A0A5K4FAF5_SCHMA Loading...

Uncharacterized protein AlphaSync

AlphaFold DB , UniProt , Accession A0A5K4FAF5, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 503 aa.

Structure Viewer

Loading PAE data...

(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	35.1	Very low	50.4	Low	241 Å²	241	146.9 Å²	146.9	100%	1.187	73%	0.728	S	S	*	*				0	60.5	0	-162.6	177.4	-176.9	0	0	109.4
2	I	40.8	Very low	50.8	Low	178 Å²	178	145.8 Å²	145.8	91%	0.913	72%	0.716	S	S	*	*			trans	-150.8	82	164.7	-53.5	179.8	0	0	0	104.3
3	Q	40.3	Very low	51.2	Low	193 Å²	193	139.2 Å²	139.2	90%	0.902	70%	0.698	S	S	*	*			trans	-133	134.8	174.8	-154.5	175.6	2.7	0	0	105.6
4	S	48.3	Very low	51.4	Low	67 Å²	67	134.8 Å²	134.8	47%	0.469	68%	0.682	S	S	.	*			trans	87	68.9	176.1	-174	0	0	0	0	117.6
5	N	51.7	Low	51.6	Low	125 Å²	125	131.5 Å²	131.5	67%	0.668	67%	0.671	S	S	*	*	S	Bend	trans	-103.5	-16.8	148.6	-94.6	-3.1	0	0	0	113
6	E	54.9	Low	51.7	Low	168 Å²	168	129.4 Å²	129.4	79%	0.785	66%	0.661	S	S	*	*	H	α-helix	trans	-72.4	-33.3	-178.3	-70.7	-172.7	158.8	0	0	113.1	I8 F9 V10	E6-I8 VanDerWaalsContact C-N 3.31Å; E6-I8 PolarHBondContact O-N 3.18Å; E6-F9 PolarHBondContact O-N 3.06Å; E6-V10 PolarHBondContact O-N 3.3Å
7	H	53.5	Low	51.6	Low	139 Å²	139	125.1 Å²	125.1	64%	0.644	65%	0.649	S	S	*	*	H	α-helix	trans	-70.8	-23.8	178.9	-75.8	-69.7	0	0	0	114	F11	H7-F11 PolarHBondContact O-N 3.12Å
8	I	60.9	Low	51.2	Low	88 Å²	88	124.5 Å²	124.5	45%	0.451	65%	0.646	S	S	.	*	H	α-helix	trans	-73.1	-39.6	178.9	-65.3	172.9	0	0	0	110.2	E6 F11 F12	E6-I8 VanDerWaalsContact C-N 3.31Å; E6-I8 PolarHBondContact O-N 3.18Å; I8-F11 PolarHBondContact O-N 3.26Å; I8-F12 HydrophobicContact CG2-CD2 3.82Å; I8-F12 HydrophobicContact CG2-CE2 3.95Å; I8-F12 WeakPolarHBondContact O-CD2 3.39Å; I8-F12 PolarHBondContact O-N 2.91Å; I8-F12 VanDerWaalsContact O-N 3.09Å
9	F	54.6	Low	50.9	Low	168 Å²	168	121.3 Å²	121.3	74%	0.737	64%	0.64	S	S	*	*	H	α-helix	trans	-66.4	-39.6	179.4	-93.8	-82.9	0	0	0	112.8	E6 F12 A13	E6-F9 PolarHBondContact O-N 3.06Å; F9-F12 PolarHBondContact O-N 3.17Å; F9-A13 WeakPolarHBondContact O-CB 3.3Å; F9-A13 PolarHBondContact O-N 3.46Å
10	V	61.4	Low	50.5	Low	94 Å²	94	121.8 Å²	121.8	57%	0.57	64%	0.642	S	S	*	*	H	α-helix	trans	-65.9	-40	177.2	-178.6	0	0	0	0	111	E6 A13 V14	E6-V10 PolarHBondContact O-N 3.3Å; V10-A13 PolarHBondContact O-N 3.06Å; V10-V14 WeakPolarHBondContact O-CG2 3.21Å; V10-V14 PolarHBondContact O-N 3.47Å; V10-V14 VanDerWaalsContact O-N 3.13Å
11	F	53.5	Low	49.8	Very low	155 Å²	155	121.9 Å²	121.9	68%	0.68	64%	0.642	S	S	*	*	H	α-helix	trans	-65.1	-41.8	177.5	-109	-84.6	0	0	0	112.8	H7 I8 V14 V15	H7-F11 PolarHBondContact O-N 3.12Å; I8-F11 PolarHBondContact O-N 3.26Å; F11-V14 PolarHBondContact O-N 3.43Å; F11-V15 WeakPolarHBondContact O-CG2 3.39Å; F11-V15 PolarHBondContact O-N 3.26Å; F11-V15 VanDerWaalsContact O-N 3.1Å
12	F	55.2	Low	50	Low	134 Å²	134	118 Å²	118	59%	0.588	62%	0.621	S	S	*	*	H	α-helix	trans	-68	-37.4	177.4	-89.8	-79.3	0	0	0	112.6	I8 F9 V14 V15 I16	I8-F12 HydrophobicContact CG2-CD2 3.82Å; I8-F12 HydrophobicContact CG2-CE2 3.95Å; I8-F12 WeakPolarHBondContact O-CD2 3.39Å; I8-F12 PolarHBondContact O-N 2.91Å; I8-F12 VanDerWaalsContact O-N 3.09Å; F9-F12 PolarHBondContact O-N 3.17Å; F12-V14 PolarHBondContact O-N 2.97Å; F12-V15 PolarHBondContact O-N 3.43Å; F12-I16 WeakPolarHBondContact O-CB 3.37Å; F12-I16 VanDerWaalsContact O-CG1 3.25Å; F12-I16 WeakPolarHBondContact O-CG1 3.41Å; F12-I16 PolarHBondContact O-N 2.98Å
13	A	55.7	Low	49.9	Very low	59 Å²	59	114.6 Å²	114.6	49%	0.488	61%	0.609	S	S	.	*	H	α-helix	trans	-63.6	-40.6	176.5	0	0	0	0	0	112.2	F9 V10 I16 A17	F9-A13 WeakPolarHBondContact O-CB 3.3Å; F9-A13 PolarHBondContact O-N 3.46Å; V10-A13 PolarHBondContact O-N 3.06Å; A13-I16 PolarHBondContact O-N 3.43Å; A13-A17 WeakPolarHBondContact O-CB 3.42Å; A13-A17 PolarHBondContact O-N 3.48Å
14	V	53.4	Low	50.1	Low	78 Å²	78	111.2 Å²	111.2	47%	0.473	60%	0.601	S	S	.	*	H	α-helix	trans	-69.1	-38.9	178.3	174.3	0	0	0	0	111.7	V10 F11 F12 A17 L18	V10-V14 WeakPolarHBondContact O-CG2 3.21Å; V10-V14 PolarHBondContact O-N 3.47Å; V10-V14 VanDerWaalsContact O-N 3.13Å; F11-V14 PolarHBondContact O-N 3.43Å; F12-V14 PolarHBondContact O-N 2.97Å; V14-A17 PolarHBondContact O-N 2.97Å; V14-L18 HydrophobicContact CG1-CD1 3.87Å; V14-L18 WeakPolarHBondContact O-CB 3.48Å; V14-L18 WeakPolarHBondContact O-CG 3.24Å; V14-L18 PolarHBondContact O-N 3.24Å
15	V	55.6	Low	49.9	Very low	85 Å²	85	114.9 Å²	114.9	52%	0.515	62%	0.616	S	S	.	*	H	α-helix	trans	-68.5	-37.8	176.5	175.3	0	0	0	0	111.6	F11 F12 L18 A19	F11-V15 WeakPolarHBondContact O-CG2 3.39Å; F11-V15 PolarHBondContact O-N 3.26Å; F11-V15 VanDerWaalsContact O-N 3.1Å; F12-V15 PolarHBondContact O-N 3.43Å; V15-L18 PolarHBondContact O-N 3.34Å; V15-A19 WeakPolarHBondContact O-CB 3.43Å; V15-A19 PolarHBondContact O-N 3.29Å
16	I	52.6	Low	50	Low	99 Å²	99	111.1 Å²	111.1	51%	0.508	61%	0.606	S	S	.	*	H	α-helix	trans	-68.6	-39.5	175.9	-67.8	167.4	0	0	0	110.9	F12 A13 A19 L20	F12-I16 WeakPolarHBondContact O-CB 3.37Å; F12-I16 VanDerWaalsContact O-CG1 3.25Å; F12-I16 WeakPolarHBondContact O-CG1 3.41Å; F12-I16 PolarHBondContact O-N 2.98Å; A13-I16 PolarHBondContact O-N 3.43Å; I16-A19 PolarHBondContact O-N 2.8Å; I16-L20 HydrophobicContact CG2-CD1 3.81Å; I16-L20 WeakPolarHBondContact O-CB 3.45Å; I16-L20 PolarHBondContact O-N 2.87Å
17	A	49.1	Very low	49.7	Very low	56 Å²	56	111.9 Å²	111.9	46%	0.463	61%	0.609	S	S	.	*	H	α-helix	trans	-64.6	-38.6	174.3	0	0	0	0	0	112.3	A13 V14 L20 L21	A13-A17 WeakPolarHBondContact O-CB 3.42Å; A13-A17 PolarHBondContact O-N 3.48Å; V14-A17 PolarHBondContact O-N 2.97Å; A17-L20 PolarHBondContact O-N 2.67Å; A17-L21 PolarHBondContact O-N 3Å
18	L	45.1	Very low	49.7	Very low	114 Å²	114	115.3 Å²	115.3	60%	0.597	62%	0.618	S	S	*	*	H	α-helix	trans	-70.5	-30.9	174.3	-81.6	159.2	0	0	0	113	V14 V15	V14-L18 HydrophobicContact CG1-CD1 3.87Å; V14-L18 WeakPolarHBondContact O-CB 3.48Å; V14-L18 WeakPolarHBondContact O-CG 3.24Å; V14-L18 PolarHBondContact O-N 3.24Å; V15-L18 PolarHBondContact O-N 3.34Å
19	A	45.7	Very low	49.8	Very low	63 Å²	63	116.8 Å²	116.8	52%	0.521	63%	0.632	S	S	.	*	H	α-helix	trans	-76.3	-29.1	174.9	0	0	0	0	0	112.9	V15 I16 L21	V15-A19 WeakPolarHBondContact O-CB 3.43Å; V15-A19 PolarHBondContact O-N 3.29Å; I16-A19 PolarHBondContact O-N 2.8Å; A19-L21 VanDerWaalsContact C-N 3.33Å
20	L	42.4	Very low	50.7	Low	132 Å²	132	113 Å²	113	69%	0.691	62%	0.623	S	S	*	*	H	α-helix	trans	-80.4	-12.7	176.1	-80.2	160.8	0	0	0	113.7	I16 A17 H22	I16-L20 HydrophobicContact CG2-CD1 3.81Å; I16-L20 WeakPolarHBondContact O-CB 3.45Å; I16-L20 PolarHBondContact O-N 2.87Å; A17-L20 PolarHBondContact O-N 2.67Å; L20-H22 PolarHBondContact O-N 3.29Å
21	L	35.7	Very low	51.4	Low	123 Å²	123	113.1 Å²	113.1	64%	0.644	64%	0.635	S	S	*	*			trans	-72.3	59.5	158.9	-76	152.9	0	0	0	109.2	A17 A19 T23	A17-L21 PolarHBondContact O-N 3Å; A19-L21 VanDerWaalsContact C-N 3.33Å; L21-T23 PolarHBondContact O-N 3.48Å
22	H	40.3	Very low	53	Low	160 Å²	160	109.1 Å²	109.1	74%	0.741	62%	0.616	S	S	*	*			trans	-57.9	93.3	151.9	-85.8	-59.1	0	0	0	106.1	L20 V24	L20-H22 PolarHBondContact O-N 3.29Å; H22-V24 PolarHBondContact O-N 2.97Å
23	T	38.9	Very low	54.6	Low	106 Å²	106	106.2 Å²	106.2	65%	0.65	61%	0.606	S	S	*	*			trans	-43.1	101.3	169	41.3	0	0	0	0	109	L21 N25	L21-T23 PolarHBondContact O-N 3.48Å; T23-N25 PolarHBondContact O-N 3.29Å
24	V	43	Very low	56.4	Low	122 Å²	122	105.9 Å²	105.9	74%	0.739	59%	0.594	S	S	*	*			trans	-74	59.3	159.1	-169.7	0	0	0	0	106.6	H22 G26	H22-V24 PolarHBondContact O-N 2.97Å; V24-G26 PolarHBondContact O-N 3.09Å
25	N	45.6	Very low	58.3	Low	145 Å²	145	103.4 Å²	103.4	78%	0.775	58%	0.579	S	S	*	*			trans	-80.8	42.4	166.9	-83.6	-8.9	0	0	0	109.1	T23 Q27	T23-N25 PolarHBondContact O-N 3.29Å; N25-Q27 PolarHBondContact O-N 2.81Å; N25-Q27 VanDerWaalsContact O-N 3.14Å
26	G	53.2	Low	60.1	Low	45 Å²	45	100.9 Å²	100.9	46%	0.464	56%	0.563	S	S	.	*			trans	-74.6	100.2	169.4	0	0	0	0	0	107.5	V24 Y28	V24-G26 PolarHBondContact O-N 3.09Å; G26-Y28 PolarHBondContact O-N 2.97Å
27	Q	48.6	Very low	62	Low	184 Å²	184	98.8 Å²	98.8	86%	0.86	55%	0.552	S	S	*	*			trans	-58	107.4	166.9	-157.5	174.4	-1.2	0	0	106.9	N25 T29	N25-Q27 PolarHBondContact O-N 2.81Å; N25-Q27 VanDerWaalsContact O-N 3.14Å; Q27-T29 PolarHBondContact O-N 3.1Å
28	Y	53.4	Low	63.9	Low	212 Å²	212	99.5 Å²	99.5	83%	0.831	55%	0.55	S	S	*	.			trans	-63.6	101.9	-177.4	-72.3	-86.3	0	0	0	109.4	G26	G26-Y28 PolarHBondContact O-N 2.97Å
29	T	63.6	Low	65.9	Low	119 Å²	119	102.6 Å²	102.6	73%	0.73	56%	0.562	S	S	*	*	P	Polyproline II helix	trans	-81.8	128.3	170.2	53.6	0	0	0	0	108.7	Q27 A31	Q27-T29 PolarHBondContact O-N 3.1Å; T29-A31 PolarHBondContact O-N 2.96Å
30	P	71.9	Confident	67.6	Low	87 Å²	87	106.2 Å²	106.2	57%	0.565	57%	0.572	S	S	*	*	P	Polyproline II helix	trans	-53.3	134	174.3	-24.7	33	0	0	0	111.2	Y32	P30-Y32 HydrophobicContact CB-CE1 4.05Å; P30-Y32 HydrophobicContact CB-CE2 4.26Å
31	A	77.8	Confident	69.8	Low	98 Å²	98	102.4 Å²	102.4	81%	0.81	55%	0.553	S	S	*	*	P	Polyproline II helix	trans	-83.3	120.4	173.3	0	0	0	0	0	109.2	T29	T29-A31 PolarHBondContact O-N 2.96Å
32	Y	86.4	Confident	72.2	Confident	71 Å²	71	101.5 Å²	101.5	28%	0.278	55%	0.552	S	S	.	*	P	Polyproline II helix	trans	-100.5	141.2	178.1	-58.8	-64.4	0	0	0	110.3	P30 Q34 T35 R48 I50 E60	P30-Y32 HydrophobicContact CB-CE1 4.05Å; P30-Y32 HydrophobicContact CB-CE2 4.26Å; Y32-Q34 VanDerWaalsContact C-N 3.34Å; Y32-T35 HydrophobicContact CD2-CG2 4.17Å; Y32-T35 HydrophobicContact CG-CG2 4.2Å; Y32-R48 HydrophobicContact CD1-CB 4.09Å; Y32-R48 HydrophobicContact CD1-CG 4.49Å; Y32-R48 HydrophobicContact CG-CB 4.33Å; Y32-R48 HydrophobicContact CG-CG 4.49Å; Y32-R48 VanDerWaalsContact CZ-CD 3.45Å; Y32-R48 PolarHBondContact OH-NH1 3.03Å; Y32-I50 HydrophobicContact CD1-CG2 3.84Å; Y32-I50 HydrophobicContact CE1-CG2 3.9Å; Y32-E60 WeakPolarHBondContact CE1-OE2 3.28Å; Y32-E60 PolarHBondContact OH-OE2 3.04Å
33	L	89.4	Confident	74.4	Confident	72 Å²	72	100.3 Å²	100.3	38%	0.377	55%	0.551	S	S	.	*	S	Bend	trans	-68.7	-36.6	177.3	-70.8	175.9	0	0	0	111.7	V49 E52	L33-V49 HydrophobicContact CB-CB 4.11Å; L33-V49 HydrophobicContact CB-CG1 4.05Å; L33-V49 HydrophobicContact CD1-CG1 3.99Å; L33-V49 PolarHBondContact N-O 3.13Å; L33-E52 HydrophobicContact CD1-CB 3.92Å
34	Q	92.1	Very high	76.8	Confident	52 Å²	52	99.7 Å²	99.7	24%	0.243	54%	0.539	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.4	148.6	176.7	-173.4	62.9	30.1	0	0	109.7	Y32 R48 V49 M127 Y129 H212	Y32-Q34 VanDerWaalsContact C-N 3.34Å; Q34-R48 CarbonylContact O-C 3.47Å; Q34-R48 VanDerWaalsContact O-CA 3.28Å; Q34-R48 WeakPolarHBondContact O-CA 3.3Å; Q34-V49 HydrophobicContact CB-CB 4.25Å; Q34-V49 HydrophobicContact CB-CG2 4.04Å; Q34-V49 PolarHBondContact O-N 2.8Å; Q34-M127 HydrophobicContact CB-SD 4.18Å; Q34-M127 HydrophobicContact CG-CG 4.19Å; Q34-M127 HydrophobicContact CG-SD 3.86Å; Q34-Y129 HydrophobicContact CB-CD2 3.52Å; Q34-Y129 HydrophobicContact CB-CE2 3.97Å; Q34-Y129 HydrophobicContact CG-CD2 3.88Å; Q34-H212 PolarHBondContact OE1-CE1 3.36Å
35	T	93.6	Very high	79.2	Confident	27 Å²	27	94.6 Å²	94.6	17%	0.166	51%	0.508	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	163.3	172.4	72.7	0	0	0	0	110	Y32 M37 N45 R48	Y32-T35 HydrophobicContact CD2-CG2 4.17Å; Y32-T35 HydrophobicContact CG-CG2 4.2Å; T35-M37 VanDerWaalsContact C-N 3.28Å; T35-M37 VanDerWaalsContact OG1-CB 3.25Å; T35-M37 WeakPolarHBondContact OG1-CB 3.44Å; T35-M37 PolarHBondContact OG1-N 3.12Å; T35-N45 WeakPolarHBondContact CB-OD1 3.27Å; T35-R48 HydrophobicContact CG2-CB 4.36Å; T35-R48 HydrophobicContact CG2-CG 3.95Å
36	N	94.2	Very high	81.6	Confident	32 Å²	32	88.9 Å²	88.9	17%	0.171	48%	0.478	C	S	.	.			trans	-90.3	14.2	169.5	72.2	-23.6	0	0	0	113.9	K44 T46 F47 H126 M127	N36-K44 PolarHBondContact OD1-O 3.4Å; N36-T46 PolarHBondContact ND2-OG1 3.07Å; N36-T46 PolarHBondContact OD1-N 3.49Å; N36-F47 PolarHBondContact N-O 3.06Å; N36-F47 PolarHBondContact OD1-N 2.97Å; N36-F47 PolarHBondContact OD1-O 3.33Å; N36-H126 WeakPolarHBondContact CB-O 3.25Å; N36-H126 PolarHBondContact ND2-O 3.46Å; N36-M127 HydrophobicContact CB-CB 4.12Å; N36-M127 HydrophobicContact CB-CG 4.34Å
37	M	91.7	Very high	83.7	Confident	55 Å²	55	86.7 Å²	86.7	27%	0.271	46%	0.456	S	S	.	.			trans	-59.1	139.6	174.2	-176	161.6	64.5	0	0	111.2	T35 D41 T42 N45	T35-M37 VanDerWaalsContact C-N 3.28Å; T35-M37 VanDerWaalsContact OG1-CB 3.25Å; T35-M37 WeakPolarHBondContact OG1-CB 3.44Å; T35-M37 PolarHBondContact OG1-N 3.12Å; M37-D41 VanDerWaalsContact CG-O 3.24Å; M37-D41 WeakPolarHBondContact CG-O 3.23Å; M37-D41 VanDerWaalsContact SD-C 3.58Å; M37-T42 HydrophobicContact SD-CG2 4.23Å; M37-N45 HydrophobicContact CB-CB 4.01Å; M37-N45 HydrophobicContact CG-CB 4.43Å; M37-N45 HydrophobicContact SD-CB 4.36Å
38	V	89.3	Confident	85.9	Confident	70 Å²	70	79.2 Å²	79.2	42%	0.424	42%	0.42	S	S	.	.	S	Bend	trans	-110.4	130	174.9	-177.6	0	0	0	0	108.4	N40 D41 K44	V38-N40 VanDerWaalsContact C-N 3.29Å; V38-N40 PolarHBondContact O-N 2.96Å; V38-D41 WeakPolarHBondContact O-CB 3.26Å; V38-D41 PolarHBondContact O-N 3.48Å; V38-K44 HydrophobicContact CB-CD 3.67Å; V38-K44 HydrophobicContact CG2-CD 4.07Å
39	E	86.1	Confident	87.9	Confident	180 Å²	180	69.1 Å²	69.1	84%	0.841	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.9	39.1	174.4	-64.8	170.8	-177.6	0	0	114.4	D41	E39-D41 PolarHBondContact O-N 3.1Å; E39-D41 VanDerWaalsContact O-N 3.15Å
40	N	83	Confident	89.3	Confident	138 Å²	138	66.1 Å²	66.1	74%	0.738	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	60	15.4	-176.2	-72.5	-11.1	0	0	0	116	V38 T42	V38-N40 VanDerWaalsContact C-N 3.29Å; V38-N40 PolarHBondContact O-N 2.96Å; N40-T42 PolarHBondContact O-N 3.4Å
41	D	88.3	Confident	90.3	Very high	53 Å²	53	66.5 Å²	66.5	28%	0.283	35%	0.354	S	S	.	.			trans	-77.5	100.3	174.9	-178.2	3.2	0	0	0	111.4	M37 V38 E39 N43 K44	M37-D41 VanDerWaalsContact CG-O 3.24Å; M37-D41 WeakPolarHBondContact CG-O 3.23Å; M37-D41 VanDerWaalsContact SD-C 3.58Å; V38-D41 WeakPolarHBondContact O-CB 3.26Å; V38-D41 PolarHBondContact O-N 3.48Å; E39-D41 PolarHBondContact O-N 3.1Å; E39-D41 VanDerWaalsContact O-N 3.15Å; D41-N43 PolarHBondContact O-N 3.41Å; D41-N43 VanDerWaalsContact OD1-CB 3.27Å; D41-N43 WeakPolarHBondContact OD1-CB 3.38Å; D41-N43 PolarHBondContact OD1-N 2.93Å; D41-N43 PolarHBondContact OD1-ND2 3.42Å; D41-K44 HydrophobicContact CB-CD 4.1Å; D41-K44 HydrophobicContact CB-CG 4.27Å; D41-K44 PolarHBondContact O-N 3.27Å; D41-K44 VanDerWaalsContact OD2-CE 3.27Å; D41-K44 WeakPolarHBondContact OD2-CE 3.42Å; D41-K44 WeakPolarHBondContact OD2-CG 3.27Å; D41-K44 IonicContact OD2-NZ 3.94Å
42	T	86	Confident	90.8	Very high	104 Å²	104	62 Å²	62	64%	0.638	32%	0.316	S	S	*	.	G	3₁₀ helix	trans	-57.4	-23.1	-179.8	54.4	0	0	0	0	113.4	M37 N40 K44 N45	M37-T42 HydrophobicContact SD-CG2 4.23Å; N40-T42 PolarHBondContact O-N 3.4Å; T42-K44 VanDerWaalsContact C-N 3.26Å; T42-K44 PolarHBondContact O-N 3.49Å; T42-N45 WeakPolarHBondContact O-CB 3.15Å; T42-N45 PolarHBondContact O-N 3.02Å
43	N	86.7	Confident	90.9	Very high	134 Å²	134	62.6 Å²	62.6	72%	0.717	32%	0.321	S	S	*	.	G	3₁₀ helix	trans	-70.1	-24	176.6	-56.5	-60.5	0	0	0	112.8	D41 N45	D41-N43 PolarHBondContact O-N 3.41Å; D41-N43 VanDerWaalsContact OD1-CB 3.27Å; D41-N43 WeakPolarHBondContact OD1-CB 3.38Å; D41-N43 PolarHBondContact OD1-N 2.93Å; D41-N43 PolarHBondContact OD1-ND2 3.42Å; N43-N45 VanDerWaalsContact C-N 3.34Å
44	K	89.3	Confident	90.7	Very high	93 Å²	93	62.1 Å²	62.1	40%	0.404	32%	0.321	S	S	.	.	G	3₁₀ helix	trans	-85.9	-8.3	175.7	-65.9	176.9	-172.9	166.7	0	112.9	N36 V38 D41 T42 T46	N36-K44 PolarHBondContact OD1-O 3.4Å; V38-K44 HydrophobicContact CB-CD 3.67Å; V38-K44 HydrophobicContact CG2-CD 4.07Å; D41-K44 HydrophobicContact CB-CD 4.1Å; D41-K44 HydrophobicContact CB-CG 4.27Å; D41-K44 PolarHBondContact O-N 3.27Å; D41-K44 VanDerWaalsContact OD2-CE 3.27Å; D41-K44 WeakPolarHBondContact OD2-CE 3.42Å; D41-K44 WeakPolarHBondContact OD2-CG 3.27Å; D41-K44 IonicContact OD2-NZ 3.94Å; T42-K44 VanDerWaalsContact C-N 3.26Å; T42-K44 PolarHBondContact O-N 3.49Å; K44-T46 PolarHBondContact O-N 2.96Å
45	N	93.6	Very high	90.6	Very high	15 Å²	15	62.8 Å²	62.8	8%	0.08	34%	0.335	C	S	.	.			trans	-80	86.1	-178.6	-172.5	-1	0	0	0	111	T35 M37 T42 N43 R48 N62	T35-N45 WeakPolarHBondContact CB-OD1 3.27Å; M37-N45 HydrophobicContact CB-CB 4.01Å; M37-N45 HydrophobicContact CG-CB 4.43Å; M37-N45 HydrophobicContact SD-CB 4.36Å; T42-N45 WeakPolarHBondContact O-CB 3.15Å; T42-N45 PolarHBondContact O-N 3.02Å; N43-N45 VanDerWaalsContact C-N 3.34Å; N45-R48 PolarHBondContact ND2-NE 2.99Å; N45-R48 PolarHBondContact O-NH2 3.04Å; N45-R48 WeakPolarHBondContact OD1-CD 3.49Å; N45-R48 WeakPolarHBondContact OD1-CG 3.44Å; N45-R48 PolarHBondContact OD1-NE 3.43Å; N45-N62 PolarHBondContact O-ND2 3.24Å; N45-N62 PolarHBondContact O-OD1 3.3Å
46	T	95.6	Very high	90.5	Very high	25 Å²	25	61.8 Å²	61.8	15%	0.153	33%	0.33	C	S	.	.			trans	-108.3	-14.9	-177.6	67.4	0	0	0	0	114.6	N36 K44 W61 N62 Y125	N36-T46 PolarHBondContact ND2-OG1 3.07Å; N36-T46 PolarHBondContact OD1-N 3.49Å; K44-T46 PolarHBondContact O-N 2.96Å; T46-W61 CarbonylContact O-C 3.6Å; T46-W61 WeakPolarHBondContact O-CA 3.5Å; T46-W61 WeakPolarHBondContact O-CB 3.43Å; T46-N62 PolarHBondContact O-N 3.46Å; T46-Y125 HydrophobicContact CG2-CD1 4.26Å; T46-Y125 HydrophobicContact CG2-CE1 3.91Å; T46-Y125 WeakPolarHBondContact OG1-CD1 3.23Å; T46-Y125 VanDerWaalsContact OG1-CG 3.31Å
47	F	97.3	Very high	90.5	Very high	0 Å²	0	60.3 Å²	60.3	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	132.8	-177.3	-174.4	-139.6	0	0	0	111.1	N36 F59 E60 W61 L74 A110 Y125 M127	N36-F47 PolarHBondContact N-O 3.06Å; N36-F47 PolarHBondContact OD1-N 2.97Å; N36-F47 PolarHBondContact OD1-O 3.33Å; F47-F59 HydrophobicContact CD2-CB 4.35Å; F47-F59 HydrophobicContact CD2-CD1 4.42Å; F47-F59 HydrophobicContact CE1-CD1 4.04Å; F47-F59 HydrophobicContact CE1-CE1 4.23Å; F47-F59 HydrophobicContact CE2-CB 3.48Å; F47-F59 VanDerWaalsContact CE2-CB 3.48Å; F47-F59 AromaticContact CE2-CD1 3.53Å; F47-F59 HydrophobicContact CE2-CD1 3.53Å; F47-F59 HydrophobicContact CE2-CE1 4.45Å; F47-F59 AromaticContact CE2-CG 3.72Å; F47-F59 HydrophobicContact CE2-CG 3.72Å; F47-F59 HydrophobicContact CZ-CB 4.04Å; F47-F59 AromaticContact CZ-CD1 3.27Å; F47-F59 HydrophobicContact CZ-CD1 3.27Å; F47-F59 AromaticContact CZ-CE1 3.76Å; F47-F59 HydrophobicContact CZ-CE1 3.76Å; F47-F59 AromaticContact CZ-CG 3.73Å; F47-F59 HydrophobicContact CZ-CG 3.73Å; F47-E60 CarbonylContact C-O 3.58Å; F47-E60 WeakPolarHBondContact CA-O 3.27Å; F47-E60 WeakPolarHBondContact CD2-O 3.34Å; F47-W61 HydrophobicContact CD2-CB 3.98Å; F47-W61 HydrophobicContact CE2-CE3 4.25Å; F47-L74 HydrophobicContact CE2-CD2 3.85Å; F47-L74 HydrophobicContact CZ-CD2 3.95Å; F47-A110 HydrophobicContact CD2-CB 4.03Å; F47-A110 HydrophobicContact CE2-CB 3.78Å; F47-A110 HydrophobicContact CG-CB 4.5Å; F47-A110 HydrophobicContact CZ-CB 4.1Å; F47-Y125 HydrophobicContact CB-CG 4.44Å; F47-M127 HydrophobicContact CD1-CB 3.51Å; F47-M127 HydrophobicContact CD1-CE 3.81Å; F47-M127 HydrophobicContact CE1-CB 3.98Å; F47-M127 HydrophobicContact CE1-CE 3.8Å; F47-M127 HydrophobicContact CG-CB 4.46Å; F47-M127 HydrophobicContact CG-CE 4.26Å; F47-M127 HydrophobicContact CZ-CE 4.3Å
48	R	95.4	Very high	90.7	Very high	27 Å²	27	58.2 Å²	58.2	10%	0.102	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	145.1	-166.2	-49.1	178	-169.2	125.3	10.9	111.3	Y32 Q34 T35 N45 F59 E60 N62	Y32-R48 HydrophobicContact CD1-CB 4.09Å; Y32-R48 HydrophobicContact CD1-CG 4.49Å; Y32-R48 HydrophobicContact CG-CB 4.33Å; Y32-R48 HydrophobicContact CG-CG 4.49Å; Y32-R48 VanDerWaalsContact CZ-CD 3.45Å; Y32-R48 PolarHBondContact OH-NH1 3.03Å; Q34-R48 CarbonylContact O-C 3.47Å; Q34-R48 VanDerWaalsContact O-CA 3.28Å; Q34-R48 WeakPolarHBondContact O-CA 3.3Å; T35-R48 HydrophobicContact CG2-CB 4.36Å; T35-R48 HydrophobicContact CG2-CG 3.95Å; N45-R48 PolarHBondContact ND2-NE 2.99Å; N45-R48 PolarHBondContact O-NH2 3.04Å; N45-R48 WeakPolarHBondContact OD1-CD 3.49Å; N45-R48 WeakPolarHBondContact OD1-CG 3.44Å; N45-R48 PolarHBondContact OD1-NE 3.43Å; R48-F59 CarbonylContact O-C 3.21Å; R48-F59 WeakPolarHBondContact O-CA 3.31Å; R48-E60 PolarHBondContact N-O 3.23Å; R48-E60 IonicContact NH1-OE1 3.31Å; R48-E60 PolarHBondContact NH1-OE1 3.14Å; R48-E60 VanDerWaalsContact NH1-OE1 3.13Å; R48-E60 IonicContact NH1-OE2 2.6Å; R48-E60 PolarHBondContact O-N 3.07Å; R48-N62 PolarHBondContact NH2-OD1 3.22Å
49	V	94.6	Very high	91	Very high	0 Å²	0	54.9 Å²	54.9	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	119.2	161.5	-174	0	0	0	0	107.6	L33 Q34 F59 M127 Y129	L33-V49 HydrophobicContact CB-CB 4.11Å; L33-V49 HydrophobicContact CB-CG1 4.05Å; L33-V49 HydrophobicContact CD1-CG1 3.99Å; L33-V49 PolarHBondContact N-O 3.13Å; Q34-V49 HydrophobicContact CB-CB 4.25Å; Q34-V49 HydrophobicContact CB-CG2 4.04Å; Q34-V49 PolarHBondContact O-N 2.8Å; V49-F59 HydrophobicContact CG2-CD1 4.06Å; V49-F59 HydrophobicContact CG2-CE1 3.75Å; V49-M127 HydrophobicContact CB-CE 4.44Å; V49-M127 HydrophobicContact CG2-CE 3.36Å; V49-M127 HydrophobicContact CG2-SD 4.15Å; V49-Y129 HydrophobicContact CG2-CD2 4.33Å; V49-Y129 HydrophobicContact CG2-CG 4.25Å
50	I	93.5	Very high	91.5	Very high	55 Å²	55	48.6 Å²	48.6	28%	0.282	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	-28	178.7	65.7	175.8	0	0	0	111.8	Y32 A58 E60 I93	Y32-I50 HydrophobicContact CD1-CG2 3.84Å; Y32-I50 HydrophobicContact CE1-CG2 3.9Å; I50-A58 HydrophobicContact CD1-CB 4.16Å; I50-A58 HydrophobicContact CG1-CB 3.76Å; I50-A58 WeakPolarHBondContact CG1-O 3.34Å; I50-A58 PolarHBondContact N-O 3.36Å; I50-E60 HydrophobicContact CG2-CB 3.48Å; I50-E60 VanDerWaalsContact CG2-CB 3.48Å; I50-I93 HydrophobicContact CD1-CG2 3.89Å
51	H	91.6	Very high	92.2	Very high	96 Å²	96	42.1 Å²	42.1	44%	0.444	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.5	133.3	-178.6	-174.1	-178.5	0	0	0	110.3	A58	H51-A58 HydrophobicContact CB-CB 4.05Å; H51-A58 PolarHBondContact N-O 3.24Å; H51-A58 PolarHBondContact O-N 2.74Å
52	E	89.4	Confident	92.5	Very high	4 Å²	4	42 Å²	42	2%	0.019	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	133.4	168	177.3	-170.9	146.9	0	0	109.7	L33 M57 Y129 R131 R134 L215	L33-E52 HydrophobicContact CD1-CB 3.92Å; E52-M57 HydrophobicContact CG-CG 4.32Å; E52-Y129 VanDerWaalsContact OE2-CE1 3.31Å; E52-Y129 WeakPolarHBondContact OE2-CE1 3.31Å; E52-Y129 PolarHBondContact OE2-OH 3.49Å; E52-R131 WeakPolarHBondContact OE1-CD 3Å; E52-R134 IonicContact OE1-CZ 2.75Å; E52-R134 IonicContact OE1-NE 2.72Å; E52-R134 PolarHBondContact OE1-NE 2.94Å; E52-R134 IonicContact OE1-NH2 3.39Å; E52-R134 PolarHBondContact OE1-NH2 3.4Å; E52-L215 HydrophobicContact CB-CD1 3.59Å; E52-L215 HydrophobicContact CG-CD1 3.92Å; E52-L215 WeakPolarHBondContact O-CD1 3.41Å
53	Q	88.2	Confident	92.9	Very high	82 Å²	82	40.9 Å²	40.9	38%	0.383	22%	0.223	S	C	.	.			trans	-115.1	177.3	177.1	-58.5	-176.7	1.5	0	0	111	A55 A56 R134	Q53-A55 PolarHBondContact O-N 3.12Å; Q53-A55 VanDerWaalsContact O-N 3.13Å; Q53-A56 WeakPolarHBondContact CA-O 3.19Å; Q53-A56 HydrophobicContact CB-CB 4.37Å; Q53-A56 WeakPolarHBondContact CB-O 3.41Å; Q53-A56 PolarHBondContact N-O 2.87Å; Q53-R134 PolarHBondContact O-NH2 2.88Å
54	T	84.4	Confident	93.1	Very high	62 Å²	62	35.1 Å²	35.1	38%	0.38	19%	0.192	S	C	.	.	S	Bend	trans	-53.3	-38	-178.9	-51.3	0	0	0	0	113.6	I99 R134 T217	T54-I99 WeakPolarHBondContact O-CD1 3.21Å; T54-R134 VanDerWaalsContact CA-NH1 3.33Å; T54-R134 PolarHBondContact O-NH1 3Å; T54-T217 HydrophobicContact CG2-CG2 4.48Å
55	A	89.8	Confident	93.2	Very high	66 Å²	66	36.4 Å²	36.4	55%	0.545	21%	0.208	S	C	.	.	S	Bend	trans	-138.9	11.9	-178.5	0	0	0	0	0	113.6	Q53 E97 A98	Q53-A55 PolarHBondContact O-N 3.12Å; Q53-A55 VanDerWaalsContact O-N 3.13Å; A55-E97 CarbonylContact O-C 3.46Å; A55-E97 VanDerWaalsContact O-C 3.3Å; A55-A98 PolarHBondContact O-N 2.87Å
56	A	93	Very high	93.1	Very high	6 Å²	6	39.2 Å²	39.2	5%	0.05	22%	0.22	C	C	.	.			trans	-145	159.6	-176.2	0	0	0	0	0	111.4	Q53 L95 L96 E97	Q53-A56 WeakPolarHBondContact CA-O 3.19Å; Q53-A56 HydrophobicContact CB-CB 4.37Å; Q53-A56 WeakPolarHBondContact CB-O 3.41Å; Q53-A56 PolarHBondContact N-O 2.87Å; A56-L95 HydrophobicContact CB-CD1 3.84Å; A56-L95 HydrophobicContact CB-CD2 4.14Å; A56-L95 HydrophobicContact CB-CG 3.96Å; A56-L96 CarbonylContact C-O 3.58Å; A56-L96 WeakPolarHBondContact CA-O 3.41Å; A56-L96 WeakPolarHBondContact CB-O 3.49Å; A56-E97 HydrophobicContact CB-CG 4.46Å
57	M	93.9	Very high	92.8	Very high	1 Å²	1	47 Å²	47	1%	0.005	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	136.2	170.1	-66.1	-163.4	-69	0	0	110.8	E52 F59 L95 L96 I99 Y108 Y129	E52-M57 HydrophobicContact CG-CG 4.32Å; M57-F59 HydrophobicContact CB-CD2 4.3Å; M57-F59 HydrophobicContact CB-CE2 3.56Å; M57-F59 HydrophobicContact CB-CZ 3.85Å; M57-F59 HydrophobicContact CE-CE1 4.47Å; M57-F59 HydrophobicContact CE-CE2 4.25Å; M57-F59 HydrophobicContact CE-CZ 3.58Å; M57-F59 WeakPolarHBondContact O-CD2 3.34Å; M57-F59 HydrophobicContact SD-CZ 4.42Å; M57-L95 WeakPolarHBondContact O-CA 3.08Å; M57-L96 PolarHBondContact N-O 2.96Å; M57-L96 PolarHBondContact O-N 2.98Å; M57-I99 HydrophobicContact CG-CG2 3.99Å; M57-Y108 HydrophobicContact CE-CD1 3.88Å; M57-Y108 HydrophobicContact CE-CD2 4.26Å; M57-Y108 HydrophobicContact CE-CE1 3.1Å; M57-Y108 HydrophobicContact CE-CE2 3.59Å; M57-Y108 HydrophobicContact CE-CG 4.39Å; M57-Y108 WeakPolarHBondContact CE-OH 3.34Å; M57-Y129 HydrophobicContact CE-CD1 4.38Å; M57-Y129 HydrophobicContact SD-CD1 3.64Å; M57-Y129 HydrophobicContact SD-CE1 3.78Å
58	A	95.3	Very high	92.5	Very high	12 Å²	12	50.5 Å²	50.5	10%	0.099	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	134.2	171.1	0	0	0	0	0	109.5	I50 H51 G94 L95	I50-A58 HydrophobicContact CD1-CB 4.16Å; I50-A58 HydrophobicContact CG1-CB 3.76Å; I50-A58 WeakPolarHBondContact CG1-O 3.34Å; I50-A58 PolarHBondContact N-O 3.36Å; H51-A58 HydrophobicContact CB-CB 4.05Å; H51-A58 PolarHBondContact N-O 3.24Å; H51-A58 PolarHBondContact O-N 2.74Å; A58-G94 CarbonylContact C-O 3.58Å; A58-G94 WeakPolarHBondContact CA-O 3.24Å; A58-L95 HydrophobicContact CB-CD1 4.07Å
