A0A096LRI4_POEFO Loading...

E3 ubiquitin-protein ligase

E3 ubiquitin ligase.

AlphaFold DB , UniProt , Accession A0A096LRI4, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 663 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	34.3	Very low	32.7	Very low	249 Å²	249	145.8 Å²	145.8	100%	1.227	84%	0.84	S	S	*	*				0	130.8	0	-52.5	-168.9	-63.3	0	0	107.1
2	G	33.2	Very low	32.9	Very low	76 Å²	76	144.7 Å²	144.7	78%	0.784	84%	0.837	S	S	*	*			cis	148	72.3	6.2	0	0	0	0	0	108.8
3	A	26	Very low	32.8	Very low	105 Å²	105	147.2 Å²	147.2	87%	0.868	84%	0.836	S	S	*	*			trans	-92	137.2	-177.4	0	0	0	0	0	110.5
4	L	34.7	Very low	33.1	Very low	158 Å²	158	149.8 Å²	149.8	83%	0.827	84%	0.838	S	S	*	*			trans	-100.2	166.7	-175.5	-69.6	169	0	0	0	111.9
5	T	34.7	Very low	33.4	Very low	143 Å²	143	147.9 Å²	147.9	88%	0.877	83%	0.831	S	S	*	*			trans	56.2	97.5	166.6	56.2	0	0	0	0	117
6	S	26.1	Very low	33.5	Very low	102 Å²	102	148.4 Å²	148.4	71%	0.713	83%	0.832	S	S	*	*			trans	-109.9	116.3	137.1	-174.8	0	0	0	0	108.5
7	R	38.7	Very low	34.1	Very low	238 Å²	238	145.8 Å²	145.8	90%	0.898	81%	0.814	S	S	*	*			trans	-107.7	107.9	156.2	-99.2	-172.2	170	-170.8	-3.4	105.8
8	Q	33.5	Very low	34.3	Very low	157 Å²	157	143.8 Å²	143.8	73%	0.734	81%	0.808	S	S	*	*			trans	-127.2	106.7	165.2	-74.8	-173.5	-31.1	0	0	107.6	I10	Q8-I10 PolarHBondContact O-N 3.46Å
9	N	35.1	Very low	34.8	Very low	162 Å²	162	142.7 Å²	142.7	87%	0.866	81%	0.811	S	S	*	*			trans	-67.6	108.7	161.6	-67.5	8.4	0	0	0	106.1
10	I	31.8	Very low	35.4	Very low	146 Å²	146	142.3 Å²	142.3	75%	0.749	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-94.4	118.2	156.7	-70.2	175.8	0	0	0	104.6	Q8 V12	Q8-I10 PolarHBondContact O-N 3.46Å; I10-V12 PolarHBondContact O-N 2.91Å
11	G	32	Very low	36.1	Very low	68 Å²	68	139.1 Å²	139.1	70%	0.701	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-63.3	120.7	173.8	0	0	0	0	0	108.7	E13	G11-E13 PolarHBondContact O-N 3.01Å
12	V	35.1	Very low	37.2	Very low	132 Å²	132	130.7 Å²	130.7	80%	0.8	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-66.4	124	151.5	179.4	0	0	0	0	104.7	I10 E14	I10-V12 PolarHBondContact O-N 2.91Å; V12-E14 PolarHBondContact O-N 3.12Å; V12-E14 VanDerWaalsContact O-N 3.1Å
13	E	30.9	Very low	38.3	Very low	177 Å²	177	128.2 Å²	128.2	83%	0.827	72%	0.723	S	S	*	*			trans	-62.2	114.7	168.6	-70.7	-179.8	119.4	0	0	107.2	G11 V15	G11-E13 PolarHBondContact O-N 3.01Å; E13-V15 VanDerWaalsContact C-N 3.29Å; E13-V15 PolarHBondContact O-N 2.88Å
14	E	38.1	Very low	40.5	Very low	184 Å²	184	127.7 Å²	127.7	86%	0.86	70%	0.698	S	S	*	*			trans	-65.7	97.1	168.5	-72	-175.6	123.8	0	0	107	V12 D16	V12-E14 PolarHBondContact O-N 3.12Å; V12-E14 VanDerWaalsContact O-N 3.1Å; E14-D16 PolarHBondContact O-N 3.13Å
15	V	37.8	Very low	42.3	Very low	122 Å²	122	123.1 Å²	123.1	74%	0.739	67%	0.67	S	S	*	*			trans	-62.4	103.6	166.3	177.3	0	0	0	0	106	E13 I17	E13-V15 VanDerWaalsContact C-N 3.29Å; E13-V15 PolarHBondContact O-N 2.88Å; V15-I17 VanDerWaalsContact C-N 3.35Å; V15-I17 PolarHBondContact O-N 3.38Å
16	D	34	Very low	44	Very low	156 Å²	156	121 Å²	121	83%	0.834	66%	0.659	S	S	*	*			trans	-57.1	97.2	173.4	-101.2	-39.6	0	0	0	108.9	E14 P18	E14-D16 PolarHBondContact O-N 3.13Å; D16-P18 VanDerWaalsContact O-CD 3.25Å; D16-P18 WeakPolarHBondContact O-CD 3.34Å
17	I	43.7	Very low	46.1	Very low	104 Å²	104	118.1 Å²	118.1	53%	0.533	64%	0.638	S	S	.	*			trans	-75.7	112.2	171.5	-60.7	175.7	0	0	0	106	V15 S19	V15-I17 VanDerWaalsContact C-N 3.35Å; V15-I17 PolarHBondContact O-N 3.38Å; I17-S19 PolarHBondContact O-N 3.38Å
18	P	37.8	Very low	47.6	Very low	110 Å²	110	115.6 Å²	115.6	71%	0.714	63%	0.633	S	S	*	*			trans	-58.2	136.6	176.9	25	-33.7	0	0	0	109.4	D16 N20	D16-P18 VanDerWaalsContact O-CD 3.25Å; D16-P18 WeakPolarHBondContact O-CD 3.34Å; P18-N20 PolarHBondContact O-N 3.09Å
19	S	44.5	Very low	49.2	Very low	122 Å²	122	113.2 Å²	113.2	85%	0.853	63%	0.634	S	S	*	*	S	Bend	trans	-75.4	35.8	-152.3	-41.3	0	0	0	0	116.9	I17	I17-S19 PolarHBondContact O-N 3.38Å
20	N	46.5	Very low	50.6	Low	134 Å²	134	108.9 Å²	108.9	72%	0.717	63%	0.628	S	S	*	*			trans	-109.9	38.8	-177.5	-89.7	-6.8	0	0	0	112.9	P18 V22	P18-N20 PolarHBondContact O-N 3.09Å; N20-V22 PolarHBondContact O-N 2.89Å
21	S	50.7	Low	51.9	Low	76 Å²	76	107 Å²	107	53%	0.531	63%	0.627	S	S	.	*			trans	-71.8	96	-179.9	60.4	0	0	0	0	113
22	V	57.3	Low	53.8	Low	72 Å²	72	107.7 Å²	107.7	44%	0.436	61%	0.609	S	S	.	*				25.2	106.1	98.6	169.5	0	0	0	0	111.8	N20 E196	N20-V22 PolarHBondContact O-N 2.89Å; V22-E196 WeakPolarHBondContact CA-OE1 3.44Å; V22-E196 VanDerWaalsContact CG1-CD 3.49Å; V22-E196 HydrophobicContact CG1-CG 4.07Å; V22-E196 VanDerWaalsContact CG1-OE1 3.27Å; V22-E196 WeakPolarHBondContact CG1-OE1 3.2Å
23	Y	54.8	Low	55.7	Low	25 Å²	25	103.5 Å²	103.5	10%	0.098	58%	0.58	C	S	.	*			trans	-92.5	136.1	-166.4	175.2	-86.9	0	0	0	112.3	Y32 L60 E196	Y23-Y32 HydrophobicContact CD2-CE2 4.38Å; Y23-Y32 HydrophobicContact CE1-CE2 4.34Å; Y23-Y32 AromaticContact CE2-CD2 3.48Å; Y23-Y32 HydrophobicContact CE2-CD2 3.48Å; Y23-Y32 VanDerWaalsContact CE2-CD2 3.48Å; Y23-Y32 AromaticContact CE2-CE2 3.45Å; Y23-Y32 HydrophobicContact CE2-CE2 3.45Å; Y23-Y32 VanDerWaalsContact CE2-CE2 3.45Å; Y23-Y32 AromaticContact CZ-CD2 3.58Å; Y23-Y32 AromaticContact CZ-CE2 3.43Å; Y23-Y32 VanDerWaalsContact CZ-CE2 3.43Å; Y23-Y32 WeakPolarHBondContact OH-CD2 3.45Å; Y23-Y32 VanDerWaalsContact OH-CE2 3.22Å; Y23-Y32 WeakPolarHBondContact OH-CE2 3.39Å; Y23-L60 HydrophobicContact CE1-CB 3.86Å; Y23-E196 PolarHBondContact N-OE1 3.34Å
24	R	73.5	Confident	57.8	Low	94 Å²	94	97.3 Å²	97.3	36%	0.355	56%	0.56	S	S	.	*			trans	-137.4	136.5	171.3	-57.4	-168.9	-165.9	-178.8	9.3	111.6	P26 P27 N61 D194	R24-P26 CarbonylContact O-C 3.49Å; R24-P26 VanDerWaalsContact O-C 3.3Å; R24-P27 WeakPolarHBondContact O-CA 3.33Å; R24-N61 WeakPolarHBondContact CA-OD1 3.4Å; R24-D194 IonicContact CZ-OD1 2.64Å; R24-D194 IonicContact NH1-OD1 2.88Å; R24-D194 PolarHBondContact NH1-OD1 2.92Å; R24-D194 VanDerWaalsContact NH2-CA 3.34Å; R24-D194 PolarHBondContact NH2-O 2.84Å; R24-D194 VanDerWaalsContact NH2-O 3.09Å; R24-D194 IonicContact NH2-OD1 3.97Å; R24-D194 PolarHBondContact NH2-OD1 2.82Å
25	Y	71.7	Confident	59.6	Low	62 Å²	62	93.7 Å²	93.7	24%	0.243	55%	0.546	C	S	.	.	S	Bend	trans	-90.1	140.1	167.3	-169.2	-82.9	0	0	0	111.4	F33 N57 L60 N61	Y25-F33 HydrophobicContact CE2-CE2 4.25Å; Y25-N57 WeakPolarHBondContact CB-O 3.46Å; Y25-N57 HydrophobicContact CD1-CB 3.48Å; Y25-N57 VanDerWaalsContact CD1-CB 3.48Å; Y25-N57 HydrophobicContact CD2-CB 4.28Å; Y25-N57 HydrophobicContact CE1-CB 3.24Å; Y25-N57 HydrophobicContact CE2-CB 4.05Å; Y25-N57 HydrophobicContact CG-CB 4.01Å; Y25-N57 PolarHBondContact OH-ND2 2.93Å; Y25-L60 HydrophobicContact CD2-CD1 3.55Å; Y25-L60 HydrophobicContact CE2-CD1 3.95Å; Y25-L60 HydrophobicContact CG-CD1 4.3Å; Y25-N61 PolarHBondContact N-OD1 2.62Å
26	P	71.2	Confident	61.6	Low	98 Å²	98	90.7 Å²	90.7	64%	0.636	52%	0.524	S	S	*	.	S	Bend	cis	-67.7	146.4	-11.1	29.9	-34.8	0	0	0	110.7	R24	R24-P26 CarbonylContact O-C 3.49Å; R24-P26 VanDerWaalsContact O-C 3.3Å
27	P	70.5	Confident	63.6	Low	41 Å²	41	84.8 Å²	84.8	27%	0.266	49%	0.491	S	S	.	.	P	Polyproline II helix	trans	-60.8	143	-179.2	28.7	-37.7	0	0	0	110.8	R24 S29	R24-P27 WeakPolarHBondContact O-CA 3.33Å; P27-S29 PolarHBondContact O-N 3.1Å; P27-S29 VanDerWaalsContact O-N 3.13Å
28	K	70.2	Confident	65.1	Low	186 Å²	186	85.4 Å²	85.4	81%	0.809	49%	0.494	S	S	*	.	S	Bend	trans	-58.3	-26.9	179.5	-66.5	-178.9	-179.8	176.1	0	113
29	S	65.9	Low	66.9	Low	107 Å²	107	81 Å²	81	75%	0.748	46%	0.464	S	S	*	.	S	Bend	trans	-160	161.2	173.1	58.3	0	0	0	0	111.2	P27	P27-S29 PolarHBondContact O-N 3.1Å; P27-S29 VanDerWaalsContact O-N 3.13Å
30	G	64.2	Low	68.1	Low	71 Å²	71	76.2 Å²	76.2	73%	0.732	43%	0.434	S	S	*	.	S	Bend	trans	84.2	172.1	178.5	0	0	0	0	0	114.8
31	S	60.6	Low	69.1	Low	105 Å²	105	71.6 Å²	71.6	73%	0.734	42%	0.418	S	S	*	.			trans	-94	125.6	170	-170.2	0	0	0	0	109.4	F33	S31-F33 PolarHBondContact OG-O 3.19Å
32	Y	70.6	Confident	70.2	Confident	84 Å²	84	73 Å²	73	33%	0.329	42%	0.416	S	S	.	.	S	Bend	trans	-76	-35.3	173.6	-178.2	-101.4	0	0	0	112.2	Y23 L60	Y23-Y32 HydrophobicContact CD2-CE2 4.38Å; Y23-Y32 HydrophobicContact CE1-CE2 4.34Å; Y23-Y32 AromaticContact CE2-CD2 3.48Å; Y23-Y32 HydrophobicContact CE2-CD2 3.48Å; Y23-Y32 VanDerWaalsContact CE2-CD2 3.48Å; Y23-Y32 AromaticContact CE2-CE2 3.45Å; Y23-Y32 HydrophobicContact CE2-CE2 3.45Å; Y23-Y32 VanDerWaalsContact CE2-CE2 3.45Å; Y23-Y32 AromaticContact CZ-CD2 3.58Å; Y23-Y32 AromaticContact CZ-CE2 3.43Å; Y23-Y32 VanDerWaalsContact CZ-CE2 3.43Å; Y23-Y32 WeakPolarHBondContact OH-CD2 3.45Å; Y23-Y32 VanDerWaalsContact OH-CE2 3.22Å; Y23-Y32 WeakPolarHBondContact OH-CE2 3.39Å; Y32-L60 HydrophobicContact CD1-CD1 3.78Å; Y32-L60 HydrophobicContact CE1-CB 4.43Å; Y32-L60 HydrophobicContact CE1-CD1 3.49Å; Y32-L60 VanDerWaalsContact CE1-CD1 3.49Å; Y32-L60 HydrophobicContact CE1-CD2 3.77Å; Y32-L60 HydrophobicContact CE1-CG 4.08Å
33	F	76	Confident	71.2	Confident	43 Å²	43	74.8 Å²	74.8	19%	0.189	42%	0.418	C	S	.	.	S	Bend	trans	-96.4	154	178.9	-60.5	-68.6	0	0	0	111.6	Y25 S31 P49 E50 L53 L60	Y25-F33 HydrophobicContact CE2-CE2 4.25Å; S31-F33 PolarHBondContact OG-O 3.19Å; F33-P49 HydrophobicContact CB-CB 3.58Å; F33-P49 HydrophobicContact CB-CG 3.44Å; F33-P49 VanDerWaalsContact CB-CG 3.44Å; F33-P49 HydrophobicContact CD1-CB 4.5Å; F33-P49 HydrophobicContact CD2-CB 4.2Å; F33-P49 HydrophobicContact CD2-CG 3.99Å; F33-P49 HydrophobicContact CG-CB 3.86Å; F33-P49 HydrophobicContact CG-CG 3.94Å; F33-E50 HydrophobicContact CD2-CB 4.33Å; F33-E50 HydrophobicContact CE2-CB 3.84Å; F33-L53 HydrophobicContact CE1-CD2 3.88Å; F33-L53 HydrophobicContact CZ-CD1 4.13Å; F33-L53 HydrophobicContact CZ-CD2 3.88Å; F33-L53 HydrophobicContact CZ-CG 4.13Å; F33-L60 HydrophobicContact CE1-CD1 4.45Å; F33-L60 HydrophobicContact CZ-CD1 3.82Å
34	A	74.5	Confident	72.3	Confident	48 Å²	48	75.7 Å²	75.7	40%	0.397	42%	0.422	S	S	.	.			trans	-69.1	164.6	157.9	0	0	0	0	0	110.5	H36 P49	A34-H36 PolarHBondContact O-N 2.78Å; A34-P49 WeakPolarHBondContact O-CG 3.11Å
35	N	76.3	Confident	72.7	Confident	107 Å²	107	76.2 Å²	76.2	57%	0.572	43%	0.432	S	S	*	.	S	Bend	trans	-69.6	19.6	171.4	70.8	-34.9	0	0	0	113.9	D45 S46	N35-D45 WeakPolarHBondContact O-CA 3.24Å; N35-S46 CarbonylContact C-O 3.41Å; N35-S46 PolarHBondContact O-N 2.64Å; N35-S46 VanDerWaalsContact O-O 3.11Å
36	H	78.9	Confident	72.9	Confident	59 Å²	59	74.1 Å²	74.1	27%	0.273	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.6	159.8	-175.3	63.3	-93.4	0	0	0	110.5	A34 K43 F44	A34-H36 PolarHBondContact O-N 2.78Å; H36-K43 HydrophobicContact CB-CG 4.21Å; H36-F44 CarbonylContact C-O 3.58Å; H36-F44 WeakPolarHBondContact CA-O 3.24Å; H36-F44 VanDerWaalsContact CB-O 3.25Å; H36-F44 WeakPolarHBondContact CB-O 3.09Å
37	F	76.7	Confident	73	Confident	32 Å²	32	75.4 Å²	75.4	14%	0.14	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	162.4	167.8	61.7	-92.2	0	0	0	110.1	M39 F44 Y52 M537	F37-M39 HydrophobicContact CD2-CB 4.09Å; F37-M39 HydrophobicContact CD2-CE 3.99Å; F37-M39 HydrophobicContact CE2-CB 4.16Å; F37-M39 HydrophobicContact CE2-CE 3.9Å; F37-F44 HydrophobicContact CD1-CB 4.23Å; F37-F44 HydrophobicContact CD2-CB 4.09Å; F37-F44 AromaticContact CD2-CD2 3.98Å; F37-F44 HydrophobicContact CD2-CD2 3.98Å; F37-F44 HydrophobicContact CD2-CG 4.42Å; F37-F44 HydrophobicContact CE1-CB 3.76Å; F37-F44 HydrophobicContact CE2-CB 3.6Å; F37-F44 AromaticContact CE2-CD2 3.44Å; F37-F44 HydrophobicContact CE2-CD2 3.44Å; F37-F44 VanDerWaalsContact CE2-CD2 3.44Å; F37-F44 HydrophobicContact CE2-CE2 4.33Å; F37-F44 AromaticContact CE2-CG 3.7Å; F37-F44 HydrophobicContact CE2-CG 3.7Å; F37-F44 HydrophobicContact CG-CB 4.39Å; F37-F44 HydrophobicContact CZ-CB 3.42Å; F37-F44 VanDerWaalsContact CZ-CB 3.42Å; F37-F44 HydrophobicContact CZ-CD2 4.06Å; F37-F44 AromaticContact CZ-CG 3.82Å; F37-F44 HydrophobicContact CZ-CG 3.82Å; F37-F44 PolarHBondContact N-O 3.3Å; F37-F44 PolarHBondContact O-N 3.37Å; F37-Y52 AromaticContact CD1-CD2 3.99Å; F37-Y52 HydrophobicContact CD1-CD2 3.99Å; F37-Y52 AromaticContact CD1-CG 3.98Å; F37-Y52 HydrophobicContact CD1-CG 3.98Å; F37-Y52 AromaticContact CE1-CD1 3.75Å; F37-Y52 HydrophobicContact CE1-CD1 3.75Å; F37-Y52 AromaticContact CE1-CD2 3.56Å; F37-Y52 HydrophobicContact CE1-CD2 3.56Å; F37-Y52 AromaticContact CE1-CE1 3.97Å; F37-Y52 HydrophobicContact CE1-CE1 3.97Å; F37-Y52 AromaticContact CE1-CE2 3.8Å; F37-Y52 HydrophobicContact CE1-CE2 3.8Å; F37-Y52 AromaticContact CE1-CG 3.53Å; F37-Y52 HydrophobicContact CE1-CG 3.53Å; F37-Y52 AromaticContact CE1-CZ 3.98Å; F37-Y52 HydrophobicContact CE2-CD1 4.37Å; F37-Y52 AromaticContact CZ-CD1 3.63Å; F37-Y52 HydrophobicContact CZ-CD1 3.63Å; F37-Y52 HydrophobicContact CZ-CD2 4.32Å; F37-Y52 AromaticContact CZ-CE1 3.83Å; F37-Y52 HydrophobicContact CZ-CE1 3.83Å; F37-Y52 HydrophobicContact CZ-CE2 4.49Å; F37-Y52 AromaticContact CZ-CG 3.89Å; F37-Y52 HydrophobicContact CZ-CG 3.89Å; F37-M537 HydrophobicContact CE2-CE 3.87Å; F37-M537 HydrophobicContact CZ-CE 4.37Å
38	I	75.9	Confident	73.2	Confident	118 Å²	118	78.6 Å²	78.6	61%	0.605	44%	0.444	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.9	129.1	173.4	-60.8	174.8	0	0	0	107.5	E42 K43	I38-E42 CarbonylContact C-O 3.49Å; I38-E42 VanDerWaalsContact CA-O 3.29Å; I38-E42 WeakPolarHBondContact CA-O 3.47Å; I38-K43 HydrophobicContact CG1-CB 4.45Å
39	M	74.2	Confident	73	Confident	18 Å²	18	70.5 Å²	70.5	9%	0.089	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	135.7	179	-161	176.1	-54.6	0	0	109.3	F37 G41 E42 F44 F54 L291 L324 M537	F37-M39 HydrophobicContact CD2-CB 4.09Å; F37-M39 HydrophobicContact CD2-CE 3.99Å; F37-M39 HydrophobicContact CE2-CB 4.16Å; F37-M39 HydrophobicContact CE2-CE 3.9Å; M39-G41 PolarHBondContact O-N 3.4Å; M39-G41 VanDerWaalsContact O-N 3.11Å; M39-E42 PolarHBondContact N-O 2.87Å; M39-E42 PolarHBondContact O-N 2.91Å; M39-F44 HydrophobicContact CB-CE2 4.31Å; M39-F54 HydrophobicContact CE-CE2 3.69Å; M39-F54 HydrophobicContact CE-CZ 3.8Å; M39-F54 HydrophobicContact CG-CZ 4.36Å; M39-F54 HydrophobicContact SD-CE2 4.22Å; M39-F54 HydrophobicContact SD-CZ 3.73Å; M39-L291 HydrophobicContact SD-CD1 4.3Å; M39-L324 HydrophobicContact CG-CD1 4.1Å; M39-L324 HydrophobicContact SD-CD1 3.86Å; M39-L324 HydrophobicContact SD-CD2 4.35Å; M39-M537 HydrophobicContact CB-CE 4.07Å; M39-M537 HydrophobicContact CE-CE 4.11Å; M39-M537 HydrophobicContact CG-CE 4.17Å; M39-M537 HydrophobicContact SD-CE 3.44Å; M39-M537 WeakPolarHBondContact SD-CE 3.37Å; M39-M537 HydrophobicContact SD-CG 4.5Å; M39-M537 HydrophobicContact SD-SD 3.51Å
40	G	69.4	Low	73.3	Confident	21 Å²	21	68.6 Å²	68.6	22%	0.216	39%	0.39	C	S	.	.	T	Hydrogen-bonded Turn	trans	67.1	8.1	-178	0	0	0	0	0	115.9	S535	G40-S535 WeakPolarHBondContact CA-O 3.49Å
41	G	68.7	Low	73.5	Confident	36 Å²	36	65.7 Å²	65.7	37%	0.371	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	93.4	-12	-170.5	0	0	0	0	0	113.8	M39	M39-G41 PolarHBondContact O-N 3.4Å; M39-G41 VanDerWaalsContact O-N 3.11Å
42	E	72.4	Confident	73.8	Confident	107 Å²	107	64.7 Å²	64.7	50%	0.5	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	149.4	177.8	-62.7	-172.1	130.6	0	0	112	I38 M39 F44	I38-E42 CarbonylContact C-O 3.49Å; I38-E42 VanDerWaalsContact CA-O 3.29Å; I38-E42 WeakPolarHBondContact CA-O 3.47Å; M39-E42 PolarHBondContact N-O 2.87Å; M39-E42 PolarHBondContact O-N 2.91Å; E42-F44 HydrophobicContact CB-CD2 4.47Å; E42-F44 HydrophobicContact CB-CE2 3.66Å; E42-F44 HydrophobicContact CB-CZ 3.82Å; E42-F44 WeakPolarHBondContact OE2-CZ 3.3Å
43	K	79.3	Confident	73.9	Confident	108 Å²	108	62.6 Å²	62.6	47%	0.47	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	126.8	174.5	174.2	-178.2	171.3	-78.6	0	109.9	H36 I38 D45	H36-K43 HydrophobicContact CB-CG 4.21Å; I38-K43 HydrophobicContact CG1-CB 4.45Å; K43-D45 IonicContact NZ-OD1 2.64Å; K43-D45 PolarHBondContact NZ-OD1 2.87Å; K43-D45 IonicContact NZ-OD2 2.83Å; K43-D45 PolarHBondContact NZ-OD2 3.12Å
44	F	76.8	Confident	73.7	Confident	45 Å²	45	64.1 Å²	64.1	20%	0.197	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	118.5	176.7	-59.7	-89	0	0	0	109.9	H36 F37 M39 E42 M537	H36-F44 CarbonylContact C-O 3.58Å; H36-F44 WeakPolarHBondContact CA-O 3.24Å; H36-F44 VanDerWaalsContact CB-O 3.25Å; H36-F44 WeakPolarHBondContact CB-O 3.09Å; F37-F44 HydrophobicContact CD1-CB 4.23Å; F37-F44 HydrophobicContact CD2-CB 4.09Å; F37-F44 AromaticContact CD2-CD2 3.98Å; F37-F44 HydrophobicContact CD2-CD2 3.98Å; F37-F44 HydrophobicContact CD2-CG 4.42Å; F37-F44 HydrophobicContact CE1-CB 3.76Å; F37-F44 HydrophobicContact CE2-CB 3.6Å; F37-F44 AromaticContact CE2-CD2 3.44Å; F37-F44 HydrophobicContact CE2-CD2 3.44Å; F37-F44 VanDerWaalsContact CE2-CD2 3.44Å; F37-F44 HydrophobicContact CE2-CE2 4.33Å; F37-F44 AromaticContact CE2-CG 3.7Å; F37-F44 HydrophobicContact CE2-CG 3.7Å; F37-F44 HydrophobicContact CG-CB 4.39Å; F37-F44 HydrophobicContact CZ-CB 3.42Å; F37-F44 VanDerWaalsContact CZ-CB 3.42Å; F37-F44 HydrophobicContact CZ-CD2 4.06Å; F37-F44 AromaticContact CZ-CG 3.82Å; F37-F44 HydrophobicContact CZ-CG 3.82Å; F37-F44 PolarHBondContact N-O 3.3Å; F37-F44 PolarHBondContact O-N 3.37Å; M39-F44 HydrophobicContact CB-CE2 4.31Å; E42-F44 HydrophobicContact CB-CD2 4.47Å; E42-F44 HydrophobicContact CB-CE2 3.66Å; E42-F44 HydrophobicContact CB-CZ 3.82Å; E42-F44 WeakPolarHBondContact OE2-CZ 3.3Å; F44-M537 HydrophobicContact CD2-CE 4.35Å; F44-M537 HydrophobicContact CE2-CE 3.97Å; F44-M537 HydrophobicContact CZ-CB 4.21Å; F44-M537 HydrophobicContact CZ-CE 4.17Å
45	D	82.3	Confident	74	Confident	105 Å²	105	62.9 Å²	62.9	56%	0.561	33%	0.334	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.5	140.1	171	-67.2	-67.7	0	0	0	110.6	N35 K43	N35-D45 WeakPolarHBondContact O-CA 3.24Å; K43-D45 IonicContact NZ-OD1 2.64Å; K43-D45 PolarHBondContact NZ-OD1 2.87Å; K43-D45 IonicContact NZ-OD2 2.83Å; K43-D45 PolarHBondContact NZ-OD2 3.12Å
46	S	75.4	Confident	74.2	Confident	18 Å²	18	64.2 Å²	64.2	13%	0.126	34%	0.336	C	S	.	.			trans	-148.5	134.6	-173.9	-176.9	0	0	0	0	111.7	N35 H48 Y52	N35-S46 CarbonylContact C-O 3.41Å; N35-S46 PolarHBondContact O-N 2.64Å; N35-S46 VanDerWaalsContact O-O 3.11Å; S46-H48 VanDerWaalsContact C-N 3.28Å; S46-H48 PolarHBondContact OG-N 2.9Å; S46-H48 VanDerWaalsContact OG-N 3.1Å; S46-H48 PolarHBondContact OG-O 3.38Å; S46-Y52 WeakPolarHBondContact OG-CE2 3.49Å
47	T	75	Confident	74.3	Confident	124 Å²	124	63.5 Å²	63.5	76%	0.761	34%	0.335	S	S	*	.	S	Bend	trans	-80.1	-12	169.1	59.9	0	0	0	0	112.8
48	H	73.3	Confident	74.7	Confident	108 Å²	108	65 Å²	65	50%	0.5	35%	0.347	S	S	.	.			trans	-133.3	62.3	-178.5	-65.4	-62.5	0	0	0	110.7	S46 E50 G51 Y52	S46-H48 VanDerWaalsContact C-N 3.28Å; S46-H48 PolarHBondContact OG-N 2.9Å; S46-H48 VanDerWaalsContact OG-N 3.1Å; S46-H48 PolarHBondContact OG-O 3.38Å; H48-E50 WeakPolarHBondContact CA-OE1 3.49Å; H48-E50 VanDerWaalsContact CA-OE2 3.28Å; H48-E50 WeakPolarHBondContact CA-OE2 3.39Å; H48-E50 WeakPolarHBondContact CB-OE1 3.35Å; H48-E50 IonicContact CG-OE1 2.64Å; H48-E50 IonicContact ND1-OE1 2.69Å; H48-E50 PolarHBondContact ND1-OE1 3.47Å; H48-E50 PolarHBondContact O-N 2.93Å; H48-G51 PolarHBondContact O-N 3.38Å; H48-Y52 WeakPolarHBondContact O-CD2 3.31Å
49	P	67.3	Low	75.2	Confident	17 Å²	17	60 Å²	60	11%	0.11	32%	0.321	C	S	.	.	G	3₁₀ helix	trans	-58.5	-31	179	26.6	-36.5	0	0	0	112.7	F33 A34 G51 Y52	F33-P49 HydrophobicContact CB-CB 3.58Å; F33-P49 HydrophobicContact CB-CG 3.44Å; F33-P49 VanDerWaalsContact CB-CG 3.44Å; F33-P49 HydrophobicContact CD1-CB 4.5Å; F33-P49 HydrophobicContact CD2-CB 4.2Å; F33-P49 HydrophobicContact CD2-CG 3.99Å; F33-P49 HydrophobicContact CG-CB 3.86Å; F33-P49 HydrophobicContact CG-CG 3.94Å; A34-P49 WeakPolarHBondContact O-CG 3.11Å; P49-G51 PolarHBondContact O-N 2.73Å; P49-G51 VanDerWaalsContact O-N 3.1Å; P49-Y52 PolarHBondContact O-N 2.65Å
50	E	71.6	Confident	75.6	Confident	67 Å²	67	59.8 Å²	59.8	31%	0.313	32%	0.32	S	S	.	.	G	3₁₀ helix	trans	-57	-22.9	171.7	72.3	-76.1	177	0	0	113.4	F33 H48 Y52 N57	F33-E50 HydrophobicContact CD2-CB 4.33Å; F33-E50 HydrophobicContact CE2-CB 3.84Å; H48-E50 WeakPolarHBondContact CA-OE1 3.49Å; H48-E50 VanDerWaalsContact CA-OE2 3.28Å; H48-E50 WeakPolarHBondContact CA-OE2 3.39Å; H48-E50 WeakPolarHBondContact CB-OE1 3.35Å; H48-E50 IonicContact CG-OE1 2.64Å; H48-E50 IonicContact ND1-OE1 2.69Å; H48-E50 PolarHBondContact ND1-OE1 3.47Å; H48-E50 PolarHBondContact O-N 2.93Å; E50-Y52 VanDerWaalsContact C-N 3.33Å; E50-Y52 PolarHBondContact O-N 2.83Å; E50-N57 PolarHBondContact O-ND2 2.81Å
51	G	68.2	Low	76.4	Confident	10 Å²	10	59.7 Å²	59.7	10%	0.103	32%	0.315	C	S	.	.	G	3₁₀ helix	trans	-76.2	-14.2	-178.3	0	0	0	0	0	115.2	H48 P49 R321	H48-G51 PolarHBondContact O-N 3.38Å; P49-G51 PolarHBondContact O-N 2.73Å; P49-G51 VanDerWaalsContact O-N 3.1Å; G51-R321 WeakPolarHBondContact O-CD 3.19Å; G51-R321 PolarHBondContact O-NH1 2.83Å
52	Y	68.3	Low	77.3	Confident	84 Å²	84	58.8 Å²	58.8	33%	0.329	30%	0.3	S	S	.	.	G	3₁₀ helix	trans	-113.6	11.4	-170.3	-66.2	-89.2	0	0	0	114.3	F37 S46 H48 P49 E50	F37-Y52 AromaticContact CD1-CD2 3.99Å; F37-Y52 HydrophobicContact CD1-CD2 3.99Å; F37-Y52 AromaticContact CD1-CG 3.98Å; F37-Y52 HydrophobicContact CD1-CG 3.98Å; F37-Y52 AromaticContact CE1-CD1 3.75Å; F37-Y52 HydrophobicContact CE1-CD1 3.75Å; F37-Y52 AromaticContact CE1-CD2 3.56Å; F37-Y52 HydrophobicContact CE1-CD2 3.56Å; F37-Y52 AromaticContact CE1-CE1 3.97Å; F37-Y52 HydrophobicContact CE1-CE1 3.97Å; F37-Y52 AromaticContact CE1-CE2 3.8Å; F37-Y52 HydrophobicContact CE1-CE2 3.8Å; F37-Y52 AromaticContact CE1-CG 3.53Å; F37-Y52 HydrophobicContact CE1-CG 3.53Å; F37-Y52 AromaticContact CE1-CZ 3.98Å; F37-Y52 HydrophobicContact CE2-CD1 4.37Å; F37-Y52 AromaticContact CZ-CD1 3.63Å; F37-Y52 HydrophobicContact CZ-CD1 3.63Å; F37-Y52 HydrophobicContact CZ-CD2 4.32Å; F37-Y52 AromaticContact CZ-CE1 3.83Å; F37-Y52 HydrophobicContact CZ-CE1 3.83Å; F37-Y52 HydrophobicContact CZ-CE2 4.49Å; F37-Y52 AromaticContact CZ-CG 3.89Å; F37-Y52 HydrophobicContact CZ-CG 3.89Å; S46-Y52 WeakPolarHBondContact OG-CE2 3.49Å; H48-Y52 WeakPolarHBondContact O-CD2 3.31Å; P49-Y52 PolarHBondContact O-N 2.65Å; E50-Y52 VanDerWaalsContact C-N 3.33Å; E50-Y52 PolarHBondContact O-N 2.83Å
53	L	70.8	Confident	77.8	Confident	39 Å²	39	55.6 Å²	55.6	20%	0.204	29%	0.287	C	S	.	.			trans	-62.3	144.6	172.2	-69.5	-176.5	0	0	0	112.1	F33 G55 N57 L60	F33-L53 HydrophobicContact CE1-CD2 3.88Å; F33-L53 HydrophobicContact CZ-CD1 4.13Å; F33-L53 HydrophobicContact CZ-CD2 3.88Å; F33-L53 HydrophobicContact CZ-CG 4.13Å; L53-G55 VanDerWaalsContact CB-O 3.32Å; L53-G55 WeakPolarHBondContact CB-O 3.43Å; L53-G55 PolarHBondContact O-N 2.92Å; L53-N57 HydrophobicContact CD1-CB 4.11Å; L53-N57 VanDerWaalsContact CD1-ND2 3.31Å; L53-N57 WeakPolarHBondContact CD1-ND2 3.29Å; L53-L60 HydrophobicContact CD1-CD1 4.37Å
54	F	73.6	Confident	77.6	Confident	75 Å²	75	51.7 Å²	51.7	33%	0.329	28%	0.277	S	S	.	.	S	Bend	trans	-81.2	8.3	168.7	-67.9	-97.9	0	0	0	113	M39 Q250 L289 L291 R294 L324	M39-F54 HydrophobicContact CE-CE2 3.69Å; M39-F54 HydrophobicContact CE-CZ 3.8Å; M39-F54 HydrophobicContact CG-CZ 4.36Å; M39-F54 HydrophobicContact SD-CE2 4.22Å; M39-F54 HydrophobicContact SD-CZ 3.73Å; F54-Q250 HydrophobicContact CB-CG 4.39Å; F54-Q250 WeakPolarHBondContact O-CG 3.45Å; F54-L289 HydrophobicContact CE1-CD2 4.41Å; F54-L291 HydrophobicContact CD1-CD1 4.36Å; F54-L291 HydrophobicContact CD1-CD2 3.63Å; F54-L291 HydrophobicContact CE1-CD1 3.74Å; F54-L291 HydrophobicContact CE1-CD2 3.69Å; F54-L291 HydrophobicContact CE1-CG 4.35Å; F54-L291 HydrophobicContact CZ-CD1 3.96Å; F54-R294 WeakPolarHBondContact O-CD 3.41Å; F54-R294 PolarHBondContact O-NE 2.83Å; F54-R294 VanDerWaalsContact O-NE 3.09Å; F54-L324 HydrophobicContact CE1-CD2 3.62Å; F54-L324 HydrophobicContact CZ-CD2 3.78Å
55	G	78.8	Confident	77.1	Confident	23 Å²	23	52.5 Å²	52.5	24%	0.237	29%	0.288	C	S	.	.	S	Bend	trans	-154.7	-174.1	-177.6	0	0	0	0	0	110.6	L53	L53-G55 VanDerWaalsContact CB-O 3.32Å; L53-G55 WeakPolarHBondContact CB-O 3.43Å; L53-G55 PolarHBondContact O-N 2.92Å
56	E	81.7	Confident	76.6	Confident	134 Å²	134	56.2 Å²	56.2	63%	0.626	30%	0.295	S	S	*	.			trans	-75.7	152.7	174.6	-59	-174.2	175.1	0	0	110.8	T58 D59	E56-T58 WeakPolarHBondContact CB-OG1 3.37Å; E56-T58 PolarHBondContact O-N 2.98Å; E56-T58 PolarHBondContact OE2-OG1 3.21Å; E56-D59 WeakPolarHBondContact O-CB 3.32Å; E56-D59 PolarHBondContact O-N 3.14Å
57	N	81.4	Confident	76.4	Confident	45 Å²	45	61.8 Å²	61.8	24%	0.241	33%	0.33	C	S	.	.	G	3₁₀ helix	trans	-67.2	-24.4	178.5	-54	79.1	0	0	0	113	Y25 E50 L53 D59 L60	Y25-N57 WeakPolarHBondContact CB-O 3.46Å; Y25-N57 HydrophobicContact CD1-CB 3.48Å; Y25-N57 VanDerWaalsContact CD1-CB 3.48Å; Y25-N57 HydrophobicContact CD2-CB 4.28Å; Y25-N57 HydrophobicContact CE1-CB 3.24Å; Y25-N57 HydrophobicContact CE2-CB 4.05Å; Y25-N57 HydrophobicContact CG-CB 4.01Å; Y25-N57 PolarHBondContact OH-ND2 2.93Å; E50-N57 PolarHBondContact O-ND2 2.81Å; L53-N57 HydrophobicContact CD1-CB 4.11Å; L53-N57 VanDerWaalsContact CD1-ND2 3.31Å; L53-N57 WeakPolarHBondContact CD1-ND2 3.29Å; N57-D59 PolarHBondContact O-N 3.42Å; N57-L60 WeakPolarHBondContact O-CB 3.07Å; N57-L60 WeakPolarHBondContact O-CD1 3.27Å; N57-L60 VanDerWaalsContact O-CG 3.28Å; N57-L60 WeakPolarHBondContact O-CG 3.18Å; N57-L60 PolarHBondContact O-N 3.21Å
58	T	83.6	Confident	76.4	Confident	64 Å²	64	60.1 Å²	60.1	39%	0.393	32%	0.319	S	S	.	.	G	3₁₀ helix	trans	-59.5	-25.5	167.2	32.3	0	0	0	0	113.2	E56 L60 N61	E56-T58 WeakPolarHBondContact CB-OG1 3.37Å; E56-T58 PolarHBondContact O-N 2.98Å; E56-T58 PolarHBondContact OE2-OG1 3.21Å; T58-L60 PolarHBondContact O-N 3.16Å; T58-N61 VanDerWaalsContact O-CB 3.3Å; T58-N61 WeakPolarHBondContact O-CB 3.41Å; T58-N61 VanDerWaalsContact O-CG 3.3Å; T58-N61 PolarHBondContact O-N 3.24Å; T58-N61 VanDerWaalsContact O-N 3.11Å
59	D	86.6	Confident	76.6	Confident	13 Å²	13	59.3 Å²	59.3	7%	0.07	33%	0.331	C	S	.	.	G	3₁₀ helix	trans	-66.7	-18.8	178.8	-74.2	-0.7	0	0	0	112.9	E56 N57 N61 F62 K237 L248 Q250	E56-D59 WeakPolarHBondContact O-CB 3.32Å; E56-D59 PolarHBondContact O-N 3.14Å; N57-D59 PolarHBondContact O-N 3.42Å; D59-N61 PolarHBondContact O-N 3.02Å; D59-F62 WeakPolarHBondContact O-CD2 3.33Å; D59-F62 PolarHBondContact O-N 2.85Å; D59-F62 VanDerWaalsContact O-N 3.09Å; D59-K237 WeakPolarHBondContact OD1-CE 3.31Å; D59-K237 IonicContact OD1-NZ 3.43Å; D59-K237 PolarHBondContact OD1-NZ 2.87Å; D59-K237 IonicContact OD2-NZ 2.75Å; D59-K237 PolarHBondContact OD2-NZ 3.15Å; D59-L248 HydrophobicContact CB-CD2 3.59Å; D59-Q250 PolarHBondContact OD2-NE2 3.03Å
60	L	83.7	Confident	77.3	Confident	13 Å²	13	64.8 Å²	64.8	7%	0.068	35%	0.354	C	S	.	.	G	3₁₀ helix	trans	-66	-19.4	174.8	-57.7	172.4	0	0	0	112.5	Y23 Y25 Y32 F33 L53 N57 T58 F62 L63	Y23-L60 HydrophobicContact CE1-CB 3.86Å; Y25-L60 HydrophobicContact CD2-CD1 3.55Å; Y25-L60 HydrophobicContact CE2-CD1 3.95Å; Y25-L60 HydrophobicContact CG-CD1 4.3Å; Y32-L60 HydrophobicContact CD1-CD1 3.78Å; Y32-L60 HydrophobicContact CE1-CB 4.43Å; Y32-L60 HydrophobicContact CE1-CD1 3.49Å; Y32-L60 VanDerWaalsContact CE1-CD1 3.49Å; Y32-L60 HydrophobicContact CE1-CD2 3.77Å; Y32-L60 HydrophobicContact CE1-CG 4.08Å; F33-L60 HydrophobicContact CE1-CD1 4.45Å; F33-L60 HydrophobicContact CZ-CD1 3.82Å; L53-L60 HydrophobicContact CD1-CD1 4.37Å; N57-L60 WeakPolarHBondContact O-CB 3.07Å; N57-L60 WeakPolarHBondContact O-CD1 3.27Å; N57-L60 VanDerWaalsContact O-CG 3.28Å; N57-L60 WeakPolarHBondContact O-CG 3.18Å; N57-L60 PolarHBondContact O-N 3.21Å; T58-L60 PolarHBondContact O-N 3.16Å; L60-F62 PolarHBondContact O-N 3.01Å; L60-L63 HydrophobicContact CD2-CD1 4.17Å; L60-L63 PolarHBondContact O-N 3.23Å; L60-L63 VanDerWaalsContact O-N 3.09Å
61	N	84.9	Confident	77.7	Confident	19 Å²	19	64.6 Å²	64.6	10%	0.102	36%	0.358	C	S	.	.	G	3₁₀ helix	trans	-67.5	-11.8	172.6	-58.1	-9.2	0	0	0	112.7	R24 Y25 T58 D59	R24-N61 WeakPolarHBondContact CA-OD1 3.4Å; Y25-N61 PolarHBondContact N-OD1 2.62Å; T58-N61 VanDerWaalsContact O-CB 3.3Å; T58-N61 WeakPolarHBondContact O-CB 3.41Å; T58-N61 VanDerWaalsContact O-CG 3.3Å; T58-N61 PolarHBondContact O-N 3.24Å; T58-N61 VanDerWaalsContact O-N 3.11Å; D59-N61 PolarHBondContact O-N 3.02Å
62	F	87.6	Confident	78.3	Confident	16 Å²	16	68.1 Å²	68.1	7%	0.07	37%	0.369	C	S	.	.	G	3₁₀ helix	trans	-98.4	14.9	172.6	-54.2	-78.4	0	0	0	112.7	D59 L60 F191 F198 L220 L236 K237 K239 L248	D59-F62 WeakPolarHBondContact O-CD2 3.33Å; D59-F62 PolarHBondContact O-N 2.85Å; D59-F62 VanDerWaalsContact O-N 3.09Å; L60-F62 PolarHBondContact O-N 3.01Å; F62-F191 HydrophobicContact CE1-CD1 4.19Å; F62-F191 AromaticContact CE1-CE1 3.89Å; F62-F191 HydrophobicContact CE1-CE1 3.89Å; F62-F191 HydrophobicContact CE1-CZ 4.12Å; F62-F191 HydrophobicContact CZ-CD1 4.35Å; F62-F191 HydrophobicContact CZ-CE1 4.15Å; F62-F198 AromaticContact CD1-CE1 3.93Å; F62-F198 HydrophobicContact CD1-CE1 3.93Å; F62-F198 HydrophobicContact CD1-CZ 4.37Å; F62-F198 HydrophobicContact CE1-CE1 4.01Å; F62-L220 HydrophobicContact CD1-CD1 3.81Å; F62-L220 HydrophobicContact CE1-CD1 4.47Å; F62-L236 HydrophobicContact CE1-CD2 3.86Å; F62-L236 HydrophobicContact CE1-CG 4.35Å; F62-L236 HydrophobicContact CZ-CD2 4.15Å; F62-L236 HydrophobicContact CZ-CG 4.32Å; F62-K237 HydrophobicContact CD1-CG 4.21Å; F62-K237 HydrophobicContact CD2-CD 4.34Å; F62-K237 HydrophobicContact CD2-CG 3.76Å; F62-K237 HydrophobicContact CE1-CG 4.3Å; F62-K237 HydrophobicContact CE2-CD 4.41Å; F62-K237 HydrophobicContact CE2-CG 3.87Å; F62-K237 HydrophobicContact CG-CG 3.94Å; F62-K237 HydrophobicContact CZ-CG 4.14Å; F62-K239 WeakPolarHBondContact O-CE 3.42Å; F62-K239 PolarHBondContact O-NZ 3.39Å; F62-L248 HydrophobicContact CB-CD1 3.91Å
63	L	84.9	Confident	78.7	Confident	41 Å²	41	68.5 Å²	68.5	22%	0.215	39%	0.39	C	S	.	.	S	Bend	trans	-122.1	151.1	176.7	-65.7	176.3	0	0	0	111	L60 L248	L60-L63 HydrophobicContact CD2-CD1 4.17Å; L60-L63 PolarHBondContact O-N 3.23Å; L60-L63 VanDerWaalsContact O-N 3.09Å; L63-L248 HydrophobicContact CD2-CB 4.2Å
64	G	74.1	Confident	78.7	Confident	25 Å²	25	70.4 Å²	70.4	26%	0.258	41%	0.411	S	S	.	.			trans	-60.9	141.3	-175.9	0	0	0	0	0	113.6	R66	G64-R66 PolarHBondContact O-N 3.19Å; G64-R66 VanDerWaalsContact O-N 3.15Å
