.3	K222 H224 T278 V279 Q287	K222-Q285 CarbonylContact C-O 3.55Å; H224-Q285 PolarHBondContact CE1-OE1 2.76Å; H224-Q285 PolarHBondContact NE2-OE1 2.79Å; T278-Q285 CarbonylContact O-C 3.58Å; T278-Q285 WeakPolarHBondContact O-CA 3.42Å; V279-Q285 HydrophobicContact CG2-CG 4.42Å; Q285-Q287 PolarHBondContact O-N 3.46Å
286	L	78.9	Confident	74.8	Confident	2 Å²	2	55 Å²	55	1%	0.01	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	103.1	175.7	176.2	65.7	0	0	0	109.3	I220 R221 K222 F242 Y257 F262 T278 L280 L288	I220-L286 HydrophobicContact CB-CD1 4.2Å; I220-L286 HydrophobicContact CD1-CD1 4.34Å; R221-L286 CarbonylContact O-C 3.57Å; R221-L286 WeakPolarHBondContact O-CA 3.07Å; K222-L286 HydrophobicContact CG-CD1 4.43Å; F242-L286 HydrophobicContact CE2-CD2 4.1Å; F242-L286 HydrophobicContact CZ-CD2 4.4Å; Y257-L286 HydrophobicContact CD1-CD2 4.31Å; Y257-L286 HydrophobicContact CD2-CD2 4.11Å; Y257-L286 HydrophobicContact CE1-CD2 4.3Å; Y257-L286 HydrophobicContact CE2-CD2 4.08Å; Y257-L286 HydrophobicContact CG-CD2 4.22Å; F262-L286 HydrophobicContact CE1-CD2 4.13Å; F262-L286 HydrophobicContact CZ-CD2 4.02Å; T278-L286 WeakPolarHBondContact CB-O 3.42Å; T278-L286 PolarHBondContact N-O 2.85Å; T278-L286 PolarHBondContact O-N 2.54Å; T278-L286 WeakPolarHBondContact OG1-CB 3.44Å; T278-L286 PolarHBondContact OG1-O 2.86Å; L280-L286 HydrophobicContact CD1-CB 4.25Å; L286-L288 HydrophobicContact CD1-CD2 4.06Å; L286-L288 HydrophobicContact CD2-CD2 4.12Å; L286-L288 HydrophobicContact CG-CD2 3.82Å
287	Q	81.3	Confident	74.8	Confident	21 Å²	21	57.6 Å²	57.6	10%	0.098	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	132.8	170.8	-40.8	-168.9	-97.6	0	0	109.1	I220 R221 W228 D277 Q285	I220-Q287 CarbonylContact C-O 3.5Å; I220-Q287 WeakPolarHBondContact CA-O 3.18Å; R221-Q287 HydrophobicContact CB-CB 4.18Å; R221-Q287 VanDerWaalsContact CD-OE1 3.32Å; R221-Q287 PolarHBondContact N-O 3.36Å; R221-Q287 PolarHBondContact O-N 3.29Å; W228-Q287 HydrophobicContact CH2-CB 3.54Å; W228-Q287 HydrophobicContact CZ2-CB 4.22Å; W228-Q287 HydrophobicContact CZ3-CB 4.15Å; W228-Q287 WeakPolarHBondContact CZ3-O 3.36Å; D277-Q287 WeakPolarHBondContact OD1-CG 3.2Å; D277-Q287 PolarHBondContact OD1-NE2 2.95Å; Q285-Q287 PolarHBondContact O-N 3.46Å
288	L	81.8	Confident	74.8	Confident	2 Å²	2	59.4 Å²	59.4	1%	0.01	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	144.6	174.2	-47.9	177.4	0	0	0	109.2	L218 E219 I220 L240 F242 M275 V276 L286 L303	L218-L288 HydrophobicContact CD1-CB 4.46Å; L218-L288 HydrophobicContact CD1-CD1 4.44Å; E219-L288 CarbonylContact O-C 3.56Å; I220-L288 HydrophobicContact CB-CD2 4.14Å; I220-L288 HydrophobicContact CG2-CD2 3.55Å; L240-L288 HydrophobicContact CD2-CD1 4.22Å; F242-L288 HydrophobicContact CE1-CD2 4.26Å; F242-L288 HydrophobicContact CZ-CD2 3.68Å; M275-L288 CarbonylContact C-O 3.58Å; M275-L288 VanDerWaalsContact CA-O 3.3Å; M275-L288 WeakPolarHBondContact CA-O 3.38Å; V276-L288 HydrophobicContact CB-CB 4.29Å; V276-L288 PolarHBondContact N-O 3.45Å; V276-L288 PolarHBondContact O-N 3.28Å; L286-L288 HydrophobicContact CD1-CD2 4.06Å; L286-L288 HydrophobicContact CD2-CD2 4.12Å; L286-L288 HydrophobicContact CG-CD2 3.82Å; L288-L303 HydrophobicContact CD1-CD1 3.55Å
289	K	82.2	Confident	75.1	Confident	68 Å²	68	59.4 Å²	59.4	30%	0.296	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	128	179.3	174.3	179.6	165.3	-133.9	0	111.2	L218 E219 W228 R274 M275	L218-K289 WeakPolarHBondContact CA-O 3.48Å; L218-K289 WeakPolarHBondContact CD2-O 3.24Å; E219-K289 HydrophobicContact CB-CB 4.26Å; E219-K289 PolarHBondContact N-O 2.88Å; E219-K289 PolarHBondContact O-N 3.37Å; E219-K289 WeakPolarHBondContact OE2-CD 3.36Å; E219-K289 WeakPolarHBondContact OE2-CE 3.45Å; E219-K289 IonicContact OE2-NZ 2.65Å; E219-K289 PolarHBondContact OE2-NZ 3.33Å; W228-K289 HydrophobicContact CE3-CB 4.05Å; W228-K289 HydrophobicContact CH2-CB 3.72Å; W228-K289 HydrophobicContact CZ3-CB 3.45Å; W228-K289 VanDerWaalsContact CZ3-CB 3.45Å; R274-K289 HydrophobicContact CB-CG 4.37Å; R274-K289 CarbonylContact O-C 3.59Å; R274-K289 VanDerWaalsContact O-CA 3.24Å; R274-K289 WeakPolarHBondContact O-CA 3.49Å; M275-K289 HydrophobicContact CG-CB 4.19Å; M275-K289 HydrophobicContact CG-CD 4.42Å; M275-K289 HydrophobicContact CG-CG 4.19Å
290	A	82.7	Confident	75.4	Confident	8 Å²	8	57.9 Å²	57.9	7%	0.066	28%	0.28	C	S	.	.			trans	-105	173.6	-173	0	0	0	0	0	112.6	L218 R274 S292 E295 A296	L218-A290 HydrophobicContact CD2-CB 3.72Å; R274-A290 WeakPolarHBondContact CB-O 3.4Å; R274-A290 PolarHBondContact O-N 3.03Å; A290-S292 VanDerWaalsContact C-N 3.33Å; A290-S292 PolarHBondContact O-N 3.36Å; A290-E295 HydrophobicContact CB-CB 4Å; A290-E295 HydrophobicContact CB-CG 4.29Å; A290-A296 HydrophobicContact CB-CB 3.96Å
291	E	75.9	Confident	75.4	Confident	154 Å²	154	60.6 Å²	60.6	72%	0.72	29%	0.293	S	S	*	.	S	Bend	trans	-73.2	-26.2	-178	-169.6	168.1	-171.4	0	0	112.2	R274 E295	R274-E291 WeakPolarHBondContact CD-O 3.33Å; R274-E291 VanDerWaalsContact CZ-O 3.31Å; R274-E291 PolarHBondContact NH1-O 3.03Å; E291-E295 PolarHBondContact N-OE2 2.81Å
292	S	75.6	Confident	76.1	Confident	42 Å²	42	56 Å²	56	29%	0.294	28%	0.276	S	S	.	.	S	Bend	trans	-139.1	161.9	175	71.9	0	0	0	0	113.2	A290 W294 E295 A296	A290-S292 VanDerWaalsContact C-N 3.33Å; A290-S292 PolarHBondContact O-N 3.36Å; S292-W294 VanDerWaalsContact C-N 3.28Å; S292-W294 PolarHBondContact O-N 3.42Å; S292-E295 PolarHBondContact O-N 3.23Å; S292-E295 WeakPolarHBondContact OG-CB 3.48Å; S292-E295 PolarHBondContact OG-N 3.29Å; S292-A296 PolarHBondContact O-N 3.34Å
293	P	74.6	Confident	76.7	Confident	33 Å²	33	51 Å²	51	21%	0.214	25%	0.249	C	C	.	.	H	α-helix	trans	-60.5	-36.9	173.7	-22	33.9	0	0	0	112.6	L271 R274 A296 L297	L271-P293 WeakPolarHBondContact O-CB 3.38Å; L271-P293 VanDerWaalsContact O-CG 3.31Å; L271-P293 WeakPolarHBondContact O-CG 3.27Å; R274-P293 HydrophobicContact CG-CG 4.12Å; P293-A296 PolarHBondContact O-N 2.98Å; P293-L297 WeakPolarHBondContact O-CG 3.5Å; P293-L297 PolarHBondContact O-N 2.74Å
294	W	72.6	Confident	77.5	Confident	201 Å²	201	48.3 Å²	48.3	76%	0.761	23%	0.23	S	C	*	.	H	α-helix	trans	-63.5	-41.4	174.2	-64.5	110.1	0	0	0	112.4	S292 L297 D298	S292-W294 VanDerWaalsContact C-N 3.28Å; S292-W294 PolarHBondContact O-N 3.42Å; W294-L297 HydrophobicContact CE3-CD1 4.36Å; W294-L297 PolarHBondContact O-N 2.96Å; W294-D298 PolarHBondContact O-N 3.23Å
295	E	79.9	Confident	77.5	Confident	37 Å²	37	49 Å²	49	17%	0.173	23%	0.229	C	C	.	.	H	α-helix	trans	-69.6	-36.1	176.4	-157.6	-153.7	169.8	0	0	111.6	A290 E291 S292 D298 W299	A290-E295 HydrophobicContact CB-CB 4Å; A290-E295 HydrophobicContact CB-CG 4.29Å; E291-E295 PolarHBondContact N-OE2 2.81Å; S292-E295 PolarHBondContact O-N 3.23Å; S292-E295 WeakPolarHBondContact OG-CB 3.48Å; S292-E295 PolarHBondContact OG-N 3.29Å; E295-D298 PolarHBondContact O-N 2.97Å; E295-W299 WeakPolarHBondContact O-CB 3.48Å; E295-W299 PolarHBondContact O-N 3.19Å; E295-W299 PolarHBondContact OE1-NE1 3.14Å
296	A	78.6	Confident	77.5	Confident	1 Å²	1	46 Å²	46	1%	0.008	22%	0.216	C	C	.	.	H	α-helix	trans	-64.1	-39.8	173	0	0	0	0	0	111.9	R274 V276 A290 S292 P293 G300	R274-A296 VanDerWaalsContact C-CB 3.4Å; V276-A296 HydrophobicContact CG2-CB 4.24Å; V276-A296 WeakPolarHBondContact CG2-O 3.48Å; A290-A296 HydrophobicContact CB-CB 3.96Å; S292-A296 PolarHBondContact O-N 3.34Å; P293-A296 PolarHBondContact O-N 2.98Å; A296-G300 PolarHBondContact O-N 3.41Å
297	L	75.3	Confident	77.3	Confident	56 Å²	56	46.6 Å²	46.6	29%	0.293	22%	0.22	S	C	.	.	H	α-helix	trans	-63	-44	172.4	-77.3	163.6	0	0	0	111.8	V267 P293 W294 G300 Q301	V267-L297 HydrophobicContact CB-CD2 4.4Å; V267-L297 HydrophobicContact CG1-CD2 3.93Å; V267-L297 HydrophobicContact CG1-CG 4.38Å; P293-L297 WeakPolarHBondContact O-CG 3.5Å; P293-L297 PolarHBondContact O-N 2.74Å; W294-L297 HydrophobicContact CE3-CD1 4.36Å; W294-L297 PolarHBondContact O-N 2.96Å; L297-G300 PolarHBondContact O-N 3.45Å; L297-Q301 VanDerWaalsContact O-CB 3.22Å; L297-Q301 WeakPolarHBondContact O-CB 3.37Å; L297-Q301 PolarHBondContact O-N 3.43Å
298	D	77	Confident	76.5	Confident	69 Å²	69	46.4 Å²	46.4	37%	0.369	22%	0.219	S	C	.	.	H	α-helix	trans	-67.2	-44.2	177.6	-179.1	40	0	0	0	112.4	K214 W294 E295 G300 Q301 K302	K214-D298 WeakPolarHBondContact CD-OD2 3.46Å; K214-D298 WeakPolarHBondContact CE-OD2 3.31Å; K214-D298 IonicContact NZ-OD2 3.77Å; K214-D298 PolarHBondContact NZ-OD2 3.12Å; W294-D298 PolarHBondContact O-N 3.23Å; E295-D298 PolarHBondContact O-N 2.97Å; D298-G300 PolarHBondContact O-N 2.98Å; D298-Q301 PolarHBondContact O-N 2.75Å; D298-K302 WeakPolarHBondContact O-CB 3.41Å; D298-K302 PolarHBondContact O-N 3.45Å
299	W	81.1	Confident	75.6	Confident	1 Å²	1	50.2 Å²	50.2	0%	0.004	25%	0.251	C	S	.	.	H	α-helix	trans	-59.3	-46.3	170.9	-83.5	111.7	0	0	0	111.8	K214 L218 A233 L235 L240 E295 K302 L303	K214-W299 HydrophobicContact CB-CE3 4.38Å; K214-W299 HydrophobicContact CB-CH2 4.39Å; K214-W299 HydrophobicContact CB-CZ3 4.11Å; K214-W299 HydrophobicContact CD-CD2 3.68Å; K214-W299 HydrophobicContact CD-CE3 3.87Å; K214-W299 HydrophobicContact CD-CG 4.02Å; K214-W299 HydrophobicContact CD-CZ2 4.44Å; K214-W299 HydrophobicContact CD-CZ3 4.33Å; K214-W299 VanDerWaalsContact CE-NE1 3.29Å; K214-W299 HydrophobicContact CG-CD2 4.16Å; K214-W299 HydrophobicContact CG-CE3 4.09Å; K214-W299 HydrophobicContact CG-CH2 4.03Å; K214-W299 HydrophobicContact CG-CZ2 4.08Å; K214-W299 HydrophobicContact CG-CZ3 4.04Å; L218-W299 HydrophobicContact CD1-CD2 3.89Å; L218-W299 HydrophobicContact CD1-CE3 4.16Å; L218-W299 HydrophobicContact CD1-CG 4.37Å; L218-W299 HydrophobicContact CD1-CH2 4.32Å; L218-W299 HydrophobicContact CD1-CZ2 4.07Å; L218-W299 HydrophobicContact CD1-CZ3 4.36Å; L218-W299 HydrophobicContact CD2-CD2 4.33Å; L218-W299 HydrophobicContact CD2-CG 4.17Å; L218-W299 HydrophobicContact CG-CD2 4.38Å; L218-W299 HydrophobicContact CG-CZ2 4.08Å; A233-W299 HydrophobicContact CB-CH2 3.73Å; A233-W299 HydrophobicContact CB-CZ2 4.15Å; A233-W299 HydrophobicContact CB-CZ3 4.36Å; L235-W299 HydrophobicContact CB-CZ3 3.98Å; L240-W299 HydrophobicContact CD1-CZ3 4.4Å; E295-W299 WeakPolarHBondContact O-CB 3.48Å; E295-W299 PolarHBondContact O-N 3.19Å; E295-W299 PolarHBondContact OE1-NE1 3.14Å; W299-K302 PolarHBondContact O-N 3.01Å; W299-L303 WeakPolarHBondContact O-CB 3.46Å; W299-L303 WeakPolarHBondContact O-CD1 3.33Å; W299-L303 VanDerWaalsContact O-CG 3.28Å; W299-L303 WeakPolarHBondContact O-CG 3.29Å; W299-L303 PolarHBondContact O-N 2.71Å
300	G	78.6	Confident	74.2	Confident	3 Å²	3	48.4 Å²	48.4	3%	0.031	25%	0.248	C	C	.	.	H	α-helix	trans	-64.2	-42.9	178.6	0	0	0	0	0	112.7	A296 L297 D298 W304	A296-G300 PolarHBondContact O-N 3.41Å; L297-G300 PolarHBondContact O-N 3.45Å; D298-G300 PolarHBondContact O-N 2.98Å; G300-W304 WeakPolarHBondContact O-CB 3.37Å; G300-W304 PolarHBondContact O-N 2.97Å
301	Q	74.7	Confident	72.5	Confident	64 Å²	64	51.1 Å²	51.1	30%	0.299	26%	0.264	S	S	.	.	H	α-helix	trans	-62.5	-48.5	174.1	-177.3	-178.4	-26.5	0	0	110.6	W159 L297 D298 L303 W304 E305	W159-Q301 HydrophobicContact CH2-CB 3.82Å; W159-Q301 HydrophobicContact CH2-CG 3.69Å; W159-Q301 HydrophobicContact CZ2-CB 3.72Å; W159-Q301 HydrophobicContact CZ2-CG 3.81Å; W159-Q301 HydrophobicContact CZ3-CG 4.13Å; L297-Q301 VanDerWaalsContact O-CB 3.22Å; L297-Q301 WeakPolarHBondContact O-CB 3.37Å; L297-Q301 PolarHBondContact O-N 3.43Å; D298-Q301 PolarHBondContact O-N 2.75Å; Q301-L303 PolarHBondContact O-N 3.31Å; Q301-W304 PolarHBondContact O-N 2.97Å; Q301-E305 HydrophobicContact CG-CG 4.34Å; Q301-E305 WeakPolarHBondContact CG-OE1 3.36Å; Q301-E305 PolarHBondContact NE2-OE1 3.49Å; Q301-E305 WeakPolarHBondContact O-CB 3.34Å; Q301-E305 WeakPolarHBondContact O-CG 3.47Å; Q301-E305 PolarHBondContact O-N 2.78Å
302	K	78.1	Confident	70.6	Confident	56 Å²	56	48 Å²	48	24%	0.243	26%	0.257	C	S	.	.	H	α-helix	trans	-66.3	-39.8	-178.1	-146.3	75.3	-160.8	159.3	0	112.5	L213 K214 L235 D298 W299 E305 V306	L213-K302 HydrophobicContact CB-CG 4.34Å; K214-K302 HydrophobicContact CB-CG 4.42Å; L235-K302 HydrophobicContact CD2-CB 3.76Å; L235-K302 HydrophobicContact CD2-CG 3.74Å; D298-K302 WeakPolarHBondContact O-CB 3.41Å; D298-K302 PolarHBondContact O-N 3.45Å; W299-K302 PolarHBondContact O-N 3.01Å; K302-E305 WeakPolarHBondContact CE-OE2 3.4Å; K302-E305 IonicContact NZ-OE2 2.75Å; K302-E305 PolarHBondContact NZ-OE2 3.5Å; K302-V306 WeakPolarHBondContact O-CB 3.31Å; K302-V306 WeakPolarHBondContact O-CG2 3.46Å; K302-V306 PolarHBondContact O-N 3.18Å; K302-V306 VanDerWaalsContact O-N 3.07Å
303	L	77.6	Confident	68.6	Low	0 Å²	0	48.8 Å²	48.8	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-62.3	-44.6	171.8	-73.7	164.3	0	0	0	111.5	L235 L240 L259 I265 L288 W299 Q301 V306 V307	L235-L303 HydrophobicContact CD1-CD2 3.66Å; L235-L303 HydrophobicContact CD2-CD2 4.19Å; L235-L303 HydrophobicContact CD2-CG 4.27Å; L240-L303 HydrophobicContact CD1-CD2 4.4Å; L240-L303 HydrophobicContact CD2-CD2 3.96Å; L259-L303 HydrophobicContact CD2-CD2 3.9Å; I265-L303 HydrophobicContact CD1-CB 3.82Å; L288-L303 HydrophobicContact CD1-CD1 3.55Å; W299-L303 WeakPolarHBondContact O-CB 3.46Å; W299-L303 WeakPolarHBondContact O-CD1 3.33Å; W299-L303 VanDerWaalsContact O-CG 3.28Å; W299-L303 WeakPolarHBondContact O-CG 3.29Å; W299-L303 PolarHBondContact O-N 2.71Å; Q301-L303 PolarHBondContact O-N 3.31Å; L303-V306 PolarHBondContact O-N 2.99Å; L303-V307 VanDerWaalsContact O-CG2 3.28Å; L303-V307 WeakPolarHBondContact O-CG2 3.4Å; L303-V307 PolarHBondContact O-N 3.49Å
304	W	75.3	Confident	66.4	Low	70 Å²	70	58 Å²	58	27%	0.265	30%	0.304	S	S	.	.	H	α-helix	trans	-63.5	-45.5	178.2	-170.7	113.5	0	0	0	111.6	W159 G300 Q301 V306 H308	W159-W304 HydrophobicContact CB-CH2 4.18Å; W159-W304 HydrophobicContact CB-CZ2 4.46Å; W159-W304 HydrophobicContact CB-CZ3 4.44Å; W159-W304 AromaticContact CD1-CD2 3.69Å; W159-W304 AromaticContact CD1-CE2 3.48Å; W159-W304 VanDerWaalsContact CD1-CE2 3.48Å; W159-W304 AromaticContact CD1-CZ2 3.71Å; W159-W304 AromaticContact CD1-NE1 3.78Å; W159-W304 HydrophobicContact CG-CH2 4.46Å; W159-W304 HydrophobicContact CG-CZ2 4.45Å; G300-W304 WeakPolarHBondContact O-CB 3.37Å; G300-W304 PolarHBondContact O-N 2.97Å; Q301-W304 PolarHBondContact O-N 2.97Å; W304-V306 VanDerWaalsContact C-N 3.31Å; W304-V306 PolarHBondContact O-N 2.95Å; W304-H308 AromaticContact CD2-CD2 3.52Å; W304-H308 AromaticContact CE2-CD2 3.76Å; W304-H308 AromaticContact CE3-CD2 3.81Å; W304-H308 AromaticContact CG-CD2 3.84Å; W304-H308 VanDerWaalsContact O-CB 3.24Å; W304-H308 WeakPolarHBondContact O-CB 3.36Å; W304-H308 PolarHBondContact O-CD2 3.35Å; W304-H308 PolarHBondContact O-N 3.15Å
305	E	72.6	Confident	64.2	Low	65 Å²	65	58.1 Å²	58.1	30%	0.304	32%	0.315	S	S	.	.	H	α-helix	trans	-57.2	-45.2	175.2	-77.9	175.4	-170.2	0	0	111.2	Q301 K302 H308 A309	Q301-E305 HydrophobicContact CG-CG 4.34Å; Q301-E305 WeakPolarHBondContact CG-OE1 3.36Å; Q301-E305 PolarHBondContact NE2-OE1 3.49Å; Q301-E305 WeakPolarHBondContact O-CB 3.34Å; Q301-E305 WeakPolarHBondContact O-CG 3.47Å; Q301-E305 PolarHBondContact O-N 2.78Å; K302-E305 WeakPolarHBondContact CE-OE2 3.4Å; K302-E305 IonicContact NZ-OE2 2.75Å; K302-E305 PolarHBondContact NZ-OE2 3.5Å; E305-H308 CarbonylContact O-C 3.56Å; E305-H308 PolarHBondContact O-N 2.93Å; E305-H308 VanDerWaalsContact O-N 3.17Å; E305-A309 WeakPolarHBondContact O-CB 3.45Å; E305-A309 PolarHBondContact O-N 3.42Å
306	V	73.8	Confident	61.7	Low	14 Å²	14	60 Å²	60	9%	0.085	35%	0.345	C	S	.	.	H	α-helix	trans	-75.5	-43	-172.9	176.7	0	0	0	0	112.7	L213 L235 P237 L259 K302 L303 W304 H308	L213-V306 HydrophobicContact CD1-CG1 4.48Å; L213-V306 HydrophobicContact CD1-CG2 3.27Å; L235-V306 HydrophobicContact CD2-CG2 4.44Å; P237-V306 WeakPolarHBondContact O-CG1 3.42Å; L259-V306 HydrophobicContact CD1-CB 4.23Å; L259-V306 HydrophobicContact CD1-CG1 3.32Å; K302-V306 WeakPolarHBondContact O-CB 3.31Å; K302-V306 WeakPolarHBondContact O-CG2 3.46Å; K302-V306 PolarHBondContact O-N 3.18Å; K302-V306 VanDerWaalsContact O-N 3.07Å; L303-V306 PolarHBondContact O-N 2.99Å; W304-V306 VanDerWaalsContact C-N 3.31Å; W304-V306 PolarHBondContact O-N 2.95Å; V306-H308 PolarHBondContact O-N 3.31Å
307	V	73.4	Confident	59.2	Low	13 Å²	13	71.5 Å²	71.5	8%	0.079	39%	0.388	C	S	.	.	H	α-helix	trans	-62.6	-12	171.8	-176.4	0	0	0	0	110.7	F143 L259 F262 I265 L303	F143-V307 WeakPolarHBondContact CA-O 3.49Å; L259-V307 HydrophobicContact CB-CG2 4.04Å; L259-V307 HydrophobicContact CD2-CG2 4.23Å; F262-V307 HydrophobicContact CB-CG1 4.37Å; F262-V307 HydrophobicContact CB-CG2 4.1Å; I265-V307 HydrophobicContact CD1-CB 4.28Å; I265-V307 HydrophobicContact CD1-CG2 3.84Å; L303-V307 VanDerWaalsContact O-CG2 3.28Å; L303-V307 WeakPolarHBondContact O-CG2 3.4Å; L303-V307 PolarHBondContact O-N 3.49Å
308	H	64.9	Low	56.8	Low	18 Å²	18	77.3 Å²	77.3	8%	0.083	41%	0.414	C	S	.	.	T	Hydrogen-bonded Turn	trans	-131.3	20.6	-174.8	-48.7	-29.5	0	0	0	116.2	F143 K144 W304 E305 V306 A310	F143-H308 HydrophobicContact CD1-CB 3.99Å; F143-H308 WeakPolarHBondContact CD1-O 3.34Å; F143-H308 WeakPolarHBondContact CE1-O 3.19Å; K144-H308 VanDerWaalsContact CD-NE2 3.33Å; K144-H308 WeakPolarHBondContact CD-NE2 3.48Å; K144-H308 WeakPolarHBondContact CE-NE2 3.4Å; K144-H308 PolarHBondContact N-ND1 3.24Å; K144-H308 PolarHBondContact NZ-CD2 3.24Å; K144-H308 PolarHBondContact NZ-NE2 3.21Å; W304-H308 AromaticContact CD2-CD2 3.52Å; W304-H308 AromaticContact CE2-CD2 3.76Å; W304-H308 AromaticContact CE3-CD2 3.81Å; W304-H308 AromaticContact CG-CD2 3.84Å; W304-H308 VanDerWaalsContact O-CB 3.24Å; W304-H308 WeakPolarHBondContact O-CB 3.36Å; W304-H308 PolarHBondContact O-CD2 3.35Å; W304-H308 PolarHBondContact O-N 3.15Å; E305-H308 CarbonylContact O-C 3.56Å; E305-H308 PolarHBondContact O-N 2.93Å; E305-H308 VanDerWaalsContact O-N 3.17Å; V306-H308 PolarHBondContact O-N 3.31Å; H308-A310 PolarHBondContact O-N 2.67Å
309	A	63.4	Low	54.3	Low	82 Å²	82	80.2 Å²	80.2	68%	0.678	43%	0.43	S	S	*	.	S	Bend	trans	-91	71.2	169.4	0	0	0	0	0	113.2	T142 E305	T142-A309 PolarHBondContact OG1-O 3.32Å; E305-A309 WeakPolarHBondContact O-CB 3.45Å; E305-A309 PolarHBondContact O-N 3.42Å
310	A	52.5	Low	51.7	Low	30 Å²	30	87.8 Å²	87.8	25%	0.248	47%	0.465	C	S	.	.				-154.7	-151.1	-125.2	0	0	0	0	0	125.2	T142 F143 H308	T142-A310 HydrophobicContact CG2-CB 3.47Å; T142-A310 VanDerWaalsContact CG2-CB 3.47Å; T142-A310 WeakPolarHBondContact OG1-CA 3.41Å; T142-A310 WeakPolarHBondContact OG1-CB 3.32Å; F143-A310 HydrophobicContact CB-CB 3.3Å; F143-A310 HydrophobicContact CD1-CB 3.46Å; F143-A310 VanDerWaalsContact CD1-CB 3.46Å; F143-A310 HydrophobicContact CD2-CB 3.85Å; F143-A310 VanDerWaalsContact CD2-O 3.3Å; F143-A310 WeakPolarHBondContact CD2-O 3.43Å; F143-A310 HydrophobicContact CE1-CB 4.25Å; F143-A310 WeakPolarHBondContact CE2-O 3.32Å; F143-A310 HydrophobicContact CG-CB 3.12Å; H308-A310 PolarHBondContact O-N 2.67Å
311	V	46.5	Very low	49.1	Very low	64 Å²	64	94.5 Å²	94.5	39%	0.388	50%	0.5	S	S	.	.			trans	-5	145.9	-132.8	77	0	0	0	0	120.9	T142 F143 G313	T142-V311 WeakPolarHBondContact O-CA 3.48Å; F143-V311 HydrophobicContact CB-CB 3.64Å; F143-V311 HydrophobicContact CB-CG1 4.09Å; F143-V311 HydrophobicContact CD2-CB 3.97Å; F143-V311 HydrophobicContact CD2-CG1 3.67Å; F143-V311 HydrophobicContact CG-CB 4.29Å; F143-V311 HydrophobicContact CG-CG1 4.38Å; V311-G313 PolarHBondContact O-N 2.94Å
312	P	36.7	Very low	46.7	Very low	89 Å²	89	97 Å²	97	58%	0.578	52%	0.519	S	S	*	.			trans	-55.5	88.8	149.3	-22.1	35.5	0	0	0	109.9	T142 Y314	T142-P312 WeakPolarHBondContact O-CD 3.38Å; P312-Y314 PolarHBondContact O-N 3.32Å
313	G	32.7	Very low	44.1	Very low	59 Å²	59	101.8 Å²	101.8	61%	0.608	55%	0.546	S	S	*	.			trans	-68.3	88.2	-162.9	0	0	0	0	0	114.9	V311	V311-G313 PolarHBondContact O-N 2.94Å
314	Y	28.6	Very low	41.4	Very low	226 Å²	226	106.8 Å²	106.8	89%	0.886	58%	0.581	S	S	*	*			trans	-136.8	72.1	177.6	-100.1	-82.7	0	0	0	114.6	P312	P312-Y314 PolarHBondContact O-N 3.32Å
315	M	27.6	Very low	39.7	Very low	203 Å²	203	109.9 Å²	109.9	100%	1	61%	0.61	S	S	*	*			trans	-141.1	110.7	146.8	-96.6	-129.4	159.4	0	0	109
316	G	26	Very low	37.4	Very low	78 Å²	78	110.2 Å²	110.2	80%	0.804	63%	0.631	S	S	*	*			trans	-166.8	14.5	-167.2	0	0	0	0	0	117
317	R	25.9	Very low	35	Very low	241 Å²	241	118 Å²	118	91%	0.909	67%	0.671	S	S	*	*			trans	-156.1	126.6	164.6	-109.5	174.5	-170.1	-97.3	1	110.3
318	Q	26.6	Very low	32.6	Very low	178 Å²	178	120.5 Å²	120.5	83%	0.832	70%	0.699	S	S	*	*			trans	-99	169.7	157.5	-78.6	-176.3	-32	0	0	108.9
319	N	24.4	Very low	30.9	Very low	131 Å²	131	128.3 Å²	128.3	70%	0.701	74%	0.736	S	S	*	*			trans	67.8	146.1	-172.3	-60.5	24.7	0	0	0	113.1
320	E	25	Very low	29.1	Very low	160 Å²	160	131.5 Å²	131.5	75%	0.748	74%	0.736	S	S	*	*			cis	-145	-164.8	14.1	-141.5	137.6	-114.2	0	0	112.9
321	L	25.7	Very low	27.8	Very low	144 Å²	144	137.4 Å²	137.4	75%	0.754	76%	0.764	S	S	*	*			trans	-71.4	167.9	-160.5	-78.5	74.7	0	0	0	117.8
322	T	22.6	Very low	26.8	Very low	115 Å²	115	140.3 Å²	140.3	71%	0.706	78%	0.777	S	S	*	*			trans	86.7	126.7	139.4	31.9	0	0	0	0	123.4
323	I	23.9	Very low	26.1	Very low	157 Å²	157	146.5 Å²	146.5	81%	0.805	79%	0.79	S	S	*	*			trans	81.4	134.2	140.5	-65.3	161.9	0	0	0	119.5
324	S	21.6	Very low	25.8	Very low	105 Å²	105	148 Å²	148	73%	0.734	79%	0.788	S	S	*	*			trans	-100.7	-169.9	176.3	15.2	0	0	0	0	111.3
325	P	38.8	Very low	25.6	Very low	135 Å²	135	143.8 Å²	143.8	88%	0.877	78%	0.776	S	S	*	*			cis	-124.9	-172.1	-36.1	35.8	-19.3	0	0	0	111.3
326	G	24	Very low	25.4	Very low	72 Å²	72	145.4 Å²	145.4	74%	0.742	77%	0.773	S	S	*	*			trans	-171	143.6	170.6	0	0	0	0	0	117.9
327	L	24.7	Very low	25.4	Very low	177 Å²	177	150.1 Å²	150.1	93%	0.927	77%	0.774	S	S	*	*			trans	-74.9	164.5	166.3	-79.8	56.9	0	0	0	110.2
328	G	23.4	Very low	25.2	Very low	66 Å²	66	143.3 Å²	143.3	68%	0.68	76%	0.762	S	S	*	*			cis	154.7	-169.6	-2.7	0	0	0	0	0	112.5
329	H	27.3	Very low	25	Very low	182 Å²	182	145.1 Å²	145.1	84%	0.843	77%	0.767	S	S	*	*			trans	74.4	132.9	168.2	-100.9	-89.4	0	0	0	122.4
330	H	27.5	Very low	25.1	Very low	149 Å²	149	146.9 Å²	146.9	69%	0.69	77%	0.772	S	S	*	*			trans	-66.9	165.2	157.7	-92	-123.9	0	0	0	111.9	D332	H330-D332 IonicContact ND1-OD1 3.82Å
331	D	24.8	Very low	24.9	Very low	154 Å²	154	149.4 Å²	149.4	82%	0.824	78%	0.78	S	S	*	*				-155.1	155.7	113	-97.9	-25	0	0	0	112.6
332	D	25	Very low	24.8	Very low	126 Å²	126	151.7 Å²	151.7	67%	0.674	78%	0.784	S	S	*	*			trans	-91.1	179.9	-168	-64	-47.5	0	0	0	114.3	H330	H330-D332 IonicContact ND1-OD1 3.82Å
333	Y	22.9	Very low	24.7	Very low	218 Å²	218	151.2 Å²	151.2	86%	0.855	79%	0.791	S	S	*	*			trans	-152.3	105.3	133.7	-131.3	-98.4	0	0	0	115.4
334	T	25.6	Very low	24.8	Very low	91 Å²	91	149.5 Å²	149.5	56%	0.558	79%	0.793	S	S	*	*			trans	43	98.2	151	63.6	0	0	0	0	123.1
335	Q	24.7	Very low	24.9	Very low	137 Å²	137	147.8 Å²	147.8	64%	0.64	79%	0.792	S	S	*	*				42.8	129.4	95.5	-169	178.6	15.4	0	0	122	H337	Q335-H337 PolarHBondContact NE2-NE2 3.41Å
336	Y	22.1	Very low	24.3	Very low	237 Å²	237	150 Å²	150	93%	0.929	80%	0.796	S	S	*	*			trans	-142	152.2	146.2	-91.3	-79.9	0	0	0	111.2
337	H	26.4	Very low	24.6	Very low	177 Å²	177	154.5 Å²	154.5	82%	0.819	80%	0.802	S	S	*	*			trans	-87.7	145.5	-179.1	-80.8	-109.9	0	0	0	111.7	Q335	Q335-H337 PolarHBondContact NE2-NE2 3.41Å
338	C	22.7	Very low	24.6	Very low	98 Å²	98	151.7 Å²	151.7	66%	0.662	79%	0.794	S	S	*	*			cis	77.7	117.3	49	-172.3	0	0	0	0	115
339	F	22.9	Very low	24.8	Very low	216 Å²	216	154.5 Å²	154.5	95%	0.947	80%	0.801	S	S	*	*			trans	-159.7	159.9	152.7	-104.7	-66.9	0	0	0	111.9
340	Q	25.1	Very low	25	Very low	169 Å²	169	151 Å²	151	79%	0.79	80%	0.797	S	S	*	*			trans	-112.3	159.1	-167.9	-59.2	175.1	-9.4	0	0	114.2
341	K	22	Very low	25.1	Very low	212 Å²	212	149.7 Å²	149.7	92%	0.922	80%	0.801	S	S	*	*			trans	-155.8	149.6	140.8	-120.7	169.1	-175.1	174.7	0	113.1
342	K	23	Very low	25.2	Very low	193 Å²	193	148.4 Å²	148.4	84%	0.839	80%	0.799	S	S	*	*			trans	-102.1	156.4	178.7	-70.4	179.9	175.7	178.3	0	111.8
343	A	20.5	Very low	25.3	Very low	104 Å²	104	150.1 Å²	150.1	86%	0.86	81%	0.807	S	S	*	*			trans	-142.5	160	148.6	0	0	0	0	0	108.8
344	S	26.3	Very low	25.5	Very low	121 Å²	121	147 Å²	147	85%	0.846	81%	0.805	S	S	*	*			trans	-133.1	146	-170.6	-55.9	0	0	0	0	112.5
345	G	23.7	Very low	25.7	Very low	69 Å²	69	147.3 Å²	147.3	71%	0.711	81%	0.811	S	S	*	*			trans	120.2	144.7	140.9	0	0	0	0	0	118.9
346	L	24.9	Very low	26.2	Very low	182 Å²	182	146.1 Å²	146.1	95%	0.953	82%	0.815	S	S	*	*			trans	79.6	142.3	161.9	-49.9	-178.2	0	0	0	118.5
347	L	31.3	Very low	26.9	Very low	167 Å²	167	140.7 Å²	140.7	87%	0.874	80%	0.796	S	S	*	*			trans	-99.7	154	-172	-68.9	162.6	0	0	0	111.9
348	P	24.4	Very low	27.6	Very low	117 Å²	117	140.3 Å²	140.3	76%	0.76	80%	0.795	S	S	*	*				-113	166.7	124.3	-10.4	29.6	0	0	0	112.8
349	P	28.1	Very low	29.1	Very low	126 Å²	126	139 Å²	139	82%	0.818	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-83.3	159.5	-173.9	34.2	-36.3	0	0	0	114.3
350	S	32	Very low	30.1	Very low	108 Å²	108	135.8 Å²	135.8	76%	0.755	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-65.8	145.4	173.6	-47.1	0	0	0	0	112.9
351	P	28.7	Very low	31.8	Very low	122 Å²	122	132 Å²	132	79%	0.792	75%	0.75	S	S	*	*	P	Polyproline II helix	trans	-67.5	145.6	150.5	32.2	-32.3	0	0	0	109.3
352	V	26.7	Very low	34.4	Very low	126 Å²	126	125.9 Å²	125.9	76%	0.764	73%	0.726	S	S	*	*	P	Polyproline II helix	trans	-75.4	137.2	177.6	175.3	0	0	0	0	109.7	D354	V352-D354 PolarHBondContact O-N 3.48Å
353	L	28	Very low	36.8	Very low	163 Å²	163	120.7 Å²	120.7	85%	0.853	71%	0.707	S	S	*	*			trans	-78.5	100.9	166.4	177.8	67	0	0	0	108.4	S355	L353-S355 PolarHBondContact O-N 2.97Å
354	D	26.1	Very low	39.6	Very low	151 Å²	151	117.8 Å²	117.8	81%	0.807	68%	0.675	S	S	*	*	P	Polyproline II helix	trans	-64.7	120.8	168.5	-83.9	-37.7	0	0	0	109.2	V352	V352-D354 PolarHBondContact O-N 3.48Å
355	S	30.9	Very low	42.3	Very low	98 Å²	98	115.5 Å²	115.5	69%	0.685	66%	0.659	S	S	*	*	P	Polyproline II helix	trans	-81.2	149	179.1	50.5	0	0	0	0	111.5	L353	L353-S355 PolarHBondContact O-N 2.97Å
356	P	34	Very low	44.9	Very low	112 Å²	112	113.4 Å²	113.4	73%	0.727	64%	0.637	S	S	*	*	P	Polyproline II helix	trans	-60.3	145.5	171.4	26	-34	0	0	0	110.7	Q358	P356-Q358 VanDerWaalsContact C-N 3.3Å; P356-Q358 PolarHBondContact O-N 2.7Å
357	K	36.5	Very low	47.6	Very low	124 Å²	124	107.3 Å²	107.3	54%	0.539	61%	0.608	S	S	.	*			trans	-64.3	78.7	-175.6	-68.5	175.4	-179.4	168.1	0	112.2	Y359 D400	K357-Y359 WeakPolarHBondContact O-CD2 3.36Å; K357-Y359 PolarHBondContact O-N 2.99Å; K357-D400 IonicContact NZ-OD1 2.69Å; K357-D400 PolarHBondContact NZ-OD1 2.92Å; K357-D400 IonicContact NZ-OD2 3.46Å; K357-D400 PolarHBondContact NZ-OD2 3.46Å
358	Q	41.9	Very low	50.2	Low	168 Å²	168	99.5 Å²	99.5	79%	0.785	57%	0.567	S	S	*	*			trans	-72.1	102.2	179.4	-163.8	175.2	26.9	0	0	110.8	P356 Q360	P356-Q358 VanDerWaalsContact C-N 3.3Å; P356-Q358 PolarHBondContact O-N 2.7Å; Q358-Q360 PolarHBondContact O-N 3.05Å
359	Y	53.3	Low	53.2	Low	71 Å²	71	98 Å²	98	28%	0.278	55%	0.547	S	S	.	.			trans	-64.2	92.4	177.8	-63.5	-80.1	0	0	0	111.5	K357 M390 F392 L397 E399	K357-Y359 WeakPolarHBondContact O-CD2 3.36Å; K357-Y359 PolarHBondContact O-N 2.99Å; Y359-M390 HydrophobicContact CD1-CE 3.86Å; Y359-M390 HydrophobicContact CD1-SD 4.21Å; Y359-M390 HydrophobicContact CE1-CE 4.25Å; Y359-M390 HydrophobicContact CE1-SD 4.06Å; Y359-F392 HydrophobicContact CE1-CZ 4.21Å; Y359-F392 HydrophobicContact CE2-CE1 4.41Å; Y359-F392 HydrophobicContact CE2-CZ 4.18Å; Y359-F392 AromaticContact CZ-CZ 3.79Å; Y359-L397 WeakPolarHBondContact CE2-O 3.4Å; Y359-E399 PolarHBondContact OH-O 3.01Å
360	Q	45.8	Very low	55.9	Low	148 Å²	148	94 Å²	94	69%	0.692	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.4	147.7	-178.6	-63	-174.7	-3.8	0	0	112.5	Q358	Q358-Q360 PolarHBondContact O-N 3.05Å
361	N	60.4	Low	58.3	Low	90 Å²	90	90.1 Å²	90.1	48%	0.481	49%	0.486	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.4	46.5	173.9	-57.2	-73.6	0	0	0	115.4	S385 R386	N361-S385 VanDerWaalsContact O-CA 3.29Å; N361-S385 WeakPolarHBondContact O-CA 3.44Å; N361-S385 WeakPolarHBondContact O-CB 3.48Å; N361-R386 HydrophobicContact CB-CG 4.09Å; N361-R386 PolarHBondContact O-N 3.29Å
362	I	75.4	Confident	60.4	Low	83 Å²	83	86.1 Å²	86.1	43%	0.426	46%	0.46	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.6	133.5	162.8	-59.6	173.1	0	0	0	109.1	V383	I362-V383 HydrophobicContact CB-CG1 4.44Å; I362-V383 HydrophobicContact CD1-CG1 3.9Å; I362-V383 HydrophobicContact CG1-CG1 3.79Å; I362-V383 HydrophobicContact CG2-CG1 3.9Å
363	L	74.4	Confident	62.3	Low	85 Å²	85	87.7 Å²	87.7	45%	0.445	47%	0.469	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	-35.9	176.4	-64.4	179.6	0	0	0	112.4	L384 R386 A454	L363-L384 HydrophobicContact CB-CG 4.4Å; L363-L384 PolarHBondContact N-O 3.21Å; L363-R386 HydrophobicContact CD1-CG 3.96Å; L363-R386 HydrophobicContact CD2-CG 3.83Å; L363-R386 HydrophobicContact CG-CG 3.96Å; L363-A454 HydrophobicContact CD1-CB 3.81Å
364	K	79.1	Confident	63.7	Low	43 Å²	43	85.9 Å²	85.9	19%	0.187	46%	0.456	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.7	141	176	-164.3	173.5	-179.1	68.8	0	109.8	L384 E446 W447 A450	K364-L384 HydrophobicContact CB-CB 4.46Å; K364-L384 PolarHBondContact N-O 3.37Å; K364-L384 PolarHBondContact O-N 3.46Å; K364-E446 IonicContact NZ-OE2 3.06Å; K364-E446 PolarHBondContact NZ-OE2 3.03Å; K364-W447 HydrophobicContact CB-CH2 4.3Å; K364-W447 HydrophobicContact CB-CZ3 4.19Å; K364-W447 HydrophobicContact CD-CD2 3.73Å; K364-W447 HydrophobicContact CD-CE3 3.91Å; K364-W447 HydrophobicContact CD-CG 4.16Å; K364-W447 HydrophobicContact CD-CZ2 4.36Å; K364-W447 HydrophobicContact CD-CZ3 4.3Å; K364-W447 HydrophobicContact CG-CD2 4.33Å; K364-W447 HydrophobicContact CG-CE3 4.33Å; K364-W447 HydrophobicContact CG-CH2 4.09Å; K364-W447 HydrophobicContact CG-CZ2 4.07Å; K364-W447 HydrophobicContact CG-CZ3 4.22Å; K364-A450 HydrophobicContact CB-CB 4.46Å; K364-A450 HydrophobicContact CD-CB 3.87Å
365	S	82.1	Confident	65.7	Low	72 Å²	72	84.4 Å²	84.4	50%	0.503	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	160.9	172.1	56.1	0	0	0	0	110.7	F382	S365-F382 CarbonylContact C-O 3.55Å; S365-F382 VanDerWaalsContact CA-O 3.25Å; S365-F382 WeakPolarHBondContact CA-O 3.16Å
366	G	78.1	Confident	67.8	Low	25 Å²	25	84.1 Å²	84.1	26%	0.258	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	151.3	174.2	177.5	0	0	0	0	0	113.5	F382	G366-F382 PolarHBondContact N-O 3.42Å; G366-F382 PolarHBondContact O-N 3.32Å
367	T	83.1	Confident	70	Confident	55 Å²	55	82.5 Å²	82.5	34%	0.337	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	132.2	179.7	-52.4	0	0	0	0	111	A379 F380	T367-A379 HydrophobicContact CG2-CB 4.02Å; T367-F380 WeakPolarHBondContact CA-O 3.49Å
368	L	86	Confident	72.1	Confident	2 Å²	2	82.4 Å²	82.4	1%	0.01	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	149	163.7	-66.2	172.2	0	0	0	109.2	F380 F382 F425 L436 A438 W447	L368-F380 PolarHBondContact N-O 2.89Å; L368-F380 PolarHBondContact O-N 3.29Å; L368-F380 VanDerWaalsContact O-O 3.1Å; L368-F382 HydrophobicContact CB-CD2 3.68Å; L368-F382 HydrophobicContact CB-CE2 4.01Å; L368-F382 HydrophobicContact CD1-CB 4.28Å; L368-F382 HydrophobicContact CD1-CD2 4.16Å; L368-F382 HydrophobicContact CD1-CG 4.21Å; L368-F382 HydrophobicContact CG-CD2 4.32Å; L368-F425 HydrophobicContact CD1-CZ 3.94Å; L368-F425 HydrophobicContact CD2-CE1 4.28Å; L368-F425 HydrophobicContact CD2-CZ 4.34Å; L368-L436 HydrophobicContact CD1-CD1 4.1Å; L368-A438 HydrophobicContact CD2-CB 3.76Å; L368-W447 HydrophobicContact CD1-CD2 3.85Å; L368-W447 HydrophobicContact CD1-CE3 4.16Å; L368-W447 HydrophobicContact CD1-CG 4.12Å; L368-W447 HydrophobicContact CD1-CZ2 4.37Å; L368-W447 HydrophobicContact CD2-CG 4.22Å; L368-W447 HydrophobicContact CG-CD2 4.44Å; L368-W447 HydrophobicContact CG-CZ2 4.48Å
369	Y	86.1	Confident	74.1	Confident	87 Å²	87	75.8 Å²	75.8	34%	0.341	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	122.7	173.5	-57.5	-95.1	0	0	0	108.1	W377 K378 A379 L436 R437 E439	Y369-W377 VanDerWaalsContact O-CZ3 3.29Å; Y369-W377 WeakPolarHBondContact O-CZ3 3.43Å; Y369-K378 CarbonylContact C-O 3.59Å; Y369-K378 WeakPolarHBondContact CA-O 3.26Å; Y369-A379 HydrophobicContact CD1-CB 3.94Å; Y369-A379 HydrophobicContact CE1-CB 3.79Å; Y369-L436 CarbonylContact O-C 3.51Å; Y369-L436 VanDerWaalsContact O-CA 3.31Å; Y369-L436 WeakPolarHBondContact O-CA 3.45Å; Y369-R437 PolarHBondContact N-O 2.85Å; Y369-R437 PolarHBondContact O-N 3.31Å; Y369-E439 HydrophobicContact CE2-CG 4.38Å
370	R	86.3	Confident	75.5	Confident	40 Å²	40	73.5 Å²	73.5	15%	0.151	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	136.1	169.5	-176.5	-174.4	170.9	157	10.8	109	T372 K378 F380 L403 Y405 D432 L434 R435 L436	R370-T372 PolarHBondContact O-N 3.24Å; R370-K378 PolarHBondContact N-O 3.27Å; R370-K378 PolarHBondContact O-N 3.38Å; R370-F380 HydrophobicContact CB-CD2 3.9Å; R370-F380 HydrophobicContact CB-CE2 3.95Å; R370-L403 VanDerWaalsContact NH1-CD1 3.33Å; R370-Y405 PolarHBondContact NH1-OH 2.94Å; R370-D432 IonicContact CZ-OD2 3.7Å; R370-D432 IonicContact NH1-OD2 3.67Å; R370-D432 PolarHBondContact NH1-OD2 3.49Å; R370-D432 VanDerWaalsContact NH1-OD2 3.17Å; R370-D432 VanDerWaalsContact NH2-CG 3.27Å; R370-D432 IonicContact NH2-OD1 2.7Å; R370-D432 PolarHBondContact NH2-OD1 3.08Å; R370-D432 IonicContact NH2-OD2 3.57Å; R370-D432 PolarHBondContact NH2-OD2 3.32Å; R370-L434 VanDerWaalsContact NH1-CD2 3.27Å; R370-R435 WeakPolarHBondContact CA-O 3.13Å; R370-L436 HydrophobicContact CB-CD2 3.9Å; R370-L436 HydrophobicContact CG-CD2 4.12Å
