A0A5K4F4I6_SCHMA Loading...

Uncharacterized protein AlphaSync

AlphaFold DB , UniProt , Accession A0A5K4F4I6, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 218 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters 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	35.5	Very low	42.4	Very low	252 Å²	252	150.2 Å²	150.2	100%	1.241	75%	0.754	S	S	*	*				0	95.8	0	-151.3	174.3	-160.2	0	0	107.1
2	I	32.9	Very low	42.5	Very low	153 Å²	153	148.5 Å²	148.5	79%	0.785	74%	0.738	S	S	*	*			trans	-110.7	136.5	-171.3	-72.8	175.7	0	0	0	109.3
3	Q	32.6	Very low	43	Very low	163 Å²	163	142 Å²	142	76%	0.762	72%	0.722	S	S	*	*			trans	73.8	92.3	160.9	-78.4	172.5	15.7	0	0	119.4
4	S	42.5	Very low	43.3	Very low	101 Å²	101	138.2 Å²	138.2	71%	0.706	71%	0.709	S	S	*	*			trans	-113.2	75.5	132.7	-174.4	0	0	0	0	108.7
5	K	42.2	Very low	43.3	Very low	180 Å²	180	137.1 Å²	137.1	78%	0.783	70%	0.704	S	S	*	*			trans	-102.2	-1.2	170.3	-85.7	-168.5	176.6	-175.2	0	113.1
6	K	44.1	Very low	43.4	Very low	186 Å²	186	138.1 Å²	138.1	81%	0.809	70%	0.702	S	S	*	*	H	α-helix	trans	-85.9	-29	-175.1	-76.7	-172.2	175.8	-177.2	0	114.8
7	H	45.6	Very low	43.3	Very low	148 Å²	148	133.9 Å²	133.9	69%	0.685	69%	0.693	S	S	*	*	H	α-helix	trans	-77.9	-31.8	-176.1	-83.1	-80.8	0	0	0	114.4	S9	H7-S9 PolarHBondContact O-N 3.4Å
8	F	46.1	Very low	43.2	Very low	161 Å²	161	135.8 Å²	135.8	71%	0.706	70%	0.696	S	S	*	*	H	α-helix	trans	-69.7	-32.4	-179.1	-103.9	-86.3	0	0	0	113.1	A10 F12	F8-A10 PolarHBondContact O-N 3.22Å; F8-F12 HydrophobicContact CD1-CE2 4.17Å; F8-F12 WeakPolarHBondContact O-CD2 3.48Å
9	S	51.4	Low	43	Very low	88 Å²	88	132.6 Å²	132.6	62%	0.615	69%	0.687	S	S	*	*	H	α-helix	trans	-70.7	-32	-177.2	-167.6	0	0	0	0	113.2	H7 A13	H7-S9 PolarHBondContact O-N 3.4Å; S9-A13 PolarHBondContact O-N 2.77Å
10	A	48	Very low	42.7	Very low	60 Å²	60	130.2 Å²	130.2	50%	0.496	68%	0.682	S	S	.	*	H	α-helix	trans	-69.9	-39.6	-179.4	0	0	0	0	0	111.6	F8 F12 A13 V14	F8-A10 PolarHBondContact O-N 3.22Å; A10-F12 VanDerWaalsContact C-N 3.33Å; A10-F12 PolarHBondContact O-N 2.88Å; A10-A13 PolarHBondContact O-N 3.06Å; A10-V14 PolarHBondContact O-N 2.94Å
11	F	45.6	Very low	42.6	Very low	160 Å²	160	130.2 Å²	130.2	70%	0.702	68%	0.682	S	S	*	*	H	α-helix	trans	-62.5	-38.2	177.2	-105.6	-87.9	0	0	0	112.7	V14 L15	F11-V14 PolarHBondContact O-N 3.49Å; F11-L15 PolarHBondContact O-N 3.11Å; F11-L15 VanDerWaalsContact O-N 3.15Å
12	F	43.9	Very low	42.7	Very low	130 Å²	130	125.9 Å²	125.9	57%	0.57	66%	0.658	S	S	*	*	H	α-helix	trans	-71.5	-28.5	177.3	-87.1	-77.3	0	0	0	113.6	F8 A10 K16	F8-F12 HydrophobicContact CD1-CE2 4.17Å; F8-F12 WeakPolarHBondContact O-CD2 3.48Å; A10-F12 VanDerWaalsContact C-N 3.33Å; A10-F12 PolarHBondContact O-N 2.88Å; F12-K16 WeakPolarHBondContact O-CG 3.45Å; F12-K16 PolarHBondContact O-N 2.84Å; F12-K16 VanDerWaalsContact O-N 3.08Å
13	A	48.9	Very low	42.8	Very low	64 Å²	64	123.9 Å²	123.9	53%	0.529	65%	0.653	S	S	.	*	H	α-helix	trans	-70.4	-40.1	175.4	0	0	0	0	0	111.6	S9 A10 K16 A17	S9-A13 PolarHBondContact O-N 2.77Å; A10-A13 PolarHBondContact O-N 3.06Å; A13-K16 PolarHBondContact O-N 3.12Å; A13-A17 PolarHBondContact O-N 3.34Å; A13-A17 VanDerWaalsContact O-N 3.15Å
14	V	47.3	Very low	43.3	Very low	89 Å²	89	120 Å²	120	54%	0.539	64%	0.641	S	S	.	*	H	α-helix	trans	-64.8	-42.7	175.6	179.8	0	0	0	0	110.7	A10 F11 K16 A17 F18	A10-V14 PolarHBondContact O-N 2.94Å; F11-V14 PolarHBondContact O-N 3.49Å; V14-K16 PolarHBondContact O-N 3.3Å; V14-A17 PolarHBondContact O-N 3.43Å; V14-F18 HydrophobicContact CG1-CE2 4.06Å; V14-F18 WeakPolarHBondContact O-CD2 3.45Å
15	L	43.3	Very low	43.4	Very low	121 Å²	121	122.8 Å²	122.8	63%	0.634	65%	0.648	S	S	*	*	H	α-helix	trans	-65	-36.8	176.5	-111.2	96.2	0	0	0	113.3	F11 F18	F11-L15 PolarHBondContact O-N 3.11Å; F11-L15 VanDerWaalsContact O-N 3.15Å; L15-F18 PolarHBondContact O-N 3.29Å
16	K	44.5	Very low	43.7	Very low	153 Å²	153	116.4 Å²	116.4	67%	0.665	63%	0.633	S	S	*	*	H	α-helix	trans	-72.8	-27.8	179.5	-79.1	-165.5	176.7	-168	0	113.3	F12 A13 V14 F18 S19	F12-K16 WeakPolarHBondContact O-CG 3.45Å; F12-K16 PolarHBondContact O-N 2.84Å; F12-K16 VanDerWaalsContact O-N 3.08Å; A13-K16 PolarHBondContact O-N 3.12Å; V14-K16 PolarHBondContact O-N 3.3Å; K16-F18 PolarHBondContact O-N 2.85Å; K16-S19 PolarHBondContact O-N 3.3Å; K16-S19 PolarHBondContact O-OG 2.65Å
17	A	41.6	Very low	43.6	Very low	68 Å²	68	117.2 Å²	117.2	56%	0.562	64%	0.639	S	S	*	*	H	α-helix	trans	-65.7	-26.5	174.6	0	0	0	0	0	112.7	A13 V14 S19 S20	A13-A17 PolarHBondContact O-N 3.34Å; A13-A17 VanDerWaalsContact O-N 3.15Å; V14-A17 PolarHBondContact O-N 3.43Å; A17-S19 VanDerWaalsContact C-N 3.3Å; A17-S20 PolarHBondContact O-OG 2.9Å
18	F	42	Very low	43.9	Very low	167 Å²	167	118.2 Å²	118.2	73%	0.732	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.6	-6	171.4	-68.4	-76.2	0	0	0	113.9	V14 L15 K16	V14-F18 HydrophobicContact CG1-CE2 4.06Å; V14-F18 WeakPolarHBondContact O-CD2 3.45Å; L15-F18 PolarHBondContact O-N 3.29Å; K16-F18 PolarHBondContact O-N 2.85Å
19	S	38.5	Very low	44.6	Very low	75 Å²	75	119 Å²	119	52%	0.524	64%	0.644	S	S	.	*	T	Hydrogen-bonded Turn	trans	-94	-3.3	-179.8	74.3	0	0	0	0	114.2	K16 A17 L21	K16-S19 PolarHBondContact O-N 3.3Å; K16-S19 PolarHBondContact O-OG 2.65Å; A17-S19 VanDerWaalsContact C-N 3.3Å; S19-L21 PolarHBondContact O-N 2.84Å
20	S	38.2	Very low	45.5	Very low	84 Å²	84	118.9 Å²	118.9	59%	0.587	64%	0.641	S	S	*	*			trans	-72.4	65.9	154.8	55	0	0	0	0	108.6	A17 H22	A17-S20 PolarHBondContact O-OG 2.9Å; S20-H22 PolarHBondContact O-N 2.74Å
21	L	39.5	Very low	47	Very low	132 Å²	132	120.7 Å²	120.7	69%	0.691	66%	0.657	S	S	*	*			trans	-57.1	85	155.1	-80.2	139.5	0	0	0	106.2	S19 T23	S19-L21 PolarHBondContact O-N 2.84Å; L21-T23 PolarHBondContact O-N 2.95Å
22	H	38	Very low	49	Very low	161 Å²	161	116.2 Å²	116.2	75%	0.745	64%	0.635	S	S	*	*			trans	-58.4	92.8	137.6	-74.1	-78.1	0	0	0	104.6	S20 V24	S20-H22 PolarHBondContact O-N 2.74Å; H22-V24 HydrophobicContact CB-CG2 4.06Å; H22-V24 PolarHBondContact O-N 3.21Å
23	T	34.7	Very low	51.2	Low	110 Å²	110	112.3 Å²	112.3	68%	0.675	62%	0.62	S	S	*	*			trans	-65.2	78.7	165.9	-33.9	0	0	0	0	105.4	L21 N25	L21-T23 PolarHBondContact O-N 2.95Å; T23-N25 PolarHBondContact O-N 3.41Å; T23-N25 VanDerWaalsContact O-N 3.09Å
24	V	43.7	Very low	53.3	Low	82 Å²	82	111.4 Å²	111.4	50%	0.497	61%	0.605	S	S	.	*			trans	-72.9	106.5	170.5	-172	0	0	0	0	104.6	H22 G26 Y28	H22-V24 HydrophobicContact CB-CG2 4.06Å; H22-V24 PolarHBondContact O-N 3.21Å; V24-G26 VanDerWaalsContact C-N 3.25Å; V24-G26 PolarHBondContact O-N 3.41Å; V24-Y28 HydrophobicContact CB-CE2 3.92Å; V24-Y28 WeakPolarHBondContact CB-OH 3.5Å; V24-Y28 HydrophobicContact CG1-CE2 4.2Å; V24-Y28 WeakPolarHBondContact CG1-OH 3.49Å
25	N	43.9	Very low	55.6	Low	160 Å²	160	108.5 Å²	108.5	86%	0.856	59%	0.587	S	S	*	*			trans	-62.2	88.3	176.5	-89.8	-19.2	0	0	0	109.2	T23	T23-N25 PolarHBondContact O-N 3.41Å; T23-N25 VanDerWaalsContact O-N 3.09Å
26	G	48.1	Very low	58	Low	45 Å²	45	104.2 Å²	104.2	46%	0.464	57%	0.565	S	S	.	*	S	Bend	trans	-160.3	132.9	169.7	0	0	0	0	0	108.3	V24 Y28	V24-G26 VanDerWaalsContact C-N 3.25Å; V24-G26 PolarHBondContact O-N 3.41Å; G26-Y28 VanDerWaalsContact C-N 3.27Å; G26-Y28 VanDerWaalsContact O-CD2 3.3Å; G26-Y28 WeakPolarHBondContact O-CD2 3.43Å; G26-Y28 PolarHBondContact O-N 3.01Å
27	Q	41.9	Very low	60.3	Low	203 Å²	203	99.9 Å²	99.9	95%	0.949	55%	0.548	S	S	*	.			trans	-62.9	99.7	157.2	-99	178.2	-47.2	0	0	106	E29	Q27-E29 PolarHBondContact O-N 2.67Å
28	Y	53.3	Low	62.6	Low	170 Å²	170	102.3 Å²	102.3	67%	0.667	55%	0.551	S	S	*	*			trans	-74.1	111.1	170.5	-72.9	-84.7	0	0	0	107.8	V24 G26	V24-Y28 HydrophobicContact CB-CE2 3.92Å; V24-Y28 WeakPolarHBondContact CB-OH 3.5Å; V24-Y28 HydrophobicContact CG1-CE2 4.2Å; V24-Y28 WeakPolarHBondContact CG1-OH 3.49Å; G26-Y28 VanDerWaalsContact C-N 3.27Å; G26-Y28 VanDerWaalsContact O-CD2 3.3Å; G26-Y28 WeakPolarHBondContact O-CD2 3.43Å; G26-Y28 PolarHBondContact O-N 3.01Å
29	E	60.8	Low	64.7	Low	176 Å²	176	97.2 Å²	97.2	82%	0.822	55%	0.546	S	S	*	.			trans	-69.7	132.7	159.7	-70.5	-171.5	160.8	0	0	108.1	Q27 A31	Q27-E29 PolarHBondContact O-N 2.67Å; E29-A31 PolarHBondContact O-N 2.8Å
30	P	70.7	Confident	66.9	Low	86 Å²	86	101.1 Å²	101.1	56%	0.558	56%	0.561	S	S	*	*			trans	-56.8	124.3	173.9	-22.3	31.9	0	0	0	110.2	Y32	P30-Y32 HydrophobicContact CB-CE1 4.05Å; P30-Y32 HydrophobicContact CB-CE2 3.97Å; P30-Y32 WeakPolarHBondContact O-CD2 3.45Å; P30-Y32 WeakPolarHBondContact O-CE2 3.32Å; P30-Y32 PolarHBondContact O-N 3.29Å
31	A	78	Confident	69.3	Low	99 Å²	99	100.5 Å²	100.5	82%	0.818	55%	0.551	S	S	*	*			trans	-83	113.2	171.3	0	0	0	0	0	108.7	E29	E29-A31 PolarHBondContact O-N 2.8Å
32	Y	88	Confident	71.5	Confident	65 Å²	65	99 Å²	99	26%	0.255	55%	0.548	S	S	.	.			trans	-92.6	147.1	175.6	-56.6	-72.8	0	0	0	110	P30 Q34 T35 R48 I50	P30-Y32 HydrophobicContact CB-CE1 4.05Å; P30-Y32 HydrophobicContact CB-CE2 3.97Å; P30-Y32 WeakPolarHBondContact O-CD2 3.45Å; P30-Y32 WeakPolarHBondContact O-CE2 3.32Å; P30-Y32 PolarHBondContact O-N 3.29Å; Y32-Q34 PolarHBondContact O-N 3.14Å; Y32-T35 HydrophobicContact CD2-CG2 3.63Å; Y32-T35 HydrophobicContact CG-CG2 3.81Å; Y32-R48 HydrophobicContact CD1-CB 3.79Å; Y32-R48 HydrophobicContact CD1-CG 4.27Å; Y32-R48 HydrophobicContact CE1-CB 4.19Å; Y32-R48 HydrophobicContact CE1-CG 4.36Å; Y32-R48 HydrophobicContact CG-CB 4.11Å; Y32-R48 HydrophobicContact CG-CG 4.38Å; Y32-I50 HydrophobicContact CD1-CG2 3.89Å; Y32-I50 HydrophobicContact CE1-CG2 3.99Å
33	L	90.6	Very high	73.9	Confident	48 Å²	48	96.8 Å²	96.8	25%	0.251	54%	0.542	S	S	.	.	S	Bend	trans	-66.8	-30.6	174.2	-66	177.7	0	0	0	111.5	V49 E52 Y129 F213 L215	L33-V49 HydrophobicContact CB-CB 4.08Å; L33-V49 HydrophobicContact CB-CG1 4Å; L33-V49 HydrophobicContact CD1-CG1 4Å; L33-V49 PolarHBondContact N-O 3.4Å; L33-E52 HydrophobicContact CD1-CB 3.82Å; L33-Y129 HydrophobicContact CB-CE2 4.29Å; L33-F213 HydrophobicContact CD2-CZ 4.37Å; L33-L215 HydrophobicContact CD1-CD1 4.38Å
34	Q	93.3	Very high	76.5	Confident	46 Å²	46	93.1 Å²	93.1	22%	0.215	52%	0.519	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.9	148.3	174.5	-177.6	66.4	42.9	0	0	109.2	Y32 R48 V49 M127 T128 Y129 R212	Y32-Q34 PolarHBondContact O-N 3.14Å; Q34-R48 CarbonylContact O-C 3.46Å; Q34-R48 WeakPolarHBondContact O-CA 3.35Å; Q34-V49 HydrophobicContact CB-CB 4.29Å; Q34-V49 HydrophobicContact CB-CG2 4.03Å; Q34-V49 PolarHBondContact O-N 3.24Å; Q34-M127 HydrophobicContact CB-SD 4.2Å; Q34-M127 HydrophobicContact CG-CG 4.05Å; Q34-M127 HydrophobicContact CG-SD 3.79Å; Q34-T128 WeakPolarHBondContact CG-O 3.44Å; Q34-Y129 HydrophobicContact CB-CD2 3.54Å; Q34-Y129 HydrophobicContact CB-CE2 3.89Å; Q34-Y129 HydrophobicContact CG-CD2 4Å; Q34-R212 VanDerWaalsContact OE1-NH2 3.08Å
35	T	94.6	Very high	78.8	Confident	27 Å²	27	90.2 Å²	90.2	17%	0.166	50%	0.5	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	164.1	169.5	70.8	0	0	0	0	109.8	Y32 M37 N45 R48	Y32-T35 HydrophobicContact CD2-CG2 3.63Å; Y32-T35 HydrophobicContact CG-CG2 3.81Å; T35-M37 VanDerWaalsContact OG1-CB 3.22Å; T35-M37 WeakPolarHBondContact OG1-CB 3.36Å; T35-M37 PolarHBondContact OG1-N 2.92Å; T35-N45 WeakPolarHBondContact CB-OD1 3.39Å; T35-R48 HydrophobicContact CG2-CB 4.36Å; T35-R48 HydrophobicContact CG2-CG 4.01Å
36	N	95	Very high	81.3	Confident	31 Å²	31	83.4 Å²	83.4	17%	0.166	47%	0.465	C	S	.	.			trans	-92.1	26.9	166	71.5	-20.6	0	0	0	112.8	D38 T44 T46 F47 L126 M127	N36-D38 PolarHBondContact O-N 2.83Å; N36-T44 PolarHBondContact OD1-O 2.83Å; N36-T44 VanDerWaalsContact OD1-O 3.14Å; N36-T46 PolarHBondContact ND2-OG1 2.8Å; N36-T46 PolarHBondContact OD1-N 2.9Å; N36-T46 PolarHBondContact OD1-OG1 3.43Å; N36-F47 PolarHBondContact N-O 2.97Å; N36-F47 VanDerWaalsContact N-O 3.1Å; N36-F47 PolarHBondContact OD1-N 3.49Å; N36-F47 PolarHBondContact OD1-O 3.23Å; N36-L126 WeakPolarHBondContact CB-O 3.49Å; N36-L126 PolarHBondContact ND2-O 2.81Å; N36-L126 VanDerWaalsContact ND2-O 3.15Å; N36-M127 HydrophobicContact CB-CB 4.21Å; N36-M127 HydrophobicContact CB-CG 4.43Å
37	M	92.6	Very high	83.7	Confident	62 Å²	62	81.3 Å²	81.3	31%	0.305	44%	0.443	S	S	.	.			trans	-71.1	127.2	177.9	-170.4	167.7	65.9	0	0	110.5	T35 G39 D41 T42 T44 N45	T35-M37 VanDerWaalsContact OG1-CB 3.22Å; T35-M37 WeakPolarHBondContact OG1-CB 3.36Å; T35-M37 PolarHBondContact OG1-N 2.92Å; M37-G39 PolarHBondContact O-N 3.42Å; M37-D41 WeakPolarHBondContact CG-O 3.44Å; M37-T42 HydrophobicContact SD-CG2 4.41Å; M37-T44 WeakPolarHBondContact CA-OG1 3.45Å; M37-N45 HydrophobicContact CB-CB 3.91Å; M37-N45 HydrophobicContact CG-CB 4Å; M37-N45 HydrophobicContact SD-CB 4Å
38	D	88.8	Confident	86.3	Confident	119 Å²	119	73.5 Å²	73.5	64%	0.636	41%	0.405	S	S	*	.			trans	-81.8	104	175.2	-68.6	-31.8	0	0	0	109.8	N36 N40 D41 T44	N36-D38 PolarHBondContact O-N 2.83Å; D38-N40 PolarHBondContact O-N 3.18Å; D38-N40 VanDerWaalsContact O-N 3.16Å; D38-D41 PolarHBondContact O-N 2.65Å; D38-D41 VanDerWaalsContact O-N 3.07Å; D38-T44 HydrophobicContact CB-CG2 4.06Å; D38-T44 PolarHBondContact N-OG1 2.7Å
39	G	87.3	Confident	88.3	Confident	60 Å²	60	65.4 Å²	65.4	62%	0.619	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.5	-120.4	-176	0	0	0	0	0	111.1	M37	M37-G39 PolarHBondContact O-N 3.42Å
40	N	84.4	Confident	89.8	Confident	158 Å²	158	59.9 Å²	59.9	85%	0.845	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104	9.1	179.5	-67.1	-12.5	0	0	0	113.3	D38 T42	D38-N40 PolarHBondContact O-N 3.18Å; D38-N40 VanDerWaalsContact O-N 3.16Å; N40-T42 PolarHBondContact O-N 3.47Å; N40-T42 VanDerWaalsContact O-N 3.12Å
41	D	87.7	Confident	90.8	Very high	71 Å²	71	60.4 Å²	60.4	38%	0.38	34%	0.343	S	S	.	.			trans	-79.2	97.2	-179.2	-175.3	4	0	0	0	111.5	M37 D38 N43 T44	M37-D41 WeakPolarHBondContact CG-O 3.44Å; D38-D41 PolarHBondContact O-N 2.65Å; D38-D41 VanDerWaalsContact O-N 3.07Å; D41-N43 PolarHBondContact O-N 2.86Å; D41-N43 VanDerWaalsContact OD1-CB 3.27Å; D41-N43 WeakPolarHBondContact OD1-CB 3.14Å; D41-N43 PolarHBondContact OD1-N 3.47Å; D41-N43 PolarHBondContact OD1-ND2 3.31Å; D41-T44 HydrophobicContact CB-CG2 4.18Å; D41-T44 PolarHBondContact O-N 2.91Å; D41-T44 PolarHBondContact O-OG1 3.06Å
42	T	85.9	Confident	91.4	Very high	100 Å²	100	56 Å²	56	61%	0.613	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-18.3	179.1	58.7	0	0	0	0	114.1	M37 N40 T44 N45	M37-T42 HydrophobicContact SD-CG2 4.41Å; N40-T42 PolarHBondContact O-N 3.47Å; N40-T42 VanDerWaalsContact O-N 3.12Å; T42-T44 VanDerWaalsContact C-N 3.31Å; T42-T44 PolarHBondContact O-N 2.73Å; T42-N45 WeakPolarHBondContact O-CB 3.34Å; T42-N45 PolarHBondContact O-N 2.81Å
43	N	87.6	Confident	91.5	Very high	115 Å²	115	56.8 Å²	56.8	62%	0.615	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.4	-26.6	177.1	-62.2	-63.3	0	0	0	113.3	D41	D41-N43 PolarHBondContact O-N 2.86Å; D41-N43 VanDerWaalsContact OD1-CB 3.27Å; D41-N43 WeakPolarHBondContact OD1-CB 3.14Å; D41-N43 PolarHBondContact OD1-N 3.47Å; D41-N43 PolarHBondContact OD1-ND2 3.31Å