65	S	67.2	Low	78.4	Confident	63 Å²	63	69 Å²	69	44%	0.441	41%	0.41	S	S	.	.	S	Bend	trans	-67.4	-11.5	-176	63.3	0	0	0	0	115.4
66	R	71.7	Confident	78.1	Confident	183 Å²	183	71.3 Å²	71.3	69%	0.691	42%	0.42	S	S	*	.	S	Bend	trans	-107.6	131.3	-173.8	-63.1	-177.2	-179.6	177	2	110.7	G64 V68	G64-R66 PolarHBondContact O-N 3.19Å; G64-R66 VanDerWaalsContact O-N 3.15Å; R66-V68 PolarHBondContact O-N 3.04Å
67	P	70.5	Confident	77.5	Confident	135 Å²	135	71.3 Å²	71.3	88%	0.877	43%	0.432	S	S	*	.	P	Polyproline II helix	trans	-57.8	124.3	172.4	-24.4	34.3	0	0	0	111.6
68	V	74.5	Confident	77	Confident	88 Å²	88	76.9 Å²	76.9	53%	0.533	46%	0.456	S	S	.	.	P	Polyproline II helix	trans	-99.7	135.4	173.1	-174.9	0	0	0	0	108.5	R66 F70 V245	R66-V68 PolarHBondContact O-N 3.04Å; V68-F70 PolarHBondContact O-N 3.34Å; V68-V245 HydrophobicContact CG1-CG2 3.97Å
69	A	78.1	Confident	76.5	Confident	91 Å²	91	77.5 Å²	77.5	75%	0.752	46%	0.455	S	S	*	.	P	Polyproline II helix	trans	-69	125.2	172.4	0	0	0	0	0	109.5
70	F	81	Confident	75.9	Confident	133 Å²	133	76.9 Å²	76.9	58%	0.583	45%	0.452	S	S	*	.	P	Polyproline II helix	trans	-66.4	123.1	-179.7	-166.2	-115.3	0	0	0	109.9	V68 Y72 Y247	V68-F70 PolarHBondContact O-N 3.34Å; F70-Y72 VanDerWaalsContact C-N 3.31Å; F70-Y72 VanDerWaalsContact CD1-O 3.3Å; F70-Y72 WeakPolarHBondContact CD1-O 3.45Å; F70-Y72 AromaticContact CE1-CD2 3.9Å; F70-Y72 HydrophobicContact CE1-CD2 3.9Å; F70-Y72 HydrophobicContact CE1-CG 4.42Å; F70-Y72 HydrophobicContact CE2-CD2 4.24Å; F70-Y72 AromaticContact CZ-CD2 3.69Å; F70-Y72 HydrophobicContact CZ-CD2 3.69Å; F70-Y72 HydrophobicContact CZ-CE2 4.48Å; F70-Y72 PolarHBondContact O-N 2.9Å; F70-Y247 HydrophobicContact CE2-CE1 4.22Å; F70-Y247 WeakPolarHBondContact CE2-OH 3.42Å
71	P	80.4	Confident	75.5	Confident	62 Å²	62	78.3 Å²	78.3	40%	0.403	46%	0.461	S	S	.	.	S	Bend	trans	-76.2	-18.8	-167.1	29	-36.2	0	0	0	113.3	D243 V245	P71-D243 HydrophobicContact CB-CB 4.35Å; P71-D243 HydrophobicContact CG-CB 4.02Å; P71-V245 VanDerWaalsContact CD-CG2 3.41Å; P71-V245 HydrophobicContact CG-CG2 4.02Å
72	Y	80.9	Confident	75.2	Confident	84 Å²	84	83.3 Å²	83.3	33%	0.329	48%	0.481	S	S	.	.	S	Bend	trans	-97.5	131.4	-178.2	-45.4	-58.9	0	0	0	111.2	F70 L84 V242 D243 Y247	F70-Y72 VanDerWaalsContact C-N 3.31Å; F70-Y72 VanDerWaalsContact CD1-O 3.3Å; F70-Y72 WeakPolarHBondContact CD1-O 3.45Å; F70-Y72 AromaticContact CE1-CD2 3.9Å; F70-Y72 HydrophobicContact CE1-CD2 3.9Å; F70-Y72 HydrophobicContact CE1-CG 4.42Å; F70-Y72 HydrophobicContact CE2-CD2 4.24Å; F70-Y72 AromaticContact CZ-CD2 3.69Å; F70-Y72 HydrophobicContact CZ-CD2 3.69Å; F70-Y72 HydrophobicContact CZ-CE2 4.48Å; F70-Y72 PolarHBondContact O-N 2.9Å; Y72-L84 HydrophobicContact CE2-CD1 4.01Å; Y72-V242 VanDerWaalsContact OH-CG1 3.26Å; Y72-V242 WeakPolarHBondContact OH-CG1 3.44Å; Y72-D243 WeakPolarHBondContact CE1-OD2 3.38Å; Y72-D243 PolarHBondContact OH-OD2 2.87Å; Y72-Y247 WeakPolarHBondContact CE2-OH 3.07Å
73	A	76.6	Confident	75	Confident	92 Å²	92	85.9 Å²	85.9	76%	0.76	50%	0.499	S	S	*	.	P	Polyproline II helix	trans	-66.3	151	165.3	0	0	0	0	0	110.5
74	A	70.8	Confident	75.1	Confident	79 Å²	79	86.8 Å²	86.8	65%	0.653	50%	0.504	S	S	*	.	P	Polyproline II helix	trans	-58	132.3	169.6	0	0	0	0	0	109.7
75	P	67.8	Low	75.8	Confident	47 Å²	47	91.7 Å²	91.7	31%	0.305	51%	0.514	S	S	.	.	P	Polyproline II helix	trans	-64.8	146.9	-179	26.7	-33.7	0	0	0	110.6	E79 V81	P75-E79 HydrophobicContact CB-CB 4.5Å; P75-V81 HydrophobicContact CG-CG2 4.39Å
76	P	72.4	Confident	77	Confident	71 Å²	71	91.3 Å²	91.3	46%	0.461	51%	0.511	S	S	.	.	P	Polyproline II helix	trans	-57.7	148	167.4	-20.7	32.4	0	0	0	110.1	Q78 E79	P76-Q78 PolarHBondContact O-N 3.07Å; P76-E79 PolarHBondContact O-N 2.87Å
77	P	68.4	Low	78.1	Confident	134 Å²	134	83 Å²	83	87%	0.87	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	0.8	178.5	-25.9	35.1	0	0	0	116.4
78	Q	71.3	Confident	79.4	Confident	161 Å²	161	76.7 Å²	76.7	75%	0.752	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.9	0.7	178.3	-61.2	-179.1	-0.6	0	0	112.9	P76 P363	P76-Q78 PolarHBondContact O-N 3.07Å; Q78-P363 WeakPolarHBondContact O-CB 3.22Å
79	E	72.6	Confident	80.4	Confident	78 Å²	78	75.7 Å²	75.7	36%	0.364	43%	0.431	S	S	.	.	S	Bend	trans	-110.2	143.2	169.5	-66.3	-164.7	-178.9	0	0	110.1	P75 P76 K82	P75-E79 HydrophobicContact CB-CB 4.5Å; P76-E79 PolarHBondContact O-N 2.87Å; E79-K82 WeakPolarHBondContact OE2-CE 3.29Å; E79-K82 IonicContact OE2-NZ 2.67Å; E79-K82 PolarHBondContact OE2-NZ 3.06Å
80	P	73.8	Confident	81.4	Confident	0 Å²	0	71.4 Å²	71.4	0%	0	40%	0.396	C	S	.	.	P	Polyproline II helix	trans	-68.4	157.9	172.3	30.9	-35.1	0	0	0	111.6	K82 M329 Y366 D532 M534	P80-K82 PolarHBondContact O-N 3.23Å; P80-M329 HydrophobicContact CB-SD 4.48Å; P80-Y366 HydrophobicContact CG-CD1 4.14Å; P80-Y366 HydrophobicContact CG-CE1 3.74Å; P80-Y366 HydrophobicContact CG-CE2 4.14Å; P80-D532 HydrophobicContact CB-CB 3.77Å; P80-D532 HydrophobicContact CG-CB 3.54Å; P80-M534 VanDerWaalsContact CA-SD 3.56Å; P80-M534 HydrophobicContact CB-CG 4.05Å; P80-M534 HydrophobicContact CB-SD 4.28Å
81	V	76	Confident	82.1	Confident	42 Å²	42	67.5 Å²	67.5	26%	0.255	38%	0.377	S	S	.	.	B	Isolated β-bridge	trans	-68.7	116.3	171.4	178.5	0	0	0	0	108.5	P75 T533 M534	P75-V81 HydrophobicContact CG-CG2 4.39Å; V81-T533 CarbonylContact C-O 3.58Å; V81-T533 WeakPolarHBondContact CA-O 3.29Å; V81-T533 WeakPolarHBondContact CB-O 3.25Å; V81-T533 PolarHBondContact N-O 2.92Å; V81-T533 PolarHBondContact O-N 2.84Å; V81-M534 HydrophobicContact CB-SD 4.42Å; V81-M534 HydrophobicContact CG2-SD 3.91Å; V81-M534 PolarHBondContact N-SD 2.93Å; V81-M534 VanDerWaalsContact N-SD 3.39Å
82	K	79.6	Confident	82.8	Confident	124 Å²	124	67.3 Å²	67.3	54%	0.539	37%	0.37	S	S	.	.	P	Polyproline II helix	trans	-71.3	133.3	-179.6	-70	154	-168.3	162.4	0	109.8	E79 P80 D532	E79-K82 WeakPolarHBondContact OE2-CE 3.29Å; E79-K82 IonicContact OE2-NZ 2.67Å; E79-K82 PolarHBondContact OE2-NZ 3.06Å; P80-K82 PolarHBondContact O-N 3.23Å; K82-D532 WeakPolarHBondContact CG-OD1 3.4Å
83	T	83.4	Confident	83.4	Confident	70 Å²	70	69.6 Å²	69.6	43%	0.429	39%	0.388	S	S	.	.	P	Polyproline II helix	trans	-65.6	144.7	172.4	53	0	0	0	0	110.8	R85 A531 T533	T83-R85 PolarHBondContact O-N 3.33Å; T83-A531 WeakPolarHBondContact CG2-O 3.47Å; T83-A531 PolarHBondContact OG1-O 2.89Å; T83-T533 HydrophobicContact CG2-CG2 4Å
84	L	86.6	Confident	84.4	Confident	61 Å²	61	66.1 Å²	66.1	32%	0.319	36%	0.357	S	S	.	.	P	Polyproline II helix	trans	-63.2	125.4	172	-167.2	72.7	0	0	0	110.1	Y72 S86 Q240 V242 Y247	Y72-L84 HydrophobicContact CE2-CD1 4.01Å; L84-S86 VanDerWaalsContact C-N 3.27Å; L84-S86 PolarHBondContact O-N 2.84Å; L84-Q240 HydrophobicContact CD2-CG 4.11Å; L84-V242 HydrophobicContact CD1-CB 3.92Å; L84-V242 HydrophobicContact CD1-CG1 3.82Å; L84-V242 HydrophobicContact CD1-CG2 4.24Å; L84-V242 HydrophobicContact CD2-CB 4.37Å; L84-V242 HydrophobicContact CD2-CG2 4.03Å; L84-V242 HydrophobicContact CG-CB 4.23Å; L84-V242 HydrophobicContact CG-CG1 4.37Å; L84-V242 HydrophobicContact CG-CG2 3.99Å; L84-Y247 HydrophobicContact CD1-CE1 4.42Å; L84-Y247 HydrophobicContact CD1-CE2 3.83Å; L84-Y247 HydrophobicContact CD2-CD1 4.21Å; L84-Y247 HydrophobicContact CD2-CD2 3.54Å; L84-Y247 HydrophobicContact CD2-CE1 4.35Å; L84-Y247 HydrophobicContact CD2-CE2 3.73Å; L84-Y247 HydrophobicContact CD2-CG 3.82Å; L84-Y247 HydrophobicContact CG-CE2 4.45Å
85	R	88.3	Confident	85.7	Confident	127 Å²	127	63 Å²	63	48%	0.479	33%	0.33	S	S	.	.			trans	-75.5	75.5	-179.9	-172	176.3	174.3	-159.9	-14.1	110.8	T83 L87 E211 H212	T83-R85 PolarHBondContact O-N 3.33Å; R85-L87 HydrophobicContact CG-CD2 4.05Å; R85-L87 HydrophobicContact CG-CG 4.39Å; R85-L87 PolarHBondContact O-N 2.84Å; R85-E211 IonicContact CZ-OE1 2.65Å; R85-E211 IonicContact NH1-OE1 2.66Å; R85-E211 PolarHBondContact NH1-OE1 2.94Å; R85-H212 VanDerWaalsContact CZ-CE1 3.49Å; R85-H212 PolarHBondContact NH1-CE1 2.88Å; R85-H212 PolarHBondContact NH1-NE2 2.93Å; R85-H212 VanDerWaalsContact NH1-NE2 3.13Å; R85-H212 PolarHBondContact NH2-NE2 2.59Å
86	S	92	Very high	87.1	Confident	55 Å²	55	66.8 Å²	66.8	39%	0.385	34%	0.338	S	S	.	.			trans	-65.2	120	166	175.4	0	0	0	0	109.3	L84 I88 Q240	L84-S86 VanDerWaalsContact C-N 3.27Å; L84-S86 PolarHBondContact O-N 2.84Å; S86-I88 PolarHBondContact OG-O 3.35Å; S86-Q240 PolarHBondContact OG-OE1 2.81Å
87	L	95.6	Very high	88.2	Confident	9 Å²	9	64.6 Å²	64.6	5%	0.047	32%	0.322	C	S	.	.			trans	-96.9	-11.2	177.5	-65.9	170.4	0	0	0	113	R85 A127 D128 T129 V206 H212	R85-L87 HydrophobicContact CG-CD2 4.05Å; R85-L87 HydrophobicContact CG-CG 4.39Å; R85-L87 PolarHBondContact O-N 2.84Å; L87-A127 WeakPolarHBondContact O-CA 3.35Å; L87-D128 HydrophobicContact CD2-CB 4.46Å; L87-D128 PolarHBondContact O-N 2.96Å; L87-T129 HydrophobicContact CB-CG2 3.96Å; L87-T129 HydrophobicContact CD1-CG2 4.47Å; L87-V206 HydrophobicContact CB-CG2 4.25Å; L87-V206 HydrophobicContact CD1-CG2 4.08Å; L87-H212 HydrophobicContact CD1-CB 3.63Å; L87-H212 VanDerWaalsContact CD1-CD2 3.4Å; L87-H212 WeakPolarHBondContact CD1-CD2 3.22Å
88	I	97.3	Very high	89.5	Confident	2 Å²	2	60.8 Å²	60.8	1%	0.01	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	127.9	-174.9	-55.1	162.6	0	0	0	107.9	S86 D126 V131 A204 V206 H217 Q240	S86-I88 PolarHBondContact OG-O 3.35Å; I88-D126 CarbonylContact C-O 3.54Å; I88-D126 WeakPolarHBondContact CA-O 3.23Å; I88-V131 HydrophobicContact CD1-CB 4.29Å; I88-V131 HydrophobicContact CD1-CG2 3.56Å; I88-V131 HydrophobicContact CG1-CB 4.48Å; I88-V131 HydrophobicContact CG1-CG2 4.04Å; I88-V131 HydrophobicContact CG2-CG2 4.35Å; I88-A204 HydrophobicContact CD1-CB 4.5Å; I88-A204 WeakPolarHBondContact CD1-O 3.22Å; I88-A204 HydrophobicContact CG2-CB 3.82Å; I88-V206 HydrophobicContact CD1-CG2 3.73Å; I88-V206 HydrophobicContact CG1-CG2 4.32Å; I88-H217 HydrophobicContact CB-CB 3.99Å; I88-H217 HydrophobicContact CG2-CB 3.84Å; I88-H217 WeakPolarHBondContact O-CB 3.45Å; I88-H217 PolarHBondContact O-ND1 3.23Å; I88-Q240 PolarHBondContact O-OE1 2.89Å
89	N	96.4	Very high	90.4	Very high	67 Å²	67	59 Å²	59	36%	0.358	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	111.3	179	174.4	54.4	0	0	0	110.4	F125 D126	N89-F125 CarbonylContact O-C 3.57Å; N89-F125 VanDerWaalsContact O-CA 3.23Å; N89-F125 WeakPolarHBondContact O-CA 3.36Å; N89-F125 WeakPolarHBondContact O-CB 3.36Å; N89-D126 HydrophobicContact CB-CB 4.34Å; N89-D126 PolarHBondContact N-O 2.93Å; N89-D126 PolarHBondContact ND2-OD2 2.85Å; N89-D126 PolarHBondContact O-N 2.96Å
90	I	98.2	Very high	91.1	Very high	1 Å²	1	57.5 Å²	57.5	1%	0.005	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	124.1	173.5	-55.4	178.2	0	0	0	108.9	K92 F123 F125 V202 A204 H217 L219 Q238	I90-K92 PolarHBondContact O-N 3.29Å; I90-K92 VanDerWaalsContact O-N 3.08Å; I90-F123 HydrophobicContact CG2-CD2 3.76Å; I90-F123 HydrophobicContact CG2-CE2 4.13Å; I90-F123 HydrophobicContact CG2-CG 4.34Å; I90-F125 HydrophobicContact CG1-CB 4.46Å; I90-V202 HydrophobicContact CD1-CB 4.43Å; I90-V202 HydrophobicContact CD1-CG1 3.87Å; I90-A204 HydrophobicContact CD1-CB 4.13Å; I90-H217 HydrophobicContact CD1-CB 4.45Å; I90-H217 HydrophobicContact CG1-CB 4.35Å; I90-L219 HydrophobicContact CD1-CB 4.21Å; I90-L219 HydrophobicContact CG2-CB 4.35Å; I90-L219 HydrophobicContact CG2-CD2 3.63Å; I90-Q238 PolarHBondContact O-NE2 3.27Å
91	R	95.8	Very high	91.2	Very high	52 Å²	52	61.6 Å²	61.6	20%	0.196	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	85.9	179.9	-57.3	-170.9	-171.5	178	4.9	109.9	D93 T94 T124 D126 C169	R91-D93 VanDerWaalsContact C-OD1 3.23Å; R91-D93 WeakPolarHBondContact CB-OD1 3.18Å; R91-D93 PolarHBondContact O-N 3.16Å; R91-D93 VanDerWaalsContact O-N 3.08Å; R91-T94 HydrophobicContact CB-CG2 3.86Å; R91-T94 WeakPolarHBondContact O-CB 3.29Å; R91-T94 PolarHBondContact O-N 2.83Å; R91-T94 PolarHBondContact O-OG1 3.19Å; R91-T124 WeakPolarHBondContact CB-O 3.23Å; R91-T124 PolarHBondContact N-O 3.47Å; R91-D126 IonicContact CZ-OD1 2.84Å; R91-D126 IonicContact CZ-OD2 3.14Å; R91-D126 IonicContact NE-OD1 3.93Å; R91-D126 IonicContact NE-OD2 2.71Å; R91-D126 PolarHBondContact NE-OD2 2.84Å; R91-D126 VanDerWaalsContact NH2-CG 3.25Å; R91-D126 IonicContact NH2-OD1 2.95Å; R91-D126 PolarHBondContact NH2-OD1 2.89Å; R91-D126 IonicContact NH2-OD2 2.69Å; R91-D126 PolarHBondContact NH2-OD2 3.2Å; R91-C169 PolarHBondContact NH2-SG 3.27Å
92	K	95.1	Very high	90.4	Very high	58 Å²	58	64.6 Å²	64.6	25%	0.252	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.1	-27.3	-171.6	62.2	157.3	173.5	172.5	0	114.9	I90 T94 L95 L219 P235 Q238 E251	I90-K92 PolarHBondContact O-N 3.29Å; I90-K92 VanDerWaalsContact O-N 3.08Å; K92-T94 PolarHBondContact O-N 2.83Å; K92-L95 VanDerWaalsContact O-CB 3.29Å; K92-L95 WeakPolarHBondContact O-CB 3.38Å; K92-L95 PolarHBondContact O-N 3.01Å; K92-L219 HydrophobicContact CB-CD1 3.93Å; K92-L219 HydrophobicContact CB-CD2 3.92Å; K92-P235 HydrophobicContact CB-CB 3.98Å; K92-P235 HydrophobicContact CB-CG 3.87Å; K92-P235 HydrophobicContact CD-CB 3.89Å; K92-P235 HydrophobicContact CD-CG 4.39Å; K92-P235 HydrophobicContact CG-CB 4.48Å; K92-P235 VanDerWaalsContact O-CG 3.22Å; K92-P235 WeakPolarHBondContact O-CG 3.47Å; K92-Q238 HydrophobicContact CB-CG 4.49Å; K92-E251 WeakPolarHBondContact CE-OE1 3.14Å; K92-E251 IonicContact NZ-OE1 3.48Å; K92-E251 PolarHBondContact NZ-OE1 3.49Å
93	D	94.1	Very high	89	Confident	132 Å²	132	65.4 Å²	65.4	71%	0.706	33%	0.33	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64.9	-25.3	175	57.3	-66.8	0	0	0	113	R91	R91-D93 VanDerWaalsContact C-OD1 3.23Å; R91-D93 WeakPolarHBondContact CB-OD1 3.18Å; R91-D93 PolarHBondContact O-N 3.16Å; R91-D93 VanDerWaalsContact O-N 3.08Å
94	T	97.3	Very high	87.6	Confident	19 Å²	19	70 Å²	70	12%	0.117	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	-10.2	179.2	69.5	0	0	0	0	113.7	R91 K92 R96 T124	R91-T94 HydrophobicContact CB-CG2 3.86Å; R91-T94 WeakPolarHBondContact O-CB 3.29Å; R91-T94 PolarHBondContact O-N 2.83Å; R91-T94 PolarHBondContact O-OG1 3.19Å; K92-T94 PolarHBondContact O-N 2.83Å; T94-R96 PolarHBondContact O-N 3.38Å; T94-R96 PolarHBondContact O-NE 2.63Å; T94-R96 PolarHBondContact O-NH2 2.81Å; T94-T124 PolarHBondContact OG1-N 2.68Å
95	L	98.2	Very high	85.5	Confident	14 Å²	14	73.8 Å²	73.8	7%	0.073	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.2	122.7	-178.1	-177	70.1	0	0	0	110.7	K92 V121 E122 F123 M200 L219 A221 V233 P235	K92-L95 VanDerWaalsContact O-CB 3.29Å; K92-L95 WeakPolarHBondContact O-CB 3.38Å; K92-L95 PolarHBondContact O-N 3.01Å; L95-V121 HydrophobicContact CD1-CG1 3.75Å; L95-E122 CarbonylContact C-O 3.57Å; L95-E122 WeakPolarHBondContact CA-O 3.41Å; L95-F123 HydrophobicContact CB-CB 4.38Å; L95-F123 HydrophobicContact CD1-CB 3.98Å; L95-F123 HydrophobicContact CD1-CD1 3.8Å; L95-F123 HydrophobicContact CD1-CG 4.26Å; L95-M200 HydrophobicContact CD1-CE 4.2Å; L95-M200 HydrophobicContact CD2-CE 4.01Å; L95-L219 HydrophobicContact CB-CD2 4.42Å; L95-L219 HydrophobicContact CD2-CD2 3.89Å; L95-L219 HydrophobicContact CD2-CG 4.37Å; L95-A221 HydrophobicContact CD2-CB 4.13Å; L95-V233 HydrophobicContact CD2-CG1 4.17Å; L95-V233 HydrophobicContact CD2-CG2 3.75Å; L95-V233 HydrophobicContact CG-CG1 3.88Å; L95-V233 HydrophobicContact CG-CG2 4.32Å; L95-P235 HydrophobicContact CD2-CG 4.25Å
96	R	97	Very high	83.5	Confident	125 Å²	125	75 Å²	75	47%	0.472	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	158.1	-178.4	72.4	-164	72.9	-174.7	4.2	112	T94 V98 E122	T94-R96 PolarHBondContact O-N 3.38Å; T94-R96 PolarHBondContact O-NE 2.63Å; T94-R96 PolarHBondContact O-NH2 2.81Å; R96-V98 HydrophobicContact CG-CG2 3.97Å; R96-E122 HydrophobicContact CG-CB 3.97Å; R96-E122 PolarHBondContact N-O 3.41Å; R96-E122 PolarHBondContact O-N 2.82Å
97	L	96.4	Very high	81.1	Confident	26 Å²	26	79 Å²	79	14%	0.136	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	132.3	161.2	-64.6	-176.6	0	0	0	109.3	Y119 N120 V121 L181 F223 V233	L97-Y119 HydrophobicContact CB-CD1 3.66Å; L97-Y119 HydrophobicContact CB-CE1 4.38Å; L97-Y119 HydrophobicContact CB-CG 4.1Å; L97-Y119 HydrophobicContact CD1-CD1 4.27Å; L97-Y119 HydrophobicContact CD1-CD2 4.48Å; L97-Y119 HydrophobicContact CD1-CG 4.14Å; L97-N120 WeakPolarHBondContact CA-O 3.23Å; L97-V121 HydrophobicContact CD2-CG2 3.97Å; L97-L181 HydrophobicContact CD1-CD1 3.65Å; L97-F223 HydrophobicContact CD1-CD1 4.03Å; L97-F223 HydrophobicContact CD1-CE1 4.21Å; L97-F223 HydrophobicContact CD2-CE1 4.11Å; L97-V233 HydrophobicContact CD1-CB 4.39Å; L97-V233 HydrophobicContact CD2-CB 4.26Å; L97-V233 HydrophobicContact CD2-CG1 4.31Å; L97-V233 HydrophobicContact CG-CB 3.92Å; L97-V233 HydrophobicContact CG-CG1 3.92Å
98	V	94.1	Very high	79	Confident	53 Å²	53	81.9 Å²	81.9	32%	0.321	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	114.5	171.8	-178.9	0	0	0	0	107.8	R96 C100 Y119 N120 E122	R96-V98 HydrophobicContact CG-CG2 3.97Å; V98-C100 PolarHBondContact O-N 2.88Å; V98-Y119 WeakPolarHBondContact O-CA 3.48Å; V98-N120 PolarHBondContact N-O 3.33Å; V98-N120 PolarHBondContact O-N 3.32Å; V98-E122 HydrophobicContact CG2-CB 4.34Å; V98-E122 HydrophobicContact CG2-CG 3.86Å
99	R	91.3	Very high	76.8	Confident	124 Å²	124	86.6 Å²	86.6	47%	0.468	46%	0.462	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	126.1	-179.4	-174.8	172.3	172.4	165	-3	110.2	Y119	R99-Y119 HydrophobicContact CB-CD1 3.86Å; R99-Y119 HydrophobicContact CB-CE1 3.65Å; R99-Y119 HydrophobicContact CG-CD1 4.44Å; R99-Y119 HydrophobicContact CG-CE1 4.07Å
100	C	87.3	Confident	74.7	Confident	46 Å²	46	92.5 Å²	92.5	31%	0.311	49%	0.488	S	S	.	.	P	Polyproline II helix	trans	-71.4	141.3	176	-59.2	0	0	0	0	110.6	V98 C118 T178	V98-C100 PolarHBondContact O-N 2.88Å; C100-C118 HydrophobicContact CB-CB 4.36Å; C100-C118 PolarHBondContact N-O 2.78Å; C100-T178 VanDerWaalsContact SG-CG2 3.55Å
101	S	74.4	Confident	72.4	Confident	87 Å²	87	96.8 Å²	96.8	61%	0.608	52%	0.524	S	S	*	.	P	Polyproline II helix	trans	-73.4	137	174.9	50.6	0	0	0	0	111.3	D103	S101-D103 PolarHBondContact O-N 3.23Å; S101-D103 VanDerWaalsContact O-N 3.12Å
102	E	61.2	Low	70	Confident	104 Å²	104	96.8 Å²	96.8	49%	0.486	53%	0.534	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.9	3.1	-172.8	-149.6	175.2	140.1	0	0	113.9	L104 K105	E102-L104 PolarHBondContact O-N 3.13Å; E102-K105 WeakPolarHBondContact O-CG 3.39Å
103	D	50	Low	67.7	Low	142 Å²	142	98.1 Å²	98.1	76%	0.759	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.5	-6.8	-168.8	-62.6	-62.4	0	0	0	115.1	S101 K105	S101-D103 PolarHBondContact O-N 3.23Å; S101-D103 VanDerWaalsContact O-N 3.12Å; D103-K105 PolarHBondContact O-N 3.25Å
104	L	52.8	Low	65.7	Low	166 Å²	166	100.2 Å²	100.2	87%	0.869	57%	0.568	S	S	*	*			trans	-78.1	48.3	170.1	-68.5	-178.9	0	0	0	112	E102 L106	E102-L104 PolarHBondContact O-N 3.13Å; L104-L106 PolarHBondContact O-N 3.41Å
105	K	42.2	Very low	63.7	Low	140 Å²	140	105 Å²	105	61%	0.609	59%	0.592	S	S	*	*			trans	-70.8	97.1	176.3	-62.7	-163.2	175.7	-166.2	0	110.5	E102 D103	E102-K105 WeakPolarHBondContact O-CG 3.39Å; D103-K105 PolarHBondContact O-N 3.25Å
106	L	46.2	Very low	62.1	Low	152 Å²	152	110.3 Å²	110.3	80%	0.796	61%	0.611	S	S	*	*			trans	-57.8	130.4	159.4	-68.8	175.4	0	0	0	108.4	L104 G108	L104-L106 PolarHBondContact O-N 3.41Å; L106-G108 PolarHBondContact O-N 3.41Å
107	P	41.5	Very low	61.2	Low	139 Å²	139	104.6 Å²	104.6	90%	0.903	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.8	93.3	-173.3	28	-34.7	0	0	0	111
108	G	53.1	Low	60.9	Low	70 Å²	70	104.9 Å²	104.9	72%	0.722	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	179.4	-33	178.3	0	0	0	0	0	116.2	L106 E110	L106-G108 PolarHBondContact O-N 3.41Å; G108-E110 PolarHBondContact O-N 3.32Å; G108-E110 VanDerWaalsContact O-N 3.13Å
109	D	49.7	Very low	60.9	Low	102 Å²	102	102.7 Å²	102.7	55%	0.545	58%	0.581	S	S	.	*			trans	-90.6	66.2	-175.4	-163.6	-1.7	0	0	0	113.4	A111 A112	D109-A111 PolarHBondContact O-N 2.56Å; D109-A111 PolarHBondContact OD1-N 3.28Å; D109-A112 WeakPolarHBondContact OD1-CB 3.42Å; D109-A112 PolarHBondContact OD1-N 3.34Å; D109-A112 VanDerWaalsContact OD1-N 3.1Å
110	E	52.9	Low	61.1	Low	190 Å²	190	97.2 Å²	97.2	89%	0.888	56%	0.561	S	S	*	*			trans	-84.8	20.2	170.8	-71.3	-83.2	110.1	0	0	112	G108	G108-E110 PolarHBondContact O-N 3.32Å; G108-E110 VanDerWaalsContact O-N 3.13Å
111	A	49.2	Very low	61.5	Low	92 Å²	92	95.1 Å²	95.1	76%	0.76	55%	0.546	S	S	*	.	S	Bend	trans	-118.5	-31.4	-171.7	0	0	0	0	0	114.1	D109 G113	D109-A111 PolarHBondContact O-N 2.56Å; D109-A111 PolarHBondContact OD1-N 3.28Å; A111-G113 PolarHBondContact O-N 2.83Å; A111-G113 VanDerWaalsContact O-N 3.09Å
112	A	46.4	Very low	62.6	Low	51 Å²	51	92.3 Å²	92.3	42%	0.421	52%	0.524	S	S	.	.			trans	-85.3	70	-176.7	0	0	0	0	0	113.5	D109 K114	D109-A112 WeakPolarHBondContact OD1-CB 3.42Å; D109-A112 PolarHBondContact OD1-N 3.34Å; D109-A112 VanDerWaalsContact OD1-N 3.1Å; A112-K114 PolarHBondContact O-N 2.68Å
113	G	45.8	Very low	64.4	Low	86 Å²	86	87.4 Å²	87.4	89%	0.887	50%	0.501	S	S	*	.			trans	-68.9	40.2	176.8	0	0	0	0	0	116.2	A111	A111-G113 PolarHBondContact O-N 2.83Å; A111-G113 VanDerWaalsContact O-N 3.09Å
114	K	52.9	Low	66.7	Low	177 Å²	177	82 Å²	82	77%	0.77	47%	0.473	S	S	*	.	S	Bend	trans	-119	132.3	171.4	-71.8	-176.3	175.8	-175.6	0	108.6	A112 R116	A112-K114 PolarHBondContact O-N 2.68Å; K114-R116 PolarHBondContact O-N 2.67Å
115	N	54.8	Low	68.9	Low	119 Å²	119	74.1 Å²	74.1	64%	0.636	43%	0.432	S	S	*	.			trans	-60.4	93.8	174.8	-63.3	-1.1	0	0	0	110.6	A117	N115-A117 VanDerWaalsContact C-N 3.29Å; N115-A117 PolarHBondContact O-N 3.09Å
116	R	65.1	Low	71.5	Confident	125 Å²	125	68.7 Å²	68.7	47%	0.472	41%	0.41	S	S	.	.			trans	-73.4	86.2	173	-80.6	-174.5	144.8	178.3	-13.7	109.2	K114 C118 E183	K114-R116 PolarHBondContact O-N 2.67Å; R116-C118 PolarHBondContact O-N 2.86Å; R116-E183 IonicContact CZ-OE1 3.2Å; R116-E183 IonicContact NE-OE1 2.81Å; R116-E183 PolarHBondContact NE-OE1 3.32Å; R116-E183 IonicContact NH2-OE1 2.73Å; R116-E183 PolarHBondContact NH2-OE1 3.31Å; R116-E183 IonicContact NH2-OE2 3.47Å; R116-E183 PolarHBondContact NH2-OE2 2.79Å
117	A	78.4	Confident	74	Confident	5 Å²	5	61.6 Å²	61.6	4%	0.041	37%	0.372	C	S	.	.			trans	-73.6	77.9	174.4	0	0	0	0	0	109.5	N115 Y119	N115-A117 VanDerWaalsContact C-N 3.29Å; N115-A117 PolarHBondContact O-N 3.09Å; A117-Y119 HydrophobicContact CB-CE2 3.74Å; A117-Y119 WeakPolarHBondContact O-CD2 3.37Å; A117-Y119 WeakPolarHBondContact O-CE2 3.43Å
118	C	90.2	Very high	76.5	Confident	32 Å²	32	58.9 Å²	58.9	22%	0.216	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	138.9	170	-62.4	0	0	0	0	110.1	C100 R116 V179	C100-C118 HydrophobicContact CB-CB 4.36Å; C100-C118 PolarHBondContact N-O 2.78Å; R116-C118 PolarHBondContact O-N 2.86Å; C118-V179 CarbonylContact C-O 3.55Å; C118-V179 WeakPolarHBondContact CA-O 3.35Å
119	Y	93.7	Very high	78.6	Confident	7 Å²	7	56.1 Å²	56.1	3%	0.027	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	138.1	179.4	-63.5	-90.3	0	0	0	111.2	L97 V98 R99 A117 T178 V179 L181 Y231	L97-Y119 HydrophobicContact CB-CD1 3.66Å; L97-Y119 HydrophobicContact CB-CE1 4.38Å; L97-Y119 HydrophobicContact CB-CG 4.1Å; L97-Y119 HydrophobicContact CD1-CD1 4.27Å; L97-Y119 HydrophobicContact CD1-CD2 4.48Å; L97-Y119 HydrophobicContact CD1-CG 4.14Å; V98-Y119 WeakPolarHBondContact O-CA 3.48Å; R99-Y119 HydrophobicContact CB-CD1 3.86Å; R99-Y119 HydrophobicContact CB-CE1 3.65Å; R99-Y119 HydrophobicContact CG-CD1 4.44Å; R99-Y119 HydrophobicContact CG-CE1 4.07Å; A117-Y119 HydrophobicContact CB-CE2 3.74Å; A117-Y119 WeakPolarHBondContact O-CD2 3.37Å; A117-Y119 WeakPolarHBondContact O-CE2 3.43Å; Y119-T178 CarbonylContact O-C 3.58Å; Y119-T178 VanDerWaalsContact O-CA 3.29Å; Y119-T178 WeakPolarHBondContact O-CA 3.49Å; Y119-V179 PolarHBondContact N-O 2.8Å; Y119-V179 PolarHBondContact O-N 2.79Å; Y119-L181 HydrophobicContact CD2-CD1 4.33Å; Y119-Y231 AromaticContact CE2-CD2 3.91Å; Y119-Y231 HydrophobicContact CE2-CD2 3.91Å; Y119-Y231 HydrophobicContact CE2-CG 4.22Å; Y119-Y231 PolarHBondContact OH-N 2.82Å; Y119-Y231 VanDerWaalsContact OH-N 3.12Å
120	N	94.8	Very high	80.8	Confident	9 Å²	9	54.3 Å²	54.3	5%	0.048	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	152.8	160.4	172.2	46.9	0	0	0	109.2	L97 V98 E122 C173 L174	L97-N120 WeakPolarHBondContact CA-O 3.23Å; V98-N120 PolarHBondContact N-O 3.33Å; V98-N120 PolarHBondContact O-N 3.32Å; N120-E122 VanDerWaalsContact ND2-CG 3.35Å; N120-E122 WeakPolarHBondContact ND2-CG 3.49Å; N120-E122 PolarHBondContact ND2-OE1 2.83Å; N120-C173 PolarHBondContact ND2-SG 2.67Å; N120-L174 PolarHBondContact OD1-N 2.81Å; N120-L174 VanDerWaalsContact OD1-N 3.16Å; N120-L174 PolarHBondContact OD1-O 3.23Å
121	V	97.1	Very high	83	Confident	2 Å²	2	45.3 Å²	45.3	1%	0.012	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	131	175	-178.5	0	0	0	0	109.1	L95 L97 F123 I135 Y137 M200	L95-V121 HydrophobicContact CD1-CG1 3.75Å; L97-V121 HydrophobicContact CD2-CG2 3.97Å; V121-F123 HydrophobicContact CG1-CD1 4.25Å; V121-I135 HydrophobicContact CB-CD1 3.74Å; V121-I135 HydrophobicContact CG1-CD1 3.85Å; V121-I135 HydrophobicContact CG2-CD1 4.22Å; V121-Y137 WeakPolarHBondContact CG2-OH 3.44Å; V121-M200 HydrophobicContact CG1-CE 4.25Å; V121-M200 HydrophobicContact CG1-SD 4.28Å; V121-M200 HydrophobicContact CG2-SD 3.83Å
122	E	97.8	Very high	85.3	Confident	28 Å²	28	41.2 Å²	41.2	13%	0.131	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	143.4	174.8	-61	-170.4	-170	0	0	112.2	L95 R96 V98 N120 Q171 F172 C173	L95-E122 CarbonylContact C-O 3.57Å; L95-E122 WeakPolarHBondContact CA-O 3.41Å; R96-E122 HydrophobicContact CG-CB 3.97Å; R96-E122 PolarHBondContact N-O 3.41Å; R96-E122 PolarHBondContact O-N 2.82Å; V98-E122 HydrophobicContact CG2-CB 4.34Å; V98-E122 HydrophobicContact CG2-CG 3.86Å; N120-E122 VanDerWaalsContact ND2-CG 3.35Å; N120-E122 WeakPolarHBondContact ND2-CG 3.49Å; N120-E122 PolarHBondContact ND2-OE1 2.83Å; E122-Q171 PolarHBondContact OE2-NE2 3.22Å; E122-F172 VanDerWaalsContact CA-O 3.31Å; E122-F172 WeakPolarHBondContact CA-O 3.43Å; E122-C173 HydrophobicContact CG-CB 3.9Å; E122-C173 PolarHBondContact OE1-SG 3.2Å
123	F	98.5	Very high	87.8	Confident	2 Å²	2	38.8 Å²	38.8	1%	0.009	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.6	162.1	173	55.9	-90.7	0	0	0	110.7	I90 L95 V121 F125 I133 I135 F172 V202	I90-F123 HydrophobicContact CG2-CD2 3.76Å; I90-F123 HydrophobicContact CG2-CE2 4.13Å; I90-F123 HydrophobicContact CG2-CG 4.34Å; L95-F123 HydrophobicContact CB-CB 4.38Å; L95-F123 HydrophobicContact CD1-CB 3.98Å; L95-F123 HydrophobicContact CD1-CD1 3.8Å; L95-F123 HydrophobicContact CD1-CG 4.26Å; V121-F123 HydrophobicContact CG1-CD1 4.25Å; F123-F125 HydrophobicContact CD2-CB 4.39Å; F123-F125 HydrophobicContact CD2-CD1 4.21Å; F123-F125 HydrophobicContact CE2-CB 4.36Å; F123-F125 AromaticContact CE2-CD1 3.87Å; F123-F125 HydrophobicContact CE2-CD1 3.87Å; F123-F125 HydrophobicContact CE2-CG 4.44Å; F123-I133 HydrophobicContact CZ-CG2 4.06Å; F123-I135 HydrophobicContact CE1-CD1 4.38Å; F123-F172 HydrophobicContact CD1-CB 4.05Å; F123-F172 HydrophobicContact CD1-CD1 4.22Å; F123-F172 HydrophobicContact CD1-CG 4.33Å; F123-F172 HydrophobicContact CD2-CB 3.93Å; F123-F172 HydrophobicContact CE1-CB 3.65Å; F123-F172 AromaticContact CE1-CD1 3.55Å; F123-F172 HydrophobicContact CE1-CD1 3.55Å; F123-F172 HydrophobicContact CE1-CD2 4.28Å; F123-F172 HydrophobicContact CE1-CE1 4.29Å; F123-F172 AromaticContact CE1-CG 3.56Å; F123-F172 HydrophobicContact CE1-CG 3.56Å; F123-F172 HydrophobicContact CE2-CB 3.53Å; F123-F172 HydrophobicContact CE2-CG 4.11Å; F123-F172 HydrophobicContact CG-CB 4.18Å; F123-F172 HydrophobicContact CZ-CB 3.37Å; F123-F172 AromaticContact CZ-CD1 3.93Å; F123-F172 HydrophobicContact CZ-CD1 3.93Å; F123-F172 AromaticContact CZ-CD2 3.82Å; F123-F172 HydrophobicContact CZ-CD2 3.82Å; F123-F172 AromaticContact CZ-CG 3.42Å; F123-F172 HydrophobicContact CZ-CG 3.42Å; F123-F172 VanDerWaalsContact CZ-CG 3.42Å; F123-F172 PolarHBondContact N-O 2.81Å; F123-F172 PolarHBondContact O-N 3.48Å; F123-V202 HydrophobicContact CE1-CG1 3.7Å; F123-V202 HydrophobicContact CE1-CG2 4.08Å; F123-V202 HydrophobicContact CE2-CG1 4.21Å; F123-V202 HydrophobicContact CZ-CG1 3.42Å; F123-V202 VanDerWaalsContact CZ-CG1 3.42Å
124	T	98.5	Very high	90.3	Very high	28 Å²	28	35.2 Å²	35.2	17%	0.172	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	142.3	170.3	-52.6	0	0	0	0	109.9	R91 T94 Q170	R91-T124 WeakPolarHBondContact CB-O 3.23Å; R91-T124 PolarHBondContact N-O 3.47Å; T94-T124 PolarHBondContact OG1-N 2.68Å; T124-Q170 CarbonylContact C-O 3.56Å; T124-Q170 VanDerWaalsContact CA-O 3.27Å; T124-Q170 WeakPolarHBondContact CA-O 3.36Å
125	F	98.4	Very high	92.5	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	162.5	172.5	68.6	-84.2	0	0	0	111.6	N89 I90 F123 A127 V131 I133 F164 Q170 F172	N89-F125 CarbonylContact O-C 3.57Å; N89-F125 VanDerWaalsContact O-CA 3.23Å; N89-F125 WeakPolarHBondContact O-CA 3.36Å; N89-F125 WeakPolarHBondContact O-CB 3.36Å; I90-F125 HydrophobicContact CG1-CB 4.46Å; F123-F125 HydrophobicContact CD2-CB 4.39Å; F123-F125 HydrophobicContact CD2-CD1 4.21Å; F123-F125 HydrophobicContact CE2-CB 4.36Å; F123-F125 AromaticContact CE2-CD1 3.87Å; F123-F125 HydrophobicContact CE2-CD1 3.87Å; F123-F125 HydrophobicContact CE2-CG 4.44Å; F125-A127 HydrophobicContact CD2-CB 4.11Å; F125-A127 HydrophobicContact CE2-CB 4.01Å; F125-V131 HydrophobicContact CE2-CG1 3.94Å; F125-I133 HydrophobicContact CD1-CD1 4.07Å; F125-I133 HydrophobicContact CD2-CD1 4.27Å; F125-I133 HydrophobicContact CE1-CD1 3.77Å; F125-I133 HydrophobicContact CE2-CD1 3.98Å; F125-I133 HydrophobicContact CG-CD1 4.32Å; F125-I133 HydrophobicContact CZ-CD1 3.72Å; F125-F164 HydrophobicContact CE1-CD1 4.32Å; F125-F164 HydrophobicContact CE1-CD2 4.4Å; F125-F164 HydrophobicContact CE1-CE1 4.26Å; F125-F164 HydrophobicContact CE1-CE2 4.33Å; F125-F164 HydrophobicContact CE1-CG 4.4Å; F125-F164 HydrophobicContact CE1-CZ 4.27Å; F125-F164 HydrophobicContact CE2-CB 4.33Å; F125-F164 HydrophobicContact CE2-CG 4.43Å; F125-F164 HydrophobicContact CZ-CB 3.91Å; F125-F164 AromaticContact CZ-CD1 3.75Å; F125-F164 HydrophobicContact CZ-CD1 3.75Å; F125-F164 AromaticContact CZ-CD2 3.82Å; F125-F164 HydrophobicContact CZ-CD2 3.82Å; F125-F164 HydrophobicContact CZ-CE1 4.14Å; F125-F164 HydrophobicContact CZ-CE2 4.2Å; F125-F164 AromaticContact CZ-CG 3.57Å; F125-F164 HydrophobicContact CZ-CG 3.57Å; F125-F164 HydrophobicContact CZ-CZ 4.35Å; F125-Q170 HydrophobicContact CD1-CB 4.22Å; F125-Q170 WeakPolarHBondContact CD1-O 3.43Å; F125-Q170 HydrophobicContact CD2-CB 4.29Å; F125-Q170 HydrophobicContact CE1-CB 3.71Å; F125-Q170 HydrophobicContact CE2-CB 3.79Å; F125-Q170 HydrophobicContact CE2-CG 4.42Å; F125-Q170 HydrophobicContact CG-CB 4.48Å; F125-Q170 HydrophobicContact CZ-CB 3.46Å; F125-Q170 VanDerWaalsContact CZ-CB 3.46Å; F125-Q170 HydrophobicContact CZ-CG 4.36Å; F125-Q170 PolarHBondContact N-O 3.45Å; F125-Q170 PolarHBondContact O-N 3.21Å; F125-F172 HydrophobicContact CD1-CB 4.33Å; F125-F172 HydrophobicContact CE1-CB 4.19Å