371	L	81.3	Confident	77.2	Confident	27 Å²	27	67.5 Å²	67.5	14%	0.141	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	121.5	167	-168.6	70	0	0	0	109.2	W377 R435	L371-W377 HydrophobicContact CB-CD2 4.32Å; L371-W377 HydrophobicContact CB-CE3 4.04Å; L371-W377 HydrophobicContact CB-CH2 4.07Å; L371-W377 HydrophobicContact CB-CZ2 4.35Å; L371-W377 HydrophobicContact CB-CZ3 3.89Å; L371-W377 HydrophobicContact CD1-CD2 3.96Å; L371-W377 HydrophobicContact CD1-CG 4.18Å; L371-W377 HydrophobicContact CD1-CZ2 4.25Å; L371-R435 HydrophobicContact CB-CB 3.91Å; L371-R435 HydrophobicContact CD2-CB 4.45Å; L371-R435 PolarHBondContact N-O 3.2Å
372	T	73.5	Confident	78.5	Confident	39 Å²	39	63.2 Å²	63.2	24%	0.239	33%	0.334	C	S	.	.	P	Polyproline II helix	trans	-82.2	160.3	175.7	61.2	0	0	0	0	111.2	R370 Q374 N375 N376 K378	R370-T372 PolarHBondContact O-N 3.24Å; T372-Q374 PolarHBondContact O-N 3.07Å; T372-N375 WeakPolarHBondContact O-CA 3.48Å; T372-N375 PolarHBondContact O-N 3.32Å; T372-N376 WeakPolarHBondContact CB-O 3.37Å; T372-N376 WeakPolarHBondContact CG2-O 3.29Å; T372-N376 PolarHBondContact N-O 3.05Å; T372-N376 PolarHBondContact OG1-N 2.95Å; T372-N376 PolarHBondContact OG1-O 3.05Å; T372-K378 HydrophobicContact CG2-CB 3.93Å
373	V	65.3	Low	78.9	Confident	158 Å²	158	59.6 Å²	59.6	96%	0.958	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-14.8	173.9	-70.5	0	0	0	0	114.1	N375	V373-N375 PolarHBondContact O-N 3.38Å
374	Q	57.9	Low	79.4	Confident	126 Å²	126	55.6 Å²	55.6	59%	0.589	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.9	17	171.4	-61.4	-176.8	-2.5	0	0	112.8	T372 N376	T372-Q374 PolarHBondContact O-N 3.07Å; Q374-N376 PolarHBondContact O-N 3.03Å; Q374-N376 VanDerWaalsContact O-N 3.14Å; Q374-N376 PolarHBondContact O-ND2 3.49Å
375	N	69.1	Low	79.6	Confident	120 Å²	120	54.1 Å²	54.1	64%	0.642	29%	0.29	S	S	*	.	S	Bend	trans	54.1	25.2	-174.2	-154.2	44.4	0	0	0	115.3	T372 V373	T372-N375 WeakPolarHBondContact O-CA 3.48Å; T372-N375 PolarHBondContact O-N 3.32Å; V373-N375 PolarHBondContact O-N 3.38Å
376	N	73.8	Confident	79.3	Confident	92 Å²	92	58.4 Å²	58.4	49%	0.492	30%	0.295	S	S	.	.			trans	-109	134.6	178.8	-73.4	-76.8	0	0	0	110.7	T372 Q374	T372-N376 WeakPolarHBondContact CB-O 3.37Å; T372-N376 WeakPolarHBondContact CG2-O 3.29Å; T372-N376 PolarHBondContact N-O 3.05Å; T372-N376 PolarHBondContact OG1-N 2.95Å; T372-N376 PolarHBondContact OG1-O 3.05Å; Q374-N376 PolarHBondContact O-N 3.03Å; Q374-N376 VanDerWaalsContact O-N 3.14Å; Q374-N376 PolarHBondContact O-ND2 3.49Å
377	W	80.3	Confident	79.3	Confident	78 Å²	78	59 Å²	59	30%	0.295	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	125.7	173.1	-70.1	102.2	0	0	0	110.7	Y369 L371 R435 R437	Y369-W377 VanDerWaalsContact O-CZ3 3.29Å; Y369-W377 WeakPolarHBondContact O-CZ3 3.43Å; L371-W377 HydrophobicContact CB-CD2 4.32Å; L371-W377 HydrophobicContact CB-CE3 4.04Å; L371-W377 HydrophobicContact CB-CH2 4.07Å; L371-W377 HydrophobicContact CB-CZ2 4.35Å; L371-W377 HydrophobicContact CB-CZ3 3.89Å; L371-W377 HydrophobicContact CD1-CD2 3.96Å; L371-W377 HydrophobicContact CD1-CG 4.18Å; L371-W377 HydrophobicContact CD1-CZ2 4.25Å; W377-R435 HydrophobicContact CH2-CB 4.4Å; W377-R437 HydrophobicContact CD2-CB 4.39Å; W377-R437 HydrophobicContact CE3-CB 3.85Å; W377-R437 HydrophobicContact CH2-CB 3.72Å; W377-R437 HydrophobicContact CZ2-CB 4.26Å; W377-R437 HydrophobicContact CZ3-CB 3.49Å; W377-R437 VanDerWaalsContact CZ3-CB 3.49Å
378	K	82.2	Confident	79.3	Confident	121 Å²	121	61.2 Å²	61.2	53%	0.526	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	132.5	178.4	-177.3	174.1	179.4	178.8	0	111	Y369 R370 T372 F380	Y369-K378 CarbonylContact C-O 3.59Å; Y369-K378 WeakPolarHBondContact CA-O 3.26Å; R370-K378 PolarHBondContact N-O 3.27Å; R370-K378 PolarHBondContact O-N 3.38Å; T372-K378 HydrophobicContact CG2-CB 3.93Å; K378-F380 HydrophobicContact CB-CE2 3.94Å; K378-F380 HydrophobicContact CD-CE2 4.13Å; K378-F380 HydrophobicContact CD-CZ 3.89Å; K378-F380 HydrophobicContact CG-CE2 3.9Å; K378-F380 HydrophobicContact CG-CZ 4.14Å; K378-F380 VanDerWaalsContact O-CD2 3.23Å; K378-F380 WeakPolarHBondContact O-CD2 3.12Å
379	A	82.6	Confident	79.2	Confident	29 Å²	29	61.2 Å²	61.2	24%	0.24	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	136.7	178	0	0	0	0	0	112.3	T367 Y369 P394	T367-A379 HydrophobicContact CG2-CB 4.02Å; Y369-A379 HydrophobicContact CD1-CB 3.94Å; Y369-A379 HydrophobicContact CE1-CB 3.79Å; A379-P394 HydrophobicContact CB-CG 4.21Å; A379-P394 WeakPolarHBondContact O-CG 3.49Å
380	F	83.1	Confident	79.2	Confident	23 Å²	23	57.7 Å²	57.7	10%	0.101	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	147.9	169.8	-64.3	-90.9	0	0	0	109.2	T367 L368 R370 K378 F382 A391 F392 L402	T367-F380 WeakPolarHBondContact CA-O 3.49Å; L368-F380 PolarHBondContact N-O 2.89Å; L368-F380 PolarHBondContact O-N 3.29Å; L368-F380 VanDerWaalsContact O-O 3.1Å; R370-F380 HydrophobicContact CB-CD2 3.9Å; R370-F380 HydrophobicContact CB-CE2 3.95Å; K378-F380 HydrophobicContact CB-CE2 3.94Å; K378-F380 HydrophobicContact CD-CE2 4.13Å; K378-F380 HydrophobicContact CD-CZ 3.89Å; K378-F380 HydrophobicContact CG-CE2 3.9Å; K378-F380 HydrophobicContact CG-CZ 4.14Å; K378-F380 VanDerWaalsContact O-CD2 3.23Å; K378-F380 WeakPolarHBondContact O-CD2 3.12Å; F380-F382 HydrophobicContact CB-CD2 4.05Å; F380-F382 HydrophobicContact CB-CE2 3.77Å; F380-F382 PolarHBondContact O-N 3.19Å; F380-A391 HydrophobicContact CB-CB 4.47Å; F380-F392 WeakPolarHBondContact CA-O 3.44Å; F380-L402 HydrophobicContact CD1-CD1 4.08Å; F380-L402 HydrophobicContact CE1-CD1 3.89Å
381	T	82.5	Confident	79.1	Confident	23 Å²	23	55.8 Å²	55.8	14%	0.141	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	110.3	169.1	-59.2	0	0	0	0	107.9	F392 L397	T381-F392 PolarHBondContact N-O 2.72Å; T381-F392 PolarHBondContact O-N 3.31Å; T381-L397 HydrophobicContact CG2-CD2 4.1Å
382	F	85.7	Confident	79.1	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	143.3	174.2	-80.4	-98.1	0	0	0	110.6	S365 G366 L368 F380 L389 M390 A391 L434 L436 W447	S365-F382 CarbonylContact C-O 3.55Å; S365-F382 VanDerWaalsContact CA-O 3.25Å; S365-F382 WeakPolarHBondContact CA-O 3.16Å; G366-F382 PolarHBondContact N-O 3.42Å; G366-F382 PolarHBondContact O-N 3.32Å; L368-F382 HydrophobicContact CB-CD2 3.68Å; L368-F382 HydrophobicContact CB-CE2 4.01Å; L368-F382 HydrophobicContact CD1-CB 4.28Å; L368-F382 HydrophobicContact CD1-CD2 4.16Å; L368-F382 HydrophobicContact CD1-CG 4.21Å; L368-F382 HydrophobicContact CG-CD2 4.32Å; F380-F382 HydrophobicContact CB-CD2 4.05Å; F380-F382 HydrophobicContact CB-CE2 3.77Å; F380-F382 PolarHBondContact O-N 3.19Å; F382-L389 HydrophobicContact CB-CD1 4.46Å; F382-L389 HydrophobicContact CD1-CD1 3.81Å; F382-L389 HydrophobicContact CD1-CD2 4.35Å; F382-L389 HydrophobicContact CD1-CG 4.03Å; F382-L389 HydrophobicContact CE1-CD2 4.43Å; F382-L389 HydrophobicContact CE1-CG 4.46Å; F382-M390 CarbonylContact C-O 3.57Å; F382-M390 VanDerWaalsContact CA-O 3.3Å; F382-M390 WeakPolarHBondContact CA-O 3.38Å; F382-A391 HydrophobicContact CD1-CB 3.89Å; F382-A391 HydrophobicContact CD2-CB 4.45Å; F382-A391 HydrophobicContact CE1-CB 3.63Å; F382-A391 HydrophobicContact CE2-CB 4.23Å; F382-A391 HydrophobicContact CG-CB 4.33Å; F382-A391 HydrophobicContact CZ-CB 3.81Å; F382-L434 HydrophobicContact CE1-CD1 4.36Å; F382-L436 HydrophobicContact CE1-CD1 4.42Å; F382-L436 HydrophobicContact CE1-CD2 4.28Å; F382-L436 HydrophobicContact CE2-CD2 3.87Å; F382-L436 HydrophobicContact CZ-CD1 4.41Å; F382-L436 HydrophobicContact CZ-CD2 3.52Å; F382-W447 HydrophobicContact CB-CH2 3.93Å; F382-W447 HydrophobicContact CB-CZ3 4.36Å
383	V	84.9	Confident	79.2	Confident	7 Å²	7	57.6 Å²	57.6	4%	0.042	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	108.5	174.8	-176.7	0	0	0	0	107.8	I362 M390 F392 L397	I362-V383 HydrophobicContact CB-CG1 4.44Å; I362-V383 HydrophobicContact CD1-CG1 3.9Å; I362-V383 HydrophobicContact CG1-CG1 3.79Å; I362-V383 HydrophobicContact CG2-CG1 3.9Å; V383-M390 HydrophobicContact CB-CE 4.46Å; V383-M390 HydrophobicContact CG1-CE 4.26Å; V383-M390 PolarHBondContact N-O 3.03Å; V383-M390 PolarHBondContact O-N 3.04Å; V383-F392 HydrophobicContact CB-CD2 4.47Å; V383-F392 HydrophobicContact CB-CE2 3.98Å; V383-F392 HydrophobicContact CG2-CD2 3.86Å; V383-F392 HydrophobicContact CG2-CE2 3.69Å; V383-L397 HydrophobicContact CG2-CD2 4.03Å
384	L	84.1	Confident	79.4	Confident	0 Å²	0	53 Å²	53	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	119.3	170.7	177.7	61.2	0	0	0	108.9	L363 K364 L389 V407 W447 A450 L451 A454	L363-L384 HydrophobicContact CB-CG 4.4Å; L363-L384 PolarHBondContact N-O 3.21Å; K364-L384 HydrophobicContact CB-CB 4.46Å; K364-L384 PolarHBondContact N-O 3.37Å; K364-L384 PolarHBondContact O-N 3.46Å; L384-L389 HydrophobicContact CB-CD1 4.1Å; L384-L389 HydrophobicContact CD1-CB 4.23Å; L384-L389 HydrophobicContact CD1-CD1 4.33Å; L384-V407 HydrophobicContact CD1-CG1 4.41Å; L384-V407 HydrophobicContact CD1-CG2 3.79Å; L384-W447 HydrophobicContact CB-CZ3 4.01Å; L384-A450 HydrophobicContact CD2-CB 3.94Å; L384-L451 HydrophobicContact CD1-CD2 3.83Å; L384-L451 HydrophobicContact CD2-CD2 3.96Å; L384-L451 HydrophobicContact CD2-CG 4.16Å; L384-L451 HydrophobicContact CG-CD2 4.44Å; L384-A454 HydrophobicContact CD1-CB 4.11Å; L384-A454 HydrophobicContact CD2-CB 4.13Å; L384-A454 HydrophobicContact CG-CB 4.38Å
385	S	83.6	Confident	79.2	Confident	12 Å²	12	50.4 Å²	50.4	8%	0.084	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	176.5	166.7	66.6	0	0	0	0	110.5	N361 A387 Y388	N361-S385 VanDerWaalsContact O-CA 3.29Å; N361-S385 WeakPolarHBondContact O-CA 3.44Å; N361-S385 WeakPolarHBondContact O-CB 3.48Å; S385-A387 PolarHBondContact O-N 3.43Å; S385-A387 VanDerWaalsContact O-N 3.14Å; S385-Y388 PolarHBondContact N-O 3.43Å; S385-Y388 WeakPolarHBondContact OG-CA 3.24Å; S385-Y388 PolarHBondContact OG-N 2.87Å; S385-Y388 PolarHBondContact OG-O 2.9Å
386	R	76.6	Confident	78.7	Confident	162 Å²	162	49.4 Å²	49.4	61%	0.611	26%	0.256	S	S	*	.	S	Bend	trans	-59.5	-20.2	176.1	-70.5	-177.2	-177.8	-167.7	1	115.1	N361 L363	N361-R386 HydrophobicContact CB-CG 4.09Å; N361-R386 PolarHBondContact O-N 3.29Å; L363-R386 HydrophobicContact CD1-CG 3.96Å; L363-R386 HydrophobicContact CD2-CG 3.83Å; L363-R386 HydrophobicContact CG-CG 3.96Å
387	A	77	Confident	77.8	Confident	39 Å²	39	47.8 Å²	47.8	32%	0.322	25%	0.247	S	C	.	.	S	Bend	trans	-123.7	-33.3	-178.2	0	0	0	0	0	113.6	S385 N406 V407	S385-A387 PolarHBondContact O-N 3.43Å; S385-A387 VanDerWaalsContact O-N 3.14Å; A387-N406 PolarHBondContact O-OD1 2.73Å; A387-V407 WeakPolarHBondContact O-CG2 3.49Å; A387-V407 PolarHBondContact O-N 3.22Å
388	Y	83.5	Confident	76.6	Confident	100 Å²	100	51.1 Å²	51.1	39%	0.392	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	134.5	-174.2	-62.1	-82.5	0	0	0	112.8	S385 Y405 N406	S385-Y388 PolarHBondContact N-O 3.43Å; S385-Y388 WeakPolarHBondContact OG-CA 3.24Å; S385-Y388 PolarHBondContact OG-N 2.87Å; S385-Y388 PolarHBondContact OG-O 2.9Å; Y388-Y405 CarbonylContact C-O 3.55Å; Y388-Y405 VanDerWaalsContact CA-O 3.31Å; Y388-Y405 WeakPolarHBondContact CA-O 3.43Å; Y388-N406 HydrophobicContact CD1-CB 4.19Å; Y388-N406 HydrophobicContact CE1-CB 3.96Å
389	L	85.1	Confident	75.5	Confident	2 Å²	2	50.4 Å²	50.4	1%	0.01	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	110.8	160.7	177.1	65.8	0	0	0	107.8	F382 L384 Y405 V407 F429 L434 L451	F382-L389 HydrophobicContact CB-CD1 4.46Å; F382-L389 HydrophobicContact CD1-CD1 3.81Å; F382-L389 HydrophobicContact CD1-CD2 4.35Å; F382-L389 HydrophobicContact CD1-CG 4.03Å; F382-L389 HydrophobicContact CE1-CD2 4.43Å; F382-L389 HydrophobicContact CE1-CG 4.46Å; L384-L389 HydrophobicContact CB-CD1 4.1Å; L384-L389 HydrophobicContact CD1-CB 4.23Å; L384-L389 HydrophobicContact CD1-CD1 4.33Å; L389-Y405 PolarHBondContact N-O 2.69Å; L389-Y405 PolarHBondContact O-N 2.96Å; L389-V407 HydrophobicContact CB-CG2 4.05Å; L389-V407 VanDerWaalsContact N-CG2 3.33Å; L389-F429 HydrophobicContact CD2-CZ 4.35Å; L389-L434 HydrophobicContact CD2-CD1 4.09Å; L389-L451 HydrophobicContact CB-CD2 4.49Å; L389-L451 HydrophobicContact CD1-CD2 4.09Å; L389-L451 HydrophobicContact CD2-CD2 3.85Å; L389-L451 HydrophobicContact CG-CD2 4.36Å
390	M	86.1	Confident	74.5	Confident	14 Å²	14	54 Å²	54	7%	0.069	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	147.9	-178.8	-64.6	175.6	-66.8	0	0	110.3	Y359 F382 V383 F392 P401 L403	Y359-M390 HydrophobicContact CD1-CE 3.86Å; Y359-M390 HydrophobicContact CD1-SD 4.21Å; Y359-M390 HydrophobicContact CE1-CE 4.25Å; Y359-M390 HydrophobicContact CE1-SD 4.06Å; F382-M390 CarbonylContact C-O 3.57Å; F382-M390 VanDerWaalsContact CA-O 3.3Å; F382-M390 WeakPolarHBondContact CA-O 3.38Å; V383-M390 HydrophobicContact CB-CE 4.46Å; V383-M390 HydrophobicContact CG1-CE 4.26Å; V383-M390 PolarHBondContact N-O 3.03Å; V383-M390 PolarHBondContact O-N 3.04Å; M390-F392 HydrophobicContact CB-CD2 4.37Å; M390-F392 HydrophobicContact CB-CE2 3.61Å; M390-F392 HydrophobicContact CB-CZ 4.16Å; M390-F392 HydrophobicContact SD-CZ 4.37Å; M390-P401 HydrophobicContact CB-CB 3.92Å; M390-P401 HydrophobicContact CB-CG 4.49Å; M390-P401 HydrophobicContact CG-CB 4.21Å; M390-P401 HydrophobicContact CG-CG 4.25Å; M390-P401 HydrophobicContact SD-CB 4.48Å; M390-P401 HydrophobicContact SD-CG 4.09Å; M390-L403 CarbonylContact C-O 3.56Å; M390-L403 WeakPolarHBondContact CA-O 3.14Å
391	A	83.7	Confident	74.1	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	130.3	173.5	0	0	0	0	0	110.3	F380 F382 P401 L402 L403	F380-A391 HydrophobicContact CB-CB 4.47Å; F382-A391 HydrophobicContact CD1-CB 3.89Å; F382-A391 HydrophobicContact CD2-CB 4.45Å; F382-A391 HydrophobicContact CE1-CB 3.63Å; F382-A391 HydrophobicContact CE2-CB 4.23Å; F382-A391 HydrophobicContact CG-CB 4.33Å; F382-A391 HydrophobicContact CZ-CB 3.81Å; A391-P401 CarbonylContact O-C 3.58Å; A391-L402 WeakPolarHBondContact O-CB 3.49Å; A391-L402 PolarHBondContact O-N 2.83Å; A391-L403 HydrophobicContact CB-CB 4.06Å; A391-L403 HydrophobicContact CB-CD1 4.14Å; A391-L403 HydrophobicContact CB-CG 4.45Å; A391-L403 PolarHBondContact N-O 2.84Å; A391-L403 PolarHBondContact O-N 3.01Å
392	F	81	Confident	73.7	Confident	3 Å²	3	58.2 Å²	58.2	1%	0.013	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	160.1	-177.8	-62.9	-95.1	0	0	0	110.6	Y359 F380 T381 V383 M390 K396 L397 E399 P401	Y359-F392 HydrophobicContact CE1-CZ 4.21Å; Y359-F392 HydrophobicContact CE2-CE1 4.41Å; Y359-F392 HydrophobicContact CE2-CZ 4.18Å; Y359-F392 AromaticContact CZ-CZ 3.79Å; F380-F392 WeakPolarHBondContact CA-O 3.44Å; T381-F392 PolarHBondContact N-O 2.72Å; T381-F392 PolarHBondContact O-N 3.31Å; V383-F392 HydrophobicContact CB-CD2 4.47Å; V383-F392 HydrophobicContact CB-CE2 3.98Å; V383-F392 HydrophobicContact CG2-CD2 3.86Å; V383-F392 HydrophobicContact CG2-CE2 3.69Å; M390-F392 HydrophobicContact CB-CD2 4.37Å; M390-F392 HydrophobicContact CB-CE2 3.61Å; M390-F392 HydrophobicContact CB-CZ 4.16Å; M390-F392 HydrophobicContact SD-CZ 4.37Å; F392-K396 WeakPolarHBondContact CB-O 3.48Å; F392-L397 HydrophobicContact CB-CD2 4.05Å; F392-L397 HydrophobicContact CD1-CD2 4.17Å; F392-L397 HydrophobicContact CD2-CD2 3.71Å; F392-L397 HydrophobicContact CE2-CD2 4.13Å; F392-L397 HydrophobicContact CG-CD2 3.72Å; F392-E399 WeakPolarHBondContact CE1-O 3.49Å; F392-P401 HydrophobicContact CD1-CB 4.19Å; F392-P401 HydrophobicContact CE1-CB 3.73Å; F392-P401 HydrophobicContact CE1-CG 4.38Å; F392-P401 HydrophobicContact CE2-CB 4.18Å; F392-P401 HydrophobicContact CZ-CB 3.73Å; F392-P401 HydrophobicContact CZ-CG 4.32Å
393	Q	75.5	Confident	73.2	Confident	101 Å²	101	60.5 Å²	60.5	47%	0.472	32%	0.32	S	S	.	.			trans	-65.1	139	166.6	-171.6	173	2.9	0	0	108.8	G395 K396 L402	Q393-G395 PolarHBondContact O-N 3.4Å; Q393-K396 HydrophobicContact CB-CB 4.36Å; Q393-K396 PolarHBondContact O-N 2.87Å; Q393-L402 HydrophobicContact CB-CD1 4.13Å
394	P	68.6	Low	73.2	Confident	62 Å²	62	63.2 Å²	63.2	40%	0.403	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.2	128.5	173.7	-27.9	36.7	0	0	0	111.3	A379	A379-P394 HydrophobicContact CB-CG 4.21Å; A379-P394 WeakPolarHBondContact O-CG 3.49Å
395	G	54.4	Low	73.1	Confident	70 Å²	70	64.8 Å²	64.8	72%	0.722	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.3	2.6	-178.5	0	0	0	0	0	116.6	Q393	Q393-G395 PolarHBondContact O-N 3.4Å
396	K	57.6	Low	73	Confident	100 Å²	100	66.5 Å²	66.5	44%	0.435	35%	0.354	S	S	.	.			trans	-128.9	92.4	-179.5	-61.7	-167.8	176.5	-168.7	0	113	F392 Q393 E399	F392-K396 WeakPolarHBondContact CB-O 3.48Å; Q393-K396 HydrophobicContact CB-CB 4.36Å; Q393-K396 PolarHBondContact O-N 2.87Å; K396-E399 HydrophobicContact CB-CG 4.17Å; K396-E399 HydrophobicContact CD-CG 4.21Å
397	L	56.8	Low	73.4	Confident	58 Å²	58	58.9 Å²	58.9	30%	0.304	33%	0.325	S	S	.	.			trans	-101.5	-18.8	178.7	-70.4	172.6	0	0	0	114.3	Y359 T381 V383 F392 E399	Y359-L397 WeakPolarHBondContact CE2-O 3.4Å; T381-L397 HydrophobicContact CG2-CD2 4.1Å; V383-L397 HydrophobicContact CG2-CD2 4.03Å; F392-L397 HydrophobicContact CB-CD2 4.05Å; F392-L397 HydrophobicContact CD1-CD2 4.17Å; F392-L397 HydrophobicContact CD2-CD2 3.71Å; F392-L397 HydrophobicContact CE2-CD2 4.13Å; F392-L397 HydrophobicContact CG-CD2 3.72Å; L397-E399 VanDerWaalsContact C-N 3.32Å
398	D	53.2	Low	73.5	Confident	148 Å²	148	59.7 Å²	59.7	79%	0.791	32%	0.324	S	S	*	.	S	Bend	trans	-79.6	-15.1	177.4	-59.3	-58.7	0	0	0	113.5
399	E	60.8	Low	73.4	Confident	105 Å²	105	58.2 Å²	58.2	49%	0.491	33%	0.325	S	S	.	.	S	Bend	trans	-74.1	159.7	171.1	-67.2	-74	-178.3	0	0	111.4	Y359 F392 K396 L397	Y359-E399 PolarHBondContact OH-O 3.01Å; F392-E399 WeakPolarHBondContact CE1-O 3.49Å; K396-E399 HydrophobicContact CB-CG 4.17Å; K396-E399 HydrophobicContact CD-CG 4.21Å; L397-E399 VanDerWaalsContact C-N 3.32Å
400	D	60.6	Low	73.4	Confident	104 Å²	104	58.2 Å²	58.2	56%	0.556	33%	0.325	S	S	*	.	P	Polyproline II helix	trans	-68.2	142.4	171.1	-82.6	-50	0	0	0	111.4	K357 L402	K357-D400 IonicContact NZ-OD1 2.69Å; K357-D400 PolarHBondContact NZ-OD1 2.92Å; K357-D400 IonicContact NZ-OD2 3.46Å; K357-D400 PolarHBondContact NZ-OD2 3.46Å; D400-L402 PolarHBondContact O-N 2.84Å
401	P	74.1	Confident	73.1	Confident	33 Å²	33	63 Å²	63	21%	0.214	35%	0.35	C	S	.	.	P	Polyproline II helix	trans	-64.8	126.9	-173.6	24.4	-34.1	0	0	0	112.3	M390 A391 F392 L403	M390-P401 HydrophobicContact CB-CB 3.92Å; M390-P401 HydrophobicContact CB-CG 4.49Å; M390-P401 HydrophobicContact CG-CB 4.21Å; M390-P401 HydrophobicContact CG-CG 4.25Å; M390-P401 HydrophobicContact SD-CB 4.48Å; M390-P401 HydrophobicContact SD-CG 4.09Å; A391-P401 CarbonylContact O-C 3.58Å; F392-P401 HydrophobicContact CD1-CB 4.19Å; F392-P401 HydrophobicContact CE1-CB 3.73Å; F392-P401 HydrophobicContact CE1-CG 4.38Å; F392-P401 HydrophobicContact CE2-CB 4.18Å; F392-P401 HydrophobicContact CZ-CB 3.73Å; F392-P401 HydrophobicContact CZ-CG 4.32Å; P401-L403 PolarHBondContact O-N 2.79Å; P401-L403 VanDerWaalsContact O-N 3.14Å
402	L	74.6	Confident	73	Confident	103 Å²	103	64.3 Å²	64.3	54%	0.539	36%	0.362	S	S	.	.	S	Bend	trans	-55.1	-32.6	178.4	-62.3	178.6	0	0	0	112.7	F380 A391 Q393 D400	F380-L402 HydrophobicContact CD1-CD1 4.08Å; F380-L402 HydrophobicContact CE1-CD1 3.89Å; A391-L402 WeakPolarHBondContact O-CB 3.49Å; A391-L402 PolarHBondContact O-N 2.83Å; Q393-L402 HydrophobicContact CB-CD1 4.13Å; D400-L402 PolarHBondContact O-N 2.84Å
403	L	76.3	Confident	73.4	Confident	47 Å²	47	65 Å²	65	25%	0.246	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	140.5	174.4	-52	164.5	0	0	0	108.8	R370 M390 A391 P401 Y405	R370-L403 VanDerWaalsContact NH1-CD1 3.33Å; M390-L403 CarbonylContact C-O 3.56Å; M390-L403 WeakPolarHBondContact CA-O 3.14Å; A391-L403 HydrophobicContact CB-CB 4.06Å; A391-L403 HydrophobicContact CB-CD1 4.14Å; A391-L403 HydrophobicContact CB-CG 4.45Å; A391-L403 PolarHBondContact N-O 2.84Å; A391-L403 PolarHBondContact O-N 3.01Å; P401-L403 PolarHBondContact O-N 2.79Å; P401-L403 VanDerWaalsContact O-N 3.14Å; L403-Y405 HydrophobicContact CB-CD2 4.43Å; L403-Y405 HydrophobicContact CB-CE2 3.56Å; L403-Y405 HydrophobicContact CD1-CE2 4.23Å; L403-Y405 HydrophobicContact CG-CE2 4.4Å
404	S	83.4	Confident	73.8	Confident	64 Å²	64	65.4 Å²	65.4	45%	0.448	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	116.4	174.3	-176.8	0	0	0	0	110.5
405	Y	82	Confident	74.4	Confident	34 Å²	34	65.6 Å²	65.6	13%	0.133	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	131	-179.1	-56.1	-89.8	0	0	0	109.1	R370 Y388 L389 L403 F429 D432 L434	R370-Y405 PolarHBondContact NH1-OH 2.94Å; Y388-Y405 CarbonylContact C-O 3.55Å; Y388-Y405 VanDerWaalsContact CA-O 3.31Å; Y388-Y405 WeakPolarHBondContact CA-O 3.43Å; L389-Y405 PolarHBondContact N-O 2.69Å; L389-Y405 PolarHBondContact O-N 2.96Å; L403-Y405 HydrophobicContact CB-CD2 4.43Å; L403-Y405 HydrophobicContact CB-CE2 3.56Å; L403-Y405 HydrophobicContact CD1-CE2 4.23Å; L403-Y405 HydrophobicContact CG-CE2 4.4Å; Y405-F429 AromaticContact CD1-CD2 3.73Å; Y405-F429 HydrophobicContact CD1-CD2 3.73Å; Y405-F429 AromaticContact CD1-CE2 3.91Å; Y405-F429 HydrophobicContact CD1-CE2 3.91Å; Y405-F429 HydrophobicContact CD1-CG 4.09Å; Y405-F429 HydrophobicContact CD1-CZ 4.43Å; Y405-F429 HydrophobicContact CD2-CE2 4.46Å; Y405-F429 HydrophobicContact CE1-CD2 4.34Å; Y405-F429 HydrophobicContact CG-CD2 4.12Å; Y405-F429 AromaticContact CG-CE2 3.81Å; Y405-F429 HydrophobicContact CG-CE2 3.81Å; Y405-F429 HydrophobicContact CG-CZ 4.04Å; Y405-D432 HydrophobicContact CE1-CB 3.98Å; Y405-D432 PolarHBondContact OH-OD2 3.06Å; Y405-L434 HydrophobicContact CD2-CD1 3.94Å; Y405-L434 HydrophobicContact CE1-CD2 4.34Å; Y405-L434 HydrophobicContact CE2-CD1 3.73Å; Y405-L434 HydrophobicContact CE2-CD2 4.04Å; Y405-L434 HydrophobicContact CE2-CG 4.39Å; Y405-L434 WeakPolarHBondContact OH-CD2 3.26Å
406	N	82.1	Confident	75.5	Confident	48 Å²	48	62.8 Å²	62.8	26%	0.257	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	134.8	171.2	-166.7	-2.5	0	0	0	109	A387 Y388 D408 V409 F429	A387-N406 PolarHBondContact O-OD1 2.73Å; Y388-N406 HydrophobicContact CD1-CB 4.19Å; Y388-N406 HydrophobicContact CE1-CB 3.96Å; N406-D408 WeakPolarHBondContact CB-OD1 3.43Å; N406-D408 PolarHBondContact ND2-OD1 3.47Å; N406-D408 PolarHBondContact ND2-OD2 2.95Å; N406-D408 VanDerWaalsContact OD1-CG 3.28Å; N406-D408 PolarHBondContact OD1-OD1 3.06Å; N406-D408 PolarHBondContact OD1-OD2 3.37Å; N406-V409 HydrophobicContact CB-CG2 4.33Å; N406-V409 VanDerWaalsContact O-CG2 3.32Å; N406-V409 WeakPolarHBondContact O-CG2 3.36Å; N406-F429 WeakPolarHBondContact O-CE1 3.43Å
407	V	84.9	Confident	75.8	Confident	1 Å²	1	64.6 Å²	64.6	1%	0.006	35%	0.347	C	S	.	.	S	Bend	trans	-86.8	-16.7	-168.8	-173	0	0	0	0	111.4	L384 A387 L389 C410 A454 A455	L384-V407 HydrophobicContact CD1-CG1 4.41Å; L384-V407 HydrophobicContact CD1-CG2 3.79Å; A387-V407 WeakPolarHBondContact O-CG2 3.49Å; A387-V407 PolarHBondContact O-N 3.22Å; L389-V407 HydrophobicContact CB-CG2 4.05Å; L389-V407 VanDerWaalsContact N-CG2 3.33Å; V407-C410 WeakPolarHBondContact O-CB 3.48Å; V407-C410 PolarHBondContact O-N 2.9Å; V407-A454 HydrophobicContact CG1-CB 3.86Å; V407-A455 HydrophobicContact CG1-CB 3.88Å; V407-A455 WeakPolarHBondContact O-CB 3.42Å
408	D	79.6	Confident	75.7	Confident	56 Å²	56	66.1 Å²	66.1	30%	0.299	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59	-46.5	172.6	54.8	12.2	0	0	0	112.9	N406 C410 A458 R459	N406-D408 WeakPolarHBondContact CB-OD1 3.43Å; N406-D408 PolarHBondContact ND2-OD1 3.47Å; N406-D408 PolarHBondContact ND2-OD2 2.95Å; N406-D408 VanDerWaalsContact OD1-CG 3.28Å; N406-D408 PolarHBondContact OD1-OD1 3.06Å; N406-D408 PolarHBondContact OD1-OD2 3.37Å; D408-C410 VanDerWaalsContact C-N 3.25Å; D408-C410 PolarHBondContact O-N 3.28Å; D408-A458 HydrophobicContact CB-CB 4.17Å; D408-R459 PolarHBondContact O-NH1 3.41Å
409	V	81.6	Confident	75.7	Confident	69 Å²	69	65.1 Å²	65.1	42%	0.418	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.7	8.3	178.1	-65.6	0	0	0	0	113.7	N406 L411 F429 P430	N406-V409 HydrophobicContact CB-CG2 4.33Å; N406-V409 VanDerWaalsContact O-CG2 3.32Å; N406-V409 WeakPolarHBondContact O-CG2 3.36Å; V409-L411 PolarHBondContact O-N 3.28Å; V409-F429 HydrophobicContact CG2-CD1 4.4Å; V409-P430 HydrophobicContact CB-CG 4.16Å; V409-P430 WeakPolarHBondContact O-CD 3.25Å
410	C	84.5	Confident	75.5	Confident	2 Å²	2	63.6 Å²	63.6	1%	0.014	36%	0.362	C	S	.	.			trans	-64.7	106.8	170.2	-177.4	0	0	0	0	109.5	V407 D408 F429 A455 R459	V407-C410 WeakPolarHBondContact O-CB 3.48Å; V407-C410 PolarHBondContact O-N 2.9Å; D408-C410 VanDerWaalsContact C-N 3.25Å; D408-C410 PolarHBondContact O-N 3.28Å; C410-F429 HydrophobicContact CB-CD1 4.3Å; C410-F429 HydrophobicContact CB-CE1 3.77Å; C410-F429 HydrophobicContact CB-CZ 4.47Å; C410-A455 HydrophobicContact CB-CB 3.97Å; C410-R459 PolarHBondContact O-NH1 3.45Å
411	L	80.4	Confident	75.5	Confident	114 Å²	114	60.5 Å²	60.5	60%	0.597	35%	0.348	S	S	*	.			trans	-75.7	-43.3	-172.3	-60.8	179	0	0	0	111.6	V409 I428 P430	V409-L411 PolarHBondContact O-N 3.28Å; L411-I428 HydrophobicContact CB-CG2 4.28Å; L411-I428 WeakPolarHBondContact CB-O 3.32Å; L411-I428 HydrophobicContact CD1-CG2 4.3Å; L411-I428 PolarHBondContact N-O 3.17Å; L411-P430 HydrophobicContact CD1-CB 4.49Å; L411-P430 HydrophobicContact CD1-CG 4.11Å; L411-P430 HydrophobicContact CD2-CG 4.31Å; L411-P430 HydrophobicContact CG-CG 4.2Å
412	A	81.9	Confident	75.1	Confident	29 Å²	29	62.2 Å²	62.2	24%	0.24	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.3	155.5	177.6	0	0	0	0	0	112.1	Q414 I428	A412-Q414 HydrophobicContact CB-CG 4.19Å; A412-I428 HydrophobicContact CB-CB 4.48Å; A412-I428 HydrophobicContact CB-CD1 4.33Å; A412-I428 PolarHBondContact O-N 3.06Å
413	V	87.9	Confident	75.3	Confident	17 Å²	17	57.6 Å²	57.6	10%	0.103	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	118.3	168.7	-175.2	0	0	0	0	107.7	F425 Q426 V427 M448 L451 K452	V413-F425 HydrophobicContact CG1-CD2 4.43Å; V413-Q426 WeakPolarHBondContact CA-O 3.26Å; V413-V427 HydrophobicContact CG1-CG2 4.49Å; V413-V427 HydrophobicContact CG2-CG1 4.29Å; V413-M448 HydrophobicContact CG1-CB 3.82Å; V413-M448 HydrophobicContact CG1-CG 3.62Å; V413-M448 HydrophobicContact CG1-SD 4.35Å; V413-L451 HydrophobicContact CG2-CB 4.01Å; V413-K452 HydrophobicContact CB-CG 3.98Å; V413-K452 HydrophobicContact CG2-CG 4.19Å
414	Q	84.9	Confident	75.8	Confident	110 Å²	110	55.6 Å²	55.6	51%	0.514	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	153.9	-170.5	-54.6	-172.9	28.6	0	0	110.6	A412 F425 Q426	A412-Q414 HydrophobicContact CB-CG 4.19Å; Q414-F425 CarbonylContact O-C 3.53Å; Q414-F425 WeakPolarHBondContact O-CA 3.36Å; Q414-F425 WeakPolarHBondContact O-CB 3.5Å; Q414-Q426 PolarHBondContact N-O 3.2Å; Q414-Q426 PolarHBondContact O-N 2.92Å
415	M	80.4	Confident	76	Confident	65 Å²	65	52.6 Å²	52.6	32%	0.32	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	148	170.4	-72	-167.7	72.5	0	0	110.7	D422 M448	M415-D422 VanDerWaalsContact CE-O 3.25Å; M415-D422 WeakPolarHBondContact CE-O 3.44Å; M415-M448 HydrophobicContact CG-CE 3.68Å; M415-M448 HydrophobicContact CG-SD 3.88Å; M415-M448 HydrophobicContact SD-CE 4.33Å
416	D	77.4	Confident	76.4	Confident	12 Å²	12	52.7 Å²	52.7	6%	0.064	30%	0.302	C	S	.	.			trans	-107.6	116.4	174.6	-157.1	-14.9	0	0	0	109.1	L418 C424 Q426 R435	D416-L418 WeakPolarHBondContact OD1-CD1 3.41Å; D416-L418 PolarHBondContact OD1-N 3.14Å; D416-C424 HydrophobicContact CB-CB 3.96Å; D416-C424 PolarHBondContact N-O 3.43Å; D416-Q426 HydrophobicContact CB-CG 3.85Å; D416-Q426 PolarHBondContact OD1-NE2 2.91Å; D416-Q426 WeakPolarHBondContact OD2-CG 3.32Å; D416-Q426 PolarHBondContact OD2-NE2 3.19Å; D416-R435 WeakPolarHBondContact OD2-CD 3.23Å; D416-R435 IonicContact OD2-NE 2.75Å; D416-R435 PolarHBondContact OD2-NE 3.21Å
417	N	64.1	Low	76.7	Confident	137 Å²	137	50.4 Å²	50.4	73%	0.733	29%	0.29	S	S	*	.			trans	-93.6	4.5	-176.3	-72.6	-5.6	0	0	0	113.1
418	L	56	Low	76.6	Confident	91 Å²	91	52.4 Å²	52.4	48%	0.476	30%	0.3	S	S	.	.	G	3₁₀ helix	trans	-61.9	148.5	169.5	-85.6	132.3	0	0	0	111.2	D416 G420	D416-L418 WeakPolarHBondContact OD1-CD1 3.41Å; D416-L418 PolarHBondContact OD1-N 3.14Å; L418-G420 PolarHBondContact O-N 2.94Å
419	D	53	Low	77	Confident	126 Å²	126	50.3 Å²	50.3	67%	0.674	29%	0.289	S	S	*	.	G	3₁₀ helix	trans	57.3	10.3	-179.5	-51.4	-23.5	0	0	0	116.5	C421	D419-C421 PolarHBondContact O-N 2.95Å
420	G	55.3	Low	76.6	Confident	73 Å²	73	50.9 Å²	50.9	75%	0.753	29%	0.294	S	S	*	.	G	3₁₀ helix	trans	65.2	5.9	177.4	0	0	0	0	0	115.4	L418 D422	L418-G420 PolarHBondContact O-N 2.94Å; G420-D422 PolarHBondContact O-N 2.82Å
421	C	61.1	Low	76	Confident	40 Å²	40	60.1 Å²	60.1	27%	0.27	34%	0.337	S	S	.	.			trans	-88.7	104.7	-178.7	-74.1	0	0	0	0	111	D419 S423 C424	D419-C421 PolarHBondContact O-N 2.95Å; C421-S423 PolarHBondContact O-N 2.91Å; C421-C424 WeakPolarHBondContact O-CB 3.45Å; C421-C424 PolarHBondContact O-N 3.34Å; C421-C424 PolarHBondContact O-SG 2.68Å
422	D	66.2	Low	75.9	Confident	68 Å²	68	57 Å²	57	36%	0.364	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-1.6	-176.4	72.2	-8.7	0	0	0	116	M415 G420 R441	M415-D422 VanDerWaalsContact CE-O 3.25Å; M415-D422 WeakPolarHBondContact CE-O 3.44Å; G420-D422 PolarHBondContact O-N 2.82Å; D422-R441 HydrophobicContact CB-CG 4.11Å; D422-R441 WeakPolarHBondContact OD2-CD 3.43Å; D422-R441 WeakPolarHBondContact OD2-CG 3.4Å; D422-R441 IonicContact OD2-CZ 3.46Å; D422-R441 IonicContact OD2-NE 2.64Å; D422-R441 IonicContact OD2-NH1 2.86Å; D422-R441 PolarHBondContact OD2-NH1 2.93Å
423	S	79.3	Confident	76.1	Confident	7 Å²	7	58.7 Å²	58.7	5%	0.049	33%	0.328	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.4	8	172.1	79.9	0	0	0	0	114.6	C421 R437 A438 A444	C421-S423 PolarHBondContact O-N 2.91Å; S423-R437 WeakPolarHBondContact O-CA 3.43Å; S423-R437 WeakPolarHBondContact OG-CG 3.35Å; S423-R437 PolarHBondContact OG-NE 3.33Å; S423-A438 WeakPolarHBondContact CB-O 3.3Å; S423-A438 PolarHBondContact O-N 3.35Å; S423-A438 PolarHBondContact OG-O 2.94Å; S423-A444 WeakPolarHBondContact O-CB 3.46Å
424	C	85.6	Confident	76	Confident	4 Å²	4	57.9 Å²	57.9	3%	0.027	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	141.5	179.1	-53.7	0	0	0	0	112.6	D416 C421 L436	D416-C424 HydrophobicContact CB-CB 3.96Å; D416-C424 PolarHBondContact N-O 3.43Å; C421-C424 WeakPolarHBondContact O-CB 3.45Å; C421-C424 PolarHBondContact O-N 3.34Å; C421-C424 PolarHBondContact O-SG 2.68Å; C424-L436 WeakPolarHBondContact CA-O 3.17Å
425	F	88.5	Confident	76.1	Confident	1 Å²	1	56.9 Å²	56.9	0%	0.004	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	156.3	178.8	65.1	-81.6	0	0	0	112.5	L368 V413 Q414 V427 L436 A444 W447 M448 L451	L368-F425 HydrophobicContact CD1-CZ 3.94Å; L368-F425 HydrophobicContact CD2-CE1 4.28Å; L368-F425 HydrophobicContact CD2-CZ 4.34Å; V413-F425 HydrophobicContact CG1-CD2 4.43Å; Q414-F425 CarbonylContact O-C 3.53Å; Q414-F425 WeakPolarHBondContact O-CA 3.36Å; Q414-F425 WeakPolarHBondContact O-CB 3.5Å; F425-V427 HydrophobicContact CD2-CG2 4.07Å; F425-V427 HydrophobicContact CE2-CG2 3.95Å; F425-L436 HydrophobicContact CD1-CB 4.35Å; F425-L436 WeakPolarHBondContact CD1-O 3.22Å; F425-L436 HydrophobicContact CD2-CB 4.31Å; F425-L436 HydrophobicContact CE1-CB 3.94Å; F425-L436 HydrophobicContact CE2-CB 3.91Å; F425-L436 HydrophobicContact CE2-CD1 3.87Å; F425-L436 HydrophobicContact CE2-CG 4.45Å; F425-L436 HydrophobicContact CZ-CB 3.71Å; F425-L436 HydrophobicContact CZ-CD1 4.07Å; F425-L436 PolarHBondContact N-O 2.88Å; F425-L436 PolarHBondContact O-N 3.29Å; F425-L436 VanDerWaalsContact O-O 3.07Å; F425-A444 HydrophobicContact CD1-CB 3.95Å; F425-A444 HydrophobicContact CE1-CB 4.25Å; F425-W447 HydrophobicContact CE1-CB 4.36Å; F425-W447 HydrophobicContact CE2-CB 4.44Å; F425-W447 HydrophobicContact CZ-CB 3.79Å; F425-M448 HydrophobicContact CB-CG 3.82Å; F425-M448 HydrophobicContact CB-SD 3.53Å; F425-M448 VanDerWaalsContact CB-SD 3.53Å; F425-M448 HydrophobicContact CD1-CG 4.41Å; F425-M448 HydrophobicContact CD2-CG 3.65Å; F425-M448 HydrophobicContact CD2-SD 4.48Å; F425-M448 HydrophobicContact CE2-CG 4.25Å; F425-M448 HydrophobicContact CG-CG 3.73Å; F425-M448 HydrophobicContact CG-SD 4.13Å; F425-L451 HydrophobicContact CE2-CD1 4.01Å
426	Q	89	Confident	76.5	Confident	36 Å²	36	53.9 Å²	53.9	17%	0.168	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	138	176.9	-52.1	-162.8	-6.3	0	0	111.3	V413 Q414 D416 V433 L434 R435	V413-Q426 WeakPolarHBondContact CA-O 3.26Å; Q414-Q426 PolarHBondContact N-O 3.2Å; Q414-Q426 PolarHBondContact O-N 2.92Å; D416-Q426 HydrophobicContact CB-CG 3.85Å; D416-Q426 PolarHBondContact OD1-NE2 2.91Å; D416-Q426 WeakPolarHBondContact OD2-CG 3.32Å; D416-Q426 PolarHBondContact OD2-NE2 3.19Å; Q426-V433 HydrophobicContact CB-CG1 4.41Å; Q426-L434 CarbonylContact C-O 3.01Å; Q426-L434 VanDerWaalsContact CA-O 3.32Å; Q426-L434 WeakPolarHBondContact CA-O 3.3Å; Q426-R435 HydrophobicContact CG-CG 4.1Å