44	T	89.9	Confident	91.4	Very high	32 Å²	32	58.8 Å²	58.8	20%	0.196	33%	0.326	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.9	-18.6	179.4	62.3	0	0	0	0	112.7	N36 M37 D38 D41 T42 T46	N36-T44 PolarHBondContact OD1-O 2.83Å; N36-T44 VanDerWaalsContact OD1-O 3.14Å; M37-T44 WeakPolarHBondContact CA-OG1 3.45Å; D38-T44 HydrophobicContact CB-CG2 4.06Å; D38-T44 PolarHBondContact N-OG1 2.7Å; D41-T44 HydrophobicContact CB-CG2 4.18Å; D41-T44 PolarHBondContact O-N 2.91Å; D41-T44 PolarHBondContact O-OG1 3.06Å; T42-T44 VanDerWaalsContact C-N 3.31Å; T42-T44 PolarHBondContact O-N 2.73Å; T44-T46 VanDerWaalsContact C-N 3.3Å; T44-T46 PolarHBondContact O-N 2.81Å; T44-T46 PolarHBondContact O-OG1 3.15Å
45	N	92.9	Very high	91.4	Very high	21 Å²	21	59.7 Å²	59.7	11%	0.112	34%	0.342	C	S	.	.			trans	-68	82.5	179.1	-170.1	4.4	0	0	0	111.3	T35 M37 T42 R48	T35-N45 WeakPolarHBondContact CB-OD1 3.39Å; M37-N45 HydrophobicContact CB-CB 3.91Å; M37-N45 HydrophobicContact CG-CB 4Å; M37-N45 HydrophobicContact SD-CB 4Å; T42-N45 WeakPolarHBondContact O-CB 3.34Å; T42-N45 PolarHBondContact O-N 2.81Å; N45-R48 PolarHBondContact ND2-NE 3.41Å; N45-R48 PolarHBondContact O-NH2 2.83Å; N45-R48 WeakPolarHBondContact OD1-CD 3.39Å; N45-R48 WeakPolarHBondContact OD1-CG 3.46Å; N45-R48 PolarHBondContact OD1-NE 2.95Å
46	T	96.1	Very high	91.4	Very high	18 Å²	18	58.6 Å²	58.6	11%	0.11	34%	0.335	C	S	.	.			trans	-116.4	-19.2	-169.3	46.9	0	0	0	0	113.1	N36 T44 W61 K62 Y125	N36-T46 PolarHBondContact ND2-OG1 2.8Å; N36-T46 PolarHBondContact OD1-N 2.9Å; N36-T46 PolarHBondContact OD1-OG1 3.43Å; T44-T46 VanDerWaalsContact C-N 3.3Å; T44-T46 PolarHBondContact O-N 2.81Å; T44-T46 PolarHBondContact O-OG1 3.15Å; T46-W61 CarbonylContact O-C 3.57Å; T46-W61 WeakPolarHBondContact O-CA 3.47Å; T46-W61 WeakPolarHBondContact O-CB 3.48Å; T46-K62 HydrophobicContact CG2-CB 4.2Å; T46-K62 HydrophobicContact CG2-CD 3.96Å; T46-K62 PolarHBondContact O-N 2.78Å; T46-Y125 HydrophobicContact CG2-CE1 4.13Å; T46-Y125 WeakPolarHBondContact O-CD2 3.23Å
47	F	97.6	Very high	91.4	Very high	1 Å²	1	57.1 Å²	57.1	0%	0.004	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	132.4	179.6	-173.5	-144.3	0	0	0	110.3	N36 F59 E60 W61 L74 A110 Y125 M127	N36-F47 PolarHBondContact N-O 2.97Å; N36-F47 VanDerWaalsContact N-O 3.1Å; N36-F47 PolarHBondContact OD1-N 3.49Å; N36-F47 PolarHBondContact OD1-O 3.23Å; F47-F59 HydrophobicContact CD2-CB 4.41Å; F47-F59 HydrophobicContact CD2-CD1 4.31Å; F47-F59 HydrophobicContact CE1-CD1 4.19Å; F47-F59 HydrophobicContact CE1-CE1 4.35Å; F47-F59 HydrophobicContact CE2-CB 3.57Å; F47-F59 AromaticContact CE2-CD1 3.42Å; F47-F59 HydrophobicContact CE2-CD1 3.42Å; F47-F59 VanDerWaalsContact CE2-CD1 3.42Å; F47-F59 HydrophobicContact CE2-CE1 4.32Å; F47-F59 AromaticContact CE2-CG 3.7Å; F47-F59 HydrophobicContact CE2-CG 3.7Å; F47-F59 HydrophobicContact CZ-CB 4.24Å; F47-F59 AromaticContact CZ-CD1 3.33Å; F47-F59 HydrophobicContact CZ-CD1 3.33Å; F47-F59 AromaticContact CZ-CE1 3.77Å; F47-F59 HydrophobicContact CZ-CE1 3.77Å; F47-F59 AromaticContact CZ-CG 3.86Å; F47-F59 HydrophobicContact CZ-CG 3.86Å; F47-E60 WeakPolarHBondContact CD2-O 3.48Å; F47-W61 HydrophobicContact CD2-CB 4.1Å; F47-L74 HydrophobicContact CE2-CD2 3.78Å; F47-L74 HydrophobicContact CZ-CD2 3.98Å; F47-A110 HydrophobicContact CD2-CB 3.95Å; F47-A110 HydrophobicContact CE1-CB 4.42Å; F47-A110 HydrophobicContact CE2-CB 3.74Å; F47-A110 HydrophobicContact CG-CB 4.36Å; F47-A110 HydrophobicContact CZ-CB 4.02Å; F47-Y125 HydrophobicContact CB-CD2 4.37Å; F47-Y125 HydrophobicContact CB-CG 4.42Å; F47-M127 HydrophobicContact CD1-CB 3.53Å; F47-M127 HydrophobicContact CD1-CE 3.85Å; F47-M127 HydrophobicContact CE1-CB 4.01Å; F47-M127 HydrophobicContact CE1-CE 3.87Å; F47-M127 HydrophobicContact CG-CB 4.44Å; F47-M127 HydrophobicContact CG-CE 4.18Å; F47-M127 HydrophobicContact CZ-CE 4.27Å
48	R	96.2	Very high	91.5	Very high	39 Å²	39	54.9 Å²	54.9	15%	0.147	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	142.7	-163.8	-47.6	178.2	-172.3	123.3	1.6	111.1	Y32 Q34 T35 N45 F59 E60	Y32-R48 HydrophobicContact CD1-CB 3.79Å; Y32-R48 HydrophobicContact CD1-CG 4.27Å; Y32-R48 HydrophobicContact CE1-CB 4.19Å; Y32-R48 HydrophobicContact CE1-CG 4.36Å; Y32-R48 HydrophobicContact CG-CB 4.11Å; Y32-R48 HydrophobicContact CG-CG 4.38Å; Q34-R48 CarbonylContact O-C 3.46Å; Q34-R48 WeakPolarHBondContact O-CA 3.35Å; T35-R48 HydrophobicContact CG2-CB 4.36Å; T35-R48 HydrophobicContact CG2-CG 4.01Å; N45-R48 PolarHBondContact ND2-NE 3.41Å; N45-R48 PolarHBondContact O-NH2 2.83Å; N45-R48 WeakPolarHBondContact OD1-CD 3.39Å; N45-R48 WeakPolarHBondContact OD1-CG 3.46Å; N45-R48 PolarHBondContact OD1-NE 2.95Å; R48-F59 VanDerWaalsContact O-CA 3.23Å; R48-F59 WeakPolarHBondContact O-CA 3.38Å; R48-E60 IonicContact CZ-OE2 3.79Å; R48-E60 PolarHBondContact N-O 3.29Å; R48-E60 IonicContact NH1-OE2 2.73Å; R48-E60 PolarHBondContact NH1-OE2 2.97Å; R48-E60 PolarHBondContact O-N 3Å
49	V	95.1	Very high	92	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	115	164.8	-173.3	0	0	0	0	107.8	L33 Q34 L57 F59 M127 Y129	L33-V49 HydrophobicContact CB-CB 4.08Å; L33-V49 HydrophobicContact CB-CG1 4Å; L33-V49 HydrophobicContact CD1-CG1 4Å; L33-V49 PolarHBondContact N-O 3.4Å; Q34-V49 HydrophobicContact CB-CB 4.29Å; Q34-V49 HydrophobicContact CB-CG2 4.03Å; Q34-V49 PolarHBondContact O-N 3.24Å; V49-L57 HydrophobicContact CG1-CD2 4.1Å; V49-F59 HydrophobicContact CG2-CD1 4.16Å; V49-F59 HydrophobicContact CG2-CE1 3.81Å; V49-M127 HydrophobicContact CB-CE 4.48Å; V49-M127 HydrophobicContact CG2-CE 3.35Å; V49-M127 HydrophobicContact CG2-SD 4.1Å; V49-Y129 HydrophobicContact CG2-CD2 4.08Å; V49-Y129 HydrophobicContact CG2-CE2 4.49Å; V49-Y129 HydrophobicContact CG2-CG 4.23Å
50	I	93.4	Very high	92.4	Very high	60 Å²	60	48.6 Å²	48.6	31%	0.308	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	-28.2	-179.6	59	172.3	0	0	0	112.2	Y32 A58 E60 M93	Y32-I50 HydrophobicContact CD1-CG2 3.89Å; Y32-I50 HydrophobicContact CE1-CG2 3.99Å; I50-A58 HydrophobicContact CD1-CB 4.13Å; I50-A58 HydrophobicContact CG1-CB 3.75Å; I50-A58 WeakPolarHBondContact CG1-O 3.42Å; I50-A58 PolarHBondContact N-O 2.69Å; I50-E60 HydrophobicContact CG2-CB 3.58Å; I50-M93 HydrophobicContact CD1-CG 4.25Å; I50-M93 HydrophobicContact CD1-SD 3.97Å
51	H	91.1	Very high	93	Very high	96 Å²	96	41.2 Å²	41.2	44%	0.444	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.3	143.4	-177.8	-172	79.1	0	0	0	111.1	A58	H51-A58 HydrophobicContact CB-CB 3.99Å; H51-A58 PolarHBondContact N-O 3.15Å; H51-A58 PolarHBondContact O-N 3.08Å
52	E	91.2	Very high	93.4	Very high	6 Å²	6	43 Å²	43	3%	0.028	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	128.4	173.7	168.4	-168.7	134.8	0	0	109.3	L33 L57 Y129 R131 R134 L215	L33-E52 HydrophobicContact CD1-CB 3.82Å; E52-L57 HydrophobicContact CB-CD2 3.48Å; E52-L57 VanDerWaalsContact CB-CD2 3.48Å; E52-L57 HydrophobicContact CG-CD2 3.65Å; E52-Y129 WeakPolarHBondContact OE2-CE1 3.43Å; E52-Y129 PolarHBondContact OE2-OH 3.44Å; E52-R131 WeakPolarHBondContact OE1-CD 3.45Å; E52-R131 WeakPolarHBondContact OE2-CD 3.29Å; E52-R131 WeakPolarHBondContact OE2-CG 3.42Å; E52-R134 VanDerWaalsContact CG-NH2 3.28Å; E52-R134 IonicContact OE1-CZ 3.99Å; E52-R134 VanDerWaalsContact OE1-CZ 3.26Å; E52-R134 IonicContact OE1-NE 3.24Å; E52-R134 PolarHBondContact OE1-NE 2.95Å; E52-R134 IonicContact OE1-NH2 2.65Å; E52-R134 PolarHBondContact OE1-NH2 2.88Å; E52-L215 HydrophobicContact CB-CD1 3.6Å; E52-L215 HydrophobicContact CG-CD1 4.17Å; E52-L215 WeakPolarHBondContact O-CD1 3.33Å
53	Q	90.7	Very high	93.9	Very high	83 Å²	83	44.2 Å²	44.2	39%	0.388	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	172.1	175	-56.2	-177	-2.7	0	0	110.9	A55 A56 R134	Q53-A55 PolarHBondContact O-N 3.36Å; Q53-A56 WeakPolarHBondContact CA-O 3.43Å; Q53-A56 HydrophobicContact CB-CB 4.35Å; Q53-A56 WeakPolarHBondContact CB-O 3.39Å; Q53-A56 PolarHBondContact N-O 3.45Å; Q53-R134 PolarHBondContact O-NH2 2.9Å
54	T	88.5	Confident	94.2	Very high	89 Å²	89	39 Å²	39	55%	0.546	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-49.6	-38.1	-179	-53.7	0	0	0	0	114.1	I99 R134 T217	T54-I99 WeakPolarHBondContact O-CD1 2.94Å; T54-R134 VanDerWaalsContact CA-NH1 3.31Å; T54-R134 PolarHBondContact O-NH1 2.84Å; T54-T217 HydrophobicContact CG2-CG2 4.1Å
55	A	91.8	Very high	94.5	Very high	66 Å²	66	42.4 Å²	42.4	55%	0.545	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-140	17.2	-178.6	0	0	0	0	0	113.5	Q53 K97	Q53-A55 PolarHBondContact O-N 3.36Å; A55-K97 CarbonylContact O-C 3.56Å; A55-K97 VanDerWaalsContact O-C 3.31Å; A55-K97 WeakPolarHBondContact O-CA 3.19Å
56	A	94.7	Very high	94.6	Very high	4 Å²	4	44.7 Å²	44.7	3%	0.033	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	150.3	179.3	0	0	0	0	0	112.8	Q53 L95 L96 K97	Q53-A56 WeakPolarHBondContact CA-O 3.43Å; Q53-A56 HydrophobicContact CB-CB 4.35Å; Q53-A56 WeakPolarHBondContact CB-O 3.39Å; Q53-A56 PolarHBondContact N-O 3.45Å; A56-L95 HydrophobicContact CB-CD1 3.68Å; A56-L95 HydrophobicContact CB-CD2 4.15Å; A56-L95 HydrophobicContact CB-CG 3.83Å; A56-L96 CarbonylContact C-O 3.57Å; A56-L96 WeakPolarHBondContact CA-O 3.4Å; A56-L96 WeakPolarHBondContact CB-O 3.43Å; A56-K97 HydrophobicContact CB-CG 4.34Å
57	L	95.5	Very high	94.5	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	133.7	168.4	-72.3	-178.9	0	0	0	109.2	V49 E52 F59 L96 I99 Y108 Y129	V49-L57 HydrophobicContact CG1-CD2 4.1Å; E52-L57 HydrophobicContact CB-CD2 3.48Å; E52-L57 VanDerWaalsContact CB-CD2 3.48Å; E52-L57 HydrophobicContact CG-CD2 3.65Å; L57-F59 HydrophobicContact CB-CD2 4.2Å; L57-F59 HydrophobicContact CB-CE2 3.35Å; L57-F59 HydrophobicContact CB-CZ 3.54Å; L57-F59 HydrophobicContact CD1-CE1 4.49Å; L57-F59 HydrophobicContact CD1-CE2 4.41Å; L57-F59 HydrophobicContact CD1-CZ 3.75Å; L57-F59 HydrophobicContact CG-CZ 4.3Å; L57-F59 WeakPolarHBondContact O-CD2 3.43Å; L57-F59 WeakPolarHBondContact O-CE2 3.49Å; L57-L96 PolarHBondContact N-O 3.09Å; L57-L96 PolarHBondContact O-N 3.34Å; L57-I99 HydrophobicContact CD2-CG2 4.43Å; L57-I99 HydrophobicContact CG-CB 4.32Å; L57-I99 HydrophobicContact CG-CG2 4.02Å; L57-Y108 HydrophobicContact CD1-CE1 3.95Å; L57-Y108 HydrophobicContact CD1-CE2 4.03Å; L57-Y108 WeakPolarHBondContact CD1-OH 3.34Å; L57-Y129 HydrophobicContact CD1-CD1 3.75Å; L57-Y129 HydrophobicContact CD1-CE1 4.21Å; L57-Y129 HydrophobicContact CD2-CD1 4.44Å; L57-Y129 HydrophobicContact CD2-CE1 4.06Å
58	A	95.8	Very high	94.4	Very high	14 Å²	14	57 Å²	57	12%	0.116	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	133.6	169.2	0	0	0	0	0	109.2	I50 H51 G94 L95	I50-A58 HydrophobicContact CD1-CB 4.13Å; I50-A58 HydrophobicContact CG1-CB 3.75Å; I50-A58 WeakPolarHBondContact CG1-O 3.42Å; I50-A58 PolarHBondContact N-O 2.69Å; H51-A58 HydrophobicContact CB-CB 3.99Å; H51-A58 PolarHBondContact N-O 3.15Å; H51-A58 PolarHBondContact O-N 3.08Å; A58-G94 WeakPolarHBondContact CA-O 3.37Å; A58-L95 HydrophobicContact CB-CD1 3.94Å
59	F	97.4	Very high	94.4	Very high	1 Å²	1	58.5 Å²	58.5	0%	0.004	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	154.1	-178.4	-61.3	-92.7	0	0	0	111.1	F47 R48 V49 L57 W61 L74 M93 G94 L96 Y108 M127	F47-F59 HydrophobicContact CD2-CB 4.41Å; F47-F59 HydrophobicContact CD2-CD1 4.31Å; F47-F59 HydrophobicContact CE1-CD1 4.19Å; F47-F59 HydrophobicContact CE1-CE1 4.35Å; F47-F59 HydrophobicContact CE2-CB 3.57Å; F47-F59 AromaticContact CE2-CD1 3.42Å; F47-F59 HydrophobicContact CE2-CD1 3.42Å; F47-F59 VanDerWaalsContact CE2-CD1 3.42Å; F47-F59 HydrophobicContact CE2-CE1 4.32Å; F47-F59 AromaticContact CE2-CG 3.7Å; F47-F59 HydrophobicContact CE2-CG 3.7Å; F47-F59 HydrophobicContact CZ-CB 4.24Å; F47-F59 AromaticContact CZ-CD1 3.33Å; F47-F59 HydrophobicContact CZ-CD1 3.33Å; F47-F59 AromaticContact CZ-CE1 3.77Å; F47-F59 HydrophobicContact CZ-CE1 3.77Å; F47-F59 AromaticContact CZ-CG 3.86Å; F47-F59 HydrophobicContact CZ-CG 3.86Å; R48-F59 VanDerWaalsContact O-CA 3.23Å; R48-F59 WeakPolarHBondContact O-CA 3.38Å; V49-F59 HydrophobicContact CG2-CD1 4.16Å; V49-F59 HydrophobicContact CG2-CE1 3.81Å; L57-F59 HydrophobicContact CB-CD2 4.2Å; L57-F59 HydrophobicContact CB-CE2 3.35Å; L57-F59 HydrophobicContact CB-CZ 3.54Å; L57-F59 HydrophobicContact CD1-CE1 4.49Å; L57-F59 HydrophobicContact CD1-CE2 4.41Å; L57-F59 HydrophobicContact CD1-CZ 3.75Å; L57-F59 HydrophobicContact CG-CZ 4.3Å; L57-F59 WeakPolarHBondContact O-CD2 3.43Å; L57-F59 WeakPolarHBondContact O-CE2 3.49Å; F59-W61 HydrophobicContact CB-CE3 4.47Å; F59-W61 HydrophobicContact CB-CZ3 4.48Å; F59-L74 HydrophobicContact CB-CD1 4.36Å; F59-L74 HydrophobicContact CB-CD2 4.21Å; F59-L74 HydrophobicContact CD2-CD1 4.1Å; F59-L74 HydrophobicContact CG-CD2 4.43Å; F59-M93 WeakPolarHBondContact O-CA 3.36Å; F59-G94 PolarHBondContact N-O 3.1Å; F59-G94 PolarHBondContact O-N 3.15Å; F59-L96 HydrophobicContact CD2-CB 4.34Å; F59-L96 HydrophobicContact CE2-CB 3.88Å; F59-L96 HydrophobicContact CE2-CD2 4.33Å; F59-Y108 HydrophobicContact CE1-CD1 4.16Å; F59-Y108 HydrophobicContact CE1-CG 4.07Å; F59-Y108 HydrophobicContact CE2-CD1 4.3Å; F59-Y108 AromaticContact CZ-CD1 3.47Å; F59-Y108 HydrophobicContact CZ-CD1 3.47Å; F59-Y108 VanDerWaalsContact CZ-CD1 3.47Å; F59-Y108 AromaticContact CZ-CE1 3.84Å; F59-Y108 HydrophobicContact CZ-CE1 3.84Å; F59-Y108 AromaticContact CZ-CG 3.85Å; F59-Y108 HydrophobicContact CZ-CG 3.85Å; F59-M127 HydrophobicContact CD1-CE 3.71Å; F59-M127 HydrophobicContact CE1-CE 3.62Å
60	E	97.1	Very high	94.5	Very high	46 Å²	46	60 Å²	60	22%	0.215	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	145.1	163.1	-176.6	-168.5	-132.2	0	0	108.7	F47 R48 I50 N92 M93	F47-E60 WeakPolarHBondContact CD2-O 3.48Å; R48-E60 IonicContact CZ-OE2 3.79Å; R48-E60 PolarHBondContact N-O 3.29Å; R48-E60 IonicContact NH1-OE2 2.73Å; R48-E60 PolarHBondContact NH1-OE2 2.97Å; R48-E60 PolarHBondContact O-N 3Å; I50-E60 HydrophobicContact CG2-CB 3.58Å; E60-N92 CarbonylContact C-O 3.56Å; E60-N92 VanDerWaalsContact CA-O 3.3Å; E60-N92 WeakPolarHBondContact CA-O 3.27Å; E60-N92 WeakPolarHBondContact CG-O 2.95Å; E60-M93 HydrophobicContact CB-CG 3.93Å; E60-M93 HydrophobicContact CG-CG 3.89Å
