A0A096NVJ3_PAPAN Loading...

Synaptotagmin 16

May be involved in the trafficking and exocytosis of secretory vesicles in non-neuronal tissues. Is Ca(2+)-independent.

AlphaFold DB , UniProt , Accession A0A096NVJ3, Species PAPAN (Papio anubis, Olive baboon), Gene SYT16, Length 645 aa.

Structure Viewer

Loading PAE data...

(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	45.6	Very low	44.5	Very low	243 Å²	243	140.3 Å²	140.3	100%	1.197	81%	0.813	S	S	*	*				0	54.1	0	-167.1	176.7	-176	0	0	110.2
2	V	42	Very low	44.6	Very low	142 Å²	142	137.7 Å²	137.7	86%	0.861	79%	0.794	S	S	*	*			trans	-148	76	179	-174	0	0	0	0	108
3	L	39.9	Very low	44.8	Very low	179 Å²	179	139.3 Å²	139.3	94%	0.937	79%	0.786	S	S	*	*	S	Bend	trans	-163.5	35.2	173.6	-119.1	164.7	0	0	0	111.8
4	A	45	Very low	44.9	Very low	99 Å²	99	140 Å²	140	82%	0.818	78%	0.777	S	S	*	*	S	Bend	trans	-147.6	35.4	-172.9	0	0	0	0	0	113.5
5	M	42.7	Very low	45.1	Very low	188 Å²	188	139.7 Å²	139.7	93%	0.926	77%	0.768	S	S	*	*	S	Bend	trans	-134.6	4.2	179.1	-84.1	-171.9	154.9	0	0	115.3
6	A	44.5	Very low	45.6	Very low	111 Å²	111	136.3 Å²	136.3	92%	0.917	75%	0.754	S	S	*	*	S	Bend	trans	-101.8	22.7	-178.7	0	0	0	0	0	114.2
7	S	47.8	Very low	45.9	Very low	94 Å²	94	135 Å²	135	66%	0.657	74%	0.739	S	S	*	*	S	Bend	trans	-121.4	0.1	-174.4	-167.4	0	0	0	0	115
8	Q	46.7	Very low	46.2	Very low	138 Å²	138	131.3 Å²	131.3	65%	0.645	73%	0.725	S	S	*	*	S	Bend	trans	-91.3	-34.9	-175.2	-142	78	43.8	0	0	113	A10	Q8-A10 PolarHBondContact O-N 3.21Å
9	D	43.4	Very low	47	Very low	136 Å²	136	127.2 Å²	127.2	73%	0.727	71%	0.706	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.5	-15.7	-171.9	-69.7	-37.2	0	0	0	114.9	Q11	D9-Q11 VanDerWaalsContact C-N 3.32Å; D9-Q11 PolarHBondContact O-N 3.39Å
10	A	45.8	Very low	48.1	Very low	73 Å²	73	129.1 Å²	129.1	60%	0.603	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.1	-21.3	176.3	0	0	0	0	0	113.6	Q8	Q8-A10 PolarHBondContact O-N 3.21Å
11	Q	46.3	Very low	49	Very low	140 Å²	140	128.2 Å²	128.2	65%	0.654	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.9	-23.3	-177.1	-75.7	-175.4	-25.3	0	0	114	D9	D9-Q11 VanDerWaalsContact C-N 3.32Å; D9-Q11 PolarHBondContact O-N 3.39Å
12	N	45.8	Very low	50	Low	109 Å²	109	120.1 Å²	120.1	58%	0.583	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.8	-15.4	-177	-72.3	-30.5	0	0	0	114
13	F	47.5	Very low	51.3	Low	159 Å²	159	121.6 Å²	121.6	70%	0.697	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.4	-23	-177.8	-147.2	-93.3	0	0	0	114.1
14	F	45.6	Very low	52.9	Low	149 Å²	149	116.4 Å²	116.4	65%	0.654	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.2	-13.5	-175	-77.3	-79.9	0	0	0	114.9	P16 F17 S18	F14-P16 VanDerWaalsContact C-CD 3.5Å; F14-F17 PolarHBondContact O-N 3.46Å; F14-S18 PolarHBondContact O-N 3.46Å
15	Q	47.5	Very low	53.8	Low	136 Å²	136	119.4 Å²	119.4	64%	0.636	62%	0.62	S	S	*	*	H	α-helix	trans	-63.2	-34.4	179.5	-67.1	-149.6	-23.7	0	0	115.8	F17 S18 S19	Q15-F17 VanDerWaalsContact C-N 3.31Å; Q15-F17 PolarHBondContact O-N 3.44Å; Q15-S18 PolarHBondContact O-OG 3.46Å; Q15-S19 PolarHBondContact O-N 3.49Å
16	P	53.8	Low	55.5	Low	84 Å²	84	116.8 Å²	116.8	55%	0.545	61%	0.605	S	S	.	*	H	α-helix	trans	-64.9	-35.5	176.7	-22.6	34.4	0	0	0	112.9	F14 W20	F14-P16 VanDerWaalsContact C-CD 3.5Å; P16-W20 PolarHBondContact O-N 3.03Å; P16-W20 VanDerWaalsContact O-N 3.13Å
17	F	51.3	Low	56.7	Low	115 Å²	115	114.2 Å²	114.2	50%	0.504	58%	0.584	S	S	.	*	H	α-helix	trans	-75	-40.6	-176.1	-82.3	-83.1	0	0	0	113.1	F14 Q15 W20 I21	F14-F17 PolarHBondContact O-N 3.46Å; Q15-F17 VanDerWaalsContact C-N 3.31Å; Q15-F17 PolarHBondContact O-N 3.44Å; F17-W20 HydrophobicContact CD1-CE3 4.29Å; F17-W20 HydrophobicContact CE1-CE3 4.35Å; F17-W20 HydrophobicContact CE1-CZ3 4.31Å; F17-W20 PolarHBondContact O-N 2.93Å; F17-I21 WeakPolarHBondContact O-CG1 3.42Å; F17-I21 PolarHBondContact O-N 3.33Å
18	S	50.9	Low	57.8	Low	69 Å²	69	115.3 Å²	115.3	48%	0.483	58%	0.582	S	S	.	*	H	α-helix	trans	-64.5	-41.9	175.6	55.8	0	0	0	0	111.7	F14 Q15 W20 I21 S22	F14-S18 PolarHBondContact O-N 3.46Å; Q15-S18 PolarHBondContact O-OG 3.46Å; S18-W20 PolarHBondContact O-N 3.31Å; S18-I21 PolarHBondContact O-N 2.97Å; S18-S22 PolarHBondContact O-N 3.48Å; S18-S22 PolarHBondContact O-OG 3.28Å; S18-S22 VanDerWaalsContact O-OG 3.09Å
19	S	61.7	Low	59.1	Low	52 Å²	52	113.3 Å²	113.3	36%	0.364	57%	0.572	S	S	.	*	H	α-helix	trans	-57.3	-43.7	172.8	173.4	0	0	0	0	112.8	Q15 R23	Q15-S19 PolarHBondContact O-N 3.49Å; S19-R23 WeakPolarHBondContact O-CG 3.4Å; S19-R23 PolarHBondContact O-N 3.09Å
20	W	68.4	Low	60.1	Low	165 Å²	165	113.4 Å²	113.4	63%	0.625	57%	0.568	S	S	*	*	H	α-helix	trans	-68	-45.6	178.8	-176	25.5	0	0	0	112.2	P16 F17 S18 S22 R23 V24	P16-W20 PolarHBondContact O-N 3.03Å; P16-W20 VanDerWaalsContact O-N 3.13Å; F17-W20 HydrophobicContact CD1-CE3 4.29Å; F17-W20 HydrophobicContact CE1-CE3 4.35Å; F17-W20 HydrophobicContact CE1-CZ3 4.31Å; F17-W20 PolarHBondContact O-N 2.93Å; S18-W20 PolarHBondContact O-N 3.31Å; W20-S22 VanDerWaalsContact C-N 3.34Å; W20-S22 PolarHBondContact O-N 3.23Å; W20-R23 PolarHBondContact O-N 3Å; W20-V24 WeakPolarHBondContact O-CG2 3.36Å; W20-V24 PolarHBondContact O-N 3.4Å
21	I	66.5	Low	60.9	Low	112 Å²	112	112.2 Å²	112.2	57%	0.574	56%	0.559	S	S	*	*	H	α-helix	trans	-61.4	-42.2	178.5	-68.2	166.4	0	0	0	111	F17 S18 R23 V24 Y25	F17-I21 WeakPolarHBondContact O-CG1 3.42Å; F17-I21 PolarHBondContact O-N 3.33Å; S18-I21 PolarHBondContact O-N 2.97Å; I21-R23 PolarHBondContact O-N 3.43Å; I21-V24 PolarHBondContact O-N 3Å; I21-Y25 WeakPolarHBondContact O-CB 3.4Å; I21-Y25 PolarHBondContact O-N 3.44Å
22	S	67.4	Low	62	Low	73 Å²	73	107.2 Å²	107.2	51%	0.51	54%	0.544	S	S	.	.	H	α-helix	trans	-61.3	-42.7	175.6	-63	0	0	0	0	112.7	S18 W20 Y25 E26	S18-S22 PolarHBondContact O-N 3.48Å; S18-S22 PolarHBondContact O-OG 3.28Å; S18-S22 VanDerWaalsContact O-OG 3.09Å; W20-S22 VanDerWaalsContact C-N 3.34Å; W20-S22 PolarHBondContact O-N 3.23Å; S22-Y25 PolarHBondContact O-N 3.17Å; S22-E26 PolarHBondContact O-N 2.95Å
23	R	68.6	Low	62.8	Low	173 Å²	173	106.5 Å²	106.5	65%	0.653	54%	0.541	S	S	*	.	H	α-helix	trans	-68	-35	177.1	-73	176.7	-180	175.1	1.4	113.3	S19 W20 I21 Y25 A27	S19-R23 WeakPolarHBondContact O-CG 3.4Å; S19-R23 PolarHBondContact O-N 3.09Å; W20-R23 PolarHBondContact O-N 3Å; I21-R23 PolarHBondContact O-N 3.43Å; R23-Y25 VanDerWaalsContact C-N 3.33Å; R23-A27 WeakPolarHBondContact O-CB 3.32Å; R23-A27 PolarHBondContact O-N 3.35Å
24	V	72.9	Confident	63.5	Low	69 Å²	69	105.9 Å²	105.9	42%	0.418	54%	0.542	S	S	.	.	H	α-helix	trans	-66.9	-38.5	173.8	170.1	0	0	0	0	110.5	W20 I21 A27 L28	W20-V24 WeakPolarHBondContact O-CG2 3.36Å; W20-V24 PolarHBondContact O-N 3.4Å; I21-V24 PolarHBondContact O-N 3Å; V24-A27 PolarHBondContact O-N 3.18Å; V24-L28 HydrophobicContact CG1-CD1 4.07Å; V24-L28 WeakPolarHBondContact O-CB 3.44Å; V24-L28 PolarHBondContact O-N 3.36Å
25	Y	65.7	Low	64.1	Low	163 Å²	163	104.7 Å²	104.7	64%	0.639	54%	0.541	S	S	*	.	H	α-helix	trans	-67.4	-44.2	176.1	-162.7	-96.3	0	0	0	112.5	I21 S22 R23 A27 L28 Q29	I21-Y25 WeakPolarHBondContact O-CB 3.4Å; I21-Y25 PolarHBondContact O-N 3.44Å; S22-Y25 PolarHBondContact O-N 3.17Å; R23-Y25 VanDerWaalsContact C-N 3.33Å; Y25-A27 PolarHBondContact O-N 3.2Å; Y25-L28 PolarHBondContact O-N 3.32Å; Y25-Q29 WeakPolarHBondContact O-CB 3.36Å; Y25-Q29 PolarHBondContact O-N 3.06Å
26	E	76.9	Confident	64.5	Low	133 Å²	133	101.8 Å²	101.8	62%	0.621	54%	0.536	S	S	*	.	H	α-helix	trans	-60.8	-40.9	173	-76.8	-173.5	140.5	0	0	112.6	S22 Q29 Q30	S22-E26 PolarHBondContact O-N 2.95Å; E26-Q29 PolarHBondContact O-N 3.13Å; E26-Q30 PolarHBondContact O-N 3.4Å
27	A	70.1	Confident	64.6	Low	56 Å²	56	100.8 Å²	100.8	46%	0.463	54%	0.535	S	S	.	.	H	α-helix	trans	-66.4	-39.2	177.5	0	0	0	0	0	112.5	R23 V24 Y25 A31	R23-A27 WeakPolarHBondContact O-CB 3.32Å; R23-A27 PolarHBondContact O-N 3.35Å; V24-A27 PolarHBondContact O-N 3.18Å; Y25-A27 PolarHBondContact O-N 3.2Å; A27-A31 WeakPolarHBondContact O-CB 3.43Å; A27-A31 PolarHBondContact O-N 3.08Å
28	L	70.3	Confident	64.7	Low	118 Å²	118	98.6 Å²	98.6	62%	0.618	53%	0.534	S	S	*	.	H	α-helix	trans	-64.6	-39.7	172.6	-90.7	157.6	0	0	0	111.9	V24 Y25 A31 G32	V24-L28 HydrophobicContact CG1-CD1 4.07Å; V24-L28 WeakPolarHBondContact O-CB 3.44Å; V24-L28 PolarHBondContact O-N 3.36Å; Y25-L28 PolarHBondContact O-N 3.32Å; L28-A31 PolarHBondContact O-N 3.47Å; L28-G32 PolarHBondContact O-N 3.49Å
29	Q	74.1	Confident	64.7	Low	95 Å²	95	101.4 Å²	101.4	44%	0.444	54%	0.543	S	S	.	.	H	α-helix	trans	-65.4	-46.5	176.8	-166.1	63.1	48.1	0	0	111.5	Y25 E26 A31 G32 D33	Y25-Q29 WeakPolarHBondContact O-CB 3.36Å; Y25-Q29 PolarHBondContact O-N 3.06Å; E26-Q29 PolarHBondContact O-N 3.13Å; Q29-A31 VanDerWaalsContact C-N 3.32Å; Q29-A31 PolarHBondContact O-N 3.25Å; Q29-G32 PolarHBondContact O-N 3.12Å; Q29-D33 PolarHBondContact O-N 3.48Å
30	Q	65.3	Low	64.3	Low	139 Å²	139	103.1 Å²	103.1	65%	0.65	55%	0.551	S	S	*	*	H	α-helix	trans	-60.6	-38.5	174.9	-80.5	-172	-25.6	0	0	112.8	E26 M34	E26-Q30 PolarHBondContact O-N 3.4Å; Q30-M34 WeakPolarHBondContact O-CG 3.47Å; Q30-M34 PolarHBondContact O-N 3.39Å; Q30-M34 VanDerWaalsContact O-N 3.08Å
31	A	62.2	Low	63.5	Low	48 Å²	48	100.7 Å²	100.7	40%	0.397	55%	0.55	S	S	.	*	H	α-helix	trans	-65.7	-40.4	175	0	0	0	0	0	112.1	A27 L28 Q29 M34 L35	A27-A31 WeakPolarHBondContact O-CB 3.43Å; A27-A31 PolarHBondContact O-N 3.08Å; L28-A31 PolarHBondContact O-N 3.47Å; Q29-A31 VanDerWaalsContact C-N 3.32Å; Q29-A31 PolarHBondContact O-N 3.25Å; A31-M34 PolarHBondContact O-N 3.17Å; A31-L35 WeakPolarHBondContact O-CG 3.46Å; A31-L35 PolarHBondContact O-N 3.41Å; A31-L35 VanDerWaalsContact O-N 3.12Å
32	G	68.6	Low	62.6	Low	34 Å²	34	99 Å²	99	35%	0.351	55%	0.545	S	S	.	.	H	α-helix	trans	-61.6	-46	174.7	0	0	0	0	0	112.9	L28 Q29 M34 L35 S36	L28-G32 PolarHBondContact O-N 3.49Å; Q29-G32 PolarHBondContact O-N 3.12Å; G32-M34 PolarHBondContact O-N 2.98Å; G32-L35 PolarHBondContact O-N 3.03Å; G32-S36 PolarHBondContact O-N 2.93Å
33	D	63.7	Low	61.5	Low	95 Å²	95	99.2 Å²	99.2	51%	0.508	55%	0.546	S	S	.	.	H	α-helix	trans	-67.1	-36	-179.7	-65.7	-24.3	0	0	0	112	Q29 S36 A37	Q29-D33 PolarHBondContact O-N 3.48Å; D33-S36 PolarHBondContact O-N 2.98Å; D33-A37 PolarHBondContact O-N 3.34Å
34	M	62	Low	60.5	Low	146 Å²	146	98.4 Å²	98.4	72%	0.719	55%	0.547	S	S	*	.	H	α-helix	trans	-64.9	-39.2	172.6	-77.4	-174.2	65.4	0	0	113.2	Q30 A31 G32 S38	Q30-M34 WeakPolarHBondContact O-CG 3.47Å; Q30-M34 PolarHBondContact O-N 3.39Å; Q30-M34 VanDerWaalsContact O-N 3.08Å; A31-M34 PolarHBondContact O-N 3.17Å; G32-M34 PolarHBondContact O-N 2.98Å; M34-S38 PolarHBondContact O-N 2.99Å
35	L	58	Low	59.3	Low	124 Å²	124	102.3 Å²	102.3	65%	0.649	56%	0.561	S	S	*	*	H	α-helix	trans	-70	-39	177	-70.7	170.9	0	0	0	111.7	A31 G32 S38 L39	A31-L35 WeakPolarHBondContact O-CG 3.46Å; A31-L35 PolarHBondContact O-N 3.41Å; A31-L35 VanDerWaalsContact O-N 3.12Å; G32-L35 PolarHBondContact O-N 3.03Å; L35-S38 WeakPolarHBondContact O-CB 3.49Å; L35-S38 PolarHBondContact O-N 2.97Å; L35-L39 PolarHBondContact O-N 2.98Å
36	S	56.2	Low	58.3	Low	74 Å²	74	99.3 Å²	99.3	52%	0.517	56%	0.556	S	S	.	*	H	α-helix	trans	-60.5	-44.4	174.7	-168.4	0	0	0	0	112	G32 D33 S38 L39 V40	G32-S36 PolarHBondContact O-N 2.93Å; D33-S36 PolarHBondContact O-N 2.98Å; S36-S38 VanDerWaalsContact C-N 3.29Å; S36-S38 PolarHBondContact O-N 2.94Å; S36-L39 PolarHBondContact O-N 3.45Å; S36-V40 WeakPolarHBondContact O-CG2 3.47Å; S36-V40 PolarHBondContact O-N 3.4Å
37	A	55.4	Low	56.7	Low	63 Å²	63	96.4 Å²	96.4	52%	0.521	55%	0.551	S	S	.	*	H	α-helix	trans	-63.8	-31.4	175.2	0	0	0	0	0	113.5	D33	D33-A37 PolarHBondContact O-N 3.34Å
38	S	52.9	Low	55.4	Low	69 Å²	69	102.4 Å²	102.4	48%	0.483	57%	0.566	S	S	.	*	H	α-helix	trans	-71	-44.7	175.7	-164.2	0	0	0	0	112	M34 L35 S36 V40 N41 V42	M34-S38 PolarHBondContact O-N 2.99Å; L35-S38 WeakPolarHBondContact O-CB 3.49Å; L35-S38 PolarHBondContact O-N 2.97Å; S36-S38 VanDerWaalsContact C-N 3.29Å; S36-S38 PolarHBondContact O-N 2.94Å; S38-V40 VanDerWaalsContact C-N 3.28Å; S38-V40 PolarHBondContact O-N 3.07Å; S38-N41 PolarHBondContact O-N 3.29Å; S38-V42 PolarHBondContact O-N 3.35Å
39	L	51.3	Low	54.1	Low	128 Å²	128	102.9 Å²	102.9	67%	0.67	57%	0.569	S	S	*	*	H	α-helix	trans	-60.9	-35.3	-178.7	-130.4	80.4	0	0	0	113	L35 S36 N41 V42 S43	L35-L39 PolarHBondContact O-N 2.98Å; S36-L39 PolarHBondContact O-N 3.45Å; L39-N41 VanDerWaalsContact C-N 3.27Å; L39-N41 PolarHBondContact O-N 3.31Å; L39-V42 PolarHBondContact O-N 3.03Å; L39-S43 PolarHBondContact O-N 2.97Å
40	V	54.8	Low	52.4	Low	89 Å²	89	101.6 Å²	101.6	54%	0.539	57%	0.57	S	S	.	*	H	α-helix	trans	-69.4	-21.6	178	174.1	0	0	0	0	113	S36 S38 S43	S36-V40 WeakPolarHBondContact O-CG2 3.47Å; S36-V40 PolarHBondContact O-N 3.4Å; S38-V40 VanDerWaalsContact C-N 3.28Å; S38-V40 PolarHBondContact O-N 3.07Å; V40-S43 PolarHBondContact O-OG 3.42Å
41	N	50	Low	51.3	Low	114 Å²	114	101.9 Å²	101.9	61%	0.61	58%	0.576	S	S	*	*	H	α-helix	trans	-83.9	-32.3	172.1	-86.8	-25.3	0	0	0	112.6	S38 L39 K44	S38-N41 PolarHBondContact O-N 3.29Å; L39-N41 VanDerWaalsContact C-N 3.27Å; L39-N41 PolarHBondContact O-N 3.31Å; N41-K44 PolarHBondContact O-N 3.29Å
42	V	48.2	Very low	50.4	Low	77 Å²	77	108.3 Å²	108.3	47%	0.467	60%	0.595	S	S	.	*	H	α-helix	trans	-66.4	-46.5	177.5	177.1	0	0	0	0	111	S38 L39 K44 Q45	S38-V42 PolarHBondContact O-N 3.35Å; L39-V42 PolarHBondContact O-N 3.03Å; V42-K44 PolarHBondContact O-N 3.35Å; V42-Q45 PolarHBondContact O-N 3.16Å
43	S	44.7	Very low	48.9	Very low	76 Å²	76	113.7 Å²	113.7	53%	0.531	62%	0.615	S	S	.	*	H	α-helix	trans	-63.5	-11.3	-179.8	62.8	0	0	0	0	115.1	L39 V40	L39-S43 PolarHBondContact O-N 2.97Å; V40-S43 PolarHBondContact O-OG 3.42Å
44	K	47.7	Very low	47.6	Very low	157 Å²	157	117.1 Å²	117.1	68%	0.683	63%	0.633	S	S	*	*	H	α-helix	trans	-88.3	-10.5	172.6	-95.4	-179.8	176.5	173	0	114.8	N41 V42	N41-K44 PolarHBondContact O-N 3.29Å; V42-K44 PolarHBondContact O-N 3.35Å
45	Q	46.4	Very low	46.6	Very low	150 Å²	150	118.6 Å²	118.6	70%	0.701	64%	0.639	S	S	*	*	H	α-helix	trans	-91.6	-35.8	174.7	-77.1	-171.8	-61.8	0	0	112.6	V42 S47 K48	V42-Q45 PolarHBondContact O-N 3.16Å; Q45-S47 PolarHBondContact O-N 2.93Å; Q45-K48 PolarHBondContact O-N 3.06Å
46	D	46	Very low	45.6	Very low	101 Å²	101	120.2 Å²	120.2	54%	0.54	65%	0.648	S	S	.	*	H	α-helix	trans	-71.1	-31	-175.6	-66.1	-39	0	0	0	113.8	K48 L49	D46-K48 PolarHBondContact O-N 3.26Å; D46-L49 PolarHBondContact O-N 2.83Å; D46-L49 VanDerWaalsContact O-N 3.11Å
47	S	43.1	Very low	44.8	Very low	72 Å²	72	125 Å²	125	50%	0.503	67%	0.666	S	S	.	*	T	Hydrogen-bonded Turn	trans	-67.2	4.2	176.1	57	0	0	0	0	114.8	Q45	Q45-S47 PolarHBondContact O-N 2.93Å
48	K	43.3	Very low	43.6	Very low	181 Å²	181	129.7 Å²	129.7	79%	0.787	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.1	0.2	176.5	-141.6	174.8	-173.5	177.9	0	113.8	Q45 D46	Q45-K48 PolarHBondContact O-N 3.06Å; D46-K48 PolarHBondContact O-N 3.26Å
49	L	41.6	Very low	42.5	Very low	129 Å²	129	133.9 Å²	133.9	68%	0.675	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.2	-21.9	177	-85.6	163.9	0	0	0	113.3	D46	D46-L49 PolarHBondContact O-N 2.83Å; D46-L49 VanDerWaalsContact O-N 3.11Å
50	S	39.6	Very low	41.6	Very low	68 Å²	68	135.5 Å²	135.5	48%	0.476	71%	0.708	S	S	.	*	G	3₁₀ helix	trans	-63.5	-42.9	176.2	50.7	0	0	0	0	113.4	K52	S50-K52 PolarHBondContact O-N 2.92Å
51	D	42.1	Very low	40.3	Very low	144 Å²	144	139.1 Å²	139.1	77%	0.77	72%	0.719	S	S	*	*	G	3₁₀ helix	trans	-73.9	15.1	-168.9	-62.3	6.4	0	0	0	114.3
52	K	42.2	Very low	39.5	Very low	184 Å²	184	140 Å²	140	80%	0.8	72%	0.722	S	S	*	*	G	3₁₀ helix	trans	-127.4	2.5	-171.6	-114.8	-172.8	178	-168.5	0	115.8	S50	S50-K52 PolarHBondContact O-N 2.92Å
53	L	37.2	Very low	38.5	Very low	147 Å²	147	144.5 Å²	144.5	77%	0.77	74%	0.738	S	S	*	*	S	Bend	trans	-113.3	-13.7	-177.1	-112.7	159.5	0	0	0	114.5	Q55	L53-Q55 VanDerWaalsContact C-N 3.28Å; L53-Q55 PolarHBondContact O-N 3.24Å
54	D	37.5	Very low	37.7	Very low	166 Å²	166	148.1 Å²	148.1	89%	0.888	75%	0.747	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.6	28.1	-179	-77.4	-17.3	0	0	0	114.4
55	Q	40.6	Very low	36.8	Very low	178 Å²	178	145.4 Å²	145.4	83%	0.832	74%	0.743	S	S	*	*	T	Hydrogen-bonded Turn	trans	-129.7	-0.2	-171.9	-161.4	151.3	90.2	0	0	116.3	L53	L53-Q55 VanDerWaalsContact C-N 3.28Å; L53-Q55 PolarHBondContact O-N 3.24Å
56	D	36.5	Very low	35.7	Very low	158 Å²	158	147 Å²	147	85%	0.845	74%	0.744	S	S	*	*	S	Bend	trans	-123.2	14.6	-172.1	-93.2	-21.4	0	0	0	115.5
57	L	38.8	Very low	35	Very low	173 Å²	173	150.1 Å²	150.1	91%	0.906	75%	0.753	S	S	*	*			trans	-119.1	46.5	179.4	-73	178.8	0	0	0	114.2
58	D	32.3	Very low	34.4	Very low	162 Å²	162	153.5 Å²	153.5	87%	0.866	76%	0.761	S	S	*	*			trans	-144	66.8	171.9	-124.5	-14	0	0	0	111.6
59	N	29.2	Very low	33.9	Very low	158 Å²	158	151.8 Å²	151.8	85%	0.845	76%	0.76	S	S	*	*			trans	-159.6	149.5	161.5	-135.6	-28.6	0	0	0	116.3
60	I	32.1	Very low	33.3	Very low	162 Å²	162	155 Å²	155	83%	0.831	77%	0.772	S	S	*	*			trans	88.5	122	168	-53.4	175.9	0	0	0	117.2
61	Q	28.4	Very low	33	Very low	165 Å²	165	160.2 Å²	160.2	77%	0.771	79%	0.789	S	S	*	*			trans	-136.6	132	-169.8	174.5	179.2	-14.3	0	0	110.4
62	I	31.9	Very low	32.3	Very low	131 Å²	131	161.6 Å²	161.6	67%	0.672	79%	0.791	S	S	*	*			trans	44.9	125.7	148.5	-56.6	168.6	0	0	0	121.2
63	Q	26.6	Very low	31.7	Very low	173 Å²	173	159.9 Å²	159.9	81%	0.808	79%	0.79	S	S	*	*				-170.8	116.5	117.1	-131.5	160.4	-2.9	0	0	110.6
64	E	29.5	Very low	31.2	Very low	152 Å²	152	159.3 Å²	159.3	71%	0.71	79%	0.788	S	S	*	*				68.2	130	77.7	-108.8	-177.9	-165.8	0	0	114.3
65	T	28.4	Very low	30.7	Very low	100 Å²	100	157.4 Å²	157.4	61%	0.613	78%	0.778	S	S	*	*			cis	-173.1	174.7	48.6	31.9	0	0	0	0	114.5
66	Y	23.4	Very low	30	Very low	183 Å²	183	159.3 Å²	159.3	72%	0.718	78%	0.778	S	S	*	*			trans	80.2	107.6	165.5	-70.4	-84.6	0	0	0	118.9
67	F	30.2	Very low	29.7	Very low	167 Å²	167	156.6 Å²	156.6	73%	0.732	77%	0.771	S	S	*	*				84.8	154.5	52.8	-72.3	-59.7	0	0	0	114
68	E	30.1	Very low	29.2	Very low	143 Å²	143	156.7 Å²	156.7	67%	0.668	77%	0.767	S	S	*	*			cis	-135.9	146.3	8.2	-70.9	82.3	-134.5	0	0	113.9
69	D	32.9	Very low	29.1	Very low	144 Å²	144	157 Å²	157	77%	0.77	76%	0.763	S	S	*	*			trans	28.4	159.1	132.7	-52.8	-39.5	0	0	0	124.4
70	E	30	Very low	29.1	Very low	197 Å²	197	156.3 Å²	156.3	92%	0.921	76%	0.759	S	S	*	*			cis	-140.2	170.4	29.6	-77.5	-170.4	133.4	0	0	116.5
71	E	33.5	Very low	29.1	Very low	178 Å²	178	152.6 Å²	152.6	83%	0.832	75%	0.753	S	S	*	*			trans	-80.4	167.2	176.6	-48.2	173.5	128.9	0	0	115
72	Q	27.2	Very low	29.1	Very low	172 Å²	172	152.2 Å²	152.2	80%	0.804	76%	0.756	S	S	*	*				-168.5	126.9	111.9	-151.4	120.6	95.1	0	0	112.7
73	D	28.6	Very low	28.9	Very low	149 Å²	149	150.9 Å²	150.9	80%	0.797	76%	0.758	S	S	*	*			trans	-69.2	160.4	161.7	-92	-43.3	0	0	0	111.7
74	N	26.4	Very low	29.1	Very low	135 Å²	135	149 Å²	149	72%	0.722	75%	0.753	S	S	*	*			trans	-166.4	122.8	134.4	-99.2	-58.4	0	0	0	112
75	D	27.6	Very low	28.9	Very low	125 Å²	125	150.4 Å²	150.4	67%	0.668	76%	0.757	S	S	*	*			trans	-64.4	171	153.6	-177.9	25.8	0	0	0	110.1
76	W	26.6	Very low	28.9	Very low	219 Å²	219	152.5 Å²	152.5	83%	0.83	76%	0.764	S	S	*	*			trans	168.1	156.8	135.7	-88.5	113.6	0	0	0	112.3
77	S	29.8	Very low	29.1	Very low	100 Å²	100	152 Å²	152	70%	0.699	77%	0.768	S	S	*	*			trans	-100.6	174.4	-160.4	-66.2	0	0	0	0	114.8
78	Q	29.1	Very low	29	Very low	176 Å²	176	149.5 Å²	149.5	82%	0.822	77%	0.766	S	S	*	*			trans	-57.6	138	170.8	179.7	-179.3	-17.2	0	0	113.9
79	E	29.5	Very low	28.8	Very low	168 Å²	168	150.2 Å²	150.2	79%	0.785	78%	0.775	S	S	*	*				174.8	155.7	126.7	-94.7	173.9	179.9	0	0	115.1
80	D	29.4	Very low	28.6	Very low	143 Å²	143	150.8 Å²	150.8	77%	0.765	77%	0.772	S	S	*	*			trans	57.7	105.5	154.5	-69.7	0.2	0	0	0	126.1
81	A	31.5	Very low	28.4	Very low	85 Å²	85	151.3 Å²	151.3	70%	0.702	77%	0.772	S	S	*	*				50.3	130.6	109.1	0	0	0	0	0	124.1
82	N	29.7	Very low	28	Very low	156 Å²	156	148.1 Å²	148.1	83%	0.834	77%	0.769	S	S	*	*			trans	89.5	138.4	145.1	-78.3	-19	0	0	0	122.5
83	S	27.9	Very low	28	Very low	103 Å²	103	145.2 Å²	145.2	72%	0.72	77%	0.767	S	S	*	*			trans	79.8	136	155.3	-63.5	0	0	0	0	118.9
84	L	29.8	Very low	27.8	Very low	135 Å²	135	144.5 Å²	144.5	71%	0.707	77%	0.772	S	S	*	*			cis	-164.4	142.5	-8.1	-93.7	160.5	0	0	0	107.6
85	F	25.2	Very low	27.8	Very low	181 Å²	181	145.4 Å²	145.4	79%	0.794	78%	0.777	S	S	*	*			trans	55.8	154.4	143.6	-73.5	-130.3	0	0	0	118.9
86	L	28.9	Very low	27.8	Very low	143 Å²	143	145.1 Å²	145.1	75%	0.749	78%	0.784	S	S	*	*			cis	-119.3	179.9	-0.4	-72	164.9	0	0	0	107.7
87	E	27	Very low	27.9	Very low	172 Å²	172	141.7 Å²	141.7	80%	0.804	78%	0.783	S	S	*	*			cis	-157.7	151.8	24.9	-156.5	156.2	-153.9	0	0	110
88	V	28.1	Very low	27.9	Very low	116 Å²	116	144.2 Å²	144.2	70%	0.703	79%	0.787	S	S	*	*			trans	-125.7	124	-179.5	171.3	0	0	0	0	108.4
89	D	25.9	Very low	28	Very low	158 Å²	158	143.6 Å²	143.6	85%	0.845	79%	0.785	S	S	*	*			trans	-101.1	113.9	165.4	-101.4	-33.1	0	0	0	111
90	H	28.8	Very low	27.9	Very low	155 Å²	155	142 Å²	142	72%	0.718	78%	0.781	S	S	*	*			trans	-87.8	137.8	164.3	-98.3	-99.9	0	0	0	109.1
91	F	26.2	Very low	27.9	Very low	209 Å²	209	140.2 Å²	140.2	92%	0.917	78%	0.78	S	S	*	*			trans	-131.6	140.9	142.5	-93.5	-76.2	0	0	0	111.7
92	S	24.8	Very low	27.8	Very low	110 Å²	110	140.2 Å²	140.2	77%	0.769	78%	0.78	S	S	*	*			trans	-105.9	165.2	-164.7	-172.5	0	0	0	0	112.4
93	C	27.9	Very low	27.9	Very low	112 Å²	112	140.6 Å²	140.6	76%	0.757	78%	0.777	S	S	*	*			trans	-63.9	157.8	-177.6	-46.9	0	0	0	0	114.5
94	C	24.4	Very low	27.8	Very low	133 Å²	133	142.1 Å²	142.1	90%	0.899	78%	0.777	S	S	*	*			trans	-144.8	134.4	145.4	-100	0	0	0	0	110.7
95	N	26.9	Very low	27.6	Very low	154 Å²	154	141.1 Å²	141.1	82%	0.824	78%	0.781	S	S	*	*			trans	-84.2	157.1	167.4	-63.2	-29	0	0	0	110.3
96	S	26.7	Very low	27.9	Very low	119 Å²	119	137.8 Å²	137.8	83%	0.832	78%	0.78	S	S	*	*				-176.6	153.2	119	48.2	0	0	0	0	114
97	D	28	Very low	29	Very low	148 Å²	148	136.2 Å²	136.2	79%	0.791	78%	0.779	S	S	*	*			trans	-83.2	166.6	-173.1	-51.4	-98.1	0	0	0	115.4
98	L	31.4	Very low	29	Very low	152 Å²	152	139 Å²	139	80%	0.796	78%	0.782	S	S	*	*			trans	-172.2	116.9	135.6	-93.1	152.7	0	0	0	106.8
99	Q	30.7	Very low	29	Very low	164 Å²	164	140.8 Å²	140.8	77%	0.766	79%	0.786	S	S	*	*				58.2	137.6	76.7	-90.1	-179.8	-16.5	0	0	114.3
100	D	26.8	Very low	29.1	Very low	133 Å²	133	137.5 Å²	137.5	71%	0.711	78%	0.776	S	S	*	*			cis	-165.1	172.5	-1.6	-158.8	-5.6	0	0	0	110.7
101	S	29.5	Very low	29.3	Very low	106 Å²	106	137.7 Å²	137.7	74%	0.741	78%	0.777	S	S	*	*			trans	70.2	161.9	154	76.3	0	0	0	0	120.4
102	A	29.8	Very low	29.5	Very low	85 Å²	85	135.6 Å²	135.6	70%	0.702	77%	0.77	S	S	*	*				172.3	152.4	-57.7	0	0	0	0	0	110.5
103	Q	32.2	Very low	29.8	Very low	165 Å²	165	134.2 Å²	134.2	77%	0.771	77%	0.766	S	S	*	*			trans	120.9	125.7	141.4	-64.1	-148.3	-18.3	0	0	120.6
104	N	25.3	Very low	30	Very low	135 Å²	135	137 Å²	137	72%	0.722	76%	0.764	S	S	*	*			trans	69.7	144.4	139.4	-62.4	-14.1	0	0	0	119.6
105	S	26.2	Very low	30.2	Very low	113 Å²	113	136.2 Å²	136.2	79%	0.79	75%	0.751	S	S	*	*			cis	-158.8	154.8	5.1	41.1	0	0	0	0	113.7
106	S	31.7	Very low	30.3	Very low	112 Å²	112	134.8 Å²	134.8	78%	0.783	75%	0.754	S	S	*	*			trans	-76.2	-160.4	171.6	-33	0	0	0	0	112.8
107	P	51.6	Low	30.3	Very low	109 Å²	109	134.6 Å²	134.6	71%	0.708	75%	0.751	S	S	*	*			cis	-140.3	-178.5	-11.3	29.7	-5.4	0	0	0	116.1
108	R	25.9	Very low	30.1	Very low	231 Å²	231	132.3 Å²	132.3	87%	0.872	75%	0.747	S	S	*	*				157.5	130.3	118.5	-84.7	-174.3	-179.3	-156.5	0.1	117.9
109	L	28.7	Very low	29.8	Very low	153 Å²	153	130.4 Å²	130.4	80%	0.801	74%	0.742	S	S	*	*			trans	40.9	117.3	138.8	-93.1	79.9	0	0	0	125.6
110	S	27.8	Very low	29.6	Very low	90 Å²	90	130.7 Å²	130.7	63%	0.629	75%	0.745	S	S	*	*				73.3	126.4	116.1	76.4	0	0	0	0	125
111	Q	33.6	Very low	29.6	Very low	159 Å²	159	130 Å²	130	74%	0.743	75%	0.75	S	S	*	*				103.2	117.3	128.3	-133.5	89.3	24.5	0	0	121.9
112	H	29.9	Very low	29.5	Very low	164 Å²	164	134 Å²	134	76%	0.759	76%	0.758	S	S	*	*			trans	68.6	133.1	143.1	-95.8	-55.5	0	0	0	124.7
113	A	30.7	Very low	29.6	Very low	82 Å²	82	141.2 Å²	141.2	68%	0.678	77%	0.767	S	S	*	*			trans	76	152.6	138	0	0	0	0	0	118.4
114	K	32.1	Very low	30.2	Very low	169 Å²	169	139.4 Å²	139.4	74%	0.735	77%	0.769	S	S	*	*			cis	-164.4	160.1	-18.4	-114.3	-176.6	161.4	-130.9	0	109.6
115	D	27.7	Very low	30.4	Very low	117 Å²	117	139.8 Å²	139.8	63%	0.626	77%	0.771	S	S	*	*			trans	27	122.9	140.2	-43.6	-25.4	0	0	0	120.4
116	S	29.8	Very low	30.5	Very low	125 Å²	125	146 Å²	146	87%	0.874	78%	0.777	S	S	*	*				177.4	141.2	129	-78.8	0	0	0	0	111.2
117	C	27	Very low	30.2	Very low	114 Å²	114	145.2 Å²	145.2	77%	0.77	78%	0.777	S	S	*	*			cis	-158.5	144.1	-25	-163.1	0	0	0	0	109.5
118	S	24.3	Very low	29.1	Very low	101 Å²	101	145.1 Å²	145.1	71%	0.706	78%	0.779	S	S	*	*			trans	-21.9	163.4	145.8	-44.8	0	0	0	0	117.1
119	T	25.2	Very low	29.2	Very low	112 Å²	112	141.8 Å²	141.8	69%	0.687	78%	0.779	S	S	*	*			cis	177.4	148.9	-10.6	-88.5	0	0	0	0	107.4
120	M	25.4	Very low	29.2	Very low	170 Å²	170	140.8 Å²	140.8	84%	0.837	77%	0.774	S	S	*	*			trans	59.4	138.8	166.1	-74.1	165.9	69.8	0	0	118.3
121	S	26.4	Very low	29.2	Very low	117 Å²	117	144 Å²	144	82%	0.818	78%	0.779	S	S	*	*				-176.1	-177.1	74.9	40.8	0	0	0	0	112.3
122	Q	28.4	Very low	28.8	Very low	192 Å²	192	145.8 Å²	145.8	90%	0.897	79%	0.785	S	S	*	*			trans	-83.3	174.8	-160.9	-71.4	169.6	-30.4	0	0	116.5
123	W	32.4	Very low	28.8	Very low	235 Å²	235	142 Å²	142	89%	0.89	78%	0.777	S	S	*	*			trans	-45.4	168.5	-176.4	-58.7	-25.8	0	0	0	118.7
124	P	44.6	Very low	29.3	Very low	128 Å²	128	144.1 Å²	144.1	83%	0.831	78%	0.784	S	S	*	*				-136.7	158.5	117	38	-27.8	0	0	0	116
125	N	28.8	Very low	29.1	Very low	142 Å²	142	144.1 Å²	144.1	76%	0.759	79%	0.786	S	S	*	*			trans	-73.4	152.6	168.7	-69.6	-48.6	0	0	0	112.5
126	R	27.6	Very low	29.1	Very low	244 Å²	244	145.2 Å²	145.2	92%	0.921	80%	0.796	S	S	*	*				-173.7	143	127.5	-115.9	-178.3	177.5	-172.4	-1	118
127	A	27	Very low	29	Very low	95 Å²	95	146.8 Å²	146.8	79%	0.785	79%	0.794	S	S	*	*			trans	86.9	152.6	134.8	0	0	0	0	0	121.1
128	S	28.1	Very low	28.8	Very low	107 Å²	107	147.3 Å²	147.3	75%	0.748	80%	0.799	S	S	*	*			trans	-117.3	-178.9	-158	-47.5	0	0	0	0	112.6
129	D	26.6	Very low	28.9	Very low	161 Å²	161	147.8 Å²	147.8	86%	0.861	80%	0.802	S	S	*	*			trans	126.5	147.1	151.9	-66.8	-7.4	0	0	0	111.9
130	D	29.7	Very low	29	Very low	132 Å²	132	150.5 Å²	150.5	71%	0.706	81%	0.811	S	S	*	*			cis	-165.8	174.1	-29	-177.9	26.5	0	0	0	106.4
131	H	27.9	Very low	29.1	Very low	159 Å²	159	145.8 Å²	145.8	74%	0.736	80%	0.799	S	S	*	*			trans	125.8	94.1	154.7	-63.4	-22.2	0	0	0	118.7
132	K	25.5	Very low	29.3	Very low	196 Å²	196	149 Å²	149	85%	0.852	80%	0.801	S	S	*	*				74.5	122.4	111.8	-129.1	177.6	-174.9	174.8	0	121.2
133	S	29.5	Very low	29.2	Very low	85 Å²	85	148.9 Å²	148.9	59%	0.594	80%	0.801	S	S	*	*			trans	-78.1	178.1	157.9	59.1	0	0	0	0	112.4
134	P	42.3	Very low	29	Very low	126 Å²	126	144.1 Å²	144.1	82%	0.818	79%	0.788	S	S	*	*				-140.7	168.9	102.6	38.2	-25.6	0	0	0	115.9
135	H	27.2	Very low	28.3	Very low	168 Å²	168	146.9 Å²	146.9	78%	0.778	79%	0.79	S	S	*	*			trans	-83.7	171.3	174.9	-58.3	-104.4	0	0	0	112.6
136	V	27.6	Very low	28.3	Very low	141 Å²	141	146.7 Å²	146.7	86%	0.855	78%	0.784	S	S	*	*				175.2	155.7	106.5	156.9	0	0	0	0	111.6
137	L	28.1	Very low	28.5	Very low	158 Å²	158	141.5 Å²	141.5	83%	0.827	77%	0.774	S	S	*	*			trans	-87.5	164.3	-170.6	-59	144.8	0	0	0	114.2
138	S	22.8	Very low	28.5	Very low	124 Å²	124	142.9 Å²	142.9	87%	0.867	76%	0.764	S	S	*	*				164	173.9	113	53.1	0	0	0	0	114.3
139	S	26	Very low	28.5	Very low	111 Å²	111	145.4 Å²	145.4	78%	0.776	76%	0.761	S	S	*	*			trans	-112.8	-163.6	-155.1	-41.1	0	0	0	0	114.5
140	I	27	Very low	28.5	Very low	169 Å²	169	145 Å²	145	87%	0.867	75%	0.754	S	S	*	*			trans	95	140	167.1	-56.8	165.6	0	0	0	114.3
141	A	27.9	Very low	28.5	Very low	72 Å²	72	149.4 Å²	149.4	60%	0.595	76%	0.761	S	S	*	*			cis	-168.8	162	-24.6	0	0	0	0	0	111.9
142	E	30.1	Very low	28.4	Very low	185 Å²	185	147.7 Å²	147.7	86%	0.864	77%	0.767	S	S	*	*			trans	72.5	160.4	134.7	-80.9	170.7	165.2	0	0	125.9
143	E	27.1	Very low	28.3	Very low	189 Å²	189	141.3 Å²	141.3	88%	0.883	76%	0.757	S	S	*	*			trans	67.4	139.7	179.3	-63.6	-166.4	128.3	0	0	118.3
144	E	28.2	Very low	28.2	Very low	134 Å²	134	145 Å²	145	63%	0.626	77%	0.769	S	S	*	*			cis	156.8	127.5	-19	-110.3	-81.7	135.2	0	0	104.5	H146	E144-H146 IonicContact OE2-CD2 3.51Å
145	H	29.5	Very low	27.5	Very low	186 Å²	186	147.1 Å²	147.1	86%	0.861	77%	0.768	S	S	*	*			trans	-179	86.9	146.2	-106.9	-71.5	0	0	0	113.2