427	V	88.6	Confident	76.9	Confident	0 Å²	0	57.4 Å²	57.4	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	116.7	168.6	-170.4	0	0	0	0	108.1	V413 F425 F429 L434 L436 L451	V413-V427 HydrophobicContact CG1-CG2 4.49Å; V413-V427 HydrophobicContact CG2-CG1 4.29Å; F425-V427 HydrophobicContact CD2-CG2 4.07Å; F425-V427 HydrophobicContact CE2-CG2 3.95Å; V427-F429 HydrophobicContact CB-CE2 4.15Å; V427-F429 HydrophobicContact CG1-CD2 4.24Å; V427-F429 HydrophobicContact CG1-CE1 4.49Å; V427-F429 HydrophobicContact CG1-CE2 3.44Å; V427-F429 VanDerWaalsContact CG1-CE2 3.44Å; V427-F429 HydrophobicContact CG1-CZ 3.6Å; V427-L434 HydrophobicContact CB-CB 4.17Å; V427-L434 PolarHBondContact N-O 2.84Å; V427-L434 PolarHBondContact O-N 2.98Å; V427-L436 HydrophobicContact CG2-CD1 3.96Å; V427-L451 HydrophobicContact CG2-CD1 3.72Å
428	I	83.9	Confident	78	Confident	43 Å²	43	51 Å²	51	22%	0.221	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	118.7	-171.5	-56.2	-177.6	0	0	0	109.6	L411 A412 V433	L411-I428 HydrophobicContact CB-CG2 4.28Å; L411-I428 WeakPolarHBondContact CB-O 3.32Å; L411-I428 HydrophobicContact CD1-CG2 4.3Å; L411-I428 PolarHBondContact N-O 3.17Å; A412-I428 HydrophobicContact CB-CB 4.48Å; A412-I428 HydrophobicContact CB-CD1 4.33Å; A412-I428 PolarHBondContact O-N 3.06Å; I428-V433 HydrophobicContact CG1-CG1 4.3Å; I428-V433 HydrophobicContact CG2-CG2 4.36Å
429	F	86.7	Confident	79.2	Confident	12 Å²	12	53 Å²	53	5%	0.053	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	164.3	171.2	-62.4	-79.6	0	0	0	110.2	L389 Y405 N406 V409 C410 V427 Q431 D432 L434	L389-F429 HydrophobicContact CD2-CZ 4.35Å; Y405-F429 AromaticContact CD1-CD2 3.73Å; Y405-F429 HydrophobicContact CD1-CD2 3.73Å; Y405-F429 AromaticContact CD1-CE2 3.91Å; Y405-F429 HydrophobicContact CD1-CE2 3.91Å; Y405-F429 HydrophobicContact CD1-CG 4.09Å; Y405-F429 HydrophobicContact CD1-CZ 4.43Å; Y405-F429 HydrophobicContact CD2-CE2 4.46Å; Y405-F429 HydrophobicContact CE1-CD2 4.34Å; Y405-F429 HydrophobicContact CG-CD2 4.12Å; Y405-F429 AromaticContact CG-CE2 3.81Å; Y405-F429 HydrophobicContact CG-CE2 3.81Å; Y405-F429 HydrophobicContact CG-CZ 4.04Å; N406-F429 WeakPolarHBondContact O-CE1 3.43Å; V409-F429 HydrophobicContact CG2-CD1 4.4Å; C410-F429 HydrophobicContact CB-CD1 4.3Å; C410-F429 HydrophobicContact CB-CE1 3.77Å; C410-F429 HydrophobicContact CB-CZ 4.47Å; V427-F429 HydrophobicContact CB-CE2 4.15Å; V427-F429 HydrophobicContact CG1-CD2 4.24Å; V427-F429 HydrophobicContact CG1-CE1 4.49Å; V427-F429 HydrophobicContact CG1-CE2 3.44Å; V427-F429 VanDerWaalsContact CG1-CE2 3.44Å; V427-F429 HydrophobicContact CG1-CZ 3.6Å; F429-Q431 PolarHBondContact O-N 3.1Å; F429-D432 WeakPolarHBondContact CB-O 3.38Å; F429-D432 PolarHBondContact N-O 2.73Å; F429-D432 VanDerWaalsContact O-O 3.13Å; F429-L434 HydrophobicContact CD2-CD1 4.46Å; F429-L434 HydrophobicContact CD2-CG 4.33Å; F429-L434 HydrophobicContact CE2-CD1 3.81Å; F429-L434 HydrophobicContact CE2-CG 4.13Å
430	P	73.4	Confident	80.5	Confident	81 Å²	81	50.2 Å²	50.2	53%	0.526	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67	-5.2	-176.4	-21.3	33.9	0	0	0	115.7	V409 L411	V409-P430 HydrophobicContact CB-CG 4.16Å; V409-P430 WeakPolarHBondContact O-CD 3.25Å; L411-P430 HydrophobicContact CD1-CB 4.49Å; L411-P430 HydrophobicContact CD1-CG 4.11Å; L411-P430 HydrophobicContact CD2-CG 4.31Å; L411-P430 HydrophobicContact CG-CG 4.2Å
431	Q	72.5	Confident	81.6	Confident	196 Å²	196	53 Å²	53	92%	0.916	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-139.9	-3.9	-175.8	-64.1	-176.5	-8	0	0	114.2	F429	F429-Q431 PolarHBondContact O-N 3.1Å
432	D	78.3	Confident	82.5	Confident	49 Å²	49	58 Å²	58	26%	0.262	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156	151	179	-166.6	1.7	0	0	0	109.7	R370 Y405 F429 L434	R370-D432 IonicContact CZ-OD2 3.7Å; R370-D432 IonicContact NH1-OD2 3.67Å; R370-D432 PolarHBondContact NH1-OD2 3.49Å; R370-D432 VanDerWaalsContact NH1-OD2 3.17Å; R370-D432 VanDerWaalsContact NH2-CG 3.27Å; R370-D432 IonicContact NH2-OD1 2.7Å; R370-D432 PolarHBondContact NH2-OD1 3.08Å; R370-D432 IonicContact NH2-OD2 3.57Å; R370-D432 PolarHBondContact NH2-OD2 3.32Å; Y405-D432 HydrophobicContact CE1-CB 3.98Å; Y405-D432 PolarHBondContact OH-OD2 3.06Å; F429-D432 WeakPolarHBondContact CB-O 3.38Å; F429-D432 PolarHBondContact N-O 2.73Å; F429-D432 VanDerWaalsContact O-O 3.13Å; D432-L434 WeakPolarHBondContact OD2-CD2 3.24Å
433	V	85.3	Confident	83.2	Confident	65 Å²	65	60.5 Å²	60.5	39%	0.394	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	106.8	174.3	178.7	0	0	0	0	108.4	Q426 I428 R435	Q426-V433 HydrophobicContact CB-CG1 4.41Å; I428-V433 HydrophobicContact CG1-CG1 4.3Å; I428-V433 HydrophobicContact CG2-CG2 4.36Å; V433-R435 PolarHBondContact O-N 2.92Å
434	L	86.7	Confident	83.5	Confident	0 Å²	0	60.2 Å²	60.2	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	101.5	179.1	-55.2	-173.5	0	0	0	110	R370 F382 L389 Y405 Q426 V427 F429 D432 L436	R370-L434 VanDerWaalsContact NH1-CD2 3.27Å; F382-L434 HydrophobicContact CE1-CD1 4.36Å; L389-L434 HydrophobicContact CD2-CD1 4.09Å; Y405-L434 HydrophobicContact CD2-CD1 3.94Å; Y405-L434 HydrophobicContact CE1-CD2 4.34Å; Y405-L434 HydrophobicContact CE2-CD1 3.73Å; Y405-L434 HydrophobicContact CE2-CD2 4.04Å; Y405-L434 HydrophobicContact CE2-CG 4.39Å; Y405-L434 WeakPolarHBondContact OH-CD2 3.26Å; Q426-L434 CarbonylContact C-O 3.01Å; Q426-L434 VanDerWaalsContact CA-O 3.32Å; Q426-L434 WeakPolarHBondContact CA-O 3.3Å; V427-L434 HydrophobicContact CB-CB 4.17Å; V427-L434 PolarHBondContact N-O 2.84Å; V427-L434 PolarHBondContact O-N 2.98Å; F429-L434 HydrophobicContact CD2-CD1 4.46Å; F429-L434 HydrophobicContact CD2-CG 4.33Å; F429-L434 HydrophobicContact CE2-CD1 3.81Å; F429-L434 HydrophobicContact CE2-CG 4.13Å; D432-L434 WeakPolarHBondContact OD2-CD2 3.24Å; L434-L436 HydrophobicContact CB-CD1 4.2Å; L434-L436 HydrophobicContact CB-CD2 4.19Å; L434-L436 HydrophobicContact CB-CG 3.96Å; L434-L436 HydrophobicContact CD1-CD1 4.47Å; L434-L436 PolarHBondContact O-N 3Å
435	R	87.6	Confident	83.5	Confident	89 Å²	89	63.6 Å²	63.6	34%	0.336	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	115.3	159.9	-64.5	-168.1	177.2	161.7	2.2	108.9	R370 L371 W377 D416 Q426 V433	R370-R435 WeakPolarHBondContact CA-O 3.13Å; L371-R435 HydrophobicContact CB-CB 3.91Å; L371-R435 HydrophobicContact CD2-CB 4.45Å; L371-R435 PolarHBondContact N-O 3.2Å; W377-R435 HydrophobicContact CH2-CB 4.4Å; D416-R435 WeakPolarHBondContact OD2-CD 3.23Å; D416-R435 IonicContact OD2-NE 2.75Å; D416-R435 PolarHBondContact OD2-NE 3.21Å; Q426-R435 HydrophobicContact CG-CG 4.1Å; V433-R435 PolarHBondContact O-N 2.92Å
436	L	88.4	Confident	83.3	Confident	1 Å²	1	66.2 Å²	66.2	1%	0.005	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	145	-176.2	-59.5	178.5	0	0	0	109.9	L368 Y369 R370 F382 C424 F425 V427 L434	L368-L436 HydrophobicContact CD1-CD1 4.1Å; Y369-L436 CarbonylContact O-C 3.51Å; Y369-L436 VanDerWaalsContact O-CA 3.31Å; Y369-L436 WeakPolarHBondContact O-CA 3.45Å; R370-L436 HydrophobicContact CB-CD2 3.9Å; R370-L436 HydrophobicContact CG-CD2 4.12Å; F382-L436 HydrophobicContact CE1-CD1 4.42Å; F382-L436 HydrophobicContact CE1-CD2 4.28Å; F382-L436 HydrophobicContact CE2-CD2 3.87Å; F382-L436 HydrophobicContact CZ-CD1 4.41Å; F382-L436 HydrophobicContact CZ-CD2 3.52Å; C424-L436 WeakPolarHBondContact CA-O 3.17Å; F425-L436 HydrophobicContact CD1-CB 4.35Å; F425-L436 WeakPolarHBondContact CD1-O 3.22Å; F425-L436 HydrophobicContact CD2-CB 4.31Å; F425-L436 HydrophobicContact CE1-CB 3.94Å; F425-L436 HydrophobicContact CE2-CB 3.91Å; F425-L436 HydrophobicContact CE2-CD1 3.87Å; F425-L436 HydrophobicContact CE2-CG 4.45Å; F425-L436 HydrophobicContact CZ-CB 3.71Å; F425-L436 HydrophobicContact CZ-CD1 4.07Å; F425-L436 PolarHBondContact N-O 2.88Å; F425-L436 PolarHBondContact O-N 3.29Å; F425-L436 VanDerWaalsContact O-O 3.07Å; V427-L436 HydrophobicContact CG2-CD1 3.96Å; L434-L436 HydrophobicContact CB-CD1 4.2Å; L434-L436 HydrophobicContact CB-CD2 4.19Å; L434-L436 HydrophobicContact CB-CG 3.96Å; L434-L436 HydrophobicContact CD1-CD1 4.47Å; L434-L436 PolarHBondContact O-N 3Å
437	R	85.6	Confident	83.4	Confident	87 Å²	87	65 Å²	65	33%	0.328	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	134.7	175.3	-179.7	178	-178.5	-174.4	0.1	110	Y369 W377 S423	Y369-R437 PolarHBondContact N-O 2.85Å; Y369-R437 PolarHBondContact O-N 3.31Å; W377-R437 HydrophobicContact CD2-CB 4.39Å; W377-R437 HydrophobicContact CE3-CB 3.85Å; W377-R437 HydrophobicContact CH2-CB 3.72Å; W377-R437 HydrophobicContact CZ2-CB 4.26Å; W377-R437 HydrophobicContact CZ3-CB 3.49Å; W377-R437 VanDerWaalsContact CZ3-CB 3.49Å; S423-R437 WeakPolarHBondContact O-CA 3.43Å; S423-R437 WeakPolarHBondContact OG-CG 3.35Å; S423-R437 PolarHBondContact OG-NE 3.33Å
438	A	86.4	Confident	83.3	Confident	3 Å²	3	65 Å²	65	3%	0.025	30%	0.304	C	S	.	.			trans	-101.3	166.7	172.3	0	0	0	0	0	111.4	L368 S423 T440 R443 A444	L368-A438 HydrophobicContact CD2-CB 3.76Å; S423-A438 WeakPolarHBondContact CB-O 3.3Å; S423-A438 PolarHBondContact O-N 3.35Å; S423-A438 PolarHBondContact OG-O 2.94Å; A438-T440 VanDerWaalsContact C-N 3.29Å; A438-T440 PolarHBondContact O-N 3.16Å; A438-R443 HydrophobicContact CB-CB 3.89Å; A438-A444 HydrophobicContact CB-CB 3.97Å
439	E	80.9	Confident	83.4	Confident	132 Å²	132	66.6 Å²	66.6	62%	0.617	31%	0.31	S	S	*	.	S	Bend	trans	-65.4	-30.6	179.8	-65.3	164.1	170.4	0	0	112.8	Y369	Y369-E439 HydrophobicContact CE2-CG 4.38Å
440	T	80.5	Confident	83.4	Confident	67 Å²	67	67.2 Å²	67.2	41%	0.411	32%	0.318	S	S	.	.	S	Bend	trans	-140	158.7	176.5	75.1	0	0	0	0	111.6	A438 Q442 R443 A444	A438-T440 VanDerWaalsContact C-N 3.29Å; A438-T440 PolarHBondContact O-N 3.16Å; T440-Q442 PolarHBondContact O-N 3.4Å; T440-Q442 PolarHBondContact OG1-N 3.37Å; T440-R443 PolarHBondContact O-N 2.85Å; T440-R443 PolarHBondContact OG1-N 3.34Å; T440-R443 VanDerWaalsContact OG1-N 3.15Å; T440-A444 PolarHBondContact O-N 3.2Å
441	R	80	Confident	84	Confident	133 Å²	133	63.4 Å²	63.4	50%	0.502	29%	0.293	S	S	.	.	H	α-helix	trans	-51.6	-43.2	171.7	-165.1	-160.2	-172.6	107.6	2.5	112.4	D422 A444 Q445	D422-R441 HydrophobicContact CB-CG 4.11Å; D422-R441 WeakPolarHBondContact OD2-CD 3.43Å; D422-R441 WeakPolarHBondContact OD2-CG 3.4Å; D422-R441 IonicContact OD2-CZ 3.46Å; D422-R441 IonicContact OD2-NE 2.64Å; D422-R441 IonicContact OD2-NH1 2.86Å; D422-R441 PolarHBondContact OD2-NH1 2.93Å; R441-A444 WeakPolarHBondContact O-CB 3.41Å; R441-A444 PolarHBondContact O-N 3.48Å; R441-Q445 PolarHBondContact O-N 3.08Å
442	Q	78.3	Confident	84.7	Confident	143 Å²	143	57.2 Å²	57.2	67%	0.668	26%	0.263	S	S	*	.	H	α-helix	trans	-63.8	-44.9	179.4	-175.6	176	0.1	0	0	111.5	T440 A444 Q445 E446	T440-Q442 PolarHBondContact O-N 3.4Å; T440-Q442 PolarHBondContact OG1-N 3.37Å; Q442-A444 VanDerWaalsContact C-N 3.33Å; Q442-A444 PolarHBondContact O-N 3.32Å; Q442-Q445 PolarHBondContact O-N 3.02Å; Q442-E446 WeakPolarHBondContact O-CG 3.21Å; Q442-E446 PolarHBondContact O-N 3.32Å
443	R	82.3	Confident	85.1	Confident	121 Å²	121	59.4 Å²	59.4	46%	0.457	28%	0.278	S	S	.	.	H	α-helix	trans	-63.4	-38.1	174.9	-70	-54.6	-159.5	-167.7	3.8	112	A438 T440 E446 W447	A438-R443 HydrophobicContact CB-CB 3.89Å; T440-R443 PolarHBondContact O-N 2.85Å; T440-R443 PolarHBondContact OG1-N 3.34Å; T440-R443 VanDerWaalsContact OG1-N 3.15Å; R443-E446 WeakPolarHBondContact CD-OE1 3.44Å; R443-E446 WeakPolarHBondContact CD-OE2 3.24Å; R443-E446 IonicContact CZ-OE1 2.76Å; R443-E446 IonicContact CZ-OE2 3.08Å; R443-E446 IonicContact NE-OE1 3.3Å; R443-E446 VanDerWaalsContact NH1-CD 3.32Å; R443-E446 IonicContact NH1-OE1 3.67Å; R443-E446 PolarHBondContact NH1-OE1 3.32Å; R443-E446 IonicContact NH1-OE2 3.67Å; R443-E446 PolarHBondContact NH1-OE2 2.65Å; R443-E446 PolarHBondContact O-N 2.9Å; R443-W447 VanDerWaalsContact O-CD1 3.24Å; R443-W447 PolarHBondContact O-N 3.13Å
444	A	85.4	Confident	85	Confident	1 Å²	1	56.4 Å²	56.4	1%	0.008	26%	0.26	C	S	.	.	H	α-helix	trans	-59.9	-46	173.2	0	0	0	0	0	111.2	S423 F425 A438 T440 R441 Q442 W447 M448	S423-A444 WeakPolarHBondContact O-CB 3.46Å; F425-A444 HydrophobicContact CD1-CB 3.95Å; F425-A444 HydrophobicContact CE1-CB 4.25Å; A438-A444 HydrophobicContact CB-CB 3.97Å; T440-A444 PolarHBondContact O-N 3.2Å; R441-A444 WeakPolarHBondContact O-CB 3.41Å; R441-A444 PolarHBondContact O-N 3.48Å; Q442-A444 VanDerWaalsContact C-N 3.33Å; Q442-A444 PolarHBondContact O-N 3.32Å; A444-W447 PolarHBondContact O-N 3.16Å; A444-M448 WeakPolarHBondContact O-CG 3.27Å; A444-M448 PolarHBondContact O-N 2.82Å
445	Q	84.3	Confident	84.9	Confident	75 Å²	75	56.4 Å²	56.4	35%	0.35	26%	0.261	S	S	.	.	H	α-helix	trans	-62.9	-44.9	177.1	-161.7	70.1	47.4	0	0	112.7	R441 Q442 W447 M448 E449	R441-Q445 PolarHBondContact O-N 3.08Å; Q442-Q445 PolarHBondContact O-N 3.02Å; Q445-W447 VanDerWaalsContact C-N 3.29Å; Q445-W447 PolarHBondContact O-N 3.24Å; Q445-M448 HydrophobicContact CB-CE 4.48Å; Q445-M448 PolarHBondContact O-N 3.37Å; Q445-E449 HydrophobicContact CG-CG 4.46Å; Q445-E449 PolarHBondContact NE2-OE1 3.25Å; Q445-E449 PolarHBondContact O-N 3.08Å
446	E	85.4	Confident	84.7	Confident	56 Å²	56	56.6 Å²	56.6	26%	0.262	27%	0.268	S	S	.	.	H	α-helix	trans	-56	-43.2	174.8	-71.9	174	-150.8	0	0	112.2	K364 Q442 R443 A450	K364-E446 IonicContact NZ-OE2 3.06Å; K364-E446 PolarHBondContact NZ-OE2 3.03Å; Q442-E446 WeakPolarHBondContact O-CG 3.21Å; Q442-E446 PolarHBondContact O-N 3.32Å; R443-E446 WeakPolarHBondContact CD-OE1 3.44Å; R443-E446 WeakPolarHBondContact CD-OE2 3.24Å; R443-E446 IonicContact CZ-OE1 2.76Å; R443-E446 IonicContact CZ-OE2 3.08Å; R443-E446 IonicContact NE-OE1 3.3Å; R443-E446 VanDerWaalsContact NH1-CD 3.32Å; R443-E446 IonicContact NH1-OE1 3.67Å; R443-E446 PolarHBondContact NH1-OE1 3.32Å; R443-E446 IonicContact NH1-OE2 3.67Å; R443-E446 PolarHBondContact NH1-OE2 2.65Å; R443-E446 PolarHBondContact O-N 2.9Å; E446-A450 VanDerWaalsContact O-CB 3.24Å; E446-A450 WeakPolarHBondContact O-CB 3.16Å; E446-A450 PolarHBondContact O-N 3.35Å
447	W	89.9	Confident	84.4	Confident	10 Å²	10	59 Å²	59	4%	0.038	29%	0.288	C	S	.	.	H	α-helix	trans	-68.7	-42.1	177.9	-86.8	107.1	0	0	0	112	K364 L368 F382 L384 F425 R443 A444 Q445 A450 L451	K364-W447 HydrophobicContact CB-CH2 4.3Å; K364-W447 HydrophobicContact CB-CZ3 4.19Å; K364-W447 HydrophobicContact CD-CD2 3.73Å; K364-W447 HydrophobicContact CD-CE3 3.91Å; K364-W447 HydrophobicContact CD-CG 4.16Å; K364-W447 HydrophobicContact CD-CZ2 4.36Å; K364-W447 HydrophobicContact CD-CZ3 4.3Å; K364-W447 HydrophobicContact CG-CD2 4.33Å; K364-W447 HydrophobicContact CG-CE3 4.33Å; K364-W447 HydrophobicContact CG-CH2 4.09Å; K364-W447 HydrophobicContact CG-CZ2 4.07Å; K364-W447 HydrophobicContact CG-CZ3 4.22Å; L368-W447 HydrophobicContact CD1-CD2 3.85Å; L368-W447 HydrophobicContact CD1-CE3 4.16Å; L368-W447 HydrophobicContact CD1-CG 4.12Å; L368-W447 HydrophobicContact CD1-CZ2 4.37Å; L368-W447 HydrophobicContact CD2-CG 4.22Å; L368-W447 HydrophobicContact CG-CD2 4.44Å; L368-W447 HydrophobicContact CG-CZ2 4.48Å; F382-W447 HydrophobicContact CB-CH2 3.93Å; F382-W447 HydrophobicContact CB-CZ3 4.36Å; L384-W447 HydrophobicContact CB-CZ3 4.01Å; F425-W447 HydrophobicContact CE1-CB 4.36Å; F425-W447 HydrophobicContact CE2-CB 4.44Å; F425-W447 HydrophobicContact CZ-CB 3.79Å; R443-W447 VanDerWaalsContact O-CD1 3.24Å; R443-W447 PolarHBondContact O-N 3.13Å; A444-W447 PolarHBondContact O-N 3.16Å; Q445-W447 VanDerWaalsContact C-N 3.29Å; Q445-W447 PolarHBondContact O-N 3.24Å; W447-A450 PolarHBondContact O-N 3.1Å; W447-L451 WeakPolarHBondContact O-CB 3.44Å; W447-L451 WeakPolarHBondContact O-CD1 3.46Å; W447-L451 VanDerWaalsContact O-CG 3.25Å; W447-L451 WeakPolarHBondContact O-CG 3.05Å; W447-L451 PolarHBondContact O-N 3.43Å
448	M	87.4	Confident	84	Confident	2 Å²	2	55.9 Å²	55.9	1%	0.01	28%	0.281	C	S	.	.	H	α-helix	trans	-61.7	-46.3	176.5	-72.9	-169.9	-72.7	0	0	112.3	V413 M415 F425 A444 Q445 L451 K452	V413-M448 HydrophobicContact CG1-CB 3.82Å; V413-M448 HydrophobicContact CG1-CG 3.62Å; V413-M448 HydrophobicContact CG1-SD 4.35Å; M415-M448 HydrophobicContact CG-CE 3.68Å; M415-M448 HydrophobicContact CG-SD 3.88Å; M415-M448 HydrophobicContact SD-CE 4.33Å; F425-M448 HydrophobicContact CB-CG 3.82Å; F425-M448 HydrophobicContact CB-SD 3.53Å; F425-M448 VanDerWaalsContact CB-SD 3.53Å; F425-M448 HydrophobicContact CD1-CG 4.41Å; F425-M448 HydrophobicContact CD2-CG 3.65Å; F425-M448 HydrophobicContact CD2-SD 4.48Å; F425-M448 HydrophobicContact CE2-CG 4.25Å; F425-M448 HydrophobicContact CG-CG 3.73Å; F425-M448 HydrophobicContact CG-SD 4.13Å; A444-M448 WeakPolarHBondContact O-CG 3.27Å; A444-M448 PolarHBondContact O-N 2.82Å; Q445-M448 HydrophobicContact CB-CE 4.48Å; Q445-M448 PolarHBondContact O-N 3.37Å; M448-L451 PolarHBondContact O-N 3.05Å; M448-K452 VanDerWaalsContact O-CG 3.26Å; M448-K452 WeakPolarHBondContact O-CG 3.22Å; M448-K452 PolarHBondContact O-N 3.42Å
449	E	86.4	Confident	83.4	Confident	75 Å²	75	60.4 Å²	60.4	35%	0.35	30%	0.297	S	S	.	.	H	α-helix	trans	-71.2	-35.5	179.3	-61.6	-41.5	127.8	0	0	112.6	Q445 L451 K452 T453	Q445-E449 HydrophobicContact CG-CG 4.46Å; Q445-E449 PolarHBondContact NE2-OE1 3.25Å; Q445-E449 PolarHBondContact O-N 3.08Å; E449-L451 VanDerWaalsContact C-N 3.34Å; E449-L451 PolarHBondContact O-N 2.83Å; E449-K452 PolarHBondContact O-N 2.93Å; E449-K452 IonicContact OE1-NZ 3.53Å; E449-K452 PolarHBondContact OE1-NZ 2.88Å; E449-K452 VanDerWaalsContact OE2-CD 3.3Å; E449-K452 WeakPolarHBondContact OE2-CD 3.42Å; E449-K452 IonicContact OE2-NZ 2.69Å; E449-T453 WeakPolarHBondContact O-CB 3.42Å; E449-T453 PolarHBondContact O-N 2.86Å; E449-T453 PolarHBondContact O-OG1 3.09Å
450	A	85.6	Confident	82.5	Confident	25 Å²	25	56.9 Å²	56.9	21%	0.207	29%	0.287	C	S	.	.	H	α-helix	trans	-60.9	-43.1	172	0	0	0	0	0	111.6	K364 L384 E446 W447 T453 A454	K364-A450 HydrophobicContact CB-CB 4.46Å; K364-A450 HydrophobicContact CD-CB 3.87Å; L384-A450 HydrophobicContact CD2-CB 3.94Å; E446-A450 VanDerWaalsContact O-CB 3.24Å; E446-A450 WeakPolarHBondContact O-CB 3.16Å; E446-A450 PolarHBondContact O-N 3.35Å; W447-A450 PolarHBondContact O-N 3.1Å; A450-T453 PolarHBondContact O-N 3.41Å; A450-A454 VanDerWaalsContact O-CB 3.31Å; A450-A454 WeakPolarHBondContact O-CB 3.48Å; A450-A454 PolarHBondContact O-N 2.93Å
451	L	86.6	Confident	81.3	Confident	1 Å²	1	58 Å²	58	1%	0.005	30%	0.298	C	S	.	.	H	α-helix	trans	-65.8	-46	176.9	-75.6	165.4	0	0	0	112.8	L384 L389 V413 F425 V427 W447 M448 E449 T453 A454 A455	L384-L451 HydrophobicContact CD1-CD2 3.83Å; L384-L451 HydrophobicContact CD2-CD2 3.96Å; L384-L451 HydrophobicContact CD2-CG 4.16Å; L384-L451 HydrophobicContact CG-CD2 4.44Å; L389-L451 HydrophobicContact CB-CD2 4.49Å; L389-L451 HydrophobicContact CD1-CD2 4.09Å; L389-L451 HydrophobicContact CD2-CD2 3.85Å; L389-L451 HydrophobicContact CG-CD2 4.36Å; V413-L451 HydrophobicContact CG2-CB 4.01Å; F425-L451 HydrophobicContact CE2-CD1 4.01Å; V427-L451 HydrophobicContact CG2-CD1 3.72Å; W447-L451 WeakPolarHBondContact O-CB 3.44Å; W447-L451 WeakPolarHBondContact O-CD1 3.46Å; W447-L451 VanDerWaalsContact O-CG 3.25Å; W447-L451 WeakPolarHBondContact O-CG 3.05Å; W447-L451 PolarHBondContact O-N 3.43Å; M448-L451 PolarHBondContact O-N 3.05Å; E449-L451 VanDerWaalsContact C-N 3.34Å; E449-L451 PolarHBondContact O-N 2.83Å; L451-T453 VanDerWaalsContact C-N 3.34Å; L451-T453 PolarHBondContact O-N 3.03Å; L451-A454 PolarHBondContact O-N 2.88Å; L451-A455 WeakPolarHBondContact O-CB 3.44Å; L451-A455 PolarHBondContact O-N 3.3Å
452	K	87.7	Confident	79.8	Confident	67 Å²	67	59.8 Å²	59.8	29%	0.291	31%	0.312	S	S	.	.	H	α-helix	trans	-60.4	-44.3	175	-70	164.3	-174.7	175.6	0	111.4	V413 M448 E449 A455 N456	V413-K452 HydrophobicContact CB-CG 3.98Å; V413-K452 HydrophobicContact CG2-CG 4.19Å; M448-K452 VanDerWaalsContact O-CG 3.26Å; M448-K452 WeakPolarHBondContact O-CG 3.22Å; M448-K452 PolarHBondContact O-N 3.42Å; E449-K452 PolarHBondContact O-N 2.93Å; E449-K452 IonicContact OE1-NZ 3.53Å; E449-K452 PolarHBondContact OE1-NZ 2.88Å; E449-K452 VanDerWaalsContact OE2-CD 3.3Å; E449-K452 WeakPolarHBondContact OE2-CD 3.42Å; E449-K452 IonicContact OE2-NZ 2.69Å; K452-A455 PolarHBondContact O-N 3.19Å; K452-N456 WeakPolarHBondContact O-CB 3.43Å; K452-N456 PolarHBondContact O-N 2.91Å; K452-N456 PolarHBondContact O-ND2 2.97Å
453	T	85.4	Confident	78.2	Confident	94 Å²	94	60.3 Å²	60.3	58%	0.577	31%	0.314	S	S	*	.	H	α-helix	trans	-64	-45.9	179.2	-58	0	0	0	0	111.1	E449 A450 L451 N456 A457	E449-T453 WeakPolarHBondContact O-CB 3.42Å; E449-T453 PolarHBondContact O-N 2.86Å; E449-T453 PolarHBondContact O-OG1 3.09Å; A450-T453 PolarHBondContact O-N 3.41Å; L451-T453 VanDerWaalsContact C-N 3.34Å; L451-T453 PolarHBondContact O-N 3.03Å; T453-N456 PolarHBondContact O-N 3.27Å; T453-A457 VanDerWaalsContact O-CB 3.24Å; T453-A457 WeakPolarHBondContact O-CB 3.43Å; T453-A457 PolarHBondContact O-N 3.3Å
454	A	84.4	Confident	75.8	Confident	2 Å²	2	60.8 Å²	60.8	2%	0.017	33%	0.326	C	S	.	.	H	α-helix	trans	-62.6	-43.2	176.3	0	0	0	0	0	112.3	L363 L384 V407 A450 L451 A457 A458	L363-A454 HydrophobicContact CD1-CB 3.81Å; L384-A454 HydrophobicContact CD1-CB 4.11Å; L384-A454 HydrophobicContact CD2-CB 4.13Å; L384-A454 HydrophobicContact CG-CB 4.38Å; V407-A454 HydrophobicContact CG1-CB 3.86Å; A450-A454 VanDerWaalsContact O-CB 3.31Å; A450-A454 WeakPolarHBondContact O-CB 3.48Å; A450-A454 PolarHBondContact O-N 2.93Å; L451-A454 PolarHBondContact O-N 2.88Å; A454-A457 PolarHBondContact O-N 2.95Å; A454-A458 WeakPolarHBondContact O-CB 3.35Å; A454-A458 PolarHBondContact O-N 3.01Å
455	A	85	Confident	73.4	Confident	1 Å²	1	68.4 Å²	68.4	1%	0.008	37%	0.366	C	S	.	.	H	α-helix	trans	-66	-40.1	178.5	0	0	0	0	0	112.7	V407 C410 L451 K452 R459	V407-A455 HydrophobicContact CG1-CB 3.88Å; V407-A455 WeakPolarHBondContact O-CB 3.42Å; C410-A455 HydrophobicContact CB-CB 3.97Å; L451-A455 WeakPolarHBondContact O-CB 3.44Å; L451-A455 PolarHBondContact O-N 3.3Å; K452-A455 PolarHBondContact O-N 3.19Å; A455-R459 WeakPolarHBondContact O-CG 3.31Å; A455-R459 PolarHBondContact O-N 3.34Å; A455-R459 VanDerWaalsContact O-N 3.1Å; A455-R459 PolarHBondContact O-NE 2.7Å
456	N	82.6	Confident	70.7	Confident	93 Å²	93	72.9 Å²	72.9	50%	0.497	39%	0.386	S	S	.	.	H	α-helix	trans	-70.1	-39.3	175.2	-69	-15.5	0	0	0	111.9	K452 T453 R459 S460	K452-N456 WeakPolarHBondContact O-CB 3.43Å; K452-N456 PolarHBondContact O-N 2.91Å; K452-N456 PolarHBondContact O-ND2 2.97Å; T453-N456 PolarHBondContact O-N 3.27Å; N456-R459 PolarHBondContact O-N 3.17Å; N456-R459 PolarHBondContact OD1-NH2 3.35Å; N456-S460 WeakPolarHBondContact O-CB 3.15Å; N456-S460 PolarHBondContact O-N 3.22Å; N456-S460 PolarHBondContact O-OG 3.41Å
457	A	81.8	Confident	68	Low	52 Å²	52	76.8 Å²	76.8	43%	0.43	41%	0.414	S	S	.	.	H	α-helix	trans	-61.8	-47.9	174	0	0	0	0	0	111.4	T453 A454 R459 S460 S461	T453-A457 VanDerWaalsContact O-CB 3.24Å; T453-A457 WeakPolarHBondContact O-CB 3.43Å; T453-A457 PolarHBondContact O-N 3.3Å; A454-A457 PolarHBondContact O-N 2.95Å; A457-R459 PolarHBondContact O-N 3.23Å; A457-S460 WeakPolarHBondContact CA-OG 3.3Å; A457-S460 PolarHBondContact O-N 3.32Å; A457-S460 VanDerWaalsContact O-N 3.15Å; A457-S460 PolarHBondContact O-OG 2.78Å; A457-S461 PolarHBondContact O-N 3.31Å; A457-S461 VanDerWaalsContact O-N 3.07Å
458	A	77.1	Confident	65	Low	20 Å²	20	81.7 Å²	81.7	17%	0.165	45%	0.445	C	S	.	.	H	α-helix	trans	-55.5	-49.6	175.8	0	0	0	0	0	111.9	D408 A454 S460 S461	D408-A458 HydrophobicContact CB-CB 4.17Å; A454-A458 WeakPolarHBondContact O-CB 3.35Å; A454-A458 PolarHBondContact O-N 3.01Å; A458-S460 VanDerWaalsContact C-N 3.33Å; A458-S460 PolarHBondContact O-N 3.44Å; A458-S461 WeakPolarHBondContact O-CB 3.49Å; A458-S461 PolarHBondContact O-N 2.87Å; A458-S461 VanDerWaalsContact O-N 3.15Å
459	R	74.1	Confident	62.1	Low	98 Å²	98	88.6 Å²	88.6	37%	0.37	48%	0.481	S	S	.	.	H	α-helix	trans	-61.7	-34.7	176.2	-73.9	-177.1	-76.1	-103.7	11.2	113.9	D408 C410 A455 N456 A457 S461	D408-R459 PolarHBondContact O-NH1 3.41Å; C410-R459 PolarHBondContact O-NH1 3.45Å; A455-R459 WeakPolarHBondContact O-CG 3.31Å; A455-R459 PolarHBondContact O-N 3.34Å; A455-R459 VanDerWaalsContact O-N 3.1Å; A455-R459 PolarHBondContact O-NE 2.7Å; N456-R459 PolarHBondContact O-N 3.17Å; N456-R459 PolarHBondContact OD1-NH2 3.35Å; A457-R459 PolarHBondContact O-N 3.23Å; R459-S461 VanDerWaalsContact C-N 3.33Å
460	S	62.7	Low	59.2	Low	59 Å²	59	95 Å²	95	41%	0.413	50%	0.502	S	S	.	.	H	α-helix	trans	-72.9	-23.3	176.2	72.8	0	0	0	0	113.9	N456 A457 A458 E462 Q463	N456-S460 WeakPolarHBondContact O-CB 3.15Å; N456-S460 PolarHBondContact O-N 3.22Å; N456-S460 PolarHBondContact O-OG 3.41Å; A457-S460 WeakPolarHBondContact CA-OG 3.3Å; A457-S460 PolarHBondContact O-N 3.32Å; A457-S460 VanDerWaalsContact O-N 3.15Å; A457-S460 PolarHBondContact O-OG 2.78Å; A458-S460 VanDerWaalsContact C-N 3.33Å; A458-S460 PolarHBondContact O-N 3.44Å; S460-E462 PolarHBondContact O-N 3.24Å; S460-Q463 PolarHBondContact O-N 2.89Å
461	S	55.3	Low	56.4	Low	90 Å²	90	99.8 Å²	99.8	63%	0.629	53%	0.525	S	S	*	.	H	α-helix	trans	-69.6	-32.6	-177	-160.9	0	0	0	0	112.6	A457 A458 R459 Q463	A457-S461 PolarHBondContact O-N 3.31Å; A457-S461 VanDerWaalsContact O-N 3.07Å; A458-S461 WeakPolarHBondContact O-CB 3.49Å; A458-S461 PolarHBondContact O-N 2.87Å; A458-S461 VanDerWaalsContact O-N 3.15Å; R459-S461 VanDerWaalsContact C-N 3.33Å; S461-Q463 VanDerWaalsContact C-N 3.26Å; S461-Q463 PolarHBondContact O-N 2.86Å
462	E	47.7	Very low	53.6	Low	170 Å²	170	109.3 Å²	109.3	79%	0.794	57%	0.566	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.5	-16.6	175.1	-63.9	-161.5	129.7	0	0	113.4	S460	S460-E462 PolarHBondContact O-N 3.24Å
463	Q	44.4	Very low	51.6	Low	155 Å²	155	111.5 Å²	111.5	72%	0.724	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.5	-6.5	-178.5	-64.3	-172.1	-14.1	0	0	114	S460 S461 L465	S460-Q463 PolarHBondContact O-N 2.89Å; S461-Q463 VanDerWaalsContact C-N 3.26Å; S461-Q463 PolarHBondContact O-N 2.86Å; Q463-L465 PolarHBondContact O-N 2.96Å
464	N	32.8	Very low	48.8	Very low	131 Å²	131	116.2 Å²	116.2	70%	0.701	60%	0.599	S	S	*	*			trans	-96.9	34.9	-176.1	-94.8	-68.1	0	0	0	114.9
465	L	33.8	Very low	46.2	Very low	161 Å²	161	121.7 Å²	121.7	84%	0.843	63%	0.628	S	S	*	*			trans	-111.9	63.6	162.9	-80.3	169.4	0	0	0	110.6	Q463 V467	Q463-L465 PolarHBondContact O-N 2.96Å; L465-V467 PolarHBondContact O-N 2.88Å
466	Q	29.1	Very low	43.6	Very low	168 Å²	168	129.3 Å²	129.3	79%	0.785	66%	0.664	S	S	*	*			trans	-73.7	108.4	171.3	-71.4	-166.5	3.6	0	0	110.9
467	V	27.8	Very low	41.1	Very low	139 Å²	139	131.3 Å²	131.3	84%	0.842	68%	0.68	S	S	*	*			trans	-105.6	101.3	161.7	-177.9	0	0	0	0	109	L465	L465-V467 PolarHBondContact O-N 2.88Å
468	T	27.6	Very low	39.1	Very low	112 Å²	112	132.8 Å²	132.8	69%	0.687	70%	0.7	S	S	*	*			trans	-71	137.3	166.1	-8.4	0	0	0	0	108.2
469	L	26	Very low	36.6	Very low	147 Å²	147	135.6 Å²	135.6	77%	0.77	73%	0.731	S	S	*	*			cis	-155.4	153.3	40.3	-86.9	158.7	0	0	0	114.2
470	R	25.2	Very low	34.7	Very low	209 Å²	209	139.8 Å²	139.8	79%	0.789	75%	0.754	S	S	*	*			trans	69.4	120	142.8	-84.2	-171.1	158.5	169.2	-1.9	123.4
471	N	27.5	Very low	33.1	Very low	127 Å²	127	144.4 Å²	144.4	68%	0.679	77%	0.769	S	S	*	*				103.6	92.1	120.8	-75.1	-2.2	0	0	0	122.1
472	K	28	Very low	32.1	Very low	200 Å²	200	147 Å²	147	87%	0.87	78%	0.775	S	S	*	*			trans	74.6	157.3	134.3	-76.9	-156.7	177.2	-169.7	0	119.4
473	P	45.5	Very low	31.7	Very low	114 Å²	114	147.9 Å²	147.9	74%	0.74	77%	0.771	S	S	*	*			trans	-121.7	155.3	-147.6	40.7	-28.7	0	0	0	115.9
474	K	27.5	Very low	31	Very low	192 Å²	192	149.4 Å²	149.4	84%	0.835	78%	0.776	S	S	*	*			trans	-170.6	152.6	135.1	-110.9	-179.6	177.5	-171.9	0	112.8
475	D	28.3	Very low	30.9	Very low	117 Å²	117	148.9 Å²	148.9	63%	0.626	77%	0.773	S	S	*	*			trans	47.1	128.8	149.2	-77.7	45.3	0	0	0	124.2
476	Q	31	Very low	31.1	Very low	161 Å²	161	150.5 Å²	150.5	75%	0.752	77%	0.773	S	S	*	*			trans	80.6	122	134.1	-69.5	178.1	58.5	0	0	122.1
477	T	30.7	Very low	31.5	Very low	136 Å²	136	154.2 Å²	154.2	83%	0.834	78%	0.78	S	S	*	*			trans	75.3	116.8	140.1	-53.4	0	0	0	0	120
478	G	38.4	Very low	32.4	Very low	82 Å²	82	154 Å²	154	85%	0.845	77%	0.77	S	S	*	*			trans	98.3	106.2	151.6	0	0	0	0	0	116.1
479	G	26.1	Very low	34.2	Very low	80 Å²	80	151.3 Å²	151.3	83%	0.825	76%	0.756	S	S	*	*			trans	-147.5	121	170.5	0	0	0	0	0	110.8
480	H	33.6	Very low	36.2	Very low	185 Å²	185	148 Å²	148	86%	0.856	74%	0.741	S	S	*	*			trans	-69.1	130	-177.7	-97.1	-99.6	0	0	0	112.2	L482	H480-L482 PolarHBondContact O-N 2.89Å
481	E	28.7	Very low	38.6	Very low	156 Å²	156	141.3 Å²	141.3	73%	0.729	72%	0.724	S	S	*	*			trans	-60	108.4	157.5	-76	-164.3	149.6	0	0	109.4	R483	E481-R483 PolarHBondContact O-N 2.85Å; E481-R483 IonicContact OE2-NE 2.67Å
482	L	34.6	Very low	40.8	Very low	144 Å²	144	138.6 Å²	138.6	75%	0.754	71%	0.712	S	S	*	*			trans	-78.3	75.1	171.3	-137.6	82.5	0	0	0	109.7	H480 K484	H480-L482 PolarHBondContact O-N 2.89Å; L482-K484 VanDerWaalsContact C-N 3.29Å; L482-K484 PolarHBondContact O-N 2.92Å
483	R	39.1	Very low	43.5	Very low	189 Å²	189	130.8 Å²	130.8	71%	0.713	68%	0.683	S	S	*	*			trans	-56.4	90.8	170.1	-79	-171.6	176.2	-166.2	-4.3	110	E481 N485	E481-R483 PolarHBondContact O-N 2.85Å; E481-R483 IonicContact OE2-NE 2.67Å; R483-N485 PolarHBondContact O-N 2.91Å
484	K	29.6	Very low	45.7	Very low	187 Å²	187	125.9 Å²	125.9	81%	0.813	65%	0.649	S	S	*	*			trans	-71.1	66.2	167.3	-71.9	-179	-179.1	172.6	0	109.1	L482 K486	L482-K484 VanDerWaalsContact C-N 3.29Å; L482-K484 PolarHBondContact O-N 2.92Å; K484-K486 VanDerWaalsContact C-N 3.29Å; K484-K486 PolarHBondContact O-N 2.86Å
485	N	31	Very low	48.8	Very low	120 Å²	120	120.5 Å²	120.5	64%	0.642	63%	0.629	S	S	*	*			trans	-60	93.3	169.3	-76.6	-2.7	0	0	0	108	R483 R487	R483-N485 PolarHBondContact O-N 2.91Å; N485-R487 VanDerWaalsContact C-N 3.3Å; N485-R487 PolarHBondContact O-N 3.42Å
486	K	37	Very low	51.9	Low	196 Å²	196	118.4 Å²	118.4	85%	0.852	62%	0.624	S	S	*	*			trans	-60.1	96.7	169.3	-168.2	175.4	-174.4	179	0	106.2	K484 Q488	K484-K486 VanDerWaalsContact C-N 3.29Å; K484-K486 PolarHBondContact O-N 2.86Å; K486-Q488 PolarHBondContact O-N 2.97Å
487	R	38.5	Very low	54.8	Low	246 Å²	246	112.1 Å²	112.1	93%	0.928	60%	0.596	S	S	*	*			trans	-61.2	101.9	-172	-71.5	-175.9	179.5	178.4	0.7	108.7	N485	N485-R487 VanDerWaalsContact C-N 3.3Å; N485-R487 PolarHBondContact O-N 3.42Å
488	Q	46.8	Very low	57.9	Low	134 Å²	134	106.2 Å²	106.2	63%	0.626	56%	0.559	S	S	*	*			trans	-53.7	140.4	162.4	-70.5	172.2	-25.5	0	0	107.8	K486	K486-Q488 PolarHBondContact O-N 2.97Å
489	S	65.4	Low	60.5	Low	56 Å²	56	103.2 Å²	103.2	39%	0.392	52%	0.524	S	S	.	.			trans	-59.4	150.3	170.5	56.9	0	0	0	0	109.2	T491 T492 S493	S489-T491 PolarHBondContact O-N 2.64Å; S489-T491 PolarHBondContact OG-OG1 2.83Å; S489-T492 PolarHBondContact O-N 2.92Å; S489-T492 VanDerWaalsContact O-N 3.13Å; S489-T492 VanDerWaalsContact OG-CB 3.31Å; S489-T492 WeakPolarHBondContact OG-CB 3.34Å; S489-T492 PolarHBondContact OG-N 3.33Å; S489-T492 PolarHBondContact OG-OG1 2.65Å; S489-S493 PolarHBondContact O-N 2.95Å; S489-S493 PolarHBondContact O-OG 3.23Å
490	V	68.3	Low	63.8	Low	77 Å²	77	103 Å²	103	47%	0.467	51%	0.507	S	S	.	.	H	α-helix	trans	-56.4	-39.2	179	-179.7	0	0	0	0	110.1	S493 F494	V490-S493 WeakPolarHBondContact CA-OG 2.99Å; V490-S493 PolarHBondContact O-N 2.9Å; V490-S493 PolarHBondContact O-OG 2.84Å; V490-F494 HydrophobicContact CG1-CD2 3.85Å; V490-F494 HydrophobicContact CG1-CE1 4.47Å; V490-F494 HydrophobicContact CG1-CE2 3.5Å; V490-F494 HydrophobicContact CG1-CG 4.47Å; V490-F494 HydrophobicContact CG1-CZ 3.86Å; V490-F494 WeakPolarHBondContact O-CB 3.31Å; V490-F494 WeakPolarHBondContact O-CG 3.42Å; V490-F494 PolarHBondContact O-N 3.48Å
491	T	74.2	Confident	66.5	Low	69 Å²	69	97.7 Å²	97.7	42%	0.423	48%	0.484	S	S	.	.	H	α-helix	trans	-60.1	-50.4	174.2	47.7	0	0	0	0	113.1	S489 S493 F494 L495 F572	S489-T491 PolarHBondContact O-N 2.64Å; S489-T491 PolarHBondContact OG-OG1 2.83Å; T491-S493 VanDerWaalsContact C-N 3.32Å; T491-S493 PolarHBondContact O-N 3.47Å; T491-F494 PolarHBondContact O-N 2.98Å; T491-F494 VanDerWaalsContact O-N 3.16Å; T491-L495 WeakPolarHBondContact O-CG 3.43Å; T491-L495 PolarHBondContact O-N 2.85Å; T491-F572 HydrophobicContact CG2-CD2 4.41Å
492	T	74.7	Confident	69.5	Low	69 Å²	69	92.1 Å²	92.1	42%	0.423	46%	0.462	S	S	.	.	H	α-helix	trans	-63.6	-37.5	176.7	-61.2	0	0	0	0	111.8	S489 F494 L495 S496	S489-T492 PolarHBondContact O-N 2.92Å; S489-T492 VanDerWaalsContact O-N 3.13Å; S489-T492 VanDerWaalsContact OG-CB 3.31Å; S489-T492 WeakPolarHBondContact OG-CB 3.34Å; S489-T492 PolarHBondContact OG-N 3.33Å; S489-T492 PolarHBondContact OG-OG1 2.65Å; T492-F494 VanDerWaalsContact C-N 3.25Å; T492-F494 PolarHBondContact O-N 2.83Å; T492-L495 PolarHBondContact O-N 3.5Å; T492-S496 PolarHBondContact O-N 3.4Å; T492-S496 VanDerWaalsContact O-N 3.11Å; T492-S496 PolarHBondContact O-OG 3.45Å