59	F	97	Very high	92.3	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	153.3	-180	-61.6	-92.8	0	0	0	110.9	F47 R48 V49 M57 W61 L74 I93 G94 L96 Y108 M127	F47-F59 HydrophobicContact CD2-CB 4.35Å; F47-F59 HydrophobicContact CD2-CD1 4.42Å; F47-F59 HydrophobicContact CE1-CD1 4.04Å; F47-F59 HydrophobicContact CE1-CE1 4.23Å; F47-F59 HydrophobicContact CE2-CB 3.48Å; F47-F59 VanDerWaalsContact CE2-CB 3.48Å; F47-F59 AromaticContact CE2-CD1 3.53Å; F47-F59 HydrophobicContact CE2-CD1 3.53Å; F47-F59 HydrophobicContact CE2-CE1 4.45Å; F47-F59 AromaticContact CE2-CG 3.72Å; F47-F59 HydrophobicContact CE2-CG 3.72Å; F47-F59 HydrophobicContact CZ-CB 4.04Å; F47-F59 AromaticContact CZ-CD1 3.27Å; F47-F59 HydrophobicContact CZ-CD1 3.27Å; F47-F59 AromaticContact CZ-CE1 3.76Å; F47-F59 HydrophobicContact CZ-CE1 3.76Å; F47-F59 AromaticContact CZ-CG 3.73Å; F47-F59 HydrophobicContact CZ-CG 3.73Å; R48-F59 CarbonylContact O-C 3.21Å; R48-F59 WeakPolarHBondContact O-CA 3.31Å; V49-F59 HydrophobicContact CG2-CD1 4.06Å; V49-F59 HydrophobicContact CG2-CE1 3.75Å; M57-F59 HydrophobicContact CB-CD2 4.3Å; M57-F59 HydrophobicContact CB-CE2 3.56Å; M57-F59 HydrophobicContact CB-CZ 3.85Å; M57-F59 HydrophobicContact CE-CE1 4.47Å; M57-F59 HydrophobicContact CE-CE2 4.25Å; M57-F59 HydrophobicContact CE-CZ 3.58Å; M57-F59 WeakPolarHBondContact O-CD2 3.34Å; M57-F59 HydrophobicContact SD-CZ 4.42Å; F59-W61 HydrophobicContact CB-CE3 4.43Å; F59-W61 HydrophobicContact CB-CZ3 4.41Å; F59-L74 HydrophobicContact CB-CD1 4.47Å; F59-L74 HydrophobicContact CB-CD2 4.2Å; F59-L74 HydrophobicContact CD2-CD1 4.01Å; F59-L74 HydrophobicContact CD2-CD2 4.34Å; F59-L74 HydrophobicContact CG-CD2 4.37Å; F59-I93 VanDerWaalsContact O-CA 3.25Å; F59-I93 WeakPolarHBondContact O-CA 3.48Å; F59-G94 PolarHBondContact N-O 3.04Å; F59-G94 PolarHBondContact O-N 2.85Å; F59-L96 HydrophobicContact CD2-CB 4.4Å; F59-L96 HydrophobicContact CE2-CB 3.89Å; F59-L96 HydrophobicContact CE2-CD2 4.23Å; F59-Y108 HydrophobicContact CE1-CD1 4.21Å; F59-Y108 AromaticContact CE1-CG 3.97Å; F59-Y108 HydrophobicContact CE1-CG 3.97Å; F59-Y108 HydrophobicContact CE2-CD1 4.33Å; F59-Y108 AromaticContact CZ-CD1 3.49Å; F59-Y108 HydrophobicContact CZ-CD1 3.49Å; F59-Y108 VanDerWaalsContact CZ-CD1 3.49Å; F59-Y108 HydrophobicContact CZ-CD2 4.44Å; F59-Y108 HydrophobicContact CZ-CE1 4.05Å; F59-Y108 AromaticContact CZ-CG 3.73Å; F59-Y108 HydrophobicContact CZ-CG 3.73Å; F59-M127 HydrophobicContact CD1-CE 3.68Å; F59-M127 HydrophobicContact CE1-CE 3.61Å
60	E	96.4	Very high	92.1	Very high	47 Å²	47	51.8 Å²	51.8	22%	0.22	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	141.6	166.8	-176.3	-166.7	170.1	0	0	108.7	Y32 F47 R48 I50 N92 I93	Y32-E60 WeakPolarHBondContact CE1-OE2 3.28Å; Y32-E60 PolarHBondContact OH-OE2 3.04Å; F47-E60 CarbonylContact C-O 3.58Å; F47-E60 WeakPolarHBondContact CA-O 3.27Å; F47-E60 WeakPolarHBondContact CD2-O 3.34Å; R48-E60 PolarHBondContact N-O 3.23Å; R48-E60 IonicContact NH1-OE1 3.31Å; R48-E60 PolarHBondContact NH1-OE1 3.14Å; R48-E60 VanDerWaalsContact NH1-OE1 3.13Å; R48-E60 IonicContact NH1-OE2 2.6Å; R48-E60 PolarHBondContact O-N 3.07Å; I50-E60 HydrophobicContact CG2-CB 3.48Å; I50-E60 VanDerWaalsContact CG2-CB 3.48Å; E60-N92 CarbonylContact C-O 3.56Å; E60-N92 VanDerWaalsContact CA-O 3.25Å; E60-N92 WeakPolarHBondContact CA-O 3.41Å; E60-I93 HydrophobicContact CB-CG1 4.29Å; E60-I93 HydrophobicContact CG-CG1 4.12Å
61	W	96.3	Very high	92.1	Very high	2 Å²	2	49.8 Å²	49.8	1%	0.008	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	158.9	172.7	54.6	93.3	0	0	0	112.1	T46 F47 F59 V72 L74 V88 G91 N92 I93 G94 A110 Y125	T46-W61 CarbonylContact O-C 3.6Å; T46-W61 WeakPolarHBondContact O-CA 3.5Å; T46-W61 WeakPolarHBondContact O-CB 3.43Å; F47-W61 HydrophobicContact CD2-CB 3.98Å; F47-W61 HydrophobicContact CE2-CE3 4.25Å; F59-W61 HydrophobicContact CB-CE3 4.43Å; F59-W61 HydrophobicContact CB-CZ3 4.41Å; W61-V72 HydrophobicContact CH2-CG1 4.39Å; W61-V72 HydrophobicContact CZ2-CB 3.91Å; W61-V72 HydrophobicContact CZ2-CG1 3.89Å; W61-V72 HydrophobicContact CZ2-CG2 4.04Å; W61-L74 HydrophobicContact CE3-CD2 4.05Å; W61-L74 HydrophobicContact CH2-CD1 4.46Å; W61-L74 HydrophobicContact CH2-CD2 4.39Å; W61-L74 HydrophobicContact CH2-CG 4.46Å; W61-L74 HydrophobicContact CZ3-CD1 4.06Å; W61-L74 HydrophobicContact CZ3-CD2 3.7Å; W61-L74 HydrophobicContact CZ3-CG 4.14Å; W61-V88 HydrophobicContact CH2-CB 4.14Å; W61-V88 HydrophobicContact CH2-CG1 3.97Å; W61-V88 HydrophobicContact CH2-CG2 4.07Å; W61-V88 HydrophobicContact CZ2-CB 4.44Å; W61-V88 HydrophobicContact CZ2-CG1 4.2Å; W61-G91 VanDerWaalsContact CZ2-O 3.3Å; W61-G91 WeakPolarHBondContact CZ2-O 3.38Å; W61-G91 PolarHBondContact NE1-O 3.19Å; W61-N92 PolarHBondContact N-O 2.93Å; W61-N92 WeakPolarHBondContact O-CB 3.37Å; W61-I93 VanDerWaalsContact CH2-C 3.41Å; W61-G94 VanDerWaalsContact CZ3-N 3.35Å; W61-A110 HydrophobicContact CD2-CB 4.48Å; W61-A110 HydrophobicContact CG-CB 4.48Å; W61-Y125 HydrophobicContact CB-CD2 3.89Å; W61-Y125 HydrophobicContact CB-CE2 4.11Å
62	N	94.8	Very high	92.3	Very high	51 Å²	51	45.2 Å²	45.2	27%	0.273	25%	0.25	S	C	.	.	P	Polyproline II helix	trans	-65.2	139.1	170.4	-74.2	-2.9	0	0	0	109.8	N45 T46 R48 M64 Y125	N45-N62 PolarHBondContact O-ND2 3.24Å; N45-N62 PolarHBondContact O-OD1 3.3Å; T46-N62 PolarHBondContact O-N 3.46Å; R48-N62 PolarHBondContact NH2-OD1 3.22Å; N62-M64 PolarHBondContact O-N 3.15Å; N62-Y125 HydrophobicContact CB-CE2 4.45Å; N62-Y125 WeakPolarHBondContact O-CE2 3.15Å
63	P	94	Very high	92.6	Very high	81 Å²	81	48.1 Å²	48.1	53%	0.526	26%	0.261	S	S	.	.	P	Polyproline II helix	trans	-50.1	129.8	-179.9	-11.4	9.9	0	0	0	112.4	N92	P63-N92 WeakPolarHBondContact CA-OD1 3.33Å; P63-N92 WeakPolarHBondContact CG-ND2 3.27Å
64	M	92.7	Very high	93.1	Very high	13 Å²	13	44.3 Å²	44.3	6%	0.064	24%	0.243	C	C	.	.	P	Polyproline II helix	trans	-95.2	128.9	175.7	-64.1	179.9	-176	0	0	108.9	N62 F69 V72 A110 G112 F122 Y125	N62-M64 PolarHBondContact O-N 3.15Å; M64-F69 HydrophobicContact CB-CE2 4.33Å; M64-V72 HydrophobicContact CE-CG1 4.45Å; M64-V72 HydrophobicContact SD-CG2 3.93Å; M64-A110 HydrophobicContact CE-CB 3.83Å; M64-A110 WeakPolarHBondContact CE-O 3.37Å; M64-G112 WeakPolarHBondContact SD-CA 3.34Å; M64-G112 PolarHBondContact SD-N 3.41Å; M64-G112 VanDerWaalsContact SD-N 3.39Å; M64-F122 HydrophobicContact CB-CE2 4.04Å; M64-F122 HydrophobicContact CB-CZ 4.22Å; M64-Y125 HydrophobicContact CE-CD2 3.3Å; M64-Y125 HydrophobicContact CE-CE2 3.39Å; M64-Y125 HydrophobicContact CE-CG 4.13Å; M64-Y125 HydrophobicContact CG-CE2 3.88Å; M64-Y125 HydrophobicContact SD-CE2 4.49Å
65	T	90.6	Very high	93.6	Very high	120 Å²	120	41.5 Å²	41.5	74%	0.736	23%	0.226	S	C	*	.			trans	-115.7	128.7	-178	55.3	0	0	0	0	110.8
66	H	90.5	Very high	94	Very high	73 Å²	73	39.2 Å²	39.2	34%	0.338	20%	0.204	S	C	.	.			trans	-156	142.2	175.7	-170.8	-85.8	0	0	0	109.1	N68 F69 F122	H66-N68 VanDerWaalsContact C-N 3.27Å; H66-N68 PolarHBondContact ND1-N 2.93Å; H66-N68 PolarHBondContact O-N 3.02Å; H66-F69 WeakPolarHBondContact O-CB 3.41Å; H66-F69 PolarHBondContact O-N 3.4Å; H66-F122 HydrophobicContact CB-CD1 3.84Å; H66-F122 HydrophobicContact CB-CD2 3.8Å; H66-F122 HydrophobicContact CB-CE1 3.68Å; H66-F122 HydrophobicContact CB-CE2 3.69Å; H66-F122 HydrophobicContact CB-CG 3.92Å; H66-F122 HydrophobicContact CB-CZ 3.64Å; H66-F122 VanDerWaalsContact CD2-CB 3.49Å; H66-F122 WeakPolarHBondContact CD2-CB 3.3Å; H66-F122 AromaticContact CD2-CD1 3.8Å; H66-F122 AromaticContact CD2-CD2 3.85Å; H66-F122 AromaticContact CD2-CG 3.43Å; H66-F122 VanDerWaalsContact CD2-CG 3.43Å; H66-F122 WeakPolarHBondContact CD2-CG 3.46Å; H66-F122 AromaticContact CG-CD1 3.69Å; H66-F122 AromaticContact CG-CG 3.73Å
67	E	90.3	Very high	93.9	Very high	188 Å²	188	42 Å²	42	88%	0.879	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.6	-43.7	-175.5	-65.2	-177.7	168.6	0	0	112.3
68	N	90.6	Very high	93.7	Very high	75 Å²	75	44.1 Å²	44.1	40%	0.401	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.9	42.4	176.9	-61.7	-24.5	0	0	0	112.2	H66 G70 S114 K115 N116	H66-N68 VanDerWaalsContact C-N 3.27Å; H66-N68 PolarHBondContact ND1-N 2.93Å; H66-N68 PolarHBondContact O-N 3.02Å; N68-G70 PolarHBondContact O-N 3.21Å; N68-S114 CarbonylContact O-C 3.28Å; N68-S114 WeakPolarHBondContact O-CA 3.45Å; N68-K115 PolarHBondContact O-N 3.35Å; N68-N116 WeakPolarHBondContact CB-OD1 3.25Å; N68-N116 PolarHBondContact ND2-OD1 3.13Å
69	F	91.4	Very high	93.2	Very high	48 Å²	48	50.8 Å²	50.8	21%	0.211	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-51.8	124.2	-179.2	178.2	-86.9	0	0	0	111.8	M64 H66 V72 K115 F122	M64-F69 HydrophobicContact CB-CE2 4.33Å; H66-F69 WeakPolarHBondContact O-CB 3.41Å; H66-F69 PolarHBondContact O-N 3.4Å; F69-V72 HydrophobicContact CE2-CG2 4.06Å; F69-V72 HydrophobicContact CZ-CG2 3.93Å; F69-K115 WeakPolarHBondContact O-CD 3.28Å; F69-K115 PolarHBondContact O-NZ 3.23Å; F69-F122 HydrophobicContact CD2-CE1 4.21Å; F69-F122 AromaticContact CD2-CZ 3.73Å; F69-F122 HydrophobicContact CD2-CZ 3.73Å; F69-F122 HydrophobicContact CE2-CZ 4.17Å
70	G	90.8	Very high	92.6	Very high	6 Å²	6	60.2 Å²	60.2	6%	0.062	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	-70.2	-178.3	0	0	0	0	0	113.2	N68 H113 K115	N68-G70 PolarHBondContact O-N 3.21Å; G70-H113 WeakPolarHBondContact CA-O 3.27Å; G70-H113 PolarHBondContact N-O 2.83Å; G70-K115 WeakPolarHBondContact O-CE 3.06Å; G70-K115 PolarHBondContact O-NZ 3.46Å
71	Y	93.6	Very high	91.9	Very high	13 Å²	13	67.6 Å²	67.6	5%	0.051	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-166.6	169.3	-172.7	53	-96.7	0	0	0	109.4	Y73 K87 V88 H113 N119	Y71-Y73 HydrophobicContact CD2-CD2 4.19Å; Y71-Y73 HydrophobicContact CD2-CE2 4.18Å; Y71-Y73 AromaticContact CE2-CD2 3.5Å; Y71-Y73 HydrophobicContact CE2-CD2 3.5Å; Y71-Y73 HydrophobicContact CE2-CE1 4.48Å; Y71-Y73 AromaticContact CE2-CE2 3.22Å; Y71-Y73 HydrophobicContact CE2-CE2 3.22Å; Y71-Y73 HydrophobicContact CE2-CG 4.22Å; Y71-Y73 AromaticContact CE2-CZ 3.74Å; Y71-Y73 AromaticContact CZ-CE2 3.86Å; Y71-K87 HydrophobicContact CD1-CD 4.38Å; Y71-K87 VanDerWaalsContact CD1-NZ 3.31Å; Y71-K87 HydrophobicContact CD2-CD 4.12Å; Y71-K87 HydrophobicContact CD2-CG 3.91Å; Y71-K87 VanDerWaalsContact CE1-NZ 3.3Å; Y71-K87 HydrophobicContact CE2-CD 4.45Å; Y71-K87 HydrophobicContact CG-CD 4.1Å; Y71-K87 HydrophobicContact CG-CG 4.04Å; Y71-V88 WeakPolarHBondContact CA-O 3.48Å; Y71-V88 VanDerWaalsContact CB-O 3.27Å; Y71-V88 WeakPolarHBondContact CB-O 3.16Å; Y71-H113 HydrophobicContact CD2-CB 4Å; Y71-H113 HydrophobicContact CE1-CB 4.32Å; Y71-H113 HydrophobicContact CE2-CB 3.46Å; Y71-H113 VanDerWaalsContact CE2-CB 3.46Å; Y71-H113 AromaticContact CE2-CG 3.81Å; Y71-H113 PolarHBondContact N-O 3.08Å; Y71-H113 PolarHBondContact O-N 3.21Å; Y71-N119 PolarHBondContact OH-ND2 2.92Å; Y71-N119 VanDerWaalsContact OH-ND2 3.09Å
72	V	95.9	Very high	91.5	Very high	0 Å²	0	73.2 Å²	73.2	0%	0	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	132.3	170	178.7	0	0	0	0	109.9	W61 M64 F69 V88 A110 E111	W61-V72 HydrophobicContact CH2-CG1 4.39Å; W61-V72 HydrophobicContact CZ2-CB 3.91Å; W61-V72 HydrophobicContact CZ2-CG1 3.89Å; W61-V72 HydrophobicContact CZ2-CG2 4.04Å; M64-V72 HydrophobicContact CE-CG1 4.45Å; M64-V72 HydrophobicContact SD-CG2 3.93Å; F69-V72 HydrophobicContact CE2-CG2 4.06Å; F69-V72 HydrophobicContact CZ-CG2 3.93Å; V72-V88 PolarHBondContact N-O 2.98Å; V72-V88 PolarHBondContact O-N 3.26Å; V72-A110 HydrophobicContact CG1-CB 4.09Å; V72-E111 CarbonylContact C-O 3.57Å; V72-E111 WeakPolarHBondContact CA-O 3.41Å
73	Y	95.7	Very high	91.4	Very high	65 Å²	65	74.1 Å²	74.1	26%	0.255	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	124.8	163.1	-84.3	-58.6	0	0	0	109.8	Y71 A86 K87 A110 E111 H113	Y71-Y73 HydrophobicContact CD2-CD2 4.19Å; Y71-Y73 HydrophobicContact CD2-CE2 4.18Å; Y71-Y73 AromaticContact CE2-CD2 3.5Å; Y71-Y73 HydrophobicContact CE2-CD2 3.5Å; Y71-Y73 HydrophobicContact CE2-CE1 4.48Å; Y71-Y73 AromaticContact CE2-CE2 3.22Å; Y71-Y73 HydrophobicContact CE2-CE2 3.22Å; Y71-Y73 HydrophobicContact CE2-CG 4.22Å; Y71-Y73 AromaticContact CE2-CZ 3.74Å; Y71-Y73 AromaticContact CZ-CE2 3.86Å; Y73-A86 WeakPolarHBondContact CA-O 3.13Å; Y73-K87 HydrophobicContact CD1-CB 4.04Å; Y73-K87 HydrophobicContact CE1-CB 3.68Å; Y73-K87 HydrophobicContact CE1-CD 4.37Å; Y73-K87 HydrophobicContact CE1-CG 4.18Å; Y73-A110 CarbonylContact O-C 3.56Å; Y73-A110 WeakPolarHBondContact O-CA 3.21Å; Y73-E111 PolarHBondContact N-O 3.04Å; Y73-E111 PolarHBondContact O-N 2.83Å; Y73-H113 AromaticContact CD2-CD2 3.74Å; Y73-H113 AromaticContact CD2-NE2 3.78Å
74	L	97.4	Very high	91.4	Very high	1 Å²	1	72.9 Å²	72.9	1%	0.005	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	129.6	158.5	-68.2	176.4	0	0	0	108.2	F47 F59 W61 T85 A86 V88 L96 R109 A110	F47-L74 HydrophobicContact CE2-CD2 3.85Å; F47-L74 HydrophobicContact CZ-CD2 3.95Å; F59-L74 HydrophobicContact CB-CD1 4.47Å; F59-L74 HydrophobicContact CB-CD2 4.2Å; F59-L74 HydrophobicContact CD2-CD1 4.01Å; F59-L74 HydrophobicContact CD2-CD2 4.34Å; F59-L74 HydrophobicContact CG-CD2 4.37Å; W61-L74 HydrophobicContact CE3-CD2 4.05Å; W61-L74 HydrophobicContact CH2-CD1 4.46Å; W61-L74 HydrophobicContact CH2-CD2 4.39Å; W61-L74 HydrophobicContact CH2-CG 4.46Å; W61-L74 HydrophobicContact CZ3-CD1 4.06Å; W61-L74 HydrophobicContact CZ3-CD2 3.7Å; W61-L74 HydrophobicContact CZ3-CG 4.14Å; L74-T85 CarbonylContact O-C 3.47Å; L74-T85 WeakPolarHBondContact O-CA 3.37Å; L74-A86 HydrophobicContact CB-CB 4.41Å; L74-A86 PolarHBondContact N-O 3.18Å; L74-A86 PolarHBondContact O-N 2.86Å; L74-V88 HydrophobicContact CD1-CG2 4.04Å; L74-V88 HydrophobicContact CG-CG2 4.21Å; L74-L96 HydrophobicContact CB-CB 4.28Å; L74-L96 HydrophobicContact CB-CD1 4.41Å; L74-L96 HydrophobicContact CD1-CB 4.41Å; L74-R109 CarbonylContact C-O 3.54Å; L74-R109 WeakPolarHBondContact CA-O 3.42Å; L74-A110 HydrophobicContact CD2-CB 4.07Å
75	V	96.8	Very high	91.5	Very high	4 Å²	4	76 Å²	76	2%	0.024	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	130.7	-175	-171.3	0	0	0	0	109	D83 T84 T85 Y108 R109 E111	V75-D83 HydrophobicContact CG1-CB 3.68Å; V75-T84 CarbonylContact C-O 3.6Å; V75-T84 WeakPolarHBondContact CA-O 3.36Å; V75-T85 HydrophobicContact CB-CG2 4.48Å; V75-T85 HydrophobicContact CG1-CG2 4.05Å; V75-T85 HydrophobicContact CG2-CG2 4.08Å; V75-Y108 CarbonylContact O-C 3.52Å; V75-Y108 WeakPolarHBondContact O-CA 3.34Å; V75-R109 HydrophobicContact CB-CB 4.24Å; V75-R109 PolarHBondContact N-O 2.96Å; V75-R109 PolarHBondContact O-N 3.19Å; V75-E111 HydrophobicContact CG2-CG 4.46Å
76	Q	96.1	Very high	91.7	Very high	17 Å²	17	71.4 Å²	71.4	8%	0.079	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	122.1	159.7	-179.2	-178.2	-4.5	0	0	108.2	V78 D83 T84 L96 A98 Y108	Q76-V78 HydrophobicContact CG-CG2 4.46Å; Q76-V78 PolarHBondContact O-N 2.6Å; Q76-D83 WeakPolarHBondContact O-CA 3.19Å; Q76-D83 WeakPolarHBondContact O-CB 3.21Å; Q76-T84 PolarHBondContact N-O 3.32Å; Q76-T84 PolarHBondContact O-N 3.09Å; Q76-T84 VanDerWaalsContact O-N 3.09Å; Q76-L96 HydrophobicContact CB-CD2 3.85Å; Q76-A98 HydrophobicContact CB-CB 4.16Å; Q76-Y108 HydrophobicContact CB-CD1 3.82Å; Q76-Y108 HydrophobicContact CB-CE1 3.51Å; Q76-Y108 HydrophobicContact CG-CD1 4.1Å; Q76-Y108 HydrophobicContact CG-CE1 3.45Å; Q76-Y108 VanDerWaalsContact CG-CE1 3.45Å; Q76-Y108 PolarHBondContact NE2-OH 3.23Å
77	E	92.3	Very high	91.9	Very high	65 Å²	65	74 Å²	74	30%	0.304	35%	0.353	S	S	.	.			trans	-73.6	125.2	175.1	-58.7	-178.4	167.4	0	0	109.7	D83 N107 R109	E77-D83 VanDerWaalsContact CA-OD1 3.31Å; E77-D83 WeakPolarHBondContact CA-OD1 3.37Å; E77-N107 HydrophobicContact CB-CB 4.09Å; E77-N107 HydrophobicContact CG-CB 4.07Å; E77-N107 PolarHBondContact N-O 3.32Å; E77-N107 VanDerWaalsContact OE2-CB 3.26Å; E77-N107 WeakPolarHBondContact OE2-CB 3.41Å; E77-N107 PolarHBondContact OE2-ND2 2.84Å; E77-R109 WeakPolarHBondContact OE1-CD 3.21Å; E77-R109 IonicContact OE1-NH1 2.94Å
78	V	88.9	Confident	92.1	Very high	46 Å²	46	66.1 Å²	66.1	28%	0.279	32%	0.318	S	S	.	.			trans	-116.6	110.7	178.4	-169	0	0	0	0	109.3	Q76 Y80 W81 D83	Q76-V78 HydrophobicContact CG-CG2 4.46Å; Q76-V78 PolarHBondContact O-N 2.6Å; V78-Y80 PolarHBondContact O-N 3.25Å; V78-W81 HydrophobicContact CB-CB 4.14Å; V78-W81 HydrophobicContact CG1-CB 3.74Å; V78-W81 HydrophobicContact CG1-CG 4.47Å; V78-W81 PolarHBondContact O-N 2.87Å; V78-W81 VanDerWaalsContact O-N 3.13Å; V78-D83 PolarHBondContact N-OD1 3.31Å
79	K	85.2	Confident	91.8	Very high	151 Å²	151	64.5 Å²	64.5	66%	0.657	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	125.6	179.8	-159.8	-173.9	-177.5	-174.1	0	110.6	W81	K79-W81 PolarHBondContact O-N 2.81Å
80	Y	84.4	Confident	91.4	Very high	199 Å²	199	71.2 Å²	71.2	78%	0.78	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.6	5.9	-179.4	-48.1	-71.9	0	0	0	116.6	V78	V78-Y80 PolarHBondContact O-N 3.25Å
81	W	82.2	Confident	91.1	Very high	202 Å²	202	72.4 Å²	72.4	77%	0.765	36%	0.364	S	S	*	.	S	Bend	trans	-129.5	172.3	176.6	-80	82.6	0	0	0	110.3	V78 K79	V78-W81 HydrophobicContact CB-CB 4.14Å; V78-W81 HydrophobicContact CG1-CB 3.74Å; V78-W81 HydrophobicContact CG1-CG 4.47Å; V78-W81 PolarHBondContact O-N 2.87Å; V78-W81 VanDerWaalsContact O-N 3.13Å; K79-W81 PolarHBondContact O-N 2.81Å
82	T	88.3	Confident	91.1	Very high	120 Å²	120	74.8 Å²	74.8	74%	0.736	38%	0.378	S	S	*	.	P	Polyproline II helix	trans	-67.6	132.3	170.6	52.2	0	0	0	0	109.5
83	D	91.6	Very high	91.1	Very high	70 Å²	70	79.7 Å²	79.7	37%	0.374	40%	0.403	S	S	.	.	P	Polyproline II helix	trans	-55.5	143.1	174.6	-65.2	-21.8	0	0	0	110.8	V75 Q76 E77 V78 T85	V75-D83 HydrophobicContact CG1-CB 3.68Å; Q76-D83 WeakPolarHBondContact O-CA 3.19Å; Q76-D83 WeakPolarHBondContact O-CB 3.21Å; E77-D83 VanDerWaalsContact CA-OD1 3.31Å; E77-D83 WeakPolarHBondContact CA-OD1 3.37Å; V78-D83 PolarHBondContact N-OD1 3.31Å; D83-T85 HydrophobicContact CB-CG2 4.45Å
84	T	93.8	Very high	91.1	Very high	55 Å²	55	77.1 Å²	77.1	34%	0.337	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	120.9	174.3	-53.4	0	0	0	0	108.3	V75 Q76 L96 A98	V75-T84 CarbonylContact C-O 3.6Å; V75-T84 WeakPolarHBondContact CA-O 3.36Å; Q76-T84 PolarHBondContact N-O 3.32Å; Q76-T84 PolarHBondContact O-N 3.09Å; Q76-T84 VanDerWaalsContact O-N 3.09Å; T84-L96 HydrophobicContact CG2-CD1 4.33Å; T84-A98 HydrophobicContact CG2-CB 3.51Å
85	T	95.2	Very high	91.1	Very high	79 Å²	79	80.5 Å²	80.5	49%	0.485	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	140.1	-173.3	63.5	0	0	0	0	111.7	L74 V75 D83	L74-T85 CarbonylContact O-C 3.47Å; L74-T85 WeakPolarHBondContact O-CA 3.37Å; V75-T85 HydrophobicContact CB-CG2 4.48Å; V75-T85 HydrophobicContact CG1-CG2 4.05Å; V75-T85 HydrophobicContact CG2-CG2 4.08Å; D83-T85 HydrophobicContact CB-CG2 4.45Å
86	A	95.7	Very high	91	Very high	22 Å²	22	80.4 Å²	80.4	18%	0.182	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	129.7	167.9	0	0	0	0	0	110	Y73 L74 L95 L96	Y73-A86 WeakPolarHBondContact CA-O 3.13Å; L74-A86 HydrophobicContact CB-CB 4.41Å; L74-A86 PolarHBondContact N-O 3.18Å; L74-A86 PolarHBondContact O-N 2.86Å; A86-L95 WeakPolarHBondContact CB-O 3.25Å; A86-L96 HydrophobicContact CB-CD1 3.68Å
87	K	94.3	Very high	91	Very high	127 Å²	127	87.3 Å²	87.3	55%	0.552	45%	0.445	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.9	118	177	-176.4	170.5	170.2	162.3	0	109.8	Y71 Y73	Y71-K87 HydrophobicContact CD1-CD 4.38Å; Y71-K87 VanDerWaalsContact CD1-NZ 3.31Å; Y71-K87 HydrophobicContact CD2-CD 4.12Å; Y71-K87 HydrophobicContact CD2-CG 3.91Å; Y71-K87 VanDerWaalsContact CE1-NZ 3.3Å; Y71-K87 HydrophobicContact CE2-CD 4.45Å; Y71-K87 HydrophobicContact CG-CD 4.1Å; Y71-K87 HydrophobicContact CG-CG 4.04Å; Y73-K87 HydrophobicContact CD1-CB 4.04Å; Y73-K87 HydrophobicContact CE1-CB 3.68Å; Y73-K87 HydrophobicContact CE1-CD 4.37Å; Y73-K87 HydrophobicContact CE1-CG 4.18Å
88	V	93.7	Very high	90.9	Very high	23 Å²	23	84.6 Å²	84.6	14%	0.139	43%	0.434	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	126.6	174.8	-173.1	0	0	0	0	107.8	W61 Y71 V72 L74	W61-V88 HydrophobicContact CH2-CB 4.14Å; W61-V88 HydrophobicContact CH2-CG1 3.97Å; W61-V88 HydrophobicContact CH2-CG2 4.07Å; W61-V88 HydrophobicContact CZ2-CB 4.44Å; W61-V88 HydrophobicContact CZ2-CG1 4.2Å; Y71-V88 WeakPolarHBondContact CA-O 3.48Å; Y71-V88 VanDerWaalsContact CB-O 3.27Å; Y71-V88 WeakPolarHBondContact CB-O 3.16Å; V72-V88 PolarHBondContact N-O 2.98Å; V72-V88 PolarHBondContact O-N 3.26Å; L74-V88 HydrophobicContact CD1-CG2 4.04Å; L74-V88 HydrophobicContact CG-CG2 4.21Å
89	G	85.7	Confident	90.9	Very high	42 Å²	42	84.4 Å²	84.4	43%	0.433	43%	0.431	S	S	.	.			trans	-68.7	-101.6	-178.2	0	0	0	0	0	112.2
90	E	81	Confident	91.2	Very high	188 Å²	188	77.4 Å²	77.4	88%	0.879	40%	0.401	S	S	*	.	S	Bend	trans	-104.5	133.3	176.5	-169.4	173.1	-179.1	0	0	109.9
91	G	86.2	Confident	91.5	Very high	32 Å²	32	74.4 Å²	74.4	33%	0.33	39%	0.392	S	S	.	.	S	Bend	trans	139	176.5	179.2	0	0	0	0	0	113.7	W61	W61-G91 VanDerWaalsContact CZ2-O 3.3Å; W61-G91 WeakPolarHBondContact CZ2-O 3.38Å; W61-G91 PolarHBondContact NE1-O 3.19Å
92	N	93.3	Very high	92	Very high	63 Å²	63	66 Å²	66	34%	0.337	36%	0.364	S	S	.	.	S	Bend	trans	-119.2	5.9	-175.4	-62.6	-24.2	0	0	0	112.8	E60 W61 P63	E60-N92 CarbonylContact C-O 3.56Å; E60-N92 VanDerWaalsContact CA-O 3.25Å; E60-N92 WeakPolarHBondContact CA-O 3.41Å; W61-N92 PolarHBondContact N-O 2.93Å; W61-N92 WeakPolarHBondContact O-CB 3.37Å; P63-N92 WeakPolarHBondContact CA-OD1 3.33Å; P63-N92 WeakPolarHBondContact CG-ND2 3.27Å
93	I	95.7	Very high	92.2	Very high	103 Å²	103	62 Å²	62	53%	0.528	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	139.5	180	-62.3	173.6	0	0	0	107.5	I50 F59 E60 W61	I50-I93 HydrophobicContact CD1-CG2 3.89Å; F59-I93 VanDerWaalsContact O-CA 3.25Å; F59-I93 WeakPolarHBondContact O-CA 3.48Å; E60-I93 HydrophobicContact CB-CG1 4.29Å; E60-I93 HydrophobicContact CG-CG1 4.12Å; W61-I93 VanDerWaalsContact CH2-C 3.41Å
94	G	95.5	Very high	92.3	Very high	10 Å²	10	63.5 Å²	63.5	10%	0.103	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155	160.7	179.3	0	0	0	0	0	112.6	A58 F59 W61	A58-G94 CarbonylContact C-O 3.58Å; A58-G94 WeakPolarHBondContact CA-O 3.24Å; F59-G94 PolarHBondContact N-O 3.04Å; F59-G94 PolarHBondContact O-N 2.85Å; W61-G94 VanDerWaalsContact CZ3-N 3.35Å
95	L	96.5	Very high	92.3	Very high	73 Å²	73	63.9 Å²	63.9	38%	0.382	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	134.5	177.5	-169.3	77.5	0	0	0	109.2	A56 M57 A58 A86	A56-L95 HydrophobicContact CB-CD1 3.84Å; A56-L95 HydrophobicContact CB-CD2 4.14Å; A56-L95 HydrophobicContact CB-CG 3.96Å; M57-L95 WeakPolarHBondContact O-CA 3.08Å; A58-L95 HydrophobicContact CB-CD1 4.07Å; A86-L95 WeakPolarHBondContact CB-O 3.25Å
96	L	96.2	Very high	92.3	Very high	1 Å²	1	60.8 Å²	60.8	1%	0.005	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	121.4	170.9	-179.3	63.3	0	0	0	108.3	A56 M57 F59 L74 Q76 T84 A86 A98 Y108	A56-L96 CarbonylContact C-O 3.58Å; A56-L96 WeakPolarHBondContact CA-O 3.41Å; A56-L96 WeakPolarHBondContact CB-O 3.49Å; M57-L96 PolarHBondContact N-O 2.96Å; M57-L96 PolarHBondContact O-N 2.98Å; F59-L96 HydrophobicContact CD2-CB 4.4Å; F59-L96 HydrophobicContact CE2-CB 3.89Å; F59-L96 HydrophobicContact CE2-CD2 4.23Å; L74-L96 HydrophobicContact CB-CB 4.28Å; L74-L96 HydrophobicContact CB-CD1 4.41Å; L74-L96 HydrophobicContact CD1-CB 4.41Å; Q76-L96 HydrophobicContact CB-CD2 3.85Å; T84-L96 HydrophobicContact CG2-CD1 4.33Å; A86-L96 HydrophobicContact CB-CD1 3.68Å; L96-A98 HydrophobicContact CD1-CB 4.29Å; L96-A98 HydrophobicContact CD2-CB 4.07Å; L96-A98 HydrophobicContact CG-CB 3.73Å; L96-A98 PolarHBondContact O-N 2.82Å; L96-Y108 HydrophobicContact CD2-CD1 3.9Å; L96-Y108 HydrophobicContact CD2-CE1 4.09Å
97	E	94.9	Very high	92.3	Very high	162 Å²	162	63 Å²	63	76%	0.757	34%	0.344	S	S	*	.	S	Bend	trans	-77.2	52.1	176.7	-64.1	-171.4	163.3	0	0	111.7	A55 A56	A55-E97 CarbonylContact O-C 3.46Å; A55-E97 VanDerWaalsContact O-C 3.3Å; A56-E97 HydrophobicContact CB-CG 4.46Å
98	A	90.8	Very high	92.4	Very high	8 Å²	8	57 Å²	57	7%	0.066	32%	0.318	C	S	.	.			trans	-149	126.2	-176.5	0	0	0	0	0	108.5	A55 Q76 T84 L96	A55-A98 PolarHBondContact O-N 2.87Å; Q76-A98 HydrophobicContact CB-CB 4.16Å; T84-A98 HydrophobicContact CG2-CB 3.51Å; L96-A98 HydrophobicContact CD1-CB 4.29Å; L96-A98 HydrophobicContact CD2-CB 4.07Å; L96-A98 HydrophobicContact CG-CB 3.73Å; L96-A98 PolarHBondContact O-N 2.82Å
99	I	89.8	Confident	92.6	Very high	43 Å²	43	58.2 Å²	58.2	22%	0.221	32%	0.32	C	S	.	.			trans	-119.6	138.9	175.4	62.6	172.4	0	0	0	108.7	T54 M57	T54-I99 WeakPolarHBondContact O-CD1 3.21Å; M57-I99 HydrophobicContact CG-CG2 3.99Å
100	G	90.1	Very high	93.1	Very high	3 Å²	3	56.2 Å²	56.2	3%	0.031	30%	0.299	C	S	.	.	P	Polyproline II helix	trans	-59.7	165.7	174.6	0	0	0	0	0	112.2	S106 Y108 R131	G100-S106 WeakPolarHBondContact CA-OG 3.49Å; G100-Y108 WeakPolarHBondContact CA-OH 3.26Å; G100-Y108 PolarHBondContact N-OH 3.37Å; G100-R131 PolarHBondContact O-NE 2.99Å; G100-R131 PolarHBondContact O-NH2 3.49Å
101	K	91.4	Very high	93.9	Very high	136 Å²	136	48.4 Å²	48.4	59%	0.591	26%	0.263	S	S	*	.	P	Polyproline II helix	trans	-69.4	151.6	167.9	-78.5	174.1	178.3	177.8	0	110.5	E104	K101-E104 HydrophobicContact CB-CB 4Å; K101-E104 WeakPolarHBondContact CD-OE2 3.4Å
102	P	92.5	Very high	94.3	Very high	27 Å²	27	46.9 Å²	46.9	18%	0.175	25%	0.247	C	C	.	.	B	Isolated β-bridge	trans	-65.2	144.9	174.5	27	-26.4	0	0	0	109.6	E104 R131 P133 S156	P102-E104 PolarHBondContact O-N 2.83Å; P102-R131 VanDerWaalsContact CD-NH2 3.28Å; P102-R131 VanDerWaalsContact N-CZ 3.35Å; P102-P133 HydrophobicContact CB-CB 4.18Å; P102-P133 HydrophobicContact CB-CG 3.98Å; P102-S156 WeakPolarHBondContact CB-OG 3.42Å; P102-S156 WeakPolarHBondContact CG-OG 3.46Å
103	C	93.3	Very high	94.3	Very high	36 Å²	36	44.9 Å²	44.9	24%	0.243	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	61.5	0.4	179.3	-52.6	0	0	0	0	116.5	K130 R131 P133 C159	C103-K130 WeakPolarHBondContact O-CE 3.38Å; C103-R131 PolarHBondContact N-O 3.37Å; C103-P133 VanDerWaalsContact SG-CD 3.56Å; C103-P133 WeakPolarHBondContact SG-CG 3.15Å; C103-C159 WeakPolarHBondContact CA-SG 3.47Å; C103-C159 HydrophobicContact CB-CB 3.69Å; C103-C159 WeakPolarHBondContact CB-SG 3.47Å; C103-C159 WeakPolarHBondContact SG-CA 3.48Å; C103-C159 WeakPolarHBondContact SG-CB 3.33Å; C103-C159 PolarHBondContact SG-N 3.06Å; C103-C159 VanDerWaalsContact SG-N 3.42Å; C103-C159 CovalentContact SG-SG 2.03Å; C103-C159 PolarHBondContact SG-SG 2.94Å
104	E	93.1	Very high	94.2	Very high	100 Å²	100	40 Å²	40	47%	0.467	21%	0.211	S	C	.	.	S	Bend	trans	-109.9	125.8	178.2	-168.1	173.7	173	0	0	109.3	K101 P102 S106	K101-E104 HydrophobicContact CB-CB 4Å; K101-E104 WeakPolarHBondContact CD-OE2 3.4Å; P102-E104 PolarHBondContact O-N 2.83Å; E104-S106 PolarHBondContact O-N 2.93Å