146	H	29.6	Very low	27.4	Very low	138 Å²	138	146.9 Å²	146.9	64%	0.639	77%	0.767	S	S	*	*			trans	24.4	133.8	139.9	-89.7	-91.2	0	0	0	124.8	E144	E144-H146 IonicContact OE2-CD2 3.51Å
147	L	31.2	Very low	27.3	Very low	136 Å²	136	143.1 Å²	143.1	71%	0.712	76%	0.756	S	S	*	*			trans	78.1	144.1	134.7	-74.5	167.5	0	0	0	120.6
148	E	26.1	Very low	27.2	Very low	123 Å²	123	143.9 Å²	143.9	58%	0.575	75%	0.753	S	S	*	*			cis	-165.3	152	0.6	-174.1	161.4	-171.9	0	0	113.5
149	K	29.6	Very low	27.3	Very low	160 Å²	160	144.3 Å²	144.3	70%	0.696	75%	0.746	S	S	*	*			trans	34	167.4	154.8	-68.4	173.4	-176.5	145.3	0	122.1
150	Q	27	Very low	27.4	Very low	152 Å²	152	143.4 Å²	143.4	71%	0.71	74%	0.74	S	S	*	*			cis	-157.4	137.4	-18.8	-113.2	174.2	-19.2	0	0	105.7
151	R	27.8	Very low	27.3	Very low	225 Å²	225	144.5 Å²	144.5	85%	0.849	74%	0.741	S	S	*	*				59.7	132.4	92.8	-155.5	179.3	-165.2	179	6	117
152	S	26.2	Very low	27.6	Very low	124 Å²	124	149 Å²	149	87%	0.867	75%	0.754	S	S	*	*			trans	68.3	153.1	169.8	65.7	0	0	0	0	116.8
153	G	23.8	Very low	27.9	Very low	61 Å²	61	146.2 Å²	146.2	63%	0.629	75%	0.752	S	S	*	*			cis	148.4	154.6	-2.1	0	0	0	0	0	111.7
154	L	27	Very low	27.9	Very low	163 Å²	163	140.4 Å²	140.4	85%	0.853	74%	0.743	S	S	*	*			trans	67.3	140.3	-173.4	-61.1	99.5	0	0	0	115.1
155	Q	26.9	Very low	27.9	Very low	170 Å²	170	140.1 Å²	140.1	79%	0.794	75%	0.75	S	S	*	*			cis	92	144.9	22.8	-161.4	160.6	8.8	0	0	114.9
156	H	26	Very low	27.9	Very low	164 Å²	164	138 Å²	138	76%	0.759	75%	0.745	S	S	*	*			trans	71.6	143.9	-161.8	-76.1	-99.1	0	0	0	115.3
157	G	25.3	Very low	27.8	Very low	61 Å²	61	138.8 Å²	138.8	63%	0.629	75%	0.749	S	S	*	*			cis	139.9	139	-7.3	0	0	0	0	0	113.7
158	F	25.8	Very low	27.7	Very low	175 Å²	175	138 Å²	138	77%	0.768	75%	0.75	S	S	*	*			trans	81.9	131.2	163.9	-67.3	-81.2	0	0	0	121.9
159	D	24.5	Very low	27.9	Very low	132 Å²	132	139 Å²	139	71%	0.706	76%	0.757	S	S	*	*				76.7	102.2	128	-71.3	-17.3	0	0	0	125.3
160	S	28.2	Very low	27.8	Very low	93 Å²	93	139 Å²	139	65%	0.65	77%	0.765	S	S	*	*				97.1	142.6	100.4	83.5	0	0	0	0	122.6
161	Q	24.8	Very low	28	Very low	191 Å²	191	135.2 Å²	135.2	89%	0.893	77%	0.767	S	S	*	*			trans	76.6	140.1	149.1	-71.6	177.6	19.4	0	0	122.5
162	L	34.1	Very low	28.1	Very low	167 Å²	167	134.1 Å²	134.1	87%	0.874	77%	0.768	S	S	*	*			trans	-91.9	163.6	-179.3	-69.2	158.5	0	0	0	111.6
163	P	38.2	Very low	28.3	Very low	126 Å²	126	136.9 Å²	136.9	82%	0.818	77%	0.765	S	S	*	*				-144	143.6	97.2	32.8	-15.4	0	0	0	113.5
164	G	26.7	Very low	28.6	Very low	67 Å²	67	140.6 Å²	140.6	69%	0.691	77%	0.766	S	S	*	*				103.1	167.7	90.8	0	0	0	0	0	113.1
165	T	28.2	Very low	28.7	Very low	128 Å²	128	138.2 Å²	138.2	79%	0.785	76%	0.758	S	S	*	*			cis	-167.1	134	-19.4	-67	0	0	0	0	110.3
166	L	28.5	Very low	28.6	Very low	143 Å²	143	137.9 Å²	137.9	75%	0.749	76%	0.762	S	S	*	*			trans	68.8	152	164.9	-106.2	63.8	0	0	0	119.9
167	E	27.4	Very low	28.8	Very low	153 Å²	153	135 Å²	135	72%	0.715	76%	0.76	S	S	*	*			cis	-156.5	139.8	9	-162	156.9	-139.6	0	0	114.4
168	T	28.8	Very low	29.1	Very low	121 Å²	121	141.4 Å²	141.4	74%	0.742	77%	0.771	S	S	*	*			trans	28.9	155.4	159.3	60.5	0	0	0	0	123.9
169	I	30.8	Very low	29.2	Very low	142 Å²	142	136.5 Å²	136.5	73%	0.728	77%	0.77	S	S	*	*				-154.1	137.7	52.1	-68.3	166.4	0	0	0	113.7
170	N	28.4	Very low	29.5	Very low	160 Å²	160	137.3 Å²	137.3	86%	0.856	77%	0.774	S	S	*	*			trans	46.2	135.2	164.3	-69.9	-16.7	0	0	0	120.8
171	G	30.9	Very low	29.7	Very low	73 Å²	73	141 Å²	141	75%	0.753	79%	0.787	S	S	*	*			cis	122	132	9.6	0	0	0	0	0	110.2
172	K	30.2	Very low	30.2	Very low	202 Å²	202	140.6 Å²	140.6	88%	0.878	79%	0.785	S	S	*	*			cis	-138.8	144.6	14.3	-60.2	165.9	179.4	174.8	0	108.1
173	K	31	Very low	30.2	Very low	182 Å²	182	141.8 Å²	141.8	79%	0.791	79%	0.786	S	S	*	*				57.3	137.5	69.8	-90.3	-158.8	171.9	-148	0	115.3
174	Q	28.5	Very low	29.8	Very low	139 Å²	139	143.1 Å²	143.1	65%	0.65	79%	0.785	S	S	*	*			cis	-165.7	145.9	-7.4	-162.1	169.8	-9.1	0	0	112.7
175	V	29	Very low	29.9	Very low	114 Å²	114	145.8 Å²	145.8	69%	0.691	79%	0.793	S	S	*	*			trans	5.9	141.2	151.1	-174.1	0	0	0	0	121.9
176	N	26	Very low	30.1	Very low	162 Å²	162	145.8 Å²	145.8	87%	0.866	79%	0.793	S	S	*	*			trans	-162.5	160.4	131.4	-91	-14.4	0	0	0	107
177	S	29.7	Very low	30.5	Very low	105 Å²	105	144.6 Å²	144.6	73%	0.734	80%	0.797	S	S	*	*			cis	179.4	159.5	-40.3	-172.3	0	0	0	0	104.2
178	F	31.5	Very low	30.9	Very low	195 Å²	195	142.7 Å²	142.7	86%	0.855	80%	0.8	S	S	*	*			trans	-59.3	156.4	-173.8	-88.4	-115.8	0	0	0	115.7
179	G	29	Very low	31.1	Very low	72 Å²	72	144.2 Å²	144.2	74%	0.742	80%	0.804	S	S	*	*			trans	-147	121.6	158.6	0	0	0	0	0	109.9
180	D	29.2	Very low	31.7	Very low	149 Å²	149	140.4 Å²	140.4	80%	0.797	79%	0.79	S	S	*	*			trans	-93.5	144.1	166.7	-75.9	-58	0	0	0	108.7
181	D	33.6	Very low	32.3	Very low	171 Å²	171	139.4 Å²	139.4	91%	0.914	78%	0.784	S	S	*	*			trans	-99.8	115.8	175.4	-70.1	-46.4	0	0	0	111
182	E	34.2	Very low	33.1	Very low	181 Å²	181	142 Å²	142	85%	0.846	78%	0.777	S	S	*	*			trans	-110.4	118.5	168.3	-84.3	-94.8	143.3	0	0	109.2
183	E	34.6	Very low	33.9	Very low	192 Å²	192	138.5 Å²	138.5	90%	0.897	76%	0.764	S	S	*	*			trans	-87.8	118.1	172.1	-77.2	-166.2	145.2	0	0	111.6
184	L	30.7	Very low	34.8	Very low	155 Å²	155	133.8 Å²	133.8	81%	0.812	75%	0.75	S	S	*	*			trans	-76.6	144.3	169.4	-72.2	165.5	0	0	0	111.3
185	S	28	Very low	35.7	Very low	122 Å²	122	133.1 Å²	133.1	85%	0.853	75%	0.75	S	S	*	*			trans	-140.2	100.1	161.6	-79.3	0	0	0	0	110.1
186	T	31.3	Very low	36.6	Very low	128 Å²	128	134.4 Å²	134.4	79%	0.785	75%	0.746	S	S	*	*			trans	-84.1	131.8	178.6	-50.2	0	0	0	0	110.8
187	S	37.3	Very low	37.3	Very low	118 Å²	118	132.8 Å²	132.8	83%	0.825	73%	0.733	S	S	*	*			trans	-137.8	109.1	153.5	65.9	0	0	0	0	109.4
188	S	37.1	Very low	37.7	Very low	113 Å²	113	135 Å²	135	79%	0.79	73%	0.73	S	S	*	*			trans	-78.3	138.2	177	-175.7	0	0	0	0	110.2
189	D	31.4	Very low	37.9	Very low	154 Å²	154	132.5 Å²	132.5	82%	0.824	72%	0.721	S	S	*	*			trans	-138.9	140.4	165.3	-130	-24.4	0	0	0	108.9
190	S	43.6	Very low	38.5	Very low	61 Å²	61	134.7 Å²	134.7	43%	0.427	71%	0.714	S	S	.	*			trans	-90.7	143.8	-159.5	-168.1	0	0	0	0	114	E192	S190-E192 WeakPolarHBondContact CB-OE2 3.24Å; S190-E192 PolarHBondContact O-N 3.03Å; S190-E192 PolarHBondContact OG-OE2 2.69Å
191	D	41.9	Very low	38.8	Very low	139 Å²	139	131.7 Å²	131.7	74%	0.743	71%	0.705	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.1	-6.2	-178.6	-75.1	-47.6	0	0	0	114.6
192	E	47.5	Very low	39.1	Very low	128 Å²	128	128.8 Å²	128.8	60%	0.598	69%	0.693	S	S	*	*	H	α-helix	trans	-78.8	-18.6	-176.3	68.8	-159.4	-103.8	0	0	115.6	S190	S190-E192 WeakPolarHBondContact CB-OE2 3.24Å; S190-E192 PolarHBondContact O-N 3.03Å; S190-E192 PolarHBondContact OG-OE2 2.69Å
193	E	47.7	Very low	39.2	Very low	129 Å²	129	124.8 Å²	124.8	60%	0.603	69%	0.685	S	S	*	*	H	α-helix	trans	-86.4	-27.6	175.8	-72.4	-149.6	128.7	0	0	113.4	I195 K196 Q197	E193-I195 VanDerWaalsContact C-N 3.33Å; E193-I195 PolarHBondContact O-N 2.94Å; E193-K196 PolarHBondContact O-N 3.5Å; E193-Q197 PolarHBondContact O-N 3.15Å
194	V	48.6	Very low	39.3	Very low	82 Å²	82	126.4 Å²	126.4	50%	0.497	68%	0.683	S	S	.	*	H	α-helix	trans	-64.7	-38.3	-176.1	-174.8	0	0	0	0	111.5	Q197 F198	V194-Q197 PolarHBondContact O-N 3.06Å; V194-F198 HydrophobicContact CG1-CD2 4.48Å; V194-F198 PolarHBondContact O-N 3.11Å
195	I	48.6	Very low	39.5	Very low	126 Å²	126	124 Å²	124	65%	0.646	68%	0.679	S	S	*	*	H	α-helix	trans	-68.9	-38.7	-177.9	-58.1	176.1	0	0	0	111	E193 Q197 F198 E199	E193-I195 VanDerWaalsContact C-N 3.33Å; E193-I195 PolarHBondContact O-N 2.94Å; I195-Q197 PolarHBondContact O-N 3.36Å; I195-F198 PolarHBondContact O-N 3.48Å; I195-E199 PolarHBondContact O-N 3.23Å
196	K	46.1	Very low	40.1	Very low	140 Å²	140	126.8 Å²	126.8	61%	0.609	68%	0.679	S	S	*	*	H	α-helix	trans	-68.3	-33.1	177.4	-71.1	172.4	-177.2	159.8	0	112.6	E193 I200	E193-K196 PolarHBondContact O-N 3.5Å; K196-I200 WeakPolarHBondContact O-CD1 3.18Å; K196-I200 VanDerWaalsContact O-CG1 3.3Å; K196-I200 WeakPolarHBondContact O-CG1 3.47Å; K196-I200 PolarHBondContact O-N 2.85Å
197	Q	41.6	Very low	40	Very low	129 Å²	129	125.6 Å²	125.6	60%	0.603	68%	0.676	S	S	*	*	H	α-helix	trans	-73.1	-29.7	175.2	-70.3	-172.2	3.9	0	0	113.3	E193 V194 I195 S201	E193-Q197 PolarHBondContact O-N 3.15Å; V194-Q197 PolarHBondContact O-N 3.06Å; I195-Q197 PolarHBondContact O-N 3.36Å; Q197-S201 PolarHBondContact O-N 3.32Å; Q197-S201 PolarHBondContact O-OG 2.91Å
198	F	39.2	Very low	39.5	Very low	150 Å²	150	130.3 Å²	130.3	66%	0.658	68%	0.682	S	S	*	*	H	α-helix	trans	-67.5	-41.2	174	-105.8	-91.8	0	0	0	112.4	V194 I195 S201	V194-F198 HydrophobicContact CG1-CD2 4.48Å; V194-F198 PolarHBondContact O-N 3.11Å; I195-F198 PolarHBondContact O-N 3.48Å; F198-S201 PolarHBondContact O-N 3.24Å
199	E	35.6	Very low	39.1	Very low	144 Å²	144	136 Å²	136	67%	0.673	69%	0.686	S	S	*	*	H	α-helix	trans	-65.9	-40.4	179.5	-160.2	168.2	-150.2	0	0	112.1	I195 S201 V202 S203	I195-E199 PolarHBondContact O-N 3.23Å; E199-S201 PolarHBondContact O-N 2.87Å; E199-V202 PolarHBondContact O-N 3.44Å; E199-S203 PolarHBondContact O-OG 3.44Å
200	I	39.9	Very low	38.9	Very low	118 Å²	118	133.6 Å²	133.6	61%	0.605	68%	0.681	S	S	*	*	H	α-helix	trans	-63.7	-27.7	175.3	-64.1	164.5	0	0	0	112.3	K196	K196-I200 WeakPolarHBondContact O-CD1 3.18Å; K196-I200 VanDerWaalsContact O-CG1 3.3Å; K196-I200 WeakPolarHBondContact O-CG1 3.47Å; K196-I200 PolarHBondContact O-N 2.85Å
201	S	36	Very low	38	Very low	85 Å²	85	137.1 Å²	137.1	59%	0.594	70%	0.7	S	S	*	*	H	α-helix	trans	-79.6	-22.6	-176.1	-62.3	0	0	0	0	113.6	Q197 F198 E199	Q197-S201 PolarHBondContact O-N 3.32Å; Q197-S201 PolarHBondContact O-OG 2.91Å; F198-S201 PolarHBondContact O-N 3.24Å; E199-S201 PolarHBondContact O-N 2.87Å
202	V	40.1	Very low	37.2	Very low	110 Å²	110	136.3 Å²	136.3	67%	0.667	70%	0.7	S	S	*	*	H	α-helix	trans	-86.5	-29	179.7	179.8	0	0	0	0	112.1	E199 R204	E199-V202 PolarHBondContact O-N 3.44Å; V202-R204 VanDerWaalsContact C-N 3.28Å; V202-R204 PolarHBondContact O-N 2.84Å
203	S	35.6	Very low	36.2	Very low	97 Å²	97	135.1 Å²	135.1	68%	0.678	71%	0.706	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.7	-3.2	-177.8	-49.4	0	0	0	0	115.5	E199	E199-S203 PolarHBondContact O-OG 3.44Å
204	R	36.8	Very low	35.2	Very low	226 Å²	226	137.2 Å²	137.2	85%	0.853	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103	4.4	-166.9	-134.9	176	-177.3	-177	1.7	116.1	V202	V202-R204 VanDerWaalsContact C-N 3.28Å; V202-R204 PolarHBondContact O-N 2.84Å
205	S	35.8	Very low	34.1	Very low	104 Å²	104	143 Å²	143	73%	0.727	73%	0.734	S	S	*	*	S	Bend	trans	-119.7	5.6	-176.5	49	0	0	0	0	114.9
206	Q	40.2	Very low	33	Very low	181 Å²	181	140.3 Å²	140.3	85%	0.846	74%	0.737	S	S	*	*	S	Bend	trans	-134.1	101.7	169.2	-67	-169.3	9.7	0	0	111.9
207	S	28.5	Very low	32.2	Very low	103 Å²	103	142.9 Å²	142.9	72%	0.72	75%	0.748	S	S	*	*			trans	157.9	111.8	139.9	-177.4	0	0	0	0	110.8
208	F	27.2	Very low	31.6	Very low	217 Å²	217	143.4 Å²	143.4	95%	0.952	75%	0.751	S	S	*	*			trans	-159.7	75.7	147.3	-86.3	-58.3	0	0	0	110.4
209	R	29.3	Very low	31	Very low	232 Å²	232	142.9 Å²	142.9	88%	0.875	76%	0.76	S	S	*	*			trans	-146	106.6	147.6	-81.5	-153.6	-172.7	-101.6	3.4	111
210	S	27.1	Very low	30.6	Very low	105 Å²	105	139.3 Å²	139.3	73%	0.734	76%	0.762	S	S	*	*			trans	56.3	138.9	136.4	65.2	0	0	0	0	122.9
211	V	24.6	Very low	30.1	Very low	134 Å²	134	141.7 Å²	141.7	81%	0.812	78%	0.775	S	S	*	*			trans	112.6	140.3	148.2	-169.3	0	0	0	0	116.9
212	T	24.8	Very low	29.7	Very low	122 Å²	122	145.4 Å²	145.4	75%	0.748	78%	0.783	S	S	*	*			trans	-84.8	156	-152.4	48	0	0	0	0	118.4
213	S	26.2	Very low	29.1	Very low	103 Å²	103	148.9 Å²	148.9	72%	0.72	79%	0.792	S	S	*	*			trans	66.4	118.5	136.9	-170.1	0	0	0	0	120.9
214	E	27.6	Very low	28.9	Very low	173 Å²	173	152.7 Å²	152.7	81%	0.808	80%	0.797	S	S	*	*				-170.4	117.7	96.7	-95.9	-160.1	122	0	0	115.6
215	K	26.3	Very low	29.1	Very low	204 Å²	204	146.9 Å²	146.9	89%	0.887	79%	0.788	S	S	*	*				39.7	118.6	128	-132	173.8	-169.4	172	0	123.1
216	G	25.3	Very low	28.9	Very low	69 Å²	69	149.2 Å²	149.2	71%	0.711	79%	0.785	S	S	*	*			trans	148.9	96.1	147.7	0	0	0	0	0	115.1
217	K	27.6	Very low	28.4	Very low	194 Å²	194	148.9 Å²	148.9	84%	0.843	78%	0.781	S	S	*	*				66.1	134.3	87.3	-90.7	-173.3	168.9	-162.2	0	114.9
218	Q	30.1	Very low	28.4	Very low	141 Å²	141	148.9 Å²	148.9	66%	0.659	78%	0.781	S	S	*	*			cis	-168.6	172.6	8.1	-158.7	168.1	-36.1	0	0	112.8
219	T	26.5	Very low	28.4	Very low	139 Å²	139	148 Å²	148	85%	0.853	77%	0.771	S	S	*	*			trans	80.3	143.4	165.1	77.2	0	0	0	0	118.4
220	G	26.3	Very low	28.2	Very low	69 Å²	69	143.5 Å²	143.5	71%	0.711	76%	0.764	S	S	*	*			cis	-179.3	140.7	-10.3	0	0	0	0	0	108.4
221	L	29.4	Very low	28.1	Very low	168 Å²	168	143.7 Å²	143.7	88%	0.88	76%	0.756	S	S	*	*				-177.6	167.1	81.7	-93.2	163.3	0	0	0	112.1
222	E	28.2	Very low	28.2	Very low	162 Å²	162	144 Å²	144	76%	0.757	75%	0.753	S	S	*	*			trans	-43.6	169	179.7	-49.2	-179.3	99.3	0	0	119.2
223	Q	28.1	Very low	28.2	Very low	183 Å²	183	143.5 Å²	143.5	86%	0.855	75%	0.749	S	S	*	*			cis	-146.3	177.5	33.3	-71.6	-174.4	7.3	0	0	116.5
224	K	30.1	Very low	28	Very low	178 Å²	178	145.7 Å²	145.7	77%	0.774	75%	0.748	S	S	*	*			trans	-83.2	-172.7	-175.5	-108.8	177.3	-179.9	154.8	0	113.4
225	P	41.3	Very low	27.9	Very low	103 Å²	103	140.1 Å²	140.1	67%	0.669	74%	0.737	S	S	*	*			cis	-139.2	150.3	11.3	23.2	3.2	0	0	0	120.8
226	K	32.1	Very low	28.1	Very low	154 Å²	154	138.3 Å²	138.3	67%	0.67	73%	0.732	S	S	*	*				60.5	145.4	129.5	-61.3	171.2	179.1	176.8	0	119.8
227	F	29.2	Very low	28.1	Very low	174 Å²	174	142.7 Å²	142.7	76%	0.763	74%	0.739	S	S	*	*			cis	-160.2	-179	-1.4	-106.6	-34.9	0	0	0	106.9
228	S	29.4	Very low	28.1	Very low	102 Å²	102	135.9 Å²	135.9	71%	0.713	72%	0.723	S	S	*	*			cis	-155.4	149.8	2.8	18.9	0	0	0	0	107.8
229	R	26.4	Very low	28	Very low	198 Å²	198	135 Å²	135	75%	0.747	73%	0.728	S	S	*	*				69	123.7	72.2	-128.5	-162.6	179.8	-162.2	-0.7	112.3
230	L	26	Very low	28.1	Very low	138 Å²	138	136.1 Å²	136.1	72%	0.723	72%	0.724	S	S	*	*			cis	-155.6	178.4	40.1	-75.6	154.3	0	0	0	110.1
231	L	25.4	Very low	28.3	Very low	110 Å²	110	138.9 Å²	138.9	58%	0.576	73%	0.726	S	S	*	*				179.6	146.8	-50.2	-108.7	-170	0	0	0	107.7
232	L	25.6	Very low	28.3	Very low	141 Å²	141	135.6 Å²	135.6	74%	0.738	72%	0.717	S	S	*	*			trans	67.8	159.2	151.3	-62.2	165.3	0	0	0	117.8
233	T	24.6	Very low	28.3	Very low	110 Å²	110	131.8 Å²	131.8	68%	0.675	71%	0.713	S	S	*	*			cis	-155.7	164	7.9	-11.9	0	0	0	0	111.4
234	H	23.4	Very low	28.3	Very low	149 Å²	149	127.7 Å²	127.7	69%	0.69	70%	0.704	S	S	*	*			trans	38.9	138.1	147.7	-103.3	-107.8	0	0	0	120.7	E236	H234-E236 IonicContact CE1-OE1 2.6Å; H234-E236 PolarHBondContact CE1-OE1 3.33Å; H234-E236 IonicContact CE1-OE2 3.47Å; H234-E236 IonicContact ND1-OE1 3.94Å; H234-E236 PolarHBondContact ND1-OE1 2.71Å; H234-E236 IonicContact ND1-OE2 3.77Å; H234-E236 PolarHBondContact ND1-OE2 2.78Å
235	G	25.3	Very low	28.3	Very low	57 Å²	57	127.4 Å²	127.4	59%	0.588	71%	0.705	S	S	*	*			cis	151.3	175.8	4.6	0	0	0	0	0	109.9
236	E	30.3	Very low	27.7	Very low	166 Å²	166	128.6 Å²	128.6	78%	0.776	71%	0.706	S	S	*	*			trans	65.2	154.3	161	-68.7	143.5	168.5	0	0	116.2	H234	H234-E236 IonicContact CE1-OE1 2.6Å; H234-E236 PolarHBondContact CE1-OE1 3.33Å; H234-E236 IonicContact CE1-OE2 3.47Å; H234-E236 IonicContact ND1-OE1 3.94Å; H234-E236 PolarHBondContact ND1-OE1 2.71Å; H234-E236 IonicContact ND1-OE2 3.77Å; H234-E236 PolarHBondContact ND1-OE2 2.78Å
237	D	24.6	Very low	27.9	Very low	161 Å²	161	127.5 Å²	127.5	86%	0.861	71%	0.707	S	S	*	*			cis	-165.2	167.3	-21.4	-179.3	29.1	0	0	0	107.1
238	G	27.1	Very low	27.9	Very low	50 Å²	50	127 Å²	127	52%	0.515	71%	0.712	S	S	.	*			trans	87.5	132.7	166.6	0	0	0	0	0	116.3
239	T	29.3	Very low	27.9	Very low	122 Å²	122	125.8 Å²	125.8	75%	0.748	72%	0.716	S	S	*	*				71.5	120.3	52.8	-53.4	0	0	0	0	107.9
240	E	28	Very low	28	Very low	164 Å²	164	120.9 Å²	120.9	77%	0.766	72%	0.718	S	S	*	*			cis	-171.3	163.5	32.5	42.6	-151.3	115.1	0	0	115.1
241	V	30.1	Very low	28.2	Very low	127 Å²	127	119.8 Å²	119.8	77%	0.77	72%	0.722	S	S	*	*			trans	66.4	114.2	137	165	0	0	0	0	121.3
242	S	29.9	Very low	28.3	Very low	99 Å²	99	122.2 Å²	122.2	69%	0.692	73%	0.73	S	S	*	*			trans	73	125	130.1	-153.3	0	0	0	0	118.8
243	A	28.5	Very low	28.2	Very low	81 Å²	81	124.2 Å²	124.2	67%	0.669	73%	0.728	S	S	*	*				54.8	130.5	62.7	0	0	0	0	0	112.7
244	C	27.3	Very low	28.1	Very low	98 Å²	98	128.7 Å²	128.7	66%	0.662	73%	0.732	S	S	*	*			cis	-158.4	169.9	-2.2	-100.3	0	0	0	0	107.8
245	E	30.7	Very low	28.2	Very low	172 Å²	172	132.6 Å²	132.6	80%	0.804	74%	0.742	S	S	*	*			trans	65.1	157.4	154.9	-71.1	154.9	-166.4	0	0	115.7
246	D	28.6	Very low	28.4	Very low	128 Å²	128	134.7 Å²	134.7	68%	0.684	75%	0.748	S	S	*	*			cis	-157.6	167.8	-8.7	-131.4	-17.3	0	0	0	111.9
247	L	35.3	Very low	28.1	Very low	131 Å²	131	135.8 Å²	135.8	69%	0.686	75%	0.753	S	S	*	*			trans	61.4	129.1	148.2	-64.6	167.8	0	0	0	124.1
248	D	30.1	Very low	28.5	Very low	163 Å²	163	135.7 Å²	135.7	87%	0.872	75%	0.753	S	S	*	*			trans	58.7	145.1	137.2	-75.9	-26.5	0	0	0	123.6
249	G	29.2	Very low	28.5	Very low	77 Å²	77	141.6 Å²	141.6	79%	0.794	77%	0.772	S	S	*	*			trans	152.2	88.6	158.1	0	0	0	0	0	116.9
250	A	28.8	Very low	28.4	Very low	95 Å²	95	140.6 Å²	140.6	79%	0.785	77%	0.769	S	S	*	*			trans	-59.8	-177.7	-179.8	0	0	0	0	0	118.2
251	S	29.5	Very low	28.4	Very low	115 Å²	115	143.2 Å²	143.2	80%	0.804	77%	0.774	S	S	*	*			trans	90.1	112.4	169.4	-35.6	0	0	0	0	114.2
252	Q	27.3	Very low	28.2	Very low	160 Å²	160	140.7 Å²	140.7	75%	0.748	77%	0.774	S	S	*	*			cis	64.2	90.7	43.9	-149.9	-156.6	93.4	0	0	114.2
253	R	25.4	Very low	28.2	Very low	184 Å²	184	143 Å²	143	69%	0.694	77%	0.774	S	S	*	*				171.4	142.2	109.2	-91.1	-173.9	178.9	-152.4	-3.1	114.1
254	R	22.5	Very low	28.2	Very low	203 Å²	203	145.4 Å²	145.4	77%	0.766	78%	0.775	S	S	*	*			trans	25	132.8	146.9	-58.8	179.2	-174	167.6	-0.6	119.2
255	Y	25.1	Very low	28.3	Very low	231 Å²	231	146.1 Å²	146.1	91%	0.906	77%	0.772	S	S	*	*				-152.7	140.4	102.3	-113.1	-81	0	0	0	110.8
256	S	28.8	Very low	28.3	Very low	101 Å²	101	145.7 Å²	145.7	71%	0.706	77%	0.77	S	S	*	*			trans	-110.9	133.5	158.5	-58.6	0	0	0	0	106.3
257	E	24.3	Very low	28.2	Very low	189 Å²	189	147 Å²	147	88%	0.883	78%	0.776	S	S	*	*				175	153.4	124.3	-96.5	177.4	160.5	0	0	111.6
258	N	33.2	Very low	27.8	Very low	159 Å²	159	146.1 Å²	146.1	85%	0.85	78%	0.78	S	S	*	*			trans	-84.4	151	178.7	-59	-71.1	0	0	0	110.6
259	L	27	Very low	27.8	Very low	175 Å²	175	142 Å²	142	92%	0.916	77%	0.769	S	S	*	*			trans	-151.7	138.7	151.1	-110.3	161.9	0	0	0	110.6
260	S	27.4	Very low	27.6	Very low	100 Å²	100	147.3 Å²	147.3	70%	0.699	77%	0.773	S	S	*	*			trans	-79	160.8	-175.8	68.8	0	0	0	0	113.4
261	Y	26.6	Very low	27.5	Very low	220 Å²	220	147 Å²	147	86%	0.863	77%	0.765	S	S	*	*			trans	-164.3	155.8	141.1	-121.3	-78.8	0	0	0	110.5
262	G	27.5	Very low	27.3	Very low	74 Å²	74	150.7 Å²	150.7	76%	0.763	77%	0.769	S	S	*	*			trans	131.6	75.6	156	0	0	0	0	0	117.8
263	E	29.1	Very low	27.2	Very low	148 Å²	148	148.2 Å²	148.2	69%	0.692	77%	0.769	S	S	*	*			trans	-44.6	162.1	164.1	-84.9	147.3	121.4	0	0	120.1
264	D	28.1	Very low	28	Very low	131 Å²	131	144.9 Å²	144.9	70%	0.701	77%	0.772	S	S	*	*			trans	90.3	114	138.4	-65.4	-4.1	0	0	0	126.2
265	D	30.8	Very low	28.3	Very low	113 Å²	113	140.6 Å²	140.6	60%	0.604	77%	0.772	S	S	*	*				58.3	111.4	121.3	-70	6.3	0	0	0	122.8
266	H	29.9	Very low	28.5	Very low	163 Å²	163	136.9 Å²	136.9	76%	0.755	76%	0.762	S	S	*	*				101.4	138.9	90.9	-73	-9.8	0	0	0	111
267	I	26.7	Very low	28.5	Very low	156 Å²	156	141.4 Å²	141.4	80%	0.8	76%	0.764	S	S	*	*				-169.9	152	68.2	-80.7	-178.2	0	0	0	110.5
268	S	27.4	Very low	28.8	Very low	112 Å²	112	135.5 Å²	135.5	78%	0.783	75%	0.754	S	S	*	*			trans	-3.3	162.9	150.5	-69.6	0	0	0	0	122.4
269	A	28.8	Very low	28.8	Very low	77 Å²	77	134.9 Å²	134.9	64%	0.636	75%	0.751	S	S	*	*			cis	-173	160.4	-10	0	0	0	0	0	110
270	H	25.1	Very low	29.1	Very low	188 Å²	188	130.2 Å²	130.2	87%	0.87	74%	0.737	S	S	*	*				-178.8	175.3	123.4	-104.3	-69.5	0	0	0	112
271	S	27.5	Very low	29.3	Very low	89 Å²	89	134 Å²	134	62%	0.622	74%	0.741	S	S	*	*			trans	-138.8	145.1	-145.6	54.4	0	0	0	0	114
272	Q	25.4	Very low	29.5	Very low	192 Å²	192	130.5 Å²	130.5	90%	0.897	73%	0.732	S	S	*	*				153.1	150	125.4	-84.3	-177.6	-16.3	0	0	113.5
273	S	25.2	Very low	29.5	Very low	107 Å²	107	135.4 Å²	135.4	75%	0.748	74%	0.735	S	S	*	*			trans	-95.6	-177	175.1	60	0	0	0	0	110.8
274	P	40.8	Very low	29.4	Very low	115 Å²	115	131 Å²	131	75%	0.747	73%	0.73	S	S	*	*				-144	160.5	74.9	33.3	-12.8	0	0	0	117
275	C	29.7	Very low	29.4	Very low	113 Å²	113	131 Å²	131	76%	0.764	74%	0.735	S	S	*	*			trans	15.5	148	145.1	-42.6	0	0	0	0	120.4
276	E	29.7	Very low	29.1	Very low	152 Å²	152	129.6 Å²	129.6	71%	0.71	73%	0.734	S	S	*	*			cis	-167.9	169.9	48.1	-93.5	-153.4	108	0	0	108.5
277	R	27.8	Very low	29	Very low	196 Å²	196	129.9 Å²	129.9	74%	0.74	74%	0.735	S	S	*	*			cis	-166	129.8	-3.9	157	-172.5	-62.8	-154.2	5.2	105
278	G	30.8	Very low	29.1	Very low	65 Å²	65	130.2 Å²	130.2	67%	0.67	73%	0.733	S	S	*	*				90.1	142.8	102.5	0	0	0	0	0	112.2
279	D	33.7	Very low	28.9	Very low	146 Å²	146	131.8 Å²	131.8	78%	0.781	73%	0.728	S	S	*	*			cis	-157.8	144.8	4.2	-103	-59.2	0	0	0	111.7
280	A	33.7	Very low	28.8	Very low	77 Å²	77	133.2 Å²	133.2	64%	0.636	73%	0.733	S	S	*	*				53.7	156.9	128.6	0	0	0	0	0	121.4
281	K	30.3	Very low	28.7	Very low	181 Å²	181	131 Å²	131	79%	0.787	73%	0.727	S	S	*	*			cis	-159.4	122.1	10.3	-130.6	149.3	-174.9	176.3	0	106.1
282	H	31.1	Very low	28.6	Very low	145 Å²	145	132.4 Å²	132.4	67%	0.671	73%	0.732	S	S	*	*				85.9	132.2	87.4	-83	-31.5	0	0	0	118.1
283	H	27.5	Very low	28.6	Very low	177 Å²	177	128.8 Å²	128.8	82%	0.819	72%	0.723	S	S	*	*			trans	65.6	141.7	149.4	-58.8	-51.6	0	0	0	120.5
284	G	26.9	Very low	28.5	Very low	56 Å²	56	132.1 Å²	132.1	58%	0.577	73%	0.727	S	S	*	*			cis	169.5	-173.8	-5.1	0	0	0	0	0	115.2
285	T	28.2	Very low	27.8	Very low	132 Å²	132	131.6 Å²	131.6	81%	0.81	73%	0.726	S	S	*	*			trans	62.7	120.3	163.8	53.4	0	0	0	0	118
286	S	24.7	Very low	27.7	Very low	83 Å²	83	133.3 Å²	133.3	58%	0.58	73%	0.727	S	S	*	*				67.6	149	51.2	81.8	0	0	0	0	113.2
287	H	28.7	Very low	27.4	Very low	168 Å²	168	135.1 Å²	135.1	78%	0.778	73%	0.727	S	S	*	*			cis	-131	-163.7	2	-62.2	-97.8	0	0	0	108.7
288	Q	27.1	Very low	27.4	Very low	163 Å²	163	133.7 Å²	133.7	76%	0.762	72%	0.722	S	S	*	*			cis	-144.9	-131.2	0.9	-156.2	175.2	-15.1	0	0	112.9
289	E	25	Very low	27.4	Very low	146 Å²	146	137.3 Å²	137.3	68%	0.682	72%	0.721	S	S	*	*			trans	-145.9	149.2	-150.8	-60.6	158.9	108.5	0	0	113.6
290	S	26.2	Very low	27	Very low	106 Å²	106	134.6 Å²	134.6	74%	0.741	71%	0.714	S	S	*	*			trans	68.8	159.7	144.3	86.2	0	0	0	0	118.7
291	N	22.4	Very low	26.7	Very low	141 Å²	141	135.9 Å²	135.9	75%	0.754	71%	0.714	S	S	*	*			cis	-161.8	153	3.5	-137.1	-18.3	0	0	0	113
292	V	25	Very low	26.5	Very low	120 Å²	120	136.1 Å²	136.1	73%	0.727	72%	0.718	S	S	*	*			trans	50.7	137.7	157.1	-146.4	0	0	0	0	123.5
293	V	26.2	Very low	26.1	Very low	116 Å²	116	132.6 Å²	132.6	70%	0.703	72%	0.721	S	S	*	*			trans	133.7	85.9	136.4	-175.4	0	0	0	0	116
294	Q	24	Very low	25.9	Very low	176 Å²	176	129.9 Å²	129.9	82%	0.822	72%	0.722	S	S	*	*				69	145.2	115.5	-145.2	170.2	23.2	0	0	123.6
295	S	24.1	Very low	25.9	Very low	105 Å²	105	134.8 Å²	134.8	73%	0.734	73%	0.734	S	S	*	*			trans	82.8	140.4	167	80.5	0	0	0	0	117.4
296	L	28.1	Very low	25.9	Very low	149 Å²	149	136.9 Å²	136.9	78%	0.78	74%	0.735	S	S	*	*			cis	-153.4	149.6	-0.7	-148.2	89.2	0	0	0	111.7
297	R	23.6	Very low	26	Very low	189 Å²	189	140.9 Å²	140.9	71%	0.713	75%	0.746	S	S	*	*			trans	13.9	150.8	139.6	-79.2	-172	154.1	-173	-6.5	121
298	R	29.1	Very low	25.9	Very low	167 Å²	167	140.8 Å²	140.8	63%	0.63	75%	0.746	S	S	*	*			cis	-175.8	151.4	-3.7	-130.6	180	175	-149.6	-1	110.9
299	Q	29.1	Very low	25.9	Very low	140 Å²	140	139.6 Å²	139.6	65%	0.654	75%	0.75	S	S	*	*			trans	52.3	154.3	133.8	-81.1	173.1	-14.2	0	0	121.8
300	S	26.3	Very low	26	Very low	90 Å²	90	136.8 Å²	136.8	63%	0.629	75%	0.752	S	S	*	*			cis	-161.4	-176.8	-7.2	54	0	0	0	0	107.7
301	T	26.1	Very low	25.9	Very low	103 Å²	103	141.5 Å²	141.5	63%	0.632	76%	0.759	S	S	*	*			cis	-159.7	128.1	19.9	-7.8	0	0	0	0	105.2
302	E	26.1	Very low	26.1	Very low	186 Å²	186	141.6 Å²	141.6	87%	0.869	76%	0.76	S	S	*	*				78.7	137.3	93.7	-168.2	166.3	-122.3	0	0	113
303	G	23.8	Very low	26	Very low	72 Å²	72	140.9 Å²	140.9	74%	0.742	76%	0.76	S	S	*	*			cis	145.9	122.8	2	0	0	0	0	0	109
304	S	23.9	Very low	26.1	Very low	119 Å²	119	147.5 Å²	147.5	83%	0.832	77%	0.772	S	S	*	*			trans	-102.6	128.6	-172.7	166.2	0	0	0	0	111.8
305	L	27	Very low	26.1	Very low	160 Å²	160	142.4 Å²	142.4	84%	0.838	77%	0.767	S	S	*	*			trans	-170.1	-177.7	143.3	-134.4	91.6	0	0	0	112.4
306	E	27.3	Very low	26.3	Very low	176 Å²	176	146.3 Å²	146.3	82%	0.822	77%	0.771	S	S	*	*			trans	80.4	142.3	170	-60.2	-169	164.8	0	0	116.8
307	M	27.9	Very low	26.4	Very low	167 Å²	167	145.9 Å²	145.9	82%	0.823	77%	0.765	S	S	*	*			cis	-163.1	163.1	-8.9	165.1	167.4	170.8	0	0	110.3
308	E	25.9	Very low	26.6	Very low	165 Å²	165	143.5 Å²	143.5	77%	0.771	77%	0.766	S	S	*	*			trans	-72.5	149.5	174.8	-53.9	178.8	116.4	0	0	113.9
309	T	27.8	Very low	26.6	Very low	139 Å²	139	140 Å²	140	85%	0.853	77%	0.767	S	S	*	*				169.1	164	114	34.7	0	0	0	0	113.2
310	A	25.9	Very low	26.7	Very low	86 Å²	86	143.2 Å²	143.2	71%	0.711	78%	0.775	S	S	*	*			trans	-97.9	168.4	-169.2	0	0	0	0	0	114.7
311	F	23.4	Very low	27	Very low	206 Å²	206	142.9 Å²	142.9	90%	0.904	78%	0.777	S	S	*	*				-172.8	157	118.8	-114	-83.6	0	0	0	113.3
312	N	26.6	Very low	27.2	Very low	143 Å²	143	144 Å²	144	77%	0.765	79%	0.785	S	S	*	*			trans	-84.9	154.4	-175.9	-70.2	-34.2	0	0	0	114.6
313	S	24.6	Very low	27.2	Very low	104 Å²	104	142.1 Å²	142.1	73%	0.727	78%	0.78	S	S	*	*				157.2	140.7	106.4	-71	0	0	0	0	116.4
314	R	26.5	Very low	27.7	Very low	256 Å²	256	143.4 Å²	143.4	97%	0.966	78%	0.778	S	S	*	*			trans	66.3	145.5	162.2	-63.9	173.5	177.9	-154	-4.2	117
315	G	23.9	Very low	28.2	Very low	68 Å²	68	142.6 Å²	142.6	70%	0.701	77%	0.772	S	S	*	*			cis	150.9	155.3	-4.4	0	0	0	0	0	111.6
316	F	30.4	Very low	28.2	Very low	188 Å²	188	140.7 Å²	140.7	83%	0.825	77%	0.772	S	S	*	*			trans	68.1	151.4	178.2	-100.7	-134.3	0	0	0	115.6
317	E	28.5	Very low	28.2	Very low	139 Å²	139	138.9 Å²	138.9	65%	0.65	77%	0.766	S	S	*	*			cis	-164.7	160.5	-10.2	-162.2	171.5	-156.4	0	0	109.3
318	D	28.6	Very low	28.3	Very low	139 Å²	139	141.3 Å²	141.3	74%	0.743	77%	0.766	S	S	*	*			trans	53.7	128.1	158.7	-87.2	5.9	0	0	0	122.6
319	S	29	Very low	28.4	Very low	94 Å²	94	138 Å²	138	66%	0.657	76%	0.761	S	S	*	*				77.1	135.8	87.9	-150.1	0	0	0	0	112
320	Y	31.4	Very low	29.3	Very low	208 Å²	208	136.9 Å²	136.9	82%	0.816	76%	0.756	S	S	*	*			cis	-168.9	169.8	42.5	41.5	-96.6	0	0	0	111.9
321	A	32.7	Very low	29.4	Very low	82 Å²	82	142.3 Å²	142.3	68%	0.678	77%	0.766	S	S	*	*			trans	49.5	125.8	157.1	0	0	0	0	0	120.4
322	T	30.2	Very low	29.7	Very low	128 Å²	128	141.1 Å²	141.1	79%	0.785	76%	0.764	S	S	*	*				82.9	141.2	52.9	-58.7	0	0	0	0	114.1
323	D	26.1	Very low	29.9	Very low	146 Å²	146	143.1 Å²	143.1	78%	0.781	77%	0.768	S	S	*	*			trans	76.1	143.6	175.6	-95.6	-35.3	0	0	0	117.5
324	S	33.5	Very low	30	Very low	99 Å²	99	144.3 Å²	144.3	69%	0.692	77%	0.767	S	S	*	*			cis	-152.3	166.8	1	-146.6	0	0	0	0	112.8
325	S	34.2	Very low	30.1	Very low	102 Å²	102	142.2 Å²	142.2	71%	0.713	76%	0.759	S	S	*	*			trans	-97	149.5	175.4	58.1	0	0	0	0	112.2
326	S	28	Very low	30.4	Very low	119 Å²	119	144.5 Å²	144.5	83%	0.832	76%	0.759	S	S	*	*			trans	-174.6	138.7	150.6	20	0	0	0	0	115.1
327	M	27.7	Very low	30.4	Very low	139 Å²	139	142.6 Å²	142.6	69%	0.685	76%	0.758	S	S	*	*			trans	-99.6	164.4	157.5	-47.2	92.3	75	0	0	108.2
328	W	28.3	Very low	30.5	Very low	217 Å²	217	144.3 Å²	144.3	82%	0.822	77%	0.771	S	S	*	*			cis	-140.5	178.9	22.9	-81.7	102.3	0	0	0	113.2
329	S	29	Very low	30.7	Very low	97 Å²	97	147 Å²	147	68%	0.678	78%	0.779	S	S	*	*			trans	-46.4	-178.2	158.6	-30.5	0	0	0	0	114.5
330	P	45.8	Very low	30.6	Very low	115 Å²	115	148.7 Å²	148.7	75%	0.747	79%	0.785	S	S	*	*			cis	-136.6	172	0.5	42	-25.9	0	0	0	115.6
331	E	28.6	Very low	30.5	Very low	199 Å²	199	144.5 Å²	144.5	93%	0.93	78%	0.783	S	S	*	*			trans	-171.6	163.5	138.6	-108.6	169.3	163.9	0	0	111.8
332	E	30.9	Very low	30.2	Very low	182 Å²	182	146.6 Å²	146.6	85%	0.85	79%	0.793	S	S	*	*			trans	-100.9	159.5	-164	-60.1	-175.3	138.8	0	0	115.1
333	Q	29.2	Very low	30.3	Very low	184 Å²	184	144 Å²	144	86%	0.86	79%	0.791	S	S	*	*			trans	105.9	119.9	139.7	-155.3	161.2	80.7	0	0	120.6