61	W	97	Very high	94.7	Very high	4 Å²	4	58.2 Å²	58.2	2%	0.015	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	159.6	171.9	54.6	94.4	0	0	0	112.3	T46 F47 F59 Q63 V72 L74 V88 N92 M93 A110 Y125	T46-W61 CarbonylContact O-C 3.57Å; T46-W61 WeakPolarHBondContact O-CA 3.47Å; T46-W61 WeakPolarHBondContact O-CB 3.48Å; F47-W61 HydrophobicContact CD2-CB 4.1Å; F59-W61 HydrophobicContact CB-CE3 4.47Å; F59-W61 HydrophobicContact CB-CZ3 4.48Å; W61-Q63 PolarHBondContact O-N 3.18Å; W61-V72 HydrophobicContact CD2-CG1 4.35Å; W61-V72 HydrophobicContact CH2-CG1 4.43Å; W61-V72 HydrophobicContact CZ2-CB 3.82Å; W61-V72 HydrophobicContact CZ2-CG1 3.88Å; W61-V72 HydrophobicContact CZ2-CG2 4.15Å; W61-L74 HydrophobicContact CE3-CD2 3.88Å; W61-L74 HydrophobicContact CH2-CD1 4.29Å; W61-L74 HydrophobicContact CH2-CD2 4.35Å; W61-L74 HydrophobicContact CH2-CG 4.32Å; W61-L74 HydrophobicContact CZ3-CD1 3.85Å; W61-L74 HydrophobicContact CZ3-CD2 3.64Å; W61-L74 HydrophobicContact CZ3-CG 3.97Å; W61-V88 HydrophobicContact CH2-CB 4.03Å; W61-V88 HydrophobicContact CH2-CG1 3.96Å; W61-V88 HydrophobicContact CH2-CG2 4.04Å; W61-V88 HydrophobicContact CZ2-CB 4.26Å; W61-V88 HydrophobicContact CZ2-CG1 4.12Å; W61-N92 PolarHBondContact N-O 2.67Å; W61-N92 WeakPolarHBondContact O-CB 3.22Å; W61-M93 VanDerWaalsContact CZ3-C 3.48Å; W61-A110 HydrophobicContact CB-CB 4.48Å; W61-Y125 HydrophobicContact CB-CD2 3.99Å; W61-Y125 HydrophobicContact CB-CE2 4.2Å
62	K	95.9	Very high	95	Very high	109 Å²	109	53.7 Å²	53.7	47%	0.474	27%	0.274	S	S	.	.	P	Polyproline II helix	trans	-63.6	134.2	167.6	-174.7	175.2	-174.7	174.2	0	108.7	T46 M64 Y125	T46-K62 HydrophobicContact CG2-CB 4.2Å; T46-K62 HydrophobicContact CG2-CD 3.96Å; T46-K62 PolarHBondContact O-N 2.78Å; K62-M64 PolarHBondContact O-N 2.5Å; K62-M64 VanDerWaalsContact O-N 3.13Å; K62-Y125 HydrophobicContact CB-CE2 4.13Å; K62-Y125 WeakPolarHBondContact O-CE2 3.43Å
63	Q	95.9	Very high	95.3	Very high	124 Å²	124	53.9 Å²	53.9	58%	0.579	28%	0.276	S	S	*	.	P	Polyproline II helix	trans	-52.2	123.1	-178.1	-172.9	174.3	-6.3	0	0	111.6	W61 T65 N92	W61-Q63 PolarHBondContact O-N 3.18Å; Q63-T65 HydrophobicContact CG-CG2 4.09Å; Q63-N92 WeakPolarHBondContact CA-OD1 3.15Å
64	M	95.2	Very high	95.7	Very high	7 Å²	7	50 Å²	50	3%	0.034	26%	0.258	C	S	.	.	P	Polyproline II helix	trans	-89	129.4	173.5	-59.6	178.4	-176	0	0	108.5	K62 V72 A110 G112 F122 Q123 Y125	K62-M64 PolarHBondContact O-N 2.5Å; K62-M64 VanDerWaalsContact O-N 3.13Å; M64-V72 HydrophobicContact CE-CG1 4.46Å; M64-V72 HydrophobicContact SD-CG1 4.45Å; M64-V72 HydrophobicContact SD-CG2 3.81Å; M64-A110 HydrophobicContact CE-CB 3.85Å; M64-A110 WeakPolarHBondContact CE-O 3.34Å; M64-G112 WeakPolarHBondContact SD-CA 3.26Å; M64-G112 PolarHBondContact SD-N 3.16Å; M64-F122 HydrophobicContact CB-CE2 3.98Å; M64-F122 HydrophobicContact CB-CZ 3.79Å; M64-Q123 HydrophobicContact CG-CG 4.35Å; M64-Q123 HydrophobicContact SD-CB 4.32Å; M64-Q123 HydrophobicContact SD-CG 4.4Å; M64-Y125 HydrophobicContact CE-CD2 3.29Å; M64-Y125 HydrophobicContact CE-CE2 3.39Å; M64-Y125 HydrophobicContact CE-CG 3.92Å; M64-Y125 HydrophobicContact CG-CE2 3.98Å
65	T	94.3	Very high	96.1	Very high	103 Å²	103	45.9 Å²	45.9	63%	0.632	23%	0.233	S	C	*	.			trans	-121.3	130.8	-175.5	57.3	0	0	0	0	111.1	Q63	Q63-T65 HydrophobicContact CG-CG2 4.09Å
66	H	95	Very high	96.4	Very high	69 Å²	69	43.7 Å²	43.7	32%	0.319	21%	0.211	S	C	.	.			trans	-153.2	144.4	173.4	-167.5	-91.1	0	0	0	108.8	Y68 F69 Y114 F122	H66-Y68 PolarHBondContact ND1-N 2.86Å; H66-Y68 PolarHBondContact O-N 3.26Å; H66-F69 WeakPolarHBondContact O-CB 3.23Å; H66-F69 PolarHBondContact O-N 2.74Å; H66-F69 VanDerWaalsContact O-N 3.08Å; H66-Y114 AromaticContact CE1-CD1 3.82Å; H66-Y114 AromaticContact CE1-CD2 3.59Å; H66-Y114 AromaticContact CE1-CG 3.39Å; H66-Y114 WeakPolarHBondContact ND1-CB 3.1Å; H66-Y114 AromaticContact ND1-CG 3.56Å; H66-Y114 AromaticContact NE2-CD1 3.95Å; H66-Y114 AromaticContact NE2-CG 3.99Å; H66-F122 HydrophobicContact CB-CD1 4.21Å; H66-F122 HydrophobicContact CB-CD2 4.15Å; H66-F122 HydrophobicContact CB-CE1 3.94Å; H66-F122 HydrophobicContact CB-CE2 3.92Å; H66-F122 HydrophobicContact CB-CG 4.3Å; H66-F122 HydrophobicContact CB-CZ 3.81Å
67	Q	95.3	Very high	96.4	Very high	162 Å²	162	47 Å²	47	76%	0.757	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.6	-34.4	-178	-178.7	179.8	4.5	0	0	112.7
68	Y	95.4	Very high	96.1	Very high	114 Å²	114	49.8 Å²	49.8	45%	0.447	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-109.1	32.3	179.2	-56.1	-73.6	0	0	0	112.5	H66 S70 Y114 K115	H66-Y68 PolarHBondContact ND1-N 2.86Å; H66-Y68 PolarHBondContact O-N 3.26Å; Y68-S70 PolarHBondContact O-N 3.17Å; Y68-Y114 CarbonylContact O-C 3.45Å; Y68-Y114 WeakPolarHBondContact O-CA 3.49Å; Y68-Y114 WeakPolarHBondContact O-CB 3.26Å; Y68-K115 WeakPolarHBondContact CB-O 3.46Å; Y68-K115 PolarHBondContact O-N 2.7Å
69	F	96.2	Very high	95.6	Very high	72 Å²	72	56.8 Å²	56.8	32%	0.316	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-47.6	137.2	179.7	177.1	-91.3	0	0	0	111.7	H66 V72 E89 F122	H66-F69 WeakPolarHBondContact O-CB 3.23Å; H66-F69 PolarHBondContact O-N 2.74Å; H66-F69 VanDerWaalsContact O-N 3.08Å; F69-V72 HydrophobicContact CE2-CG2 3.92Å; F69-V72 HydrophobicContact CZ-CG2 4.05Å; F69-E89 WeakPolarHBondContact CE1-O 3.2Å; F69-F122 HydrophobicContact CD2-CE1 4.18Å; F69-F122 HydrophobicContact CD2-CZ 4.05Å
70	S	96.2	Very high	94.9	Very high	30 Å²	30	65.7 Å²	65.7	21%	0.21	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	-65.4	-179.3	-162.1	0	0	0	0	110	Y68 Y113	Y68-S70 PolarHBondContact O-N 3.17Å; S70-Y113 WeakPolarHBondContact CA-O 3.34Å; S70-Y113 VanDerWaalsContact CB-O 3.28Å; S70-Y113 WeakPolarHBondContact CB-O 3.3Å; S70-Y113 PolarHBondContact N-O 3.36Å
71	Y	97.4	Very high	94.3	Very high	24 Å²	24	65.5 Å²	65.5	9%	0.094	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.1	169.7	-179.4	56.9	-92.2	0	0	0	110.6	E87 V88 Y113 N119	Y71-E87 HydrophobicContact CD2-CB 3.93Å; Y71-E87 HydrophobicContact CD2-CG 3.77Å; Y71-E87 HydrophobicContact CE2-CB 4.32Å; Y71-E87 VanDerWaalsContact CE2-CD 3.46Å; Y71-E87 HydrophobicContact CE2-CG 3.64Å; Y71-E87 WeakPolarHBondContact CE2-OE1 3.11Å; Y71-E87 HydrophobicContact CG-CB 4.32Å; Y71-E87 HydrophobicContact CG-CG 4.48Å; Y71-E87 PolarHBondContact OH-OE1 3.24Å; Y71-V88 WeakPolarHBondContact CA-O 3.27Å; Y71-V88 WeakPolarHBondContact CB-O 3.46Å; Y71-Y113 HydrophobicContact CD2-CD2 4.15Å; Y71-Y113 AromaticContact CE2-CD2 3.62Å; Y71-Y113 HydrophobicContact CE2-CD2 3.62Å; Y71-Y113 HydrophobicContact CE2-CE2 4.34Å; Y71-Y113 AromaticContact CE2-CG 3.91Å; Y71-Y113 HydrophobicContact CE2-CG 3.91Å; Y71-Y113 PolarHBondContact N-O 2.86Å; Y71-Y113 PolarHBondContact O-N 2.89Å; Y71-N119 HydrophobicContact CE1-CB 4.42Å; Y71-N119 WeakPolarHBondContact CE1-ND2 3.33Å; Y71-N119 PolarHBondContact OH-ND2 2.89Å
72	V	98.3	Very high	94	Very high	1 Å²	1	74.3 Å²	74.3	1%	0.006	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	129.9	163.5	175.8	0	0	0	0	109.4	W61 M64 F69 V88 A110 E111	W61-V72 HydrophobicContact CD2-CG1 4.35Å; W61-V72 HydrophobicContact CH2-CG1 4.43Å; W61-V72 HydrophobicContact CZ2-CB 3.82Å; W61-V72 HydrophobicContact CZ2-CG1 3.88Å; W61-V72 HydrophobicContact CZ2-CG2 4.15Å; M64-V72 HydrophobicContact CE-CG1 4.46Å; M64-V72 HydrophobicContact SD-CG1 4.45Å; M64-V72 HydrophobicContact SD-CG2 3.81Å; F69-V72 HydrophobicContact CE2-CG2 3.92Å; F69-V72 HydrophobicContact CZ-CG2 4.05Å; V72-V88 PolarHBondContact N-O 2.8Å; V72-V88 PolarHBondContact O-N 2.84Å; V72-A110 HydrophobicContact CG1-CB 4.06Å; V72-E111 CarbonylContact C-O 3.59Å; V72-E111 VanDerWaalsContact CA-O 3.23Å; V72-E111 WeakPolarHBondContact CA-O 3.46Å
73	S	98.1	Very high	93.9	Very high	9 Å²	9	71.9 Å²	71.9	6%	0.063	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	119.3	169.4	-161.8	0	0	0	0	109.2	V86 A110 E111	S73-V86 WeakPolarHBondContact CA-O 3.41Å; S73-A110 CarbonylContact O-C 3.52Å; S73-A110 WeakPolarHBondContact O-CA 3.22Å; S73-E111 PolarHBondContact N-O 2.91Å; S73-E111 PolarHBondContact O-N 2.88Å
74	L	98.2	Very high	93.9	Very high	1 Å²	1	71.3 Å²	71.3	1%	0.005	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	130.4	166	-68.7	177	0	0	0	108.3	F47 F59 W61 S85 V86 V88 L96 R109 A110	F47-L74 HydrophobicContact CE2-CD2 3.78Å; F47-L74 HydrophobicContact CZ-CD2 3.98Å; F59-L74 HydrophobicContact CB-CD1 4.36Å; F59-L74 HydrophobicContact CB-CD2 4.21Å; F59-L74 HydrophobicContact CD2-CD1 4.1Å; F59-L74 HydrophobicContact CG-CD2 4.43Å; W61-L74 HydrophobicContact CE3-CD2 3.88Å; W61-L74 HydrophobicContact CH2-CD1 4.29Å; W61-L74 HydrophobicContact CH2-CD2 4.35Å; W61-L74 HydrophobicContact CH2-CG 4.32Å; W61-L74 HydrophobicContact CZ3-CD1 3.85Å; W61-L74 HydrophobicContact CZ3-CD2 3.64Å; W61-L74 HydrophobicContact CZ3-CG 3.97Å; L74-S85 CarbonylContact O-C 3.57Å; L74-S85 WeakPolarHBondContact O-CA 3.2Å; L74-S85 WeakPolarHBondContact O-CB 3.42Å; L74-V86 HydrophobicContact CB-CG1 3.86Å; L74-V86 HydrophobicContact CD1-CG1 4.17Å; L74-V86 HydrophobicContact CG-CG1 4.49Å; L74-V86 PolarHBondContact N-O 2.8Å; L74-V86 PolarHBondContact O-N 2.9Å; L74-V88 HydrophobicContact CD1-CG2 4.33Å; L74-L96 HydrophobicContact CB-CB 4.43Å; L74-R109 WeakPolarHBondContact CA-O 3.38Å; L74-A110 HydrophobicContact CD2-CB 3.94Å
75	V	97.9	Very high	94	Very high	4 Å²	4	74.6 Å²	74.6	2%	0.024	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	136.4	-175.4	-167.1	0	0	0	0	110.7	D83 K84 Y108 R109	V75-D83 HydrophobicContact CG1-CB 3.61Å; V75-D83 WeakPolarHBondContact CG1-OD2 3.38Å; V75-K84 CarbonylContact C-O 3.31Å; V75-K84 VanDerWaalsContact CA-O 3.26Å; V75-K84 WeakPolarHBondContact CA-O 3.48Å; V75-Y108 CarbonylContact O-C 3.51Å; V75-Y108 VanDerWaalsContact O-CA 3.28Å; V75-Y108 WeakPolarHBondContact O-CA 3.49Å; V75-R109 HydrophobicContact CB-CG 3.55Å; V75-R109 HydrophobicContact CG1-CG 4.42Å; V75-R109 HydrophobicContact CG2-CG 4.03Å; V75-R109 PolarHBondContact N-O 3.09Å; V75-R109 PolarHBondContact O-N 2.78Å
76	Q	97.4	Very high	94.1	Very high	19 Å²	19	72.1 Å²	72.1	9%	0.089	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	122	159	-175.6	-172.3	4.6	0	0	107.3	I78 D83 K84 L96 A98 S106 N107 Y108	Q76-I78 HydrophobicContact CG-CG1 4.44Å; Q76-D83 WeakPolarHBondContact O-CA 3.47Å; Q76-K84 HydrophobicContact CB-CB 4.44Å; Q76-K84 PolarHBondContact N-O 2.9Å; Q76-K84 PolarHBondContact O-N 2.81Å; Q76-L96 HydrophobicContact CB-CD2 3.91Å; Q76-A98 HydrophobicContact CB-CB 4.01Å; Q76-S106 PolarHBondContact NE2-OG 3.38Å; Q76-N107 WeakPolarHBondContact CA-O 3.12Å; Q76-Y108 HydrophobicContact CB-CD1 3.85Å; Q76-Y108 HydrophobicContact CB-CE1 3.61Å; Q76-Y108 HydrophobicContact CG-CD1 4.13Å; Q76-Y108 HydrophobicContact CG-CE1 3.65Å
77	D	94	Very high	94.3	Very high	75 Å²	75	73.9 Å²	73.9	40%	0.401	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	122.3	173.5	-174.1	-17.6	0	0	0	108.7	D83 N107	D77-D83 WeakPolarHBondContact CA-OD1 3.12Å; D77-N107 HydrophobicContact CB-CB 4.02Å; D77-N107 PolarHBondContact N-O 2.88Å
78	I	90.8	Very high	94.4	Very high	58 Å²	58	67.2 Å²	67.2	30%	0.297	34%	0.341	S	S	.	.			trans	-112.4	107.1	178.1	-60	-173.1	0	0	0	108.1	Q76 M80 G81 D83 K84	Q76-I78 HydrophobicContact CG-CG1 4.44Å; I78-M80 PolarHBondContact O-N 2.98Å; I78-G81 PolarHBondContact O-N 3.36Å; I78-D83 PolarHBondContact N-OD1 3.19Å; I78-K84 HydrophobicContact CD1-CG 3.76Å
79	E	85.1	Confident	94.3	Very high	161 Å²	161	67.8 Å²	67.8	75%	0.752	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.5	130.3	177.2	-169.9	176.7	-179.3	0	0	110.6	G81	E79-G81 PolarHBondContact O-N 3.4Å; E79-G81 VanDerWaalsContact O-N 3.09Å
80	M	83.2	Confident	94.1	Very high	187 Å²	187	71 Å²	71	92%	0.921	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.2	14.6	-176.2	-59.3	172.2	-76.3	0	0	115	I78	I78-M80 PolarHBondContact O-N 2.98Å
81	G	84.3	Confident	93.9	Very high	42 Å²	42	72 Å²	72	43%	0.433	38%	0.382	S	S	.	.	S	Bend	trans	-126.5	-171.2	-178.2	0	0	0	0	0	113.9	I78 E79	I78-G81 PolarHBondContact O-N 3.36Å; E79-G81 PolarHBondContact O-N 3.4Å; E79-G81 VanDerWaalsContact O-N 3.09Å
82	F	89.3	Confident	93.8	Very high	190 Å²	190	73.4 Å²	73.4	83%	0.833	39%	0.392	S	S	*	.	P	Polyproline II helix	trans	-92.3	121.9	167.2	-66.9	-77.4	0	0	0	109.1
83	D	93.9	Very high	93.8	Very high	57 Å²	57	78.7 Å²	78.7	31%	0.305	42%	0.418	S	S	.	.	P	Polyproline II helix	trans	-47.3	140.1	170.4	-76.3	7.9	0	0	0	111.8	V75 Q76 D77 I78 R109	V75-D83 HydrophobicContact CG1-CB 3.61Å; V75-D83 WeakPolarHBondContact CG1-OD2 3.38Å; Q76-D83 WeakPolarHBondContact O-CA 3.47Å; D77-D83 WeakPolarHBondContact CA-OD1 3.12Å; I78-D83 PolarHBondContact N-OD1 3.19Å; D83-R109 IonicContact OD2-CZ 3.64Å; D83-R109 IonicContact OD2-NE 3.98Å; D83-R109 IonicContact OD2-NH2 2.72Å; D83-R109 PolarHBondContact OD2-NH2 2.81Å
84	K	96	Very high	93.7	Very high	113 Å²	113	78.9 Å²	78.9	49%	0.491	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	125.5	168	-63.4	-62.2	-177.5	-171.6	0	108	V75 Q76 I78 L96 A98	V75-K84 CarbonylContact C-O 3.31Å; V75-K84 VanDerWaalsContact CA-O 3.26Å; V75-K84 WeakPolarHBondContact CA-O 3.48Å; Q76-K84 HydrophobicContact CB-CB 4.44Å; Q76-K84 PolarHBondContact N-O 2.9Å; Q76-K84 PolarHBondContact O-N 2.81Å; I78-K84 HydrophobicContact CD1-CG 3.76Å; K84-L96 HydrophobicContact CB-CD1 4.46Å; K84-A98 HydrophobicContact CB-CB 3.71Å; K84-A98 HydrophobicContact CG-CB 4.05Å
85	S	97	Very high	93.7	Very high	76 Å²	76	82.1 Å²	82.1	53%	0.531	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	158.5	178.5	64	0	0	0	0	113.7	L74	L74-S85 CarbonylContact O-C 3.57Å; L74-S85 WeakPolarHBondContact O-CA 3.2Å; L74-S85 WeakPolarHBondContact O-CB 3.42Å
86	V	97.8	Very high	93.7	Very high	51 Å²	51	82.1 Å²	82.1	31%	0.309	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	138.5	168.9	63.8	0	0	0	0	109.2	S73 L74 L96	S73-V86 WeakPolarHBondContact CA-O 3.41Å; L74-V86 HydrophobicContact CB-CG1 3.86Å; L74-V86 HydrophobicContact CD1-CG1 4.17Å; L74-V86 HydrophobicContact CG-CG1 4.49Å; L74-V86 PolarHBondContact N-O 2.8Å; L74-V86 PolarHBondContact O-N 2.9Å; V86-L96 HydrophobicContact CB-CD1 4.45Å; V86-L96 HydrophobicContact CG1-CB 4.32Å; V86-L96 HydrophobicContact CG1-CD1 4.01Å
87	E	97.6	Very high	93.6	Very high	106 Å²	106	89.5 Å²	89.5	50%	0.495	47%	0.47	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	134.3	175.1	-61.4	-175.9	159.8	0	0	110.1	Y71	Y71-E87 HydrophobicContact CD2-CB 3.93Å; Y71-E87 HydrophobicContact CD2-CG 3.77Å; Y71-E87 HydrophobicContact CE2-CB 4.32Å; Y71-E87 VanDerWaalsContact CE2-CD 3.46Å; Y71-E87 HydrophobicContact CE2-CG 3.64Å; Y71-E87 WeakPolarHBondContact CE2-OE1 3.11Å; Y71-E87 HydrophobicContact CG-CB 4.32Å; Y71-E87 HydrophobicContact CG-CG 4.48Å; Y71-E87 PolarHBondContact OH-OE1 3.24Å
88	V	97.4	Very high	93.6	Very high	21 Å²	21	86.4 Å²	86.4	13%	0.127	46%	0.455	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	104.3	178.1	-176.6	0	0	0	0	107.8	W61 Y71 V72 L74 N90	W61-V88 HydrophobicContact CH2-CB 4.03Å; W61-V88 HydrophobicContact CH2-CG1 3.96Å; W61-V88 HydrophobicContact CH2-CG2 4.04Å; W61-V88 HydrophobicContact CZ2-CB 4.26Å; W61-V88 HydrophobicContact CZ2-CG1 4.12Å; Y71-V88 WeakPolarHBondContact CA-O 3.27Å; Y71-V88 WeakPolarHBondContact CB-O 3.46Å; V72-V88 PolarHBondContact N-O 2.8Å; V72-V88 PolarHBondContact O-N 2.84Å; L74-V88 HydrophobicContact CD1-CG2 4.33Å; V88-N90 WeakPolarHBondContact CG1-O 3.4Å