105	A	93.1	Very high	93.7	Very high	64 Å²	64	46.3 Å²	46.3	53%	0.529	24%	0.236	S	C	.	.			trans	-65.2	118.8	176.5	0	0	0	0	0	109.1
106	S	94.6	Very high	93	Very high	13 Å²	13	46 Å²	46	9%	0.091	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	135.8	177.1	-61	0	0	0	0	109.6	G100 E104 Y108 T128 Y129	G100-S106 WeakPolarHBondContact CA-OG 3.49Å; E104-S106 PolarHBondContact O-N 2.93Å; S106-Y108 VanDerWaalsContact CB-CE2 3.49Å; S106-Y108 WeakPolarHBondContact CB-OH 3.37Å; S106-Y108 WeakPolarHBondContact O-CD2 2.92Å; S106-Y108 VanDerWaalsContact O-CE2 3.3Å; S106-Y108 WeakPolarHBondContact O-CE2 3.33Å; S106-T128 WeakPolarHBondContact O-CA 3.49Å; S106-Y129 PolarHBondContact N-O 3.46Å; S106-Y129 PolarHBondContact O-N 3.31Å
107	N	96.5	Very high	91.9	Very high	68 Å²	68	55.5 Å²	55.5	36%	0.364	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	132.4	179.5	-62	-22.6	0	0	0	110	E77 T128	E77-N107 HydrophobicContact CB-CB 4.09Å; E77-N107 HydrophobicContact CG-CB 4.07Å; E77-N107 PolarHBondContact N-O 3.32Å; E77-N107 VanDerWaalsContact OE2-CB 3.26Å; E77-N107 WeakPolarHBondContact OE2-CB 3.41Å; E77-N107 PolarHBondContact OE2-ND2 2.84Å; N107-T128 WeakPolarHBondContact OD1-CG2 3.42Å
108	Y	97.2	Very high	90.9	Very high	2 Å²	2	55.8 Å²	55.8	1%	0.008	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	145.9	175.5	-61.2	-87	0	0	0	110.4	M57 F59 V75 Q76 L96 G100 S106 M127	M57-Y108 HydrophobicContact CE-CD1 3.88Å; M57-Y108 HydrophobicContact CE-CD2 4.26Å; M57-Y108 HydrophobicContact CE-CE1 3.1Å; M57-Y108 HydrophobicContact CE-CE2 3.59Å; M57-Y108 HydrophobicContact CE-CG 4.39Å; M57-Y108 WeakPolarHBondContact CE-OH 3.34Å; F59-Y108 HydrophobicContact CE1-CD1 4.21Å; F59-Y108 AromaticContact CE1-CG 3.97Å; F59-Y108 HydrophobicContact CE1-CG 3.97Å; F59-Y108 HydrophobicContact CE2-CD1 4.33Å; F59-Y108 AromaticContact CZ-CD1 3.49Å; F59-Y108 HydrophobicContact CZ-CD1 3.49Å; F59-Y108 VanDerWaalsContact CZ-CD1 3.49Å; F59-Y108 HydrophobicContact CZ-CD2 4.44Å; F59-Y108 HydrophobicContact CZ-CE1 4.05Å; F59-Y108 AromaticContact CZ-CG 3.73Å; F59-Y108 HydrophobicContact CZ-CG 3.73Å; V75-Y108 CarbonylContact O-C 3.52Å; V75-Y108 WeakPolarHBondContact O-CA 3.34Å; Q76-Y108 HydrophobicContact CB-CD1 3.82Å; Q76-Y108 HydrophobicContact CB-CE1 3.51Å; Q76-Y108 HydrophobicContact CG-CD1 4.1Å; Q76-Y108 HydrophobicContact CG-CE1 3.45Å; Q76-Y108 VanDerWaalsContact CG-CE1 3.45Å; Q76-Y108 PolarHBondContact NE2-OH 3.23Å; L96-Y108 HydrophobicContact CD2-CD1 3.9Å; L96-Y108 HydrophobicContact CD2-CE1 4.09Å; G100-Y108 WeakPolarHBondContact CA-OH 3.26Å; G100-Y108 PolarHBondContact N-OH 3.37Å; S106-Y108 VanDerWaalsContact CB-CE2 3.49Å; S106-Y108 WeakPolarHBondContact CB-OH 3.37Å; S106-Y108 WeakPolarHBondContact O-CD2 2.92Å; S106-Y108 VanDerWaalsContact O-CE2 3.3Å; S106-Y108 WeakPolarHBondContact O-CE2 3.33Å; Y108-M127 PolarHBondContact N-O 3.36Å; Y108-M127 PolarHBondContact O-N 3.45Å
109	R	97.1	Very high	90.2	Very high	48 Å²	48	60 Å²	60	18%	0.181	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	143	179.2	-64.1	168.7	59	-154.4	-5.5	110.9	L74 V75 E77 E111 T124 Y125 H126	L74-R109 CarbonylContact C-O 3.54Å; L74-R109 WeakPolarHBondContact CA-O 3.42Å; V75-R109 HydrophobicContact CB-CB 4.24Å; V75-R109 PolarHBondContact N-O 2.96Å; V75-R109 PolarHBondContact O-N 3.19Å; E77-R109 WeakPolarHBondContact OE1-CD 3.21Å; E77-R109 IonicContact OE1-NH1 2.94Å; R109-E111 HydrophobicContact CB-CG 4.45Å; R109-E111 IonicContact CZ-OE1 3.13Å; R109-E111 IonicContact NE-OE1 3.79Å; R109-E111 IonicContact NH1-OE1 3.51Å; R109-E111 PolarHBondContact NH1-OE1 3.39Å; R109-E111 IonicContact NH2-OE1 3.83Å; R109-E111 PolarHBondContact NH2-OE1 3.31Å; R109-T124 HydrophobicContact CB-CG2 4.2Å; R109-T124 HydrophobicContact CG-CG2 4.35Å; R109-Y125 CarbonylContact C-O 3.56Å; R109-Y125 WeakPolarHBondContact CA-O 3.18Å; R109-H126 VanDerWaalsContact CD-CE1 3.46Å; R109-H126 WeakPolarHBondContact CD-CE1 3.37Å; R109-H126 WeakPolarHBondContact CG-ND1 3.46Å; R109-H126 PolarHBondContact NE-CE1 3.13Å
110	A	97.3	Very high	90.1	Very high	0 Å²	0	60.3 Å²	60.3	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	116.1	162.2	0	0	0	0	0	107.4	F47 W61 M64 V72 Y73 L74 T124 Y125	F47-A110 HydrophobicContact CD2-CB 4.03Å; F47-A110 HydrophobicContact CE2-CB 3.78Å; F47-A110 HydrophobicContact CG-CB 4.5Å; F47-A110 HydrophobicContact CZ-CB 4.1Å; W61-A110 HydrophobicContact CD2-CB 4.48Å; W61-A110 HydrophobicContact CG-CB 4.48Å; M64-A110 HydrophobicContact CE-CB 3.83Å; M64-A110 WeakPolarHBondContact CE-O 3.37Å; V72-A110 HydrophobicContact CG1-CB 4.09Å; Y73-A110 CarbonylContact O-C 3.56Å; Y73-A110 WeakPolarHBondContact O-CA 3.21Å; L74-A110 HydrophobicContact CD2-CB 4.07Å; A110-T124 CarbonylContact O-C 3.53Å; A110-T124 VanDerWaalsContact O-CA 3.31Å; A110-T124 WeakPolarHBondContact O-CA 3.46Å; A110-Y125 HydrophobicContact CB-CD2 4.48Å; A110-Y125 PolarHBondContact N-O 3.1Å; A110-Y125 PolarHBondContact O-N 3.09Å
111	E	95.9	Very high	90.2	Very high	24 Å²	24	63.1 Å²	63.1	11%	0.112	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	119.1	-178.4	-58.9	-176.7	-175.4	0	0	111	V72 Y73 V75 R109 H113 N121 Q123 T124	V72-E111 CarbonylContact C-O 3.57Å; V72-E111 WeakPolarHBondContact CA-O 3.41Å; Y73-E111 PolarHBondContact N-O 3.04Å; Y73-E111 PolarHBondContact O-N 2.83Å; V75-E111 HydrophobicContact CG2-CG 4.46Å; R109-E111 HydrophobicContact CB-CG 4.45Å; R109-E111 IonicContact CZ-OE1 3.13Å; R109-E111 IonicContact NE-OE1 3.79Å; R109-E111 IonicContact NH1-OE1 3.51Å; R109-E111 PolarHBondContact NH1-OE1 3.39Å; R109-E111 IonicContact NH2-OE1 3.83Å; R109-E111 PolarHBondContact NH2-OE1 3.31Å; E111-H113 PolarHBondContact O-CD2 2.85Å; E111-H113 IonicContact OE2-CD2 2.7Å; E111-H113 IonicContact OE2-CE1 3.89Å; E111-H113 IonicContact OE2-NE2 3.31Å; E111-H113 PolarHBondContact OE2-NE2 2.82Å; E111-N121 PolarHBondContact OE2-ND2 3.46Å; E111-Q123 CarbonylContact C-O 3.35Å; E111-Q123 WeakPolarHBondContact CA-O 3.16Å; E111-T124 HydrophobicContact CG-CG2 3.99Å
112	G	95.7	Very high	90.3	Very high	0 Å²	0	59.2 Å²	59.2	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	123.9	170.5	0	0	0	0	0	110.8	M64 N121 F122 Q123	M64-G112 WeakPolarHBondContact SD-CA 3.34Å; M64-G112 PolarHBondContact SD-N 3.41Å; M64-G112 VanDerWaalsContact SD-N 3.39Å; G112-N121 WeakPolarHBondContact O-CA 3.25Å; G112-F122 WeakPolarHBondContact O-CD1 3.45Å; G112-F122 WeakPolarHBondContact O-CE1 3.44Å; G112-F122 PolarHBondContact O-N 3.28Å; G112-Q123 PolarHBondContact N-O 3.42Å
113	H	93.9	Very high	90.4	Very high	21 Å²	21	60.9 Å²	60.9	10%	0.097	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	140.3	179.6	-79.5	-102.5	0	0	0	112	G70 Y71 Y73 E111 S120 F122	G70-H113 WeakPolarHBondContact CA-O 3.27Å; G70-H113 PolarHBondContact N-O 2.83Å; Y71-H113 HydrophobicContact CD2-CB 4Å; Y71-H113 HydrophobicContact CE1-CB 4.32Å; Y71-H113 HydrophobicContact CE2-CB 3.46Å; Y71-H113 VanDerWaalsContact CE2-CB 3.46Å; Y71-H113 AromaticContact CE2-CG 3.81Å; Y71-H113 PolarHBondContact N-O 3.08Å; Y71-H113 PolarHBondContact O-N 3.21Å; Y73-H113 AromaticContact CD2-CD2 3.74Å; Y73-H113 AromaticContact CD2-NE2 3.78Å; E111-H113 PolarHBondContact O-CD2 2.85Å; E111-H113 IonicContact OE2-CD2 2.7Å; E111-H113 IonicContact OE2-CE1 3.89Å; E111-H113 IonicContact OE2-NE2 3.31Å; E111-H113 PolarHBondContact OE2-NE2 2.82Å; H113-S120 WeakPolarHBondContact CA-O 3.2Å; H113-F122 VanDerWaalsContact C-CE1 3.45Å
114	S	92.3	Very high	90.6	Very high	0 Å²	0	61 Å²	61	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	153.8	175.9	72.7	0	0	0	0	112.3	N68 N116 N119 S120	N68-S114 CarbonylContact O-C 3.28Å; N68-S114 WeakPolarHBondContact O-CA 3.45Å; S114-N116 VanDerWaalsContact C-N 3.25Å; S114-N116 PolarHBondContact O-N 3.19Å; S114-N119 PolarHBondContact O-OD1 2.84Å; S114-S120 PolarHBondContact N-O 2.82Å; S114-S120 PolarHBondContact OG-N 3.06Å; S114-S120 PolarHBondContact OG-OG 2.98Å
115	K	85.5	Confident	90.8	Very high	144 Å²	144	57.4 Å²	57.4	63%	0.626	29%	0.287	S	S	*	.			trans	-81.9	14.4	177.5	-97.9	160.6	-167.5	152.6	0	114.4	N68 F69 G70	N68-K115 PolarHBondContact O-N 3.35Å; F69-K115 WeakPolarHBondContact O-CD 3.28Å; F69-K115 PolarHBondContact O-NZ 3.23Å; G70-K115 WeakPolarHBondContact O-CE 3.06Å; G70-K115 PolarHBondContact O-NZ 3.46Å
116	N	81.2	Confident	90.9	Very high	67 Å²	67	59.5 Å²	59.5	36%	0.358	29%	0.286	S	S	.	.	S	Bend	trans	-68.8	165.8	-176.5	-68.6	-12.4	0	0	0	112.1	N68 S114 F118 N119	N68-N116 WeakPolarHBondContact CB-OD1 3.25Å; N68-N116 PolarHBondContact ND2-OD1 3.13Å; S114-N116 VanDerWaalsContact C-N 3.25Å; S114-N116 PolarHBondContact O-N 3.19Å; N116-F118 CarbonylContact O-C 3.31Å; N116-F118 PolarHBondContact O-N 3.23Å; N116-N119 PolarHBondContact O-OD1 3.14Å
117	F	74.6	Confident	91	Very high	200 Å²	200	59.2 Å²	59.2	88%	0.877	28%	0.283	S	S	*	.	S	Bend	trans	-52.4	-30.7	177.4	-163.3	-89.9	0	0	0	112.9
118	F	73.8	Confident	90.9	Very high	167 Å²	167	59.6 Å²	59.6	73%	0.732	29%	0.288	S	S	*	.	S	Bend	trans	-111.3	112.9	162.8	-57.6	-79.5	0	0	0	107.7	N116 S120	N116-F118 CarbonylContact O-C 3.31Å; N116-F118 PolarHBondContact O-N 3.23Å; F118-S120 PolarHBondContact O-N 2.78Å; F118-S120 VanDerWaalsContact O-N 3.07Å
119	N	76.3	Confident	90.7	Very high	96 Å²	96	60 Å²	60	51%	0.513	29%	0.29	S	S	.	.			trans	-59.3	116.2	173.4	-64.8	-22.2	0	0	0	108.1	Y71 S114 N116	Y71-N119 PolarHBondContact OH-ND2 2.92Å; Y71-N119 VanDerWaalsContact OH-ND2 3.09Å; S114-N119 PolarHBondContact O-OD1 2.84Å; N116-N119 PolarHBondContact O-OD1 3.14Å
120	S	87.3	Confident	90.5	Very high	51 Å²	51	60.9 Å²	60.9	36%	0.357	30%	0.295	S	S	.	.			trans	-109.9	131.2	175.6	62.9	0	0	0	0	109.8	H113 S114 F118 F122	H113-S120 WeakPolarHBondContact CA-O 3.2Å; S114-S120 PolarHBondContact N-O 2.82Å; S114-S120 PolarHBondContact OG-N 3.06Å; S114-S120 PolarHBondContact OG-OG 2.98Å; F118-S120 PolarHBondContact O-N 2.78Å; F118-S120 VanDerWaalsContact O-N 3.07Å; S120-F122 PolarHBondContact O-N 2.94Å
121	N	92.4	Very high	90.2	Very high	62 Å²	62	61.5 Å²	61.5	33%	0.332	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	122.8	164.7	-179.4	-23.8	0	0	0	107.9	E111 G112 Q123 T124	E111-N121 PolarHBondContact OE2-ND2 3.46Å; G112-N121 WeakPolarHBondContact O-CA 3.25Å; N121-Q123 PolarHBondContact OD1-N 3.36Å; N121-Q123 VanDerWaalsContact OD1-N 3.13Å; N121-Q123 PolarHBondContact OD1-O 3.49Å; N121-T124 PolarHBondContact ND2-OG1 2.9Å; N121-T124 PolarHBondContact OD1-OG1 3.41Å; N121-T124 VanDerWaalsContact OD1-OG1 3.12Å
122	F	93.4	Very high	90	Very high	54 Å²	54	60.6 Å²	60.6	24%	0.237	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	-19	179.4	64.5	-101.4	0	0	0	112.9	M64 H66 F69 G112 H113 S120	M64-F122 HydrophobicContact CB-CE2 4.04Å; M64-F122 HydrophobicContact CB-CZ 4.22Å; H66-F122 HydrophobicContact CB-CD1 3.84Å; H66-F122 HydrophobicContact CB-CD2 3.8Å; H66-F122 HydrophobicContact CB-CE1 3.68Å; H66-F122 HydrophobicContact CB-CE2 3.69Å; H66-F122 HydrophobicContact CB-CG 3.92Å; H66-F122 HydrophobicContact CB-CZ 3.64Å; H66-F122 VanDerWaalsContact CD2-CB 3.49Å; H66-F122 WeakPolarHBondContact CD2-CB 3.3Å; H66-F122 AromaticContact CD2-CD1 3.8Å; H66-F122 AromaticContact CD2-CD2 3.85Å; H66-F122 AromaticContact CD2-CG 3.43Å; H66-F122 VanDerWaalsContact CD2-CG 3.43Å; H66-F122 WeakPolarHBondContact CD2-CG 3.46Å; H66-F122 AromaticContact CG-CD1 3.69Å; H66-F122 AromaticContact CG-CG 3.73Å; F69-F122 HydrophobicContact CD2-CE1 4.21Å; F69-F122 AromaticContact CD2-CZ 3.73Å; F69-F122 HydrophobicContact CD2-CZ 3.73Å; F69-F122 HydrophobicContact CE2-CZ 4.17Å; G112-F122 WeakPolarHBondContact O-CD1 3.45Å; G112-F122 WeakPolarHBondContact O-CE1 3.44Å; G112-F122 PolarHBondContact O-N 3.28Å; H113-F122 VanDerWaalsContact C-CE1 3.45Å; S120-F122 PolarHBondContact O-N 2.94Å
123	Q	94.8	Very high	89.9	Confident	62 Å²	62	60.8 Å²	60.8	29%	0.29	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.3	138.3	-179.6	-171.1	168.1	27.2	0	0	110.1	E111 G112 N121 Y125	E111-Q123 CarbonylContact C-O 3.35Å; E111-Q123 WeakPolarHBondContact CA-O 3.16Å; G112-Q123 PolarHBondContact N-O 3.42Å; N121-Q123 PolarHBondContact OD1-N 3.36Å; N121-Q123 VanDerWaalsContact OD1-N 3.13Å; N121-Q123 PolarHBondContact OD1-O 3.49Å; Q123-Y125 HydrophobicContact CG-CE1 4.14Å; Q123-Y125 PolarHBondContact NE2-OH 3.44Å
124	T	96.5	Very high	89.8	Confident	38 Å²	38	60.1 Å²	60.1	23%	0.233	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	131.6	175.9	-59.2	0	0	0	0	110.2	R109 A110 E111 N121 H126	R109-T124 HydrophobicContact CB-CG2 4.2Å; R109-T124 HydrophobicContact CG-CG2 4.35Å; A110-T124 CarbonylContact O-C 3.53Å; A110-T124 VanDerWaalsContact O-CA 3.31Å; A110-T124 WeakPolarHBondContact O-CA 3.46Å; E111-T124 HydrophobicContact CG-CG2 3.99Å; N121-T124 PolarHBondContact ND2-OG1 2.9Å; N121-T124 PolarHBondContact OD1-OG1 3.41Å; N121-T124 VanDerWaalsContact OD1-OG1 3.12Å; T124-H126 VanDerWaalsContact CG2-NE2 3.27Å; T124-H126 WeakPolarHBondContact CG2-NE2 3.46Å
125	Y	97.1	Very high	89.7	Confident	25 Å²	25	60.1 Å²	60.1	10%	0.098	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	140.1	165.3	-55.1	-45	0	0	0	109.9	T46 F47 W61 N62 M64 R109 A110 Q123	T46-Y125 HydrophobicContact CG2-CD1 4.26Å; T46-Y125 HydrophobicContact CG2-CE1 3.91Å; T46-Y125 WeakPolarHBondContact OG1-CD1 3.23Å; T46-Y125 VanDerWaalsContact OG1-CG 3.31Å; F47-Y125 HydrophobicContact CB-CG 4.44Å; W61-Y125 HydrophobicContact CB-CD2 3.89Å; W61-Y125 HydrophobicContact CB-CE2 4.11Å; N62-Y125 HydrophobicContact CB-CE2 4.45Å; N62-Y125 WeakPolarHBondContact O-CE2 3.15Å; M64-Y125 HydrophobicContact CE-CD2 3.3Å; M64-Y125 HydrophobicContact CE-CE2 3.39Å; M64-Y125 HydrophobicContact CE-CG 4.13Å; M64-Y125 HydrophobicContact CG-CE2 3.88Å; M64-Y125 HydrophobicContact SD-CE2 4.49Å; R109-Y125 CarbonylContact C-O 3.56Å; R109-Y125 WeakPolarHBondContact CA-O 3.18Å; A110-Y125 HydrophobicContact CB-CD2 4.48Å; A110-Y125 PolarHBondContact N-O 3.1Å; A110-Y125 PolarHBondContact O-N 3.09Å; Q123-Y125 HydrophobicContact CG-CE1 4.14Å; Q123-Y125 PolarHBondContact NE2-OH 3.44Å
126	H	96.4	Very high	89.8	Confident	107 Å²	107	56.1 Å²	56.1	50%	0.495	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	145.1	179.5	-66.3	-99.9	0	0	0	110.1	N36 R109 T124	N36-H126 WeakPolarHBondContact CB-O 3.25Å; N36-H126 PolarHBondContact ND2-O 3.46Å; R109-H126 VanDerWaalsContact CD-CE1 3.46Å; R109-H126 WeakPolarHBondContact CD-CE1 3.37Å; R109-H126 WeakPolarHBondContact CG-ND1 3.46Å; R109-H126 PolarHBondContact NE-CE1 3.13Å; T124-H126 VanDerWaalsContact CG2-NE2 3.27Å; T124-H126 WeakPolarHBondContact CG2-NE2 3.46Å
127	M	95.2	Very high	90	Very high	7 Å²	7	57.3 Å²	57.3	3%	0.034	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150	148.6	171.4	-177.6	172.2	53.9	0	0	110	Q34 N36 F47 V49 F59 Y108	Q34-M127 HydrophobicContact CB-SD 4.18Å; Q34-M127 HydrophobicContact CG-CG 4.19Å; Q34-M127 HydrophobicContact CG-SD 3.86Å; N36-M127 HydrophobicContact CB-CB 4.12Å; N36-M127 HydrophobicContact CB-CG 4.34Å; F47-M127 HydrophobicContact CD1-CB 3.51Å; F47-M127 HydrophobicContact CD1-CE 3.81Å; F47-M127 HydrophobicContact CE1-CB 3.98Å; F47-M127 HydrophobicContact CE1-CE 3.8Å; F47-M127 HydrophobicContact CG-CB 4.46Å; F47-M127 HydrophobicContact CG-CE 4.26Å; F47-M127 HydrophobicContact CZ-CE 4.3Å; V49-M127 HydrophobicContact CB-CE 4.44Å; V49-M127 HydrophobicContact CG2-CE 3.36Å; V49-M127 HydrophobicContact CG2-SD 4.15Å; F59-M127 HydrophobicContact CD1-CE 3.68Å; F59-M127 HydrophobicContact CE1-CE 3.61Å; Y108-M127 PolarHBondContact N-O 3.36Å; Y108-M127 PolarHBondContact O-N 3.45Å
128	T	94.2	Very high	90.4	Very high	77 Å²	77	49.1 Å²	49.1	47%	0.472	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	132.7	170.7	57.2	0	0	0	0	109.4	S106 N107	S106-T128 WeakPolarHBondContact O-CA 3.49Å; N107-T128 WeakPolarHBondContact OD1-CG2 3.42Å
129	Y	93.7	Very high	90.9	Very high	10 Å²	10	46 Å²	46	4%	0.039	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	126.2	176.3	-178	-118.6	0	0	0	110.4	Q34 V49 E52 M57 S106 R131	Q34-Y129 HydrophobicContact CB-CD2 3.52Å; Q34-Y129 HydrophobicContact CB-CE2 3.97Å; Q34-Y129 HydrophobicContact CG-CD2 3.88Å; V49-Y129 HydrophobicContact CG2-CD2 4.33Å; V49-Y129 HydrophobicContact CG2-CG 4.25Å; E52-Y129 VanDerWaalsContact OE2-CE1 3.31Å; E52-Y129 WeakPolarHBondContact OE2-CE1 3.31Å; E52-Y129 PolarHBondContact OE2-OH 3.49Å; M57-Y129 HydrophobicContact CE-CD1 4.38Å; M57-Y129 HydrophobicContact SD-CD1 3.64Å; M57-Y129 HydrophobicContact SD-CE1 3.78Å; S106-Y129 PolarHBondContact N-O 3.46Å; S106-Y129 PolarHBondContact O-N 3.31Å; Y129-R131 HydrophobicContact CE1-CB 4.35Å
130	K	92.3	Very high	91	Very high	67 Å²	67	43.5 Å²	43.5	29%	0.291	23%	0.225	S	C	.	.			trans	-108	110.3	177	-172.2	-172.1	-177.4	-166	0	108.4	C103 H209	C103-K130 WeakPolarHBondContact O-CE 3.38Å; K130-H209 PolarHBondContact NZ-NE2 2.86Å
131	R	91.5	Very high	90.2	Very high	12 Å²	12	45.6 Å²	45.6	5%	0.045	23%	0.225	C	C	.	.	B	Isolated β-bridge	trans	-76.3	140.9	-178.5	165.1	164.7	70.9	92.7	-22.1	111.8	E52 G100 P102 C103 Y129 E155	E52-R131 WeakPolarHBondContact OE1-CD 3Å; G100-R131 PolarHBondContact O-NE 2.99Å; G100-R131 PolarHBondContact O-NH2 3.49Å; P102-R131 VanDerWaalsContact CD-NH2 3.28Å; P102-R131 VanDerWaalsContact N-CZ 3.35Å; C103-R131 PolarHBondContact N-O 3.37Å; Y129-R131 HydrophobicContact CE1-CB 4.35Å; R131-E155 IonicContact CZ-OE1 3.28Å; R131-E155 VanDerWaalsContact CZ-OE1 3.28Å; R131-E155 IonicContact CZ-OE2 2.73Å; R131-E155 IonicContact NH1-OE1 3.53Å; R131-E155 PolarHBondContact NH1-OE1 3.49Å; R131-E155 IonicContact NH1-OE2 3.88Å; R131-E155 PolarHBondContact NH1-OE2 3.28Å; R131-E155 IonicContact NH2-OE1 2.98Å; R131-E155 PolarHBondContact NH2-OE1 2.87Å
132	V	93.1	Very high	89.1	Confident	5 Å²	5	46.1 Å²	46.1	3%	0.03	22%	0.223	C	C	.	.	P	Polyproline II helix	trans	-81.3	133.9	168.6	-170.1	0	0	0	0	109.6	R134 N207 H209 H212	V132-R134 PolarHBondContact O-N 2.99Å; V132-N207 HydrophobicContact CG1-CB 3.78Å; V132-H209 HydrophobicContact CG1-CB 3.93Å; V132-H209 HydrophobicContact CG2-CB 3.86Å; V132-H212 HydrophobicContact CG2-CB 3.48Å; V132-H212 VanDerWaalsContact CG2-CB 3.48Å
133	P	93	Very high	87.6	Confident	4 Å²	4	50 Å²	50	3%	0.026	24%	0.239	C	C	.	.	P	Polyproline II helix	trans	-49.7	136.3	175.5	-26.1	29.6	0	0	0	112.2	P102 C103 S156 S157 C159 N207 S214	P102-P133 HydrophobicContact CB-CB 4.18Å; P102-P133 HydrophobicContact CB-CG 3.98Å; C103-P133 VanDerWaalsContact SG-CD 3.56Å; C103-P133 WeakPolarHBondContact SG-CG 3.15Å; P133-S156 WeakPolarHBondContact CB-OG 3.31Å; P133-S156 WeakPolarHBondContact CG-OG 3.48Å; P133-S157 WeakPolarHBondContact CG-O 3.4Å; P133-C159 WeakPolarHBondContact CD-SG 3.46Å; P133-N207 PolarHBondContact O-ND2 3.15Å; P133-S214 WeakPolarHBondContact O-CB 3.36Å
134	R	91.4	Very high	85.5	Confident	8 Å²	8	52.3 Å²	52.3	3%	0.03	26%	0.259	C	S	.	.	P	Polyproline II helix	trans	-83.3	149.2	179.9	-57.8	-168.5	178	153.2	-3.6	112.5	E52 Q53 T54 V132 E155 L215 T217	E52-R134 IonicContact OE1-CZ 2.75Å; E52-R134 IonicContact OE1-NE 2.72Å; E52-R134 PolarHBondContact OE1-NE 2.94Å; E52-R134 IonicContact OE1-NH2 3.39Å; E52-R134 PolarHBondContact OE1-NH2 3.4Å; Q53-R134 PolarHBondContact O-NH2 2.88Å; T54-R134 VanDerWaalsContact CA-NH1 3.33Å; T54-R134 PolarHBondContact O-NH1 3Å; V132-R134 PolarHBondContact O-N 2.99Å; R134-E155 HydrophobicContact CB-CB 4.43Å; R134-E155 WeakPolarHBondContact CB-OE2 3.06Å; R134-E155 WeakPolarHBondContact CG-OE2 3.34Å; R134-E155 PolarHBondContact N-OE2 3.46Å; R134-E155 WeakPolarHBondContact O-CB 3.32Å; R134-E155 PolarHBondContact O-N 2.96Å; R134-L215 WeakPolarHBondContact CB-O 3.49Å; R134-L215 VanDerWaalsContact CD-O 3.31Å; R134-L215 WeakPolarHBondContact CD-O 3.39Å; R134-L215 WeakPolarHBondContact CG-O 3Å; R134-T217 WeakPolarHBondContact CB-OG1 3.31Å
135	I	89.8	Confident	83.7	Confident	0 Å²	0	59 Å²	59	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	137.1	165	-61.7	-176.1	0	0	0	108.5	V138 W152 V165 L205 T217	I135-V138 HydrophobicContact CG2-CG2 3.5Å; I135-V138 VanDerWaalsContact CG2-CG2 3.5Å; I135-W152 HydrophobicContact CG2-CB 3.59Å; I135-W152 HydrophobicContact CG2-CG 3.87Å; I135-V165 HydrophobicContact CD1-CG1 3.84Å; I135-L205 HydrophobicContact CD1-CB 3.76Å; I135-T217 PolarHBondContact O-N 2.89Å; I135-T217 PolarHBondContact O-OG1 3.14Å
136	Q	87.5	Confident	82.2	Confident	60 Å²	60	60.4 Å²	60.4	28%	0.28	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	165.3	179.7	-66.7	-179.1	-14	0	0	109.9	V138 G153 E155	Q136-V138 VanDerWaalsContact C-N 3.3Å; Q136-V138 PolarHBondContact O-N 2.93Å; Q136-V138 VanDerWaalsContact O-N 3.09Å; Q136-G153 PolarHBondContact N-O 3Å; Q136-G153 CarbonylContact O-C 3.26Å; Q136-G153 WeakPolarHBondContact O-CA 3.45Å; Q136-G153 PolarHBondContact O-N 3.21Å; Q136-E155 HydrophobicContact CG-CB 4.49Å
137	N	84.8	Confident	80.8	Confident	91 Å²	91	63.3 Å²	63.3	49%	0.487	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	46	48.8	167.2	-59.8	-37.4	0	0	0	114.3	E139	N137-E139 PolarHBondContact O-N 2.82Å
138	V	84.8	Confident	80	Confident	29 Å²	29	64.1 Å²	64.1	18%	0.176	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	121.8	177.7	-172.5	0	0	0	0	108.8	I135 Q136 L150 M151 W152 L205 V239 V241	I135-V138 HydrophobicContact CG2-CG2 3.5Å; I135-V138 VanDerWaalsContact CG2-CG2 3.5Å; Q136-V138 VanDerWaalsContact C-N 3.3Å; Q136-V138 PolarHBondContact O-N 2.93Å; Q136-V138 VanDerWaalsContact O-N 3.09Å; V138-L150 HydrophobicContact CG1-CD1 3.72Å; V138-M151 CarbonylContact C-O 3.47Å; V138-M151 WeakPolarHBondContact CA-O 3.42Å; V138-W152 HydrophobicContact CG2-CB 3.97Å; V138-L205 HydrophobicContact CG1-CD1 4.27Å; V138-V239 HydrophobicContact CB-CG1 3.85Å; V138-V239 HydrophobicContact CG1-CG1 4.25Å; V138-V239 HydrophobicContact CG2-CB 4.15Å; V138-V239 HydrophobicContact CG2-CG1 3.75Å; V138-V239 HydrophobicContact CG2-CG2 3.86Å; V138-V241 HydrophobicContact CB-CG2 4.23Å; V138-V241 HydrophobicContact CG1-CG2 3.45Å; V138-V241 VanDerWaalsContact CG1-CG2 3.45Å
139	E	83.3	Confident	79.5	Confident	102 Å²	102	63.4 Å²	63.4	48%	0.477	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	140	-179.9	-66.5	-173.4	171.4	0	0	109.4	N137 M151	N137-E139 PolarHBondContact O-N 2.82Å; E139-M151 PolarHBondContact N-O 3.03Å; E139-M151 PolarHBondContact O-N 2.9Å
140	S	78	Confident	79.1	Confident	42 Å²	42	63 Å²	63	29%	0.294	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	130.1	172.9	61.8	0	0	0	0	109.4	W142 R149	S140-W142 PolarHBondContact OG-NE1 2.85Å; S140-R149 WeakPolarHBondContact CA-O 3.05Å
141	R	71	Confident	78.9	Confident	96 Å²	96	62 Å²	62	36%	0.362	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	105.7	178	-169.5	-179.2	-61.9	171.3	6	109.2	K143 P148 R149	R141-K143 HydrophobicContact CG-CG 4.22Å; R141-P148 WeakPolarHBondContact O-CA 3.31Å; R141-R149 PolarHBondContact N-O 2.94Å; R141-R149 PolarHBondContact O-N 2.84Å
142	W	69.5	Low	78.8	Confident	73 Å²	73	62 Å²	62	28%	0.277	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	88.6	172	-48.8	92	0	0	0	107.2	S140 P148 M190 F193 F203 S243	S140-W142 PolarHBondContact OG-NE1 2.85Å; W142-P148 HydrophobicContact CD2-CB 4.44Å; W142-P148 HydrophobicContact CE3-CB 3.62Å; W142-P148 HydrophobicContact CH2-CB 4.29Å; W142-P148 HydrophobicContact CZ3-CB 3.53Å; W142-P148 HydrophobicContact CZ3-CG 4.33Å; W142-M190 HydrophobicContact CH2-CE 3.73Å; W142-M190 HydrophobicContact CH2-SD 4.34Å; W142-M190 HydrophobicContact CZ2-CE 3.75Å; W142-M190 HydrophobicContact CZ3-CE 4.46Å; W142-F193 AromaticContact CH2-CD1 3.5Å; W142-F193 HydrophobicContact CH2-CD1 3.5Å; W142-F193 VanDerWaalsContact CH2-CD1 3.5Å; W142-F193 AromaticContact CH2-CE1 3.71Å; W142-F193 HydrophobicContact CH2-CE1 3.71Å; W142-F193 AromaticContact CZ3-CD1 3.7Å; W142-F193 HydrophobicContact CZ3-CD1 3.7Å; W142-F193 HydrophobicContact CZ3-CE1 4.11Å; W142-F203 HydrophobicContact CH2-CE2 4.01Å; W142-F203 AromaticContact CH2-CZ 3.61Å; W142-F203 HydrophobicContact CH2-CZ 3.61Å; W142-F203 AromaticContact CZ2-CE2 3.67Å; W142-F203 HydrophobicContact CZ2-CE2 3.67Å; W142-F203 AromaticContact CZ2-CZ 3.72Å; W142-F203 HydrophobicContact CZ2-CZ 3.72Å; W142-S243 PolarHBondContact NE1-OG 2.85Å
143	K	62.1	Low	78.6	Confident	136 Å²	136	62.8 Å²	62.8	59%	0.591	31%	0.31	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116	139.4	172.6	-72.9	-171.6	177.8	-172.1	0	108.7	R141 N145 V146	R141-K143 HydrophobicContact CG-CG 4.22Å; K143-N145 PolarHBondContact O-N 2.85Å; K143-V146 HydrophobicContact CB-CB 3.92Å; K143-V146 HydrophobicContact CB-CG2 3.74Å; K143-V146 PolarHBondContact O-N 3.38Å; K143-V146 VanDerWaalsContact O-O 3.11Å
144	P	50.9	Low	78.4	Confident	109 Å²	109	65 Å²	65	71%	0.708	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.3	136.6	167.3	-22.5	32.1	0	0	0	109.7	V146	P144-V146 PolarHBondContact O-N 2.78Å
145	N	57.9	Low	78.4	Confident	179 Å²	179	67.6 Å²	67.6	96%	0.957	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.5	4.3	-176.6	-53.4	-36.7	0	0	0	116.7	K143	K143-N145 PolarHBondContact O-N 2.85Å
146	V	64.9	Low	78.5	Confident	54 Å²	54	69.4 Å²	69.4	33%	0.327	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	128.3	171.1	-174.2	0	0	0	0	108	K143 P144	K143-V146 HydrophobicContact CB-CB 3.92Å; K143-V146 HydrophobicContact CB-CG2 3.74Å; K143-V146 PolarHBondContact O-N 3.38Å; K143-V146 VanDerWaalsContact O-O 3.11Å; P144-V146 PolarHBondContact O-N 2.78Å
147	R	67.9	Low	78.7	Confident	168 Å²	168	71.1 Å²	71.1	63%	0.634	36%	0.364	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-51	125.7	172.5	-74.3	175.6	177.5	-175	1.3	109.2	R149 N191	R147-R149 PolarHBondContact O-N 2.81Å; R147-N191 WeakPolarHBondContact CB-OD1 3.35Å; R147-N191 VanDerWaalsContact CD-OD1 3.24Å; R147-N191 WeakPolarHBondContact CD-OD1 3.33Å; R147-N191 WeakPolarHBondContact CG-OD1 3.33Å
148	P	78	Confident	79	Confident	24 Å²	24	68.4 Å²	68.4	16%	0.156	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.2	127.8	179.8	26.1	-34.4	0	0	0	108.6	R141 W142 M190	R141-P148 WeakPolarHBondContact O-CA 3.31Å; W142-P148 HydrophobicContact CD2-CB 4.44Å; W142-P148 HydrophobicContact CE3-CB 3.62Å; W142-P148 HydrophobicContact CH2-CB 4.29Å; W142-P148 HydrophobicContact CZ3-CB 3.53Å; W142-P148 HydrophobicContact CZ3-CG 4.33Å; P148-M190 HydrophobicContact CB-CB 4.28Å; P148-M190 HydrophobicContact CB-CE 4.28Å; P148-M190 HydrophobicContact CG-CB 4.11Å; P148-M190 VanDerWaalsContact CG-O 3.26Å; P148-M190 WeakPolarHBondContact CG-O 3.48Å; P148-M190 PolarHBondContact O-N 2.82Å