334	D	27	Very low	30.4	Very low	130 Å²	130	143.4 Å²	143.4	70%	0.695	79%	0.793	S	S	*	*			trans	99.7	139.4	152.8	-131.7	5.1	0	0	0	121.7
335	R	28.3	Very low	30.3	Very low	211 Å²	211	144.1 Å²	144.1	80%	0.796	80%	0.798	S	S	*	*			trans	-42.3	155.2	-172.5	-64.4	153.5	173.5	150.5	-6	115.7
336	T	29.9	Very low	30	Very low	116 Å²	116	147.3 Å²	147.3	71%	0.712	80%	0.801	S	S	*	*			cis	-168.7	160.4	31.3	-17.7	0	0	0	0	111.6
337	N	31.4	Very low	30.4	Very low	148 Å²	148	147 Å²	147	79%	0.791	80%	0.797	S	S	*	*			trans	57.1	100.1	159.5	-70.1	-57.3	0	0	0	119.5
338	L	30.6	Very low	31.2	Very low	176 Å²	176	144.9 Å²	144.9	92%	0.921	79%	0.787	S	S	*	*			trans	-146.8	149.2	131.5	-85	-171.7	0	0	0	110
339	Q	33.4	Very low	32.2	Very low	194 Å²	194	138.8 Å²	138.8	91%	0.907	78%	0.778	S	S	*	*			trans	-74.1	138.9	-175.3	-69.2	166.4	-71.8	0	0	112.4
340	V	26.6	Very low	33.5	Very low	131 Å²	131	140.7 Å²	140.7	79%	0.794	77%	0.774	S	S	*	*			trans	-112.5	131.1	162.6	-179.2	0	0	0	0	108	S342	V340-S342 PolarHBondContact O-N 3.19Å
341	P	28.6	Very low	34.5	Very low	120 Å²	120	135.9 Å²	135.9	78%	0.779	74%	0.742	S	S	*	*			trans	-68.4	121.9	172.2	-14.2	28.8	0	0	0	109.9	G343	P341-G343 VanDerWaalsContact C-N 3.25Å; P341-G343 PolarHBondContact O-N 3.3Å
342	S	27.4	Very low	36.8	Very low	126 Å²	126	126.5 Å²	126.5	88%	0.881	70%	0.699	S	S	*	*			trans	-73.4	79.2	175.1	59.6	0	0	0	0	110.7	V340	V340-S342 PolarHBondContact O-N 3.19Å
343	G	32.8	Very low	39.5	Very low	73 Å²	73	120.2 Å²	120.2	75%	0.753	67%	0.671	S	S	*	*			trans	-99.3	20.9	-177.7	0	0	0	0	0	115	P341	P341-G343 VanDerWaalsContact C-N 3.25Å; P341-G343 PolarHBondContact O-N 3.3Å
344	V	27.9	Very low	42.4	Very low	134 Å²	134	111.5 Å²	111.5	81%	0.812	63%	0.631	S	S	*	*			trans	-119.6	110.5	175.3	-174.5	0	0	0	0	107.9
345	S	30.5	Very low	45.4	Very low	114 Å²	114	106.3 Å²	106.3	80%	0.797	60%	0.603	S	S	*	*			trans	-81.1	118.6	174.7	-63.1	0	0	0	0	109.2
346	E	29.1	Very low	48.5	Very low	168 Å²	168	96.3 Å²	96.3	79%	0.785	57%	0.566	S	S	*	*			trans	-58.2	146.7	173.7	-65.3	177.5	148.2	0	0	111	I348	E346-I348 PolarHBondContact O-N 3.25Å
347	P	34.6	Very low	51.4	Low	114 Å²	114	92 Å²	92	74%	0.74	54%	0.538	S	S	*	.			trans	-60.6	113.9	-178.2	23.4	-33.3	0	0	0	111.1	S349	P347-S349 PolarHBondContact O-N 2.91Å; P347-S349 PolarHBondContact O-OG 2.71Å
348	I	46.2	Very low	54.3	Low	93 Å²	93	85 Å²	85	48%	0.477	50%	0.5	S	S	.	.			trans	-69.6	101.5	-166	-48.3	99	0	0	0	112	E346	E346-I348 PolarHBondContact O-N 3.25Å
349	S	47.7	Very low	57.1	Low	89 Å²	89	79.6 Å²	79.6	62%	0.622	47%	0.47	S	S	*	.			trans	-95	-1.3	-175.2	-58.5	0	0	0	0	114.7	P347	P347-S349 PolarHBondContact O-N 2.91Å; P347-S349 PolarHBondContact O-OG 2.71Å
350	K	57.4	Low	59.8	Low	138 Å²	138	70.8 Å²	70.8	60%	0.6	43%	0.429	S	S	*	.			trans	-133.4	133.9	-172.1	-60.6	-176.5	-178.1	180	0	112.1
351	C	66.6	Low	62.8	Low	13 Å²	13	70.7 Å²	70.7	9%	0.088	41%	0.414	C	S	.	.			trans	-104.6	21.5	173.2	-73	0	0	0	0	113	M449 L471 P473	C351-M449 PolarHBondContact SG-O 2.83Å; C351-L471 HydrophobicContact CB-CB 4.13Å; C351-L471 WeakPolarHBondContact CB-O 3.18Å; C351-L471 PolarHBondContact N-O 3.07Å; C351-L471 VanDerWaalsContact N-O 3.08Å; C351-P473 VanDerWaalsContact SG-CG 3.6Å
352	G	77.8	Confident	65.5	Low	2 Å²	2	66.2 Å²	66.2	2%	0.021	39%	0.387	C	S	.	.			trans	88.3	171.7	-178.3	0	0	0	0	0	113.9	Q375 G376 L471	G352-Q375 CarbonylContact C-O 3.54Å; G352-Q375 WeakPolarHBondContact CA-O 3.14Å; G352-G376 WeakPolarHBondContact CA-O 3.43Å; G352-G376 PolarHBondContact N-O 3.45Å; G352-L471 VanDerWaalsContact O-CB 3.22Å; G352-L471 WeakPolarHBondContact O-CB 3.38Å; G352-L471 WeakPolarHBondContact O-CG 3.4Å; G352-L471 PolarHBondContact O-N 3.44Å
353	D	86.5	Confident	68.3	Low	50 Å²	50	64.9 Å²	64.9	27%	0.267	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	136.7	-172.8	-57	-40.3	0	0	0	109.8	A374 Q375 T468 V470	D353-A374 CarbonylContact O-C 3.58Å; D353-A374 VanDerWaalsContact O-CA 3.23Å; D353-A374 WeakPolarHBondContact O-CA 3.44Å; D353-Q375 PolarHBondContact N-O 3.08Å; D353-Q375 PolarHBondContact O-N 3.12Å; D353-T468 HydrophobicContact CB-CG2 3.78Å; D353-V470 WeakPolarHBondContact OD1-CG2 3.35Å
354	L	89.8	Confident	70.9	Confident	1 Å²	1	63.6 Å²	63.6	1%	0.005	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	112.8	-178.1	-173.8	72.5	0	0	0	110.5	V356 I371 A374 V390 F435 L469 L471	L354-V356 HydrophobicContact CD2-CG2 3.76Å; L354-V356 HydrophobicContact CG-CG2 3.76Å; L354-V356 PolarHBondContact O-N 3.23Å; L354-I371 HydrophobicContact CD1-CG2 3.83Å; L354-I371 HydrophobicContact CG-CG2 4.39Å; L354-A374 HydrophobicContact CD1-CB 3.83Å; L354-V390 HydrophobicContact CD1-CG2 3.93Å; L354-V390 HydrophobicContact CD2-CG1 4.04Å; L354-V390 HydrophobicContact CD2-CG2 4.45Å; L354-F435 HydrophobicContact CD2-CB 4.04Å; L354-F435 HydrophobicContact CD2-CD1 3.76Å; L354-F435 HydrophobicContact CD2-CG 4.07Å; L354-L469 HydrophobicContact CB-CB 4.38Å; L354-L469 PolarHBondContact N-O 2.97Å; L354-L469 PolarHBondContact O-N 2.82Å; L354-L471 HydrophobicContact CB-CD1 4.32Å; L354-L471 HydrophobicContact CB-CD2 4.26Å; L354-L471 HydrophobicContact CB-CG 4.22Å; L354-L471 HydrophobicContact CD2-CD2 4.45Å
355	D	90.6	Very high	73.8	Confident	22 Å²	22	60.5 Å²	60.5	12%	0.118	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	116.5	175.8	-73.5	-22.6	0	0	0	110.1	V372 R373 T468	D355-V372 HydrophobicContact CB-CB 4.12Å; D355-V372 WeakPolarHBondContact O-CB 3.35Å; D355-V372 PolarHBondContact O-N 2.8Å; D355-R373 HydrophobicContact CB-CG 4.01Å; D355-R373 PolarHBondContact N-O 3.38Å; D355-R373 IonicContact OD2-CZ 2.76Å; D355-R373 IonicContact OD2-NE 3.67Å; D355-R373 PolarHBondContact OD2-NE 3.33Å; D355-R373 IonicContact OD2-NH2 3.15Å; D355-R373 PolarHBondContact OD2-NH2 2.92Å; D355-T468 WeakPolarHBondContact OD1-CB 3.41Å; D355-T468 WeakPolarHBondContact OD1-CG2 3.37Å; D355-T468 PolarHBondContact OD1-OG1 2.89Å
356	V	92.4	Very high	76.6	Confident	1 Å²	1	59.8 Å²	59.8	1%	0.006	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	143.9	-177.3	-174.6	0	0	0	0	110.5	L354 F358 V369 T370 F435 V467 L469	L354-V356 HydrophobicContact CD2-CG2 3.76Å; L354-V356 HydrophobicContact CG-CG2 3.76Å; L354-V356 PolarHBondContact O-N 3.23Å; V356-F358 HydrophobicContact CB-CE2 4.03Å; V356-F358 HydrophobicContact CG1-CD2 4.01Å; V356-F358 HydrophobicContact CG1-CE2 3.5Å; V356-F358 HydrophobicContact CG1-CZ 3.82Å; V356-V369 HydrophobicContact CG1-CG1 3.55Å; V356-T370 WeakPolarHBondContact CA-O 3.38Å; V356-F435 HydrophobicContact CG1-CE1 3.85Å; V356-F435 HydrophobicContact CG1-CZ 3.76Å; V356-F435 HydrophobicContact CG2-CD1 4.25Å; V356-F435 HydrophobicContact CG2-CE1 3.86Å; V356-F435 HydrophobicContact CG2-CZ 4.22Å; V356-V467 PolarHBondContact N-O 2.91Å; V356-V467 PolarHBondContact O-N 2.57Å; V356-V467 VanDerWaalsContact O-O 3.11Å; V356-L469 HydrophobicContact CB-CD1 4.26Å; V356-L469 HydrophobicContact CG2-CD1 3.83Å; V356-L469 HydrophobicContact CG2-CG 4.4Å
357	I	91.9	Very high	79.4	Confident	26 Å²	26	51.8 Å²	51.8	13%	0.133	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	129.7	174.2	-55.3	175.2	0	0	0	108.5	V369 T370 V372 E464 M465 K466	I357-V369 CarbonylContact O-C 3.57Å; I357-V369 WeakPolarHBondContact O-CA 3.3Å; I357-T370 PolarHBondContact N-O 2.81Å; I357-T370 PolarHBondContact O-N 3.35Å; I357-V372 HydrophobicContact CD1-CG2 3.53Å; I357-V372 HydrophobicContact CG1-CG2 3.66Å; I357-E464 HydrophobicContact CG2-CG 3.34Å; I357-E464 VanDerWaalsContact CG2-OE1 3.28Å; I357-E464 WeakPolarHBondContact CG2-OE1 3.46Å; I357-M465 CarbonylContact C-O 3.33Å; I357-M465 WeakPolarHBondContact CA-O 3.49Å; I357-K466 HydrophobicContact CD1-CD 4.25Å; I357-K466 HydrophobicContact CD1-CG 4.48Å; I357-K466 HydrophobicContact CG1-CB 4.49Å; I357-K466 HydrophobicContact CG1-CD 4.3Å; I357-K466 HydrophobicContact CG1-CG 4.01Å; I357-K466 HydrophobicContact CG2-CG 4.31Å
358	F	91.4	Very high	82.1	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	129.7	174.6	-63.7	-97.8	0	0	0	109.4	V356 L367 V369 V433 F435 F454 L456 L459 E464 M465 V467	V356-F358 HydrophobicContact CB-CE2 4.03Å; V356-F358 HydrophobicContact CG1-CD2 4.01Å; V356-F358 HydrophobicContact CG1-CE2 3.5Å; V356-F358 HydrophobicContact CG1-CZ 3.82Å; F358-L367 HydrophobicContact CD1-CD1 4.39Å; F358-V369 HydrophobicContact CD1-CG1 4.41Å; F358-V369 HydrophobicContact CD1-CG2 3.74Å; F358-V369 HydrophobicContact CE1-CG1 4.12Å; F358-V369 HydrophobicContact CE1-CG2 3.86Å; F358-V369 HydrophobicContact CZ-CG1 4.48Å; F358-V433 HydrophobicContact CE1-CB 4.18Å; F358-V433 HydrophobicContact CE1-CG1 4.48Å; F358-V433 HydrophobicContact CE1-CG2 4.27Å; F358-F435 HydrophobicContact CE1-CE2 4.37Å; F358-F435 AromaticContact CE1-CZ 4Å; F358-F435 HydrophobicContact CE1-CZ 4Å; F358-F435 HydrophobicContact CE2-CZ 4.44Å; F358-F435 AromaticContact CZ-CE2 3.73Å; F358-F435 HydrophobicContact CZ-CE2 3.73Å; F358-F435 AromaticContact CZ-CZ 3.52Å; F358-F435 HydrophobicContact CZ-CZ 3.52Å; F358-F454 HydrophobicContact CD1-CD1 4.37Å; F358-F454 HydrophobicContact CD1-CE1 4.41Å; F358-F454 HydrophobicContact CD2-CD1 4.44Å; F358-F454 HydrophobicContact CD2-CE1 4.17Å; F358-F454 AromaticContact CE1-CD1 3.69Å; F358-F454 HydrophobicContact CE1-CD1 3.69Å; F358-F454 HydrophobicContact CE1-CE1 4.16Å; F358-F454 HydrophobicContact CE1-CG 4.48Å; F358-F454 AromaticContact CE2-CD1 3.77Å; F358-F454 HydrophobicContact CE2-CD1 3.77Å; F358-F454 AromaticContact CE2-CE1 3.9Å; F358-F454 HydrophobicContact CE2-CE1 3.9Å; F358-F454 HydrophobicContact CE2-CG 4.12Å; F358-F454 HydrophobicContact CE2-CZ 4.36Å; F358-F454 HydrophobicContact CG-CE1 4.42Å; F358-F454 HydrophobicContact CZ-CB 4.12Å; F358-F454 AromaticContact CZ-CD1 3.33Å; F358-F454 HydrophobicContact CZ-CD1 3.33Å; F358-F454 AromaticContact CZ-CE1 3.88Å; F358-F454 HydrophobicContact CZ-CE1 3.88Å; F358-F454 AromaticContact CZ-CG 3.75Å; F358-F454 HydrophobicContact CZ-CG 3.75Å; F358-L456 HydrophobicContact CD1-CD2 4.04Å; F358-L456 HydrophobicContact CE1-CD2 3.97Å; F358-L459 HydrophobicContact CB-CD1 4.2Å; F358-L459 HydrophobicContact CB-CD2 3.5Å; F358-L459 VanDerWaalsContact CB-CD2 3.5Å; F358-L459 HydrophobicContact CD1-CD1 4.33Å; F358-L459 HydrophobicContact CD1-CD2 4.47Å; F358-L459 HydrophobicContact CG-CD2 3.98Å; F358-E464 CarbonylContact O-C 3.49Å; F358-E464 WeakPolarHBondContact O-CA 3.47Å; F358-M465 PolarHBondContact N-O 3.04Å; F358-M465 PolarHBondContact O-N 2.8Å; F358-V467 HydrophobicContact CD2-CG1 3.9Å; F358-V467 HydrophobicContact CE2-CG1 3.49Å; F358-V467 VanDerWaalsContact CE2-CG1 3.49Å
359	E	90.7	Very high	84.3	Confident	63 Å²	63	43 Å²	43	29%	0.294	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	108.4	174.7	179.2	-168.4	173.1	0	0	107.2	T368	E359-T368 PolarHBondContact N-O 2.95Å; E359-T368 PolarHBondContact O-N 3.18Å
360	Y	89.2	Confident	86.5	Confident	9 Å²	9	39.4 Å²	39.4	4%	0.035	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	139.3	174	-176.5	-110.4	0	0	0	110.3	A362 K366 L367 L423 P425 V428 P461	Y360-A362 HydrophobicContact CE1-CB 3.86Å; Y360-K366 VanDerWaalsContact CD2-O 3.27Å; Y360-K366 WeakPolarHBondContact CD2-O 3.46Å; Y360-L367 HydrophobicContact CD2-CB 4.04Å; Y360-L367 HydrophobicContact CD2-CD1 4.31Å; Y360-L423 HydrophobicContact CE2-CB 4.12Å; Y360-L423 PolarHBondContact OH-O 2.86Å; Y360-P425 HydrophobicContact CE1-CB 4.46Å; Y360-P425 HydrophobicContact CE1-CG 4.37Å; Y360-P425 WeakPolarHBondContact OH-CA 3.49Å; Y360-P425 VanDerWaalsContact OH-CD 3.32Å; Y360-P425 WeakPolarHBondContact OH-CD 3.06Å; Y360-P425 WeakPolarHBondContact OH-CG 3.42Å; Y360-V428 HydrophobicContact CD2-CG2 4.2Å; Y360-V428 HydrophobicContact CE1-CG2 4.17Å; Y360-V428 HydrophobicContact CE2-CG2 3.62Å; Y360-P461 WeakPolarHBondContact CD1-O 3.17Å
361	R	89.1	Confident	88.1	Confident	129 Å²	129	32.9 Å²	32.9	49%	0.487	17%	0.174	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	98.7	175.8	-178.2	180	-67.8	-124.3	1.1	109.7	S363 S364 Q365 K366	R361-S363 VanDerWaalsContact C-N 3.3Å; R361-S363 VanDerWaalsContact CG-OG 3.24Å; R361-S363 WeakPolarHBondContact CG-OG 3.48Å; R361-S363 PolarHBondContact O-N 2.86Å; R361-S364 WeakPolarHBondContact CD-OG 3.27Å; R361-S364 WeakPolarHBondContact CG-OG 3.48Å; R361-S364 PolarHBondContact O-N 2.77Å; R361-S364 VanDerWaalsContact O-N 3.1Å; R361-S364 PolarHBondContact O-OG 2.74Å; R361-Q365 PolarHBondContact O-N 1.98Å; R361-Q365 VanDerWaalsContact O-N 3.08Å; R361-K366 PolarHBondContact N-O 2.41Å; R361-K366 PolarHBondContact O-N 3.15Å
362	A	85.3	Confident	89.3	Confident	26 Å²	26	34 Å²	34	22%	0.215	18%	0.18	C	C	.	.	G	3₁₀ helix	trans	-54.8	-44.1	-179.2	0	0	0	0	0	112.5	Y360 S364 Q365 P425	Y360-A362 HydrophobicContact CE1-CB 3.86Å; A362-S364 PolarHBondContact O-N 3.1Å; A362-Q365 PolarHBondContact O-N 2.84Å; A362-P425 HydrophobicContact CB-CG 3.97Å
363	S	87.6	Confident	89.9	Confident	98 Å²	98	38.5 Å²	38.5	69%	0.685	20%	0.197	S	C	*	.	G	3₁₀ helix	trans	-59.7	-17.8	179.3	52.8	0	0	0	0	115.2	R361	R361-S363 VanDerWaalsContact C-N 3.3Å; R361-S363 VanDerWaalsContact CG-OG 3.24Å; R361-S363 WeakPolarHBondContact CG-OG 3.48Å; R361-S363 PolarHBondContact O-N 2.86Å
364	S	86.8	Confident	90	Very high	45 Å²	45	36.1 Å²	36.1	32%	0.315	18%	0.184	S	C	.	.	G	3₁₀ helix	trans	-121.2	0.1	178.4	70.6	0	0	0	0	114.4	R361 A362 K366	R361-S364 WeakPolarHBondContact CD-OG 3.27Å; R361-S364 WeakPolarHBondContact CG-OG 3.48Å; R361-S364 PolarHBondContact O-N 2.77Å; R361-S364 VanDerWaalsContact O-N 3.1Å; R361-S364 PolarHBondContact O-OG 2.74Å; A362-S364 PolarHBondContact O-N 3.1Å; S364-K366 WeakPolarHBondContact O-CG 3.41Å; S364-K366 PolarHBondContact O-N 3.3Å
365	Q	88.4	Confident	89.8	Confident	70 Å²	70	39.3 Å²	39.3	33%	0.327	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	51	40.4	-174.1	-57.6	-174.7	-10.8	0	0	113.6	R361 A362 K422 L423 E424	R361-Q365 PolarHBondContact O-N 1.98Å; R361-Q365 VanDerWaalsContact O-N 3.08Å; A362-Q365 PolarHBondContact O-N 2.84Å; Q365-K422 PolarHBondContact O-N 3.11Å; Q365-L423 WeakPolarHBondContact CA-O 3.24Å; Q365-L423 WeakPolarHBondContact CB-O 3.41Å; Q365-L423 PolarHBondContact O-N 3.32Å; Q365-L423 VanDerWaalsContact O-N 3.17Å; Q365-E424 PolarHBondContact NE2-OE1 3.09Å; Q365-E424 VanDerWaalsContact NE2-OE1 3.14Å
366	K	88.8	Confident	89	Confident	98 Å²	98	40.9 Å²	40.9	43%	0.426	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	132.9	-177.5	-71.9	171.3	-172.3	178.5	0	111.6	Y360 R361 S364 T419 F420 T421	Y360-K366 VanDerWaalsContact CD2-O 3.27Å; Y360-K366 WeakPolarHBondContact CD2-O 3.46Å; R361-K366 PolarHBondContact N-O 2.41Å; R361-K366 PolarHBondContact O-N 3.15Å; S364-K366 WeakPolarHBondContact O-CG 3.41Å; S364-K366 PolarHBondContact O-N 3.3Å; K366-T419 HydrophobicContact CB-CG2 4.38Å; K366-T419 HydrophobicContact CG-CG2 4.46Å; K366-F420 WeakPolarHBondContact CA-O 3.36Å; K366-T421 HydrophobicContact CG-CG2 4.25Å
367	L	89.1	Confident	88.4	Confident	1 Å²	1	41.4 Å²	41.4	1%	0.005	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	119.3	169	176.6	69.8	0	0	0	108.6	F358 Y360 V369 T419 F420 L423 V433 L456 L459	F358-L367 HydrophobicContact CD1-CD1 4.39Å; Y360-L367 HydrophobicContact CD2-CB 4.04Å; Y360-L367 HydrophobicContact CD2-CD1 4.31Å; L367-V369 HydrophobicContact CD2-CG2 4.06Å; L367-V369 HydrophobicContact CG-CG2 4.01Å; L367-T419 WeakPolarHBondContact O-CA 3.23Å; L367-F420 HydrophobicContact CB-CB 4.3Å; L367-F420 HydrophobicContact CD2-CD2 4.19Å; L367-F420 HydrophobicContact CG-CD2 4.47Å; L367-F420 PolarHBondContact N-O 2.8Å; L367-F420 PolarHBondContact O-N 3.17Å; L367-L423 HydrophobicContact CB-CD1 3.48Å; L367-L423 VanDerWaalsContact CB-CD1 3.48Å; L367-L423 HydrophobicContact CD2-CD1 3.98Å; L367-L423 HydrophobicContact CG-CD1 4.39Å; L367-V433 HydrophobicContact CD2-CG2 4.01Å; L367-L456 HydrophobicContact CD2-CD1 3.65Å; L367-L456 HydrophobicContact CD2-CD2 3.96Å; L367-L456 HydrophobicContact CD2-CG 4.49Å; L367-L459 HydrophobicContact CD1-CD1 3.57Å
368	T	91.4	Very high	87.3	Confident	22 Å²	22	40.9 Å²	40.9	14%	0.135	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	123	173.2	-53.8	0	0	0	0	109.2	E359 K417	E359-T368 PolarHBondContact N-O 2.95Å; E359-T368 PolarHBondContact O-N 3.18Å; T368-K417 HydrophobicContact CG2-CB 4.07Å; T368-K417 HydrophobicContact CG2-CD 3.96Å; T368-K417 HydrophobicContact CG2-CG 4.36Å
369	V	92.9	Very high	85.8	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	109	177.3	-178.4	0	0	0	0	108.1	V356 I357 F358 L367 V392 V418 F420 F435	V356-V369 HydrophobicContact CG1-CG1 3.55Å; I357-V369 CarbonylContact O-C 3.57Å; I357-V369 WeakPolarHBondContact O-CA 3.3Å; F358-V369 HydrophobicContact CD1-CG1 4.41Å; F358-V369 HydrophobicContact CD1-CG2 3.74Å; F358-V369 HydrophobicContact CE1-CG1 4.12Å; F358-V369 HydrophobicContact CE1-CG2 3.86Å; F358-V369 HydrophobicContact CZ-CG1 4.48Å; L367-V369 HydrophobicContact CD2-CG2 4.06Å; L367-V369 HydrophobicContact CG-CG2 4.01Å; V369-V392 HydrophobicContact CG1-CG1 4.45Å; V369-V418 PolarHBondContact N-O 2.84Å; V369-V418 PolarHBondContact O-N 2.89Å; V369-F420 HydrophobicContact CB-CE2 4.19Å; V369-F420 HydrophobicContact CG2-CD2 3.94Å; V369-F420 HydrophobicContact CG2-CE2 3.69Å; V369-F435 HydrophobicContact CG1-CE1 3.72Å; V369-F435 HydrophobicContact CG1-CZ 3.69Å
370	T	92.2	Very high	84.3	Confident	14 Å²	14	50 Å²	50	9%	0.086	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	118.6	177	-46.5	0	0	0	0	109.7	V356 I357 E416 K417	V356-T370 WeakPolarHBondContact CA-O 3.38Å; I357-T370 PolarHBondContact N-O 2.81Å; I357-T370 PolarHBondContact O-N 3.35Å; T370-E416 CarbonylContact C-O 3.56Å; T370-E416 WeakPolarHBondContact CA-O 3.3Å; T370-K417 HydrophobicContact CG2-CG 3.91Å; T370-K417 WeakPolarHBondContact OG1-CG 3.47Å
371	I	92.9	Very high	82.5	Confident	0 Å²	0	56.7 Å²	56.7	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	111.1	174.7	-54.3	89.5	0	0	0	106.9	L354 V390 V392 T404 F414 K415 E416 V418	L354-I371 HydrophobicContact CD1-CG2 3.83Å; L354-I371 HydrophobicContact CG-CG2 4.39Å; I371-V390 HydrophobicContact CG2-CB 4.49Å; I371-V390 HydrophobicContact CG2-CG2 4.28Å; I371-V392 HydrophobicContact CD1-CG2 3.95Å; I371-V392 HydrophobicContact CG1-CG2 4.14Å; I371-T404 HydrophobicContact CB-CG2 4.13Å; I371-T404 HydrophobicContact CD1-CG2 4Å; I371-T404 HydrophobicContact CG1-CG2 4.16Å; I371-T404 HydrophobicContact CG2-CG2 4.34Å; I371-F414 HydrophobicContact CB-CB 4.44Å; I371-F414 HydrophobicContact CG2-CB 4.24Å; I371-F414 HydrophobicContact CG2-CD2 3.86Å; I371-F414 HydrophobicContact CG2-CG 4.25Å; I371-K415 VanDerWaalsContact O-CA 3.26Å; I371-K415 WeakPolarHBondContact O-CA 3.41Å; I371-K415 PolarHBondContact O-N 3.07Å; I371-E416 PolarHBondContact N-O 3.08Å; I371-E416 PolarHBondContact O-N 3.36Å; I371-V418 HydrophobicContact CD1-CB 4.49Å; I371-V418 HydrophobicContact CD1-CG2 3.76Å
372	V	91.8	Very high	80.9	Confident	36 Å²	36	56 Å²	56	22%	0.218	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	-63	-171.6	-176.4	0	0	0	0	110.4	D355 I357 F414 K415	D355-V372 HydrophobicContact CB-CB 4.12Å; D355-V372 WeakPolarHBondContact O-CB 3.35Å; D355-V372 PolarHBondContact O-N 2.8Å; I357-V372 HydrophobicContact CD1-CG2 3.53Å; I357-V372 HydrophobicContact CG1-CG2 3.66Å; V372-F414 PolarHBondContact O-N 2.86Å; V372-K415 PolarHBondContact O-N 3.07Å; V372-K415 VanDerWaalsContact O-N 3.1Å
373	R	90.1	Very high	79.6	Confident	98 Å²	98	55.1 Å²	55.1	37%	0.37	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.9	162.1	-177.4	63	-178.5	-178.6	-176.4	1.9	110.2	D355 Q375 P412 V413	D355-R373 HydrophobicContact CB-CG 4.01Å; D355-R373 PolarHBondContact N-O 3.38Å; D355-R373 IonicContact OD2-CZ 2.76Å; D355-R373 IonicContact OD2-NE 3.67Å; D355-R373 PolarHBondContact OD2-NE 3.33Å; D355-R373 IonicContact OD2-NH2 3.15Å; D355-R373 PolarHBondContact OD2-NH2 2.92Å; R373-Q375 HydrophobicContact CG-CG 4.45Å; R373-Q375 VanDerWaalsContact CZ-NE2 3.32Å; R373-P412 CarbonylContact C-O 3.53Å; R373-P412 WeakPolarHBondContact CA-O 3.27Å; R373-P412 WeakPolarHBondContact CB-O 3.19Å; R373-V413 HydrophobicContact CB-CG2 4.1Å
374	A	88.6	Confident	78.2	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	152.6	162.8	0	0	0	0	0	110.8	D353 L354 L377 N411 P412 F414	D353-A374 CarbonylContact O-C 3.58Å; D353-A374 VanDerWaalsContact O-CA 3.23Å; D353-A374 WeakPolarHBondContact O-CA 3.44Å; L354-A374 HydrophobicContact CD1-CB 3.83Å; A374-L377 HydrophobicContact CB-CD1 4Å; A374-L377 HydrophobicContact CB-CD2 3.9Å; A374-L377 HydrophobicContact CB-CG 4.13Å; A374-N411 CarbonylContact O-C 3.51Å; A374-N411 VanDerWaalsContact O-CA 3.26Å; A374-N411 WeakPolarHBondContact O-CA 3.34Å; A374-P412 HydrophobicContact CB-CG 3.99Å; A374-P412 PolarHBondContact N-O 2.82Å; A374-F414 HydrophobicContact CB-CE2 4.38Å
375	Q	84.7	Confident	77.3	Confident	67 Å²	67	50.6 Å²	50.6	31%	0.313	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	162.2	-179.9	-55.5	-162.9	-43.5	0	0	110.3	G352 D353 R373 L377	G352-Q375 CarbonylContact C-O 3.54Å; G352-Q375 WeakPolarHBondContact CA-O 3.14Å; D353-Q375 PolarHBondContact N-O 3.08Å; D353-Q375 PolarHBondContact O-N 3.12Å; R373-Q375 HydrophobicContact CG-CG 4.45Å; R373-Q375 VanDerWaalsContact CZ-NE2 3.32Å; Q375-L377 PolarHBondContact O-N 3.32Å
376	G	74.7	Confident	76.5	Confident	55 Å²	55	51 Å²	51	57%	0.567	27%	0.268	S	S	*	.	S	Bend	trans	61.6	26.4	178	0	0	0	0	0	114.5	G352	G352-G376 WeakPolarHBondContact CA-O 3.43Å; G352-G376 PolarHBondContact N-O 3.45Å
377	L	79.6	Confident	76.3	Confident	13 Å²	13	47 Å²	47	7%	0.068	25%	0.253	C	S	.	.	P	Polyproline II helix	trans	-70.8	147.4	-179.5	-61.1	-168	0	0	0	111.2	A374 Q375 W388 P412 L437	A374-L377 HydrophobicContact CB-CD1 4Å; A374-L377 HydrophobicContact CB-CD2 3.9Å; A374-L377 HydrophobicContact CB-CG 4.13Å; Q375-L377 PolarHBondContact O-N 3.32Å; L377-W388 HydrophobicContact CB-CH2 3.95Å; L377-W388 HydrophobicContact CB-CZ2 3.73Å; L377-W388 HydrophobicContact CD1-CB 4.39Å; L377-W388 HydrophobicContact CD1-CD2 3.45Å; L377-W388 VanDerWaalsContact CD1-CD2 3.45Å; L377-W388 VanDerWaalsContact CD1-CE2 3.46Å; L377-W388 HydrophobicContact CD1-CE3 3.97Å; L377-W388 HydrophobicContact CD1-CG 3.63Å; L377-W388 HydrophobicContact CD1-CH2 4.41Å; L377-W388 HydrophobicContact CD1-CZ2 3.98Å; L377-W388 HydrophobicContact CD1-CZ3 4.41Å; L377-P412 VanDerWaalsContact CD1-CD 3.48Å; L377-P412 HydrophobicContact CD1-CG 3.56Å; L377-L437 HydrophobicContact CD1-CD2 4.2Å; L377-L437 HydrophobicContact CD2-CD2 3.42Å; L377-L437 VanDerWaalsContact CD2-CD2 3.42Å; L377-L437 HydrophobicContact CG-CD2 4.43Å
378	P	67.3	Low	76.1	Confident	15 Å²	15	47.2 Å²	47.2	10%	0.097	25%	0.254	C	S	.	.	P	Polyproline II helix	trans	-64.9	139.3	-175.6	25	-33.2	0	0	0	112.4	R382 W388 M449	P378-R382 HydrophobicContact CB-CB 4.4Å; P378-W388 HydrophobicContact CG-CH2 3.98Å; P378-W388 HydrophobicContact CG-CZ3 4.37Å; P378-W388 WeakPolarHBondContact O-CH2 3.46Å; P378-M449 HydrophobicContact CG-SD 4.21Å
379	D	61.3	Low	76	Confident	114 Å²	114	47.2 Å²	47.2	61%	0.61	25%	0.252	S	S	*	.	P	Polyproline II helix	trans	-56.7	160.6	-175.3	-73.1	-59.2	0	0	0	114.8	D381 R382 S383	D379-D381 PolarHBondContact O-N 2.87Å; D379-D381 VanDerWaalsContact O-N 3.09Å; D379-R382 PolarHBondContact O-N 3.01Å; D379-S383 PolarHBondContact O-N 3.12Å
380	K	59	Low	75.9	Confident	140 Å²	140	47.2 Å²	47.2	61%	0.609	25%	0.252	S	S	*	.	H	α-helix	trans	-52.7	-35.1	-176.3	-174.2	-173.5	170.6	-161.8	0	112.7	G384	K380-G384 WeakPolarHBondContact O-CA 3.45Å; K380-G384 PolarHBondContact O-N 2.93Å
381	D	51.8	Low	75.8	Confident	150 Å²	150	47.4 Å²	47.4	80%	0.802	25%	0.252	S	S	*	.	H	α-helix	trans	-75.4	-26.8	-179.2	-52.6	-72.4	0	0	0	112.7	D379	D379-D381 PolarHBondContact O-N 2.87Å; D379-D381 VanDerWaalsContact O-N 3.09Å
382	R	55.6	Low	75.7	Confident	114 Å²	114	47.4 Å²	47.4	43%	0.43	25%	0.252	S	S	.	.	H	α-helix	trans	-90.1	-38.7	175.5	-68	-177.7	61.4	-124.4	-6.4	113	P378 D379 R447	P378-R382 HydrophobicContact CB-CB 4.4Å; D379-R382 PolarHBondContact O-N 3.01Å; R382-R447 PolarHBondContact O-NH1 3.12Å; R382-R447 PolarHBondContact O-NH2 2.8Å
383	S	57.3	Low	75.6	Confident	7 Å²	7	47.2 Å²	47.2	5%	0.049	25%	0.251	C	S	.	.	H	α-helix	trans	-79.1	-32.3	178.2	-177.9	0	0	0	0	112.3	D379 V385 W388 R447	D379-S383 PolarHBondContact O-N 3.12Å; S383-V385 WeakPolarHBondContact CB-O 3.46Å; S383-V385 PolarHBondContact O-N 3.16Å; S383-V385 PolarHBondContact OG-O 3.07Å; S383-V385 VanDerWaalsContact OG-O 3.13Å; S383-W388 VanDerWaalsContact OG-CH2 3.28Å; S383-W388 WeakPolarHBondContact OG-CH2 3.44Å; S383-W388 WeakPolarHBondContact OG-CZ3 3.34Å; S383-R447 PolarHBondContact O-NH1 2.85Å; S383-R447 VanDerWaalsContact O-NH1 3.13Å
384	G	58.8	Low	75.5	Confident	31 Å²	31	43 Å²	43	32%	0.32	24%	0.235	S	C	.	.	S	Bend	trans	77.5	-3.4	-173.4	0	0	0	0	0	114.1	K380 R441	K380-G384 WeakPolarHBondContact O-CA 3.45Å; K380-G384 PolarHBondContact O-N 2.93Å; G384-R441 PolarHBondContact O-NE 2.8Å; G384-R441 PolarHBondContact O-NH2 3.16Å
385	V	66.3	Low	75.2	Confident	17 Å²	17	44.1 Å²	44.1	10%	0.103	24%	0.241	C	C	.	.			trans	-151.8	166	176.2	-66.7	0	0	0	0	110.1	S383 A439 R441	S383-V385 WeakPolarHBondContact CB-O 3.46Å; S383-V385 PolarHBondContact O-N 3.16Å; S383-V385 PolarHBondContact OG-O 3.07Å; S383-V385 VanDerWaalsContact OG-O 3.13Å; V385-A439 HydrophobicContact CG2-CB 3.57Å; V385-R441 HydrophobicContact CG1-CB 3.74Å; V385-R441 HydrophobicContact CG1-CG 3.45Å; V385-R441 VanDerWaalsContact CG1-CG 3.45Å; V385-R441 VanDerWaalsContact CG1-NE 3.31Å
386	N	73.4	Confident	74.3	Confident	78 Å²	78	45.8 Å²	45.8	42%	0.417	26%	0.258	S	S	.	.	S	Bend	trans	-122.2	25.8	173.8	64.6	-8	0	0	0	112.2	R408 G409	N386-R408 CarbonylContact O-C 3.58Å; N386-R408 VanDerWaalsContact O-CA 3.24Å; N386-R408 WeakPolarHBondContact O-CA 3.46Å; N386-G409 PolarHBondContact O-N 3.49Å
387	S	83.5	Confident	73.8	Confident	16 Å²	16	45 Å²	45	11%	0.112	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	128.7	178.2	22.8	0	0	0	0	110.3	Q407 A439 A440	S387-Q407 CarbonylContact C-O 3.56Å; S387-Q407 WeakPolarHBondContact CA-O 3.42Å; S387-A439 CarbonylContact O-C 3.59Å; S387-A439 WeakPolarHBondContact O-CA 3.34Å; S387-A440 WeakPolarHBondContact CB-O 3.3Å; S387-A440 PolarHBondContact O-N 3.27Å; S387-A440 PolarHBondContact OG-O 2.87Å
388	W	86.2	Confident	72.9	Confident	5 Å²	5	52.3 Å²	52.3	2%	0.019	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	144.7	-167.4	-47.8	100.7	0	0	0	111.4	L377 P378 S383 I406 Q407 G409 P412 F414 L437 Y438 A439 M449	L377-W388 HydrophobicContact CB-CH2 3.95Å; L377-W388 HydrophobicContact CB-CZ2 3.73Å; L377-W388 HydrophobicContact CD1-CB 4.39Å; L377-W388 HydrophobicContact CD1-CD2 3.45Å; L377-W388 VanDerWaalsContact CD1-CD2 3.45Å; L377-W388 VanDerWaalsContact CD1-CE2 3.46Å; L377-W388 HydrophobicContact CD1-CE3 3.97Å; L377-W388 HydrophobicContact CD1-CG 3.63Å; L377-W388 HydrophobicContact CD1-CH2 4.41Å; L377-W388 HydrophobicContact CD1-CZ2 3.98Å; L377-W388 HydrophobicContact CD1-CZ3 4.41Å; P378-W388 HydrophobicContact CG-CH2 3.98Å; P378-W388 HydrophobicContact CG-CZ3 4.37Å; P378-W388 WeakPolarHBondContact O-CH2 3.46Å; S383-W388 VanDerWaalsContact OG-CH2 3.28Å; S383-W388 WeakPolarHBondContact OG-CH2 3.44Å; S383-W388 WeakPolarHBondContact OG-CZ3 3.34Å; W388-I406 WeakPolarHBondContact O-CA 3.45Å; W388-Q407 PolarHBondContact N-O 2.86Å; W388-Q407 PolarHBondContact O-N 3.1Å; W388-G409 VanDerWaalsContact CD1-O 3.29Å; W388-G409 PolarHBondContact NE1-O 2.88Å; W388-P412 HydrophobicContact CB-CB 4.45Å; W388-P412 HydrophobicContact CB-CG 4.06Å; W388-P412 HydrophobicContact CG-CG 4.01Å; W388-F414 HydrophobicContact CB-CZ 4.22Å; W388-L437 HydrophobicContact CB-CD1 4.17Å; W388-L437 HydrophobicContact CE3-CD2 4.13Å; W388-L437 HydrophobicContact CE3-CG 4.35Å; W388-L437 HydrophobicContact CZ3-CD2 4.44Å; W388-Y438 CarbonylContact C-O 3.5Å; W388-Y438 WeakPolarHBondContact CA-O 3.34Å; W388-A439 HydrophobicContact CE3-CB 4.35Å; W388-A439 HydrophobicContact CZ3-CB 4.23Å; W388-M449 HydrophobicContact CE3-CG 4.29Å; W388-M449 HydrophobicContact CZ3-CG 3.78Å; W388-M449 HydrophobicContact CZ3-SD 3.85Å
389	Q	88.9	Confident	72.6	Confident	22 Å²	22	61.2 Å²	61.2	10%	0.103	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	137.8	175.7	-168.3	-178.4	42.7	0	0	109.7	H391 T404 I406 Y438	Q389-H391 PolarHBondContact OE1-NE2 3.22Å; Q389-T404 VanDerWaalsContact CG-O 3.27Å; Q389-T404 WeakPolarHBondContact CG-O 3.38Å; Q389-T404 PolarHBondContact NE2-O 2.7Å; Q389-I406 HydrophobicContact CB-CG1 4.27Å; Q389-I406 HydrophobicContact CG-CG1 4.39Å; Q389-Y438 PolarHBondContact N-O 3.46Å; Q389-Y438 PolarHBondContact O-N 2.81Å