89	E	94.4	Very high	93.6	Very high	126 Å²	126	84.7 Å²	84.7	59%	0.589	45%	0.446	S	S	*	.			trans	-76.9	-26.2	-175.2	-62.5	-177.4	171.2	0	0	113.1	F69	F69-E89 WeakPolarHBondContact CE1-O 3.2Å
90	N	91	Very high	93.9	Very high	140 Å²	140	77.4 Å²	77.4	75%	0.749	41%	0.414	S	S	*	.	S	Bend	trans	-141.3	138.9	-176	-70.4	-63	0	0	0	111.7	V88	V88-N90 WeakPolarHBondContact CG1-O 3.4Å
91	G	93	Very high	94.3	Very high	50 Å²	50	74.2 Å²	74.2	52%	0.515	40%	0.397	S	S	.	.	S	Bend	trans	91.2	-177.4	177.4	0	0	0	0	0	113.9
92	N	96.2	Very high	94.7	Very high	55 Å²	55	73.3 Å²	73.3	29%	0.294	38%	0.383	S	S	.	.	S	Bend	trans	-119.7	17	-172.9	-60.1	-30.7	0	0	0	112.4	E60 W61 Q63	E60-N92 CarbonylContact C-O 3.56Å; E60-N92 VanDerWaalsContact CA-O 3.3Å; E60-N92 WeakPolarHBondContact CA-O 3.27Å; E60-N92 WeakPolarHBondContact CG-O 2.95Å; W61-N92 PolarHBondContact N-O 2.67Å; W61-N92 WeakPolarHBondContact O-CB 3.22Å; Q63-N92 WeakPolarHBondContact CA-OD1 3.15Å
93	M	96.8	Very high	94.9	Very high	111 Å²	111	65.9 Å²	65.9	55%	0.547	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	146.9	-179.7	-72.9	179.8	-88.9	0	0	109.6	I50 F59 E60 W61	I50-M93 HydrophobicContact CD1-CG 4.25Å; I50-M93 HydrophobicContact CD1-SD 3.97Å; F59-M93 WeakPolarHBondContact O-CA 3.36Å; E60-M93 HydrophobicContact CB-CG 3.93Å; E60-M93 HydrophobicContact CG-CG 3.89Å; W61-M93 VanDerWaalsContact CZ3-C 3.48Å
94	G	96.9	Very high	94.9	Very high	14 Å²	14	69 Å²	69	14%	0.144	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161	160.6	-178.8	0	0	0	0	0	112.5	A58 F59	A58-G94 WeakPolarHBondContact CA-O 3.37Å; F59-G94 PolarHBondContact N-O 3.1Å; F59-G94 PolarHBondContact O-N 3.15Å
95	L	97.4	Very high	94.9	Very high	68 Å²	68	67.8 Å²	67.8	36%	0.356	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	114.1	-177.9	-175.1	78	0	0	0	109.6	A56 A58	A56-L95 HydrophobicContact CB-CD1 3.68Å; A56-L95 HydrophobicContact CB-CD2 4.15Å; A56-L95 HydrophobicContact CB-CG 3.83Å; A58-L95 HydrophobicContact CB-CD1 3.94Å
96	L	97.6	Very high	94.8	Very high	4 Å²	4	64.9 Å²	64.9	2%	0.021	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	125.1	173.9	178.8	64.8	0	0	0	109.3	A56 L57 F59 L74 Q76 K84 V86 A98 Y108	A56-L96 CarbonylContact C-O 3.57Å; A56-L96 WeakPolarHBondContact CA-O 3.4Å; A56-L96 WeakPolarHBondContact CB-O 3.43Å; L57-L96 PolarHBondContact N-O 3.09Å; L57-L96 PolarHBondContact O-N 3.34Å; F59-L96 HydrophobicContact CD2-CB 4.34Å; F59-L96 HydrophobicContact CE2-CB 3.88Å; F59-L96 HydrophobicContact CE2-CD2 4.33Å; L74-L96 HydrophobicContact CB-CB 4.43Å; Q76-L96 HydrophobicContact CB-CD2 3.91Å; K84-L96 HydrophobicContact CB-CD1 4.46Å; V86-L96 HydrophobicContact CB-CD1 4.45Å; V86-L96 HydrophobicContact CG1-CB 4.32Å; V86-L96 HydrophobicContact CG1-CD1 4.01Å; L96-A98 HydrophobicContact CD1-CB 4.41Å; L96-A98 HydrophobicContact CD2-CB 4.07Å; L96-A98 HydrophobicContact CG-CB 3.82Å; L96-A98 PolarHBondContact O-N 2.76Å; L96-Y108 HydrophobicContact CD2-CD1 3.91Å; L96-Y108 HydrophobicContact CD2-CE1 4Å
97	K	96.3	Very high	94.8	Very high	175 Å²	175	66.2 Å²	66.2	76%	0.761	36%	0.355	S	S	*	.	S	Bend	trans	-78.5	57.4	177.1	-66.3	-174.9	178.9	-179.7	0	112	A55 A56	A55-K97 CarbonylContact O-C 3.56Å; A55-K97 VanDerWaalsContact O-C 3.31Å; A55-K97 WeakPolarHBondContact O-CA 3.19Å; A56-K97 HydrophobicContact CB-CG 4.34Å
98	A	93.2	Very high	94.8	Very high	9 Å²	9	61.3 Å²	61.3	7%	0.074	33%	0.332	C	S	.	.			trans	-158.5	127.4	-177.2	0	0	0	0	0	108.5	Q76 K84 L96	Q76-A98 HydrophobicContact CB-CB 4.01Å; K84-A98 HydrophobicContact CB-CB 3.71Å; K84-A98 HydrophobicContact CG-CB 4.05Å; L96-A98 HydrophobicContact CD1-CB 4.41Å; L96-A98 HydrophobicContact CD2-CB 4.07Å; L96-A98 HydrophobicContact CG-CB 3.82Å; L96-A98 PolarHBondContact O-N 2.76Å
99	I	90.7	Very high	94.8	Very high	23 Å²	23	63.7 Å²	63.7	12%	0.118	34%	0.338	C	S	.	.			trans	-129.1	-0.3	-167.9	64.7	173.1	0	0	0	115.3	T54 L57 Y108 R131	T54-I99 WeakPolarHBondContact O-CD1 2.94Å; L57-I99 HydrophobicContact CD2-CG2 4.43Å; L57-I99 HydrophobicContact CG-CB 4.32Å; L57-I99 HydrophobicContact CG-CG2 4.02Å; I99-Y108 WeakPolarHBondContact CA-OH 3.21Å; I99-Y108 PolarHBondContact O-OH 2.74Å; I99-R131 PolarHBondContact O-NE 2.74Å
100	G	91.4	Very high	95	Very high	8 Å²	8	57.7 Å²	57.7	8%	0.082	31%	0.31	C	S	.	.			trans	67.9	162.2	-175.2	0	0	0	0	0	114.6	S106 Y108 R131	G100-S106 WeakPolarHBondContact CA-OG 3.16Å; G100-Y108 PolarHBondContact N-OH 2.8Å; G100-Y108 VanDerWaalsContact N-OH 3.16Å; G100-R131 PolarHBondContact O-NE 3.04Å; G100-R131 PolarHBondContact O-NH2 2.83Å
101	E	92.1	Very high	95.3	Very high	120 Å²	120	51.6 Å²	51.6	56%	0.561	28%	0.277	S	S	*	.			trans	-76	148.1	173.7	-67.7	-54.6	140.1	0	0	111.2	E104	E101-E104 HydrophobicContact CB-CB 4.17Å; E101-E104 HydrophobicContact CB-CG 4.22Å; E101-E104 PolarHBondContact O-N 2.75Å
102	P	92.8	Very high	95.5	Very high	22 Å²	22	49.2 Å²	49.2	14%	0.143	25%	0.253	C	S	.	.	B	Isolated β-bridge	trans	-64.1	144.1	176.3	30	-34.9	0	0	0	110.4	E104 P133 E155	P102-E104 PolarHBondContact O-N 2.9Å; P102-P133 HydrophobicContact CB-CB 4.1Å; P102-P133 HydrophobicContact CB-CG 3.97Å; P102-E155 HydrophobicContact CG-CG 4.32Å
103	C	94.1	Very high	95.6	Very high	35 Å²	35	48.9 Å²	48.9	24%	0.236	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	63.7	0.8	-177	-53.7	0	0	0	0	116.4	K130 R131 P133 C159	C103-K130 WeakPolarHBondContact O-CE 3.03Å; C103-R131 PolarHBondContact N-O 3.47Å; C103-P133 WeakPolarHBondContact SG-CD 3.02Å; C103-P133 WeakPolarHBondContact SG-CG 3.19Å; C103-C159 WeakPolarHBondContact CA-SG 3.46Å; C103-C159 HydrophobicContact CB-CB 3.69Å; C103-C159 WeakPolarHBondContact CB-SG 3.41Å; C103-C159 WeakPolarHBondContact SG-CA 3.41Å; C103-C159 WeakPolarHBondContact SG-CB 3.31Å; C103-C159 PolarHBondContact SG-N 2.83Å; C103-C159 VanDerWaalsContact SG-N 3.38Å; C103-C159 CovalentContact SG-SG 2.04Å; C103-C159 PolarHBondContact SG-SG 2.77Å
104	E	93.9	Very high	95.6	Very high	121 Å²	121	46 Å²	46	57%	0.565	23%	0.231	S	C	*	.	S	Bend	trans	-106.2	143.3	175.6	-63.6	-172.6	177.6	0	0	111	E101 P102 S106 K130	E101-E104 HydrophobicContact CB-CB 4.17Å; E101-E104 HydrophobicContact CB-CG 4.22Å; E101-E104 PolarHBondContact O-N 2.75Å; P102-E104 PolarHBondContact O-N 2.9Å; E104-S106 PolarHBondContact O-N 3.07Å; E104-K130 WeakPolarHBondContact O-CA 3.48Å
105	V	94.5	Very high	95.4	Very high	89 Å²	89	52 Å²	52	54%	0.539	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	117.9	176.3	-179.6	0	0	0	0	108.2	T128 K130	V105-T128 HydrophobicContact CG1-CG2 4.14Å; V105-K130 HydrophobicContact CG2-CB 4.2Å; V105-K130 HydrophobicContact CG2-CD 4.32Å; V105-K130 HydrophobicContact CG2-CG 4.43Å
106	S	95.7	Very high	94.9	Very high	15 Å²	15	55.5 Å²	55.5	11%	0.105	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	138.1	173.4	-70	0	0	0	0	111	Q76 G100 E104 Y108 T128 Y129	Q76-S106 PolarHBondContact NE2-OG 3.38Å; G100-S106 WeakPolarHBondContact CA-OG 3.16Å; E104-S106 PolarHBondContact O-N 3.07Å; S106-Y108 VanDerWaalsContact CB-CE2 3.46Å; S106-Y108 WeakPolarHBondContact O-CD2 3.38Å; S106-T128 CarbonylContact O-C 3.5Å; S106-T128 WeakPolarHBondContact O-CA 3.27Å; S106-Y129 PolarHBondContact N-O 3.38Å; S106-Y129 PolarHBondContact O-N 2.04Å
107	N	96.9	Very high	94.4	Very high	79 Å²	79	65.1 Å²	65.1	42%	0.422	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	133	178.8	-62.9	-54.8	0	0	0	110.3	Q76 D77 T128	Q76-N107 WeakPolarHBondContact CA-O 3.12Å; D77-N107 HydrophobicContact CB-CB 4.02Å; D77-N107 PolarHBondContact N-O 2.88Å; N107-T128 VanDerWaalsContact OD1-CG2 3.29Å; N107-T128 WeakPolarHBondContact OD1-CG2 3.44Å
108	Y	98	Very high	94.2	Very high	3 Å²	3	61.8 Å²	61.8	1%	0.012	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	148.5	178.5	-64	-89.2	0	0	0	110.5	L57 F59 V75 Q76 L96 I99 G100 S106 M127	L57-Y108 HydrophobicContact CD1-CE1 3.95Å; L57-Y108 HydrophobicContact CD1-CE2 4.03Å; L57-Y108 WeakPolarHBondContact CD1-OH 3.34Å; F59-Y108 HydrophobicContact CE1-CD1 4.16Å; F59-Y108 HydrophobicContact CE1-CG 4.07Å; F59-Y108 HydrophobicContact CE2-CD1 4.3Å; F59-Y108 AromaticContact CZ-CD1 3.47Å; F59-Y108 HydrophobicContact CZ-CD1 3.47Å; F59-Y108 VanDerWaalsContact CZ-CD1 3.47Å; F59-Y108 AromaticContact CZ-CE1 3.84Å; F59-Y108 HydrophobicContact CZ-CE1 3.84Å; F59-Y108 AromaticContact CZ-CG 3.85Å; F59-Y108 HydrophobicContact CZ-CG 3.85Å; V75-Y108 CarbonylContact O-C 3.51Å; V75-Y108 VanDerWaalsContact O-CA 3.28Å; V75-Y108 WeakPolarHBondContact O-CA 3.49Å; Q76-Y108 HydrophobicContact CB-CD1 3.85Å; Q76-Y108 HydrophobicContact CB-CE1 3.61Å; Q76-Y108 HydrophobicContact CG-CD1 4.13Å; Q76-Y108 HydrophobicContact CG-CE1 3.65Å; L96-Y108 HydrophobicContact CD2-CD1 3.91Å; L96-Y108 HydrophobicContact CD2-CE1 4Å; I99-Y108 WeakPolarHBondContact CA-OH 3.21Å; I99-Y108 PolarHBondContact O-OH 2.74Å; G100-Y108 PolarHBondContact N-OH 2.8Å; G100-Y108 VanDerWaalsContact N-OH 3.16Å; S106-Y108 VanDerWaalsContact CB-CE2 3.46Å; S106-Y108 WeakPolarHBondContact O-CD2 3.38Å; Y108-M127 PolarHBondContact N-O 3.09Å; Y108-M127 PolarHBondContact O-N 2.97Å; Y108-M127 VanDerWaalsContact O-O 3.08Å
109	R	97.7	Very high	94.2	Very high	70 Å²	70	64.5 Å²	64.5	26%	0.264	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	146	176.5	58.4	-171.2	177	155.1	2.7	112	L74 V75 D83 E111 T124 Y125 L126	L74-R109 WeakPolarHBondContact CA-O 3.38Å; V75-R109 HydrophobicContact CB-CG 3.55Å; V75-R109 HydrophobicContact CG1-CG 4.42Å; V75-R109 HydrophobicContact CG2-CG 4.03Å; V75-R109 PolarHBondContact N-O 3.09Å; V75-R109 PolarHBondContact O-N 2.78Å; D83-R109 IonicContact OD2-CZ 3.64Å; D83-R109 IonicContact OD2-NE 3.98Å; D83-R109 IonicContact OD2-NH2 2.72Å; D83-R109 PolarHBondContact OD2-NH2 2.81Å; R109-E111 HydrophobicContact CB-CG 4.47Å; R109-E111 VanDerWaalsContact CD-OE1 3.29Å; R109-E111 WeakPolarHBondContact CD-OE1 3.35Å; R109-E111 HydrophobicContact CG-CG 4.22Å; R109-E111 IonicContact CZ-OE1 3.19Å; R109-E111 IonicContact NE-OE1 3.45Å; R109-E111 PolarHBondContact NE-OE1 3.03Å; R109-E111 IonicContact NH1-OE1 2.63Å; R109-E111 PolarHBondContact NH1-OE1 3.38Å; R109-T124 HydrophobicContact CB-CG2 4.3Å; R109-Y125 CarbonylContact C-O 3.55Å; R109-Y125 WeakPolarHBondContact CA-O 3.17Å; R109-L126 HydrophobicContact CB-CD2 3.81Å
110	A	98.3	Very high	94.5	Very high	0 Å²	0	69.7 Å²	69.7	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	122.4	164	0	0	0	0	0	107.7	F47 W61 M64 V72 S73 L74 T124 Y125	F47-A110 HydrophobicContact CD2-CB 3.95Å; F47-A110 HydrophobicContact CE1-CB 4.42Å; F47-A110 HydrophobicContact CE2-CB 3.74Å; F47-A110 HydrophobicContact CG-CB 4.36Å; F47-A110 HydrophobicContact CZ-CB 4.02Å; W61-A110 HydrophobicContact CB-CB 4.48Å; M64-A110 HydrophobicContact CE-CB 3.85Å; M64-A110 WeakPolarHBondContact CE-O 3.34Å; V72-A110 HydrophobicContact CG1-CB 4.06Å; S73-A110 CarbonylContact O-C 3.52Å; S73-A110 WeakPolarHBondContact O-CA 3.22Å; L74-A110 HydrophobicContact CD2-CB 3.94Å; A110-T124 CarbonylContact O-C 3.57Å; A110-T124 WeakPolarHBondContact O-CA 3.4Å; A110-Y125 PolarHBondContact N-O 3.11Å; A110-Y125 PolarHBondContact O-N 2.83Å
111	E	98.1	Very high	94.7	Very high	13 Å²	13	72.3 Å²	72.3	6%	0.061	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	115.6	-173.7	-69.9	-170.6	162.1	0	0	111	V72 S73 R109 Y113 N121 Q123 T124	V72-E111 CarbonylContact C-O 3.59Å; V72-E111 VanDerWaalsContact CA-O 3.23Å; V72-E111 WeakPolarHBondContact CA-O 3.46Å; S73-E111 PolarHBondContact N-O 2.91Å; S73-E111 PolarHBondContact O-N 2.88Å; R109-E111 HydrophobicContact CB-CG 4.47Å; R109-E111 VanDerWaalsContact CD-OE1 3.29Å; R109-E111 WeakPolarHBondContact CD-OE1 3.35Å; R109-E111 HydrophobicContact CG-CG 4.22Å; R109-E111 IonicContact CZ-OE1 3.19Å; R109-E111 IonicContact NE-OE1 3.45Å; R109-E111 PolarHBondContact NE-OE1 3.03Å; R109-E111 IonicContact NH1-OE1 2.63Å; R109-E111 PolarHBondContact NH1-OE1 3.38Å; E111-Y113 HydrophobicContact CB-CD2 4.18Å; E111-Y113 HydrophobicContact CB-CE2 3.51Å; E111-Y113 WeakPolarHBondContact O-CD2 2.99Å; E111-Y113 WeakPolarHBondContact OE2-CE2 3.44Å; E111-Y113 PolarHBondContact OE2-OH 3.46Å; E111-N121 WeakPolarHBondContact CB-ND2 3.4Å; E111-Q123 CarbonylContact C-O 3.43Å; E111-Q123 WeakPolarHBondContact CA-O 3.22Å; E111-T124 HydrophobicContact CG-CG2 4Å
112	G	98.2	Very high	95	Very high	0 Å²	0	69.1 Å²	69.1	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	126.2	174	0	0	0	0	0	110.9	M64 N121 F122 Q123	M64-G112 WeakPolarHBondContact SD-CA 3.26Å; M64-G112 PolarHBondContact SD-N 3.16Å; G112-N121 CarbonylContact O-C 3.58Å; G112-N121 WeakPolarHBondContact O-CA 3.3Å; G112-F122 WeakPolarHBondContact O-CD1 3.43Å; G112-F122 WeakPolarHBondContact O-CE1 3.45Å; G112-F122 PolarHBondContact O-N 2.75Å; G112-Q123 PolarHBondContact N-O 3.43Å
113	Y	98.1	Very high	95.2	Very high	47 Å²	47	71.1 Å²	71.1	18%	0.184	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	139.8	174.8	-74.2	-93.2	0	0	0	111.6	S70 Y71 E111 N119 R120 N121	S70-Y113 WeakPolarHBondContact CA-O 3.34Å; S70-Y113 VanDerWaalsContact CB-O 3.28Å; S70-Y113 WeakPolarHBondContact CB-O 3.3Å; S70-Y113 PolarHBondContact N-O 3.36Å; Y71-Y113 HydrophobicContact CD2-CD2 4.15Å; Y71-Y113 AromaticContact CE2-CD2 3.62Å; Y71-Y113 HydrophobicContact CE2-CD2 3.62Å; Y71-Y113 HydrophobicContact CE2-CE2 4.34Å; Y71-Y113 AromaticContact CE2-CG 3.91Å; Y71-Y113 HydrophobicContact CE2-CG 3.91Å; Y71-Y113 PolarHBondContact N-O 2.86Å; Y71-Y113 PolarHBondContact O-N 2.89Å; E111-Y113 HydrophobicContact CB-CD2 4.18Å; E111-Y113 HydrophobicContact CB-CE2 3.51Å; E111-Y113 WeakPolarHBondContact O-CD2 2.99Å; E111-Y113 WeakPolarHBondContact OE2-CE2 3.44Å; E111-Y113 PolarHBondContact OE2-OH 3.46Å; Y113-N119 HydrophobicContact CD1-CB 4.06Å; Y113-R120 WeakPolarHBondContact CA-O 3.38Å; Y113-R120 VanDerWaalsContact CD1-C 3.41Å; Y113-N121 HydrophobicContact CD1-CB 4.31Å; Y113-N121 HydrophobicContact CE1-CB 3.81Å
114	Y	96.4	Very high	95.4	Very high	52 Å²	52	72.2 Å²	72.2	20%	0.204	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	150.3	169.1	72	-89.2	0	0	0	110.9	H66 Y68 N119 R120 F122	H66-Y114 AromaticContact CE1-CD1 3.82Å; H66-Y114 AromaticContact CE1-CD2 3.59Å; H66-Y114 AromaticContact CE1-CG 3.39Å; H66-Y114 WeakPolarHBondContact ND1-CB 3.1Å; H66-Y114 AromaticContact ND1-CG 3.56Å; H66-Y114 AromaticContact NE2-CD1 3.95Å; H66-Y114 AromaticContact NE2-CG 3.99Å; Y68-Y114 CarbonylContact O-C 3.45Å; Y68-Y114 WeakPolarHBondContact O-CA 3.49Å; Y68-Y114 WeakPolarHBondContact O-CB 3.26Å; Y114-N119 WeakPolarHBondContact O-CA 3.47Å; Y114-R120 HydrophobicContact CD1-CB 4.18Å; Y114-R120 WeakPolarHBondContact CD1-O 3.49Å; Y114-R120 HydrophobicContact CE1-CB 3.56Å; Y114-R120 HydrophobicContact CE2-CB 4.19Å; Y114-R120 PolarHBondContact N-O 2.89Å; Y114-R120 PolarHBondContact O-N 3.01Å; Y114-R120 VanDerWaalsContact OH-CD 3.3Å; Y114-R120 WeakPolarHBondContact OH-CD 3.19Å; Y114-F122 HydrophobicContact CD1-CB 3.71Å; Y114-F122 AromaticContact CD1-CD1 3.82Å; Y114-F122 HydrophobicContact CD1-CD1 3.82Å; Y114-F122 HydrophobicContact CD1-CG 4.13Å; Y114-F122 HydrophobicContact CE1-CB 3.95Å