149	R	83.2	Confident	79.4	Confident	63 Å²	63	68.5 Å²	68.5	24%	0.238	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	136.4	-177.4	-79.3	-170.7	-73.6	175	-9.8	110.5	S140 R141 R147 E187 Y188 N189	S140-R149 WeakPolarHBondContact CA-O 3.05Å; R141-R149 PolarHBondContact N-O 2.94Å; R141-R149 PolarHBondContact O-N 2.84Å; R147-R149 PolarHBondContact O-N 2.81Å; R149-E187 IonicContact CZ-OE2 3.86Å; R149-E187 IonicContact NH1-OE2 2.85Å; R149-E187 PolarHBondContact NH1-OE2 2.79Å; R149-Y188 WeakPolarHBondContact CA-O 3.32Å; R149-N189 WeakPolarHBondContact CD-OD1 3.08Å; R149-N189 WeakPolarHBondContact CG-OD1 3.16Å
150	L	86.5	Confident	79.9	Confident	0 Å²	0	67.8 Å²	67.8	0%	0	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	124.9	171.6	-174.1	59.5	0	0	0	106.6	V138 W152 V167 E187 Y188 M190 F203 L205 V241	V138-L150 HydrophobicContact CG1-CD1 3.72Å; L150-W152 HydrophobicContact CG-CE3 4.44Å; L150-W152 WeakPolarHBondContact O-CZ3 3.46Å; L150-V167 HydrophobicContact CD2-CG1 4.1Å; L150-E187 CarbonylContact O-C 3.35Å; L150-E187 WeakPolarHBondContact O-CA 2.88Å; L150-Y188 PolarHBondContact N-O 2.85Å; L150-Y188 PolarHBondContact O-N 2.95Å; L150-M190 HydrophobicContact CB-CE 3.72Å; L150-M190 HydrophobicContact CB-SD 3.85Å; L150-M190 HydrophobicContact CD2-SD 4.36Å; L150-F203 HydrophobicContact CD2-CB 4.26Å; L150-F203 HydrophobicContact CD2-CD1 4.05Å; L150-F203 HydrophobicContact CD2-CG 4.35Å; L150-L205 HydrophobicContact CD1-CD1 4.49Å; L150-L205 HydrophobicContact CD2-CD1 3.67Å; L150-L205 HydrophobicContact CD2-CD2 3.62Å; L150-L205 HydrophobicContact CD2-CG 4.01Å; L150-L205 HydrophobicContact CG-CD1 4.41Å; L150-L205 HydrophobicContact CG-CD2 3.99Å; L150-V241 HydrophobicContact CD1-CG2 4.3Å
151	M	87.8	Confident	80.5	Confident	47 Å²	47	71.8 Å²	71.8	23%	0.232	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	151.9	-179.8	-53	-174.9	-25.2	0	0	109.2	V138 E139 V186 E187	V138-M151 CarbonylContact C-O 3.47Å; V138-M151 WeakPolarHBondContact CA-O 3.42Å; E139-M151 PolarHBondContact N-O 3.03Å; E139-M151 PolarHBondContact O-N 2.9Å; M151-V186 CarbonylContact C-O 3.59Å; M151-V186 VanDerWaalsContact CA-O 3.28Å; M151-V186 WeakPolarHBondContact CA-O 3.18Å; M151-E187 HydrophobicContact CG-CB 4.25Å
152	W	90.4	Very high	81.6	Confident	11 Å²	11	72.5 Å²	72.5	4%	0.042	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	150.6	175.7	60.2	93.6	0	0	0	112.3	I135 V138 L150 V165 V181 Q185 V186 L205	I135-W152 HydrophobicContact CG2-CB 3.59Å; I135-W152 HydrophobicContact CG2-CG 3.87Å; V138-W152 HydrophobicContact CG2-CB 3.97Å; L150-W152 HydrophobicContact CG-CE3 4.44Å; L150-W152 WeakPolarHBondContact O-CZ3 3.46Å; W152-V165 HydrophobicContact CZ2-CB 4.13Å; W152-V165 HydrophobicContact CZ2-CG1 3.92Å; W152-V165 HydrophobicContact CZ2-CG2 3.96Å; W152-V181 HydrophobicContact CH2-CG1 4.14Å; W152-V181 HydrophobicContact CZ2-CG1 4.33Å; W152-Q185 WeakPolarHBondContact CZ2-O 3.43Å; W152-V186 PolarHBondContact N-O 2.85Å; W152-V186 WeakPolarHBondContact O-CB 3.46Å; W152-L205 HydrophobicContact CD2-CD2 4.07Å; W152-L205 HydrophobicContact CE3-CD2 3.64Å; W152-L205 HydrophobicContact CZ3-CD2 4.03Å
153	G	89	Confident	82.8	Confident	22 Å²	22	69.5 Å²	69.5	23%	0.227	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	164.3	165	0	0	0	0	0	112.1	Q136	Q136-G153 PolarHBondContact N-O 3Å; Q136-G153 CarbonylContact O-C 3.26Å; Q136-G153 WeakPolarHBondContact O-CA 3.45Å; Q136-G153 PolarHBondContact O-N 3.21Å
154	K	88.7	Confident	84.4	Confident	52 Å²	52	64.3 Å²	64.3	23%	0.226	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	136	175.9	-63.7	172.5	-178.9	161.6	0	108.7	S156 S183 D184 Q185 V186	K154-S156 VanDerWaalsContact C-N 3.28Å; K154-S156 WeakPolarHBondContact CB-O 3.21Å; K154-S156 PolarHBondContact O-N 2.96Å; K154-S183 WeakPolarHBondContact CE-O 3.39Å; K154-S183 PolarHBondContact NZ-O 3.04Å; K154-D184 PolarHBondContact NZ-O 2.82Å; K154-Q185 VanDerWaalsContact CE-O 3.22Å; K154-Q185 WeakPolarHBondContact CE-O 3.3Å; K154-Q185 PolarHBondContact NZ-O 3.35Å; K154-V186 HydrophobicContact CD-CG1 4.03Å; K154-V186 HydrophobicContact CG-CG1 4.4Å
155	E	90.7	Very high	86.4	Confident	61 Å²	61	59.1 Å²	59.1	29%	0.285	33%	0.329	S	S	.	.	S	Bend	trans	-63.5	-36.4	173.7	-175.3	-170.8	175.2	0	0	112.1	R131 R134 Q136	R131-E155 IonicContact CZ-OE1 3.28Å; R131-E155 VanDerWaalsContact CZ-OE1 3.28Å; R131-E155 IonicContact CZ-OE2 2.73Å; R131-E155 IonicContact NH1-OE1 3.53Å; R131-E155 PolarHBondContact NH1-OE1 3.49Å; R131-E155 IonicContact NH1-OE2 3.88Å; R131-E155 PolarHBondContact NH1-OE2 3.28Å; R131-E155 IonicContact NH2-OE1 2.98Å; R131-E155 PolarHBondContact NH2-OE1 2.87Å; R134-E155 HydrophobicContact CB-CB 4.43Å; R134-E155 WeakPolarHBondContact CB-OE2 3.06Å; R134-E155 WeakPolarHBondContact CG-OE2 3.34Å; R134-E155 PolarHBondContact N-OE2 3.46Å; R134-E155 WeakPolarHBondContact O-CB 3.32Å; R134-E155 PolarHBondContact O-N 2.96Å; Q136-E155 HydrophobicContact CG-CB 4.49Å
156	S	91.1	Very high	88.1	Confident	38 Å²	38	51 Å²	51	27%	0.266	29%	0.285	S	S	.	.	S	Bend	trans	-155.7	175	176.3	58.8	0	0	0	0	110.4	P102 P133 K154	P102-S156 WeakPolarHBondContact CB-OG 3.42Å; P102-S156 WeakPolarHBondContact CG-OG 3.46Å; P133-S156 WeakPolarHBondContact CB-OG 3.31Å; P133-S156 WeakPolarHBondContact CG-OG 3.48Å; K154-S156 VanDerWaalsContact C-N 3.28Å; K154-S156 WeakPolarHBondContact CB-O 3.21Å; K154-S156 PolarHBondContact O-N 2.96Å
157	S	91.3	Very high	89.3	Confident	97 Å²	97	48.4 Å²	48.4	68%	0.678	27%	0.269	S	S	*	.			trans	-60.8	159.7	171.1	56.1	0	0	0	0	111.4	P133	P133-S157 WeakPolarHBondContact CG-O 3.4Å
158	A	92.5	Very high	90.4	Very high	33 Å²	33	43 Å²	43	27%	0.273	25%	0.25	S	S	.	.			trans	-52.4	150.2	168.7	0	0	0	0	0	111.6	D163 S183	A158-D163 HydrophobicContact CB-CB 4.01Å; A158-S183 WeakPolarHBondContact CB-OG 3.42Å
159	C	93	Very high	90.8	Very high	31 Å²	31	42.6 Å²	42.6	21%	0.209	25%	0.246	C	C	.	.	S	Bend	trans	-74.5	-38.4	177.2	-56.1	0	0	0	0	110.8	C103 P133 D163	C103-C159 WeakPolarHBondContact CA-SG 3.47Å; C103-C159 HydrophobicContact CB-CB 3.69Å; C103-C159 WeakPolarHBondContact CB-SG 3.47Å; C103-C159 WeakPolarHBondContact SG-CA 3.48Å; C103-C159 WeakPolarHBondContact SG-CB 3.33Å; C103-C159 PolarHBondContact SG-N 3.06Å; C103-C159 VanDerWaalsContact SG-N 3.42Å; C103-C159 CovalentContact SG-SG 2.03Å; C103-C159 PolarHBondContact SG-SG 2.94Å; P133-C159 WeakPolarHBondContact CD-SG 3.46Å; C159-D163 WeakPolarHBondContact CA-OD2 3.36Å; C159-D163 WeakPolarHBondContact CB-OD2 3.15Å; C159-D163 PolarHBondContact N-OD2 3.22Å
160	E	93.3	Very high	91	Very high	88 Å²	88	40 Å²	40	41%	0.411	24%	0.238	S	C	.	.	S	Bend	trans	-136.3	153.5	178.7	-75.1	171.3	-161.1	0	0	111	T162 D163 H209	E160-T162 PolarHBondContact O-N 3.44Å; E160-T162 VanDerWaalsContact O-N 3.15Å; E160-D163 PolarHBondContact N-OD2 3.05Å; E160-D163 VanDerWaalsContact O-CB 3.28Å; E160-D163 WeakPolarHBondContact O-CB 3.37Å; E160-D163 VanDerWaalsContact O-CG 3.22Å; E160-D163 PolarHBondContact O-N 3.43Å; E160-H209 IonicContact OE1-CE1 3.7Å; E160-H209 IonicContact OE2-CE1 3.62Å
161	P	91.2	Very high	90.9	Very high	126 Å²	126	41.4 Å²	41.4	82%	0.818	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-22.3	176.8	-22.2	33.6	0	0	0	113.9	D163	P161-D163 VanDerWaalsContact C-N 3.28Å
162	T	93.4	Very high	90.6	Very high	111 Å²	111	42.7 Å²	42.7	68%	0.681	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.9	-4.8	177.8	47.4	0	0	0	0	113.6	E160	E160-T162 PolarHBondContact O-N 3.44Å; E160-T162 VanDerWaalsContact O-N 3.15Å
163	D	95.1	Very high	90.2	Very high	10 Å²	10	46.3 Å²	46.3	5%	0.053	29%	0.285	C	S	.	.			trans	-64.6	156.6	176.2	-66.3	-12.8	0	0	0	110.1	A158 C159 E160 P161 S183 K208 H209	A158-D163 HydrophobicContact CB-CB 4.01Å; C159-D163 WeakPolarHBondContact CA-OD2 3.36Å; C159-D163 WeakPolarHBondContact CB-OD2 3.15Å; C159-D163 PolarHBondContact N-OD2 3.22Å; E160-D163 PolarHBondContact N-OD2 3.05Å; E160-D163 VanDerWaalsContact O-CB 3.28Å; E160-D163 WeakPolarHBondContact O-CB 3.37Å; E160-D163 VanDerWaalsContact O-CG 3.22Å; E160-D163 PolarHBondContact O-N 3.43Å; P161-D163 VanDerWaalsContact C-N 3.28Å; D163-S183 WeakPolarHBondContact O-CB 3.44Å; D163-S183 PolarHBondContact O-N 3.09Å; D163-S183 PolarHBondContact O-OG 2.87Å; D163-K208 WeakPolarHBondContact CA-O 3.42Å; D163-K208 WeakPolarHBondContact CB-O 3.47Å; D163-H209 WeakPolarHBondContact OD1-CA 3.45Å; D163-H209 IonicContact OD1-CE1 2.81Å; D163-H209 IonicContact OD1-CG 3.5Å; D163-H209 IonicContact OD1-ND1 3.68Å; D163-H209 PolarHBondContact OD1-ND1 3.42Å; D163-H209 IonicContact OD2-CG 3.49Å; D163-H209 IonicContact OD2-ND1 3.85Å; D163-H209 PolarHBondContact OD2-ND1 2.03Å
164	S	94.8	Very high	90	Very high	27 Å²	27	49.9 Å²	49.9	19%	0.189	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	155.3	-178.5	-57.1	0	0	0	0	110.8	V181 N207 K208	S164-V181 CarbonylContact C-O 3.56Å; S164-V181 WeakPolarHBondContact CA-O 3.49Å; S164-V181 WeakPolarHBondContact CB-O 3.43Å; S164-N207 CarbonylContact O-C 3.53Å; S164-N207 WeakPolarHBondContact O-CA 3.01Å; S164-K208 PolarHBondContact N-O 2.7Å; S164-K208 VanDerWaalsContact N-O 3.14Å; S164-K208 PolarHBondContact O-N 3.31Å
165	V	93.4	Very high	90	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	124	167	-172.1	0	0	0	0	107.6	I135 W152 V167 V181 N207	I135-V165 HydrophobicContact CD1-CG1 3.84Å; W152-V165 HydrophobicContact CZ2-CB 4.13Å; W152-V165 HydrophobicContact CZ2-CG1 3.92Å; W152-V165 HydrophobicContact CZ2-CG2 3.96Å; V165-V167 HydrophobicContact CG1-CG2 4.26Å; V165-V181 HydrophobicContact CB-CB 4.2Å; V165-V181 PolarHBondContact N-O 3.18Å; V165-V181 PolarHBondContact O-N 3.42Å; V165-N207 WeakPolarHBondContact CG2-OD1 3.38Å
166	I	93	Very high	89.9	Confident	7 Å²	7	53 Å²	53	4%	0.036	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	127.4	173.8	-51.9	-59.2	0	0	0	107.8	F168 M178 I180 L205 F206 K208	I166-F168 HydrophobicContact CG2-CD2 4.23Å; I166-F168 HydrophobicContact CG2-CE2 3.9Å; I166-F168 HydrophobicContact CG2-CZ 4.4Å; I166-M178 HydrophobicContact CG2-CG 3.75Å; I166-M178 HydrophobicContact CG2-SD 3.9Å; I166-I180 HydrophobicContact CD1-CB 4.39Å; I166-I180 HydrophobicContact CD1-CG1 3.88Å; I166-I180 HydrophobicContact CD1-CG2 4.17Å; I166-L205 WeakPolarHBondContact O-CA 3.4Å; I166-F206 HydrophobicContact CB-CD2 3.99Å; I166-F206 HydrophobicContact CB-CE1 4.32Å; I166-F206 HydrophobicContact CB-CE2 3.45Å; I166-F206 VanDerWaalsContact CB-CE2 3.45Å; I166-F206 HydrophobicContact CB-CZ 3.65Å; I166-F206 HydrophobicContact CG1-CD2 4.21Å; I166-F206 HydrophobicContact CG1-CE2 3.59Å; I166-F206 HydrophobicContact CG1-CZ 4.18Å; I166-F206 HydrophobicContact CG2-CE1 4.31Å; I166-F206 HydrophobicContact CG2-CE2 3.97Å; I166-F206 HydrophobicContact CG2-CZ 3.66Å; I166-F206 PolarHBondContact N-O 3.04Å; I166-F206 PolarHBondContact O-N 3.09Å; I166-K208 HydrophobicContact CD1-CB 4.42Å; I166-K208 HydrophobicContact CD1-CD 4.18Å; I166-K208 HydrophobicContact CG1-CB 3.93Å; I166-K208 HydrophobicContact CG1-CD 4.31Å
167	V	91	Very high	89.8	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	110.8	177.5	-176.9	0	0	0	0	107.9	L150 V165 F179 V181 Y188 I204 L205	L150-V167 HydrophobicContact CD2-CG1 4.1Å; V165-V167 HydrophobicContact CG1-CG2 4.26Å; V167-F179 HydrophobicContact CB-CB 4.38Å; V167-F179 PolarHBondContact N-O 3.04Å; V167-F179 PolarHBondContact O-N 3.44Å; V167-V181 HydrophobicContact CG2-CG2 4.06Å; V167-Y188 HydrophobicContact CG1-CD1 4.3Å; V167-Y188 HydrophobicContact CG1-CE1 4.46Å; V167-I204 CarbonylContact C-O 3.23Å; V167-I204 WeakPolarHBondContact CA-O 3.43Å; V167-L205 HydrophobicContact CG1-CG 4.32Å; V167-L205 HydrophobicContact CG2-CD2 4.06Å; V167-L205 HydrophobicContact CG2-CG 4.14Å
168	F	91.2	Very high	89.9	Confident	54 Å²	54	57.1 Å²	57.1	24%	0.237	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	134.4	162.9	-67.1	-86.7	0	0	0	109.3	I166 L176 Q177 M178 F203 I204 F206	I166-F168 HydrophobicContact CG2-CD2 4.23Å; I166-F168 HydrophobicContact CG2-CE2 3.9Å; I166-F168 HydrophobicContact CG2-CZ 4.4Å; F168-L176 HydrophobicContact CB-CB 3.98Å; F168-L176 HydrophobicContact CB-CD1 3.99Å; F168-L176 HydrophobicContact CD1-CB 4.25Å; F168-Q177 CarbonylContact C-O 3.58Å; F168-Q177 VanDerWaalsContact CA-O 3.29Å; F168-Q177 WeakPolarHBondContact CA-O 3.38Å; F168-M178 HydrophobicContact CD1-CB 3.85Å; F168-M178 HydrophobicContact CD1-CG 4.35Å; F168-M178 HydrophobicContact CE1-CB 3.62Å; F168-M178 HydrophobicContact CE1-CE 4.33Å; F168-M178 HydrophobicContact CE1-CG 3.94Å; F168-M178 HydrophobicContact CE1-SD 4.02Å; F168-M178 HydrophobicContact CZ-CB 4.34Å; F168-M178 HydrophobicContact CZ-CG 4.15Å; F168-M178 HydrophobicContact CZ-SD 3.82Å; F168-F203 CarbonylContact O-C 3.57Å; F168-F203 VanDerWaalsContact O-CA 3.29Å; F168-F203 WeakPolarHBondContact O-CA 3.41Å; F168-I204 HydrophobicContact CB-CB 4.14Å; F168-I204 HydrophobicContact CD2-CB 4.46Å; F168-I204 HydrophobicContact CD2-CG2 4.39Å; F168-I204 PolarHBondContact N-O 3.03Å; F168-I204 PolarHBondContact O-N 3.07Å; F168-F206 AromaticContact CD2-CE1 3.85Å; F168-F206 HydrophobicContact CD2-CE1 3.85Å; F168-F206 HydrophobicContact CD2-CZ 4.3Å; F168-F206 AromaticContact CE2-CE1 3.61Å; F168-F206 HydrophobicContact CE2-CE1 3.61Å; F168-F206 AromaticContact CE2-CZ 3.65Å; F168-F206 HydrophobicContact CE2-CZ 3.65Å
169	R	87.2	Confident	89.9	Confident	16 Å²	16	58 Å²	58	6%	0.06	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	133.5	-178.8	171.8	-170.2	87.6	-177.2	3.9	109.9	Q177 F179 F193 V202 F203	R169-Q177 PolarHBondContact N-O 3.21Å; R169-Q177 VanDerWaalsContact NH2-OE1 3.07Å; R169-Q177 PolarHBondContact O-N 3.13Å; R169-F179 HydrophobicContact CB-CD2 4.24Å; R169-F179 HydrophobicContact CB-CE2 4.04Å; R169-F179 VanDerWaalsContact NH2-CZ 3.34Å; R169-F193 VanDerWaalsContact CD-CD2 3.5Å; R169-F193 HydrophobicContact CG-CD2 3.59Å; R169-F193 HydrophobicContact CG-CE2 3.88Å; R169-F193 HydrophobicContact CG-CG 4.43Å; R169-V202 WeakPolarHBondContact CA-O 3.41Å; R169-F203 HydrophobicContact CB-CD1 4.09Å; R169-F203 HydrophobicContact CB-CE1 4.12Å; R169-F203 HydrophobicContact CG-CD1 3.98Å; R169-F203 HydrophobicContact CG-CE1 3.49Å; R169-F203 VanDerWaalsContact CG-CE1 3.49Å; R169-F203 HydrophobicContact CG-CZ 4.3Å
170	G	85.8	Confident	89.9	Confident	8 Å²	8	62.3 Å²	62.3	8%	0.082	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	179.8	-160.5	170.4	0	0	0	0	0	110.8	V202	G170-V202 PolarHBondContact N-O 3.47Å; G170-V202 VanDerWaalsContact N-O 3.13Å; G170-V202 PolarHBondContact O-N 2.69Å
171	Y	84.4	Confident	89.9	Confident	30 Å²	30	58.5 Å²	58.5	12%	0.118	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	155.1	171.6	-53.4	-78.3	0	0	0	109.8	S173 E174 F193 K194 T196 M199 E200	Y171-S173 PolarHBondContact O-N 3.01Å; Y171-E174 HydrophobicContact CD2-CG 4.43Å; Y171-E174 WeakPolarHBondContact CD2-OE2 3.48Å; Y171-E174 PolarHBondContact O-N 3.4Å; Y171-F193 HydrophobicContact CD1-CE2 4.41Å; Y171-F193 HydrophobicContact CD1-CZ 4.11Å; Y171-F193 HydrophobicContact CE1-CE1 4.38Å; Y171-F193 AromaticContact CE1-CE2 3.94Å; Y171-F193 HydrophobicContact CE1-CE2 3.94Å; Y171-F193 AromaticContact CE1-CZ 3.64Å; Y171-F193 HydrophobicContact CE1-CZ 3.64Å; Y171-K194 PolarHBondContact OH-O 3.4Å; Y171-T196 PolarHBondContact OH-OG1 3.06Å; Y171-M199 HydrophobicContact CD1-CB 3.6Å; Y171-M199 HydrophobicContact CD1-CG 4.44Å; Y171-M199 HydrophobicContact CD1-SD 4.03Å; Y171-M199 HydrophobicContact CD2-SD 4.17Å; Y171-M199 HydrophobicContact CE1-CB 4.25Å; Y171-M199 HydrophobicContact CE1-SD 4.41Å; Y171-M199 HydrophobicContact CG-CB 4.15Å; Y171-M199 HydrophobicContact CG-SD 3.89Å; Y171-E200 CarbonylContact C-O 3.44Å; Y171-E200 WeakPolarHBondContact CA-O 3.28Å
172	S	81.6	Confident	90	Very high	74 Å²	74	55.1 Å²	55.1	52%	0.517	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-27.5	179	54.5	0	0	0	0	114	E200	S172-E200 PolarHBondContact N-O 2.71Å
173	S	82.4	Confident	89.8	Confident	87 Å²	87	50.5 Å²	50.5	61%	0.608	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.3	-2.4	177.9	52	0	0	0	0	114.1	Y171	Y171-S173 PolarHBondContact O-N 3.01Å
174	E	85.1	Confident	89.6	Confident	98 Å²	98	55.6 Å²	55.6	46%	0.458	31%	0.307	S	S	.	.	S	Bend	trans	-127.7	155.6	-173.5	-67.9	-172.3	-177.4	0	0	112.5	Y171 L176	Y171-E174 HydrophobicContact CD2-CG 4.43Å; Y171-E174 WeakPolarHBondContact CD2-OE2 3.48Å; Y171-E174 PolarHBondContact O-N 3.4Å; E174-L176 PolarHBondContact O-N 3.35Å
175	P	87.9	Confident	89.4	Confident	120 Å²	120	58.8 Å²	58.8	78%	0.779	32%	0.319	S	S	*	.	P	Polyproline II helix	trans	-57.6	131	170.6	-22.9	33.6	0	0	0	111.6
176	L	88.5	Confident	89.2	Confident	57 Å²	57	62.2 Å²	62.2	30%	0.298	34%	0.34	S	S	.	.	P	Polyproline II helix	trans	-74.7	133.1	178	-51.7	-179.4	0	0	0	110.8	F168 E174 V202 I204	F168-L176 HydrophobicContact CB-CB 3.98Å; F168-L176 HydrophobicContact CB-CD1 3.99Å; F168-L176 HydrophobicContact CD1-CB 4.25Å; E174-L176 PolarHBondContact O-N 3.35Å; L176-V202 HydrophobicContact CD1-CG1 4.05Å; L176-V202 HydrophobicContact CD2-CB 4.03Å; L176-V202 HydrophobicContact CD2-CG1 4.21Å; L176-I204 HydrophobicContact CD1-CD1 3.85Å
177	Q	90.6	Very high	89	Confident	109 Å²	109	65.4 Å²	65.4	51%	0.509	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	135.3	171.2	-67	177.5	-14.9	0	0	110.4	F168 R169 F179	F168-Q177 CarbonylContact C-O 3.58Å; F168-Q177 VanDerWaalsContact CA-O 3.29Å; F168-Q177 WeakPolarHBondContact CA-O 3.38Å; R169-Q177 PolarHBondContact N-O 3.21Å; R169-Q177 VanDerWaalsContact NH2-OE1 3.07Å; R169-Q177 PolarHBondContact O-N 3.13Å; Q177-F179 HydrophobicContact CB-CD2 4.47Å; Q177-F179 HydrophobicContact CB-CE2 3.58Å; Q177-F179 HydrophobicContact CB-CZ 3.94Å
178	M	93.2	Very high	88.8	Confident	113 Å²	113	67.1 Å²	67.1	56%	0.557	36%	0.362	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.2	132	178.1	-178.9	171.4	25.7	0	0	111.1	I166 F168	I166-M178 HydrophobicContact CG2-CG 3.75Å; I166-M178 HydrophobicContact CG2-SD 3.9Å; F168-M178 HydrophobicContact CD1-CB 3.85Å; F168-M178 HydrophobicContact CD1-CG 4.35Å; F168-M178 HydrophobicContact CE1-CB 3.62Å; F168-M178 HydrophobicContact CE1-CE 4.33Å; F168-M178 HydrophobicContact CE1-CG 3.94Å; F168-M178 HydrophobicContact CE1-SD 4.02Å; F168-M178 HydrophobicContact CZ-CB 4.34Å; F168-M178 HydrophobicContact CZ-CG 4.15Å; F168-M178 HydrophobicContact CZ-SD 3.82Å
179	F	91.8	Very high	88.6	Confident	52 Å²	52	68 Å²	68	23%	0.228	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	137.6	174.6	-60.9	-86.4	0	0	0	109.7	V167 R169 Q177 Y188	V167-F179 HydrophobicContact CB-CB 4.38Å; V167-F179 PolarHBondContact N-O 3.04Å; V167-F179 PolarHBondContact O-N 3.44Å; R169-F179 HydrophobicContact CB-CD2 4.24Å; R169-F179 HydrophobicContact CB-CE2 4.04Å; R169-F179 VanDerWaalsContact NH2-CZ 3.34Å; Q177-F179 HydrophobicContact CB-CD2 4.47Å; Q177-F179 HydrophobicContact CB-CE2 3.58Å; Q177-F179 HydrophobicContact CB-CZ 3.94Å; F179-Y188 HydrophobicContact CB-CE2 4.31Å; F179-Y188 WeakPolarHBondContact CD1-OH 3.45Å; F179-Y188 WeakPolarHBondContact CD2-OH 3.04Å; F179-Y188 WeakPolarHBondContact CE1-OH 3.38Å; F179-Y188 HydrophobicContact CG-CE2 4.44Å; F179-Y188 AromaticContact CG-CZ 3.86Å; F179-Y188 WeakPolarHBondContact CG-OH 3.21Å
180	I	93.3	Very high	88.2	Confident	122 Å²	122	67.3 Å²	67.3	63%	0.626	37%	0.366	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.7	120.8	177.1	-53.7	-179.8	0	0	0	107.2	I166	I166-I180 HydrophobicContact CD1-CB 4.39Å; I166-I180 HydrophobicContact CD1-CG1 3.88Å; I166-I180 HydrophobicContact CD1-CG2 4.17Å
181	V	92.8	Very high	87.8	Confident	8 Å²	8	70.6 Å²	70.6	5%	0.048	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	143.4	-179.6	-177.7	0	0	0	0	107.7	W152 S164 V165 V167 Q185 Y188	W152-V181 HydrophobicContact CH2-CG1 4.14Å; W152-V181 HydrophobicContact CZ2-CG1 4.33Å; S164-V181 CarbonylContact C-O 3.56Å; S164-V181 WeakPolarHBondContact CA-O 3.49Å; S164-V181 WeakPolarHBondContact CB-O 3.43Å; V165-V181 HydrophobicContact CB-CB 4.2Å; V165-V181 PolarHBondContact N-O 3.18Å; V165-V181 PolarHBondContact O-N 3.42Å; V167-V181 HydrophobicContact CG2-CG2 4.06Å; V181-Q185 HydrophobicContact CG1-CB 3.75Å; V181-Q185 HydrophobicContact CG1-CG 4.36Å; V181-Y188 HydrophobicContact CG2-CD2 3.74Å; V181-Y188 HydrophobicContact CG2-CE2 4.31Å; V181-Y188 HydrophobicContact CG2-CG 4.36Å
182	S	93.2	Very high	87.2	Confident	54 Å²	54	75.5 Å²	75.5	38%	0.378	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.5	144.4	179.3	179.9	0	0	0	0	111.2	D184 Q185	S182-D184 WeakPolarHBondContact CB-OD1 3.18Å; S182-D184 PolarHBondContact O-N 2.86Å; S182-D184 VanDerWaalsContact O-N 3.13Å; S182-D184 PolarHBondContact OG-OD1 2.94Å; S182-Q185 PolarHBondContact O-N 3.15Å; S182-Q185 VanDerWaalsContact O-N 3.11Å
183	S	90.6	Very high	86.8	Confident	15 Å²	15	72.7 Å²	72.7	11%	0.105	39%	0.389	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-12.8	-177	65.9	0	0	0	0	115.4	K154 A158 D163	K154-S183 WeakPolarHBondContact CE-O 3.39Å; K154-S183 PolarHBondContact NZ-O 3.04Å; A158-S183 WeakPolarHBondContact CB-OG 3.42Å; D163-S183 WeakPolarHBondContact O-CB 3.44Å; D163-S183 PolarHBondContact O-N 3.09Å; D163-S183 PolarHBondContact O-OG 2.87Å
184	D	89.3	Confident	86.1	Confident	116 Å²	116	76.2 Å²	76.2	62%	0.62	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.6	-29	175	66.1	-35.4	0	0	0	112.1	K154 S182	K154-D184 PolarHBondContact NZ-O 2.82Å; S182-D184 WeakPolarHBondContact CB-OD1 3.18Å; S182-D184 PolarHBondContact O-N 2.86Å; S182-D184 VanDerWaalsContact O-N 3.13Å; S182-D184 PolarHBondContact OG-OD1 2.94Å
185	Q	90.5	Very high	85.1	Confident	94 Å²	94	73.3 Å²	73.3	44%	0.439	39%	0.386	S	S	.	.			trans	-71.4	143.7	178.4	-58.3	-173.8	-70.2	0	0	111.8	W152 K154 V181 S182	W152-Q185 WeakPolarHBondContact CZ2-O 3.43Å; K154-Q185 VanDerWaalsContact CE-O 3.22Å; K154-Q185 WeakPolarHBondContact CE-O 3.3Å; K154-Q185 PolarHBondContact NZ-O 3.35Å; V181-Q185 HydrophobicContact CG1-CB 3.75Å; V181-Q185 HydrophobicContact CG1-CG 4.36Å; S182-Q185 PolarHBondContact O-N 3.15Å; S182-Q185 VanDerWaalsContact O-N 3.11Å
186	V	89.8	Confident	83.8	Confident	72 Å²	72	70.5 Å²	70.5	44%	0.436	37%	0.367	S	S	.	.			trans	-122.3	5.1	178.3	-69.6	0	0	0	0	111.8	M151 W152 K154	M151-V186 CarbonylContact C-O 3.59Å; M151-V186 VanDerWaalsContact CA-O 3.28Å; M151-V186 WeakPolarHBondContact CA-O 3.18Å; W152-V186 PolarHBondContact N-O 2.85Å; W152-V186 WeakPolarHBondContact O-CB 3.46Å; K154-V186 HydrophobicContact CD-CG1 4.03Å; K154-V186 HydrophobicContact CG-CG1 4.4Å
187	E	88	Confident	82.5	Confident	75 Å²	75	73.5 Å²	73.5	35%	0.35	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	148.4	177.1	62.8	170.9	-169.3	0	0	111.2	R149 L150 M151	R149-E187 IonicContact CZ-OE2 3.86Å; R149-E187 IonicContact NH1-OE2 2.85Å; R149-E187 PolarHBondContact NH1-OE2 2.79Å; L150-E187 CarbonylContact O-C 3.35Å; L150-E187 WeakPolarHBondContact O-CA 2.88Å; M151-E187 HydrophobicContact CG-CB 4.25Å
188	Y	88.1	Confident	81.4	Confident	35 Å²	35	72.4 Å²	72.4	14%	0.137	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	124.5	175.4	177	-114.3	0	0	0	109.7	R149 L150 V167 F179 V181 M190	R149-Y188 WeakPolarHBondContact CA-O 3.32Å; L150-Y188 PolarHBondContact N-O 2.85Å; L150-Y188 PolarHBondContact O-N 2.95Å; V167-Y188 HydrophobicContact CG1-CD1 4.3Å; V167-Y188 HydrophobicContact CG1-CE1 4.46Å; F179-Y188 HydrophobicContact CB-CE2 4.31Å; F179-Y188 WeakPolarHBondContact CD1-OH 3.45Å; F179-Y188 WeakPolarHBondContact CD2-OH 3.04Å; F179-Y188 WeakPolarHBondContact CE1-OH 3.38Å; F179-Y188 HydrophobicContact CG-CE2 4.44Å; F179-Y188 AromaticContact CG-CZ 3.86Å; F179-Y188 WeakPolarHBondContact CG-OH 3.21Å; V181-Y188 HydrophobicContact CG2-CD2 3.74Å; V181-Y188 HydrophobicContact CG2-CE2 4.31Å; V181-Y188 HydrophobicContact CG2-CG 4.36Å; Y188-M190 HydrophobicContact CD1-CG 3.58Å; Y188-M190 HydrophobicContact CD1-SD 4.37Å; Y188-M190 HydrophobicContact CE1-CG 3.73Å
189	N	86.1	Confident	80.4	Confident	74 Å²	74	70.3 Å²	70.3	40%	0.396	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	122.4	179.1	-71.2	-52.8	0	0	0	110.1	R149	R149-N189 WeakPolarHBondContact CD-OD1 3.08Å; R149-N189 WeakPolarHBondContact CG-OD1 3.16Å
190	M	80.3	Confident	79.6	Confident	0 Å²	0	70.5 Å²	70.5	0%	0	39%	0.388	C	S	.	.			trans	-105.9	40.7	-175	-59.3	-178.3	-68.9	0	0	111.7	W142 P148 L150 Y188 D192 F193 F203	W142-M190 HydrophobicContact CH2-CE 3.73Å; W142-M190 HydrophobicContact CH2-SD 4.34Å; W142-M190 HydrophobicContact CZ2-CE 3.75Å; W142-M190 HydrophobicContact CZ3-CE 4.46Å; P148-M190 HydrophobicContact CB-CB 4.28Å; P148-M190 HydrophobicContact CB-CE 4.28Å; P148-M190 HydrophobicContact CG-CB 4.11Å; P148-M190 VanDerWaalsContact CG-O 3.26Å; P148-M190 WeakPolarHBondContact CG-O 3.48Å; P148-M190 PolarHBondContact O-N 2.82Å; L150-M190 HydrophobicContact CB-CE 3.72Å; L150-M190 HydrophobicContact CB-SD 3.85Å; L150-M190 HydrophobicContact CD2-SD 4.36Å; Y188-M190 HydrophobicContact CD1-CG 3.58Å; Y188-M190 HydrophobicContact CD1-SD 4.37Å; Y188-M190 HydrophobicContact CE1-CG 3.73Å; M190-D192 PolarHBondContact O-N 3.04Å; M190-D192 VanDerWaalsContact O-N 3.09Å; M190-F193 HydrophobicContact CB-CB 3.99Å; M190-F193 WeakPolarHBondContact O-CB 3.47Å; M190-F193 PolarHBondContact O-N 3.45Å; M190-F203 HydrophobicContact CE-CE1 4.35Å; M190-F203 HydrophobicContact CE-CZ 4.5Å; M190-F203 HydrophobicContact SD-CD1 3.79Å; M190-F203 HydrophobicContact SD-CE1 3.14Å; M190-F203 WeakPolarHBondContact SD-CE1 3.39Å; M190-F203 HydrophobicContact SD-CZ 3.75Å
191	N	75.7	Confident	79	Confident	77 Å²	77	64.8 Å²	64.8	41%	0.412	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.1	-34.7	-170.5	-61.8	-23.2	0	0	0	113.6	R147 F193	R147-N191 WeakPolarHBondContact CB-OD1 3.35Å; R147-N191 VanDerWaalsContact CD-OD1 3.24Å; R147-N191 WeakPolarHBondContact CD-OD1 3.33Å; R147-N191 WeakPolarHBondContact CG-OD1 3.33Å; N191-F193 VanDerWaalsContact C-N 3.34Å
192	D	72	Confident	78.6	Confident	134 Å²	134	65.3 Å²	65.3	72%	0.717	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.2	-8.7	-178	-48.1	-38.6	0	0	0	112.9	M190 K194	M190-D192 PolarHBondContact O-N 3.04Å; M190-D192 VanDerWaalsContact O-N 3.09Å; D192-K194 PolarHBondContact O-N 2.97Å