390	V	89.7	Confident	73.3	Confident	0 Å²	0	58.1 Å²	58.1	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	126.5	174.4	-176.8	0	0	0	0	109.2	L354 I371 V392 R403 T404 F414 F435 R436 L437	L354-V390 HydrophobicContact CD1-CG2 3.93Å; L354-V390 HydrophobicContact CD2-CG1 4.04Å; L354-V390 HydrophobicContact CD2-CG2 4.45Å; I371-V390 HydrophobicContact CG2-CB 4.49Å; I371-V390 HydrophobicContact CG2-CG2 4.28Å; V390-V392 HydrophobicContact CG1-CG2 3.9Å; V390-R403 CarbonylContact O-C 3.54Å; V390-R403 WeakPolarHBondContact O-CA 3.45Å; V390-T404 HydrophobicContact CB-CG2 3.93Å; V390-T404 PolarHBondContact N-OG1 3.05Å; V390-T404 PolarHBondContact O-N 3.16Å; V390-F414 HydrophobicContact CG2-CD2 4.48Å; V390-F414 HydrophobicContact CG2-CE2 3.88Å; V390-F414 HydrophobicContact CG2-CZ 3.91Å; V390-F435 HydrophobicContact CG1-CD1 4.25Å; V390-R436 CarbonylContact C-O 3.58Å; V390-R436 WeakPolarHBondContact CA-O 3.21Å; V390-L437 HydrophobicContact CG2-CD1 3.78Å
391	H	89.8	Confident	74.5	Confident	17 Å²	17	61 Å²	61	8%	0.079	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	134.8	168.3	-64.6	-157.9	0	0	0	107.8	Q389 R403 R436 Y438 E446	Q389-H391 PolarHBondContact OE1-NE2 3.22Å; H391-R403 HydrophobicContact CB-CG 4.37Å; H391-R403 PolarHBondContact CE1-NE 3.29Å; H391-R403 PolarHBondContact ND1-NE 3.32Å; H391-R403 VanDerWaalsContact ND1-NE 3.2Å; H391-R436 PolarHBondContact N-O 3.27Å; H391-R436 PolarHBondContact O-N 3.33Å; H391-Y438 HydrophobicContact CB-CD2 4.28Å; H391-Y438 HydrophobicContact CB-CE2 3.92Å; H391-Y438 AromaticContact CD2-CD2 3.52Å; H391-Y438 AromaticContact CD2-CE2 3.86Å; H391-Y438 AromaticContact CE1-CD2 3.99Å; H391-Y438 AromaticContact CE1-CE2 3.89Å; H391-Y438 AromaticContact CG-CD2 3.76Å; H391-Y438 AromaticContact CG-CE2 3.59Å; H391-Y438 AromaticContact ND1-CE2 3.69Å; H391-Y438 AromaticContact NE2-CD2 3.69Å; H391-E446 IonicContact CE1-OE2 3.06Å; H391-E446 IonicContact NE2-OE2 3.21Å
392	V	90.9	Very high	76	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	125.9	-176.4	-169.9	0	0	0	0	108.6	V369 I371 V390 R401 G402 F420 V433 R434 F435	V369-V392 HydrophobicContact CG1-CG1 4.45Å; I371-V392 HydrophobicContact CD1-CG2 3.95Å; I371-V392 HydrophobicContact CG1-CG2 4.14Å; V390-V392 HydrophobicContact CG1-CG2 3.9Å; V392-R401 CarbonylContact O-C 3.54Å; V392-R401 WeakPolarHBondContact O-CA 3.49Å; V392-G402 PolarHBondContact N-O 3.49Å; V392-G402 PolarHBondContact O-N 3.22Å; V392-F420 HydrophobicContact CB-CZ 4.46Å; V392-F420 HydrophobicContact CG1-CE2 4.16Å; V392-F420 HydrophobicContact CG1-CZ 3.85Å; V392-V433 HydrophobicContact CG1-CG1 3.31Å; V392-R434 WeakPolarHBondContact CA-O 3.41Å; V392-F435 HydrophobicContact CG1-CD1 4.1Å; V392-F435 HydrophobicContact CG1-CE1 3.75Å; V392-F435 HydrophobicContact CG1-CZ 4.18Å; V392-F435 HydrophobicContact CG2-CD1 3.78Å; V392-F435 HydrophobicContact CG2-CE1 3.92Å
393	V	89.8	Confident	77.5	Confident	32 Å²	32	55.9 Å²	55.9	19%	0.194	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	131.8	-175.3	-178.9	0	0	0	0	110	L395 R401 R434	V393-L395 HydrophobicContact CG1-CD2 4.42Å; V393-R401 HydrophobicContact CG2-CB 4.19Å; V393-R434 PolarHBondContact N-O 3.37Å; V393-R434 PolarHBondContact O-N 3.29Å
394	L	87.8	Confident	79	Confident	10 Å²	10	55.8 Å²	55.8	5%	0.052	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	139.8	172.3	-176.3	68.7	0	0	0	110.4	G397 Q400 F420 L423 C431 V433 L456	L394-G397 CarbonylContact O-C 3.59Å; L394-Q400 PolarHBondContact N-O 3.4Å; L394-F420 HydrophobicContact CB-CD1 3.76Å; L394-F420 HydrophobicContact CB-CE1 3.82Å; L394-F420 HydrophobicContact CB-CG 4.38Å; L394-F420 HydrophobicContact CB-CZ 4.47Å; L394-F420 HydrophobicContact CD2-CB 4.21Å; L394-F420 HydrophobicContact CD2-CD1 4.16Å; L394-F420 HydrophobicContact CD2-CG 4.33Å; L394-L423 HydrophobicContact CD1-CD1 4.31Å; L394-L423 HydrophobicContact CD1-CD2 4.35Å; L394-L423 HydrophobicContact CD2-CD1 3.99Å; L394-L423 HydrophobicContact CD2-CD2 3.93Å; L394-L423 HydrophobicContact CD2-CG 4.08Å; L394-C431 HydrophobicContact CD1-CB 4.23Å; L394-V433 HydrophobicContact CD1-CG2 3.98Å; L394-L456 HydrophobicContact CD1-CD1 4.13Å
395	L	83.5	Confident	80.2	Confident	24 Å²	24	59.2 Å²	59.2	13%	0.126	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	150	178.5	-61.9	171.8	0	0	0	109.7	V393 K398 C431 A432 R434 L453	V393-L395 HydrophobicContact CG1-CD2 4.42Å; L395-K398 HydrophobicContact CD2-CG 4.09Å; L395-C431 VanDerWaalsContact O-CA 3.31Å; L395-C431 WeakPolarHBondContact O-CA 3.41Å; L395-C431 WeakPolarHBondContact O-CB 3.39Å; L395-C431 PolarHBondContact O-SG 2.88Å; L395-A432 WeakPolarHBondContact CB-O 3.31Å; L395-A432 PolarHBondContact N-O 3.21Å; L395-A432 PolarHBondContact O-N 2.61Å; L395-A432 VanDerWaalsContact O-N 3.08Å; L395-R434 HydrophobicContact CD1-CB 3.96Å; L395-L453 HydrophobicContact CD1-CD1 3.79Å
396	P	66.1	Low	81.1	Confident	101 Å²	101	62 Å²	62	66%	0.656	30%	0.304	S	S	*	.	S	Bend	cis	-77.8	-24.1	7.8	30	-35.5	0	0	0	114.5	K398	P396-K398 PolarHBondContact O-N 2.98Å
397	G	62.5	Low	81.6	Confident	40 Å²	40	61.2 Å²	61.2	41%	0.412	30%	0.298	S	S	.	.			trans	-73.5	89.7	-177.9	0	0	0	0	0	113.6	L394 K399	L394-G397 CarbonylContact O-C 3.59Å; G397-K399 PolarHBondContact O-N 3.39Å
398	K	62.1	Low	81.4	Confident	166 Å²	166	68.5 Å²	68.5	72%	0.722	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	8.8	175.9	-59.5	175.1	-174.8	166.3	0	116	L395 P396	L395-K398 HydrophobicContact CD2-CG 4.09Å; P396-K398 PolarHBondContact O-N 2.98Å
399	K	61.4	Low	80.9	Confident	201 Å²	201	69.1 Å²	69.1	87%	0.874	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.4	-29.4	-178	-62.4	-176.3	178.9	-179.1	0	112.6	G397	G397-K399 PolarHBondContact O-N 3.39Å
400	Q	74.6	Confident	80.1	Confident	50 Å²	50	72.3 Å²	72.3	23%	0.234	35%	0.354	C	S	.	.			trans	-108.3	123.5	-179.4	-57.4	-173.4	32.2	0	0	111.4	L394 F420 T421	L394-Q400 PolarHBondContact N-O 3.4Å; Q400-F420 HydrophobicContact CB-CD1 3.73Å; Q400-F420 HydrophobicContact CB-CE1 4.14Å; Q400-F420 VanDerWaalsContact OE1-CA 3.29Å; Q400-T421 PolarHBondContact NE2-O 3.18Å; Q400-T421 PolarHBondContact OE1-O 3.07Å
401	R	84.7	Confident	79.6	Confident	199 Å²	199	76.2 Å²	76.2	75%	0.751	38%	0.375	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-141.6	136.4	-176.8	65.6	-172.1	-176.2	-164	-1.1	110.3	V392 V393	V392-R401 CarbonylContact O-C 3.54Å; V392-R401 WeakPolarHBondContact O-CA 3.49Å; V393-R401 HydrophobicContact CG2-CB 4.19Å
402	G	83.5	Confident	79.3	Confident	13 Å²	13	75.4 Å²	75.4	13%	0.134	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	160.6	169.3	0	0	0	0	0	111.3	V392	V392-G402 PolarHBondContact N-O 3.49Å; V392-G402 PolarHBondContact O-N 3.22Å
403	R	87.3	Confident	79.1	Confident	145 Å²	145	78.6 Å²	78.6	55%	0.547	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	141.9	170.9	-64.6	-177.2	174.3	159.6	-3.4	108	V390 H391	V390-R403 CarbonylContact O-C 3.54Å; V390-R403 WeakPolarHBondContact O-CA 3.45Å; H391-R403 HydrophobicContact CB-CG 4.37Å; H391-R403 PolarHBondContact CE1-NE 3.29Å; H391-R403 PolarHBondContact ND1-NE 3.32Å; H391-R403 VanDerWaalsContact ND1-NE 3.2Å
404	T	88.3	Confident	78.9	Confident	4 Å²	4	77.6 Å²	77.6	3%	0.025	38%	0.383	C	S	.	.			trans	-77.9	168.6	169	67.6	0	0	0	0	110.9	I371 Q389 V390 F414 E416	I371-T404 HydrophobicContact CB-CG2 4.13Å; I371-T404 HydrophobicContact CD1-CG2 4Å; I371-T404 HydrophobicContact CG1-CG2 4.16Å; I371-T404 HydrophobicContact CG2-CG2 4.34Å; Q389-T404 VanDerWaalsContact CG-O 3.27Å; Q389-T404 WeakPolarHBondContact CG-O 3.38Å; Q389-T404 PolarHBondContact NE2-O 2.7Å; V390-T404 HydrophobicContact CB-CG2 3.93Å; V390-T404 PolarHBondContact N-OG1 3.05Å; V390-T404 PolarHBondContact O-N 3.16Å; T404-F414 HydrophobicContact CG2-CB 4.28Å; T404-F414 HydrophobicContact CG2-CD1 3.99Å; T404-F414 HydrophobicContact CG2-CG 4.18Å; T404-F414 VanDerWaalsContact OG1-CD1 3.31Å; T404-F414 WeakPolarHBondContact OG1-CD1 3.46Å; T404-F414 WeakPolarHBondContact OG1-CE1 3.26Å; T404-E416 WeakPolarHBondContact CA-OE2 3.45Å; T404-E416 HydrophobicContact CG2-CB 4.39Å
405	N	84.3	Confident	78.9	Confident	103 Å²	103	84.5 Å²	84.5	55%	0.551	41%	0.413	S	S	*	.			trans	-66.9	164.4	161.3	-155.9	-12.9	0	0	0	110.5	Q407 F414 E416	N405-Q407 PolarHBondContact O-N 3.13Å; N405-F414 WeakPolarHBondContact O-CE1 3.5Å; N405-E416 VanDerWaalsContact CB-OE1 3.23Å; N405-E416 WeakPolarHBondContact CB-OE1 3.42Å; N405-E416 PolarHBondContact N-OE1 3.19Å; N405-E416 PolarHBondContact N-OE2 2.84Å
406	I	84.8	Confident	79.2	Confident	75 Å²	75	85.8 Å²	85.8	39%	0.385	42%	0.418	S	S	.	.			trans	-87.5	109.2	-179.1	-58.9	170.1	0	0	0	108.9	W388 Q389 A440	W388-I406 WeakPolarHBondContact O-CA 3.45Å; Q389-I406 HydrophobicContact CB-CG1 4.27Å; Q389-I406 HydrophobicContact CG-CG1 4.39Å; I406-A440 HydrophobicContact CD1-CB 4.03Å; I406-A440 HydrophobicContact CG1-CB 4.23Å; I406-A440 HydrophobicContact CG2-CB 3.91Å
407	Q	83.9	Confident	80.3	Confident	63 Å²	63	87.4 Å²	87.4	29%	0.294	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	150.4	179.9	-66.1	-64.5	-8.6	0	0	111.3	S387 W388 N405 P412 V413 F414	S387-Q407 CarbonylContact C-O 3.56Å; S387-Q407 WeakPolarHBondContact CA-O 3.42Å; W388-Q407 PolarHBondContact N-O 2.86Å; W388-Q407 PolarHBondContact O-N 3.1Å; N405-Q407 PolarHBondContact O-N 3.13Å; Q407-P412 HydrophobicContact CB-CB 3.56Å; Q407-V413 WeakPolarHBondContact CG-O 3.45Å; Q407-F414 HydrophobicContact CB-CD1 4.04Å; Q407-F414 HydrophobicContact CB-CE1 3.74Å; Q407-F414 HydrophobicContact CB-CZ 4.29Å; Q407-F414 HydrophobicContact CG-CD1 3.42Å; Q407-F414 VanDerWaalsContact CG-CD1 3.42Å; Q407-F414 HydrophobicContact CG-CE1 3.66Å; Q407-F414 HydrophobicContact CG-CG 4.17Å
408	R	80	Confident	81.7	Confident	169 Å²	169	86.3 Å²	86.3	64%	0.638	40%	0.4	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.9	148.8	-178	-62.9	-169.9	-164	152.8	15	112.9	N386	N386-R408 CarbonylContact O-C 3.58Å; N386-R408 VanDerWaalsContact O-CA 3.24Å; N386-R408 WeakPolarHBondContact O-CA 3.46Å
409	G	76.1	Confident	83	Confident	17 Å²	17	82 Å²	82	18%	0.175	39%	0.388	C	S	.	.	S	Bend	trans	116	172.9	177.1	0	0	0	0	0	113.2	N386 W388 N411	N386-G409 PolarHBondContact O-N 3.49Å; W388-G409 VanDerWaalsContact CD1-O 3.29Å; W388-G409 PolarHBondContact NE1-O 2.88Å; G409-N411 VanDerWaalsContact C-N 3.28Å; G409-N411 PolarHBondContact O-N 2.78Å
410	P	70.5	Confident	84.3	Confident	90 Å²	90	72.5 Å²	72.5	58%	0.584	35%	0.346	S	S	*	.	S	Bend	trans	-69.7	-25.5	179.6	28	-34.5	0	0	0	113.1
411	N	79.4	Confident	84.9	Confident	81 Å²	81	72.8 Å²	72.8	43%	0.433	35%	0.352	S	S	.	.	S	Bend	trans	-127.5	73	-180	-56.8	87	0	0	0	109.9	A374 G409 V413	A374-N411 CarbonylContact O-C 3.51Å; A374-N411 VanDerWaalsContact O-CA 3.26Å; A374-N411 WeakPolarHBondContact O-CA 3.34Å; G409-N411 VanDerWaalsContact C-N 3.28Å; G409-N411 PolarHBondContact O-N 2.78Å; N411-V413 PolarHBondContact O-N 2.99Å
412	P	83.4	Confident	84.8	Confident	1 Å²	1	71.8 Å²	71.8	1%	0.006	35%	0.353	C	S	.	.			trans	-64.5	131.2	-178	27.8	-35.2	0	0	0	110.8	R373 A374 L377 W388 Q407 F414	R373-P412 CarbonylContact C-O 3.53Å; R373-P412 WeakPolarHBondContact CA-O 3.27Å; R373-P412 WeakPolarHBondContact CB-O 3.19Å; A374-P412 HydrophobicContact CB-CG 3.99Å; A374-P412 PolarHBondContact N-O 2.82Å; L377-P412 VanDerWaalsContact CD1-CD 3.48Å; L377-P412 HydrophobicContact CD1-CG 3.56Å; W388-P412 HydrophobicContact CB-CB 4.45Å; W388-P412 HydrophobicContact CB-CG 4.06Å; W388-P412 HydrophobicContact CG-CG 4.01Å; Q407-P412 HydrophobicContact CB-CB 3.56Å; P412-F414 HydrophobicContact CB-CE2 3.97Å; P412-F414 HydrophobicContact CB-CZ 3.88Å; P412-F414 HydrophobicContact CG-CE2 3.88Å; P412-F414 HydrophobicContact CG-CZ 3.96Å
413	V	86.8	Confident	84.8	Confident	67 Å²	67	71.4 Å²	71.4	41%	0.406	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	116.1	175.1	178.1	0	0	0	0	107.7	R373 Q407 N411 K415	R373-V413 HydrophobicContact CB-CG2 4.1Å; Q407-V413 WeakPolarHBondContact CG-O 3.45Å; N411-V413 PolarHBondContact O-N 2.99Å; V413-K415 HydrophobicContact CG1-CD 3.85Å; V413-K415 HydrophobicContact CG1-CG 3.74Å
414	F	86.9	Confident	84.7	Confident	11 Å²	11	68.7 Å²	68.7	5%	0.048	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	-55.8	-179.1	-58.9	-82.8	0	0	0	110.3	I371 V372 A374 W388 V390 T404 N405 Q407 P412 E416	I371-F414 HydrophobicContact CB-CB 4.44Å; I371-F414 HydrophobicContact CG2-CB 4.24Å; I371-F414 HydrophobicContact CG2-CD2 3.86Å; I371-F414 HydrophobicContact CG2-CG 4.25Å; V372-F414 PolarHBondContact O-N 2.86Å; A374-F414 HydrophobicContact CB-CE2 4.38Å; W388-F414 HydrophobicContact CB-CZ 4.22Å; V390-F414 HydrophobicContact CG2-CD2 4.48Å; V390-F414 HydrophobicContact CG2-CE2 3.88Å; V390-F414 HydrophobicContact CG2-CZ 3.91Å; T404-F414 HydrophobicContact CG2-CB 4.28Å; T404-F414 HydrophobicContact CG2-CD1 3.99Å; T404-F414 HydrophobicContact CG2-CG 4.18Å; T404-F414 VanDerWaalsContact OG1-CD1 3.31Å; T404-F414 WeakPolarHBondContact OG1-CD1 3.46Å; T404-F414 WeakPolarHBondContact OG1-CE1 3.26Å; N405-F414 WeakPolarHBondContact O-CE1 3.5Å; Q407-F414 HydrophobicContact CB-CD1 4.04Å; Q407-F414 HydrophobicContact CB-CE1 3.74Å; Q407-F414 HydrophobicContact CB-CZ 4.29Å; Q407-F414 HydrophobicContact CG-CD1 3.42Å; Q407-F414 VanDerWaalsContact CG-CD1 3.42Å; Q407-F414 HydrophobicContact CG-CE1 3.66Å; Q407-F414 HydrophobicContact CG-CG 4.17Å; P412-F414 HydrophobicContact CB-CE2 3.97Å; P412-F414 HydrophobicContact CB-CZ 3.88Å; P412-F414 HydrophobicContact CG-CE2 3.88Å; P412-F414 HydrophobicContact CG-CZ 3.96Å; F414-E416 PolarHBondContact O-N 2.9Å
415	K	86.8	Confident	84.4	Confident	155 Å²	155	71.8 Å²	71.8	67%	0.674	36%	0.361	S	S	*	.	E	Extended strand (participates in β ladder)	trans	53.4	31	-172.5	-66.1	173.9	176.2	179.2	0	113.5	I371 V372 V413	I371-K415 VanDerWaalsContact O-CA 3.26Å; I371-K415 WeakPolarHBondContact O-CA 3.41Å; I371-K415 PolarHBondContact O-N 3.07Å; V372-K415 PolarHBondContact O-N 3.07Å; V372-K415 VanDerWaalsContact O-N 3.1Å; V413-K415 HydrophobicContact CG1-CD 3.85Å; V413-K415 HydrophobicContact CG1-CG 3.74Å
416	E	89.9	Confident	84.3	Confident	51 Å²	51	77.3 Å²	77.3	24%	0.238	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	141	-175.5	-73.7	173.6	-116.7	0	0	111.5	T370 I371 T404 N405 F414	T370-E416 CarbonylContact C-O 3.56Å; T370-E416 WeakPolarHBondContact CA-O 3.3Å; I371-E416 PolarHBondContact N-O 3.08Å; I371-E416 PolarHBondContact O-N 3.36Å; T404-E416 WeakPolarHBondContact CA-OE2 3.45Å; T404-E416 HydrophobicContact CG2-CB 4.39Å; N405-E416 VanDerWaalsContact CB-OE1 3.23Å; N405-E416 WeakPolarHBondContact CB-OE1 3.42Å; N405-E416 PolarHBondContact N-OE1 3.19Å; N405-E416 PolarHBondContact N-OE2 2.84Å; F414-E416 PolarHBondContact O-N 2.9Å
417	K	89.8	Confident	84.2	Confident	135 Å²	135	78 Å²	78	59%	0.587	38%	0.379	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.6	123	-179.2	-61.6	-162	168	-162.9	0	110.9	T368 T370	T368-K417 HydrophobicContact CG2-CB 4.07Å; T368-K417 HydrophobicContact CG2-CD 3.96Å; T368-K417 HydrophobicContact CG2-CG 4.36Å; T370-K417 HydrophobicContact CG2-CG 3.91Å; T370-K417 WeakPolarHBondContact OG1-CG 3.47Å
418	V	90.3	Very high	84.1	Confident	17 Å²	17	75.5 Å²	75.5	10%	0.103	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	116.3	171.1	178.5	0	0	0	0	108.2	V369 I371 F420	V369-V418 PolarHBondContact N-O 2.84Å; V369-V418 PolarHBondContact O-N 2.89Å; I371-V418 HydrophobicContact CD1-CB 4.49Å; I371-V418 HydrophobicContact CD1-CG2 3.76Å; V418-F420 HydrophobicContact CB-CE2 4.49Å; V418-F420 HydrophobicContact CG1-CE1 4.1Å; V418-F420 HydrophobicContact CG1-CE2 3.77Å; V418-F420 HydrophobicContact CG1-CZ 3.53Å
419	T	89.4	Confident	84.2	Confident	74 Å²	74	70.4 Å²	70.4	45%	0.454	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	125.7	178.7	-51.9	0	0	0	0	110.9	K366 L367	K366-T419 HydrophobicContact CB-CG2 4.38Å; K366-T419 HydrophobicContact CG-CG2 4.46Å; L367-T419 WeakPolarHBondContact O-CA 3.23Å
420	F	88.6	Confident	84.5	Confident	2 Å²	2	73.5 Å²	73.5	1%	0.009	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	140.7	168.8	-57.1	-77.1	0	0	0	109.6	K366 L367 V369 V392 L394 Q400 V418 L423	K366-F420 WeakPolarHBondContact CA-O 3.36Å; L367-F420 HydrophobicContact CB-CB 4.3Å; L367-F420 HydrophobicContact CD2-CD2 4.19Å; L367-F420 HydrophobicContact CG-CD2 4.47Å; L367-F420 PolarHBondContact N-O 2.8Å; L367-F420 PolarHBondContact O-N 3.17Å; V369-F420 HydrophobicContact CB-CE2 4.19Å; V369-F420 HydrophobicContact CG2-CD2 3.94Å; V369-F420 HydrophobicContact CG2-CE2 3.69Å; V392-F420 HydrophobicContact CB-CZ 4.46Å; V392-F420 HydrophobicContact CG1-CE2 4.16Å; V392-F420 HydrophobicContact CG1-CZ 3.85Å; L394-F420 HydrophobicContact CB-CD1 3.76Å; L394-F420 HydrophobicContact CB-CE1 3.82Å; L394-F420 HydrophobicContact CB-CG 4.38Å; L394-F420 HydrophobicContact CB-CZ 4.47Å; L394-F420 HydrophobicContact CD2-CB 4.21Å; L394-F420 HydrophobicContact CD2-CD1 4.16Å; L394-F420 HydrophobicContact CD2-CG 4.33Å; Q400-F420 HydrophobicContact CB-CD1 3.73Å; Q400-F420 HydrophobicContact CB-CE1 4.14Å; Q400-F420 VanDerWaalsContact OE1-CA 3.29Å; V418-F420 HydrophobicContact CB-CE2 4.49Å; V418-F420 HydrophobicContact CG1-CE1 4.1Å; V418-F420 HydrophobicContact CG1-CE2 3.77Å; V418-F420 HydrophobicContact CG1-CZ 3.53Å; F420-L423 HydrophobicContact CB-CD1 3.77Å
421	T	87.4	Confident	85.2	Confident	57 Å²	57	69.9 Å²	69.9	35%	0.35	36%	0.363	S	S	.	.			trans	-121.7	167.1	-176.4	60.6	0	0	0	0	110.3	K366 Q400 L423	K366-T421 HydrophobicContact CG-CG2 4.25Å; Q400-T421 PolarHBondContact NE2-O 3.18Å; Q400-T421 PolarHBondContact OE1-O 3.07Å; T421-L423 VanDerWaalsContact C-N 3.31Å; T421-L423 PolarHBondContact O-N 3Å
422	K	83.3	Confident	85.6	Confident	177 Å²	177	66.3 Å²	66.3	77%	0.77	35%	0.345	S	S	*	.			trans	59	41.4	-179.3	-47.9	-175.2	179	-169.2	0	112.4	Q365	Q365-K422 PolarHBondContact O-N 3.11Å
423	L	83.8	Confident	85.9	Confident	6 Å²	6	66.3 Å²	66.3	3%	0.031	35%	0.345	C	S	.	.			trans	-106.9	97.5	173.6	-84.8	169.3	0	0	0	108.8	Y360 Q365 L367 L394 F420 T421 V428 C431	Y360-L423 HydrophobicContact CE2-CB 4.12Å; Y360-L423 PolarHBondContact OH-O 2.86Å; Q365-L423 WeakPolarHBondContact CA-O 3.24Å; Q365-L423 WeakPolarHBondContact CB-O 3.41Å; Q365-L423 PolarHBondContact O-N 3.32Å; Q365-L423 VanDerWaalsContact O-N 3.17Å; L367-L423 HydrophobicContact CB-CD1 3.48Å; L367-L423 VanDerWaalsContact CB-CD1 3.48Å; L367-L423 HydrophobicContact CD2-CD1 3.98Å; L367-L423 HydrophobicContact CG-CD1 4.39Å; L394-L423 HydrophobicContact CD1-CD1 4.31Å; L394-L423 HydrophobicContact CD1-CD2 4.35Å; L394-L423 HydrophobicContact CD2-CD1 3.99Å; L394-L423 HydrophobicContact CD2-CD2 3.93Å; L394-L423 HydrophobicContact CD2-CG 4.08Å; F420-L423 HydrophobicContact CB-CD1 3.77Å; T421-L423 VanDerWaalsContact C-N 3.31Å; T421-L423 PolarHBondContact O-N 3Å; L423-V428 HydrophobicContact CB-CG2 4.25Å; L423-C431 HydrophobicContact CD2-CB 4.39Å
424	E	84.1	Confident	86	Confident	87 Å²	87	66.1 Å²	66.1	41%	0.407	34%	0.337	S	S	.	.			trans	-69.7	142.9	175.7	-60.4	-141	136	0	0	111	Q365 R426 D427 V428	Q365-E424 PolarHBondContact NE2-OE1 3.09Å; Q365-E424 VanDerWaalsContact NE2-OE1 3.14Å; E424-R426 PolarHBondContact O-N 2.77Å; E424-D427 PolarHBondContact O-N 2.96Å; E424-V428 WeakPolarHBondContact O-CG2 3.5Å; E424-V428 PolarHBondContact O-N 2.89Å; E424-V428 VanDerWaalsContact O-N 3.11Å
425	P	82.6	Confident	86.1	Confident	69 Å²	69	65.6 Å²	65.6	45%	0.448	33%	0.334	S	S	.	.	H	α-helix	trans	-57.1	-25.9	-177.6	-25.8	33	0	0	0	114.4	Y360 A362	Y360-P425 HydrophobicContact CE1-CB 4.46Å; Y360-P425 HydrophobicContact CE1-CG 4.37Å; Y360-P425 WeakPolarHBondContact OH-CA 3.49Å; Y360-P425 VanDerWaalsContact OH-CD 3.32Å; Y360-P425 WeakPolarHBondContact OH-CD 3.06Å; Y360-P425 WeakPolarHBondContact OH-CG 3.42Å; A362-P425 HydrophobicContact CB-CG 3.97Å
426	R	81.9	Confident	86.2	Confident	220 Å²	220	61.2 Å²	61.2	83%	0.83	31%	0.313	S	S	*	.	H	α-helix	trans	-72	-37.7	177.4	-59.8	-179.5	-178.9	-158	0	112.2	E424	E424-R426 PolarHBondContact O-N 2.77Å
427	D	82.6	Confident	86.1	Confident	90 Å²	90	58.8 Å²	58.8	48%	0.481	30%	0.302	S	S	.	.	H	α-helix	trans	-86.6	-22.4	-176.5	-66.9	-17.3	0	0	0	112.7	E424 A429 A430 C431	E424-D427 PolarHBondContact O-N 2.96Å; D427-A429 PolarHBondContact O-N 2.93Å; D427-A430 PolarHBondContact O-N 3.48Å; D427-C431 PolarHBondContact O-N 2.89Å; D427-C431 VanDerWaalsContact O-N 3.15Å; D427-C431 PolarHBondContact O-SG 3.26Å
428	V	83	Confident	85.8	Confident	9 Å²	9	54.2 Å²	54.2	6%	0.055	28%	0.281	C	S	.	.	H	α-helix	trans	-51	-44	178.2	169.9	0	0	0	0	111.2	Y360 L423 E424 A430 C431 L456	Y360-V428 HydrophobicContact CD2-CG2 4.2Å; Y360-V428 HydrophobicContact CE1-CG2 4.17Å; Y360-V428 HydrophobicContact CE2-CG2 3.62Å; L423-V428 HydrophobicContact CB-CG2 4.25Å; E424-V428 WeakPolarHBondContact O-CG2 3.5Å; E424-V428 PolarHBondContact O-N 2.89Å; E424-V428 VanDerWaalsContact O-N 3.11Å; V428-A430 PolarHBondContact O-N 2.95Å; V428-C431 PolarHBondContact O-N 3.13Å; V428-L456 HydrophobicContact CG1-CB 3.86Å; V428-L456 VanDerWaalsContact O-CB 3.3Å; V428-L456 WeakPolarHBondContact O-CB 3.49Å
429	A	82	Confident	85.4	Confident	62 Å²	62	53.5 Å²	53.5	51%	0.512	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-26.5	-179.2	0	0	0	0	0	114.2	D427	D427-A429 PolarHBondContact O-N 2.93Å
430	A	82.4	Confident	84.7	Confident	83 Å²	83	50.2 Å²	50.2	69%	0.686	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.8	-9.1	176.1	0	0	0	0	0	113.2	D427 V428	D427-A430 PolarHBondContact O-N 3.48Å; V428-A430 PolarHBondContact O-N 2.95Å
431	C	84.8	Confident	83.7	Confident	13 Å²	13	56.3 Å²	56.3	9%	0.088	28%	0.281	C	S	.	.			trans	-89.5	153.9	-179.9	-77.9	0	0	0	0	112.9	L394 L395 L423 D427 V428 L456	L394-C431 HydrophobicContact CD1-CB 4.23Å; L395-C431 VanDerWaalsContact O-CA 3.31Å; L395-C431 WeakPolarHBondContact O-CA 3.41Å; L395-C431 WeakPolarHBondContact O-CB 3.39Å; L395-C431 PolarHBondContact O-SG 2.88Å; L423-C431 HydrophobicContact CD2-CB 4.39Å; D427-C431 PolarHBondContact O-N 2.89Å; D427-C431 VanDerWaalsContact O-N 3.15Å; D427-C431 PolarHBondContact O-SG 3.26Å; V428-C431 PolarHBondContact O-N 3.13Å; C431-L456 HydrophobicContact CB-CD1 3.76Å; C431-L456 WeakPolarHBondContact O-CB 3.14Å; C431-L456 PolarHBondContact O-N 3.46Å
432	A	87.8	Confident	82	Confident	7 Å²	7	62.8 Å²	62.8	6%	0.058	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	144.7	174	0	0	0	0	0	110.9	L395 L453 F454 Y455	L395-A432 WeakPolarHBondContact CB-O 3.31Å; L395-A432 PolarHBondContact N-O 3.21Å; L395-A432 PolarHBondContact O-N 2.61Å; L395-A432 VanDerWaalsContact O-N 3.08Å; A432-L453 HydrophobicContact CB-CD2 3.75Å; A432-L453 HydrophobicContact CB-CG 4.13Å; A432-F454 CarbonylContact C-O 3.58Å; A432-F454 VanDerWaalsContact CA-O 3.3Å; A432-F454 WeakPolarHBondContact CA-O 3.47Å; A432-Y455 HydrophobicContact CB-CD1 3.88Å; A432-Y455 HydrophobicContact CB-CE1 4.23Å
433	V	88.9	Confident	80.3	Confident	0 Å²	0	63.2 Å²	63.2	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	126.3	172.8	179.6	0	0	0	0	109	F358 L367 V392 L394 F435 F454 L456	F358-V433 HydrophobicContact CE1-CB 4.18Å; F358-V433 HydrophobicContact CE1-CG1 4.48Å; F358-V433 HydrophobicContact CE1-CG2 4.27Å; L367-V433 HydrophobicContact CD2-CG2 4.01Å; V392-V433 HydrophobicContact CG1-CG1 3.31Å; L394-V433 HydrophobicContact CD1-CG2 3.98Å; V433-F435 HydrophobicContact CB-CE2 4.01Å; V433-F435 HydrophobicContact CB-CZ 4.28Å; V433-F435 HydrophobicContact CG1-CD2 4.28Å; V433-F435 HydrophobicContact CG1-CE1 4.2Å; V433-F435 HydrophobicContact CG1-CE2 3.52Å; V433-F435 HydrophobicContact CG1-CZ 3.46Å; V433-F435 VanDerWaalsContact CG1-CZ 3.46Å; V433-F454 PolarHBondContact N-O 3.16Å; V433-F454 PolarHBondContact O-N 3.28Å; V433-L456 HydrophobicContact CB-CD2 4.46Å; V433-L456 HydrophobicContact CG2-CD1 4.03Å; V433-L456 HydrophobicContact CG2-CD2 3.79Å; V433-L456 HydrophobicContact CG2-CG 4.21Å
434	R	89.1	Confident	78.5	Confident	64 Å²	64	66.4 Å²	66.4	24%	0.242	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	121.6	-179.2	171.7	178.7	-80.3	179.1	3.7	109.7	V392 V393 L395 R436 E451 L453	V392-R434 WeakPolarHBondContact CA-O 3.41Å; V393-R434 PolarHBondContact N-O 3.37Å; V393-R434 PolarHBondContact O-N 3.29Å; L395-R434 HydrophobicContact CD1-CB 3.96Å; R434-R436 HydrophobicContact CG-CG 4.41Å; R434-E451 WeakPolarHBondContact CD-OE1 3.38Å; R434-E451 HydrophobicContact CG-CG 4.36Å; R434-E451 VanDerWaalsContact CG-OE1 3.3Å; R434-E451 WeakPolarHBondContact CG-OE1 3.28Å; R434-E451 IonicContact CZ-OE1 3.57Å; R434-E451 IonicContact NE-OE1 3.47Å; R434-E451 PolarHBondContact NE-OE1 3.39Å; R434-L453 HydrophobicContact CB-CD1 4.13Å; R434-L453 HydrophobicContact CG-CD1 4.49Å
435	F	90.2	Very high	77.1	Confident	0 Å²	0	69.6 Å²	69.6	0%	0	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	135.4	175	-59.7	-92.2	0	0	0	109.3	L354 V356 F358 V369 V390 V392 V433 E451 K452 F454 L469	L354-F435 HydrophobicContact CD2-CB 4.04Å; L354-F435 HydrophobicContact CD2-CD1 3.76Å; L354-F435 HydrophobicContact CD2-CG 4.07Å; V356-F435 HydrophobicContact CG1-CE1 3.85Å; V356-F435 HydrophobicContact CG1-CZ 3.76Å; V356-F435 HydrophobicContact CG2-CD1 4.25Å; V356-F435 HydrophobicContact CG2-CE1 3.86Å; V356-F435 HydrophobicContact CG2-CZ 4.22Å; F358-F435 HydrophobicContact CE1-CE2 4.37Å; F358-F435 AromaticContact CE1-CZ 4Å; F358-F435 HydrophobicContact CE1-CZ 4Å; F358-F435 HydrophobicContact CE2-CZ 4.44Å; F358-F435 AromaticContact CZ-CE2 3.73Å; F358-F435 HydrophobicContact CZ-CE2 3.73Å; F358-F435 AromaticContact CZ-CZ 3.52Å; F358-F435 HydrophobicContact CZ-CZ 3.52Å; V369-F435 HydrophobicContact CG1-CE1 3.72Å; V369-F435 HydrophobicContact CG1-CZ 3.69Å; V390-F435 HydrophobicContact CG1-CD1 4.25Å; V392-F435 HydrophobicContact CG1-CD1 4.1Å; V392-F435 HydrophobicContact CG1-CE1 3.75Å; V392-F435 HydrophobicContact CG1-CZ 4.18Å; V392-F435 HydrophobicContact CG2-CD1 3.78Å; V392-F435 HydrophobicContact CG2-CE1 3.92Å; V433-F435 HydrophobicContact CB-CE2 4.01Å; V433-F435 HydrophobicContact CB-CZ 4.28Å; V433-F435 HydrophobicContact CG1-CD2 4.28Å; V433-F435 HydrophobicContact CG1-CE1 4.2Å; V433-F435 HydrophobicContact CG1-CE2 3.52Å; V433-F435 HydrophobicContact CG1-CZ 3.46Å; V433-F435 VanDerWaalsContact CG1-CZ 3.46Å; F435-E451 WeakPolarHBondContact O-CA 3.17Å; F435-K452 PolarHBondContact N-O 2.8Å; F435-K452 PolarHBondContact O-N 2.72Å; F435-F454 HydrophobicContact CE2-CB 4.08Å; F435-L469 HydrophobicContact CD2-CD1 3.49Å; F435-L469 VanDerWaalsContact CD2-CD1 3.49Å; F435-L469 HydrophobicContact CE2-CD1 3.5Å; F435-L469 HydrophobicContact CG-CD1 4.1Å; F435-L469 HydrophobicContact CZ-CD1 4.11Å
436	R	88.3	Confident	76.3	Confident	62 Å²	62	70.1 Å²	70.1	23%	0.234	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	119.3	173.6	-70.7	178.7	175.4	-170.9	-9.8	109.7	V390 H391 R434 Y438 G450 E451	V390-R436 CarbonylContact C-O 3.58Å; V390-R436 WeakPolarHBondContact CA-O 3.21Å; H391-R436 PolarHBondContact N-O 3.27Å; H391-R436 PolarHBondContact O-N 3.33Å; R434-R436 HydrophobicContact CG-CG 4.41Å; R436-Y438 HydrophobicContact CB-CD2 4.2Å; R436-Y438 HydrophobicContact CB-CE2 3.55Å; R436-G450 WeakPolarHBondContact CA-O 3.3Å; R436-E451 HydrophobicContact CG-CB 4.34Å; R436-E451 HydrophobicContact CG-CG 4.05Å; R436-E451 IonicContact CZ-OE1 3.2Å; R436-E451 IonicContact CZ-OE2 2.75Å; R436-E451 VanDerWaalsContact NE-CD 3.32Å; R436-E451 IonicContact NE-OE1 2.68Å; R436-E451 PolarHBondContact NE-OE1 2.83Å; R436-E451 IonicContact NE-OE2 2.62Å; R436-E451 IonicContact NH2-OE1 2.84Å; R436-E451 PolarHBondContact NH2-OE1 2.89Å; R436-E451 IonicContact NH2-OE2 3.11Å; R436-E451 PolarHBondContact NH2-OE2 3.25Å
437	L	87.3	Confident	75.7	Confident	1 Å²	1	65.3 Å²	65.3	1%	0.005	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	130.6	173.5	-175.5	71.5	0	0	0	109.5	L377 W388 V390 M449 G450 L471	L377-L437 HydrophobicContact CD1-CD2 4.2Å; L377-L437 HydrophobicContact CD2-CD2 3.42Å; L377-L437 VanDerWaalsContact CD2-CD2 3.42Å; L377-L437 HydrophobicContact CG-CD2 4.43Å; W388-L437 HydrophobicContact CB-CD1 4.17Å; W388-L437 HydrophobicContact CE3-CD2 4.13Å; W388-L437 HydrophobicContact CE3-CG 4.35Å; W388-L437 HydrophobicContact CZ3-CD2 4.44Å; V390-L437 HydrophobicContact CG2-CD1 3.78Å; L437-M449 HydrophobicContact CB-CB 4.34Å; L437-M449 HydrophobicContact CD2-CB 4.07Å; L437-M449 HydrophobicContact CG-CB 4.23Å; L437-M449 PolarHBondContact O-N 2.86Å; L437-G450 PolarHBondContact N-O 2.84Å; L437-L471 HydrophobicContact CB-CD1 3.73Å; L437-L471 HydrophobicContact CD2-CD1 3.68Å; L437-L471 HydrophobicContact CG-CD1 4.25Å