115	K	93.2	Very high	95.6	Very high	139 Å²	139	67.5 Å²	67.5	60%	0.604	31%	0.307	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99	116.2	-177.4	-174.7	169.3	-176.7	174.4	0	110.8	Y68	Y68-K115 WeakPolarHBondContact CB-O 3.46Å; Y68-K115 PolarHBondContact O-N 2.7Å
116	Y	85.6	Confident	95.7	Very high	142 Å²	142	68.7 Å²	68.7	56%	0.557	31%	0.31	S	S	*	.	S	Bend	trans	-120	-116.6	164.1	-162.3	-122.3	0	0	0	108.2
117	Y	88.3	Confident	95.7	Very high	205 Å²	205	68.5 Å²	68.5	80%	0.804	31%	0.308	S	S	*	.	S	Bend	trans	-75.4	-33.8	168.1	-64.9	-67.9	0	0	0	113.3
118	I	90.9	Very high	95.6	Very high	106 Å²	106	67.9 Å²	67.9	54%	0.544	31%	0.307	S	S	.	.	S	Bend	trans	-134.5	155	173.9	57.8	173	0	0	0	107.5	R120	I118-R120 HydrophobicContact CG1-CG 4.23Å; I118-R120 PolarHBondContact O-N 2.87Å
119	N	93.9	Very high	95.4	Very high	66 Å²	66	68.4 Å²	68.4	35%	0.353	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	131.3	172.9	-64.2	-32.9	0	0	0	109.1	Y71 Y113 Y114	Y71-N119 HydrophobicContact CE1-CB 4.42Å; Y71-N119 WeakPolarHBondContact CE1-ND2 3.33Å; Y71-N119 PolarHBondContact OH-ND2 2.89Å; Y113-N119 HydrophobicContact CD1-CB 4.06Å; Y114-N119 WeakPolarHBondContact O-CA 3.47Å
120	R	96.2	Very high	95.2	Very high	132 Å²	132	67 Å²	67	50%	0.498	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	134.7	176.9	-71.5	-178	177.6	-108.5	1	109.7	Y113 Y114 I118	Y113-R120 WeakPolarHBondContact CA-O 3.38Å; Y113-R120 VanDerWaalsContact CD1-C 3.41Å; Y114-R120 HydrophobicContact CD1-CB 4.18Å; Y114-R120 WeakPolarHBondContact CD1-O 3.49Å; Y114-R120 HydrophobicContact CE1-CB 3.56Å; Y114-R120 HydrophobicContact CE2-CB 4.19Å; Y114-R120 PolarHBondContact N-O 2.89Å; Y114-R120 PolarHBondContact O-N 3.01Å; Y114-R120 VanDerWaalsContact OH-CD 3.3Å; Y114-R120 WeakPolarHBondContact OH-CD 3.19Å; I118-R120 HydrophobicContact CG1-CG 4.23Å; I118-R120 PolarHBondContact O-N 2.87Å
121	N	96.7	Very high	95	Very high	63 Å²	63	67.4 Å²	67.4	34%	0.337	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.4	133.8	170.9	-178	-75	0	0	0	109	E111 G112 Y113 Q123 T124	E111-N121 WeakPolarHBondContact CB-ND2 3.4Å; G112-N121 CarbonylContact O-C 3.58Å; G112-N121 WeakPolarHBondContact O-CA 3.3Å; Y113-N121 HydrophobicContact CD1-CB 4.31Å; Y113-N121 HydrophobicContact CE1-CB 3.81Å; N121-Q123 PolarHBondContact OD1-N 2.89Å; N121-T124 PolarHBondContact ND2-OG1 2.87Å; N121-T124 PolarHBondContact OD1-OG1 3.22Å
122	F	97.1	Very high	94.7	Very high	53 Å²	53	67 Å²	67	23%	0.232	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	-19	173.1	67.2	-87	0	0	0	113.7	M64 H66 F69 G112 Y114	M64-F122 HydrophobicContact CB-CE2 3.98Å; M64-F122 HydrophobicContact CB-CZ 3.79Å; H66-F122 HydrophobicContact CB-CD1 4.21Å; H66-F122 HydrophobicContact CB-CD2 4.15Å; H66-F122 HydrophobicContact CB-CE1 3.94Å; H66-F122 HydrophobicContact CB-CE2 3.92Å; H66-F122 HydrophobicContact CB-CG 4.3Å; H66-F122 HydrophobicContact CB-CZ 3.81Å; F69-F122 HydrophobicContact CD2-CE1 4.18Å; F69-F122 HydrophobicContact CD2-CZ 4.05Å; G112-F122 WeakPolarHBondContact O-CD1 3.43Å; G112-F122 WeakPolarHBondContact O-CE1 3.45Å; G112-F122 PolarHBondContact O-N 2.75Å; Y114-F122 HydrophobicContact CD1-CB 3.71Å; Y114-F122 AromaticContact CD1-CD1 3.82Å; Y114-F122 HydrophobicContact CD1-CD1 3.82Å; Y114-F122 HydrophobicContact CD1-CG 4.13Å; Y114-F122 HydrophobicContact CE1-CB 3.95Å
123	Q	97.4	Very high	94.5	Very high	64 Å²	64	67.1 Å²	67.1	30%	0.299	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.6	139.8	-177.8	-173.8	160.7	29.6	0	0	109.2	M64 E111 G112 N121 Y125	M64-Q123 HydrophobicContact CG-CG 4.35Å; M64-Q123 HydrophobicContact SD-CB 4.32Å; M64-Q123 HydrophobicContact SD-CG 4.4Å; E111-Q123 CarbonylContact C-O 3.43Å; E111-Q123 WeakPolarHBondContact CA-O 3.22Å; G112-Q123 PolarHBondContact N-O 3.43Å; N121-Q123 PolarHBondContact OD1-N 2.89Å; Q123-Y125 VanDerWaalsContact CD-OH 3.32Å; Q123-Y125 HydrophobicContact CG-CD1 4.44Å; Q123-Y125 HydrophobicContact CG-CE1 3.82Å; Q123-Y125 PolarHBondContact NE2-OH 3.44Å
124	T	97.9	Very high	94.2	Very high	57 Å²	57	65.1 Å²	65.1	35%	0.35	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	131.2	177	-60	0	0	0	0	108.8	R109 A110 E111 N121 L126	R109-T124 HydrophobicContact CB-CG2 4.3Å; A110-T124 CarbonylContact O-C 3.57Å; A110-T124 WeakPolarHBondContact O-CA 3.4Å; E111-T124 HydrophobicContact CG-CG2 4Å; N121-T124 PolarHBondContact ND2-OG1 2.87Å; N121-T124 PolarHBondContact OD1-OG1 3.22Å; T124-L126 HydrophobicContact CG2-CD2 3.86Å; T124-L126 HydrophobicContact CG2-CG 4.28Å
125	Y	98	Very high	94	Very high	22 Å²	22	62.9 Å²	62.9	9%	0.086	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	139.2	165.7	-55.6	-35.6	0	0	0	109.2	T46 F47 W61 K62 M64 R109 A110 Q123	T46-Y125 HydrophobicContact CG2-CE1 4.13Å; T46-Y125 WeakPolarHBondContact O-CD2 3.23Å; F47-Y125 HydrophobicContact CB-CD2 4.37Å; F47-Y125 HydrophobicContact CB-CG 4.42Å; W61-Y125 HydrophobicContact CB-CD2 3.99Å; W61-Y125 HydrophobicContact CB-CE2 4.2Å; K62-Y125 HydrophobicContact CB-CE2 4.13Å; K62-Y125 WeakPolarHBondContact O-CE2 3.43Å; M64-Y125 HydrophobicContact CE-CD2 3.29Å; M64-Y125 HydrophobicContact CE-CE2 3.39Å; M64-Y125 HydrophobicContact CE-CG 3.92Å; M64-Y125 HydrophobicContact CG-CE2 3.98Å; R109-Y125 CarbonylContact C-O 3.55Å; R109-Y125 WeakPolarHBondContact CA-O 3.17Å; A110-Y125 PolarHBondContact N-O 3.11Å; A110-Y125 PolarHBondContact O-N 2.83Å; Q123-Y125 VanDerWaalsContact CD-OH 3.32Å; Q123-Y125 HydrophobicContact CG-CD1 4.44Å; Q123-Y125 HydrophobicContact CG-CE1 3.82Å; Q123-Y125 PolarHBondContact NE2-OH 3.44Å
126	L	97.1	Very high	93.8	Very high	115 Å²	115	59.9 Å²	59.9	60%	0.602	28%	0.276	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.8	145.4	-178.4	-60.4	173.8	0	0	0	109.4	N36 R109 T124	N36-L126 WeakPolarHBondContact CB-O 3.49Å; N36-L126 PolarHBondContact ND2-O 2.81Å; N36-L126 VanDerWaalsContact ND2-O 3.15Å; R109-L126 HydrophobicContact CB-CD2 3.81Å; T124-L126 HydrophobicContact CG2-CD2 3.86Å; T124-L126 HydrophobicContact CG2-CG 4.28Å
127	M	95.7	Very high	94	Very high	10 Å²	10	58.4 Å²	58.4	5%	0.049	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	150.9	173.5	-177.8	171.4	56.2	0	0	109.7	Q34 N36 F47 V49 F59 Y108	Q34-M127 HydrophobicContact CB-SD 4.2Å; Q34-M127 HydrophobicContact CG-CG 4.05Å; Q34-M127 HydrophobicContact CG-SD 3.79Å; N36-M127 HydrophobicContact CB-CB 4.21Å; N36-M127 HydrophobicContact CB-CG 4.43Å; F47-M127 HydrophobicContact CD1-CB 3.53Å; F47-M127 HydrophobicContact CD1-CE 3.85Å; F47-M127 HydrophobicContact CE1-CB 4.01Å; F47-M127 HydrophobicContact CE1-CE 3.87Å; F47-M127 HydrophobicContact CG-CB 4.44Å; F47-M127 HydrophobicContact CG-CE 4.18Å; F47-M127 HydrophobicContact CZ-CE 4.27Å; V49-M127 HydrophobicContact CB-CE 4.48Å; V49-M127 HydrophobicContact CG2-CE 3.35Å; V49-M127 HydrophobicContact CG2-SD 4.1Å; F59-M127 HydrophobicContact CD1-CE 3.71Å; F59-M127 HydrophobicContact CE1-CE 3.62Å; Y108-M127 PolarHBondContact N-O 3.09Å; Y108-M127 PolarHBondContact O-N 2.97Å; Y108-M127 VanDerWaalsContact O-O 3.08Å
128	T	95.3	Very high	94.1	Very high	66 Å²	66	52.1 Å²	52.1	41%	0.405	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	144.3	169	64.4	0	0	0	0	110.1	Q34 V105 S106 N107	Q34-T128 WeakPolarHBondContact CG-O 3.44Å; V105-T128 HydrophobicContact CG1-CG2 4.14Å; S106-T128 CarbonylContact O-C 3.5Å; S106-T128 WeakPolarHBondContact O-CA 3.27Å; N107-T128 VanDerWaalsContact OD1-CG2 3.29Å; N107-T128 WeakPolarHBondContact OD1-CG2 3.44Å
129	Y	94.6	Very high	94.1	Very high	14 Å²	14	50.8 Å²	50.8	6%	0.055	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	132.6	175.4	-171.5	-116.3	0	0	0	110	L33 Q34 V49 E52 L57 S106 R131	L33-Y129 HydrophobicContact CB-CE2 4.29Å; Q34-Y129 HydrophobicContact CB-CD2 3.54Å; Q34-Y129 HydrophobicContact CB-CE2 3.89Å; Q34-Y129 HydrophobicContact CG-CD2 4Å; V49-Y129 HydrophobicContact CG2-CD2 4.08Å; V49-Y129 HydrophobicContact CG2-CE2 4.49Å; V49-Y129 HydrophobicContact CG2-CG 4.23Å; E52-Y129 WeakPolarHBondContact OE2-CE1 3.43Å; E52-Y129 PolarHBondContact OE2-OH 3.44Å; L57-Y129 HydrophobicContact CD1-CD1 3.75Å; L57-Y129 HydrophobicContact CD1-CE1 4.21Å; L57-Y129 HydrophobicContact CD2-CD1 4.44Å; L57-Y129 HydrophobicContact CD2-CE1 4.06Å; S106-Y129 PolarHBondContact N-O 3.38Å; S106-Y129 PolarHBondContact O-N 2.04Å; Y129-R131 HydrophobicContact CE1-CB 4.27Å
130	K	93.5	Very high	93.7	Very high	42 Å²	42	51.8 Å²	51.8	18%	0.183	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	114.5	178.9	179.9	-169.4	-173.8	-169.1	0	106.5	C103 E104 V105 H209 R212	C103-K130 WeakPolarHBondContact O-CE 3.03Å; E104-K130 WeakPolarHBondContact O-CA 3.48Å; V105-K130 HydrophobicContact CG2-CB 4.2Å; V105-K130 HydrophobicContact CG2-CD 4.32Å; V105-K130 HydrophobicContact CG2-CG 4.43Å; K130-H209 PolarHBondContact NZ-NE2 3.17Å; K130-R212 VanDerWaalsContact CB-NH1 3.34Å; K130-R212 PolarHBondContact O-NH1 3.18Å
131	R	92	Very high	93.2	Very high	7 Å²	7	49.5 Å²	49.5	3%	0.026	25%	0.254	C	S	.	.	B	Isolated β-bridge	trans	-85.5	146.8	-175.7	-171.8	160.3	60.5	91.3	-0.9	110.4	E52 I99 G100 C103 Y129 E155	E52-R131 WeakPolarHBondContact OE1-CD 3.45Å; E52-R131 WeakPolarHBondContact OE2-CD 3.29Å; E52-R131 WeakPolarHBondContact OE2-CG 3.42Å; I99-R131 PolarHBondContact O-NE 2.74Å; G100-R131 PolarHBondContact O-NE 3.04Å; G100-R131 PolarHBondContact O-NH2 2.83Å; C103-R131 PolarHBondContact N-O 3.47Å; Y129-R131 HydrophobicContact CE1-CB 4.27Å; R131-E155 IonicContact CZ-OE1 3.92Å; R131-E155 IonicContact CZ-OE2 3.46Å; R131-E155 VanDerWaalsContact NH1-CD 3.33Å; R131-E155 IonicContact NH1-OE1 3.42Å; R131-E155 PolarHBondContact NH1-OE1 2.77Å; R131-E155 VanDerWaalsContact NH1-OE1 3.1Å; R131-E155 IonicContact NH1-OE2 2.7Å; R131-E155 PolarHBondContact NH1-OE2 2.95Å; R131-E155 IonicContact NH2-OE1 2.7Å; R131-E155 PolarHBondContact NH2-OE1 3.43Å; R131-E155 IonicContact NH2-OE2 2.67Å
132	V	93.7	Very high	92.3	Very high	4 Å²	4	52.3 Å²	52.3	2%	0.024	27%	0.269	C	S	.	.	P	Polyproline II helix	trans	-89.3	134.9	172.3	-173.3	0	0	0	0	108.2	R134 N207 H209 R212	V132-R134 PolarHBondContact O-N 2.99Å; V132-N207 HydrophobicContact CG1-CB 3.67Å; V132-H209 HydrophobicContact CG1-CB 4.09Å; V132-H209 HydrophobicContact CG2-CB 3.84Å; V132-R212 HydrophobicContact CG2-CB 3.64Å
133	P	93.3	Very high	91.3	Very high	3 Å²	3	51.6 Å²	51.6	2%	0.019	27%	0.269	C	S	.	.	P	Polyproline II helix	trans	-49.6	132.8	178	-21.1	22.8	0	0	0	111.1	P102 C103 P157 C159 N207 S214	P102-P133 HydrophobicContact CB-CB 4.1Å; P102-P133 HydrophobicContact CB-CG 3.97Å; C103-P133 WeakPolarHBondContact SG-CD 3.02Å; C103-P133 WeakPolarHBondContact SG-CG 3.19Å; P133-P157 WeakPolarHBondContact CG-O 3.14Å; P133-C159 VanDerWaalsContact CD-SG 3.51Å; P133-N207 PolarHBondContact O-ND2 2.89Å; P133-S214 WeakPolarHBondContact O-CB 3.48Å
134	R	92	Very high	90.2	Very high	6 Å²	6	55.1 Å²	55.1	2%	0.023	30%	0.295	C	S	.	.	P	Polyproline II helix	trans	-80.5	151.1	-178	-60.7	-173.3	-172.9	144.3	-9.2	112.6	E52 Q53 T54 V132 R154 E155 L215	E52-R134 VanDerWaalsContact CG-NH2 3.28Å; E52-R134 IonicContact OE1-CZ 3.99Å; E52-R134 VanDerWaalsContact OE1-CZ 3.26Å; E52-R134 IonicContact OE1-NE 3.24Å; E52-R134 PolarHBondContact OE1-NE 2.95Å; E52-R134 IonicContact OE1-NH2 2.65Å; E52-R134 PolarHBondContact OE1-NH2 2.88Å; Q53-R134 PolarHBondContact O-NH2 2.9Å; T54-R134 VanDerWaalsContact CA-NH1 3.31Å; T54-R134 PolarHBondContact O-NH1 2.84Å; V132-R134 PolarHBondContact O-N 2.99Å; R134-R154 CarbonylContact O-C 3.6Å; R134-R154 WeakPolarHBondContact O-CA 3.49Å; R134-E155 HydrophobicContact CB-CB 4.41Å; R134-E155 WeakPolarHBondContact CG-OE2 3.41Å; R134-E155 PolarHBondContact N-OE2 3.1Å; R134-E155 VanDerWaalsContact N-OE2 3.15Å; R134-E155 PolarHBondContact O-N 2.79Å; R134-L215 WeakPolarHBondContact CG-O 3.3Å
135	I	91.5	Very high	89	Confident	4 Å²	4	58.1 Å²	58.1	2%	0.021	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	132.6	167.1	-63.4	-175.5	0	0	0	109	V138 W152 E153 V165 L205 N207 T217	I135-V138 HydrophobicContact CG2-CG2 3.58Å; I135-W152 HydrophobicContact CG2-CB 3.58Å; I135-W152 HydrophobicContact CG2-CG 3.79Å; I135-E153 WeakPolarHBondContact CA-O 3.5Å; I135-V165 HydrophobicContact CD1-CG1 3.92Å; I135-L205 HydrophobicContact CD1-CB 3.73Å; I135-N207 WeakPolarHBondContact CG1-ND2 3.41Å; I135-T217 PolarHBondContact O-OG1 2.97Å
136	K	90.1	Very high	87.7	Confident	76 Å²	76	64.4 Å²	64.4	33%	0.33	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	162.9	-179.7	-66.1	-179.7	178.3	176.8	0	110	V138 E153 E155	K136-V138 VanDerWaalsContact C-N 3.27Å; K136-V138 PolarHBondContact O-N 2.86Å; K136-V138 VanDerWaalsContact O-N 3.14Å; K136-E153 HydrophobicContact CB-CB 4.39Å; K136-E153 PolarHBondContact N-O 2.94Å; K136-E153 PolarHBondContact O-N 2.83Å; K136-E155 HydrophobicContact CD-CB 4.42Å
137	N	90	Very high	86.8	Confident	111 Å²	111	64.4 Å²	64.4	59%	0.594	33%	0.333	S	S	*	.	E	Extended strand (participates in β ladder)	trans	49.9	45.5	168.4	-62	-24	0	0	0	113.7	N139 E153	N137-N139 PolarHBondContact O-N 3.42Å; N137-E153 HydrophobicContact CB-CB 4.23Å; N137-E153 HydrophobicContact CB-CG 4.14Å; N137-E153 PolarHBondContact ND2-OE2 2.79Å
138	V	89.7	Confident	86.1	Confident	74 Å²	74	64.2 Å²	64.2	45%	0.448	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	123.2	176.6	-176.2	0	0	0	0	109	I135 K136 L150 M151 W152 L205	I135-V138 HydrophobicContact CG2-CG2 3.58Å; K136-V138 VanDerWaalsContact C-N 3.27Å; K136-V138 PolarHBondContact O-N 2.86Å; K136-V138 VanDerWaalsContact O-N 3.14Å; V138-L150 HydrophobicContact CG1-CD1 3.61Å; V138-M151 CarbonylContact C-O 3.55Å; V138-M151 WeakPolarHBondContact CA-O 3.45Å; V138-W152 HydrophobicContact CG2-CB 4.12Å; V138-L205 HydrophobicContact CG1-CD1 3.94Å; V138-L205 HydrophobicContact CG1-CD2 4.38Å
139	N	90	Very high	85.8	Confident	77 Å²	77	64 Å²	64	41%	0.412	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	136.7	-178.1	-170.6	-2.4	0	0	0	110.4	N137 Q141 M151	N137-N139 PolarHBondContact O-N 3.42Å; N139-Q141 PolarHBondContact ND2-NE2 3.04Å; N139-M151 PolarHBondContact N-O 2.86Å; N139-M151 PolarHBondContact O-N 2.99Å
140	L	85.9	Confident	85.6	Confident	88 Å²	88	63.4 Å²	63.4	46%	0.461	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	114.2	173.2	-172.6	69	0	0	0	109	P148 L150 F203	L140-P148 HydrophobicContact CD1-CB 3.85Å; L140-L150 HydrophobicContact CD1-CD1 4.39Å; L140-F203 HydrophobicContact CD1-CE2 4.4Å; L140-F203 HydrophobicContact CD2-CE2 3.95Å