493	S	84.5	Confident	72	Confident	37 Å²	37	92.1 Å²	92.1	26%	0.259	46%	0.462	S	S	.	.	H	α-helix	trans	-70.4	-19.3	176.8	76.5	0	0	0	0	114.2	S489 V490 T491 S496	S489-S493 PolarHBondContact O-N 2.95Å; S489-S493 PolarHBondContact O-OG 3.23Å; V490-S493 WeakPolarHBondContact CA-OG 2.99Å; V490-S493 PolarHBondContact O-N 2.9Å; V490-S493 PolarHBondContact O-OG 2.84Å; T491-S493 VanDerWaalsContact C-N 3.32Å; T491-S493 PolarHBondContact O-N 3.47Å; S493-S496 PolarHBondContact O-OG 3.38Å
494	F	92.4	Very high	74.4	Confident	10 Å²	10	88.3 Å²	88.3	4%	0.044	45%	0.453	C	S	.	.	H	α-helix	trans	-93.3	-34.8	174.1	-75.2	-12.5	0	0	0	112	V490 T491 T492 S496 I497 L498 Y533 Q568 A569 F572	V490-F494 HydrophobicContact CG1-CD2 3.85Å; V490-F494 HydrophobicContact CG1-CE1 4.47Å; V490-F494 HydrophobicContact CG1-CE2 3.5Å; V490-F494 HydrophobicContact CG1-CG 4.47Å; V490-F494 HydrophobicContact CG1-CZ 3.86Å; V490-F494 WeakPolarHBondContact O-CB 3.31Å; V490-F494 WeakPolarHBondContact O-CG 3.42Å; V490-F494 PolarHBondContact O-N 3.48Å; T491-F494 PolarHBondContact O-N 2.98Å; T491-F494 VanDerWaalsContact O-N 3.16Å; T492-F494 VanDerWaalsContact C-N 3.25Å; T492-F494 PolarHBondContact O-N 2.83Å; F494-S496 VanDerWaalsContact C-N 3.33Å; F494-S496 PolarHBondContact O-N 2.85Å; F494-I497 HydrophobicContact CD1-CD1 4.24Å; F494-I497 VanDerWaalsContact O-CG1 3.26Å; F494-I497 WeakPolarHBondContact O-CG1 3.38Å; F494-I497 PolarHBondContact O-N 2.77Å; F494-L498 PolarHBondContact O-N 2.88Å; F494-Y533 HydrophobicContact CB-CE1 3.91Å; F494-Y533 HydrophobicContact CD1-CD1 4.44Å; F494-Y533 HydrophobicContact CD1-CE1 4.1Å; F494-Y533 AromaticContact CG-CE1 3.98Å; F494-Y533 HydrophobicContact CG-CE1 3.98Å; F494-Y533 PolarHBondContact O-OH 3.06Å; F494-Q568 HydrophobicContact CE2-CB 4.11Å; F494-Q568 WeakPolarHBondContact CE2-O 3.26Å; F494-Q568 HydrophobicContact CZ-CB 4.47Å; F494-A569 HydrophobicContact CE2-CB 4.22Å; F494-A569 HydrophobicContact CZ-CB 4.31Å; F494-F572 HydrophobicContact CB-CD1 3.64Å; F494-F572 HydrophobicContact CB-CD2 4.04Å; F494-F572 HydrophobicContact CB-CE1 3.72Å; F494-F572 HydrophobicContact CB-CE2 4.1Å; F494-F572 HydrophobicContact CB-CG 3.82Å; F494-F572 HydrophobicContact CB-CZ 3.95Å; F494-F572 HydrophobicContact CD2-CB 3.75Å; F494-F572 HydrophobicContact CD2-CD1 4.09Å; F494-F572 HydrophobicContact CD2-CD2 4.44Å; F494-F572 AromaticContact CD2-CG 3.8Å; F494-F572 HydrophobicContact CD2-CG 3.8Å; F494-F572 HydrophobicContact CE2-CB 4.43Å; F494-F572 HydrophobicContact CG-CD1 4.28Å; F494-F572 HydrophobicContact CG-CG 4.31Å
495	L	92.5	Very high	76.9	Confident	79 Å²	79	86.7 Å²	86.7	41%	0.414	44%	0.442	S	S	.	.	H	α-helix	trans	-59.8	-42.6	170.7	-77.8	163.8	0	0	0	111.7	T491 T492 I497 L498 F572 V576 L581	T491-L495 WeakPolarHBondContact O-CG 3.43Å; T491-L495 PolarHBondContact O-N 2.85Å; T492-L495 PolarHBondContact O-N 3.5Å; L495-I497 PolarHBondContact O-N 2.79Å; L495-L498 WeakPolarHBondContact O-CB 3.49Å; L495-L498 PolarHBondContact O-N 3.02Å; L495-L498 VanDerWaalsContact O-N 3.13Å; L495-F572 HydrophobicContact CB-CZ 4.45Å; L495-F572 HydrophobicContact CD2-CE2 4.09Å; L495-F572 HydrophobicContact CD2-CZ 3.79Å; L495-F572 HydrophobicContact CG-CE2 3.79Å; L495-F572 HydrophobicContact CG-CZ 3.76Å; L495-V576 HydrophobicContact CD2-CG1 4.38Å; L495-L581 HydrophobicContact CD2-CD1 3.93Å
496	S	91.8	Very high	79.5	Confident	74 Å²	74	82 Å²	82	52%	0.517	42%	0.422	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-6.5	-179.2	63	0	0	0	0	115.2	T492 S493 F494	T492-S496 PolarHBondContact O-N 3.4Å; T492-S496 VanDerWaalsContact O-N 3.11Å; T492-S496 PolarHBondContact O-OG 3.45Å; S493-S496 PolarHBondContact O-OG 3.38Å; F494-S496 VanDerWaalsContact C-N 3.33Å; F494-S496 PolarHBondContact O-N 2.85Å
497	I	93.7	Very high	82	Confident	29 Å²	29	74.2 Å²	74.2	15%	0.149	39%	0.389	C	S	.	.	T	Hydrogen-bonded Turn	trans	-119.2	9.6	175.1	61.3	168.9	0	0	0	113.2	F494 L495 T499 T500 Y533	F494-I497 HydrophobicContact CD1-CD1 4.24Å; F494-I497 VanDerWaalsContact O-CG1 3.26Å; F494-I497 WeakPolarHBondContact O-CG1 3.38Å; F494-I497 PolarHBondContact O-N 2.77Å; L495-I497 PolarHBondContact O-N 2.79Å; I497-T499 PolarHBondContact O-N 2.7Å; I497-T500 PolarHBondContact O-N 2.69Å; I497-T500 VanDerWaalsContact O-N 3.12Å; I497-T500 VanDerWaalsContact O-O 3.12Å; I497-Y533 HydrophobicContact CD1-CD1 4.12Å; I497-Y533 HydrophobicContact CD1-CE1 3.76Å; I497-Y533 HydrophobicContact CG1-CE1 3.9Å
498	L	94.8	Very high	84.4	Confident	11 Å²	11	67.6 Å²	67.6	6%	0.058	38%	0.376	C	S	.	.	S	Bend	trans	-51.4	-52.8	-173.6	-169.1	74.5	0	0	0	112.3	F494 L495 Y533 P551 A552 F572 L573 V576 L581 I582	F494-L498 PolarHBondContact O-N 2.88Å; L495-L498 WeakPolarHBondContact O-CB 3.49Å; L495-L498 PolarHBondContact O-N 3.02Å; L495-L498 VanDerWaalsContact O-N 3.13Å; L498-Y533 VanDerWaalsContact CA-OH 3.28Å; L498-Y533 WeakPolarHBondContact CA-OH 3.5Å; L498-P551 HydrophobicContact CD1-CB 4.4Å; L498-P551 HydrophobicContact CD1-CG 3.85Å; L498-P551 HydrophobicContact CG-CB 4.28Å; L498-P551 HydrophobicContact CG-CG 4.26Å; L498-P551 WeakPolarHBondContact O-CB 3.42Å; L498-A552 PolarHBondContact O-N 2.87Å; L498-A552 VanDerWaalsContact O-N 3.12Å; L498-F572 HydrophobicContact CD1-CE1 4.14Å; L498-F572 HydrophobicContact CD1-CZ 4.49Å; L498-L573 HydrophobicContact CD1-CD2 4.31Å; L498-V576 HydrophobicContact CD1-CG2 4.21Å; L498-L581 HydrophobicContact CD2-CB 3.73Å; L498-L581 HydrophobicContact CD2-CD1 4.07Å; L498-I582 HydrophobicContact CD2-CG1 4.08Å
499	T	94.1	Very high	86.3	Confident	19 Å²	19	64.2 Å²	64.2	12%	0.117	37%	0.371	C	S	.	.	S	Bend	trans	-98	0.2	179.4	59.1	0	0	0	0	113.5	I497 A552 H556 I582 E587	I497-T499 PolarHBondContact O-N 2.7Å; T499-A552 WeakPolarHBondContact O-CB 3.41Å; T499-H556 PolarHBondContact O-CD2 2.93Å; T499-H556 VanDerWaalsContact O-CD2 3.3Å; T499-H556 PolarHBondContact O-NE2 3.41Å; T499-I582 HydrophobicContact CG2-CG1 4.37Å; T499-I582 HydrophobicContact CG2-CG2 4.28Å; T499-E587 WeakPolarHBondContact CB-OE2 3.28Å; T499-E587 HydrophobicContact CG2-CG 3.99Å; T499-E587 VanDerWaalsContact OG1-CD 3.27Å; T499-E587 PolarHBondContact OG1-OE2 3.41Å
500	T	93.6	Very high	87.5	Confident	76 Å²	76	62.6 Å²	62.6	47%	0.466	36%	0.357	S	S	.	.	S	Bend	trans	-94.1	131.5	-179.5	-60.2	0	0	0	0	111.6	I497 S502 A552	I497-T500 PolarHBondContact O-N 2.69Å; I497-T500 VanDerWaalsContact O-N 3.12Å; I497-T500 VanDerWaalsContact O-O 3.12Å; T500-S502 PolarHBondContact O-N 2.9Å; T500-A552 VanDerWaalsContact C-CB 3.45Å; T500-A552 WeakPolarHBondContact O-CB 3.35Å
501	L	92.1	Very high	88.6	Confident	74 Å²	74	63 Å²	63	39%	0.387	36%	0.364	S	S	.	.			trans	-72.3	101.5	176.3	-70.1	171.9	0	0	0	111.2	L503 A552 R553 H556	L501-L503 PolarHBondContact O-N 2.89Å; L501-A552 HydrophobicContact CD2-CB 3.79Å; L501-A552 HydrophobicContact CG-CB 4.16Å; L501-R553 HydrophobicContact CD2-CG 3.74Å; L501-H556 HydrophobicContact CD1-CB 4.15Å
502	S	89.9	Confident	89.5	Confident	38 Å²	38	63.4 Å²	63.4	27%	0.266	36%	0.36	S	S	.	.			trans	-64.6	114.3	174.2	-68.5	0	0	0	0	112.3	T500 Y533	T500-S502 PolarHBondContact O-N 2.9Å; S502-Y533 WeakPolarHBondContact CB-O 3.41Å; S502-Y533 PolarHBondContact OG-O 2.73Å
503	L	88.9	Confident	90.3	Very high	144 Å²	144	64.6 Å²	64.6	75%	0.754	36%	0.359	S	S	*	.			trans	-76.9	150.1	167.7	-60	179.7	0	0	0	111.3	L501 R505	L501-L503 PolarHBondContact O-N 2.89Å; L503-R505 PolarHBondContact O-N 2.86Å
504	E	89.7	Confident	90.7	Very high	109 Å²	109	62.8 Å²	62.8	51%	0.509	35%	0.347	S	S	.	.			trans	-66.9	127.7	173.1	-168.3	-166.6	124.7	0	0	110.7	V530 G535 Y537	E504-V530 HydrophobicContact CG-CG1 4.05Å; E504-V530 HydrophobicContact CG-CG2 4.05Å; E504-G535 WeakPolarHBondContact CA-O 3.33Å; E504-Y537 VanDerWaalsContact CD-OH 3.32Å; E504-Y537 HydrophobicContact CG-CE2 3.83Å; E504-Y537 VanDerWaalsContact OE1-CE2 3.22Å; E504-Y537 WeakPolarHBondContact OE1-CE2 3.39Å; E504-Y537 VanDerWaalsContact OE1-CZ 3.23Å; E504-Y537 PolarHBondContact OE1-OH 2.94Å
505	R	80.7	Confident	90.7	Very high	154 Å²	154	63.8 Å²	63.8	58%	0.581	36%	0.357	S	S	*	.			trans	-95.7	-4.6	-175.6	-62.2	-174.6	176.2	-159.7	-2.9	114.9	L503 A509 G535 W536	L503-R505 PolarHBondContact O-N 2.86Å; R505-A509 HydrophobicContact CB-CB 4.12Å; R505-A509 WeakPolarHBondContact O-CB 3.42Å; R505-G535 PolarHBondContact N-O 3.44Å; R505-W536 HydrophobicContact CB-CE3 4.16Å; R505-W536 HydrophobicContact CB-CZ3 4.02Å
506	G	86.5	Confident	90.6	Very high	22 Å²	22	61 Å²	61	23%	0.227	35%	0.346	C	S	.	.	H	α-helix	trans	72.8	154.1	-175.8	0	0	0	0	0	114.2	T508 A509	G506-T508 VanDerWaalsContact C-N 3.26Å; G506-T508 PolarHBondContact O-N 2.85Å; G506-A509 PolarHBondContact O-N 3.12Å
507	L	88.6	Confident	90.6	Very high	32 Å²	32	59.5 Å²	59.5	17%	0.168	34%	0.336	C	S	.	.	H	α-helix	trans	-61.2	-31.5	-179.9	-82.4	164.3	0	0	0	113.8	A509 Q510 S511 F512 I521 A528 Y537	L507-A509 PolarHBondContact O-N 3.24Å; L507-Q510 CarbonylContact O-C 3.4Å; L507-Q510 VanDerWaalsContact O-CG 3.26Å; L507-Q510 WeakPolarHBondContact O-CG 3.5Å; L507-Q510 PolarHBondContact O-N 3.06Å; L507-S511 PolarHBondContact O-N 3.32Å; L507-F512 HydrophobicContact CB-CD1 3.82Å; L507-F512 HydrophobicContact CB-CE1 3.84Å; L507-F512 HydrophobicContact CD1-CD1 4.47Å; L507-F512 PolarHBondContact O-N 3.37Å; L507-I521 HydrophobicContact CD2-CD1 3.79Å; L507-I521 HydrophobicContact CD2-CG1 3.87Å; L507-A528 HydrophobicContact CD1-CB 4.16Å; L507-A528 HydrophobicContact CD2-CB 3.91Å; L507-Y537 HydrophobicContact CD1-CD1 4.36Å; L507-Y537 HydrophobicContact CD1-CE1 4.27Å; L507-Y537 HydrophobicContact CD2-CD1 3.98Å; L507-Y537 HydrophobicContact CD2-CD2 4.28Å; L507-Y537 HydrophobicContact CD2-CG 3.74Å; L507-Y537 HydrophobicContact CG-CD1 3.91Å; L507-Y537 HydrophobicContact CG-CD2 4.02Å; L507-Y537 HydrophobicContact CG-CE1 4.08Å; L507-Y537 HydrophobicContact CG-CE2 4.25Å; L507-Y537 HydrophobicContact CG-CG 3.84Å
508	T	88.9	Confident	90.5	Very high	106 Å²	106	64 Å²	64	65%	0.65	36%	0.356	S	S	*	.	H	α-helix	trans	-64.3	-39	-179.3	-46.4	0	0	0	0	112.3	G506 Q510 S511	G506-T508 VanDerWaalsContact C-N 3.26Å; G506-T508 PolarHBondContact O-N 2.85Å; T508-Q510 PolarHBondContact O-N 3.41Å; T508-S511 PolarHBondContact O-N 3.32Å
509	A	88.2	Confident	90.3	Very high	64 Å²	64	70.4 Å²	70.4	53%	0.529	38%	0.38	S	S	.	.	H	α-helix	trans	-65.9	-18.8	-179.2	0	0	0	0	0	113.7	R505 G506 L507 W536	R505-A509 HydrophobicContact CB-CB 4.12Å; R505-A509 WeakPolarHBondContact O-CB 3.42Å; G506-A509 PolarHBondContact O-N 3.12Å; L507-A509 PolarHBondContact O-N 3.24Å; A509-W536 HydrophobicContact CB-CZ3 4.26Å
510	Q	90.3	Very high	90.2	Very high	21 Å²	21	72.7 Å²	72.7	10%	0.098	40%	0.397	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111	21.1	173.7	57.5	-173.9	98.7	0	0	112.4	L507 T508 F512 K513 W536 Y537	L507-Q510 CarbonylContact O-C 3.4Å; L507-Q510 VanDerWaalsContact O-CG 3.26Å; L507-Q510 WeakPolarHBondContact O-CG 3.5Å; L507-Q510 PolarHBondContact O-N 3.06Å; T508-Q510 PolarHBondContact O-N 3.41Å; Q510-F512 PolarHBondContact O-N 3.14Å; Q510-F512 VanDerWaalsContact O-N 3.12Å; Q510-K513 PolarHBondContact NE2-O 3.08Å; Q510-K513 PolarHBondContact O-N 3.03Å; Q510-W536 HydrophobicContact CB-CE3 4Å; Q510-W536 HydrophobicContact CB-CZ3 3.96Å; Q510-W536 HydrophobicContact CG-CE3 4.42Å; Q510-Y537 PolarHBondContact NE2-O 3.12Å
511	S	91.4	Very high	90.1	Very high	86 Å²	86	69.5 Å²	69.5	60%	0.601	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.9	36.7	176.4	-49.3	0	0	0	0	113.7	L507 T508 K513	L507-S511 PolarHBondContact O-N 3.32Å; T508-S511 PolarHBondContact O-N 3.32Å; S511-K513 PolarHBondContact O-N 3.19Å
512	F	91.4	Very high	89.7	Confident	78 Å²	78	66.6 Å²	66.6	34%	0.342	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.8	23.8	-175.3	-61.3	-92.4	0	0	0	114.8	L507 Q510 S520 I521	L507-F512 HydrophobicContact CB-CD1 3.82Å; L507-F512 HydrophobicContact CB-CE1 3.84Å; L507-F512 HydrophobicContact CD1-CD1 4.47Å; L507-F512 PolarHBondContact O-N 3.37Å; Q510-F512 PolarHBondContact O-N 3.14Å; Q510-F512 VanDerWaalsContact O-N 3.12Å; F512-S520 CarbonylContact O-C 3.49Å; F512-S520 VanDerWaalsContact O-CA 3.26Å; F512-S520 WeakPolarHBondContact O-CA 3.18Å; F512-I521 WeakPolarHBondContact O-CG1 3.25Å; F512-I521 PolarHBondContact O-N 3.01Å
513	K	92.2	Very high	88.9	Confident	93 Å²	93	73 Å²	73	40%	0.404	40%	0.395	S	S	.	.	B	Isolated β-bridge	trans	-107.1	138.4	177.3	-67.5	175.8	-175.2	177	0	111.5	Q510 S511 A515 Q518	Q510-K513 PolarHBondContact NE2-O 3.08Å; Q510-K513 PolarHBondContact O-N 3.03Å; S511-K513 PolarHBondContact O-N 3.19Å; K513-A515 PolarHBondContact O-N 2.94Å; K513-Q518 WeakPolarHBondContact CG-O 3.49Å
514	C	92.8	Very high	88.1	Confident	0 Å²	0	71.3 Å²	71.3	0%	0	40%	0.395	C	S	.	.			trans	-57.6	122.7	174.5	173.2	0	0	0	0	110.9	G516 C517 Q518 R519 I521 C539	C514-G516 VanDerWaalsContact C-N 3.26Å; C514-G516 PolarHBondContact O-N 2.82Å; C514-C517 PolarHBondContact O-N 3.39Å; C514-C517 VanDerWaalsContact SG-SG 3.61Å; C514-Q518 VanDerWaalsContact O-CA 3.24Å; C514-Q518 WeakPolarHBondContact O-CA 3.49Å; C514-Q518 PolarHBondContact O-N 3.22Å; C514-Q518 PolarHBondContact O-NE2 3Å; C514-R519 WeakPolarHBondContact CB-O 3.41Å; C514-R519 PolarHBondContact N-O 3.31Å; C514-I521 HydrophobicContact CB-CD1 4.09Å; C514-I521 HydrophobicContact CB-CG2 4.12Å; C514-C539 HydrophobicContact CB-CB 4.21Å; C514-C539 PolarHBondContact SG-N 3.1Å; C514-C539 VanDerWaalsContact SG-SG 3.68Å
515	A	92.2	Very high	87.1	Confident	31 Å²	31	70.6 Å²	70.6	26%	0.256	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.2	-42.7	-178.1	0	0	0	0	0	112.4	K513 Q518 W536 Y537 Y538	K513-A515 PolarHBondContact O-N 2.94Å; A515-Q518 PolarHBondContact O-NE2 3.28Å; A515-W536 HydrophobicContact CB-CB 3.88Å; A515-W536 HydrophobicContact CB-CG 4.37Å; A515-Y537 PolarHBondContact N-O 3.31Å; A515-Y537 VanDerWaalsContact N-O 3.12Å; A515-Y538 HydrophobicContact CB-CD1 4.35Å; A515-Y538 HydrophobicContact CB-CE1 3.89Å; A515-Y538 HydrophobicContact CB-CE2 4.26Å
516	G	90.9	Very high	86.8	Confident	19 Å²	19	65.4 Å²	65.4	20%	0.196	39%	0.389	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.7	-25.9	-176	0	0	0	0	0	116.9	C514 Q568	C514-G516 VanDerWaalsContact C-N 3.26Å; C514-G516 PolarHBondContact O-N 2.82Å; G516-Q568 PolarHBondContact O-NE2 3Å
517	C	92.3	Very high	86.7	Confident	44 Å²	44	73.3 Å²	73.3	30%	0.297	42%	0.417	S	S	.	.	T	Hydrogen-bonded Turn	trans	-139.3	10.6	-176	80.7	0	0	0	0	115.4	C514 R519 C539	C514-C517 PolarHBondContact O-N 3.39Å; C514-C517 VanDerWaalsContact SG-SG 3.61Å; C517-R519 PolarHBondContact O-N 3.1Å; C517-R519 PolarHBondContact SG-NE 3.23Å; C517-R519 VanDerWaalsContact SG-NE 3.37Å; C517-C539 VanDerWaalsContact SG-SG 3.64Å
518	Q	92.1	Very high	86.8	Confident	123 Å²	123	73 Å²	73	58%	0.575	42%	0.419	S	S	*	.			trans	58.1	-2.8	171	-57.1	-62.6	-47.8	0	0	118.1	K513 C514 A515	K513-Q518 WeakPolarHBondContact CG-O 3.49Å; C514-Q518 VanDerWaalsContact O-CA 3.24Å; C514-Q518 WeakPolarHBondContact O-CA 3.49Å; C514-Q518 PolarHBondContact O-N 3.22Å; C514-Q518 PolarHBondContact O-NE2 3Å; A515-Q518 PolarHBondContact O-NE2 3.28Å
519	R	90.6	Very high	87	Confident	146 Å²	146	70.6 Å²	70.6	55%	0.551	40%	0.4	S	S	*	.			trans	-64.7	142.4	169.2	-70.4	-177.1	-69.1	163.9	2.4	111.4	C514 C517 S541	C514-R519 WeakPolarHBondContact CB-O 3.41Å; C514-R519 PolarHBondContact N-O 3.31Å; C517-R519 PolarHBondContact O-N 3.1Å; C517-R519 PolarHBondContact SG-NE 3.23Å; C517-R519 VanDerWaalsContact SG-NE 3.37Å; R519-S541 PolarHBondContact NH2-OG 3.18Å
520	S	91	Very high	87.3	Confident	67 Å²	67	69.3 Å²	69.3	47%	0.469	39%	0.385	S	S	.	.	B	Isolated β-bridge	trans	-63.2	142	177.9	-47.1	0	0	0	0	112.5	F512 N525	F512-S520 CarbonylContact O-C 3.49Å; F512-S520 VanDerWaalsContact O-CA 3.26Å; F512-S520 WeakPolarHBondContact O-CA 3.18Å; S520-N525 WeakPolarHBondContact O-CB 3.39Å
521	I	90.9	Very high	87.6	Confident	9 Å²	9	68.3 Å²	68.3	5%	0.046	38%	0.38	C	S	.	.			trans	-143.4	157.6	-175.6	51.6	172.3	0	0	0	111.1	L507 F512 C514 A528 C539	L507-I521 HydrophobicContact CD2-CD1 3.79Å; L507-I521 HydrophobicContact CD2-CG1 3.87Å; F512-I521 WeakPolarHBondContact O-CG1 3.25Å; F512-I521 PolarHBondContact O-N 3.01Å; C514-I521 HydrophobicContact CB-CD1 4.09Å; C514-I521 HydrophobicContact CB-CG2 4.12Å; I521-A528 HydrophobicContact CB-CB 4.25Å; I521-A528 HydrophobicContact CD1-CB 3.91Å; I521-A528 HydrophobicContact CG1-CB 4.34Å; I521-C539 HydrophobicContact CG2-CB 3.53Å
522	G	83.3	Confident	87.8	Confident	13 Å²	13	66.9 Å²	66.9	13%	0.134	37%	0.366	C	S	.	.	S	Bend	trans	105.2	-138.5	-178.5	0	0	0	0	0	112.2	S524 N525 G526	G522-S524 VanDerWaalsContact C-N 3.31Å; G522-S524 PolarHBondContact O-N 2.93Å; G522-N525 PolarHBondContact O-N 2.79Å; G522-G526 PolarHBondContact N-O 2.88Å
523	L	73.3	Confident	88	Confident	172 Å²	172	63.3 Å²	63.3	90%	0.901	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-29.5	-53	-163.3	-66.6	167.1	0	0	0	116.6
524	S	72.4	Confident	88.1	Confident	108 Å²	108	59 Å²	59	76%	0.755	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.2	-7.8	179.8	51.1	0	0	0	0	114.8	G522	G522-S524 VanDerWaalsContact C-N 3.31Å; G522-S524 PolarHBondContact O-N 2.93Å
525	N	68.6	Low	88.1	Confident	94 Å²	94	59.1 Å²	59.1	50%	0.503	33%	0.333	S	S	.	.	S	Bend	trans	-116.2	27.4	-162.2	-72.6	46	0	0	0	113.2	S520 G522	S520-N525 WeakPolarHBondContact O-CB 3.39Å; G522-N525 PolarHBondContact O-N 2.79Å
526	G	74.1	Confident	88.2	Confident	45 Å²	45	61.2 Å²	61.2	46%	0.464	33%	0.334	S	S	.	.			trans	86	158.9	178.6	0	0	0	0	0	114.1	G522 A528	G522-G526 PolarHBondContact N-O 2.88Å; G526-A528 PolarHBondContact O-N 3.3Å
527	K	85.3	Confident	88.4	Confident	188 Å²	188	62.3 Å²	62.3	82%	0.817	33%	0.333	S	S	*	.			trans	-62.8	118.7	-176	-66.4	-172.6	178.7	-176.3	0	110.9
528	A	91.3	Very high	88.5	Confident	25 Å²	25	60.4 Å²	60.4	21%	0.207	32%	0.319	C	S	.	.			trans	-76	153.4	170.8	0	0	0	0	0	110.8	L507 I521 G526 Y537	L507-A528 HydrophobicContact CD1-CB 4.16Å; L507-A528 HydrophobicContact CD2-CB 3.91Å; I521-A528 HydrophobicContact CB-CB 4.25Å; I521-A528 HydrophobicContact CD1-CB 3.91Å; I521-A528 HydrophobicContact CG1-CB 4.34Å; G526-A528 PolarHBondContact O-N 3.3Å; A528-Y537 HydrophobicContact CB-CD1 3.56Å; A528-Y537 HydrophobicContact CB-CE1 4.29Å; A528-Y537 HydrophobicContact CB-CG 4.39Å
529	K	93.3	Very high	88.6	Confident	57 Å²	57	55.2 Å²	55.2	25%	0.248	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	136.6	-178.6	-64.1	176.8	169.8	-167.7	0	111.4	Y537 Y538 H543 D545	K529-Y537 CarbonylContact O-C 3.55Å; K529-Y537 VanDerWaalsContact O-CA 3.3Å; K529-Y537 WeakPolarHBondContact O-CA 3.3Å; K529-Y538 PolarHBondContact N-O 2.89Å; K529-Y538 PolarHBondContact O-N 2.66Å; K529-H543 HydrophobicContact CB-CB 4.12Å; K529-H543 HydrophobicContact CD-CB 4.05Å; K529-H543 VanDerWaalsContact CD-O 3.24Å; K529-H543 WeakPolarHBondContact CD-O 3.38Å; K529-H543 PolarHBondContact NZ-O 2.97Å; K529-D545 WeakPolarHBondContact CD-OD1 3.46Å; K529-D545 WeakPolarHBondContact CE-OD1 3.46Å; K529-D545 VanDerWaalsContact NZ-CG 3.26Å; K529-D545 IonicContact NZ-OD1 2.87Å; K529-D545 PolarHBondContact NZ-OD1 3.05Å; K529-D545 IonicContact NZ-OD2 3.41Å; K529-D545 PolarHBondContact NZ-OD2 3.26Å
530	V	94.5	Very high	88.7	Confident	37 Å²	37	51.3 Å²	51.3	22%	0.224	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	130.6	179.7	-176.4	0	0	0	0	110.8	E504 Y537 H543	E504-V530 HydrophobicContact CG-CG1 4.05Å; E504-V530 HydrophobicContact CG-CG2 4.05Å; V530-Y537 HydrophobicContact CG2-CD1 3.71Å; V530-Y537 HydrophobicContact CG2-CD2 3.98Å; V530-Y537 HydrophobicContact CG2-CE1 3.43Å; V530-Y537 VanDerWaalsContact CG2-CE1 3.43Å; V530-Y537 HydrophobicContact CG2-CE2 3.64Å; V530-Y537 HydrophobicContact CG2-CG 4.02Å; V530-H543 PolarHBondContact O-NE2 2.82Å; V530-H543 VanDerWaalsContact O-NE2 3.16Å
531	C	95.6	Very high	88.8	Confident	0 Å²	0	51 Å²	51	0%	0	29%	0.289	C	S	.	.			trans	-81	121.1	170	178.4	0	0	0	0	110.4	Y533 S534 G535 W536 Y538 S566	C531-Y533 PolarHBondContact O-N 3.19Å; C531-S534 WeakPolarHBondContact CB-OG 3.47Å; C531-S534 PolarHBondContact O-N 2.97Å; C531-G535 PolarHBondContact O-N 2.78Å; C531-W536 PolarHBondContact N-O 2.79Å; C531-Y538 HydrophobicContact CB-CD2 3.86Å; C531-Y538 HydrophobicContact CB-CE2 3.48Å; C531-Y538 VanDerWaalsContact CB-CE2 3.48Å; C531-S566 PolarHBondContact SG-N 3.01Å
532	N	95.8	Very high	88.9	Confident	55 Å²	55	51.6 Å²	51.6	29%	0.294	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-11.7	-178.9	-73.8	-92.2	0	0	0	114.3	I550 Y563 K564	N532-I550 HydrophobicContact CB-CD1 4.38Å; N532-Y563 HydrophobicContact CB-CD1 4.37Å; N532-Y563 HydrophobicContact CB-CG 4.21Å; N532-K564 WeakPolarHBondContact CB-O 3.39Å; N532-K564 PolarHBondContact N-O 3.23Å; N532-K564 PolarHBondContact ND2-O 3.06Å
533	Y	95.8	Very high	89.5	Confident	3 Å²	3	51.1 Å²	51.1	1%	0.012	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.5	-46.3	172.4	-177.6	-107.3	0	0	0	112.4	F494 I497 L498 S502 C531 I550 P551 A569 F572 L573	F494-Y533 HydrophobicContact CB-CE1 3.91Å; F494-Y533 HydrophobicContact CD1-CD1 4.44Å; F494-Y533 HydrophobicContact CD1-CE1 4.1Å; F494-Y533 AromaticContact CG-CE1 3.98Å; F494-Y533 HydrophobicContact CG-CE1 3.98Å; F494-Y533 PolarHBondContact O-OH 3.06Å; I497-Y533 HydrophobicContact CD1-CD1 4.12Å; I497-Y533 HydrophobicContact CD1-CE1 3.76Å; I497-Y533 HydrophobicContact CG1-CE1 3.9Å; L498-Y533 VanDerWaalsContact CA-OH 3.28Å; L498-Y533 WeakPolarHBondContact CA-OH 3.5Å; S502-Y533 WeakPolarHBondContact CB-O 3.41Å; S502-Y533 PolarHBondContact OG-O 2.73Å; C531-Y533 PolarHBondContact O-N 3.19Å; Y533-I550 HydrophobicContact CD2-CD1 4.42Å; Y533-I550 HydrophobicContact CD2-CG2 4.37Å; Y533-P551 HydrophobicContact CE2-CG 4.31Å; Y533-A569 HydrophobicContact CD1-CB 3.95Å; Y533-A569 HydrophobicContact CG-CB 4.38Å; Y533-F572 HydrophobicContact CE1-CD1 4.16Å; Y533-F572 HydrophobicContact CE1-CE1 4.24Å; Y533-F572 WeakPolarHBondContact OH-CE1 3.35Å; Y533-L573 HydrophobicContact CD2-CD1 3.85Å; Y533-L573 HydrophobicContact CD2-CD2 4.14Å; Y533-L573 HydrophobicContact CD2-CG 4.39Å; Y533-L573 HydrophobicContact CE2-CD1 4.31Å; Y533-L573 HydrophobicContact CE2-CD2 3.76Å; Y533-L573 HydrophobicContact CE2-CG 4.38Å; Y533-L573 HydrophobicContact CG-CD1 4.01Å
534	S	93.6	Very high	90.6	Very high	4 Å²	4	46.3 Å²	46.3	3%	0.028	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.5	-6.2	-167.8	68	0	0	0	0	115.5	C531 W536 Y538	C531-S534 WeakPolarHBondContact CB-OG 3.47Å; C531-S534 PolarHBondContact O-N 2.97Å; S534-W536 PolarHBondContact O-N 3.19Å; S534-W536 VanDerWaalsContact O-N 3.08Å; S534-Y538 PolarHBondContact OG-OH 2.98Å
535	G	93.9	Very high	91.6	Very high	2 Å²	2	43.3 Å²	43.3	2%	0.021	24%	0.242	C	C	.	.			trans	69.4	0.9	178	0	0	0	0	0	115.5	E504 R505 C531	E504-G535 WeakPolarHBondContact CA-O 3.33Å; R505-G535 PolarHBondContact N-O 3.44Å; C531-G535 PolarHBondContact O-N 2.78Å
536	W	94.3	Very high	92.9	Very high	74 Å²	74	41 Å²	41	28%	0.28	23%	0.229	S	C	.	.			trans	-97.4	155.8	-179.9	-62	108.3	0	0	0	112.6	R505 A509 Q510 A515 C531 S534 Y538	R505-W536 HydrophobicContact CB-CE3 4.16Å; R505-W536 HydrophobicContact CB-CZ3 4.02Å; A509-W536 HydrophobicContact CB-CZ3 4.26Å; Q510-W536 HydrophobicContact CB-CE3 4Å; Q510-W536 HydrophobicContact CB-CZ3 3.96Å; Q510-W536 HydrophobicContact CG-CE3 4.42Å; A515-W536 HydrophobicContact CB-CB 3.88Å; A515-W536 HydrophobicContact CB-CG 4.37Å; C531-W536 PolarHBondContact N-O 2.79Å; S534-W536 PolarHBondContact O-N 3.19Å; S534-W536 VanDerWaalsContact O-N 3.08Å; W536-Y538 HydrophobicContact CB-CE2 4.02Å; W536-Y538 VanDerWaalsContact O-CD2 3.25Å; W536-Y538 WeakPolarHBondContact O-CD2 3.38Å; W536-Y538 WeakPolarHBondContact O-CE2 3.45Å
537	Y	94.3	Very high	94	Very high	42 Å²	42	41.6 Å²	41.6	17%	0.165	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	144.8	174.4	-74.3	-101.8	0	0	0	113.3	E504 L507 Q510 A515 A528 K529 V530	E504-Y537 VanDerWaalsContact CD-OH 3.32Å; E504-Y537 HydrophobicContact CG-CE2 3.83Å; E504-Y537 VanDerWaalsContact OE1-CE2 3.22Å; E504-Y537 WeakPolarHBondContact OE1-CE2 3.39Å; E504-Y537 VanDerWaalsContact OE1-CZ 3.23Å; E504-Y537 PolarHBondContact OE1-OH 2.94Å; L507-Y537 HydrophobicContact CD1-CD1 4.36Å; L507-Y537 HydrophobicContact CD1-CE1 4.27Å; L507-Y537 HydrophobicContact CD2-CD1 3.98Å; L507-Y537 HydrophobicContact CD2-CD2 4.28Å; L507-Y537 HydrophobicContact CD2-CG 3.74Å; L507-Y537 HydrophobicContact CG-CD1 3.91Å; L507-Y537 HydrophobicContact CG-CD2 4.02Å; L507-Y537 HydrophobicContact CG-CE1 4.08Å; L507-Y537 HydrophobicContact CG-CE2 4.25Å; L507-Y537 HydrophobicContact CG-CG 3.84Å; Q510-Y537 PolarHBondContact NE2-O 3.12Å; A515-Y537 PolarHBondContact N-O 3.31Å; A515-Y537 VanDerWaalsContact N-O 3.12Å; A528-Y537 HydrophobicContact CB-CD1 3.56Å; A528-Y537 HydrophobicContact CB-CE1 4.29Å; A528-Y537 HydrophobicContact CB-CG 4.39Å; K529-Y537 CarbonylContact O-C 3.55Å; K529-Y537 VanDerWaalsContact O-CA 3.3Å; K529-Y537 WeakPolarHBondContact O-CA 3.3Å; V530-Y537 HydrophobicContact CG2-CD1 3.71Å; V530-Y537 HydrophobicContact CG2-CD2 3.98Å; V530-Y537 HydrophobicContact CG2-CE1 3.43Å; V530-Y537 VanDerWaalsContact CG2-CE1 3.43Å; V530-Y537 HydrophobicContact CG2-CE2 3.64Å; V530-Y537 HydrophobicContact CG2-CG 4.02Å
538	Y	94.1	Very high	94.6	Very high	4 Å²	4	33.9 Å²	33.9	2%	0.016	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	156.7	-178.8	-66.5	-99.8	0	0	0	111.1	A515 K529 C531 S534 W536 C542 S566	A515-Y538 HydrophobicContact CB-CD1 4.35Å; A515-Y538 HydrophobicContact CB-CE1 3.89Å; A515-Y538 HydrophobicContact CB-CE2 4.26Å; K529-Y538 PolarHBondContact N-O 2.89Å; K529-Y538 PolarHBondContact O-N 2.66Å; C531-Y538 HydrophobicContact CB-CD2 3.86Å; C531-Y538 HydrophobicContact CB-CE2 3.48Å; C531-Y538 VanDerWaalsContact CB-CE2 3.48Å; S534-Y538 PolarHBondContact OG-OH 2.98Å; W536-Y538 HydrophobicContact CB-CE2 4.02Å; W536-Y538 VanDerWaalsContact O-CD2 3.25Å; W536-Y538 WeakPolarHBondContact O-CD2 3.38Å; W536-Y538 WeakPolarHBondContact O-CE2 3.45Å; Y538-C542 HydrophobicContact CD1-CB 4.05Å; Y538-S566 VanDerWaalsContact CZ-OG 3.26Å; Y538-S566 PolarHBondContact OH-OG 3.14Å
539	C	94.1	Very high	94.9	Very high	14 Å²	14	33.1 Å²	33.1	10%	0.095	19%	0.185	C	C	.	.			trans	-77.9	158.8	169.7	71.7	0	0	0	0	111.8	C514 C517 I521 S541 C542 H543	C514-C539 HydrophobicContact CB-CB 4.21Å; C514-C539 PolarHBondContact SG-N 3.1Å; C514-C539 VanDerWaalsContact SG-SG 3.68Å; C517-C539 VanDerWaalsContact SG-SG 3.64Å; I521-C539 HydrophobicContact CG2-CB 3.53Å; C539-S541 PolarHBondContact O-N 2.7Å; C539-S541 PolarHBondContact SG-OG 3Å; C539-C542 PolarHBondContact O-N 3.03Å; C539-H543 PolarHBondContact O-N 3.02Å
540	S	93.1	Very high	95.1	Very high	65 Å²	65	30.7 Å²	30.7	46%	0.455	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.5	-27	-177.3	-48	0	0	0	0	115.5	H543	S540-H543 CarbonylContact O-C 3.59Å
541	S	93.2	Very high	95.2	Very high	59 Å²	59	28.9 Å²	28.9	41%	0.413	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.9	-24.7	177.1	63	0	0	0	0	113.8	R519 C539 K567	R519-S541 PolarHBondContact NH2-OG 3.18Å; C539-S541 PolarHBondContact O-N 2.7Å; C539-S541 PolarHBondContact SG-OG 3Å; S541-K567 PolarHBondContact O-NZ 3.17Å
542	C	94.2	Very high	95.2	Very high	22 Å²	22	29 Å²	29	15%	0.149	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.7	-15.5	177.1	-63.1	0	0	0	0	112.8	Y538 C539 K567	Y538-C542 HydrophobicContact CD1-CB 4.05Å; C539-C542 PolarHBondContact O-N 3.03Å; C542-K567 PolarHBondContact O-N 2.85Å
543	H	95.5	Very high	95.2	Very high	3 Å²	3	29.7 Å²	29.7	1%	0.014	16%	0.164	C	C	.	.			trans	-134.3	90.1	178.9	-164.2	-67	0	0	0	109.9	K529 V530 C539 S540 D545 V565 S566	K529-H543 HydrophobicContact CB-CB 4.12Å; K529-H543 HydrophobicContact CD-CB 4.05Å; K529-H543 VanDerWaalsContact CD-O 3.24Å; K529-H543 WeakPolarHBondContact CD-O 3.38Å; K529-H543 PolarHBondContact NZ-O 2.97Å; V530-H543 PolarHBondContact O-NE2 2.82Å; V530-H543 VanDerWaalsContact O-NE2 3.16Å; C539-H543 PolarHBondContact O-N 3.02Å; S540-H543 CarbonylContact O-C 3.59Å; H543-D545 VanDerWaalsContact C-N 3.3Å; H543-D545 IonicContact CE1-OD1 2.74Å; H543-D545 PolarHBondContact CE1-OD1 3.36Å; H543-D545 IonicContact ND1-OD1 3.69Å; H543-D545 PolarHBondContact ND1-OD1 2.8Å; H543-V565 VanDerWaalsContact CD2-C 3.49Å; H543-V565 VanDerWaalsContact NE2-C 3.33Å; H543-V565 PolarHBondContact NE2-O 3.03Å; H543-S566 PolarHBondContact CD2-N 3.23Å
544	V	94.9	Very high	95.3	Very high	72 Å²	72	29.6 Å²	29.6	44%	0.436	16%	0.163	S	C	.	.			trans	-93.1	10.2	-178.3	-60.7	0	0	0	0	113	D546 K567	V544-D546 VanDerWaalsContact C-N 3.34Å; V544-D546 WeakPolarHBondContact CG2-OD2 3.46Å; V544-K567 HydrophobicContact CG2-CG 4.34Å
545	D	95	Very high	95.4	Very high	45 Å²	45	29.4 Å²	29.4	24%	0.241	16%	0.162	C	C	.	.			trans	70.8	22.8	177.9	-60.4	9.2	0	0	0	115	K529 H543 S547 K564	K529-D545 WeakPolarHBondContact CD-OD1 3.46Å; K529-D545 WeakPolarHBondContact CE-OD1 3.46Å; K529-D545 VanDerWaalsContact NZ-CG 3.26Å; K529-D545 IonicContact NZ-OD1 2.87Å; K529-D545 PolarHBondContact NZ-OD1 3.05Å; K529-D545 IonicContact NZ-OD2 3.41Å; K529-D545 PolarHBondContact NZ-OD2 3.26Å; H543-D545 VanDerWaalsContact C-N 3.3Å; H543-D545 IonicContact CE1-OD1 2.74Å; H543-D545 PolarHBondContact CE1-OD1 3.36Å; H543-D545 IonicContact ND1-OD1 3.69Å; H543-D545 PolarHBondContact ND1-OD1 2.8Å; D545-S547 PolarHBondContact O-N 3.01Å; D545-S547 PolarHBondContact O-OG 2.85Å; D545-K564 HydrophobicContact CB-CD 3.74Å; D545-K564 HydrophobicContact CB-CG 4.15Å; D545-K564 IonicContact OD2-NZ 2.68Å; D545-K564 PolarHBondContact OD2-NZ 3.19Å
546	D	95.7	Very high	95.5	Very high	44 Å²	44	32.5 Å²	32.5	24%	0.235	18%	0.175	C	C	.	.			trans	-42.3	134.3	156.7	-78	-71.5	0	0	0	110.3	V544 K564 V565 K570	V544-D546 VanDerWaalsContact C-N 3.34Å; V544-D546 WeakPolarHBondContact CG2-OD2 3.46Å; D546-K564 CarbonylContact O-C 3.5Å; D546-K564 WeakPolarHBondContact O-CA 3.45Å; D546-V565 HydrophobicContact CB-CG2 4.47Å; D546-V565 WeakPolarHBondContact O-CG2 3.28Å; D546-V565 PolarHBondContact O-N 2.85Å; D546-K570 HydrophobicContact CB-CD 3.84Å; D546-K570 HydrophobicContact CB-CG 4.38Å; D546-K570 VanDerWaalsContact OD1-CE 3.28Å; D546-K570 WeakPolarHBondContact OD1-CE 3.36Å; D546-K570 IonicContact OD1-NZ 3.66Å; D546-K570 PolarHBondContact OD1-NZ 2.78Å
547	S	96.9	Very high	95.5	Very high	58 Å²	58	33.9 Å²	33.9	41%	0.406	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	126.4	-174.5	-62	0	0	0	0	111.5	D545 Y563	D545-S547 PolarHBondContact O-N 3.01Å; D545-S547 PolarHBondContact O-OG 2.85Å; S547-Y563 CarbonylContact C-O 3.57Å; S547-Y563 VanDerWaalsContact CA-O 3.28Å; S547-Y563 WeakPolarHBondContact CA-O 3Å
548	F	97.5	Very high	95.5	Very high	27 Å²	27	34.2 Å²	34.2	12%	0.118	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	162.8	-174	-150.2	-92.5	0	0	0	111.3	K562 Y563 V565 K570 L573 E574 Y577	F548-K562 CarbonylContact O-C 3.58Å; F548-K562 WeakPolarHBondContact O-CA 3.24Å; F548-Y563 PolarHBondContact N-O 2.76Å; F548-Y563 PolarHBondContact O-N 2.95Å; F548-V565 HydrophobicContact CB-CG2 4.02Å; F548-K570 HydrophobicContact CD2-CG 4.23Å; F548-L573 HydrophobicContact CD1-CB 3.68Å; F548-L573 HydrophobicContact CD1-CD1 3.85Å; F548-L573 HydrophobicContact CD1-CG 4.32Å; F548-L573 HydrophobicContact CE1-CB 3.58Å; F548-L573 HydrophobicContact CG-CB 4.4Å; F548-L573 HydrophobicContact CG-CD1 4.44Å; F548-L573 HydrophobicContact CZ-CB 4.18Å; F548-E574 HydrophobicContact CD2-CG 4.38Å; F548-E574 HydrophobicContact CE2-CG 3.58Å; F548-E574 HydrophobicContact CZ-CG 4.09Å; F548-Y577 HydrophobicContact CE1-CD2 4.35Å; F548-Y577 AromaticContact CZ-CD2 3.93Å; F548-Y577 HydrophobicContact CZ-CD2 3.93Å; F548-Y577 HydrophobicContact CZ-CE2 4.39Å
549	L	96.9	Very high	95.6	Very high	8 Å²	8	35.1 Å²	35.1	4%	0.042	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	134.6	173.7	-71.5	175.8	0	0	0	110.5	I554 T560 K562 Q649	L549-I554 HydrophobicContact CB-CD1 4.03Å; L549-I554 HydrophobicContact CD1-CD1 4.2Å; L549-I554 HydrophobicContact CD2-CD1 4.41Å; L549-I554 HydrophobicContact CG-CD1 4.44Å; L549-T560 VanDerWaalsContact CD2-O 3.26Å; L549-T560 WeakPolarHBondContact CD2-O 3.33Å; L549-K562 HydrophobicContact CD2-CG 3.83Å; L549-K562 HydrophobicContact CG-CG 4.15Å; L549-Q649 HydrophobicContact CD1-CB 4.02Å; L549-Q649 HydrophobicContact CD1-CG 3.87Å
550	I	97.5	Very high	95.7	Very high	6 Å²	6	37.6 Å²	37.6	3%	0.031	21%	0.209	C	C	.	.			trans	-97.3	116.6	-179.7	-53.9	-58.1	0	0	0	108.8	N532 Y533 A552 R553 I554 Y563 V565	N532-I550 HydrophobicContact CB-CD1 4.38Å; Y533-I550 HydrophobicContact CD2-CD1 4.42Å; Y533-I550 HydrophobicContact CD2-CG2 4.37Å; I550-A552 PolarHBondContact O-N 3.38Å; I550-R553 HydrophobicContact CB-CB 4.02Å; I550-R553 HydrophobicContact CB-CG 3.87Å; I550-R553 HydrophobicContact CG2-CB 4.26Å; I550-R553 HydrophobicContact CG2-CG 3.78Å; I550-R553 WeakPolarHBondContact O-CB 3.24Å; I550-R553 PolarHBondContact O-N 3.27Å; I550-I554 PolarHBondContact O-N 3.48Å; I550-Y563 HydrophobicContact CG1-CD2 3.9Å; I550-Y563 HydrophobicContact CG1-CG 4.18Å; I550-V565 HydrophobicContact CD1-CG1 3.76Å