438	Y	84.3	Confident	75.4	Confident	38 Å²	38	62.6 Å²	62.6	15%	0.149	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	132.7	176.5	-72.3	-91	0	0	0	110.6	W388 Q389 H391 R436 A440 E446 R447 M448	W388-Y438 CarbonylContact C-O 3.5Å; W388-Y438 WeakPolarHBondContact CA-O 3.34Å; Q389-Y438 PolarHBondContact N-O 3.46Å; Q389-Y438 PolarHBondContact O-N 2.81Å; H391-Y438 HydrophobicContact CB-CD2 4.28Å; H391-Y438 HydrophobicContact CB-CE2 3.92Å; H391-Y438 AromaticContact CD2-CD2 3.52Å; H391-Y438 AromaticContact CD2-CE2 3.86Å; H391-Y438 AromaticContact CE1-CD2 3.99Å; H391-Y438 AromaticContact CE1-CE2 3.89Å; H391-Y438 AromaticContact CG-CD2 3.76Å; H391-Y438 AromaticContact CG-CE2 3.59Å; H391-Y438 AromaticContact ND1-CE2 3.69Å; H391-Y438 AromaticContact NE2-CD2 3.69Å; R436-Y438 HydrophobicContact CB-CD2 4.2Å; R436-Y438 HydrophobicContact CB-CE2 3.55Å; Y438-A440 PolarHBondContact O-N 3.38Å; Y438-E446 HydrophobicContact CD1-CB 3.89Å; Y438-E446 HydrophobicContact CG-CB 4.47Å; Y438-R447 WeakPolarHBondContact CA-O 3.34Å; Y438-M448 HydrophobicContact CD1-CB 3.9Å; Y438-M448 HydrophobicContact CD1-CG 4.4Å; Y438-M448 HydrophobicContact CE1-CB 3.61Å; Y438-M448 HydrophobicContact CE1-CG 4.03Å
439	A	82.3	Confident	75.1	Confident	3 Å²	3	63.1 Å²	63.1	3%	0.025	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	105.7	164.6	0	0	0	0	0	108.5	V385 S387 W388 E446 R447 M449	V385-A439 HydrophobicContact CG2-CB 3.57Å; S387-A439 CarbonylContact O-C 3.59Å; S387-A439 WeakPolarHBondContact O-CA 3.34Å; W388-A439 HydrophobicContact CE3-CB 4.35Å; W388-A439 HydrophobicContact CZ3-CB 4.23Å; A439-E446 WeakPolarHBondContact O-CA 3.14Å; A439-R447 HydrophobicContact CB-CB 4.38Å; A439-R447 PolarHBondContact N-O 3.12Å; A439-R447 PolarHBondContact O-N 2.99Å; A439-M449 HydrophobicContact CB-CE 3.87Å; A439-M449 HydrophobicContact CB-CG 3.7Å; A439-M449 HydrophobicContact CB-SD 3.7Å
440	A	73.1	Confident	75	Confident	4 Å²	4	60.1 Å²	60.1	3%	0.033	28%	0.28	C	S	.	.			trans	-88.9	138.3	-176.9	0	0	0	0	0	111	S387 I406 Y438	S387-A440 WeakPolarHBondContact CB-O 3.3Å; S387-A440 PolarHBondContact O-N 3.27Å; S387-A440 PolarHBondContact OG-O 2.87Å; I406-A440 HydrophobicContact CD1-CB 4.03Å; I406-A440 HydrophobicContact CG1-CB 4.23Å; I406-A440 HydrophobicContact CG2-CB 3.91Å; Y438-A440 PolarHBondContact O-N 3.38Å
441	R	69.2	Low	75.1	Confident	131 Å²	131	56.7 Å²	56.7	49%	0.494	25%	0.249	S	C	.	.			trans	-133.6	137.9	178.1	-158.5	174.3	-132.9	-163.5	10.2	109.6	G384 V385 M443 T444	G384-R441 PolarHBondContact O-NE 2.8Å; G384-R441 PolarHBondContact O-NH2 3.16Å; V385-R441 HydrophobicContact CG1-CB 3.74Å; V385-R441 HydrophobicContact CG1-CG 3.45Å; V385-R441 VanDerWaalsContact CG1-CG 3.45Å; V385-R441 VanDerWaalsContact CG1-NE 3.31Å; R441-M443 PolarHBondContact O-N 2.54Å; R441-M443 VanDerWaalsContact O-N 3.08Å; R441-T444 WeakPolarHBondContact CD-OG1 3.44Å; R441-T444 VanDerWaalsContact O-O 3.08Å
442	K	51.1	Low	75.2	Confident	193 Å²	193	58.5 Å²	58.5	84%	0.839	26%	0.256	S	S	*	.	S	Bend	trans	-61.7	-18.6	-175.3	-78.6	-170.1	170.8	-168.7	0	115.5
443	M	46.6	Very low	75.2	Confident	185 Å²	185	60.6 Å²	60.6	91%	0.911	27%	0.266	S	S	*	.	S	Bend	trans	-138.1	-4.2	-170.5	-94.8	-81.3	179.1	0	0	114.1	R441	R441-M443 PolarHBondContact O-N 2.54Å; R441-M443 VanDerWaalsContact O-N 3.08Å
444	T	47.3	Very low	75.1	Confident	73 Å²	73	61.7 Å²	61.7	45%	0.448	27%	0.271	S	S	.	.	S	Bend	trans	-131.3	160.9	173.1	74.4	0	0	0	0	109.8	R441	R441-T444 WeakPolarHBondContact CD-OG1 3.44Å; R441-T444 VanDerWaalsContact O-O 3.08Å
445	R	53.6	Low	74.9	Confident	154 Å²	154	65.6 Å²	65.6	58%	0.581	29%	0.287	S	S	*	.	P	Polyproline II helix	trans	-57	142.3	-177.2	-166.2	167.7	-161.2	165	7.3	112.9	R447 A536	R445-R447 PolarHBondContact O-N 3.08Å; R445-A536 VanDerWaalsContact CZ-C 3.41Å; R445-A536 VanDerWaalsContact CZ-CB 3.47Å; R445-A536 VanDerWaalsContact NH1-CB 3.27Å; R445-A536 PolarHBondContact NH1-O 3.15Å; R445-A536 PolarHBondContact NH2-O 3.49Å
446	E	65.8	Low	74.6	Confident	80 Å²	80	65.7 Å²	65.7	37%	0.374	29%	0.287	S	S	.	.	P	Polyproline II helix	trans	-52.6	124.5	169.2	-65.6	165.1	-165	0	0	110.7	H391 Y438 A439	H391-E446 IonicContact CE1-OE2 3.06Å; H391-E446 IonicContact NE2-OE2 3.21Å; Y438-E446 HydrophobicContact CD1-CB 3.89Å; Y438-E446 HydrophobicContact CG-CB 4.47Å; A439-E446 WeakPolarHBondContact O-CA 3.14Å
447	R	70.6	Confident	74.1	Confident	120 Å²	120	65.6 Å²	65.6	45%	0.453	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	120.4	177.1	-174	-177.1	164.2	-151.5	0.4	108.3	R382 S383 Y438 A439 R445 M449	R382-R447 PolarHBondContact O-NH1 3.12Å; R382-R447 PolarHBondContact O-NH2 2.8Å; S383-R447 PolarHBondContact O-NH1 2.85Å; S383-R447 VanDerWaalsContact O-NH1 3.13Å; Y438-R447 WeakPolarHBondContact CA-O 3.34Å; A439-R447 HydrophobicContact CB-CB 4.38Å; A439-R447 PolarHBondContact N-O 3.12Å; A439-R447 PolarHBondContact O-N 2.99Å; R445-R447 PolarHBondContact O-N 3.08Å; R447-M449 HydrophobicContact CB-CE 3.94Å; R447-M449 HydrophobicContact CG-CE 3.45Å; R447-M449 VanDerWaalsContact CG-CE 3.45Å
448	M	76.7	Confident	73.3	Confident	33 Å²	33	72 Å²	72	16%	0.163	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	132.4	177	-168.9	-103.5	-95.2	0	0	109.2	Y438 E451 R474	Y438-M448 HydrophobicContact CD1-CB 3.9Å; Y438-M448 HydrophobicContact CD1-CG 4.4Å; Y438-M448 HydrophobicContact CE1-CB 3.61Å; Y438-M448 HydrophobicContact CE1-CG 4.03Å; M448-E451 HydrophobicContact CE-CB 4.24Å; M448-E451 HydrophobicContact SD-CB 4.44Å; M448-R474 HydrophobicContact CE-CG 4.02Å
449	M	75.9	Confident	73	Confident	19 Å²	19	71.1 Å²	71.1	9%	0.094	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	-45.2	-171.9	-64.5	-78.1	98.4	0	0	111.8	C351 P378 W388 L437 A439 R447	C351-M449 PolarHBondContact SG-O 2.83Å; P378-M449 HydrophobicContact CG-SD 4.21Å; W388-M449 HydrophobicContact CE3-CG 4.29Å; W388-M449 HydrophobicContact CZ3-CG 3.78Å; W388-M449 HydrophobicContact CZ3-SD 3.85Å; L437-M449 HydrophobicContact CB-CB 4.34Å; L437-M449 HydrophobicContact CD2-CB 4.07Å; L437-M449 HydrophobicContact CG-CB 4.23Å; L437-M449 PolarHBondContact O-N 2.86Å; A439-M449 HydrophobicContact CB-CE 3.87Å; A439-M449 HydrophobicContact CB-CG 3.7Å; A439-M449 HydrophobicContact CB-SD 3.7Å; R447-M449 HydrophobicContact CB-CE 3.94Å; R447-M449 HydrophobicContact CG-CE 3.45Å; R447-M449 VanDerWaalsContact CG-CE 3.45Å
450	G	79.6	Confident	72.4	Confident	0 Å²	0	77.3 Å²	77.3	0%	0	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.3	158.3	178.9	0	0	0	0	0	111.5	R436 L437 E472	R436-G450 WeakPolarHBondContact CA-O 3.3Å; L437-G450 PolarHBondContact N-O 2.84Å; G450-E472 WeakPolarHBondContact CA-O 3.05Å
451	E	85.3	Confident	72.2	Confident	10 Å²	10	81 Å²	81	5%	0.047	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	144.8	179.5	-179.5	159	-150.9	0	0	108.9	R434 F435 R436 M448 E472	R434-E451 WeakPolarHBondContact CD-OE1 3.38Å; R434-E451 HydrophobicContact CG-CG 4.36Å; R434-E451 VanDerWaalsContact CG-OE1 3.3Å; R434-E451 WeakPolarHBondContact CG-OE1 3.28Å; R434-E451 IonicContact CZ-OE1 3.57Å; R434-E451 IonicContact NE-OE1 3.47Å; R434-E451 PolarHBondContact NE-OE1 3.39Å; F435-E451 WeakPolarHBondContact O-CA 3.17Å; R436-E451 HydrophobicContact CG-CB 4.34Å; R436-E451 HydrophobicContact CG-CG 4.05Å; R436-E451 IonicContact CZ-OE1 3.2Å; R436-E451 IonicContact CZ-OE2 2.75Å; R436-E451 VanDerWaalsContact NE-CD 3.32Å; R436-E451 IonicContact NE-OE1 2.68Å; R436-E451 PolarHBondContact NE-OE1 2.83Å; R436-E451 IonicContact NE-OE2 2.62Å; R436-E451 IonicContact NH2-OE1 2.84Å; R436-E451 PolarHBondContact NH2-OE1 2.89Å; R436-E451 IonicContact NH2-OE2 3.11Å; R436-E451 PolarHBondContact NH2-OE2 3.25Å; M448-E451 HydrophobicContact CE-CB 4.24Å; M448-E451 HydrophobicContact SD-CB 4.44Å; E451-E472 PolarHBondContact N-O 3.45Å; E451-E472 VanDerWaalsContact N-O 3.11Å; E451-E472 PolarHBondContact O-N 2.72Å; E451-E472 VanDerWaalsContact O-N 3.12Å
452	K	86.3	Confident	72.1	Confident	51 Å²	51	81 Å²	81	22%	0.222	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	138.5	167.8	-167.6	57.2	163.6	177.5	0	110.1	F435 L469 V470 L471 E472	F435-K452 PolarHBondContact N-O 2.8Å; F435-K452 PolarHBondContact O-N 2.72Å; K452-L469 HydrophobicContact CG-CB 4.16Å; K452-V470 VanDerWaalsContact CD-O 3.27Å; K452-V470 WeakPolarHBondContact CD-O 3.44Å; K452-V470 WeakPolarHBondContact CE-O 3.43Å; K452-V470 WeakPolarHBondContact CG-O 3.43Å; K452-L471 HydrophobicContact CB-CD2 4.04Å; K452-E472 IonicContact NZ-OE1 3.18Å; K452-E472 PolarHBondContact NZ-OE1 3.26Å; K452-E472 IonicContact NZ-OE2 2.72Å
453	L	88.3	Confident	73	Confident	52 Å²	52	73.4 Å²	73.4	27%	0.272	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	133.6	173.4	-150.1	104.6	0	0	0	109	L395 A432 R434 Y455	L395-L453 HydrophobicContact CD1-CD1 3.79Å; A432-L453 HydrophobicContact CB-CD2 3.75Å; A432-L453 HydrophobicContact CB-CG 4.13Å; R434-L453 HydrophobicContact CB-CD1 4.13Å; R434-L453 HydrophobicContact CG-CD1 4.49Å; L453-Y455 HydrophobicContact CD2-CD1 4.15Å; L453-Y455 HydrophobicContact CD2-CD2 4.24Å; L453-Y455 HydrophobicContact CD2-CE1 3.57Å; L453-Y455 HydrophobicContact CD2-CE2 3.68Å; L453-Y455 HydrophobicContact CD2-CG 4.46Å
454	F	86.5	Confident	74.8	Confident	23 Å²	23	70 Å²	70	10%	0.101	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	114.7	174	-174.8	-97.3	0	0	0	109.2	F358 A432 V433 F435 L456 L459 M465 V467 L469	F358-F454 HydrophobicContact CD1-CD1 4.37Å; F358-F454 HydrophobicContact CD1-CE1 4.41Å; F358-F454 HydrophobicContact CD2-CD1 4.44Å; F358-F454 HydrophobicContact CD2-CE1 4.17Å; F358-F454 AromaticContact CE1-CD1 3.69Å; F358-F454 HydrophobicContact CE1-CD1 3.69Å; F358-F454 HydrophobicContact CE1-CE1 4.16Å; F358-F454 HydrophobicContact CE1-CG 4.48Å; F358-F454 AromaticContact CE2-CD1 3.77Å; F358-F454 HydrophobicContact CE2-CD1 3.77Å; F358-F454 AromaticContact CE2-CE1 3.9Å; F358-F454 HydrophobicContact CE2-CE1 3.9Å; F358-F454 HydrophobicContact CE2-CG 4.12Å; F358-F454 HydrophobicContact CE2-CZ 4.36Å; F358-F454 HydrophobicContact CG-CE1 4.42Å; F358-F454 HydrophobicContact CZ-CB 4.12Å; F358-F454 AromaticContact CZ-CD1 3.33Å; F358-F454 HydrophobicContact CZ-CD1 3.33Å; F358-F454 AromaticContact CZ-CE1 3.88Å; F358-F454 HydrophobicContact CZ-CE1 3.88Å; F358-F454 AromaticContact CZ-CG 3.75Å; F358-F454 HydrophobicContact CZ-CG 3.75Å; A432-F454 CarbonylContact C-O 3.58Å; A432-F454 VanDerWaalsContact CA-O 3.3Å; A432-F454 WeakPolarHBondContact CA-O 3.47Å; V433-F454 PolarHBondContact N-O 3.16Å; V433-F454 PolarHBondContact O-N 3.28Å; F435-F454 HydrophobicContact CE2-CB 4.08Å; F454-L456 HydrophobicContact CD1-CD2 3.93Å; F454-L456 HydrophobicContact CE1-CD2 4.18Å; F454-L459 HydrophobicContact CE1-CD2 4.12Å; F454-L459 HydrophobicContact CE1-CG 4.36Å; F454-M465 HydrophobicContact CZ-CE 3.71Å; F454-V467 HydrophobicContact CD2-CG1 4.41Å; F454-V467 HydrophobicContact CE2-CG1 4.07Å; F454-V467 HydrophobicContact CE2-CG2 4.28Å; F454-V467 HydrophobicContact CZ-CG1 4.44Å; F454-L469 HydrophobicContact CB-CD1 4.45Å; F454-L469 HydrophobicContact CB-CD2 4.43Å; F454-L469 HydrophobicContact CD2-CD2 3.71Å; F454-L469 HydrophobicContact CE2-CD2 4.47Å; F454-L469 HydrophobicContact CG-CD2 4.39Å
455	Y	85.6	Confident	76.7	Confident	146 Å²	146	68.8 Å²	68.8	57%	0.573	33%	0.328	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.5	130.6	176	-66.2	-80.4	0	0	0	109.9	A432 L453 S457	A432-Y455 HydrophobicContact CB-CD1 3.88Å; A432-Y455 HydrophobicContact CB-CE1 4.23Å; L453-Y455 HydrophobicContact CD2-CD1 4.15Å; L453-Y455 HydrophobicContact CD2-CD2 4.24Å; L453-Y455 HydrophobicContact CD2-CE1 3.57Å; L453-Y455 HydrophobicContact CD2-CE2 3.68Å; L453-Y455 HydrophobicContact CD2-CG 4.46Å; Y455-S457 PolarHBondContact O-N 2.87Å
456	L	83.9	Confident	78.3	Confident	1 Å²	1	67.8 Å²	67.8	1%	0.005	33%	0.329	C	S	.	.	G	3₁₀ helix	trans	-82	1.3	-177	-55.6	174.9	0	0	0	112.7	F358 L367 L394 V428 C431 V433 F454 H458 L459	F358-L456 HydrophobicContact CD1-CD2 4.04Å; F358-L456 HydrophobicContact CE1-CD2 3.97Å; L367-L456 HydrophobicContact CD2-CD1 3.65Å; L367-L456 HydrophobicContact CD2-CD2 3.96Å; L367-L456 HydrophobicContact CD2-CG 4.49Å; L394-L456 HydrophobicContact CD1-CD1 4.13Å; V428-L456 HydrophobicContact CG1-CB 3.86Å; V428-L456 VanDerWaalsContact O-CB 3.3Å; V428-L456 WeakPolarHBondContact O-CB 3.49Å; C431-L456 HydrophobicContact CB-CD1 3.76Å; C431-L456 WeakPolarHBondContact O-CB 3.14Å; C431-L456 PolarHBondContact O-N 3.46Å; V433-L456 HydrophobicContact CB-CD2 4.46Å; V433-L456 HydrophobicContact CG2-CD1 4.03Å; V433-L456 HydrophobicContact CG2-CD2 3.79Å; V433-L456 HydrophobicContact CG2-CG 4.21Å; F454-L456 HydrophobicContact CD1-CD2 3.93Å; F454-L456 HydrophobicContact CE1-CD2 4.18Å; L456-H458 PolarHBondContact O-N 2.85Å; L456-H458 VanDerWaalsContact O-N 3.13Å; L456-L459 HydrophobicContact CB-CD1 4.07Å; L456-L459 HydrophobicContact CB-CG 4.36Å; L456-L459 HydrophobicContact CD2-CD1 3.49Å; L456-L459 VanDerWaalsContact CD2-CD1 3.49Å; L456-L459 HydrophobicContact CD2-CG 4.16Å; L456-L459 HydrophobicContact CG-CD1 4.27Å; L456-L459 WeakPolarHBondContact O-CB 3.42Å; L456-L459 PolarHBondContact O-N 2.82Å
457	S	76.8	Confident	79.4	Confident	60 Å²	60	65.9 Å²	65.9	42%	0.42	32%	0.322	S	S	.	.	G	3₁₀ helix	trans	-51.5	-27.3	170.3	51.8	0	0	0	0	114.5	Y455	Y455-S457 PolarHBondContact O-N 2.87Å
458	H	71.2	Confident	80.3	Confident	135 Å²	135	64 Å²	64	63%	0.625	32%	0.324	S	S	*	.	G	3₁₀ helix	trans	-98.3	4.6	-179.5	-56	-70.2	0	0	0	113.6	L456 M465	L456-H458 PolarHBondContact O-N 2.85Å; L456-H458 VanDerWaalsContact O-N 3.13Å; H458-M465 HydrophobicContact CB-CE 4.03Å; H458-M465 VanDerWaalsContact O-CE 3.23Å; H458-M465 WeakPolarHBondContact O-CE 3.47Å
459	L	76.4	Confident	80.8	Confident	21 Å²	21	62.8 Å²	62.8	11%	0.11	32%	0.318	C	S	.	.			trans	-77.4	130.8	175.8	-70.9	-174.2	0	0	0	111.6	F358 L367 F454 L456 M465	F358-L459 HydrophobicContact CB-CD1 4.2Å; F358-L459 HydrophobicContact CB-CD2 3.5Å; F358-L459 VanDerWaalsContact CB-CD2 3.5Å; F358-L459 HydrophobicContact CD1-CD1 4.33Å; F358-L459 HydrophobicContact CD1-CD2 4.47Å; F358-L459 HydrophobicContact CG-CD2 3.98Å; L367-L459 HydrophobicContact CD1-CD1 3.57Å; F454-L459 HydrophobicContact CE1-CD2 4.12Å; F454-L459 HydrophobicContact CE1-CG 4.36Å; L456-L459 HydrophobicContact CB-CD1 4.07Å; L456-L459 HydrophobicContact CB-CG 4.36Å; L456-L459 HydrophobicContact CD2-CD1 3.49Å; L456-L459 VanDerWaalsContact CD2-CD1 3.49Å; L456-L459 HydrophobicContact CD2-CG 4.16Å; L456-L459 HydrophobicContact CG-CD1 4.27Å; L456-L459 WeakPolarHBondContact O-CB 3.42Å; L456-L459 PolarHBondContact O-N 2.82Å; L459-M465 HydrophobicContact CD2-CB 4.01Å; L459-M465 HydrophobicContact CD2-CE 4.15Å; L459-M465 HydrophobicContact CD2-CG 4.4Å; L459-M465 HydrophobicContact CD2-SD 4.46Å
460	H	71.7	Confident	81.2	Confident	132 Å²	132	64.9 Å²	64.9	61%	0.611	33%	0.332	S	S	*	.			trans	-69.4	136.7	167.5	-67.2	-69.9	0	0	0	110.3	E462	H460-E462 PolarHBondContact O-N 2.99Å; H460-E462 VanDerWaalsContact O-N 3.14Å
461	P	67.7	Low	81.4	Confident	82 Å²	82	65 Å²	65	53%	0.532	33%	0.332	S	S	.	.	S	Bend	trans	-61.1	-22.8	-176	-27.8	35.8	0	0	0	115.8	Y360	Y360-P461 WeakPolarHBondContact CD1-O 3.17Å
462	E	67.4	Low	80.9	Confident	132 Å²	132	67.4 Å²	67.4	62%	0.617	34%	0.344	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-142.5	79	-174.6	-142.7	81.6	-140.7	0	0	108.6	H460	H460-E462 PolarHBondContact O-N 2.99Å; H460-E462 VanDerWaalsContact O-N 3.14Å
463	G	69.5	Low	79.9	Confident	33 Å²	33	66.1 Å²	66.1	34%	0.34	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-179.8	163.3	-177.7	0	0	0	0	0	116
464	E	84.7	Confident	78.5	Confident	114 Å²	114	69.2 Å²	69.2	53%	0.533	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	115.8	171.6	-173.9	-169.7	-158.8	0	0	109.3	I357 F358 K466	I357-E464 HydrophobicContact CG2-CG 3.34Å; I357-E464 VanDerWaalsContact CG2-OE1 3.28Å; I357-E464 WeakPolarHBondContact CG2-OE1 3.46Å; F358-E464 CarbonylContact O-C 3.49Å; F358-E464 WeakPolarHBondContact O-CA 3.47Å; E464-K466 WeakPolarHBondContact OE1-CE 3.42Å; E464-K466 IonicContact OE1-NZ 2.86Å; E464-K466 PolarHBondContact OE1-NZ 3.49Å; E464-K466 VanDerWaalsContact OE1-NZ 3.15Å; E464-K466 WeakPolarHBondContact OE2-CE 3.3Å; E464-K466 IonicContact OE2-NZ 3.46Å; E464-K466 PolarHBondContact OE2-NZ 3.47Å
465	M	86.5	Confident	76.4	Confident	46 Å²	46	71.4 Å²	71.4	23%	0.227	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	120.8	177.1	-176.9	139.6	121.9	0	0	111	I357 F358 F454 H458 L459	I357-M465 CarbonylContact C-O 3.33Å; I357-M465 WeakPolarHBondContact CA-O 3.49Å; F358-M465 PolarHBondContact N-O 3.04Å; F358-M465 PolarHBondContact O-N 2.8Å; F454-M465 HydrophobicContact CZ-CE 3.71Å; H458-M465 HydrophobicContact CB-CE 4.03Å; H458-M465 VanDerWaalsContact O-CE 3.23Å; H458-M465 WeakPolarHBondContact O-CE 3.47Å; L459-M465 HydrophobicContact CD2-CB 4.01Å; L459-M465 HydrophobicContact CD2-CE 4.15Å; L459-M465 HydrophobicContact CD2-CG 4.4Å; L459-M465 HydrophobicContact CD2-SD 4.46Å
466	K	88.6	Confident	74.2	Confident	134 Å²	134	69.4 Å²	69.4	58%	0.583	37%	0.366	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.6	129.5	179.4	-50	-168.4	174.3	164.7	0	109.1	I357 E464	I357-K466 HydrophobicContact CD1-CD 4.25Å; I357-K466 HydrophobicContact CD1-CG 4.48Å; I357-K466 HydrophobicContact CG1-CB 4.49Å; I357-K466 HydrophobicContact CG1-CD 4.3Å; I357-K466 HydrophobicContact CG1-CG 4.01Å; I357-K466 HydrophobicContact CG2-CG 4.31Å; E464-K466 WeakPolarHBondContact OE1-CE 3.42Å; E464-K466 IonicContact OE1-NZ 2.86Å; E464-K466 PolarHBondContact OE1-NZ 3.49Å; E464-K466 VanDerWaalsContact OE1-NZ 3.15Å; E464-K466 WeakPolarHBondContact OE2-CE 3.3Å; E464-K466 IonicContact OE2-NZ 3.46Å; E464-K466 PolarHBondContact OE2-NZ 3.47Å
467	V	88.7	Confident	72.2	Confident	39 Å²	39	74.3 Å²	74.3	24%	0.236	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	135.6	-179.1	62.6	0	0	0	0	110.6	V356 F358 F454 L469	V356-V467 PolarHBondContact N-O 2.91Å; V356-V467 PolarHBondContact O-N 2.57Å; V356-V467 VanDerWaalsContact O-O 3.11Å; F358-V467 HydrophobicContact CD2-CG1 3.9Å; F358-V467 HydrophobicContact CE2-CG1 3.49Å; F358-V467 VanDerWaalsContact CE2-CG1 3.49Å; F454-V467 HydrophobicContact CD2-CG1 4.41Å; F454-V467 HydrophobicContact CE2-CG1 4.07Å; F454-V467 HydrophobicContact CE2-CG2 4.28Å; F454-V467 HydrophobicContact CZ-CG1 4.44Å; V467-L469 HydrophobicContact CG1-CD2 3.94Å; V467-L469 HydrophobicContact CG1-CG 4.17Å; V467-L469 HydrophobicContact CG2-CD2 3.84Å
468	T	89.7	Confident	70.3	Confident	81 Å²	81	77.2 Å²	77.2	50%	0.497	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	115.1	170.4	-58.5	0	0	0	0	108.1	D353 D355	D353-T468 HydrophobicContact CB-CG2 3.78Å; D355-T468 WeakPolarHBondContact OD1-CB 3.41Å; D355-T468 WeakPolarHBondContact OD1-CG2 3.37Å; D355-T468 PolarHBondContact OD1-OG1 2.89Å
469	L	86	Confident	68.8	Low	8 Å²	8	76.1 Å²	76.1	4%	0.042	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	106	-177.2	-61.9	-179.8	0	0	0	109.8	L354 V356 F435 K452 F454 V467 L471	L354-L469 HydrophobicContact CB-CB 4.38Å; L354-L469 PolarHBondContact N-O 2.97Å; L354-L469 PolarHBondContact O-N 2.82Å; V356-L469 HydrophobicContact CB-CD1 4.26Å; V356-L469 HydrophobicContact CG2-CD1 3.83Å; V356-L469 HydrophobicContact CG2-CG 4.4Å; F435-L469 HydrophobicContact CD2-CD1 3.49Å; F435-L469 VanDerWaalsContact CD2-CD1 3.49Å; F435-L469 HydrophobicContact CE2-CD1 3.5Å; F435-L469 HydrophobicContact CG-CD1 4.1Å; F435-L469 HydrophobicContact CZ-CD1 4.11Å; K452-L469 HydrophobicContact CG-CB 4.16Å; F454-L469 HydrophobicContact CB-CD1 4.45Å; F454-L469 HydrophobicContact CB-CD2 4.43Å; F454-L469 HydrophobicContact CD2-CD2 3.71Å; F454-L469 HydrophobicContact CE2-CD2 4.47Å; F454-L469 HydrophobicContact CG-CD2 4.39Å; V467-L469 HydrophobicContact CG1-CD2 3.94Å; V467-L469 HydrophobicContact CG1-CG 4.17Å; V467-L469 HydrophobicContact CG2-CD2 3.84Å; L469-L471 PolarHBondContact O-N 2.81Å
470	V	85.1	Confident	67	Low	63 Å²	63	79.4 Å²	79.4	38%	0.382	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.4	120.6	169	-172.8	0	0	0	0	108.3	D353 K452	D353-V470 WeakPolarHBondContact OD1-CG2 3.35Å; K452-V470 VanDerWaalsContact CD-O 3.27Å; K452-V470 WeakPolarHBondContact CD-O 3.44Å; K452-V470 WeakPolarHBondContact CE-O 3.43Å; K452-V470 WeakPolarHBondContact CG-O 3.43Å
471	L	82.8	Confident	65.1	Low	1 Å²	1	76 Å²	76	1%	0.005	46%	0.458	C	S	.	.	P	Polyproline II helix	trans	-82.3	123.2	176.9	-61.3	170.9	0	0	0	109.3	C351 G352 L354 L437 K452 L469	C351-L471 HydrophobicContact CB-CB 4.13Å; C351-L471 WeakPolarHBondContact CB-O 3.18Å; C351-L471 PolarHBondContact N-O 3.07Å; C351-L471 VanDerWaalsContact N-O 3.08Å; G352-L471 VanDerWaalsContact O-CB 3.22Å; G352-L471 WeakPolarHBondContact O-CB 3.38Å; G352-L471 WeakPolarHBondContact O-CG 3.4Å; G352-L471 PolarHBondContact O-N 3.44Å; L354-L471 HydrophobicContact CB-CD1 4.32Å; L354-L471 HydrophobicContact CB-CD2 4.26Å; L354-L471 HydrophobicContact CB-CG 4.22Å; L354-L471 HydrophobicContact CD2-CD2 4.45Å; L437-L471 HydrophobicContact CB-CD1 3.73Å; L437-L471 HydrophobicContact CD2-CD1 3.68Å; L437-L471 HydrophobicContact CG-CD1 4.25Å; K452-L471 HydrophobicContact CB-CD2 4.04Å; L469-L471 PolarHBondContact O-N 2.81Å
472	E	76.4	Confident	63.3	Low	62 Å²	62	77.8 Å²	77.8	29%	0.29	47%	0.473	S	S	.	.	B	Isolated β-bridge	trans	-85.4	136.4	-179.8	-79.5	151.4	-163.4	0	0	110.5	G450 E451 K452	G450-E472 WeakPolarHBondContact CA-O 3.05Å; E451-E472 PolarHBondContact N-O 3.45Å; E451-E472 VanDerWaalsContact N-O 3.11Å; E451-E472 PolarHBondContact O-N 2.72Å; E451-E472 VanDerWaalsContact O-N 3.12Å; K452-E472 IonicContact NZ-OE1 3.18Å; K452-E472 PolarHBondContact NZ-OE1 3.26Å; K452-E472 IonicContact NZ-OE2 2.72Å
473	P	64.1	Low	62.3	Low	23 Å²	23	77.3 Å²	77.3	15%	0.149	48%	0.481	C	S	.	.	P	Polyproline II helix	trans	-55.8	147.7	163.3	-15.9	26.5	0	0	0	110.1	C351 S475 N476	C351-P473 VanDerWaalsContact SG-CG 3.6Å; P473-S475 PolarHBondContact O-N 3Å; P473-N476 PolarHBondContact O-N 3.05Å
474	R	59	Low	60.5	Low	118 Å²	118	83.5 Å²	83.5	45%	0.445	51%	0.506	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-10.6	-169.5	-158.4	-174.2	-178.6	165.4	8.7	115.2	M448 N476	M448-R474 HydrophobicContact CE-CG 4.02Å; R474-N476 VanDerWaalsContact C-N 3.33Å; R474-N476 PolarHBondContact O-N 3.21Å
475	S	43.4	Very low	57.8	Low	69 Å²	69	83.2 Å²	83.2	48%	0.483	52%	0.516	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-26.3	179.4	50	0	0	0	0	114.2	P473	P473-S475 PolarHBondContact O-N 3Å
476	N	38.7	Very low	55.5	Low	103 Å²	103	87.1 Å²	87.1	55%	0.551	55%	0.545	S	S	*	.			trans	-116.2	21.4	-156.4	-67.4	10.3	0	0	0	117.3	P473 R474 S478	P473-N476 PolarHBondContact O-N 3.05Å; R474-N476 VanDerWaalsContact C-N 3.33Å; R474-N476 PolarHBondContact O-N 3.21Å; N476-S478 VanDerWaalsContact C-N 3.27Å; N476-S478 PolarHBondContact O-N 2.87Å; N476-S478 VanDerWaalsContact O-N 3.08Å
477	I	42.4	Very low	52.8	Low	104 Å²	104	86.4 Å²	86.4	53%	0.533	56%	0.557	S	S	.	*			trans	-87.1	55.9	175.9	62.6	161	0	0	0	114.5
478	S	36.9	Very low	50	Low	121 Å²	121	89.1 Å²	89.1	85%	0.846	58%	0.584	S	S	*	*			trans	-146.6	55.4	155.9	-172.9	0	0	0	0	111.2	N476	N476-S478 VanDerWaalsContact C-N 3.27Å; N476-S478 PolarHBondContact O-N 2.87Å; N476-S478 VanDerWaalsContact O-N 3.08Å
479	S	39.7	Very low	47.7	Very low	112 Å²	112	91.2 Å²	91.2	78%	0.783	60%	0.596	S	S	*	*			trans	-121.6	90.8	164.9	-163.8	0	0	0	0	110.1
480	G	37.3	Very low	45	Very low	90 Å²	90	96.4 Å²	96.4	93%	0.928	63%	0.633	S	S	*	*			trans	-131.5	56.4	173.3	0	0	0	0	0	109.5
481	G	31.6	Very low	42.8	Very low	60 Å²	60	101.2 Å²	101.2	62%	0.619	65%	0.651	S	S	*	*	S	Bend	trans	-169.4	133.3	-179.9	0	0	0	0	0	110
482	S	30.3	Very low	40.5	Very low	120 Å²	120	106.9 Å²	106.9	84%	0.839	69%	0.691	S	S	*	*			trans	-66.3	155.2	-169.4	-63.9	0	0	0	0	114.5
483	P	47.4	Very low	38.3	Very low	122 Å²	122	111 Å²	111	79%	0.792	72%	0.715	S	S	*	*			trans	-86.3	119.2	-178.1	33.1	-32.2	0	0	0	112.1
484	L	31.9	Very low	36.9	Very low	164 Å²	164	115 Å²	115	86%	0.859	74%	0.743	S	S	*	*			trans	-144	114.7	161	-75.9	-179.5	0	0	0	111.9
485	S	27	Very low	35.8	Very low	108 Å²	108	115.8 Å²	115.8	76%	0.755	76%	0.761	S	S	*	*			trans	66.6	121.6	150.8	-55.7	0	0	0	0	120.8
486	P	39.5	Very low	35.5	Very low	127 Å²	127	117.4 Å²	117.4	83%	0.825	77%	0.772	S	S	*	*			trans	-90.1	136.1	164.4	35.2	-30.3	0	0	0	111.6
487	S	30.2	Very low	35.4	Very low	120 Å²	120	117.4 Å²	117.4	84%	0.839	78%	0.781	S	S	*	*			trans	-179.4	166.1	153.5	41.5	0	0	0	0	112.3
488	A	30.1	Very low	34.9	Very low	96 Å²	96	118 Å²	118	79%	0.793	79%	0.79	S	S	*	*			trans	80.1	87.7	169.3	0	0	0	0	0	117.9
489	V	42.2	Very low	35.1	Very low	125 Å²	125	119.6 Å²	119.6	76%	0.758	78%	0.783	S	S	*	*			trans	-27.8	136.1	141	-173.4	0	0	0	0	113.1
490	S	28.4	Very low	35.1	Very low	117 Å²	117	116.3 Å²	116.3	82%	0.818	76%	0.76	S	S	*	*			trans	-148.3	125.4	150.8	-158	0	0	0	0	110.5
491	H	38.4	Very low	35.3	Very low	163 Å²	163	119.5 Å²	119.5	76%	0.755	76%	0.756	S	S	*	*			trans	-78.6	140.6	169.7	-55.1	-95.3	0	0	0	109.2
492	S	34.8	Very low	35.6	Very low	121 Å²	121	120.8 Å²	120.8	85%	0.846	76%	0.755	S	S	*	*			trans	173.7	160.1	131.6	-98.1	0	0	0	0	112.4
493	D	31.9	Very low	36.1	Very low	149 Å²	149	117.9 Å²	117.9	80%	0.797	73%	0.728	S	S	*	*			trans	-75.6	162.8	-163.1	-55.2	-84.8	0	0	0	117
494	S	34.3	Very low	36	Very low	106 Å²	106	114.4 Å²	114.4	74%	0.741	71%	0.714	S	S	*	*			trans	86.1	131.2	149.9	-62.6	0	0	0	0	120.6
495	T	35.5	Very low	37.2	Very low	134 Å²	134	107.8 Å²	107.8	82%	0.822	69%	0.686	S	S	*	*			trans	70.7	102.8	157.8	55.8	0	0	0	0	119.9
496	S	36.3	Very low	39.2	Very low	103 Å²	103	104.1 Å²	104.1	72%	0.72	66%	0.662	S	S	*	*				77.6	110.2	127.4	-155.3	0	0	0	0	120.2
497	S	37	Very low	41.2	Very low	104 Å²	104	99.5 Å²	99.5	73%	0.727	63%	0.632	S	S	*	*			trans	75.9	51.1	132.3	-51.5	0	0	0	0	120.6
498	T	33.1	Very low	43.9	Very low	117 Å²	117	93.9 Å²	93.9	72%	0.718	59%	0.592	S	S	*	*			trans	-136.8	-14.3	162.1	52.6	0	0	0	0	117.3	S500	T498-S500 PolarHBondContact O-N 2.87Å; T498-S500 VanDerWaalsContact O-N 3.07Å
499	Q	39.2	Very low	46.8	Very low	153 Å²	153	89.3 Å²	89.3	72%	0.715	56%	0.555	S	S	*	*			trans	-68.8	-5.1	-178.9	-76	-177.9	-19.6	0	0	115.2	L501 S502	Q499-L501 PolarHBondContact O-N 2.97Å; Q499-S502 PolarHBondContact O-OG 2.81Å
500	S	41.3	Very low	49.1	Very low	43 Å²	43	84.6 Å²	84.6	30%	0.301	53%	0.525	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75	19.2	-179.4	-46.8	0	0	0	0	115.5	T498	T498-S500 PolarHBondContact O-N 2.87Å; T498-S500 VanDerWaalsContact O-N 3.07Å
501	L	40.1	Very low	52.2	Low	158 Å²	158	79 Å²	79	83%	0.827	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	-130	-5.8	-174.9	-68.7	176	0	0	0	114.6	Q499	Q499-L501 PolarHBondContact O-N 2.97Å
502	S	39.7	Very low	54.9	Low	86 Å²	86	71.2 Å²	71.2	60%	0.601	45%	0.45	S	S	*	.	S	Bend	trans	-79	-38.1	174.2	41.4	0	0	0	0	112.8	Q499 G504	Q499-S502 PolarHBondContact O-OG 2.81Å; S502-G504 PolarHBondContact O-N 3.02Å
503	H	39.9	Very low	57.7	Low	59 Å²	59	65.5 Å²	65.5	27%	0.273	41%	0.41	S	S	.	.	S	Bend	trans	-86.4	99.6	-177.3	-52.7	-85.4	0	0	0	110	G505 E508 T641	H503-G505 VanDerWaalsContact C-N 3.33Å; H503-G505 PolarHBondContact O-N 3Å; H503-E508 HydrophobicContact CB-CG 4.49Å; H503-E508 IonicContact CD2-OE1 3.19Å; H503-E508 IonicContact CG-OE1 3.8Å; H503-T641 PolarHBondContact ND1-OG1 2.92Å
504	G	45.1	Very low	60.7	Low	49 Å²	49	59.2 Å²	59.2	51%	0.505	38%	0.378	S	S	.	.			trans	-59.9	77.4	-171.3	0	0	0	0	0	115.8	S502 A506	S502-G504 PolarHBondContact O-N 3.02Å; G504-A506 PolarHBondContact O-N 3.45Å; G504-A506 VanDerWaalsContact O-N 3.17Å
505	G	56.6	Low	63.5	Low	26 Å²	26	54.4 Å²	54.4	27%	0.268	34%	0.344	S	S	.	.	S	Bend	trans	66.1	13.9	172.5	0	0	0	0	0	115.8	H503	H503-G505 VanDerWaalsContact C-N 3.33Å; H503-G505 PolarHBondContact O-N 3Å
506	A	70	Confident	66.2	Low	31 Å²	31	51.1 Å²	51.1	26%	0.256	32%	0.321	S	S	.	.			trans	-68.8	149.7	167.8	0	0	0	0	0	110	G504 E508 H531 T641	G504-A506 PolarHBondContact O-N 3.45Å; G504-A506 VanDerWaalsContact O-N 3.17Å; A506-E508 PolarHBondContact O-N 2.87Å; A506-H531 WeakPolarHBondContact O-CB 3.27Å; A506-T641 HydrophobicContact CB-CG2 3.79Å
507	P	81.3	Confident	68.7	Low	29 Å²	29	48.5 Å²	48.5	19%	0.188	31%	0.305	C	S	.	.			trans	-68	127.1	175.4	27.1	-32	0	0	0	110.5	F532 I607 L642	P507-F532 HydrophobicContact CB-CD1 3.59Å; P507-F532 HydrophobicContact CB-CE1 3.9Å; P507-I607 HydrophobicContact CB-CG2 4.05Å; P507-I607 HydrophobicContact CG-CG2 4.42Å; P507-L642 HydrophobicContact CB-CB 4.39Å; P507-L642 HydrophobicContact CB-CD1 4.36Å; P507-L642 HydrophobicContact CG-CB 4.15Å; P507-L642 WeakPolarHBondContact O-CB 3.33Å; P507-L642 PolarHBondContact O-N 3.4Å