126	D	97.4	Very high	94.5	Very high	27 Å²	27	22.7 Å²	22.7	14%	0.144	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	135.7	170.7	-54.3	-72.2	0	0	0	108.2	I88 N89 R91 V168 C169	I88-D126 CarbonylContact C-O 3.54Å; I88-D126 WeakPolarHBondContact CA-O 3.23Å; N89-D126 HydrophobicContact CB-CB 4.34Å; N89-D126 PolarHBondContact N-O 2.93Å; N89-D126 PolarHBondContact ND2-OD2 2.85Å; N89-D126 PolarHBondContact O-N 2.96Å; R91-D126 IonicContact CZ-OD1 2.84Å; R91-D126 IonicContact CZ-OD2 3.14Å; R91-D126 IonicContact NE-OD1 3.93Å; R91-D126 IonicContact NE-OD2 2.71Å; R91-D126 PolarHBondContact NE-OD2 2.84Å; R91-D126 VanDerWaalsContact NH2-CG 3.25Å; R91-D126 IonicContact NH2-OD1 2.95Å; R91-D126 PolarHBondContact NH2-OD1 2.89Å; R91-D126 IonicContact NH2-OD2 2.69Å; R91-D126 PolarHBondContact NH2-OD2 3.2Å; D126-V168 HydrophobicContact CB-CG1 4.41Å; D126-V168 WeakPolarHBondContact OD1-CA 3.4Å; D126-V168 WeakPolarHBondContact OD1-CB 3.47Å; D126-C169 PolarHBondContact OD1-N 3.21Å
127	A	97.2	Very high	96.1	Very high	2 Å²	2	16.9 Å²	16.9	2%	0.017	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	124.9	178.8	0	0	0	0	0	110.3	L87 F125 T129 V131 R166 G167	L87-A127 WeakPolarHBondContact O-CA 3.35Å; F125-A127 HydrophobicContact CD2-CB 4.11Å; F125-A127 HydrophobicContact CE2-CB 4.01Å; A127-T129 VanDerWaalsContact C-N 3.29Å; A127-V131 HydrophobicContact CB-CB 4.26Å; A127-V131 HydrophobicContact CB-CG1 3.67Å; A127-R166 CarbonylContact O-C 3.55Å; A127-R166 WeakPolarHBondContact O-CA 3.36Å; A127-G167 PolarHBondContact N-O 2.97Å; A127-G167 PolarHBondContact O-N 3.33Å
128	D	95.2	Very high	97	Very high	83 Å²	83	17.4 Å²	17.4	44%	0.444	9%	0.092	S	C	.	.	S	Bend	trans	-94.2	11.8	-176.4	-139.3	27.4	0	0	0	113.3	L87 R166	L87-D128 HydrophobicContact CD2-CB 4.46Å; L87-D128 PolarHBondContact O-N 2.96Å; D128-R166 WeakPolarHBondContact O-CD 3.48Å; D128-R166 PolarHBondContact O-NE 2.82Å; D128-R166 IonicContact OD1-CZ 3.33Å; D128-R166 IonicContact OD1-NE 2.73Å; D128-R166 PolarHBondContact OD1-NE 2.98Å; D128-R166 IonicContact OD1-NH2 2.8Å; D128-R166 PolarHBondContact OD1-NH2 3.2Å; D128-R166 IonicContact OD2-CZ 3Å; D128-R166 IonicContact OD2-NH2 3.65Å; D128-R166 PolarHBondContact OD2-NH2 2.93Å
129	T	96.2	Very high	97.3	Very high	11 Å²	11	15.9 Å²	15.9	7%	0.067	8%	0.082	C	C	.	.	S	Bend	trans	-158.9	166.3	-172.8	-172.8	0	0	0	0	108.8	L87 A127 R166 V206 E208	L87-T129 HydrophobicContact CB-CG2 3.96Å; L87-T129 HydrophobicContact CD1-CG2 4.47Å; A127-T129 VanDerWaalsContact C-N 3.29Å; T129-R166 PolarHBondContact O-N 3.29Å; T129-V206 HydrophobicContact CG2-CB 4.31Å; T129-V206 HydrophobicContact CG2-CG1 3.8Å; T129-V206 HydrophobicContact CG2-CG2 3.75Å; T129-E208 VanDerWaalsContact OG1-CB 3.22Å; T129-E208 WeakPolarHBondContact OG1-CB 3.46Å; T129-E208 PolarHBondContact OG1-OE2 3.37Å
130	Q	97.3	Very high	97.3	Very high	65 Å²	65	18.7 Å²	18.7	30%	0.304	10%	0.096	S	C	.	.			trans	-61.6	137.6	166.5	179.1	169.4	-49.1	0	0	110.2	F164 D207 E208	Q130-F164 WeakPolarHBondContact CA-O 3.45Å; Q130-F164 WeakPolarHBondContact CG-O 3.42Å; Q130-D207 HydrophobicContact CG-CB 4.25Å; Q130-D207 WeakPolarHBondContact CG-O 3.34Å; Q130-D207 PolarHBondContact NE2-O 2.97Å; Q130-D207 PolarHBondContact NE2-OD2 2.78Å; Q130-D207 PolarHBondContact O-N 2.98Å; Q130-E208 HydrophobicContact CB-CB 3.98Å; Q130-E208 HydrophobicContact CB-CG 4.09Å; Q130-E208 WeakPolarHBondContact CB-OE2 3.45Å; Q130-E208 PolarHBondContact N-OE2 2.95Å
131	V	97.8	Very high	97.2	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	136	-170.1	59.8	0	0	0	0	110.7	I88 F125 A127 I133 H163 F164 A204 V205	I88-V131 HydrophobicContact CD1-CB 4.29Å; I88-V131 HydrophobicContact CD1-CG2 3.56Å; I88-V131 HydrophobicContact CG1-CB 4.48Å; I88-V131 HydrophobicContact CG1-CG2 4.04Å; I88-V131 HydrophobicContact CG2-CG2 4.35Å; F125-V131 HydrophobicContact CE2-CG1 3.94Å; A127-V131 HydrophobicContact CB-CB 4.26Å; A127-V131 HydrophobicContact CB-CG1 3.67Å; V131-I133 HydrophobicContact CG2-CD1 4.44Å; V131-I133 HydrophobicContact CG2-CG1 3.95Å; V131-H163 WeakPolarHBondContact O-CA 3.35Å; V131-F164 HydrophobicContact CG1-CB 3.86Å; V131-F164 PolarHBondContact N-O 2.93Å; V131-F164 PolarHBondContact O-N 2.84Å; V131-A204 HydrophobicContact CG2-CB 3.92Å; V131-V205 WeakPolarHBondContact CA-O 3.44Å; V131-V205 WeakPolarHBondContact CG2-O 3.26Å
132	A	98.1	Very high	96.9	Very high	7 Å²	7	23.5 Å²	23.5	6%	0.058	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	130.8	171.9	0	0	0	0	0	109.4	T161 A204 V205 D207	A132-T161 HydrophobicContact CB-CG2 3.74Å; A132-A204 CarbonylContact O-C 3.57Å; A132-A204 WeakPolarHBondContact O-CA 3.34Å; A132-V205 HydrophobicContact CB-CG2 3.92Å; A132-V205 PolarHBondContact N-O 3.18Å; A132-V205 PolarHBondContact O-N 2.87Å; A132-D207 HydrophobicContact CB-CB 3.98Å
133	I	98.6	Very high	96.3	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	125.4	-173.6	-54.3	-173.6	0	0	0	110.2	F123 F125 V131 T161 V162 F164 F172 V202 Q203 A204	F123-I133 HydrophobicContact CZ-CG2 4.06Å; F125-I133 HydrophobicContact CD1-CD1 4.07Å; F125-I133 HydrophobicContact CD2-CD1 4.27Å; F125-I133 HydrophobicContact CE1-CD1 3.77Å; F125-I133 HydrophobicContact CE2-CD1 3.98Å; F125-I133 HydrophobicContact CG-CD1 4.32Å; F125-I133 HydrophobicContact CZ-CD1 3.72Å; V131-I133 HydrophobicContact CG2-CD1 4.44Å; V131-I133 HydrophobicContact CG2-CG1 3.95Å; I133-T161 CarbonylContact O-C 3.5Å; I133-T161 WeakPolarHBondContact O-CA 3.31Å; I133-V162 PolarHBondContact N-O 2.91Å; I133-V162 PolarHBondContact O-N 3.33Å; I133-F164 HydrophobicContact CB-CE2 4.45Å; I133-F164 HydrophobicContact CD1-CD2 3.82Å; I133-F164 HydrophobicContact CD1-CE2 3.89Å; I133-F164 HydrophobicContact CG1-CD2 4.14Å; I133-F164 HydrophobicContact CG1-CE2 4.31Å; I133-F172 HydrophobicContact CB-CD2 4.15Å; I133-F172 HydrophobicContact CB-CE2 4Å; I133-F172 HydrophobicContact CD1-CD2 4.25Å; I133-F172 HydrophobicContact CG2-CD2 3.71Å; I133-F172 HydrophobicContact CG2-CE2 3.6Å; I133-V202 HydrophobicContact CG2-CG1 4.17Å; I133-Q203 WeakPolarHBondContact CA-O 3.43Å; I133-A204 HydrophobicContact CD1-CB 4.27Å; I133-A204 HydrophobicContact CG1-CB 3.87Å
134	T	98.4	Very high	95.6	Very high	11 Å²	11	30.3 Å²	30.3	7%	0.067	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	142.8	173.2	-51.8	0	0	0	0	109.6	Y136 T161 Q203	T134-Y136 HydrophobicContact CG2-CD1 4.35Å; T134-Y136 HydrophobicContact CG2-CD2 4.21Å; T134-Y136 HydrophobicContact CG2-CE1 3.83Å; T134-Y136 HydrophobicContact CG2-CE2 3.67Å; T134-Y136 VanDerWaalsContact CG2-CZ 3.46Å; T134-T161 PolarHBondContact OG1-OG1 2.96Å; T134-Q203 PolarHBondContact N-O 3Å; T134-Q203 PolarHBondContact O-N 2.8Å
135	I	98.4	Very high	94.7	Very high	1 Å²	1	37.1 Å²	37.1	1%	0.005	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	132.8	168.2	-50.4	-175.3	0	0	0	108.7	V121 F123 Y137 Q158 S159 F172 M200 V201 V202	V121-I135 HydrophobicContact CB-CD1 3.74Å; V121-I135 HydrophobicContact CG1-CD1 3.85Å; V121-I135 HydrophobicContact CG2-CD1 4.22Å; F123-I135 HydrophobicContact CE1-CD1 4.38Å; I135-Y137 HydrophobicContact CB-CE2 4.2Å; I135-Y137 HydrophobicContact CG2-CD2 4.35Å; I135-Y137 HydrophobicContact CG2-CE1 4.23Å; I135-Y137 HydrophobicContact CG2-CE2 3.62Å; I135-Q158 CarbonylContact O-C 3.56Å; I135-Q158 VanDerWaalsContact O-CA 3.23Å; I135-Q158 WeakPolarHBondContact O-CA 3.31Å; I135-S159 PolarHBondContact N-OG 3.36Å; I135-S159 PolarHBondContact O-N 3.19Å; I135-F172 HydrophobicContact CD1-CD1 4.35Å; I135-F172 HydrophobicContact CD1-CE1 3.59Å; I135-F172 HydrophobicContact CD1-CZ 3.96Å; I135-F172 HydrophobicContact CG1-CE1 4.3Å; I135-F172 HydrophobicContact CG1-CZ 4.17Å; I135-M200 HydrophobicContact CG2-CG 3.68Å; I135-M200 HydrophobicContact CG2-SD 3.94Å; I135-V201 CarbonylContact C-O 3.6Å; I135-V201 WeakPolarHBondContact CA-O 3.23Å; I135-V202 HydrophobicContact CD1-CG2 4.42Å; I135-V202 HydrophobicContact CG1-CG2 4.25Å; I135-V202 HydrophobicContact CG2-CG2 4.44Å
136	Y	98.3	Very high	93.7	Very high	32 Å²	32	37.9 Å²	37.9	13%	0.125	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	150.6	175.3	-56.3	-88.3	0	0	0	110.3	T134 Y150 P152 Q158 M200 V201 Q203	T134-Y136 HydrophobicContact CG2-CD1 4.35Å; T134-Y136 HydrophobicContact CG2-CD2 4.21Å; T134-Y136 HydrophobicContact CG2-CE1 3.83Å; T134-Y136 HydrophobicContact CG2-CE2 3.67Å; T134-Y136 VanDerWaalsContact CG2-CZ 3.46Å; Y136-Y150 HydrophobicContact CD2-CG 4.45Å; Y136-P152 HydrophobicContact CD1-CG 4.24Å; Y136-Q158 HydrophobicContact CD1-CB 3.79Å; Y136-Q158 HydrophobicContact CE1-CB 4.19Å; Y136-M200 CarbonylContact O-C 3.57Å; Y136-M200 WeakPolarHBondContact O-CA 3.39Å; Y136-V201 PolarHBondContact N-O 2.88Å; Y136-V201 PolarHBondContact O-N 2.9Å; Y136-Q203 HydrophobicContact CD2-CB 4.48Å; Y136-Q203 HydrophobicContact CE2-CB 4.08Å
137	Y	97.8	Very high	93.2	Very high	3 Å²	3	38.6 Å²	38.6	1%	0.012	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	146.3	-179.4	-57.4	-95.8	0	0	0	110.3	V121 I135 A139 L157 H177 V179 W184 P199 M200 F223	V121-Y137 WeakPolarHBondContact CG2-OH 3.44Å; I135-Y137 HydrophobicContact CB-CE2 4.2Å; I135-Y137 HydrophobicContact CG2-CD2 4.35Å; I135-Y137 HydrophobicContact CG2-CE1 4.23Å; I135-Y137 HydrophobicContact CG2-CE2 3.62Å; Y137-A139 PolarHBondContact O-N 2.73Å; Y137-L157 PolarHBondContact N-O 3.36Å; Y137-H177 AromaticContact CE2-CE1 3.95Å; Y137-H177 AromaticContact CE2-NE2 3.18Å; Y137-H177 WeakPolarHBondContact CE2-NE2 3.37Å; Y137-H177 AromaticContact CZ-NE2 3.66Å; Y137-H177 PolarHBondContact OH-NE2 2.87Å; Y137-V179 HydrophobicContact CD1-CG2 4.13Å; Y137-V179 HydrophobicContact CE1-CB 3.92Å; Y137-V179 HydrophobicContact CE1-CG1 3.95Å; Y137-V179 HydrophobicContact CE1-CG2 4.03Å; Y137-W184 AromaticContact CD1-CH2 3.93Å; Y137-W184 HydrophobicContact CD1-CH2 3.93Å; Y137-W184 HydrophobicContact CD1-CZ2 4.4Å; Y137-W184 HydrophobicContact CG-CH2 4.35Å; Y137-P199 VanDerWaalsContact CA-O 3.31Å; Y137-P199 WeakPolarHBondContact CA-O 3.46Å; Y137-M200 HydrophobicContact CD1-CB 4.24Å; Y137-M200 HydrophobicContact CD1-CG 3.92Å; Y137-M200 HydrophobicContact CD1-SD 4.5Å; Y137-M200 HydrophobicContact CE1-CB 4.46Å; Y137-M200 HydrophobicContact CE1-CG 3.76Å; Y137-M200 HydrophobicContact CE1-SD 3.79Å; Y137-F223 HydrophobicContact CD1-CE2 4.34Å; Y137-F223 HydrophobicContact CD1-CZ 4.15Å; Y137-F223 HydrophobicContact CE1-CZ 4.06Å
138	Q	96.8	Very high	92.9	Very high	15 Å²	15	38.5 Å²	38.5	7%	0.07	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	46.5	44.8	-173.2	-57.9	-57.4	-28	0	0	112.5	Q153 L157 W184 E188 I197 F198 P199	Q138-Q153 HydrophobicContact CB-CG 4.5Å; Q138-L157 HydrophobicContact CB-CD1 4.24Å; Q138-L157 HydrophobicContact CG-CD1 4.46Å; Q138-W184 HydrophobicContact CG-CH2 4.2Å; Q138-W184 HydrophobicContact CG-CZ2 4.34Å; Q138-W184 HydrophobicContact CG-CZ3 4.45Å; Q138-E188 PolarHBondContact NE2-O 3.17Å; Q138-I197 HydrophobicContact CB-CG2 4.21Å; Q138-I197 VanDerWaalsContact OE1-CG2 3.31Å; Q138-F198 WeakPolarHBondContact CA-O 3.44Å; Q138-F198 PolarHBondContact N-O 3.41Å; Q138-P199 PolarHBondContact N-O 3.26Å
139	A	96.7	Very high	92.8	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	142.7	-167.8	0	0	0	0	0	112.4	Y137 L151 F198	Y137-A139 PolarHBondContact O-N 2.73Å; A139-L151 VanDerWaalsContact CA-O 3.31Å; A139-L151 WeakPolarHBondContact CA-O 3.44Å; A139-F198 PolarHBondContact N-O 2.89Å; A139-F198 WeakPolarHBondContact O-CD2 3.31Å; A139-F198 PolarHBondContact O-N 2.86Å
140	I	94	Very high	92.7	Very high	66 Å²	66	36.5 Å²	36.5	34%	0.338	19%	0.187	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	146	172.3	-61.7	172.5	0	0	0	108.5	Y150 L151 I197	I140-Y150 WeakPolarHBondContact O-CA 3.47Å; I140-L151 PolarHBondContact N-O 2.88Å; I140-L151 PolarHBondContact O-N 3.08Å; I140-I197 HydrophobicContact CD1-CG1 4.33Å; I140-I197 HydrophobicContact CG1-CG1 3.92Å
141	E	93.1	Very high	92.7	Very high	25 Å²	25	37.1 Å²	37.1	12%	0.117	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	126	176.5	-176	176.6	-137.6	0	0	111.7	F143 P148 Y150 F198 K239	E141-F143 VanDerWaalsContact CD-CE2 3.48Å; E141-F143 HydrophobicContact CG-CD2 4.36Å; E141-F143 HydrophobicContact CG-CE2 3.73Å; E141-F143 HydrophobicContact CG-CZ 4.01Å; E141-F143 VanDerWaalsContact OE1-CZ 3.31Å; E141-F143 WeakPolarHBondContact OE1-CZ 3.2Å; E141-P148 HydrophobicContact CG-CB 4.19Å; E141-P148 WeakPolarHBondContact OE1-CB 3.43Å; E141-Y150 HydrophobicContact CB-CD1 4.11Å; E141-Y150 HydrophobicContact CB-CE1 3.73Å; E141-Y150 HydrophobicContact CG-CD1 4.42Å; E141-Y150 HydrophobicContact CG-CE1 3.75Å; E141-Y150 PolarHBondContact OE1-OH 2.93Å; E141-F198 HydrophobicContact CB-CE2 3.89Å; E141-K239 IonicContact OE1-NZ 3.39Å; E141-K239 PolarHBondContact OE1-NZ 3.44Å; E141-K239 IonicContact OE2-NZ 2.81Å; E141-K239 PolarHBondContact OE2-NZ 2.92Å
142	E	90.5	Very high	92.5	Very high	87 Å²	87	38.5 Å²	38.5	41%	0.407	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	148.7	168.8	-65.1	-165.2	162.1	0	0	111.2	H144 P148 V149 L151	E142-H144 IonicContact OE2-CE1 2.85Å; E142-H144 PolarHBondContact OE2-CE1 2.8Å; E142-P148 CarbonylContact O-C 3.6Å; E142-P148 WeakPolarHBondContact O-CA 3.4Å; E142-V149 PolarHBondContact N-O 2.9Å; E142-V149 PolarHBondContact O-N 3.08Å; E142-L151 VanDerWaalsContact CD-CD1 3.48Å; E142-L151 HydrophobicContact CG-CD1 4.06Å
143	F	85.4	Confident	92.1	Very high	71 Å²	71	44.2 Å²	44.2	31%	0.311	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	112.2	-179.3	-73.9	-87.8	0	0	0	112.4	E141 P148	E141-F143 VanDerWaalsContact CD-CE2 3.48Å; E141-F143 HydrophobicContact CG-CD2 4.36Å; E141-F143 HydrophobicContact CG-CE2 3.73Å; E141-F143 HydrophobicContact CG-CZ 4.01Å; E141-F143 VanDerWaalsContact OE1-CZ 3.31Å; E141-F143 WeakPolarHBondContact OE1-CZ 3.2Å; F143-P148 HydrophobicContact CD1-CB 4.3Å; F143-P148 HydrophobicContact CE1-CB 3.93Å; F143-P148 HydrophobicContact CZ-CB 4.39Å
144	H	83.9	Confident	91.7	Very high	103 Å²	103	47.9 Å²	47.9	48%	0.477	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	108.7	177.1	-73.5	83.9	0	0	0	109.6	E142 G146 V147 V149	E142-H144 IonicContact OE2-CE1 2.85Å; E142-H144 PolarHBondContact OE2-CE1 2.8Å; H144-G146 PolarHBondContact O-N 3.24Å; H144-G146 VanDerWaalsContact O-N 3.14Å; H144-V147 PolarHBondContact N-O 3.47Å; H144-V147 WeakPolarHBondContact O-CB 3.2Å; H144-V147 PolarHBondContact O-N 2.92Å; H144-V149 HydrophobicContact CB-CG2 4.11Å
145	N	79.1	Confident	91.1	Very high	171 Å²	171	51.4 Å²	51.4	91%	0.914	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.9	32.9	-177.5	-60.4	-21.1	0	0	0	114.7	V147	N145-V147 VanDerWaalsContact C-N 3.34Å
146	G	78.2	Confident	90.6	Very high	16 Å²	16	55.2 Å²	55.2	17%	0.165	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	89.6	-11.1	-177.9	0	0	0	0	0	114.9	H144 G244	H144-G146 PolarHBondContact O-N 3.24Å; H144-G146 VanDerWaalsContact O-N 3.14Å; G146-G244 WeakPolarHBondContact CA-O 3.49Å
147	V	86.3	Confident	90.4	Very high	41 Å²	41	55.4 Å²	55.4	25%	0.248	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	129.7	173.2	-173.8	0	0	0	0	109.4	H144 N145	H144-V147 PolarHBondContact N-O 3.47Å; H144-V147 WeakPolarHBondContact O-CB 3.2Å; H144-V147 PolarHBondContact O-N 2.92Å; N145-V147 VanDerWaalsContact C-N 3.34Å
148	P	90.8	Very high	90.3	Very high	1 Å²	1	58.8 Å²	58.8	1%	0.006	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	140.3	174.1	31.1	-33.8	0	0	0	111.3	E141 E142 F143 Y150 Q203 I218 V241	E141-P148 HydrophobicContact CG-CB 4.19Å; E141-P148 WeakPolarHBondContact OE1-CB 3.43Å; E142-P148 CarbonylContact O-C 3.6Å; E142-P148 WeakPolarHBondContact O-CA 3.4Å; F143-P148 HydrophobicContact CD1-CB 4.3Å; F143-P148 HydrophobicContact CE1-CB 3.93Å; F143-P148 HydrophobicContact CZ-CB 4.39Å; P148-Y150 HydrophobicContact CB-CE2 4.04Å; P148-Y150 HydrophobicContact CG-CE2 4.39Å; P148-Q203 PolarHBondContact O-NE2 2.98Å; P148-I218 HydrophobicContact CG-CD1 3.82Å; P148-I218 HydrophobicContact CG-CG1 4.42Å; P148-V241 HydrophobicContact CG-CG2 3.8Å
149	V	92.8	Very high	90.3	Very high	49 Å²	49	58.5 Å²	58.5	30%	0.297	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	131.7	175.9	179.9	0	0	0	0	107	E142 H144 L151	E142-V149 PolarHBondContact N-O 2.9Å; E142-V149 PolarHBondContact O-N 3.08Å; H144-V149 HydrophobicContact CB-CG2 4.11Å; V149-L151 HydrophobicContact CG1-CD2 4.13Å
150	Y	95.4	Very high	90.3	Very high	3 Å²	3	64.1 Å²	64.1	1%	0.012	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	125.5	-179.3	-62.8	-81.7	0	0	0	110.3	Y136 I140 E141 P148 V201 Q203 I218 L220	Y136-Y150 HydrophobicContact CD2-CG 4.45Å; I140-Y150 WeakPolarHBondContact O-CA 3.47Å; E141-Y150 HydrophobicContact CB-CD1 4.11Å; E141-Y150 HydrophobicContact CB-CE1 3.73Å; E141-Y150 HydrophobicContact CG-CD1 4.42Å; E141-Y150 HydrophobicContact CG-CE1 3.75Å; E141-Y150 PolarHBondContact OE1-OH 2.93Å; P148-Y150 HydrophobicContact CB-CE2 4.04Å; P148-Y150 HydrophobicContact CG-CE2 4.39Å; Y150-V201 HydrophobicContact CD1-CB 4.25Å; Y150-V201 HydrophobicContact CD1-CG1 3.87Å; Y150-V201 HydrophobicContact CD1-CG2 3.86Å; Y150-V201 HydrophobicContact CD2-CG1 3.85Å; Y150-V201 HydrophobicContact CE1-CG1 3.85Å; Y150-V201 HydrophobicContact CE1-CG2 4.1Å; Y150-V201 HydrophobicContact CE2-CG1 3.89Å; Y150-V201 HydrophobicContact CG-CB 4.36Å; Y150-V201 HydrophobicContact CG-CG1 3.87Å; Y150-V201 HydrophobicContact CG-CG2 4.43Å; Y150-Q203 HydrophobicContact CD2-CB 4.33Å; Y150-Q203 HydrophobicContact CD2-CG 4.46Å; Y150-Q203 HydrophobicContact CE2-CG 4.42Å; Y150-I218 HydrophobicContact CE2-CG1 3.97Å; Y150-I218 HydrophobicContact CE2-CG2 4.1Å; Y150-I218 WeakPolarHBondContact OH-CG2 3.39Å; Y150-L220 HydrophobicContact CE1-CD2 4.26Å
151	L	95.4	Very high	90.5	Very high	78 Å²	78	64 Å²	64	41%	0.408	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	107.6	-179	-60.6	-175.3	0	0	0	109.5	A139 I140 E142 V149	A139-L151 VanDerWaalsContact CA-O 3.31Å; A139-L151 WeakPolarHBondContact CA-O 3.44Å; I140-L151 PolarHBondContact N-O 2.88Å; I140-L151 PolarHBondContact O-N 3.08Å; E142-L151 VanDerWaalsContact CD-CD1 3.48Å; E142-L151 HydrophobicContact CG-CD1 4.06Å; V149-L151 HydrophobicContact CG1-CD2 4.13Å
152	P	95.1	Very high	90.7	Very high	28 Å²	28	64.5 Å²	64.5	18%	0.182	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	153.8	173.5	33.4	-35.4	0	0	0	110.6	Y136 D154 L157 Q158	Y136-P152 HydrophobicContact CD1-CG 4.24Å; P152-D154 PolarHBondContact O-N 2.95Å; P152-L157 HydrophobicContact CB-CB 3.99Å; P152-L157 WeakPolarHBondContact CB-O 3.12Å; P152-Q158 HydrophobicContact CG-CB 4.27Å; P152-Q158 HydrophobicContact CG-CG 4.35Å
153	Q	89.7	Confident	91.1	Very high	128 Å²	128	65.7 Å²	65.7	60%	0.598	36%	0.355	S	S	*	.	S	Bend	trans	-63.3	-26.2	177.9	-69.8	-180	41.3	0	0	113.8	Q138 L157	Q138-Q153 HydrophobicContact CB-CG 4.5Å; Q153-L157 HydrophobicContact CB-CD1 4.32Å
154	D	88.9	Confident	91.7	Very high	76 Å²	76	64.2 Å²	64.2	41%	0.406	35%	0.349	S	S	.	.	S	Bend	trans	-142.9	152.4	172	175.8	35.3	0	0	0	110.7	P152 S156 L157	P152-D154 PolarHBondContact O-N 2.95Å; D154-S156 PolarHBondContact O-N 2.93Å; D154-S156 VanDerWaalsContact O-N 3.14Å; D154-S156 VanDerWaalsContact OD2-CB 3.23Å; D154-S156 WeakPolarHBondContact OD2-CB 3.4Å; D154-S156 PolarHBondContact OD2-N 2.96Å; D154-S156 PolarHBondContact OD2-OG 2.77Å; D154-L157 HydrophobicContact CB-CD1 4.43Å; D154-L157 WeakPolarHBondContact O-CB 3.44Å; D154-L157 PolarHBondContact O-N 3.3Å
155	S	86.4	Confident	92.4	Very high	86 Å²	86	66.9 Å²	66.9	60%	0.601	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51	-23.9	169.3	61.3	0	0	0	0	115.6	Q158	S155-Q158 WeakPolarHBondContact O-CG 3.46Å
156	S	88	Confident	93.2	Very high	80 Å²	80	65.5 Å²	65.5	56%	0.559	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79	-17.3	173.6	67.9	0	0	0	0	114.1	D154 Q158	D154-S156 PolarHBondContact O-N 2.93Å; D154-S156 VanDerWaalsContact O-N 3.14Å; D154-S156 VanDerWaalsContact OD2-CB 3.23Å; D154-S156 WeakPolarHBondContact OD2-CB 3.4Å; D154-S156 PolarHBondContact OD2-N 2.96Å; D154-S156 PolarHBondContact OD2-OG 2.77Å; S156-Q158 PolarHBondContact O-N 2.82Å
157	L	94.2	Very high	94.1	Very high	37 Å²	37	65.8 Å²	65.8	19%	0.194	34%	0.344	C	S	.	.	S	Bend	trans	-92.6	35.7	-177.8	-65.3	170.1	0	0	0	112	Y137 Q138 P152 Q153 D154 W184	Y137-L157 PolarHBondContact N-O 3.36Å; Q138-L157 HydrophobicContact CB-CD1 4.24Å; Q138-L157 HydrophobicContact CG-CD1 4.46Å; P152-L157 HydrophobicContact CB-CB 3.99Å; P152-L157 WeakPolarHBondContact CB-O 3.12Å; Q153-L157 HydrophobicContact CB-CD1 4.32Å; D154-L157 HydrophobicContact CB-CD1 4.43Å; D154-L157 WeakPolarHBondContact O-CB 3.44Å; D154-L157 PolarHBondContact O-N 3.3Å; L157-W184 HydrophobicContact CD2-CZ2 4.2Å
158	Q	96.3	Very high	94.5	Very high	73 Å²	73	69 Å²	69	34%	0.341	36%	0.363	S	S	.	.	B	Isolated β-bridge	trans	-147	155.7	171.8	56.4	175.3	14.2	0	0	111	I135 Y136 P152 S155 S156 H177	I135-Q158 CarbonylContact O-C 3.56Å; I135-Q158 VanDerWaalsContact O-CA 3.23Å; I135-Q158 WeakPolarHBondContact O-CA 3.31Å; Y136-Q158 HydrophobicContact CD1-CB 3.79Å; Y136-Q158 HydrophobicContact CE1-CB 4.19Å; P152-Q158 HydrophobicContact CG-CB 4.27Å; P152-Q158 HydrophobicContact CG-CG 4.35Å; S155-Q158 WeakPolarHBondContact O-CG 3.46Å; S156-Q158 PolarHBondContact O-N 2.82Å; Q158-H177 PolarHBondContact O-CE1 3.44Å; Q158-H177 VanDerWaalsContact O-CE1 3.23Å
159	S	97	Very high	94.7	Very high	9 Å²	9	72.6 Å²	72.6	6%	0.063	39%	0.388	C	S	.	.			trans	-81.4	166.7	172.5	77.2	0	0	0	0	112.2	I135	I135-S159 PolarHBondContact N-OG 3.36Å; I135-S159 PolarHBondContact O-N 3.19Å
160	E	96.4	Very high	95	Very high	119 Å²	119	72.2 Å²	72.2	56%	0.556	38%	0.383	S	S	*	.			trans	-63.5	149.4	154.7	56	-174.5	148.4	0	0	110	V162 L174 S176	E160-V162 PolarHBondContact O-N 3.26Å; E160-L174 HydrophobicContact CG-CD1 4.19Å; E160-L174 HydrophobicContact CG-CD2 3.89Å; E160-S176 WeakPolarHBondContact OE1-CB 3.16Å; E160-S176 PolarHBondContact OE1-OG 3.43Å
161	T	97.7	Very high	95.1	Very high	64 Å²	64	77.7 Å²	77.7	39%	0.393	41%	0.408	S	S	.	.			trans	-80.8	114.2	177.9	-56.4	0	0	0	0	110.1	A132 I133 T134 H163	A132-T161 HydrophobicContact CB-CG2 3.74Å; I133-T161 CarbonylContact O-C 3.5Å; I133-T161 WeakPolarHBondContact O-CA 3.31Å; T134-T161 PolarHBondContact OG1-OG1 2.96Å; T161-H163 PolarHBondContact O-CE1 2.84Å; T161-H163 PolarHBondContact O-ND1 2.84Å
162	V	98.3	Very high	95.2	Very high	34 Å²	34	74 Å²	74	21%	0.206	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	129.1	-177.6	-167.5	0	0	0	0	109.7	I133 E160 F164 F172 L174	I133-V162 PolarHBondContact N-O 2.91Å; I133-V162 PolarHBondContact O-N 3.33Å; E160-V162 PolarHBondContact O-N 3.26Å; V162-F164 HydrophobicContact CB-CD2 4.49Å; V162-F164 HydrophobicContact CB-CE2 3.73Å; V162-F164 HydrophobicContact CB-CZ 4.33Å; V162-F164 HydrophobicContact CG1-CD2 4.15Å; V162-F164 HydrophobicContact CG1-CE1 4.5Å; V162-F164 HydrophobicContact CG1-CE2 3.39Å; V162-F164 HydrophobicContact CG1-CZ 3.6Å; V162-F172 HydrophobicContact CB-CE2 3.98Å; V162-F172 HydrophobicContact CG2-CE2 3.81Å; V162-F172 HydrophobicContact CG2-CZ 4.08Å; V162-L174 HydrophobicContact CG2-CD1 3.67Å; V162-L174 HydrophobicContact CG2-CD2 3.7Å; V162-L174 HydrophobicContact CG2-CG 4.23Å
163	H	98.1	Very high	95.3	Very high	112 Å²	112	75 Å²	75	52%	0.519	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	123.8	-172.9	-59.8	71.6	0	0	0	110.3	V131 T161 D207	V131-H163 WeakPolarHBondContact O-CA 3.35Å; T161-H163 PolarHBondContact O-CE1 2.84Å; T161-H163 PolarHBondContact O-ND1 2.84Å; H163-D207 IonicContact CD2-OD2 2.72Å; H163-D207 PolarHBondContact CD2-OD2 2.66Å
164	F	98.3	Very high	95.5	Very high	40 Å²	40	69.7 Å²	69.7	18%	0.175	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	148.7	-179.5	-60.6	-100	0	0	0	110.7	F125 Q130 V131 I133 V162 F172	F125-F164 HydrophobicContact CE1-CD1 4.32Å; F125-F164 HydrophobicContact CE1-CD2 4.4Å; F125-F164 HydrophobicContact CE1-CE1 4.26Å; F125-F164 HydrophobicContact CE1-CE2 4.33Å; F125-F164 HydrophobicContact CE1-CG 4.4Å; F125-F164 HydrophobicContact CE1-CZ 4.27Å; F125-F164 HydrophobicContact CE2-CB 4.33Å; F125-F164 HydrophobicContact CE2-CG 4.43Å; F125-F164 HydrophobicContact CZ-CB 3.91Å; F125-F164 AromaticContact CZ-CD1 3.75Å; F125-F164 HydrophobicContact CZ-CD1 3.75Å; F125-F164 AromaticContact CZ-CD2 3.82Å; F125-F164 HydrophobicContact CZ-CD2 3.82Å; F125-F164 HydrophobicContact CZ-CE1 4.14Å; F125-F164 HydrophobicContact CZ-CE2 4.2Å; F125-F164 AromaticContact CZ-CG 3.57Å; F125-F164 HydrophobicContact CZ-CG 3.57Å; F125-F164 HydrophobicContact CZ-CZ 4.35Å; Q130-F164 WeakPolarHBondContact CA-O 3.45Å; Q130-F164 WeakPolarHBondContact CG-O 3.42Å; V131-F164 HydrophobicContact CG1-CB 3.86Å; V131-F164 PolarHBondContact N-O 2.93Å; V131-F164 PolarHBondContact O-N 2.84Å; I133-F164 HydrophobicContact CB-CE2 4.45Å; I133-F164 HydrophobicContact CD1-CD2 3.82Å; I133-F164 HydrophobicContact CD1-CE2 3.89Å; I133-F164 HydrophobicContact CG1-CD2 4.14Å; I133-F164 HydrophobicContact CG1-CE2 4.31Å; V162-F164 HydrophobicContact CB-CD2 4.49Å; V162-F164 HydrophobicContact CB-CE2 3.73Å; V162-F164 HydrophobicContact CB-CZ 4.33Å; V162-F164 HydrophobicContact CG1-CD2 4.15Å; V162-F164 HydrophobicContact CG1-CE1 4.5Å; V162-F164 HydrophobicContact CG1-CE2 3.39Å; V162-F164 HydrophobicContact CG1-CZ 3.6Å; F164-F172 AromaticContact CE2-CD2 3.74Å; F164-F172 HydrophobicContact CE2-CD2 3.74Å; F164-F172 HydrophobicContact CE2-CE2 4.25Å; F164-F172 AromaticContact CZ-CD2 3.88Å; F164-F172 HydrophobicContact CZ-CD2 3.88Å
165	K	97.8	Very high	95.5	Very high	160 Å²	160	70.6 Å²	70.6	70%	0.696	38%	0.382	S	S	*	.			trans	-81.5	170.1	174.4	-62.5	-175.1	-179.4	-176.3	0	110.4	G167 Q170	K165-G167 PolarHBondContact O-N 3.24Å; K165-Q170 PolarHBondContact O-NE2 3.14Å; K165-Q170 PolarHBondContact O-OE1 3.25Å
166	R	96.9	Very high	95.7	Very high	142 Å²	142	70.5 Å²	70.5	54%	0.536	38%	0.381	S	S	.	.	S	Bend	trans	-48.6	129.9	164.8	178.4	172.2	-169.3	-172.4	5.7	111.1	A127 D128 T129	A127-R166 CarbonylContact O-C 3.55Å; A127-R166 WeakPolarHBondContact O-CA 3.36Å; D128-R166 WeakPolarHBondContact O-CD 3.48Å; D128-R166 PolarHBondContact O-NE 2.82Å; D128-R166 IonicContact OD1-CZ 3.33Å; D128-R166 IonicContact OD1-NE 2.73Å; D128-R166 PolarHBondContact OD1-NE 2.98Å; D128-R166 IonicContact OD1-NH2 2.8Å; D128-R166 PolarHBondContact OD1-NH2 3.2Å; D128-R166 IonicContact OD2-CZ 3Å; D128-R166 IonicContact OD2-NH2 3.65Å; D128-R166 PolarHBondContact OD2-NH2 2.93Å; T129-R166 PolarHBondContact O-N 3.29Å
167	G	96.5	Very high	95.9	Very high	22 Å²	22	68.3 Å²	68.3	23%	0.227	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	173.8	150.1	179.6	0	0	0	0	0	112.8	A127 K165 Q170	A127-G167 PolarHBondContact N-O 2.97Å; A127-G167 PolarHBondContact O-N 3.33Å; K165-G167 PolarHBondContact O-N 3.24Å; G167-Q170 PolarHBondContact O-NE2 2.77Å
168	V	95.1	Very high	95.9	Very high	107 Å²	107	69.4 Å²	69.4	65%	0.648	37%	0.37	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.6	157.2	175.2	-64.2	0	0	0	0	111.1	D126 Q170	D126-V168 HydrophobicContact CB-CG1 4.41Å; D126-V168 WeakPolarHBondContact OD1-CA 3.4Å; D126-V168 WeakPolarHBondContact OD1-CB 3.47Å; V168-Q170 PolarHBondContact O-N 3.22Å
169	C	95.6	Very high	95.8	Very high	78 Å²	78	66.5 Å²	66.5	53%	0.527	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	53.3	32.7	-176.9	-61.3	0	0	0	0	113.9	R91 D126	R91-C169 PolarHBondContact NH2-SG 3.27Å; D126-C169 PolarHBondContact OD1-N 3.21Å
170	Q	97.7	Very high	95.6	Very high	40 Å²	40	67 Å²	67	19%	0.187	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	138	178.5	-65.6	-169.3	88.5	0	0	110.3	T124 F125 K165 G167 V168	T124-Q170 CarbonylContact C-O 3.56Å; T124-Q170 VanDerWaalsContact CA-O 3.27Å; T124-Q170 WeakPolarHBondContact CA-O 3.36Å; F125-Q170 HydrophobicContact CD1-CB 4.22Å; F125-Q170 WeakPolarHBondContact CD1-O 3.43Å; F125-Q170 HydrophobicContact CD2-CB 4.29Å; F125-Q170 HydrophobicContact CE1-CB 3.71Å; F125-Q170 HydrophobicContact CE2-CB 3.79Å; F125-Q170 HydrophobicContact CE2-CG 4.42Å; F125-Q170 HydrophobicContact CG-CB 4.48Å; F125-Q170 HydrophobicContact CZ-CB 3.46Å; F125-Q170 VanDerWaalsContact CZ-CB 3.46Å; F125-Q170 HydrophobicContact CZ-CG 4.36Å; F125-Q170 PolarHBondContact N-O 3.45Å; F125-Q170 PolarHBondContact O-N 3.21Å; K165-Q170 PolarHBondContact O-NE2 3.14Å; K165-Q170 PolarHBondContact O-OE1 3.25Å; G167-Q170 PolarHBondContact O-NE2 2.77Å; V168-Q170 PolarHBondContact O-N 3.22Å
171	Q	97.8	Very high	95.4	Very high	118 Å²	118	61.3 Å²	61.3	55%	0.551	33%	0.333	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.3	124.4	176.9	-175.1	176.2	-0.3	0	0	109.9	E122	E122-Q171 PolarHBondContact OE2-NE2 3.22Å