551	P	97.1	Very high	95.9	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-61.9	-48.5	-169.4	-16.6	27.2	0	0	0	112.1	L498 Y533 R553 I554 V555 L573 I582 L645	L498-P551 HydrophobicContact CD1-CB 4.4Å; L498-P551 HydrophobicContact CD1-CG 3.85Å; L498-P551 HydrophobicContact CG-CB 4.28Å; L498-P551 HydrophobicContact CG-CG 4.26Å; L498-P551 WeakPolarHBondContact O-CB 3.42Å; Y533-P551 HydrophobicContact CE2-CG 4.31Å; P551-R553 PolarHBondContact O-N 2.86Å; P551-R553 VanDerWaalsContact O-N 3.13Å; P551-I554 PolarHBondContact O-N 2.79Å; P551-I554 VanDerWaalsContact O-N 3.08Å; P551-V555 WeakPolarHBondContact O-CG2 3.48Å; P551-V555 PolarHBondContact O-N 2.79Å; P551-L573 HydrophobicContact CG-CD2 3.75Å; P551-I582 HydrophobicContact CB-CD1 3.96Å; P551-L645 HydrophobicContact CB-CD2 3.83Å; P551-L645 HydrophobicContact CG-CD1 3.86Å; P551-L645 HydrophobicContact CG-CD2 3.77Å; P551-L645 HydrophobicContact CG-CG 4.3Å
552	A	96.4	Very high	96	Very high	2 Å²	2	40.4 Å²	40.4	2%	0.017	21%	0.213	C	C	.	.	H	α-helix	trans	-51.4	-34.3	173	0	0	0	0	0	114.2	L498 T499 T500 L501 I550 H556	L498-A552 PolarHBondContact O-N 2.87Å; L498-A552 VanDerWaalsContact O-N 3.12Å; T499-A552 WeakPolarHBondContact O-CB 3.41Å; T500-A552 VanDerWaalsContact C-CB 3.45Å; T500-A552 WeakPolarHBondContact O-CB 3.35Å; L501-A552 HydrophobicContact CD2-CB 3.79Å; L501-A552 HydrophobicContact CG-CB 4.16Å; I550-A552 PolarHBondContact O-N 3.38Å; A552-H556 WeakPolarHBondContact O-CB 3.28Å; A552-H556 PolarHBondContact O-CD2 2.96Å; A552-H556 PolarHBondContact O-N 2.81Å
553	R	96.2	Very high	96.2	Very high	70 Å²	70	42.2 Å²	42.2	26%	0.264	22%	0.217	S	C	.	.	H	α-helix	trans	-74.5	-37.9	179.4	-70	-177.8	165.4	-93.8	-5.4	112.2	L501 I550 P551 N557 W558 D559 Y563	L501-R553 HydrophobicContact CD2-CG 3.74Å; I550-R553 HydrophobicContact CB-CB 4.02Å; I550-R553 HydrophobicContact CB-CG 3.87Å; I550-R553 HydrophobicContact CG2-CB 4.26Å; I550-R553 HydrophobicContact CG2-CG 3.78Å; I550-R553 WeakPolarHBondContact O-CB 3.24Å; I550-R553 PolarHBondContact O-N 3.27Å; P551-R553 PolarHBondContact O-N 2.86Å; P551-R553 VanDerWaalsContact O-N 3.13Å; R553-N557 WeakPolarHBondContact O-CB 3.42Å; R553-N557 PolarHBondContact O-N 2.68Å; R553-W558 PolarHBondContact O-N 2.94Å; R553-D559 HydrophobicContact CB-CB 4.03Å; R553-D559 WeakPolarHBondContact CD-OD2 3.33Å; R553-D559 IonicContact NH1-OD2 2.94Å; R553-D559 PolarHBondContact NH1-OD2 3.43Å; R553-D559 VanDerWaalsContact NH1-OD2 3.11Å; R553-D559 PolarHBondContact O-N 3.41Å; R553-Y563 VanDerWaalsContact CD-CE2 3.44Å; R553-Y563 PolarHBondContact NH1-OH 3.49Å
554	I	96.9	Very high	96.3	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-65.2	-46.2	171.9	-62.4	169.7	0	0	0	110.2	L549 I550 P551 W558 D559 L648 I652	L549-I554 HydrophobicContact CB-CD1 4.03Å; L549-I554 HydrophobicContact CD1-CD1 4.2Å; L549-I554 HydrophobicContact CD2-CD1 4.41Å; L549-I554 HydrophobicContact CG-CD1 4.44Å; I550-I554 PolarHBondContact O-N 3.48Å; P551-I554 PolarHBondContact O-N 2.79Å; P551-I554 VanDerWaalsContact O-N 3.08Å; I554-W558 HydrophobicContact CG2-CE3 3.76Å; I554-W558 HydrophobicContact CG2-CZ3 3.67Å; I554-W558 VanDerWaalsContact O-CA 3.22Å; I554-W558 WeakPolarHBondContact O-CA 3.37Å; I554-W558 PolarHBondContact O-N 2.93Å; I554-D559 WeakPolarHBondContact CG1-O 3.43Å; I554-L648 HydrophobicContact CG2-CD1 4.23Å; I554-I652 HydrophobicContact CD1-CD1 4.17Å
555	V	96.6	Very high	96.4	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-67.7	-42.3	-175.4	174.2	0	0	0	0	112.6	P551 I582 I584 E587 N588 L591	P551-V555 WeakPolarHBondContact O-CG2 3.48Å; P551-V555 PolarHBondContact O-N 2.79Å; V555-I582 HydrophobicContact CG2-CG2 3.61Å; V555-I584 HydrophobicContact CG2-CD1 3.93Å; V555-E587 HydrophobicContact CG1-CB 3.52Å; V555-E587 HydrophobicContact CG1-CG 4.35Å; V555-N588 HydrophobicContact CG1-CB 4.26Å; V555-N588 WeakPolarHBondContact O-CB 3.29Å; V555-N588 PolarHBondContact O-ND2 3.3Å; V555-L591 WeakPolarHBondContact O-CD2 3.47Å
556	H	94.8	Very high	96.4	Very high	67 Å²	67	41.3 Å²	41.3	31%	0.31	21%	0.205	S	C	.	.	H	α-helix	trans	-87.8	-35.8	-177.5	-68.6	-60.8	0	0	0	113.8	T499 L501 A552	T499-H556 PolarHBondContact O-CD2 2.93Å; T499-H556 VanDerWaalsContact O-CD2 3.3Å; T499-H556 PolarHBondContact O-NE2 3.41Å; L501-H556 HydrophobicContact CD1-CB 4.15Å; A552-H556 WeakPolarHBondContact O-CB 3.28Å; A552-H556 PolarHBondContact O-CD2 2.96Å; A552-H556 PolarHBondContact O-N 2.81Å
557	N	93.9	Very high	96.4	Very high	103 Å²	103	42.9 Å²	42.9	55%	0.551	21%	0.21	S	C	*	.	H	α-helix	trans	-123.8	0.6	-169.1	-57.7	-40.9	0	0	0	114.8	R553 D559	R553-N557 WeakPolarHBondContact O-CB 3.42Å; R553-N557 PolarHBondContact O-N 2.68Å; N557-D559 HydrophobicContact CB-CB 4.11Å; N557-D559 PolarHBondContact O-N 3.38Å; N557-D559 VanDerWaalsContact O-N 3.14Å
558	W	96.1	Very high	96.3	Very high	49 Å²	49	43.1 Å²	43.1	19%	0.186	21%	0.205	C	C	.	.			trans	50.9	29	-166.3	-157.8	-116.7	0	0	0	114	R553 I554 T560 L591 A595 L598 L648 V651 I652	R553-W558 PolarHBondContact O-N 2.94Å; I554-W558 HydrophobicContact CG2-CE3 3.76Å; I554-W558 HydrophobicContact CG2-CZ3 3.67Å; I554-W558 VanDerWaalsContact O-CA 3.22Å; I554-W558 WeakPolarHBondContact O-CA 3.37Å; I554-W558 PolarHBondContact O-N 2.93Å; W558-T560 WeakPolarHBondContact O-CG2 3.44Å; W558-T560 PolarHBondContact O-N 3.44Å; W558-T560 VanDerWaalsContact O-N 3.12Å; W558-L591 HydrophobicContact CB-CD1 3.97Å; W558-L591 HydrophobicContact CE3-CD1 4.06Å; W558-L591 HydrophobicContact CE3-CD2 3.94Å; W558-L591 HydrophobicContact CE3-CG 4.13Å; W558-L591 HydrophobicContact CZ3-CD2 4.21Å; W558-A595 HydrophobicContact CB-CB 4.45Å; W558-A595 HydrophobicContact CD2-CB 3.52Å; W558-A595 HydrophobicContact CE3-CB 3.99Å; W558-A595 HydrophobicContact CG-CB 3.72Å; W558-A595 HydrophobicContact CZ2-CB 4.24Å; W558-L598 HydrophobicContact CE3-CD2 4.49Å; W558-L598 HydrophobicContact CH2-CB 3.89Å; W558-L598 HydrophobicContact CH2-CD1 4.18Å; W558-L598 HydrophobicContact CH2-CD2 4.25Å; W558-L598 HydrophobicContact CH2-CG 4.33Å; W558-L598 HydrophobicContact CZ2-CB 4.32Å; W558-L598 HydrophobicContact CZ3-CB 4.27Å; W558-L598 HydrophobicContact CZ3-CD1 4.41Å; W558-L598 HydrophobicContact CZ3-CD2 3.83Å; W558-L598 HydrophobicContact CZ3-CG 4.4Å; W558-L648 HydrophobicContact CZ3-CD2 4.44Å; W558-V651 HydrophobicContact CH2-CB 4.24Å; W558-V651 HydrophobicContact CH2-CG1 3.8Å; W558-V651 HydrophobicContact CZ2-CG1 3.86Å; W558-I652 HydrophobicContact CH2-CG1 4.33Å; W558-I652 HydrophobicContact CZ2-CG1 3.99Å
559	D	95.9	Very high	96.2	Very high	24 Å²	24	41.8 Å²	41.8	13%	0.128	20%	0.199	C	C	.	.			trans	-76.5	101.4	-176.6	170.1	15.7	0	0	0	110.1	R553 I554 N557 S561 Y563	R553-D559 HydrophobicContact CB-CB 4.03Å; R553-D559 WeakPolarHBondContact CD-OD2 3.33Å; R553-D559 IonicContact NH1-OD2 2.94Å; R553-D559 PolarHBondContact NH1-OD2 3.43Å; R553-D559 VanDerWaalsContact NH1-OD2 3.11Å; R553-D559 PolarHBondContact O-N 3.41Å; I554-D559 WeakPolarHBondContact CG1-O 3.43Å; N557-D559 HydrophobicContact CB-CB 4.11Å; N557-D559 PolarHBondContact O-N 3.38Å; N557-D559 VanDerWaalsContact O-N 3.14Å; D559-S561 PolarHBondContact O-N 2.86Å; D559-S561 WeakPolarHBondContact OD1-CB 3.45Å; D559-S561 PolarHBondContact OD1-N 2.91Å; D559-S561 VanDerWaalsContact OD1-N 3.15Å; D559-S561 PolarHBondContact OD1-OG 3.48Å; D559-Y563 VanDerWaalsContact OD2-CE2 3.23Å; D559-Y563 WeakPolarHBondContact OD2-CE2 3.24Å; D559-Y563 PolarHBondContact OD2-OH 3.4Å
560	T	95.6	Very high	96.2	Very high	65 Å²	65	43.8 Å²	43.8	40%	0.399	21%	0.207	S	C	.	.			trans	-81.4	5.1	-176.8	66.4	0	0	0	0	113.5	L549 W558 I652	L549-T560 VanDerWaalsContact CD2-O 3.26Å; L549-T560 WeakPolarHBondContact CD2-O 3.33Å; W558-T560 WeakPolarHBondContact O-CG2 3.44Å; W558-T560 PolarHBondContact O-N 3.44Å; W558-T560 VanDerWaalsContact O-N 3.12Å; T560-I652 HydrophobicContact CG2-CB 4.42Å; T560-I652 HydrophobicContact CG2-CD1 3.71Å; T560-I652 HydrophobicContact CG2-CG1 3.71Å; T560-I652 HydrophobicContact CG2-CG2 3.84Å
561	S	96.6	Very high	96.1	Very high	57 Å²	57	48.8 Å²	48.8	40%	0.399	23%	0.23	S	C	.	.			trans	-74.4	143.2	-175.4	-40.7	0	0	0	0	111.7	D559 Y563	D559-S561 PolarHBondContact O-N 2.86Å; D559-S561 WeakPolarHBondContact OD1-CB 3.45Å; D559-S561 PolarHBondContact OD1-N 2.91Å; D559-S561 VanDerWaalsContact OD1-N 3.15Å; D559-S561 PolarHBondContact OD1-OG 3.48Å; S561-Y563 VanDerWaalsContact O-CD2 3.32Å; S561-Y563 WeakPolarHBondContact O-CD2 2.97Å
562	K	96.4	Very high	96.1	Very high	126 Å²	126	49.2 Å²	49.2	55%	0.548	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	127	171.7	-64.8	-171.3	-179.4	-170.6	0	110	F548 L549	F548-K562 CarbonylContact O-C 3.58Å; F548-K562 WeakPolarHBondContact O-CA 3.24Å; L549-K562 HydrophobicContact CD2-CG 3.83Å; L549-K562 HydrophobicContact CG-CG 4.15Å
563	Y	97.1	Very high	96.1	Very high	61 Å²	61	49.1 Å²	49.1	24%	0.239	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	150.6	-176.6	-72	-88.3	0	0	0	112.3	N532 S547 F548 I550 R553 D559 S561 V565	N532-Y563 HydrophobicContact CB-CD1 4.37Å; N532-Y563 HydrophobicContact CB-CG 4.21Å; S547-Y563 CarbonylContact C-O 3.57Å; S547-Y563 VanDerWaalsContact CA-O 3.28Å; S547-Y563 WeakPolarHBondContact CA-O 3Å; F548-Y563 PolarHBondContact N-O 2.76Å; F548-Y563 PolarHBondContact O-N 2.95Å; I550-Y563 HydrophobicContact CG1-CD2 3.9Å; I550-Y563 HydrophobicContact CG1-CG 4.18Å; R553-Y563 VanDerWaalsContact CD-CE2 3.44Å; R553-Y563 PolarHBondContact NH1-OH 3.49Å; D559-Y563 VanDerWaalsContact OD2-CE2 3.23Å; D559-Y563 WeakPolarHBondContact OD2-CE2 3.24Å; D559-Y563 PolarHBondContact OD2-OH 3.4Å; S561-Y563 VanDerWaalsContact O-CD2 3.32Å; S561-Y563 WeakPolarHBondContact O-CD2 2.97Å; Y563-V565 PolarHBondContact O-N 2.68Å
564	K	97.7	Very high	96.1	Very high	100 Å²	100	50.3 Å²	50.3	44%	0.435	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	129.1	-178.9	-62.9	-179.8	166	-165.6	0	111.7	N532 D545 D546	N532-K564 WeakPolarHBondContact CB-O 3.39Å; N532-K564 PolarHBondContact N-O 3.23Å; N532-K564 PolarHBondContact ND2-O 3.06Å; D545-K564 HydrophobicContact CB-CD 3.74Å; D545-K564 HydrophobicContact CB-CG 4.15Å; D545-K564 IonicContact OD2-NZ 2.68Å; D545-K564 PolarHBondContact OD2-NZ 3.19Å; D546-K564 CarbonylContact O-C 3.5Å; D546-K564 WeakPolarHBondContact O-CA 3.45Å
565	V	97.2	Very high	96	Very high	0 Å²	0	59 Å²	59	0%	0	27%	0.274	C	S	.	.			trans	-128	160.5	-177.1	-69.2	0	0	0	0	112.4	H543 D546 F548 I550 Y563 A569 K570	H543-V565 VanDerWaalsContact CD2-C 3.49Å; H543-V565 VanDerWaalsContact NE2-C 3.33Å; H543-V565 PolarHBondContact NE2-O 3.03Å; D546-V565 HydrophobicContact CB-CG2 4.47Å; D546-V565 WeakPolarHBondContact O-CG2 3.28Å; D546-V565 PolarHBondContact O-N 2.85Å; F548-V565 HydrophobicContact CB-CG2 4.02Å; I550-V565 HydrophobicContact CD1-CG1 3.76Å; Y563-V565 PolarHBondContact O-N 2.68Å; V565-A569 HydrophobicContact CB-CB 4.28Å; V565-K570 HydrophobicContact CG2-CB 3.93Å; V565-K570 HydrophobicContact CG2-CG 4.35Å
566	S	96.1	Very high	96	Very high	0 Å²	0	59.4 Å²	59.4	0%	0	28%	0.276	C	S	.	.			trans	-73.1	154.3	168.2	61.6	0	0	0	0	110.6	C531 Y538 H543 Q568 A569 K570	C531-S566 PolarHBondContact SG-N 3.01Å; Y538-S566 VanDerWaalsContact CZ-OG 3.26Å; Y538-S566 PolarHBondContact OH-OG 3.14Å; H543-S566 PolarHBondContact CD2-N 3.23Å; S566-Q568 VanDerWaalsContact C-N 3.32Å; S566-Q568 PolarHBondContact O-N 3.19Å; S566-A569 PolarHBondContact O-N 2.84Å; S566-A569 WeakPolarHBondContact OG-CB 3.35Å; S566-K570 PolarHBondContact O-N 3.5Å
567	K	95.9	Very high	96.1	Very high	78 Å²	78	58.8 Å²	58.8	34%	0.339	27%	0.272	S	S	.	.	H	α-helix	trans	-52.6	-48.7	179.8	-73.3	178.6	171.6	168.2	0	112.5	S541 C542 V544 A569 K570 E571	S541-K567 PolarHBondContact O-NZ 3.17Å; C542-K567 PolarHBondContact O-N 2.85Å; V544-K567 HydrophobicContact CG2-CG 4.34Å; K567-A569 VanDerWaalsContact C-N 3.29Å; K567-A569 PolarHBondContact O-N 2.67Å; K567-K570 WeakPolarHBondContact O-CA 3.33Å; K567-K570 WeakPolarHBondContact O-CB 3.41Å; K567-K570 PolarHBondContact O-N 3Å; K567-E571 WeakPolarHBondContact O-CB 3.43Å; K567-E571 VanDerWaalsContact O-CD 3.31Å; K567-E571 WeakPolarHBondContact O-CG 3.15Å; K567-E571 PolarHBondContact O-N 3.21Å
568	Q	94.4	Very high	96.2	Very high	62 Å²	62	59 Å²	59	29%	0.29	27%	0.269	S	S	.	.	H	α-helix	trans	-58.3	-36.2	176.8	-69.7	167	-29.6	0	0	113.6	F494 G516 S566 E571 F572	F494-Q568 HydrophobicContact CE2-CB 4.11Å; F494-Q568 WeakPolarHBondContact CE2-O 3.26Å; F494-Q568 HydrophobicContact CZ-CB 4.47Å; G516-Q568 PolarHBondContact O-NE2 3Å; S566-Q568 VanDerWaalsContact C-N 3.32Å; S566-Q568 PolarHBondContact O-N 3.19Å; Q568-E571 WeakPolarHBondContact CA-OE2 3.33Å; Q568-F572 VanDerWaalsContact O-CB 3.3Å; Q568-F572 WeakPolarHBondContact O-CB 3.23Å; Q568-F572 PolarHBondContact O-N 2.99Å; Q568-F572 VanDerWaalsContact O-N 3.13Å
569	A	95.8	Very high	96.1	Very high	0 Å²	0	61.7 Å²	61.7	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-75.6	-34.5	176.9	0	0	0	0	0	111.5	F494 Y533 V565 S566 K567 L573	F494-A569 HydrophobicContact CE2-CB 4.22Å; F494-A569 HydrophobicContact CZ-CB 4.31Å; Y533-A569 HydrophobicContact CD1-CB 3.95Å; Y533-A569 HydrophobicContact CG-CB 4.38Å; V565-A569 HydrophobicContact CB-CB 4.28Å; S566-A569 PolarHBondContact O-N 2.84Å; S566-A569 WeakPolarHBondContact OG-CB 3.35Å; K567-A569 VanDerWaalsContact C-N 3.29Å; K567-A569 PolarHBondContact O-N 2.67Å; A569-L573 WeakPolarHBondContact O-CB 3.41Å; A569-L573 WeakPolarHBondContact O-CD1 3.37Å; A569-L573 WeakPolarHBondContact O-CG 3.46Å; A569-L573 PolarHBondContact O-N 3.48Å
570	K	96.3	Very high	96.1	Very high	50 Å²	50	62.1 Å²	62.1	22%	0.217	29%	0.288	C	S	.	.	H	α-helix	trans	-64.5	-53.8	172.2	-163	-151.7	-169.4	-174.9	0	111.3	D546 F548 V565 S566 K567 F572 L573 E574	D546-K570 HydrophobicContact CB-CD 3.84Å; D546-K570 HydrophobicContact CB-CG 4.38Å; D546-K570 VanDerWaalsContact OD1-CE 3.28Å; D546-K570 WeakPolarHBondContact OD1-CE 3.36Å; D546-K570 IonicContact OD1-NZ 3.66Å; D546-K570 PolarHBondContact OD1-NZ 2.78Å; F548-K570 HydrophobicContact CD2-CG 4.23Å; V565-K570 HydrophobicContact CG2-CB 3.93Å; V565-K570 HydrophobicContact CG2-CG 4.35Å; S566-K570 PolarHBondContact O-N 3.5Å; K567-K570 WeakPolarHBondContact O-CA 3.33Å; K567-K570 WeakPolarHBondContact O-CB 3.41Å; K567-K570 PolarHBondContact O-N 3Å; K570-F572 PolarHBondContact O-N 3.34Å; K570-L573 PolarHBondContact O-N 3.07Å; K570-E574 WeakPolarHBondContact CE-OE1 3.45Å; K570-E574 HydrophobicContact CG-CG 4.41Å; K570-E574 IonicContact NZ-OE1 3.8Å; K570-E574 WeakPolarHBondContact O-CB 3.37Å; K570-E574 WeakPolarHBondContact O-CG 3.32Å; K570-E574 PolarHBondContact O-N 3.42Å
571	E	95.7	Very high	96.1	Very high	110 Å²	110	62.7 Å²	62.7	51%	0.514	29%	0.289	S	S	.	.	H	α-helix	trans	-51.9	-41.8	176.2	-70.3	154.2	-161.6	0	0	111.4	K567 Q568 Y575	K567-E571 WeakPolarHBondContact O-CB 3.43Å; K567-E571 VanDerWaalsContact O-CD 3.31Å; K567-E571 WeakPolarHBondContact O-CG 3.15Å; K567-E571 PolarHBondContact O-N 3.21Å; Q568-E571 WeakPolarHBondContact CA-OE2 3.33Å; E571-Y575 WeakPolarHBondContact O-CB 3.31Å; E571-Y575 PolarHBondContact O-N 3.17Å
572	F	95.9	Very high	96.1	Very high	9 Å²	9	60.1 Å²	60.1	4%	0.039	27%	0.27	C	S	.	.	H	α-helix	trans	-68	-48	174.5	170.1	-97.9	0	0	0	113.5	T491 F494 L495 L498 Y533 Q568 K570 E574 Y575 V576	T491-F572 HydrophobicContact CG2-CD2 4.41Å; F494-F572 HydrophobicContact CB-CD1 3.64Å; F494-F572 HydrophobicContact CB-CD2 4.04Å; F494-F572 HydrophobicContact CB-CE1 3.72Å; F494-F572 HydrophobicContact CB-CE2 4.1Å; F494-F572 HydrophobicContact CB-CG 3.82Å; F494-F572 HydrophobicContact CB-CZ 3.95Å; F494-F572 HydrophobicContact CD2-CB 3.75Å; F494-F572 HydrophobicContact CD2-CD1 4.09Å; F494-F572 HydrophobicContact CD2-CD2 4.44Å; F494-F572 AromaticContact CD2-CG 3.8Å; F494-F572 HydrophobicContact CD2-CG 3.8Å; F494-F572 HydrophobicContact CE2-CB 4.43Å; F494-F572 HydrophobicContact CG-CD1 4.28Å; F494-F572 HydrophobicContact CG-CG 4.31Å; L495-F572 HydrophobicContact CB-CZ 4.45Å; L495-F572 HydrophobicContact CD2-CE2 4.09Å; L495-F572 HydrophobicContact CD2-CZ 3.79Å; L495-F572 HydrophobicContact CG-CE2 3.79Å; L495-F572 HydrophobicContact CG-CZ 3.76Å; L498-F572 HydrophobicContact CD1-CE1 4.14Å; L498-F572 HydrophobicContact CD1-CZ 4.49Å; Y533-F572 HydrophobicContact CE1-CD1 4.16Å; Y533-F572 HydrophobicContact CE1-CE1 4.24Å; Y533-F572 WeakPolarHBondContact OH-CE1 3.35Å; Q568-F572 VanDerWaalsContact O-CB 3.3Å; Q568-F572 WeakPolarHBondContact O-CB 3.23Å; Q568-F572 PolarHBondContact O-N 2.99Å; Q568-F572 VanDerWaalsContact O-N 3.13Å; K570-F572 PolarHBondContact O-N 3.34Å; F572-E574 VanDerWaalsContact C-N 3.28Å; F572-E574 PolarHBondContact O-N 2.82Å; F572-Y575 WeakPolarHBondContact O-CB 3.45Å; F572-Y575 PolarHBondContact O-N 2.99Å; F572-Y575 VanDerWaalsContact O-N 3.17Å; F572-V576 HydrophobicContact CD2-CG1 4.36Å; F572-V576 HydrophobicContact CE1-CG2 4.04Å; F572-V576 HydrophobicContact CE2-CG1 3.71Å; F572-V576 HydrophobicContact CZ-CG1 3.85Å; F572-V576 HydrophobicContact CZ-CG2 4.02Å; F572-V576 PolarHBondContact O-N 3.39Å
573	L	96.8	Very high	96.1	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-68.4	-28	-179.4	-72.8	167.9	0	0	0	112.7	L498 Y533 F548 P551 A569 K570 Y577 L645	L498-L573 HydrophobicContact CD1-CD2 4.31Å; Y533-L573 HydrophobicContact CD2-CD1 3.85Å; Y533-L573 HydrophobicContact CD2-CD2 4.14Å; Y533-L573 HydrophobicContact CD2-CG 4.39Å; Y533-L573 HydrophobicContact CE2-CD1 4.31Å; Y533-L573 HydrophobicContact CE2-CD2 3.76Å; Y533-L573 HydrophobicContact CE2-CG 4.38Å; Y533-L573 HydrophobicContact CG-CD1 4.01Å; F548-L573 HydrophobicContact CD1-CB 3.68Å; F548-L573 HydrophobicContact CD1-CD1 3.85Å; F548-L573 HydrophobicContact CD1-CG 4.32Å; F548-L573 HydrophobicContact CE1-CB 3.58Å; F548-L573 HydrophobicContact CG-CB 4.4Å; F548-L573 HydrophobicContact CG-CD1 4.44Å; F548-L573 HydrophobicContact CZ-CB 4.18Å; P551-L573 HydrophobicContact CG-CD2 3.75Å; A569-L573 WeakPolarHBondContact O-CB 3.41Å; A569-L573 WeakPolarHBondContact O-CD1 3.37Å; A569-L573 WeakPolarHBondContact O-CG 3.46Å; A569-L573 PolarHBondContact O-N 3.48Å; K570-L573 PolarHBondContact O-N 3.07Å; L573-Y577 WeakPolarHBondContact O-CB 3.33Å; L573-Y577 PolarHBondContact O-N 2.8Å; L573-L645 HydrophobicContact CD2-CD1 4.17Å
574	E	96.8	Very high	96	Very high	95 Å²	95	52.7 Å²	52.7	44%	0.444	24%	0.24	S	C	.	.	H	α-helix	trans	-71.6	-40.4	169.7	-71.9	172.1	151.5	0	0	111	F548 K570 F572 Y577	F548-E574 HydrophobicContact CD2-CG 4.38Å; F548-E574 HydrophobicContact CE2-CG 3.58Å; F548-E574 HydrophobicContact CZ-CG 4.09Å; K570-E574 WeakPolarHBondContact CE-OE1 3.45Å; K570-E574 HydrophobicContact CG-CG 4.41Å; K570-E574 IonicContact NZ-OE1 3.8Å; K570-E574 WeakPolarHBondContact O-CB 3.37Å; K570-E574 WeakPolarHBondContact O-CG 3.32Å; K570-E574 PolarHBondContact O-N 3.42Å; F572-E574 VanDerWaalsContact C-N 3.28Å; F572-E574 PolarHBondContact O-N 2.82Å; E574-Y577 VanDerWaalsContact O-CB 3.29Å; E574-Y577 WeakPolarHBondContact O-CB 3.35Å; E574-Y577 PolarHBondContact O-N 3.28Å
575	Y	95.6	Very high	95.9	Very high	183 Å²	183	51.5 Å²	51.5	72%	0.718	24%	0.236	S	C	*	.	H	α-helix	trans	-64.2	-40.8	176	174.1	-107.6	0	0	0	113.4	E571 F572 Y577	E571-Y575 WeakPolarHBondContact O-CB 3.31Å; E571-Y575 PolarHBondContact O-N 3.17Å; F572-Y575 WeakPolarHBondContact O-CB 3.45Å; F572-Y575 PolarHBondContact O-N 2.99Å; F572-Y575 VanDerWaalsContact O-N 3.17Å; Y575-Y577 VanDerWaalsContact C-N 3.34Å
576	V	95.4	Very high	95.8	Very high	8 Å²	8	58.1 Å²	58.1	5%	0.048	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.6	12.8	177.9	-53.6	0	0	0	0	114	L495 L498 F572 E578 E579 L581 L645	L495-V576 HydrophobicContact CD2-CG1 4.38Å; L498-V576 HydrophobicContact CD1-CG2 4.21Å; F572-V576 HydrophobicContact CD2-CG1 4.36Å; F572-V576 HydrophobicContact CE1-CG2 4.04Å; F572-V576 HydrophobicContact CE2-CG1 3.71Å; F572-V576 HydrophobicContact CZ-CG1 3.85Å; F572-V576 HydrophobicContact CZ-CG2 4.02Å; F572-V576 PolarHBondContact O-N 3.39Å; V576-E578 PolarHBondContact O-N 2.96Å; V576-E579 PolarHBondContact O-N 2.92Å; V576-L581 HydrophobicContact CB-CD1 3.91Å; V576-L581 HydrophobicContact CG1-CD1 4.15Å; V576-L581 HydrophobicContact CG2-CD1 4.49Å; V576-L645 HydrophobicContact CG2-CD1 4.4Å
577	Y	96.5	Very high	95.7	Very high	54 Å²	54	62 Å²	62	21%	0.212	29%	0.286	C	S	.	.	S	Bend	trans	-64.8	-41.9	-167.9	-178.2	-110.4	0	0	0	114	F548 L573 E574 Y575 L645 A646 Q649	F548-Y577 HydrophobicContact CE1-CD2 4.35Å; F548-Y577 AromaticContact CZ-CD2 3.93Å; F548-Y577 HydrophobicContact CZ-CD2 3.93Å; F548-Y577 HydrophobicContact CZ-CE2 4.39Å; L573-Y577 WeakPolarHBondContact O-CB 3.33Å; L573-Y577 PolarHBondContact O-N 2.8Å; E574-Y577 VanDerWaalsContact O-CB 3.29Å; E574-Y577 WeakPolarHBondContact O-CB 3.35Å; E574-Y577 PolarHBondContact O-N 3.28Å; Y575-Y577 VanDerWaalsContact C-N 3.34Å; Y577-L645 HydrophobicContact CD2-CB 3.78Å; Y577-L645 HydrophobicContact CE2-CB 4.17Å; Y577-L645 WeakPolarHBondContact O-CB 3.46Å; Y577-L645 PolarHBondContact O-N 2.94Å; Y577-A646 HydrophobicContact CD1-CB 3.87Å; Y577-A646 HydrophobicContact CE1-CB 3.52Å; Y577-A646 HydrophobicContact CG-CB 4.49Å; Y577-A646 PolarHBondContact O-N 2.81Å; Y577-Q649 VanDerWaalsContact OH-CD 3.29Å; Y577-Q649 PolarHBondContact OH-NE2 3.28Å; Y577-Q649 PolarHBondContact OH-OE1 3.2Å
578	E	95.6	Very high	95.6	Very high	108 Å²	108	60 Å²	60	51%	0.505	28%	0.278	S	S	.	.	S	Bend	trans	-93.1	-4.7	179.2	-56.4	-149.5	122.8	0	0	113.5	V576 Y635 S644 A646	V576-E578 PolarHBondContact O-N 2.96Å; E578-Y635 PolarHBondContact O-OH 3.38Å; E578-S644 VanDerWaalsContact C-CB 3.46Å; E578-S644 VanDerWaalsContact O-CB 3.24Å; E578-S644 WeakPolarHBondContact O-CB 3.36Å; E578-A646 HydrophobicContact CG-CB 4.16Å
579	E	95.1	Very high	95.7	Very high	106 Å²	106	59.4 Å²	59.4	50%	0.495	28%	0.284	S	S	.	.	S	Bend	trans	-75.4	129.9	-177.2	-67.8	-59.2	145.3	0	0	111.7	V576 L581 S644	V576-E579 PolarHBondContact O-N 2.92Å; E579-L581 VanDerWaalsContact C-N 3.31Å; E579-L581 HydrophobicContact CB-CD1 4.08Å; E579-L581 HydrophobicContact CB-CD2 4.27Å; E579-L581 HydrophobicContact CB-CG 3.81Å; E579-L581 PolarHBondContact O-N 2.89Å; E579-S644 VanDerWaalsContact O-CA 3.29Å; E579-S644 WeakPolarHBondContact O-CA 3.22Å; E579-S644 WeakPolarHBondContact O-CB 3.43Å
580	P	95.4	Very high	95.6	Very high	33 Å²	33	64.2 Å²	64.2	21%	0.214	31%	0.308	C	S	.	.			trans	-79.8	74	-177.1	34.3	-37	0	0	0	111.4	Y635 L642	P580-Y635 HydrophobicContact CB-CD1 3.81Å; P580-Y635 HydrophobicContact CB-CD2 3.84Å; P580-Y635 HydrophobicContact CB-CE1 3.77Å; P580-Y635 HydrophobicContact CB-CE2 3.84Å; P580-Y635 HydrophobicContact CB-CG 3.82Å; P580-Y635 HydrophobicContact CG-CD1 3.63Å; P580-Y635 HydrophobicContact CG-CE1 3.72Å; P580-Y635 HydrophobicContact CG-CG 4.05Å; P580-L642 HydrophobicContact CB-CD2 3.96Å; P580-L642 HydrophobicContact CB-CG 4.07Å; P580-L642 WeakPolarHBondContact O-CD1 3.32Å; P580-L642 WeakPolarHBondContact O-CD2 3.4Å; P580-L642 WeakPolarHBondContact O-CG 3.48Å
581	L	95.7	Very high	95.6	Very high	77 Å²	77	62 Å²	62	40%	0.403	30%	0.299	S	S	.	.			trans	-100.7	-8.8	-172.6	-59	-178.5	0	0	0	115	L495 L498 V576 E579 Y643	L495-L581 HydrophobicContact CD2-CD1 3.93Å; L498-L581 HydrophobicContact CD2-CB 3.73Å; L498-L581 HydrophobicContact CD2-CD1 4.07Å; V576-L581 HydrophobicContact CB-CD1 3.91Å; V576-L581 HydrophobicContact CG1-CD1 4.15Å; V576-L581 HydrophobicContact CG2-CD1 4.49Å; E579-L581 VanDerWaalsContact C-N 3.31Å; E579-L581 HydrophobicContact CB-CD1 4.08Å; E579-L581 HydrophobicContact CB-CD2 4.27Å; E579-L581 HydrophobicContact CB-CG 3.81Å; E579-L581 PolarHBondContact O-N 2.89Å; L581-Y643 PolarHBondContact N-O 3.07Å
582	I	96.8	Very high	95.6	Very high	2 Å²	2	58 Å²	58	1%	0.01	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	107.4	-168.3	-56	171.9	0	0	0	110.2	L498 T499 P551 V555 I584 L642 Y643 L645 L648	L498-I582 HydrophobicContact CD2-CG1 4.08Å; T499-I582 HydrophobicContact CG2-CG1 4.37Å; T499-I582 HydrophobicContact CG2-CG2 4.28Å; P551-I582 HydrophobicContact CB-CD1 3.96Å; V555-I582 HydrophobicContact CG2-CG2 3.61Å; I582-I584 HydrophobicContact CG2-CD1 3.69Å; I582-I584 HydrophobicContact CG2-CG1 4.44Å; I582-L642 CarbonylContact O-C 3.56Å; I582-L642 WeakPolarHBondContact O-CA 3.22Å; I582-Y643 PolarHBondContact N-O 3.46Å; I582-Y643 VanDerWaalsContact N-O 3.11Å; I582-Y643 PolarHBondContact O-N 3.27Å; I582-L645 HydrophobicContact CD1-CD2 4.22Å; I582-L645 HydrophobicContact CD1-CG 4.16Å; I582-L648 HydrophobicContact CD1-CD1 3.87Å; I582-L648 HydrophobicContact CG2-CD1 4.49Å
583	D	96.3	Very high	95.6	Very high	31 Å²	31	64.5 Å²	64.5	17%	0.166	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	102.5	171	-170.3	-32.6	0	0	0	110.3	Q585 Q586 E587 H641 L642	D583-Q585 PolarHBondContact O-N 2.66Å; D583-Q585 WeakPolarHBondContact OD1-CB 3.18Å; D583-Q585 PolarHBondContact OD1-N 3.15Å; D583-Q586 HydrophobicContact CB-CB 4.16Å; D583-Q586 HydrophobicContact CB-CG 4.2Å; D583-Q586 PolarHBondContact O-N 3.36Å; D583-Q586 PolarHBondContact OD1-N 3Å; D583-Q586 PolarHBondContact OD2-NE2 3.34Å; D583-E587 VanDerWaalsContact O-CG 3.31Å; D583-E587 WeakPolarHBondContact O-CG 3.39Å; D583-E587 PolarHBondContact O-N 3.23Å; D583-H641 WeakPolarHBondContact CA-O 3.48Å; D583-H641 VanDerWaalsContact OD1-CB 3.26Å; D583-H641 WeakPolarHBondContact OD1-CB 3.41Å; D583-L642 HydrophobicContact CB-CD1 4.05Å
584	I	96.1	Very high	95.5	Very high	0 Å²	0	71.5 Å²	71.5	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-64.3	-28.9	-176.7	-59.5	-65.2	0	0	0	111.8	V555 I582 N588 A589 L591 Y592 L598 H641 Y643 L648	V555-I584 HydrophobicContact CG2-CD1 3.93Å; I582-I584 HydrophobicContact CG2-CD1 3.69Å; I582-I584 HydrophobicContact CG2-CG1 4.44Å; I584-N588 CarbonylContact O-C 3.56Å; I584-N588 PolarHBondContact O-N 2.84Å; I584-A589 PolarHBondContact O-N 3.03Å; I584-L591 HydrophobicContact CD1-CD2 4.01Å; I584-L591 HydrophobicContact CG2-CB 4.12Å; I584-L591 HydrophobicContact CG2-CD2 3.85Å; I584-Y592 HydrophobicContact CB-CE2 4.13Å; I584-Y592 HydrophobicContact CG2-CD2 4.19Å; I584-Y592 HydrophobicContact CG2-CE1 4.18Å; I584-Y592 HydrophobicContact CG2-CE2 3.63Å; I584-L598 HydrophobicContact CG2-CD2 4.06Å; I584-H641 PolarHBondContact N-O 3.41Å; I584-Y643 HydrophobicContact CB-CD2 4.47Å; I584-Y643 HydrophobicContact CB-CE2 4.4Å; I584-Y643 HydrophobicContact CG1-CD2 3.65Å; I584-Y643 HydrophobicContact CG1-CE2 3.93Å; I584-L648 HydrophobicContact CD1-CD2 4.36Å
585	Q	95.2	Very high	95.5	Very high	75 Å²	75	67 Å²	67	35%	0.35	32%	0.321	S	S	.	.	H	α-helix	trans	-70.6	-36.7	178	-172.3	-175.3	30.2	0	0	111.4	D583 H641	D583-Q585 PolarHBondContact O-N 2.66Å; D583-Q585 WeakPolarHBondContact OD1-CB 3.18Å; D583-Q585 PolarHBondContact OD1-N 3.15Å; Q585-H641 HydrophobicContact CB-CB 3.74Å; Q585-H641 PolarHBondContact OE1-CD2 3.35Å; Q585-H641 PolarHBondContact OE1-NE2 2.95Å
586	Q	94.4	Very high	95.5	Very high	140 Å²	140	63.4 Å²	63.4	65%	0.654	31%	0.311	S	S	*	.	H	α-helix	trans	-76.9	-36.6	178.8	-65	-176.3	70	0	0	112.3	D583	D583-Q586 HydrophobicContact CB-CB 4.16Å; D583-Q586 HydrophobicContact CB-CG 4.2Å; D583-Q586 PolarHBondContact O-N 3.36Å; D583-Q586 PolarHBondContact OD1-N 3Å; D583-Q586 PolarHBondContact OD2-NE2 3.34Å
587	E	93.7	Very high	95.6	Very high	82 Å²	82	66.3 Å²	66.3	38%	0.383	33%	0.33	S	S	.	.	H	α-helix	trans	-85.4	-43.7	-176.4	-60.6	-72.4	145.6	0	0	113.6	T499 V555 D583	T499-E587 WeakPolarHBondContact CB-OE2 3.28Å; T499-E587 HydrophobicContact CG2-CG 3.99Å; T499-E587 VanDerWaalsContact OG1-CD 3.27Å; T499-E587 PolarHBondContact OG1-OE2 3.41Å; V555-E587 HydrophobicContact CG1-CB 3.52Å; V555-E587 HydrophobicContact CG1-CG 4.35Å; D583-E587 VanDerWaalsContact O-CG 3.31Å; D583-E587 WeakPolarHBondContact O-CG 3.39Å; D583-E587 PolarHBondContact O-N 3.23Å
588	N	94.8	Very high	95.6	Very high	34 Å²	34	63.7 Å²	63.7	18%	0.182	32%	0.32	C	S	.	.	H	α-helix	trans	-161.3	81.1	-179	-175.7	5.9	0	0	0	112	V555 I584 M590 L591	V555-N588 HydrophobicContact CG1-CB 4.26Å; V555-N588 WeakPolarHBondContact O-CB 3.29Å; V555-N588 PolarHBondContact O-ND2 3.3Å; I584-N588 CarbonylContact O-C 3.56Å; I584-N588 PolarHBondContact O-N 2.84Å; N588-M590 PolarHBondContact O-N 2.83Å; N588-M590 PolarHBondContact OD1-N 3.49Å; N588-L591 HydrophobicContact CB-CB 4.31Å; N588-L591 WeakPolarHBondContact O-CB 3.38Å; N588-L591 PolarHBondContact O-N 3.28Å; N588-L591 PolarHBondContact OD1-N 3.11Å
589	A	95.2	Very high	95.6	Very high	50 Å²	50	59 Å²	59	41%	0.413	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-30.3	177.9	0	0	0	0	0	113.6	I584 L591 Y592	I584-A589 PolarHBondContact O-N 3.03Å; A589-L591 PolarHBondContact O-N 2.98Å; A589-Y592 WeakPolarHBondContact O-CD2 3.47Å; A589-Y592 PolarHBondContact O-N 3.01Å
590	M	95.1	Very high	95.7	Very high	101 Å²	101	55.1 Å²	55.1	50%	0.498	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66	-19.4	177.8	-69.8	-61.3	-65	0	0	113.1	N588 Y592 H593 H594	N588-M590 PolarHBondContact O-N 2.83Å; N588-M590 PolarHBondContact OD1-N 3.49Å; M590-Y592 PolarHBondContact O-N 3.23Å; M590-H593 PolarHBondContact O-N 3.26Å; M590-H594 PolarHBondContact O-CD2 2.94Å; M590-H594 VanDerWaalsContact O-CD2 3.24Å; M590-H594 PolarHBondContact O-N 2.81Å
591	L	95.6	Very high	95.7	Very high	5 Å²	5	53.6 Å²	53.6	3%	0.026	28%	0.275	C	S	.	.	H	α-helix	trans	-56.3	-34.9	176.2	-165.3	67.3	0	0	0	112	V555 W558 I584 N588 A589 H593 H594 A595 L598	V555-L591 WeakPolarHBondContact O-CD2 3.47Å; W558-L591 HydrophobicContact CB-CD1 3.97Å; W558-L591 HydrophobicContact CE3-CD1 4.06Å; W558-L591 HydrophobicContact CE3-CD2 3.94Å; W558-L591 HydrophobicContact CE3-CG 4.13Å; W558-L591 HydrophobicContact CZ3-CD2 4.21Å; I584-L591 HydrophobicContact CD1-CD2 4.01Å; I584-L591 HydrophobicContact CG2-CB 4.12Å; I584-L591 HydrophobicContact CG2-CD2 3.85Å; N588-L591 HydrophobicContact CB-CB 4.31Å; N588-L591 WeakPolarHBondContact O-CB 3.38Å; N588-L591 PolarHBondContact O-N 3.28Å; N588-L591 PolarHBondContact OD1-N 3.11Å; A589-L591 PolarHBondContact O-N 2.98Å; L591-H593 VanDerWaalsContact C-N 3.25Å; L591-H593 PolarHBondContact O-N 3.45Å; L591-H594 PolarHBondContact O-N 2.95Å; L591-A595 HydrophobicContact CG-CB 4.47Å; L591-A595 VanDerWaalsContact O-CB 3.32Å; L591-A595 WeakPolarHBondContact O-CB 3.4Å; L591-A595 PolarHBondContact O-N 3.37Å; L591-L598 HydrophobicContact CD2-CD2 3.69Å; L591-L598 HydrophobicContact CG-CD2 3.97Å
592	Y	96.7	Very high	95.7	Very high	24 Å²	24	50.9 Å²	50.9	9%	0.094	26%	0.261	C	S	.	.	H	α-helix	trans	-66.2	-23.2	176.2	-64.3	-67.8	0	0	0	113.6	I584 A589 M590 L598 A599 L602 H641	I584-Y592 HydrophobicContact CB-CE2 4.13Å; I584-Y592 HydrophobicContact CG2-CD2 4.19Å; I584-Y592 HydrophobicContact CG2-CE1 4.18Å; I584-Y592 HydrophobicContact CG2-CE2 3.63Å; A589-Y592 WeakPolarHBondContact O-CD2 3.47Å; A589-Y592 PolarHBondContact O-N 3.01Å; M590-Y592 PolarHBondContact O-N 3.23Å; Y592-L598 HydrophobicContact CD1-CD2 4.01Å; Y592-L598 HydrophobicContact CD1-CG 3.9Å; Y592-L598 HydrophobicContact CE1-CD2 4.02Å; Y592-L598 HydrophobicContact CE1-CG 3.85Å; Y592-A599 VanDerWaalsContact O-CB 3.29Å; Y592-A599 WeakPolarHBondContact O-CB 3.44Å; Y592-L602 HydrophobicContact CD1-CB 3.99Å; Y592-L602 HydrophobicContact CD1-CD2 3.69Å; Y592-L602 HydrophobicContact CD1-CG 4.42Å; Y592-L602 HydrophobicContact CD2-CD2 4.14Å; Y592-L602 HydrophobicContact CE1-CB 3.78Å; Y592-L602 HydrophobicContact CE1-CD1 4.36Å; Y592-L602 HydrophobicContact CE1-CD2 3.7Å; Y592-L602 HydrophobicContact CE1-CG 4.14Å; Y592-L602 HydrophobicContact CE2-CD2 4.15Å; Y592-L602 HydrophobicContact CG-CD2 3.91Å; Y592-H641 AromaticContact CE2-ND1 3.85Å; Y592-H641 AromaticContact CZ-ND1 3.7Å; Y592-H641 PolarHBondContact OH-ND1 3.18Å; Y592-H641 VanDerWaalsContact OH-ND1 3.09Å
593	H	95.3	Very high	95.6	Very high	147 Å²	147	56.2 Å²	56.2	68%	0.681	28%	0.281	S	S	*	.	H	α-helix	trans	-85	-24.6	175.3	-65.8	-64.3	0	0	0	112.9	M590 L591	M590-H593 PolarHBondContact O-N 3.26Å; L591-H593 VanDerWaalsContact C-N 3.25Å; L591-H593 PolarHBondContact O-N 3.45Å
594	H	94.7	Very high	95.5	Very high	146 Å²	146	56.7 Å²	56.7	68%	0.676	28%	0.283	S	S	*	.	H	α-helix	trans	-99.8	-21.4	-178.3	-62.2	-61	0	0	0	113.9	M590 L591	M590-H594 PolarHBondContact O-CD2 2.94Å; M590-H594 VanDerWaalsContact O-CD2 3.24Å; M590-H594 PolarHBondContact O-N 2.81Å; L591-H594 PolarHBondContact O-N 2.95Å
595	A	96.3	Very high	95.5	Very high	2 Å²	2	56.7 Å²	56.7	2%	0.017	28%	0.283	C	S	.	.			trans	-114.8	80.4	-179.5	0	0	0	0	0	112	W558 L591 P597 L598 A599	W558-A595 HydrophobicContact CB-CB 4.45Å; W558-A595 HydrophobicContact CD2-CB 3.52Å; W558-A595 HydrophobicContact CE3-CB 3.99Å; W558-A595 HydrophobicContact CG-CB 3.72Å; W558-A595 HydrophobicContact CZ2-CB 4.24Å; L591-A595 HydrophobicContact CG-CB 4.47Å; L591-A595 VanDerWaalsContact O-CB 3.32Å; L591-A595 WeakPolarHBondContact O-CB 3.4Å; L591-A595 PolarHBondContact O-N 3.37Å; A595-P597 VanDerWaalsContact C-CD 3.42Å; A595-P597 VanDerWaalsContact C-N 3.33Å; A595-L598 HydrophobicContact CB-CB 4.05Å; A595-L598 WeakPolarHBondContact O-CA 3.49Å; A595-L598 WeakPolarHBondContact O-CB 3.39Å; A595-L598 PolarHBondContact O-N 3.44Å; A595-A599 PolarHBondContact O-N 2.91Å
596	E	95.8	Very high	95.3	Very high	106 Å²	106	56.5 Å²	56.5	50%	0.495	28%	0.283	S	S	.	.	H	α-helix	trans	-53.3	-35.3	-179.4	174	51.7	-154.8	0	0	115.1	L598 A599 A600 R603	E596-L598 VanDerWaalsContact C-N 3.25Å; E596-L598 PolarHBondContact O-N 3.13Å; E596-A599 WeakPolarHBondContact O-CB 3.32Å; E596-A599 PolarHBondContact O-N 3.01Å; E596-A599 WeakPolarHBondContact OE2-CB 3.49Å; E596-A600 WeakPolarHBondContact O-CB 3.34Å; E596-A600 PolarHBondContact O-N 3.08Å; E596-R603 IonicContact OE1-CZ 3.11Å; E596-R603 IonicContact OE1-NH1 3.58Å; E596-R603 PolarHBondContact OE1-NH1 2.91Å; E596-R603 IonicContact OE1-NH2 3.53Å; E596-R603 PolarHBondContact OE1-NH2 3.24Å; E596-R603 IonicContact OE2-CZ 3.17Å; E596-R603 IonicContact OE2-NH1 2.7Å; E596-R603 PolarHBondContact OE2-NH1 3.47Å; E596-R603 IonicContact OE2-NH2 2.68Å