508	E	86.8	Confident	71.2	Confident	2 Å²	2	50.2 Å²	50.2	1%	0.009	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	155.2	-178.4	-57.7	157.9	119.7	0	0	111.2	H503 A506 G529 S530 H531 F532 W639 H640	H503-E508 HydrophobicContact CB-CG 4.49Å; H503-E508 IonicContact CD2-OE1 3.19Å; H503-E508 IonicContact CG-OE1 3.8Å; A506-E508 PolarHBondContact O-N 2.87Å; E508-G529 WeakPolarHBondContact O-CA 3.23Å; E508-S530 PolarHBondContact N-O 3.23Å; E508-S530 PolarHBondContact O-N 3.07Å; E508-H531 IonicContact OE2-CE1 2.78Å; E508-H531 PolarHBondContact OE2-CE1 2.6Å; E508-H531 IonicContact OE2-CG 3.02Å; E508-H531 IonicContact OE2-ND1 3.62Å; E508-H531 PolarHBondContact OE2-ND1 2.93Å; E508-F532 WeakPolarHBondContact O-CE1 3.19Å; E508-F532 WeakPolarHBondContact O-CZ 3.34Å; E508-W639 HydrophobicContact CB-CE3 3.97Å; E508-W639 HydrophobicContact CB-CZ3 4.34Å; E508-H640 CarbonylContact C-O 3.44Å; E508-H640 VanDerWaalsContact CA-O 3.3Å; E508-H640 WeakPolarHBondContact CA-O 3.44Å
509	L	90.1	Very high	73.9	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	124.4	176.8	-175	68.5	0	0	0	111.3	V511 M526 F532 I593 V595 I610 H640 L642	L509-V511 HydrophobicContact CD2-CG2 3.73Å; L509-V511 HydrophobicContact CG-CG2 3.8Å; L509-M526 HydrophobicContact CD1-CE 3.42Å; L509-M526 VanDerWaalsContact CD1-CE 3.42Å; L509-M526 HydrophobicContact CD1-CG 3.93Å; L509-M526 HydrophobicContact CD1-SD 4.48Å; L509-M526 HydrophobicContact CD2-CE 3.78Å; L509-M526 HydrophobicContact CD2-CG 4.31Å; L509-M526 HydrophobicContact CD2-SD 4.45Å; L509-M526 HydrophobicContact CG-CE 4.27Å; L509-F532 HydrophobicContact CD1-CZ 4.28Å; L509-I593 HydrophobicContact CD2-CG2 3.72Å; L509-V595 HydrophobicContact CD2-CG2 4.37Å; L509-I610 HydrophobicContact CD2-CD1 4.28Å; L509-H640 PolarHBondContact N-O 2.82Å; L509-H640 PolarHBondContact O-N 2.88Å; L509-L642 HydrophobicContact CB-CD2 3.73Å; L509-L642 HydrophobicContact CB-CG 4.23Å; L509-L642 HydrophobicContact CD2-CD2 4.26Å
510	L	91.2	Very high	76.3	Confident	26 Å²	26	41 Å²	41	14%	0.136	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	117	168.9	-178	58.8	0	0	0	109.3	I527 K528 C637 W639	L510-I527 HydrophobicContact CB-CB 4.35Å; L510-I527 HydrophobicContact CD2-CB 4.05Å; L510-I527 HydrophobicContact CD2-CD1 4.25Å; L510-I527 HydrophobicContact CD2-CG2 3.83Å; L510-I527 HydrophobicContact CG-CB 4.01Å; L510-I527 HydrophobicContact CG-CD1 4.08Å; L510-I527 HydrophobicContact CG-CG2 4.37Å; L510-I527 PolarHBondContact O-N 2.78Å; L510-I527 VanDerWaalsContact O-N 3.1Å; L510-K528 HydrophobicContact CB-CB 4.46Å; L510-K528 WeakPolarHBondContact CB-O 3.37Å; L510-K528 PolarHBondContact N-O 2.83Å; L510-C637 HydrophobicContact CD1-CB 4.13Å; L510-W639 HydrophobicContact CB-CD2 3.81Å; L510-W639 HydrophobicContact CB-CE3 3.74Å; L510-W639 HydrophobicContact CB-CH2 3.78Å; L510-W639 HydrophobicContact CB-CZ2 3.86Å; L510-W639 HydrophobicContact CB-CZ3 3.72Å; L510-W639 HydrophobicContact CD1-CD2 4.15Å; L510-W639 HydrophobicContact CD1-CG 4.12Å; L510-W639 HydrophobicContact CD2-CH2 4.49Å; L510-W639 HydrophobicContact CD2-CZ2 3.93Å; L510-W639 HydrophobicContact CG-CD2 4.46Å; L510-W639 HydrophobicContact CG-CZ2 4.36Å
511	V	93.9	Very high	78.8	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	129.4	179.6	-175.2	0	0	0	0	109	L509 L513 V524 E525 I593 I610 H624 C637 R638	L509-V511 HydrophobicContact CD2-CG2 3.73Å; L509-V511 HydrophobicContact CG-CG2 3.8Å; V511-L513 HydrophobicContact CG1-CD2 3.91Å; V511-L513 HydrophobicContact CG1-CG 4.22Å; V511-V524 HydrophobicContact CG1-CG1 3.97Å; V511-E525 WeakPolarHBondContact CA-O 3.45Å; V511-I593 HydrophobicContact CG1-CD1 3.92Å; V511-I593 HydrophobicContact CG2-CD1 3.96Å; V511-I610 HydrophobicContact CG2-CD1 4.03Å; V511-H624 PolarHBondContact O-CE1 2.91Å; V511-C637 WeakPolarHBondContact O-CA 3.23Å; V511-R638 PolarHBondContact N-O 3.19Å; V511-R638 PolarHBondContact O-N 3.29Å; V511-R638 VanDerWaalsContact O-N 3.1Å
512	G	94	Very high	81.3	Confident	0 Å²	0	38 Å²	38	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	126.4	167.5	0	0	0	0	0	110.2	V524 E525 I636	G512-V524 CarbonylContact O-C 3.52Å; G512-V524 WeakPolarHBondContact O-CA 3.42Å; G512-E525 PolarHBondContact N-O 3.01Å; G512-E525 PolarHBondContact O-N 2.79Å; G512-I636 CarbonylContact C-O 3.35Å; G512-I636 VanDerWaalsContact CA-O 3.31Å; G512-I636 WeakPolarHBondContact CA-O 3.26Å
513	L	94.4	Very high	83.9	Confident	0 Å²	0	35.2 Å²	35.2	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	139.1	172.5	-59.5	178.1	0	0	0	110	V511 V524 L591 L612 H624 W625 M628 Q635 I636	V511-L513 HydrophobicContact CG1-CD2 3.91Å; V511-L513 HydrophobicContact CG1-CG 4.22Å; L513-V524 HydrophobicContact CD2-CB 4.2Å; L513-V524 HydrophobicContact CD2-CG1 3.86Å; L513-V524 HydrophobicContact CD2-CG2 3.79Å; L513-L591 HydrophobicContact CD2-CD2 3.69Å; L513-L612 HydrophobicContact CD1-CD1 4.37Å; L513-L612 HydrophobicContact CD1-CD2 4.37Å; L513-H624 WeakPolarHBondContact CD1-ND1 3.32Å; L513-H624 WeakPolarHBondContact CG-CE1 2.97Å; L513-W625 HydrophobicContact CD1-CE3 3.97Å; L513-W625 HydrophobicContact CD1-CZ3 4.41Å; L513-M628 HydrophobicContact CB-CB 4.2Å; L513-M628 HydrophobicContact CB-CG 3.79Å; L513-M628 HydrophobicContact CD1-CE 4.34Å; L513-Q635 WeakPolarHBondContact O-CA 3.31Å; L513-I636 PolarHBondContact N-O 2.79Å; L513-I636 PolarHBondContact O-N 3.08Å
514	S	94.3	Very high	86.5	Confident	18 Å²	18	32.4 Å²	32.4	13%	0.126	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	139.6	169.1	66.3	0	0	0	0	109.4	S523 Q634	S514-S523 PolarHBondContact N-O 2.81Å; S514-S523 PolarHBondContact O-N 3.12Å; S514-S523 WeakPolarHBondContact OG-CB 3.12Å; S514-Q634 WeakPolarHBondContact CB-O 3.32Å
515	Y	94.3	Very high	88.9	Confident	5 Å²	5	31.8 Å²	31.8	2%	0.02	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	124.9	174.2	-178.3	-102.6	0	0	0	112.4	A517 R521 L522 V581 L583 L586 M628 G633	Y515-A517 HydrophobicContact CD1-CB 4.17Å; Y515-A517 HydrophobicContact CE1-CB 3.69Å; Y515-R521 WeakPolarHBondContact CA-O 3.46Å; Y515-R521 WeakPolarHBondContact CD2-O 3.47Å; Y515-L522 HydrophobicContact CD2-CB 3.87Å; Y515-L522 HydrophobicContact CD2-CD1 4.29Å; Y515-L522 HydrophobicContact CE2-CB 4.41Å; Y515-V581 HydrophobicContact CE2-CB 4.4Å; Y515-V581 WeakPolarHBondContact CE2-O 3.36Å; Y515-V581 PolarHBondContact OH-O 2.86Å; Y515-L583 HydrophobicContact CE1-CD1 3.88Å; Y515-L583 VanDerWaalsContact OH-CA 3.3Å; Y515-L583 WeakPolarHBondContact OH-CA 3.5Å; Y515-L583 PolarHBondContact OH-N 3.17Å; Y515-L583 VanDerWaalsContact OH-N 3.08Å; Y515-L586 HydrophobicContact CD1-CD2 3.4Å; Y515-L586 VanDerWaalsContact CD1-CD2 3.4Å; Y515-L586 HydrophobicContact CD2-CD1 3.88Å; Y515-L586 HydrophobicContact CD2-CD2 3.95Å; Y515-L586 HydrophobicContact CE1-CD2 3.53Å; Y515-L586 HydrophobicContact CE2-CD1 3.97Å; Y515-L586 HydrophobicContact CE2-CD2 4.09Å; Y515-L586 HydrophobicContact CG-CD1 4.31Å; Y515-L586 HydrophobicContact CG-CD2 3.61Å; Y515-M628 WeakPolarHBondContact CB-SD 3.46Å; Y515-M628 HydrophobicContact CG-SD 4.37Å; Y515-G633 VanDerWaalsContact O-CA 3.24Å; Y515-G633 WeakPolarHBondContact O-CA 3.48Å; Y515-G633 PolarHBondContact O-N 3.46Å
516	N	92.8	Very high	90.6	Very high	64 Å²	64	30.5 Å²	30.5	34%	0.342	18%	0.177	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	99.7	174.9	-177	-57.8	0	0	0	109.5	T518 T519 G520 R521	N516-T518 VanDerWaalsContact C-N 3.28Å; N516-T518 PolarHBondContact O-N 3.06Å; N516-T518 PolarHBondContact OD1-N 2.86Å; N516-T519 WeakPolarHBondContact CB-OG1 3.09Å; N516-T519 PolarHBondContact O-N 3.37Å; N516-T519 PolarHBondContact O-OG1 2.92Å; N516-T519 PolarHBondContact OD1-N 3.08Å; N516-T519 PolarHBondContact OD1-OG1 3.46Å; N516-G520 WeakPolarHBondContact O-CA 3.46Å; N516-G520 PolarHBondContact O-N 3.47Å; N516-R521 PolarHBondContact N-O 3.11Å; N516-R521 PolarHBondContact O-N 3.06Å
517	A	88.2	Confident	91.6	Very high	48 Å²	48	30.3 Å²	30.3	40%	0.397	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-29.6	-177.9	0	0	0	0	0	114.2	Y515 T519 L583	Y515-A517 HydrophobicContact CD1-CB 4.17Å; Y515-A517 HydrophobicContact CE1-CB 3.69Å; A517-T519 VanDerWaalsContact C-N 3.35Å; A517-L583 HydrophobicContact CB-CD1 4.2Å
518	T	88.4	Confident	91.9	Very high	140 Å²	140	32.6 Å²	32.6	86%	0.859	18%	0.178	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.2	-32.6	178.4	-49.4	0	0	0	0	112.5	N516	N516-T518 VanDerWaalsContact C-N 3.28Å; N516-T518 PolarHBondContact O-N 3.06Å; N516-T518 PolarHBondContact OD1-N 2.86Å
519	T	89.6	Confident	91.8	Very high	68 Å²	68	32.5 Å²	32.5	42%	0.417	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-106.3	-7.7	-178.8	59.6	0	0	0	0	113.6	N516 A517 R521 Q580	N516-T519 WeakPolarHBondContact CB-OG1 3.09Å; N516-T519 PolarHBondContact O-N 3.37Å; N516-T519 PolarHBondContact O-OG1 2.92Å; N516-T519 PolarHBondContact OD1-N 3.08Å; N516-T519 PolarHBondContact OD1-OG1 3.46Å; A517-T519 VanDerWaalsContact C-N 3.35Å; T519-R521 VanDerWaalsContact C-N 3.27Å; T519-R521 PolarHBondContact O-N 2.91Å; T519-Q580 PolarHBondContact O-NE2 2.87Å
520	G	91.1	Very high	91.4	Very high	8 Å²	8	33 Å²	33	8%	0.082	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	64.3	28.6	-174.4	0	0	0	0	0	113.5	N516 Q580 V581	N516-G520 WeakPolarHBondContact O-CA 3.46Å; N516-G520 PolarHBondContact O-N 3.47Å; G520-Q580 CarbonylContact O-C 3.57Å; G520-Q580 WeakPolarHBondContact O-CA 3.37Å; G520-Q580 PolarHBondContact O-NE2 3.46Å; G520-Q580 VanDerWaalsContact O-NE2 3.08Å; G520-V581 CarbonylContact C-O 3.51Å; G520-V581 VanDerWaalsContact CA-O 3.27Å; G520-V581 WeakPolarHBondContact CA-O 3.15Å; G520-V581 CarbonylContact O-C 3.54Å; G520-V581 PolarHBondContact O-N 3.03Å
521	R	92.6	Very high	90.4	Very high	138 Å²	138	33.6 Å²	33.6	52%	0.521	18%	0.183	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	115.9	-176.4	-70.4	-178.3	174.3	-169	-0.4	111.1	Y515 N516 T519 V578	Y515-R521 WeakPolarHBondContact CA-O 3.46Å; Y515-R521 WeakPolarHBondContact CD2-O 3.47Å; N516-R521 PolarHBondContact N-O 3.11Å; N516-R521 PolarHBondContact O-N 3.06Å; T519-R521 VanDerWaalsContact C-N 3.27Å; T519-R521 PolarHBondContact O-N 2.91Å; R521-V578 HydrophobicContact CB-CG1 4.1Å; R521-V578 HydrophobicContact CG-CG1 4.17Å
522	L	93.5	Very high	89.2	Confident	0 Å²	0	33.9 Å²	33.9	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	110.2	167.9	176.4	67.8	0	0	0	108.4	Y515 V524 L549 V578 F579 V581 L586 W625 M628	Y515-L522 HydrophobicContact CD2-CB 3.87Å; Y515-L522 HydrophobicContact CD2-CD1 4.29Å; Y515-L522 HydrophobicContact CE2-CB 4.41Å; L522-V524 HydrophobicContact CD2-CG2 4.39Å; L522-V524 HydrophobicContact CG-CG2 4.13Å; L522-L549 HydrophobicContact CD2-CD1 4.2Å; L522-V578 WeakPolarHBondContact O-CA 3.46Å; L522-F579 HydrophobicContact CB-CB 4.34Å; L522-F579 HydrophobicContact CD2-CD2 4.38Å; L522-F579 PolarHBondContact N-O 2.71Å; L522-F579 PolarHBondContact O-N 3.29Å; L522-V581 HydrophobicContact CB-CG2 4.16Å; L522-V581 HydrophobicContact CD2-CG2 4.27Å; L522-L586 HydrophobicContact CD1-CD1 4.46Å; L522-W625 HydrophobicContact CD1-CH2 4.19Å; L522-W625 HydrophobicContact CD1-CZ3 4.33Å; L522-W625 HydrophobicContact CD2-CH2 3.65Å; L522-W625 HydrophobicContact CD2-CZ3 4.21Å; L522-M628 HydrophobicContact CD1-CE 3.88Å; L522-M628 HydrophobicContact CD1-SD 4.09Å
523	S	94.1	Very high	87.5	Confident	28 Å²	28	39.6 Å²	39.6	20%	0.196	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	126.8	173.9	-38	0	0	0	0	109.9	S514 F577	S514-S523 PolarHBondContact N-O 2.81Å; S514-S523 PolarHBondContact O-N 3.12Å; S514-S523 WeakPolarHBondContact OG-CB 3.12Å; S523-F577 CarbonylContact C-O 3.54Å; S523-F577 WeakPolarHBondContact CA-O 3.42Å
524	V	95.2	Very high	85.6	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	110.4	179.7	-177.3	0	0	0	0	108.3	V511 G512 L513 L522 L547 T576 F577 F579 L591 I593	V511-V524 HydrophobicContact CG1-CG1 3.97Å; G512-V524 CarbonylContact O-C 3.52Å; G512-V524 WeakPolarHBondContact O-CA 3.42Å; L513-V524 HydrophobicContact CD2-CB 4.2Å; L513-V524 HydrophobicContact CD2-CG1 3.86Å; L513-V524 HydrophobicContact CD2-CG2 3.79Å; L522-V524 HydrophobicContact CD2-CG2 4.39Å; L522-V524 HydrophobicContact CG-CG2 4.13Å; V524-L547 HydrophobicContact CB-CD2 4.09Å; V524-L547 HydrophobicContact CG1-CD2 3.57Å; V524-T576 WeakPolarHBondContact O-CA 3.32Å; V524-F577 PolarHBondContact N-O 2.92Å; V524-F577 PolarHBondContact O-N 3.14Å; V524-F579 HydrophobicContact CB-CE2 4.04Å; V524-F579 HydrophobicContact CG2-CD2 3.83Å; V524-F579 HydrophobicContact CG2-CE2 3.67Å; V524-L591 HydrophobicContact CB-CD2 4.35Å; V524-L591 HydrophobicContact CG1-CD2 3.88Å; V524-L591 HydrophobicContact CG2-CD1 4.17Å; V524-L591 HydrophobicContact CG2-CD2 3.51Å; V524-L591 HydrophobicContact CG2-CG 4.49Å; V524-I593 HydrophobicContact CG1-CD1 4.13Å
525	E	94.6	Very high	83.4	Confident	36 Å²	36	44.7 Å²	44.7	17%	0.168	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	121.6	173.1	-168.9	-179	179.4	0	0	110.6	V511 G512 I527 E575 T576 Q635	V511-E525 WeakPolarHBondContact CA-O 3.45Å; G512-E525 PolarHBondContact N-O 3.01Å; G512-E525 PolarHBondContact O-N 2.79Å; E525-I527 HydrophobicContact CB-CG1 4.14Å; E525-I527 VanDerWaalsContact CD-CG1 3.49Å; E525-I527 HydrophobicContact CG-CD1 4.48Å; E525-I527 HydrophobicContact CG-CG1 3.61Å; E525-I527 PolarHBondContact O-N 2.8Å; E525-E575 WeakPolarHBondContact CA-O 3.22Å; E525-T576 WeakPolarHBondContact CG-OG1 3.18Å; E525-Q635 PolarHBondContact OE2-NE2 2.86Å
526	M	93.1	Very high	81	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	103.9	165.7	-165	169.7	175.5	0	0	107.4	L509 L547 T562 Y573 K574 E575 F577 I593 V595	L509-M526 HydrophobicContact CD1-CE 3.42Å; L509-M526 VanDerWaalsContact CD1-CE 3.42Å; L509-M526 HydrophobicContact CD1-CG 3.93Å; L509-M526 HydrophobicContact CD1-SD 4.48Å; L509-M526 HydrophobicContact CD2-CE 3.78Å; L509-M526 HydrophobicContact CD2-CG 4.31Å; L509-M526 HydrophobicContact CD2-SD 4.45Å; L509-M526 HydrophobicContact CG-CE 4.27Å; M526-L547 HydrophobicContact SD-CD1 4.37Å; M526-T562 HydrophobicContact CB-CG2 4.4Å; M526-T562 HydrophobicContact CG-CG2 4.43Å; M526-T562 HydrophobicContact SD-CG2 3.42Å; M526-T562 WeakPolarHBondContact SD-CG2 3.33Å; M526-Y573 HydrophobicContact CE-CD2 3.86Å; M526-Y573 HydrophobicContact CE-CE2 3.51Å; M526-Y573 HydrophobicContact CE-CG 4.49Å; M526-Y573 HydrophobicContact CG-CD2 4Å; M526-Y573 HydrophobicContact CG-CG 4.26Å; M526-Y573 VanDerWaalsContact O-CB 3.24Å; M526-Y573 WeakPolarHBondContact O-CB 3.21Å; M526-Y573 HydrophobicContact SD-CD2 4.3Å; M526-Y573 HydrophobicContact SD-CE2 4.46Å; M526-Y573 HydrophobicContact SD-CG 4.46Å; M526-K574 PolarHBondContact O-N 3.09Å; M526-E575 PolarHBondContact N-O 2.84Å; M526-E575 PolarHBondContact O-N 2.76Å; M526-E575 VanDerWaalsContact O-N 3.13Å; M526-F577 HydrophobicContact CB-CE2 4.48Å; M526-I593 HydrophobicContact SD-CG2 4.44Å; M526-V595 HydrophobicContact CE-CG2 3.77Å
527	I	90.1	Very high	78.9	Confident	27 Å²	27	46 Å²	46	14%	0.138	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	-64.2	-169.6	-60.2	171.6	0	0	0	110.2	L510 E525 Y573 K574 C637	L510-I527 HydrophobicContact CB-CB 4.35Å; L510-I527 HydrophobicContact CD2-CB 4.05Å; L510-I527 HydrophobicContact CD2-CD1 4.25Å; L510-I527 HydrophobicContact CD2-CG2 3.83Å; L510-I527 HydrophobicContact CG-CB 4.01Å; L510-I527 HydrophobicContact CG-CD1 4.08Å; L510-I527 HydrophobicContact CG-CG2 4.37Å; L510-I527 PolarHBondContact O-N 2.78Å; L510-I527 VanDerWaalsContact O-N 3.1Å; E525-I527 HydrophobicContact CB-CG1 4.14Å; E525-I527 VanDerWaalsContact CD-CG1 3.49Å; E525-I527 HydrophobicContact CG-CD1 4.48Å; E525-I527 HydrophobicContact CG-CG1 3.61Å; E525-I527 PolarHBondContact O-N 2.8Å; I527-Y573 PolarHBondContact O-N 3.08Å; I527-K574 PolarHBondContact O-N 3.49Å; I527-K574 VanDerWaalsContact O-N 3.12Å; I527-C637 HydrophobicContact CD1-CB 4.25Å; I527-C637 VanDerWaalsContact CD1-SG 3.54Å
528	K	88.2	Confident	77.2	Confident	76 Å²	76	52 Å²	52	33%	0.33	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	136.1	-170.8	177.8	179.2	173.8	-169.7	0	111.2	L510 P571 V572 W639	L510-K528 HydrophobicContact CB-CB 4.46Å; L510-K528 WeakPolarHBondContact CB-O 3.37Å; L510-K528 PolarHBondContact N-O 2.83Å; K528-P571 CarbonylContact C-O 3.59Å; K528-P571 WeakPolarHBondContact CA-O 3.2Å; K528-V572 HydrophobicContact CD-CG2 4.39Å; K528-V572 HydrophobicContact CG-CG2 4.21Å; K528-W639 HydrophobicContact CB-CH2 4.35Å; K528-W639 HydrophobicContact CD-CH2 4.07Å; K528-W639 HydrophobicContact CG-CH2 4.12Å
529	G	85.3	Confident	75.7	Confident	0 Å²	0	55 Å²	55	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	144.7	163.3	0	0	0	0	0	111.4	E508 N570 P571	E508-G529 WeakPolarHBondContact O-CA 3.23Å; G529-N570 CarbonylContact O-C 3.59Å; G529-N570 WeakPolarHBondContact O-CA 3.5Å; G529-P571 PolarHBondContact N-O 3.11Å
530	S	80.5	Confident	74.2	Confident	10 Å²	10	53.1 Å²	53.1	7%	0.07	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	154.9	169.3	-167	0	0	0	0	109.8	E508 F532	E508-S530 PolarHBondContact N-O 3.23Å; E508-S530 PolarHBondContact O-N 3.07Å; S530-F532 WeakPolarHBondContact O-CD1 3.36Å; S530-F532 WeakPolarHBondContact O-CE1 3.23Å; S530-F532 PolarHBondContact O-N 2.84Å
531	H	69.9	Low	73.1	Confident	40 Å²	40	53 Å²	53	19%	0.185	26%	0.257	C	S	.	.			trans	60.5	16.9	168.6	-64	124.6	0	0	0	116.6	A506 E508 R533 N570	A506-H531 WeakPolarHBondContact O-CB 3.27Å; E508-H531 IonicContact OE2-CE1 2.78Å; E508-H531 PolarHBondContact OE2-CE1 2.6Å; E508-H531 IonicContact OE2-CG 3.02Å; E508-H531 IonicContact OE2-ND1 3.62Å; E508-H531 PolarHBondContact OE2-ND1 2.93Å; H531-R533 WeakPolarHBondContact O-CG 3.27Å; H531-R533 PolarHBondContact O-N 3.13Å; H531-N570 PolarHBondContact N-OD1 3.12Å
532	F	68.4	Low	72.6	Confident	5 Å²	5	48 Å²	48	2%	0.022	24%	0.24	C	C	.	.			trans	-69.5	16.7	174.8	-60.5	-12.5	0	0	0	114	P507 E508 L509 S530 N534 P541 T543 P569 P571 Y573 V595 I607 L642	P507-F532 HydrophobicContact CB-CD1 3.59Å; P507-F532 HydrophobicContact CB-CE1 3.9Å; E508-F532 WeakPolarHBondContact O-CE1 3.19Å; E508-F532 WeakPolarHBondContact O-CZ 3.34Å; L509-F532 HydrophobicContact CD1-CZ 4.28Å; S530-F532 WeakPolarHBondContact O-CD1 3.36Å; S530-F532 WeakPolarHBondContact O-CE1 3.23Å; S530-F532 PolarHBondContact O-N 2.84Å; F532-N534 PolarHBondContact O-N 3.35Å; F532-P541 HydrophobicContact CB-CG 4.46Å; F532-P541 WeakPolarHBondContact O-CD 3.36Å; F532-P541 VanDerWaalsContact O-CG 3.23Å; F532-P541 WeakPolarHBondContact O-CG 3.34Å; F532-T543 HydrophobicContact CD2-CG2 4.03Å; F532-P569 PolarHBondContact N-O 2.96Å; F532-P571 HydrophobicContact CD2-CG 3.45Å; F532-P571 VanDerWaalsContact CD2-CG 3.45Å; F532-P571 HydrophobicContact CE2-CG 3.6Å; F532-Y573 HydrophobicContact CE2-CE2 4.43Å; F532-V595 HydrophobicContact CD2-CG1 4.36Å; F532-V595 HydrophobicContact CE2-CG1 3.84Å; F532-V595 HydrophobicContact CZ-CG1 4.11Å; F532-V595 HydrophobicContact CZ-CG2 4.18Å; F532-I607 HydrophobicContact CB-CD1 4.49Å; F532-I607 HydrophobicContact CD1-CG2 4.18Å; F532-I607 HydrophobicContact CG-CG2 4.45Å; F532-L642 HydrophobicContact CE1-CD1 3.53Å; F532-L642 HydrophobicContact CE1-CG 4.45Å; F532-L642 HydrophobicContact CZ-CD1 3.85Å
533	R	58.2	Low	72.2	Confident	121 Å²	121	48 Å²	48	46%	0.457	24%	0.24	S	C	.	.			trans	-60.4	100	172.8	51.4	173.7	-170.2	-146.9	-2.7	110.1	H531 L535	H531-R533 WeakPolarHBondContact O-CG 3.27Å; H531-R533 PolarHBondContact O-N 3.13Å; R533-L535 VanDerWaalsContact C-N 3.25Å; R533-L535 HydrophobicContact CB-CG 4.5Å; R533-L535 HydrophobicContact CG-CD1 4.11Å; R533-L535 HydrophobicContact CG-CG 4.13Å; R533-L535 WeakPolarHBondContact O-CG 3.49Å; R533-L535 PolarHBondContact O-N 2.78Å
534	N	54.8	Low	72	Confident	36 Å²	36	47.3 Å²	47.3	19%	0.193	23%	0.233	C	C	.	.			trans	-66.8	89.2	168.2	-171.9	-74.7	0	0	0	108.3	F532 A536 V537 E605	F532-N534 PolarHBondContact O-N 3.35Å; N534-A536 CarbonylContact O-C 3.52Å; N534-A536 PolarHBondContact O-N 3.2Å; N534-A536 WeakPolarHBondContact OD1-CB 3.37Å; N534-A536 PolarHBondContact OD1-N 2.96Å; N534-V537 PolarHBondContact O-N 2.99Å; N534-V537 PolarHBondContact OD1-N 3.01Å; N534-E605 PolarHBondContact ND2-OE1 3.33Å
535	L	48.5	Very low	71.8	Confident	89 Å²	89	47.3 Å²	47.3	47%	0.466	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.1	1.1	-173.7	-74.2	142	0	0	0	114.2	R533	R533-L535 VanDerWaalsContact C-N 3.25Å; R533-L535 HydrophobicContact CB-CG 4.5Å; R533-L535 HydrophobicContact CG-CD1 4.11Å; R533-L535 HydrophobicContact CG-CG 4.13Å; R533-L535 WeakPolarHBondContact O-CG 3.49Å; R533-L535 PolarHBondContact O-N 2.78Å
536	A	44.6	Very low	71.7	Confident	39 Å²	39	46.9 Å²	46.9	32%	0.322	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.2	-51.3	164.8	0	0	0	0	0	110.9	R445 N534	R445-A536 VanDerWaalsContact CZ-C 3.41Å; R445-A536 VanDerWaalsContact CZ-CB 3.47Å; R445-A536 VanDerWaalsContact NH1-CB 3.27Å; R445-A536 PolarHBondContact NH1-O 3.15Å; R445-A536 PolarHBondContact NH2-O 3.49Å; N534-A536 CarbonylContact O-C 3.52Å; N534-A536 PolarHBondContact O-N 3.2Å; N534-A536 WeakPolarHBondContact OD1-CB 3.37Å; N534-A536 PolarHBondContact OD1-N 2.96Å
537	V	48.5	Very low	71.8	Confident	56 Å²	56	46.9 Å²	46.9	34%	0.339	23%	0.231	S	C	.	.	S	Bend	trans	-88	123.2	-178.9	-170.8	0	0	0	0	110.1	N534 R539	N534-V537 PolarHBondContact O-N 2.99Å; N534-V537 PolarHBondContact OD1-N 3.01Å; V537-R539 HydrophobicContact CG1-CB 3.97Å; V537-R539 PolarHBondContact O-N 2.96Å
538	N	51.1	Low	71.9	Confident	176 Å²	176	46.4 Å²	46.4	94%	0.941	23%	0.228	S	C	*	.	S	Bend	trans	-68.5	27.7	174.7	-68.4	-14.2	0	0	0	113.8
539	R	57.1	Low	72.1	Confident	202 Å²	202	42.9 Å²	42.9	76%	0.762	21%	0.212	S	C	*	.	S	Bend	trans	-144.1	131.2	-178.5	-169.9	176.4	-173.2	163.4	4.9	107.5	V537	V537-R539 HydrophobicContact CG1-CB 3.97Å; V537-R539 PolarHBondContact O-N 2.96Å
540	A	58.8	Low	72.3	Confident	28 Å²	28	44.5 Å²	44.5	23%	0.231	22%	0.221	C	C	.	.			trans	-59.2	142.4	178.1	0	0	0	0	0	111.3	G567 P569	A540-G567 VanDerWaalsContact CB-O 3.27Å; A540-G567 WeakPolarHBondContact CB-O 3.34Å; A540-P569 HydrophobicContact CB-CB 4.4Å
541	P	67.9	Low	72.6	Confident	7 Å²	7	45.9 Å²	45.9	5%	0.045	23%	0.227	C	C	.	.			trans	-74	160.2	-177.1	30.9	-35.4	0	0	0	113	F532 T543 G567 N597 I607	F532-P541 HydrophobicContact CB-CG 4.46Å; F532-P541 WeakPolarHBondContact O-CD 3.36Å; F532-P541 VanDerWaalsContact O-CG 3.23Å; F532-P541 WeakPolarHBondContact O-CG 3.34Å; P541-T543 HydrophobicContact CB-CG2 3.96Å; P541-T543 HydrophobicContact CG-CG2 3.65Å; P541-G567 PolarHBondContact O-N 3.34Å; P541-N597 HydrophobicContact CB-CB 4.49Å; P541-N597 VanDerWaalsContact CB-ND2 3.34Å; P541-N597 WeakPolarHBondContact CB-ND2 3.23Å; P541-I607 HydrophobicContact CG-CD1 4.37Å
542	D	81.8	Confident	73.2	Confident	33 Å²	33	47 Å²	47	18%	0.176	24%	0.24	C	C	.	.			trans	-90.2	111.4	165.3	-78.3	15.1	0	0	0	108	R565 R566 G567 N597 R598	D542-R565 CarbonylContact C-O 3.57Å; D542-R565 WeakPolarHBondContact CA-O 3.43Å; D542-R566 HydrophobicContact CB-CG 4.45Å; D542-R566 VanDerWaalsContact OD1-CA 3.23Å; D542-R566 WeakPolarHBondContact OD1-CA 3.3Å; D542-R566 VanDerWaalsContact OD1-CB 3.27Å; D542-R566 WeakPolarHBondContact OD1-CB 2.95Å; D542-R566 WeakPolarHBondContact OD2-CD 3.47Å; D542-R566 WeakPolarHBondContact OD2-CG 3.3Å; D542-G567 PolarHBondContact OD1-N 2.85Å; D542-G567 VanDerWaalsContact OD1-N 3.12Å; D542-N597 CarbonylContact O-C 3.6Å; D542-N597 WeakPolarHBondContact O-CA 3.42Å; D542-R598 WeakPolarHBondContact CB-O 3.34Å; D542-R598 PolarHBondContact O-N 3.48Å; D542-R598 IonicContact OD2-NH2 2.75Å
543	T	86.2	Confident	73.7	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	145.1	-168.5	61.1	0	0	0	0	112.6	F532 P541 R565 P571 Y573 Y596 I607	F532-T543 HydrophobicContact CD2-CG2 4.03Å; P541-T543 HydrophobicContact CB-CG2 3.96Å; P541-T543 HydrophobicContact CG-CG2 3.65Å; T543-R565 PolarHBondContact N-O 3.03Å; T543-R565 PolarHBondContact O-N 2.75Å; T543-P571 WeakPolarHBondContact OG1-CB 3.48Å; T543-P571 WeakPolarHBondContact OG1-CG 3.23Å; T543-Y573 WeakPolarHBondContact CB-OH 3.45Å; T543-Y573 PolarHBondContact OG1-OH 3.23Å; T543-Y596 WeakPolarHBondContact CA-O 3.46Å; T543-I607 HydrophobicContact CG2-CD1 3.59Å
544	Y	89.5	Confident	74.6	Confident	13 Å²	13	48.6 Å²	48.6	5%	0.051	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	141.2	169.7	72.3	-77.5	0	0	0	111.2	K546 T562 I564 Y596 R598	Y544-K546 HydrophobicContact CD2-CG 4.32Å; Y544-K546 HydrophobicContact CE2-CD 4.37Å; Y544-K546 HydrophobicContact CE2-CG 3.86Å; Y544-K546 WeakPolarHBondContact OH-CE 3.49Å; Y544-T562 WeakPolarHBondContact CA-OG1 3.3Å; Y544-I564 HydrophobicContact CG-CG1 4.22Å; Y544-Y596 WeakPolarHBondContact CD1-O 3.35Å; Y544-Y596 VanDerWaalsContact CE1-CB 3.46Å; Y544-Y596 HydrophobicContact CE1-CG 4.44Å; Y544-Y596 HydrophobicContact CE2-CD2 4.35Å; Y544-Y596 PolarHBondContact N-O 2.92Å; Y544-Y596 PolarHBondContact O-N 3.08Å; Y544-R598 HydrophobicContact CD1-CB 4.05Å; Y544-R598 HydrophobicContact CE1-CB 3.9Å
545	G	90.7	Very high	75.8	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	149.8	171.3	0	0	0	0	0	111.8	K561 T562 S594	G545-K561 WeakPolarHBondContact O-CA 3.48Å; G545-T562 PolarHBondContact N-OG1 2.75Å; G545-T562 PolarHBondContact O-N 3.29Å; G545-S594 CarbonylContact C-O 3.54Å
546	K	92.6	Very high	77.7	Confident	27 Å²	27	53.3 Å²	53.3	12%	0.117	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	133	155.9	-54.3	-174.4	-156.7	146	0	107.6	Y544 F548 C560 K561 S594 Y596	Y544-K546 HydrophobicContact CD2-CG 4.32Å; Y544-K546 HydrophobicContact CE2-CD 4.37Å; Y544-K546 HydrophobicContact CE2-CG 3.86Å; Y544-K546 WeakPolarHBondContact OH-CE 3.49Å; K546-F548 HydrophobicContact CB-CD2 4.27Å; K546-F548 HydrophobicContact CB-CE2 3.69Å; K546-F548 HydrophobicContact CB-CZ 4.35Å; K546-F548 HydrophobicContact CD-CE2 4.19Å; K546-F548 HydrophobicContact CD-CZ 4.16Å; K546-C560 WeakPolarHBondContact CA-O 3.31Å; K546-K561 HydrophobicContact CG-CG 4.17Å; K546-S594 PolarHBondContact N-O 2.82Å; K546-S594 PolarHBondContact O-N 2.82Å; K546-Y596 HydrophobicContact CB-CE2 4.2Å; K546-Y596 HydrophobicContact CD-CD2 3.97Å; K546-Y596 HydrophobicContact CD-CE2 3.46Å; K546-Y596 VanDerWaalsContact CD-CE2 3.46Å; K546-Y596 VanDerWaalsContact CE-CD2 3.47Å; K546-Y596 HydrophobicContact CG-CD2 3.85Å; K546-Y596 HydrophobicContact CG-CE2 3.7Å; K546-Y596 PolarHBondContact NZ-OH 2.82Å; K546-Y596 VanDerWaalsContact NZ-OH 3.07Å
547	L	94.1	Very high	79.7	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	136.7	174	-65.2	79.1	0	0	0	107.5	V524 M526 R559 C560 T562 F577 F579 M592 I593	V524-L547 HydrophobicContact CB-CD2 4.09Å; V524-L547 HydrophobicContact CG1-CD2 3.57Å; M526-L547 HydrophobicContact SD-CD1 4.37Å; L547-R559 WeakPolarHBondContact O-CA 3.49Å; L547-C560 HydrophobicContact CB-CB 4.28Å; L547-C560 PolarHBondContact N-O 2.84Å; L547-C560 PolarHBondContact O-N 3.02Å; L547-T562 HydrophobicContact CD1-CG2 4.37Å; L547-F577 HydrophobicContact CD1-CD2 3.83Å; L547-F577 HydrophobicContact CD1-CE2 3.71Å; L547-F577 HydrophobicContact CD1-CZ 4.37Å; L547-F577 HydrophobicContact CD2-CB 4.35Å; L547-F577 HydrophobicContact CD2-CD2 3.58Å; L547-F577 HydrophobicContact CD2-CE2 4.27Å; L547-F577 HydrophobicContact CD2-CG 4.18Å; L547-F577 HydrophobicContact CG-CD2 4.35Å; L547-F579 HydrophobicContact CB-CZ 4.13Å; L547-F579 HydrophobicContact CD2-CE2 4.36Å; L547-F579 HydrophobicContact CD2-CZ 4.34Å; L547-M592 WeakPolarHBondContact CA-O 3.48Å; L547-I593 HydrophobicContact CD2-CD1 4.42Å; L547-I593 HydrophobicContact CD2-CG1 4.45Å; L547-I593 HydrophobicContact CG-CG1 4.17Å; L547-I593 HydrophobicContact CG-CG2 4.28Å
548	F	92.8	Very high	81.6	Confident	16 Å²	16	54.4 Å²	54.4	7%	0.07	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	126.5	177.6	-62.2	-98.6	0	0	0	107.6	K546 L550 E556 R559 M592	K546-F548 HydrophobicContact CB-CD2 4.27Å; K546-F548 HydrophobicContact CB-CE2 3.69Å; K546-F548 HydrophobicContact CB-CZ 4.35Å; K546-F548 HydrophobicContact CD-CE2 4.19Å; K546-F548 HydrophobicContact CD-CZ 4.16Å; F548-L550 HydrophobicContact CB-CD2 4.42Å; F548-E556 VanDerWaalsContact CD1-CD 3.49Å; F548-E556 HydrophobicContact CD1-CG 4.01Å; F548-E556 WeakPolarHBondContact CD1-OE1 3.48Å; F548-R559 HydrophobicContact CD1-CG 3.92Å; F548-R559 HydrophobicContact CE1-CG 4.05Å; F548-M592 HydrophobicContact CB-CB 4.39Å; F548-M592 HydrophobicContact CB-CE 4.02Å; F548-M592 HydrophobicContact CD2-CE 3.78Å; F548-M592 HydrophobicContact CE2-CE 4.27Å; F548-M592 HydrophobicContact CG-CE 3.97Å; F548-M592 PolarHBondContact N-O 3.13Å; F548-M592 PolarHBondContact O-N 2.81Å