193	F	73.1	Confident	78.2	Confident	15 Å²	15	62.7 Å²	62.7	7%	0.066	35%	0.345	C	S	.	.			trans	-83.3	108.4	179.5	-170	-92.8	0	0	0	109.6	W142 R169 Y171 M190 N191 F203	W142-F193 AromaticContact CH2-CD1 3.5Å; W142-F193 HydrophobicContact CH2-CD1 3.5Å; W142-F193 VanDerWaalsContact CH2-CD1 3.5Å; W142-F193 AromaticContact CH2-CE1 3.71Å; W142-F193 HydrophobicContact CH2-CE1 3.71Å; W142-F193 AromaticContact CZ3-CD1 3.7Å; W142-F193 HydrophobicContact CZ3-CD1 3.7Å; W142-F193 HydrophobicContact CZ3-CE1 4.11Å; R169-F193 VanDerWaalsContact CD-CD2 3.5Å; R169-F193 HydrophobicContact CG-CD2 3.59Å; R169-F193 HydrophobicContact CG-CE2 3.88Å; R169-F193 HydrophobicContact CG-CG 4.43Å; Y171-F193 HydrophobicContact CD1-CE2 4.41Å; Y171-F193 HydrophobicContact CD1-CZ 4.11Å; Y171-F193 HydrophobicContact CE1-CE1 4.38Å; Y171-F193 AromaticContact CE1-CE2 3.94Å; Y171-F193 HydrophobicContact CE1-CE2 3.94Å; Y171-F193 AromaticContact CE1-CZ 3.64Å; Y171-F193 HydrophobicContact CE1-CZ 3.64Å; M190-F193 HydrophobicContact CB-CB 3.99Å; M190-F193 WeakPolarHBondContact O-CB 3.47Å; M190-F193 PolarHBondContact O-N 3.45Å; N191-F193 VanDerWaalsContact C-N 3.34Å; F193-F203 AromaticContact CD1-CZ 4Å; F193-F203 HydrophobicContact CD1-CZ 4Å; F193-F203 HydrophobicContact CD2-CZ 4.39Å; F193-F203 HydrophobicContact CE1-CE2 4.37Å; F193-F203 AromaticContact CE1-CZ 3.74Å; F193-F203 HydrophobicContact CE1-CZ 3.74Å; F193-F203 HydrophobicContact CE2-CZ 4.16Å; F193-F203 HydrophobicContact CG-CZ 4.3Å; F193-F203 HydrophobicContact CZ-CE2 4.4Å; F193-F203 AromaticContact CZ-CZ 3.83Å; F193-F203 HydrophobicContact CZ-CZ 3.83Å
194	K	68.6	Low	78.1	Confident	161 Å²	161	63.7 Å²	63.7	70%	0.7	35%	0.348	S	S	*	.			trans	-91.8	129.3	173.6	-64.1	-177.7	-179.3	179.8	0	108.6	Y171 D192 T196	Y171-K194 PolarHBondContact OH-O 3.4Å; D192-K194 PolarHBondContact O-N 2.97Å; K194-T196 PolarHBondContact O-N 3.1Å; K194-T196 VanDerWaalsContact O-N 3.11Å
195	A	64.1	Low	78.1	Confident	37 Å²	37	58.1 Å²	58.1	31%	0.306	32%	0.319	S	S	.	.			trans	-73.1	107	167.6	0	0	0	0	0	107.7	N245	A195-N245 HydrophobicContact CB-CB 3.89Å
196	T	61.5	Low	78.2	Confident	60 Å²	60	55.3 Å²	55.3	37%	0.368	31%	0.305	S	S	.	.			trans	-82.2	133.8	171.3	-41.2	0	0	0	0	108	Y171 K194 M199	Y171-T196 PolarHBondContact OH-OG1 3.06Å; K194-T196 PolarHBondContact O-N 3.1Å; K194-T196 VanDerWaalsContact O-N 3.11Å; T196-M199 HydrophobicContact CG2-CE 4.39Å; T196-M199 HydrophobicContact CG2-CG 4.46Å; T196-M199 HydrophobicContact CG2-SD 4.09Å; T196-M199 PolarHBondContact O-N 3.2Å
197	E	60	Low	78.4	Confident	121 Å²	121	52.7 Å²	52.7	57%	0.565	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	142.3	-178.7	-162.2	156.4	-153.3	0	0	110.5	M199 N251	E197-M199 PolarHBondContact O-N 3.32Å; E197-M199 VanDerWaalsContact O-N 3.16Å; E197-N251 PolarHBondContact OE2-ND2 2.85Å
198	G	67.7	Low	78.7	Confident	86 Å²	86	52.8 Å²	52.8	89%	0.887	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.5	-22.1	-171.9	0	0	0	0	0	115.7
199	M	72.1	Confident	78.9	Confident	69 Å²	69	51.8 Å²	51.8	34%	0.34	28%	0.284	S	S	.	.			trans	-89.5	131.5	180	-62.5	-172.1	178.5	0	0	112.5	Y171 T196 E197 G201	Y171-M199 HydrophobicContact CD1-CB 3.6Å; Y171-M199 HydrophobicContact CD1-CG 4.44Å; Y171-M199 HydrophobicContact CD1-SD 4.03Å; Y171-M199 HydrophobicContact CD2-SD 4.17Å; Y171-M199 HydrophobicContact CE1-CB 4.25Å; Y171-M199 HydrophobicContact CE1-SD 4.41Å; Y171-M199 HydrophobicContact CG-CB 4.15Å; Y171-M199 HydrophobicContact CG-SD 3.89Å; T196-M199 HydrophobicContact CG2-CE 4.39Å; T196-M199 HydrophobicContact CG2-CG 4.46Å; T196-M199 HydrophobicContact CG2-SD 4.09Å; T196-M199 PolarHBondContact O-N 3.2Å; E197-M199 PolarHBondContact O-N 3.32Å; E197-M199 VanDerWaalsContact O-N 3.16Å; M199-G201 PolarHBondContact O-N 3.22Å
200	E	74.9	Confident	79	Confident	56 Å²	56	50.2 Å²	50.2	26%	0.262	29%	0.285	S	S	.	.			trans	-83.8	113.8	173.6	-173.2	169.2	-142.1	0	0	109.8	Y171 S172 V202 T242	Y171-E200 CarbonylContact C-O 3.44Å; Y171-E200 WeakPolarHBondContact CA-O 3.28Å; S172-E200 PolarHBondContact N-O 2.71Å; E200-V202 PolarHBondContact O-N 2.95Å; E200-T242 HydrophobicContact CG-CG2 3.96Å; E200-T242 WeakPolarHBondContact OE1-CB 2.86Å; E200-T242 VanDerWaalsContact OE1-CG2 3.22Å; E200-T242 WeakPolarHBondContact OE1-CG2 3.46Å; E200-T242 PolarHBondContact OE1-OG1 2.52Å
201	G	80.8	Confident	79.3	Confident	2 Å²	2	57.4 Å²	57.4	2%	0.021	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71	122.2	172.8	0	0	0	0	0	110.4	M199 T242 S243	M199-G201 PolarHBondContact O-N 3.22Å; G201-T242 VanDerWaalsContact O-CA 3.29Å; G201-T242 WeakPolarHBondContact O-CA 3.36Å; G201-S243 PolarHBondContact N-O 3Å; G201-S243 PolarHBondContact O-N 2.72Å
202	V	84.9	Confident	79.9	Confident	18 Å²	18	56.6 Å²	56.6	11%	0.109	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	125.7	-178.6	176.4	0	0	0	0	109.6	R169 G170 L176 E200 I204 I240	R169-V202 WeakPolarHBondContact CA-O 3.41Å; G170-V202 PolarHBondContact N-O 3.47Å; G170-V202 VanDerWaalsContact N-O 3.13Å; G170-V202 PolarHBondContact O-N 2.69Å; L176-V202 HydrophobicContact CD1-CG1 4.05Å; L176-V202 HydrophobicContact CD2-CB 4.03Å; L176-V202 HydrophobicContact CD2-CG1 4.21Å; E200-V202 PolarHBondContact O-N 2.95Å; V202-I204 HydrophobicContact CG1-CG1 4.4Å; V202-I240 HydrophobicContact CG1-CG2 4.21Å
203	F	85.2	Confident	80.8	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	128.3	173.2	-54.9	-90.5	0	0	0	110.1	W142 L150 F168 R169 M190 F193 L205 I240 V241	W142-F203 HydrophobicContact CH2-CE2 4.01Å; W142-F203 AromaticContact CH2-CZ 3.61Å; W142-F203 HydrophobicContact CH2-CZ 3.61Å; W142-F203 AromaticContact CZ2-CE2 3.67Å; W142-F203 HydrophobicContact CZ2-CE2 3.67Å; W142-F203 AromaticContact CZ2-CZ 3.72Å; W142-F203 HydrophobicContact CZ2-CZ 3.72Å; L150-F203 HydrophobicContact CD2-CB 4.26Å; L150-F203 HydrophobicContact CD2-CD1 4.05Å; L150-F203 HydrophobicContact CD2-CG 4.35Å; F168-F203 CarbonylContact O-C 3.57Å; F168-F203 VanDerWaalsContact O-CA 3.29Å; F168-F203 WeakPolarHBondContact O-CA 3.41Å; R169-F203 HydrophobicContact CB-CD1 4.09Å; R169-F203 HydrophobicContact CB-CE1 4.12Å; R169-F203 HydrophobicContact CG-CD1 3.98Å; R169-F203 HydrophobicContact CG-CE1 3.49Å; R169-F203 VanDerWaalsContact CG-CE1 3.49Å; R169-F203 HydrophobicContact CG-CZ 4.3Å; M190-F203 HydrophobicContact CE-CE1 4.35Å; M190-F203 HydrophobicContact CE-CZ 4.5Å; M190-F203 HydrophobicContact SD-CD1 3.79Å; M190-F203 HydrophobicContact SD-CE1 3.14Å; M190-F203 WeakPolarHBondContact SD-CE1 3.39Å; M190-F203 HydrophobicContact SD-CZ 3.75Å; F193-F203 AromaticContact CD1-CZ 4Å; F193-F203 HydrophobicContact CD1-CZ 4Å; F193-F203 HydrophobicContact CD2-CZ 4.39Å; F193-F203 HydrophobicContact CE1-CE2 4.37Å; F193-F203 AromaticContact CE1-CZ 3.74Å; F193-F203 HydrophobicContact CE1-CZ 3.74Å; F193-F203 HydrophobicContact CE2-CZ 4.16Å; F193-F203 HydrophobicContact CG-CZ 4.3Å; F193-F203 HydrophobicContact CZ-CE2 4.4Å; F193-F203 AromaticContact CZ-CZ 3.83Å; F193-F203 HydrophobicContact CZ-CZ 3.83Å; F203-L205 HydrophobicContact CB-CD1 4.08Å; F203-I240 VanDerWaalsContact O-CA 3.3Å; F203-I240 WeakPolarHBondContact O-CA 3.46Å; F203-V241 HydrophobicContact CB-CB 4.15Å; F203-V241 HydrophobicContact CD2-CB 4.26Å; F203-V241 WeakPolarHBondContact CD2-O 3.42Å; F203-V241 PolarHBondContact N-O 3.33Å; F203-V241 PolarHBondContact O-N 3.28Å
204	I	88	Confident	81.4	Confident	35 Å²	35	54.7 Å²	54.7	18%	0.179	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	126.7	172.8	-62.4	166.9	0	0	0	108	V167 F168 L176 V202 F206 A238 I240	V167-I204 CarbonylContact C-O 3.23Å; V167-I204 WeakPolarHBondContact CA-O 3.43Å; F168-I204 HydrophobicContact CB-CB 4.14Å; F168-I204 HydrophobicContact CD2-CB 4.46Å; F168-I204 HydrophobicContact CD2-CG2 4.39Å; F168-I204 PolarHBondContact N-O 3.03Å; F168-I204 PolarHBondContact O-N 3.07Å; L176-I204 HydrophobicContact CD1-CD1 3.85Å; V202-I204 HydrophobicContact CG1-CG1 4.4Å; I204-F206 HydrophobicContact CG2-CD1 3.98Å; I204-F206 HydrophobicContact CG2-CE1 4.14Å; I204-A238 HydrophobicContact CB-CB 4.35Å; I204-A238 HydrophobicContact CD1-CB 4.49Å; I204-A238 HydrophobicContact CG1-CB 4.08Å; I204-A238 HydrophobicContact CG2-CB 3.61Å; I204-I240 HydrophobicContact CG1-CG1 4.34Å
205	L	89.8	Confident	81.8	Confident	0 Å²	0	49 Å²	49	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	136.5	179.5	-60.5	84.7	0	0	0	111.1	I135 V138 L150 W152 I166 V167 F203	I135-L205 HydrophobicContact CD1-CB 3.76Å; V138-L205 HydrophobicContact CG1-CD1 4.27Å; L150-L205 HydrophobicContact CD1-CD1 4.49Å; L150-L205 HydrophobicContact CD2-CD1 3.67Å; L150-L205 HydrophobicContact CD2-CD2 3.62Å; L150-L205 HydrophobicContact CD2-CG 4.01Å; L150-L205 HydrophobicContact CG-CD1 4.41Å; L150-L205 HydrophobicContact CG-CD2 3.99Å; W152-L205 HydrophobicContact CD2-CD2 4.07Å; W152-L205 HydrophobicContact CE3-CD2 3.64Å; W152-L205 HydrophobicContact CZ3-CD2 4.03Å; I166-L205 WeakPolarHBondContact O-CA 3.4Å; V167-L205 HydrophobicContact CG1-CG 4.32Å; V167-L205 HydrophobicContact CG2-CD2 4.06Å; V167-L205 HydrophobicContact CG2-CG 4.14Å; F203-L205 HydrophobicContact CB-CD1 4.08Å
206	F	92.3	Very high	82.2	Confident	35 Å²	35	47.8 Å²	47.8	15%	0.154	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.8	153	168.5	53.1	-94.2	0	0	0	110.4	I166 F168 I204 F213 S214	I166-F206 HydrophobicContact CB-CD2 3.99Å; I166-F206 HydrophobicContact CB-CE1 4.32Å; I166-F206 HydrophobicContact CB-CE2 3.45Å; I166-F206 VanDerWaalsContact CB-CE2 3.45Å; I166-F206 HydrophobicContact CB-CZ 3.65Å; I166-F206 HydrophobicContact CG1-CD2 4.21Å; I166-F206 HydrophobicContact CG1-CE2 3.59Å; I166-F206 HydrophobicContact CG1-CZ 4.18Å; I166-F206 HydrophobicContact CG2-CE1 4.31Å; I166-F206 HydrophobicContact CG2-CE2 3.97Å; I166-F206 HydrophobicContact CG2-CZ 3.66Å; I166-F206 PolarHBondContact N-O 3.04Å; I166-F206 PolarHBondContact O-N 3.09Å; F168-F206 AromaticContact CD2-CE1 3.85Å; F168-F206 HydrophobicContact CD2-CE1 3.85Å; F168-F206 HydrophobicContact CD2-CZ 4.3Å; F168-F206 AromaticContact CE2-CE1 3.61Å; F168-F206 HydrophobicContact CE2-CE1 3.61Å; F168-F206 AromaticContact CE2-CZ 3.65Å; F168-F206 HydrophobicContact CE2-CZ 3.65Å; I204-F206 HydrophobicContact CG2-CD1 3.98Å; I204-F206 HydrophobicContact CG2-CE1 4.14Å; F206-F213 HydrophobicContact CD2-CB 3.88Å; F206-F213 AromaticContact CD2-CD1 3.46Å; F206-F213 HydrophobicContact CD2-CD1 3.46Å; F206-F213 VanDerWaalsContact CD2-CD1 3.46Å; F206-F213 HydrophobicContact CD2-CE1 4.32Å; F206-F213 HydrophobicContact CD2-CG 4.01Å; F206-F213 HydrophobicContact CE2-CB 4.3Å; F206-F213 AromaticContact CE2-CD1 3.17Å; F206-F213 HydrophobicContact CE2-CD1 3.17Å; F206-F213 AromaticContact CE2-CE1 3.59Å; F206-F213 HydrophobicContact CE2-CE1 3.59Å; F206-F213 AromaticContact CE2-CG 3.93Å; F206-F213 HydrophobicContact CE2-CG 3.93Å; F206-F213 HydrophobicContact CZ-CD1 4.26Å; F206-F213 HydrophobicContact CZ-CE1 4.47Å; F206-S214 WeakPolarHBondContact CB-O 3.16Å
207	N	93.9	Very high	82.4	Confident	16 Å²	16	46 Å²	46	9%	0.086	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	144.4	169.5	-62.3	-34.1	0	0	0	109.4	V132 P133 S164 V165 F213 S214	V132-N207 HydrophobicContact CG1-CB 3.78Å; P133-N207 PolarHBondContact O-ND2 3.15Å; S164-N207 CarbonylContact O-C 3.53Å; S164-N207 WeakPolarHBondContact O-CA 3.01Å; V165-N207 WeakPolarHBondContact CG2-OD1 3.38Å; N207-F213 CarbonylContact O-C 3.57Å; N207-F213 WeakPolarHBondContact O-CA 3.41Å; N207-S214 PolarHBondContact N-OG 3.47Å; N207-S214 PolarHBondContact O-N 2.86Å
208	K	93.2	Very high	82.2	Confident	78 Å²	78	44.9 Å²	44.9	34%	0.339	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	129.2	172.5	177.7	-175.6	-177.8	-63.7	0	108.5	D163 S164 I166 G210 H212 F213	D163-K208 WeakPolarHBondContact CA-O 3.42Å; D163-K208 WeakPolarHBondContact CB-O 3.47Å; S164-K208 PolarHBondContact N-O 2.7Å; S164-K208 VanDerWaalsContact N-O 3.14Å; S164-K208 PolarHBondContact O-N 3.31Å; I166-K208 HydrophobicContact CD1-CB 4.42Å; I166-K208 HydrophobicContact CD1-CD 4.18Å; I166-K208 HydrophobicContact CG1-CB 3.93Å; I166-K208 HydrophobicContact CG1-CD 4.31Å; K208-G210 PolarHBondContact NZ-O 2.73Å; K208-H212 WeakPolarHBondContact CA-O 3.19Å; K208-F213 HydrophobicContact CB-CD1 3.75Å; K208-F213 HydrophobicContact CB-CE1 3.83Å; K208-F213 HydrophobicContact CD-CE1 3.77Å; K208-F213 HydrophobicContact CG-CD1 3.84Å; K208-F213 HydrophobicContact CG-CE1 3.51Å; K208-F213 HydrophobicContact CG-CZ 4.39Å
209	H	92.8	Very high	81.6	Confident	14 Å²	14	45.2 Å²	45.2	7%	0.065	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	110.4	173.6	172.9	62	0	0	0	108.6	K130 V132 E160 D163 N211 H212	K130-H209 PolarHBondContact NZ-NE2 2.86Å; V132-H209 HydrophobicContact CG1-CB 3.93Å; V132-H209 HydrophobicContact CG2-CB 3.86Å; E160-H209 IonicContact OE1-CE1 3.7Å; E160-H209 IonicContact OE2-CE1 3.62Å; D163-H209 WeakPolarHBondContact OD1-CA 3.45Å; D163-H209 IonicContact OD1-CE1 2.81Å; D163-H209 IonicContact OD1-CG 3.5Å; D163-H209 IonicContact OD1-ND1 3.68Å; D163-H209 PolarHBondContact OD1-ND1 3.42Å; D163-H209 IonicContact OD2-CG 3.49Å; D163-H209 IonicContact OD2-ND1 3.85Å; D163-H209 PolarHBondContact OD2-ND1 2.03Å; H209-N211 PolarHBondContact O-N 2.76Å; H209-N211 VanDerWaalsContact O-N 3.15Å; H209-H212 PolarHBondContact N-O 2.93Å; H209-H212 WeakPolarHBondContact O-CA 3.41Å; H209-H212 WeakPolarHBondContact O-CB 3.42Å; H209-H212 PolarHBondContact O-N 2.81Å
210	G	88.8	Confident	80.2	Confident	40 Å²	40	51.7 Å²	51.7	41%	0.412	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.2	-120.2	-171.8	0	0	0	0	0	111.8	K208	K208-G210 PolarHBondContact NZ-O 2.73Å
211	N	86.5	Confident	78.5	Confident	151 Å²	151	56.6 Å²	56.6	81%	0.807	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.1	6.4	175.6	-66.9	-15.7	0	0	0	113.6	H209	H209-N211 PolarHBondContact O-N 2.76Å; H209-N211 VanDerWaalsContact O-N 3.15Å
212	H	88.9	Confident	75.9	Confident	61 Å²	61	65.5 Å²	65.5	28%	0.282	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	154.3	-178.1	-56	-97.8	0	0	0	110.5	Q34 V132 K208 H209	Q34-H212 PolarHBondContact OE1-CE1 3.36Å; V132-H212 HydrophobicContact CG2-CB 3.48Å; V132-H212 VanDerWaalsContact CG2-CB 3.48Å; K208-H212 WeakPolarHBondContact CA-O 3.19Å; H209-H212 PolarHBondContact N-O 2.93Å; H209-H212 WeakPolarHBondContact O-CA 3.41Å; H209-H212 WeakPolarHBondContact O-CB 3.42Å; H209-H212 PolarHBondContact O-N 2.81Å
213	F	90	Very high	73.3	Confident	104 Å²	104	70.9 Å²	70.9	46%	0.456	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	147.7	176.3	-54	-80.7	0	0	0	109.9	F206 N207 K208	F206-F213 HydrophobicContact CD2-CB 3.88Å; F206-F213 AromaticContact CD2-CD1 3.46Å; F206-F213 HydrophobicContact CD2-CD1 3.46Å; F206-F213 VanDerWaalsContact CD2-CD1 3.46Å; F206-F213 HydrophobicContact CD2-CE1 4.32Å; F206-F213 HydrophobicContact CD2-CG 4.01Å; F206-F213 HydrophobicContact CE2-CB 4.3Å; F206-F213 AromaticContact CE2-CD1 3.17Å; F206-F213 HydrophobicContact CE2-CD1 3.17Å; F206-F213 AromaticContact CE2-CE1 3.59Å; F206-F213 HydrophobicContact CE2-CE1 3.59Å; F206-F213 AromaticContact CE2-CG 3.93Å; F206-F213 HydrophobicContact CE2-CG 3.93Å; F206-F213 HydrophobicContact CZ-CD1 4.26Å; F206-F213 HydrophobicContact CZ-CE1 4.47Å; N207-F213 CarbonylContact O-C 3.57Å; N207-F213 WeakPolarHBondContact O-CA 3.41Å; K208-F213 HydrophobicContact CB-CD1 3.75Å; K208-F213 HydrophobicContact CB-CE1 3.83Å; K208-F213 HydrophobicContact CD-CE1 3.77Å; K208-F213 HydrophobicContact CG-CD1 3.84Å; K208-F213 HydrophobicContact CG-CE1 3.51Å; K208-F213 HydrophobicContact CG-CZ 4.39Å
214	S	86.5	Confident	70.5	Confident	5 Å²	5	73.5 Å²	73.5	4%	0.035	38%	0.383	C	S	.	.	P	Polyproline II helix	trans	-77	141.2	175.1	69.9	0	0	0	0	110.9	P133 F206 N207	P133-S214 WeakPolarHBondContact O-CB 3.36Å; F206-S214 WeakPolarHBondContact CB-O 3.16Å; N207-S214 PolarHBondContact N-OG 3.47Å; N207-S214 PolarHBondContact O-N 2.86Å
215	L	76.5	Confident	67.4	Low	42 Å²	42	81.4 Å²	81.4	22%	0.22	42%	0.416	C	S	.	.	P	Polyproline II helix	trans	-78.2	142.5	160.8	-65.1	178.4	0	0	0	110.5	E52 R134 P237	E52-L215 HydrophobicContact CB-CD1 3.59Å; E52-L215 HydrophobicContact CG-CD1 3.92Å; E52-L215 WeakPolarHBondContact O-CD1 3.41Å; R134-L215 WeakPolarHBondContact CB-O 3.49Å; R134-L215 VanDerWaalsContact CD-O 3.31Å; R134-L215 WeakPolarHBondContact CD-O 3.39Å; R134-L215 WeakPolarHBondContact CG-O 3Å; L215-P237 HydrophobicContact CD2-CB 4.38Å
216	P	71.1	Confident	64.5	Low	10 Å²	10	87.7 Å²	87.7	7%	0.065	45%	0.454	C	S	.	.	P	Polyproline II helix	trans	-63.9	150.2	173.9	32.3	-40.7	0	0	0	111.3	M218 P237 V239	P216-M218 PolarHBondContact O-N 2.63Å; P216-P237 WeakPolarHBondContact CD-O 3.38Å; P216-P237 WeakPolarHBondContact CG-O 3.12Å; P216-V239 HydrophobicContact CB-CB 4.13Å; P216-V239 HydrophobicContact CB-CG2 3.2Å; P216-V239 HydrophobicContact CG-CG2 4.42Å
217	T	66.4	Low	61.5	Low	24 Å²	24	92.7 Å²	92.7	15%	0.147	48%	0.483	C	S	.	.			trans	-81.4	111.9	165.3	-48.3	0	0	0	0	108.6	T54 R134 I135 D219	T54-T217 HydrophobicContact CG2-CG2 4.48Å; R134-T217 WeakPolarHBondContact CB-OG1 3.31Å; I135-T217 PolarHBondContact O-N 2.89Å; I135-T217 PolarHBondContact O-OG1 3.14Å; T217-D219 PolarHBondContact O-N 3.39Å; T217-D219 VanDerWaalsContact O-N 3.14Å
218	M	55.4	Low	58.4	Low	96 Å²	96	99.2 Å²	99.2	47%	0.473	52%	0.517	S	S	.	.			trans	-79.3	89.1	170.1	-65.1	-170.3	-65.9	0	0	108.9	P216 K220	P216-M218 PolarHBondContact O-N 2.63Å; M218-K220 PolarHBondContact O-N 2.75Å
219	D	54.9	Low	55.3	Low	94 Å²	94	104.6 Å²	104.6	50%	0.503	54%	0.544	S	S	.	.			trans	-65.7	128.5	167.3	-77.8	-28.6	0	0	0	109	T217 K221	T217-D219 PolarHBondContact O-N 3.39Å; T217-D219 VanDerWaalsContact O-N 3.14Å; D219-K221 PolarHBondContact O-N 2.85Å
220	K	44.3	Very low	52.2	Low	205 Å²	205	115 Å²	115	89%	0.891	58%	0.582	S	S	*	*			trans	-69.7	71.1	163.6	-66.6	-179.8	-177.8	176.4	0	107.9	M218 Q222	M218-K220 PolarHBondContact O-N 2.75Å; K220-Q222 PolarHBondContact O-N 2.88Å
221	K	39	Very low	49.3	Very low	159 Å²	159	118.6 Å²	118.6	69%	0.691	60%	0.599	S	S	*	*			trans	-61.1	111.8	157.9	-86.4	-173.8	178.9	176.5	0	105	D219 V223	D219-K221 PolarHBondContact O-N 2.85Å; K221-V223 VanDerWaalsContact C-N 3.29Å; K221-V223 PolarHBondContact O-N 2.76Å
222	Q	26.1	Very low	46.3	Very low	188 Å²	188	117.5 Å²	117.5	88%	0.879	60%	0.598	S	S	*	*			trans	-55.6	105.8	164.1	-68.5	-161.1	13.3	0	0	105.4	K220 G224	K220-Q222 PolarHBondContact O-N 2.88Å; Q222-G224 VanDerWaalsContact C-N 3.33Å; Q222-G224 PolarHBondContact O-N 2.8Å
223	V	28.9	Very low	43.1	Very low	132 Å²	132	121.8 Å²	121.8	80%	0.8	62%	0.621	S	S	*	*			trans	-54.2	110.6	163	176	0	0	0	0	103.6	K221 K225	K221-V223 VanDerWaalsContact C-N 3.29Å; K221-V223 PolarHBondContact O-N 2.76Å; V223-K225 PolarHBondContact O-N 2.8Å
224	G	27.1	Very low	40.1	Very low	54 Å²	54	126.4 Å²	126.4	56%	0.557	64%	0.635	S	S	*	*			trans	-48.6	132.1	-178.3	0	0	0	0	0	108	Q222 V226	Q222-G224 VanDerWaalsContact C-N 3.33Å; Q222-G224 PolarHBondContact O-N 2.8Å; G224-V226 PolarHBondContact O-N 2.89Å
225	K	22.9	Very low	37.1	Very low	201 Å²	201	131.5 Å²	131.5	87%	0.874	67%	0.666	S	S	*	*			trans	-31.6	98	177.3	-75.3	174.4	173.1	176.2	0	110.9	V223	V223-K225 PolarHBondContact O-N 2.8Å
226	V	30.1	Very low	34.9	Very low	133 Å²	133	134.1 Å²	134.1	81%	0.806	68%	0.676	S	S	*	*			trans	-103.3	122.7	153	-178.9	0	0	0	0	103.7	G224	G224-V226 PolarHBondContact O-N 2.89Å
227	N	27.5	Very low	33.6	Very low	140 Å²	140	138.4 Å²	138.4	75%	0.749	70%	0.704	S	S	*	*			trans	-57.4	140	-164.8	-66	-41.6	0	0	0	112.5
228	N	28.9	Very low	32.7	Very low	152 Å²	152	138.4 Å²	138.4	81%	0.813	71%	0.706	S	S	*	*			trans	44.2	81.4	157.7	-68	-10.4	0	0	0	117.9
229	E	29.4	Very low	32.7	Very low	191 Å²	191	135.2 Å²	135.2	89%	0.893	69%	0.692	S	S	*	*			trans	-156.4	147.7	140.4	-109.2	158.5	-143.6	0	0	110.5
230	R	28.1	Very low	32.7	Very low	233 Å²	233	133.5 Å²	133.5	88%	0.879	68%	0.682	S	S	*	*			trans	-65.5	129.1	-163.1	-158.4	173.4	-151.9	166.9	4.8	110.8	T232	R230-T232 PolarHBondContact O-N 3.43Å; R230-T232 VanDerWaalsContact O-N 3.17Å
231	P	26.8	Very low	33.2	Very low	116 Å²	116	124.7 Å²	124.7	75%	0.753	65%	0.645	S	S	*	*			trans	-75.6	110.9	-176.3	-1.1	15	0	0	0	111	I233	P231-I233 PolarHBondContact O-N 3.15Å
232	T	23.2	Very low	33.7	Very low	128 Å²	128	120.2 Å²	120.2	79%	0.785	63%	0.632	S	S	*	*			trans	-82.6	108.6	164.2	-45.5	0	0	0	0	108.3	R230 R234	R230-T232 PolarHBondContact O-N 3.43Å; R230-T232 VanDerWaalsContact O-N 3.17Å; T232-R234 PolarHBondContact O-N 2.91Å; T232-R234 VanDerWaalsContact O-N 3.08Å
233	I	23.1	Very low	34.9	Very low	151 Å²	151	112 Å²	112	77%	0.774	60%	0.595	S	S	*	*			trans	-67	103.8	178.3	-61	170.6	0	0	0	108.5	P231 T235	P231-I233 PolarHBondContact O-N 3.15Å; I233-T235 HydrophobicContact CG2-CG2 4.44Å
234	R	25.7	Very low	35.6	Very low	201 Å²	201	113 Å²	113	76%	0.758	59%	0.589	S	S	*	*			trans	-93.8	100.7	166.2	-76.4	-174.9	173.6	-164.9	-4.7	109.2	T232 K236	T232-R234 PolarHBondContact O-N 2.91Å; T232-R234 VanDerWaalsContact O-N 3.08Å; R234-K236 PolarHBondContact O-N 3.14Å
235	T	23.2	Very low	36	Very low	111 Å²	111	113.4 Å²	113.4	68%	0.681	58%	0.578	S	S	*	*			trans	-68.5	110.7	162.4	41.7	0	0	0	0	108.5	I233	I233-T235 HydrophobicContact CG2-CG2 4.44Å
236	K	31.8	Very low	36.8	Very low	98 Å²	98	113 Å²	113	43%	0.426	58%	0.576	S	S	.	*			trans	-121.7	126.5	171.2	-73.2	-167.2	178.5	-174.1	0	110.4	R234 A238 I240	R234-K236 PolarHBondContact O-N 3.14Å; K236-A238 PolarHBondContact O-N 3.36Å; K236-A238 VanDerWaalsContact O-N 3.16Å; K236-I240 HydrophobicContact CB-CD1 4.45Å; K236-I240 HydrophobicContact CD-CD1 3.48Å; K236-I240 VanDerWaalsContact CD-CD1 3.48Å
237	P	43.2	Very low	36.8	Very low	100 Å²	100	113.1 Å²	113.1	65%	0.649	57%	0.572	S	S	*	*	S	Bend	trans	-77	8.8	-174.2	29.8	-34.7	0	0	0	114.7	L215 P216	L215-P237 HydrophobicContact CD2-CB 4.38Å; P216-P237 WeakPolarHBondContact CD-O 3.38Å; P216-P237 WeakPolarHBondContact CG-O 3.12Å
238	A	47.6	Very low	37	Very low	24 Å²	24	109.2 Å²	109.2	20%	0.198	56%	0.556	C	S	.	*	S	Bend	trans	-118.7	143	175.6	0	0	0	0	0	109.7	I204 K236 I240	I204-A238 HydrophobicContact CB-CB 4.35Å; I204-A238 HydrophobicContact CD1-CB 4.49Å; I204-A238 HydrophobicContact CG1-CB 4.08Å; I204-A238 HydrophobicContact CG2-CB 3.61Å; K236-A238 PolarHBondContact O-N 3.36Å; K236-A238 VanDerWaalsContact O-N 3.16Å; A238-I240 HydrophobicContact CB-CG1 3.94Å; A238-I240 PolarHBondContact O-N 3.34Å
239	V	56	Low	37.2	Very low	28 Å²	28	106.3 Å²	106.3	17%	0.17	55%	0.553	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-67.6	96.2	160	-176.8	0	0	0	0	105	V138 P216 V241	V138-V239 HydrophobicContact CB-CG1 3.85Å; V138-V239 HydrophobicContact CG1-CG1 4.25Å; V138-V239 HydrophobicContact CG2-CB 4.15Å; V138-V239 HydrophobicContact CG2-CG1 3.75Å; V138-V239 HydrophobicContact CG2-CG2 3.86Å; P216-V239 HydrophobicContact CB-CB 4.13Å; P216-V239 HydrophobicContact CB-CG2 3.2Å; P216-V239 HydrophobicContact CG-CG2 4.42Å; V239-V241 HydrophobicContact CG1-CG2 3.98Å; V239-V241 PolarHBondContact O-N 3.43Å
240	I	53.5	Low	37.2	Very low	58 Å²	58	104.6 Å²	104.6	30%	0.297	55%	0.55	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-85.7	102.6	168.7	-54.9	-174	0	0	0	106	V202 F203 I204 K236 A238 T242	V202-I240 HydrophobicContact CG1-CG2 4.21Å; F203-I240 VanDerWaalsContact O-CA 3.3Å; F203-I240 WeakPolarHBondContact O-CA 3.46Å; I204-I240 HydrophobicContact CG1-CG1 4.34Å; K236-I240 HydrophobicContact CB-CD1 4.45Å; K236-I240 HydrophobicContact CD-CD1 3.48Å; K236-I240 VanDerWaalsContact CD-CD1 3.48Å; A238-I240 HydrophobicContact CB-CG1 3.94Å; A238-I240 PolarHBondContact O-N 3.34Å; I240-T242 HydrophobicContact CG2-CG2 3.49Å; I240-T242 VanDerWaalsContact CG2-CG2 3.49Å; I240-T242 PolarHBondContact O-N 3.34Å
241	V	54.4	Low	37.3	Very low	20 Å²	20	96.4 Å²	96.4	12%	0.121	52%	0.524	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	115.4	160.4	-174.2	0	0	0	0	105.3	V138 L150 F203 V239	V138-V241 HydrophobicContact CB-CG2 4.23Å; V138-V241 HydrophobicContact CG1-CG2 3.45Å; V138-V241 VanDerWaalsContact CG1-CG2 3.45Å; L150-V241 HydrophobicContact CD1-CG2 4.3Å; F203-V241 HydrophobicContact CB-CB 4.15Å; F203-V241 HydrophobicContact CD2-CB 4.26Å; F203-V241 WeakPolarHBondContact CD2-O 3.42Å; F203-V241 PolarHBondContact N-O 3.33Å; F203-V241 PolarHBondContact O-N 3.28Å; V239-V241 HydrophobicContact CG1-CG2 3.98Å; V239-V241 PolarHBondContact O-N 3.43Å
242	T	51	Low	37.4	Very low	66 Å²	66	98.6 Å²	98.6	41%	0.405	53%	0.526	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	125.5	164.4	65.2	0	0	0	0	109.4	E200 G201 I240	E200-T242 HydrophobicContact CG-CG2 3.96Å; E200-T242 WeakPolarHBondContact OE1-CB 2.86Å; E200-T242 VanDerWaalsContact OE1-CG2 3.22Å; E200-T242 WeakPolarHBondContact OE1-CG2 3.46Å; E200-T242 PolarHBondContact OE1-OG1 2.52Å; G201-T242 VanDerWaalsContact O-CA 3.29Å; G201-T242 WeakPolarHBondContact O-CA 3.36Å; I240-T242 HydrophobicContact CG2-CG2 3.49Å; I240-T242 VanDerWaalsContact CG2-CG2 3.49Å; I240-T242 PolarHBondContact O-N 3.34Å
243	S	49.8	Very low	37.5	Very low	15 Å²	15	97.6 Å²	97.6	11%	0.105	52%	0.52	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	109.2	172	-172.7	0	0	0	0	108.1	W142 G201	W142-S243 PolarHBondContact NE1-OG 2.85Å; G201-S243 PolarHBondContact N-O 3Å; G201-S243 PolarHBondContact O-N 2.72Å
244	K	44.2	Very low	38	Very low	154 Å²	154	92.9 Å²	92.9	67%	0.67	50%	0.498	S	S	*	.			trans	-92.8	110.3	160.9	-66.6	-171	178.2	-171.3	0	106.6	K246	K244-K246 PolarHBondContact O-N 2.73Å; K244-K246 VanDerWaalsContact O-N 3.13Å
245	N	36.2	Very low	38.7	Very low	61 Å²	61	87.9 Å²	87.9	33%	0.326	49%	0.494	S	S	.	.			trans	-68.6	112.4	175.1	-169.2	6.9	0	0	0	108.6	A195 N247	A195-N245 HydrophobicContact CB-CB 3.89Å; N245-N247 PolarHBondContact OD1-N 2.98Å; N245-N247 PolarHBondContact OD1-O 3.47Å
246	K	38.2	Very low	39.2	Very low	194 Å²	194	90.9 Å²	90.9	84%	0.843	50%	0.5	S	S	*	.	S	Bend	trans	-92.9	-1.2	169.6	-76.6	-166.3	175.5	-171.8	0	113.2	K244	K244-K246 PolarHBondContact O-N 2.73Å; K244-K246 VanDerWaalsContact O-N 3.13Å
247	N	30.5	Very low	39.5	Very low	134 Å²	134	87.4 Å²	87.4	72%	0.717	49%	0.487	S	S	*	.			trans	-142.4	76.7	-177.8	-75.7	-23.3	0	0	0	110.4	N245	N245-N247 PolarHBondContact OD1-N 2.98Å; N245-N247 PolarHBondContact OD1-O 3.47Å
248	S	32.9	Very low	38.9	Very low	58 Å²	58	87.2 Å²	87.2	41%	0.406	49%	0.486	S	S	.	.			trans	-103.8	75.6	149.8	-160	0	0	0	0	107.9	N250	S248-N250 PolarHBondContact O-N 2.78Å
249	A	31.5	Very low	38.5	Very low	92 Å²	92	97 Å²	97	76%	0.76	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70	88.7	165.1	0	0	0	0	0	107.7
250	N	30.8	Very low	37.4	Very low	155 Å²	155	102.3 Å²	102.3	83%	0.829	54%	0.54	S	S	*	.	T	Hydrogen-bonded Turn	trans	-163.9	29.9	150.7	-100.6	9.1	0	0	0	111.2	S248	S248-N250 PolarHBondContact O-N 2.78Å
251	N	30.5	Very low	36.6	Very low	60 Å²	60	100.2 Å²	100.2	32%	0.321	53%	0.532	S	S	.	.	S	Bend	trans	-94.4	130.7	161.5	-78.1	2.9	0	0	0	108	E197 T253	E197-N251 PolarHBondContact OE2-ND2 2.85Å; N251-T253 PolarHBondContact O-N 2.74Å