597	P	96.6	Very high	95.3	Very high	69 Å²	69	53.1 Å²	53.1	45%	0.448	26%	0.264	S	S	.	.	H	α-helix	trans	-59.2	-34.4	171.7	-26.5	36.5	0	0	0	113.8	A595 V601 V651	A595-P597 VanDerWaalsContact C-CD 3.42Å; A595-P597 VanDerWaalsContact C-N 3.33Å; P597-V601 PolarHBondContact O-N 3.41Å; P597-V651 HydrophobicContact CB-CG1 3.9Å
598	L	97.1	Very high	95.2	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-76.9	-39.4	175.6	-171.9	67.6	0	0	0	111.1	W558 I584 L591 Y592 A595 E596 V601 L602 Y643 L648 V651	W558-L598 HydrophobicContact CE3-CD2 4.49Å; W558-L598 HydrophobicContact CH2-CB 3.89Å; W558-L598 HydrophobicContact CH2-CD1 4.18Å; W558-L598 HydrophobicContact CH2-CD2 4.25Å; W558-L598 HydrophobicContact CH2-CG 4.33Å; W558-L598 HydrophobicContact CZ2-CB 4.32Å; W558-L598 HydrophobicContact CZ3-CB 4.27Å; W558-L598 HydrophobicContact CZ3-CD1 4.41Å; W558-L598 HydrophobicContact CZ3-CD2 3.83Å; W558-L598 HydrophobicContact CZ3-CG 4.4Å; I584-L598 HydrophobicContact CG2-CD2 4.06Å; L591-L598 HydrophobicContact CD2-CD2 3.69Å; L591-L598 HydrophobicContact CG-CD2 3.97Å; Y592-L598 HydrophobicContact CD1-CD2 4.01Å; Y592-L598 HydrophobicContact CD1-CG 3.9Å; Y592-L598 HydrophobicContact CE1-CD2 4.02Å; Y592-L598 HydrophobicContact CE1-CG 3.85Å; A595-L598 HydrophobicContact CB-CB 4.05Å; A595-L598 WeakPolarHBondContact O-CA 3.49Å; A595-L598 WeakPolarHBondContact O-CB 3.39Å; A595-L598 PolarHBondContact O-N 3.44Å; E596-L598 VanDerWaalsContact C-N 3.25Å; E596-L598 PolarHBondContact O-N 3.13Å; L598-V601 PolarHBondContact O-N 3.12Å; L598-L602 PolarHBondContact O-N 3.05Å; L598-Y643 HydrophobicContact CD1-CE1 3.9Å; L598-Y643 HydrophobicContact CD1-CE2 4.45Å; L598-L648 HydrophobicContact CD1-CD2 4.06Å; L598-V651 HydrophobicContact CB-CG1 4.17Å; L598-V651 HydrophobicContact CD1-CG1 4.26Å; L598-V651 HydrophobicContact CD1-CG2 4.04Å
599	A	96.2	Very high	95	Very high	9 Å²	9	50 Å²	50	7%	0.074	25%	0.247	C	C	.	.	H	α-helix	trans	-59.5	-45	173.8	0	0	0	0	0	111.8	Y592 A595 E596 V601 L602 R603	Y592-A599 VanDerWaalsContact O-CB 3.29Å; Y592-A599 WeakPolarHBondContact O-CB 3.44Å; A595-A599 PolarHBondContact O-N 2.91Å; E596-A599 WeakPolarHBondContact O-CB 3.32Å; E596-A599 PolarHBondContact O-N 3.01Å; E596-A599 WeakPolarHBondContact OE2-CB 3.49Å; A599-V601 VanDerWaalsContact C-N 3.31Å; A599-V601 PolarHBondContact O-N 3.38Å; A599-L602 WeakPolarHBondContact O-CB 3.31Å; A599-L602 PolarHBondContact O-N 3.22Å; A599-L602 VanDerWaalsContact O-N 3.16Å; A599-R603 WeakPolarHBondContact O-CG 3.31Å; A599-R603 PolarHBondContact O-N 3Å
600	A	96.1	Very high	94.7	Very high	25 Å²	25	48.2 Å²	48.2	21%	0.207	23%	0.232	C	C	.	.	H	α-helix	trans	-59.4	-40.7	174.5	0	0	0	0	0	112.1	E596 L604	E596-A600 WeakPolarHBondContact O-CB 3.34Å; E596-A600 PolarHBondContact O-N 3.08Å; A600-L604 VanDerWaalsContact O-CG 3.26Å; A600-L604 WeakPolarHBondContact O-CG 3.32Å; A600-L604 PolarHBondContact O-N 2.95Å; A600-L604 VanDerWaalsContact O-N 3.08Å
601	V	96.9	Very high	94.6	Very high	1 Å²	1	43.4 Å²	43.4	1%	0.006	21%	0.208	C	C	.	.	H	α-helix	trans	-68.4	-38.1	174.3	166	0	0	0	0	112.1	P597 L598 A599 L604 R605 Y643 V651 L656 A657 L660	P597-V601 PolarHBondContact O-N 3.41Å; L598-V601 PolarHBondContact O-N 3.12Å; A599-V601 VanDerWaalsContact C-N 3.31Å; A599-V601 PolarHBondContact O-N 3.38Å; V601-L604 PolarHBondContact O-N 3.39Å; V601-R605 HydrophobicContact CG1-CG 4.41Å; V601-R605 WeakPolarHBondContact O-CG 3.44Å; V601-R605 PolarHBondContact O-N 3.48Å; V601-Y643 HydrophobicContact CG1-CE1 3.95Å; V601-V651 HydrophobicContact CB-CG2 4.43Å; V601-V651 HydrophobicContact CG1-CG2 4.37Å; V601-V651 HydrophobicContact CG2-CG2 4.19Å; V601-L656 HydrophobicContact CG1-CD2 3.85Å; V601-L656 HydrophobicContact CG1-CG 4.22Å; V601-L656 HydrophobicContact CG2-CB 4.32Å; V601-L656 HydrophobicContact CG2-CG 4.35Å; V601-A657 HydrophobicContact CG2-CB 3.9Å; V601-L660 HydrophobicContact CG1-CD1 3.99Å
602	L	95.7	Very high	94.5	Very high	19 Å²	19	45.3 Å²	45.3	10%	0.099	22%	0.215	C	C	.	.	H	α-helix	trans	-60.2	-48.6	173.7	177	61.5	0	0	0	111.3	Y592 L598 A599 L604 R605 Q606 I640 H641	Y592-L602 HydrophobicContact CD1-CB 3.99Å; Y592-L602 HydrophobicContact CD1-CD2 3.69Å; Y592-L602 HydrophobicContact CD1-CG 4.42Å; Y592-L602 HydrophobicContact CD2-CD2 4.14Å; Y592-L602 HydrophobicContact CE1-CB 3.78Å; Y592-L602 HydrophobicContact CE1-CD1 4.36Å; Y592-L602 HydrophobicContact CE1-CD2 3.7Å; Y592-L602 HydrophobicContact CE1-CG 4.14Å; Y592-L602 HydrophobicContact CE2-CD2 4.15Å; Y592-L602 HydrophobicContact CG-CD2 3.91Å; L598-L602 PolarHBondContact O-N 3.05Å; A599-L602 WeakPolarHBondContact O-CB 3.31Å; A599-L602 PolarHBondContact O-N 3.22Å; A599-L602 VanDerWaalsContact O-N 3.16Å; L602-L604 VanDerWaalsContact C-N 3.31Å; L602-L604 PolarHBondContact O-N 3.11Å; L602-R605 CarbonylContact O-C 3.53Å; L602-R605 PolarHBondContact O-N 3.47Å; L602-Q606 HydrophobicContact CD1-CG 4.21Å; L602-Q606 HydrophobicContact CG-CG 4.4Å; L602-Q606 WeakPolarHBondContact O-CG 3.31Å; L602-Q606 PolarHBondContact O-N 3.07Å; L602-I640 HydrophobicContact CD1-CB 4.39Å; L602-I640 HydrophobicContact CD1-CD1 4.24Å; L602-I640 HydrophobicContact CD1-CG1 4.43Å; L602-H641 WeakPolarHBondContact CD1-ND1 3.38Å
603	R	93.8	Very high	94.2	Very high	115 Å²	115	45 Å²	45	43%	0.434	22%	0.217	S	C	.	.	H	α-helix	trans	-58	-43	177.4	-65	-176.7	-51.2	-106.9	7.1	111.3	E596 A599 R605 Q606 R607	E596-R603 IonicContact OE1-CZ 3.11Å; E596-R603 IonicContact OE1-NH1 3.58Å; E596-R603 PolarHBondContact OE1-NH1 2.91Å; E596-R603 IonicContact OE1-NH2 3.53Å; E596-R603 PolarHBondContact OE1-NH2 3.24Å; E596-R603 IonicContact OE2-CZ 3.17Å; E596-R603 IonicContact OE2-NH1 2.7Å; E596-R603 PolarHBondContact OE2-NH1 3.47Å; E596-R603 IonicContact OE2-NH2 2.68Å; A599-R603 WeakPolarHBondContact O-CG 3.31Å; A599-R603 PolarHBondContact O-N 3Å; R603-R605 PolarHBondContact O-N 2.66Å; R603-Q606 PolarHBondContact O-N 3.16Å; R603-R607 WeakPolarHBondContact O-CB 3.48Å; R603-R607 PolarHBondContact O-N 2.76Å
604	L	95.3	Very high	94.1	Very high	41 Å²	41	38.2 Å²	38.2	22%	0.215	19%	0.186	C	C	.	.	H	α-helix	trans	-63.1	-39.5	173.4	-67.7	168.1	0	0	0	112.7	A600 V601 L602 L608 A657 L660 I664	A600-L604 VanDerWaalsContact O-CG 3.26Å; A600-L604 WeakPolarHBondContact O-CG 3.32Å; A600-L604 PolarHBondContact O-N 2.95Å; A600-L604 VanDerWaalsContact O-N 3.08Å; V601-L604 PolarHBondContact O-N 3.39Å; L602-L604 VanDerWaalsContact C-N 3.31Å; L602-L604 PolarHBondContact O-N 3.11Å; L604-L608 VanDerWaalsContact O-CB 3.24Å; L604-L608 WeakPolarHBondContact O-CB 3.38Å; L604-L608 PolarHBondContact O-N 3.23Å; L604-A657 HydrophobicContact CD1-CB 3.61Å; L604-L660 HydrophobicContact CB-CB 4.19Å; L604-L660 HydrophobicContact CB-CD1 4.09Å; L604-L660 HydrophobicContact CD1-CB 4.38Å; L604-I664 HydrophobicContact CB-CD1 3.86Å; L604-I664 HydrophobicContact CD2-CD1 3.58Å; L604-I664 HydrophobicContact CG-CD1 4.32Å; L604-I664 WeakPolarHBondContact O-CD1 3.42Å
605	R	95.3	Very high	94.1	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-70.1	-37.1	176.7	-71.2	179	77.5	175.4	2.8	112.8	V601 L602 R603 L608 K609 Q639 I640 L642 L660	V601-R605 HydrophobicContact CG1-CG 4.41Å; V601-R605 WeakPolarHBondContact O-CG 3.44Å; V601-R605 PolarHBondContact O-N 3.48Å; L602-R605 CarbonylContact O-C 3.53Å; L602-R605 PolarHBondContact O-N 3.47Å; R603-R605 PolarHBondContact O-N 2.66Å; R605-L608 PolarHBondContact O-N 3.07Å; R605-K609 WeakPolarHBondContact O-CB 3.49Å; R605-K609 PolarHBondContact O-N 3.29Å; R605-Q639 PolarHBondContact NH2-O 2.83Å; R605-I640 HydrophobicContact CB-CB 4.17Å; R605-I640 HydrophobicContact CB-CG2 4.08Å; R605-I640 VanDerWaalsContact CZ-O 3.23Å; R605-I640 PolarHBondContact NE-O 2.88Å; R605-I640 PolarHBondContact NH1-O 3.08Å; R605-L642 VanDerWaalsContact CZ-O 3.26Å; R605-L642 PolarHBondContact NH1-O 3.12Å; R605-L642 PolarHBondContact NH2-O 3.43Å; R605-L660 HydrophobicContact CG-CD1 3.85Å
606	Q	91.9	Very high	93.9	Very high	71 Å²	71	34.1 Å²	34.1	33%	0.332	17%	0.166	S	C	.	.	H	α-helix	trans	-60.6	-51.6	171.5	-72.7	167.4	-48.7	0	0	110.5	L602 R603 L608 K609 S610 I640	L602-Q606 HydrophobicContact CD1-CG 4.21Å; L602-Q606 HydrophobicContact CG-CG 4.4Å; L602-Q606 WeakPolarHBondContact O-CG 3.31Å; L602-Q606 PolarHBondContact O-N 3.07Å; R603-Q606 PolarHBondContact O-N 3.16Å; Q606-L608 VanDerWaalsContact C-N 3.29Å; Q606-L608 PolarHBondContact O-N 3.22Å; Q606-K609 WeakPolarHBondContact O-CB 3.41Å; Q606-K609 PolarHBondContact O-N 2.99Å; Q606-K609 VanDerWaalsContact O-N 3.07Å; Q606-S610 PolarHBondContact O-N 2.7Å; Q606-I640 HydrophobicContact CG-CD1 3.69Å
607	R	92.5	Very high	93.8	Very high	68 Å²	68	31.9 Å²	31.9	26%	0.257	16%	0.162	S	C	.	.	H	α-helix	trans	-57.2	-41.5	176.5	-162.8	178.4	-172.3	-163.3	2.7	112.5	R603 S610 L611 F696	R603-R607 WeakPolarHBondContact O-CB 3.48Å; R603-R607 PolarHBondContact O-N 2.76Å; R607-S610 PolarHBondContact O-N 3.06Å; R607-L611 HydrophobicContact CG-CD1 4.34Å; R607-L611 WeakPolarHBondContact O-CD1 3.36Å; R607-L611 WeakPolarHBondContact O-CG 3.38Å; R607-L611 PolarHBondContact O-N 2.91Å; R607-F696 HydrophobicContact CG-CB 3.81Å; R607-F696 VanDerWaalsContact CZ-O 3.26Å; R607-F696 PolarHBondContact NE-O 3.49Å; R607-F696 PolarHBondContact NH2-O 2.95Å
608	L	93.4	Very high	93.6	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-68.7	-34.3	176.3	-176.1	60.8	0	0	0	113	L604 R605 Q606 L611 R612 L626 I630 L637 L660 V663 I664	L604-L608 VanDerWaalsContact O-CB 3.24Å; L604-L608 WeakPolarHBondContact O-CB 3.38Å; L604-L608 PolarHBondContact O-N 3.23Å; R605-L608 PolarHBondContact O-N 3.07Å; Q606-L608 VanDerWaalsContact C-N 3.29Å; Q606-L608 PolarHBondContact O-N 3.22Å; L608-L611 PolarHBondContact O-N 3.37Å; L608-R612 PolarHBondContact O-N 3.12Å; L608-L626 HydrophobicContact CD1-CD1 4.34Å; L608-I630 HydrophobicContact CD2-CD1 4.01Å; L608-L637 HydrophobicContact CD1-CD2 4.13Å; L608-L637 HydrophobicContact CD2-CD2 4.02Å; L608-L637 HydrophobicContact CG-CD2 3.82Å; L608-L660 HydrophobicContact CD2-CD2 3.88Å; L608-V663 HydrophobicContact CD1-CG1 4.24Å; L608-I664 HydrophobicContact CB-CD1 4.36Å; L608-I664 HydrophobicContact CB-CG1 4.1Å; L608-I664 HydrophobicContact CD1-CG1 4.15Å
609	K	90.3	Very high	93.4	Very high	50 Å²	50	37.4 Å²	37.4	22%	0.217	18%	0.177	C	C	.	.	H	α-helix	trans	-63.9	-42.2	172.3	-177.3	-174.9	175.1	-174.2	0	111.3	L23 R605 Q606 R612 I640	L23-K609 HydrophobicContact CD2-CD 3.94Å; R605-K609 WeakPolarHBondContact O-CB 3.49Å; R605-K609 PolarHBondContact O-N 3.29Å; Q606-K609 WeakPolarHBondContact O-CB 3.41Å; Q606-K609 PolarHBondContact O-N 2.99Å; Q606-K609 VanDerWaalsContact O-N 3.07Å; K609-R612 WeakPolarHBondContact O-CB 3.31Å; K609-R612 PolarHBondContact O-N 3.09Å; K609-I640 HydrophobicContact CB-CG2 4.03Å; K609-I640 HydrophobicContact CD-CG2 3.95Å; K609-I640 HydrophobicContact CG-CG2 4.49Å
610	S	89.2	Confident	93.2	Very high	13 Å²	13	40.7 Å²	40.7	9%	0.091	20%	0.204	C	C	.	.	H	α-helix	trans	-61.6	-47.5	172.3	-64.3	0	0	0	0	111.5	Q606 R607 R612 A613 Y614 P695	Q606-S610 PolarHBondContact O-N 2.7Å; R607-S610 PolarHBondContact O-N 3.06Å; S610-R612 VanDerWaalsContact C-N 3.33Å; S610-R612 PolarHBondContact O-N 3.11Å; S610-A613 WeakPolarHBondContact O-CB 3.12Å; S610-A613 PolarHBondContact O-N 3.35Å; S610-Y614 WeakPolarHBondContact O-CD2 3.27Å; S610-P695 PolarHBondContact OG-O 3.33Å
611	L	93	Very high	93.1	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-63.4	-32.4	178.4	-75.4	160.7	0	0	0	113.8	R607 L608 A613 Y614 L615 I664 A667 T668 V671 F696	R607-L611 HydrophobicContact CG-CD1 4.34Å; R607-L611 WeakPolarHBondContact O-CD1 3.36Å; R607-L611 WeakPolarHBondContact O-CG 3.38Å; R607-L611 PolarHBondContact O-N 2.91Å; L608-L611 PolarHBondContact O-N 3.37Å; L611-A613 PolarHBondContact O-N 2.96Å; L611-Y614 PolarHBondContact O-N 3.4Å; L611-L615 WeakPolarHBondContact O-CD1 3.48Å; L611-L615 PolarHBondContact O-N 3.43Å; L611-I664 HydrophobicContact CD1-CB 4.44Å; L611-I664 HydrophobicContact CD1-CG1 4.41Å; L611-I664 HydrophobicContact CD1-CG2 3.88Å; L611-A667 HydrophobicContact CB-CB 4.04Å; L611-A667 HydrophobicContact CD1-CB 4.16Å; L611-A667 HydrophobicContact CD2-CB 4.16Å; L611-A667 HydrophobicContact CG-CB 4.36Å; L611-T668 HydrophobicContact CD1-CG2 3.74Å; L611-T668 HydrophobicContact CD2-CG2 3.88Å; L611-T668 HydrophobicContact CG-CG2 4.45Å; L611-V671 HydrophobicContact CD2-CG2 4.04Å; L611-F696 HydrophobicContact CD1-CB 4.49Å; L611-F696 HydrophobicContact CD1-CG 4.46Å; L611-F696 HydrophobicContact CD2-CB 4.47Å; L611-F696 HydrophobicContact CD2-CD1 3.45Å; L611-F696 VanDerWaalsContact CD2-CD1 3.45Å; L611-F696 HydrophobicContact CD2-CD2 3.99Å; L611-F696 HydrophobicContact CD2-CE1 3.51Å; L611-F696 HydrophobicContact CD2-CE2 4.07Å; L611-F696 HydrophobicContact CD2-CG 3.72Å; L611-F696 HydrophobicContact CD2-CZ 3.84Å; L611-F696 HydrophobicContact CG-CB 4.06Å; L611-F696 HydrophobicContact CG-CD1 3.83Å; L611-F696 HydrophobicContact CG-CD2 4.4Å; L611-F696 HydrophobicContact CG-CE1 4.38Å; L611-F696 HydrophobicContact CG-CG 3.85Å
612	R	92.6	Very high	93	Very high	45 Å²	45	43.8 Å²	43.8	17%	0.17	23%	0.228	C	C	.	.	H	α-helix	trans	-54.2	-42.2	174.1	-178	-165.4	167.6	97.1	-9.5	111.2	L608 K609 S610 Y614 L615 F616 L637	L608-R612 PolarHBondContact O-N 3.12Å; K609-R612 WeakPolarHBondContact O-CB 3.31Å; K609-R612 PolarHBondContact O-N 3.09Å; S610-R612 VanDerWaalsContact C-N 3.33Å; S610-R612 PolarHBondContact O-N 3.11Å; R612-Y614 PolarHBondContact O-N 2.98Å; R612-L615 PolarHBondContact O-N 2.75Å; R612-F616 HydrophobicContact CG-CD2 3.61Å; R612-F616 HydrophobicContact CG-CE2 3.81Å; R612-F616 HydrophobicContact CG-CG 4.09Å; R612-F616 HydrophobicContact CG-CZ 4.42Å; R612-F616 VanDerWaalsContact O-CB 3.32Å; R612-F616 WeakPolarHBondContact O-CB 3.29Å; R612-F616 WeakPolarHBondContact O-CD2 3.41Å; R612-F616 PolarHBondContact O-N 2.89Å; R612-L637 HydrophobicContact CB-CD2 4.48Å; R612-L637 WeakPolarHBondContact CD-O 3.32Å
613	A	90.3	Very high	92.8	Very high	18 Å²	18	43.2 Å²	43.2	15%	0.149	23%	0.226	C	C	.	.	H	α-helix	trans	-59.8	-44.3	-177.8	0	0	0	0	0	112.3	F19 F20 S610 L611 S617	F19-A613 HydrophobicContact CD1-CB 3.93Å; F19-A613 HydrophobicContact CE1-CB 3.59Å; F19-A613 HydrophobicContact CZ-CB 4.28Å; F20-A613 HydrophobicContact CE1-CB 4.33Å; F20-A613 HydrophobicContact CZ-CB 3.99Å; S610-A613 WeakPolarHBondContact O-CB 3.12Å; S610-A613 PolarHBondContact O-N 3.35Å; L611-A613 PolarHBondContact O-N 2.96Å; A613-S617 WeakPolarHBondContact O-CB 3.44Å; A613-S617 PolarHBondContact O-N 2.86Å; A613-S617 PolarHBondContact O-OG 2.89Å
614	Y	93.2	Very high	92.8	Very high	5 Å²	5	40.9 Å²	40.9	2%	0.02	22%	0.22	C	C	.	.	H	α-helix	trans	-63.4	-51.8	175.9	-71.6	-92.8	0	0	0	111.5	F20 S610 L611 R612 S617 C618 V671 C677 K680 Y694 P695 F696	F20-Y614 AromaticContact CZ-CE2 3.93Å; F20-Y614 HydrophobicContact CZ-CE2 3.93Å; S610-Y614 WeakPolarHBondContact O-CD2 3.27Å; L611-Y614 PolarHBondContact O-N 3.4Å; R612-Y614 PolarHBondContact O-N 2.98Å; Y614-S617 PolarHBondContact O-N 3.01Å; Y614-S617 PolarHBondContact O-OG 2.94Å; Y614-C618 WeakPolarHBondContact O-CB 3.44Å; Y614-C618 PolarHBondContact O-N 2.98Å; Y614-V671 HydrophobicContact CD1-CG1 4.22Å; Y614-V671 HydrophobicContact CD1-CG2 4.32Å; Y614-V671 HydrophobicContact CG-CG2 4.02Å; Y614-C677 HydrophobicContact CD1-CB 4.34Å; Y614-K680 HydrophobicContact CD1-CB 4.07Å; Y614-K680 HydrophobicContact CE1-CB 3.63Å; Y614-K680 VanDerWaalsContact CE1-O 3.23Å; Y614-K680 WeakPolarHBondContact CE1-O 3.29Å; Y614-K680 PolarHBondContact OH-O 3.13Å; Y614-Y694 HydrophobicContact CE1-CD1 4.04Å; Y614-Y694 HydrophobicContact CE1-CE1 4.3Å; Y614-P695 WeakPolarHBondContact OH-CD 3.43Å; Y614-F696 HydrophobicContact CD2-CD1 4.31Å; Y614-F696 HydrophobicContact CD2-CE1 4.12Å; Y614-F696 HydrophobicContact CE2-CD1 4.15Å; Y614-F696 HydrophobicContact CE2-CE1 4.05Å
615	L	94.2	Very high	92.8	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-70.7	-37.4	-174.1	-86.8	70	0	0	0	113.1	L611 R612 S617 C618 V622 L626 F666 A667 V671	L611-L615 WeakPolarHBondContact O-CD1 3.48Å; L611-L615 PolarHBondContact O-N 3.43Å; R612-L615 PolarHBondContact O-N 2.75Å; L615-S617 VanDerWaalsContact C-N 3.34Å; L615-C618 PolarHBondContact O-N 3.16Å; L615-V622 HydrophobicContact CB-CG1 4.41Å; L615-V622 HydrophobicContact CD2-CG1 3.82Å; L615-V622 HydrophobicContact CG-CG1 3.81Å; L615-L626 HydrophobicContact CB-CD2 4.13Å; L615-L626 HydrophobicContact CD2-CB 4.2Å; L615-L626 HydrophobicContact CD2-CD2 3.97Å; L615-F666 HydrophobicContact CD2-CE1 4.13Å; L615-A667 HydrophobicContact CD1-CB 4.05Å; L615-A667 HydrophobicContact CD2-CB 3.81Å; L615-V671 HydrophobicContact CD1-CG2 3.86Å
616	F	93.1	Very high	92.7	Very high	62 Å²	62	41.6 Å²	41.6	27%	0.272	22%	0.224	S	C	.	.	H	α-helix	trans	-74.6	-22.4	178.2	-83.8	-123.2	0	0	0	113	R612 A623 L626 R627 L637	R612-F616 HydrophobicContact CG-CD2 3.61Å; R612-F616 HydrophobicContact CG-CE2 3.81Å; R612-F616 HydrophobicContact CG-CG 4.09Å; R612-F616 HydrophobicContact CG-CZ 4.42Å; R612-F616 VanDerWaalsContact O-CB 3.32Å; R612-F616 WeakPolarHBondContact O-CB 3.29Å; R612-F616 WeakPolarHBondContact O-CD2 3.41Å; R612-F616 PolarHBondContact O-N 2.89Å; F616-A623 HydrophobicContact CD2-CB 4.1Å; F616-A623 HydrophobicContact CE2-CB 4.38Å; F616-A623 HydrophobicContact CG-CB 4.22Å; F616-L626 HydrophobicContact CD2-CD2 4.32Å; F616-L626 HydrophobicContact CE2-CD2 3.97Å; F616-L626 HydrophobicContact CE2-CG 4.48Å; F616-R627 HydrophobicContact CZ-CG 4.02Å; F616-L637 HydrophobicContact CE2-CD1 4.32Å; F616-L637 HydrophobicContact CZ-CD1 4.27Å
617	S	92.6	Very high	92.7	Very high	58 Å²	58	42.3 Å²	42.3	41%	0.406	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.2	9.5	172.7	67.2	0	0	0	0	113.7	A613 Y614 L615 K680	A613-S617 WeakPolarHBondContact O-CB 3.44Å; A613-S617 PolarHBondContact O-N 2.86Å; A613-S617 PolarHBondContact O-OG 2.89Å; Y614-S617 PolarHBondContact O-N 3.01Å; Y614-S617 PolarHBondContact O-OG 2.94Å; L615-S617 VanDerWaalsContact C-N 3.34Å; S617-K680 PolarHBondContact O-NZ 3.16Å; S617-K680 PolarHBondContact OG-NZ 3.28Å
618	C	93.6	Very high	92.8	Very high	26 Å²	26	46.1 Å²	46.1	18%	0.176	24%	0.238	C	C	.	.	S	Bend	trans	-97.5	-130.5	176.7	-170.3	0	0	0	0	110.1	Y614 L615 H670 C674 C677	Y614-C618 WeakPolarHBondContact O-CB 3.44Å; Y614-C618 PolarHBondContact O-N 2.98Å; L615-C618 PolarHBondContact O-N 3.16Å; C618-H670 PolarHBondContact SG-NE2 2.64Å; C618-C674 VanDerWaalsContact SG-SG 3.64Å; C618-C677 VanDerWaalsContact SG-SG 3.65Å
619	R	92.6	Very high	92.8	Very high	160 Å²	160	51.4 Å²	51.4	60%	0.604	26%	0.258	S	S	*	.			trans	-92.2	134.6	177.9	-60.1	179.7	-176.9	179.2	0.1	110.2	A621 V622 A623 L676	R619-A621 VanDerWaalsContact C-N 3.26Å; R619-A621 PolarHBondContact O-N 3.14Å; R619-A621 VanDerWaalsContact O-N 3.1Å; R619-V622 HydrophobicContact CB-CG2 4.28Å; R619-V622 WeakPolarHBondContact O-CB 3.43Å; R619-V622 PolarHBondContact O-N 3.31Å; R619-A623 PolarHBondContact O-N 2.88Å; R619-L676 HydrophobicContact CG-CD1 4.18Å
620	A	92.3	Very high	92.9	Very high	77 Å²	77	49.2 Å²	49.2	64%	0.636	25%	0.248	S	C	*	.	H	α-helix	trans	-49.1	-42.6	-177.3	0	0	0	0	0	113.9	V622 A623 E624	A620-V622 PolarHBondContact O-N 2.92Å; A620-V622 VanDerWaalsContact O-N 3.14Å; A620-A623 WeakPolarHBondContact O-CB 3.45Å; A620-A623 PolarHBondContact O-N 2.86Å; A620-A623 VanDerWaalsContact O-N 3.12Å; A620-E624 WeakPolarHBondContact O-CG 3.36Å; A620-E624 PolarHBondContact O-N 2.84Å
621	A	94	Very high	93	Very high	70 Å²	70	55.9 Å²	55.9	58%	0.579	28%	0.276	S	S	*	.	H	α-helix	trans	-55.6	-32.2	177.8	0	0	0	0	0	114.1	R619 D625	R619-A621 VanDerWaalsContact C-N 3.26Å; R619-A621 PolarHBondContact O-N 3.14Å; R619-A621 VanDerWaalsContact O-N 3.1Å; A621-D625 PolarHBondContact O-N 2.96Å
622	V	93.9	Very high	92.8	Very high	22 Å²	22	60 Å²	60	13%	0.133	30%	0.302	C	S	.	.	H	α-helix	trans	-78.6	-38.8	179.4	-174.3	0	0	0	0	111.2	L615 R619 A620 E624 D625 L626	L615-V622 HydrophobicContact CB-CG1 4.41Å; L615-V622 HydrophobicContact CD2-CG1 3.82Å; L615-V622 HydrophobicContact CG-CG1 3.81Å; R619-V622 HydrophobicContact CB-CG2 4.28Å; R619-V622 WeakPolarHBondContact O-CB 3.43Å; R619-V622 PolarHBondContact O-N 3.31Å; A620-V622 PolarHBondContact O-N 2.92Å; A620-V622 VanDerWaalsContact O-N 3.14Å; V622-E624 VanDerWaalsContact C-N 3.32Å; V622-D625 PolarHBondContact O-N 3.33Å; V622-L626 PolarHBondContact O-N 2.95Å
623	A	92.7	Very high	92.7	Very high	6 Å²	6	59.7 Å²	59.7	5%	0.05	30%	0.301	C	S	.	.	H	α-helix	trans	-62	-42.6	172.1	0	0	0	0	0	111	F616 R619 A620 L626 R627	F616-A623 HydrophobicContact CD2-CB 4.1Å; F616-A623 HydrophobicContact CE2-CB 4.38Å; F616-A623 HydrophobicContact CG-CB 4.22Å; R619-A623 PolarHBondContact O-N 2.88Å; A620-A623 WeakPolarHBondContact O-CB 3.45Å; A620-A623 PolarHBondContact O-N 2.86Å; A620-A623 VanDerWaalsContact O-N 3.12Å; A623-L626 WeakPolarHBondContact O-CB 3.19Å; A623-L626 PolarHBondContact O-N 3.15Å; A623-R627 WeakPolarHBondContact O-CG 3.5Å; A623-R627 PolarHBondContact O-N 3.02Å
624	E	93.4	Very high	92.6	Very high	67 Å²	67	61.8 Å²	61.8	31%	0.313	31%	0.308	S	S	.	.	H	α-helix	trans	-67.1	-34.2	175	-65.7	-50.9	132.3	0	0	113.1	A620 V622 L626 R627 R628	A620-E624 WeakPolarHBondContact O-CG 3.36Å; A620-E624 PolarHBondContact O-N 2.84Å; V622-E624 VanDerWaalsContact C-N 3.32Å; E624-L626 VanDerWaalsContact C-N 3.35Å; E624-R627 PolarHBondContact O-N 2.84Å; E624-R627 IonicContact OE1-CZ 3.43Å; E624-R627 IonicContact OE1-NE 3.79Å; E624-R627 IonicContact OE1-NH1 3.85Å; E624-R627 PolarHBondContact OE1-NH1 2.82Å; E624-R627 IonicContact OE1-NH2 2.95Å; E624-R627 IonicContact OE2-NH1 3.31Å; E624-R628 WeakPolarHBondContact O-CB 2.82Å; E624-R628 WeakPolarHBondContact O-CG 2.94Å; E624-R628 PolarHBondContact O-N 2.87Å
625	D	93.9	Very high	92.5	Very high	56 Å²	56	63 Å²	63	30%	0.299	31%	0.313	S	S	.	.	H	α-helix	trans	-65.5	-37.2	170.8	-100.5	6.2	0	0	0	112.3	A621 V622 R628 R629 F666	A621-D625 PolarHBondContact O-N 2.96Å; V622-D625 PolarHBondContact O-N 3.33Å; D625-R628 IonicContact OD1-CZ 2.93Å; D625-R628 VanDerWaalsContact OD1-CZ 3.3Å; D625-R628 IonicContact OD1-NE 2.75Å; D625-R628 PolarHBondContact OD1-NE 2.82Å; D625-R628 IonicContact OD1-NH2 2.68Å; D625-R628 PolarHBondContact OD1-NH2 3.08Å; D625-R629 WeakPolarHBondContact O-CB 3.5Å; D625-R629 WeakPolarHBondContact O-CD 3.42Å; D625-R629 WeakPolarHBondContact O-CG 3.35Å; D625-R629 PolarHBondContact O-N 2.79Å; D625-R629 VanDerWaalsContact O-N 3.12Å; D625-F666 HydrophobicContact CB-CE1 4.19Å; D625-F666 HydrophobicContact CB-CZ 3.71Å
626	L	93.9	Very high	92.3	Very high	0 Å²	0	63 Å²	63	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-66.4	-41.1	174.3	-179.1	56.8	0	0	0	111.5	L608 L615 F616 V622 A623 E624 R629 I630 L637 V663	L608-L626 HydrophobicContact CD1-CD1 4.34Å; L615-L626 HydrophobicContact CB-CD2 4.13Å; L615-L626 HydrophobicContact CD2-CB 4.2Å; L615-L626 HydrophobicContact CD2-CD2 3.97Å; F616-L626 HydrophobicContact CD2-CD2 4.32Å; F616-L626 HydrophobicContact CE2-CD2 3.97Å; F616-L626 HydrophobicContact CE2-CG 4.48Å; V622-L626 PolarHBondContact O-N 2.95Å; A623-L626 WeakPolarHBondContact O-CB 3.19Å; A623-L626 PolarHBondContact O-N 3.15Å; E624-L626 VanDerWaalsContact C-N 3.35Å; L626-R629 PolarHBondContact O-N 2.84Å; L626-I630 HydrophobicContact CD1-CD1 3.84Å; L626-I630 HydrophobicContact CG-CD1 4.38Å; L626-I630 PolarHBondContact O-N 2.83Å; L626-L637 HydrophobicContact CD2-CD2 4.21Å; L626-L637 HydrophobicContact CG-CD1 4.46Å; L626-L637 HydrophobicContact CG-CD2 4.34Å; L626-V663 HydrophobicContact CD1-CG1 3.44Å; L626-V663 VanDerWaalsContact CD1-CG1 3.44Å
627	R	93	Very high	91.9	Very high	86 Å²	86	60.1 Å²	60.1	33%	0.325	30%	0.3	S	S	.	.	H	α-helix	trans	-60.8	-52.2	172.7	-67.6	179.2	-164	176	2	111.4	F616 A623 E624 R629 I630 F631	F616-R627 HydrophobicContact CZ-CG 4.02Å; A623-R627 WeakPolarHBondContact O-CG 3.5Å; A623-R627 PolarHBondContact O-N 3.02Å; E624-R627 PolarHBondContact O-N 2.84Å; E624-R627 IonicContact OE1-CZ 3.43Å; E624-R627 IonicContact OE1-NE 3.79Å; E624-R627 IonicContact OE1-NH1 3.85Å; E624-R627 PolarHBondContact OE1-NH1 2.82Å; E624-R627 IonicContact OE1-NH2 2.95Å; E624-R627 IonicContact OE2-NH1 3.31Å; R627-R629 PolarHBondContact O-N 2.89Å; R627-R629 VanDerWaalsContact O-N 3.11Å; R627-I630 PolarHBondContact O-N 2.95Å; R627-F631 PolarHBondContact O-N 2.85Å
628	R	93.9	Very high	91.5	Very high	148 Å²	148	62.2 Å²	62.2	56%	0.558	30%	0.304	S	S	*	.	H	α-helix	trans	-53.6	-32.6	177.1	-80.6	-173.9	-75.2	-85.6	3.9	113.8	E624 D625	E624-R628 WeakPolarHBondContact O-CB 2.82Å; E624-R628 WeakPolarHBondContact O-CG 2.94Å; E624-R628 PolarHBondContact O-N 2.87Å; D625-R628 IonicContact OD1-CZ 2.93Å; D625-R628 VanDerWaalsContact OD1-CZ 3.3Å; D625-R628 IonicContact OD1-NE 2.75Å; D625-R628 PolarHBondContact OD1-NE 2.82Å; D625-R628 IonicContact OD1-NH2 2.68Å; D625-R628 PolarHBondContact OD1-NH2 3.08Å
629	R	93.7	Very high	91.3	Very high	111 Å²	111	66 Å²	66	42%	0.419	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.3	-13.5	179.1	-72	169.4	-168	-72.4	-2.8	114.4	D625 L626 R627 F659 V663 F666	D625-R629 WeakPolarHBondContact O-CB 3.5Å; D625-R629 WeakPolarHBondContact O-CD 3.42Å; D625-R629 WeakPolarHBondContact O-CG 3.35Å; D625-R629 PolarHBondContact O-N 2.79Å; D625-R629 VanDerWaalsContact O-N 3.12Å; L626-R629 PolarHBondContact O-N 2.84Å; R627-R629 PolarHBondContact O-N 2.89Å; R627-R629 VanDerWaalsContact O-N 3.11Å; R629-F659 WeakPolarHBondContact O-CZ 3.35Å; R629-V663 HydrophobicContact CB-CG1 4.36Å; R629-V663 HydrophobicContact CB-CG2 4.29Å; R629-F666 VanDerWaalsContact CD-CD1 3.48Å
630	I	92.5	Very high	91.3	Very high	3 Å²	3	59.3 Å²	59.3	2%	0.015	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-116.6	-24.8	-175.8	-67.7	175.4	0	0	0	112.2	L608 L626 R627 R633 L636 L637 V663	L608-I630 HydrophobicContact CD2-CD1 4.01Å; L626-I630 HydrophobicContact CD1-CD1 3.84Å; L626-I630 HydrophobicContact CG-CD1 4.38Å; L626-I630 PolarHBondContact O-N 2.83Å; R627-I630 PolarHBondContact O-N 2.95Å; I630-R633 VanDerWaalsContact CG2-O 3.22Å; I630-R633 WeakPolarHBondContact CG2-O 3.3Å; I630-R633 PolarHBondContact O-N 3.42Å; I630-L636 HydrophobicContact CG2-CB 4.37Å; I630-L637 HydrophobicContact CD1-CD1 3.92Å; I630-L637 HydrophobicContact CD1-CD2 3.32Å; I630-L637 HydrophobicContact CD1-CG 3.49Å; I630-L637 VanDerWaalsContact CD1-CG 3.49Å; I630-L637 HydrophobicContact CG2-CG 4.47Å; I630-V663 HydrophobicContact CD1-CG1 3.92Å; I630-V663 HydrophobicContact CG1-CG1 3.96Å; I630-V663 HydrophobicContact CG1-CG2 4.36Å
631	F	89.9	Confident	91.5	Very high	153 Å²	153	56.9 Å²	56.9	67%	0.671	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47	132.8	176.5	-177.5	-87.9	0	0	0	112.2	R627	R627-F631 PolarHBondContact O-N 2.85Å
632	P	89.5	Confident	91.6	Very high	86 Å²	86	54.6 Å²	54.6	56%	0.558	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	cis	-85.1	-4.7	7	33.8	-36.6	0	0	0	115.5	E634	P632-E634 VanDerWaalsContact C-N 3.3Å; P632-E634 PolarHBondContact O-N 2.9Å
633	R	90	Very high	91.8	Very high	39 Å²	39	53.6 Å²	53.6	15%	0.147	24%	0.242	C	C	.	.			trans	-86.5	52.1	-165.5	-55.7	-169	-164.4	145.1	15.5	114.2	I630 Y635 L636 D647 Q650	I630-R633 VanDerWaalsContact CG2-O 3.22Å; I630-R633 WeakPolarHBondContact CG2-O 3.3Å; I630-R633 PolarHBondContact O-N 3.42Å; R633-Y635 HydrophobicContact CB-CE1 3.94Å; R633-Y635 HydrophobicContact CB-CE2 4.19Å; R633-Y635 WeakPolarHBondContact CD-OH 3.39Å; R633-Y635 HydrophobicContact CG-CE1 4.19Å; R633-Y635 PolarHBondContact O-N 3.1Å; R633-Y635 VanDerWaalsContact O-N 3.09Å; R633-L636 HydrophobicContact CB-CD1 3.67Å; R633-L636 HydrophobicContact CB-CG 3.88Å; R633-L636 VanDerWaalsContact O-CB 3.3Å; R633-L636 WeakPolarHBondContact O-CB 3.35Å; R633-L636 WeakPolarHBondContact O-CG 3.26Å; R633-L636 PolarHBondContact O-N 3.14Å; R633-D647 WeakPolarHBondContact CD-OD1 3.16Å; R633-D647 IonicContact CZ-OD1 3.54Å; R633-D647 IonicContact NE-OD1 3.79Å; R633-D647 IonicContact NH1-OD1 2.65Å; R633-D647 PolarHBondContact NH1-OD1 2.86Å; R633-Q650 VanDerWaalsContact NH1-CD 3.33Å
634	E	88.8	Confident	92	Very high	62 Å²	62	53.3 Å²	53.3	29%	0.29	24%	0.24	S	C	.	.	G	3₁₀ helix	trans	-60.4	-22.2	-176.1	-69.1	-152.1	-171.9	0	0	114.6	P632 L636 L637	P632-E634 VanDerWaalsContact C-N 3.3Å; P632-E634 PolarHBondContact O-N 2.9Å; E634-L636 PolarHBondContact O-N 3.19Å; E634-L637 WeakPolarHBondContact O-CB 3.19Å; E634-L637 PolarHBondContact O-N 2.76Å
635	Y	90.4	Very high	92.1	Very high	31 Å²	31	50.3 Å²	50.3	12%	0.122	23%	0.226	C	C	.	.	G	3₁₀ helix	trans	-58	-26.1	171.8	54.3	-99.5	0	0	0	113.2	E578 P580 R633 L637 Q638 Q639 S644 D647	E578-Y635 PolarHBondContact O-OH 3.38Å; P580-Y635 HydrophobicContact CB-CD1 3.81Å; P580-Y635 HydrophobicContact CB-CD2 3.84Å; P580-Y635 HydrophobicContact CB-CE1 3.77Å; P580-Y635 HydrophobicContact CB-CE2 3.84Å; P580-Y635 HydrophobicContact CB-CG 3.82Å; P580-Y635 HydrophobicContact CG-CD1 3.63Å; P580-Y635 HydrophobicContact CG-CE1 3.72Å; P580-Y635 HydrophobicContact CG-CG 4.05Å; R633-Y635 HydrophobicContact CB-CE1 3.94Å; R633-Y635 HydrophobicContact CB-CE2 4.19Å; R633-Y635 WeakPolarHBondContact CD-OH 3.39Å; R633-Y635 HydrophobicContact CG-CE1 4.19Å; R633-Y635 PolarHBondContact O-N 3.1Å; R633-Y635 VanDerWaalsContact O-N 3.09Å; Y635-L637 PolarHBondContact O-N 3.43Å; Y635-Q638 PolarHBondContact O-N 3.44Å; Y635-Q639 PolarHBondContact O-N 2.87Å; Y635-S644 PolarHBondContact OH-OG 3.01Å; Y635-D647 VanDerWaalsContact CE2-OD2 3.31Å; Y635-D647 WeakPolarHBondContact CE2-OD2 3.49Å; Y635-D647 PolarHBondContact OH-OD2 3.07Å; Y635-D647 VanDerWaalsContact OH-OD2 3.07Å
636	L	90.6	Very high	92.3	Very high	1 Å²	1	47.6 Å²	47.6	1%	0.005	21%	0.211	C	C	.	.	G	3₁₀ helix	trans	-59.6	-27.1	175	-64	179.2	0	0	0	112.9	I630 R633 E634 F659	I630-L636 HydrophobicContact CG2-CB 4.37Å; R633-L636 HydrophobicContact CB-CD1 3.67Å; R633-L636 HydrophobicContact CB-CG 3.88Å; R633-L636 VanDerWaalsContact O-CB 3.3Å; R633-L636 WeakPolarHBondContact O-CB 3.35Å; R633-L636 WeakPolarHBondContact O-CG 3.26Å; R633-L636 PolarHBondContact O-N 3.14Å; E634-L636 PolarHBondContact O-N 3.19Å; L636-F659 HydrophobicContact CD1-CE1 4.47Å
637	L	85.3	Confident	92.5	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	21%	0.211	C	C	.	.	G	3₁₀ helix	trans	-81.3	-18.9	176.5	-73.9	177.3	0	0	0	114.5	L608 R612 F616 L626 I630 E634 Y635	L608-L637 HydrophobicContact CD1-CD2 4.13Å; L608-L637 HydrophobicContact CD2-CD2 4.02Å; L608-L637 HydrophobicContact CG-CD2 3.82Å; R612-L637 HydrophobicContact CB-CD2 4.48Å; R612-L637 WeakPolarHBondContact CD-O 3.32Å; F616-L637 HydrophobicContact CE2-CD1 4.32Å; F616-L637 HydrophobicContact CZ-CD1 4.27Å; L626-L637 HydrophobicContact CD2-CD2 4.21Å; L626-L637 HydrophobicContact CG-CD1 4.46Å; L626-L637 HydrophobicContact CG-CD2 4.34Å; I630-L637 HydrophobicContact CD1-CD1 3.92Å; I630-L637 HydrophobicContact CD1-CD2 3.32Å; I630-L637 HydrophobicContact CD1-CG 3.49Å; I630-L637 VanDerWaalsContact CD1-CG 3.49Å; I630-L637 HydrophobicContact CG2-CG 4.47Å; E634-L637 WeakPolarHBondContact O-CB 3.19Å; E634-L637 PolarHBondContact O-N 2.76Å; Y635-L637 PolarHBondContact O-N 3.43Å
638	Q	83.1	Confident	92.7	Very high	102 Å²	102	43.5 Å²	43.5	48%	0.477	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-118.1	-55	-164.7	-54.6	-167	42.6	0	0	112.2	Y635	Y635-Q638 PolarHBondContact O-N 3.44Å
639	Q	89.2	Confident	92.8	Very high	107 Å²	107	38 Å²	38	50%	0.5	18%	0.177	S	C	.	.			trans	-107.2	77.5	-171.5	-67	163.8	-64.8	0	0	109.4	R605 Y635 H641 L642	R605-Q639 PolarHBondContact NH2-O 2.83Å; Y635-Q639 PolarHBondContact O-N 2.87Å; Q639-H641 PolarHBondContact O-N 3.15Å; Q639-L642 HydrophobicContact CB-CB 3.77Å; Q639-L642 HydrophobicContact CB-CD2 4.17Å; Q639-L642 PolarHBondContact O-N 2.72Å
640	I	93.8	Very high	93	Very high	18 Å²	18	34.5 Å²	34.5	9%	0.092	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.6	-20.9	-168.3	59.3	169.9	0	0	0	115.7	L602 R605 Q606 K609	L602-I640 HydrophobicContact CD1-CB 4.39Å; L602-I640 HydrophobicContact CD1-CD1 4.24Å; L602-I640 HydrophobicContact CD1-CG1 4.43Å; R605-I640 HydrophobicContact CB-CB 4.17Å; R605-I640 HydrophobicContact CB-CG2 4.08Å; R605-I640 VanDerWaalsContact CZ-O 3.23Å; R605-I640 PolarHBondContact NE-O 2.88Å; R605-I640 PolarHBondContact NH1-O 3.08Å; Q606-I640 HydrophobicContact CG-CD1 3.69Å; K609-I640 HydrophobicContact CB-CG2 4.03Å; K609-I640 HydrophobicContact CD-CG2 3.95Å; K609-I640 HydrophobicContact CG-CG2 4.49Å