172	F	98.3	Very high	95.1	Very high	1 Å²	1	60.6 Å²	60.6	0%	0.004	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	130.5	161.8	-173.7	-80.2	0	0	0	109	E122 F123 F125 I133 I135 V162 F164 L174	E122-F172 VanDerWaalsContact CA-O 3.31Å; E122-F172 WeakPolarHBondContact CA-O 3.43Å; F123-F172 HydrophobicContact CD1-CB 4.05Å; F123-F172 HydrophobicContact CD1-CD1 4.22Å; F123-F172 HydrophobicContact CD1-CG 4.33Å; F123-F172 HydrophobicContact CD2-CB 3.93Å; F123-F172 HydrophobicContact CE1-CB 3.65Å; F123-F172 AromaticContact CE1-CD1 3.55Å; F123-F172 HydrophobicContact CE1-CD1 3.55Å; F123-F172 HydrophobicContact CE1-CD2 4.28Å; F123-F172 HydrophobicContact CE1-CE1 4.29Å; F123-F172 AromaticContact CE1-CG 3.56Å; F123-F172 HydrophobicContact CE1-CG 3.56Å; F123-F172 HydrophobicContact CE2-CB 3.53Å; F123-F172 HydrophobicContact CE2-CG 4.11Å; F123-F172 HydrophobicContact CG-CB 4.18Å; F123-F172 HydrophobicContact CZ-CB 3.37Å; F123-F172 AromaticContact CZ-CD1 3.93Å; F123-F172 HydrophobicContact CZ-CD1 3.93Å; F123-F172 AromaticContact CZ-CD2 3.82Å; F123-F172 HydrophobicContact CZ-CD2 3.82Å; F123-F172 AromaticContact CZ-CG 3.42Å; F123-F172 HydrophobicContact CZ-CG 3.42Å; F123-F172 VanDerWaalsContact CZ-CG 3.42Å; F123-F172 PolarHBondContact N-O 2.81Å; F123-F172 PolarHBondContact O-N 3.48Å; F125-F172 HydrophobicContact CD1-CB 4.33Å; F125-F172 HydrophobicContact CE1-CB 4.19Å; I133-F172 HydrophobicContact CB-CD2 4.15Å; I133-F172 HydrophobicContact CB-CE2 4Å; I133-F172 HydrophobicContact CD1-CD2 4.25Å; I133-F172 HydrophobicContact CG2-CD2 3.71Å; I133-F172 HydrophobicContact CG2-CE2 3.6Å; I135-F172 HydrophobicContact CD1-CD1 4.35Å; I135-F172 HydrophobicContact CD1-CE1 3.59Å; I135-F172 HydrophobicContact CD1-CZ 3.96Å; I135-F172 HydrophobicContact CG1-CE1 4.3Å; I135-F172 HydrophobicContact CG1-CZ 4.17Å; V162-F172 HydrophobicContact CB-CE2 3.98Å; V162-F172 HydrophobicContact CG2-CE2 3.81Å; V162-F172 HydrophobicContact CG2-CZ 4.08Å; F164-F172 AromaticContact CE2-CD2 3.74Å; F164-F172 HydrophobicContact CE2-CD2 3.74Å; F164-F172 HydrophobicContact CE2-CE2 4.25Å; F164-F172 AromaticContact CZ-CD2 3.88Å; F164-F172 HydrophobicContact CZ-CD2 3.88Å; F172-L174 HydrophobicContact CE1-CB 3.78Å; F172-L174 HydrophobicContact CZ-CB 3.9Å; F172-L174 HydrophobicContact CZ-CD2 3.98Å
173	C	95.7	Very high	94.7	Very high	48 Å²	48	64.5 Å²	64.5	32%	0.324	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.8	129.5	172	173.2	0	0	0	0	106.6	N120 E122	N120-C173 PolarHBondContact ND2-SG 2.67Å; E122-C173 HydrophobicContact CG-CB 3.9Å; E122-C173 PolarHBondContact OE1-SG 3.2Å
174	L	94.7	Very high	94.5	Very high	17 Å²	17	61 Å²	61	9%	0.089	33%	0.329	C	S	.	.			trans	-135.5	74	-173.7	-171.6	61.8	0	0	0	111.7	N120 E160 V162 F172 S176 H177	N120-L174 PolarHBondContact OD1-N 2.81Å; N120-L174 VanDerWaalsContact OD1-N 3.16Å; N120-L174 PolarHBondContact OD1-O 3.23Å; E160-L174 HydrophobicContact CG-CD1 4.19Å; E160-L174 HydrophobicContact CG-CD2 3.89Å; V162-L174 HydrophobicContact CG2-CD1 3.67Å; V162-L174 HydrophobicContact CG2-CD2 3.7Å; V162-L174 HydrophobicContact CG2-CG 4.23Å; F172-L174 HydrophobicContact CE1-CB 3.78Å; F172-L174 HydrophobicContact CZ-CB 3.9Å; F172-L174 HydrophobicContact CZ-CD2 3.98Å; L174-S176 VanDerWaalsContact CD1-OG 3.24Å; L174-S176 WeakPolarHBondContact CD1-OG 3.43Å; L174-S176 WeakPolarHBondContact CG-OG 3.2Å; L174-S176 PolarHBondContact O-N 2.77Å; L174-H177 HydrophobicContact CD2-CB 3.81Å; L174-H177 HydrophobicContact CG-CB 3.96Å; L174-H177 PolarHBondContact O-N 3.41Å; L174-H177 VanDerWaalsContact O-O 3.08Å
175	P	89.8	Confident	94.2	Very high	96 Å²	96	61 Å²	61	62%	0.623	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-10.6	-173.9	-22.8	35.4	0	0	0	115.5
176	S	90.4	Very high	94.1	Very high	84 Å²	84	57.2 Å²	57.2	59%	0.587	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.1	-20	169	45.3	0	0	0	0	113.1	E160 L174	E160-S176 WeakPolarHBondContact OE1-CB 3.16Å; E160-S176 PolarHBondContact OE1-OG 3.43Å; L174-S176 VanDerWaalsContact CD1-OG 3.24Å; L174-S176 WeakPolarHBondContact CD1-OG 3.43Å; L174-S176 WeakPolarHBondContact CG-OG 3.2Å; L174-S176 PolarHBondContact O-N 2.77Å
177	H	92.6	Very high	93.9	Very high	33 Å²	33	57.4 Å²	57.4	15%	0.153	33%	0.331	C	S	.	.			trans	-123.3	119.6	-174.4	178.5	81.1	0	0	0	110.7	Y137 Q158 L174	Y137-H177 AromaticContact CE2-CE1 3.95Å; Y137-H177 AromaticContact CE2-NE2 3.18Å; Y137-H177 WeakPolarHBondContact CE2-NE2 3.37Å; Y137-H177 AromaticContact CZ-NE2 3.66Å; Y137-H177 PolarHBondContact OH-NE2 2.87Å; Q158-H177 PolarHBondContact O-CE1 3.44Å; Q158-H177 VanDerWaalsContact O-CE1 3.23Å; L174-H177 HydrophobicContact CD2-CB 3.81Å; L174-H177 HydrophobicContact CG-CB 3.96Å; L174-H177 PolarHBondContact O-N 3.41Å; L174-H177 VanDerWaalsContact O-O 3.08Å
178	T	93.3	Very high	93.9	Very high	61 Å²	61	60.2 Å²	60.2	37%	0.374	34%	0.338	S	S	.	.			trans	-135.7	132.2	-176.1	67.4	0	0	0	0	111.7	C100 Y119	C100-T178 VanDerWaalsContact SG-CG2 3.55Å; Y119-T178 CarbonylContact O-C 3.58Å; Y119-T178 VanDerWaalsContact O-CA 3.29Å; Y119-T178 WeakPolarHBondContact O-CA 3.49Å
179	V	93.1	Very high	93.9	Very high	11 Å²	11	55.4 Å²	55.4	7%	0.067	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	136.8	175.8	64.2	0	0	0	0	111	C118 Y119 Y137 L181 W184	C118-V179 CarbonylContact C-O 3.55Å; C118-V179 WeakPolarHBondContact CA-O 3.35Å; Y119-V179 PolarHBondContact N-O 2.8Å; Y119-V179 PolarHBondContact O-N 2.79Å; Y137-V179 HydrophobicContact CD1-CG2 4.13Å; Y137-V179 HydrophobicContact CE1-CB 3.92Å; Y137-V179 HydrophobicContact CE1-CG1 3.95Å; Y137-V179 HydrophobicContact CE1-CG2 4.03Å; V179-L181 HydrophobicContact CG1-CD2 4.29Å; V179-L181 HydrophobicContact CG1-CG 4.2Å; V179-L181 HydrophobicContact CG2-CD2 3.72Å; V179-L181 HydrophobicContact CG2-CG 4.24Å; V179-W184 HydrophobicContact CG2-CH2 4.25Å; V179-W184 HydrophobicContact CG2-CZ2 3.72Å
180	N	92.8	Very high	94	Very high	19 Å²	19	56 Å²	56	10%	0.102	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	85	176.6	-178.2	15.7	0	0	0	111.2	S182 E183	N180-S182 PolarHBondContact O-N 2.74Å; N180-S182 PolarHBondContact OD1-N 2.83Å; N180-S182 PolarHBondContact OD1-OG 2.91Å; N180-E183 WeakPolarHBondContact ND2-CG 3.42Å; N180-E183 PolarHBondContact ND2-OE1 3.48Å; N180-E183 PolarHBondContact ND2-OE2 2.84Å; N180-E183 PolarHBondContact O-N 3.19Å
181	L	93.6	Very high	93.8	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	31%	0.307	C	S	.	.	G	3₁₀ helix	trans	-67.1	-7.6	-177	-58.3	173.1	0	0	0	114.2	L97 Y119 V179 E183 W184 L189 F223 Y231	L97-L181 HydrophobicContact CD1-CD1 3.65Å; Y119-L181 HydrophobicContact CD2-CD1 4.33Å; V179-L181 HydrophobicContact CG1-CD2 4.29Å; V179-L181 HydrophobicContact CG1-CG 4.2Å; V179-L181 HydrophobicContact CG2-CD2 3.72Å; V179-L181 HydrophobicContact CG2-CG 4.24Å; L181-E183 VanDerWaalsContact C-N 3.3Å; L181-W184 HydrophobicContact CD2-CD2 4.01Å; L181-W184 HydrophobicContact CD2-CE3 3.76Å; L181-W184 HydrophobicContact CD2-CH2 3.93Å; L181-W184 HydrophobicContact CD2-CZ2 4.19Å; L181-W184 HydrophobicContact CD2-CZ3 3.71Å; L181-L189 HydrophobicContact CB-CD2 4.37Å; L181-L189 HydrophobicContact CD2-CD2 4.34Å; L181-F223 HydrophobicContact CD1-CB 4.27Å; L181-F223 HydrophobicContact CD1-CD1 3.69Å; L181-F223 HydrophobicContact CD1-CD2 4.28Å; L181-F223 HydrophobicContact CD1-CE1 4.05Å; L181-F223 HydrophobicContact CD1-CG 3.8Å; L181-F223 HydrophobicContact CD1-CZ 4.47Å; L181-F223 HydrophobicContact CD2-CD1 4.45Å; L181-F223 HydrophobicContact CD2-CD2 3.64Å; L181-F223 HydrophobicContact CD2-CE1 4.47Å; L181-F223 HydrophobicContact CD2-CE2 3.67Å; L181-F223 HydrophobicContact CD2-CG 4.04Å; L181-F223 HydrophobicContact CD2-CZ 4.08Å; L181-Y231 HydrophobicContact CB-CD1 3.55Å; L181-Y231 HydrophobicContact CB-CD2 4.32Å; L181-Y231 HydrophobicContact CB-CE1 3.55Å; L181-Y231 HydrophobicContact CB-CE2 4.36Å; L181-Y231 HydrophobicContact CB-CG 3.95Å; L181-Y231 HydrophobicContact CD1-CD1 3.8Å; L181-Y231 HydrophobicContact CD1-CG 3.95Å; L181-Y231 HydrophobicContact CG-CD1 4.32Å; L181-Y231 WeakPolarHBondContact O-CE1 3.43Å; L181-Y231 VanDerWaalsContact O-CZ 3.3Å; L181-Y231 PolarHBondContact O-OH 3.07Å
182	S	90.8	Very high	93.4	Very high	50 Å²	50	52.6 Å²	52.6	35%	0.35	29%	0.291	S	S	.	.	G	3₁₀ helix	trans	-79.4	-8.4	175.4	74.5	0	0	0	0	114.6	N180	N180-S182 PolarHBondContact O-N 2.74Å; N180-S182 PolarHBondContact OD1-N 2.83Å; N180-S182 PolarHBondContact OD1-OG 2.91Å
183	E	90.1	Very high	92.7	Very high	116 Å²	116	57 Å²	57	54%	0.542	31%	0.312	S	S	.	.	G	3₁₀ helix	trans	-100.2	-5.8	176.3	-75.5	169.9	-169.5	0	0	113	R116 N180 L181	R116-E183 IonicContact CZ-OE1 3.2Å; R116-E183 IonicContact NE-OE1 2.81Å; R116-E183 PolarHBondContact NE-OE1 3.32Å; R116-E183 IonicContact NH2-OE1 2.73Å; R116-E183 PolarHBondContact NH2-OE1 3.31Å; R116-E183 IonicContact NH2-OE2 3.47Å; R116-E183 PolarHBondContact NH2-OE2 2.79Å; N180-E183 WeakPolarHBondContact ND2-CG 3.42Å; N180-E183 PolarHBondContact ND2-OE1 3.48Å; N180-E183 PolarHBondContact ND2-OE2 2.84Å; N180-E183 PolarHBondContact O-N 3.19Å; L181-E183 VanDerWaalsContact C-N 3.3Å
184	W	92.8	Very high	92.2	Very high	38 Å²	38	59.8 Å²	59.8	14%	0.144	32%	0.324	C	S	.	.	S	Bend	trans	-90.8	155.5	177.4	-63	9	0	0	0	111.8	Y137 Q138 L157 V179 L181 E188 L189 P199 F223	Y137-W184 AromaticContact CD1-CH2 3.93Å; Y137-W184 HydrophobicContact CD1-CH2 3.93Å; Y137-W184 HydrophobicContact CD1-CZ2 4.4Å; Y137-W184 HydrophobicContact CG-CH2 4.35Å; Q138-W184 HydrophobicContact CG-CH2 4.2Å; Q138-W184 HydrophobicContact CG-CZ2 4.34Å; Q138-W184 HydrophobicContact CG-CZ3 4.45Å; L157-W184 HydrophobicContact CD2-CZ2 4.2Å; V179-W184 HydrophobicContact CG2-CH2 4.25Å; V179-W184 HydrophobicContact CG2-CZ2 3.72Å; L181-W184 HydrophobicContact CD2-CD2 4.01Å; L181-W184 HydrophobicContact CD2-CE3 3.76Å; L181-W184 HydrophobicContact CD2-CH2 3.93Å; L181-W184 HydrophobicContact CD2-CZ2 4.19Å; L181-W184 HydrophobicContact CD2-CZ3 3.71Å; W184-E188 WeakPolarHBondContact CA-OE2 3.48Å; W184-E188 HydrophobicContact CB-CB 4.32Å; W184-E188 HydrophobicContact CE3-CB 4.43Å; W184-L189 HydrophobicContact CB-CD2 4.48Å; W184-L189 HydrophobicContact CE3-CD2 4.02Å; W184-P199 HydrophobicContact CZ3-CB 4.42Å; W184-F223 HydrophobicContact CE3-CD2 4.46Å; W184-F223 HydrophobicContact CH2-CD2 4.44Å; W184-F223 AromaticContact CH2-CE2 3.84Å; W184-F223 HydrophobicContact CH2-CE2 3.84Å; W184-F223 AromaticContact CZ3-CD2 3.73Å; W184-F223 HydrophobicContact CZ3-CD2 3.73Å; W184-F223 AromaticContact CZ3-CE2 3.58Å; W184-F223 HydrophobicContact CZ3-CE2 3.58Å
185	A	93.9	Very high	91.8	Very high	41 Å²	41	65.5 Å²	65.5	34%	0.339	35%	0.348	S	S	.	.			trans	-74.2	157.4	169.2	0	0	0	0	0	111.4	E187 E188	A185-E187 PolarHBondContact O-N 2.91Å; A185-E188 HydrophobicContact CB-CG 4.07Å; A185-E188 PolarHBondContact N-OE2 3.03Å; A185-E188 WeakPolarHBondContact O-CB 3.38Å; A185-E188 PolarHBondContact O-N 3.43Å; A185-E188 VanDerWaalsContact O-N 3.09Å
186	D	93.7	Very high	91.8	Very high	79 Å²	79	62.8 Å²	62.8	42%	0.422	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-21.7	-176	-74.1	-24.4	0	0	0	112.4	K225	D186-K225 WeakPolarHBondContact OD1-CD 3.31Å; D186-K225 WeakPolarHBondContact OD1-CE 3.4Å; D186-K225 IonicContact OD1-NZ 2.59Å; D186-K225 PolarHBondContact OD1-NZ 2.67Å; D186-K225 IonicContact OD2-NZ 2.84Å; D186-K225 PolarHBondContact OD2-NZ 3.42Å
187	E	94.6	Very high	91.9	Very high	146 Å²	146	59.6 Å²	59.6	68%	0.682	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.2	-35.5	170	-59.8	79.6	-177.5	0	0	112.6	A185 L189 L190	A185-E187 PolarHBondContact O-N 2.91Å; E187-L189 PolarHBondContact O-N 2.84Å; E187-L190 PolarHBondContact O-N 3.18Å
188	E	95.3	Very high	92.1	Very high	82 Å²	82	58.2 Å²	58.2	38%	0.383	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-15.6	-178.9	-67	173.6	152.9	0	0	112.5	Q138 W184 A185 L190	Q138-E188 PolarHBondContact NE2-O 3.17Å; W184-E188 WeakPolarHBondContact CA-OE2 3.48Å; W184-E188 HydrophobicContact CB-CB 4.32Å; W184-E188 HydrophobicContact CE3-CB 4.43Å; A185-E188 HydrophobicContact CB-CG 4.07Å; A185-E188 PolarHBondContact N-OE2 3.03Å; A185-E188 WeakPolarHBondContact O-CB 3.38Å; A185-E188 PolarHBondContact O-N 3.43Å; A185-E188 VanDerWaalsContact O-N 3.09Å; E188-L190 PolarHBondContact O-N 3.1Å
189	L	96.1	Very high	92.3	Very high	5 Å²	5	55.3 Å²	55.3	3%	0.026	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-17.9	173.9	-58	174.5	0	0	0	112.6	L181 W184 E187 P199 T222 F223 K225 Y231	L181-L189 HydrophobicContact CB-CD2 4.37Å; L181-L189 HydrophobicContact CD2-CD2 4.34Å; W184-L189 HydrophobicContact CB-CD2 4.48Å; W184-L189 HydrophobicContact CE3-CD2 4.02Å; E187-L189 PolarHBondContact O-N 2.84Å; L189-P199 WeakPolarHBondContact O-CG 3.26Å; L189-T222 WeakPolarHBondContact O-CB 3.44Å; L189-F223 HydrophobicContact CB-CB 4.11Å; L189-F223 HydrophobicContact CD2-CB 3.92Å; L189-F223 HydrophobicContact CD2-CD2 4.41Å; L189-F223 PolarHBondContact O-N 3.07Å; L189-K225 HydrophobicContact CD1-CB 3.97Å; L189-K225 HydrophobicContact CD1-CD 4.25Å; L189-Y231 HydrophobicContact CD1-CD1 4.39Å; L189-Y231 HydrophobicContact CD1-CE1 3.82Å; L189-Y231 HydrophobicContact CD2-CD1 4.19Å; L189-Y231 HydrophobicContact CD2-CE1 3.82Å
190	L	96.4	Very high	92.5	Very high	92 Å²	92	54.8 Å²	54.8	48%	0.482	28%	0.276	S	S	.	.	S	Bend	trans	-112.9	156	-171.1	-57.8	179.4	0	0	0	111.9	E187 E188 D192 P199	E187-L190 PolarHBondContact O-N 3.18Å; E188-L190 PolarHBondContact O-N 3.1Å; L190-D192 PolarHBondContact O-N 2.86Å; L190-P199 WeakPolarHBondContact O-CG 3.43Å
191	F	93.8	Very high	92.8	Very high	44 Å²	44	53.9 Å²	53.9	19%	0.193	27%	0.271	C	S	.	.			trans	-67.4	116.2	177.9	170.8	-114.9	0	0	0	111.1	F62 M193 I197 F198 T222 L236	F62-F191 HydrophobicContact CE1-CD1 4.19Å; F62-F191 AromaticContact CE1-CE1 3.89Å; F62-F191 HydrophobicContact CE1-CE1 3.89Å; F62-F191 HydrophobicContact CE1-CZ 4.12Å; F62-F191 HydrophobicContact CZ-CD1 4.35Å; F62-F191 HydrophobicContact CZ-CE1 4.15Å; F191-M193 HydrophobicContact CD1-CB 4.28Å; F191-M193 HydrophobicContact CE1-CB 3.82Å; F191-M193 HydrophobicContact CE1-CG 4.23Å; F191-M193 HydrophobicContact CZ-CB 4.49Å; F191-M193 PolarHBondContact O-N 3.3Å; F191-I197 VanDerWaalsContact CD2-O 3.26Å; F191-I197 WeakPolarHBondContact CD2-O 3.49Å; F191-F198 AromaticContact CD2-CD1 3.5Å; F191-F198 HydrophobicContact CD2-CD1 3.5Å; F191-F198 AromaticContact CD2-CE1 3.59Å; F191-F198 HydrophobicContact CD2-CE1 3.59Å; F191-F198 HydrophobicContact CD2-CG 4.22Å; F191-F198 HydrophobicContact CD2-CZ 4.37Å; F191-F198 AromaticContact CE2-CD1 3.6Å; F191-F198 HydrophobicContact CE2-CD1 3.6Å; F191-F198 AromaticContact CE2-CE1 3.22Å; F191-F198 HydrophobicContact CE2-CE1 3.22Å; F191-F198 HydrophobicContact CE2-CE2 4.25Å; F191-F198 HydrophobicContact CE2-CG 4.25Å; F191-F198 AromaticContact CE2-CZ 3.6Å; F191-F198 HydrophobicContact CE2-CZ 3.6Å; F191-F198 AromaticContact CZ-CE1 3.94Å; F191-F198 HydrophobicContact CZ-CE1 3.94Å; F191-F198 HydrophobicContact CZ-CZ 4.18Å; F191-T222 HydrophobicContact CB-CG2 4.05Å; F191-L236 HydrophobicContact CB-CD2 3.76Å; F191-L236 HydrophobicContact CD1-CD2 4.39Å; F191-L236 HydrophobicContact CG-CD2 4Å
192	D	88.9	Confident	93.1	Very high	42 Å²	42	53.9 Å²	53.9	23%	0.225	27%	0.271	C	S	.	.	B	Isolated β-bridge	trans	-83.8	92.8	176.3	-169.2	-33.4	0	0	0	109.9	L190 D194 K195 E196 I197	L190-D192 PolarHBondContact O-N 2.86Å; D192-D194 PolarHBondContact O-N 3.04Å; D192-D194 WeakPolarHBondContact OD1-CA 3.27Å; D192-D194 WeakPolarHBondContact OD1-CB 3.27Å; D192-D194 PolarHBondContact OD1-N 2.85Å; D192-K195 HydrophobicContact CB-CB 4.36Å; D192-K195 PolarHBondContact O-N 2.85Å; D192-K195 PolarHBondContact OD1-N 2.91Å; D192-K195 WeakPolarHBondContact OD2-CG 3.47Å; D192-K195 IonicContact OD2-NZ 3.81Å; D192-K195 PolarHBondContact OD2-NZ 2.93Å; D192-E196 WeakPolarHBondContact O-CA 3.39Å; D192-E196 PolarHBondContact O-N 3.22Å; D192-I197 HydrophobicContact CB-CB 4.26Å; D192-I197 PolarHBondContact N-O 3Å; D192-I197 VanDerWaalsContact N-O 3.16Å; D192-I197 PolarHBondContact O-N 2.77Å
193	M	84	Confident	93.4	Very high	92 Å²	92	52.3 Å²	52.3	45%	0.453	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-18.4	175.4	-173	-176.3	66.3	0	0	113.2	F191	F191-M193 HydrophobicContact CD1-CB 4.28Å; F191-M193 HydrophobicContact CE1-CB 3.82Å; F191-M193 HydrophobicContact CE1-CG 4.23Å; F191-M193 HydrophobicContact CZ-CB 4.49Å; F191-M193 PolarHBondContact O-N 3.3Å
194	D	85.2	Confident	93.8	Very high	108 Å²	108	46.8 Å²	46.8	58%	0.578	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.9	-34.4	177.6	-93.9	-55.3	0	0	0	112.6	R24 D192	R24-D194 IonicContact CZ-OD1 2.64Å; R24-D194 IonicContact NH1-OD1 2.88Å; R24-D194 PolarHBondContact NH1-OD1 2.92Å; R24-D194 VanDerWaalsContact NH2-CA 3.34Å; R24-D194 PolarHBondContact NH2-O 2.84Å; R24-D194 VanDerWaalsContact NH2-O 3.09Å; R24-D194 IonicContact NH2-OD1 3.97Å; R24-D194 PolarHBondContact NH2-OD1 2.82Å; D192-D194 PolarHBondContact O-N 3.04Å; D192-D194 WeakPolarHBondContact OD1-CA 3.27Å; D192-D194 WeakPolarHBondContact OD1-CB 3.27Å; D192-D194 PolarHBondContact OD1-N 2.85Å
195	K	87.4	Confident	94	Very high	136 Å²	136	47.1 Å²	47.1	59%	0.591	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-103.2	-4.3	179.4	-54.2	-169.7	-160.6	87	0	115.1	D192 I197	D192-K195 HydrophobicContact CB-CB 4.36Å; D192-K195 PolarHBondContact O-N 2.85Å; D192-K195 PolarHBondContact OD1-N 2.91Å; D192-K195 WeakPolarHBondContact OD2-CG 3.47Å; D192-K195 IonicContact OD2-NZ 3.81Å; D192-K195 PolarHBondContact OD2-NZ 2.93Å; K195-I197 VanDerWaalsContact C-N 3.27Å; K195-I197 HydrophobicContact CB-CD1 3.64Å; K195-I197 HydrophobicContact CB-CG1 3.73Å; K195-I197 HydrophobicContact CD-CD1 3.78Å; K195-I197 HydrophobicContact CG-CD1 4.36Å; K195-I197 PolarHBondContact O-N 2.73Å
196	E	88.4	Confident	94.2	Very high	39 Å²	39	45.7 Å²	45.7	18%	0.182	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.5	35.7	-171.5	-67.6	-179.7	169.6	0	0	113.6	V22 Y23 D192	V22-E196 WeakPolarHBondContact CA-OE1 3.44Å; V22-E196 VanDerWaalsContact CG1-CD 3.49Å; V22-E196 HydrophobicContact CG1-CG 4.07Å; V22-E196 VanDerWaalsContact CG1-OE1 3.27Å; V22-E196 WeakPolarHBondContact CG1-OE1 3.2Å; Y23-E196 PolarHBondContact N-OE1 3.34Å; D192-E196 WeakPolarHBondContact O-CA 3.39Å; D192-E196 PolarHBondContact O-N 3.22Å
197	I	93.8	Very high	94.2	Very high	17 Å²	17	45 Å²	45	9%	0.087	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	122	-179.5	-58.8	171.1	0	0	0	110.8	Q138 I140 F191 D192 K195	Q138-I197 HydrophobicContact CB-CG2 4.21Å; Q138-I197 VanDerWaalsContact OE1-CG2 3.31Å; I140-I197 HydrophobicContact CD1-CG1 4.33Å; I140-I197 HydrophobicContact CG1-CG1 3.92Å; F191-I197 VanDerWaalsContact CD2-O 3.26Å; F191-I197 WeakPolarHBondContact CD2-O 3.49Å; D192-I197 HydrophobicContact CB-CB 4.26Å; D192-I197 PolarHBondContact N-O 3Å; D192-I197 VanDerWaalsContact N-O 3.16Å; D192-I197 PolarHBondContact O-N 2.77Å; K195-I197 VanDerWaalsContact C-N 3.27Å; K195-I197 HydrophobicContact CB-CD1 3.64Å; K195-I197 HydrophobicContact CB-CG1 3.73Å; K195-I197 HydrophobicContact CD-CD1 3.78Å; K195-I197 HydrophobicContact CG-CD1 4.36Å; K195-I197 PolarHBondContact O-N 2.73Å
198	F	96.1	Very high	94	Very high	5 Å²	5	43.1 Å²	43.1	2%	0.022	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	120.1	174.6	-59.7	-78.2	0	0	0	110.8	F62 Q138 A139 E141 F191 M200 V201 L220	F62-F198 AromaticContact CD1-CE1 3.93Å; F62-F198 HydrophobicContact CD1-CE1 3.93Å; F62-F198 HydrophobicContact CD1-CZ 4.37Å; F62-F198 HydrophobicContact CE1-CE1 4.01Å; Q138-F198 WeakPolarHBondContact CA-O 3.44Å; Q138-F198 PolarHBondContact N-O 3.41Å; A139-F198 PolarHBondContact N-O 2.89Å; A139-F198 WeakPolarHBondContact O-CD2 3.31Å; A139-F198 PolarHBondContact O-N 2.86Å; E141-F198 HydrophobicContact CB-CE2 3.89Å; F191-F198 AromaticContact CD2-CD1 3.5Å; F191-F198 HydrophobicContact CD2-CD1 3.5Å; F191-F198 AromaticContact CD2-CE1 3.59Å; F191-F198 HydrophobicContact CD2-CE1 3.59Å; F191-F198 HydrophobicContact CD2-CG 4.22Å; F191-F198 HydrophobicContact CD2-CZ 4.37Å; F191-F198 AromaticContact CE2-CD1 3.6Å; F191-F198 HydrophobicContact CE2-CD1 3.6Å; F191-F198 AromaticContact CE2-CE1 3.22Å; F191-F198 HydrophobicContact CE2-CE1 3.22Å; F191-F198 HydrophobicContact CE2-CE2 4.25Å; F191-F198 HydrophobicContact CE2-CG 4.25Å; F191-F198 AromaticContact CE2-CZ 3.6Å; F191-F198 HydrophobicContact CE2-CZ 3.6Å; F191-F198 AromaticContact CZ-CE1 3.94Å; F191-F198 HydrophobicContact CZ-CE1 3.94Å; F191-F198 HydrophobicContact CZ-CZ 4.18Å; F198-M200 VanDerWaalsContact C-N 3.29Å; F198-M200 PolarHBondContact O-N 2.86Å; F198-V201 HydrophobicContact CB-CG2 3.49Å; F198-V201 VanDerWaalsContact CB-CG2 3.49Å; F198-V201 HydrophobicContact CD2-CG2 4.44Å; F198-V201 HydrophobicContact CG-CG2 4.08Å; F198-L220 HydrophobicContact CD1-CB 4.39Å; F198-L220 HydrophobicContact CD1-CD1 4Å; F198-L220 HydrophobicContact CD1-CD2 3.93Å; F198-L220 HydrophobicContact CD1-CG 4.32Å; F198-L220 HydrophobicContact CE1-CD1 3.56Å; F198-L220 HydrophobicContact CE1-CD2 4.19Å; F198-L220 HydrophobicContact CE1-CG 4.36Å; F198-L220 HydrophobicContact CG-CD2 4.14Å; F198-L220 HydrophobicContact CZ-CD1 4.16Å
199	P	97.4	Very high	93.5	Very high	0 Å²	0	42 Å²	42	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60	-37.3	-179.6	-27.6	35.9	0	0	0	113.4	Y137 Q138 W184 L189 L190 T222 F223	Y137-P199 VanDerWaalsContact CA-O 3.31Å; Y137-P199 WeakPolarHBondContact CA-O 3.46Å; Q138-P199 PolarHBondContact N-O 3.26Å; W184-P199 HydrophobicContact CZ3-CB 4.42Å; L189-P199 WeakPolarHBondContact O-CG 3.26Å; L190-P199 WeakPolarHBondContact O-CG 3.43Å; P199-T222 HydrophobicContact CG-CG2 4.27Å; P199-F223 HydrophobicContact CB-CD2 4.02Å; P199-F223 HydrophobicContact CB-CE2 4.15Å
200	M	98.2	Very high	93.1	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	140	169.1	-164.9	-179.6	73.9	0	0	111.9	L95 V121 I135 Y136 Y137 F198 V202 A221 F223 V233	L95-M200 HydrophobicContact CD1-CE 4.2Å; L95-M200 HydrophobicContact CD2-CE 4.01Å; V121-M200 HydrophobicContact CG1-CE 4.25Å; V121-M200 HydrophobicContact CG1-SD 4.28Å; V121-M200 HydrophobicContact CG2-SD 3.83Å; I135-M200 HydrophobicContact CG2-CG 3.68Å; I135-M200 HydrophobicContact CG2-SD 3.94Å; Y136-M200 CarbonylContact O-C 3.57Å; Y136-M200 WeakPolarHBondContact O-CA 3.39Å; Y137-M200 HydrophobicContact CD1-CB 4.24Å; Y137-M200 HydrophobicContact CD1-CG 3.92Å; Y137-M200 HydrophobicContact CD1-SD 4.5Å; Y137-M200 HydrophobicContact CE1-CB 4.46Å; Y137-M200 HydrophobicContact CE1-CG 3.76Å; Y137-M200 HydrophobicContact CE1-SD 3.79Å; F198-M200 VanDerWaalsContact C-N 3.29Å; F198-M200 PolarHBondContact O-N 2.86Å; M200-V202 HydrophobicContact CE-CG2 4.12Å; M200-A221 HydrophobicContact CB-CB 4.44Å; M200-A221 HydrophobicContact CE-CB 3.87Å; M200-A221 PolarHBondContact N-O 2.85Å; M200-A221 PolarHBondContact O-N 2.88Å; M200-F223 HydrophobicContact CB-CE1 4.44Å; M200-F223 HydrophobicContact CB-CE2 3.97Å; M200-F223 HydrophobicContact CB-CZ 3.62Å; M200-F223 HydrophobicContact CG-CZ 4.11Å; M200-F223 HydrophobicContact SD-CE1 4.09Å; M200-F223 HydrophobicContact SD-CZ 3.79Å; M200-V233 HydrophobicContact CE-CG2 3.68Å
201	V	98.6	Very high	92.7	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	124.8	171.9	-177.4	0	0	0	0	108.8	I135 Y136 Y150 F198 I218 L220	I135-V201 CarbonylContact C-O 3.6Å; I135-V201 WeakPolarHBondContact CA-O 3.23Å; Y136-V201 PolarHBondContact N-O 2.88Å; Y136-V201 PolarHBondContact O-N 2.9Å; Y150-V201 HydrophobicContact CD1-CB 4.25Å; Y150-V201 HydrophobicContact CD1-CG1 3.87Å; Y150-V201 HydrophobicContact CD1-CG2 3.86Å; Y150-V201 HydrophobicContact CD2-CG1 3.85Å; Y150-V201 HydrophobicContact CE1-CG1 3.85Å; Y150-V201 HydrophobicContact CE1-CG2 4.1Å; Y150-V201 HydrophobicContact CE2-CG1 3.89Å; Y150-V201 HydrophobicContact CG-CB 4.36Å; Y150-V201 HydrophobicContact CG-CG1 3.87Å; Y150-V201 HydrophobicContact CG-CG2 4.43Å; F198-V201 HydrophobicContact CB-CG2 3.49Å; F198-V201 VanDerWaalsContact CB-CG2 3.49Å; F198-V201 HydrophobicContact CD2-CG2 4.44Å; F198-V201 HydrophobicContact CG-CG2 4.08Å; V201-I218 HydrophobicContact CG1-CG2 3.56Å; V201-L220 HydrophobicContact CB-CD2 4.4Å; V201-L220 HydrophobicContact CG1-CD2 3.98Å; V201-L220 HydrophobicContact CG2-CD2 3.75Å
202	V	98.7	Very high	92.5	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	116.9	164.7	-177.3	0	0	0	0	107.7	I90 F123 I133 I135 M200 I218 L219	I90-V202 HydrophobicContact CD1-CB 4.43Å; I90-V202 HydrophobicContact CD1-CG1 3.87Å; F123-V202 HydrophobicContact CE1-CG1 3.7Å; F123-V202 HydrophobicContact CE1-CG2 4.08Å; F123-V202 HydrophobicContact CE2-CG1 4.21Å; F123-V202 HydrophobicContact CZ-CG1 3.42Å; F123-V202 VanDerWaalsContact CZ-CG1 3.42Å; I133-V202 HydrophobicContact CG2-CG1 4.17Å; I135-V202 HydrophobicContact CD1-CG2 4.42Å; I135-V202 HydrophobicContact CG1-CG2 4.25Å; I135-V202 HydrophobicContact CG2-CG2 4.44Å; M200-V202 HydrophobicContact CE-CG2 4.12Å; V202-I218 WeakPolarHBondContact O-CA 3.41Å; V202-L219 HydrophobicContact CB-CB 4.32Å; V202-L219 PolarHBondContact N-O 2.95Å; V202-L219 PolarHBondContact O-N 3.5Å
203	Q	98.4	Very high	92.4	Very high	16 Å²	16	54.3 Å²	54.3	8%	0.075	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	122.8	174.6	-173.6	176.2	26.1	0	0	109.6	I133 T134 Y136 P148 Y150 V205 I218	I133-Q203 WeakPolarHBondContact CA-O 3.43Å; T134-Q203 PolarHBondContact N-O 3Å; T134-Q203 PolarHBondContact O-N 2.8Å; Y136-Q203 HydrophobicContact CD2-CB 4.48Å; Y136-Q203 HydrophobicContact CE2-CB 4.08Å; P148-Q203 PolarHBondContact O-NE2 2.98Å; Y150-Q203 HydrophobicContact CD2-CB 4.33Å; Y150-Q203 HydrophobicContact CD2-CG 4.46Å; Y150-Q203 HydrophobicContact CE2-CG 4.42Å; Q203-V205 HydrophobicContact CG-CG1 3.76Å; Q203-I218 HydrophobicContact CG-CG1 4.26Å
204	A	98.3	Very high	92.7	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	115.2	173.4	0	0	0	0	0	109.1	I88 I90 V131 A132 I133 S216 H217	I88-A204 HydrophobicContact CD1-CB 4.5Å; I88-A204 WeakPolarHBondContact CD1-O 3.22Å; I88-A204 HydrophobicContact CG2-CB 3.82Å; I90-A204 HydrophobicContact CD1-CB 4.13Å; V131-A204 HydrophobicContact CG2-CB 3.92Å; A132-A204 CarbonylContact O-C 3.57Å; A132-A204 WeakPolarHBondContact O-CA 3.34Å; I133-A204 HydrophobicContact CD1-CB 4.27Å; I133-A204 HydrophobicContact CG1-CB 3.87Å; A204-S216 CarbonylContact O-C 3.6Å; A204-S216 WeakPolarHBondContact O-CA 3.4Å; A204-S216 WeakPolarHBondContact O-CB 3.22Å; A204-H217 PolarHBondContact N-O 3.25Å; A204-H217 PolarHBondContact O-N 2.82Å
205	V	97.4	Very high	93.1	Very high	46 Å²	46	45.9 Å²	45.9	28%	0.279	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	146.5	-175.6	-51.6	0	0	0	0	111.3	V131 A132 Q203 D207	V131-V205 WeakPolarHBondContact CA-O 3.44Å; V131-V205 WeakPolarHBondContact CG2-O 3.26Å; A132-V205 HydrophobicContact CB-CG2 3.92Å; A132-V205 PolarHBondContact N-O 3.18Å; A132-V205 PolarHBondContact O-N 2.87Å; Q203-V205 HydrophobicContact CG-CG1 3.76Å; V205-D207 PolarHBondContact O-N 2.67Å
206	V	96.8	Very high	93.6	Very high	11 Å²	11	39.5 Å²	39.5	7%	0.067	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	129.2	174.2	176.5	0	0	0	0	110.2	L87 I88 T129 H212 H215	L87-V206 HydrophobicContact CB-CG2 4.25Å; L87-V206 HydrophobicContact CD1-CG2 4.08Å; I88-V206 HydrophobicContact CD1-CG2 3.73Å; I88-V206 HydrophobicContact CG1-CG2 4.32Å; T129-V206 HydrophobicContact CG2-CB 4.31Å; T129-V206 HydrophobicContact CG2-CG1 3.8Å; T129-V206 HydrophobicContact CG2-CG2 3.75Å; V206-H212 HydrophobicContact CG1-CB 4.07Å; V206-H215 HydrophobicContact CB-CB 4.35Å; V206-H215 HydrophobicContact CG2-CB 3.7Å; V206-H215 PolarHBondContact N-O 3.46Å
207	D	94.5	Very high	94	Very high	64 Å²	64	37.6 Å²	37.6	34%	0.342	21%	0.205	S	C	.	.			trans	-124.1	43	-179.1	-179.2	51.9	0	0	0	109.8	Q130 A132 H163 V205	Q130-D207 HydrophobicContact CG-CB 4.25Å; Q130-D207 WeakPolarHBondContact CG-O 3.34Å; Q130-D207 PolarHBondContact NE2-O 2.97Å; Q130-D207 PolarHBondContact NE2-OD2 2.78Å; Q130-D207 PolarHBondContact O-N 2.98Å; A132-D207 HydrophobicContact CB-CB 3.98Å; H163-D207 IonicContact CD2-OD2 2.72Å; H163-D207 PolarHBondContact CD2-OD2 2.66Å; V205-D207 PolarHBondContact O-N 2.67Å
208	E	89.8	Confident	94.3	Very high	107 Å²	107	36.8 Å²	36.8	50%	0.5	20%	0.201	S	C	.	.	S	Bend	trans	-142.3	99.5	176.2	-142.6	180	144.9	0	0	111.9	T129 Q130	T129-E208 VanDerWaalsContact OG1-CB 3.22Å; T129-E208 WeakPolarHBondContact OG1-CB 3.46Å; T129-E208 PolarHBondContact OG1-OE2 3.37Å; Q130-E208 HydrophobicContact CB-CB 3.98Å; Q130-E208 HydrophobicContact CB-CG 4.09Å; Q130-E208 WeakPolarHBondContact CB-OE2 3.45Å; Q130-E208 PolarHBondContact N-OE2 2.95Å
209	G	86.2	Confident	94.4	Very high	57 Å²	57	36.6 Å²	36.6	59%	0.588	20%	0.2	S	C	*	.			trans	70.2	-177.8	172	0	0	0	0	0	116
210	E	86.7	Confident	94.4	Very high	160 Å²	160	36.6 Å²	36.6	75%	0.748	20%	0.2	S	C	*	.	S	Bend	trans	-92.1	-16.1	-173.6	-55.7	-68.7	150.5	0	0	113.5	H212	E210-H212 PolarHBondContact O-N 2.85Å
211	E	87.5	Confident	94.4	Very high	144 Å²	144	36.6 Å²	36.6	67%	0.673	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-29	-175	-167	-173.5	134	0	0	112.5	R85	R85-E211 IonicContact CZ-OE1 2.65Å; R85-E211 IonicContact NH1-OE1 2.66Å; R85-E211 PolarHBondContact NH1-OE1 2.94Å
212	H	89.5	Confident	94.4	Very high	18 Å²	18	37.4 Å²	37.4	8%	0.083	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-129.4	24	-172.8	-57.4	-41.5	0	0	0	112.6	R85 L87 V206 E210 G214 H215	R85-H212 VanDerWaalsContact CZ-CE1 3.49Å; R85-H212 PolarHBondContact NH1-CE1 2.88Å; R85-H212 PolarHBondContact NH1-NE2 2.93Å; R85-H212 VanDerWaalsContact NH1-NE2 3.13Å; R85-H212 PolarHBondContact NH2-NE2 2.59Å; L87-H212 HydrophobicContact CD1-CB 3.63Å; L87-H212 VanDerWaalsContact CD1-CD2 3.4Å; L87-H212 WeakPolarHBondContact CD1-CD2 3.22Å; V206-H212 HydrophobicContact CG1-CB 4.07Å; E210-H212 PolarHBondContact O-N 2.85Å; H212-G214 PolarHBondContact O-N 3.24Å; H212-H215 HydrophobicContact CB-CB 4.27Å; H212-H215 AromaticContact ND1-CE1 3.5Å; H212-H215 AromaticContact ND1-ND1 3.97Å; H212-H215 AromaticContact ND1-NE2 3.99Å; H212-H215 WeakPolarHBondContact O-CB 3.43Å; H212-H215 PolarHBondContact O-CD2 3.46Å; H212-H215 PolarHBondContact O-N 3.45Å
213	L	88.1	Confident	94.3	Very high	121 Å²	121	37.4 Å²	37.4	63%	0.634	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59	129.8	-179	-171.7	67.5	0	0	0	110.7	H215	L213-H215 VanDerWaalsContact C-N 3.28Å; L213-H215 PolarHBondContact O-N 2.89Å
214	G	88.9	Confident	94.2	Very high	18 Å²	18	40.2 Å²	40.2	19%	0.186	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	81.4	-4.8	-176.1	0	0	0	0	0	115.3	H212 S216	H212-G214 PolarHBondContact O-N 3.24Å; G214-S216 PolarHBondContact O-N 2.89Å