252	M	27.3	Very low	35.6	Very low	162 Å²	162	103.9 Å²	103.9	80%	0.798	56%	0.555	S	S	*	*			trans	-65.8	80.2	-179.4	-166.5	-178.1	-62.5	0	0	108.2	V254	M252-V254 VanDerWaalsContact C-N 3.34Å; M252-V254 HydrophobicContact CG-CG2 4.32Å; M252-V254 PolarHBondContact O-N 2.76Å
253	T	26.3	Very low	34.9	Very low	107 Å²	107	108.1 Å²	108.1	66%	0.656	57%	0.57	S	S	*	*			trans	-66.6	96.2	172.3	49.3	0	0	0	0	107.2	N251 S255	N251-T253 PolarHBondContact O-N 2.74Å; T253-S255 PolarHBondContact O-N 3.46Å
254	V	32.6	Very low	34.3	Very low	53 Å²	53	115.8 Å²	115.8	32%	0.321	60%	0.601	S	S	.	*	B	Isolated β-bridge	trans	-78.5	102.7	168	-177.8	0	0	0	0	106	M252 E256 V257	M252-V254 VanDerWaalsContact C-N 3.34Å; M252-V254 HydrophobicContact CG-CG2 4.32Å; M252-V254 PolarHBondContact O-N 2.76Å; V254-E256 WeakPolarHBondContact CG1-O 3.26Å; V254-E256 PolarHBondContact O-N 2.73Å; V254-V257 HydrophobicContact CG1-CG2 4.21Å
255	S	40.9	Very low	34.1	Very low	96 Å²	96	111.3 Å²	111.3	67%	0.671	58%	0.584	S	S	*	*	S	Bend	trans	-62.4	-26.3	-177.2	-55.5	0	0	0	0	113.2	T253	T253-S255 PolarHBondContact O-N 3.46Å
256	E	35.2	Very low	34.4	Very low	173 Å²	173	112.7 Å²	112.7	81%	0.808	60%	0.603	S	S	*	*			trans	-147.3	118.4	175.6	-75.7	-176.4	142.6	0	0	110	V254	V254-E256 WeakPolarHBondContact CG1-O 3.26Å; V254-E256 PolarHBondContact O-N 2.73Å
257	V	36.6	Very low	34.5	Very low	26 Å²	26	104.6 Å²	104.6	16%	0.158	57%	0.57	C	S	.	*			trans	-80.1	137.5	163.3	179.9	0	0	0	0	107.5	V254 A261 I265 I270 P274	V254-V257 HydrophobicContact CG1-CG2 4.21Å; V257-A261 HydrophobicContact CG1-CB 4.08Å; V257-I265 HydrophobicContact CG1-CD1 4.07Å; V257-I270 HydrophobicContact CG2-CG2 4.2Å; V257-P274 HydrophobicContact CB-CG 3.9Å; V257-P274 HydrophobicContact CG1-CG 3.76Å
258	P	31.9	Very low	35.2	Very low	95 Å²	95	102 Å²	102	62%	0.617	56%	0.557	S	S	*	*			trans	-50.8	144.7	179.4	-27	34	0	0	0	112.6	Q260	P258-Q260 CarbonylContact O-C 3.48Å; P258-Q260 PolarHBondContact O-N 2.74Å
259	R	38.2	Very low	35.3	Very low	230 Å²	230	101.5 Å²	101.5	87%	0.868	55%	0.553	S	S	*	*	S	Bend	trans	-52.1	-16.4	-175.6	-76.5	-177.1	176.9	168.2	0.8	115.5
260	Q	33.1	Very low	36	Very low	139 Å²	139	97.7 Å²	97.7	65%	0.65	52%	0.52	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-134.2	112.2	169.6	-71	-178.3	-42	0	0	107.7	P258	P258-Q260 CarbonylContact O-C 3.48Å; P258-Q260 PolarHBondContact O-N 2.74Å
261	A	37.3	Very low	36.9	Very low	14 Å²	14	93.5 Å²	93.5	12%	0.116	50%	0.502	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	118	166.8	0	0	0	0	0	107.8	V257 I265	V257-A261 HydrophobicContact CG1-CB 4.08Å; A261-I265 HydrophobicContact CB-CD1 3.91Å
262	T	32.7	Very low	37.5	Very low	98 Å²	98	96 Å²	96	60%	0.601	51%	0.512	S	S	*	.			trans	-103	9.1	179.3	43.5	0	0	0	0	113
263	E	35.9	Very low	38.6	Very low	154 Å²	154	88.6 Å²	88.6	72%	0.72	48%	0.476	S	S	*	.	S	Bend	trans	-125.8	154.6	178	-72.1	-174.6	175.7	0	0	111	I265	E263-I265 WeakPolarHBondContact O-CG1 3.1Å; E263-I265 PolarHBondContact O-N 3.13Å; E263-I265 VanDerWaalsContact O-N 3.16Å
264	K	37.6	Very low	39.5	Very low	176 Å²	176	84.2 Å²	84.2	77%	0.765	45%	0.45	S	S	*	.			trans	-65	106.4	173.6	-168.4	179.6	-175.7	-175.5	0	110.1
265	I	39.3	Very low	40.1	Very low	61 Å²	61	90.9 Å²	90.9	31%	0.313	47%	0.469	S	S	.	.			trans	-106.8	128.3	177.6	-49.3	175.4	0	0	0	108.7	V257 A261 E263 V267	V257-I265 HydrophobicContact CG1-CD1 4.07Å; A261-I265 HydrophobicContact CB-CD1 3.91Å; E263-I265 WeakPolarHBondContact O-CG1 3.1Å; E263-I265 PolarHBondContact O-N 3.13Å; E263-I265 VanDerWaalsContact O-N 3.16Å; I265-V267 HydrophobicContact CB-CG2 4.41Å; I265-V267 HydrophobicContact CG2-CG2 3.25Å
266	A	43.7	Very low	40.1	Very low	89 Å²	89	91.7 Å²	91.7	74%	0.736	46%	0.462	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.6	121.9	162.4	0	0	0	0	0	107.6
267	V	40.3	Very low	40.4	Very low	24 Å²	24	84.5 Å²	84.5	15%	0.145	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	135.2	177.3	-166.4	0	0	0	0	109.1	I265 S269 I270 V283	I265-V267 HydrophobicContact CB-CG2 4.41Å; I265-V267 HydrophobicContact CG2-CG2 3.25Å; V267-S269 VanDerWaalsContact C-N 3.3Å; V267-S269 PolarHBondContact O-N 2.83Å; V267-I270 HydrophobicContact CB-CG2 4.12Å; V267-I270 HydrophobicContact CG1-CG2 3.98Å; V267-I270 HydrophobicContact CG2-CG2 4.34Å; V267-V283 WeakPolarHBondContact O-CG1 3.49Å
268	D	43.7	Very low	40.3	Very low	81 Å²	81	87.5 Å²	87.5	43%	0.433	45%	0.451	S	S	.	.	S	Bend	trans	-62.5	-34.5	180	-51	-15.6	0	0	0	112.4	S285	D268-S285 PolarHBondContact O-N 2.85Å
269	S	35.8	Very low	40.8	Very low	47 Å²	47	88 Å²	88	33%	0.329	45%	0.445	S	S	.	.			trans	-158	133.8	177.3	-62.3	0	0	0	0	112.3	V267 S285	V267-S269 VanDerWaalsContact C-N 3.3Å; V267-S269 PolarHBondContact O-N 2.83Å; S269-S285 WeakPolarHBondContact CA-O 3.48Å
270	I	46.5	Very low	41	Very low	11 Å²	11	84.4 Å²	84.4	6%	0.056	44%	0.435	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	141.2	169.5	50	166.8	0	0	0	110.7	V257 V267 V273 V283 S285 I286	V257-I270 HydrophobicContact CG2-CG2 4.2Å; V267-I270 HydrophobicContact CB-CG2 4.12Å; V267-I270 HydrophobicContact CG1-CG2 3.98Å; V267-I270 HydrophobicContact CG2-CG2 4.34Å; I270-V273 HydrophobicContact CD1-CB 4.14Å; I270-V273 HydrophobicContact CD1-CG2 3.56Å; I270-V283 HydrophobicContact CD1-CG1 4.37Å; I270-V283 HydrophobicContact CD1-CG2 4.01Å; I270-V283 HydrophobicContact CG1-CG1 3.81Å; I270-V283 HydrophobicContact CG1-CG2 4.35Å; I270-S285 PolarHBondContact N-O 3.45Å; I270-I286 HydrophobicContact CD1-CD1 4.48Å; I270-I286 HydrophobicContact CD1-CG1 4.34Å; I270-I286 HydrophobicContact CG1-CG1 4.06Å
271	S	49.3	Very low	41.6	Very low	67 Å²	67	79 Å²	79	47%	0.469	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	-39.3	176.8	-44.6	0	0	0	0	111.8
272	E	43.7	Very low	42	Very low	113 Å²	113	81 Å²	81	53%	0.528	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	136.8	-178.1	-164.4	179.2	172.3	0	0	109.4
273	V	49.9	Very low	42.7	Very low	7 Å²	7	76.5 Å²	76.5	4%	0.042	40%	0.399	C	S	.	.			trans	-77.8	149.2	174.4	-170.3	0	0	0	0	109.6	I270 I281 I286 P290	I270-V273 HydrophobicContact CD1-CB 4.14Å; I270-V273 HydrophobicContact CD1-CG2 3.56Å; V273-I281 HydrophobicContact CG1-CD1 3.65Å; V273-I286 HydrophobicContact CG2-CD1 3.72Å; V273-I286 HydrophobicContact CG2-CG2 4.3Å; V273-P290 HydrophobicContact CB-CG 3.79Å; V273-P290 WeakPolarHBondContact O-CG 3.49Å
274	P	45.8	Very low	43.3	Very low	15 Å²	15	73 Å²	73	10%	0.097	39%	0.386	C	S	.	.			trans	-59.5	140.9	168.9	-24.2	34	0	0	0	112.6	V257 Q276	V257-P274 HydrophobicContact CB-CG 3.9Å; V257-P274 HydrophobicContact CG1-CG 3.76Å; P274-Q276 PolarHBondContact O-N 2.94Å; P274-Q276 VanDerWaalsContact O-N 3.12Å
275	R	45.7	Very low	43.4	Very low	192 Å²	192	67 Å²	67	73%	0.725	37%	0.366	S	S	*	.	S	Bend	trans	-59.9	-20.4	177.9	-70.9	-175.1	-178.8	178.8	0.4	114.7	P290 Q292	R275-P290 HydrophobicContact CG-CB 4.37Å; R275-Q292 VanDerWaalsContact O-O 3.08Å
276	Q	38.9	Very low	44	Very low	114 Å²	114	64.2 Å²	64.2	53%	0.533	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	97.3	174.9	-71.6	-164.9	-37.3	0	0	108.8	P274	P274-Q276 PolarHBondContact O-N 2.94Å; P274-Q276 VanDerWaalsContact O-N 3.12Å
277	A	42.5	Very low	44.3	Very low	21 Å²	21	63.5 Å²	63.5	17%	0.174	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	135.3	162.5	0	0	0	0	0	108.2	I281	A277-I281 HydrophobicContact CB-CD1 3.56Å; A277-I281 HydrophobicContact CB-CG1 4.12Å
278	T	35.3	Very low	44.5	Very low	90 Å²	90	67.6 Å²	67.6	55%	0.552	36%	0.359	S	S	*	.	S	Bend	trans	-99.3	-5.2	177.4	19.4	0	0	0	0	113
279	E	41.5	Very low	44.8	Very low	105 Å²	105	64 Å²	64	49%	0.491	34%	0.34	S	S	.	.	S	Bend	trans	-142.1	160.7	175.5	-69	-166.2	165.9	0	0	112.1	I281	E279-I281 PolarHBondContact O-N 3.19Å
280	K	42.5	Very low	45.2	Very low	154 Å²	154	62.2 Å²	62.2	67%	0.67	33%	0.327	S	S	*	.			trans	-52.3	119.9	-179.8	-68.5	-179.6	-179.8	180	0	112
281	I	44.7	Very low	45.2	Very low	27 Å²	27	71.2 Å²	71.2	14%	0.138	36%	0.36	C	S	.	.			trans	-99	129.1	171.1	-49.9	-179.5	0	0	0	108	V273 A277 E279 V283	V273-I281 HydrophobicContact CG1-CD1 3.65Å; A277-I281 HydrophobicContact CB-CD1 3.56Å; A277-I281 HydrophobicContact CB-CG1 4.12Å; E279-I281 PolarHBondContact O-N 3.19Å; I281-V283 HydrophobicContact CB-CG2 4.45Å; I281-V283 HydrophobicContact CG2-CG2 3.33Å
282	A	47.1	Very low	44.8	Very low	55 Å²	55	74.4 Å²	74.4	46%	0.455	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	120.7	166.7	0	0	0	0	0	107.5
283	V	46.4	Very low	44.9	Very low	3 Å²	3	70.2 Å²	70.2	2%	0.018	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	131.3	-179.1	-168.9	0	0	0	0	109.1	V267 I270 I281 S285 I286 V299 D300	V267-V283 WeakPolarHBondContact O-CG1 3.49Å; I270-V283 HydrophobicContact CD1-CG1 4.37Å; I270-V283 HydrophobicContact CD1-CG2 4.01Å; I270-V283 HydrophobicContact CG1-CG1 3.81Å; I270-V283 HydrophobicContact CG1-CG2 4.35Å; I281-V283 HydrophobicContact CB-CG2 4.45Å; I281-V283 HydrophobicContact CG2-CG2 3.33Å; V283-S285 WeakPolarHBondContact CG1-O 3.02Å; V283-I286 HydrophobicContact CB-CD1 4.02Å; V283-I286 HydrophobicContact CB-CG1 3.89Å; V283-I286 HydrophobicContact CG1-CD1 4.3Å; V283-I286 HydrophobicContact CG1-CG1 3.63Å; V283-I286 HydrophobicContact CG2-CD1 4.12Å; V283-I286 HydrophobicContact CG2-CG1 4.33Å; V283-V299 WeakPolarHBondContact O-CA 3.49Å; V283-V299 WeakPolarHBondContact O-CG1 3.32Å; V283-D300 PolarHBondContact O-N 3.19Å
284	D	49.3	Very low	44.3	Very low	80 Å²	80	73.6 Å²	73.6	43%	0.428	37%	0.374	S	S	.	.	S	Bend	trans	-75.3	-31.6	-178.1	-58.4	-4.2	0	0	0	111.5	S301	D284-S301 PolarHBondContact O-N 3.48Å
285	S	39.3	Very low	44.4	Very low	51 Å²	51	78 Å²	78	36%	0.357	39%	0.393	S	S	.	.			trans	-151.2	130.1	176.5	-71.8	0	0	0	0	113.7	D268 S269 I270 V283 S301	D268-S285 PolarHBondContact O-N 2.85Å; S269-S285 WeakPolarHBondContact CA-O 3.48Å; I270-S285 PolarHBondContact N-O 3.45Å; V283-S285 WeakPolarHBondContact CG1-O 3.02Å; S285-S301 WeakPolarHBondContact CA-O 3.35Å
286	I	51.7	Low	44.4	Very low	2 Å²	2	76 Å²	76	1%	0.01	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	131.1	175.5	-57.9	173.8	0	0	0	110	I270 V273 V283 E288 V289 V299 S301 S303	I270-I286 HydrophobicContact CD1-CD1 4.48Å; I270-I286 HydrophobicContact CD1-CG1 4.34Å; I270-I286 HydrophobicContact CG1-CG1 4.06Å; V273-I286 HydrophobicContact CG2-CD1 3.72Å; V273-I286 HydrophobicContact CG2-CG2 4.3Å; V283-I286 HydrophobicContact CB-CD1 4.02Å; V283-I286 HydrophobicContact CB-CG1 3.89Å; V283-I286 HydrophobicContact CG1-CD1 4.3Å; V283-I286 HydrophobicContact CG1-CG1 3.63Å; V283-I286 HydrophobicContact CG2-CD1 4.12Å; V283-I286 HydrophobicContact CG2-CG1 4.33Å; I286-E288 VanDerWaalsContact CG2-O 3.26Å; I286-E288 WeakPolarHBondContact CG2-O 3.34Å; I286-V289 HydrophobicContact CG2-CG2 4.21Å; I286-V299 HydrophobicContact CB-CG1 4.45Å; I286-V299 HydrophobicContact CD1-CG1 3.95Å; I286-V299 HydrophobicContact CD1-CG2 3.65Å; I286-V299 HydrophobicContact CG1-CG1 3.99Å; I286-S301 PolarHBondContact N-O 3.26Å; I286-S303 PolarHBondContact O-N 3.11Å
287	S	49.5	Very low	44.9	Very low	74 Å²	74	71.5 Å²	71.5	52%	0.517	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	-47.1	173.8	-60.4	0	0	0	0	111.9
288	E	44.9	Very low	45.2	Very low	110 Å²	110	73.4 Å²	73.4	51%	0.514	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	131	177.8	-165.5	176.7	175.1	0	0	110.9	I286	I286-E288 VanDerWaalsContact CG2-O 3.26Å; I286-E288 WeakPolarHBondContact CG2-O 3.34Å
289	V	49.9	Very low	46	Very low	7 Å²	7	69.2 Å²	69.2	4%	0.042	36%	0.358	C	S	.	.			trans	-82.9	147.2	172	-177	0	0	0	0	109	I286 I297 I302 P306	I286-V289 HydrophobicContact CG2-CG2 4.21Å; V289-I297 HydrophobicContact CG1-CD1 4.01Å; V289-I302 HydrophobicContact CG2-CD1 4.02Å; V289-P306 HydrophobicContact CB-CG 3.95Å; V289-P306 WeakPolarHBondContact O-CG 3.22Å
290	P	45.2	Very low	46.5	Very low	8 Å²	8	68 Å²	68	5%	0.052	36%	0.355	C	S	.	.			trans	-67.2	150.5	173.4	-22.1	33.4	0	0	0	112.3	V273 R275 Q292	V273-P290 HydrophobicContact CB-CG 3.79Å; V273-P290 WeakPolarHBondContact O-CG 3.49Å; R275-P290 HydrophobicContact CG-CB 4.37Å; P290-Q292 PolarHBondContact O-N 3.39Å
291	R	46.3	Very low	46.4	Very low	200 Å²	200	63.1 Å²	63.1	76%	0.755	34%	0.341	S	S	*	.	S	Bend	trans	-56.3	-17.9	176.2	-66.9	-174.9	-178.7	-177.5	0.3	115.5	Q308	R291-Q308 VanDerWaalsContact O-O 3.05Å
292	Q	40.9	Very low	46.9	Very low	134 Å²	134	61.9 Å²	61.9	63%	0.626	33%	0.334	S	S	*	.			trans	-139.6	99.2	175.5	-68.7	-161.1	-43.4	0	0	107.9	R275 P290	R275-Q292 VanDerWaalsContact O-O 3.08Å; P290-Q292 PolarHBondContact O-N 3.39Å
293	A	45	Very low	46.9	Very low	26 Å²	26	62.8 Å²	62.8	22%	0.215	34%	0.337	C	S	.	.			trans	-95.8	134.4	159.3	0	0	0	0	0	107.7	I297	A293-I297 HydrophobicContact CB-CD1 3.76Å; A293-I297 HydrophobicContact CB-CG1 4.42Å
294	T	37.6	Very low	46.9	Very low	78 Å²	78	68.3 Å²	68.3	48%	0.479	36%	0.363	S	S	.	.			trans	-91.6	-7.6	-178	25.2	0	0	0	0	114.4
295	E	48.1	Very low	46.9	Very low	106 Å²	106	64.7 Å²	64.7	50%	0.495	34%	0.344	S	S	.	.	S	Bend	trans	-148.2	165.3	177.7	-71.4	-162.8	173.5	0	0	113.3	I297	E295-I297 WeakPolarHBondContact O-CG1 3.44Å; E295-I297 PolarHBondContact O-N 3.36Å
296	K	45.1	Very low	47.2	Very low	152 Å²	152	62.9 Å²	62.9	66%	0.661	33%	0.331	S	S	*	.	P	Polyproline II helix	trans	-51.1	117.9	178.9	-68.6	-178.3	-179.1	-179.4	0	112.4
297	I	50.1	Low	46.8	Very low	19 Å²	19	72.5 Å²	72.5	10%	0.097	37%	0.367	C	S	.	.	P	Polyproline II helix	trans	-102	130.4	171.2	-44.7	-178.5	0	0	0	107.9	V289 A293 E295 V299	V289-I297 HydrophobicContact CG1-CD1 4.01Å; A293-I297 HydrophobicContact CB-CD1 3.76Å; A293-I297 HydrophobicContact CB-CG1 4.42Å; E295-I297 WeakPolarHBondContact O-CG1 3.44Å; E295-I297 PolarHBondContact O-N 3.36Å; I297-V299 HydrophobicContact CB-CG2 4.22Å; I297-V299 HydrophobicContact CG2-CG2 3.31Å
298	A	49.6	Very low	46.4	Very low	60 Å²	60	75.1 Å²	75.1	50%	0.496	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	120.6	165.9	0	0	0	0	0	107.2
299	V	51.4	Low	46.3	Very low	2 Å²	2	71.1 Å²	71.1	1%	0.012	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	129.2	-177.2	-167.7	0	0	0	0	108.9	V283 I286 I297 S301 I302 V315 D316	V283-V299 WeakPolarHBondContact O-CA 3.49Å; V283-V299 WeakPolarHBondContact O-CG1 3.32Å; I286-V299 HydrophobicContact CB-CG1 4.45Å; I286-V299 HydrophobicContact CD1-CG1 3.95Å; I286-V299 HydrophobicContact CD1-CG2 3.65Å; I286-V299 HydrophobicContact CG1-CG1 3.99Å; I297-V299 HydrophobicContact CB-CG2 4.22Å; I297-V299 HydrophobicContact CG2-CG2 3.31Å; V299-S301 WeakPolarHBondContact CG1-O 3.39Å; V299-I302 HydrophobicContact CB-CD1 4.06Å; V299-I302 HydrophobicContact CB-CG1 3.9Å; V299-I302 HydrophobicContact CG1-CD1 4.27Å; V299-I302 HydrophobicContact CG1-CG1 3.6Å; V299-I302 HydrophobicContact CG2-CD1 4.1Å; V299-I302 HydrophobicContact CG2-CG1 4.33Å; V299-V315 WeakPolarHBondContact O-CA 3.49Å; V299-V315 WeakPolarHBondContact O-CG1 3.08Å; V299-D316 PolarHBondContact O-N 2.77Å
300	D	51.1	Low	45.8	Very low	80 Å²	80	74.4 Å²	74.4	43%	0.428	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	-32.9	-178.6	-65	3.4	0	0	0	111.1	V283 S317	V283-D300 PolarHBondContact O-N 3.19Å; D300-S317 PolarHBondContact O-N 3.31Å
301	S	41.7	Very low	46	Very low	51 Å²	51	79 Å²	79	36%	0.357	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.7	129.6	176.7	-71.8	0	0	0	0	113.9	D284 S285 I286 V299 S317	D284-S301 PolarHBondContact O-N 3.48Å; S285-S301 WeakPolarHBondContact CA-O 3.35Å; I286-S301 PolarHBondContact N-O 3.26Å; V299-S301 WeakPolarHBondContact CG1-O 3.39Å; S301-S317 WeakPolarHBondContact CA-O 3.14Å
302	I	53.9	Low	46	Very low	2 Å²	2	76.3 Å²	76.3	1%	0.01	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	131.7	174.2	-58.8	177.2	0	0	0	110.2	V289 V299 E304 V305 I313 V315 S317 S319	V289-I302 HydrophobicContact CG2-CD1 4.02Å; V299-I302 HydrophobicContact CB-CD1 4.06Å; V299-I302 HydrophobicContact CB-CG1 3.9Å; V299-I302 HydrophobicContact CG1-CD1 4.27Å; V299-I302 HydrophobicContact CG1-CG1 3.6Å; V299-I302 HydrophobicContact CG2-CD1 4.1Å; V299-I302 HydrophobicContact CG2-CG1 4.33Å; I302-E304 WeakPolarHBondContact CG2-O 3.39Å; I302-V305 HydrophobicContact CD1-CG2 4.34Å; I302-V305 HydrophobicContact CG2-CG2 3.94Å; I302-I313 HydrophobicContact CD1-CG2 4.39Å; I302-V315 HydrophobicContact CB-CG1 4.41Å; I302-V315 HydrophobicContact CD1-CG1 4.1Å; I302-V315 HydrophobicContact CD1-CG2 3.64Å; I302-V315 HydrophobicContact CG1-CG1 3.99Å; I302-V315 HydrophobicContact CG1-CG2 4.43Å; I302-S317 PolarHBondContact N-O 3.01Å; I302-S319 PolarHBondContact O-N 3.28Å
303	S	48.2	Very low	46.4	Very low	73 Å²	73	70.8 Å²	70.8	51%	0.51	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	-47.3	174.9	-62	0	0	0	0	112.1	I286	I286-S303 PolarHBondContact O-N 3.11Å
304	E	46	Very low	46.8	Very low	119 Å²	119	72.3 Å²	72.3	56%	0.556	38%	0.379	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-144.7	128.1	177.9	-165	175.7	174.1	0	0	110.9	I302	I302-E304 WeakPolarHBondContact CG2-O 3.39Å
305	V	49	Very low	47.5	Very low	5 Å²	5	68.7 Å²	68.7	3%	0.03	36%	0.357	C	S	.	.			trans	-88.7	141	172.8	-178.8	0	0	0	0	109.3	I302 I313 I318 P322	I302-V305 HydrophobicContact CD1-CG2 4.34Å; I302-V305 HydrophobicContact CG2-CG2 3.94Å; V305-I313 HydrophobicContact CG1-CD1 4.07Å; V305-I318 HydrophobicContact CG2-CD1 4.06Å; V305-P322 HydrophobicContact CB-CG 4.05Å; V305-P322 HydrophobicContact CG1-CG 4.33Å; V305-P322 WeakPolarHBondContact O-CB 3.4Å; V305-P322 WeakPolarHBondContact O-CD 3.37Å; V305-P322 WeakPolarHBondContact O-CG 3.18Å
306	P	44.9	Very low	47.8	Very low	13 Å²	13	67.4 Å²	67.4	8%	0.084	35%	0.353	C	S	.	.			trans	-64.3	151.9	177	-23.3	34.3	0	0	0	113.3	V289 Q308	V289-P306 HydrophobicContact CB-CG 3.95Å; V289-P306 WeakPolarHBondContact O-CG 3.22Å; P306-Q308 PolarHBondContact O-N 2.91Å
307	R	44.3	Very low	47.7	Very low	203 Å²	203	62.6 Å²	62.6	77%	0.766	34%	0.339	S	S	*	.	S	Bend	trans	-57.3	-14	176.2	-64.8	-174.8	-179.8	-174.4	0.4	116	Q324	R307-Q324 CarbonylContact C-O 3.45Å
308	Q	40.4	Very low	47.9	Very low	130 Å²	130	61.8 Å²	61.8	61%	0.607	34%	0.335	S	S	*	.			trans	-143.9	106.3	174.5	-70.1	-167.2	-49	0	0	106.9	R291 P306	R291-Q308 VanDerWaalsContact O-O 3.05Å; P306-Q308 PolarHBondContact O-N 2.91Å
309	A	44.2	Very low	47.9	Very low	26 Å²	26	62.4 Å²	62.4	22%	0.215	34%	0.335	C	S	.	.			trans	-104	130.5	163.3	0	0	0	0	0	107	I313	A309-I313 HydrophobicContact CB-CD1 3.86Å
310	T	38.6	Very low	47.6	Very low	75 Å²	75	67.7 Å²	67.7	46%	0.46	36%	0.36	S	S	.	.			trans	-84.6	-12.3	-174.7	-3.5	0	0	0	0	114
311	E	48.9	Very low	47.6	Very low	106 Å²	106	64 Å²	64	50%	0.495	34%	0.34	S	S	.	.	S	Bend	trans	-150.7	165.1	179.8	-70.6	-163.1	175	0	0	113.3	I313	E311-I313 PolarHBondContact O-N 3.13Å
312	K	46	Very low	47.7	Very low	143 Å²	143	62.3 Å²	62.3	62%	0.622	33%	0.328	S	S	*	.			trans	-48.9	117.1	-179	-67.8	-179.8	-179	179	0	113.4
313	I	51.2	Low	47.4	Very low	17 Å²	17	71.3 Å²	71.3	9%	0.087	36%	0.362	C	S	.	.			trans	-102.1	131.4	169.8	-44.9	-179.2	0	0	0	108	I302 V305 A309 E311 V315	I302-I313 HydrophobicContact CD1-CG2 4.39Å; V305-I313 HydrophobicContact CG1-CD1 4.07Å; A309-I313 HydrophobicContact CB-CD1 3.86Å; E311-I313 PolarHBondContact O-N 3.13Å; I313-V315 HydrophobicContact CB-CG2 4.25Å; I313-V315 HydrophobicContact CG2-CG2 3.32Å
314	A	51.5	Low	47	Very low	59 Å²	59	73.5 Å²	73.5	49%	0.488	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	120.5	166.5	0	0	0	0	0	107.3
315	V	53.5	Low	46.9	Very low	2 Å²	2	68.8 Å²	68.8	1%	0.012	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	130.2	-176.8	-167.3	0	0	0	0	109.1	V299 I302 I313 S317 I318 A330 V331 D332	V299-V315 WeakPolarHBondContact O-CA 3.49Å; V299-V315 WeakPolarHBondContact O-CG1 3.08Å; I302-V315 HydrophobicContact CB-CG1 4.41Å; I302-V315 HydrophobicContact CD1-CG1 4.1Å; I302-V315 HydrophobicContact CD1-CG2 3.64Å; I302-V315 HydrophobicContact CG1-CG1 3.99Å; I302-V315 HydrophobicContact CG1-CG2 4.43Å; I313-V315 HydrophobicContact CB-CG2 4.25Å; I313-V315 HydrophobicContact CG2-CG2 3.32Å; V315-S317 WeakPolarHBondContact CG1-O 3.29Å; V315-I318 HydrophobicContact CB-CD1 4.01Å; V315-I318 HydrophobicContact CB-CG1 3.85Å; V315-I318 HydrophobicContact CG1-CD1 4.26Å; V315-I318 HydrophobicContact CG1-CG1 3.59Å; V315-I318 HydrophobicContact CG2-CD1 4.03Å; V315-I318 HydrophobicContact CG2-CG1 4.27Å; V315-A330 PolarHBondContact N-O 2.63Å; V315-V331 WeakPolarHBondContact O-CA 3.5Å; V315-V331 WeakPolarHBondContact O-CG1 3.47Å; V315-D332 PolarHBondContact O-N 2.86Å
316	D	53.1	Low	46.4	Very low	78 Å²	78	71.9 Å²	71.9	42%	0.417	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	-33.8	-179.1	-66	3.6	0	0	0	111.1	V299 S333	V299-D316 PolarHBondContact O-N 2.77Å; D316-S333 PolarHBondContact O-N 3.48Å
317	S	43.1	Very low	46.6	Very low	52 Å²	52	75.8 Å²	75.8	36%	0.364	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	129.1	176.9	-71.9	0	0	0	0	113.8	D300 S301 I302 V315	D300-S317 PolarHBondContact O-N 3.31Å; S301-S317 WeakPolarHBondContact CA-O 3.14Å; I302-S317 PolarHBondContact N-O 3.01Å; V315-S317 WeakPolarHBondContact CG1-O 3.29Å
318	I	54.9	Low	46.8	Very low	2 Å²	2	72.7 Å²	72.7	1%	0.01	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	131.8	174.3	-58.7	178.2	0	0	0	110	V305 V315 E320 V321 I329 V331 S333 S335	V305-I318 HydrophobicContact CG2-CD1 4.06Å; V315-I318 HydrophobicContact CB-CD1 4.01Å; V315-I318 HydrophobicContact CB-CG1 3.85Å; V315-I318 HydrophobicContact CG1-CD1 4.26Å; V315-I318 HydrophobicContact CG1-CG1 3.59Å; V315-I318 HydrophobicContact CG2-CD1 4.03Å; V315-I318 HydrophobicContact CG2-CG1 4.27Å; I318-E320 WeakPolarHBondContact CG2-O 3.29Å; I318-V321 HydrophobicContact CD1-CG2 4.35Å; I318-V321 HydrophobicContact CG2-CG2 3.99Å; I318-I329 HydrophobicContact CD1-CG2 4.31Å; I318-V331 HydrophobicContact CB-CG1 4.33Å; I318-V331 HydrophobicContact CD1-CG1 4.08Å; I318-V331 HydrophobicContact CD1-CG2 3.59Å; I318-V331 HydrophobicContact CG1-CG1 3.93Å; I318-V331 HydrophobicContact CG1-CG2 4.37Å; I318-S333 PolarHBondContact N-O 3.18Å; I318-S335 PolarHBondContact O-N 3.38Å
319	S	49.2	Very low	47.3	Very low	73 Å²	73	67.4 Å²	67.4	51%	0.51	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	-47.8	174.9	-62.4	0	0	0	0	111.9	I302	I302-S319 PolarHBondContact O-N 3.28Å
320	E	46.6	Very low	47.7	Very low	113 Å²	113	69 Å²	69	53%	0.528	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	127.9	177.9	-166.6	175.7	173.5	0	0	111.1	I318	I318-E320 WeakPolarHBondContact CG2-O 3.29Å
321	V	49.5	Very low	48.5	Very low	2 Å²	2	65.5 Å²	65.5	1%	0.012	34%	0.341	C	S	.	.			trans	-86.8	137	172.2	179.4	0	0	0	0	108.8	I318 I329 I334 P338	I318-V321 HydrophobicContact CD1-CG2 4.35Å; I318-V321 HydrophobicContact CG2-CG2 3.99Å; V321-I329 HydrophobicContact CG1-CD1 4Å; V321-I334 HydrophobicContact CG2-CD1 3.98Å; V321-P338 HydrophobicContact CB-CG 4.09Å; V321-P338 HydrophobicContact CG1-CG 4.31Å; V321-P338 WeakPolarHBondContact O-CB 3.36Å; V321-P338 VanDerWaalsContact O-CD 3.3Å; V321-P338 WeakPolarHBondContact O-CD 3.27Å; V321-P338 WeakPolarHBondContact O-CG 3.46Å
322	P	45.2	Very low	48.8	Very low	15 Å²	15	64.2 Å²	64.2	10%	0.097	34%	0.337	C	S	.	.			trans	-63.8	149.4	177.1	27	-38.2	0	0	0	112.3	V305 Q324	V305-P322 HydrophobicContact CB-CG 4.05Å; V305-P322 HydrophobicContact CG1-CG 4.33Å; V305-P322 WeakPolarHBondContact O-CB 3.4Å; V305-P322 WeakPolarHBondContact O-CD 3.37Å; V305-P322 WeakPolarHBondContact O-CG 3.18Å; P322-Q324 PolarHBondContact O-N 3.17Å
323	R	46.2	Very low	48.7	Very low	192 Å²	192	59.9 Å²	59.9	73%	0.725	33%	0.325	S	S	*	.	S	Bend	trans	-55.8	-12.6	-179	-65.5	-175.1	-178.5	-178.6	1	116.5	P338 Q340	R323-P338 HydrophobicContact CG-CB 4.37Å; R323-Q340 CarbonylContact C-O 3.48Å
324	Q	41.1	Very low	49	Very low	119 Å²	119	59.2 Å²	59.2	56%	0.556	32%	0.321	S	S	*	.			trans	-143.7	101.2	172.9	-68.7	-158.1	-40	0	0	107.1	R307 P322	R307-Q324 CarbonylContact C-O 3.45Å; P322-Q324 PolarHBondContact O-N 3.17Å
325	A	44.1	Very low	48.9	Very low	20 Å²	20	59.9 Å²	59.9	17%	0.165	32%	0.322	C	S	.	.			trans	-89.8	137.1	158.7	0	0	0	0	0	107.4	I329	A325-I329 HydrophobicContact CB-CD1 3.76Å; A325-I329 HydrophobicContact CB-CG1 4.35Å
326	T	38	Very low	48.6	Very low	70 Å²	70	65.2 Å²	65.2	43%	0.429	35%	0.347	S	S	.	.			trans	-94.5	-10.4	-178.6	-35.5	0	0	0	0	112.5
327	E	49.5	Very low	48.4	Very low	95 Å²	95	61.6 Å²	61.6	44%	0.444	33%	0.328	S	S	.	.	S	Bend	trans	-147.8	164.7	177.5	-69	-162.5	170.2	0	0	112.9	I329	E327-I329 PolarHBondContact O-N 2.93Å
328	K	47.4	Very low	48.6	Very low	138 Å²	138	59.7 Å²	59.7	60%	0.6	31%	0.314	S	S	*	.			trans	-50.6	115.9	179.7	-68.5	-179.3	-180	-179.6	0	112.8
329	I	51.7	Low	48.1	Very low	19 Å²	19	68.1 Å²	68.1	10%	0.097	35%	0.346	C	S	.	.			trans	-100	131	168.5	-46.1	-179.6	0	0	0	107.7	I318 V321 A325 E327 V331	I318-I329 HydrophobicContact CD1-CG2 4.31Å; V321-I329 HydrophobicContact CG1-CD1 4Å; A325-I329 HydrophobicContact CB-CD1 3.76Å; A325-I329 HydrophobicContact CB-CG1 4.35Å; E327-I329 PolarHBondContact O-N 2.93Å; I329-V331 HydrophobicContact CB-CG2 4.27Å; I329-V331 HydrophobicContact CG2-CG2 3.33Å
330	A	53	Low	47.8	Very low	58 Å²	58	70.2 Å²	70.2	48%	0.479	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	120	167.2	0	0	0	0	0	107.3	V315	V315-A330 PolarHBondContact N-O 2.63Å
331	V	54.9	Low	47.7	Very low	2 Å²	2	65.6 Å²	65.6	1%	0.012	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	129.7	-177.2	-166.5	0	0	0	0	109.1	V315 I318 I329 S333 I334 V347	V315-V331 WeakPolarHBondContact O-CA 3.5Å; V315-V331 WeakPolarHBondContact O-CG1 3.47Å; I318-V331 HydrophobicContact CB-CG1 4.33Å; I318-V331 HydrophobicContact CD1-CG1 4.08Å; I318-V331 HydrophobicContact CD1-CG2 3.59Å; I318-V331 HydrophobicContact CG1-CG1 3.93Å; I318-V331 HydrophobicContact CG1-CG2 4.37Å; I329-V331 HydrophobicContact CB-CG2 4.27Å; I329-V331 HydrophobicContact CG2-CG2 3.33Å; V331-S333 WeakPolarHBondContact CG1-O 3.49Å; V331-I334 HydrophobicContact CB-CD1 4.01Å; V331-I334 HydrophobicContact CB-CG1 3.84Å; V331-I334 HydrophobicContact CG1-CD1 4.28Å; V331-I334 HydrophobicContact CG1-CG1 3.6Å; V331-I334 HydrophobicContact CG2-CD1 4.03Å; V331-I334 HydrophobicContact CG2-CG1 4.25Å; V331-V347 WeakPolarHBondContact O-CA 3.09Å; V331-V347 WeakPolarHBondContact O-CG1 3.45Å
332	D	55	Low	47.2	Very low	79 Å²	79	68.6 Å²	68.6	42%	0.422	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	-33.7	-179.5	-65.8	2.8	0	0	0	111	V315 S349	V315-D332 PolarHBondContact O-N 2.86Å; D332-S349 PolarHBondContact O-N 3.42Å