141	Q	85.1	Confident	85.6	Confident	83 Å²	83	63.9 Å²	63.9	39%	0.388	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	140.8	177.1	-64.6	-175	4.1	0	0	110.7	N139 P148 R149	N139-Q141 PolarHBondContact ND2-NE2 3.04Å; Q141-P148 CarbonylContact O-C 3.57Å; Q141-P148 WeakPolarHBondContact O-CA 3.34Å; Q141-R149 PolarHBondContact N-O 3.31Å; Q141-R149 PolarHBondContact O-N 2.84Å
142	L	79.5	Confident	85.6	Confident	123 Å²	123	64 Å²	64	64%	0.644	33%	0.326	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.9	119.3	167.2	-82.7	147.1	0	0	0	108.9
143	T	75.4	Confident	85.6	Confident	37 Å²	37	69.1 Å²	69.1	23%	0.227	35%	0.35	C	S	.	.			trans	-69.9	166.8	172.3	61.7	0	0	0	0	111	N145 M146 R147 R149 Y189	T143-N145 PolarHBondContact O-N 2.99Å; T143-M146 WeakPolarHBondContact O-CA 3.42Å; T143-M146 PolarHBondContact O-N 2.95Å; T143-R147 WeakPolarHBondContact CB-O 3.48Å; T143-R147 WeakPolarHBondContact CG2-O 3.18Å; T143-R147 PolarHBondContact N-O 2.97Å; T143-R147 WeakPolarHBondContact OG1-CB 3.28Å; T143-R147 PolarHBondContact OG1-N 3.48Å; T143-R147 PolarHBondContact OG1-O 3.18Å; T143-R149 HydrophobicContact CG2-CB 3.8Å; T143-Y189 HydrophobicContact CG2-CD1 4.47Å; T143-Y189 HydrophobicContact CG2-CE1 4.15Å
144	T	73.4	Confident	85.4	Confident	139 Å²	139	72.1 Å²	72.1	85%	0.853	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.2	-27	176.9	52.9	0	0	0	0	113.5	M146	T144-M146 PolarHBondContact O-N 3.26Å
145	N	73.4	Confident	85.4	Confident	119 Å²	119	74.4 Å²	74.4	64%	0.636	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.8	16.4	178	-62.1	-12.9	0	0	0	112.7	T143 R147	T143-N145 PolarHBondContact O-N 2.99Å; N145-R147 HydrophobicContact CB-CG 4.46Å; N145-R147 PolarHBondContact O-N 2.95Å; N145-R147 VanDerWaalsContact O-N 3.11Å
146	M	71.4	Confident	85.3	Confident	155 Å²	155	75.2 Å²	75.2	76%	0.764	38%	0.38	S	S	*	.	S	Bend	trans	56.9	21.2	-174.9	-62	-176.6	-87.6	0	0	114	T143 T144	T143-M146 WeakPolarHBondContact O-CA 3.42Å; T143-M146 PolarHBondContact O-N 2.95Å; T144-M146 PolarHBondContact O-N 3.26Å
147	R	76.3	Confident	85.4	Confident	115 Å²	115	76.6 Å²	76.6	43%	0.434	40%	0.397	S	S	.	.			trans	-90.6	130.8	174.3	-63.6	-174.6	-178.8	178.5	3.2	109.8	T143 N145 R149 N191	T143-R147 WeakPolarHBondContact CB-O 3.48Å; T143-R147 WeakPolarHBondContact CG2-O 3.18Å; T143-R147 PolarHBondContact N-O 2.97Å; T143-R147 WeakPolarHBondContact OG1-CB 3.28Å; T143-R147 PolarHBondContact OG1-N 3.48Å; T143-R147 PolarHBondContact OG1-O 3.18Å; N145-R147 HydrophobicContact CB-CG 4.46Å; N145-R147 PolarHBondContact O-N 2.95Å; N145-R147 VanDerWaalsContact O-N 3.11Å; R147-R149 PolarHBondContact O-N 3.09Å; R147-N191 WeakPolarHBondContact CD-OD1 3.47Å; R147-N191 PolarHBondContact NH1-OD1 2.99Å
148	P	82.4	Confident	85.5	Confident	5 Å²	5	72.9 Å²	72.9	3%	0.032	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.8	134.7	173.5	-15.6	27.8	0	0	0	111.1	L140 Q141 M190 F193	L140-P148 HydrophobicContact CD1-CB 3.85Å; Q141-P148 CarbonylContact O-C 3.57Å; Q141-P148 WeakPolarHBondContact O-CA 3.34Å; P148-M190 HydrophobicContact CB-CB 4.09Å; P148-M190 HydrophobicContact CB-CG 4.25Å; P148-M190 HydrophobicContact CB-SD 3.9Å; P148-M190 HydrophobicContact CG-CB 4.31Å; P148-M190 HydrophobicContact CG-SD 4.45Å; P148-M190 WeakPolarHBondContact O-CB 3.17Å; P148-M190 PolarHBondContact O-N 2.95Å; P148-F193 HydrophobicContact CG-CD1 4.06Å
149	R	88.3	Confident	85.7	Confident	61 Å²	61	70.8 Å²	70.8	23%	0.23	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	119.3	170.8	-178.9	-174.3	-177.6	-155	4.8	107.4	Q141 T143 R147 M151 D187 Y189	Q141-R149 PolarHBondContact N-O 3.31Å; Q141-R149 PolarHBondContact O-N 2.84Å; T143-R149 HydrophobicContact CG2-CB 3.8Å; R147-R149 PolarHBondContact O-N 3.09Å; R149-M151 HydrophobicContact CG-CG 4.03Å; R149-M151 PolarHBondContact NH1-SD 2.89Å; R149-D187 IonicContact CZ-OD2 3.2Å; R149-D187 IonicContact NE-OD2 2.9Å; R149-D187 PolarHBondContact NE-OD2 2.72Å; R149-D187 IonicContact NH2-OD2 2.74Å; R149-D187 PolarHBondContact NH2-OD2 2.83Å; R149-Y189 HydrophobicContact CB-CD1 4.45Å; R149-Y189 HydrophobicContact CB-CE1 4.44Å; R149-Y189 HydrophobicContact CG-CD1 4.37Å; R149-Y189 HydrophobicContact CG-CE1 4.11Å; R149-Y189 PolarHBondContact NE-OH 3.4Å
150	L	90.5	Very high	86	Confident	2 Å²	2	71.7 Å²	71.7	1%	0.01	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	130.9	174.1	-172.8	60.6	0	0	0	107.7	V138 L140 W152 I167 D187 Y188 F203 L205	V138-L150 HydrophobicContact CG1-CD1 3.61Å; L140-L150 HydrophobicContact CD1-CD1 4.39Å; L150-W152 HydrophobicContact CG-CE3 4.22Å; L150-W152 HydrophobicContact CG-CZ3 4.27Å; L150-I167 HydrophobicContact CD2-CD1 4.43Å; L150-I167 HydrophobicContact CD2-CG2 4.14Å; L150-D187 CarbonylContact O-C 3.44Å; L150-D187 WeakPolarHBondContact O-CA 3.35Å; L150-D187 WeakPolarHBondContact O-CB 3.19Å; L150-Y188 PolarHBondContact N-O 2.86Å; L150-Y188 PolarHBondContact O-N 3.23Å; L150-F203 HydrophobicContact CD2-CD1 4.39Å; L150-L205 HydrophobicContact CD1-CD1 4.46Å; L150-L205 HydrophobicContact CD1-CD2 4.45Å; L150-L205 HydrophobicContact CD2-CD1 4.03Å; L150-L205 HydrophobicContact CD2-CD2 3.57Å; L150-L205 HydrophobicContact CD2-CG 3.97Å; L150-L205 HydrophobicContact CG-CD2 3.94Å
151	M	92.9	Very high	86.3	Confident	52 Å²	52	73.4 Å²	73.4	26%	0.256	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	150.9	177.8	-60.7	-177.8	65.5	0	0	109.1	V138 N139 R149 V186 D187	V138-M151 CarbonylContact C-O 3.55Å; V138-M151 WeakPolarHBondContact CA-O 3.45Å; N139-M151 PolarHBondContact N-O 2.86Å; N139-M151 PolarHBondContact O-N 2.99Å; R149-M151 HydrophobicContact CG-CG 4.03Å; R149-M151 PolarHBondContact NH1-SD 2.89Å; M151-V186 WeakPolarHBondContact CA-O 3.45Å; M151-D187 HydrophobicContact CB-CB 4.5Å; M151-D187 HydrophobicContact CG-CB 3.88Å
152	W	93.3	Very high	86.7	Confident	10 Å²	10	74.7 Å²	74.7	4%	0.038	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	165.5	175.9	60.7	92.1	0	0	0	111.8	I135 V138 L150 V165 I167 I181 E185 V186 L205	I135-W152 HydrophobicContact CG2-CB 3.58Å; I135-W152 HydrophobicContact CG2-CG 3.79Å; V138-W152 HydrophobicContact CG2-CB 4.12Å; L150-W152 HydrophobicContact CG-CE3 4.22Å; L150-W152 HydrophobicContact CG-CZ3 4.27Å; W152-V165 HydrophobicContact CZ2-CB 4.4Å; W152-V165 HydrophobicContact CZ2-CG1 4.07Å; W152-V165 HydrophobicContact CZ2-CG2 4.13Å; W152-I167 HydrophobicContact CH2-CD1 4.14Å; W152-I167 HydrophobicContact CZ3-CD1 4.31Å; W152-I181 HydrophobicContact CH2-CD1 3.47Å; W152-I181 VanDerWaalsContact CH2-CD1 3.47Å; W152-I181 HydrophobicContact CZ2-CD1 3.76Å; W152-E185 VanDerWaalsContact CZ2-O 3.27Å; W152-E185 WeakPolarHBondContact CZ2-O 3.34Å; W152-V186 PolarHBondContact N-O 2.88Å; W152-L205 HydrophobicContact CD2-CD2 3.98Å; W152-L205 HydrophobicContact CE3-CD2 3.62Å; W152-L205 HydrophobicContact CG-CD2 4.47Å; W152-L205 HydrophobicContact CZ3-CD2 4.13Å
153	E	92.9	Very high	87.5	Confident	112 Å²	112	69.3 Å²	69.3	52%	0.523	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	168.6	168.7	-66.2	176.9	-169.5	0	0	109.8	I135 K136 N137	I135-E153 WeakPolarHBondContact CA-O 3.5Å; K136-E153 HydrophobicContact CB-CB 4.39Å; K136-E153 PolarHBondContact N-O 2.94Å; K136-E153 PolarHBondContact O-N 2.83Å; N137-E153 HydrophobicContact CB-CB 4.23Å; N137-E153 HydrophobicContact CB-CG 4.14Å; N137-E153 PolarHBondContact ND2-OE2 2.79Å
154	R	89.5	Confident	88.5	Confident	66 Å²	66	68.3 Å²	68.3	25%	0.249	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	147.4	176.6	-67.1	178.6	-75.4	164.2	-15	110.1	R134 G156 S183	R134-R154 CarbonylContact O-C 3.6Å; R134-R154 WeakPolarHBondContact O-CA 3.49Å; R154-G156 WeakPolarHBondContact CB-O 3.47Å; R154-G156 PolarHBondContact O-N 2.84Å; R154-S183 PolarHBondContact NH1-O 2.84Å; R154-S183 PolarHBondContact NH2-O 3.49Å
155	E	91.2	Very high	89.5	Confident	54 Å²	54	61.7 Å²	61.7	25%	0.252	33%	0.328	S	S	.	.	S	Bend	trans	-58.7	-30.4	174.1	-176	175.7	-155.1	0	0	112.7	P102 R131 R134 K136	P102-E155 HydrophobicContact CG-CG 4.32Å; R131-E155 IonicContact CZ-OE1 3.92Å; R131-E155 IonicContact CZ-OE2 3.46Å; R131-E155 VanDerWaalsContact NH1-CD 3.33Å; R131-E155 IonicContact NH1-OE1 3.42Å; R131-E155 PolarHBondContact NH1-OE1 2.77Å; R131-E155 VanDerWaalsContact NH1-OE1 3.1Å; R131-E155 IonicContact NH1-OE2 2.7Å; R131-E155 PolarHBondContact NH1-OE2 2.95Å; R131-E155 IonicContact NH2-OE1 2.7Å; R131-E155 PolarHBondContact NH2-OE1 3.43Å; R131-E155 IonicContact NH2-OE2 2.67Å; R134-E155 HydrophobicContact CB-CB 4.41Å; R134-E155 WeakPolarHBondContact CG-OE2 3.41Å; R134-E155 PolarHBondContact N-OE2 3.1Å; R134-E155 VanDerWaalsContact N-OE2 3.15Å; R134-E155 PolarHBondContact O-N 2.79Å; K136-E155 HydrophobicContact CD-CB 4.42Å
156	G	90.3	Very high	90.5	Very high	20 Å²	20	56.6 Å²	56.6	21%	0.206	30%	0.301	C	S	.	.	S	Bend	trans	-166.4	-176.8	179.3	0	0	0	0	0	111.4	R154	R154-G156 WeakPolarHBondContact CB-O 3.47Å; R154-G156 PolarHBondContact O-N 2.84Å
157	P	91.7	Very high	91.5	Very high	106 Å²	106	49.3 Å²	49.3	69%	0.688	27%	0.265	S	S	*	.			trans	-64	162.8	175.1	30.2	-35.6	0	0	0	111.4	P133	P133-P157 WeakPolarHBondContact CG-O 3.14Å
158	A	93.2	Very high	92.2	Very high	32 Å²	32	46.4 Å²	46.4	26%	0.264	26%	0.255	S	S	.	.			trans	-58.4	151.6	168	0	0	0	0	0	111.1	D163 S183	A158-D163 HydrophobicContact CB-CB 4.07Å; A158-S183 WeakPolarHBondContact CB-OG 3.4Å
159	C	93.9	Very high	92.5	Very high	30 Å²	30	46.5 Å²	46.5	20%	0.203	26%	0.255	C	S	.	.	S	Bend	trans	-74.9	-37.8	178.8	-54.8	0	0	0	0	111.2	C103 P133 D163	C103-C159 WeakPolarHBondContact CA-SG 3.46Å; C103-C159 HydrophobicContact CB-CB 3.69Å; C103-C159 WeakPolarHBondContact CB-SG 3.41Å; C103-C159 WeakPolarHBondContact SG-CA 3.41Å; C103-C159 WeakPolarHBondContact SG-CB 3.31Å; C103-C159 PolarHBondContact SG-N 2.83Å; C103-C159 VanDerWaalsContact SG-N 3.38Å; C103-C159 CovalentContact SG-SG 2.04Å; C103-C159 PolarHBondContact SG-SG 2.77Å; P133-C159 VanDerWaalsContact CD-SG 3.51Å; C159-D163 WeakPolarHBondContact CA-OD2 3.33Å; C159-D163 VanDerWaalsContact CB-OD2 3.31Å; C159-D163 WeakPolarHBondContact CB-OD2 3.37Å; C159-D163 PolarHBondContact N-OD2 2.9Å
160	E	94.5	Very high	92.5	Very high	96 Å²	96	44.1 Å²	44.1	45%	0.449	25%	0.249	S	C	.	.	S	Bend	trans	-138.6	154.6	176	-71.6	177.6	-167.3	0	0	111	T162 D163 H209	E160-T162 PolarHBondContact O-N 2.75Å; E160-T162 VanDerWaalsContact O-N 3.11Å; E160-T162 PolarHBondContact OE2-OG1 3.19Å; E160-D163 PolarHBondContact N-OD2 2.95Å; E160-D163 VanDerWaalsContact O-CB 3.27Å; E160-D163 WeakPolarHBondContact O-CB 3.22Å; E160-D163 VanDerWaalsContact O-CG 3.26Å; E160-D163 PolarHBondContact O-N 2.86Å; E160-H209 IonicContact OE1-CE1 3.66Å
161	P	92.2	Very high	92.2	Very high	125 Å²	125	45.2 Å²	45.2	81%	0.812	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-19.5	176.2	-23.2	34.1	0	0	0	114.4	D163	P161-D163 VanDerWaalsContact C-N 3.32Å
162	T	94.8	Very high	91.8	Very high	110 Å²	110	46.2 Å²	46.2	68%	0.675	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.6	-5.7	177.9	48.2	0	0	0	0	113.2	E160	E160-T162 PolarHBondContact O-N 2.75Å; E160-T162 VanDerWaalsContact O-N 3.11Å; E160-T162 PolarHBondContact OE2-OG1 3.19Å
163	D	95.7	Very high	91.4	Very high	9 Å²	9	50.2 Å²	50.2	5%	0.048	30%	0.295	C	S	.	.			trans	-64	153.7	175	-68.2	-12.2	0	0	0	110.5	A158 C159 E160 P161 S183 K208 H209	A158-D163 HydrophobicContact CB-CB 4.07Å; C159-D163 WeakPolarHBondContact CA-OD2 3.33Å; C159-D163 VanDerWaalsContact CB-OD2 3.31Å; C159-D163 WeakPolarHBondContact CB-OD2 3.37Å; C159-D163 PolarHBondContact N-OD2 2.9Å; E160-D163 PolarHBondContact N-OD2 2.95Å; E160-D163 VanDerWaalsContact O-CB 3.27Å; E160-D163 WeakPolarHBondContact O-CB 3.22Å; E160-D163 VanDerWaalsContact O-CG 3.26Å; E160-D163 PolarHBondContact O-N 2.86Å; P161-D163 VanDerWaalsContact C-N 3.32Å; D163-S183 VanDerWaalsContact C-CB 3.48Å; D163-S183 WeakPolarHBondContact O-CB 3.23Å; D163-S183 PolarHBondContact O-N 3.15Å; D163-S183 VanDerWaalsContact O-N 3.17Å; D163-S183 PolarHBondContact O-OG 2.81Å; D163-K208 WeakPolarHBondContact CA-O 3.34Å; D163-K208 WeakPolarHBondContact CB-O 3.41Å; D163-H209 WeakPolarHBondContact OD1-CA 3.03Å; D163-H209 WeakPolarHBondContact OD1-CB 3.44Å; D163-H209 IonicContact OD1-CE1 3.84Å; D163-H209 IonicContact OD1-CG 3.1Å; D163-H209 IonicContact OD1-ND1 2.8Å; D163-H209 PolarHBondContact OD1-ND1 2.82Å; D163-H209 IonicContact OD2-CG 3.65Å; D163-H209 IonicContact OD2-ND1 3.78Å; D163-H209 PolarHBondContact OD2-ND1 3.48Å
164	S	95.9	Very high	91	Very high	16 Å²	16	49.9 Å²	49.9	11%	0.112	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	159.8	-175.5	45.6	0	0	0	0	111.5	I181 N207 K208	S164-I181 CarbonylContact C-O 3.54Å; S164-I181 VanDerWaalsContact CA-O 3.27Å; S164-I181 WeakPolarHBondContact CA-O 3.34Å; S164-I181 VanDerWaalsContact CB-O 3.23Å; S164-I181 WeakPolarHBondContact CB-O 3.33Å; S164-N207 CarbonylContact O-C 3.59Å; S164-K208 PolarHBondContact N-O 3.22Å; S164-K208 VanDerWaalsContact N-O 3.09Å; S164-K208 PolarHBondContact O-N 3.49Å
165	V	95.1	Very high	90.9	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	129.3	166.5	-172.9	0	0	0	0	107.9	I135 W152 I167 I180 I181 N207	I135-V165 HydrophobicContact CD1-CG1 3.92Å; W152-V165 HydrophobicContact CZ2-CB 4.4Å; W152-V165 HydrophobicContact CZ2-CG1 4.07Å; W152-V165 HydrophobicContact CZ2-CG2 4.13Å; V165-I167 HydrophobicContact CG1-CG1 4.15Å; V165-I180 WeakPolarHBondContact O-CA 3.49Å; V165-I181 HydrophobicContact CB-CD1 4.13Å; V165-I181 HydrophobicContact CB-CG1 3.69Å; V165-I181 HydrophobicContact CG2-CG1 4.35Å; V165-I181 PolarHBondContact N-O 2.84Å; V165-I181 PolarHBondContact O-N 2.73Å; V165-N207 WeakPolarHBondContact CG2-OD1 3.38Å
166	I	93.8	Very high	90.8	Very high	13 Å²	13	55.8 Å²	55.8	7%	0.067	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	128.3	172.4	-63	179	0	0	0	108.1	F168 M178 V179 I180 L205 F206 K208	I166-F168 HydrophobicContact CG2-CD2 4.31Å; I166-F168 HydrophobicContact CG2-CE2 4.07Å; I166-M178 HydrophobicContact CG2-CG 3.87Å; I166-M178 HydrophobicContact CG2-SD 4.36Å; I166-V179 WeakPolarHBondContact CA-O 3.37Å; I166-I180 HydrophobicContact CG1-CG1 4.37Å; I166-L205 WeakPolarHBondContact O-CA 3.34Å; I166-F206 HydrophobicContact CB-CD2 4.01Å; I166-F206 HydrophobicContact CB-CE1 4.3Å; I166-F206 HydrophobicContact CB-CE2 3.54Å; I166-F206 HydrophobicContact CB-CZ 3.69Å; I166-F206 HydrophobicContact CD1-CE2 3.65Å; I166-F206 HydrophobicContact CD1-CZ 4.21Å; I166-F206 HydrophobicContact CG1-CE2 4.04Å; I166-F206 HydrophobicContact CG2-CE1 4.06Å; I166-F206 HydrophobicContact CG2-CE2 3.89Å; I166-F206 HydrophobicContact CG2-CZ 3.49Å; I166-F206 VanDerWaalsContact CG2-CZ 3.49Å; I166-F206 PolarHBondContact N-O 3.04Å; I166-F206 PolarHBondContact O-N 2.98Å; I166-F206 VanDerWaalsContact O-N 3.09Å; I166-K208 HydrophobicContact CD1-CB 4Å; I166-K208 HydrophobicContact CD1-CD 3.56Å; I166-K208 HydrophobicContact CD1-CG 4.36Å; I166-K208 HydrophobicContact CG1-CB 4.33Å; I166-K208 HydrophobicContact CG1-CD 4.49Å