549	L	92.6	Very high	83.5	Confident	2 Å²	2	51.3 Å²	51.3	1%	0.01	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	121.3	166.9	-168.1	72.4	0	0	0	108.3	L522 M557 S558 F579 V581 V589 L591	L522-L549 HydrophobicContact CD2-CD1 4.2Å; L549-M557 HydrophobicContact CD2-SD 4.4Å; L549-M557 PolarHBondContact O-N 3.5Å; L549-S558 WeakPolarHBondContact CB-OG 3.27Å; L549-S558 PolarHBondContact N-O 2.83Å; L549-S558 PolarHBondContact O-N 2.85Å; L549-F579 HydrophobicContact CD2-CB 4.11Å; L549-F579 HydrophobicContact CD2-CG 4.47Å; L549-V581 HydrophobicContact CD2-CG2 3.45Å; L549-V581 VanDerWaalsContact CD2-CG2 3.45Å; L549-V589 HydrophobicContact CD1-CB 4.05Å; L549-V589 HydrophobicContact CD1-CG2 4.19Å; L549-V589 HydrophobicContact CG-CB 4.4Å; L549-L591 HydrophobicContact CD1-CB 4.12Å
550	L	89.3	Confident	85.2	Confident	35 Å²	35	43.2 Å²	43.2	18%	0.183	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	143.4	178	-51.8	-179.7	0	0	0	109.6	F548 Q555 E556 V589 T590	F548-L550 HydrophobicContact CB-CD2 4.42Å; L550-Q555 WeakPolarHBondContact CA-O 2.97Å; L550-E556 HydrophobicContact CD2-CB 4.24Å; L550-V589 CarbonylContact O-C 3.53Å; L550-V589 WeakPolarHBondContact O-CA 3.4Å; L550-V589 WeakPolarHBondContact O-CB 3.45Å; L550-T590 PolarHBondContact N-O 3.04Å; L550-T590 PolarHBondContact O-N 2.8Å
551	N	87.3	Confident	86.8	Confident	38 Å²	38	47.9 Å²	47.9	20%	0.203	26%	0.256	C	S	.	.			trans	-83.4	173.5	168.8	-160	12.2	0	0	0	111.1	V553 G554 Q555 M557	N551-V553 PolarHBondContact O-N 3.39Å; N551-V553 VanDerWaalsContact O-N 3.07Å; N551-G554 WeakPolarHBondContact O-CA 3.37Å; N551-G554 PolarHBondContact O-N 3.2Å; N551-Q555 PolarHBondContact N-O 2.85Å; N551-M557 HydrophobicContact CB-CG 3.81Å; N551-M557 HydrophobicContact CB-SD 3.72Å
552	S	82.1	Confident	87.9	Confident	63 Å²	63	48 Å²	48	44%	0.441	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-25.2	177.2	43.2	0	0	0	0	114.6	G554 D588	S552-G554 VanDerWaalsContact C-N 3.26Å; S552-G554 PolarHBondContact O-N 3.01Å; S552-D588 WeakPolarHBondContact CA-O 3.44Å; S552-D588 PolarHBondContact N-O 2.88Å; S552-D588 VanDerWaalsContact N-O 3.16Å; S552-D588 PolarHBondContact OG-OD2 2.8Å
553	V	79.1	Confident	88.2	Confident	109 Å²	109	48.6 Å²	48.6	66%	0.661	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.6	9.4	174.7	-157.2	0	0	0	0	112.6	N551 Q555	N551-V553 PolarHBondContact O-N 3.39Å; N551-V553 VanDerWaalsContact O-N 3.07Å; V553-Q555 HydrophobicContact CB-CG 4.49Å; V553-Q555 PolarHBondContact O-N 3.39Å
554	G	76.3	Confident	88.2	Confident	52 Å²	52	51.5 Å²	51.5	54%	0.536	28%	0.279	S	S	.	.			trans	71.8	8.2	-178.3	0	0	0	0	0	115.3	N551 S552	N551-G554 WeakPolarHBondContact O-CA 3.37Å; N551-G554 PolarHBondContact O-N 3.2Å; S552-G554 VanDerWaalsContact C-N 3.26Å; S552-G554 PolarHBondContact O-N 3.01Å
555	Q	81.4	Confident	87.9	Confident	130 Å²	130	55.2 Å²	55.2	61%	0.607	29%	0.292	S	S	*	.			trans	-78.7	132.5	-179.4	-67.9	-176.5	-25.4	0	0	112	L550 N551 V553 M557	L550-Q555 WeakPolarHBondContact CA-O 2.97Å; N551-Q555 PolarHBondContact N-O 2.85Å; V553-Q555 HydrophobicContact CB-CG 4.49Å; V553-Q555 PolarHBondContact O-N 3.39Å; Q555-M557 PolarHBondContact O-N 2.98Å
556	E	88	Confident	87.1	Confident	94 Å²	94	62.9 Å²	62.9	44%	0.439	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66	96.8	175.7	-175.4	176.2	162.1	0	0	110.2	F548 L550 R559	F548-E556 VanDerWaalsContact CD1-CD 3.49Å; F548-E556 HydrophobicContact CD1-CG 4.01Å; F548-E556 WeakPolarHBondContact CD1-OE1 3.48Å; L550-E556 HydrophobicContact CD2-CB 4.24Å; E556-R559 WeakPolarHBondContact OE1-CB 3.33Å; E556-R559 WeakPolarHBondContact OE1-CD 3.45Å; E556-R559 WeakPolarHBondContact OE1-CG 3.38Å; E556-R559 IonicContact OE1-CZ 3.45Å; E556-R559 IonicContact OE1-NE 3.95Å; E556-R559 IonicContact OE1-NH1 3.57Å; E556-R559 PolarHBondContact OE1-NH1 3.28Å; E556-R559 IonicContact OE2-NH1 3.29Å; E556-R559 PolarHBondContact OE2-NH1 3.03Å
557	M	86.3	Confident	85.8	Confident	79 Å²	79	63.6 Å²	63.6	39%	0.389	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	-39.5	176.9	-64.1	-179.3	69.7	0	0	111.7	L549 N551 Q555 V589	L549-M557 HydrophobicContact CD2-SD 4.4Å; L549-M557 PolarHBondContact O-N 3.5Å; N551-M557 HydrophobicContact CB-CG 3.81Å; N551-M557 HydrophobicContact CB-SD 3.72Å; Q555-M557 PolarHBondContact O-N 2.98Å; M557-V589 HydrophobicContact SD-CG1 3.92Å
558	S	88.8	Confident	84.5	Confident	39 Å²	39	67.7 Å²	67.7	27%	0.273	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156	157.8	-179.1	61.6	0	0	0	0	111.7	L549 F579	L549-S558 WeakPolarHBondContact CB-OG 3.27Å; L549-S558 PolarHBondContact N-O 2.83Å; L549-S558 PolarHBondContact O-N 2.85Å; S558-F579 WeakPolarHBondContact OG-CD1 3.4Å; S558-F579 WeakPolarHBondContact OG-CE1 3.41Å
559	R	91.6	Very high	83.1	Confident	111 Å²	111	69.9 Å²	69.9	42%	0.419	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	126.7	-174.4	-161.7	-161	-161.5	122.2	-1.8	111.8	L547 F548 E556	L547-R559 WeakPolarHBondContact O-CA 3.49Å; F548-R559 HydrophobicContact CD1-CG 3.92Å; F548-R559 HydrophobicContact CE1-CG 4.05Å; E556-R559 WeakPolarHBondContact OE1-CB 3.33Å; E556-R559 WeakPolarHBondContact OE1-CD 3.45Å; E556-R559 WeakPolarHBondContact OE1-CG 3.38Å; E556-R559 IonicContact OE1-CZ 3.45Å; E556-R559 IonicContact OE1-NE 3.95Å; E556-R559 IonicContact OE1-NH1 3.57Å; E556-R559 PolarHBondContact OE1-NH1 3.28Å; E556-R559 IonicContact OE2-NH1 3.29Å; E556-R559 PolarHBondContact OE2-NH1 3.03Å
560	C	92.9	Very high	82.4	Confident	32 Å²	32	73.1 Å²	73.1	22%	0.216	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	162.4	171.2	-62.7	0	0	0	0	111	K546 L547 F577 F579	K546-C560 WeakPolarHBondContact CA-O 3.31Å; L547-C560 HydrophobicContact CB-CB 4.28Å; L547-C560 PolarHBondContact N-O 2.84Å; L547-C560 PolarHBondContact O-N 3.02Å; C560-F577 HydrophobicContact CB-CB 4.3Å; C560-F577 HydrophobicContact CB-CD1 3.33Å; C560-F577 HydrophobicContact CB-CE1 3.77Å; C560-F577 HydrophobicContact CB-CG 3.81Å; C560-F579 HydrophobicContact CB-CE1 4.47Å; C560-F579 HydrophobicContact CB-CZ 4.33Å; C560-F579 VanDerWaalsContact SG-CE1 3.55Å
561	K	91.9	Very high	82	Confident	125 Å²	125	71.5 Å²	71.5	54%	0.543	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	139.1	176.2	-56.9	177.1	-172.5	142.1	0	107.2	G545 K546	G545-K561 WeakPolarHBondContact O-CA 3.48Å; K546-K561 HydrophobicContact CG-CG 4.17Å
562	T	91.4	Very high	81.9	Confident	10 Å²	10	72.4 Å²	72.4	6%	0.061	39%	0.387	C	S	.	.			trans	-76.6	168.6	177.2	67.3	0	0	0	0	112.3	M526 Y544 G545 L547 Y573 E575 F577	M526-T562 HydrophobicContact CB-CG2 4.4Å; M526-T562 HydrophobicContact CG-CG2 4.43Å; M526-T562 HydrophobicContact SD-CG2 3.42Å; M526-T562 WeakPolarHBondContact SD-CG2 3.33Å; Y544-T562 WeakPolarHBondContact CA-OG1 3.3Å; G545-T562 PolarHBondContact N-OG1 2.75Å; G545-T562 PolarHBondContact O-N 3.29Å; L547-T562 HydrophobicContact CD1-CG2 4.37Å; T562-Y573 HydrophobicContact CG2-CD1 4.05Å; T562-Y573 HydrophobicContact CG2-CE1 4.47Å; T562-Y573 HydrophobicContact CG2-CG 4.49Å; T562-Y573 WeakPolarHBondContact OG1-CE1 3.47Å; T562-E575 WeakPolarHBondContact CA-OE2 3.16Å; T562-E575 VanDerWaalsContact CB-OE2 3.3Å; T562-E575 WeakPolarHBondContact CB-OE2 3.14Å; T562-F577 HydrophobicContact CG2-CE2 3.92Å; T562-F577 HydrophobicContact CG2-CZ 3.86Å
563	S	88	Confident	82.1	Confident	45 Å²	45	69.4 Å²	69.4	32%	0.315	37%	0.366	S	S	.	.			trans	-56.9	162	155	82.5	0	0	0	0	111.1	E575	S563-E575 WeakPolarHBondContact CB-OE1 3.37Å; S563-E575 PolarHBondContact N-OE1 2.81Å; S563-E575 VanDerWaalsContact N-OE1 3.08Å; S563-E575 PolarHBondContact N-OE2 3.44Å; S563-E575 PolarHBondContact OG-OE1 2.8Å
564	I	85.7	Confident	82.7	Confident	61 Å²	61	71.4 Å²	71.4	31%	0.313	37%	0.366	S	S	.	.			trans	-106.9	101.9	-172.4	-52.3	170	0	0	0	108.5	Y544 R598	Y544-I564 HydrophobicContact CG-CG1 4.22Å; I564-R598 VanDerWaalsContact CD1-NH1 3.25Å
565	R	82.1	Confident	83.5	Confident	91 Å²	91	70.6 Å²	70.6	34%	0.343	35%	0.348	S	S	.	.	B	Isolated β-bridge	trans	-80.3	124.6	178.3	-58.6	-57.3	-172.1	-162.5	-5	108.9	D542 T543 P571 V572 Y573 E575	D542-R565 CarbonylContact C-O 3.57Å; D542-R565 WeakPolarHBondContact CA-O 3.43Å; T543-R565 PolarHBondContact N-O 3.03Å; T543-R565 PolarHBondContact O-N 2.75Å; R565-P571 HydrophobicContact CB-CB 3.81Å; R565-P571 HydrophobicContact CG-CB 4.26Å; R565-V572 WeakPolarHBondContact CD-O 3.44Å; R565-V572 PolarHBondContact NE-O 2.95Å; R565-Y573 HydrophobicContact CB-CE1 4.43Å; R565-Y573 HydrophobicContact CG-CD1 3.83Å; R565-Y573 HydrophobicContact CG-CE1 3.88Å; R565-Y573 PolarHBondContact NH2-O 2.83Å; R565-E575 IonicContact NH2-OE1 3.6Å
566	R	75.7	Confident	84	Confident	161 Å²	161	68.2 Å²	68.2	61%	0.608	34%	0.342	S	S	*	.			trans	-103.1	140.9	-172.5	-57.3	-163.2	-160.4	-167.8	9.8	111.7	D542 Q568	D542-R566 HydrophobicContact CB-CG 4.45Å; D542-R566 VanDerWaalsContact OD1-CA 3.23Å; D542-R566 WeakPolarHBondContact OD1-CA 3.3Å; D542-R566 VanDerWaalsContact OD1-CB 3.27Å; D542-R566 WeakPolarHBondContact OD1-CB 2.95Å; D542-R566 WeakPolarHBondContact OD2-CD 3.47Å; D542-R566 WeakPolarHBondContact OD2-CG 3.3Å; R566-Q568 PolarHBondContact O-N 2.85Å; R566-Q568 VanDerWaalsContact O-N 3.11Å
567	G	64.4	Low	84.4	Confident	42 Å²	42	65 Å²	65	43%	0.433	33%	0.327	S	S	.	.	S	Bend	trans	58.9	22.9	169.2	0	0	0	0	0	116.7	A540 P541 D542	A540-G567 VanDerWaalsContact CB-O 3.27Å; A540-G567 WeakPolarHBondContact CB-O 3.34Å; P541-G567 PolarHBondContact O-N 3.34Å; D542-G567 PolarHBondContact OD1-N 2.85Å; D542-G567 VanDerWaalsContact OD1-N 3.12Å
568	Q	67.4	Low	84.7	Confident	86 Å²	86	65.1 Å²	65.1	40%	0.402	33%	0.332	S	S	.	.			trans	-111.2	125.8	179	-72.8	-179.9	-17.8	0	0	110.9	R566 N570 P571	R566-Q568 PolarHBondContact O-N 2.85Å; R566-Q568 VanDerWaalsContact O-N 3.11Å; Q568-N570 VanDerWaalsContact C-N 3.28Å; Q568-P571 HydrophobicContact CB-CB 4.35Å
569	P	63.5	Low	84.9	Confident	63 Å²	63	63.5 Å²	63.5	41%	0.409	32%	0.32	S	S	.	.	S	Bend	trans	-72.4	-25.4	177.1	29.6	-34.2	0	0	0	112.4	F532 A540	F532-P569 PolarHBondContact N-O 2.96Å; A540-P569 HydrophobicContact CB-CB 4.4Å
570	N	76.9	Confident	85	Confident	70 Å²	70	64.3 Å²	64.3	37%	0.374	33%	0.329	S	S	.	.	S	Bend	trans	-126.3	76.2	176.4	-59.9	-32.5	0	0	0	108.3	G529 H531 Q568	G529-N570 CarbonylContact O-C 3.59Å; G529-N570 WeakPolarHBondContact O-CA 3.5Å; H531-N570 PolarHBondContact N-OD1 3.12Å; Q568-N570 VanDerWaalsContact C-N 3.28Å
571	P	80.2	Confident	84.9	Confident	0 Å²	0	62.8 Å²	62.8	0%	0	32%	0.318	C	S	.	.			trans	-68.1	136.1	-173.9	30.3	-37.8	0	0	0	111.3	K528 G529 F532 T543 R565 Q568 Y573	K528-P571 CarbonylContact C-O 3.59Å; K528-P571 WeakPolarHBondContact CA-O 3.2Å; G529-P571 PolarHBondContact N-O 3.11Å; F532-P571 HydrophobicContact CD2-CG 3.45Å; F532-P571 VanDerWaalsContact CD2-CG 3.45Å; F532-P571 HydrophobicContact CE2-CG 3.6Å; T543-P571 WeakPolarHBondContact OG1-CB 3.48Å; T543-P571 WeakPolarHBondContact OG1-CG 3.23Å; R565-P571 HydrophobicContact CB-CB 3.81Å; R565-P571 HydrophobicContact CG-CB 4.26Å; Q568-P571 HydrophobicContact CB-CB 4.35Å; P571-Y573 HydrophobicContact CB-CE2 4.05Å; P571-Y573 HydrophobicContact CG-CE2 3.76Å
572	V	86.6	Confident	84.9	Confident	57 Å²	57	58.2 Å²	58.2	35%	0.345	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	119.7	171.9	178.8	0	0	0	0	108	K528 R565 K574	K528-V572 HydrophobicContact CD-CG2 4.39Å; K528-V572 HydrophobicContact CG-CG2 4.21Å; R565-V572 WeakPolarHBondContact CD-O 3.44Å; R565-V572 PolarHBondContact NE-O 2.95Å; V572-K574 HydrophobicContact CG1-CD 3.96Å; V572-K574 HydrophobicContact CG1-CG 3.73Å
573	Y	86.8	Confident	84.8	Confident	1 Å²	1	63 Å²	63	0%	0.004	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	-58.2	178.7	-64.1	-82.1	0	0	0	109.8	M526 I527 F532 T543 T562 R565 P571 E575	M526-Y573 HydrophobicContact CE-CD2 3.86Å; M526-Y573 HydrophobicContact CE-CE2 3.51Å; M526-Y573 HydrophobicContact CE-CG 4.49Å; M526-Y573 HydrophobicContact CG-CD2 4Å; M526-Y573 HydrophobicContact CG-CG 4.26Å; M526-Y573 VanDerWaalsContact O-CB 3.24Å; M526-Y573 WeakPolarHBondContact O-CB 3.21Å; M526-Y573 HydrophobicContact SD-CD2 4.3Å; M526-Y573 HydrophobicContact SD-CE2 4.46Å; M526-Y573 HydrophobicContact SD-CG 4.46Å; I527-Y573 PolarHBondContact O-N 3.08Å; F532-Y573 HydrophobicContact CE2-CE2 4.43Å; T543-Y573 WeakPolarHBondContact CB-OH 3.45Å; T543-Y573 PolarHBondContact OG1-OH 3.23Å; T562-Y573 HydrophobicContact CG2-CD1 4.05Å; T562-Y573 HydrophobicContact CG2-CE1 4.47Å; T562-Y573 HydrophobicContact CG2-CG 4.49Å; T562-Y573 WeakPolarHBondContact OG1-CE1 3.47Å; R565-Y573 HydrophobicContact CB-CE1 4.43Å; R565-Y573 HydrophobicContact CG-CD1 3.83Å; R565-Y573 HydrophobicContact CG-CE1 3.88Å; R565-Y573 PolarHBondContact NH2-O 2.83Å; P571-Y573 HydrophobicContact CB-CE2 4.05Å; P571-Y573 HydrophobicContact CG-CE2 3.76Å; Y573-E575 VanDerWaalsContact C-N 3.32Å
574	K	90.1	Very high	84.8	Confident	151 Å²	151	68.6 Å²	68.6	66%	0.657	35%	0.348	S	S	*	.	E	Extended strand (participates in β ladder)	trans	51.3	50.1	-172.5	-69.2	-179.8	174.9	-170.3	0	111.7	M526 I527 V572	M526-K574 PolarHBondContact O-N 3.09Å; I527-K574 PolarHBondContact O-N 3.49Å; I527-K574 VanDerWaalsContact O-N 3.12Å; V572-K574 HydrophobicContact CG1-CD 3.96Å; V572-K574 HydrophobicContact CG1-CG 3.73Å
575	E	92.9	Very high	84.9	Confident	35 Å²	35	68.3 Å²	68.3	16%	0.164	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	119.2	-177.5	-73.1	173.5	-129.1	0	0	110.2	E525 M526 T562 S563 R565 Y573 F577	E525-E575 WeakPolarHBondContact CA-O 3.22Å; M526-E575 PolarHBondContact N-O 2.84Å; M526-E575 PolarHBondContact O-N 2.76Å; M526-E575 VanDerWaalsContact O-N 3.13Å; T562-E575 WeakPolarHBondContact CA-OE2 3.16Å; T562-E575 VanDerWaalsContact CB-OE2 3.3Å; T562-E575 WeakPolarHBondContact CB-OE2 3.14Å; S563-E575 WeakPolarHBondContact CB-OE1 3.37Å; S563-E575 PolarHBondContact N-OE1 2.81Å; S563-E575 VanDerWaalsContact N-OE1 3.08Å; S563-E575 PolarHBondContact N-OE2 3.44Å; S563-E575 PolarHBondContact OG-OE1 2.8Å; R565-E575 IonicContact NH2-OE1 3.6Å; Y573-E575 VanDerWaalsContact C-N 3.32Å; E575-F577 HydrophobicContact CB-CE2 3.87Å; E575-F577 HydrophobicContact CB-CZ 3.83Å; E575-F577 WeakPolarHBondContact O-CE2 3.33Å
576	T	93.6	Very high	85.2	Confident	79 Å²	79	64.1 Å²	64.1	49%	0.485	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	127.5	178.6	-54.6	0	0	0	0	111	V524 E525	V524-T576 WeakPolarHBondContact O-CA 3.32Å; E525-T576 WeakPolarHBondContact CG-OG1 3.18Å
577	F	94.8	Very high	85.8	Confident	27 Å²	27	59.2 Å²	59.2	12%	0.118	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	130.6	176	-56.4	-76.8	0	0	0	109.1	S523 V524 M526 L547 C560 T562 E575 F579	S523-F577 CarbonylContact C-O 3.54Å; S523-F577 WeakPolarHBondContact CA-O 3.42Å; V524-F577 PolarHBondContact N-O 2.92Å; V524-F577 PolarHBondContact O-N 3.14Å; M526-F577 HydrophobicContact CB-CE2 4.48Å; L547-F577 HydrophobicContact CD1-CD2 3.83Å; L547-F577 HydrophobicContact CD1-CE2 3.71Å; L547-F577 HydrophobicContact CD1-CZ 4.37Å; L547-F577 HydrophobicContact CD2-CB 4.35Å; L547-F577 HydrophobicContact CD2-CD2 3.58Å; L547-F577 HydrophobicContact CD2-CE2 4.27Å; L547-F577 HydrophobicContact CD2-CG 4.18Å; L547-F577 HydrophobicContact CG-CD2 4.35Å; C560-F577 HydrophobicContact CB-CB 4.3Å; C560-F577 HydrophobicContact CB-CD1 3.33Å; C560-F577 HydrophobicContact CB-CE1 3.77Å; C560-F577 HydrophobicContact CB-CG 3.81Å; T562-F577 HydrophobicContact CG2-CE2 3.92Å; T562-F577 HydrophobicContact CG2-CZ 3.86Å; E575-F577 HydrophobicContact CB-CE2 3.87Å; E575-F577 HydrophobicContact CB-CZ 3.83Å; E575-F577 WeakPolarHBondContact O-CE2 3.33Å; F577-F579 HydrophobicContact CB-CE2 3.97Å; F577-F579 HydrophobicContact CB-CZ 3.9Å
578	V	93.6	Very high	86.9	Confident	81 Å²	81	60.3 Å²	60.3	49%	0.491	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	124	179.8	-175.8	0	0	0	0	109.3	R521 L522	R521-V578 HydrophobicContact CB-CG1 4.1Å; R521-V578 HydrophobicContact CG-CG1 4.17Å; L522-V578 WeakPolarHBondContact O-CA 3.46Å
579	F	93.2	Very high	88	Confident	6 Å²	6	56.2 Å²	56.2	3%	0.026	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	140.1	177.9	-54.7	-71.6	0	0	0	110.1	L522 V524 L547 L549 S558 C560 F577 V581 L591	L522-F579 HydrophobicContact CB-CB 4.34Å; L522-F579 HydrophobicContact CD2-CD2 4.38Å; L522-F579 PolarHBondContact N-O 2.71Å; L522-F579 PolarHBondContact O-N 3.29Å; V524-F579 HydrophobicContact CB-CE2 4.04Å; V524-F579 HydrophobicContact CG2-CD2 3.83Å; V524-F579 HydrophobicContact CG2-CE2 3.67Å; L547-F579 HydrophobicContact CB-CZ 4.13Å; L547-F579 HydrophobicContact CD2-CE2 4.36Å; L547-F579 HydrophobicContact CD2-CZ 4.34Å; L549-F579 HydrophobicContact CD2-CB 4.11Å; L549-F579 HydrophobicContact CD2-CG 4.47Å; S558-F579 WeakPolarHBondContact OG-CD1 3.4Å; S558-F579 WeakPolarHBondContact OG-CE1 3.41Å; C560-F579 HydrophobicContact CB-CE1 4.47Å; C560-F579 HydrophobicContact CB-CZ 4.33Å; C560-F579 VanDerWaalsContact SG-CE1 3.55Å; F577-F579 HydrophobicContact CB-CE2 3.97Å; F577-F579 HydrophobicContact CB-CZ 3.9Å; F579-V581 HydrophobicContact CB-CG2 4.19Å; F579-L591 HydrophobicContact CE2-CD1 4.09Å
580	Q	93.1	Very high	89.3	Confident	127 Å²	127	53.4 Å²	53.4	59%	0.593	28%	0.278	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.6	110.2	176.2	-168	67.4	51.3	0	0	108.8	T519 G520	T519-Q580 PolarHBondContact O-NE2 2.87Å; G520-Q580 CarbonylContact O-C 3.57Å; G520-Q580 WeakPolarHBondContact O-CA 3.37Å; G520-Q580 PolarHBondContact O-NE2 3.46Å; G520-Q580 VanDerWaalsContact O-NE2 3.08Å
581	V	91.8	Very high	90	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	26%	0.261	C	S	.	.			trans	-136.9	119.6	-175.6	-171.9	0	0	0	0	108.9	Y515 G520 L522 L549 F579 Q585 L586 V589	Y515-V581 HydrophobicContact CE2-CB 4.4Å; Y515-V581 WeakPolarHBondContact CE2-O 3.36Å; Y515-V581 PolarHBondContact OH-O 2.86Å; G520-V581 CarbonylContact C-O 3.51Å; G520-V581 VanDerWaalsContact CA-O 3.27Å; G520-V581 WeakPolarHBondContact CA-O 3.15Å; G520-V581 CarbonylContact O-C 3.54Å; G520-V581 PolarHBondContact O-N 3.03Å; L522-V581 HydrophobicContact CB-CG2 4.16Å; L522-V581 HydrophobicContact CD2-CG2 4.27Å; L549-V581 HydrophobicContact CD2-CG2 3.45Å; L549-V581 VanDerWaalsContact CD2-CG2 3.45Å; F579-V581 HydrophobicContact CB-CG2 4.19Å; V581-Q585 HydrophobicContact CG1-CB 4.06Å; V581-L586 HydrophobicContact CG1-CB 4.4Å; V581-L586 HydrophobicContact CG1-CD1 4.09Å; V581-V589 HydrophobicContact CG1-CG1 4.08Å; V581-V589 HydrophobicContact CG1-CG2 4.15Å
582	A	91.2	Very high	90.5	Very high	30 Å²	30	52.5 Å²	52.5	25%	0.248	27%	0.272	C	S	.	.			trans	-71.3	150.5	176.6	0	0	0	0	0	111.1	F584 Q585 L586	A582-F584 HydrophobicContact CB-CD1 3.68Å; A582-F584 HydrophobicContact CB-CE1 3.33Å; A582-F584 HydrophobicContact CB-CZ 3.96Å; A582-F584 PolarHBondContact O-N 2.67Å; A582-Q585 HydrophobicContact CB-CG 4.26Å; A582-Q585 WeakPolarHBondContact O-CA 3.27Å; A582-Q585 WeakPolarHBondContact O-CB 3.39Å; A582-Q585 PolarHBondContact O-N 2.66Å; A582-L586 PolarHBondContact O-N 3.14Å; A582-L586 VanDerWaalsContact O-N 3.16Å
583	L	88.7	Confident	90.9	Very high	109 Å²	109	49.8 Å²	49.8	57%	0.571	26%	0.256	S	S	*	.	G	3₁₀ helix	trans	-56.3	-39.2	-174.1	178.7	66.3	0	0	0	112.6	Y515 A517 Q585 L586	Y515-L583 HydrophobicContact CE1-CD1 3.88Å; Y515-L583 VanDerWaalsContact OH-CA 3.3Å; Y515-L583 WeakPolarHBondContact OH-CA 3.5Å; Y515-L583 PolarHBondContact OH-N 3.17Å; Y515-L583 VanDerWaalsContact OH-N 3.08Å; A517-L583 HydrophobicContact CB-CD1 4.2Å; L583-Q585 PolarHBondContact O-N 3.25Å; L583-L586 WeakPolarHBondContact O-CB 3.44Å; L583-L586 PolarHBondContact O-N 3.11Å
584	F	88.2	Confident	91.1	Very high	164 Å²	164	49.9 Å²	49.9	72%	0.719	26%	0.257	S	S	*	.	G	3₁₀ helix	trans	-68.4	-20.8	177.3	69.1	-92.2	0	0	0	113.7	A582	A582-F584 HydrophobicContact CB-CD1 3.68Å; A582-F584 HydrophobicContact CB-CE1 3.33Å; A582-F584 HydrophobicContact CB-CZ 3.96Å; A582-F584 PolarHBondContact O-N 2.67Å
585	Q	88.6	Confident	91.1	Very high	54 Å²	54	42.7 Å²	42.7	25%	0.252	23%	0.225	S	C	.	.	G	3₁₀ helix	trans	-89.9	-18.3	175.7	-58.1	178.8	-49.2	0	0	112	V581 A582 L583 S587 D588 V589	V581-Q585 HydrophobicContact CG1-CB 4.06Å; A582-Q585 HydrophobicContact CB-CG 4.26Å; A582-Q585 WeakPolarHBondContact O-CA 3.27Å; A582-Q585 WeakPolarHBondContact O-CB 3.39Å; A582-Q585 PolarHBondContact O-N 2.66Å; L583-Q585 PolarHBondContact O-N 3.25Å; Q585-S587 PolarHBondContact O-N 2.97Å; Q585-S587 VanDerWaalsContact O-N 3.16Å; Q585-D588 PolarHBondContact O-N 2.62Å; Q585-V589 WeakPolarHBondContact O-CG1 3.42Å; Q585-V589 PolarHBondContact O-N 2.92Å
586	L	88.3	Confident	90.8	Very high	3 Å²	3	42.6 Å²	42.6	2%	0.016	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-19.2	-173.6	-167.8	70.3	0	0	0	113.8	Y515 L522 V581 A582 L583 V589 W625 K629	Y515-L586 HydrophobicContact CD1-CD2 3.4Å; Y515-L586 VanDerWaalsContact CD1-CD2 3.4Å; Y515-L586 HydrophobicContact CD2-CD1 3.88Å; Y515-L586 HydrophobicContact CD2-CD2 3.95Å; Y515-L586 HydrophobicContact CE1-CD2 3.53Å; Y515-L586 HydrophobicContact CE2-CD1 3.97Å; Y515-L586 HydrophobicContact CE2-CD2 4.09Å; Y515-L586 HydrophobicContact CG-CD1 4.31Å; Y515-L586 HydrophobicContact CG-CD2 3.61Å; L522-L586 HydrophobicContact CD1-CD1 4.46Å; V581-L586 HydrophobicContact CG1-CB 4.4Å; V581-L586 HydrophobicContact CG1-CD1 4.09Å; A582-L586 PolarHBondContact O-N 3.14Å; A582-L586 VanDerWaalsContact O-N 3.16Å; L583-L586 WeakPolarHBondContact O-CB 3.44Å; L583-L586 PolarHBondContact O-N 3.11Å; L586-V589 HydrophobicContact CD1-CG2 4.38Å; L586-W625 HydrophobicContact CD1-CH2 4.16Å; L586-W625 HydrophobicContact CD1-CZ2 3.64Å; L586-W625 HydrophobicContact CG-CZ2 4.16Å; L586-W625 PolarHBondContact O-NE1 2.63Å; L586-W625 VanDerWaalsContact O-NE1 3.12Å; L586-K629 HydrophobicContact CD2-CD 4.49Å; L586-K629 HydrophobicContact CD2-CG 3.81Å; L586-K629 HydrophobicContact CG-CG 4.45Å; L586-K629 WeakPolarHBondContact O-CE 3.24Å
587	S	87.4	Confident	90.3	Very high	59 Å²	59	39 Å²	39	41%	0.413	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.3	-28.2	170.3	-67.2	0	0	0	0	113.3	Q585 Q614 K629	Q585-S587 PolarHBondContact O-N 2.97Å; Q585-S587 VanDerWaalsContact O-N 3.16Å; S587-Q614 WeakPolarHBondContact O-CB 3.41Å; S587-Q614 PolarHBondContact O-OE1 2.85Å; S587-K629 PolarHBondContact OG-NZ 2.76Å; S587-K629 VanDerWaalsContact OG-NZ 3.15Å
588	D	88.3	Confident	89.3	Confident	65 Å²	65	40.8 Å²	40.8	35%	0.348	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.1	-17.7	-172.8	-84.4	31	0	0	0	113.7	S552 Q585	S552-D588 WeakPolarHBondContact CA-O 3.44Å; S552-D588 PolarHBondContact N-O 2.88Å; S552-D588 VanDerWaalsContact N-O 3.16Å; S552-D588 PolarHBondContact OG-OD2 2.8Å; Q585-D588 PolarHBondContact O-N 2.62Å
589	V	90.9	Very high	88.2	Confident	0 Å²	0	40 Å²	40	0%	0	20%	0.196	C	C	.	.			trans	-83.2	149.7	-179.2	-64.2	0	0	0	0	112.8	L549 L550 M557 V581 Q585 L586 Q614 W625	L549-V589 HydrophobicContact CD1-CB 4.05Å; L549-V589 HydrophobicContact CD1-CG2 4.19Å; L549-V589 HydrophobicContact CG-CB 4.4Å; L550-V589 CarbonylContact O-C 3.53Å; L550-V589 WeakPolarHBondContact O-CA 3.4Å; L550-V589 WeakPolarHBondContact O-CB 3.45Å; M557-V589 HydrophobicContact SD-CG1 3.92Å; V581-V589 HydrophobicContact CG1-CG1 4.08Å; V581-V589 HydrophobicContact CG1-CG2 4.15Å; Q585-V589 WeakPolarHBondContact O-CG1 3.42Å; Q585-V589 PolarHBondContact O-N 2.92Å; L586-V589 HydrophobicContact CD1-CG2 4.38Å; V589-Q614 PolarHBondContact O-N 2.78Å; V589-W625 HydrophobicContact CG2-CH2 4.09Å; V589-W625 HydrophobicContact CG2-CZ2 3.65Å
590	T	90.1	Very high	86.5	Confident	4 Å²	4	45.6 Å²	45.6	3%	0.025	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	118.3	171	-65.1	0	0	0	0	109.4	L550 A611 Q614 N615	L550-T590 PolarHBondContact N-O 3.04Å; L550-T590 PolarHBondContact O-N 2.8Å; T590-A611 HydrophobicContact CG2-CB 4.04Å; T590-Q614 PolarHBondContact OG1-N 3.18Å; T590-N615 HydrophobicContact CG2-CB 4Å; T590-N615 PolarHBondContact OG1-N 3.08Å; T590-N615 PolarHBondContact OG1-OD1 2.81Å
591	L	92.3	Very high	84.7	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	109.4	171.2	172	68.2	0	0	0	109.3	L513 V524 L549 F579 I593 A611 L612 W625	L513-L591 HydrophobicContact CD2-CD2 3.69Å; V524-L591 HydrophobicContact CB-CD2 4.35Å; V524-L591 HydrophobicContact CG1-CD2 3.88Å; V524-L591 HydrophobicContact CG2-CD1 4.17Å; V524-L591 HydrophobicContact CG2-CD2 3.51Å; V524-L591 HydrophobicContact CG2-CG 4.49Å; L549-L591 HydrophobicContact CD1-CB 4.12Å; F579-L591 HydrophobicContact CE2-CD1 4.09Å; L591-I593 HydrophobicContact CD1-CG1 4.44Å; L591-I593 HydrophobicContact CD2-CD1 4.32Å; L591-I593 HydrophobicContact CG-CD1 4.44Å; L591-I593 HydrophobicContact CG-CG1 4.19Å; L591-A611 CarbonylContact O-C 3.49Å; L591-A611 WeakPolarHBondContact O-CA 3.49Å; L591-L612 HydrophobicContact CB-CB 4.36Å; L591-L612 HydrophobicContact CD2-CD1 4Å; L591-L612 PolarHBondContact N-O 2.76Å; L591-L612 PolarHBondContact O-N 3.4Å; L591-W625 HydrophobicContact CB-CH2 4.31Å; L591-W625 HydrophobicContact CB-CZ3 3.97Å; L591-W625 HydrophobicContact CD2-CZ3 4.1Å
592	M	90.8	Very high	83.2	Confident	50 Å²	50	55.3 Å²	55.3	25%	0.246	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	125.8	175.8	-179.4	179.3	57.9	0	0	110.6	L547 F548 I610	L547-M592 WeakPolarHBondContact CA-O 3.48Å; F548-M592 HydrophobicContact CB-CB 4.39Å; F548-M592 HydrophobicContact CB-CE 4.02Å; F548-M592 HydrophobicContact CD2-CE 3.78Å; F548-M592 HydrophobicContact CE2-CE 4.27Å; F548-M592 HydrophobicContact CG-CE 3.97Å; F548-M592 PolarHBondContact N-O 3.13Å; F548-M592 PolarHBondContact O-N 2.81Å; M592-I610 WeakPolarHBondContact CA-O 3.47Å
593	I	93.6	Very high	82.1	Confident	0 Å²	0	65.2 Å²	65.2	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	118.7	178.5	-50.5	-179.2	0	0	0	108.6	L509 V511 V524 M526 L547 L591 W609 I610 L612	L509-I593 HydrophobicContact CD2-CG2 3.72Å; V511-I593 HydrophobicContact CG1-CD1 3.92Å; V511-I593 HydrophobicContact CG2-CD1 3.96Å; V524-I593 HydrophobicContact CG1-CD1 4.13Å; M526-I593 HydrophobicContact SD-CG2 4.44Å; L547-I593 HydrophobicContact CD2-CD1 4.42Å; L547-I593 HydrophobicContact CD2-CG1 4.45Å; L547-I593 HydrophobicContact CG-CG1 4.17Å; L547-I593 HydrophobicContact CG-CG2 4.28Å; L591-I593 HydrophobicContact CD1-CG1 4.44Å; L591-I593 HydrophobicContact CD2-CD1 4.32Å; L591-I593 HydrophobicContact CG-CD1 4.44Å; L591-I593 HydrophobicContact CG-CG1 4.19Å; I593-W609 CarbonylContact O-C 3.57Å; I593-W609 VanDerWaalsContact O-CA 3.23Å; I593-W609 WeakPolarHBondContact O-CA 3.41Å; I593-I610 HydrophobicContact CB-CD1 4.37Å; I593-I610 HydrophobicContact CB-CG1 3.88Å; I593-I610 HydrophobicContact CD1-CD1 4.4Å; I593-I610 PolarHBondContact N-O 3.13Å; I593-I610 PolarHBondContact O-N 3.17Å; I593-L612 HydrophobicContact CD1-CD1 4.12Å
594	S	90.9	Very high	81.5	Confident	3 Å²	3	66.2 Å²	66.2	2%	0.021	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	124.6	-179.1	-44.7	0	0	0	0	111.3	G545 K546 Y596	G545-S594 CarbonylContact C-O 3.54Å; K546-S594 PolarHBondContact N-O 2.82Å; K546-S594 PolarHBondContact O-N 2.82Å; S594-Y596 WeakPolarHBondContact O-CD2 3.28Å
595	V	90	Very high	81	Confident	0 Å²	0	61.7 Å²	61.7	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	132.3	178.9	-174.5	0	0	0	0	110.2	L509 M526 F532 I607 G608 L642	L509-V595 HydrophobicContact CD2-CG2 4.37Å; M526-V595 HydrophobicContact CE-CG2 3.77Å; F532-V595 HydrophobicContact CD2-CG1 4.36Å; F532-V595 HydrophobicContact CE2-CG1 3.84Å; F532-V595 HydrophobicContact CZ-CG1 4.11Å; F532-V595 HydrophobicContact CZ-CG2 4.18Å; V595-I607 HydrophobicContact CB-CB 4.41Å; V595-I607 HydrophobicContact CG1-CB 4.3Å; V595-I607 HydrophobicContact CG1-CD1 4.19Å; V595-I607 PolarHBondContact O-N 2.85Å; V595-G608 PolarHBondContact N-O 3.4Å; V595-L642 HydrophobicContact CB-CD1 3.94Å; V595-L642 HydrophobicContact CG2-CD1 3.58Å