641	H	95.8	Very high	93.3	Very high	27 Å²	27	34.6 Å²	34.6	13%	0.125	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.4	-6.2	179.2	-56.1	-61.7	0	0	0	114.5	D583 I584 Q585 Y592 L602 Q639 Y643	D583-H641 WeakPolarHBondContact CA-O 3.48Å; D583-H641 VanDerWaalsContact OD1-CB 3.26Å; D583-H641 WeakPolarHBondContact OD1-CB 3.41Å; I584-H641 PolarHBondContact N-O 3.41Å; Q585-H641 HydrophobicContact CB-CB 3.74Å; Q585-H641 PolarHBondContact OE1-CD2 3.35Å; Q585-H641 PolarHBondContact OE1-NE2 2.95Å; Y592-H641 AromaticContact CE2-ND1 3.85Å; Y592-H641 AromaticContact CZ-ND1 3.7Å; Y592-H641 PolarHBondContact OH-ND1 3.18Å; Y592-H641 VanDerWaalsContact OH-ND1 3.09Å; L602-H641 WeakPolarHBondContact CD1-ND1 3.38Å; Q639-H641 PolarHBondContact O-N 3.15Å; H641-Y643 WeakPolarHBondContact O-CD2 3.5Å; H641-Y643 VanDerWaalsContact O-CE2 3.31Å; H641-Y643 WeakPolarHBondContact O-CE2 3.41Å
642	L	96.6	Very high	93.6	Very high	22 Å²	22	30 Å²	30	12%	0.115	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	130.3	-179.6	-169	71	0	0	0	110.9	P580 I582 D583 R605 Q639	P580-L642 HydrophobicContact CB-CD2 3.96Å; P580-L642 HydrophobicContact CB-CG 4.07Å; P580-L642 WeakPolarHBondContact O-CD1 3.32Å; P580-L642 WeakPolarHBondContact O-CD2 3.4Å; P580-L642 WeakPolarHBondContact O-CG 3.48Å; I582-L642 CarbonylContact O-C 3.56Å; I582-L642 WeakPolarHBondContact O-CA 3.22Å; D583-L642 HydrophobicContact CB-CD1 4.05Å; R605-L642 VanDerWaalsContact CZ-O 3.26Å; R605-L642 PolarHBondContact NH1-O 3.12Å; R605-L642 PolarHBondContact NH2-O 3.43Å; Q639-L642 HydrophobicContact CB-CB 3.77Å; Q639-L642 HydrophobicContact CB-CD2 4.17Å; Q639-L642 PolarHBondContact O-N 2.72Å
643	Y	97.3	Very high	93.9	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	151	-176.4	-64.1	-100.8	0	0	0	111.5	L581 I582 I584 L598 V601 H641 D647 L648	L581-Y643 PolarHBondContact N-O 3.07Å; I582-Y643 PolarHBondContact N-O 3.46Å; I582-Y643 VanDerWaalsContact N-O 3.11Å; I582-Y643 PolarHBondContact O-N 3.27Å; I584-Y643 HydrophobicContact CB-CD2 4.47Å; I584-Y643 HydrophobicContact CB-CE2 4.4Å; I584-Y643 HydrophobicContact CG1-CD2 3.65Å; I584-Y643 HydrophobicContact CG1-CE2 3.93Å; L598-Y643 HydrophobicContact CD1-CE1 3.9Å; L598-Y643 HydrophobicContact CD1-CE2 4.45Å; V601-Y643 HydrophobicContact CG1-CE1 3.95Å; H641-Y643 WeakPolarHBondContact O-CD2 3.5Å; H641-Y643 VanDerWaalsContact O-CE2 3.31Å; H641-Y643 WeakPolarHBondContact O-CE2 3.41Å; Y643-D647 HydrophobicContact CD1-CB 4.06Å; Y643-L648 HydrophobicContact CD1-CD2 4.14Å; Y643-L648 HydrophobicContact CG-CD2 4.05Å
644	S	97.1	Very high	94.2	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	16%	0.155	C	C	.	.			trans	-87.5	166.1	161.6	65.4	0	0	0	0	111.7	E578 E579 Y635 A646 D647 L648	E578-S644 VanDerWaalsContact C-CB 3.46Å; E578-S644 VanDerWaalsContact O-CB 3.24Å; E578-S644 WeakPolarHBondContact O-CB 3.36Å; E579-S644 VanDerWaalsContact O-CA 3.29Å; E579-S644 WeakPolarHBondContact O-CA 3.22Å; E579-S644 WeakPolarHBondContact O-CB 3.43Å; Y635-S644 PolarHBondContact OH-OG 3.01Å; S644-A646 VanDerWaalsContact C-N 3.26Å; S644-A646 PolarHBondContact O-N 2.62Å; S644-D647 PolarHBondContact N-OD2 2.65Å; S644-D647 VanDerWaalsContact N-OD2 3.16Å; S644-D647 PolarHBondContact O-N 3.28Å; S644-D647 PolarHBondContact OG-N 3.21Å; S644-D647 PolarHBondContact OG-OD2 2.77Å; S644-L648 PolarHBondContact O-N 2.85Å
645	L	96.9	Very high	94.6	Very high	4 Å²	4	33 Å²	33	2%	0.021	17%	0.166	C	C	.	.	H	α-helix	trans	-63.6	-36.2	170.6	-82.3	162.2	0	0	0	111.7	P551 L573 V576 Y577 I582 D647 L648 Q649	P551-L645 HydrophobicContact CB-CD2 3.83Å; P551-L645 HydrophobicContact CG-CD1 3.86Å; P551-L645 HydrophobicContact CG-CD2 3.77Å; P551-L645 HydrophobicContact CG-CG 4.3Å; L573-L645 HydrophobicContact CD2-CD1 4.17Å; V576-L645 HydrophobicContact CG2-CD1 4.4Å; Y577-L645 HydrophobicContact CD2-CB 3.78Å; Y577-L645 HydrophobicContact CE2-CB 4.17Å; Y577-L645 WeakPolarHBondContact O-CB 3.46Å; Y577-L645 PolarHBondContact O-N 2.94Å; I582-L645 HydrophobicContact CD1-CD2 4.22Å; I582-L645 HydrophobicContact CD1-CG 4.16Å; L645-D647 VanDerWaalsContact C-N 3.34Å; L645-D647 PolarHBondContact O-N 2.9Å; L645-L648 PolarHBondContact O-N 3.33Å; L645-Q649 WeakPolarHBondContact O-CB 3.17Å; L645-Q649 PolarHBondContact O-N 2.55Å
646	A	97.4	Very high	94.9	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-57.1	-46.5	171.6	0	0	0	0	0	111.4	Y577 E578 S644 Q649 Q650	Y577-A646 HydrophobicContact CD1-CB 3.87Å; Y577-A646 HydrophobicContact CE1-CB 3.52Å; Y577-A646 HydrophobicContact CG-CB 4.49Å; Y577-A646 PolarHBondContact O-N 2.81Å; E578-A646 HydrophobicContact CG-CB 4.16Å; S644-A646 VanDerWaalsContact C-N 3.26Å; S644-A646 PolarHBondContact O-N 2.62Å; A646-Q649 PolarHBondContact O-N 3.18Å; A646-Q650 WeakPolarHBondContact O-CG 3.41Å; A646-Q650 PolarHBondContact O-N 3.44Å; A646-Q650 PolarHBondContact O-NE2 3.27Å
647	D	97.3	Very high	95.2	Very high	0 Å²	0	33 Å²	33	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-63.6	-47.8	177.6	-65.2	-51.5	0	0	0	111.6	R633 Y635 Y643 S644 L645 Q649 Q650 V651 L656	R633-D647 WeakPolarHBondContact CD-OD1 3.16Å; R633-D647 IonicContact CZ-OD1 3.54Å; R633-D647 IonicContact NE-OD1 3.79Å; R633-D647 IonicContact NH1-OD1 2.65Å; R633-D647 PolarHBondContact NH1-OD1 2.86Å; Y635-D647 VanDerWaalsContact CE2-OD2 3.31Å; Y635-D647 WeakPolarHBondContact CE2-OD2 3.49Å; Y635-D647 PolarHBondContact OH-OD2 3.07Å; Y635-D647 VanDerWaalsContact OH-OD2 3.07Å; Y643-D647 HydrophobicContact CD1-CB 4.06Å; S644-D647 PolarHBondContact N-OD2 2.65Å; S644-D647 VanDerWaalsContact N-OD2 3.16Å; S644-D647 PolarHBondContact O-N 3.28Å; S644-D647 PolarHBondContact OG-N 3.21Å; S644-D647 PolarHBondContact OG-OD2 2.77Å; L645-D647 VanDerWaalsContact C-N 3.34Å; L645-D647 PolarHBondContact O-N 2.9Å; D647-Q649 VanDerWaalsContact C-N 3.3Å; D647-Q649 PolarHBondContact O-N 2.85Å; D647-Q650 CarbonylContact O-C 3.1Å; D647-Q650 WeakPolarHBondContact O-CA 3.24Å; D647-Q650 WeakPolarHBondContact O-CB 3.26Å; D647-Q650 PolarHBondContact O-N 3.08Å; D647-V651 WeakPolarHBondContact O-CG2 3.43Å; D647-V651 PolarHBondContact O-N 3.33Å; D647-L656 HydrophobicContact CB-CD2 3.91Å
648	L	97.1	Very high	95.8	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-59.4	-41	178.1	-66.6	176.3	0	0	0	111.5	I554 W558 I582 I584 L598 Y643 S644 L645 Q650 V651 I652	I554-L648 HydrophobicContact CG2-CD1 4.23Å; W558-L648 HydrophobicContact CZ3-CD2 4.44Å; I582-L648 HydrophobicContact CD1-CD1 3.87Å; I582-L648 HydrophobicContact CG2-CD1 4.49Å; I584-L648 HydrophobicContact CD1-CD2 4.36Å; L598-L648 HydrophobicContact CD1-CD2 4.06Å; Y643-L648 HydrophobicContact CD1-CD2 4.14Å; Y643-L648 HydrophobicContact CG-CD2 4.05Å; S644-L648 PolarHBondContact O-N 2.85Å; L645-L648 PolarHBondContact O-N 3.33Å; L648-Q650 VanDerWaalsContact C-N 3.33Å; L648-Q650 PolarHBondContact O-N 3.48Å; L648-V651 WeakPolarHBondContact O-CB 3.44Å; L648-V651 PolarHBondContact O-N 2.74Å; L648-I652 WeakPolarHBondContact O-CG1 3.36Å; L648-I652 PolarHBondContact O-N 3.44Å
649	Q	97.4	Very high	96.4	Very high	32 Å²	32	35.2 Å²	35.2	15%	0.15	19%	0.188	C	C	.	.	H	α-helix	trans	-63.6	-37.2	172	-167.3	177.8	-62.6	0	0	111.7	L549 Y577 L645 A646 D647 V651 I652 E653	L549-Q649 HydrophobicContact CD1-CB 4.02Å; L549-Q649 HydrophobicContact CD1-CG 3.87Å; Y577-Q649 VanDerWaalsContact OH-CD 3.29Å; Y577-Q649 PolarHBondContact OH-NE2 3.28Å; Y577-Q649 PolarHBondContact OH-OE1 3.2Å; L645-Q649 WeakPolarHBondContact O-CB 3.17Å; L645-Q649 PolarHBondContact O-N 2.55Å; A646-Q649 PolarHBondContact O-N 3.18Å; D647-Q649 VanDerWaalsContact C-N 3.3Å; D647-Q649 PolarHBondContact O-N 2.85Å; Q649-V651 VanDerWaalsContact C-N 3.34Å; Q649-V651 PolarHBondContact O-N 3.2Å; Q649-I652 PolarHBondContact O-N 3.29Å; Q649-E653 HydrophobicContact CG-CG 4.33Å; Q649-E653 WeakPolarHBondContact CG-OE1 3.4Å; Q649-E653 PolarHBondContact NE2-OE1 3.49Å; Q649-E653 WeakPolarHBondContact O-CB 3.4Å; Q649-E653 VanDerWaalsContact O-CG 3.26Å; Q649-E653 WeakPolarHBondContact O-CG 3.34Å; Q649-E653 PolarHBondContact O-N 3.07Å
650	Q	97.4	Very high	96.8	Very high	37 Å²	37	30.1 Å²	30.1	17%	0.173	16%	0.164	C	C	.	.	H	α-helix	trans	-72.8	-19.7	174	-74.3	157.4	81.7	0	0	114.1	R633 A646 D647 L648 G654 K655 L656	R633-Q650 VanDerWaalsContact NH1-CD 3.33Å; A646-Q650 WeakPolarHBondContact O-CG 3.41Å; A646-Q650 PolarHBondContact O-N 3.44Å; A646-Q650 PolarHBondContact O-NE2 3.27Å; D647-Q650 CarbonylContact O-C 3.1Å; D647-Q650 WeakPolarHBondContact O-CA 3.24Å; D647-Q650 WeakPolarHBondContact O-CB 3.26Å; D647-Q650 PolarHBondContact O-N 3.08Å; L648-Q650 VanDerWaalsContact C-N 3.33Å; L648-Q650 PolarHBondContact O-N 3.48Å; Q650-G654 PolarHBondContact O-N 3.11Å; Q650-K655 HydrophobicContact CB-CB 4.3Å; Q650-K655 HydrophobicContact CG-CB 4.37Å; Q650-K655 PolarHBondContact O-N 2.75Å; Q650-L656 HydrophobicContact CB-CB 3.94Å; Q650-L656 PolarHBondContact O-N 2.64Å
651	V	97.6	Very high	96.9	Very high	5 Å²	5	30.2 Å²	30.2	3%	0.03	17%	0.17	C	C	.	.	H	α-helix	trans	-70.3	-50.3	165.7	-179.8	0	0	0	0	109.3	W558 P597 L598 V601 D647 L648 Q649 E653 G654 L656	W558-V651 HydrophobicContact CH2-CB 4.24Å; W558-V651 HydrophobicContact CH2-CG1 3.8Å; W558-V651 HydrophobicContact CZ2-CG1 3.86Å; P597-V651 HydrophobicContact CB-CG1 3.9Å; L598-V651 HydrophobicContact CB-CG1 4.17Å; L598-V651 HydrophobicContact CD1-CG1 4.26Å; L598-V651 HydrophobicContact CD1-CG2 4.04Å; V601-V651 HydrophobicContact CB-CG2 4.43Å; V601-V651 HydrophobicContact CG1-CG2 4.37Å; V601-V651 HydrophobicContact CG2-CG2 4.19Å; D647-V651 WeakPolarHBondContact O-CG2 3.43Å; D647-V651 PolarHBondContact O-N 3.33Å; L648-V651 WeakPolarHBondContact O-CB 3.44Å; L648-V651 PolarHBondContact O-N 2.74Å; Q649-V651 VanDerWaalsContact C-N 3.34Å; Q649-V651 PolarHBondContact O-N 3.2Å; V651-E653 VanDerWaalsContact C-N 3.33Å; V651-E653 PolarHBondContact O-N 3.31Å; V651-G654 PolarHBondContact O-N 2.84Å; V651-L656 HydrophobicContact CG2-CD2 3.9Å
652	I	96.6	Very high	96.9	Very high	58 Å²	58	36.3 Å²	36.3	30%	0.297	20%	0.196	S	C	.	.	H	α-helix	trans	-59.8	-41.7	178.9	-66.2	164	0	0	0	111.3	I554 W558 T560 L648 Q649 G654	I554-I652 HydrophobicContact CD1-CD1 4.17Å; W558-I652 HydrophobicContact CH2-CG1 4.33Å; W558-I652 HydrophobicContact CZ2-CG1 3.99Å; T560-I652 HydrophobicContact CG2-CB 4.42Å; T560-I652 HydrophobicContact CG2-CD1 3.71Å; T560-I652 HydrophobicContact CG2-CG1 3.71Å; T560-I652 HydrophobicContact CG2-CG2 3.84Å; L648-I652 WeakPolarHBondContact O-CG1 3.36Å; L648-I652 PolarHBondContact O-N 3.44Å; Q649-I652 PolarHBondContact O-N 3.29Å; I652-G654 PolarHBondContact O-N 3.47Å
653	E	97.1	Very high	96.9	Very high	83 Å²	83	35.6 Å²	35.6	39%	0.388	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78	-0.3	176.1	-67.7	175.2	-176.9	0	0	113.8	Q649 V651 K655	Q649-E653 HydrophobicContact CG-CG 4.33Å; Q649-E653 WeakPolarHBondContact CG-OE1 3.4Å; Q649-E653 PolarHBondContact NE2-OE1 3.49Å; Q649-E653 WeakPolarHBondContact O-CB 3.4Å; Q649-E653 VanDerWaalsContact O-CG 3.26Å; Q649-E653 WeakPolarHBondContact O-CG 3.34Å; Q649-E653 PolarHBondContact O-N 3.07Å; V651-E653 VanDerWaalsContact C-N 3.33Å; V651-E653 PolarHBondContact O-N 3.31Å; E653-K655 HydrophobicContact CB-CD 4.06Å; E653-K655 HydrophobicContact CB-CG 4.11Å; E653-K655 PolarHBondContact O-N 3.3Å; E653-K655 VanDerWaalsContact OE2-CD 3.32Å; E653-K655 WeakPolarHBondContact OE2-CD 3.46Å; E653-K655 WeakPolarHBondContact OE2-CE 3.49Å; E653-K655 IonicContact OE2-NZ 3.46Å; E653-K655 PolarHBondContact OE2-NZ 2.96Å
654	G	96.4	Very high	96.8	Very high	45 Å²	45	35.8 Å²	35.8	46%	0.464	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	67.4	14.3	179.7	0	0	0	0	0	115.3	Q650 V651 I652 P658	Q650-G654 PolarHBondContact O-N 3.11Å; V651-G654 PolarHBondContact O-N 2.84Å; I652-G654 PolarHBondContact O-N 3.47Å; G654-P658 WeakPolarHBondContact O-CD 3.4Å; G654-P658 WeakPolarHBondContact O-CG 3.16Å
655	K	97.3	Very high	96.7	Very high	121 Å²	121	43.2 Å²	43.2	53%	0.526	23%	0.226	S	C	.	.			trans	-88.7	-32.1	-174	-66.9	175.7	-173.1	166.4	0	113.8	Q650 E653 P658 F659	Q650-K655 HydrophobicContact CB-CB 4.3Å; Q650-K655 HydrophobicContact CG-CB 4.37Å; Q650-K655 PolarHBondContact O-N 2.75Å; E653-K655 HydrophobicContact CB-CD 4.06Å; E653-K655 HydrophobicContact CB-CG 4.11Å; E653-K655 PolarHBondContact O-N 3.3Å; E653-K655 VanDerWaalsContact OE2-CD 3.32Å; E653-K655 WeakPolarHBondContact OE2-CD 3.46Å; E653-K655 WeakPolarHBondContact OE2-CE 3.49Å; E653-K655 IonicContact OE2-NZ 3.46Å; E653-K655 PolarHBondContact OE2-NZ 2.96Å; K655-P658 WeakPolarHBondContact O-CD 3.46Å; K655-F659 PolarHBondContact O-N 3.3Å
656	L	96.6	Very high	96.7	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-69.8	-40	-173.5	-172.8	54.4	0	0	0	112.6	V601 D647 Q650 V651 F659 L660	V601-L656 HydrophobicContact CG1-CD2 3.85Å; V601-L656 HydrophobicContact CG1-CG 4.22Å; V601-L656 HydrophobicContact CG2-CB 4.32Å; V601-L656 HydrophobicContact CG2-CG 4.35Å; D647-L656 HydrophobicContact CB-CD2 3.91Å; Q650-L656 HydrophobicContact CB-CB 3.94Å; Q650-L656 PolarHBondContact O-N 2.64Å; V651-L656 HydrophobicContact CG2-CD2 3.9Å; L656-F659 HydrophobicContact CD1-CD1 4.09Å; L656-F659 WeakPolarHBondContact O-CB 3.45Å; L656-F659 PolarHBondContact O-N 2.85Å; L656-L660 HydrophobicContact CD1-CD1 4.41Å; L656-L660 HydrophobicContact CD1-CG 4.25Å; L656-L660 HydrophobicContact CG-CD1 4.15Å; L656-L660 HydrophobicContact CG-CG 4.44Å; L656-L660 WeakPolarHBondContact O-CG 3.44Å; L656-L660 PolarHBondContact O-N 3.06Å
657	A	96.6	Very high	96.6	Very high	31 Å²	31	45.3 Å²	45.3	26%	0.256	24%	0.235	S	C	.	.	H	α-helix	trans	-63.8	-47	177.9	0	0	0	0	0	113.2	V601 L604 F659 L660 G661	V601-A657 HydrophobicContact CG2-CB 3.9Å; L604-A657 HydrophobicContact CD1-CB 3.61Å; A657-F659 VanDerWaalsContact C-N 3.3Å; A657-F659 PolarHBondContact O-N 3.09Å; A657-L660 PolarHBondContact O-N 3.16Å; A657-G661 PolarHBondContact O-N 3.36Å
658	P	97.5	Very high	96.5	Very high	77 Å²	77	46.1 Å²	46.1	50%	0.5	24%	0.24	S	C	.	.	H	α-helix	trans	-59.6	-33.2	170.6	-28.1	35.7	0	0	0	114.8	G654 K655 K662	G654-P658 WeakPolarHBondContact O-CD 3.4Å; G654-P658 WeakPolarHBondContact O-CG 3.16Å; K655-P658 WeakPolarHBondContact O-CD 3.46Å; P658-K662 WeakPolarHBondContact O-CG 3.07Å; P658-K662 PolarHBondContact O-N 2.91Å
659	F	96.5	Very high	96.4	Very high	72 Å²	72	49.7 Å²	49.7	32%	0.316	27%	0.265	S	S	.	.	H	α-helix	trans	-65.8	-56.1	173.8	169.5	-101.2	0	0	0	111.1	R629 L636 K655 L656 A657 G661 K662 V663	R629-F659 WeakPolarHBondContact O-CZ 3.35Å; L636-F659 HydrophobicContact CD1-CE1 4.47Å; K655-F659 PolarHBondContact O-N 3.3Å; L656-F659 HydrophobicContact CD1-CD1 4.09Å; L656-F659 WeakPolarHBondContact O-CB 3.45Å; L656-F659 PolarHBondContact O-N 2.85Å; A657-F659 VanDerWaalsContact C-N 3.3Å; A657-F659 PolarHBondContact O-N 3.09Å; F659-G661 VanDerWaalsContact C-N 3.26Å; F659-G661 PolarHBondContact O-N 2.75Å; F659-K662 WeakPolarHBondContact O-CB 3.48Å; F659-K662 PolarHBondContact O-N 2.83Å; F659-V663 HydrophobicContact CE2-CG2 4.5Å; F659-V663 HydrophobicContact CZ-CG2 4.35Å; F659-V663 PolarHBondContact O-N 3.03Å
660	L	96.3	Very high	96.3	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-57.1	-40.6	177.2	-67.1	173.8	0	0	0	111.4	V601 L604 R605 L608 L656 A657 K662 V663 I664	V601-L660 HydrophobicContact CG1-CD1 3.99Å; L604-L660 HydrophobicContact CB-CB 4.19Å; L604-L660 HydrophobicContact CB-CD1 4.09Å; L604-L660 HydrophobicContact CD1-CB 4.38Å; R605-L660 HydrophobicContact CG-CD1 3.85Å; L608-L660 HydrophobicContact CD2-CD2 3.88Å; L656-L660 HydrophobicContact CD1-CD1 4.41Å; L656-L660 HydrophobicContact CD1-CG 4.25Å; L656-L660 HydrophobicContact CG-CD1 4.15Å; L656-L660 HydrophobicContact CG-CG 4.44Å; L656-L660 WeakPolarHBondContact O-CG 3.44Å; L656-L660 PolarHBondContact O-N 3.06Å; A657-L660 PolarHBondContact O-N 3.16Å; L660-K662 VanDerWaalsContact C-N 3.31Å; L660-K662 PolarHBondContact O-N 2.85Å; L660-V663 PolarHBondContact O-N 2.85Å; L660-V663 VanDerWaalsContact O-N 3.1Å; L660-I664 HydrophobicContact CB-CD1 4.37Å; L660-I664 WeakPolarHBondContact O-CB 3.15Å; L660-I664 WeakPolarHBondContact O-CD1 3.44Å; L660-I664 VanDerWaalsContact O-CG1 3.29Å; L660-I664 WeakPolarHBondContact O-CG1 3.31Å; L660-I664 PolarHBondContact O-N 3.38Å
661	G	95.8	Very high	96.2	Very high	20 Å²	20	47.9 Å²	47.9	21%	0.206	26%	0.256	C	S	.	.	H	α-helix	trans	-59.8	-33.5	176.3	0	0	0	0	0	114.4	A657 F659 K665	A657-G661 PolarHBondContact O-N 3.36Å; F659-G661 VanDerWaalsContact C-N 3.26Å; F659-G661 PolarHBondContact O-N 2.75Å; G661-K665 WeakPolarHBondContact O-CB 3.47Å; G661-K665 VanDerWaalsContact O-CG 3.27Å; G661-K665 WeakPolarHBondContact O-CG 3.42Å; G661-K665 PolarHBondContact O-N 3.41Å; G661-K665 VanDerWaalsContact O-N 3.08Å
662	K	96.4	Very high	96	Very high	156 Å²	156	53.2 Å²	53.2	68%	0.678	28%	0.277	S	S	*	.	H	α-helix	trans	-68.7	-40.9	172.7	-72.3	169.2	-179.4	178.4	0	111.8	P658 F659 L660 F666	P658-K662 WeakPolarHBondContact O-CG 3.07Å; P658-K662 PolarHBondContact O-N 2.91Å; F659-K662 WeakPolarHBondContact O-CB 3.48Å; F659-K662 PolarHBondContact O-N 2.83Å; L660-K662 VanDerWaalsContact C-N 3.31Å; L660-K662 PolarHBondContact O-N 2.85Å; K662-F666 PolarHBondContact O-N 3.4Å
663	V	96.1	Very high	95.9	Very high	6 Å²	6	55 Å²	55	4%	0.036	29%	0.294	C	S	.	.	H	α-helix	trans	-71.2	-41.5	-179.9	-174.6	0	0	0	0	111.3	L608 L626 R629 I630 F659 L660 F666 A667	L608-V663 HydrophobicContact CD1-CG1 4.24Å; L626-V663 HydrophobicContact CD1-CG1 3.44Å; L626-V663 VanDerWaalsContact CD1-CG1 3.44Å; R629-V663 HydrophobicContact CB-CG1 4.36Å; R629-V663 HydrophobicContact CB-CG2 4.29Å; I630-V663 HydrophobicContact CD1-CG1 3.92Å; I630-V663 HydrophobicContact CG1-CG1 3.96Å; I630-V663 HydrophobicContact CG1-CG2 4.36Å; F659-V663 HydrophobicContact CE2-CG2 4.5Å; F659-V663 HydrophobicContact CZ-CG2 4.35Å; F659-V663 PolarHBondContact O-N 3.03Å; L660-V663 PolarHBondContact O-N 2.85Å; L660-V663 VanDerWaalsContact O-N 3.1Å; V663-F666 WeakPolarHBondContact O-CB 3.08Å; V663-F666 PolarHBondContact O-N 2.88Å; V663-A667 PolarHBondContact O-N 3.15Å
664	I	95.4	Very high	95.8	Very high	4 Å²	4	51.6 Å²	51.6	2%	0.021	28%	0.28	C	S	.	.	H	α-helix	trans	-60.1	-45.8	173.9	-71.1	161.7	0	0	0	110.4	L604 L608 L611 L660 F666 A667 T668	L604-I664 HydrophobicContact CB-CD1 3.86Å; L604-I664 HydrophobicContact CD2-CD1 3.58Å; L604-I664 HydrophobicContact CG-CD1 4.32Å; L604-I664 WeakPolarHBondContact O-CD1 3.42Å; L608-I664 HydrophobicContact CB-CD1 4.36Å; L608-I664 HydrophobicContact CB-CG1 4.1Å; L608-I664 HydrophobicContact CD1-CG1 4.15Å; L611-I664 HydrophobicContact CD1-CB 4.44Å; L611-I664 HydrophobicContact CD1-CG1 4.41Å; L611-I664 HydrophobicContact CD1-CG2 3.88Å; L660-I664 HydrophobicContact CB-CD1 4.37Å; L660-I664 WeakPolarHBondContact O-CB 3.15Å; L660-I664 WeakPolarHBondContact O-CD1 3.44Å; L660-I664 VanDerWaalsContact O-CG1 3.29Å; L660-I664 WeakPolarHBondContact O-CG1 3.31Å; L660-I664 PolarHBondContact O-N 3.38Å; I664-F666 VanDerWaalsContact C-N 3.29Å; I664-F666 PolarHBondContact O-N 3.2Å; I664-A667 PolarHBondContact O-N 2.9Å; I664-A667 VanDerWaalsContact O-N 3.08Å; I664-T668 HydrophobicContact CG2-CG2 4.11Å; I664-T668 WeakPolarHBondContact O-CG2 3.33Å; I664-T668 PolarHBondContact O-N 3.03Å; I664-T668 PolarHBondContact O-OG1 3.31Å
665	K	96.3	Very high	95.6	Very high	157 Å²	157	52.9 Å²	52.9	68%	0.683	28%	0.281	S	S	*	.	H	α-helix	trans	-58.4	-37.6	175.8	-79.5	178	178.9	-171.4	0	113.4	G661 T668 S669	G661-K665 WeakPolarHBondContact O-CB 3.47Å; G661-K665 VanDerWaalsContact O-CG 3.27Å; G661-K665 WeakPolarHBondContact O-CG 3.42Å; G661-K665 PolarHBondContact O-N 3.41Å; G661-K665 VanDerWaalsContact O-N 3.08Å; K665-T668 PolarHBondContact O-OG1 3.22Å; K665-S669 WeakPolarHBondContact O-CB 3.33Å; K665-S669 PolarHBondContact O-N 3.39Å; K665-S669 VanDerWaalsContact O-N 3.13Å
666	F	95.9	Very high	95.4	Very high	47 Å²	47	50.3 Å²	50.3	21%	0.206	27%	0.273	C	S	.	.	H	α-helix	trans	-64.3	-47.7	172.4	164.3	-101.5	0	0	0	111.3	L615 D625 R629 K662 V663 I664 S669 H670	L615-F666 HydrophobicContact CD2-CE1 4.13Å; D625-F666 HydrophobicContact CB-CE1 4.19Å; D625-F666 HydrophobicContact CB-CZ 3.71Å; R629-F666 VanDerWaalsContact CD-CD1 3.48Å; K662-F666 PolarHBondContact O-N 3.4Å; V663-F666 WeakPolarHBondContact O-CB 3.08Å; V663-F666 PolarHBondContact O-N 2.88Å; I664-F666 VanDerWaalsContact C-N 3.29Å; I664-F666 PolarHBondContact O-N 3.2Å; F666-S669 PolarHBondContact O-N 3.5Å; F666-H670 PolarHBondContact O-N 2.89Å
667	A	95.3	Very high	95.3	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-67	-44.6	-178.1	0	0	0	0	0	113.2	L611 L615 V663 I664 H670 V671	L611-A667 HydrophobicContact CB-CB 4.04Å; L611-A667 HydrophobicContact CD1-CB 4.16Å; L611-A667 HydrophobicContact CD2-CB 4.16Å; L611-A667 HydrophobicContact CG-CB 4.36Å; L615-A667 HydrophobicContact CD1-CB 4.05Å; L615-A667 HydrophobicContact CD2-CB 3.81Å; V663-A667 PolarHBondContact O-N 3.15Å; I664-A667 PolarHBondContact O-N 2.9Å; I664-A667 VanDerWaalsContact O-N 3.08Å; A667-H670 WeakPolarHBondContact O-CB 3.32Å; A667-H670 PolarHBondContact O-N 2.87Å; A667-V671 PolarHBondContact O-N 3.28Å
668	T	95.1	Very high	95	Very high	18 Å²	18	50.4 Å²	50.4	11%	0.11	27%	0.272	C	S	.	.	H	α-helix	trans	-63.5	-43.1	175.7	56.9	0	0	0	0	111.2	L611 I664 K665 H670 V671 Y672 F696	L611-T668 HydrophobicContact CD1-CG2 3.74Å; L611-T668 HydrophobicContact CD2-CG2 3.88Å; L611-T668 HydrophobicContact CG-CG2 4.45Å; I664-T668 HydrophobicContact CG2-CG2 4.11Å; I664-T668 WeakPolarHBondContact O-CG2 3.33Å; I664-T668 PolarHBondContact O-N 3.03Å; I664-T668 PolarHBondContact O-OG1 3.31Å; K665-T668 PolarHBondContact O-OG1 3.22Å; T668-H670 VanDerWaalsContact C-N 3.25Å; T668-H670 PolarHBondContact O-N 3.11Å; T668-V671 PolarHBondContact O-N 3.09Å; T668-V671 VanDerWaalsContact O-N 3.1Å; T668-Y672 WeakPolarHBondContact O-CD2 3.37Å; T668-Y672 PolarHBondContact O-N 3.49Å; T668-F696 HydrophobicContact CG2-CD2 4.07Å; T668-F696 HydrophobicContact CG2-CE2 3.99Å
669	S	95.6	Very high	94.6	Very high	75 Å²	75	53.7 Å²	53.7	52%	0.524	28%	0.281	S	S	.	.	H	α-helix	trans	-59.4	-36.6	176	-174.2	0	0	0	0	112	K665 F666 S673	K665-S669 WeakPolarHBondContact O-CB 3.33Å; K665-S669 PolarHBondContact O-N 3.39Å; K665-S669 VanDerWaalsContact O-N 3.13Å; F666-S669 PolarHBondContact O-N 3.5Å; S669-S673 WeakPolarHBondContact O-CB 3.37Å; S669-S673 PolarHBondContact O-N 2.91Å; S669-S673 PolarHBondContact O-OG 2.99Å
670	H	95.4	Very high	94.3	Very high	31 Å²	31	52.8 Å²	52.8	14%	0.144	28%	0.277	C	S	.	.	H	α-helix	trans	-66.7	-45.8	171.7	-177.7	70.4	0	0	0	112.7	C618 F666 A667 T668 Y672 S673 C674	C618-H670 PolarHBondContact SG-NE2 2.64Å; F666-H670 PolarHBondContact O-N 2.89Å; A667-H670 WeakPolarHBondContact O-CB 3.32Å; A667-H670 PolarHBondContact O-N 2.87Å; T668-H670 VanDerWaalsContact C-N 3.25Å; T668-H670 PolarHBondContact O-N 3.11Å; H670-Y672 PolarHBondContact O-N 2.92Å; H670-S673 PolarHBondContact O-N 3.27Å; H670-S673 PolarHBondContact O-OG 2.76Å; H670-C674 VanDerWaalsContact CE1-CB 3.49Å; H670-C674 WeakPolarHBondContact CE1-CB 3.35Å; H670-C674 WeakPolarHBondContact O-CB 3.44Å; H670-C674 PolarHBondContact O-N 3.43Å
671	V	95.2	Very high	94	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-60.3	-47	-178.3	172.8	0	0	0	0	111.7	L611 Y614 L615 A667 T668 S673 C677 Y694 F696	L611-V671 HydrophobicContact CD2-CG2 4.04Å; Y614-V671 HydrophobicContact CD1-CG1 4.22Å; Y614-V671 HydrophobicContact CD1-CG2 4.32Å; Y614-V671 HydrophobicContact CG-CG2 4.02Å; L615-V671 HydrophobicContact CD1-CG2 3.86Å; A667-V671 PolarHBondContact O-N 3.28Å; T668-V671 PolarHBondContact O-N 3.09Å; T668-V671 VanDerWaalsContact O-N 3.1Å; V671-S673 VanDerWaalsContact C-N 3.31Å; V671-S673 PolarHBondContact O-N 3.24Å; V671-C677 HydrophobicContact CB-CB 4.21Å; V671-C677 HydrophobicContact CG1-CB 4.03Å; V671-C677 HydrophobicContact CG2-CB 4.21Å; V671-Y694 HydrophobicContact CG1-CD1 3.76Å; V671-Y694 HydrophobicContact CG1-CE1 3.39Å; V671-F696 HydrophobicContact CB-CE1 4.31Å; V671-F696 HydrophobicContact CB-CZ 3.98Å; V671-F696 HydrophobicContact CG1-CE1 3.9Å; V671-F696 HydrophobicContact CG1-CZ 3.64Å; V671-F696 HydrophobicContact CG2-CE1 4.18Å; V671-F696 HydrophobicContact CG2-CZ 4.3Å
672	Y	93.4	Very high	93.7	Very high	117 Å²	117	54.2 Å²	54.2	46%	0.459	28%	0.283	S	S	.	.	H	α-helix	trans	-68.7	-25.4	180	-56.5	-51.9	0	0	0	114	T668 H670 Y694 F696 E697	T668-Y672 WeakPolarHBondContact O-CD2 3.37Å; T668-Y672 PolarHBondContact O-N 3.49Å; H670-Y672 PolarHBondContact O-N 2.92Å; Y672-Y694 HydrophobicContact CD1-CD2 4.46Å; Y672-Y694 AromaticContact CD1-CE2 3.91Å; Y672-Y694 HydrophobicContact CD1-CE2 3.91Å; Y672-Y694 AromaticContact CE1-CD2 3.9Å; Y672-Y694 HydrophobicContact CE1-CD2 3.9Å; Y672-Y694 AromaticContact CE1-CE2 3.79Å; Y672-Y694 HydrophobicContact CE1-CE2 3.79Å; Y672-F696 HydrophobicContact CE1-CE2 4.27Å; Y672-F696 HydrophobicContact CE1-CZ 4.47Å; Y672-E697 VanDerWaalsContact CE1-OE1 3.27Å; Y672-E697 WeakPolarHBondContact CE1-OE1 3.47Å; Y672-E697 VanDerWaalsContact CZ-OE1 3.3Å; Y672-E697 PolarHBondContact OH-OE1 2.98Å
673	S	93.3	Very high	93.5	Very high	94 Å²	94	50.9 Å²	50.9	66%	0.657	27%	0.272	S	S	*	.	H	α-helix	trans	-100.5	-9.3	-177.3	61.8	0	0	0	0	114.5	S669 H670 V671	S669-S673 WeakPolarHBondContact O-CB 3.37Å; S669-S673 PolarHBondContact O-N 2.91Å; S669-S673 PolarHBondContact O-OG 2.99Å; H670-S673 PolarHBondContact O-N 3.27Å; H670-S673 PolarHBondContact O-OG 2.76Å; V671-S673 VanDerWaalsContact C-N 3.31Å; V671-S673 PolarHBondContact O-N 3.24Å
674	C	95.2	Very high	93.3	Very high	13 Å²	13	50.6 Å²	50.6	9%	0.088	27%	0.27	C	S	.	.			trans	-106.1	117.7	-178.3	-169.8	0	0	0	0	111.9	C618 H670 L676 C677 S678	C618-C674 VanDerWaalsContact SG-SG 3.64Å; H670-C674 VanDerWaalsContact CE1-CB 3.49Å; H670-C674 WeakPolarHBondContact CE1-CB 3.35Å; H670-C674 WeakPolarHBondContact O-CB 3.44Å; H670-C674 PolarHBondContact O-N 3.43Å; C674-L676 PolarHBondContact O-N 2.9Å; C674-C677 HydrophobicContact CB-CB 4.18Å; C674-C677 WeakPolarHBondContact O-CA 3.28Å; C674-C677 PolarHBondContact O-N 2.83Å; C674-S678 PolarHBondContact O-N 3.18Å
675	S	92.7	Very high	93	Very high	71 Å²	71	53.8 Å²	53.8	50%	0.497	29%	0.285	S	S	.	.	H	α-helix	trans	-52.3	-39	176.7	50.3	0	0	0	0	113.9	C677 S678 Q679	S675-C677 PolarHBondContact O-N 3.5Å; S675-S678 WeakPolarHBondContact CA-OG 3.48Å; S675-S678 PolarHBondContact O-N 3.01Å; S675-S678 PolarHBondContact O-OG 2.94Å; S675-Q679 WeakPolarHBondContact O-CB 3.46Å; S675-Q679 VanDerWaalsContact O-CG 3.24Å; S675-Q679 WeakPolarHBondContact O-CG 3.32Å; S675-Q679 PolarHBondContact O-N 3.33Å; S675-Q679 VanDerWaalsContact O-N 3.16Å
676	L	93.3	Very high	92.6	Very high	68 Å²	68	49.1 Å²	49.1	36%	0.356	27%	0.267	S	S	.	.	H	α-helix	trans	-69.8	-15.6	177.9	-59.5	175.9	0	0	0	113.9	R619 C674 K680	R619-L676 HydrophobicContact CG-CD1 4.18Å; C674-L676 PolarHBondContact O-N 2.9Å; L676-K680 WeakPolarHBondContact O-CD 3.43Å; L676-K680 VanDerWaalsContact O-CE 3.27Å; L676-K680 WeakPolarHBondContact O-CE 3.34Å
677	C	93.6	Very high	92.3	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-99.8	-38.1	174.9	-66.6	0	0	0	0	111.7	Y614 C618 V671 C674 S675 Q679 K680	Y614-C677 HydrophobicContact CD1-CB 4.34Å; C618-C677 VanDerWaalsContact SG-SG 3.65Å; V671-C677 HydrophobicContact CB-CB 4.21Å; V671-C677 HydrophobicContact CG1-CB 4.03Å; V671-C677 HydrophobicContact CG2-CB 4.21Å; C674-C677 HydrophobicContact CB-CB 4.18Å; C674-C677 WeakPolarHBondContact O-CA 3.28Å; C674-C677 PolarHBondContact O-N 2.83Å; S675-C677 PolarHBondContact O-N 3.5Å; C677-Q679 VanDerWaalsContact C-N 3.31Å; C677-Q679 PolarHBondContact O-N 3Å; C677-K680 WeakPolarHBondContact O-CB 3.48Å; C677-K680 PolarHBondContact O-N 2.94Å
678	S	90.6	Very high	91.9	Very high	33 Å²	33	55.3 Å²	55.3	23%	0.231	31%	0.306	C	S	.	.	H	α-helix	trans	-66.1	-33.2	178	63.3	0	0	0	0	112.8	C674 S675 K680 G681 Y694	C674-S678 PolarHBondContact O-N 3.18Å; S675-S678 WeakPolarHBondContact CA-OG 3.48Å; S675-S678 PolarHBondContact O-N 3.01Å; S675-S678 PolarHBondContact O-OG 2.94Å; S678-K680 PolarHBondContact O-N 3.29Å; S678-K680 VanDerWaalsContact O-N 3.09Å; S678-G681 PolarHBondContact O-N 3.35Å; S678-G681 VanDerWaalsContact O-N 3.09Å; S678-Y694 WeakPolarHBondContact CA-OH 3.26Å
679	Q	89.5	Confident	91.7	Very high	146 Å²	146	58.5 Å²	58.5	68%	0.682	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-9	170.6	-73.6	171.4	-16.8	0	0	114.5	S675 C677	S675-Q679 WeakPolarHBondContact O-CB 3.46Å; S675-Q679 VanDerWaalsContact O-CG 3.24Å; S675-Q679 WeakPolarHBondContact O-CG 3.32Å; S675-Q679 PolarHBondContact O-N 3.33Å; S675-Q679 VanDerWaalsContact O-N 3.16Å; C677-Q679 VanDerWaalsContact C-N 3.31Å; C677-Q679 PolarHBondContact O-N 3Å
680	K	90.3	Very high	91.2	Very high	53 Å²	53	57.4 Å²	57.4	23%	0.23	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.2	10.8	177	-59	171.8	-175.9	166.3	0	112.5	Y614 S617 L676 C677 S678	Y614-K680 HydrophobicContact CD1-CB 4.07Å; Y614-K680 HydrophobicContact CE1-CB 3.63Å; Y614-K680 VanDerWaalsContact CE1-O 3.23Å; Y614-K680 WeakPolarHBondContact CE1-O 3.29Å; Y614-K680 PolarHBondContact OH-O 3.13Å; S617-K680 PolarHBondContact O-NZ 3.16Å; S617-K680 PolarHBondContact OG-NZ 3.28Å; L676-K680 WeakPolarHBondContact O-CD 3.43Å; L676-K680 VanDerWaalsContact O-CE 3.27Å; L676-K680 WeakPolarHBondContact O-CE 3.34Å; C677-K680 WeakPolarHBondContact O-CB 3.48Å; C677-K680 PolarHBondContact O-N 2.94Å; S678-K680 PolarHBondContact O-N 3.29Å; S678-K680 VanDerWaalsContact O-N 3.09Å
681	G	89.3	Confident	90.9	Very high	21 Å²	21	60.6 Å²	60.6	22%	0.216	34%	0.338	C	S	.	.	S	Bend	trans	-77.2	168.8	164.8	0	0	0	0	0	111.3	S678 L693	S678-G681 PolarHBondContact O-N 3.35Å; S678-G681 VanDerWaalsContact O-N 3.09Å; G681-L693 WeakPolarHBondContact CA-O 3.3Å
682	F	90.4	Very high	90.7	Very high	28 Å²	28	64.2 Å²	64.2	12%	0.123	36%	0.356	C	S	.	.	B	Isolated β-bridge	trans	-105.3	154	-178.3	-64.5	-98.2	0	0	0	110.3	F20 L693 P695 V710	F20-F682 HydrophobicContact CD2-CZ 4.42Å; F682-L693 PolarHBondContact N-O 3.23Å; F682-L693 PolarHBondContact O-N 2.96Å; F682-P695 HydrophobicContact CD2-CG 4.1Å; F682-P695 HydrophobicContact CE2-CG 3.56Å; F682-P695 HydrophobicContact CZ-CG 4.47Å; F682-V710 HydrophobicContact CB-CB 3.89Å; F682-V710 HydrophobicContact CD1-CB 4.33Å; F682-V710 HydrophobicContact CD1-CG2 4.32Å; F682-V710 HydrophobicContact CD2-CB 4.05Å; F682-V710 HydrophobicContact CD2-CG2 3.77Å; F682-V710 HydrophobicContact CE2-CG2 4.02Å; F682-V710 HydrophobicContact CG-CB 3.83Å; F682-V710 HydrophobicContact CG-CG2 3.95Å; F682-V710 HydrophobicContact CZ-CG2 4.39Å
683	I	91.4	Very high	90.6	Very high	86 Å²	86	58.8 Å²	58.8	44%	0.441	34%	0.335	S	S	.	.			trans	-112.3	135.7	168.1	-59.7	174.4	0	0	0	107.4	E685	I683-E685 PolarHBondContact O-N 2.95Å; I683-E685 VanDerWaalsContact O-N 3.15Å
684	C	92.1	Very high	90.5	Very high	0 Å²	0	54.8 Å²	54.8	0%	0	31%	0.306	C	S	.	.			trans	-70.6	108.8	-178.4	-176.9	0	0	0	0	111.3	I686 C687 N688 L693 H712	C684-I686 PolarHBondContact O-N 3.05Å; C684-C687 PolarHBondContact O-N 3.38Å; C684-N688 WeakPolarHBondContact O-CA 3.46Å; C684-N688 PolarHBondContact O-N 3.01Å; C684-L693 HydrophobicContact CB-CD1 3.93Å; C684-H712 WeakPolarHBondContact CB-ND1 3.24Å
685	E	89.4	Confident	90.2	Very high	71 Å²	71	55 Å²	55	33%	0.332	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-8.2	179.7	-46.4	-173.2	160.1	0	0	114.5	I683 F711 P723 R724 R727	I683-E685 PolarHBondContact O-N 2.95Å; I683-E685 VanDerWaalsContact O-N 3.15Å; E685-F711 HydrophobicContact CB-CE1 4.03Å; E685-F711 HydrophobicContact CG-CE1 4.1Å; E685-P723 HydrophobicContact CB-CG 4.17Å; E685-R724 WeakPolarHBondContact OE1-CD 3.25Å; E685-R724 IonicContact OE1-NE 3.97Å; E685-R724 PolarHBondContact OE2-N 3.46Å; E685-R727 IonicContact OE1-NH2 2.76Å; E685-R727 PolarHBondContact OE1-NH2 3.46Å; E685-R727 IonicContact OE2-CZ 2.66Å; E685-R727 IonicContact OE2-NH2 3.77Å; E685-R727 PolarHBondContact OE2-NH2 3.37Å
686	I	88.3	Confident	90	Very high	60 Å²	60	51.6 Å²	51.6	31%	0.308	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.7	-45.2	-175.1	-57.9	157.5	0	0	0	111.3	C684 F711 C715 S719 P723	C684-I686 PolarHBondContact O-N 3.05Å; I686-F711 HydrophobicContact CD1-CB 3.95Å; I686-F711 HydrophobicContact CD1-CD1 3.36Å; I686-F711 HydrophobicContact CD1-CE1 4.02Å; I686-F711 HydrophobicContact CD1-CG 3.74Å; I686-F711 HydrophobicContact CG1-CD1 3.74Å; I686-F711 HydrophobicContact CG1-CE1 4.09Å; I686-C715 HydrophobicContact CB-CB 4.04Å; I686-C715 HydrophobicContact CD1-CB 3.88Å; I686-C715 HydrophobicContact CG2-CB 3.99Å; I686-S719 WeakPolarHBondContact CD1-OG 3.3Å; I686-P723 HydrophobicContact CG1-CG 4.19Å
687	C	89.7	Confident	89.7	Confident	56 Å²	56	49.9 Å²	49.9	38%	0.378	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.5	-21.8	179.1	66.8	0	0	0	0	113.3	C684 N689 H712	C684-C687 PolarHBondContact O-N 3.38Å; C687-N689 PolarHBondContact O-N 3.33Å; C687-N689 VanDerWaalsContact O-N 3.12Å; C687-H712 VanDerWaalsContact SG-CE1 3.57Å
688	N	87.3	Confident	88.9	Confident	120 Å²	120	54.5 Å²	54.5	64%	0.642	30%	0.298	S	S	*	.			trans	45.5	38.5	-177.8	-159	36	0	0	0	114.4	C684 G690	C684-N688 WeakPolarHBondContact O-CA 3.46Å; C684-N688 PolarHBondContact O-N 3.01Å; N688-G690 PolarHBondContact O-N 3.17Å; N688-G690 VanDerWaalsContact O-N 3.13Å
689	N	89.4	Confident	88.6	Confident	85 Å²	85	60.4 Å²	60.4	46%	0.455	33%	0.325	S	S	.	.			trans	-74	2.8	-173.8	72.9	-22.5	0	0	0	114.9	C687 E691 H712	C687-N689 PolarHBondContact O-N 3.33Å; C687-N689 VanDerWaalsContact O-N 3.12Å; N689-E691 WeakPolarHBondContact ND2-CB 3.21Å; N689-E691 PolarHBondContact ND2-OE2 3.04Å; N689-E691 PolarHBondContact O-N 3.44Å; N689-E691 VanDerWaalsContact OD1-CB 3.23Å; N689-E691 WeakPolarHBondContact OD1-CB 3.35Å; N689-E691 PolarHBondContact OD1-N 2.81Å; N689-E691 VanDerWaalsContact OD1-N 3.13Å; N689-H712 PolarHBondContact OD1-CE1 2.75Å