167	I	92.3	Very high	90.9	Very high	1 Å²	1	60 Å²	60	1%	0.005	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	117.1	177.3	-55.2	173.4	0	0	0	107.8	L150 W152 V165 K169 M178 V179 I181 Y188 I204 L205	L150-I167 HydrophobicContact CD2-CD1 4.43Å; L150-I167 HydrophobicContact CD2-CG2 4.14Å; W152-I167 HydrophobicContact CH2-CD1 4.14Å; W152-I167 HydrophobicContact CZ3-CD1 4.31Å; V165-I167 HydrophobicContact CG1-CG1 4.15Å; I167-K169 HydrophobicContact CG2-CB 4.4Å; I167-M178 CarbonylContact O-C 3.55Å; I167-M178 WeakPolarHBondContact O-CA 3.49Å; I167-V179 HydrophobicContact CB-CB 4.5Å; I167-V179 PolarHBondContact N-O 3.3Å; I167-V179 PolarHBondContact O-N 3.29Å; I167-I181 HydrophobicContact CD1-CD1 3.79Å; I167-Y188 HydrophobicContact CD1-CD1 4.14Å; I167-Y188 HydrophobicContact CD1-CD2 4.36Å; I167-Y188 HydrophobicContact CD1-CG 3.84Å; I167-I204 CarbonylContact C-O 3.59Å; I167-I204 WeakPolarHBondContact CA-O 3.44Å; I167-L205 HydrophobicContact CG1-CD2 4.44Å; I167-L205 HydrophobicContact CG1-CG 4.31Å; I167-L205 HydrophobicContact CG2-CG 4.47Å
168	F	91.6	Very high	90.9	Very high	55 Å²	55	60 Å²	60	24%	0.241	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	124.7	160	-66	-83.2	0	0	0	109.1	I166 L176 Q177 M178 F203 I204 F206	I166-F168 HydrophobicContact CG2-CD2 4.31Å; I166-F168 HydrophobicContact CG2-CE2 4.07Å; F168-L176 HydrophobicContact CB-CB 4.03Å; F168-L176 HydrophobicContact CB-CD1 3.9Å; F168-L176 HydrophobicContact CD1-CB 4.29Å; F168-Q177 CarbonylContact C-O 3.6Å; F168-Q177 WeakPolarHBondContact CA-O 3.29Å; F168-M178 HydrophobicContact CD1-CB 4.05Å; F168-M178 HydrophobicContact CD1-CG 4.5Å; F168-M178 HydrophobicContact CE1-CB 3.89Å; F168-M178 HydrophobicContact CE1-CE 3.46Å; F168-M178 VanDerWaalsContact CE1-CE 3.46Å; F168-M178 HydrophobicContact CE1-CG 4.16Å; F168-M178 HydrophobicContact CE2-CE 4.32Å; F168-M178 HydrophobicContact CZ-CE 3.3Å; F168-M178 HydrophobicContact CZ-CG 4.49Å; F168-F203 WeakPolarHBondContact O-CA 3.34Å; F168-I204 HydrophobicContact CB-CB 4.15Å; F168-I204 HydrophobicContact CD2-CB 4.39Å; F168-I204 PolarHBondContact N-O 3.43Å; F168-I204 PolarHBondContact O-N 3.12Å; F168-F206 AromaticContact CD2-CE1 3.76Å; F168-F206 HydrophobicContact CD2-CE1 3.76Å; F168-F206 HydrophobicContact CD2-CZ 4.23Å; F168-F206 AromaticContact CE2-CE1 3.57Å; F168-F206 HydrophobicContact CE2-CE1 3.57Å; F168-F206 AromaticContact CE2-CZ 3.62Å; F168-F206 HydrophobicContact CE2-CZ 3.62Å
169	K	89	Confident	90.9	Very high	7 Å²	7	59.9 Å²	59.9	3%	0.03	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	144.6	179.9	60.8	168.7	-169.1	163.2	0	111.1	I167 L176 Q177 V179 Y188 M190 D192 V202 F203	I167-K169 HydrophobicContact CG2-CB 4.4Å; K169-L176 CarbonylContact O-C 3.56Å; K169-L176 WeakPolarHBondContact O-CA 3.32Å; K169-Q177 VanDerWaalsContact CE-OE1 3.31Å; K169-Q177 HydrophobicContact CG-CB 4.23Å; K169-Q177 PolarHBondContact N-O 2.78Å; K169-Q177 PolarHBondContact O-N 2.59Å; K169-V179 HydrophobicContact CD-CG2 4.22Å; K169-V179 HydrophobicContact CG-CG2 4.49Å; K169-Y188 HydrophobicContact CD-CE1 4.17Å; K169-M190 HydrophobicContact CB-CE 3.88Å; K169-M190 HydrophobicContact CD-CE 3.68Å; K169-M190 HydrophobicContact CG-CE 4.34Å; K169-D192 IonicContact NZ-OD1 2.9Å; K169-D192 PolarHBondContact NZ-OD1 3.29Å; K169-D192 IonicContact NZ-OD2 3.26Å; K169-D192 PolarHBondContact NZ-OD2 2.78Å; K169-V202 WeakPolarHBondContact CA-O 3.46Å; K169-F203 HydrophobicContact CB-CD1 4.08Å; K169-F203 HydrophobicContact CB-CE1 4Å
170	G	87.4	Confident	91	Very high	10 Å²	10	63.5 Å²	63.5	10%	0.103	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	164.5	-159.4	175.9	0	0	0	0	0	112.1	G201 V202	G170-G201 WeakPolarHBondContact O-CA 3.38Å; G170-V202 PolarHBondContact N-O 3.13Å; G170-V202 PolarHBondContact O-N 3.16Å
171	Y	85.9	Confident	91	Very high	26 Å²	26	59.9 Å²	59.9	10%	0.102	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	147.6	173.7	-57	-71.8	0	0	0	109.9	S173 Q174 F193 Q194 M199 E200	Y171-S173 PolarHBondContact O-N 2.63Å; Y171-Q174 PolarHBondContact O-N 3.45Å; Y171-Q174 VanDerWaalsContact O-O 3.11Å; Y171-F193 HydrophobicContact CD1-CE2 4.38Å; Y171-F193 AromaticContact CD1-CZ 3.95Å; Y171-F193 HydrophobicContact CD1-CZ 3.95Å; Y171-F193 AromaticContact CE1-CE1 3.79Å; Y171-F193 HydrophobicContact CE1-CE1 3.79Å; Y171-F193 AromaticContact CE1-CE2 3.83Å; Y171-F193 HydrophobicContact CE1-CE2 3.83Å; Y171-F193 AromaticContact CE1-CZ 3.33Å; Y171-F193 HydrophobicContact CE1-CZ 3.33Å; Y171-F193 HydrophobicContact CE2-CE2 4.29Å; Y171-F193 AromaticContact CZ-CE2 3.74Å; Y171-F193 AromaticContact CZ-CZ 3.7Å; Y171-Q194 VanDerWaalsContact OH-C 3.26Å; Y171-Q194 PolarHBondContact OH-N 2.85Å; Y171-Q194 PolarHBondContact OH-O 2.73Å; Y171-M199 HydrophobicContact CD1-CB 3.63Å; Y171-M199 HydrophobicContact CD1-CG 4.47Å; Y171-M199 HydrophobicContact CD1-SD 4.08Å; Y171-M199 HydrophobicContact CD2-SD 4.25Å; Y171-M199 HydrophobicContact CE1-CB 4.12Å; Y171-M199 HydrophobicContact CE1-SD 4.42Å; Y171-M199 HydrophobicContact CG-CB 4.3Å; Y171-M199 HydrophobicContact CG-SD 4.01Å; Y171-E200 WeakPolarHBondContact CA-O 3.42Å
172	S	84.3	Confident	91.1	Very high	72 Å²	72	56.3 Å²	56.3	50%	0.503	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-24.2	-178.7	59.3	0	0	0	0	114.3	E200	S172-E200 PolarHBondContact N-O 3.05Å
173	S	84.2	Confident	91	Very high	95 Å²	95	51.5 Å²	51.5	66%	0.664	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.8	1.7	177.1	58.8	0	0	0	0	114.6	Y171	Y171-S173 PolarHBondContact O-N 2.63Å
174	Q	84.4	Confident	90.7	Very high	105 Å²	105	56.4 Å²	56.4	49%	0.491	30%	0.302	S	S	.	.	S	Bend	trans	-130.9	164.8	-173.1	-61.1	-177.9	19.1	0	0	111.9	Y171 L176	Y171-Q174 PolarHBondContact O-N 3.45Å; Y171-Q174 VanDerWaalsContact O-O 3.11Å; Q174-L176 PolarHBondContact O-N 3.38Å
175	H	87.7	Confident	90.5	Very high	186 Å²	186	59.4 Å²	59.4	86%	0.861	31%	0.314	S	S	*	.	P	Polyproline II helix	trans	-64.1	132.4	170.7	-69.2	-67	0	0	0	110.6
176	L	89.6	Confident	90.4	Very high	58 Å²	58	62.2 Å²	62.2	30%	0.304	33%	0.331	S	S	.	.	P	Polyproline II helix	trans	-76	137.5	175.1	-52.7	-177.8	0	0	0	109.9	F168 K169 Q174 V202 I204	F168-L176 HydrophobicContact CB-CB 4.03Å; F168-L176 HydrophobicContact CB-CD1 3.9Å; F168-L176 HydrophobicContact CD1-CB 4.29Å; K169-L176 CarbonylContact O-C 3.56Å; K169-L176 WeakPolarHBondContact O-CA 3.32Å; Q174-L176 PolarHBondContact O-N 3.38Å; L176-V202 HydrophobicContact CD1-CG1 4.1Å; L176-V202 HydrophobicContact CD2-CB 4.1Å; L176-V202 HydrophobicContact CD2-CG1 4.33Å; L176-I204 HydrophobicContact CD1-CD1 4.02Å
177	Q	91.2	Very high	90.4	Very high	108 Å²	108	63.4 Å²	63.4	51%	0.505	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	133.5	169.8	-64.8	178.2	-0.3	0	0	109.4	F168 K169 D192	F168-Q177 CarbonylContact C-O 3.6Å; F168-Q177 WeakPolarHBondContact CA-O 3.29Å; K169-Q177 VanDerWaalsContact CE-OE1 3.31Å; K169-Q177 HydrophobicContact CG-CB 4.23Å; K169-Q177 PolarHBondContact N-O 2.78Å; K169-Q177 PolarHBondContact O-N 2.59Å; Q177-D192 PolarHBondContact OE1-OD2 2.78Å
178	M	93.1	Very high	90.3	Very high	105 Å²	105	65.3 Å²	65.3	52%	0.517	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	133.2	171.7	-175.5	-170.4	-73.6	0	0	109.7	I166 I167 F168 I180	I166-M178 HydrophobicContact CG2-CG 3.87Å; I166-M178 HydrophobicContact CG2-SD 4.36Å; I167-M178 CarbonylContact O-C 3.55Å; I167-M178 WeakPolarHBondContact O-CA 3.49Å; F168-M178 HydrophobicContact CD1-CB 4.05Å; F168-M178 HydrophobicContact CD1-CG 4.5Å; F168-M178 HydrophobicContact CE1-CB 3.89Å; F168-M178 HydrophobicContact CE1-CE 3.46Å; F168-M178 VanDerWaalsContact CE1-CE 3.46Å; F168-M178 HydrophobicContact CE1-CG 4.16Å; F168-M178 HydrophobicContact CE2-CE 4.32Å; F168-M178 HydrophobicContact CZ-CE 3.3Å; F168-M178 HydrophobicContact CZ-CG 4.49Å; M178-I180 HydrophobicContact CG-CG1 4.42Å; M178-I180 HydrophobicContact SD-CD1 4.32Å; M178-I180 HydrophobicContact SD-CG1 4.32Å
179	V	93	Very high	90.2	Very high	30 Å²	30	67.8 Å²	67.8	18%	0.182	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	137.5	169.6	-174.2	0	0	0	0	107.8	I166 I167 K169 I181 Y188	I166-V179 WeakPolarHBondContact CA-O 3.37Å; I167-V179 HydrophobicContact CB-CB 4.5Å; I167-V179 PolarHBondContact N-O 3.3Å; I167-V179 PolarHBondContact O-N 3.29Å; K169-V179 HydrophobicContact CD-CG2 4.22Å; K169-V179 HydrophobicContact CG-CG2 4.49Å; V179-I181 HydrophobicContact CG1-CG2 3.96Å; V179-Y188 HydrophobicContact CG1-CE2 3.87Å
180	I	94.5	Very high	89.9	Confident	107 Å²	107	67.6 Å²	67.6	55%	0.549	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	122.3	175.9	-52.6	179.9	0	0	0	106.6	V165 I166 M178	V165-I180 WeakPolarHBondContact O-CA 3.49Å; I166-I180 HydrophobicContact CG1-CG1 4.37Å; M178-I180 HydrophobicContact CG-CG1 4.42Å; M178-I180 HydrophobicContact SD-CD1 4.32Å; M178-I180 HydrophobicContact SD-CG1 4.32Å
181	I	94.5	Very high	89.5	Confident	19 Å²	19	72 Å²	72	10%	0.097	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	165.7	175.9	63.1	179	0	0	0	109.8	W152 S164 V165 I167 V179 E185 Y188	W152-I181 HydrophobicContact CH2-CD1 3.47Å; W152-I181 VanDerWaalsContact CH2-CD1 3.47Å; W152-I181 HydrophobicContact CZ2-CD1 3.76Å; S164-I181 CarbonylContact C-O 3.54Å; S164-I181 VanDerWaalsContact CA-O 3.27Å; S164-I181 WeakPolarHBondContact CA-O 3.34Å; S164-I181 VanDerWaalsContact CB-O 3.23Å; S164-I181 WeakPolarHBondContact CB-O 3.33Å; V165-I181 HydrophobicContact CB-CD1 4.13Å; V165-I181 HydrophobicContact CB-CG1 3.69Å; V165-I181 HydrophobicContact CG2-CG1 4.35Å; V165-I181 PolarHBondContact N-O 2.84Å; V165-I181 PolarHBondContact O-N 2.73Å; I167-I181 HydrophobicContact CD1-CD1 3.79Å; V179-I181 HydrophobicContact CG1-CG2 3.96Å; I181-E185 WeakPolarHBondContact CB-OE2 3.39Å; I181-E185 HydrophobicContact CD1-CB 3.97Å; I181-E185 HydrophobicContact CG1-CB 4.46Å; I181-Y188 HydrophobicContact CG2-CD2 4.08Å; I181-Y188 HydrophobicContact CG2-CE2 4.27Å
182	S	94.7	Very high	89	Confident	51 Å²	51	75.2 Å²	75.2	36%	0.357	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	148.5	179.6	-179.3	0	0	0	0	111.3	D184 E185	S182-D184 WeakPolarHBondContact CB-OD1 3.37Å; S182-D184 PolarHBondContact O-N 3.34Å; S182-D184 PolarHBondContact OG-OD1 3.26Å; S182-E185 WeakPolarHBondContact O-CB 3.44Å; S182-E185 PolarHBondContact O-N 3.38Å
183	S	92.2	Very high	88.3	Confident	8 Å²	8	73.1 Å²	73.1	6%	0.056	38%	0.375	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-9.2	-179.2	59.1	0	0	0	0	114.3	R154 A158 D163	R154-S183 PolarHBondContact NH1-O 2.84Å; R154-S183 PolarHBondContact NH2-O 3.49Å; A158-S183 WeakPolarHBondContact CB-OG 3.4Å; D163-S183 VanDerWaalsContact C-CB 3.48Å; D163-S183 WeakPolarHBondContact O-CB 3.23Å; D163-S183 PolarHBondContact O-N 3.15Å; D163-S183 VanDerWaalsContact O-N 3.17Å; D163-S183 PolarHBondContact O-OG 2.81Å
184	D	90.2	Very high	87.4	Confident	112 Å²	112	75.9 Å²	75.9	60%	0.599	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.4	-24	170.5	64.6	-35.9	0	0	0	112.6	S182	S182-D184 WeakPolarHBondContact CB-OD1 3.37Å; S182-D184 PolarHBondContact O-N 3.34Å; S182-D184 PolarHBondContact OG-OD1 3.26Å
185	E	92.5	Very high	86.4	Confident	79 Å²	79	75.8 Å²	75.8	37%	0.369	38%	0.384	S	S	.	.			trans	-70.2	136.7	175.8	-62.7	-175.9	-163	0	0	111.3	W152 I181 S182	W152-E185 VanDerWaalsContact CZ2-O 3.27Å; W152-E185 WeakPolarHBondContact CZ2-O 3.34Å; I181-E185 WeakPolarHBondContact CB-OE2 3.39Å; I181-E185 HydrophobicContact CD1-CB 3.97Å; I181-E185 HydrophobicContact CG1-CB 4.46Å; S182-E185 WeakPolarHBondContact O-CB 3.44Å; S182-E185 PolarHBondContact O-N 3.38Å
186	V	92.6	Very high	85.2	Confident	59 Å²	59	70.3 Å²	70.3	36%	0.358	36%	0.364	S	S	.	.			trans	-126.5	6.8	177.7	-65.6	0	0	0	0	112.2	M151 W152	M151-V186 WeakPolarHBondContact CA-O 3.45Å; W152-V186 PolarHBondContact N-O 2.88Å
187	D	92.8	Very high	84.2	Confident	39 Å²	39	77 Å²	77	21%	0.209	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	156.5	172.7	71.7	-30.2	0	0	0	111.7	R149 L150 M151	R149-D187 IonicContact CZ-OD2 3.2Å; R149-D187 IonicContact NE-OD2 2.9Å; R149-D187 PolarHBondContact NE-OD2 2.72Å; R149-D187 IonicContact NH2-OD2 2.74Å; R149-D187 PolarHBondContact NH2-OD2 2.83Å; L150-D187 CarbonylContact O-C 3.44Å; L150-D187 WeakPolarHBondContact O-CA 3.35Å; L150-D187 WeakPolarHBondContact O-CB 3.19Å; M151-D187 HydrophobicContact CB-CB 4.5Å; M151-D187 HydrophobicContact CG-CB 3.88Å
188	Y	92	Very high	83.2	Confident	40 Å²	40	76 Å²	76	16%	0.157	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	130.2	-178.7	179.5	-102.7	0	0	0	110.9	L150 I167 K169 V179 I181 M190	L150-Y188 PolarHBondContact N-O 2.86Å; L150-Y188 PolarHBondContact O-N 3.23Å; I167-Y188 HydrophobicContact CD1-CD1 4.14Å; I167-Y188 HydrophobicContact CD1-CD2 4.36Å; I167-Y188 HydrophobicContact CD1-CG 3.84Å; K169-Y188 HydrophobicContact CD-CE1 4.17Å; V179-Y188 HydrophobicContact CG1-CE2 3.87Å; I181-Y188 HydrophobicContact CG2-CD2 4.08Å; I181-Y188 HydrophobicContact CG2-CE2 4.27Å; Y188-M190 HydrophobicContact CD1-CG 4.14Å; Y188-M190 HydrophobicContact CE1-CG 4.17Å
189	Y	89.1	Confident	82.4	Confident	108 Å²	108	74.9 Å²	74.9	42%	0.424	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	124.6	-179.8	-69.5	-91.5	0	0	0	111.6	T143 R149 N191	T143-Y189 HydrophobicContact CG2-CD1 4.47Å; T143-Y189 HydrophobicContact CG2-CE1 4.15Å; R149-Y189 HydrophobicContact CB-CD1 4.45Å; R149-Y189 HydrophobicContact CB-CE1 4.44Å; R149-Y189 HydrophobicContact CG-CD1 4.37Å; R149-Y189 HydrophobicContact CG-CE1 4.11Å; R149-Y189 PolarHBondContact NE-OH 3.4Å; Y189-N191 PolarHBondContact O-N 2.9Å
190	M	82.6	Confident	81.8	Confident	2 Å²	2	79.8 Å²	79.8	1%	0.01	43%	0.428	C	S	.	.			trans	-92.5	79	-179.1	-59.1	-166.3	76.4	0	0	111.5	P148 K169 Y188 D192 F193 F203	P148-M190 HydrophobicContact CB-CB 4.09Å; P148-M190 HydrophobicContact CB-CG 4.25Å; P148-M190 HydrophobicContact CB-SD 3.9Å; P148-M190 HydrophobicContact CG-CB 4.31Å; P148-M190 HydrophobicContact CG-SD 4.45Å; P148-M190 WeakPolarHBondContact O-CB 3.17Å; P148-M190 PolarHBondContact O-N 2.95Å; K169-M190 HydrophobicContact CB-CE 3.88Å; K169-M190 HydrophobicContact CD-CE 3.68Å; K169-M190 HydrophobicContact CG-CE 4.34Å; Y188-M190 HydrophobicContact CD1-CG 4.14Å; Y188-M190 HydrophobicContact CE1-CG 4.17Å; M190-D192 VanDerWaalsContact C-N 3.3Å; M190-D192 PolarHBondContact O-N 2.92Å; M190-F193 HydrophobicContact CB-CB 3.79Å; M190-F193 HydrophobicContact CE-CB 3.61Å; M190-F193 HydrophobicContact CE-CD1 4.23Å; M190-F193 HydrophobicContact CE-CD2 3.34Å; M190-F193 HydrophobicContact CE-CE2 3.99Å; M190-F193 HydrophobicContact CE-CG 3.46Å; M190-F193 VanDerWaalsContact CE-CG 3.46Å; M190-F193 HydrophobicContact SD-CB 4.32Å; M190-F193 HydrophobicContact SD-CG 4.26Å; M190-F203 HydrophobicContact CE-CD1 4.37Å; M190-F203 HydrophobicContact CE-CE1 3.29Å; M190-F203 HydrophobicContact CE-CZ 3.84Å; M190-F203 HydrophobicContact SD-CD1 4.35Å; M190-F203 HydrophobicContact SD-CE1 3.34Å; M190-F203 WeakPolarHBondContact SD-CE1 3.28Å; M190-F203 HydrophobicContact SD-CZ 3.59Å; M190-F203 VanDerWaalsContact SD-CZ 3.59Å