215	H	95.2	Very high	94	Very high	5 Å²	5	44.8 Å²	44.8	2%	0.023	24%	0.238	C	C	.	.			trans	-63	132.5	166.6	-72.4	-148.8	0	0	0	109	V206 H212 L213 V241 D243	V206-H215 HydrophobicContact CB-CB 4.35Å; V206-H215 HydrophobicContact CG2-CB 3.7Å; V206-H215 PolarHBondContact N-O 3.46Å; H212-H215 HydrophobicContact CB-CB 4.27Å; H212-H215 AromaticContact ND1-CE1 3.5Å; H212-H215 AromaticContact ND1-ND1 3.97Å; H212-H215 AromaticContact ND1-NE2 3.99Å; H212-H215 WeakPolarHBondContact O-CB 3.43Å; H212-H215 PolarHBondContact O-CD2 3.46Å; H212-H215 PolarHBondContact O-N 3.45Å; L213-H215 VanDerWaalsContact C-N 3.28Å; L213-H215 PolarHBondContact O-N 2.89Å; H215-V241 WeakPolarHBondContact CA-O 3.45Å; H215-D243 IonicContact CD2-OD1 3.71Å; H215-D243 IonicContact CE1-OD1 3.28Å; H215-D243 PolarHBondContact CE1-OD1 3.16Å; H215-D243 PolarHBondContact NE2-N 3.4Å; H215-D243 IonicContact NE2-OD1 2.6Å; H215-D243 PolarHBondContact NE2-OD1 3.24Å
216	S	96.8	Very high	93.8	Very high	1 Å²	1	46.5 Å²	46.5	1%	0.007	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.2	157.1	-177.4	52.6	0	0	0	0	113	A204 G214 Q240 V241	A204-S216 CarbonylContact O-C 3.6Å; A204-S216 WeakPolarHBondContact O-CA 3.4Å; A204-S216 WeakPolarHBondContact O-CB 3.22Å; G214-S216 PolarHBondContact O-N 2.89Å; S216-Q240 PolarHBondContact O-NE2 2.78Å; S216-V241 PolarHBondContact N-O 2.96Å; S216-V241 PolarHBondContact O-N 3.19Å; S216-V241 WeakPolarHBondContact OG-CB 3.42Å
217	H	98.2	Very high	93.6	Very high	0 Å²	0	55.8 Å²	55.8	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	132.3	169.3	-164.8	117.6	0	0	0	108.5	I88 I90 A204 Q238 Q240	I88-H217 HydrophobicContact CB-CB 3.99Å; I88-H217 HydrophobicContact CG2-CB 3.84Å; I88-H217 WeakPolarHBondContact O-CB 3.45Å; I88-H217 PolarHBondContact O-ND1 3.23Å; I90-H217 HydrophobicContact CD1-CB 4.45Å; I90-H217 HydrophobicContact CG1-CB 4.35Å; A204-H217 PolarHBondContact N-O 3.25Å; A204-H217 PolarHBondContact O-N 2.82Å; H217-Q238 PolarHBondContact NE2-NE2 2.6Å; H217-Q240 PolarHBondContact ND1-OE1 3.32Å
218	I	98.3	Very high	93.3	Very high	0 Å²	0	58.8 Å²	58.8	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	131.4	178.8	-56.2	89	0	0	0	109.3	P148 Y150 V201 V202 Q203 L220 Q238 K239 V241	P148-I218 HydrophobicContact CG-CD1 3.82Å; P148-I218 HydrophobicContact CG-CG1 4.42Å; Y150-I218 HydrophobicContact CE2-CG1 3.97Å; Y150-I218 HydrophobicContact CE2-CG2 4.1Å; Y150-I218 WeakPolarHBondContact OH-CG2 3.39Å; V201-I218 HydrophobicContact CG1-CG2 3.56Å; V202-I218 WeakPolarHBondContact O-CA 3.41Å; Q203-I218 HydrophobicContact CG-CG1 4.26Å; I218-L220 HydrophobicContact CG2-CD2 3.84Å; I218-L220 HydrophobicContact CG2-CG 4.34Å; I218-Q238 CarbonylContact O-C 3.47Å; I218-Q238 VanDerWaalsContact O-CA 3.27Å; I218-Q238 WeakPolarHBondContact O-CA 3.38Å; I218-K239 HydrophobicContact CB-CB 4.22Å; I218-K239 HydrophobicContact CD1-CB 4.24Å; I218-K239 PolarHBondContact N-O 2.87Å; I218-K239 PolarHBondContact O-N 2.86Å; I218-V241 HydrophobicContact CD1-CG2 3.55Å
219	L	98.5	Very high	93.2	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	109.5	168.3	170.7	53.9	0	0	0	108.9	I90 K92 L95 V202 P235 Q238	I90-L219 HydrophobicContact CD1-CB 4.21Å; I90-L219 HydrophobicContact CG2-CB 4.35Å; I90-L219 HydrophobicContact CG2-CD2 3.63Å; K92-L219 HydrophobicContact CB-CD1 3.93Å; K92-L219 HydrophobicContact CB-CD2 3.92Å; L95-L219 HydrophobicContact CB-CD2 4.42Å; L95-L219 HydrophobicContact CD2-CD2 3.89Å; L95-L219 HydrophobicContact CD2-CG 4.37Å; V202-L219 HydrophobicContact CB-CB 4.32Å; V202-L219 PolarHBondContact N-O 2.95Å; V202-L219 PolarHBondContact O-N 3.5Å; L219-P235 HydrophobicContact CD1-CB 3.93Å; L219-Q238 HydrophobicContact CB-CG 4.42Å; L219-Q238 HydrophobicContact CD1-CG 3.73Å
220	L	98.1	Very high	93.5	Very high	0 Å²	0	54.1 Å²	54.1	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	138.2	172.5	-55.1	176.4	0	0	0	108.9	F62 Y150 F198 V201 I218 L236 K237 K239	F62-L220 HydrophobicContact CD1-CD1 3.81Å; F62-L220 HydrophobicContact CE1-CD1 4.47Å; Y150-L220 HydrophobicContact CE1-CD2 4.26Å; F198-L220 HydrophobicContact CD1-CB 4.39Å; F198-L220 HydrophobicContact CD1-CD1 4Å; F198-L220 HydrophobicContact CD1-CD2 3.93Å; F198-L220 HydrophobicContact CD1-CG 4.32Å; F198-L220 HydrophobicContact CE1-CD1 3.56Å; F198-L220 HydrophobicContact CE1-CD2 4.19Å; F198-L220 HydrophobicContact CE1-CG 4.36Å; F198-L220 HydrophobicContact CG-CD2 4.14Å; F198-L220 HydrophobicContact CZ-CD1 4.16Å; V201-L220 HydrophobicContact CB-CD2 4.4Å; V201-L220 HydrophobicContact CG1-CD2 3.98Å; V201-L220 HydrophobicContact CG2-CD2 3.75Å; I218-L220 HydrophobicContact CG2-CD2 3.84Å; I218-L220 HydrophobicContact CG2-CG 4.34Å; L220-L236 HydrophobicContact CB-CB 4.44Å; L220-L236 WeakPolarHBondContact O-CB 3.32Å; L220-L236 PolarHBondContact O-N 3.5Å; L220-K237 HydrophobicContact CD1-CB 4.19Å; L220-K237 PolarHBondContact N-O 3.37Å; L220-K237 PolarHBondContact O-N 2.95Å; L220-K239 VanDerWaalsContact CD1-CE 3.49Å
221	A	98.3	Very high	93.9	Very high	1 Å²	1	47.3 Å²	47.3	1%	0.008	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	157.7	-178.4	0	0	0	0	0	113.3	L95 M200 V233 K234	L95-A221 HydrophobicContact CD2-CB 4.13Å; M200-A221 HydrophobicContact CB-CB 4.44Å; M200-A221 HydrophobicContact CE-CB 3.87Å; M200-A221 PolarHBondContact N-O 2.85Å; M200-A221 PolarHBondContact O-N 2.88Å; A221-V233 HydrophobicContact CB-CG2 3.84Å; A221-K234 VanDerWaalsContact CA-O 3.23Å; A221-K234 WeakPolarHBondContact CA-O 3.34Å; A221-K234 VanDerWaalsContact CB-O 3.31Å; A221-K234 WeakPolarHBondContact CB-O 3.14Å
222	T	97.8	Very high	94.2	Very high	16 Å²	16	42 Å²	42	10%	0.098	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	169.5	170.9	61.8	0	0	0	0	110	L189 F191 P199 V233 K234 L236	L189-T222 WeakPolarHBondContact O-CB 3.44Å; F191-T222 HydrophobicContact CB-CG2 4.05Å; P199-T222 HydrophobicContact CG-CG2 4.27Å; T222-V233 WeakPolarHBondContact O-CA 3.48Å; T222-K234 PolarHBondContact N-O 3.3Å; T222-K234 PolarHBondContact O-N 2.93Å; T222-L236 HydrophobicContact CG2-CD2 4.17Å
223	F	97.6	Very high	94.6	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	150.6	173.2	-58.2	-65.4	0	0	0	110.8	L97 Y137 L181 W184 L189 P199 M200 C232 V233	L97-F223 HydrophobicContact CD1-CD1 4.03Å; L97-F223 HydrophobicContact CD1-CE1 4.21Å; L97-F223 HydrophobicContact CD2-CE1 4.11Å; Y137-F223 HydrophobicContact CD1-CE2 4.34Å; Y137-F223 HydrophobicContact CD1-CZ 4.15Å; Y137-F223 HydrophobicContact CE1-CZ 4.06Å; L181-F223 HydrophobicContact CD1-CB 4.27Å; L181-F223 HydrophobicContact CD1-CD1 3.69Å; L181-F223 HydrophobicContact CD1-CD2 4.28Å; L181-F223 HydrophobicContact CD1-CE1 4.05Å; L181-F223 HydrophobicContact CD1-CG 3.8Å; L181-F223 HydrophobicContact CD1-CZ 4.47Å; L181-F223 HydrophobicContact CD2-CD1 4.45Å; L181-F223 HydrophobicContact CD2-CD2 3.64Å; L181-F223 HydrophobicContact CD2-CE1 4.47Å; L181-F223 HydrophobicContact CD2-CE2 3.67Å; L181-F223 HydrophobicContact CD2-CG 4.04Å; L181-F223 HydrophobicContact CD2-CZ 4.08Å; W184-F223 HydrophobicContact CE3-CD2 4.46Å; W184-F223 HydrophobicContact CH2-CD2 4.44Å; W184-F223 AromaticContact CH2-CE2 3.84Å; W184-F223 HydrophobicContact CH2-CE2 3.84Å; W184-F223 AromaticContact CZ3-CD2 3.73Å; W184-F223 HydrophobicContact CZ3-CD2 3.73Å; W184-F223 AromaticContact CZ3-CE2 3.58Å; W184-F223 HydrophobicContact CZ3-CE2 3.58Å; L189-F223 HydrophobicContact CB-CB 4.11Å; L189-F223 HydrophobicContact CD2-CB 3.92Å; L189-F223 HydrophobicContact CD2-CD2 4.41Å; L189-F223 PolarHBondContact O-N 3.07Å; P199-F223 HydrophobicContact CB-CD2 4.02Å; P199-F223 HydrophobicContact CB-CE2 4.15Å; M200-F223 HydrophobicContact CB-CE1 4.44Å; M200-F223 HydrophobicContact CB-CE2 3.97Å; M200-F223 HydrophobicContact CB-CZ 3.62Å; M200-F223 HydrophobicContact CG-CZ 4.11Å; M200-F223 HydrophobicContact SD-CE1 4.09Å; M200-F223 HydrophobicContact SD-CZ 3.79Å; F223-C232 WeakPolarHBondContact CA-O 3.19Å; F223-V233 HydrophobicContact CD1-CB 3.97Å; F223-V233 HydrophobicContact CD1-CG2 4.07Å; F223-V233 HydrophobicContact CE1-CB 4.04Å; F223-V233 HydrophobicContact CE1-CG2 3.88Å
224	E	95.7	Very high	95	Very high	76 Å²	76	40.1 Å²	40.1	36%	0.355	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	137.5	168.2	-85.5	-174.8	-158.7	0	0	110.6	Y231 C232 K234	E224-Y231 CarbonylContact O-C 3.54Å; E224-Y231 VanDerWaalsContact O-CA 3.32Å; E224-Y231 WeakPolarHBondContact O-CA 3.16Å; E224-C232 PolarHBondContact N-O 3Å; E224-C232 PolarHBondContact O-N 2.97Å; E224-K234 HydrophobicContact CG-CD 4.38Å; E224-K234 WeakPolarHBondContact OE1-CD 3.33Å; E224-K234 VanDerWaalsContact OE1-CE 3.29Å; E224-K234 WeakPolarHBondContact OE1-CE 3.17Å; E224-K234 IonicContact OE1-NZ 2.67Å; E224-K234 PolarHBondContact OE1-NZ 3.18Å; E224-K234 WeakPolarHBondContact OE2-CE 3.48Å; E224-K234 IonicContact OE2-NZ 2.68Å; E224-K234 PolarHBondContact OE2-NZ 3.43Å
225	K	94.6	Very high	95.4	Very high	96 Å²	96	41.7 Å²	41.7	42%	0.417	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	116.9	-177.2	-177.3	-179.3	-177.3	-176.9	0	109.2	D186 L189 Y231	D186-K225 WeakPolarHBondContact OD1-CD 3.31Å; D186-K225 WeakPolarHBondContact OD1-CE 3.4Å; D186-K225 IonicContact OD1-NZ 2.59Å; D186-K225 PolarHBondContact OD1-NZ 2.67Å; D186-K225 IonicContact OD2-NZ 2.84Å; D186-K225 PolarHBondContact OD2-NZ 3.42Å; L189-K225 HydrophobicContact CD1-CB 3.97Å; L189-K225 HydrophobicContact CD1-CD 4.25Å; K225-Y231 HydrophobicContact CB-CD1 4.15Å; K225-Y231 HydrophobicContact CB-CE1 3.95Å; K225-Y231 HydrophobicContact CD-CE1 4.16Å; K225-Y231 HydrophobicContact CG-CD1 4.46Å; K225-Y231 HydrophobicContact CG-CE1 3.95Å; K225-Y231 HydrophobicContact CG-CE2 4.38Å
226	H	92.6	Very high	95.4	Very high	82 Å²	82	44.2 Å²	44.2	38%	0.38	23%	0.234	S	C	.	.			trans	-81.4	162.1	-179.5	-64.4	-58	0	0	0	111.9	D228 G229 S230 C232	H226-D228 VanDerWaalsContact CB-OD1 3.24Å; H226-D228 WeakPolarHBondContact CB-OD1 3.38Å; H226-D228 PolarHBondContact O-N 2.91Å; H226-D228 VanDerWaalsContact O-N 3.14Å; H226-G229 PolarHBondContact O-N 3.29Å; H226-S230 PolarHBondContact CD2-OG 3.34Å; H226-S230 PolarHBondContact N-O 3.33Å; H226-C232 WeakPolarHBondContact NE2-CB 3.19Å; H226-C232 PolarHBondContact NE2-SG 2.8Å
227	M	92	Very high	95.3	Very high	205 Å²	205	46.3 Å²	46.3	100%	1.01	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.1	-16.5	-176.6	-64.5	-179.1	68.6	0	0	114.3
228	D	89.6	Confident	95.2	Very high	127 Å²	127	47.3 Å²	47.3	68%	0.679	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.9	-2	174.4	69.3	-19.4	0	0	0	113.3	H226 S230	H226-D228 VanDerWaalsContact CB-OD1 3.24Å; H226-D228 WeakPolarHBondContact CB-OD1 3.38Å; H226-D228 PolarHBondContact O-N 2.91Å; H226-D228 VanDerWaalsContact O-N 3.14Å; D228-S230 VanDerWaalsContact C-N 3.34Å; D228-S230 VanDerWaalsContact CG-OG 3.29Å; D228-S230 VanDerWaalsContact OD1-CB 3.3Å; D228-S230 WeakPolarHBondContact OD1-CB 3.31Å; D228-S230 PolarHBondContact OD1-N 2.68Å; D228-S230 PolarHBondContact OD1-OG 3.43Å; D228-S230 PolarHBondContact OD2-OG 3.03Å
229	G	87.3	Confident	95.1	Very high	38 Å²	38	47.3 Å²	47.3	39%	0.392	25%	0.248	S	C	.	.	S	Bend	trans	80.7	9.2	-174.8	0	0	0	0	0	114.4	H226	H226-G229 PolarHBondContact O-N 3.29Å
230	S	91.6	Very high	95	Very high	28 Å²	28	47.7 Å²	47.7	20%	0.196	25%	0.25	C	C	.	.			trans	-79.6	162.9	165.7	71.3	0	0	0	0	111.2	H226 D228	H226-S230 PolarHBondContact CD2-OG 3.34Å; H226-S230 PolarHBondContact N-O 3.33Å; D228-S230 VanDerWaalsContact C-N 3.34Å; D228-S230 VanDerWaalsContact CG-OG 3.29Å; D228-S230 VanDerWaalsContact OD1-CB 3.3Å; D228-S230 WeakPolarHBondContact OD1-CB 3.31Å; D228-S230 PolarHBondContact OD1-N 2.68Å; D228-S230 PolarHBondContact OD1-OG 3.43Å; D228-S230 PolarHBondContact OD2-OG 3.03Å
231	Y	95.4	Very high	94.8	Very high	18 Å²	18	47.7 Å²	47.7	7%	0.071	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	141.6	179.4	-67.9	-109	0	0	0	109.7	Y119 L181 L189 E224 K225	Y119-Y231 AromaticContact CE2-CD2 3.91Å; Y119-Y231 HydrophobicContact CE2-CD2 3.91Å; Y119-Y231 HydrophobicContact CE2-CG 4.22Å; Y119-Y231 PolarHBondContact OH-N 2.82Å; Y119-Y231 VanDerWaalsContact OH-N 3.12Å; L181-Y231 HydrophobicContact CB-CD1 3.55Å; L181-Y231 HydrophobicContact CB-CD2 4.32Å; L181-Y231 HydrophobicContact CB-CE1 3.55Å; L181-Y231 HydrophobicContact CB-CE2 4.36Å; L181-Y231 HydrophobicContact CB-CG 3.95Å; L181-Y231 HydrophobicContact CD1-CD1 3.8Å; L181-Y231 HydrophobicContact CD1-CG 3.95Å; L181-Y231 HydrophobicContact CG-CD1 4.32Å; L181-Y231 WeakPolarHBondContact O-CE1 3.43Å; L181-Y231 VanDerWaalsContact O-CZ 3.3Å; L181-Y231 PolarHBondContact O-OH 3.07Å; L189-Y231 HydrophobicContact CD1-CD1 4.39Å; L189-Y231 HydrophobicContact CD1-CE1 3.82Å; L189-Y231 HydrophobicContact CD2-CD1 4.19Å; L189-Y231 HydrophobicContact CD2-CE1 3.82Å; E224-Y231 CarbonylContact O-C 3.54Å; E224-Y231 VanDerWaalsContact O-CA 3.32Å; E224-Y231 WeakPolarHBondContact O-CA 3.16Å; K225-Y231 HydrophobicContact CB-CD1 4.15Å; K225-Y231 HydrophobicContact CB-CE1 3.95Å; K225-Y231 HydrophobicContact CD-CE1 4.16Å; K225-Y231 HydrophobicContact CG-CD1 4.46Å; K225-Y231 HydrophobicContact CG-CE1 3.95Å; K225-Y231 HydrophobicContact CG-CE2 4.38Å
232	C	94.9	Very high	94.5	Very high	33 Å²	33	47.7 Å²	47.7	22%	0.223	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	167.9	164.2	73	0	0	0	0	110.7	F223 E224 H226	F223-C232 WeakPolarHBondContact CA-O 3.19Å; E224-C232 PolarHBondContact N-O 3Å; E224-C232 PolarHBondContact O-N 2.97Å; H226-C232 WeakPolarHBondContact NE2-CB 3.19Å; H226-C232 PolarHBondContact NE2-SG 2.8Å
233	V	97.7	Very high	94.1	Very high	13 Å²	13	50.6 Å²	50.6	8%	0.079	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	141.7	175	59.6	0	0	0	0	108.9	L95 L97 M200 A221 T222 F223	L95-V233 HydrophobicContact CD2-CG1 4.17Å; L95-V233 HydrophobicContact CD2-CG2 3.75Å; L95-V233 HydrophobicContact CG-CG1 3.88Å; L95-V233 HydrophobicContact CG-CG2 4.32Å; L97-V233 HydrophobicContact CD1-CB 4.39Å; L97-V233 HydrophobicContact CD2-CB 4.26Å; L97-V233 HydrophobicContact CD2-CG1 4.31Å; L97-V233 HydrophobicContact CG-CB 3.92Å; L97-V233 HydrophobicContact CG-CG1 3.92Å; M200-V233 HydrophobicContact CE-CG2 3.68Å; A221-V233 HydrophobicContact CB-CG2 3.84Å; T222-V233 WeakPolarHBondContact O-CA 3.48Å; F223-V233 HydrophobicContact CD1-CB 3.97Å; F223-V233 HydrophobicContact CD1-CG2 4.07Å; F223-V233 HydrophobicContact CE1-CB 4.04Å; F223-V233 HydrophobicContact CE1-CG2 3.88Å
234	K	97.1	Very high	93.5	Very high	86 Å²	86	51.7 Å²	51.7	37%	0.374	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	122.9	177.4	-71.7	-166.4	179.1	174.5	0	111.3	A221 T222 E224 L236	A221-K234 VanDerWaalsContact CA-O 3.23Å; A221-K234 WeakPolarHBondContact CA-O 3.34Å; A221-K234 VanDerWaalsContact CB-O 3.31Å; A221-K234 WeakPolarHBondContact CB-O 3.14Å; T222-K234 PolarHBondContact N-O 3.3Å; T222-K234 PolarHBondContact O-N 2.93Å; E224-K234 HydrophobicContact CG-CD 4.38Å; E224-K234 WeakPolarHBondContact OE1-CD 3.33Å; E224-K234 VanDerWaalsContact OE1-CE 3.29Å; E224-K234 WeakPolarHBondContact OE1-CE 3.17Å; E224-K234 IonicContact OE1-NZ 2.67Å; E224-K234 PolarHBondContact OE1-NZ 3.18Å; E224-K234 WeakPolarHBondContact OE2-CE 3.48Å; E224-K234 IonicContact OE2-NZ 2.68Å; E224-K234 PolarHBondContact OE2-NZ 3.43Å; K234-L236 PolarHBondContact O-N 3.39Å
235	P	96.5	Very high	93.2	Very high	50 Å²	50	49 Å²	49	33%	0.325	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-52.8	123.4	164.4	-28.4	36.7	0	0	0	111.8	K92 L95 L219	K92-P235 HydrophobicContact CB-CB 3.98Å; K92-P235 HydrophobicContact CB-CG 3.87Å; K92-P235 HydrophobicContact CD-CB 3.89Å; K92-P235 HydrophobicContact CD-CG 4.39Å; K92-P235 HydrophobicContact CG-CB 4.48Å; K92-P235 VanDerWaalsContact O-CG 3.22Å; K92-P235 WeakPolarHBondContact O-CG 3.47Å; L95-P235 HydrophobicContact CD2-CG 4.25Å; L219-P235 HydrophobicContact CD1-CB 3.93Å
236	L	94.4	Very high	93	Very high	58 Å²	58	45.6 Å²	45.6	30%	0.304	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	-55.5	177.1	179.6	62.8	0	0	0	110.7	F62 F191 L220 T222 K234	F62-L236 HydrophobicContact CE1-CD2 3.86Å; F62-L236 HydrophobicContact CE1-CG 4.35Å; F62-L236 HydrophobicContact CZ-CD2 4.15Å; F62-L236 HydrophobicContact CZ-CG 4.32Å; F191-L236 HydrophobicContact CB-CD2 3.76Å; F191-L236 HydrophobicContact CD1-CD2 4.39Å; F191-L236 HydrophobicContact CG-CD2 4Å; L220-L236 HydrophobicContact CB-CB 4.44Å; L220-L236 WeakPolarHBondContact O-CB 3.32Å; L220-L236 PolarHBondContact O-N 3.5Å; T222-L236 HydrophobicContact CG2-CD2 4.17Å; K234-L236 PolarHBondContact O-N 3.39Å
237	K	95.4	Very high	93	Very high	46 Å²	46	44.2 Å²	44.2	20%	0.2	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	158.5	177.9	-67.7	-61.3	178	-177.4	0	110.8	D59 F62 L220 L248	D59-K237 WeakPolarHBondContact OD1-CE 3.31Å; D59-K237 IonicContact OD1-NZ 3.43Å; D59-K237 PolarHBondContact OD1-NZ 2.87Å; D59-K237 IonicContact OD2-NZ 2.75Å; D59-K237 PolarHBondContact OD2-NZ 3.15Å; F62-K237 HydrophobicContact CD1-CG 4.21Å; F62-K237 HydrophobicContact CD2-CD 4.34Å; F62-K237 HydrophobicContact CD2-CG 3.76Å; F62-K237 HydrophobicContact CE1-CG 4.3Å; F62-K237 HydrophobicContact CE2-CD 4.41Å; F62-K237 HydrophobicContact CE2-CG 3.87Å; F62-K237 HydrophobicContact CG-CG 3.94Å; F62-K237 HydrophobicContact CZ-CG 4.14Å; L220-K237 HydrophobicContact CD1-CB 4.19Å; L220-K237 PolarHBondContact N-O 3.37Å; L220-K237 PolarHBondContact O-N 2.95Å; K237-L248 HydrophobicContact CB-CD1 4Å; K237-L248 HydrophobicContact CD-CD1 4.38Å; K237-L248 HydrophobicContact CD-CD2 4.35Å; K237-L248 HydrophobicContact CG-CD1 4.24Å
238	Q	96.6	Very high	93	Very high	21 Å²	21	36 Å²	36	10%	0.098	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	140.8	168.1	-72.7	175.4	-85.7	0	0	110.3	I90 K92 H217 I218 L219 L249	I90-Q238 PolarHBondContact O-NE2 3.27Å; K92-Q238 HydrophobicContact CB-CG 4.49Å; H217-Q238 PolarHBondContact NE2-NE2 2.6Å; I218-Q238 CarbonylContact O-C 3.47Å; I218-Q238 VanDerWaalsContact O-CA 3.27Å; I218-Q238 WeakPolarHBondContact O-CA 3.38Å; L219-Q238 HydrophobicContact CB-CG 4.42Å; L219-Q238 HydrophobicContact CD1-CG 3.73Å; Q238-L249 HydrophobicContact CB-CB 3.98Å; Q238-L249 HydrophobicContact CB-CD2 4.09Å; Q238-L249 PolarHBondContact O-N 3.42Å
239	K	95.4	Very high	93.1	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	138.9	172.1	-41.7	-172.1	-166.3	-168.5	0	109.5	F62 E141 I218 L220 Y247 L248	F62-K239 WeakPolarHBondContact O-CE 3.42Å; F62-K239 PolarHBondContact O-NZ 3.39Å; E141-K239 IonicContact OE1-NZ 3.39Å; E141-K239 PolarHBondContact OE1-NZ 3.44Å; E141-K239 IonicContact OE2-NZ 2.81Å; E141-K239 PolarHBondContact OE2-NZ 2.92Å; I218-K239 HydrophobicContact CB-CB 4.22Å; I218-K239 HydrophobicContact CD1-CB 4.24Å; I218-K239 PolarHBondContact N-O 2.87Å; I218-K239 PolarHBondContact O-N 2.86Å; L220-K239 VanDerWaalsContact CD1-CE 3.49Å; K239-Y247 CarbonylContact C-O 3.56Å; K239-Y247 VanDerWaalsContact CA-O 3.32Å; K239-Y247 WeakPolarHBondContact CA-O 3.21Å; K239-L248 HydrophobicContact CG-CD1 4.17Å
240	Q	95.7	Very high	93.3	Very high	7 Å²	7	34 Å²	34	3%	0.033	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	129	167.1	-178.8	70.5	63.1	0	0	107.7	L84 S86 I88 S216 H217 V242 Y247 L249	L84-Q240 HydrophobicContact CD2-CG 4.11Å; S86-Q240 PolarHBondContact OG-OE1 2.81Å; I88-Q240 PolarHBondContact O-OE1 2.89Å; S216-Q240 PolarHBondContact O-NE2 2.78Å; H217-Q240 PolarHBondContact ND1-OE1 3.32Å; Q240-V242 HydrophobicContact CG-CG2 4Å; Q240-Y247 PolarHBondContact N-O 2.88Å; Q240-Y247 WeakPolarHBondContact O-CD2 3.35Å; Q240-Y247 PolarHBondContact O-N 2.83Å; Q240-L249 HydrophobicContact CB-CD1 3.56Å
241	V	94.2	Very high	93.1	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	127.3	175.4	-173	0	0	0	0	108.2	P148 H215 S216 I218 V245	P148-V241 HydrophobicContact CG-CG2 3.8Å; H215-V241 WeakPolarHBondContact CA-O 3.45Å; S216-V241 PolarHBondContact N-O 2.96Å; S216-V241 PolarHBondContact O-N 3.19Å; S216-V241 WeakPolarHBondContact OG-CB 3.42Å; I218-V241 HydrophobicContact CD1-CG2 3.55Å; V241-V245 WeakPolarHBondContact CA-O 3.12Å
242	V	92.3	Very high	92.8	Very high	1 Å²	1	38.5 Å²	38.5	1%	0.006	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147	132.6	179.6	175.2	0	0	0	0	107.6	Y72 L84 Q240 G244 V245 Y247	Y72-V242 VanDerWaalsContact OH-CG1 3.26Å; Y72-V242 WeakPolarHBondContact OH-CG1 3.44Å; L84-V242 HydrophobicContact CD1-CB 3.92Å; L84-V242 HydrophobicContact CD1-CG1 3.82Å; L84-V242 HydrophobicContact CD1-CG2 4.24Å; L84-V242 HydrophobicContact CD2-CB 4.37Å; L84-V242 HydrophobicContact CD2-CG2 4.03Å; L84-V242 HydrophobicContact CG-CB 4.23Å; L84-V242 HydrophobicContact CG-CG1 4.37Å; L84-V242 HydrophobicContact CG-CG2 3.99Å; Q240-V242 HydrophobicContact CG-CG2 4Å; V242-G244 PolarHBondContact O-N 2.69Å; V242-G244 VanDerWaalsContact O-N 3.16Å; V242-V245 PolarHBondContact N-O 3.43Å; V242-V245 PolarHBondContact O-N 2.92Å; V242-Y247 HydrophobicContact CB-CE2 4.31Å
243	D	88.5	Confident	92.5	Very high	77 Å²	77	40.9 Å²	40.9	41%	0.412	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.3	41	176	-61.8	-7.2	0	0	0	114	P71 Y72 H215 V245	P71-D243 HydrophobicContact CB-CB 4.35Å; P71-D243 HydrophobicContact CG-CB 4.02Å; Y72-D243 WeakPolarHBondContact CE1-OD2 3.38Å; Y72-D243 PolarHBondContact OH-OD2 2.87Å; H215-D243 IonicContact CD2-OD1 3.71Å; H215-D243 IonicContact CE1-OD1 3.28Å; H215-D243 PolarHBondContact CE1-OD1 3.16Å; H215-D243 PolarHBondContact NE2-N 3.4Å; H215-D243 IonicContact NE2-OD1 2.6Å; H215-D243 PolarHBondContact NE2-OD1 3.24Å; D243-V245 VanDerWaalsContact C-N 3.28Å; D243-V245 PolarHBondContact O-N 3.46Å
244	G	86.5	Confident	92	Very high	24 Å²	24	41.2 Å²	41.2	25%	0.247	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	77	2.5	179.3	0	0	0	0	0	115.6	G146 V242	G146-G244 WeakPolarHBondContact CA-O 3.49Å; V242-G244 PolarHBondContact O-N 2.69Å; V242-G244 VanDerWaalsContact O-N 3.16Å
245	V	88.7	Confident	91.4	Very high	19 Å²	19	40 Å²	40	12%	0.115	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	133.7	176.7	178.9	0	0	0	0	110.7	V68 P71 V241 V242 D243 Y247	V68-V245 HydrophobicContact CG1-CG2 3.97Å; P71-V245 VanDerWaalsContact CD-CG2 3.41Å; P71-V245 HydrophobicContact CG-CG2 4.02Å; V241-V245 WeakPolarHBondContact CA-O 3.12Å; V242-V245 PolarHBondContact N-O 3.43Å; V242-V245 PolarHBondContact O-N 2.92Å; D243-V245 VanDerWaalsContact C-N 3.28Å; D243-V245 PolarHBondContact O-N 3.46Å; V245-Y247 HydrophobicContact CB-CD2 4.46Å; V245-Y247 HydrophobicContact CB-CE2 3.67Å; V245-Y247 HydrophobicContact CG1-CD2 4.1Å; V245-Y247 HydrophobicContact CG1-CE1 4.08Å; V245-Y247 HydrophobicContact CG1-CE2 3.56Å; V245-Y247 WeakPolarHBondContact O-CD2 3.37Å; V245-Y247 WeakPolarHBondContact O-CE2 3.26Å
246	S	90.9	Very high	90.3	Very high	24 Å²	24	43.1 Å²	43.1	17%	0.168	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	124.1	172.1	-66.7	0	0	0	0	111.1
247	Y	91.4	Very high	88.6	Confident	54 Å²	54	42.9 Å²	42.9	21%	0.212	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	124.2	177.9	-58.3	-97.5	0	0	0	109.2	F70 Y72 L84 K239 Q240 V242 V245	F70-Y247 HydrophobicContact CE2-CE1 4.22Å; F70-Y247 WeakPolarHBondContact CE2-OH 3.42Å; Y72-Y247 WeakPolarHBondContact CE2-OH 3.07Å; L84-Y247 HydrophobicContact CD1-CE1 4.42Å; L84-Y247 HydrophobicContact CD1-CE2 3.83Å; L84-Y247 HydrophobicContact CD2-CD1 4.21Å; L84-Y247 HydrophobicContact CD2-CD2 3.54Å; L84-Y247 HydrophobicContact CD2-CE1 4.35Å; L84-Y247 HydrophobicContact CD2-CE2 3.73Å; L84-Y247 HydrophobicContact CD2-CG 3.82Å; L84-Y247 HydrophobicContact CG-CE2 4.45Å; K239-Y247 CarbonylContact C-O 3.56Å; K239-Y247 VanDerWaalsContact CA-O 3.32Å; K239-Y247 WeakPolarHBondContact CA-O 3.21Å; Q240-Y247 PolarHBondContact N-O 2.88Å; Q240-Y247 WeakPolarHBondContact O-CD2 3.35Å; Q240-Y247 PolarHBondContact O-N 2.83Å; V242-Y247 HydrophobicContact CB-CE2 4.31Å; V245-Y247 HydrophobicContact CB-CD2 4.46Å; V245-Y247 HydrophobicContact CB-CE2 3.67Å; V245-Y247 HydrophobicContact CG1-CD2 4.1Å; V245-Y247 HydrophobicContact CG1-CE1 4.08Å; V245-Y247 HydrophobicContact CG1-CE2 3.56Å; V245-Y247 WeakPolarHBondContact O-CD2 3.37Å; V245-Y247 WeakPolarHBondContact O-CE2 3.26Å
248	L	92.7	Very high	86.7	Confident	32 Å²	32	44.8 Å²	44.8	17%	0.168	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	125.2	173.4	-165.8	75.9	0	0	0	110	D59 F62 L63 K237 K239	D59-L248 HydrophobicContact CB-CD2 3.59Å; F62-L248 HydrophobicContact CB-CD1 3.91Å; L63-L248 HydrophobicContact CD2-CB 4.2Å; K237-L248 HydrophobicContact CB-CD1 4Å; K237-L248 HydrophobicContact CD-CD1 4.38Å; K237-L248 HydrophobicContact CD-CD2 4.35Å; K237-L248 HydrophobicContact CG-CD1 4.24Å; K239-L248 HydrophobicContact CG-CD1 4.17Å
249	L	92.8	Very high	84.4	Confident	66 Å²	66	50.8 Å²	50.8	35%	0.346	25%	0.251	S	S	.	.			trans	-79.4	131.2	-177.5	-91.6	56.5	0	0	0	111.2	Q238 Q240	Q238-L249 HydrophobicContact CB-CB 3.98Å; Q238-L249 HydrophobicContact CB-CD2 4.09Å; Q238-L249 PolarHBondContact O-N 3.42Å; Q240-L249 HydrophobicContact CB-CD1 3.56Å
250	Q	89.5	Confident	81.9	Confident	58 Å²	58	56.5 Å²	56.5	27%	0.271	28%	0.282	S	S	.	.			trans	-119.1	134.9	175.2	-66.5	-68.6	-9.9	0	0	109.6	F54 D59	F54-Q250 HydrophobicContact CB-CG 4.39Å; F54-Q250 WeakPolarHBondContact O-CG 3.45Å; D59-Q250 PolarHBondContact OD2-NE2 3.03Å
251	E	87.4	Confident	79.4	Confident	85 Å²	85	61 Å²	61	40%	0.397	31%	0.314	S	S	.	.			trans	-69.5	151.8	178.4	-63.4	171.2	147.5	0	0	111.9	K92 Y253 R294	K92-E251 WeakPolarHBondContact CE-OE1 3.14Å; K92-E251 IonicContact NZ-OE1 3.48Å; K92-E251 PolarHBondContact NZ-OE1 3.49Å; E251-Y253 HydrophobicContact CB-CE1 3.86Å; E251-Y253 WeakPolarHBondContact OE2-CE1 3.42Å; E251-Y253 PolarHBondContact OE2-OH 2.76Å; E251-R294 VanDerWaalsContact O-CD 3.31Å; E251-R294 WeakPolarHBondContact O-CD 3.24Å; E251-R294 PolarHBondContact O-NH1 2.73Å
252	I	89.6	Confident	76.9	Confident	54 Å²	54	66.7 Å²	66.7	28%	0.277	34%	0.341	S	S	.	.			trans	-109.3	125.8	163.3	-67.3	172.8	0	0	0	107.3	I255 L289 L296 I326	I252-I255 HydrophobicContact CB-CB 4.43Å; I252-I255 HydrophobicContact CB-CD1 4.42Å; I252-I255 HydrophobicContact CB-CG2 4.09Å; I252-I255 HydrophobicContact CD1-CD1 4.35Å; I252-I255 HydrophobicContact CG2-CB 3.91Å; I252-I255 HydrophobicContact CG2-CD1 4.18Å; I252-I255 HydrophobicContact CG2-CG2 4.09Å; I252-I255 VanDerWaalsContact O-CG2 3.27Å; I252-I255 WeakPolarHBondContact O-CG2 3.36Å; I252-L289 HydrophobicContact CB-CD1 4.35Å; I252-L289 HydrophobicContact CG1-CD1 4.12Å; I252-L289 HydrophobicContact CG2-CD1 3.57Å; I252-L296 HydrophobicContact CG2-CB 3.6Å; I252-L296 HydrophobicContact CG2-CD2 4.23Å; I252-I326 HydrophobicContact CD1-CD1 3.98Å
253	Y	89.6	Confident	74.4	Confident	83 Å²	83	76.4 Å²	76.4	33%	0.325	39%	0.386	S	S	.	.	B	Isolated β-bridge	trans	-88.3	137.1	179	-55.2	-60.6	0	0	0	110.1	E251 R294 L296	E251-Y253 HydrophobicContact CB-CE1 3.86Å; E251-Y253 WeakPolarHBondContact OE2-CE1 3.42Å; E251-Y253 PolarHBondContact OE2-OH 2.76Å; Y253-R294 HydrophobicContact CD2-CB 4.11Å; Y253-R294 HydrophobicContact CE2-CB 4.26Å; Y253-R294 PolarHBondContact N-O 3.18Å; Y253-R294 PolarHBondContact OH-NH1 2.78Å; Y253-L296 PolarHBondContact O-N 2.77Å
254	G	87	Confident	71.9	Confident	21 Å²	21	76.6 Å²	76.6	22%	0.216	39%	0.393	C	S	.	.	T	Hydrogen-bonded Turn	trans	84.8	7.6	-179.3	0	0	0	0	0	115.9	E256 R286	G254-E256 PolarHBondContact O-N 2.64Å; G254-R286 PolarHBondContact O-NH1 2.76Å
255	I	83.8	Confident	69.6	Low	59 Å²	59	84.4 Å²	84.4	30%	0.303	42%	0.42	S	S	.	.			trans	-85.8	34.3	172.6	-157.9	164.6	0	0	0	112.2	I252 N257 L296 L375	I252-I255 HydrophobicContact CB-CB 4.43Å; I252-I255 HydrophobicContact CB-CD1 4.42Å; I252-I255 HydrophobicContact CB-CG2 4.09Å; I252-I255 HydrophobicContact CD1-CD1 4.35Å; I252-I255 HydrophobicContact CG2-CB 3.91Å; I252-I255 HydrophobicContact CG2-CD1 4.18Å; I252-I255 HydrophobicContact CG2-CG2 4.09Å; I252-I255 VanDerWaalsContact O-CG2 3.27Å; I252-I255 WeakPolarHBondContact O-CG2 3.36Å; I255-N257 PolarHBondContact O-N 3.22Å; I255-L296 HydrophobicContact CB-CD2 3.83Å; I255-L296 HydrophobicContact CD1-CD2 3.93Å; I255-L296 HydrophobicContact CG1-CD2 3.7Å; I255-L375 HydrophobicContact CD1-CD1 3.82Å; I255-L375 HydrophobicContact CG1-CD1 3.84Å
256	E	73.3	Confident	67.2	Low	116 Å²	116	89.8 Å²	89.8	54%	0.542	45%	0.453	S	S	.	.			trans	-63.5	129.7	-163.1	-70.2	166	-131.5	0	0	113.9	G254	G254-E256 PolarHBondContact O-N 2.64Å
257	N	58.8	Low	65.2	Low	54 Å²	54	93.6 Å²	93.6	29%	0.289	49%	0.486	S	S	.	.			trans	-106.5	81.3	179.7	-169.8	18.2	0	0	0	111.8	I255 Y259 N260 N376	I255-N257 PolarHBondContact O-N 3.22Å; N257-Y259 PolarHBondContact O-N 2.84Å; N257-N260 PolarHBondContact O-N 3.09Å; N257-N376 PolarHBondContact ND2-OD1 2.82Å; N257-N376 PolarHBondContact OD1-ND2 2.72Å; N257-N376 PolarHBondContact OD1-OD1 3.4Å
258	K	55	Low	62.8	Low	86 Å²	86	96.4 Å²	96.4	37%	0.374	51%	0.505	S	S	.	.	G	3₁₀ helix	trans	-53.8	-25	-176.3	-78.5	-173.1	173.8	171	0	114.7	N260 S261 I271 S272 S275	K258-N260 VanDerWaalsContact C-N 3.28Å; K258-N260 PolarHBondContact O-N 2.83Å; K258-S261 PolarHBondContact O-N 3.14Å; K258-I271 PolarHBondContact NZ-O 3.16Å; K258-S272 PolarHBondContact NZ-O 3.09Å; K258-S275 WeakPolarHBondContact CD-OG 3.49Å; K258-S275 WeakPolarHBondContact CE-OG 3.21Å; K258-S275 PolarHBondContact NZ-OG 3.22Å; K258-S275 VanDerWaalsContact NZ-OG 3.13Å
259	Y	48.4	Very low	60.8	Low	146 Å²	146	102.7 Å²	102.7	57%	0.573	54%	0.538	S	S	*	.	G	3₁₀ helix	trans	-61.8	-28.5	-178.1	-84	-80.3	0	0	0	114.6	N257 S261 L379	N257-Y259 PolarHBondContact O-N 2.84Å; Y259-S261 VanDerWaalsContact C-N 3.33Å; Y259-S261 PolarHBondContact O-N 3.27Å; Y259-L379 HydrophobicContact CE2-CD2 4.23Å
260	N	44	Very low	58.9	Low	120 Å²	120	107.9 Å²	107.9	64%	0.642	56%	0.561	S	S	*	*	G	3₁₀ helix	trans	-85.8	-1.6	-174.8	-124.6	7.6	0	0	0	114.1	N257 K258	N257-N260 PolarHBondContact O-N 3.09Å; K258-N260 VanDerWaalsContact C-N 3.28Å; K258-N260 PolarHBondContact O-N 2.83Å
261	S	42	Very low	57.2	Low	101 Å²	101	110.7 Å²	110.7	71%	0.706	58%	0.576	S	S	*	*	G	3₁₀ helix	trans	-110.1	5.9	-177.4	-54.7	0	0	0	0	113.8	K258 Y259 E263	K258-S261 PolarHBondContact O-N 3.14Å; Y259-S261 VanDerWaalsContact C-N 3.33Å; Y259-S261 PolarHBondContact O-N 3.27Å; S261-E263 VanDerWaalsContact C-N 3.32Å; S261-E263 PolarHBondContact O-N 2.83Å
262	Q	42.3	Very low	55.6	Low	121 Å²	121	109.5 Å²	109.5	57%	0.565	58%	0.578	S	S	*	*			trans	-87.9	49.7	-164.1	-153.4	167.3	25.9	0	0	115.6	S264	Q262-S264 PolarHBondContact O-N 2.64Å