333	S	44.8	Very low	47.5	Very low	52 Å²	52	72.1 Å²	72.1	36%	0.364	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	128.3	177.4	-71.2	0	0	0	0	113.7	D316 I318 V331	D316-S333 PolarHBondContact O-N 3.48Å; I318-S333 PolarHBondContact N-O 3.18Å; V331-S333 WeakPolarHBondContact CG1-O 3.49Å
334	I	56.1	Low	47.5	Very low	3 Å²	3	69.6 Å²	69.6	2%	0.015	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	131.3	174.3	-59	178.1	0	0	0	109.9	V321 V331 E336 V337 I345 V347 S349 S351	V321-I334 HydrophobicContact CG2-CD1 3.98Å; V331-I334 HydrophobicContact CB-CD1 4.01Å; V331-I334 HydrophobicContact CB-CG1 3.84Å; V331-I334 HydrophobicContact CG1-CD1 4.28Å; V331-I334 HydrophobicContact CG1-CG1 3.6Å; V331-I334 HydrophobicContact CG2-CD1 4.03Å; V331-I334 HydrophobicContact CG2-CG1 4.25Å; I334-E336 WeakPolarHBondContact CG2-O 3.36Å; I334-V337 HydrophobicContact CD1-CG2 4.36Å; I334-V337 HydrophobicContact CG2-CG2 4Å; I334-I345 HydrophobicContact CD1-CG2 4.28Å; I334-V347 HydrophobicContact CB-CG1 4.28Å; I334-V347 HydrophobicContact CD1-CB 4.5Å; I334-V347 HydrophobicContact CD1-CG1 4.03Å; I334-V347 HydrophobicContact CD1-CG2 3.57Å; I334-V347 HydrophobicContact CG1-CG1 3.89Å; I334-V347 HydrophobicContact CG1-CG2 4.35Å; I334-S349 PolarHBondContact N-O 2.85Å; I334-S351 PolarHBondContact O-N 3.35Å
335	S	49.7	Very low	48.1	Very low	73 Å²	73	64.5 Å²	64.5	51%	0.51	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	-47.4	174.6	-62.7	0	0	0	0	111.9	I318	I318-S335 PolarHBondContact O-N 3.38Å
336	E	47	Very low	48.6	Very low	114 Å²	114	66.3 Å²	66.3	53%	0.533	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	127.8	177.5	-166.6	174.6	174.2	0	0	111.2	I334	I334-E336 WeakPolarHBondContact CG2-O 3.36Å
337	V	49.7	Very low	49.4	Very low	2 Å²	2	63.1 Å²	63.1	1%	0.012	33%	0.329	C	S	.	.			trans	-85.5	139.2	171.8	179	0	0	0	0	108.9	I334 I345 I350 P354	I334-V337 HydrophobicContact CD1-CG2 4.36Å; I334-V337 HydrophobicContact CG2-CG2 4Å; V337-I345 HydrophobicContact CG1-CD1 3.99Å; V337-I350 HydrophobicContact CG2-CD1 3.89Å; V337-I350 HydrophobicContact CG2-CG2 4.45Å; V337-P354 HydrophobicContact CB-CG 4.12Å; V337-P354 HydrophobicContact CG1-CG 4.34Å; V337-P354 WeakPolarHBondContact O-CB 3.28Å; V337-P354 VanDerWaalsContact O-CD 3.25Å; V337-P354 WeakPolarHBondContact O-CD 3.14Å; V337-P354 WeakPolarHBondContact O-CG 3.48Å
338	P	46.3	Very low	49.8	Very low	12 Å²	12	62.3 Å²	62.3	8%	0.078	33%	0.327	C	S	.	.			trans	-65.3	149.2	176.8	26.8	-37.9	0	0	0	112.4	V321 R323 Q340	V321-P338 HydrophobicContact CB-CG 4.09Å; V321-P338 HydrophobicContact CG1-CG 4.31Å; V321-P338 WeakPolarHBondContact O-CB 3.36Å; V321-P338 VanDerWaalsContact O-CD 3.3Å; V321-P338 WeakPolarHBondContact O-CD 3.27Å; V321-P338 WeakPolarHBondContact O-CG 3.46Å; R323-P338 HydrophobicContact CG-CB 4.37Å; P338-Q340 PolarHBondContact O-N 2.79Å
339	R	46	Very low	49.7	Very low	180 Å²	180	58 Å²	58	68%	0.679	32%	0.315	S	S	*	.	S	Bend	trans	-56.8	-12.7	-179.9	-65.5	-174.5	-178.9	-176.5	1.5	116.5	P354 Q356	R339-P354 HydrophobicContact CG-CB 4.22Å; R339-Q356 CarbonylContact C-O 3.3Å; R339-Q356 VanDerWaalsContact C-O 3.26Å; R339-Q356 WeakPolarHBondContact CA-O 3.36Å
340	Q	41.7	Very low	49.9	Very low	116 Å²	116	57.2 Å²	57.2	54%	0.542	31%	0.311	S	S	.	.			trans	-142.1	111.5	172.3	-67.2	-163.3	-45.1	0	0	105.6	R323 P338	R323-Q340 CarbonylContact C-O 3.48Å; P338-Q340 PolarHBondContact O-N 2.79Å
341	A	45.5	Very low	49.8	Very low	17 Å²	17	58 Å²	58	14%	0.14	31%	0.312	C	S	.	.			trans	-106.2	133.4	161.6	0	0	0	0	0	106.3	I345	A341-I345 HydrophobicContact CB-CD1 3.77Å; A341-I345 HydrophobicContact CB-CG1 4.37Å
342	T	39.1	Very low	49.5	Very low	65 Å²	65	63.3 Å²	63.3	40%	0.399	34%	0.337	S	S	.	.			trans	-89.6	-8.3	-177	-13.4	0	0	0	0	113.1
343	E	50.1	Low	49.2	Very low	89 Å²	89	59.8 Å²	59.8	42%	0.416	32%	0.318	S	S	.	.	S	Bend	trans	-148.1	164.3	-179.8	-69.1	-160.6	171.3	0	0	112.8	I345	E343-I345 PolarHBondContact O-N 2.93Å
344	K	47.8	Very low	49.3	Very low	138 Å²	138	57.8 Å²	57.8	60%	0.6	30%	0.304	S	S	*	.			trans	-53.3	115.4	179.2	-67.6	-177.7	-178.4	-179.1	0	112.4
345	I	52.7	Low	48.8	Very low	13 Å²	13	66.2 Å²	66.2	7%	0.067	34%	0.336	C	S	.	.			trans	-98.1	131.1	168.1	-46.1	-179.6	0	0	0	107.7	I334 V337 A341 E343 V347	I334-I345 HydrophobicContact CD1-CG2 4.28Å; V337-I345 HydrophobicContact CG1-CD1 3.99Å; A341-I345 HydrophobicContact CB-CD1 3.77Å; A341-I345 HydrophobicContact CB-CG1 4.37Å; E343-I345 PolarHBondContact O-N 2.93Å; I345-V347 HydrophobicContact CB-CG2 4.27Å; I345-V347 HydrophobicContact CG2-CG2 3.32Å
346	A	54.3	Low	48.5	Very low	57 Å²	57	68 Å²	68	47%	0.471	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	120	167.5	0	0	0	0	0	107.3
347	V	56.1	Low	48.4	Very low	3 Å²	3	63.2 Å²	63.2	2%	0.018	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	131	-176.7	-166.1	0	0	0	0	109.2	V331 I334 I345 S349 I350 A362 V363 D364	V331-V347 WeakPolarHBondContact O-CA 3.09Å; V331-V347 WeakPolarHBondContact O-CG1 3.45Å; I334-V347 HydrophobicContact CB-CG1 4.28Å; I334-V347 HydrophobicContact CD1-CB 4.5Å; I334-V347 HydrophobicContact CD1-CG1 4.03Å; I334-V347 HydrophobicContact CD1-CG2 3.57Å; I334-V347 HydrophobicContact CG1-CG1 3.89Å; I334-V347 HydrophobicContact CG1-CG2 4.35Å; I345-V347 HydrophobicContact CB-CG2 4.27Å; I345-V347 HydrophobicContact CG2-CG2 3.32Å; V347-S349 WeakPolarHBondContact CG1-O 3.34Å; V347-I350 HydrophobicContact CB-CD1 4.03Å; V347-I350 HydrophobicContact CB-CG1 3.87Å; V347-I350 HydrophobicContact CG1-CD1 4.3Å; V347-I350 HydrophobicContact CG1-CG1 3.62Å; V347-I350 HydrophobicContact CG2-CD1 4.05Å; V347-I350 HydrophobicContact CG2-CG1 4.27Å; V347-A362 PolarHBondContact N-O 2.84Å; V347-V363 WeakPolarHBondContact O-CA 3.42Å; V347-V363 WeakPolarHBondContact O-CG1 3.3Å; V347-D364 PolarHBondContact O-N 3.34Å
348	D	56.9	Low	47.9	Very low	78 Å²	78	66 Å²	66	42%	0.417	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	-32.8	-179.3	-65	1.5	0	0	0	111.2	S365	D348-S365 PolarHBondContact O-N 2.92Å; D348-S365 PolarHBondContact O-OG 2.97Å; D348-S365 VanDerWaalsContact O-OG 3.14Å
349	S	45.8	Very low	48.1	Very low	48 Å²	48	69.7 Å²	69.7	34%	0.336	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	127.2	179.2	-64.6	0	0	0	0	113.1	D332 I334 V347 S365	D332-S349 PolarHBondContact O-N 3.42Å; I334-S349 PolarHBondContact N-O 2.85Å; V347-S349 WeakPolarHBondContact CG1-O 3.34Å; S349-S365 PolarHBondContact OG-OG 3.12Å; S349-S365 VanDerWaalsContact OG-OG 3.12Å
350	I	56.6	Low	48.2	Very low	3 Å²	3	67.3 Å²	67.3	2%	0.015	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	130.9	173.1	-58.5	177	0	0	0	110	V337 V347 E352 V353 I361 V363 S365 S367	V337-I350 HydrophobicContact CG2-CD1 3.89Å; V337-I350 HydrophobicContact CG2-CG2 4.45Å; V347-I350 HydrophobicContact CB-CD1 4.03Å; V347-I350 HydrophobicContact CB-CG1 3.87Å; V347-I350 HydrophobicContact CG1-CD1 4.3Å; V347-I350 HydrophobicContact CG1-CG1 3.62Å; V347-I350 HydrophobicContact CG2-CD1 4.05Å; V347-I350 HydrophobicContact CG2-CG1 4.27Å; I350-E352 WeakPolarHBondContact CG2-O 3.22Å; I350-V353 HydrophobicContact CD1-CG2 4.33Å; I350-V353 HydrophobicContact CG2-CG2 3.98Å; I350-I361 HydrophobicContact CD1-CG2 4.29Å; I350-V363 HydrophobicContact CB-CG1 4.28Å; I350-V363 HydrophobicContact CD1-CB 4.45Å; I350-V363 HydrophobicContact CD1-CG1 3.97Å; I350-V363 HydrophobicContact CD1-CG2 3.54Å; I350-V363 HydrophobicContact CG1-CG1 3.86Å; I350-V363 HydrophobicContact CG1-CG2 4.36Å; I350-S365 PolarHBondContact N-O 3.16Å; I350-S367 PolarHBondContact O-N 3.14Å
351	S	50.7	Low	48.8	Very low	73 Å²	73	62.4 Å²	62.4	51%	0.51	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	-47.5	175.4	-62.7	0	0	0	0	112	I334	I334-S351 PolarHBondContact O-N 3.35Å
352	E	47.2	Very low	49.2	Very low	115 Å²	115	64.3 Å²	64.3	54%	0.537	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	126.8	177.9	-165.9	173.7	172.6	0	0	110.8	I350	I350-E352 WeakPolarHBondContact CG2-O 3.22Å
353	V	49.5	Very low	50.1	Low	4 Å²	4	61.3 Å²	61.3	2%	0.024	32%	0.319	C	S	.	.			trans	-85.1	138.2	171.9	177.9	0	0	0	0	108.7	I350 I361 I366 P370	I350-V353 HydrophobicContact CD1-CG2 4.33Å; I350-V353 HydrophobicContact CG2-CG2 3.98Å; V353-I361 HydrophobicContact CG1-CD1 4.06Å; V353-I366 HydrophobicContact CG2-CD1 3.93Å; V353-I366 HydrophobicContact CG2-CG2 4.4Å; V353-P370 HydrophobicContact CB-CG 4.12Å; V353-P370 HydrophobicContact CG1-CG 4.26Å; V353-P370 WeakPolarHBondContact O-CB 3.37Å; V353-P370 VanDerWaalsContact O-CD 3.24Å; V353-P370 WeakPolarHBondContact O-CD 3.24Å; V353-P370 WeakPolarHBondContact O-CG 3.43Å
354	P	46.1	Very low	50.4	Low	11 Å²	11	61 Å²	61	7%	0.071	32%	0.32	C	S	.	.			trans	-66	150.4	177.2	28.4	-39.4	0	0	0	112.5	V337 R339 Q356	V337-P354 HydrophobicContact CB-CG 4.12Å; V337-P354 HydrophobicContact CG1-CG 4.34Å; V337-P354 WeakPolarHBondContact O-CB 3.28Å; V337-P354 VanDerWaalsContact O-CD 3.25Å; V337-P354 WeakPolarHBondContact O-CD 3.14Å; V337-P354 WeakPolarHBondContact O-CG 3.48Å; R339-P354 HydrophobicContact CG-CB 4.22Å; P354-Q356 PolarHBondContact O-N 2.82Å
355	R	46.6	Very low	50.4	Low	180 Å²	180	56.3 Å²	56.3	68%	0.679	31%	0.305	S	S	*	.	S	Bend	trans	-56.5	-11.1	-179.2	-65.7	-174.4	-179.6	-173.7	0.7	116.9	P370 Q372	R355-P370 HydrophobicContact CG-CB 4.28Å; R355-Q372 CarbonylContact C-O 3.59Å; R355-Q372 VanDerWaalsContact C-O 3.23Å; R355-Q372 WeakPolarHBondContact CA-O 3.06Å
356	Q	42.5	Very low	50.6	Low	110 Å²	110	55.8 Å²	55.8	51%	0.514	30%	0.302	S	S	.	.			trans	-143	114.3	171.7	-67.5	-164.5	-47.4	0	0	105.2	R339 P354	R339-Q356 CarbonylContact C-O 3.3Å; R339-Q356 VanDerWaalsContact C-O 3.26Å; R339-Q356 WeakPolarHBondContact CA-O 3.36Å; P354-Q356 PolarHBondContact O-N 2.82Å
357	A	44.9	Very low	50.5	Low	14 Å²	14	56.7 Å²	56.7	12%	0.116	31%	0.305	C	S	.	.			trans	-107.5	133.1	160.8	0	0	0	0	0	106	I361	A357-I361 HydrophobicContact CB-CD1 3.71Å; A357-I361 HydrophobicContact CB-CG1 4.34Å
358	T	38.9	Very low	50.1	Low	61 Å²	61	62 Å²	62	37%	0.374	33%	0.329	S	S	.	.			trans	-90.1	-9.2	-176.1	-23.9	0	0	0	0	112.7
359	E	50.6	Low	49.7	Very low	88 Å²	88	58.3 Å²	58.3	41%	0.411	31%	0.31	S	S	.	.	S	Bend	trans	-148	166.1	-179.4	-69.8	-159.6	173.7	0	0	113	I361 E375	E359-I361 PolarHBondContact O-N 2.77Å; E359-E375 WeakPolarHBondContact CA-OE2 3.41Å
360	K	49.2	Very low	49.8	Very low	131 Å²	131	56.6 Å²	56.6	57%	0.57	30%	0.298	S	S	*	.			trans	-52.8	113.2	178.7	-70.1	-178.5	179.7	-179.4	0	112.5
361	I	53	Low	49.3	Very low	12 Å²	12	65.2 Å²	65.2	6%	0.062	33%	0.33	C	S	.	.			trans	-97	131.2	167.4	-45.9	-179	0	0	0	107.7	I350 V353 A357 E359 V363	I350-I361 HydrophobicContact CD1-CG2 4.29Å; V353-I361 HydrophobicContact CG1-CD1 4.06Å; A357-I361 HydrophobicContact CB-CD1 3.71Å; A357-I361 HydrophobicContact CB-CG1 4.34Å; E359-I361 PolarHBondContact O-N 2.77Å; I361-V363 HydrophobicContact CB-CG2 4.26Å; I361-V363 HydrophobicContact CG2-CG2 3.3Å
362	A	55	Low	48.9	Very low	57 Å²	57	67.2 Å²	67.2	47%	0.471	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	119.4	167.1	0	0	0	0	0	107.4	V347	V347-A362 PolarHBondContact N-O 2.84Å
363	V	56.8	Low	48.8	Very low	2 Å²	2	62.3 Å²	62.3	1%	0.012	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	130.9	-176.8	-165.3	0	0	0	0	109.1	V347 I350 I361 S365 I366 A378 V379 D380	V347-V363 WeakPolarHBondContact O-CA 3.42Å; V347-V363 WeakPolarHBondContact O-CG1 3.3Å; I350-V363 HydrophobicContact CB-CG1 4.28Å; I350-V363 HydrophobicContact CD1-CB 4.45Å; I350-V363 HydrophobicContact CD1-CG1 3.97Å; I350-V363 HydrophobicContact CD1-CG2 3.54Å; I350-V363 HydrophobicContact CG1-CG1 3.86Å; I350-V363 HydrophobicContact CG1-CG2 4.36Å; I361-V363 HydrophobicContact CB-CG2 4.26Å; I361-V363 HydrophobicContact CG2-CG2 3.3Å; V363-S365 VanDerWaalsContact CG1-O 3.3Å; V363-S365 WeakPolarHBondContact CG1-O 3.22Å; V363-I366 HydrophobicContact CB-CD1 4.04Å; V363-I366 HydrophobicContact CB-CG1 3.86Å; V363-I366 HydrophobicContact CG1-CD1 4.34Å; V363-I366 HydrophobicContact CG1-CG1 3.65Å; V363-I366 HydrophobicContact CG2-CD1 4.04Å; V363-I366 HydrophobicContact CG2-CG1 4.25Å; V363-A378 PolarHBondContact N-O 3.21Å; V363-V379 WeakPolarHBondContact O-CA 3.36Å; V363-D380 PolarHBondContact O-N 3.38Å
364	D	56.9	Low	48.3	Very low	82 Å²	82	65.1 Å²	65.1	44%	0.439	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	-37	-179.8	-64.9	1.2	0	0	0	110.9	V347 D380 S381	V347-D364 PolarHBondContact O-N 3.34Å; D364-D380 WeakPolarHBondContact O-CB 3.44Å; D364-S381 PolarHBondContact O-N 3.44Å; D364-S381 PolarHBondContact O-OG 3.19Å
365	S	47.5	Very low	48.5	Very low	40 Å²	40	68.7 Å²	68.7	28%	0.28	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	131.4	177.4	62.6	0	0	0	0	113.9	D348 S349 I350 V363	D348-S365 PolarHBondContact O-N 2.92Å; D348-S365 PolarHBondContact O-OG 2.97Å; D348-S365 VanDerWaalsContact O-OG 3.14Å; S349-S365 PolarHBondContact OG-OG 3.12Å; S349-S365 VanDerWaalsContact OG-OG 3.12Å; I350-S365 PolarHBondContact N-O 3.16Å; V363-S365 VanDerWaalsContact CG1-O 3.3Å; V363-S365 WeakPolarHBondContact CG1-O 3.22Å
366	I	57.4	Low	48.7	Very low	3 Å²	3	66.2 Å²	66.2	2%	0.015	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	129.7	173.7	-58.7	176.4	0	0	0	109.6	V353 V363 E368 V369 I377 V379 S381 S383	V353-I366 HydrophobicContact CG2-CD1 3.93Å; V353-I366 HydrophobicContact CG2-CG2 4.4Å; V363-I366 HydrophobicContact CB-CD1 4.04Å; V363-I366 HydrophobicContact CB-CG1 3.86Å; V363-I366 HydrophobicContact CG1-CD1 4.34Å; V363-I366 HydrophobicContact CG1-CG1 3.65Å; V363-I366 HydrophobicContact CG2-CD1 4.04Å; V363-I366 HydrophobicContact CG2-CG1 4.25Å; I366-E368 WeakPolarHBondContact CG2-O 3.4Å; I366-V369 HydrophobicContact CD1-CG2 4.34Å; I366-V369 HydrophobicContact CG2-CG2 3.93Å; I366-I377 HydrophobicContact CD1-CG2 4.3Å; I366-V379 HydrophobicContact CB-CG1 4.3Å; I366-V379 HydrophobicContact CD1-CB 4.44Å; I366-V379 HydrophobicContact CD1-CG1 3.95Å; I366-V379 HydrophobicContact CD1-CG2 3.55Å; I366-V379 HydrophobicContact CG1-CG1 3.88Å; I366-V379 HydrophobicContact CG1-CG2 4.4Å; I366-S381 PolarHBondContact N-O 3.5Å; I366-S383 PolarHBondContact O-N 2.96Å
367	S	51.7	Low	49.2	Very low	75 Å²	75	61.5 Å²	61.5	52%	0.524	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	-47.9	175.1	-63.4	0	0	0	0	111.9	I350	I350-S367 PolarHBondContact O-N 3.14Å
368	E	47.5	Very low	49.6	Very low	114 Å²	114	63.4 Å²	63.4	53%	0.533	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	124.8	178.6	-164.9	174.7	171.1	0	0	111.1	I366	I366-E368 WeakPolarHBondContact CG2-O 3.4Å
369	V	49.9	Very low	50.5	Low	2 Å²	2	60.6 Å²	60.6	1%	0.012	31%	0.314	C	S	.	.			trans	-85.4	136.8	172.1	179	0	0	0	0	108.8	I366 I377 I382 P386	I366-V369 HydrophobicContact CD1-CG2 4.34Å; I366-V369 HydrophobicContact CG2-CG2 3.93Å; V369-I377 HydrophobicContact CG1-CD1 4.18Å; V369-I382 HydrophobicContact CG2-CD1 3.97Å; V369-I382 HydrophobicContact CG2-CG2 4.31Å; V369-P386 HydrophobicContact CB-CG 4.18Å; V369-P386 HydrophobicContact CG1-CG 4.27Å; V369-P386 WeakPolarHBondContact O-CB 3.37Å; V369-P386 VanDerWaalsContact O-CD 3.27Å; V369-P386 WeakPolarHBondContact O-CD 3.24Å; V369-P386 WeakPolarHBondContact O-CG 3.14Å
370	P	46.8	Very low	50.8	Low	12 Å²	12	60.2 Å²	60.2	8%	0.078	32%	0.315	C	S	.	.			trans	-67.3	149.9	177.9	28.7	-39.1	0	0	0	112.6	V353 R355 Q372 P386	V353-P370 HydrophobicContact CB-CG 4.12Å; V353-P370 HydrophobicContact CG1-CG 4.26Å; V353-P370 WeakPolarHBondContact O-CB 3.37Å; V353-P370 VanDerWaalsContact O-CD 3.24Å; V353-P370 WeakPolarHBondContact O-CD 3.24Å; V353-P370 WeakPolarHBondContact O-CG 3.43Å; R355-P370 HydrophobicContact CG-CB 4.28Å; P370-Q372 PolarHBondContact O-N 3.33Å; P370-P386 WeakPolarHBondContact O-CG 3.37Å
371	R	46.4	Very low	50.7	Low	184 Å²	184	56.2 Å²	56.2	69%	0.694	30%	0.304	S	S	*	.	S	Bend	trans	-56.1	-10.8	-179.1	-65.3	-175.1	179.5	-169.9	-0.7	116.9	P386 Q388	R371-P386 HydrophobicContact CG-CB 4.21Å; R371-Q388 CarbonylContact C-O 3.37Å; R371-Q388 WeakPolarHBondContact CA-O 3.34Å
372	Q	42.6	Very low	50.9	Low	114 Å²	114	55.8 Å²	55.8	53%	0.533	30%	0.301	S	S	.	.			trans	-143.3	113.4	171.6	-68.7	-168.7	-52.2	0	0	105	R355 P370	R355-Q372 CarbonylContact C-O 3.59Å; R355-Q372 VanDerWaalsContact C-O 3.23Å; R355-Q372 WeakPolarHBondContact CA-O 3.06Å; P370-Q372 PolarHBondContact O-N 3.33Å
373	A	45.1	Very low	50.8	Low	12 Å²	12	56.6 Å²	56.6	10%	0.099	30%	0.303	C	S	.	.			trans	-106.6	135.3	159.6	0	0	0	0	0	106.1	I377	A373-I377 HydrophobicContact CB-CD1 3.72Å; A373-I377 HydrophobicContact CB-CG1 4.37Å
374	T	38.9	Very low	50.3	Low	64 Å²	64	62.1 Å²	62.1	39%	0.393	33%	0.329	S	S	.	.			trans	-91.2	-11.3	-175.7	-22.6	0	0	0	0	112.7
375	E	50.7	Low	50	Low	85 Å²	85	58.4 Å²	58.4	40%	0.397	31%	0.309	S	S	.	.	S	Bend	trans	-146.5	167.4	-178.7	-68.9	-158.6	173.3	0	0	113.2	E359 I377	E359-E375 WeakPolarHBondContact CA-OE2 3.41Å; E375-I377 PolarHBondContact O-N 3.21Å
376	K	49.6	Very low	49.9	Very low	129 Å²	129	57.2 Å²	57.2	56%	0.561	30%	0.301	S	S	*	.			trans	-53.8	112.6	179.4	-69.5	-178	-179	180	0	112.4
377	I	52.8	Low	49.4	Very low	10 Å²	10	65.7 Å²	65.7	5%	0.051	33%	0.333	C	S	.	.			trans	-96.8	131.9	167.4	-45.1	-178.7	0	0	0	107.8	I366 V369 A373 E375 V379 A394	I366-I377 HydrophobicContact CD1-CG2 4.3Å; V369-I377 HydrophobicContact CG1-CD1 4.18Å; A373-I377 HydrophobicContact CB-CD1 3.72Å; A373-I377 HydrophobicContact CB-CG1 4.37Å; E375-I377 PolarHBondContact O-N 3.21Å; I377-V379 HydrophobicContact CB-CG2 4.22Å; I377-V379 HydrophobicContact CG2-CG2 3.29Å; I377-A394 PolarHBondContact O-N 2.79Å
378	A	54.6	Low	48.9	Very low	55 Å²	55	67.7 Å²	67.7	46%	0.455	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	119.7	166.8	0	0	0	0	0	107.3	V363	V363-A378 PolarHBondContact N-O 3.21Å
379	V	56.9	Low	48.8	Very low	2 Å²	2	62.9 Å²	62.9	1%	0.012	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	131.1	-176.3	-165.5	0	0	0	0	109.2	V363 I366 I377 S381 I382 A394 V395 D396	V363-V379 WeakPolarHBondContact O-CA 3.36Å; I366-V379 HydrophobicContact CB-CG1 4.3Å; I366-V379 HydrophobicContact CD1-CB 4.44Å; I366-V379 HydrophobicContact CD1-CG1 3.95Å; I366-V379 HydrophobicContact CD1-CG2 3.55Å; I366-V379 HydrophobicContact CG1-CG1 3.88Å; I366-V379 HydrophobicContact CG1-CG2 4.4Å; I377-V379 HydrophobicContact CB-CG2 4.22Å; I377-V379 HydrophobicContact CG2-CG2 3.29Å; V379-S381 WeakPolarHBondContact CG1-O 3.3Å; V379-I382 HydrophobicContact CB-CD1 4.03Å; V379-I382 HydrophobicContact CB-CG1 3.87Å; V379-I382 HydrophobicContact CG1-CD1 4.3Å; V379-I382 HydrophobicContact CG1-CG1 3.61Å; V379-I382 HydrophobicContact CG2-CD1 4.06Å; V379-I382 HydrophobicContact CG2-CG1 4.28Å; V379-A394 PolarHBondContact N-O 3.46Å; V379-V395 WeakPolarHBondContact O-CA 3.4Å; V379-D396 PolarHBondContact O-N 3.14Å
380	D	56.5	Low	48.3	Very low	80 Å²	80	65.8 Å²	65.8	43%	0.428	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	-36.3	179.9	-64.5	0.1	0	0	0	110.9	V363 D364 D396 S397	V363-D380 PolarHBondContact O-N 3.38Å; D364-D380 WeakPolarHBondContact O-CB 3.44Å; D380-D396 WeakPolarHBondContact O-CB 3.14Å; D380-S397 PolarHBondContact O-N 3.03Å; D380-S397 PolarHBondContact O-OG 3.49Å
381	S	48	Very low	48.5	Very low	47 Å²	47	69.5 Å²	69.5	33%	0.329	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	127.9	179.9	58.2	0	0	0	0	113.9	D364 I366 V379	D364-S381 PolarHBondContact O-N 3.44Å; D364-S381 PolarHBondContact O-OG 3.19Å; I366-S381 PolarHBondContact N-O 3.5Å; V379-S381 WeakPolarHBondContact CG1-O 3.3Å
382	I	57.4	Low	48.6	Very low	3 Å²	3	66.9 Å²	66.9	2%	0.015	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	129.8	174.2	-58.7	175.9	0	0	0	110	V369 V379 E384 V385 I393 V395 S397 S399	V369-I382 HydrophobicContact CG2-CD1 3.97Å; V369-I382 HydrophobicContact CG2-CG2 4.31Å; V379-I382 HydrophobicContact CB-CD1 4.03Å; V379-I382 HydrophobicContact CB-CG1 3.87Å; V379-I382 HydrophobicContact CG1-CD1 4.3Å; V379-I382 HydrophobicContact CG1-CG1 3.61Å; V379-I382 HydrophobicContact CG2-CD1 4.06Å; V379-I382 HydrophobicContact CG2-CG1 4.28Å; I382-E384 WeakPolarHBondContact CG2-O 3.49Å; I382-V385 HydrophobicContact CD1-CG2 4.35Å; I382-V385 HydrophobicContact CG2-CG2 3.91Å; I382-I393 HydrophobicContact CD1-CG2 4.36Å; I382-V395 HydrophobicContact CB-CG1 4.3Å; I382-V395 HydrophobicContact CD1-CB 4.39Å; I382-V395 HydrophobicContact CD1-CG1 3.86Å; I382-V395 HydrophobicContact CD1-CG2 3.53Å; I382-V395 HydrophobicContact CG1-CG1 3.85Å; I382-V395 HydrophobicContact CG1-CG2 4.44Å; I382-S397 PolarHBondContact N-O 3.06Å; I382-S399 PolarHBondContact O-N 2.83Å
383	S	51.9	Low	49.1	Very low	73 Å²	73	61.9 Å²	61.9	51%	0.51	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	-48.7	175	-61.2	0	0	0	0	111.9	I366	I366-S383 PolarHBondContact O-N 2.96Å
384	E	47.4	Very low	49.5	Very low	118 Å²	118	64 Å²	64	55%	0.551	34%	0.335	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-142.1	125.3	179.3	-164.4	175.1	170.6	0	0	111.5	I382	I382-E384 WeakPolarHBondContact CG2-O 3.49Å
385	V	50.2	Low	50.4	Low	4 Å²	4	61 Å²	61	2%	0.024	32%	0.317	C	S	.	.			trans	-88.3	135.8	172.7	179.4	0	0	0	0	109.1	I382 I393 I398 P402	I382-V385 HydrophobicContact CD1-CG2 4.35Å; I382-V385 HydrophobicContact CG2-CG2 3.91Å; V385-I393 HydrophobicContact CG1-CD1 4.3Å; V385-I398 HydrophobicContact CG2-CD1 4.01Å; V385-I398 HydrophobicContact CG2-CG1 4.5Å; V385-I398 HydrophobicContact CG2-CG2 4.21Å; V385-P402 HydrophobicContact CB-CG 4.22Å; V385-P402 HydrophobicContact CG1-CG 4.27Å; V385-P402 WeakPolarHBondContact O-CB 3.4Å; V385-P402 VanDerWaalsContact O-CD 3.26Å; V385-P402 WeakPolarHBondContact O-CD 3.4Å; V385-P402 WeakPolarHBondContact O-CG 3.29Å
386	P	46.7	Very low	50.6	Low	15 Å²	15	60.8 Å²	60.8	10%	0.097	32%	0.319	C	S	.	.			trans	-69.6	150.8	178.6	29.2	-39	0	0	0	112.8	V369 P370 R371 Q388 P402	V369-P386 HydrophobicContact CB-CG 4.18Å; V369-P386 HydrophobicContact CG1-CG 4.27Å; V369-P386 WeakPolarHBondContact O-CB 3.37Å; V369-P386 VanDerWaalsContact O-CD 3.27Å; V369-P386 WeakPolarHBondContact O-CD 3.24Å; V369-P386 WeakPolarHBondContact O-CG 3.14Å; P370-P386 WeakPolarHBondContact O-CG 3.37Å; R371-P386 HydrophobicContact CG-CB 4.21Å; P386-Q388 PolarHBondContact O-N 2.73Å; P386-P402 WeakPolarHBondContact O-CG 2.96Å
387	R	45.5	Very low	50.5	Low	182 Å²	182	56.9 Å²	56.9	69%	0.687	31%	0.307	S	S	*	.	S	Bend	trans	-56.8	-11	-178.9	-65.3	-174.8	179.6	-171.4	0.5	116.8	P402 Q404	R387-P402 HydrophobicContact CG-CB 4.16Å; R387-Q404 CarbonylContact C-O 3.53Å; R387-Q404 VanDerWaalsContact C-O 3.28Å
388	Q	42.2	Very low	50.8	Low	116 Å²	116	56.5 Å²	56.5	54%	0.542	31%	0.306	S	S	.	.			trans	-141.9	117.7	172	-67.2	-167.5	-57.6	0	0	105	R371 P386	R371-Q388 CarbonylContact C-O 3.37Å; R371-Q388 WeakPolarHBondContact CA-O 3.34Å; P386-Q388 PolarHBondContact O-N 2.73Å
389	A	45.1	Very low	50.6	Low	13 Å²	13	57.3 Å²	57.3	11%	0.107	31%	0.308	C	S	.	.			trans	-115.9	130.2	163.8	0	0	0	0	0	105.3	I393	A389-I393 HydrophobicContact CB-CD1 3.77Å; A389-I393 HydrophobicContact CB-CG1 4.43Å
390	T	38.6	Very low	50.2	Low	63 Å²	63	62.8 Å²	62.8	39%	0.387	33%	0.333	S	S	.	.			trans	-85.6	-13.7	-171.9	-21.8	0	0	0	0	112.9
391	E	50.7	Low	49.9	Very low	90 Å²	90	59.2 Å²	59.2	42%	0.421	31%	0.314	S	S	.	.	S	Bend	trans	-147.5	168.3	-178.5	-68.5	-158.8	172.1	0	0	113.5	I393	E391-I393 PolarHBondContact O-N 3.09Å
392	K	49.4	Very low	49.8	Very low	129 Å²	129	57.9 Å²	57.9	56%	0.561	30%	0.304	S	S	*	.			trans	-53.5	112.6	-179.6	-69.5	-179.2	-178.8	178.2	0	112.6
393	I	52.8	Low	49.2	Very low	10 Å²	10	66.8 Å²	66.8	5%	0.051	34%	0.338	C	S	.	.			trans	-96.3	132.2	167.5	-44.8	-179.1	0	0	0	107.9	I382 V385 A389 E391 V395 A410	I382-I393 HydrophobicContact CD1-CG2 4.36Å; V385-I393 HydrophobicContact CG1-CD1 4.3Å; A389-I393 HydrophobicContact CB-CD1 3.77Å; A389-I393 HydrophobicContact CB-CG1 4.43Å; E391-I393 PolarHBondContact O-N 3.09Å; I393-V395 HydrophobicContact CB-CG2 4.19Å; I393-V395 HydrophobicContact CG2-CG2 3.29Å; I393-A410 PolarHBondContact O-N 3.46Å
394	A	54	Low	48.8	Very low	56 Å²	56	68.8 Å²	68.8	46%	0.463	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	119.6	166.2	0	0	0	0	0	107.2	I377 V379	I377-A394 PolarHBondContact O-N 2.79Å; V379-A394 PolarHBondContact N-O 3.46Å
395	V	56.9	Low	48.7	Very low	2 Å²	2	63.8 Å²	63.8	1%	0.012	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	131.2	-176.6	-165.1	0	0	0	0	109.2	V379 I382 I393 S397 I398 A410 V411 D412	V379-V395 WeakPolarHBondContact O-CA 3.4Å; I382-V395 HydrophobicContact CB-CG1 4.3Å; I382-V395 HydrophobicContact CD1-CB 4.39Å; I382-V395 HydrophobicContact CD1-CG1 3.86Å; I382-V395 HydrophobicContact CD1-CG2 3.53Å; I382-V395 HydrophobicContact CG1-CG1 3.85Å; I382-V395 HydrophobicContact CG1-CG2 4.44Å; I393-V395 HydrophobicContact CB-CG2 4.19Å; I393-V395 HydrophobicContact CG2-CG2 3.29Å; V395-S397 VanDerWaalsContact CG1-O 3.32Å; V395-S397 WeakPolarHBondContact CG1-O 3.5Å; V395-I398 HydrophobicContact CB-CD1 4.01Å; V395-I398 HydrophobicContact CB-CG1 3.86Å; V395-I398 HydrophobicContact CG1-CD1 4.29Å; V395-I398 HydrophobicContact CG1-CG1 3.61Å; V395-I398 HydrophobicContact CG2-CD1 4.03Å; V395-I398 HydrophobicContact CG2-CG1 4.26Å; V395-A410 PolarHBondContact N-O 2.79Å; V395-V411 WeakPolarHBondContact O-CA 3.4Å; V395-D412 PolarHBondContact O-N 3.19Å
396	D	56.2	Low	48.1	Very low	80 Å²	80	66.7 Å²	66.7	43%	0.428	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	-37.7	179.5	-66	1.5	0	0	0	110.8	V379 D380 D412 S413	V379-D396 PolarHBondContact O-N 3.14Å; D380-D396 WeakPolarHBondContact O-CB 3.14Å; D396-D412 WeakPolarHBondContact O-CB 3.43Å; D396-S413 PolarHBondContact O-N 3.36Å; D396-S413 VanDerWaalsContact O-N 3.14Å; D396-S413 PolarHBondContact O-OG 2.93Å
397	S	47.7	Very low	48.2	Very low	46 Å²	46	70.4 Å²	70.4	32%	0.322	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	129.4	179.5	61.4	0	0	0	0	114	D380 I382 V395	D380-S397 PolarHBondContact O-N 3.03Å; D380-S397 PolarHBondContact O-OG 3.49Å; I382-S397 PolarHBondContact N-O 3.06Å; V395-S397 VanDerWaalsContact CG1-O 3.32Å; V395-S397 WeakPolarHBondContact CG1-O 3.5Å
398	I	57.6	Low	48.4	Very low	3 Å²	3	67.7 Å²	67.7	2%	0.015	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	130.1	174	-58.8	174.8	0	0	0	110.1	V385 V395 E400 V401 I409 V411 S413 S415	V385-I398 HydrophobicContact CG2-CD1 4.01Å; V385-I398 HydrophobicContact CG2-CG1 4.5Å; V385-I398 HydrophobicContact CG2-CG2 4.21Å; V395-I398 HydrophobicContact CB-CD1 4.01Å; V395-I398 HydrophobicContact CB-CG1 3.86Å; V395-I398 HydrophobicContact CG1-CD1 4.29Å; V395-I398 HydrophobicContact CG1-CG1 3.61Å; V395-I398 HydrophobicContact CG2-CD1 4.03Å; V395-I398 HydrophobicContact CG2-CG1 4.26Å; I398-E400 WeakPolarHBondContact CG2-O 3.26Å; I398-V401 HydrophobicContact CD1-CG2 4.38Å; I398-V401 HydrophobicContact CG2-CG2 3.91Å; I398-I409 HydrophobicContact CD1-CG2 4.38Å; I398-V411 HydrophobicContact CB-CG1 4.3Å; I398-V411 HydrophobicContact CD1-CB 4.36Å; I398-V411 HydrophobicContact CD1-CG1 3.82Å; I398-V411 HydrophobicContact CD1-CG2 3.52Å; I398-V411 HydrophobicContact CG1-CG1 3.85Å; I398-V411 HydrophobicContact CG1-CG2 4.45Å; I398-S413 PolarHBondContact N-O 3.13Å; I398-S413 VanDerWaalsContact N-O 3.15Å; I398-S415 PolarHBondContact O-N 3.22Å