690	G	84.9	Confident	88.5	Confident	52 Å²	52	56.4 Å²	56.4	54%	0.536	31%	0.314	S	S	.	.			trans	73.3	4	-177.2	0	0	0	0	0	115.2	N688	N688-G690 PolarHBondContact O-N 3.17Å; N688-G690 VanDerWaalsContact O-N 3.13Å
691	E	90	Very high	88.4	Confident	98 Å²	98	54.6 Å²	54.6	46%	0.458	31%	0.307	S	S	.	.			trans	-77.7	135.7	177.9	-170	176.3	-170.3	0	0	111	N689 L693 H712	N689-E691 WeakPolarHBondContact ND2-CB 3.21Å; N689-E691 PolarHBondContact ND2-OE2 3.04Å; N689-E691 PolarHBondContact O-N 3.44Å; N689-E691 VanDerWaalsContact OD1-CB 3.23Å; N689-E691 WeakPolarHBondContact OD1-CB 3.35Å; N689-E691 PolarHBondContact OD1-N 2.81Å; N689-E691 VanDerWaalsContact OD1-N 3.13Å; E691-L693 HydrophobicContact CG-CD2 4.16Å; E691-H712 IonicContact OE2-CD2 2.73Å; E691-H712 IonicContact OE2-CE1 2.89Å; E691-H712 IonicContact OE2-NE2 2.76Å; E691-H712 PolarHBondContact OE2-NE2 2.93Å
692	I	90.9	Very high	88.3	Confident	77 Å²	77	55.5 Å²	55.5	40%	0.395	31%	0.31	S	S	.	.			trans	-90.6	110.8	-179.8	-54.1	178.7	0	0	0	109.1	Y694	I692-Y694 HydrophobicContact CB-CE2 4.46Å; I692-Y694 HydrophobicContact CG2-CE1 4.15Å; I692-Y694 HydrophobicContact CG2-CE2 3.94Å; I692-Y694 WeakPolarHBondContact CG2-OH 3.38Å; I692-Y694 WeakPolarHBondContact O-CE2 3.46Å
693	L	91.6	Very high	88.2	Confident	2 Å²	2	56.7 Å²	56.7	1%	0.01	31%	0.313	C	S	.	.	B	Isolated β-bridge	trans	-94.9	148.6	-179.6	-55.9	-173.9	0	0	0	112	G681 F682 C684 E691 T701 V710 F711	G681-L693 WeakPolarHBondContact CA-O 3.3Å; F682-L693 PolarHBondContact N-O 3.23Å; F682-L693 PolarHBondContact O-N 2.96Å; C684-L693 HydrophobicContact CB-CD1 3.93Å; E691-L693 HydrophobicContact CG-CD2 4.16Å; L693-T701 HydrophobicContact CB-CG2 3.91Å; L693-T701 HydrophobicContact CD1-CG2 4.33Å; L693-T701 HydrophobicContact CD2-CG2 4.11Å; L693-T701 HydrophobicContact CG-CG2 4.34Å; L693-V710 HydrophobicContact CB-CG1 4.1Å; L693-V710 HydrophobicContact CD1-CG1 4.44Å; L693-F711 VanDerWaalsContact CD1-C 3.47Å
694	Y	91.4	Very high	88.1	Confident	11 Å²	11	52.7 Å²	52.7	4%	0.043	29%	0.293	C	S	.	.			trans	-127.5	139.6	179.3	-59.8	-84.9	0	0	0	113.3	Y614 V671 Y672 S678 I692 F696 E697 T701	Y614-Y694 HydrophobicContact CE1-CD1 4.04Å; Y614-Y694 HydrophobicContact CE1-CE1 4.3Å; V671-Y694 HydrophobicContact CG1-CD1 3.76Å; V671-Y694 HydrophobicContact CG1-CE1 3.39Å; Y672-Y694 HydrophobicContact CD1-CD2 4.46Å; Y672-Y694 AromaticContact CD1-CE2 3.91Å; Y672-Y694 HydrophobicContact CD1-CE2 3.91Å; Y672-Y694 AromaticContact CE1-CD2 3.9Å; Y672-Y694 HydrophobicContact CE1-CD2 3.9Å; Y672-Y694 AromaticContact CE1-CE2 3.79Å; Y672-Y694 HydrophobicContact CE1-CE2 3.79Å; S678-Y694 WeakPolarHBondContact CA-OH 3.26Å; I692-Y694 HydrophobicContact CB-CE2 4.46Å; I692-Y694 HydrophobicContact CG2-CE1 4.15Å; I692-Y694 HydrophobicContact CG2-CE2 3.94Å; I692-Y694 WeakPolarHBondContact CG2-OH 3.38Å; I692-Y694 WeakPolarHBondContact O-CE2 3.46Å; Y694-F696 VanDerWaalsContact CB-CE1 3.45Å; Y694-F696 VanDerWaalsContact CB-CZ 3.4Å; Y694-F696 AromaticContact CD1-CE1 3.75Å; Y694-F696 HydrophobicContact CD1-CE1 3.75Å; Y694-F696 AromaticContact CD1-CZ 3.74Å; Y694-F696 HydrophobicContact CD1-CZ 3.74Å; Y694-F696 HydrophobicContact CD2-CE2 4.46Å; Y694-F696 HydrophobicContact CD2-CZ 4.06Å; Y694-F696 AromaticContact CG-CE1 3.76Å; Y694-F696 HydrophobicContact CG-CE1 3.76Å; Y694-F696 HydrophobicContact CG-CE2 4.11Å; Y694-F696 AromaticContact CG-CZ 3.45Å; Y694-F696 HydrophobicContact CG-CZ 3.45Å; Y694-F696 VanDerWaalsContact CG-CZ 3.45Å; Y694-F696 PolarHBondContact O-N 3.17Å; Y694-E697 PolarHBondContact O-N 3.36Å; Y694-T701 PolarHBondContact O-OG1 2.94Å
695	P	87.3	Confident	87.7	Confident	17 Å²	17	57.7 Å²	57.7	11%	0.11	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.4	12.2	177.1	-12.6	23.9	0	0	0	116.1	F20 S610 Y614 F682 V710	F20-P695 HydrophobicContact CE1-CB 4.41Å; F20-P695 HydrophobicContact CE1-CG 4.3Å; F20-P695 HydrophobicContact CE2-CG 4.34Å; F20-P695 HydrophobicContact CZ-CG 4.14Å; S610-P695 PolarHBondContact OG-O 3.33Å; Y614-P695 WeakPolarHBondContact OH-CD 3.43Å; F682-P695 HydrophobicContact CD2-CG 4.1Å; F682-P695 HydrophobicContact CE2-CG 3.56Å; F682-P695 HydrophobicContact CZ-CG 4.47Å; P695-V710 HydrophobicContact CB-CG2 4.35Å; P695-V710 HydrophobicContact CG-CG2 3.97Å
696	F	88.5	Confident	87.5	Confident	0 Å²	0	58.4 Å²	58.4	0%	0	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-118.1	17.7	173.7	58.6	-106.4	0	0	0	111.2	R607 L611 Y614 T668 V671 Y672 Y694	R607-F696 HydrophobicContact CG-CB 3.81Å; R607-F696 VanDerWaalsContact CZ-O 3.26Å; R607-F696 PolarHBondContact NE-O 3.49Å; R607-F696 PolarHBondContact NH2-O 2.95Å; L611-F696 HydrophobicContact CD1-CB 4.49Å; L611-F696 HydrophobicContact CD1-CG 4.46Å; L611-F696 HydrophobicContact CD2-CB 4.47Å; L611-F696 HydrophobicContact CD2-CD1 3.45Å; L611-F696 VanDerWaalsContact CD2-CD1 3.45Å; L611-F696 HydrophobicContact CD2-CD2 3.99Å; L611-F696 HydrophobicContact CD2-CE1 3.51Å; L611-F696 HydrophobicContact CD2-CE2 4.07Å; L611-F696 HydrophobicContact CD2-CG 3.72Å; L611-F696 HydrophobicContact CD2-CZ 3.84Å; L611-F696 HydrophobicContact CG-CB 4.06Å; L611-F696 HydrophobicContact CG-CD1 3.83Å; L611-F696 HydrophobicContact CG-CD2 4.4Å; L611-F696 HydrophobicContact CG-CE1 4.38Å; L611-F696 HydrophobicContact CG-CG 3.85Å; Y614-F696 HydrophobicContact CD2-CD1 4.31Å; Y614-F696 HydrophobicContact CD2-CE1 4.12Å; Y614-F696 HydrophobicContact CE2-CD1 4.15Å; Y614-F696 HydrophobicContact CE2-CE1 4.05Å; T668-F696 HydrophobicContact CG2-CD2 4.07Å; T668-F696 HydrophobicContact CG2-CE2 3.99Å; V671-F696 HydrophobicContact CB-CE1 4.31Å; V671-F696 HydrophobicContact CB-CZ 3.98Å; V671-F696 HydrophobicContact CG1-CE1 3.9Å; V671-F696 HydrophobicContact CG1-CZ 3.64Å; V671-F696 HydrophobicContact CG2-CE1 4.18Å; V671-F696 HydrophobicContact CG2-CZ 4.3Å; Y672-F696 HydrophobicContact CE1-CE2 4.27Å; Y672-F696 HydrophobicContact CE1-CZ 4.47Å; Y694-F696 VanDerWaalsContact CB-CE1 3.45Å; Y694-F696 VanDerWaalsContact CB-CZ 3.4Å; Y694-F696 AromaticContact CD1-CE1 3.75Å; Y694-F696 HydrophobicContact CD1-CE1 3.75Å; Y694-F696 AromaticContact CD1-CZ 3.74Å; Y694-F696 HydrophobicContact CD1-CZ 3.74Å; Y694-F696 HydrophobicContact CD2-CE2 4.46Å; Y694-F696 HydrophobicContact CD2-CZ 4.06Å; Y694-F696 AromaticContact CG-CE1 3.76Å; Y694-F696 HydrophobicContact CG-CE1 3.76Å; Y694-F696 HydrophobicContact CG-CE2 4.11Å; Y694-F696 AromaticContact CG-CZ 3.45Å; Y694-F696 HydrophobicContact CG-CZ 3.45Å; Y694-F696 VanDerWaalsContact CG-CZ 3.45Å; Y694-F696 PolarHBondContact O-N 3.17Å
697	E	87.5	Confident	87.5	Confident	32 Å²	32	55.9 Å²	55.9	15%	0.15	32%	0.317	C	S	.	.			trans	-114	60.8	177.3	-63.6	-179.9	161.7	0	0	109	Y672 Y694 I699 S700 T701	Y672-E697 VanDerWaalsContact CE1-OE1 3.27Å; Y672-E697 WeakPolarHBondContact CE1-OE1 3.47Å; Y672-E697 VanDerWaalsContact CZ-OE1 3.3Å; Y672-E697 PolarHBondContact OH-OE1 2.98Å; Y694-E697 PolarHBondContact O-N 3.36Å; E697-I699 PolarHBondContact O-N 3.38Å; E697-S700 PolarHBondContact O-N 2.79Å; E697-S700 PolarHBondContact O-OG 3.34Å; E697-T701 HydrophobicContact CB-CG2 3.97Å; E697-T701 PolarHBondContact O-N 3.5Å; E697-T701 PolarHBondContact O-OG1 3.41Å
698	D	77.1	Confident	87.3	Confident	97 Å²	97	53.3 Å²	53.3	52%	0.519	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.5	4.1	-169.5	-7.5	-49.2	0	0	0	116.1
699	I	84.6	Confident	87.4	Confident	157 Å²	157	47.8 Å²	47.8	81%	0.805	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.7	-52.8	-178.3	-56.5	174.2	0	0	0	110.2	E697 S713	E697-I699 PolarHBondContact O-N 3.38Å; I699-S713 PolarHBondContact O-OG 3.16Å
700	S	86.3	Confident	87.4	Confident	62 Å²	62	43.8 Å²	43.8	43%	0.434	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.4	-21.2	179.8	44.3	0	0	0	0	113.2	E697 H712 S713	E697-S700 PolarHBondContact O-N 2.79Å; E697-S700 PolarHBondContact O-OG 3.34Å; S700-H712 WeakPolarHBondContact O-CA 3.3Å; S700-S713 VanDerWaalsContact C-OG 3.23Å; S700-S713 PolarHBondContact O-N 2.85Å; S700-S713 PolarHBondContact O-OG 2.85Å
701	T	89.6	Confident	87.7	Confident	15 Å²	15	41.3 Å²	41.3	9%	0.092	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	144.7	-173.9	69.9	0	0	0	0	113.1	L693 Y694 E697 V710 F711 S713	L693-T701 HydrophobicContact CB-CG2 3.91Å; L693-T701 HydrophobicContact CD1-CG2 4.33Å; L693-T701 HydrophobicContact CD2-CG2 4.11Å; L693-T701 HydrophobicContact CG-CG2 4.34Å; Y694-T701 PolarHBondContact O-OG1 2.94Å; E697-T701 HydrophobicContact CB-CG2 3.97Å; E697-T701 PolarHBondContact O-N 3.5Å; E697-T701 PolarHBondContact O-OG1 3.41Å; T701-V710 HydrophobicContact CG2-CG1 4.09Å; T701-F711 CarbonylContact C-O 3.55Å; T701-F711 VanDerWaalsContact CA-O 3.3Å; T701-F711 WeakPolarHBondContact CA-O 3.28Å; T701-S713 PolarHBondContact N-OG 3.45Å; T701-S713 PolarHBondContact O-OG 3.07Å
702	S	87.1	Confident	87.8	Confident	40 Å²	40	38 Å²	38	28%	0.28	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	137.7	172	-179	0	0	0	0	109.8	F711	S702-F711 PolarHBondContact N-O 2.81Å; S702-F711 PolarHBondContact O-N 2.79Å
703	R	88.2	Confident	87.8	Confident	52 Å²	52	35.8 Å²	35.8	20%	0.196	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	138.5	-177.1	-175.2	171.6	68.5	156.9	0.4	110.1	F20 D24 G708 A709 V710	F20-R703 PolarHBondContact O-NH1 3.13Å; D24-R703 IonicContact OD1-NH2 2.9Å; D24-R703 PolarHBondContact OD1-NH2 3.19Å; D24-R703 IonicContact OD2-CZ 2.65Å; D24-R703 IonicContact OD2-NE 3.86Å; D24-R703 IonicContact OD2-NH2 2.69Å; D24-R703 PolarHBondContact OD2-NH2 3.43Å; R703-G708 WeakPolarHBondContact CG-O 3.39Å; R703-A709 WeakPolarHBondContact CA-O 3.31Å; R703-V710 HydrophobicContact CB-CG2 4.43Å; R703-V710 HydrophobicContact CG-CG2 4.3Å
704	C	88.1	Confident	87.7	Confident	3 Å²	3	41.5 Å²	41.5	2%	0.02	23%	0.227	C	C	.	.			trans	-83.8	120.6	175.2	-174.5	0	0	0	0	111.5	S706 C707 G708 A709 F711 C722	C704-S706 PolarHBondContact O-N 2.94Å; C704-S706 VanDerWaalsContact O-N 3.13Å; C704-S706 PolarHBondContact SG-OG 2.85Å; C704-S706 VanDerWaalsContact SG-OG 3.41Å; C704-C707 PolarHBondContact O-N 3.19Å; C704-G708 PolarHBondContact O-N 3.17Å; C704-A709 PolarHBondContact N-O 3.22Å; C704-F711 HydrophobicContact CB-CE2 4.15Å; C704-C722 HydrophobicContact CB-CB 4.31Å; C704-C722 VanDerWaalsContact SG-CB 3.5Å
705	E	84.3	Confident	87.6	Confident	105 Å²	105	42 Å²	42	49%	0.491	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-35.6	-174.4	-38.7	93.1	-98.4	0	0	113
706	S	85.1	Confident	87.5	Confident	86 Å²	86	42.7 Å²	42.7	60%	0.601	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.5	-9.9	-170.9	49.7	0	0	0	0	115.5	C704 C725	C704-S706 PolarHBondContact O-N 2.94Å; C704-S706 VanDerWaalsContact O-N 3.13Å; C704-S706 PolarHBondContact SG-OG 2.85Å; C704-S706 VanDerWaalsContact SG-OG 3.41Å; S706-C725 PolarHBondContact OG-SG 3.22Å
707	C	88.1	Confident	87.3	Confident	6 Å²	6	50 Å²	50	4%	0.041	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-145	0.9	176.9	69.7	0	0	0	0	115.7	C704 A709 C725	C704-C707 PolarHBondContact O-N 3.19Å; C707-A709 PolarHBondContact O-N 2.9Å; C707-C725 PolarHBondContact SG-SG 2.87Å
708	G	85.5	Confident	87	Confident	2 Å²	2	55.6 Å²	55.6	2%	0.021	29%	0.291	C	S	.	.			trans	71.5	-7.9	178.9	0	0	0	0	0	115.8	R703 C704	R703-G708 WeakPolarHBondContact CG-O 3.39Å; C704-G708 PolarHBondContact O-N 3.17Å
709	A	89.4	Confident	86.5	Confident	4 Å²	4	52.5 Å²	52.5	3%	0.033	28%	0.277	C	S	.	.			trans	-62.8	141.3	179.2	0	0	0	0	0	112.1	R703 C704 C707 F711	R703-A709 WeakPolarHBondContact CA-O 3.31Å; C704-A709 PolarHBondContact N-O 3.22Å; C707-A709 PolarHBondContact O-N 2.9Å; A709-F711 HydrophobicContact CB-CE2 3.83Å; A709-F711 HydrophobicContact CB-CZ 3.85Å; A709-F711 WeakPolarHBondContact O-CE2 3.49Å
710	V	90.6	Very high	85.9	Confident	2 Å²	2	50.8 Å²	50.8	1%	0.012	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	139.6	-175.9	-176.7	0	0	0	0	110.7	F682 L693 P695 T701 R703	F682-V710 HydrophobicContact CB-CB 3.89Å; F682-V710 HydrophobicContact CD1-CB 4.33Å; F682-V710 HydrophobicContact CD1-CG2 4.32Å; F682-V710 HydrophobicContact CD2-CB 4.05Å; F682-V710 HydrophobicContact CD2-CG2 3.77Å; F682-V710 HydrophobicContact CE2-CG2 4.02Å; F682-V710 HydrophobicContact CG-CB 3.83Å; F682-V710 HydrophobicContact CG-CG2 3.95Å; F682-V710 HydrophobicContact CZ-CG2 4.39Å; L693-V710 HydrophobicContact CB-CG1 4.1Å; L693-V710 HydrophobicContact CD1-CG1 4.44Å; P695-V710 HydrophobicContact CB-CG2 4.35Å; P695-V710 HydrophobicContact CG-CG2 3.97Å; T701-V710 HydrophobicContact CG2-CG1 4.09Å; R703-V710 HydrophobicContact CB-CG2 4.43Å; R703-V710 HydrophobicContact CG-CG2 4.3Å
711	F	91.4	Very high	85.7	Confident	0 Å²	0	52 Å²	52	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	165.2	-179.7	-52.5	-86.6	0	0	0	109	E685 I686 L693 T701 S702 C704 A709 K716 P723	E685-F711 HydrophobicContact CB-CE1 4.03Å; E685-F711 HydrophobicContact CG-CE1 4.1Å; I686-F711 HydrophobicContact CD1-CB 3.95Å; I686-F711 HydrophobicContact CD1-CD1 3.36Å; I686-F711 HydrophobicContact CD1-CE1 4.02Å; I686-F711 HydrophobicContact CD1-CG 3.74Å; I686-F711 HydrophobicContact CG1-CD1 3.74Å; I686-F711 HydrophobicContact CG1-CE1 4.09Å; L693-F711 VanDerWaalsContact CD1-C 3.47Å; T701-F711 CarbonylContact C-O 3.55Å; T701-F711 VanDerWaalsContact CA-O 3.3Å; T701-F711 WeakPolarHBondContact CA-O 3.28Å; S702-F711 PolarHBondContact N-O 2.81Å; S702-F711 PolarHBondContact O-N 2.79Å; C704-F711 HydrophobicContact CB-CE2 4.15Å; A709-F711 HydrophobicContact CB-CE2 3.83Å; A709-F711 HydrophobicContact CB-CZ 3.85Å; A709-F711 WeakPolarHBondContact O-CE2 3.49Å; F711-K716 HydrophobicContact CB-CB 4.28Å; F711-K716 HydrophobicContact CD2-CD 4.36Å; F711-P723 HydrophobicContact CE1-CG 3.97Å; F711-P723 HydrophobicContact CZ-CG 4.27Å
712	H	92.1	Very high	85.7	Confident	27 Å²	27	51.5 Å²	51.5	13%	0.125	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.7	142.7	164.2	-58	83.5	0	0	0	110.1	C684 C687 N689 E691 S700 E714 C715 K716	C684-H712 WeakPolarHBondContact CB-ND1 3.24Å; C687-H712 VanDerWaalsContact SG-CE1 3.57Å; N689-H712 PolarHBondContact OD1-CE1 2.75Å; E691-H712 IonicContact OE2-CD2 2.73Å; E691-H712 IonicContact OE2-CE1 2.89Å; E691-H712 IonicContact OE2-NE2 2.76Å; E691-H712 PolarHBondContact OE2-NE2 2.93Å; S700-H712 WeakPolarHBondContact O-CA 3.3Å; H712-E714 VanDerWaalsContact C-N 3.32Å; H712-E714 PolarHBondContact O-N 3.49Å; H712-C715 HydrophobicContact CB-CB 4.05Å; H712-C715 PolarHBondContact O-N 3.04Å; H712-C715 VanDerWaalsContact O-N 3.08Å; H712-K716 PolarHBondContact O-N 3.04Å
713	S	89.8	Confident	85.7	Confident	31 Å²	31	51.4 Å²	51.4	22%	0.217	28%	0.275	C	S	.	.	H	α-helix	trans	-53.1	-50.1	178	-53	0	0	0	0	111.5	I699 S700 T701 C715 K716 E717	I699-S713 PolarHBondContact O-OG 3.16Å; S700-S713 VanDerWaalsContact C-OG 3.23Å; S700-S713 PolarHBondContact O-N 2.85Å; S700-S713 PolarHBondContact O-OG 2.85Å; T701-S713 PolarHBondContact N-OG 3.45Å; T701-S713 PolarHBondContact O-OG 3.07Å; S713-C715 PolarHBondContact O-N 2.68Å; S713-K716 PolarHBondContact O-N 3.26Å; S713-K716 VanDerWaalsContact O-N 3.15Å; S713-E717 PolarHBondContact O-N 3.14Å
714	E	90.1	Very high	85.6	Confident	123 Å²	123	51.9 Å²	51.9	58%	0.575	28%	0.277	S	S	*	.	H	α-helix	trans	-58.3	-40.5	176	-75.3	-166.2	-132.2	0	0	114	H712 K716 K718	H712-E714 VanDerWaalsContact C-N 3.32Å; H712-E714 PolarHBondContact O-N 3.49Å; E714-K716 VanDerWaalsContact C-N 3.33Å; E714-K718 WeakPolarHBondContact O-CB 3.32Å; E714-K718 WeakPolarHBondContact O-CD 3.4Å; E714-K718 WeakPolarHBondContact O-CE 3.45Å; E714-K718 WeakPolarHBondContact O-CG 3.28Å; E714-K718 PolarHBondContact O-N 2.57Å; E714-K718 IonicContact OE2-NZ 2.91Å; E714-K718 PolarHBondContact OE2-NZ 2.81Å
715	C	88.9	Confident	85.7	Confident	22 Å²	22	53.1 Å²	53.1	15%	0.149	29%	0.286	C	S	.	.	H	α-helix	trans	-67.5	-39.9	178.5	-70	0	0	0	0	110.4	I686 H712 S713 K718 S719	I686-C715 HydrophobicContact CB-CB 4.04Å; I686-C715 HydrophobicContact CD1-CB 3.88Å; I686-C715 HydrophobicContact CG2-CB 3.99Å; H712-C715 HydrophobicContact CB-CB 4.05Å; H712-C715 PolarHBondContact O-N 3.04Å; H712-C715 VanDerWaalsContact O-N 3.08Å; S713-C715 PolarHBondContact O-N 2.68Å; C715-K718 PolarHBondContact O-N 3.16Å; C715-S719 PolarHBondContact O-N 3.4Å; C715-S719 PolarHBondContact O-OG 2.76Å
716	K	86.1	Confident	85.8	Confident	31 Å²	31	51 Å²	51	14%	0.135	28%	0.28	C	S	.	.	H	α-helix	trans	-68.6	-37.5	-179.1	-177.5	53.6	-178	160.3	0	112.9	F711 H712 S713 E714 S719	F711-K716 HydrophobicContact CB-CB 4.28Å; F711-K716 HydrophobicContact CD2-CD 4.36Å; H712-K716 PolarHBondContact O-N 3.04Å; S713-K716 PolarHBondContact O-N 3.26Å; S713-K716 VanDerWaalsContact O-N 3.15Å; E714-K716 VanDerWaalsContact C-N 3.33Å; K716-S719 CarbonylContact O-C 3.49Å; K716-S719 PolarHBondContact O-N 2.89Å
717	E	84.4	Confident	85.9	Confident	152 Å²	152	53.2 Å²	53.2	71%	0.71	28%	0.275	S	S	*	.	H	α-helix	trans	-63.4	-41.7	171.4	-71.8	176.4	171.8	0	0	111.9	S713 S719	S713-E717 PolarHBondContact O-N 3.14Å; E717-S719 VanDerWaalsContact C-N 3.33Å; E717-S719 PolarHBondContact O-N 3.1Å
718	K	80.1	Confident	85.8	Confident	151 Å²	151	58 Å²	58	66%	0.657	29%	0.292	S	S	*	.	H	α-helix	trans	-73.3	-20.5	-179.3	-66.1	163.1	-158.6	171.4	0	113.2	E714 C715	E714-K718 WeakPolarHBondContact O-CB 3.32Å; E714-K718 WeakPolarHBondContact O-CD 3.4Å; E714-K718 WeakPolarHBondContact O-CE 3.45Å; E714-K718 WeakPolarHBondContact O-CG 3.28Å; E714-K718 PolarHBondContact O-N 2.57Å; E714-K718 IonicContact OE2-NZ 2.91Å; E714-K718 PolarHBondContact OE2-NZ 2.81Å; C715-K718 PolarHBondContact O-N 3.16Å
719	S	67.7	Low	85.9	Confident	31 Å²	31	61.9 Å²	61.9	22%	0.217	31%	0.31	C	S	.	.			trans	-130.5	95	177.6	74.9	0	0	0	0	113.8	I686 C715 K716 E717	I686-S719 WeakPolarHBondContact CD1-OG 3.3Å; C715-S719 PolarHBondContact O-N 3.4Å; C715-S719 PolarHBondContact O-OG 2.76Å; K716-S719 CarbonylContact O-C 3.49Å; K716-S719 PolarHBondContact O-N 2.89Å; E717-S719 VanDerWaalsContact C-N 3.33Å; E717-S719 PolarHBondContact O-N 3.1Å
720	V	70.2	Confident	85.7	Confident	121 Å²	121	66.4 Å²	66.4	73%	0.733	33%	0.333	S	S	*	.			trans	-107.1	99.9	164.5	-174.8	0	0	0	0	106.5
721	P	82.6	Confident	85.2	Confident	88 Å²	88	72.2 Å²	72.2	57%	0.571	36%	0.36	S	S	*	.	S	Bend	cis	-113.8	174.7	44.2	10.7	11.8	0	0	0	114.9	V726	P721-V726 HydrophobicContact CB-CG2 3.96Å; P721-V726 HydrophobicContact CG-CG2 3.99Å
722	C	89	Confident	84.7	Confident	5 Å²	5	78.2 Å²	78.2	3%	0.034	39%	0.386	C	S	.	.			trans	-67.3	123.1	175.1	178.2	0	0	0	0	111.9	C704 R724 C725 V726	C704-C722 HydrophobicContact CB-CB 4.31Å; C704-C722 VanDerWaalsContact SG-CB 3.5Å; C722-R724 VanDerWaalsContact C-N 3.34Å; C722-R724 PolarHBondContact O-N 2.69Å; C722-C725 HydrophobicContact CB-CB 3.97Å; C722-C725 PolarHBondContact O-N 2.63Å; C722-V726 WeakPolarHBondContact O-CG2 3.39Å; C722-V726 PolarHBondContact O-N 3.24Å
723	P	87.6	Confident	83.8	Confident	38 Å²	38	82.3 Å²	82.3	25%	0.247	40%	0.404	C	S	.	.	H	α-helix	trans	-62.6	-38.6	-176.7	24	-33.5	0	0	0	112.6	E685 I686 F711 V726 R727	E685-P723 HydrophobicContact CB-CG 4.17Å; I686-P723 HydrophobicContact CG1-CG 4.19Å; F711-P723 HydrophobicContact CE1-CG 3.97Å; F711-P723 HydrophobicContact CZ-CG 4.27Å; P723-V726 PolarHBondContact O-N 3.44Å; P723-R727 WeakPolarHBondContact O-CG 3.11Å; P723-R727 PolarHBondContact O-N 2.75Å
724	R	86.6	Confident	82.6	Confident	61 Å²	61	86.6 Å²	86.6	23%	0.23	42%	0.42	C	S	.	.	H	α-helix	trans	-64.9	-38.7	177	-154.7	174.3	-175.6	-153.9	3.9	112.8	E17 E685 C722 R728	E17-R724 VanDerWaalsContact CD-NH2 3.33Å; E17-R724 IonicContact OE1-CZ 3.97Å; E17-R724 IonicContact OE1-NH1 2.72Å; E17-R724 PolarHBondContact OE1-NH1 3.41Å; E17-R724 IonicContact OE1-NH2 3.16Å; E17-R724 PolarHBondContact OE1-NH2 3.42Å; E17-R724 IonicContact OE2-CZ 3.79Å; E17-R724 VanDerWaalsContact OE2-CZ 3.27Å; E17-R724 IonicContact OE2-NH1 3.11Å; E17-R724 PolarHBondContact OE2-NH1 2.87Å; E17-R724 IonicContact OE2-NH2 3.27Å; E17-R724 PolarHBondContact OE2-NH2 2.84Å; E17-R724 VanDerWaalsContact OE2-NH2 3.11Å; E685-R724 WeakPolarHBondContact OE1-CD 3.25Å; E685-R724 IonicContact OE1-NE 3.97Å; E685-R724 PolarHBondContact OE2-N 3.46Å; C722-R724 VanDerWaalsContact C-N 3.34Å; C722-R724 PolarHBondContact O-N 2.69Å; R724-R728 WeakPolarHBondContact O-CB 3.35Å; R724-R728 PolarHBondContact O-N 2.96Å
725	C	89.2	Confident	81.2	Confident	30 Å²	30	88.1 Å²	88.1	20%	0.203	43%	0.425	C	S	.	.	H	α-helix	trans	-67.9	-42.1	174	-61.6	0	0	0	0	111.6	S706 C707 C722 R728 E729	S706-C725 PolarHBondContact OG-SG 3.22Å; C707-C725 PolarHBondContact SG-SG 2.87Å; C722-C725 HydrophobicContact CB-CB 3.97Å; C722-C725 PolarHBondContact O-N 2.63Å; C725-R728 PolarHBondContact O-N 3.01Å; C725-E729 VanDerWaalsContact O-CB 3.32Å; C725-E729 WeakPolarHBondContact O-CB 3.48Å; C725-E729 PolarHBondContact O-N 2.74Å
726	V	86.8	Confident	79.8	Confident	61 Å²	61	89.1 Å²	89.1	37%	0.37	43%	0.432	S	S	.	.	H	α-helix	trans	-60.9	-45.7	176.1	172.6	0	0	0	0	110.9	P721 C722 P723 E729 L730	P721-V726 HydrophobicContact CB-CG2 3.96Å; P721-V726 HydrophobicContact CG-CG2 3.99Å; C722-V726 WeakPolarHBondContact O-CG2 3.39Å; C722-V726 PolarHBondContact O-N 3.24Å; P723-V726 PolarHBondContact O-N 3.44Å; V726-E729 PolarHBondContact O-N 2.94Å; V726-L730 HydrophobicContact CG1-CD1 3.83Å; V726-L730 HydrophobicContact CG1-CG 4.37Å; V726-L730 WeakPolarHBondContact O-CB 3.34Å; V726-L730 VanDerWaalsContact O-CG 3.3Å; V726-L730 WeakPolarHBondContact O-CG 3.42Å; V726-L730 PolarHBondContact O-N 2.8Å
727	R	87.3	Confident	78.2	Confident	132 Å²	132	92.9 Å²	92.9	50%	0.498	45%	0.449	S	S	.	.	H	α-helix	trans	-59.5	-48.1	174.4	-72.8	-171.5	-68.5	150.2	-1.1	112.3	E685 P723 E729 L730 Q731	E685-R727 IonicContact OE1-NH2 2.76Å; E685-R727 PolarHBondContact OE1-NH2 3.46Å; E685-R727 IonicContact OE2-CZ 2.66Å; E685-R727 IonicContact OE2-NH2 3.77Å; E685-R727 PolarHBondContact OE2-NH2 3.37Å; P723-R727 WeakPolarHBondContact O-CG 3.11Å; P723-R727 PolarHBondContact O-N 2.75Å; R727-E729 VanDerWaalsContact C-N 3.29Å; R727-E729 PolarHBondContact O-N 2.95Å; R727-L730 PolarHBondContact O-N 2.74Å; R727-Q731 WeakPolarHBondContact O-CG 3.46Å; R727-Q731 PolarHBondContact O-N 3.22Å
728	R	87	Confident	76.5	Confident	106 Å²	106	93.7 Å²	93.7	40%	0.4	45%	0.445	S	S	.	.	H	α-helix	trans	-60.7	-36.7	178.5	-172.3	177.4	-76.4	-169.7	-3.9	112.1	R724 C725 K732	R724-R728 WeakPolarHBondContact O-CB 3.35Å; R724-R728 PolarHBondContact O-N 2.96Å; C725-R728 PolarHBondContact O-N 3.01Å; R728-K732 WeakPolarHBondContact O-CG 3.44Å; R728-K732 PolarHBondContact O-N 3.31Å
729	E	87.1	Confident	75	Confident	83 Å²	83	94 Å²	94	39%	0.388	45%	0.449	S	S	.	.	H	α-helix	trans	-76.4	-38	178.3	-176.1	59.7	-166.1	0	0	112.9	C725 V726 R727 K732 K733	C725-E729 VanDerWaalsContact O-CB 3.32Å; C725-E729 WeakPolarHBondContact O-CB 3.48Å; C725-E729 PolarHBondContact O-N 2.74Å; V726-E729 PolarHBondContact O-N 2.94Å; R727-E729 VanDerWaalsContact C-N 3.29Å; R727-E729 PolarHBondContact O-N 2.95Å; E729-K732 PolarHBondContact O-N 2.8Å; E729-K733 HydrophobicContact CG-CD 4.39Å; E729-K733 WeakPolarHBondContact O-CG 3.22Å; E729-K733 PolarHBondContact O-N 3.12Å; E729-K733 WeakPolarHBondContact OE1-CE 3.34Å; E729-K733 IonicContact OE1-NZ 3.02Å; E729-K733 PolarHBondContact OE1-NZ 3.19Å
730	L	84.2	Confident	74.1	Confident	99 Å²	99	101.4 Å²	101.4	52%	0.518	47%	0.472	S	S	.	.	H	α-helix	trans	-64.3	-42.3	173.6	-73.5	169.8	0	0	0	111.8	V726 R727 K733 Q734	V726-L730 HydrophobicContact CG1-CD1 3.83Å; V726-L730 HydrophobicContact CG1-CG 4.37Å; V726-L730 WeakPolarHBondContact O-CB 3.34Å; V726-L730 VanDerWaalsContact O-CG 3.3Å; V726-L730 WeakPolarHBondContact O-CG 3.42Å; V726-L730 PolarHBondContact O-N 2.8Å; R727-L730 PolarHBondContact O-N 2.74Å; L730-K733 PolarHBondContact O-N 3.38Å; L730-Q734 PolarHBondContact O-N 3.27Å
731	Q	81.8	Confident	73.1	Confident	124 Å²	124	99.6 Å²	99.6	58%	0.579	46%	0.458	S	S	*	.	H	α-helix	trans	-61.8	-42.7	175	-75	176.5	-22.7	0	0	112.2	R727 Q734 K735	R727-Q731 WeakPolarHBondContact O-CG 3.46Å; R727-Q731 PolarHBondContact O-N 3.22Å; Q731-Q734 PolarHBondContact O-N 2.93Å; Q731-K735 PolarHBondContact O-N 2.96Å
732	K	80.2	Confident	71.3	Confident	126 Å²	126	101.5 Å²	101.5	55%	0.548	46%	0.464	S	S	.	.	H	α-helix	trans	-58.9	-46.2	172.2	-77.3	174.9	175.5	-175.7	0	111.7	R728 E729 K735 S736	R728-K732 WeakPolarHBondContact O-CG 3.44Å; R728-K732 PolarHBondContact O-N 3.31Å; E729-K732 PolarHBondContact O-N 2.8Å; K732-K735 PolarHBondContact O-N 2.89Å; K732-S736 WeakPolarHBondContact O-CB 3.5Å; K732-S736 PolarHBondContact O-N 3.13Å
733	K	73.4	Confident	69.4	Low	114 Å²	114	108.9 Å²	108.9	50%	0.496	50%	0.499	S	S	.	.	H	α-helix	trans	-63.7	-42.7	179.5	-78.1	172.4	176.9	155.9	0	112.3	E729 L730 S736 F737	E729-K733 HydrophobicContact CG-CD 4.39Å; E729-K733 WeakPolarHBondContact O-CG 3.22Å; E729-K733 PolarHBondContact O-N 3.12Å; E729-K733 WeakPolarHBondContact OE1-CE 3.34Å; E729-K733 IonicContact OE1-NZ 3.02Å; E729-K733 PolarHBondContact OE1-NZ 3.19Å; L730-K733 PolarHBondContact O-N 3.38Å; K733-S736 CarbonylContact O-C 3.56Å; K733-S736 PolarHBondContact O-N 2.81Å; K733-S736 PolarHBondContact O-OG 2.88Å; K733-F737 WeakPolarHBondContact O-CB 3.37Å; K733-F737 PolarHBondContact O-N 3.06Å
734	Q	64.1	Low	67.4	Low	120 Å²	120	114.1 Å²	114.1	56%	0.561	53%	0.525	S	S	*	.	H	α-helix	trans	-59.5	-48.9	172.5	-77.6	-178.6	-25.4	0	0	112	L730 Q731 S736 F737 W738	L730-Q734 PolarHBondContact O-N 3.27Å; Q731-Q734 PolarHBondContact O-N 2.93Å; Q734-S736 VanDerWaalsContact C-N 3.29Å; Q734-S736 PolarHBondContact O-N 3.12Å; Q734-F737 WeakPolarHBondContact O-CB 3.26Å; Q734-F737 PolarHBondContact O-N 3.3Å; Q734-W738 PolarHBondContact O-N 3.21Å
735	K	61.3	Low	65.4	Low	155 Å²	155	119.9 Å²	119.9	67%	0.674	56%	0.555	S	S	*	*	H	α-helix	trans	-58.4	-41.1	175.7	-71.2	-171.2	176.7	-170.7	0	112	Q731 K732 F737 Q739	Q731-K735 PolarHBondContact O-N 2.96Å; K732-K735 PolarHBondContact O-N 2.89Å; K735-F737 PolarHBondContact O-N 3.2Å; K735-Q739 WeakPolarHBondContact O-CB 3.03Å; K735-Q739 WeakPolarHBondContact O-CG 3.37Å; K735-Q739 PolarHBondContact O-N 3.28Å
736	S	59.2	Low	63.1	Low	44 Å²	44	122.3 Å²	122.3	31%	0.308	57%	0.572	S	S	.	*	H	α-helix	trans	-69.9	-13.5	175	83.7	0	0	0	0	115.2	K732 K733 Q734 R740	K732-S736 WeakPolarHBondContact O-CB 3.5Å; K732-S736 PolarHBondContact O-N 3.13Å; K733-S736 CarbonylContact O-C 3.56Å; K733-S736 PolarHBondContact O-N 2.81Å; K733-S736 PolarHBondContact O-OG 2.88Å; Q734-S736 VanDerWaalsContact C-N 3.29Å; Q734-S736 PolarHBondContact O-N 3.12Å; S736-R740 PolarHBondContact O-NE 2.82Å; S736-R740 PolarHBondContact O-NH2 2.78Å; S736-R740 PolarHBondContact OG-NH2 2.92Å
737	F	52.9	Low	61	Low	109 Å²	109	127.5 Å²	127.5	48%	0.478	60%	0.597	S	S	.	*	H	α-helix	trans	-90.4	-48.8	176.1	176	-98.9	0	0	0	109.7	K733 Q734 K735 Q739 R740 L741	K733-F737 WeakPolarHBondContact O-CB 3.37Å; K733-F737 PolarHBondContact O-N 3.06Å; Q734-F737 WeakPolarHBondContact O-CB 3.26Å; Q734-F737 PolarHBondContact O-N 3.3Å; K735-F737 PolarHBondContact O-N 3.2Å; F737-Q739 PolarHBondContact O-N 3.04Å; F737-R740 WeakPolarHBondContact O-CA 3.42Å; F737-R740 WeakPolarHBondContact O-CB 3.24Å; F737-R740 PolarHBondContact O-N 2.94Å; F737-L741 HydrophobicContact CD1-CD1 4.02Å; F737-L741 HydrophobicContact CE1-CD1 3.53Å; F737-L741 HydrophobicContact CZ-CD1 3.92Å; F737-L741 PolarHBondContact O-N 2.98Å
738	W	48.4	Very low	58.8	Low	169 Å²	169	129.7 Å²	129.7	64%	0.64	61%	0.613	S	S	*	*	H	α-helix	trans	-61	-40.9	173.8	-63.6	119.4	0	0	0	112.5	Q734 R740 L741 N742	Q734-W738 PolarHBondContact O-N 3.21Å; W738-R740 PolarHBondContact O-N 3.05Å; W738-L741 HydrophobicContact CE3-CD1 3.81Å; W738-L741 HydrophobicContact CZ3-CD1 3.96Å; W738-L741 PolarHBondContact O-N 2.8Å; W738-N742 PolarHBondContact O-N 3.27Å
739	Q	48.4	Very low	56.7	Low	157 Å²	157	132.1 Å²	132.1	73%	0.734	63%	0.629	S	S	*	*	H	α-helix	trans	-61.7	-22.1	171.6	-78.2	-174.9	-59.6	0	0	114.1	K735 F737	K735-Q739 WeakPolarHBondContact O-CB 3.03Å; K735-Q739 WeakPolarHBondContact O-CG 3.37Å; K735-Q739 PolarHBondContact O-N 3.28Å; F737-Q739 PolarHBondContact O-N 3.04Å
740	R	49.9	Very low	54.4	Low	187 Å²	187	131.9 Å²	131.9	71%	0.706	64%	0.641	S	S	*	*	H	α-helix	trans	-87.7	-11	174.3	-90.6	-179.6	-71	164.5	-3.2	113.8	S736 F737 W738	S736-R740 PolarHBondContact O-NE 2.82Å; S736-R740 PolarHBondContact O-NH2 2.78Å; S736-R740 PolarHBondContact OG-NH2 2.92Å; F737-R740 WeakPolarHBondContact O-CA 3.42Å; F737-R740 WeakPolarHBondContact O-CB 3.24Å; F737-R740 PolarHBondContact O-N 2.94Å; W738-R740 PolarHBondContact O-N 3.05Å
741	L	48.4	Very low	52.3	Low	84 Å²	84	132.4 Å²	132.4	44%	0.44	65%	0.652	S	S	.	*	H	α-helix	trans	-92.8	-11.5	175.4	-71.2	170.7	0	0	0	113.1	F737 W738 M743	F737-L741 HydrophobicContact CD1-CD1 4.02Å; F737-L741 HydrophobicContact CE1-CD1 3.53Å; F737-L741 HydrophobicContact CZ-CD1 3.92Å; F737-L741 PolarHBondContact O-N 2.98Å; W738-L741 HydrophobicContact CE3-CD1 3.81Å; W738-L741 HydrophobicContact CZ3-CD1 3.96Å; W738-L741 PolarHBondContact O-N 2.8Å; L741-M743 VanDerWaalsContact C-N 3.27Å; L741-M743 PolarHBondContact O-N 3.49Å; L741-M743 VanDerWaalsContact O-N 3.09Å
742	N	44.7	Very low	50.1	Low	128 Å²	128	132.1 Å²	132.1	68%	0.684	66%	0.659	S	S	*	*			trans	45.5	44.6	167.8	-155.4	85.1	0	0	0	115	W738 D744	W738-N742 PolarHBondContact O-N 3.27Å; N742-D744 PolarHBondContact O-N 2.76Å
743	M	49.4	Very low	48.1	Very low	159 Å²	159	133.3 Å²	133.3	78%	0.783	67%	0.668	S	S	*	*			trans	-85.4	78.5	171.1	-68	-73.1	94.4	0	0	109.5	L741	L741-M743 VanDerWaalsContact C-N 3.27Å; L741-M743 PolarHBondContact O-N 3.49Å; L741-M743 VanDerWaalsContact O-N 3.09Å
744	D	44.7	Very low	46.3	Very low	148 Å²	148	136.9 Å²	136.9	79%	0.791	68%	0.684	S	S	*	*			trans	-131.9	47.1	174.2	-157	15.8	0	0	0	111.2	N742	N742-D744 PolarHBondContact O-N 2.76Å
745	E	45.5	Very low	44.7	Very low	183 Å²	183	140.5 Å²	140.5	86%	0.855	70%	0.7	S	S	*	*	S	Bend	trans	-162	134.4	154	-113.5	179.5	176.8	0	0	107.9
746	S	41.4	Very low	43.3	Very low	81 Å²	81	140.1 Å²	140.1	57%	0.566	71%	0.705	S	S	*	*			trans	97.8	41.8	-178.9	77	0	0	0	0	120.4	E748	S746-E748 PolarHBondContact O-N 3.35Å
747	L	42.4	Very low	41.9	Very low	169 Å²	169	142.9 Å²	142.9	89%	0.885	73%	0.725	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.8	36.5	169.9	-159.3	77.1	0	0	0	114.7
748	E	40.9	Very low	41	Very low	178 Å²	178	148.7 Å²	148.7	83%	0.832	75%	0.745	S	S	*	*	T	Hydrogen-bonded Turn	trans	-132.8	-27.9	171	-70.8	-163.5	136.9	0	0	113.5	S746	S746-E748 PolarHBondContact O-N 3.35Å
749	E	42.4	Very low	40.2	Very low	158 Å²	158	149 Å²	149	74%	0.738	75%	0.753	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.4	-19.4	-177	-65.7	-166.1	131.9	0	0	114.4	C751 T752	E749-C751 PolarHBondContact O-N 3.26Å; E749-T752 PolarHBondContact O-OG1 3.31Å
750	A	39.4	Very low	39.5	Very low	77 Å²	77	149.1 Å²	149.1	64%	0.636	76%	0.759	S	S	*	*	G	3₁₀ helix	trans	-75.8	-17.8	-177	0	0	0	0	0	114.8	T752	A750-T752 VanDerWaalsContact C-N 3.27Å; A750-T752 PolarHBondContact O-N 3.3Å
751	C	38.8	Very low	38.8	Very low	111 Å²	111	150.4 Å²	150.4	75%	0.75	79%	0.788	S	S	*	*	G	3₁₀ helix	trans	-79.1	0.6	-170.4	-68.6	0	0	0	0	115.1	E749	E749-C751 PolarHBondContact O-N 3.26Å
752	T	36.5	Very low	38.3	Very low	118 Å²	118	153.7 Å²	153.7	72%	0.724	81%	0.805	S	S	*	*	G	3₁₀ helix	trans	-103.4	-0.9	-176	55.3	0	0	0	0	114.5	E749 A750	E749-T752 PolarHBondContact O-OG1 3.31Å; A750-T752 VanDerWaalsContact C-N 3.27Å; A750-T752 PolarHBondContact O-N 3.3Å
753	M	37.7	Very low	38	Very low	151 Å²	151	155.1 Å²	155.1	74%	0.744	81%	0.812	S	S	*	*	S	Bend	trans	-113.6	21.1	-165.3	-141	-175.9	-58.8	0	0	116.3
754	F	35.2	Very low	37.3	Very low	189 Å²	189	154.8 Å²	154.8	83%	0.829	81%	0.813	S	S	*	*			trans	-141	54.9	169.7	-86.1	-70.5	0	0	0	113.5	L756	F754-L756 PolarHBondContact O-N 2.9Å
755	E	31.8	Very low	36.9	Very low	195 Å²	195	155.2 Å²	155.2	91%	0.911	81%	0.814	S	S	*	*			trans	-68.7	95.1	154	-75.6	-162.7	141.5	0	0	109.4
756	L	31.7	Very low	36.4	Very low	148 Å²	148	153.5 Å²	153.5	78%	0.775	81%	0.812	S	S	*	*			trans	-84.9	113.3	164.7	-76.7	174.8	0	0	0	109.3	F754 Y758	F754-L756 PolarHBondContact O-N 2.9Å; L756-Y758 PolarHBondContact O-N 3.37Å
757	S	29.9	Very low	36	Very low	102 Å²	102	158.3 Å²	158.3	71%	0.713	83%	0.828	S	S	*	*			trans	-66.4	121.5	-179.5	45	0	0	0	0	111.9	Q759	S757-Q759 PolarHBondContact O-N 2.54Å
758	Y	32.8	Very low	35.6	Very low	231 Å²	231	157.6 Å²	157.6	91%	0.906	82%	0.824	S	S	*	*			trans	-65.3	118.1	160.6	-95.5	-98.1	0	0	0	109.1	L756	L756-Y758 PolarHBondContact O-N 3.37Å
759	Q	32.4	Very low	35.2	Very low	175 Å²	175	156 Å²	156	82%	0.818	82%	0.824	S	S	*	*			trans	-120.5	134.2	162.4	-72.2	-165.1	-17.7	0	0	109.8	S757	S757-Q759 PolarHBondContact O-N 2.54Å
760	N	33.1	Very low	34.6	Very low	159 Å²	159	155.8 Å²	155.8	85%	0.85	83%	0.831	S	S	*	*			trans	-77.3	130.3	177.5	-65.3	-45.2	0	0	0	111.1
761	T	35.3	Very low	34.1	Very low	214 Å²	214	163 Å²	163	100%	1.313	85%	0.848	S	S	*	*			trans	-149.4	0	137.7	51.6	0	0	0	0	108.5

Retrieved 761 of 761 residues in 3461.4 ms (Link to these results)

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