263	E	39.4	Very low	54	Low	204 Å²	204	112.7 Å²	112.7	95%	0.953	60%	0.595	S	S	*	*			trans	-89.9	49.6	151.2	-75.5	-149.5	137.6	0	0	111.2	S261	S261-E263 VanDerWaalsContact C-N 3.32Å; S261-E263 PolarHBondContact O-N 2.83Å
264	S	36.7	Very low	52.8	Low	81 Å²	81	113 Å²	113	57%	0.566	60%	0.603	S	S	*	*			trans	-144.6	114.1	156.4	-172.2	0	0	0	0	109.7	Q262	Q262-S264 PolarHBondContact O-N 2.64Å
265	K	39.3	Very low	52.2	Low	189 Å²	189	113.2 Å²	113.2	82%	0.822	60%	0.601	S	S	*	*			trans	-118.4	82.7	162.4	-78.8	-158.4	173.3	-163.7	0	109.3
266	V	37.9	Very low	52.2	Low	131 Å²	131	112 Å²	112	79%	0.794	60%	0.599	S	S	*	*			trans	-104.8	140.3	148.9	-166.6	0	0	0	0	106	D268	V266-D268 PolarHBondContact O-N 2.9Å
267	A	47.7	Very low	53.1	Low	105 Å²	105	108.4 Å²	108.4	87%	0.868	58%	0.583	S	S	*	*	S	Bend	trans	-78.4	112.6	-168.6	0	0	0	0	0	112.4
268	D	41.3	Very low	54.7	Low	113 Å²	113	105.8 Å²	105.8	60%	0.604	57%	0.569	S	S	*	*			trans	-150.2	112	152.9	-164.4	5.4	0	0	0	107.8	V266 I271	V266-D268 PolarHBondContact O-N 2.9Å; D268-I271 WeakPolarHBondContact OD2-CD1 3.42Å
269	D	51.2	Low	56.5	Low	163 Å²	163	104.1 Å²	104.1	87%	0.872	57%	0.566	S	S	*	*			trans	-102.7	7.4	-159.6	-130.6	15.7	0	0	0	113
270	E	52.5	Low	58.7	Low	175 Å²	175	101.2 Å²	101.2	82%	0.818	56%	0.563	S	S	*	*	S	Bend	trans	-113.7	0.8	-173.3	-61.5	-166.9	174.9	0	0	114.9
271	I	53.4	Low	61.1	Low	117 Å²	117	97.6 Å²	97.6	60%	0.6	55%	0.547	S	S	*	.	S	Bend	trans	-108.2	4.1	-175.1	-51.7	179.6	0	0	0	112.6	K258 D268	K258-I271 PolarHBondContact NZ-O 3.16Å; D268-I271 WeakPolarHBondContact OD2-CD1 3.42Å
272	S	54.1	Low	63.5	Low	60 Å²	60	98.3 Å²	98.3	42%	0.42	54%	0.542	S	S	.	.	S	Bend	trans	-74.8	-48.3	-174.9	175.2	0	0	0	0	113.8	K258 S275	K258-S272 PolarHBondContact NZ-O 3.09Å; S272-S275 PolarHBondContact O-OG 3.36Å
273	D	57.3	Low	65.9	Low	122 Å²	122	96.8 Å²	96.8	65%	0.652	54%	0.544	S	S	*	.	G	3₁₀ helix	trans	-87.6	-26.2	-150.3	-64.7	-9.4	0	0	0	114.7	S275 A276	D273-S275 PolarHBondContact O-N 2.69Å; D273-A276 PolarHBondContact O-N 3.27Å
274	N	62.8	Low	68.4	Low	90 Å²	90	90.8 Å²	90.8	48%	0.481	52%	0.519	S	S	.	.	G	3₁₀ helix	trans	-64.3	-7.6	-176	-49.7	95.8	0	0	0	115	A276 E277	N274-A276 PolarHBondContact O-N 3.11Å; N274-E277 WeakPolarHBondContact CB-OE2 3.44Å; N274-E277 VanDerWaalsContact ND2-CD 3.35Å; N274-E277 PolarHBondContact ND2-OE1 2.95Å; N274-E277 PolarHBondContact ND2-OE2 3.37Å; N274-E277 PolarHBondContact O-N 2.71Å
275	S	74.1	Confident	70.9	Confident	25 Å²	25	90.5 Å²	90.5	18%	0.175	51%	0.513	C	S	.	.	G	3₁₀ helix	trans	-68.8	-19.3	175.3	45.6	0	0	0	0	113.9	K258 S272 D273 R286	K258-S275 WeakPolarHBondContact CD-OG 3.49Å; K258-S275 WeakPolarHBondContact CE-OG 3.21Å; K258-S275 PolarHBondContact NZ-OG 3.22Å; K258-S275 VanDerWaalsContact NZ-OG 3.13Å; S272-S275 PolarHBondContact O-OG 3.36Å; D273-S275 PolarHBondContact O-N 2.69Å; S275-R286 PolarHBondContact O-NH1 2.84Å; S275-R286 PolarHBondContact O-NH2 3.13Å
276	A	85.3	Confident	73.5	Confident	33 Å²	33	83 Å²	83	27%	0.273	48%	0.48	S	S	.	.	G	3₁₀ helix	trans	-90.9	-13.1	175.5	0	0	0	0	0	113.6	D273 N274 V285 R286	D273-A276 PolarHBondContact O-N 3.27Å; N274-A276 PolarHBondContact O-N 3.11Å; A276-V285 WeakPolarHBondContact O-CA 3.27Å; A276-R286 WeakPolarHBondContact O-CG 3.17Å; A276-R286 PolarHBondContact O-N 2.95Å
277	E	90.8	Very high	76	Confident	40 Å²	40	78.3 Å²	78.3	19%	0.187	45%	0.451	C	S	.	.	B	Isolated β-bridge	trans	-84.4	143.9	-170	-65.2	171.9	174.6	0	0	113.3	N274 V279 D284 R286	N274-E277 WeakPolarHBondContact CB-OE2 3.44Å; N274-E277 VanDerWaalsContact ND2-CD 3.35Å; N274-E277 PolarHBondContact ND2-OE1 2.95Å; N274-E277 PolarHBondContact ND2-OE2 3.37Å; N274-E277 PolarHBondContact O-N 2.71Å; E277-V279 PolarHBondContact O-N 2.98Å; E277-D284 CarbonylContact C-O 3.56Å; E277-D284 WeakPolarHBondContact CA-O 3.41Å; E277-R286 VanDerWaalsContact O-CZ 3.31Å; E277-R286 PolarHBondContact O-NE 3.48Å; E277-R286 PolarHBondContact O-NH2 2.88Å
278	C	93.3	Very high	78.2	Confident	0 Å²	0	73.5 Å²	73.5	0%	0	41%	0.41	C	S	.	.			trans	-56.7	129	173.7	170.2	0	0	0	0	111.5	V280 L282 D284 C297 C299	C278-V280 PolarHBondContact O-N 3.23Å; C278-V280 PolarHBondContact SG-N 2.94Å; C278-L282 WeakPolarHBondContact O-CA 3.23Å; C278-L282 PolarHBondContact O-N 3.21Å; C278-D284 WeakPolarHBondContact CB-O 3.35Å; C278-D284 PolarHBondContact N-O 2.99Å; C278-C297 WeakPolarHBondContact CA-O 3.39Å; C278-C299 HydrophobicContact CB-CB 4Å; C278-C299 PolarHBondContact SG-N 2.85Å; C278-C299 VanDerWaalsContact SG-N 3.39Å
279	V	93.1	Very high	80.6	Confident	51 Å²	51	68.3 Å²	68.3	31%	0.309	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.2	4.3	-174.8	-51.8	0	0	0	0	114.8	E277 C297 P314 I315	E277-V279 PolarHBondContact O-N 2.98Å; V279-C297 HydrophobicContact CG1-CB 4.22Å; V279-C297 HydrophobicContact CG2-CB 4.08Å; V279-C297 PolarHBondContact N-O 3.31Å; V279-P314 HydrophobicContact CG2-CB 4.08Å; V279-I315 HydrophobicContact CG1-CD1 4.09Å; V279-I315 HydrophobicContact CG2-CD1 4.06Å
280	V	93.5	Very high	82.5	Confident	85 Å²	85	60.5 Å²	60.5	52%	0.515	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.3	-47.7	-179.1	177.9	0	0	0	0	111.5	C278 L298 C302	C278-V280 PolarHBondContact O-N 3.23Å; C278-V280 PolarHBondContact SG-N 2.94Å; V280-L298 HydrophobicContact CB-CD2 4.42Å; V280-L298 HydrophobicContact CG2-CD2 3.55Å; V280-C302 HydrophobicContact CB-CB 4.03Å; V280-C302 HydrophobicContact CG1-CB 4.21Å
281	C	95.2	Very high	84.3	Confident	44 Å²	44	52.7 Å²	52.7	30%	0.297	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.2	-20.3	176.9	64.2	0	0	0	0	114.4	S283 D284	C281-S283 VanDerWaalsContact C-N 3.26Å; C281-S283 PolarHBondContact O-N 3.32Å; C281-S283 PolarHBondContact O-OG 2.88Å; C281-D284 PolarHBondContact SG-N 2.79Å; C281-D284 VanDerWaalsContact SG-N 3.43Å; C281-D284 PolarHBondContact SG-OD2 2.72Å
282	L	92.9	Very high	85.9	Confident	116 Å²	116	49.6 Å²	49.6	61%	0.607	29%	0.292	S	S	*	.	S	Bend	trans	50	47.3	-175.6	-52.3	175.8	0	0	0	111.4	C278	C278-L282 WeakPolarHBondContact O-CA 3.23Å; C278-L282 PolarHBondContact O-N 3.21Å
283	S	91.4	Very high	87.6	Confident	88 Å²	88	47.6 Å²	47.6	62%	0.615	28%	0.278	S	S	*	.	S	Bend	trans	-154.1	-56.8	-174.6	-64.3	0	0	0	0	112	C281	C281-S283 VanDerWaalsContact C-N 3.26Å; C281-S283 PolarHBondContact O-N 3.32Å; C281-S283 PolarHBondContact O-OG 2.88Å
284	D	91.9	Very high	89.3	Confident	78 Å²	78	43.5 Å²	43.5	42%	0.417	25%	0.253	S	S	.	.	S	Bend	trans	-78.1	148.8	179.5	-58.4	-51.7	0	0	0	111.6	E277 C278 C281 C299	E277-D284 CarbonylContact C-O 3.56Å; E277-D284 WeakPolarHBondContact CA-O 3.41Å; C278-D284 WeakPolarHBondContact CB-O 3.35Å; C278-D284 PolarHBondContact N-O 2.99Å; C281-D284 PolarHBondContact SG-N 2.79Å; C281-D284 VanDerWaalsContact SG-N 3.43Å; C281-D284 PolarHBondContact SG-OD2 2.72Å; D284-C299 HydrophobicContact CB-CB 3.37Å; D284-C299 PolarHBondContact OD2-SG 3.46Å
285	V	90.3	Very high	90.7	Very high	75 Å²	75	41 Å²	41	46%	0.455	24%	0.239	S	C	.	.	B	Isolated β-bridge	trans	-68	143.6	173.5	-179.5	0	0	0	0	111	A276 D287 C299	A276-V285 WeakPolarHBondContact O-CA 3.27Å; V285-D287 PolarHBondContact O-N 3.44Å; V285-C299 WeakPolarHBondContact O-CB 3.37Å
286	R	92.6	Very high	91.7	Very high	32 Å²	32	40.1 Å²	40.1	12%	0.121	23%	0.232	C	C	.	.	P	Polyproline II helix	trans	-65.6	123.1	173.4	-61.7	165	-171	169	17.7	111.2	G254 S275 A276 E277 L296 L298	G254-R286 PolarHBondContact O-NH1 2.76Å; S275-R286 PolarHBondContact O-NH1 2.84Å; S275-R286 PolarHBondContact O-NH2 3.13Å; A276-R286 WeakPolarHBondContact O-CG 3.17Å; A276-R286 PolarHBondContact O-N 2.95Å; E277-R286 VanDerWaalsContact O-CZ 3.31Å; E277-R286 PolarHBondContact O-NE 3.48Å; E277-R286 PolarHBondContact O-NH2 2.88Å; R286-L296 HydrophobicContact CB-CD1 4.12Å; R286-L296 HydrophobicContact CB-CG 3.99Å; R286-L296 WeakPolarHBondContact CD-O 3.32Å; R286-L298 WeakPolarHBondContact CA-O 3.44Å
287	D	92.1	Very high	92	Very high	33 Å²	33	38.7 Å²	38.7	18%	0.176	22%	0.22	C	C	.	.			trans	-128.7	-12.3	173.2	69.1	-4.7	0	0	0	113	V285 L298 C299 N300 Q325 I326	V285-D287 PolarHBondContact O-N 3.44Å; D287-L298 PolarHBondContact N-O 2.88Å; D287-C299 WeakPolarHBondContact OD1-CA 3.22Å; D287-N300 PolarHBondContact OD1-N 2.96Å; D287-Q325 HydrophobicContact CB-CG 4.29Å; D287-Q325 CarbonylContact O-C 3.47Å; D287-Q325 PolarHBondContact OD2-NE2 2.86Å; D287-I326 PolarHBondContact O-N 3.24Å
288	T	92.9	Very high	92.2	Very high	3 Å²	3	36.8 Å²	36.8	2%	0.018	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	123.9	-168.6	-57.8	0	0	0	0	112.8	C297 L298 A303 L323	T288-C297 PolarHBondContact O-N 3.17Å; T288-L298 PolarHBondContact N-O 3.09Å; T288-L298 PolarHBondContact O-N 2.84Å; T288-A303 HydrophobicContact CG2-CB 3.54Å; T288-L323 HydrophobicContact CG2-CB 4.15Å
289	L	91.9	Very high	92.3	Very high	4 Å²	4	37 Å²	37	2%	0.021	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	135.9	-179.3	-170.4	80.1	0	0	0	110.8	F54 I252 L291 R294 L296 L324	F54-L289 HydrophobicContact CE1-CD2 4.41Å; I252-L289 HydrophobicContact CB-CD1 4.35Å; I252-L289 HydrophobicContact CG1-CD1 4.12Å; I252-L289 HydrophobicContact CG2-CD1 3.57Å; L289-L291 HydrophobicContact CD2-CD2 3.77Å; L289-L291 HydrophobicContact CG-CD2 4.38Å; L289-R294 VanDerWaalsContact CD1-C 3.49Å; L289-R294 HydrophobicContact CD1-CB 4.45Å; L289-R294 WeakPolarHBondContact CD1-O 3.27Å; L289-L296 HydrophobicContact CD1-CB 4.07Å; L289-L324 HydrophobicContact CB-CB 4.36Å; L289-L324 WeakPolarHBondContact CB-O 3.44Å; L289-L324 HydrophobicContact CD2-CD2 4.3Å; L289-L324 PolarHBondContact N-O 2.98Å; L289-L324 PolarHBondContact O-N 2.84Å
290	I	91.9	Very high	92.3	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	122.1	177.2	-53.9	-173.9	0	0	0	110.9	C293 R294 H295 C297 L298 L306 C313 P314 F320 L323	I290-C293 CarbonylContact O-C 3.48Å; I290-C293 PolarHBondContact O-N 2.8Å; I290-C293 PolarHBondContact O-SG 2.87Å; I290-R294 PolarHBondContact O-N 2.96Å; I290-H295 PolarHBondContact N-O 2.78Å; I290-C297 VanDerWaalsContact CD1-SG 3.57Å; I290-L298 HydrophobicContact CD1-CD1 3.81Å; I290-L298 HydrophobicContact CD1-CG 4.24Å; I290-L298 HydrophobicContact CG1-CD1 4.18Å; I290-L306 HydrophobicContact CD1-CD2 4.35Å; I290-C313 HydrophobicContact CD1-CB 4.21Å; I290-C313 HydrophobicContact CG2-CB 4.07Å; I290-P314 VanDerWaalsContact CD1-CD 3.43Å; I290-F320 HydrophobicContact CG2-CB 3.3Å; I290-F320 HydrophobicContact CG2-CD1 3.88Å; I290-F320 HydrophobicContact CG2-CG 3.8Å; I290-L323 HydrophobicContact CB-CD2 4.33Å; I290-L323 HydrophobicContact CG1-CD2 3.88Å; I290-L323 HydrophobicContact CG2-CD2 4.16Å
291	L	88.9	Confident	92.3	Very high	10 Å²	10	35.6 Å²	35.6	5%	0.052	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	140.1	-177.6	-64.5	179.7	0	0	0	112.8	M39 F54 L289 R294 F320 R321 A322 L324	M39-L291 HydrophobicContact SD-CD1 4.3Å; F54-L291 HydrophobicContact CD1-CD1 4.36Å; F54-L291 HydrophobicContact CD1-CD2 3.63Å; F54-L291 HydrophobicContact CE1-CD1 3.74Å; F54-L291 HydrophobicContact CE1-CD2 3.69Å; F54-L291 HydrophobicContact CE1-CG 4.35Å; F54-L291 HydrophobicContact CZ-CD1 3.96Å; L289-L291 HydrophobicContact CD2-CD2 3.77Å; L289-L291 HydrophobicContact CG-CD2 4.38Å; L291-R294 HydrophobicContact CD2-CG 4.36Å; L291-F320 CarbonylContact O-C 3.21Å; L291-F320 VanDerWaalsContact O-CA 3.27Å; L291-F320 WeakPolarHBondContact O-CA 3.35Å; L291-F320 WeakPolarHBondContact O-CB 3.3Å; L291-R321 PolarHBondContact O-N 3.06Å; L291-A322 HydrophobicContact CB-CB 4.28Å; L291-A322 HydrophobicContact CD1-CB 4.32Å; L291-A322 PolarHBondContact N-O 3.24Å; L291-L324 HydrophobicContact CD1-CB 4.16Å
292	P	87.3	Confident	92.4	Very high	53 Å²	53	34.3 Å²	34.3	34%	0.344	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	cis	-88.4	-0	9.2	35.1	-36.8	0	0	0	114.9	R294	P292-R294 VanDerWaalsContact C-N 3.28Å; P292-R294 PolarHBondContact O-N 3.29Å
293	C	90.9	Very high	92.5	Very high	17 Å²	17	28.9 Å²	28.9	12%	0.115	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.9	-4.8	-168.4	74.1	0	0	0	0	116.2	I290 H295 L318	I290-C293 CarbonylContact O-C 3.48Å; I290-C293 PolarHBondContact O-N 2.8Å; I290-C293 PolarHBondContact O-SG 2.87Å; C293-H295 PolarHBondContact O-CE1 3.2Å; C293-H295 PolarHBondContact O-N 3.39Å; C293-H295 VanDerWaalsContact O-N 3.14Å; C293-H295 PolarHBondContact O-ND1 2.94Å; C293-H295 PolarHBondContact SG-ND1 3.37Å; C293-L318 HydrophobicContact CB-CD1 4.36Å
294	R	92	Very high	92.6	Very high	37 Å²	37	27.9 Å²	27.9	14%	0.14	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	55	28.3	175.1	-64	177.9	-75.7	121.8	-3.8	115.8	F54 E251 Y253 L289 I290 L291 P292	F54-R294 WeakPolarHBondContact O-CD 3.41Å; F54-R294 PolarHBondContact O-NE 2.83Å; F54-R294 VanDerWaalsContact O-NE 3.09Å; E251-R294 VanDerWaalsContact O-CD 3.31Å; E251-R294 WeakPolarHBondContact O-CD 3.24Å; E251-R294 PolarHBondContact O-NH1 2.73Å; Y253-R294 HydrophobicContact CD2-CB 4.11Å; Y253-R294 HydrophobicContact CE2-CB 4.26Å; Y253-R294 PolarHBondContact N-O 3.18Å; Y253-R294 PolarHBondContact OH-NH1 2.78Å; L289-R294 VanDerWaalsContact CD1-C 3.49Å; L289-R294 HydrophobicContact CD1-CB 4.45Å; L289-R294 WeakPolarHBondContact CD1-O 3.27Å; I290-R294 PolarHBondContact O-N 2.96Å; L291-R294 HydrophobicContact CD2-CG 4.36Å; P292-R294 VanDerWaalsContact C-N 3.28Å; P292-R294 PolarHBondContact O-N 3.29Å
295	H	92.9	Very high	92.6	Very high	37 Å²	37	27.3 Å²	27.3	17%	0.171	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	112.7	172.8	-70.7	79.3	0	0	0	110.6	I290 C293 C297 I315	I290-H295 PolarHBondContact N-O 2.78Å; C293-H295 PolarHBondContact O-CE1 3.2Å; C293-H295 PolarHBondContact O-N 3.39Å; C293-H295 VanDerWaalsContact O-N 3.14Å; C293-H295 PolarHBondContact O-ND1 2.94Å; C293-H295 PolarHBondContact SG-ND1 3.37Å; H295-C297 PolarHBondContact O-N 2.86Å; H295-C297 PolarHBondContact O-SG 3.05Å; H295-I315 HydrophobicContact CB-CG1 4.2Å; H295-I315 VanDerWaalsContact CD2-CG2 3.46Å; H295-I315 WeakPolarHBondContact CD2-CG2 3.42Å
296	L	93.6	Very high	92.7	Very high	6 Å²	6	25 Å²	25	3%	0.031	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	103	167.1	176.6	63.1	0	0	0	107	I252 Y253 I255 R286 L289 L371	I252-L296 HydrophobicContact CG2-CB 3.6Å; I252-L296 HydrophobicContact CG2-CD2 4.23Å; Y253-L296 PolarHBondContact O-N 2.77Å; I255-L296 HydrophobicContact CB-CD2 3.83Å; I255-L296 HydrophobicContact CD1-CD2 3.93Å; I255-L296 HydrophobicContact CG1-CD2 3.7Å; R286-L296 HydrophobicContact CB-CD1 4.12Å; R286-L296 HydrophobicContact CB-CG 3.99Å; R286-L296 WeakPolarHBondContact CD-O 3.32Å; L289-L296 HydrophobicContact CD1-CB 4.07Å; L296-L371 HydrophobicContact CD1-CD1 4.37Å; L296-L371 HydrophobicContact CD2-CD1 4.05Å
297	C	92.9	Very high	92.6	Very high	3 Å²	3	26.3 Å²	26.3	2%	0.02	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	-7.6	-169.9	56.5	0	0	0	0	114.5	C278 V279 T288 I290 H295 I315	C278-C297 WeakPolarHBondContact CA-O 3.39Å; V279-C297 HydrophobicContact CG1-CB 4.22Å; V279-C297 HydrophobicContact CG2-CB 4.08Å; V279-C297 PolarHBondContact N-O 3.31Å; T288-C297 PolarHBondContact O-N 3.17Å; I290-C297 VanDerWaalsContact CD1-SG 3.57Å; H295-C297 PolarHBondContact O-N 2.86Å; H295-C297 PolarHBondContact O-SG 3.05Å; C297-I315 HydrophobicContact CB-CD1 4.02Å; C297-I315 HydrophobicContact CB-CG1 3.87Å
298	L	94.9	Very high	92.5	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	150.5	-177.9	-58.6	178.8	0	0	0	111.8	V280 R286 D287 T288 I290 C302 A303 L306 P314	V280-L298 HydrophobicContact CB-CD2 4.42Å; V280-L298 HydrophobicContact CG2-CD2 3.55Å; R286-L298 WeakPolarHBondContact CA-O 3.44Å; D287-L298 PolarHBondContact N-O 2.88Å; T288-L298 PolarHBondContact N-O 3.09Å; T288-L298 PolarHBondContact O-N 2.84Å; I290-L298 HydrophobicContact CD1-CD1 3.81Å; I290-L298 HydrophobicContact CD1-CG 4.24Å; I290-L298 HydrophobicContact CG1-CD1 4.18Å; L298-C302 HydrophobicContact CD2-CB 4.34Å; L298-A303 HydrophobicContact CB-CB 4.12Å; L298-A303 HydrophobicContact CD1-CB 3.9Å; L298-L306 HydrophobicContact CD1-CB 4.49Å; L298-L306 HydrophobicContact CD1-CD2 3.59Å; L298-P314 HydrophobicContact CD2-CG 4.36Å
299	C	94.9	Very high	92.4	Very high	5 Å²	5	40.3 Å²	40.3	3%	0.034	21%	0.206	C	C	.	.			trans	-84.2	161.1	153.5	68.7	0	0	0	0	109.5	C278 D284 V285 D287 A301 C302 A303	C278-C299 HydrophobicContact CB-CB 4Å; C278-C299 PolarHBondContact SG-N 2.85Å; C278-C299 VanDerWaalsContact SG-N 3.39Å; D284-C299 HydrophobicContact CB-CB 3.37Å; D284-C299 PolarHBondContact OD2-SG 3.46Å; V285-C299 WeakPolarHBondContact O-CB 3.37Å; D287-C299 WeakPolarHBondContact OD1-CA 3.22Å; C299-A301 VanDerWaalsContact C-N 3.34Å; C299-A301 PolarHBondContact O-N 3.28Å; C299-C302 PolarHBondContact O-N 3.2Å; C299-C302 PolarHBondContact SG-N 3.26Å; C299-A303 PolarHBondContact O-N 3.09Å
300	N	93.1	Very high	92.4	Very high	48 Å²	48	42.2 Å²	42.2	26%	0.257	22%	0.223	S	C	.	.	H	α-helix	trans	-52.3	-47.2	-179.9	-172.7	96.1	0	0	0	113.3	D287 C302 A303 D304 Q325	D287-N300 PolarHBondContact OD1-N 2.96Å; N300-C302 VanDerWaalsContact C-N 3.34Å; N300-C302 PolarHBondContact O-N 3.32Å; N300-A303 WeakPolarHBondContact O-CB 3.43Å; N300-A303 PolarHBondContact O-N 3.27Å; N300-D304 PolarHBondContact ND2-OD2 3.39Å; N300-D304 PolarHBondContact O-N 2.87Å; N300-Q325 PolarHBondContact OD1-NE2 2.87Å; N300-Q325 PolarHBondContact OD1-OE1 3.25Å
301	A	94.7	Very high	92.3	Very high	59 Å²	59	47.3 Å²	47.3	49%	0.488	25%	0.25	S	S	.	.	H	α-helix	trans	-62.4	-38.7	-177.8	0	0	0	0	0	112.9	C299 T305	C299-A301 VanDerWaalsContact C-N 3.34Å; C299-A301 PolarHBondContact O-N 3.28Å; A301-T305 WeakPolarHBondContact O-CB 3.39Å; A301-T305 PolarHBondContact O-N 2.95Å; A301-T305 PolarHBondContact O-OG1 3.23Å
302	C	96.3	Very high	92.6	Very high	16 Å²	16	49 Å²	49	11%	0.108	26%	0.262	C	S	.	.	H	α-helix	trans	-72.6	-31.3	173.3	-71.4	0	0	0	0	112.3	V280 L298 C299 N300 L306	V280-C302 HydrophobicContact CB-CB 4.03Å; V280-C302 HydrophobicContact CG1-CB 4.21Å; L298-C302 HydrophobicContact CD2-CB 4.34Å; C299-C302 PolarHBondContact O-N 3.2Å; C299-C302 PolarHBondContact SG-N 3.26Å; N300-C302 VanDerWaalsContact C-N 3.34Å; N300-C302 PolarHBondContact O-N 3.32Å; C302-L306 VanDerWaalsContact O-CB 3.23Å; C302-L306 WeakPolarHBondContact O-CB 3.38Å; C302-L306 PolarHBondContact O-N 3.06Å
303	A	95.1	Very high	93	Very high	3 Å²	3	46.5 Å²	46.5	3%	0.025	25%	0.246	C	C	.	.	H	α-helix	trans	-69.5	-46.5	176.1	0	0	0	0	0	112.7	T288 L298 C299 N300 T305 L306 R307 L323	T288-A303 HydrophobicContact CG2-CB 3.54Å; L298-A303 HydrophobicContact CB-CB 4.12Å; L298-A303 HydrophobicContact CD1-CB 3.9Å; C299-A303 PolarHBondContact O-N 3.09Å; N300-A303 WeakPolarHBondContact O-CB 3.43Å; N300-A303 PolarHBondContact O-N 3.27Å; A303-T305 VanDerWaalsContact C-N 3.26Å; A303-T305 PolarHBondContact O-N 3.36Å; A303-L306 PolarHBondContact O-N 2.88Å; A303-R307 WeakPolarHBondContact O-CB 3.34Å; A303-R307 PolarHBondContact O-N 2.81Å; A303-L323 HydrophobicContact CB-CD1 4.18Å; A303-L323 WeakPolarHBondContact O-CD1 3.35Å
304	D	92.7	Very high	93.1	Very high	66 Å²	66	48.1 Å²	48.1	35%	0.353	26%	0.257	S	S	.	.	H	α-helix	trans	-59	-39.7	173.2	-76	-36	0	0	0	111.3	N300 R307 Y308	N300-D304 PolarHBondContact ND2-OD2 3.39Å; N300-D304 PolarHBondContact O-N 2.87Å; D304-R307 WeakPolarHBondContact O-CB 3.46Å; D304-Y308 WeakPolarHBondContact O-CD2 3.45Å
305	T	93.4	Very high	93.2	Very high	67 Å²	67	50.4 Å²	50.4	41%	0.411	27%	0.27	S	S	.	.	H	α-helix	trans	-66.3	-48.4	174.5	-58.5	0	0	0	0	112.1	A301 A303 R307 Y308 Q309	A301-T305 WeakPolarHBondContact O-CB 3.39Å; A301-T305 PolarHBondContact O-N 2.95Å; A301-T305 PolarHBondContact O-OG1 3.23Å; A303-T305 VanDerWaalsContact C-N 3.26Å; A303-T305 PolarHBondContact O-N 3.36Å; T305-R307 VanDerWaalsContact C-N 3.3Å; T305-R307 PolarHBondContact O-N 2.8Å; T305-Y308 PolarHBondContact O-N 3.11Å; T305-Q309 VanDerWaalsContact CG2-NE2 3.34Å; T305-Q309 WeakPolarHBondContact O-CG 3.37Å
306	L	92.6	Very high	93.3	Very high	25 Å²	25	50.7 Å²	50.7	13%	0.131	28%	0.276	C	S	.	.	H	α-helix	trans	-59.2	-41.9	-177.5	-175.4	70	0	0	0	111.3	I290 L298 C302 A303 Y308 Q309 A310 P314 F320	I290-L306 HydrophobicContact CD1-CD2 4.35Å; L298-L306 HydrophobicContact CD1-CB 4.49Å; L298-L306 HydrophobicContact CD1-CD2 3.59Å; C302-L306 VanDerWaalsContact O-CB 3.23Å; C302-L306 WeakPolarHBondContact O-CB 3.38Å; C302-L306 PolarHBondContact O-N 3.06Å; A303-L306 PolarHBondContact O-N 2.88Å; L306-Y308 PolarHBondContact O-N 2.94Å; L306-Q309 PolarHBondContact O-N 3.04Å; L306-A310 HydrophobicContact CD1-CB 3.89Å; L306-A310 PolarHBondContact O-N 2.75Å; L306-P314 HydrophobicContact CD2-CG 4.17Å; L306-F320 HydrophobicContact CD2-CE1 3.83Å; L306-F320 HydrophobicContact CD2-CZ 4.37Å; L306-F320 HydrophobicContact CG-CE1 4.09Å; L306-F320 HydrophobicContact CG-CZ 4.32Å
307	R	89.4	Confident	93.4	Very high	60 Å²	60	60.2 Å²	60.2	23%	0.226	31%	0.312	C	S	.	.	H	α-helix	trans	-45.7	-37	178.9	-171.9	-162	-176.7	92.2	0.5	114.4	A303 D304 T305 L323 S538 S540	A303-R307 WeakPolarHBondContact O-CB 3.34Å; A303-R307 PolarHBondContact O-N 2.81Å; D304-R307 WeakPolarHBondContact O-CB 3.46Å; T305-R307 VanDerWaalsContact C-N 3.3Å; T305-R307 PolarHBondContact O-N 2.8Å; R307-L323 HydrophobicContact CB-CD1 4.09Å; R307-S538 PolarHBondContact NH1-O 2.72Å; R307-S538 PolarHBondContact NH2-O 3.45Å; R307-S540 PolarHBondContact NE-OG 3.17Å; R307-S540 VanDerWaalsContact NH2-N 3.15Å; R307-S540 PolarHBondContact NH2-OG 2.88Å
308	Y	90.1	Very high	93.4	Very high	177 Å²	177	64.9 Å²	64.9	69%	0.694	34%	0.336	S	S	*	.	H	α-helix	trans	-99.1	-9.5	-177.3	-60.9	-73.3	0	0	0	113.8	D304 T305 L306	D304-Y308 WeakPolarHBondContact O-CD2 3.45Å; T305-Y308 PolarHBondContact O-N 3.11Å; L306-Y308 PolarHBondContact O-N 2.94Å
309	Q	91.3	Very high	93.2	Very high	153 Å²	153	69 Å²	69	72%	0.715	36%	0.362	S	S	*	.	H	α-helix	trans	-109.2	-30.7	-175.1	-66	-177.2	3	0	0	113.4	T305 L306	T305-Q309 VanDerWaalsContact CG2-NE2 3.34Å; T305-Q309 WeakPolarHBondContact O-CG 3.37Å; L306-Q309 PolarHBondContact O-N 3.04Å
310	A	91.3	Very high	92.9	Very high	44 Å²	44	70.2 Å²	70.2	36%	0.364	37%	0.367	S	S	.	.			trans	-151.1	162.2	180	0	0	0	0	0	111.6	L306 F320	L306-A310 HydrophobicContact CD1-CB 3.89Å; L306-A310 PolarHBondContact O-N 2.75Å; A310-F320 VanDerWaalsContact O-CZ 3.24Å; A310-F320 WeakPolarHBondContact O-CZ 3.26Å
311	N	90.6	Very high	92.6	Very high	108 Å²	108	75.5 Å²	75.5	58%	0.578	38%	0.384	S	S	*	.	S	Bend	trans	-118.5	13.6	179.3	63.5	-17.5	0	0	0	113.2	P319 F320	N311-P319 CarbonylContact O-C 3.3Å; N311-P319 WeakPolarHBondContact O-CA 3.17Å; N311-F320 VanDerWaalsContact C-CD1 3.43Å; N311-F320 VanDerWaalsContact C-CE1 3.45Å; N311-F320 WeakPolarHBondContact O-CD1 3.43Å; N311-F320 PolarHBondContact O-N 3.05Å
312	C	94.9	Very high	92.2	Very high	44 Å²	44	73.3 Å²	73.3	30%	0.297	37%	0.366	S	S	.	.	B	Isolated β-bridge	trans	-122.6	148.1	-177.9	-70	0	0	0	0	112.9	R317 L318	C312-R317 WeakPolarHBondContact CB-O 3.48Å; C312-R317 PolarHBondContact SG-O 3.36Å; C312-R317 VanDerWaalsContact SG-O 3.36Å; C312-L318 CarbonylContact C-O 3.56Å; C312-L318 WeakPolarHBondContact CA-O 3.47Å
313	C	94.7	Very high	91.9	Very high	2 Å²	2	73.4 Å²	73.4	1%	0.014	37%	0.365	C	S	.	.			trans	-64.4	130.7	174.6	175.2	0	0	0	0	111.2	I290 I315 C316 R317 L318	I290-C313 HydrophobicContact CD1-CB 4.21Å; I290-C313 HydrophobicContact CG2-CB 4.07Å; C313-I315 PolarHBondContact O-N 2.98Å; C313-I315 PolarHBondContact SG-N 3.29Å; C313-C316 VanDerWaalsContact SG-SG 3.66Å; C313-R317 WeakPolarHBondContact O-CA 3.41Å; C313-R317 PolarHBondContact O-N 2.81Å; C313-L318 PolarHBondContact N-O 2.93Å
314	P	94.6	Very high	91.6	Very high	51 Å²	51	73.8 Å²	73.8	33%	0.331	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59	-32.5	177.4	-26.5	36.1	0	0	0	114.1	V279 I290 L298 L306	V279-P314 HydrophobicContact CG2-CB 4.08Å; I290-P314 VanDerWaalsContact CD1-CD 3.43Å; L298-P314 HydrophobicContact CD2-CG 4.36Å; L306-P314 HydrophobicContact CD2-CG 4.17Å
315	I	94.2	Very high	91.4	Very high	84 Å²	84	71.4 Å²	71.4	43%	0.431	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.1	-64.6	-176.7	-47.4	-58.3	0	0	0	111.3	V279 H295 C297 C313	V279-I315 HydrophobicContact CG1-CD1 4.09Å; V279-I315 HydrophobicContact CG2-CD1 4.06Å; H295-I315 HydrophobicContact CB-CG1 4.2Å; H295-I315 VanDerWaalsContact CD2-CG2 3.46Å; H295-I315 WeakPolarHBondContact CD2-CG2 3.42Å; C297-I315 HydrophobicContact CB-CD1 4.02Å; C297-I315 HydrophobicContact CB-CG1 3.87Å; C313-I315 PolarHBondContact O-N 2.98Å; C313-I315 PolarHBondContact SG-N 3.29Å
316	C	94.9	Very high	91.2	Very high	44 Å²	44	69.6 Å²	69.6	30%	0.297	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.9	-2.8	-171.6	66.3	0	0	0	0	114.6	C313 L318	C313-C316 VanDerWaalsContact SG-SG 3.66Å; C316-L318 HydrophobicContact CB-CG 4.41Å; C316-L318 PolarHBondContact O-N 2.91Å
317	R	95.1	Very high	90.9	Very high	206 Å²	206	71 Å²	71	78%	0.777	34%	0.344	S	S	*	.			trans	59.9	4.3	179.5	-52.6	-178.8	-174.6	179.4	1.3	116	C312 C313	C312-R317 WeakPolarHBondContact CB-O 3.48Å; C312-R317 PolarHBondContact SG-O 3.36Å; C312-R317 VanDerWaalsContact SG-O 3.36Å; C313-R317 WeakPolarHBondContact O-CA 3.41Å; C313-R317 PolarHBondContact O-N 2.81Å
318	L	92.1	Very high	90.7	Very high	101 Å²	101	68.3 Å²	68.3	53%	0.529	34%	0.335	S	S	.	.	P	Polyproline II helix	trans	-65.4	144.7	172	-63.7	178	0	0	0	110.8	C293 C312 C313 C316	C293-L318 HydrophobicContact CB-CD1 4.36Å; C312-L318 CarbonylContact C-O 3.56Å; C312-L318 WeakPolarHBondContact CA-O 3.47Å; C313-L318 PolarHBondContact N-O 2.93Å; C316-L318 HydrophobicContact CB-CG 4.41Å; C316-L318 PolarHBondContact O-N 2.91Å
319	P	91	Very high	90.5	Very high	85 Å²	85	59.9 Å²	59.9	55%	0.552	30%	0.302	S	S	*	.	B	Isolated β-bridge	trans	-65.9	137	175.7	28	-34.4	0	0	0	111	N311	N311-P319 CarbonylContact O-C 3.3Å; N311-P319 WeakPolarHBondContact O-CA 3.17Å
320	F	89.3	Confident	90.2	Very high	32 Å²	32	56.1 Å²	56.1	14%	0.14	28%	0.281	C	S	.	.	P	Polyproline II helix	trans	-100.2	152.6	177.2	68.4	-109.1	0	0	0	112.4	I290 L291 L306 A310 N311 L323	I290-F320 HydrophobicContact CG2-CB 3.3Å; I290-F320 HydrophobicContact CG2-CD1 3.88Å; I290-F320 HydrophobicContact CG2-CG 3.8Å; L291-F320 CarbonylContact O-C 3.21Å; L291-F320 VanDerWaalsContact O-CA 3.27Å; L291-F320 WeakPolarHBondContact O-CA 3.35Å; L291-F320 WeakPolarHBondContact O-CB 3.3Å; L306-F320 HydrophobicContact CD2-CE1 3.83Å; L306-F320 HydrophobicContact CD2-CZ 4.37Å; L306-F320 HydrophobicContact CG-CE1 4.09Å; L306-F320 HydrophobicContact CG-CZ 4.32Å; A310-F320 VanDerWaalsContact O-CZ 3.24Å; A310-F320 WeakPolarHBondContact O-CZ 3.26Å; N311-F320 VanDerWaalsContact C-CD1 3.43Å; N311-F320 VanDerWaalsContact C-CE1 3.45Å; N311-F320 WeakPolarHBondContact O-CD1 3.43Å; N311-F320 PolarHBondContact O-N 3.05Å; F320-L323 HydrophobicContact CD2-CD2 4.08Å; F320-L323 HydrophobicContact CD2-CG 4.3Å; F320-L323 HydrophobicContact CE2-CD1 4.17Å; F320-L323 HydrophobicContact CE2-CD2 4.06Å; F320-L323 HydrophobicContact CE2-CG 4.05Å; F320-L323 HydrophobicContact CG-CD2 4.35Å; F320-L323 HydrophobicContact CZ-CD1 4.37Å; F320-L323 HydrophobicContact CZ-CD2 4.3Å
321	R	85.8	Confident	89.9	Confident	159 Å²	159	60.6 Å²	60.6	60%	0.6	29%	0.292	S	S	*	.	S	Bend	trans	-110.8	-30	178.5	-65.4	177.6	179.3	153.8	-0.2	112.5	G51 L291	G51-R321 WeakPolarHBondContact O-CD 3.19Å; G51-R321 PolarHBondContact O-NH1 2.83Å; L291-R321 PolarHBondContact O-N 3.06Å
322	A	86.5	Confident	89.7	Confident	13 Å²	13	60.6 Å²	60.6	11%	0.107	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	158.6	179.5	0	0	0	0	0	110.9	L291 M537	L291-A322 HydrophobicContact CB-CB 4.28Å; L291-A322 HydrophobicContact CD1-CB 4.32Å; L291-A322 PolarHBondContact N-O 3.24Å; A322-M537 HydrophobicContact CB-SD 4.02Å
323	L	89.9	Confident	88.8	Confident	18 Å²	18	66.4 Å²	66.4	9%	0.094	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	124.7	171.9	-59	172.2	0	0	0	106.2	T288 I290 A303 R307 F320	T288-L323 HydrophobicContact CG2-CB 4.15Å; I290-L323 HydrophobicContact CB-CD2 4.33Å; I290-L323 HydrophobicContact CG1-CD2 3.88Å; I290-L323 HydrophobicContact CG2-CD2 4.16Å; A303-L323 HydrophobicContact CB-CD1 4.18Å; A303-L323 WeakPolarHBondContact O-CD1 3.35Å; R307-L323 HydrophobicContact CB-CD1 4.09Å; F320-L323 HydrophobicContact CD2-CD2 4.08Å; F320-L323 HydrophobicContact CD2-CG 4.3Å; F320-L323 HydrophobicContact CE2-CD1 4.17Å; F320-L323 HydrophobicContact CE2-CD2 4.06Å; F320-L323 HydrophobicContact CE2-CG 4.05Å; F320-L323 HydrophobicContact CG-CD2 4.35Å; F320-L323 HydrophobicContact CZ-CD1 4.37Å; F320-L323 HydrophobicContact CZ-CD2 4.3Å
324	L	88.8	Confident	87.4	Confident	11 Å²	11	70.3 Å²	70.3	6%	0.058	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	108.6	-176.5	178.8	69.6	0	0	0	109.2	M39 F54 L289 L291 M537	M39-L324 HydrophobicContact CG-CD1 4.1Å; M39-L324 HydrophobicContact SD-CD1 3.86Å; M39-L324 HydrophobicContact SD-CD2 4.35Å; F54-L324 HydrophobicContact CE1-CD2 3.62Å; F54-L324 HydrophobicContact CZ-CD2 3.78Å; L289-L324 HydrophobicContact CB-CB 4.36Å; L289-L324 WeakPolarHBondContact CB-O 3.44Å; L289-L324 HydrophobicContact CD2-CD2 4.3Å; L289-L324 PolarHBondContact N-O 2.98Å; L289-L324 PolarHBondContact O-N 2.84Å; L291-L324 HydrophobicContact CD1-CB 4.16Å; L324-M537 HydrophobicContact CD1-CG 3.85Å; L324-M537 HydrophobicContact CD1-SD 4.22Å
325	Q	90	Very high	85.3	Confident	15 Å²	15	73.8 Å²	73.8	7%	0.07	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	140.9	170.4	-161.9	-171.4	16.9	0	0	109.9	D287 N300 R327 S535	D287-Q325 HydrophobicContact CB-CG 4.29Å; D287-Q325 CarbonylContact O-C 3.47Å; D287-Q325 PolarHBondContact OD2-NE2 2.86Å; N300-Q325 PolarHBondContact OD1-NE2 2.87Å; N300-Q325 PolarHBondContact OD1-OE1 3.25Å; Q325-R327 VanDerWaalsContact CD-NE 3.27Å; Q325-R327 HydrophobicContact CG-CG 4.22Å; Q325-S535 VanDerWaalsContact O-CA 3.26Å; Q325-S535 WeakPolarHBondContact O-CA 3.12Å; Q325-S535 WeakPolarHBondContact O-CB 3.47Å; Q325-S535 PolarHBondContact O-OG 2.82Å
326	I	88.1	Confident	83	Confident	29 Å²	29	78 Å²	78	15%	0.149	39%	0.387	C	S	.	.			trans	-119.3	106.9	171.9	-47.2	176.8	0	0	0	106.8	I252 D287 L371	I252-I326 HydrophobicContact CD1-CD1 3.98Å; D287-I326 PolarHBondContact O-N 3.24Å; I326-L371 HydrophobicContact CB-CD1 4.22Å; I326-L371 HydrophobicContact CB-CD2 4.17Å; I326-L371 HydrophobicContact CG2-CD2 3.79Å; I326-L371 WeakPolarHBondContact O-CD2 3.47Å