191	N	78.8	Confident	81.2	Confident	104 Å²	104	76.1 Å²	76.1	56%	0.556	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.5	-23.8	-175.2	-68.6	-41.6	0	0	0	114.3	R147 Y189	R147-N191 WeakPolarHBondContact CD-OD1 3.47Å; R147-N191 PolarHBondContact NH1-OD1 2.99Å; Y189-N191 PolarHBondContact O-N 2.9Å
192	D	74.6	Confident	80.8	Confident	92 Å²	92	77 Å²	77	49%	0.492	42%	0.423	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.8	2.6	-174.3	60.4	-20	0	0	0	113.7	K169 Q177 M190	K169-D192 IonicContact NZ-OD1 2.9Å; K169-D192 PolarHBondContact NZ-OD1 3.29Å; K169-D192 IonicContact NZ-OD2 3.26Å; K169-D192 PolarHBondContact NZ-OD2 2.78Å; Q177-D192 PolarHBondContact OE1-OD2 2.78Å; M190-D192 VanDerWaalsContact C-N 3.3Å; M190-D192 PolarHBondContact O-N 2.92Å
193	F	69.8	Low	80.3	Confident	28 Å²	28	77 Å²	77	12%	0.123	42%	0.416	C	S	.	.			trans	-95.5	105.3	-174.4	-160.6	-94.5	0	0	0	111.1	P148 Y171 M190 T195 F203	P148-F193 HydrophobicContact CG-CD1 4.06Å; Y171-F193 HydrophobicContact CD1-CE2 4.38Å; Y171-F193 AromaticContact CD1-CZ 3.95Å; Y171-F193 HydrophobicContact CD1-CZ 3.95Å; Y171-F193 AromaticContact CE1-CE1 3.79Å; Y171-F193 HydrophobicContact CE1-CE1 3.79Å; Y171-F193 AromaticContact CE1-CE2 3.83Å; Y171-F193 HydrophobicContact CE1-CE2 3.83Å; Y171-F193 AromaticContact CE1-CZ 3.33Å; Y171-F193 HydrophobicContact CE1-CZ 3.33Å; Y171-F193 HydrophobicContact CE2-CE2 4.29Å; Y171-F193 AromaticContact CZ-CE2 3.74Å; Y171-F193 AromaticContact CZ-CZ 3.7Å; M190-F193 HydrophobicContact CB-CB 3.79Å; M190-F193 HydrophobicContact CE-CB 3.61Å; M190-F193 HydrophobicContact CE-CD1 4.23Å; M190-F193 HydrophobicContact CE-CD2 3.34Å; M190-F193 HydrophobicContact CE-CE2 3.99Å; M190-F193 HydrophobicContact CE-CG 3.46Å; M190-F193 VanDerWaalsContact CE-CG 3.46Å; M190-F193 HydrophobicContact SD-CB 4.32Å; M190-F193 HydrophobicContact SD-CG 4.26Å; F193-T195 HydrophobicContact CD1-CG2 4.32Å; F193-T195 HydrophobicContact CE1-CG2 4.32Å; F193-F203 HydrophobicContact CE1-CZ 4.24Å; F193-F203 HydrophobicContact CE2-CZ 4.35Å; F193-F203 AromaticContact CZ-CZ 4Å; F193-F203 HydrophobicContact CZ-CZ 4Å
194	Q	66.3	Low	80.2	Confident	154 Å²	154	80.3 Å²	80.3	72%	0.72	43%	0.432	S	S	*	.			trans	-93.9	104.5	175.6	-67.5	-172.1	-2.4	0	0	111	Y171 T196	Y171-Q194 VanDerWaalsContact OH-C 3.26Å; Y171-Q194 PolarHBondContact OH-N 2.85Å; Y171-Q194 PolarHBondContact OH-O 2.73Å; Q194-T196 PolarHBondContact O-N 3.45Å; Q194-T196 PolarHBondContact O-OG1 3.01Å
195	T	62.5	Low	80.2	Confident	102 Å²	102	75.5 Å²	75.5	63%	0.626	41%	0.407	S	S	*	.			trans	-58.9	104.4	173.5	54	0	0	0	0	109.5	F193	F193-T195 HydrophobicContact CD1-CG2 4.32Å; F193-T195 HydrophobicContact CE1-CG2 4.32Å
196	T	63.3	Low	80.2	Confident	71 Å²	71	73.4 Å²	73.4	44%	0.436	40%	0.396	S	S	.	.			trans	-91.3	134.1	172.9	-38.7	0	0	0	0	107.4	Q194 G198 M199	Q194-T196 PolarHBondContact O-N 3.45Å; Q194-T196 PolarHBondContact O-OG1 3.01Å; T196-G198 PolarHBondContact O-N 3.14Å; T196-M199 HydrophobicContact CG2-CE 4.46Å; T196-M199 PolarHBondContact O-N 2.67Å; T196-M199 VanDerWaalsContact O-N 3.12Å
197	E	67.1	Low	80.3	Confident	199 Å²	199	71 Å²	71	93%	0.93	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	128.9	-179.7	-158.1	172.5	-163.3	0	0	110.4
198	G	71.8	Confident	80.3	Confident	87 Å²	87	72.9 Å²	72.9	90%	0.897	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.1	-2	-178.5	0	0	0	0	0	116.4	T196	T196-G198 PolarHBondContact O-N 3.14Å
199	M	75.5	Confident	80.4	Confident	81 Å²	81	71.8 Å²	71.8	40%	0.399	38%	0.384	S	S	.	.	P	Polyproline II helix	trans	-95.6	131.7	172.1	-63.9	-168.9	-177.6	0	0	111.8	Y171 T196	Y171-M199 HydrophobicContact CD1-CB 3.63Å; Y171-M199 HydrophobicContact CD1-CG 4.47Å; Y171-M199 HydrophobicContact CD1-SD 4.08Å; Y171-M199 HydrophobicContact CD2-SD 4.25Å; Y171-M199 HydrophobicContact CE1-CB 4.12Å; Y171-M199 HydrophobicContact CE1-SD 4.42Å; Y171-M199 HydrophobicContact CG-CB 4.3Å; Y171-M199 HydrophobicContact CG-SD 4.01Å; T196-M199 HydrophobicContact CG2-CE 4.46Å; T196-M199 PolarHBondContact O-N 2.67Å; T196-M199 VanDerWaalsContact O-N 3.12Å
200	E	81.1	Confident	80.5	Confident	134 Å²	134	68.7 Å²	68.7	63%	0.626	39%	0.385	S	S	*	.	P	Polyproline II helix	trans	-84.8	117.8	173.3	-175.4	179.1	-166.4	0	0	109.9	Y171 S172	Y171-E200 WeakPolarHBondContact CA-O 3.42Å; S172-E200 PolarHBondContact N-O 3.05Å
201	G	80.5	Confident	80.7	Confident	30 Å²	30	76.6 Å²	76.6	31%	0.309	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	130.1	170.9	0	0	0	0	0	110.6	G170	G170-G201 WeakPolarHBondContact O-CA 3.38Å
202	V	86.2	Confident	81.2	Confident	37 Å²	37	75.2 Å²	75.2	22%	0.224	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	132.4	178.9	177.8	0	0	0	0	109.6	K169 G170 L176 I204	K169-V202 WeakPolarHBondContact CA-O 3.46Å; G170-V202 PolarHBondContact N-O 3.13Å; G170-V202 PolarHBondContact O-N 3.16Å; L176-V202 HydrophobicContact CD1-CG1 4.1Å; L176-V202 HydrophobicContact CD2-CB 4.1Å; L176-V202 HydrophobicContact CD2-CG1 4.33Å; V202-I204 HydrophobicContact CG1-CG1 4.28Å
203	F	85.9	Confident	81.9	Confident	50 Å²	50	75.6 Å²	75.6	22%	0.219	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	124.3	179.1	-58.5	-68.1	0	0	0	109.9	L140 L150 F168 K169 M190 F193 L205	L140-F203 HydrophobicContact CD1-CE2 4.4Å; L140-F203 HydrophobicContact CD2-CE2 3.95Å; L150-F203 HydrophobicContact CD2-CD1 4.39Å; F168-F203 WeakPolarHBondContact O-CA 3.34Å; K169-F203 HydrophobicContact CB-CD1 4.08Å; K169-F203 HydrophobicContact CB-CE1 4Å; M190-F203 HydrophobicContact CE-CD1 4.37Å; M190-F203 HydrophobicContact CE-CE1 3.29Å; M190-F203 HydrophobicContact CE-CZ 3.84Å; M190-F203 HydrophobicContact SD-CD1 4.35Å; M190-F203 HydrophobicContact SD-CE1 3.34Å; M190-F203 WeakPolarHBondContact SD-CE1 3.28Å; M190-F203 HydrophobicContact SD-CZ 3.59Å; M190-F203 VanDerWaalsContact SD-CZ 3.59Å; F193-F203 HydrophobicContact CE1-CZ 4.24Å; F193-F203 HydrophobicContact CE2-CZ 4.35Å; F193-F203 AromaticContact CZ-CZ 4Å; F193-F203 HydrophobicContact CZ-CZ 4Å; F203-L205 HydrophobicContact CB-CD1 4.06Å
204	I	88.6	Confident	82.8	Confident	78 Å²	78	74.3 Å²	74.3	40%	0.4	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	119.4	172.7	-49.2	174	0	0	0	106.9	I167 F168 L176 V202 F206	I167-I204 CarbonylContact C-O 3.59Å; I167-I204 WeakPolarHBondContact CA-O 3.44Å; F168-I204 HydrophobicContact CB-CB 4.15Å; F168-I204 HydrophobicContact CD2-CB 4.39Å; F168-I204 PolarHBondContact N-O 3.43Å; F168-I204 PolarHBondContact O-N 3.12Å; L176-I204 HydrophobicContact CD1-CD1 4.02Å; V202-I204 HydrophobicContact CG1-CG1 4.28Å; I204-F206 HydrophobicContact CG2-CD1 4.25Å; I204-F206 HydrophobicContact CG2-CE1 4.4Å
205	L	90.9	Very high	83.4	Confident	12 Å²	12	68.6 Å²	68.6	6%	0.063	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	139.8	-178.4	-52.4	79.6	0	0	0	109.6	I135 V138 L150 W152 I166 I167 F203	I135-L205 HydrophobicContact CD1-CB 3.73Å; V138-L205 HydrophobicContact CG1-CD1 3.94Å; V138-L205 HydrophobicContact CG1-CD2 4.38Å; L150-L205 HydrophobicContact CD1-CD1 4.46Å; L150-L205 HydrophobicContact CD1-CD2 4.45Å; L150-L205 HydrophobicContact CD2-CD1 4.03Å; L150-L205 HydrophobicContact CD2-CD2 3.57Å; L150-L205 HydrophobicContact CD2-CG 3.97Å; L150-L205 HydrophobicContact CG-CD2 3.94Å; W152-L205 HydrophobicContact CD2-CD2 3.98Å; W152-L205 HydrophobicContact CE3-CD2 3.62Å; W152-L205 HydrophobicContact CG-CD2 4.47Å; W152-L205 HydrophobicContact CZ3-CD2 4.13Å; I166-L205 WeakPolarHBondContact O-CA 3.34Å; I167-L205 HydrophobicContact CG1-CD2 4.44Å; I167-L205 HydrophobicContact CG1-CG 4.31Å; I167-L205 HydrophobicContact CG2-CG 4.47Å; F203-L205 HydrophobicContact CB-CD1 4.06Å
206	F	92.5	Very high	83.7	Confident	34 Å²	34	67.6 Å²	67.6	15%	0.149	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.6	151.8	169.7	48.9	-87.9	0	0	0	110.7	I166 F168 I204 F213 S214	I166-F206 HydrophobicContact CB-CD2 4.01Å; I166-F206 HydrophobicContact CB-CE1 4.3Å; I166-F206 HydrophobicContact CB-CE2 3.54Å; I166-F206 HydrophobicContact CB-CZ 3.69Å; I166-F206 HydrophobicContact CD1-CE2 3.65Å; I166-F206 HydrophobicContact CD1-CZ 4.21Å; I166-F206 HydrophobicContact CG1-CE2 4.04Å; I166-F206 HydrophobicContact CG2-CE1 4.06Å; I166-F206 HydrophobicContact CG2-CE2 3.89Å; I166-F206 HydrophobicContact CG2-CZ 3.49Å; I166-F206 VanDerWaalsContact CG2-CZ 3.49Å; I166-F206 PolarHBondContact N-O 3.04Å; I166-F206 PolarHBondContact O-N 2.98Å; I166-F206 VanDerWaalsContact O-N 3.09Å; F168-F206 AromaticContact CD2-CE1 3.76Å; F168-F206 HydrophobicContact CD2-CE1 3.76Å; F168-F206 HydrophobicContact CD2-CZ 4.23Å; F168-F206 AromaticContact CE2-CE1 3.57Å; F168-F206 HydrophobicContact CE2-CE1 3.57Å; F168-F206 AromaticContact CE2-CZ 3.62Å; F168-F206 HydrophobicContact CE2-CZ 3.62Å; I204-F206 HydrophobicContact CG2-CD1 4.25Å; I204-F206 HydrophobicContact CG2-CE1 4.4Å; F206-F213 HydrophobicContact CD2-CB 3.65Å; F206-F213 HydrophobicContact CD2-CG 4.41Å; F206-F213 HydrophobicContact CE2-CB 4.09Å; F206-F213 HydrophobicContact CG-CB 4.48Å; F206-S214 VanDerWaalsContact CB-O 3.22Å; F206-S214 WeakPolarHBondContact CB-O 3.35Å
207	N	94	Very high	83.8	Confident	8 Å²	8	65.8 Å²	65.8	4%	0.043	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	144.6	169.6	-64.9	-39.7	0	0	0	109.3	V132 P133 I135 S164 V165 F213 S214	V132-N207 HydrophobicContact CG1-CB 3.67Å; P133-N207 PolarHBondContact O-ND2 2.89Å; I135-N207 WeakPolarHBondContact CG1-ND2 3.41Å; S164-N207 CarbonylContact O-C 3.59Å; V165-N207 WeakPolarHBondContact CG2-OD1 3.38Å; N207-F213 CarbonylContact O-C 3.46Å; N207-F213 WeakPolarHBondContact O-CA 3.27Å; N207-S214 PolarHBondContact N-OG 3.41Å; N207-S214 PolarHBondContact O-N 2.91Å
208	K	94	Very high	83.3	Confident	79 Å²	79	66.9 Å²	66.9	34%	0.343	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	131.4	173.8	175.3	179.1	176.1	-59	0	109.7	D163 S164 I166 G210 R212	D163-K208 WeakPolarHBondContact CA-O 3.34Å; D163-K208 WeakPolarHBondContact CB-O 3.41Å; S164-K208 PolarHBondContact N-O 3.22Å; S164-K208 VanDerWaalsContact N-O 3.09Å; S164-K208 PolarHBondContact O-N 3.49Å; I166-K208 HydrophobicContact CD1-CB 4Å; I166-K208 HydrophobicContact CD1-CD 3.56Å; I166-K208 HydrophobicContact CD1-CG 4.36Å; I166-K208 HydrophobicContact CG1-CB 4.33Å; I166-K208 HydrophobicContact CG1-CD 4.49Å; K208-G210 VanDerWaalsContact CE-O 3.26Å; K208-G210 WeakPolarHBondContact CE-O 3.18Å; K208-G210 PolarHBondContact NZ-O 3.07Å; K208-R212 WeakPolarHBondContact CA-O 3.19Å
209	H	94	Very high	83.9	Confident	17 Å²	17	65.9 Å²	65.9	8%	0.079	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	112.4	173.9	171.5	62.8	0	0	0	108.9	K130 V132 E160 D163 D211 R212	K130-H209 PolarHBondContact NZ-NE2 3.17Å; V132-H209 HydrophobicContact CG1-CB 4.09Å; V132-H209 HydrophobicContact CG2-CB 3.84Å; E160-H209 IonicContact OE1-CE1 3.66Å; D163-H209 WeakPolarHBondContact OD1-CA 3.03Å; D163-H209 WeakPolarHBondContact OD1-CB 3.44Å; D163-H209 IonicContact OD1-CE1 3.84Å; D163-H209 IonicContact OD1-CG 3.1Å; D163-H209 IonicContact OD1-ND1 2.8Å; D163-H209 PolarHBondContact OD1-ND1 2.82Å; D163-H209 IonicContact OD2-CG 3.65Å; D163-H209 IonicContact OD2-ND1 3.78Å; D163-H209 PolarHBondContact OD2-ND1 3.48Å; H209-D211 PolarHBondContact O-N 3.01Å; H209-R212 PolarHBondContact N-O 3.21Å; H209-R212 WeakPolarHBondContact O-CA 3.21Å; H209-R212 WeakPolarHBondContact O-CB 3.14Å; H209-R212 PolarHBondContact O-N 3.08Å
210	G	89.8	Confident	84.3	Confident	43 Å²	43	65.1 Å²	65.1	44%	0.443	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.6	-124.4	-172	0	0	0	0	0	111.5	K208 R212	K208-G210 VanDerWaalsContact CE-O 3.26Å; K208-G210 WeakPolarHBondContact CE-O 3.18Å; K208-G210 PolarHBondContact NZ-O 3.07Å; G210-R212 VanDerWaalsContact C-N 3.31Å
211	D	87	Confident	84.5	Confident	169 Å²	169	61.2 Å²	61.2	90%	0.904	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.7	10.2	176.5	-58.5	-36.4	0	0	0	113.6	H209	H209-D211 PolarHBondContact O-N 3.01Å
212	R	89	Confident	84.7	Confident	75 Å²	75	63.1 Å²	63.1	28%	0.283	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	154.7	-177.3	-53.6	179	-173.3	-141.3	-6.9	110.6	Q34 K130 V132 K208 H209 G210	Q34-R212 VanDerWaalsContact OE1-NH2 3.08Å; K130-R212 VanDerWaalsContact CB-NH1 3.34Å; K130-R212 PolarHBondContact O-NH1 3.18Å; V132-R212 HydrophobicContact CG2-CB 3.64Å; K208-R212 WeakPolarHBondContact CA-O 3.19Å; H209-R212 PolarHBondContact N-O 3.21Å; H209-R212 WeakPolarHBondContact O-CA 3.21Å; H209-R212 WeakPolarHBondContact O-CB 3.14Å; H209-R212 PolarHBondContact O-N 3.08Å; G210-R212 VanDerWaalsContact C-N 3.31Å
213	F	90.1	Very high	84.6	Confident	100 Å²	100	64.7 Å²	64.7	44%	0.439	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	153.2	173	57.2	-83.4	0	0	0	110.6	L33 F206 N207 L215	L33-F213 HydrophobicContact CD2-CZ 4.37Å; F206-F213 HydrophobicContact CD2-CB 3.65Å; F206-F213 HydrophobicContact CD2-CG 4.41Å; F206-F213 HydrophobicContact CE2-CB 4.09Å; F206-F213 HydrophobicContact CG-CB 4.48Å; N207-F213 CarbonylContact O-C 3.46Å; N207-F213 WeakPolarHBondContact O-CA 3.27Å; F213-L215 HydrophobicContact CD2-CD2 4.08Å; F213-L215 HydrophobicContact CE2-CD2 3.54Å
214	S	88.2	Confident	84.5	Confident	1 Å²	1	65.7 Å²	65.7	1%	0.007	35%	0.346	C	S	.	.	P	Polyproline II helix	trans	-76.9	141.1	172.1	67.7	0	0	0	0	109.8	P133 F206 N207	P133-S214 WeakPolarHBondContact O-CB 3.48Å; F206-S214 VanDerWaalsContact CB-O 3.22Å; F206-S214 WeakPolarHBondContact CB-O 3.35Å; N207-S214 PolarHBondContact N-OG 3.41Å; N207-S214 PolarHBondContact O-N 2.91Å
215	L	78.9	Confident	84.2	Confident	34 Å²	34	64.8 Å²	64.8	18%	0.178	34%	0.342	C	S	.	.	P	Polyproline II helix	trans	-78.9	142.3	164.6	-61.2	-173.6	0	0	0	110.3	L33 E52 R134 F213	L33-L215 HydrophobicContact CD1-CD1 4.38Å; E52-L215 HydrophobicContact CB-CD1 3.6Å; E52-L215 HydrophobicContact CG-CD1 4.17Å; E52-L215 WeakPolarHBondContact O-CD1 3.33Å; R134-L215 WeakPolarHBondContact CG-O 3.3Å; F213-L215 HydrophobicContact CD2-CD2 4.08Å; F213-L215 HydrophobicContact CE2-CD2 3.54Å
216	P	69.7	Low	83.7	Confident	81 Å²	81	68.8 Å²	68.8	53%	0.526	36%	0.364	S	S	.	.	P	Polyproline II helix	trans	-63.3	139.9	174.3	26.6	-32.8	0	0	0	110.1
217	T	65.3	Low	83	Confident	33 Å²	33	71.8 Å²	71.8	20%	0.202	38%	0.382	C	S	.	.	P	Polyproline II helix	trans	-87	120.9	164.1	19.5	0	0	0	0	109	T54 I135	T54-T217 HydrophobicContact CG2-CG2 4.1Å; I135-T217 PolarHBondContact O-OG1 2.97Å
218	I	56	Low	82	Confident	221 Å²	221	77.5 Å²	77.5	100%	1.133	41%	0.413	S	S	*	.			trans	-84.6	0	167.9	-54.8	175.7	0	0	0	108.5

Retrieved 218 of 218 residues in 197.6 ms (Link to these results)

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