596	Y	86.8	Confident	80.7	Confident	34 Å²	34	61.7 Å²	61.7	13%	0.133	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	142.7	-178.3	-67.2	-90	0	0	0	112.5	T543 Y544 K546 S594 E605 M606	T543-Y596 WeakPolarHBondContact CA-O 3.46Å; Y544-Y596 WeakPolarHBondContact CD1-O 3.35Å; Y544-Y596 VanDerWaalsContact CE1-CB 3.46Å; Y544-Y596 HydrophobicContact CE1-CG 4.44Å; Y544-Y596 HydrophobicContact CE2-CD2 4.35Å; Y544-Y596 PolarHBondContact N-O 2.92Å; Y544-Y596 PolarHBondContact O-N 3.08Å; K546-Y596 HydrophobicContact CB-CE2 4.2Å; K546-Y596 HydrophobicContact CD-CD2 3.97Å; K546-Y596 HydrophobicContact CD-CE2 3.46Å; K546-Y596 VanDerWaalsContact CD-CE2 3.46Å; K546-Y596 VanDerWaalsContact CE-CD2 3.47Å; K546-Y596 HydrophobicContact CG-CD2 3.85Å; K546-Y596 HydrophobicContact CG-CE2 3.7Å; K546-Y596 PolarHBondContact NZ-OH 2.82Å; K546-Y596 VanDerWaalsContact NZ-OH 3.07Å; S594-Y596 WeakPolarHBondContact O-CD2 3.28Å; Y596-E605 WeakPolarHBondContact CA-O 3.37Å; Y596-M606 HydrophobicContact CD1-CB 4.11Å; Y596-M606 HydrophobicContact CD1-CG 4.46Å; Y596-M606 HydrophobicContact CE1-CB 4.03Å; Y596-M606 HydrophobicContact CE1-CE 3.73Å; Y596-M606 HydrophobicContact CE1-CG 4.24Å; Y596-M606 HydrophobicContact CE2-CE 4.49Å; Y596-M606 WeakPolarHBondContact OH-CE 3.19Å
597	N	84.3	Confident	80.4	Confident	4 Å²	4	63 Å²	63	2%	0.021	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	113.8	168.1	-170.3	-17.2	0	0	0	109.9	P541 D542 R599 E605 I607	P541-N597 HydrophobicContact CB-CB 4.49Å; P541-N597 VanDerWaalsContact CB-ND2 3.34Å; P541-N597 WeakPolarHBondContact CB-ND2 3.23Å; D542-N597 CarbonylContact O-C 3.6Å; D542-N597 WeakPolarHBondContact O-CA 3.42Å; N597-R599 PolarHBondContact ND2-NH2 3.41Å; N597-E605 HydrophobicContact CB-CB 4.26Å; N597-E605 PolarHBondContact N-O 2.89Å; N597-E605 PolarHBondContact O-N 2.93Å; N597-I607 HydrophobicContact CB-CD1 4.04Å; N597-I607 HydrophobicContact CB-CG1 3.98Å
598	R	73.3	Confident	80.3	Confident	64 Å²	64	60.1 Å²	60.1	24%	0.242	28%	0.275	C	S	.	.			trans	-90.4	99.6	173.1	-174	-172.4	66.4	171.5	-4.9	110.2	D542 Y544 I564	D542-R598 WeakPolarHBondContact CB-O 3.34Å; D542-R598 PolarHBondContact O-N 3.48Å; D542-R598 IonicContact OD2-NH2 2.75Å; Y544-R598 HydrophobicContact CD1-CB 4.05Å; Y544-R598 HydrophobicContact CE1-CB 3.9Å; I564-R598 VanDerWaalsContact CD1-NH1 3.25Å
599	R	70.8	Confident	80.4	Confident	64 Å²	64	61 Å²	61	24%	0.242	27%	0.274	C	S	.	.			trans	-91.1	132.7	165	-59.1	-166.7	-169.1	118.4	4	109.9	N597 M601 K602 E605	N597-R599 PolarHBondContact ND2-NH2 3.41Å; R599-M601 PolarHBondContact O-N 3.19Å; R599-K602 HydrophobicContact CB-CB 4Å; R599-E605 IonicContact CZ-OE2 3.71Å; R599-E605 IonicContact NH1-OE2 3.57Å; R599-E605 PolarHBondContact NH1-OE2 2.84Å; R599-E605 IonicContact NH2-OE1 3.85Å; R599-E605 PolarHBondContact NH2-OE1 2.63Å; R599-E605 IonicContact NH2-OE2 3.87Å; R599-E605 PolarHBondContact NH2-OE2 2.89Å
600	T	57	Low	80.4	Confident	124 Å²	124	61 Å²	61	76%	0.761	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-25.1	-179	47.4	0	0	0	0	113.8
601	M	56.5	Low	80.5	Confident	183 Å²	183	61.1 Å²	61.1	90%	0.901	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.6	6.3	-176.1	-76.6	-68.9	-154.7	0	0	114.6	R599	R599-M601 PolarHBondContact O-N 3.19Å
602	K	60.4	Low	80.4	Confident	148 Å²	148	61.1 Å²	61.1	64%	0.643	28%	0.275	S	S	*	.	S	Bend	trans	-136.5	156.4	-178.2	-64.6	-171.4	177.1	-175.1	0	111.7	R599 K604	R599-K602 HydrophobicContact CB-CB 4Å; K602-K604 PolarHBondContact O-N 2.82Å
603	R	66.9	Low	80.2	Confident	237 Å²	237	58.8 Å²	58.8	89%	0.894	26%	0.264	S	S	*	.	P	Polyproline II helix	trans	-50.8	138.5	172.1	-173.8	173.3	179.4	165.4	-0.3	109.8	E605	R603-E605 PolarHBondContact O-N 3.09Å
604	K	75.9	Confident	79.7	Confident	130 Å²	130	63.7 Å²	63.7	57%	0.565	29%	0.287	S	S	*	.	P	Polyproline II helix	trans	-57.8	122.9	176.5	-68.5	166.1	175.9	175	0	109.2	K602	K602-K604 PolarHBondContact O-N 2.82Å
605	E	78.6	Confident	79.3	Confident	70 Å²	70	68.3 Å²	68.3	33%	0.327	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	127.3	178.5	-176.4	176.1	139	0	0	106.7	N534 Y596 N597 R599 R603	N534-E605 PolarHBondContact ND2-OE1 3.33Å; Y596-E605 WeakPolarHBondContact CA-O 3.37Å; N597-E605 HydrophobicContact CB-CB 4.26Å; N597-E605 PolarHBondContact N-O 2.89Å; N597-E605 PolarHBondContact O-N 2.93Å; R599-E605 IonicContact CZ-OE2 3.71Å; R599-E605 IonicContact NH1-OE2 3.57Å; R599-E605 PolarHBondContact NH1-OE2 2.84Å; R599-E605 IonicContact NH2-OE1 3.85Å; R599-E605 PolarHBondContact NH2-OE1 2.63Å; R599-E605 IonicContact NH2-OE2 3.87Å; R599-E605 PolarHBondContact NH2-OE2 2.89Å; R603-E605 PolarHBondContact O-N 3.09Å
606	M	82.5	Confident	79	Confident	54 Å²	54	69.8 Å²	69.8	27%	0.266	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	135.4	169.8	-172.2	178.4	-76.9	0	0	107.2	Y596 W609	Y596-M606 HydrophobicContact CD1-CB 4.11Å; Y596-M606 HydrophobicContact CD1-CG 4.46Å; Y596-M606 HydrophobicContact CE1-CB 4.03Å; Y596-M606 HydrophobicContact CE1-CE 3.73Å; Y596-M606 HydrophobicContact CE1-CG 4.24Å; Y596-M606 HydrophobicContact CE2-CE 4.49Å; Y596-M606 WeakPolarHBondContact OH-CE 3.19Å; M606-W609 HydrophobicContact SD-CB 4.3Å; M606-W609 HydrophobicContact SD-CG 4.34Å
607	I	81.1	Confident	78.5	Confident	29 Å²	29	69.8 Å²	69.8	15%	0.149	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	-41	174.4	-63.2	-177	0	0	0	109.2	P507 F532 P541 T543 V595 N597	P507-I607 HydrophobicContact CB-CG2 4.05Å; P507-I607 HydrophobicContact CG-CG2 4.42Å; F532-I607 HydrophobicContact CB-CD1 4.49Å; F532-I607 HydrophobicContact CD1-CG2 4.18Å; F532-I607 HydrophobicContact CG-CG2 4.45Å; P541-I607 HydrophobicContact CG-CD1 4.37Å; T543-I607 HydrophobicContact CG2-CD1 3.59Å; V595-I607 HydrophobicContact CB-CB 4.41Å; V595-I607 HydrophobicContact CG1-CB 4.3Å; V595-I607 HydrophobicContact CG1-CD1 4.19Å; V595-I607 PolarHBondContact O-N 2.85Å; N597-I607 HydrophobicContact CB-CD1 4.04Å; N597-I607 HydrophobicContact CB-CG1 3.98Å
608	G	86.3	Confident	78.3	Confident	0 Å²	0	71.1 Å²	71.1	0%	0	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	172.9	-179.1	172	0	0	0	0	0	111.1	V595 L643	V595-G608 PolarHBondContact N-O 3.4Å; G608-L643 CarbonylContact C-O 3.48Å; G608-L643 WeakPolarHBondContact CA-O 3.23Å
609	W	88.8	Confident	78.5	Confident	83 Å²	83	75.7 Å²	75.7	31%	0.314	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	159.6	-178.9	62.5	-80.4	0	0	0	111.5	I593 M606 A611 L643	I593-W609 CarbonylContact O-C 3.57Å; I593-W609 VanDerWaalsContact O-CA 3.23Å; I593-W609 WeakPolarHBondContact O-CA 3.41Å; M606-W609 HydrophobicContact SD-CB 4.3Å; M606-W609 HydrophobicContact SD-CG 4.34Å; W609-A611 HydrophobicContact CZ3-CB 4.13Å; W609-L643 HydrophobicContact CH2-CD1 3.81Å; W609-L643 HydrophobicContact CZ2-CB 4.29Å; W609-L643 HydrophobicContact CZ2-CD1 3.84Å; W609-L643 HydrophobicContact CZ3-CD1 4.28Å; W609-L643 PolarHBondContact N-O 2.68Å; W609-L643 PolarHBondContact O-N 2.94Å
610	I	92.3	Very high	79	Confident	0 Å²	0	76.9 Å²	76.9	0%	0	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	156.9	170.5	54.2	178.2	0	0	0	109	L509 V511 M592 I593 L612 H640 T641 L642	L509-I610 HydrophobicContact CD2-CD1 4.28Å; V511-I610 HydrophobicContact CG2-CD1 4.03Å; M592-I610 WeakPolarHBondContact CA-O 3.47Å; I593-I610 HydrophobicContact CB-CD1 4.37Å; I593-I610 HydrophobicContact CB-CG1 3.88Å; I593-I610 HydrophobicContact CD1-CD1 4.4Å; I593-I610 PolarHBondContact N-O 3.13Å; I593-I610 PolarHBondContact O-N 3.17Å; I610-L612 HydrophobicContact CD1-CD1 4.36Å; I610-H640 HydrophobicContact CD1-CB 3.69Å; I610-H640 HydrophobicContact CG2-CB 4.18Å; I610-T641 WeakPolarHBondContact CG2-O 3.35Å; I610-L642 HydrophobicContact CB-CD2 4.43Å; I610-L642 HydrophobicContact CD1-CD2 4.24Å; I610-L642 HydrophobicContact CG1-CD2 4.11Å; I610-L642 HydrophobicContact CG2-CD2 3.67Å
611	A	90.8	Very high	80.4	Confident	6 Å²	6	71.6 Å²	71.6	5%	0.05	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	138.2	173.4	0	0	0	0	0	109.7	T590 L591 W609 N615 S616 S617 E621	T590-A611 HydrophobicContact CG2-CB 4.04Å; L591-A611 CarbonylContact O-C 3.49Å; L591-A611 WeakPolarHBondContact O-CA 3.49Å; W609-A611 HydrophobicContact CZ3-CB 4.13Å; A611-N615 WeakPolarHBondContact CB-O 3.46Å; A611-S616 CarbonylContact O-C 3.58Å; A611-S616 VanDerWaalsContact O-CA 3.28Å; A611-S616 WeakPolarHBondContact O-CA 3.42Å; A611-S617 PolarHBondContact N-OG 3.3Å; A611-S617 PolarHBondContact O-N 3.44Å; A611-S617 PolarHBondContact O-OG 3.22Å; A611-S617 VanDerWaalsContact O-OG 3.09Å; A611-E621 WeakPolarHBondContact O-CB 3.33Å
612	L	90.3	Very high	81.9	Confident	0 Å²	0	65.6 Å²	65.6	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	127.5	-176.3	-63.7	145.2	0	0	0	107.5	L513 L591 I593 I610 E621 H624 W625	L513-L612 HydrophobicContact CD1-CD1 4.37Å; L513-L612 HydrophobicContact CD1-CD2 4.37Å; L591-L612 HydrophobicContact CB-CB 4.36Å; L591-L612 HydrophobicContact CD2-CD1 4Å; L591-L612 PolarHBondContact N-O 2.76Å; L591-L612 PolarHBondContact O-N 3.4Å; I593-L612 HydrophobicContact CD1-CD1 4.12Å; I610-L612 HydrophobicContact CD1-CD1 4.36Å; L612-E621 HydrophobicContact CD2-CB 3.7Å; L612-E621 HydrophobicContact CD2-CG 3.91Å; L612-E621 WeakPolarHBondContact CD2-O 3.27Å; L612-E621 HydrophobicContact CG-CB 4.37Å; L612-E621 HydrophobicContact CG-CG 4.43Å; L612-H624 HydrophobicContact CD2-CB 4.28Å; L612-W625 HydrophobicContact CB-CE3 3.91Å; L612-W625 HydrophobicContact CB-CZ3 4.38Å
613	G	88.1	Confident	83.2	Confident	1 Å²	1	62.4 Å²	62.4	1%	0.01	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	123.5	-138.7	177.8	0	0	0	0	0	113.8	N615 S616 Q622	G613-N615 PolarHBondContact O-N 3.05Å; G613-N615 VanDerWaalsContact O-N 3.13Å; G613-S616 PolarHBondContact N-OG 3.28Å; G613-S616 PolarHBondContact O-N 3.1Å; G613-S616 PolarHBondContact O-OG 3.33Å; G613-Q622 PolarHBondContact O-OE1 3.2Å; G613-Q622 VanDerWaalsContact O-OE1 3.05Å
614	Q	83.3	Confident	84.3	Confident	103 Å²	103	51.1 Å²	51.1	48%	0.481	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-27	-176	-173.5	52.1	89.6	0	0	113.3	S587 V589 T590	S587-Q614 WeakPolarHBondContact O-CB 3.41Å; S587-Q614 PolarHBondContact O-OE1 2.85Å; V589-Q614 PolarHBondContact O-N 2.78Å; T590-Q614 PolarHBondContact OG1-N 3.18Å
615	N	82.5	Confident	85	Confident	101 Å²	101	45 Å²	45	54%	0.54	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-123.5	58.3	174.4	-46.3	106.3	0	0	0	110.5	T590 A611 G613	T590-N615 HydrophobicContact CG2-CB 4Å; T590-N615 PolarHBondContact OG1-N 3.08Å; T590-N615 PolarHBondContact OG1-OD1 2.81Å; A611-N615 WeakPolarHBondContact CB-O 3.46Å; G613-N615 PolarHBondContact O-N 3.05Å; G613-N615 VanDerWaalsContact O-N 3.13Å
616	S	81.8	Confident	85.6	Confident	30 Å²	30	46.1 Å²	46.1	21%	0.21	24%	0.236	C	C	.	.			trans	-56	142.1	174.6	-65	0	0	0	0	112.2	A611 G613 G618 Q622	A611-S616 CarbonylContact O-C 3.58Å; A611-S616 VanDerWaalsContact O-CA 3.28Å; A611-S616 WeakPolarHBondContact O-CA 3.42Å; G613-S616 PolarHBondContact N-OG 3.28Å; G613-S616 PolarHBondContact O-N 3.1Å; G613-S616 PolarHBondContact O-OG 3.33Å; S616-G618 VanDerWaalsContact C-N 3.29Å; S616-G618 PolarHBondContact O-N 3.44Å; S616-Q622 PolarHBondContact OG-OE1 3.13Å
617	S	76.4	Confident	85.9	Confident	34 Å²	34	46.9 Å²	46.9	24%	0.238	24%	0.239	C	C	.	.	S	Bend	trans	-75	-16.5	-179.7	32.4	0	0	0	0	114.4	A611 E621	A611-S617 PolarHBondContact N-OG 3.3Å; A611-S617 PolarHBondContact O-N 3.44Å; A611-S617 PolarHBondContact O-OG 3.22Å; A611-S617 VanDerWaalsContact O-OG 3.09Å; S617-E621 WeakPolarHBondContact CB-OE1 3.45Å; S617-E621 VanDerWaalsContact OG-CD 3.22Å; S617-E621 WeakPolarHBondContact OG-CG 3.44Å; S617-E621 PolarHBondContact OG-OE1 2.95Å
618	G	81.1	Confident	86.4	Confident	33 Å²	33	45.5 Å²	45.5	34%	0.34	23%	0.232	S	C	.	.	S	Bend	trans	-165.9	-178.3	179.4	0	0	0	0	0	111.8	S616 E621 Q622	S616-G618 VanDerWaalsContact C-N 3.29Å; S616-G618 PolarHBondContact O-N 3.44Å; G618-E621 WeakPolarHBondContact CA-OE2 2.92Å; G618-E621 PolarHBondContact N-OE2 2.79Å; G618-E621 VanDerWaalsContact N-OE2 3.11Å; G618-Q622 PolarHBondContact O-N 2.88Å
619	E	76.5	Confident	86.5	Confident	160 Å²	160	48.7 Å²	48.7	75%	0.748	25%	0.246	S	C	*	.	H	α-helix	trans	-67.5	-43.1	178.6	-168.5	170.5	-167.9	0	0	111	E621 Q622 D623	E619-E621 VanDerWaalsContact C-N 3.31Å; E619-E621 PolarHBondContact O-N 2.98Å; E619-Q622 WeakPolarHBondContact O-CB 3.48Å; E619-Q622 PolarHBondContact O-N 2.81Å; E619-D623 PolarHBondContact O-N 2.87Å
620	E	82.8	Confident	86.4	Confident	88 Å²	88	52 Å²	52	41%	0.411	27%	0.265	S	S	.	.	H	α-helix	trans	-61.1	-36	177.6	-61.5	-179.6	173.8	0	0	112.9	H624	E620-H624 WeakPolarHBondContact O-CB 3.28Å; E620-H624 PolarHBondContact O-N 2.86Å; E620-H624 VanDerWaalsContact O-N 3.12Å
621	E	86.1	Confident	85.9	Confident	14 Å²	14	53.9 Å²	53.9	7%	0.065	28%	0.276	C	S	.	.	H	α-helix	trans	-69.9	-39.1	173.1	-69.1	97	141.9	0	0	112.7	A611 L612 S617 G618 E619 H624 W625	A611-E621 WeakPolarHBondContact O-CB 3.33Å; L612-E621 HydrophobicContact CD2-CB 3.7Å; L612-E621 HydrophobicContact CD2-CG 3.91Å; L612-E621 WeakPolarHBondContact CD2-O 3.27Å; L612-E621 HydrophobicContact CG-CB 4.37Å; L612-E621 HydrophobicContact CG-CG 4.43Å; S617-E621 WeakPolarHBondContact CB-OE1 3.45Å; S617-E621 VanDerWaalsContact OG-CD 3.22Å; S617-E621 WeakPolarHBondContact OG-CG 3.44Å; S617-E621 PolarHBondContact OG-OE1 2.95Å; G618-E621 WeakPolarHBondContact CA-OE2 2.92Å; G618-E621 PolarHBondContact N-OE2 2.79Å; G618-E621 VanDerWaalsContact N-OE2 3.11Å; E619-E621 VanDerWaalsContact C-N 3.31Å; E619-E621 PolarHBondContact O-N 2.98Å; E621-H624 PolarHBondContact O-N 2.82Å; E621-W625 PolarHBondContact O-N 2.87Å; E621-W625 VanDerWaalsContact O-N 3.12Å
622	Q	87.4	Confident	85.3	Confident	57 Å²	57	62.2 Å²	62.2	27%	0.266	31%	0.312	S	S	.	.	H	α-helix	trans	-65.6	-49.1	176.8	-174.4	62.2	26.2	0	0	110.7	G613 S616 G618 E619 H624 W625 E626	G613-Q622 PolarHBondContact O-OE1 3.2Å; G613-Q622 VanDerWaalsContact O-OE1 3.05Å; S616-Q622 PolarHBondContact OG-OE1 3.13Å; G618-Q622 PolarHBondContact O-N 2.88Å; E619-Q622 WeakPolarHBondContact O-CB 3.48Å; E619-Q622 PolarHBondContact O-N 2.81Å; Q622-H624 VanDerWaalsContact C-N 3.27Å; Q622-H624 PolarHBondContact O-N 2.89Å; Q622-W625 WeakPolarHBondContact O-CA 2.95Å; Q622-W625 WeakPolarHBondContact O-CB 3.44Å; Q622-W625 PolarHBondContact O-N 3.45Å; Q622-E626 PolarHBondContact NE2-OE1 3.49Å; Q622-E626 PolarHBondContact O-N 2.85Å
623	D	88.5	Confident	84.7	Confident	80 Å²	80	63.9 Å²	63.9	43%	0.428	33%	0.328	S	S	.	.	H	α-helix	trans	-56	-42.8	176	-71.6	-9.5	0	0	0	111	E619 W625 E626 E627	E619-D623 PolarHBondContact O-N 2.87Å; D623-W625 VanDerWaalsContact C-N 3.29Å; D623-W625 PolarHBondContact O-N 3.37Å; D623-E626 PolarHBondContact O-N 2.79Å; D623-E627 WeakPolarHBondContact O-CB 3.47Å; D623-E627 PolarHBondContact O-N 2.82Å
624	H	90.3	Very high	84.7	Confident	0 Å²	0	70.7 Å²	70.7	0%	0	36%	0.36	C	S	.	.	H	α-helix	trans	-63.9	-34.3	176.9	-166.1	-152.5	0	0	0	113.4	V511 L513 L612 E620 E621 Q622 M628 I636 C637 R638 H640	V511-H624 PolarHBondContact O-CE1 2.91Å; L513-H624 WeakPolarHBondContact CD1-ND1 3.32Å; L513-H624 WeakPolarHBondContact CG-CE1 2.97Å; L612-H624 HydrophobicContact CD2-CB 4.28Å; E620-H624 WeakPolarHBondContact O-CB 3.28Å; E620-H624 PolarHBondContact O-N 2.86Å; E620-H624 VanDerWaalsContact O-N 3.12Å; E621-H624 PolarHBondContact O-N 2.82Å; Q622-H624 VanDerWaalsContact C-N 3.27Å; Q622-H624 PolarHBondContact O-N 2.89Å; H624-M628 VanDerWaalsContact O-CB 3.23Å; H624-M628 WeakPolarHBondContact O-CB 3.37Å; H624-M628 PolarHBondContact O-N 2.88Å; H624-I636 WeakPolarHBondContact NE2-CA 3.38Å; H624-I636 WeakPolarHBondContact NE2-CB 3.49Å; H624-I636 VanDerWaalsContact NE2-CG2 3.27Å; H624-I636 WeakPolarHBondContact NE2-CG2 3.41Å; H624-I636 PolarHBondContact NE2-O 3.49Å; H624-C637 PolarHBondContact NE2-N 2.92Å; H624-R638 HydrophobicContact CB-CB 4.47Å; H624-H640 AromaticContact CE1-NE2 3.87Å; H624-H640 AromaticContact CG-CE1 3.94Å; H624-H640 AromaticContact CG-NE2 3.62Å; H624-H640 AromaticContact ND1-CD2 3.98Å; H624-H640 AromaticContact ND1-CE1 3.58Å; H624-H640 AromaticContact ND1-NE2 2.86Å; H624-H640 PolarHBondContact ND1-NE2 2.94Å
625	W	90.8	Very high	85	Confident	1 Å²	1	70.3 Å²	70.3	0%	0.004	36%	0.358	C	S	.	.	H	α-helix	trans	-73.1	-39.6	176.8	-167.5	-103.8	0	0	0	112	L513 L522 L586 V589 L591 L612 E621 Q622 D623 M628 K629	L513-W625 HydrophobicContact CD1-CE3 3.97Å; L513-W625 HydrophobicContact CD1-CZ3 4.41Å; L522-W625 HydrophobicContact CD1-CH2 4.19Å; L522-W625 HydrophobicContact CD1-CZ3 4.33Å; L522-W625 HydrophobicContact CD2-CH2 3.65Å; L522-W625 HydrophobicContact CD2-CZ3 4.21Å; L586-W625 HydrophobicContact CD1-CH2 4.16Å; L586-W625 HydrophobicContact CD1-CZ2 3.64Å; L586-W625 HydrophobicContact CG-CZ2 4.16Å; L586-W625 PolarHBondContact O-NE1 2.63Å; L586-W625 VanDerWaalsContact O-NE1 3.12Å; V589-W625 HydrophobicContact CG2-CH2 4.09Å; V589-W625 HydrophobicContact CG2-CZ2 3.65Å; L591-W625 HydrophobicContact CB-CH2 4.31Å; L591-W625 HydrophobicContact CB-CZ3 3.97Å; L591-W625 HydrophobicContact CD2-CZ3 4.1Å; L612-W625 HydrophobicContact CB-CE3 3.91Å; L612-W625 HydrophobicContact CB-CZ3 4.38Å; E621-W625 PolarHBondContact O-N 2.87Å; E621-W625 VanDerWaalsContact O-N 3.12Å; Q622-W625 WeakPolarHBondContact O-CA 2.95Å; Q622-W625 WeakPolarHBondContact O-CB 3.44Å; Q622-W625 PolarHBondContact O-N 3.45Å; D623-W625 VanDerWaalsContact C-N 3.29Å; D623-W625 PolarHBondContact O-N 3.37Å; W625-M628 HydrophobicContact CD2-CE 3.46Å; W625-M628 VanDerWaalsContact CD2-CE 3.46Å; W625-M628 HydrophobicContact CE3-CE 3.31Å; W625-M628 HydrophobicContact CG-CE 4.14Å; W625-M628 HydrophobicContact CH2-CE 3.95Å; W625-M628 HydrophobicContact CZ2-CE 4.05Å; W625-M628 HydrophobicContact CZ3-CE 3.57Å; W625-K629 VanDerWaalsContact CD1-CE 3.45Å; W625-K629 VanDerWaalsContact NE1-CE 3.25Å; W625-K629 WeakPolarHBondContact O-CG 3.45Å; W625-K629 PolarHBondContact O-N 2.81Å
626	E	89.8	Confident	85.4	Confident	94 Å²	94	66.4 Å²	66.4	44%	0.439	34%	0.337	S	S	.	.	H	α-helix	trans	-71.3	-49.2	179.2	-69.9	-174.3	-170	0	0	112.1	Q622 D623 M628 K629 E630	Q622-E626 PolarHBondContact NE2-OE1 3.49Å; Q622-E626 PolarHBondContact O-N 2.85Å; D623-E626 PolarHBondContact O-N 2.79Å; E626-M628 PolarHBondContact O-N 2.88Å; E626-K629 WeakPolarHBondContact O-CA 3.2Å; E626-K629 WeakPolarHBondContact O-CB 3.26Å; E626-K629 PolarHBondContact O-N 2.79Å; E626-E630 PolarHBondContact O-N 3.15Å
627	E	90.1	Very high	85.9	Confident	70 Å²	70	68 Å²	68	33%	0.327	35%	0.348	S	S	.	.	H	α-helix	trans	-54.7	-39.9	176.1	-158.4	-169.3	145.7	0	0	110.8	D623 E630 T631 I636 R638	D623-E627 WeakPolarHBondContact O-CB 3.47Å; D623-E627 PolarHBondContact O-N 2.82Å; E627-E630 PolarHBondContact O-N 2.78Å; E627-T631 WeakPolarHBondContact O-CB 3.39Å; E627-T631 PolarHBondContact O-N 2.77Å; E627-T631 PolarHBondContact O-OG1 3.06Å; E627-I636 HydrophobicContact CB-CD1 3.78Å; E627-I636 HydrophobicContact CG-CD1 3.56Å; E627-I636 WeakPolarHBondContact O-CD1 3.24Å; E627-I636 WeakPolarHBondContact OE1-CG2 3.37Å; E627-R638 IonicContact OE2-CZ 2.85Å; E627-R638 IonicContact OE2-NH1 3.39Å; E627-R638 PolarHBondContact OE2-NH1 2.87Å; E627-R638 IonicContact OE2-NH2 2.71Å; E627-R638 PolarHBondContact OE2-NH2 3.1Å
628	M	91.8	Very high	86.4	Confident	0 Å²	0	69.9 Å²	69.9	0%	0	35%	0.35	C	S	.	.	H	α-helix	trans	-65.4	-34.6	175.1	171.3	-88.4	-66.5	0	0	113.7	L513 Y515 L522 H624 W625 E626 I636	L513-M628 HydrophobicContact CB-CB 4.2Å; L513-M628 HydrophobicContact CB-CG 3.79Å; L513-M628 HydrophobicContact CD1-CE 4.34Å; Y515-M628 WeakPolarHBondContact CB-SD 3.46Å; Y515-M628 HydrophobicContact CG-SD 4.37Å; L522-M628 HydrophobicContact CD1-CE 3.88Å; L522-M628 HydrophobicContact CD1-SD 4.09Å; H624-M628 VanDerWaalsContact O-CB 3.23Å; H624-M628 WeakPolarHBondContact O-CB 3.37Å; H624-M628 PolarHBondContact O-N 2.88Å; W625-M628 HydrophobicContact CD2-CE 3.46Å; W625-M628 VanDerWaalsContact CD2-CE 3.46Å; W625-M628 HydrophobicContact CE3-CE 3.31Å; W625-M628 HydrophobicContact CG-CE 4.14Å; W625-M628 HydrophobicContact CH2-CE 3.95Å; W625-M628 HydrophobicContact CZ2-CE 4.05Å; W625-M628 HydrophobicContact CZ3-CE 3.57Å; E626-M628 PolarHBondContact O-N 2.88Å; M628-I636 HydrophobicContact CB-CD1 4.28Å
629	K	86.7	Confident	86.7	Confident	67 Å²	67	71.3 Å²	71.3	29%	0.291	35%	0.345	S	S	.	.	H	α-helix	trans	-66.7	-42.1	172.6	-70.1	178.6	-175.9	176.3	0	111.4	L586 S587 W625 E626 T631	L586-K629 HydrophobicContact CD2-CD 4.49Å; L586-K629 HydrophobicContact CD2-CG 3.81Å; L586-K629 HydrophobicContact CG-CG 4.45Å; L586-K629 WeakPolarHBondContact O-CE 3.24Å; S587-K629 PolarHBondContact OG-NZ 2.76Å; S587-K629 VanDerWaalsContact OG-NZ 3.15Å; W625-K629 VanDerWaalsContact CD1-CE 3.45Å; W625-K629 VanDerWaalsContact NE1-CE 3.25Å; W625-K629 WeakPolarHBondContact O-CG 3.45Å; W625-K629 PolarHBondContact O-N 2.81Å; E626-K629 WeakPolarHBondContact O-CA 3.2Å; E626-K629 WeakPolarHBondContact O-CB 3.26Å; E626-K629 PolarHBondContact O-N 2.79Å; K629-T631 VanDerWaalsContact C-N 3.32Å; K629-T631 PolarHBondContact O-N 3.47Å
630	E	87.5	Confident	87.2	Confident	154 Å²	154	63.8 Å²	63.8	72%	0.72	31%	0.309	S	S	*	.	H	α-helix	trans	-67.3	-34.7	-179.1	-64.5	-166.4	150.8	0	0	112.5	E626 E627 K632	E626-E630 PolarHBondContact O-N 3.15Å; E627-E630 PolarHBondContact O-N 2.78Å; E630-K632 PolarHBondContact O-N 2.92Å; E630-K632 VanDerWaalsContact O-N 3.15Å
631	T	81.3	Confident	87.3	Confident	38 Å²	38	61.2 Å²	61.2	23%	0.233	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.3	5.9	-166.7	-63.5	0	0	0	0	114.2	E627 K629 G633 Q634 I636	E627-T631 WeakPolarHBondContact O-CB 3.39Å; E627-T631 PolarHBondContact O-N 2.77Å; E627-T631 PolarHBondContact O-OG1 3.06Å; K629-T631 VanDerWaalsContact C-N 3.32Å; K629-T631 PolarHBondContact O-N 3.47Å; T631-G633 PolarHBondContact O-N 3.21Å; T631-Q634 HydrophobicContact CG2-CB 3.58Å; T631-Q634 HydrophobicContact CG2-CG 4.01Å; T631-Q634 PolarHBondContact O-N 3.29Å; T631-Q634 VanDerWaalsContact O-N 3.16Å; T631-I636 HydrophobicContact CG2-CD1 4.02Å; T631-I636 HydrophobicContact CG2-CG1 4.03Å; T631-I636 WeakPolarHBondContact OG1-CD1 3.16Å
632	K	78.4	Confident	87.3	Confident	182 Å²	182	60.8 Å²	60.8	79%	0.791	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	44.2	39.2	164.5	-72.6	176	-175.3	173.1	0	115.8	E630	E630-K632 PolarHBondContact O-N 2.92Å; E630-K632 VanDerWaalsContact O-N 3.15Å
633	G	78.7	Confident	86.9	Confident	34 Å²	34	61.3 Å²	61.3	35%	0.351	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	103	2.7	170.8	0	0	0	0	0	116.4	Y515 T631	Y515-G633 VanDerWaalsContact O-CA 3.24Å; Y515-G633 WeakPolarHBondContact O-CA 3.48Å; Y515-G633 PolarHBondContact O-N 3.46Å; T631-G633 PolarHBondContact O-N 3.21Å
634	Q	86.5	Confident	86.2	Confident	145 Å²	145	65.4 Å²	65.4	68%	0.678	32%	0.319	S	S	*	.			trans	-73.4	160.7	157.9	-39.2	-178.9	-31.4	0	0	109.8	S514 T631	S514-Q634 WeakPolarHBondContact CB-O 3.32Å; T631-Q634 HydrophobicContact CG2-CB 3.58Å; T631-Q634 HydrophobicContact CG2-CG 4.01Å; T631-Q634 PolarHBondContact O-N 3.29Å; T631-Q634 VanDerWaalsContact O-N 3.16Å
635	Q	90.4	Very high	84.4	Confident	95 Å²	95	71.5 Å²	71.5	44%	0.444	36%	0.362	S	S	.	.			trans	-98.1	127.3	-179.5	-171.9	-174.2	18.9	0	0	110.5	L513 E525	L513-Q635 WeakPolarHBondContact O-CA 3.31Å; E525-Q635 PolarHBondContact OE2-NE2 2.86Å
636	I	90.8	Very high	84	Confident	18 Å²	18	75.1 Å²	75.1	9%	0.092	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	127.6	178.1	-48.1	-173.8	0	0	0	108.8	G512 L513 H624 E627 M628 T631	G512-I636 CarbonylContact C-O 3.35Å; G512-I636 VanDerWaalsContact CA-O 3.31Å; G512-I636 WeakPolarHBondContact CA-O 3.26Å; L513-I636 PolarHBondContact N-O 2.79Å; L513-I636 PolarHBondContact O-N 3.08Å; H624-I636 WeakPolarHBondContact NE2-CA 3.38Å; H624-I636 WeakPolarHBondContact NE2-CB 3.49Å; H624-I636 VanDerWaalsContact NE2-CG2 3.27Å; H624-I636 WeakPolarHBondContact NE2-CG2 3.41Å; H624-I636 PolarHBondContact NE2-O 3.49Å; E627-I636 HydrophobicContact CB-CD1 3.78Å; E627-I636 HydrophobicContact CG-CD1 3.56Å; E627-I636 WeakPolarHBondContact O-CD1 3.24Å; E627-I636 WeakPolarHBondContact OE1-CG2 3.37Å; M628-I636 HydrophobicContact CB-CD1 4.28Å; T631-I636 HydrophobicContact CG2-CD1 4.02Å; T631-I636 HydrophobicContact CG2-CG1 4.03Å; T631-I636 WeakPolarHBondContact OG1-CD1 3.16Å
637	C	92	Very high	83.7	Confident	64 Å²	64	74.1 Å²	74.1	43%	0.432	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	113.2	-179.1	-62.6	0	0	0	0	110.3	L510 V511 I527 H624	L510-C637 HydrophobicContact CD1-CB 4.13Å; V511-C637 WeakPolarHBondContact O-CA 3.23Å; I527-C637 HydrophobicContact CD1-CB 4.25Å; I527-C637 VanDerWaalsContact CD1-SG 3.54Å; H624-C637 PolarHBondContact NE2-N 2.92Å
638	R	87.5	Confident	83.4	Confident	74 Å²	74	74.3 Å²	74.3	28%	0.279	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	145.4	176.5	-175.4	170.8	-83.9	118.9	9.6	110.3	V511 H624 E627 H640	V511-R638 PolarHBondContact N-O 3.19Å; V511-R638 PolarHBondContact O-N 3.29Å; V511-R638 VanDerWaalsContact O-N 3.1Å; H624-R638 HydrophobicContact CB-CB 4.47Å; E627-R638 IonicContact OE2-CZ 2.85Å; E627-R638 IonicContact OE2-NH1 3.39Å; E627-R638 PolarHBondContact OE2-NH1 2.87Å; E627-R638 IonicContact OE2-NH2 2.71Å; E627-R638 PolarHBondContact OE2-NH2 3.1Å; R638-H640 PolarHBondContact O-CD2 2.86Å
639	W	87.7	Confident	82.9	Confident	63 Å²	63	78.6 Å²	78.6	24%	0.239	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	135.6	170.8	-75.7	98.2	0	0	0	109.3	E508 L510 K528	E508-W639 HydrophobicContact CB-CE3 3.97Å; E508-W639 HydrophobicContact CB-CZ3 4.34Å; L510-W639 HydrophobicContact CB-CD2 3.81Å; L510-W639 HydrophobicContact CB-CE3 3.74Å; L510-W639 HydrophobicContact CB-CH2 3.78Å; L510-W639 HydrophobicContact CB-CZ2 3.86Å; L510-W639 HydrophobicContact CB-CZ3 3.72Å; L510-W639 HydrophobicContact CD1-CD2 4.15Å; L510-W639 HydrophobicContact CD1-CG 4.12Å; L510-W639 HydrophobicContact CD2-CH2 4.49Å; L510-W639 HydrophobicContact CD2-CZ2 3.93Å; L510-W639 HydrophobicContact CG-CD2 4.46Å; L510-W639 HydrophobicContact CG-CZ2 4.36Å; K528-W639 HydrophobicContact CB-CH2 4.35Å; K528-W639 HydrophobicContact CD-CH2 4.07Å; K528-W639 HydrophobicContact CG-CH2 4.12Å
640	H	86.2	Confident	82.7	Confident	1 Å²	1	79.4 Å²	79.4	1%	0.005	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	134.5	179	-65.3	-71.8	0	0	0	110.4	E508 L509 I610 H624 R638	E508-H640 CarbonylContact C-O 3.44Å; E508-H640 VanDerWaalsContact CA-O 3.3Å; E508-H640 WeakPolarHBondContact CA-O 3.44Å; L509-H640 PolarHBondContact N-O 2.82Å; L509-H640 PolarHBondContact O-N 2.88Å; I610-H640 HydrophobicContact CD1-CB 3.69Å; I610-H640 HydrophobicContact CG2-CB 4.18Å; H624-H640 AromaticContact CE1-NE2 3.87Å; H624-H640 AromaticContact CG-CE1 3.94Å; H624-H640 AromaticContact CG-NE2 3.62Å; H624-H640 AromaticContact ND1-CD2 3.98Å; H624-H640 AromaticContact ND1-CE1 3.58Å; H624-H640 AromaticContact ND1-NE2 2.86Å; H624-H640 PolarHBondContact ND1-NE2 2.94Å; R638-H640 PolarHBondContact O-CD2 2.86Å
641	T	85.7	Confident	82.3	Confident	35 Å²	35	74.4 Å²	74.4	22%	0.215	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	122	174.8	-62.7	0	0	0	0	109.5	H503 A506 I610 L643	H503-T641 PolarHBondContact ND1-OG1 2.92Å; A506-T641 HydrophobicContact CB-CG2 3.79Å; I610-T641 WeakPolarHBondContact CG2-O 3.35Å; T641-L643 PolarHBondContact O-N 2.93Å
642	L	85.7	Confident	82.4	Confident	5 Å²	5	77 Å²	77	3%	0.026	40%	0.398	C	S	.	.	P	Polyproline II helix	trans	-74.6	128.2	178.1	-55.8	-176.1	0	0	0	111	P507 L509 F532 V595 I610	P507-L642 HydrophobicContact CB-CB 4.39Å; P507-L642 HydrophobicContact CB-CD1 4.36Å; P507-L642 HydrophobicContact CG-CB 4.15Å; P507-L642 WeakPolarHBondContact O-CB 3.33Å; P507-L642 PolarHBondContact O-N 3.4Å; L509-L642 HydrophobicContact CB-CD2 3.73Å; L509-L642 HydrophobicContact CB-CG 4.23Å; L509-L642 HydrophobicContact CD2-CD2 4.26Å; F532-L642 HydrophobicContact CE1-CD1 3.53Å; F532-L642 HydrophobicContact CE1-CG 4.45Å; F532-L642 HydrophobicContact CZ-CD1 3.85Å; V595-L642 HydrophobicContact CB-CD1 3.94Å; V595-L642 HydrophobicContact CG2-CD1 3.58Å; I610-L642 HydrophobicContact CB-CD2 4.43Å; I610-L642 HydrophobicContact CD1-CD2 4.24Å; I610-L642 HydrophobicContact CG1-CD2 4.11Å; I610-L642 HydrophobicContact CG2-CD2 3.67Å
643	L	79.1	Confident	82.7	Confident	68 Å²	68	68.9 Å²	68.9	36%	0.356	37%	0.368	S	S	.	.	B	Isolated β-bridge	trans	-72.6	135	174.9	-59.5	-177.7	0	0	0	111.2	G608 W609 T641	G608-L643 CarbonylContact C-O 3.48Å; G608-L643 WeakPolarHBondContact CA-O 3.23Å; W609-L643 HydrophobicContact CH2-CD1 3.81Å; W609-L643 HydrophobicContact CZ2-CB 4.29Å; W609-L643 HydrophobicContact CZ2-CD1 3.84Å; W609-L643 HydrophobicContact CZ3-CD1 4.28Å; W609-L643 PolarHBondContact N-O 2.68Å; W609-L643 PolarHBondContact O-N 2.94Å; T641-L643 PolarHBondContact O-N 2.93Å
644	E	72.9	Confident	83.1	Confident	166 Å²	166	71.8 Å²	71.8	78%	0.776	37%	0.37	S	S	*	.	P	Polyproline II helix	trans	-74.3	149.1	176.1	-165.5	173.3	-158.3	0	0	110.9
645	S	52.3	Low	82.7	Confident	128 Å²	128	65.2 Å²	65.2	90%	0.895	34%	0.342	S	S	*	.			trans	-107.8	0	-174.5	70.6	0	0	0	0	114.2

Retrieved 645 of 645 residues in 819.5 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).