327	R	85.8	Confident	80.5	Confident	55 Å²	55	80.5 Å²	80.5	21%	0.208	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	123.9	172.5	-54.7	-178.3	-172.2	-159.1	-1.6	108	Q325 M329 T533 M534	Q325-R327 VanDerWaalsContact CD-NE 3.27Å; Q325-R327 HydrophobicContact CG-CG 4.22Å; R327-M329 HydrophobicContact CB-CE 4.28Å; R327-T533 CarbonylContact O-C 3.58Å; R327-T533 WeakPolarHBondContact O-CA 3.48Å; R327-T533 WeakPolarHBondContact O-CB 3.2Å; R327-M534 HydrophobicContact CB-CB 4.44Å; R327-M534 WeakPolarHBondContact CB-O 3.46Å; R327-M534 PolarHBondContact N-O 2.97Å; R327-M534 PolarHBondContact O-N 3.16Å
328	A	86.6	Confident	78.2	Confident	3 Å²	3	77 Å²	77	3%	0.025	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	143.6	167.6	0	0	0	0	0	110.7	A368 V369 L371 A374	A328-A368 WeakPolarHBondContact O-CA 3.42Å; A328-V369 HydrophobicContact CB-CG2 3.82Å; A328-V369 PolarHBondContact O-N 3.4Å; A328-L371 HydrophobicContact CB-CD2 3.94Å; A328-A374 HydrophobicContact CB-CB 3.49Å; A328-A374 VanDerWaalsContact CB-CB 3.49Å
329	M	86.1	Confident	75.6	Confident	1 Å²	1	77.9 Å²	77.9	1%	0.005	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	149.6	-179	-58.6	-176.5	-179.1	0	0	109.5	P80 R327 I362 E367 A531 D532 M534	P80-M329 HydrophobicContact CB-SD 4.48Å; R327-M329 HydrophobicContact CB-CE 4.28Å; M329-I362 HydrophobicContact CE-CG1 4.27Å; M329-I362 HydrophobicContact SD-CG2 4.33Å; M329-E367 CarbonylContact C-O 3.57Å; M329-E367 VanDerWaalsContact CA-O 3.31Å; M329-E367 WeakPolarHBondContact CA-O 3.2Å; M329-A531 CarbonylContact O-C 3.56Å; M329-A531 WeakPolarHBondContact O-CA 3.34Å; M329-D532 WeakPolarHBondContact CA-O 3.44Å; M329-D532 WeakPolarHBondContact CB-O 3.38Å; M329-D532 PolarHBondContact N-O 3.36Å; M329-D532 PolarHBondContact O-N 3.14Å; M329-M534 HydrophobicContact CE-CB 3.89Å; M329-M534 HydrophobicContact CE-CG 3.85Å; M329-M534 HydrophobicContact SD-CG 4.12Å
330	R	84.6	Confident	73.4	Confident	74 Å²	74	79.3 Å²	79.3	28%	0.279	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	148.6	167.5	66.4	177.4	174.1	-131.2	-10.4	110.5	K332 Y366 E367 V369 E373	R330-K332 PolarHBondContact O-N 3.15Å; R330-Y366 WeakPolarHBondContact O-CA 3.06Å; R330-E367 HydrophobicContact CG-CG 3.8Å; R330-E367 IonicContact CZ-OE1 3.12Å; R330-E367 VanDerWaalsContact CZ-OE1 3.28Å; R330-E367 PolarHBondContact N-O 2.64Å; R330-E367 IonicContact NE-OE1 2.88Å; R330-E367 PolarHBondContact NE-OE1 3.17Å; R330-E367 IonicContact NH2-OE1 2.67Å; R330-E367 PolarHBondContact NH2-OE1 2.75Å; R330-E367 PolarHBondContact O-N 3.26Å; R330-V369 HydrophobicContact CG-CG1 3.87Å; R330-E373 IonicContact CZ-OE1 3.98Å; R330-E373 IonicContact NH1-OE1 3.81Å; R330-E373 PolarHBondContact NH1-OE1 2.94Å; R330-E373 IonicContact NH2-OE1 3.2Å
331	K	85.6	Confident	70.7	Confident	137 Å²	137	87 Å²	87	60%	0.596	46%	0.464	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.6	123.4	174.5	-168.7	168.2	-173	164.5	0	110.1	L333 Y366	K331-L333 PolarHBondContact O-N 3.43Å; K331-Y366 HydrophobicContact CB-CD1 4.09Å; K331-Y366 HydrophobicContact CB-CE1 3.82Å; K331-Y366 HydrophobicContact CG-CE1 4.17Å
332	K	84.4	Confident	68.7	Low	109 Å²	109	86.8 Å²	86.8	47%	0.474	48%	0.475	S	S	.	.			trans	-69.3	118.1	179.3	-164.7	-178.2	-163.5	83.4	0	109.6	R330 S334 G365 E367	R330-K332 PolarHBondContact O-N 3.15Å; K332-S334 VanDerWaalsContact C-N 3.3Å; K332-S334 PolarHBondContact O-N 2.69Å; K332-G365 WeakPolarHBondContact CB-O 3.5Å; K332-G365 PolarHBondContact N-O 3.44Å; K332-E367 IonicContact NZ-OE2 3.5Å; K332-E367 PolarHBondContact NZ-OE2 2.67Å
333	L	76.1	Confident	66.5	Low	165 Å²	165	92 Å²	92	86%	0.864	51%	0.508	S	S	*	.			trans	-73.9	84.2	173.6	-66.1	177.8	0	0	0	109.9	K331 P335	K331-L333 PolarHBondContact O-N 3.43Å; L333-P335 WeakPolarHBondContact O-CD 3.31Å
334	S	65.3	Low	64	Low	85 Å²	85	96.7 Å²	96.7	59%	0.594	54%	0.537	S	S	*	.			trans	-55.7	122.7	176.6	-68.2	0	0	0	0	111.8	K332 L336	K332-S334 VanDerWaalsContact C-N 3.3Å; K332-S334 PolarHBondContact O-N 2.69Å; S334-L336 PolarHBondContact O-N 3.15Å
335	P	52	Low	61.7	Low	123 Å²	123	103.6 Å²	103.6	80%	0.799	57%	0.572	S	S	*	*			trans	-61.9	124.1	171.9	-22.2	33.9	0	0	0	110.9	L333 S337	L333-P335 WeakPolarHBondContact O-CD 3.31Å; P335-S337 PolarHBondContact O-N 3.34Å
336	L	45.3	Very low	58.9	Low	172 Å²	172	109.2 Å²	109.2	90%	0.901	61%	0.608	S	S	*	*	S	Bend	trans	-74.6	86.2	178.2	-72.9	172.4	0	0	0	111.5	S334	S334-L336 PolarHBondContact O-N 3.15Å
337	S	42.7	Very low	56.5	Low	97 Å²	97	112.8 Å²	112.8	68%	0.678	64%	0.635	S	S	*	*			trans	-165.9	121.3	159.5	-84.4	0	0	0	0	113.3	P335	P335-S337 PolarHBondContact O-N 3.34Å
338	P	46.9	Very low	54.1	Low	133 Å²	133	118.4 Å²	118.4	86%	0.864	66%	0.664	S	S	*	*			trans	-92.9	102.3	168.9	33.8	-28.9	0	0	0	111.3
339	T	36.3	Very low	51.5	Low	119 Å²	119	124.7 Å²	124.7	73%	0.73	70%	0.702	S	S	*	*			trans	-128.9	105.3	167.8	42.3	0	0	0	0	111	F341	T339-F341 PolarHBondContact O-N 3.02Å
340	S	45.5	Very low	48.9	Very low	116 Å²	116	129.6 Å²	129.6	81%	0.811	74%	0.737	S	S	*	*			trans	-74.1	110.4	-179.7	55.1	0	0	0	0	112.2
341	F	33	Very low	46.5	Very low	192 Å²	192	133.5 Å²	133.5	84%	0.842	76%	0.763	S	S	*	*			trans	-138.1	104.3	161.9	-85.6	-77.9	0	0	0	110.5	T339 P343	T339-F341 PolarHBondContact O-N 3.02Å; F341-P343 WeakPolarHBondContact O-CD 3.43Å
342	N	43.9	Very low	44.1	Very low	156 Å²	156	131.6 Å²	131.6	83%	0.834	77%	0.767	S	S	*	*			trans	-81.1	124	167.6	-75.9	-28	0	0	0	109.8	V344	N342-V344 HydrophobicContact CB-CG2 4.5Å
343	P	40.8	Very low	41.8	Very low	123 Å²	123	134.6 Å²	134.6	80%	0.799	78%	0.783	S	S	*	*			trans	-82.4	139	146.6	33.4	-28.7	0	0	0	109.4	F341	F341-P343 WeakPolarHBondContact O-CD 3.43Å
344	V	36.7	Very low	40	Very low	116 Å²	116	135.2 Å²	135.2	70%	0.703	78%	0.781	S	S	*	*			trans	-117.5	134.8	-179.1	165	0	0	0	0	108.6	N342	N342-V344 HydrophobicContact CB-CG2 4.5Å
345	I	40.2	Very low	38.6	Very low	155 Å²	155	139.5 Å²	139.5	80%	0.795	79%	0.792	S	S	*	*			trans	69.9	129.9	-179.9	-62.9	157.4	0	0	0	111.6
346	T	32	Very low	38	Very low	134 Å²	134	136.9 Å²	136.9	82%	0.822	78%	0.776	S	S	*	*			cis	-127.1	148.8	36.6	47.4	0	0	0	0	115.8
347	S	35.8	Very low	37.8	Very low	103 Å²	103	136.7 Å²	136.7	72%	0.72	77%	0.771	S	S	*	*			trans	-105.2	146.9	163.3	52.3	0	0	0	0	111.8
348	Q	35.5	Very low	37.9	Very low	173 Å²	173	135.6 Å²	135.6	81%	0.808	77%	0.768	S	S	*	*				166.1	153.2	122.1	-91.3	178.9	53.9	0	0	111.8
349	T	32.2	Very low	38	Very low	135 Å²	135	133 Å²	133	83%	0.828	75%	0.753	S	S	*	*			trans	64.8	133.3	-175.9	67.8	0	0	0	0	114.4
350	S	32.6	Very low	38.8	Very low	104 Å²	104	135 Å²	135	73%	0.727	75%	0.754	S	S	*	*			cis	-132.1	151.6	4.2	-63.6	0	0	0	0	111.3
351	D	33.6	Very low	40	Very low	156 Å²	156	133.7 Å²	133.7	83%	0.834	74%	0.735	S	S	*	*			trans	-66.9	132.9	170.2	-56.8	-64.4	0	0	0	110.3
352	S	35.2	Very low	42.2	Very low	98 Å²	98	127 Å²	127	69%	0.685	71%	0.707	S	S	*	*			trans	-154.1	53	175.2	-65	0	0	0	0	109.4	E354	S352-E354 PolarHBondContact O-N 3.32Å
353	E	36.5	Very low	44	Very low	172 Å²	172	120.1 Å²	120.1	80%	0.804	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.4	54.1	-179.1	-72.1	-76.6	98.7	0	0	112.2
354	E	37	Very low	46	Very low	178 Å²	178	120.2 Å²	120.2	83%	0.832	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-141.2	11.2	-175.6	-151.7	169.4	-151.8	0	0	113.5	S352	S352-E354 PolarHBondContact O-N 3.32Å
355	H	37.7	Very low	48.3	Very low	174 Å²	174	116.5 Å²	116.5	81%	0.806	66%	0.657	S	S	*	*	S	Bend	trans	-124.6	-0.5	177.1	-79.9	32.9	0	0	0	114.2
356	S	38.9	Very low	50.5	Low	69 Å²	69	111.3 Å²	111.3	48%	0.483	63%	0.628	S	S	.	*	G	3₁₀ helix	trans	-80.8	-23.6	-171.9	-57.3	0	0	0	0	114.8	A358 S359	S356-A358 PolarHBondContact O-N 3.39Å; S356-S359 WeakPolarHBondContact O-CB 3.28Å; S356-S359 PolarHBondContact O-N 3.49Å; S356-S359 PolarHBondContact O-OG 3.22Å
357	Q	41.2	Very low	53.1	Low	167 Å²	167	107.5 Å²	107.5	78%	0.78	60%	0.601	S	S	*	*	G	3₁₀ helix	trans	-63.8	-23.5	-173.9	-84.1	-177	-48	0	0	114.5	S359 E360	Q357-S359 PolarHBondContact O-N 2.97Å; Q357-E360 PolarHBondContact O-N 2.93Å
358	A	44.3	Very low	55.6	Low	74 Å²	74	105.3 Å²	105.3	61%	0.612	59%	0.589	S	S	*	*	G	3₁₀ helix	trans	-63.9	-22	172.9	0	0	0	0	0	113.4	S356	S356-A358 PolarHBondContact O-N 3.39Å
359	S	48.9	Very low	58.1	Low	80 Å²	80	98 Å²	98	56%	0.559	56%	0.556	S	S	*	*	G	3₁₀ helix	trans	-84.1	-19.5	-178.4	72.2	0	0	0	0	114.4	S356 Q357 H361 I362	S356-S359 WeakPolarHBondContact O-CB 3.28Å; S356-S359 PolarHBondContact O-N 3.49Å; S356-S359 PolarHBondContact O-OG 3.22Å; Q357-S359 PolarHBondContact O-N 2.97Å; S359-H361 PolarHBondContact O-N 2.75Å; S359-I362 PolarHBondContact O-N 2.83Å
360	E	54.4	Low	60.7	Low	160 Å²	160	93.7 Å²	93.7	75%	0.748	53%	0.532	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.5	-11.6	-166.1	-163	164.3	-155.6	0	0	114	Q357	Q357-E360 PolarHBondContact O-N 2.93Å
361	H	68.8	Low	63.2	Low	88 Å²	88	89.8 Å²	89.8	41%	0.407	50%	0.502	S	S	.	.	T	Hydrogen-bonded Turn	trans	-129.4	20.1	-176	-153.4	-56.3	0	0	0	113.4	S359	S359-H361 PolarHBondContact O-N 2.75Å
362	I	79.3	Confident	65.5	Low	51 Å²	51	84.7 Å²	84.7	26%	0.262	48%	0.475	S	S	.	.	S	Bend	trans	-98.2	119.8	174	-56.3	177.2	0	0	0	109	M329 S359 A368	M329-I362 HydrophobicContact CE-CG1 4.27Å; M329-I362 HydrophobicContact SD-CG2 4.33Å; S359-I362 PolarHBondContact O-N 2.83Å; I362-A368 HydrophobicContact CD1-CB 3.84Å
363	P	81.7	Confident	67.9	Low	13 Å²	13	82.1 Å²	82.1	8%	0.084	45%	0.452	C	S	.	.	P	Polyproline II helix	trans	-61.1	144.2	-179.5	-26.7	36.4	0	0	0	113.8	Q78 G365 Y366	Q78-P363 WeakPolarHBondContact O-CB 3.22Å; P363-G365 PolarHBondContact O-N 3.47Å; P363-Y366 HydrophobicContact CB-CD2 3.9Å; P363-Y366 HydrophobicContact CB-CE2 4.43Å; P363-Y366 PolarHBondContact O-N 3.35Å
364	P	83	Confident	70.2	Confident	125 Å²	125	75.7 Å²	75.7	81%	0.812	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.6	125.7	-179.7	-27.4	35.4	0	0	0	113.2
365	G	85.2	Confident	72.4	Confident	38 Å²	38	72.5 Å²	72.5	39%	0.392	42%	0.416	S	S	.	.	T	Hydrogen-bonded Turn	trans	91	5.3	-177.5	0	0	0	0	0	114.8	K332 P363	K332-G365 WeakPolarHBondContact CB-O 3.5Å; K332-G365 PolarHBondContact N-O 3.44Å; P363-G365 PolarHBondContact O-N 3.47Å
366	Y	86	Confident	74.4	Confident	45 Å²	45	67.3 Å²	67.3	18%	0.176	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	162.6	167.7	-63.9	-96.2	0	0	0	110.9	P80 R330 K331 P363 D532	P80-Y366 HydrophobicContact CG-CD1 4.14Å; P80-Y366 HydrophobicContact CG-CE1 3.74Å; P80-Y366 HydrophobicContact CG-CE2 4.14Å; R330-Y366 WeakPolarHBondContact O-CA 3.06Å; K331-Y366 HydrophobicContact CB-CD1 4.09Å; K331-Y366 HydrophobicContact CB-CE1 3.82Å; K331-Y366 HydrophobicContact CG-CE1 4.17Å; P363-Y366 HydrophobicContact CB-CD2 3.9Å; P363-Y366 HydrophobicContact CB-CE2 4.43Å; P363-Y366 PolarHBondContact O-N 3.35Å; Y366-D532 WeakPolarHBondContact CE1-OD2 3.28Å
367	E	88.6	Confident	76.3	Confident	54 Å²	54	65 Å²	65	25%	0.252	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	142.6	167.9	57	-174.8	-141.6	0	0	109.3	M329 R330 K332	M329-E367 CarbonylContact C-O 3.57Å; M329-E367 VanDerWaalsContact CA-O 3.31Å; M329-E367 WeakPolarHBondContact CA-O 3.2Å; R330-E367 HydrophobicContact CG-CG 3.8Å; R330-E367 IonicContact CZ-OE1 3.12Å; R330-E367 VanDerWaalsContact CZ-OE1 3.28Å; R330-E367 PolarHBondContact N-O 2.64Å; R330-E367 IonicContact NE-OE1 2.88Å; R330-E367 PolarHBondContact NE-OE1 3.17Å; R330-E367 IonicContact NH2-OE1 2.67Å; R330-E367 PolarHBondContact NH2-OE1 2.75Å; R330-E367 PolarHBondContact O-N 3.26Å; K332-E367 IonicContact NZ-OE2 3.5Å; K332-E367 PolarHBondContact NZ-OE2 2.67Å
368	A	87.3	Confident	77.9	Confident	58 Å²	58	59.8 Å²	59.8	48%	0.479	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	147	177.3	0	0	0	0	0	111	A328 I362	A328-A368 WeakPolarHBondContact O-CA 3.42Å; I362-A368 HydrophobicContact CD1-CB 3.84Å
369	V	87.4	Confident	78.6	Confident	19 Å²	19	60 Å²	60	12%	0.115	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	157	175.4	-71.3	0	0	0	0	109.3	A328 R330 A374	A328-V369 HydrophobicContact CB-CG2 3.82Å; A328-V369 PolarHBondContact O-N 3.4Å; R330-V369 HydrophobicContact CG-CG1 3.87Å; V369-A374 HydrophobicContact CG2-CB 4.21Å
370	S	86.4	Confident	78.5	Confident	45 Å²	45	63.1 Å²	63.1	32%	0.315	36%	0.363	S	S	.	.			trans	-67.4	151.6	176	73	0	0	0	0	110.9	L372 E373 A374	S370-L372 PolarHBondContact O-N 3.35Å; S370-E373 PolarHBondContact O-N 3.38Å; S370-E373 VanDerWaalsContact O-N 3.17Å; S370-E373 VanDerWaalsContact OG-CB 3.22Å; S370-E373 WeakPolarHBondContact OG-CB 3.25Å; S370-E373 PolarHBondContact OG-N 3.41Å; S370-E373 VanDerWaalsContact OG-N 3.1Å; S370-A374 PolarHBondContact O-N 3.26Å
371	L	85.4	Confident	77.8	Confident	21 Å²	21	61.8 Å²	61.8	11%	0.11	37%	0.366	C	S	.	.	H	α-helix	trans	-58.3	-37	175.5	-66.6	-179.8	0	0	0	111.8	L296 I326 A328 A374 L375	L296-L371 HydrophobicContact CD1-CD1 4.37Å; L296-L371 HydrophobicContact CD2-CD1 4.05Å; I326-L371 HydrophobicContact CB-CD1 4.22Å; I326-L371 HydrophobicContact CB-CD2 4.17Å; I326-L371 HydrophobicContact CG2-CD2 3.79Å; I326-L371 WeakPolarHBondContact O-CD2 3.47Å; A328-L371 HydrophobicContact CB-CD2 3.94Å; L371-A374 PolarHBondContact O-N 3.16Å; L371-L375 WeakPolarHBondContact O-CB 3.4Å; L371-L375 VanDerWaalsContact O-CG 3.26Å; L371-L375 WeakPolarHBondContact O-CG 3.37Å; L371-L375 PolarHBondContact O-N 3.05Å
372	L	82.7	Confident	76.2	Confident	50 Å²	50	62.2 Å²	62.2	26%	0.262	38%	0.379	S	S	.	.	H	α-helix	trans	-67.3	-37.1	178.3	-169.4	68.4	0	0	0	112.4	S370 N376	S370-L372 PolarHBondContact O-N 3.35Å; L372-N376 WeakPolarHBondContact CD1-ND2 3.15Å; L372-N376 WeakPolarHBondContact O-CB 3.3Å; L372-N376 PolarHBondContact O-N 3.39Å; L372-N376 PolarHBondContact O-ND2 2.82Å
373	E	85.5	Confident	74.1	Confident	43 Å²	43	64.6 Å²	64.6	20%	0.201	40%	0.4	C	S	.	.	H	α-helix	trans	-71.8	-35.6	173.7	-171.5	-171	178.4	0	0	111.8	R330 S370 L375 G377	R330-E373 IonicContact CZ-OE1 3.98Å; R330-E373 IonicContact NH1-OE1 3.81Å; R330-E373 PolarHBondContact NH1-OE1 2.94Å; R330-E373 IonicContact NH2-OE1 3.2Å; S370-E373 PolarHBondContact O-N 3.38Å; S370-E373 VanDerWaalsContact O-N 3.17Å; S370-E373 VanDerWaalsContact OG-CB 3.22Å; S370-E373 WeakPolarHBondContact OG-CB 3.25Å; S370-E373 PolarHBondContact OG-N 3.41Å; S370-E373 VanDerWaalsContact OG-N 3.1Å; E373-L375 VanDerWaalsContact C-N 3.31Å; E373-L375 PolarHBondContact O-N 3.11Å; E373-G377 CarbonylContact O-C 3.6Å; E373-G377 WeakPolarHBondContact O-CA 3.46Å; E373-G377 PolarHBondContact O-N 3.03Å; E373-G377 VanDerWaalsContact O-O 3.11Å
374	A	85.3	Confident	71.6	Confident	37 Å²	37	69.5 Å²	69.5	31%	0.306	43%	0.43	S	S	.	.	H	α-helix	trans	-67	-32.6	175.2	0	0	0	0	0	112.6	A328 V369 S370 L371 A531	A328-A374 HydrophobicContact CB-CB 3.49Å; A328-A374 VanDerWaalsContact CB-CB 3.49Å; V369-A374 HydrophobicContact CG2-CB 4.21Å; S370-A374 PolarHBondContact O-N 3.26Å; L371-A374 PolarHBondContact O-N 3.16Å; A374-A531 HydrophobicContact CB-CB 4.27Å
375	L	82	Confident	69.3	Low	111 Å²	111	69 Å²	69	58%	0.581	42%	0.424	S	S	*	.	H	α-helix	trans	-83.3	-33.7	178.6	-69.8	169.3	0	0	0	113.8	I255 L371 E373	I255-L375 HydrophobicContact CD1-CD1 3.82Å; I255-L375 HydrophobicContact CG1-CD1 3.84Å; L371-L375 WeakPolarHBondContact O-CB 3.4Å; L371-L375 VanDerWaalsContact O-CG 3.26Å; L371-L375 WeakPolarHBondContact O-CG 3.37Å; L371-L375 PolarHBondContact O-N 3.05Å; E373-L375 VanDerWaalsContact C-N 3.31Å; E373-L375 PolarHBondContact O-N 3.11Å
376	N	80.6	Confident	67	Low	65 Å²	65	72 Å²	72	35%	0.348	44%	0.437	S	S	.	.	H	α-helix	trans	-101.4	-10.1	-178.2	-71.1	-70.3	0	0	0	114.5	N257 L372	N257-N376 PolarHBondContact ND2-OD1 2.82Å; N257-N376 PolarHBondContact OD1-ND2 2.72Å; N257-N376 PolarHBondContact OD1-OD1 3.4Å; L372-N376 WeakPolarHBondContact CD1-ND2 3.15Å; L372-N376 WeakPolarHBondContact O-CB 3.3Å; L372-N376 PolarHBondContact O-N 3.39Å; L372-N376 PolarHBondContact O-ND2 2.82Å
377	G	78.5	Confident	64.6	Low	21 Å²	21	75 Å²	75	22%	0.216	46%	0.462	C	S	.	.			trans	78.6	179	-163.1	0	0	0	0	0	112.9	E373 L379	E373-G377 CarbonylContact O-C 3.6Å; E373-G377 WeakPolarHBondContact O-CA 3.46Å; E373-G377 PolarHBondContact O-N 3.03Å; E373-G377 VanDerWaalsContact O-O 3.11Å; G377-L379 PolarHBondContact O-N 3.1Å
378	P	73.9	Confident	62.1	Low	57 Å²	57	77.9 Å²	77.9	37%	0.37	49%	0.485	S	S	.	.			trans	-58.7	119.5	-176.4	-25.7	35.7	0	0	0	112.9	N380 I529	P378-N380 PolarHBondContact O-N 3.37Å; P378-I529 HydrophobicContact CG-CD1 4.3Å
379	L	58.9	Low	59.5	Low	79 Å²	79	83.6 Å²	83.6	41%	0.414	51%	0.507	S	S	.	.			trans	-70.6	80.9	173	-65.3	177.8	0	0	0	109.8	Y259 G377 T381	Y259-L379 HydrophobicContact CE2-CD2 4.23Å; G377-L379 PolarHBondContact O-N 3.1Å; L379-T381 VanDerWaalsContact C-N 3.26Å; L379-T381 PolarHBondContact O-N 3.3Å
380	N	47.3	Very low	57	Low	145 Å²	145	91.3 Å²	91.3	78%	0.775	54%	0.541	S	S	*	.			trans	-68.5	78.2	-179.7	-82.5	-23.3	0	0	0	111.7	P378 S382	P378-N380 PolarHBondContact O-N 3.37Å; N380-S382 PolarHBondContact O-N 3.27Å
381	T	39.9	Very low	54.6	Low	132 Å²	132	95 Å²	95	81%	0.81	57%	0.567	S	S	*	*			trans	-68.6	70	160.1	46.8	0	0	0	0	109.4	L379 S383	L379-T381 VanDerWaalsContact C-N 3.26Å; L379-T381 PolarHBondContact O-N 3.3Å; T381-S383 VanDerWaalsContact C-N 3.26Å; T381-S383 PolarHBondContact O-N 3.1Å
382	S	35.3	Very low	52.1	Low	97 Å²	97	97.3 Å²	97.3	68%	0.678	60%	0.596	S	S	*	*			trans	-65	89.6	173.6	-170.9	0	0	0	0	108.7	N380 V384	N380-S382 PolarHBondContact O-N 3.27Å; S382-V384 PolarHBondContact O-N 2.88Å
383	S	34.4	Very low	50.1	Low	102 Å²	102	100.6 Å²	100.6	71%	0.713	62%	0.62	S	S	*	*			trans	-66.5	89	171.6	-173.7	0	0	0	0	107.9	T381 V385	T381-S383 VanDerWaalsContact C-N 3.26Å; T381-S383 PolarHBondContact O-N 3.1Å; S383-V385 PolarHBondContact O-N 3.13Å
384	V	30.3	Very low	47.5	Very low	116 Å²	116	103 Å²	103	70%	0.703	64%	0.642	S	S	*	*			trans	-71.3	80.1	173.4	-177.7	0	0	0	0	107.4	S382 P386	S382-V384 PolarHBondContact O-N 2.88Å; V384-P386 WeakPolarHBondContact O-CD 3.39Å; V384-P386 VanDerWaalsContact O-N 3.1Å
385	V	34.4	Very low	45.1	Very low	113 Å²	113	109.2 Å²	109.2	69%	0.685	66%	0.664	S	S	*	*			trans	-53.3	114.8	170.4	177.6	0	0	0	0	107.5	S383	S383-V385 PolarHBondContact O-N 3.13Å
386	P	36.4	Very low	42.7	Very low	103 Å²	103	109.4 Å²	109.4	67%	0.669	67%	0.67	S	S	*	*	P	Polyproline II helix	trans	-63.3	132.6	-179.6	-22.3	34.4	0	0	0	109.6	V384	V384-P386 WeakPolarHBondContact O-CD 3.39Å; V384-P386 VanDerWaalsContact O-N 3.1Å
387	P	36.7	Very low	40.3	Very low	108 Å²	108	113 Å²	113	70%	0.701	69%	0.694	S	S	*	*	P	Polyproline II helix	trans	-61.4	138.9	176.4	25.8	-33.6	0	0	0	109.7	L389	P387-L389 PolarHBondContact O-N 2.84Å
388	P	35.5	Very low	37.9	Very low	113 Å²	113	115.2 Å²	115.2	73%	0.734	72%	0.717	S	S	*	*	P	Polyproline II helix	trans	-63.9	124.2	-172.5	24.7	-33.9	0	0	0	111.4	H390	P388-H390 PolarHBondContact O-N 2.97Å
389	L	33.3	Very low	35.9	Very low	178 Å²	178	119.6 Å²	119.6	93%	0.932	74%	0.742	S	S	*	*			trans	-67.2	94.5	176.6	-75.9	168.2	0	0	0	110.7	P387 S391	P387-L389 PolarHBondContact O-N 2.84Å; L389-S391 PolarHBondContact O-N 2.89Å
390	H	34.7	Very low	34.5	Very low	182 Å²	182	123.5 Å²	123.5	84%	0.843	76%	0.763	S	S	*	*			trans	-64.8	115.4	168.6	-97.5	-80.6	0	0	0	110.4	P388	P388-H390 PolarHBondContact O-N 2.97Å
391	S	36.7	Very low	34.6	Very low	121 Å²	121	122.3 Å²	122.3	85%	0.846	76%	0.762	S	S	*	*			trans	-74.6	126.3	177.3	45.1	0	0	0	0	111.6	L389	L389-S391 PolarHBondContact O-N 2.89Å
392	G	32.7	Very low	34.8	Very low	70 Å²	70	121.3 Å²	121.3	72%	0.722	76%	0.758	S	S	*	*			trans	-133.2	125.3	177.5	0	0	0	0	0	111.3
393	P	40.8	Very low	34.5	Very low	119 Å²	119	127 Å²	127	77%	0.773	77%	0.767	S	S	*	*			trans	-92.7	132.4	-175.9	33.4	-32.8	0	0	0	114.4
394	S	30.1	Very low	34.2	Very low	95 Å²	95	126.4 Å²	126.4	66%	0.664	76%	0.762	S	S	*	*			trans	56.4	112.9	139.2	-46.3	0	0	0	0	121.2
395	H	33.9	Very low	34.1	Very low	167 Å²	167	126.3 Å²	126.3	77%	0.773	77%	0.766	S	S	*	*				169.3	116.3	97.6	-96	-74.7	0	0	0	116.2
396	V	32	Very low	33.9	Very low	114 Å²	114	128.9 Å²	128.9	69%	0.691	77%	0.771	S	S	*	*				60.3	139.5	126.3	-179.7	0	0	0	0	122.5
397	T	30.6	Very low	34.3	Very low	142 Å²	142	129.3 Å²	129.3	87%	0.871	77%	0.774	S	S	*	*			trans	68.6	137.7	168.7	35.7	0	0	0	0	118.9
398	G	27.6	Very low	34.1	Very low	66 Å²	66	132.3 Å²	132.3	68%	0.68	78%	0.778	S	S	*	*			cis	163.9	177.7	-7.3	0	0	0	0	0	114.4
399	V	31.5	Very low	34.4	Very low	149 Å²	149	133 Å²	133	90%	0.903	78%	0.783	S	S	*	*			trans	83.5	147.6	176.5	-169.5	0	0	0	0	116.1
400	L	30.6	Very low	34.3	Very low	162 Å²	162	128.9 Å²	128.9	85%	0.848	77%	0.774	S	S	*	*			trans	-119.3	-156.3	-172.2	-49.5	167.3	0	0	0	111.2
401	P	49.2	Very low	34.8	Very low	119 Å²	119	125.3 Å²	125.3	77%	0.773	77%	0.767	S	S	*	*			trans	-113.3	-158.4	-143.7	38	-13.6	0	0	0	112.4
402	P	44.8	Very low	34.3	Very low	111 Å²	111	125 Å²	125	72%	0.721	76%	0.761	S	S	*	*				-156	-172.9	75.8	43.8	-22.5	0	0	0	116.7
403	Y	29.3	Very low	34.1	Very low	218 Å²	218	133 Å²	133	86%	0.855	77%	0.769	S	S	*	*			trans	8.8	153.4	143.8	-83.3	-123.1	0	0	0	121.1
404	S	27.8	Very low	33.4	Very low	88 Å²	88	131.8 Å²	131.8	62%	0.615	76%	0.763	S	S	*	*			cis	179.5	-176.8	-8.8	57.6	0	0	0	0	111.6
405	S	27.9	Very low	33.4	Very low	114 Å²	114	135.3 Å²	135.3	80%	0.797	77%	0.773	S	S	*	*			trans	97.3	141.3	148.3	-51.3	0	0	0	0	121.8
406	E	30.8	Very low	33.1	Very low	167 Å²	167	132.3 Å²	132.3	78%	0.78	77%	0.772	S	S	*	*			trans	-75.1	-172.9	168.6	-107.1	-165.2	100.1	0	0	113.8
407	P	43.5	Very low	33.5	Very low	112 Å²	112	133 Å²	133	73%	0.727	78%	0.779	S	S	*	*			cis	-137.3	-172.1	8.5	32	-7.6	0	0	0	117.2
408	H	33.1	Very low	33.7	Very low	172 Å²	172	133.1 Å²	133.1	80%	0.796	77%	0.773	S	S	*	*			trans	-70	162.6	168.1	-64.2	-80.6	0	0	0	114.5
409	P	42.5	Very low	33.7	Very low	128 Å²	128	136 Å²	136	83%	0.831	77%	0.772	S	S	*	*				-149.6	177.7	84.7	39.8	-20.4	0	0	0	117.1
410	A	29.8	Very low	33.7	Very low	90 Å²	90	136.2 Å²	136.2	74%	0.744	76%	0.764	S	S	*	*			trans	-99.8	-166	172.7	0	0	0	0	0	110.7
411	P	45.4	Very low	33.7	Very low	107 Å²	107	132.6 Å²	132.6	70%	0.695	75%	0.752	S	S	*	*			cis	-148.8	-166.1	11.3	42.8	-19.6	0	0	0	118.6
412	T	26.6	Very low	32.7	Very low	116 Å²	116	134.2 Å²	134.2	71%	0.712	75%	0.754	S	S	*	*			trans	86.7	135.5	148.7	34.6	0	0	0	0	124.4
413	R	29.4	Very low	31.9	Very low	237 Å²	237	134 Å²	134	89%	0.894	76%	0.755	S	S	*	*			trans	75.9	144.7	152.9	-72.1	174.4	-179.4	176.5	0.6	118
414	S	25.9	Very low	31.9	Very low	93 Å²	93	128.2 Å²	128.2	65%	0.65	75%	0.747	S	S	*	*			cis	-173.1	167.8	-8.5	48.1	0	0	0	0	113.9
415	L	28.7	Very low	32.1	Very low	169 Å²	169	133.1 Å²	133.1	89%	0.885	76%	0.76	S	S	*	*			trans	86.3	135.8	158.8	-57.5	-178.3	0	0	0	119.7
416	S	28.2	Very low	32	Very low	105 Å²	105	130.9 Å²	130.9	73%	0.734	76%	0.755	S	S	*	*			trans	-95.1	-177	162.2	54	0	0	0	0	110.7
417	P	41.2	Very low	31.8	Very low	129 Å²	129	130.9 Å²	130.9	84%	0.838	76%	0.759	S	S	*	*				-138.1	178.1	94.8	36.2	-21.9	0	0	0	114.9
418	L	33.2	Very low	31	Very low	143 Å²	143	133.9 Å²	133.9	75%	0.749	76%	0.761	S	S	*	*			trans	-121.9	156.3	-177	-173.5	80.4	0	0	0	109.3
419	D	27.6	Very low	30.7	Very low	126 Å²	126	131.8 Å²	131.8	67%	0.674	76%	0.755	S	S	*	*			trans	177.9	128.1	136.3	-90.4	-16.3	0	0	0	110.1
420	Q	32.2	Very low	29.9	Very low	154 Å²	154	134.3 Å²	134.3	72%	0.72	75%	0.753	S	S	*	*				73.9	138.7	75	-70.8	-166.7	81.6	0	0	114.6
421	S	30.9	Very low	29.8	Very low	86 Å²	86	138.9 Å²	138.9	60%	0.601	76%	0.756	S	S	*	*			cis	-168.8	162.7	-9.7	54.7	0	0	0	0	114
422	N	28	Very low	28.9	Very low	154 Å²	154	139.5 Å²	139.5	82%	0.824	76%	0.763	S	S	*	*			trans	58.4	135.1	144.1	-61.4	-12.5	0	0	0	125.7
423	S	28.9	Very low	28.9	Very low	106 Å²	106	137.1 Å²	137.1	74%	0.741	76%	0.762	S	S	*	*				116.6	96.2	122.6	-145	0	0	0	0	122.9
424	S	29.2	Very low	29.1	Very low	96 Å²	96	130.7 Å²	130.7	67%	0.671	75%	0.753	S	S	*	*				71.7	152.6	123.8	84.1	0	0	0	0	125
425	Q	30.7	Very low	29.5	Very low	191 Å²	191	136 Å²	136	89%	0.893	76%	0.764	S	S	*	*			trans	73.4	123.3	158.8	-58.4	-168	16.4	0	0	121.9
426	G	25.7	Very low	29.6	Very low	67 Å²	67	132.5 Å²	132.5	69%	0.691	75%	0.754	S	S	*	*				111.6	81	102	0	0	0	0	0	122
427	L	27.4	Very low	29.7	Very low	167 Å²	167	134.3 Å²	134.3	87%	0.874	76%	0.755	S	S	*	*			trans	67.9	145.9	136.4	-71.6	172.6	0	0	0	123.5
428	K	26	Very low	29.2	Very low	175 Å²	175	133.3 Å²	133.3	76%	0.761	75%	0.751	S	S	*	*			trans	87.2	107.4	143.3	-84.3	-176.1	177.3	174.3	0	122.9
429	L	27.1	Very low	29.2	Very low	129 Å²	129	132.9 Å²	132.9	68%	0.675	75%	0.745	S	S	*	*				108.9	133.1	111.9	-124.2	82.1	0	0	0	121.9
430	K	26.3	Very low	29.3	Very low	181 Å²	181	132.7 Å²	132.7	79%	0.787	74%	0.744	S	S	*	*			trans	65.1	150.8	154.5	-77.4	176.3	-174.3	174.1	0	118.5
431	K	26.8	Very low	29.4	Very low	186 Å²	186	129.7 Å²	129.7	81%	0.809	74%	0.74	S	S	*	*			cis	148.6	116.1	-16.4	167.3	177.3	177.9	172.4	0	107.4
432	S	27.8	Very low	29.4	Very low	119 Å²	119	131 Å²	131	83%	0.832	75%	0.749	S	S	*	*			trans	169.6	139.4	144.7	-74.1	0	0	0	0	105.9
433	G	26.2	Very low	29.4	Very low	67 Å²	67	129.1 Å²	129.1	69%	0.691	74%	0.743	S	S	*	*			cis	110.4	134.4	32.2	0	0	0	0	0	108.2
434	S	33.7	Very low	29.7	Very low	102 Å²	102	131.4 Å²	131.4	71%	0.713	75%	0.746	S	S	*	*			cis	-165.8	145.6	11.4	-56	0	0	0	0	113.5
435	K	34	Very low	30.5	Very low	203 Å²	203	131.8 Å²	131.8	88%	0.883	75%	0.746	S	S	*	*			trans	67.5	164.8	144.8	-64.6	171.4	-176.8	-174.8	0	116.8
436	S	30.5	Very low	30.4	Very low	96 Å²	96	131 Å²	131	67%	0.671	74%	0.743	S	S	*	*			cis	-157.2	140.1	24.2	55.7	0	0	0	0	117.2
437	L	31.2	Very low	30.9	Very low	144 Å²	144	135.5 Å²	135.5	75%	0.754	75%	0.745	S	S	*	*			trans	61.7	154	135.2	-59.4	169.2	0	0	0	120	Q439	L437-Q439 HydrophobicContact CD2-CB 4.44Å; L437-Q439 HydrophobicContact CD2-CG 3.79Å
438	S	30.6	Very low	31.2	Very low	107 Å²	107	136.2 Å²	136.2	75%	0.748	74%	0.744	S	S	*	*			cis	-118	156.8	8.4	56.1	0	0	0	0	112.5
439	Q	32.3	Very low	31.5	Very low	135 Å²	135	135.2 Å²	135.2	63%	0.631	75%	0.747	S	S	*	*			cis	69.9	136.4	43.1	-78.8	-158.3	-15.1	0	0	113.9	L437	L437-Q439 HydrophobicContact CD2-CB 4.44Å; L437-Q439 HydrophobicContact CD2-CG 3.79Å
440	N	30.8	Very low	32	Very low	121 Å²	121	137.1 Å²	137.1	65%	0.647	75%	0.753	S	S	*	*			cis	-151.8	173.6	9	-94.8	-37.7	0	0	0	110.2
441	S	34.2	Very low	32.1	Very low	91 Å²	91	138.1 Å²	138.1	64%	0.636	76%	0.757	S	S	*	*			cis	172.8	-170.5	-29.3	-84.5	0	0	0	0	108.8
442	S	31.1	Very low	32.2	Very low	113 Å²	113	134.3 Å²	134.3	79%	0.79	75%	0.754	S	S	*	*			trans	87.2	151.8	161.3	85.9	0	0	0	0	118.2
443	V	27.5	Very low	32.1	Very low	116 Å²	116	134.7 Å²	134.7	70%	0.703	76%	0.755	S	S	*	*			cis	-157.3	117	-13.4	123.9	0	0	0	0	112.9
444	L	34.4	Very low	32.2	Very low	154 Å²	154	136.6 Å²	136.6	81%	0.806	76%	0.758	S	S	*	*			trans	60.3	-179.3	134	-41.8	178.4	0	0	0	120.9
445	P	46.5	Very low	32.1	Very low	103 Å²	103	140.9 Å²	140.9	67%	0.669	77%	0.767	S	S	*	*				-144.6	-164	-107.8	43.4	-19.2	0	0	0	116.2
446	E	28.4	Very low	32	Very low	176 Å²	176	136.6 Å²	136.6	82%	0.822	76%	0.762	S	S	*	*			trans	145	158.5	154	-84.7	171	-170.9	0	0	109.7
447	E	37.1	Very low	31.9	Very low	160 Å²	160	138.4 Å²	138.4	75%	0.748	77%	0.765	S	S	*	*				-164.1	142.5	-53	-117.7	168.6	-147.1	0	0	109.2
448	E	33.6	Very low	31.7	Very low	183 Å²	183	137.3 Å²	137.3	86%	0.855	76%	0.764	S	S	*	*			trans	62.8	165.5	165.5	-52.7	-170.6	145	0	0	117.4
449	D	31.4	Very low	31.4	Very low	154 Å²	154	138.3 Å²	138.3	82%	0.824	77%	0.769	S	S	*	*			cis	-148.9	172	19.4	-170.3	8.5	0	0	0	112.1
450	E	36.8	Very low	31.2	Very low	168 Å²	168	140.9 Å²	140.9	79%	0.785	77%	0.773	S	S	*	*			trans	-99	147.9	-175	-58.5	-173.7	115.7	0	0	115.3
451	K	29.2	Very low	31.2	Very low	202 Å²	202	141.3 Å²	141.3	88%	0.878	78%	0.782	S	S	*	*			trans	-161.1	144.7	135.6	-134.8	72	180	-178.9	0	116.2
452	S	29.1	Very low	30.8	Very low	107 Å²	107	144.5 Å²	144.5	75%	0.748	79%	0.785	S	S	*	*			trans	-124.5	149.4	166.8	57.7	0	0	0	0	111
453	C	24.5	Very low	30.5	Very low	126 Å²	126	147.1 Å²	147.1	85%	0.851	79%	0.789	S	S	*	*			trans	-144.5	163.1	169.1	-85.9	0	0	0	0	111
454	S	29.8	Very low	30.4	Very low	108 Å²	108	145.8 Å²	145.8	76%	0.755	79%	0.791	S	S	*	*			trans	-151	167.6	-173.9	-56	0	0	0	0	111.7
455	E	31.1	Very low	30.2	Very low	191 Å²	191	144.1 Å²	144.1	89%	0.893	79%	0.786	S	S	*	*			trans	68.5	154.6	171.1	-55.7	-174	120.5	0	0	115.2
456	S	31.8	Very low	29.1	Very low	113 Å²	113	147 Å²	147	79%	0.79	80%	0.796	S	S	*	*			cis	-167.3	-174.8	-18.1	59.6	0	0	0	0	107.5
457	D	28.7	Very low	29.1	Very low	135 Å²	135	145.9 Å²	145.9	72%	0.722	79%	0.791	S	S	*	*			cis	-157.5	170.4	0.2	-169.8	16.6	0	0	0	109.7
458	T	26.3	Very low	28.6	Very low	120 Å²	120	145.6 Å²	145.6	74%	0.736	79%	0.789	S	S	*	*			trans	70.3	159.4	166.1	73	0	0	0	0	117.9
459	C	24.5	Very low	28.3	Very low	128 Å²	128	143.9 Å²	143.9	87%	0.865	78%	0.781	S	S	*	*			cis	-144.1	-171.2	11	-152.5	0	0	0	0	113.7
460	R	28	Very low	28.1	Very low	190 Å²	190	142.5 Å²	142.5	72%	0.717	78%	0.782	S	S	*	*			trans	-132.5	165	-164.1	-143.8	-169.2	-172.2	143.4	5.8	112.9
461	P	31.1	Very low	27.5	Very low	129 Å²	129	137.6 Å²	137.6	84%	0.838	78%	0.777	S	S	*	*				-134.7	179.6	121.2	37.9	-28.3	0	0	0	114.3
462	K	26.7	Very low	27.5	Very low	158 Å²	158	135.1 Å²	135.1	69%	0.687	78%	0.778	S	S	*	*			trans	-153.7	148	-163	-157.6	-170.5	-174.6	-166.2	0	111
463	L	24.2	Very low	27.7	Very low	169 Å²	169	135.9 Å²	135.9	89%	0.885	78%	0.779	S	S	*	*			trans	-134.4	163.4	157.3	-90.8	172.7	0	0	0	110.5
464	A	26	Very low	28.4	Very low	88 Å²	88	135.8 Å²	135.8	73%	0.727	78%	0.777	S	S	*	*			trans	-83	151.5	-173.2	0	0	0	0	0	111.5
465	V	29	Very low	28.2	Very low	118 Å²	118	138.5 Å²	138.5	72%	0.715	78%	0.783	S	S	*	*			cis	73.3	107.5	36.4	-176.6	0	0	0	0	114.1
466	D	24.7	Very low	28.4	Very low	164 Å²	164	134.7 Å²	134.7	88%	0.877	78%	0.777	S	S	*	*			trans	-134.9	173	143.3	-149.4	-21	0	0	0	108.6
467	Q	27.9	Very low	28.3	Very low	153 Å²	153	137.5 Å²	137.5	72%	0.715	78%	0.778	S	S	*	*			trans	-148.1	134.9	-146.4	-177.8	179.8	122.9	0	0	115
468	Q	25.6	Very low	28.3	Very low	153 Å²	153	136.6 Å²	136.6	72%	0.715	77%	0.773	S	S	*	*			trans	-168.4	125.4	137.3	-153.4	77.1	35.9	0	0	113.3
469	E	28.3	Very low	28.4	Very low	147 Å²	147	137.4 Å²	137.4	69%	0.687	77%	0.772	S	S	*	*			trans	18.2	145.7	154.5	-65	-179.7	88.1	0	0	127.5
470	C	26.7	Very low	28.6	Very low	125 Å²	125	136.9 Å²	136.9	85%	0.845	77%	0.765	S	S	*	*			trans	58.6	124.1	141.4	-68.3	0	0	0	0	120.6
471	G	25.1	Very low	28.7	Very low	65 Å²	65	136.3 Å²	136.3	67%	0.67	78%	0.775	S	S	*	*			cis	140.4	169.3	20.3	0	0	0	0	0	110.8
472	V	29.2	Very low	28.5	Very low	150 Å²	150	135.8 Å²	135.8	91%	0.909	78%	0.775	S	S	*	*			trans	79.3	144.4	176.4	-168.2	0	0	0	0	116.5
473	T	33.4	Very low	28.6	Very low	124 Å²	124	134.2 Å²	134.2	76%	0.761	78%	0.784	S	S	*	*			trans	-85	160.3	-175.5	43.3	0	0	0	0	113.6
474	P	37.8	Very low	29	Very low	124 Å²	124	132.3 Å²	132.3	81%	0.805	79%	0.785	S	S	*	*			trans	-79	148.5	-178.9	33.2	-36	0	0	0	113.1
475	D	26.9	Very low	29	Very low	165 Å²	165	131.9 Å²	131.9	88%	0.882	79%	0.789	S	S	*	*			trans	-142	158.6	158.5	-122	-40.2	0	0	0	108.7
476	S	35.6	Very low	29.1	Very low	110 Å²	110	130.9 Å²	130.9	77%	0.769	79%	0.793	S	S	*	*			trans	-127.3	115.1	-153.9	53.9	0	0	0	0	116.4
477	E	29.5	Very low	29.4	Very low	173 Å²	173	130.8 Å²	130.8	81%	0.808	79%	0.791	S	S	*	*			trans	-143.7	164.7	167.3	-43.9	-172.7	159.1	0	0	107.9
478	N	27.6	Very low	29.3	Very low	115 Å²	115	129.3 Å²	129.3	62%	0.615	79%	0.787	S	S	*	*			cis	-163.6	162.9	25	-120.6	-40.1	0	0	0	112.3
479	L	28.8	Very low	29.4	Very low	137 Å²	137	129.8 Å²	129.8	72%	0.717	79%	0.79	S	S	*	*			trans	46.1	110.1	149.3	-54.9	171.1	0	0	0	119.9
480	T	28.6	Very low	29.3	Very low	117 Å²	117	128.3 Å²	128.3	72%	0.718	80%	0.796	S	S	*	*				54	116	75.5	71.7	0	0	0	0	117.6
481	L	29.2	Very low	30.7	Very low	178 Å²	178	127.9 Å²	127.9	93%	0.932	79%	0.791	S	S	*	*			trans	-145.3	156.1	141.9	-84.5	-172.6	0	0	0	110.2
482	S	27.5	Very low	30.8	Very low	118 Å²	118	131 Å²	131	83%	0.825	80%	0.801	S	S	*	*			trans	-141.3	149.9	178	-50.2	0	0	0	0	110.6
483	S	29.9	Very low	30.7	Very low	126 Å²	126	130.5 Å²	130.5	88%	0.881	80%	0.799	S	S	*	*			trans	-152.9	151	160.6	57	0	0	0	0	110.6
484	S	32.8	Very low	30.4	Very low	129 Å²	129	128.4 Å²	128.4	90%	0.902	80%	0.802	S	S	*	*			trans	-130.2	156	-170.7	-48.5	0	0	0	0	111.1
485	G	25.5	Very low	30	Very low	79 Å²	79	128.9 Å²	128.9	81%	0.814	80%	0.802	S	S	*	*			trans	-172.5	125.7	168.4	0	0	0	0	0	112.5
486	A	30.3	Very low	30.5	Very low	97 Å²	97	126.1 Å²	126.1	80%	0.802	79%	0.794	S	S	*	*			trans	-156.7	137.4	176.7	0	0	0	0	0	110.3
487	I	30.6	Very low	30.1	Very low	162 Å²	162	128.3 Å²	128.3	83%	0.831	80%	0.796	S	S	*	*			trans	-161.1	130.9	164.1	21	174.3	0	0	0	113.2
488	D	25.6	Very low	30	Very low	121 Å²	121	125.1 Å²	125.1	65%	0.647	79%	0.793	S	S	*	*			trans	46.5	107.7	143.4	-69.2	-56.7	0	0	0	125.6
489	Q	28.4	Very low	30.1	Very low	164 Å²	164	124.6 Å²	124.6	77%	0.766	80%	0.798	S	S	*	*				58.1	123.9	109.6	-68.8	-170.2	87.1	0	0	123.9
490	S	25.7	Very low	30.1	Very low	116 Å²	116	124 Å²	124	81%	0.811	80%	0.801	S	S	*	*			trans	92.1	161.6	133	84.8	0	0	0	0	119.1
491	P	57.8	Low	30.2	Very low	116 Å²	116	126.2 Å²	126.2	75%	0.753	81%	0.806	S	S	*	*			trans	-119.1	173.7	-136.5	43.8	-38.5	0	0	0	116.4
492	C	25.3	Very low	30.1	Very low	129 Å²	129	123.7 Å²	123.7	87%	0.872	80%	0.798	S	S	*	*			trans	-166.8	159.7	145.3	-105.3	0	0	0	0	116.3
493	T	27.1	Very low	30.1	Very low	141 Å²	141	122.8 Å²	122.8	87%	0.865	79%	0.792	S	S	*	*			trans	-49.3	155.3	177.3	47	0	0	0	0	119.3
494	G	27.3	Very low	30.5	Very low	80 Å²	80	122 Å²	122	83%	0.825	78%	0.784	S	S	*	*			trans	-176.9	96.2	157.9	0	0	0	0	0	116.5
495	T	29.6	Very low	30.3	Very low	133 Å²	133	123.8 Å²	123.8	82%	0.816	78%	0.778	S	S	*	*			trans	-102.8	150.9	171.4	-19.8	0	0	0	0	111.2
496	P	38.3	Very low	30.3	Very low	108 Å²	108	126.7 Å²	126.7	70%	0.701	78%	0.775	S	S	*	*				-143.1	139.7	109	27.2	-7.5	0	0	0	114.6
497	L	26.4	Very low	30.8	Very low	155 Å²	155	127.3 Å²	127.3	81%	0.812	77%	0.771	S	S	*	*				57.7	136	96.9	-50.6	176.3	0	0	0	115.5
498	S	27.7	Very low	30.5	Very low	106 Å²	106	125.6 Å²	125.6	74%	0.741	77%	0.767	S	S	*	*			cis	-166.9	169.1	-10.1	-84.9	0	0	0	0	106.7
499	S	28.9	Very low	30.5	Very low	105 Å²	105	124.9 Å²	124.9	73%	0.734	77%	0.772	S	S	*	*			cis	-164.1	158.4	38.9	54.3	0	0	0	0	114.7
500	T	30.6	Very low	30.3	Very low	125 Å²	125	122.2 Å²	122.2	77%	0.767	77%	0.771	S	S	*	*			trans	-10.1	148	157.5	2.2	0	0	0	0	119
501	I	29.4	Very low	30.3	Very low	163 Å²	163	122 Å²	122	84%	0.836	77%	0.77	S	S	*	*				-135.5	164.3	67.1	-59.9	-172.2	0	0	0	113.3
502	T	28.3	Very low	28.7	Very low	124 Å²	124	124.1 Å²	124.1	76%	0.761	77%	0.774	S	S	*	*			trans	-54.7	148.4	-164.6	49.9	0	0	0	0	121.7
503	S	26.6	Very low	28.7	Very low	100 Å²	100	121.8 Å²	121.8	70%	0.699	76%	0.764	S	S	*	*			trans	-65.5	-171.9	158.9	-16.6	0	0	0	0	113.4
504	P	39	Very low	28.5	Very low	108 Å²	108	124.9 Å²	124.9	70%	0.701	77%	0.769	S	S	*	*			cis	-125.1	179.1	21.3	38.1	-20.8	0	0	0	115.2
505	E	27.6	Very low	28.4	Very low	168 Å²	168	126.4 Å²	126.4	79%	0.785	77%	0.767	S	S	*	*			cis	-161.6	130.1	-22.6	-97.7	155.5	164.1	0	0	103.8
506	D	26.6	Very low	28.1	Very low	140 Å²	140	127 Å²	127	75%	0.749	77%	0.77	S	S	*	*				86.2	149.7	56.6	-84.9	-38.4	0	0	0	114.5
507	P	39.8	Very low	27.6	Very low	110 Å²	110	130.1 Å²	130.1	71%	0.714	78%	0.777	S	S	*	*				-126.7	-145.4	-70.8	31.4	-8.6	0	0	0	111.2
508	V	25.1	Very low	27.6	Very low	125 Å²	125	128.8 Å²	128.8	76%	0.758	78%	0.781	S	S	*	*				-161.6	147.5	52.6	-179	0	0	0	0	110
509	S	24.2	Very low	27.6	Very low	107 Å²	107	132.2 Å²	132.2	75%	0.748	79%	0.787	S	S	*	*			trans	-127.1	143.6	161.1	-75.8	0	0	0	0	112.4
510	S	26	Very low	27.3	Very low	107 Å²	107	131.9 Å²	131.9	75%	0.748	79%	0.791	S	S	*	*			trans	54.6	117.5	150.3	61.3	0	0	0	0	122.1
511	S	25	Very low	27.1	Very low	111 Å²	111	131 Å²	131	78%	0.776	79%	0.789	S	S	*	*				109.4	142.5	122.3	79.3	0	0	0	0	122.5
512	L	24.1	Very low	27	Very low	162 Å²	162	128.8 Å²	128.8	85%	0.848	79%	0.789	S	S	*	*			trans	78	111.2	152.1	-111	74.7	0	0	0	123.7
513	A	24.7	Very low	27	Very low	80 Å²	80	131.2 Å²	131.2	66%	0.661	79%	0.791	S	S	*	*			trans	64.2	109.4	131.3	0	0	0	0	0	122.1
514	Q	24.1	Very low	27.2	Very low	205 Å²	205	131.9 Å²	131.9	96%	0.958	80%	0.795	S	S	*	*				-155.6	150.5	127.1	-116.6	149	99.5	0	0	112.5
515	S	24.3	Very low	26.5	Very low	113 Å²	113	134.8 Å²	134.8	79%	0.79	80%	0.8	S	S	*	*			trans	-94.1	146.1	-168.4	-39	0	0	0	0	113.7
516	V	22.8	Very low	26.8	Very low	146 Å²	146	134.2 Å²	134.2	89%	0.885	80%	0.797	S	S	*	*			trans	-156.3	157.6	133.2	-106.9	0	0	0	0	111.9
517	M	28.5	Very low	26.7	Very low	173 Å²	173	132 Å²	132	85%	0.852	79%	0.792	S	S	*	*			trans	-84	152	-177.1	-56	158.6	-75.8	0	0	112.5
518	S	26.5	Very low	26.1	Very low	127 Å²	127	134.9 Å²	134.9	89%	0.888	80%	0.796	S	S	*	*			trans	-159.2	158.3	144.8	-86.7	0	0	0	0	111.3
519	M	27.6	Very low	26.3	Very low	178 Å²	178	134 Å²	134	88%	0.877	79%	0.785	S	S	*	*			trans	-117.5	147.1	-168.9	-50.7	-151.5	-50.6	0	0	112.9
520	A	23.3	Very low	26.8	Very low	97 Å²	97	132.9 Å²	132.9	80%	0.802	78%	0.778	S	S	*	*			trans	-149.6	100.8	157	0	0	0	0	0	109.9
521	S	25.7	Very low	27.4	Very low	106 Å²	106	128.8 Å²	128.8	74%	0.741	75%	0.751	S	S	*	*			trans	-89.1	107.4	174.8	-58.3	0	0	0	0	110.5
522	S	26.9	Very low	28.3	Very low	117 Å²	117	124.4 Å²	124.4	82%	0.818	72%	0.718	S	S	*	*			trans	-93.8	99.2	173.4	-63.7	0	0	0	0	110.5	S524	S522-S524 PolarHBondContact O-N 3.1Å
523	H	29.4	Very low	29.4	Very low	176 Å²	176	118.2 Å²	118.2	82%	0.815	69%	0.688	S	S	*	*			trans	-70.2	114.3	164.6	-85.4	27.4	0	0	0	109.7
524	S	29.2	Very low	30	Very low	113 Å²	113	115.2 Å²	115.2	79%	0.79	66%	0.66	S	S	*	*			trans	-101	115.6	157.3	49.8	0	0	0	0	109.2	S522	S522-S524 PolarHBondContact O-N 3.1Å
525	Q	25.8	Very low	30.8	Very low	170 Å²	170	106.4 Å²	106.4	79%	0.794	62%	0.621	S	S	*	*			trans	-88.2	132.7	167.5	-69.2	-175.6	-10	0	0	108.9	S527	Q525-S527 PolarHBondContact O-N 3.46Å
526	H	32.9	Very low	31.5	Very low	156 Å²	156	102.5 Å²	102.5	72%	0.722	59%	0.594	S	S	*	*			trans	11.3	99.4	171.5	-69.3	-77.9	0	0	0	118.2	H528	H526-H528 AromaticContact CE1-NE2 3.37Å; H526-H528 PolarHBondContact CE1-NE2 2.92Å; H526-H528 AromaticContact CG-NE2 3.99Å; H526-H528 AromaticContact ND1-CD2 3.86Å; H526-H528 AromaticContact ND1-NE2 2.88Å; H526-H528 PolarHBondContact ND1-NE2 2.77Å
527	S	25.1	Very low	32.4	Very low	92 Å²	92	96.7 Å²	96.7	64%	0.643	56%	0.557	S	S	*	*			trans	-123.6	91.5	153.3	59.1	0	0	0	0	109.2	Q525 I529	Q525-S527 PolarHBondContact O-N 3.46Å; S527-I529 PolarHBondContact O-N 2.88Å
528	H	27.5	Very low	32.7	Very low	172 Å²	172	92.3 Å²	92.3	80%	0.796	54%	0.544	S	S	*	.			trans	-74.3	94.2	172.2	-69.4	-84.7	0	0	0	108.8	H526	H526-H528 AromaticContact CE1-NE2 3.37Å; H526-H528 PolarHBondContact CE1-NE2 2.92Å; H526-H528 AromaticContact CG-NE2 3.99Å; H526-H528 AromaticContact ND1-CD2 3.86Å; H526-H528 AromaticContact ND1-NE2 2.88Å; H526-H528 PolarHBondContact ND1-NE2 2.77Å
529	I	29.4	Very low	32.9	Very low	105 Å²	105	89.6 Å²	89.6	54%	0.538	54%	0.536	S	S	.	.			trans	-98	101	173.8	-57.3	178.2	0	0	0	107.6	P378 S527	P378-I529 HydrophobicContact CG-CD1 4.3Å; S527-I529 PolarHBondContact O-N 2.88Å
530	S	33.5	Very low	33.1	Very low	84 Å²	84	84.3 Å²	84.3	59%	0.587	52%	0.516	S	S	*	.	P	Polyproline II helix	trans	-90.6	122.2	161.4	-56.4	0	0	0	0	107.9
531	A	39.9	Very low	33.4	Very low	22 Å²	22	89.9 Å²	89.9	18%	0.182	52%	0.518	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	118.2	167.7	0	0	0	0	0	107.7	T83 M329 A374	T83-A531 WeakPolarHBondContact CG2-O 3.47Å; T83-A531 PolarHBondContact OG1-O 2.89Å; M329-A531 CarbonylContact O-C 3.56Å; M329-A531 WeakPolarHBondContact O-CA 3.34Å; A374-A531 HydrophobicContact CB-CB 4.27Å
532	D	42.7	Very low	33.5	Very low	18 Å²	18	93.2 Å²	93.2	10%	0.096	53%	0.527	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	152.1	172.6	-61.2	-65.8	0	0	0	108.4	P80 K82 M329 Y366	P80-D532 HydrophobicContact CB-CB 3.77Å; P80-D532 HydrophobicContact CG-CB 3.54Å; K82-D532 WeakPolarHBondContact CG-OD1 3.4Å; M329-D532 WeakPolarHBondContact CA-O 3.44Å; M329-D532 WeakPolarHBondContact CB-O 3.38Å; M329-D532 PolarHBondContact N-O 3.36Å; M329-D532 PolarHBondContact O-N 3.14Å; Y366-D532 WeakPolarHBondContact CE1-OD2 3.28Å
533	T	47	Very low	33.6	Very low	33 Å²	33	91.8 Å²	91.8	20%	0.202	52%	0.522	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	162.8	-178.1	57.3	0	0	0	0	112.3	V81 T83 R327	V81-T533 CarbonylContact C-O 3.58Å; V81-T533 WeakPolarHBondContact CA-O 3.29Å; V81-T533 WeakPolarHBondContact CB-O 3.25Å; V81-T533 PolarHBondContact N-O 2.92Å; V81-T533 PolarHBondContact O-N 2.84Å; T83-T533 HydrophobicContact CG2-CG2 4Å; R327-T533 CarbonylContact O-C 3.58Å; R327-T533 WeakPolarHBondContact O-CA 3.48Å; R327-T533 WeakPolarHBondContact O-CB 3.2Å
534	M	37.2	Very low	33.5	Very low	16 Å²	16	87.1 Å²	87.1	8%	0.079	52%	0.521	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	139.9	164.7	-77.5	-63.1	-89.7	0	0	109.6	P80 V81 R327 M329	P80-M534 VanDerWaalsContact CA-SD 3.56Å; P80-M534 HydrophobicContact CB-CG 4.05Å; P80-M534 HydrophobicContact CB-SD 4.28Å; V81-M534 HydrophobicContact CB-SD 4.42Å; V81-M534 HydrophobicContact CG2-SD 3.91Å; V81-M534 PolarHBondContact N-SD 2.93Å; V81-M534 VanDerWaalsContact N-SD 3.39Å; R327-M534 HydrophobicContact CB-CB 4.44Å; R327-M534 WeakPolarHBondContact CB-O 3.46Å; R327-M534 PolarHBondContact N-O 2.97Å; R327-M534 PolarHBondContact O-N 3.16Å; M329-M534 HydrophobicContact CE-CB 3.89Å; M329-M534 HydrophobicContact CE-CG 3.85Å; M329-M534 HydrophobicContact SD-CG 4.12Å
535	S	42.4	Very low	33.5	Very low	21 Å²	21	86.5 Å²	86.5	15%	0.147	52%	0.524	C	S	.	.			trans	-128.2	124.5	172.1	-77	0	0	0	0	108.8	G40 Q325	G40-S535 WeakPolarHBondContact CA-O 3.49Å; Q325-S535 VanDerWaalsContact O-CA 3.26Å; Q325-S535 WeakPolarHBondContact O-CA 3.12Å; Q325-S535 WeakPolarHBondContact O-CB 3.47Å; Q325-S535 PolarHBondContact O-OG 2.82Å
536	S	38.5	Very low	33.6	Very low	31 Å²	31	87.8 Å²	87.8	22%	0.217	53%	0.53	C	S	.	.			trans	-111.1	141.9	174	-54	0	0	0	0	108.4
537	M	40.4	Very low	33.5	Very low	23 Å²	23	84.7 Å²	84.7	11%	0.113	53%	0.531	C	S	.	.			trans	-129.5	107.4	171.4	-74.1	-153.4	-52.7	0	0	110.9	F37 M39 F44 A322 L324 G539	F37-M537 HydrophobicContact CE2-CE 3.87Å; F37-M537 HydrophobicContact CZ-CE 4.37Å; M39-M537 HydrophobicContact CB-CE 4.07Å; M39-M537 HydrophobicContact CE-CE 4.11Å; M39-M537 HydrophobicContact CG-CE 4.17Å; M39-M537 HydrophobicContact SD-CE 3.44Å; M39-M537 WeakPolarHBondContact SD-CE 3.37Å; M39-M537 HydrophobicContact SD-CG 4.5Å; M39-M537 HydrophobicContact SD-SD 3.51Å; F44-M537 HydrophobicContact CD2-CE 4.35Å; F44-M537 HydrophobicContact CE2-CE 3.97Å; F44-M537 HydrophobicContact CZ-CB 4.21Å; F44-M537 HydrophobicContact CZ-CE 4.17Å; A322-M537 HydrophobicContact CB-SD 4.02Å; L324-M537 HydrophobicContact CD1-CG 3.85Å; L324-M537 HydrophobicContact CD1-SD 4.22Å; M537-G539 PolarHBondContact O-N 3.24Å; M537-G539 VanDerWaalsContact O-N 3.16Å
538	S	34.8	Very low	33.7	Very low	81 Å²	81	89 Å²	89	57%	0.566	54%	0.541	S	S	*	.			trans	-62.6	116.6	168.3	-56.7	0	0	0	0	109.5	R307	R307-S538 PolarHBondContact NH1-O 2.72Å; R307-S538 PolarHBondContact NH2-O 3.45Å
539	G	31.6	Very low	34.3	Very low	71 Å²	71	85.6 Å²	85.6	73%	0.732	53%	0.534	S	S	*	.			trans	-96.5	127.3	174.8	0	0	0	0	0	111.9	M537	M537-G539 PolarHBondContact O-N 3.24Å; M537-G539 VanDerWaalsContact O-N 3.16Å
540	S	30.9	Very low	34.3	Very low	66 Å²	66	85.8 Å²	85.8	46%	0.462	55%	0.551	S	S	.	*			trans	-151.3	113.5	173.3	66.2	0	0	0	0	110.2	R307	R307-S540 PolarHBondContact NE-OG 3.17Å; R307-S540 VanDerWaalsContact NH2-N 3.15Å; R307-S540 PolarHBondContact NH2-OG 2.88Å
541	Y	29.9	Very low	34.1	Very low	214 Å²	214	85.2 Å²	85.2	84%	0.839	56%	0.559	S	S	*	*			trans	-76.2	144.3	-178.6	52.5	-89.3	0	0	0	111.7
542	L	29.1	Very low	33.7	Very low	177 Å²	177	88.5 Å²	88.5	93%	0.927	59%	0.586	S	S	*	*			trans	-112.2	96.1	159.3	-70.1	178.4	0	0	0	107.4
543	A	27.6	Very low	33.2	Very low	86 Å²	86	95 Å²	95	71%	0.711	62%	0.621	S	S	*	*			trans	-73.8	128.2	172.6	0	0	0	0	0	109.2	A545	A543-A545 PolarHBondContact O-N 2.65Å
544	G	27.8	Very low	32.6	Very low	78 Å²	78	101 Å²	101	80%	0.804	65%	0.646	S	S	*	*			trans	-66.1	128.5	173.2	0	0	0	0	0	110.6
545	A	28.7	Very low	32.3	Very low	101 Å²	101	106.3 Å²	106.3	84%	0.835	68%	0.68	S	S	*	*			trans	-91.5	102	178.7	0	0	0	0	0	110.7	A543	A543-A545 PolarHBondContact O-N 2.65Å
546	E	29.8	Very low	31.8	Very low	197 Å²	197	109.2 Å²	109.2	92%	0.921	71%	0.712	S	S	*	*			trans	-105.1	132.7	160.6	-70.2	-84.1	111	0	0	107.2
547	A	29.1	Very low	31.5	Very low	91 Å²	91	116.9 Å²	116.9	75%	0.752	75%	0.745	S	S	*	*			trans	-121.6	147.7	-175.6	0	0	0	0	0	111.1
548	E	30.7	Very low	31.2	Very low	182 Å²	182	122.3 Å²	122.3	85%	0.85	78%	0.779	S	S	*	*			trans	-169.1	167.9	153.1	-99.4	-40.3	80.5	0	0	109.2
549	P	39.5	Very low	31.1	Very low	100 Å²	100	126.2 Å²	126.2	65%	0.649	79%	0.793	S	S	*	*				-124.7	159.1	-125.5	42.2	-31.8	0	0	0	118.2
550	A	30.2	Very low	31.1	Very low	109 Å²	109	126.6 Å²	126.6	90%	0.901	80%	0.797	S	S	*	*			trans	35.4	117.4	142.8	0	0	0	0	0	122.1
551	G	28	Very low	31.2	Very low	73 Å²	73	132.2 Å²	132.2	75%	0.753	82%	0.817	S	S	*	*			trans	173.2	99.4	155.5	0	0	0	0	0	108.8
552	A	32.4	Very low	31.4	Very low	90 Å²	90	130.7 Å²	130.7	74%	0.744	82%	0.817	S	S	*	*				96	138.2	63.7	0	0	0	0	0	111.9
553	D	31.1	Very low	31.4	Very low	156 Å²	156	127.7 Å²	127.7	83%	0.834	80%	0.802	S	S	*	*			trans	66.1	150.4	171.2	-49.7	-18.4	0	0	0	117.5
554	E	34.3	Very low	31.7	Very low	157 Å²	157	132.9 Å²	132.9	73%	0.734	80%	0.803	S	S	*	*			cis	-160.2	159.3	-37.2	-150.7	-160	122.8	0	0	109
555	V	31.4	Very low	31.7	Very low	129 Å²	129	136.9 Å²	136.9	78%	0.782	81%	0.806	S	S	*	*			trans	33.1	138.5	163	-73.2	0	0	0	0	123.5
556	G	31.4	Very low	31.9	Very low	81 Å²	81	136.2 Å²	136.2	84%	0.835	80%	0.801	S	S	*	*			trans	166.6	79.2	158.1	0	0	0	0	0	117.1
557	E	34	Very low	32.6	Very low	192 Å²	192	133.2 Å²	133.2	90%	0.897	80%	0.798	S	S	*	*			trans	-87	156.9	167.6	-64.5	176.3	120.6	0	0	112.3
558	V	33.1	Very low	32.7	Very low	137 Å²	137	137.4 Å²	137.4	83%	0.83	80%	0.804	S	S	*	*				159.4	143.1	129.2	159.3	0	0	0	0	111.8
559	D	33.3	Very low	32.8	Very low	163 Å²	163	135.9 Å²	135.9	87%	0.872	80%	0.797	S	S	*	*			trans	-78.9	172.7	-172.2	-42.3	-95.2	0	0	0	116.3
560	G	29.9	Very low	32.4	Very low	79 Å²	79	135 Å²	135	81%	0.814	79%	0.793	S	S	*	*			trans	174.7	116	164.3	0	0	0	0	0	114.5
561	E	33.3	Very low	32.3	Very low	185 Å²	185	140.9 Å²	140.9	86%	0.864	79%	0.792	S	S	*	*			trans	-107.3	164.2	-179.6	-61.3	177.9	99.2	0	0	113.2
562	E	34.4	Very low	32.2	Very low	181 Å²	181	141.9 Å²	141.9	85%	0.846	79%	0.794	S	S	*	*			trans	63.1	157.6	159.8	-73.2	-168.8	140.7	0	0	118.8
563	D	29.6	Very low	32	Very low	115 Å²	115	141.7 Å²	141.7	62%	0.615	79%	0.792	S	S	*	*			cis	-141.3	-173.1	-9.6	-164.9	6.1	0	0	0	109.3
564	R	33.1	Very low	32.8	Very low	194 Å²	194	140 Å²	140	73%	0.732	79%	0.789	S	S	*	*			trans	-58.4	155.8	174.7	-54.4	148.6	177.1	111.7	-7.3	114.6
565	D	29	Very low	32.8	Very low	163 Å²	163	140.3 Å²	140.3	87%	0.872	79%	0.79	S	S	*	*				-174.3	167.1	105.2	-114.1	-17.9	0	0	0	113.9
566	A	32.6	Very low	32.8	Very low	87 Å²	87	142.1 Å²	142.1	72%	0.719	79%	0.79	S	S	*	*			trans	-142.7	147.2	170.8	0	0	0	0	0	111.1
567	P	45	Very low	32.5	Very low	134 Å²	134	145.8 Å²	145.8	87%	0.87	79%	0.791	S	S	*	*				-150.9	176.5	129.4	37.9	-20.8	0	0	0	116.8
568	M	30.1	Very low	32.2	Very low	178 Å²	178	139.9 Å²	139.9	88%	0.877	78%	0.781	S	S	*	*			trans	-82.5	175	170.2	-132.5	176	178.9	0	0	110.7
569	E	33.8	Very low	32	Very low	150 Å²	150	141.7 Å²	141.7	70%	0.701	78%	0.781	S	S	*	*			cis	-160.9	170	13.8	-165.4	-133.6	-51.6	0	0	110.3
570	S	30.6	Very low	31.6	Very low	81 Å²	81	141.8 Å²	141.8	57%	0.566	77%	0.774	S	S	*	*				132	153.7	119.4	74.8	0	0	0	0	121
571	R	27.2	Very low	31.4	Very low	234 Å²	234	142.3 Å²	142.3	88%	0.883	77%	0.765	S	S	*	*			trans	79.2	154.6	164.3	-60.9	173	171.7	176.6	-2.6	118.5
572	A	26.9	Very low	31.2	Very low	94 Å²	94	142.9 Å²	142.9	78%	0.777	76%	0.759	S	S	*	*			cis	-172.7	157.1	-28.1	0	0	0	0	0	109.6
573	A	28.1	Very low	30.9	Very low	85 Å²	85	141.3 Å²	141.3	70%	0.702	75%	0.752	S	S	*	*			trans	-89.1	165.7	175.5	0	0	0	0	0	113.5
574	P	48.7	Very low	30.8	Very low	121 Å²	121	140 Å²	140	79%	0.786	75%	0.751	S	S	*	*				-151.1	-165.4	106.5	41.7	-24.3	0	0	0	115.6
575	H	32.8	Very low	30.6	Very low	163 Å²	163	140.1 Å²	140.1	76%	0.755	76%	0.758	S	S	*	*			trans	-115.6	-170.6	-178.1	-48.2	-82.4	0	0	0	111.1
576	Q	31.4	Very low	30.5	Very low	168 Å²	168	135.5 Å²	135.5	79%	0.785	75%	0.748	S	S	*	*			cis	-155.4	-144.3	12	-152.1	163.8	109.8	0	0	111.4
577	D	26.2	Very low	30.4	Very low	157 Å²	157	140.4 Å²	140.4	84%	0.84	76%	0.756	S	S	*	*			trans	68	147.9	170.9	-49.8	-24.2	0	0	0	118.2
578	G	27.3	Very low	29.7	Very low	68 Å²	68	141.1 Å²	141.1	70%	0.701	75%	0.752	S	S	*	*			cis	168.6	115.3	-10.9	0	0	0	0	0	114.9
579	E	28.2	Very low	29.5	Very low	175 Å²	175	143 Å²	143	82%	0.818	75%	0.751	S	S	*	*			trans	62.1	167.2	169.9	-52.7	-165.6	106.1	0	0	118
580	F	25.9	Very low	29.1	Very low	165 Å²	165	140.1 Å²	140.1	72%	0.724	75%	0.747	S	S	*	*			cis	-153.6	156.6	15.2	-141.8	-75.1	0	0	0	113.1
581	S	25.6	Very low	28.8	Very low	91 Å²	91	144 Å²	144	64%	0.636	76%	0.759	S	S	*	*			trans	96.7	93.8	146.9	-116.5	0	0	0	0	125.4
582	R	29	Very low	28.9	Very low	197 Å²	197	137 Å²	137	74%	0.743	75%	0.751	S	S	*	*				71.7	119.7	119.3	-63.7	178	79.7	141.8	9.4	125.3
583	E	26.9	Very low	29	Very low	148 Å²	148	137.6 Å²	137.6	69%	0.692	75%	0.745	S	S	*	*			trans	69.4	145.6	131.6	-70.7	-179.8	106.5	0	0	121.7
584	S	28.3	Very low	29	Very low	86 Å²	86	141.5 Å²	141.5	60%	0.601	75%	0.748	S	S	*	*			cis	-168.4	157.1	-12.1	62	0	0	0	0	112.7
585	K	29.1	Very low	28.1	Very low	198 Å²	198	143.3 Å²	143.3	86%	0.861	75%	0.746	S	S	*	*			trans	53.3	139.4	160.8	-62.8	171.9	179.9	174.3	0	118.7
586	G	27.5	Very low	28	Very low	65 Å²	65	142.5 Å²	142.5	67%	0.67	74%	0.743	S	S	*	*			cis	107.8	120.7	-1.7	0	0	0	0	0	114.4
587	H	29.1	Very low	28.2	Very low	191 Å²	191	141.2 Å²	141.2	88%	0.884	74%	0.742	S	S	*	*			trans	172	158.9	145.1	-96.9	84.3	0	0	0	112.5
588	N	30	Very low	28.7	Very low	149 Å²	149	139 Å²	139	80%	0.797	74%	0.739	S	S	*	*			trans	-103.3	158.8	177.2	-58.2	-33.8	0	0	0	112.3
589	Y	26.3	Very low	29.2	Very low	217 Å²	217	145.6 Å²	145.6	85%	0.851	75%	0.751	S	S	*	*			trans	-175.5	143.5	138.1	-121	-108.7	0	0	0	107.2
590	S	25.6	Very low	29.4	Very low	89 Å²	89	141.4 Å²	141.4	62%	0.622	76%	0.755	S	S	*	*			cis	101.6	126.9	18.8	-71.1	0	0	0	0	115.8
591	M	25.2	Very low	30	Very low	163 Å²	163	140.3 Å²	140.3	80%	0.803	76%	0.756	S	S	*	*			trans	70.4	130.8	172.5	-48.3	-158.7	78.7	0	0	115.5
592	A	28.8	Very low	30.5	Very low	88 Å²	88	142 Å²	142	73%	0.727	76%	0.758	S	S	*	*			cis	95.5	168.4	33.2	0	0	0	0	0	113.5
593	V	28.6	Very low	30.9	Very low	106 Å²	106	138.5 Å²	138.5	64%	0.642	76%	0.759	S	S	*	*			trans	94.6	108.8	172.2	-177.8	0	0	0	0	117.3
594	E	27.9	Very low	31.4	Very low	166 Å²	166	137.6 Å²	137.6	78%	0.776	76%	0.763	S	S	*	*			trans	57.2	162.6	137.1	-63.6	161	-171.9	0	0	120.1
595	E	31.3	Very low	31.9	Very low	160 Å²	160	141.9 Å²	141.9	75%	0.748	77%	0.774	S	S	*	*			cis	-152.1	-164.5	-3.3	-134.4	176.5	-179.4	0	0	113.4
596	Q	30.2	Very low	32.2	Very low	146 Å²	146	141.3 Å²	141.3	68%	0.682	77%	0.774	S	S	*	*			trans	-61.3	157.8	-168.7	-75.6	163	-12.3	0	0	121.4
597	D	35.2	Very low	32.5	Very low	141 Å²	141	145.4 Å²	145.4	75%	0.754	78%	0.781	S	S	*	*			trans	47.8	131.1	132	-49.9	-17.5	0	0	0	124.6
598	S	36	Very low	32.5	Very low	111 Å²	111	141 Å²	141	78%	0.776	77%	0.771	S	S	*	*			trans	-169.8	116.4	139.8	1.7	0	0	0	0	109.5
599	E	38	Very low	32.5	Very low	206 Å²	206	139.2 Å²	139.2	96%	0.963	77%	0.769	S	S	*	*				66.5	126	94.9	-77	-160.6	99.7	0	0	117.6
600	G	33.2	Very low	33	Very low	87 Å²	87	134.3 Å²	134.3	90%	0.897	77%	0.767	S	S	*	*			trans	169.7	107.2	172.2	0	0	0	0	0	112.9
601	N	37.3	Very low	34.1	Very low	141 Å²	141	135.9 Å²	135.9	75%	0.754	78%	0.775	S	S	*	*			trans	-123.4	174.1	-169.6	178.8	56.6	0	0	0	113
602	D	37.4	Very low	34.5	Very low	128 Å²	128	134.2 Å²	134.2	68%	0.684	78%	0.779	S	S	*	*			trans	70.6	138.8	172.1	-69.1	-29.5	0	0	0	116.2
603	V	36.9	Very low	34.7	Very low	123 Å²	123	138.1 Å²	138.1	75%	0.745	79%	0.788	S	S	*	*			cis	-152.1	178.1	-5.4	-100.5	0	0	0	0	107.3
604	T	37.3	Very low	34.7	Very low	129 Å²	129	136.6 Å²	136.6	79%	0.791	79%	0.793	S	S	*	*			cis	-156.1	176.9	22.7	-22.8	0	0	0	0	111.3
605	E	38.7	Very low	35	Very low	176 Å²	176	138.7 Å²	138.7	82%	0.822	80%	0.8	S	S	*	*			trans	-73.2	177.1	164.4	-61.9	168.3	-178.1	0	0	110.3
606	E	34.8	Very low	34.8	Very low	185 Å²	185	135 Å²	135	86%	0.864	81%	0.805	S	S	*	*			cis	-153.2	133.9	47.6	-60.3	-179.2	146.6	0	0	114.7
607	D	33.9	Very low	34.7	Very low	151 Å²	151	132 Å²	132	81%	0.807	81%	0.813	S	S	*	*			trans	17.7	159.9	145.6	-126.6	-42.5	0	0	0	127.5
608	C	30	Very low	34.4	Very low	100 Å²	100	137.3 Å²	137.3	68%	0.676	82%	0.823	S	S	*	*			trans	94.7	95.2	140.4	-90.6	0	0	0	0	124.5
609	S	30	Very low	34.1	Very low	110 Å²	110	137.2 Å²	137.2	77%	0.769	82%	0.822	S	S	*	*				63.5	124.6	108.9	-57.7	0	0	0	0	123.3
610	S	37	Very low	33.7	Very low	114 Å²	114	139 Å²	139	80%	0.797	82%	0.82	S	S	*	*			trans	-65.5	178.4	155.1	-36.2	0	0	0	0	111.8
611	P	48.9	Very low	33.5	Very low	123 Å²	123	140.6 Å²	140.6	80%	0.799	82%	0.816	S	S	*	*			cis	-146.6	-170	20.1	44.7	-24.3	0	0	0	116.7
612	S	34.2	Very low	33.8	Very low	127 Å²	127	139.8 Å²	139.8	89%	0.888	82%	0.819	S	S	*	*			trans	-157.9	165.2	148.9	56.5	0	0	0	0	113.2
613	N	32.6	Very low	33.5	Very low	171 Å²	171	141.9 Å²	141.9	91%	0.914	82%	0.824	S	S	*	*			trans	-113	147.8	-165.1	-127.6	-43.5	0	0	0	111.7
614	G	28.5	Very low	33.3	Very low	73 Å²	73	143 Å²	143	75%	0.753	83%	0.826	S	S	*	*			trans	-164.1	107.2	179.1	0	0	0	0	0	116.1
615	K	33	Very low	33.1	Very low	210 Å²	210	141.5 Å²	141.5	91%	0.913	83%	0.826	S	S	*	*			trans	-80.3	126.9	-171.9	-64	172.8	177.1	175.5	0	115.5
616	G	27.7	Very low	32.7	Very low	83 Å²	83	139.5 Å²	139.5	86%	0.856	82%	0.821	S	S	*	*				68.6	157.4	121.4	0	0	0	0	0	122.1
617	G	27.8	Very low	32.5	Very low	83 Å²	83	136.6 Å²	136.6	86%	0.856	81%	0.811	S	S	*	*			trans	165.4	130.7	168.9	0	0	0	0	0	115.5
618	R	29.4	Very low	32.5	Very low	252 Å²	252	135.1 Å²	135.1	95%	0.951	80%	0.804	S	S	*	*			trans	-83.3	140.1	179.1	-61.8	162.2	165.7	168.3	-8.3	113.8
619	S	30.2	Very low	32.6	Very low	110 Å²	110	139 Å²	139	77%	0.769	81%	0.811	S	S	*	*			trans	-178.3	143.2	137.8	46.6	0	0	0	0	107.3
620	R	28.5	Very low	32.6	Very low	244 Å²	244	137.7 Å²	137.7	92%	0.921	82%	0.816	S	S	*	*			cis	65.6	83.6	33.6	-155	-175.7	-155.5	-147	5.5	114.7
621	C	28.8	Very low	32.3	Very low	120 Å²	120	139.1 Å²	139.1	81%	0.811	82%	0.819	S	S	*	*			trans	-105.7	141.9	157.2	-70.5	0	0	0	0	109.9
622	P	43.3	Very low	31.4	Very low	124 Å²	124	137.6 Å²	137.6	81%	0.805	82%	0.817	S	S	*	*			trans	-104.5	-176.1	-179	41.6	-36	0	0	0	113.3
623	E	31.8	Very low	31.3	Very low	171 Å²	171	140.1 Å²	140.1	80%	0.799	81%	0.814	S	S	*	*			trans	-91.1	176	177.5	-164.3	-178.8	-179.8	0	0	112.9
624	L	32.7	Very low	31.1	Very low	148 Å²	148	136.2 Å²	136.2	78%	0.775	80%	0.8	S	S	*	*			trans	90.6	114.3	161.5	-54.4	173.9	0	0	0	120.6
625	A	32.9	Very low	31	Very low	97 Å²	97	140 Å²	140	80%	0.802	80%	0.803	S	S	*	*			trans	53.8	150.3	137.6	0	0	0	0	0	120.8
626	N	31.3	Very low	31	Very low	134 Å²	134	136.4 Å²	136.4	72%	0.717	80%	0.798	S	S	*	*				172.5	175.7	60	-164.2	-1.3	0	0	0	110.7
627	N	30.8	Very low	31.9	Very low	123 Å²	123	138.1 Å²	138.1	66%	0.658	80%	0.795	S	S	*	*			trans	69.3	160.7	155.1	-75	-43.1	0	0	0	120.5
628	N	33.2	Very low	32.2	Very low	121 Å²	121	139 Å²	139	65%	0.647	79%	0.788	S	S	*	*			cis	-172.4	166.6	-35.9	-142.9	-38.7	0	0	0	111.6
629	Q	32.6	Very low	32.4	Very low	180 Å²	180	135.7 Å²	135.7	84%	0.841	79%	0.788	S	S	*	*			trans	66.3	144.7	156.4	-67.2	158.5	6.9	0	0	121.9
630	G	28.7	Very low	32.4	Very low	83 Å²	83	133.7 Å²	133.7	86%	0.856	78%	0.784	S	S	*	*			trans	161.2	83.4	165.2	0	0	0	0	0	119.4
631	V	32.1	Very low	32.7	Very low	145 Å²	145	129.9 Å²	129.9	88%	0.879	78%	0.781	S	S	*	*			trans	-68	140.5	-177.7	176.4	0	0	0	0	116.3
632	A	30.4	Very low	32.8	Very low	91 Å²	91	130.9 Å²	130.9	75%	0.752	78%	0.779	S	S	*	*			trans	170.1	150.8	131	0	0	0	0	0	117.8
633	H	30.6	Very low	32.4	Very low	179 Å²	179	131.6 Å²	131.6	83%	0.829	78%	0.776	S	S	*	*			trans	-18.3	161.7	160.3	-75	-92.9	0	0	0	121.3
634	C	28.6	Very low	32.6	Very low	90 Å²	90	131.1 Å²	131.1	61%	0.608	77%	0.773	S	S	*	*			cis	-160.3	175.9	17.7	-136	0	0	0	0	116.1
635	D	27.4	Very low	32.5	Very low	152 Å²	152	132.6 Å²	132.6	81%	0.813	78%	0.777	S	S	*	*			trans	76.3	128.9	152.5	-58.5	-22.6	0	0	0	124.3
636	T	31.6	Very low	32.7	Very low	134 Å²	134	132.1 Å²	132.1	82%	0.822	77%	0.773	S	S	*	*			trans	-134.9	149.1	166.8	52	0	0	0	0	110.1
637	P	48.1	Very low	33.7	Very low	120 Å²	120	131.6 Å²	131.6	78%	0.779	78%	0.777	S	S	*	*				-151.1	170.3	115.5	35.2	-17.6	0	0	0	113.8
638	S	33.7	Very low	34	Very low	102 Å²	102	133 Å²	133	71%	0.713	78%	0.784	S	S	*	*			cis	-172.8	173.7	-19.6	-90.5	0	0	0	0	109.5
639	L	32.8	Very low	33.8	Very low	182 Å²	182	132.8 Å²	132.8	95%	0.953	79%	0.792	S	S	*	*			trans	80.2	134.2	172.4	-45.4	175	0	0	0	116.5
640	G	30.1	Very low	33.8	Very low	67 Å²	67	134.1 Å²	134.1	69%	0.691	79%	0.789	S	S	*	*			cis	159.1	132.7	-17.4	0	0	0	0	0	116
641	L	35.3	Very low	33.9	Very low	164 Å²	164	138.8 Å²	138.8	86%	0.859	79%	0.786	S	S	*	*			trans	70.3	150.5	165.5	-52.1	-178.3	0	0	0	116.4
642	D	31.3	Very low	33.9	Very low	142 Å²	142	136 Å²	136	76%	0.759	78%	0.779	S	S	*	*			cis	-145.1	-168.3	4.9	-88.5	-50.7	0	0	0	108.4
643	N	34.9	Very low	34	Very low	138 Å²	138	138.7 Å²	138.7	74%	0.738	78%	0.78	S	S	*	*				-162.5	172.8	-61.1	-173.4	26.6	0	0	0	109.3
644	E	34.9	Very low	34	Very low	161 Å²	161	139.3 Å²	139.3	75%	0.752	78%	0.784	S	S	*	*			trans	69.9	169.3	170.2	-56	-164.7	95.4	0	0	119.9
645	Q	31.6	Very low	34.1	Very low	180 Å²	180	142.7 Å²	142.7	84%	0.841	80%	0.796	S	S	*	*				-160.8	155.2	-64	-164.3	146.4	60.4	0	0	109.9
646	A	36.5	Very low	34.2	Very low	87 Å²	87	140.4 Å²	140.4	72%	0.719	79%	0.792	S	S	*	*			trans	-102.2	165.9	176.6	0	0	0	0	0	112.5
647	P	53.6	Low	34.1	Very low	123 Å²	123	139.4 Å²	139.4	80%	0.799	79%	0.789	S	S	*	*				-157.8	162	95.5	40.5	-21.1	0	0	0	120
648	D	35.3	Very low	34	Very low	153 Å²	153	139.4 Å²	139.4	82%	0.818	79%	0.789	S	S	*	*			trans	2.6	140	154.9	-59.1	-21.2	0	0	0	124.9
649	S	30.3	Very low	33.8	Very low	116 Å²	116	141.5 Å²	141.5	81%	0.811	80%	0.797	S	S	*	*				173	153.9	125.2	35.9	0	0	0	0	112.7
650	R	32.3	Very low	33.8	Very low	207 Å²	207	141.2 Å²	141.2	78%	0.781	79%	0.791	S	S	*	*			cis	-176.1	144.1	-30.3	-121.8	179.2	-172.2	-169.1	4.6	109.9
651	F	31.2	Very low	33.8	Very low	181 Å²	181	144.9 Å²	144.9	79%	0.794	79%	0.793	S	S	*	*			trans	65.6	155.3	164.2	-70.3	-63.2	0	0	0	117.9
652	A	32.3	Very low	33.6	Very low	88 Å²	88	145 Å²	145	73%	0.727	79%	0.789	S	S	*	*			cis	-148.6	178.5	-2	0	0	0	0	0	111.8
653	D	30.7	Very low	33.7	Very low	146 Å²	146	149.6 Å²	149.6	78%	0.781	81%	0.814	S	S	*	*			trans	-93.7	-175	-168	-50.5	-101	0	0	0	116.9
654	E	30.9	Very low	33.6	Very low	192 Å²	192	150.2 Å²	150.2	90%	0.897	82%	0.817	S	S	*	*			trans	74.1	135.4	168.7	-56.1	-176.1	126.8	0	0	115.9
655	D	30.8	Very low	33.5	Very low	162 Å²	162	149.6 Å²	149.6	87%	0.866	82%	0.821	S	S	*	*				-151.4	-171.6	51.7	-150.1	-23.3	0	0	0	115.1
656	S	30.1	Very low	33.6	Very low	103 Å²	103	147.9 Å²	147.9	72%	0.72	82%	0.82	S	S	*	*			trans	-72.6	164.1	-159.2	-174.1	0	0	0	0	120.3
657	C	28.6	Very low	33.5	Very low	113 Å²	113	151.5 Å²	151.5	76%	0.764	83%	0.826	S	S	*	*			trans	-87.5	-159.3	163	-30.1	0	0	0	0	111.4
658	P	47.6	Very low	32.2	Very low	120 Å²	120	153.3 Å²	153.3	78%	0.779	83%	0.827	S	S	*	*			cis	-127.7	173.4	-48.4	36.9	-22.5	0	0	0	113.1
659	V	29.7	Very low	32	Very low	146 Å²	146	153.3 Å²	153.3	89%	0.885	83%	0.828	S	S	*	*			trans	-141.4	145.3	162.8	-178.3	0	0	0	0	111.8
660	H	31.3	Very low	32.1	Very low	177 Å²	177	156 Å²	156	82%	0.819	83%	0.829	S	S	*	*			trans	-121.8	150.2	176.9	-125.8	-84	0	0	0	109
661	I	30.1	Very low	32.1	Very low	143 Å²	143	152.1 Å²	152.1	73%	0.733	83%	0.833	S	S	*	*			trans	161.8	118.7	163.6	-93.1	153.9	0	0	0	105.3
662	E	30.7	Very low	32.2	Very low	166 Å²	166	149.7 Å²	149.7	78%	0.776	84%	0.836	S	S	*	*				59.7	127.6	78	-65.1	177.2	148.1	0	0	111.7
663	D	33.4	Very low	32.2	Very low	240 Å²	240	155.3 Å²	155.3	100%	1.283	85%	0.846	S	S	*	*			cis	-106.2	0	4.9	-63.4	-71	0	0	0	113.7

Retrieved 663 of 663 residues in 612.2 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).