399	S	51.9	Low	48.9	Very low	72 Å²	72	62.7 Å²	62.7	50%	0.503	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	-49.4	175.1	-59.7	0	0	0	0	111.9	I382	I382-S399 PolarHBondContact O-N 2.83Å
400	E	47.8	Very low	49.3	Very low	117 Å²	117	64.6 Å²	64.6	55%	0.547	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	125.9	180	-163.9	176	169.5	0	0	111.7	I398	I398-E400 WeakPolarHBondContact CG2-O 3.26Å
401	V	49.9	Very low	50.1	Low	4 Å²	4	61.7 Å²	61.7	2%	0.024	32%	0.32	C	S	.	.			trans	-91.2	133.3	173.3	179.7	0	0	0	0	109.3	I398 I409 I414 P418	I398-V401 HydrophobicContact CD1-CG2 4.38Å; I398-V401 HydrophobicContact CG2-CG2 3.91Å; V401-I409 HydrophobicContact CG1-CD1 4.38Å; V401-I414 HydrophobicContact CG2-CD1 4.02Å; V401-I414 HydrophobicContact CG2-CG1 4.48Å; V401-I414 HydrophobicContact CG2-CG2 4.17Å; V401-P418 HydrophobicContact CB-CG 4.22Å; V401-P418 HydrophobicContact CG1-CG 4.2Å; V401-P418 VanDerWaalsContact O-CD 3.32Å; V401-P418 WeakPolarHBondContact O-CD 3.39Å; V401-P418 WeakPolarHBondContact O-CG 3.49Å
402	P	46.3	Very low	50.4	Low	19 Å²	19	61.3 Å²	61.3	12%	0.123	32%	0.321	C	S	.	.			trans	-68.9	150.3	179.9	28.6	-38.6	0	0	0	112.9	V385 P386 R387 Q404 P418	V385-P402 HydrophobicContact CB-CG 4.22Å; V385-P402 HydrophobicContact CG1-CG 4.27Å; V385-P402 WeakPolarHBondContact O-CB 3.4Å; V385-P402 VanDerWaalsContact O-CD 3.26Å; V385-P402 WeakPolarHBondContact O-CD 3.4Å; V385-P402 WeakPolarHBondContact O-CG 3.29Å; P386-P402 WeakPolarHBondContact O-CG 2.96Å; R387-P402 HydrophobicContact CG-CB 4.16Å; P402-Q404 PolarHBondContact O-N 3.38Å; P402-P418 WeakPolarHBondContact O-CG 3.4Å
403	R	45.6	Very low	50.3	Low	190 Å²	190	57.7 Å²	57.7	72%	0.717	31%	0.312	S	S	*	.	S	Bend	trans	-55.3	-10.6	-178.3	-66.9	-174.7	-179.8	-176.5	1.2	117.4	P418 Q420	R403-P418 HydrophobicContact CG-CB 4.21Å; R403-Q420 CarbonylContact C-O 3.51Å; R403-Q420 VanDerWaalsContact C-O 3.31Å
404	Q	42	Very low	50.5	Low	115 Å²	115	57.3 Å²	57.3	54%	0.537	31%	0.31	S	S	.	.			trans	-144	112	172.1	-68.5	-169.2	-52	0	0	105.1	R387 P402	R387-Q404 CarbonylContact C-O 3.53Å; R387-Q404 VanDerWaalsContact C-O 3.28Å; P402-Q404 PolarHBondContact O-N 3.38Å
405	A	45.1	Very low	50.4	Low	14 Å²	14	58 Å²	58	12%	0.116	31%	0.311	C	S	.	.			trans	-99.6	140.7	159.7	0	0	0	0	0	106.7	I409	A405-I409 HydrophobicContact CB-CD1 3.82Å; A405-I409 HydrophobicContact CB-CG1 4.44Å
406	T	37.2	Very low	50	Low	65 Å²	65	63.2 Å²	63.2	40%	0.399	34%	0.336	S	S	.	.			trans	-92.9	-16.8	-175.9	-39.3	0	0	0	0	112.3
407	E	50	Low	49.7	Very low	92 Å²	92	59.6 Å²	59.6	43%	0.43	32%	0.316	S	S	.	.	S	Bend	trans	-148.2	171.6	178.2	-68.4	-160.7	170.7	0	0	113.5	I409	E407-I409 PolarHBondContact O-N 3.08Å
408	K	49	Very low	49.7	Very low	125 Å²	125	58.4 Å²	58.4	54%	0.543	31%	0.307	S	S	.	.			trans	-54.4	114.9	-178.5	-68.7	-179.5	-177.5	176.4	0	113
409	I	52.8	Low	49.1	Very low	11 Å²	11	67.3 Å²	67.3	6%	0.056	34%	0.341	C	S	.	.			trans	-98.8	132.9	168.2	-44.7	-179.7	0	0	0	108	I398 V401 A405 E407 V411 A426	I398-I409 HydrophobicContact CD1-CG2 4.38Å; V401-I409 HydrophobicContact CG1-CD1 4.38Å; A405-I409 HydrophobicContact CB-CD1 3.82Å; A405-I409 HydrophobicContact CB-CG1 4.44Å; E407-I409 PolarHBondContact O-N 3.08Å; I409-V411 HydrophobicContact CB-CG2 4.2Å; I409-V411 HydrophobicContact CG2-CG2 3.29Å; I409-A426 PolarHBondContact O-N 3.48Å
410	A	53.6	Low	48.7	Very low	54 Å²	54	69.8 Å²	69.8	45%	0.446	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	119.2	166.6	0	0	0	0	0	107.3	I393 V395	I393-A410 PolarHBondContact O-N 3.46Å; V395-A410 PolarHBondContact N-O 2.79Å
411	V	56.4	Low	48.6	Very low	2 Å²	2	65 Å²	65	1%	0.012	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	130.4	-175.9	-165.7	0	0	0	0	109.1	V395 I398 I409 S413 I414 A426 V427 D428	V395-V411 WeakPolarHBondContact O-CA 3.4Å; I398-V411 HydrophobicContact CB-CG1 4.3Å; I398-V411 HydrophobicContact CD1-CB 4.36Å; I398-V411 HydrophobicContact CD1-CG1 3.82Å; I398-V411 HydrophobicContact CD1-CG2 3.52Å; I398-V411 HydrophobicContact CG1-CG1 3.85Å; I398-V411 HydrophobicContact CG1-CG2 4.45Å; I409-V411 HydrophobicContact CB-CG2 4.2Å; I409-V411 HydrophobicContact CG2-CG2 3.29Å; V411-S413 WeakPolarHBondContact CG1-O 3.25Å; V411-I414 HydrophobicContact CB-CD1 4.01Å; V411-I414 HydrophobicContact CB-CG1 3.87Å; V411-I414 HydrophobicContact CG1-CD1 4.26Å; V411-I414 HydrophobicContact CG1-CG1 3.59Å; V411-I414 HydrophobicContact CG2-CD1 4.05Å; V411-I414 HydrophobicContact CG2-CG1 4.29Å; V411-A426 PolarHBondContact N-O 3.17Å; V411-V427 WeakPolarHBondContact O-CA 3.4Å; V411-D428 PolarHBondContact O-N 3.04Å
412	D	55.9	Low	48	Very low	82 Å²	82	68.3 Å²	68.3	44%	0.439	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	-38.3	178.9	-67.5	1.6	0	0	0	110.5	V395 D396 D428 S429	V395-D412 PolarHBondContact O-N 3.19Å; D396-D412 WeakPolarHBondContact O-CB 3.43Å; D412-D428 WeakPolarHBondContact O-CB 3.42Å; D412-S429 PolarHBondContact O-N 3.41Å
413	S	47.3	Very low	48.1	Very low	53 Å²	53	71.9 Å²	71.9	37%	0.371	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	130.4	179.9	54.1	0	0	0	0	114.6	D396 I398 V411	D396-S413 PolarHBondContact O-N 3.36Å; D396-S413 VanDerWaalsContact O-N 3.14Å; D396-S413 PolarHBondContact O-OG 2.93Å; I398-S413 PolarHBondContact N-O 3.13Å; I398-S413 VanDerWaalsContact N-O 3.15Å; V411-S413 WeakPolarHBondContact CG1-O 3.25Å
414	I	57.8	Low	48.2	Very low	2 Å²	2	68.9 Å²	68.9	1%	0.01	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	132.6	176.3	-59	174.7	0	0	0	110.4	V401 V411 E416 V417 I425 V427 S429 S431	V401-I414 HydrophobicContact CG2-CD1 4.02Å; V401-I414 HydrophobicContact CG2-CG1 4.48Å; V401-I414 HydrophobicContact CG2-CG2 4.17Å; V411-I414 HydrophobicContact CB-CD1 4.01Å; V411-I414 HydrophobicContact CB-CG1 3.87Å; V411-I414 HydrophobicContact CG1-CD1 4.26Å; V411-I414 HydrophobicContact CG1-CG1 3.59Å; V411-I414 HydrophobicContact CG2-CD1 4.05Å; V411-I414 HydrophobicContact CG2-CG1 4.29Å; I414-E416 WeakPolarHBondContact CG2-O 3.46Å; I414-V417 HydrophobicContact CG2-CG2 4.08Å; I414-I425 HydrophobicContact CD1-CG2 4.38Å; I414-V427 HydrophobicContact CB-CG1 4.32Å; I414-V427 HydrophobicContact CD1-CB 4.35Å; I414-V427 HydrophobicContact CD1-CG1 3.81Å; I414-V427 HydrophobicContact CD1-CG2 3.52Å; I414-V427 HydrophobicContact CG1-CG1 3.87Å; I414-V427 HydrophobicContact CG1-CG2 4.48Å; I414-S429 PolarHBondContact N-O 3.18Å; I414-S429 VanDerWaalsContact N-O 3.1Å; I414-S431 PolarHBondContact O-N 2.85Å
415	S	51.6	Low	48.7	Very low	69 Å²	69	63.9 Å²	63.9	48%	0.483	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	-51	175	-57	0	0	0	0	111.9	I398 S431 E432	I398-S415 PolarHBondContact O-N 3.22Å; S415-S431 WeakPolarHBondContact O-CB 3.35Å; S415-E432 PolarHBondContact O-N 2.84Å
416	E	47.6	Very low	49.1	Very low	113 Å²	113	65.7 Å²	65.7	53%	0.528	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	127.7	-179.3	-164.8	176.2	170	0	0	112.1	I414	I414-E416 WeakPolarHBondContact CG2-O 3.46Å
417	V	50.7	Low	49.9	Very low	4 Å²	4	62.8 Å²	62.8	2%	0.024	33%	0.326	C	S	.	.			trans	-91.2	136	174.3	-179.3	0	0	0	0	109.8	I414 I430 P434 I441	I414-V417 HydrophobicContact CG2-CG2 4.08Å; V417-I430 HydrophobicContact CG2-CD1 4Å; V417-I430 HydrophobicContact CG2-CG1 4.42Å; V417-I430 HydrophobicContact CG2-CG2 3.97Å; V417-P434 HydrophobicContact CB-CG 4.43Å; V417-P434 HydrophobicContact CG1-CG 4.47Å; V417-P434 WeakPolarHBondContact O-CD 3.43Å; V417-P434 WeakPolarHBondContact O-CG 3.37Å; V417-I441 HydrophobicContact CG1-CD1 4.46Å
418	P	47.5	Very low	50.2	Low	20 Å²	20	62 Å²	62	13%	0.13	33%	0.325	C	S	.	.			trans	-71.6	149.8	178.6	27.5	-36.8	0	0	0	113.4	V401 P402 R403 Q420	V401-P418 HydrophobicContact CB-CG 4.22Å; V401-P418 HydrophobicContact CG1-CG 4.2Å; V401-P418 VanDerWaalsContact O-CD 3.32Å; V401-P418 WeakPolarHBondContact O-CD 3.39Å; V401-P418 WeakPolarHBondContact O-CG 3.49Å; P402-P418 WeakPolarHBondContact O-CG 3.4Å; R403-P418 HydrophobicContact CG-CB 4.21Å; P418-Q420 PolarHBondContact O-N 3.46Å
419	R	46.2	Very low	50.1	Low	191 Å²	191	58.8 Å²	58.8	72%	0.721	32%	0.318	S	S	*	.	S	Bend	trans	-57.3	-13	-178	-69.6	-175.7	177.2	-177.8	1	116.5	P434 Q436	R419-P434 HydrophobicContact CB-CB 4.47Å; R419-P434 HydrophobicContact CG-CB 3.9Å; R419-Q436 CarbonylContact C-O 3.48Å
420	Q	42.2	Very low	50.3	Low	124 Å²	124	58.3 Å²	58.3	58%	0.579	32%	0.316	S	S	*	.			trans	-142.3	120.2	173	-68.4	-167.4	-44.4	0	0	105.5	R403 P418	R403-Q420 CarbonylContact C-O 3.51Å; R403-Q420 VanDerWaalsContact C-O 3.31Å; P418-Q420 PolarHBondContact O-N 3.46Å
421	A	45.3	Very low	50.1	Low	17 Å²	17	58.8 Å²	58.8	14%	0.14	32%	0.316	C	S	.	.			trans	-115.1	134.4	164.5	0	0	0	0	0	106.1	I425	A421-I425 HydrophobicContact CB-CD1 3.95Å
422	T	37.5	Very low	49.6	Very low	72 Å²	72	63.8 Å²	63.8	44%	0.442	34%	0.339	S	S	.	.	S	Bend	trans	-86	-17.2	-174.6	-26.5	0	0	0	0	112.4
423	E	49.8	Very low	49.3	Very low	94 Å²	94	60.2 Å²	60.2	44%	0.439	32%	0.32	S	S	.	.	S	Bend	trans	-147.2	170.4	-179.2	-68.4	-159	170.6	0	0	113.6	I425	E423-I425 PolarHBondContact O-N 2.9Å
424	K	47.7	Very low	49.3	Very low	127 Å²	127	58.8 Å²	58.8	55%	0.552	31%	0.31	S	S	*	.			trans	-58.1	115.7	-177.2	-68.3	179.9	-178.1	176	0	112.9
425	I	52.6	Low	48.5	Very low	10 Å²	10	67.9 Å²	67.9	5%	0.051	34%	0.344	C	S	.	.			trans	-97.5	132.8	167.3	-45.5	179.1	0	0	0	108	I414 A421 E423 V427 A442	I414-I425 HydrophobicContact CD1-CG2 4.38Å; A421-I425 HydrophobicContact CB-CD1 3.95Å; E423-I425 PolarHBondContact O-N 2.9Å; I425-V427 HydrophobicContact CB-CG2 4.22Å; I425-V427 HydrophobicContact CG2-CG2 3.32Å; I425-A442 PolarHBondContact O-N 3.36Å
426	A	52.3	Low	48	Very low	53 Å²	53	70.9 Å²	70.9	44%	0.438	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	119.1	167.3	0	0	0	0	0	107.5	I409 V411	I409-A426 PolarHBondContact O-N 3.48Å; V411-A426 PolarHBondContact N-O 3.17Å
427	V	55.1	Low	47.8	Very low	3 Å²	3	66.9 Å²	66.9	2%	0.018	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	130.7	-175.8	-165.5	0	0	0	0	109.5	V411 I414 I425 S429 I430 A442 V443 D444	V411-V427 WeakPolarHBondContact O-CA 3.4Å; I414-V427 HydrophobicContact CB-CG1 4.32Å; I414-V427 HydrophobicContact CD1-CB 4.35Å; I414-V427 HydrophobicContact CD1-CG1 3.81Å; I414-V427 HydrophobicContact CD1-CG2 3.52Å; I414-V427 HydrophobicContact CG1-CG1 3.87Å; I414-V427 HydrophobicContact CG1-CG2 4.48Å; I425-V427 HydrophobicContact CB-CG2 4.22Å; I425-V427 HydrophobicContact CG2-CG2 3.32Å; V427-S429 WeakPolarHBondContact CG1-O 3.47Å; V427-I430 HydrophobicContact CB-CD1 4.03Å; V427-I430 HydrophobicContact CB-CG1 3.88Å; V427-I430 HydrophobicContact CG1-CD1 4.27Å; V427-I430 HydrophobicContact CG1-CG1 3.58Å; V427-I430 HydrophobicContact CG2-CD1 4.1Å; V427-I430 HydrophobicContact CG2-CG1 4.3Å; V427-A442 PolarHBondContact N-O 3.23Å; V427-V443 WeakPolarHBondContact O-CA 3.47Å; V427-D444 PolarHBondContact O-N 3.3Å
428	D	55.1	Low	47.2	Very low	77 Å²	77	70.4 Å²	70.4	41%	0.412	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	-40.6	178.5	-69.1	2.2	0	0	0	110.7	V411 D412 D444 S445	V411-D428 PolarHBondContact O-N 3.04Å; D412-D428 WeakPolarHBondContact O-CB 3.42Å; D428-D444 WeakPolarHBondContact O-CB 3.39Å; D428-S445 PolarHBondContact O-N 2.8Å
429	S	46.7	Very low	47.1	Very low	56 Å²	56	74.7 Å²	74.7	39%	0.392	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	129.3	179.8	-61.1	0	0	0	0	114.2	D412 I414 V427	D412-S429 PolarHBondContact O-N 3.41Å; I414-S429 PolarHBondContact N-O 3.18Å; I414-S429 VanDerWaalsContact N-O 3.1Å; V427-S429 WeakPolarHBondContact CG1-O 3.47Å
430	I	56.7	Low	47	Very low	2 Å²	2	71.6 Å²	71.6	1%	0.01	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	133.4	174.6	-59.1	172.8	0	0	0	110.9	V417 V427 V433 I441 V443 S445 S447	V417-I430 HydrophobicContact CG2-CD1 4Å; V417-I430 HydrophobicContact CG2-CG1 4.42Å; V417-I430 HydrophobicContact CG2-CG2 3.97Å; V427-I430 HydrophobicContact CB-CD1 4.03Å; V427-I430 HydrophobicContact CB-CG1 3.88Å; V427-I430 HydrophobicContact CG1-CD1 4.27Å; V427-I430 HydrophobicContact CG1-CG1 3.58Å; V427-I430 HydrophobicContact CG2-CD1 4.1Å; V427-I430 HydrophobicContact CG2-CG1 4.3Å; I430-V433 HydrophobicContact CG2-CG2 3.92Å; I430-I441 HydrophobicContact CD1-CG2 4.3Å; I430-V443 HydrophobicContact CB-CG1 4.4Å; I430-V443 HydrophobicContact CD1-CB 4.28Å; I430-V443 HydrophobicContact CD1-CG1 3.73Å; I430-V443 HydrophobicContact CD1-CG2 3.48Å; I430-V443 VanDerWaalsContact CD1-CG2 3.48Å; I430-V443 HydrophobicContact CG1-CG1 3.9Å; I430-S445 PolarHBondContact N-O 2.85Å; I430-S447 PolarHBondContact O-N 2.85Å; I430-S447 VanDerWaalsContact O-N 3.09Å
431	S	50.3	Low	47.4	Very low	64 Å²	64	66.2 Å²	66.2	45%	0.448	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	-51.7	174.1	-55.6	0	0	0	0	112	I414 S415 E448	I414-S431 PolarHBondContact O-N 2.85Å; S415-S431 WeakPolarHBondContact O-CB 3.35Å; S431-E448 PolarHBondContact O-N 3.09Å
432	E	46.5	Very low	47.7	Very low	106 Å²	106	68 Å²	68	50%	0.495	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	127.1	-178.4	-162.3	173.6	172.1	0	0	113	S415	S415-E432 PolarHBondContact O-N 2.84Å
433	V	49.8	Very low	48.4	Very low	7 Å²	7	64.7 Å²	64.7	4%	0.042	34%	0.338	C	S	.	.			trans	-99.9	133.3	175.7	-176.2	0	0	0	0	109.8	I430 I446 P450	I430-V433 HydrophobicContact CG2-CG2 3.92Å; V433-I446 HydrophobicContact CG2-CD1 4.38Å; V433-I446 HydrophobicContact CG2-CG2 3.91Å; V433-P450 VanDerWaalsContact O-CD 3.23Å; V433-P450 WeakPolarHBondContact O-CD 3.05Å; V433-P450 WeakPolarHBondContact O-CG 3.43Å
434	P	45.4	Very low	48.6	Very low	23 Å²	23	63.8 Å²	63.8	15%	0.149	34%	0.336	C	S	.	.			trans	-72	153.8	178.8	28.2	-36.1	0	0	0	113.3	V417 R419 Q436	V417-P434 HydrophobicContact CB-CG 4.43Å; V417-P434 HydrophobicContact CG1-CG 4.47Å; V417-P434 WeakPolarHBondContact O-CD 3.43Å; V417-P434 WeakPolarHBondContact O-CG 3.37Å; R419-P434 HydrophobicContact CB-CB 4.47Å; R419-P434 HydrophobicContact CG-CB 3.9Å; P434-Q436 PolarHBondContact O-N 3.29Å
435	R	42.6	Very low	48.6	Very low	194 Å²	194	59.5 Å²	59.5	73%	0.732	32%	0.322	S	S	*	.	S	Bend	trans	-59.1	-18.6	-176.9	-70.2	-176.2	-178.9	175.1	1.8	115.9	P450	R435-P450 HydrophobicContact CG-CB 3.94Å; R435-P450 HydrophobicContact CG-CG 4.36Å
436	Q	40.6	Very low	48.7	Very low	131 Å²	131	60.1 Å²	60.1	61%	0.612	33%	0.325	S	S	*	.			trans	-135.1	118.1	174.9	-67.9	-168.7	-40.5	0	0	106.5	R419 P434	R419-Q436 CarbonylContact C-O 3.48Å; P434-Q436 PolarHBondContact O-N 3.29Å
437	A	43.6	Very low	48.6	Very low	29 Å²	29	62.6 Å²	62.6	24%	0.24	34%	0.339	C	S	.	.			trans	-118.4	133.3	164.7	0	0	0	0	0	106.1	I441	A437-I441 HydrophobicContact CB-CD1 4.1Å
438	T	36.8	Very low	48.1	Very low	79 Å²	79	68.6 Å²	68.6	49%	0.485	37%	0.367	S	S	.	.			trans	-88.3	-16.6	-173.2	-30.1	0	0	0	0	112.5
439	E	46.2	Very low	47.8	Very low	109 Å²	109	69 Å²	69	51%	0.509	37%	0.372	S	S	.	.	S	Bend	trans	-143.9	168.6	-178.1	-71.8	-157.3	173.1	0	0	114.6	I441	E439-I441 PolarHBondContact O-N 2.97Å
440	K	44.4	Very low	47.6	Very low	127 Å²	127	67.8 Å²	67.8	55%	0.552	36%	0.363	S	S	*	.			trans	-61.5	110.1	-173.7	-70.7	-178.8	-179.5	178.1	0	112.4
441	I	50.5	Low	46.8	Very low	11 Å²	11	79.6 Å²	79.6	6%	0.056	41%	0.407	C	S	.	.			trans	-90.7	129.3	165.2	-44.8	178.6	0	0	0	107.8	V417 I430 A437 E439 V443	V417-I441 HydrophobicContact CG1-CD1 4.46Å; I430-I441 HydrophobicContact CD1-CG2 4.3Å; A437-I441 HydrophobicContact CB-CD1 4.1Å; E439-I441 PolarHBondContact O-N 2.97Å; I441-V443 HydrophobicContact CB-CG2 4.08Å; I441-V443 HydrophobicContact CG2-CG2 3.28Å
442	A	51.2	Low	46	Very low	54 Å²	54	82.9 Å²	82.9	45%	0.446	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	116.6	167.2	0	0	0	0	0	107.1	I425 V427	I425-A442 PolarHBondContact O-N 3.36Å; V427-A442 PolarHBondContact N-O 3.23Å
443	V	53.5	Low	45.7	Very low	2 Å²	2	80.2 Å²	80.2	1%	0.012	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	132.2	-175.8	-165.6	0	0	0	0	108.9	V427 I430 I441 S445 I446	V427-V443 WeakPolarHBondContact O-CA 3.47Å; I430-V443 HydrophobicContact CB-CG1 4.4Å; I430-V443 HydrophobicContact CD1-CB 4.28Å; I430-V443 HydrophobicContact CD1-CG1 3.73Å; I430-V443 HydrophobicContact CD1-CG2 3.48Å; I430-V443 VanDerWaalsContact CD1-CG2 3.48Å; I430-V443 HydrophobicContact CG1-CG1 3.9Å; I441-V443 HydrophobicContact CB-CG2 4.08Å; I441-V443 HydrophobicContact CG2-CG2 3.28Å; V443-S445 VanDerWaalsContact CG1-O 3.31Å; V443-S445 WeakPolarHBondContact CG1-O 3.44Å; V443-I446 HydrophobicContact CB-CD1 4.14Å; V443-I446 HydrophobicContact CB-CG1 3.99Å; V443-I446 HydrophobicContact CG1-CD1 4.27Å; V443-I446 HydrophobicContact CG1-CG1 3.57Å; V443-I446 HydrophobicContact CG2-CD1 4.31Å; V443-I446 HydrophobicContact CG2-CG1 4.42Å
444	D	53.8	Low	45.1	Very low	76 Å²	76	84.7 Å²	84.7	41%	0.406	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	-40.9	175.7	-72.5	-4.4	0	0	0	110.8	V427 D428 S463	V427-D444 PolarHBondContact O-N 3.3Å; D428-D444 WeakPolarHBondContact O-CB 3.39Å; D444-S463 WeakPolarHBondContact O-CB 3.45Å; D444-S463 PolarHBondContact O-OG 2.87Å
445	S	47	Very low	44.6	Very low	36 Å²	36	90.3 Å²	90.3	25%	0.252	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	131.5	-177.7	-44.8	0	0	0	0	113.4	D428 I430 V443 S463	D428-S445 PolarHBondContact O-N 2.8Å; I430-S445 PolarHBondContact N-O 2.85Å; V443-S445 VanDerWaalsContact CG1-O 3.31Å; V443-S445 WeakPolarHBondContact CG1-O 3.44Å; S445-S463 PolarHBondContact OG-OG 3Å
446	I	54.3	Low	44.4	Very low	23 Å²	23	88.5 Å²	88.5	12%	0.118	46%	0.461	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	128.5	177.2	-57.1	166.8	0	0	0	110.1	V433 V443 V449 I457 V459	V433-I446 HydrophobicContact CG2-CD1 4.38Å; V433-I446 HydrophobicContact CG2-CG2 3.91Å; V443-I446 HydrophobicContact CB-CD1 4.14Å; V443-I446 HydrophobicContact CB-CG1 3.99Å; V443-I446 HydrophobicContact CG1-CD1 4.27Å; V443-I446 HydrophobicContact CG1-CG1 3.57Å; V443-I446 HydrophobicContact CG2-CD1 4.31Å; V443-I446 HydrophobicContact CG2-CG1 4.42Å; I446-V449 HydrophobicContact CB-CG2 4.24Å; I446-V449 HydrophobicContact CD1-CG2 4.32Å; I446-V449 HydrophobicContact CG2-CG2 3.68Å; I446-I457 HydrophobicContact CD1-CG2 4.25Å; I446-V459 HydrophobicContact CD1-CG2 4.06Å
447	S	50.5	Low	44.7	Very low	106 Å²	106	84.9 Å²	84.9	74%	0.741	45%	0.445	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.2	-41	176.9	-58.5	0	0	0	0	113	I430	I430-S447 PolarHBondContact O-N 2.85Å; I430-S447 VanDerWaalsContact O-N 3.09Å
448	E	45.7	Very low	44.7	Very low	128 Å²	128	86.8 Å²	86.8	60%	0.598	46%	0.461	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-139	122.2	-178.3	-161.3	165.1	-178.1	0	0	113.1	S431	S431-E448 PolarHBondContact O-N 3.09Å
449	V	47.7	Very low	45.2	Very low	86 Å²	86	85.9 Å²	85.9	52%	0.521	46%	0.455	S	S	.	.			trans	-110.5	120.7	178.5	-175.7	0	0	0	0	110.1	I446	I446-V449 HydrophobicContact CB-CG2 4.24Å; I446-V449 HydrophobicContact CD1-CG2 4.32Å; I446-V449 HydrophobicContact CG2-CG2 3.68Å
450	P	42	Very low	45.1	Very low	31 Å²	31	84.2 Å²	84.2	20%	0.201	45%	0.45	C	S	.	.			trans	-67.7	146.6	176.8	-16.8	27.3	0	0	0	113.5	V433 R435 Q452	V433-P450 VanDerWaalsContact O-CD 3.23Å; V433-P450 WeakPolarHBondContact O-CD 3.05Å; V433-P450 WeakPolarHBondContact O-CG 3.43Å; R435-P450 HydrophobicContact CG-CB 3.94Å; R435-P450 HydrophobicContact CG-CG 4.36Å; P450-Q452 PolarHBondContact O-N 2.92Å
451	R	39.5	Very low	44.9	Very low	249 Å²	249	83.8 Å²	83.8	94%	0.94	46%	0.46	S	S	*	.	S	Bend	trans	-56.9	-6.1	-176.8	-72.9	-178.4	176.4	159.3	0.6	117.1
452	Q	34.7	Very low	44.1	Very low	133 Å²	133	89.3 Å²	89.3	62%	0.621	50%	0.495	S	S	*	.			trans	-142.8	68.8	-178.6	-72.1	-170.1	-41	0	0	111.2	P450	P450-Q452 PolarHBondContact O-N 2.92Å
453	A	39.1	Very low	43.4	Very low	50 Å²	50	88.8 Å²	88.8	41%	0.413	49%	0.488	S	S	.	.			trans	-75.5	128.5	162	0	0	0	0	0	109.2	I457	A453-I457 HydrophobicContact CB-CD1 4.05Å
454	T	37.3	Very low	42.6	Very low	101 Å²	101	92.3 Å²	92.3	62%	0.62	51%	0.507	S	S	*	.			trans	-89	-8.1	-174.8	-18.8	0	0	0	0	114.5
455	E	35.3	Very low	41.4	Very low	142 Å²	142	96.3 Å²	96.3	66%	0.664	53%	0.528	S	S	*	.	S	Bend	trans	-159.8	170.2	174	-130.6	176.2	158.4	0	0	115	I457	E455-I457 PolarHBondContact O-N 2.86Å
456	K	39	Very low	40.6	Very low	156 Å²	156	102 Å²	102	68%	0.678	56%	0.555	S	S	*	*			trans	-47.6	98.3	-165.3	-70.2	174.6	178.1	172	0	115
457	I	46.3	Very low	39.3	Very low	54 Å²	54	111 Å²	111	28%	0.277	59%	0.593	S	S	.	*			trans	-81.3	125.7	157.7	-54.2	173.9	0	0	0	107.3	I446 A453 E455 V459	I446-I457 HydrophobicContact CD1-CG2 4.25Å; A453-I457 HydrophobicContact CB-CD1 4.05Å; E455-I457 PolarHBondContact O-N 2.86Å; I457-V459 HydrophobicContact CG2-CG2 3.62Å
458	A	44.9	Very low	38.2	Very low	70 Å²	70	110.9 Å²	110.9	58%	0.579	59%	0.588	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-100.2	103.9	169.2	0	0	0	0	0	107.5
459	V	46.9	Very low	37.4	Very low	59 Å²	59	109.7 Å²	109.7	36%	0.358	59%	0.594	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-96	133	174.3	-174.8	0	0	0	0	107.5	I446 I457 P461	I446-V459 HydrophobicContact CD1-CG2 4.06Å; I457-V459 HydrophobicContact CG2-CG2 3.62Å; V459-P461 WeakPolarHBondContact O-CD 3.46Å
460	D	44	Very low	36.5	Very low	74 Å²	74	112.2 Å²	112.2	40%	0.396	60%	0.604	S	S	.	*			trans	-65.7	118.4	168.3	-168.3	-40	0	0	0	108.6	T462 S463	D460-T462 PolarHBondContact O-N 3.27Å; D460-T462 PolarHBondContact OD1-N 3Å; D460-T462 PolarHBondContact OD1-OG1 3.33Å; D460-S463 PolarHBondContact O-N 2.98Å
461	P	39.1	Very low	35.9	Very low	119 Å²	119	120.9 Å²	120.9	77%	0.773	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.1	-6.5	-176.1	26.2	-34.3	0	0	0	114.4	V459	V459-P461 WeakPolarHBondContact O-CD 3.46Å
462	T	35.2	Very low	35.3	Very low	126 Å²	126	118 Å²	118	77%	0.773	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.4	-11.9	-179	52.3	0	0	0	0	115.4	D460	D460-T462 PolarHBondContact O-N 3.27Å; D460-T462 PolarHBondContact OD1-N 3Å; D460-T462 PolarHBondContact OD1-OG1 3.33Å
463	S	36.5	Very low	35.1	Very low	43 Å²	43	121.6 Å²	121.6	30%	0.301	65%	0.645	S	S	.	*	S	Bend	trans	-93.3	-18.8	-174.5	-173.2	0	0	0	0	116.6	D444 S445 D460 N465	D444-S463 WeakPolarHBondContact O-CB 3.45Å; D444-S463 PolarHBondContact O-OG 2.87Å; S445-S463 PolarHBondContact OG-OG 3Å; D460-S463 PolarHBondContact O-N 2.98Å; S463-N465 PolarHBondContact O-N 3.42Å
464	N	35	Very low	34.9	Very low	77 Å²	77	123.6 Å²	123.6	41%	0.412	65%	0.654	S	S	.	*			trans	-84.4	88.1	-173.4	-85.3	3.1	0	0	0	113.9	T468	N464-T468 HydrophobicContact CB-CG2 4.09Å
465	N	29.4	Very low	34.8	Very low	160 Å²	160	127.5 Å²	127.5	86%	0.856	66%	0.657	S	S	*	*			trans	-74.3	117.7	156.2	-83	-42.8	0	0	0	110	S463	S463-N465 PolarHBondContact O-N 3.42Å
466	L	29.5	Very low	35	Very low	155 Å²	155	125 Å²	125	81%	0.812	66%	0.655	S	S	*	*	S	Bend	trans	65.1	60.2	164.3	-66.7	163.3	0	0	0	117.6
467	F	27.8	Very low	35	Very low	212 Å²	212	121.5 Å²	121.5	93%	0.93	65%	0.648	S	S	*	*			trans	-164.7	29.4	138.3	-99.1	-67.2	0	0	0	112.9	S469	F467-S469 PolarHBondContact O-N 2.52Å
468	T	26.9	Very low	34.8	Very low	103 Å²	103	126.3 Å²	126.3	63%	0.632	67%	0.667	S	S	*	*			trans	-93.4	83.7	173.5	32.5	0	0	0	0	111.2	N464	N464-T468 HydrophobicContact CB-CG2 4.09Å
469	S	30	Very low	34.8	Very low	103 Å²	103	129.3 Å²	129.3	72%	0.72	67%	0.672	S	S	*	*	S	Bend	trans	-172.4	117.8	138.5	58.9	0	0	0	0	109.9	F467	F467-S469 PolarHBondContact O-N 2.52Å
470	L	28.5	Very low	34.6	Very low	139 Å²	139	132 Å²	132	73%	0.728	68%	0.683	S	S	*	*	S	Bend	trans	154.3	-1.3	141.4	-83.3	156	0	0	0	116
471	F	29.4	Very low	34.8	Very low	213 Å²	213	133.1 Å²	133.1	93%	0.934	69%	0.688	S	S	*	*			trans	-120.9	54.8	176.8	-63.9	-71.7	0	0	0	114
472	Q	27.5	Very low	35.3	Very low	188 Å²	188	131 Å²	131	88%	0.879	67%	0.674	S	S	*	*			trans	-119.5	73.9	160.4	-164.1	169.4	-7.2	0	0	109.3
473	Y	28.9	Very low	36.5	Very low	209 Å²	209	131 Å²	131	82%	0.82	67%	0.667	S	S	*	*			trans	-107.7	121.6	160.5	-89	-80.1	0	0	0	108.8	R475	Y473-R475 PolarHBondContact O-N 3.11Å
474	P	35	Very low	38	Very low	92 Å²	92	134.3 Å²	134.3	60%	0.597	68%	0.681	S	S	*	*			trans	-67.3	123.2	-176.8	25.6	-31.5	0	0	0	110.6	S476	P474-S476 PolarHBondContact O-N 3.46Å
475	R	34.9	Very low	39.7	Very low	183 Å²	183	134.5 Å²	134.5	69%	0.691	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.8	6.8	-178.6	-93.7	-176.8	173.7	151.1	2.1	115.6	Y473 T477	Y473-R475 PolarHBondContact O-N 3.11Å; R475-T477 VanDerWaalsContact C-N 3.31Å; R475-T477 PolarHBondContact O-N 3.16Å
476	S	40.7	Very low	41.8	Very low	89 Å²	89	131.1 Å²	131.1	62%	0.622	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76	-12.1	-179.3	52.1	0	0	0	0	114.5	P474	P474-S476 PolarHBondContact O-N 3.46Å
477	T	37.5	Very low	44.1	Very low	84 Å²	84	127.8 Å²	127.8	52%	0.515	65%	0.652	S	S	.	*	S	Bend	trans	-92.9	-17.2	176.9	27.9	0	0	0	0	115	R475 I479 L480	R475-T477 VanDerWaalsContact C-N 3.31Å; R475-T477 PolarHBondContact O-N 3.16Å; T477-I479 PolarHBondContact O-N 3.24Å; T477-L480 PolarHBondContact O-N 3.31Å
478	F	42.5	Very low	46.3	Very low	155 Å²	155	121 Å²	121	68%	0.68	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.7	-13.4	-174.9	-90.9	-81.8	0	0	0	115.5	P482	F478-P482 WeakPolarHBondContact O-CD 3.48Å
479	I	45.2	Very low	48.6	Very low	133 Å²	133	119.5 Å²	119.5	68%	0.682	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.6	-24.5	171.5	-60.1	175.9	0	0	0	111.1	T477	T477-I479 PolarHBondContact O-N 3.24Å
480	L	43.4	Very low	51	Low	114 Å²	114	118.8 Å²	118.8	60%	0.597	61%	0.61	S	S	*	*	H	α-helix	trans	-78.3	-32.4	-178.2	-90.6	147.3	0	0	0	113.7	T477 M483 L484	T477-L480 PolarHBondContact O-N 3.31Å; L480-M483 PolarHBondContact O-N 3.41Å; L480-L484 WeakPolarHBondContact O-CB 3.45Å; L480-L484 PolarHBondContact O-N 3.45Å
481	I	48.7	Very low	53.5	Low	98 Å²	98	116.9 Å²	116.9	50%	0.503	60%	0.599	S	S	.	*	H	α-helix	trans	-63.5	-50.4	180	-58.9	170.5	0	0	0	112.3	M483 L484 V485	I481-M483 VanDerWaalsContact C-N 3.31Å; I481-M483 PolarHBondContact O-N 2.9Å; I481-L484 PolarHBondContact O-N 3.25Å; I481-V485 WeakPolarHBondContact O-CG2 3.38Å; I481-V485 PolarHBondContact O-N 3.18Å; I481-V485 VanDerWaalsContact O-N 3.1Å
482	P	49.1	Very low	55.9	Low	74 Å²	74	110.4 Å²	110.4	48%	0.481	58%	0.581	S	S	.	*	H	α-helix	trans	-65.1	-34.9	178.1	22.5	-30.3	0	0	0	112.1	F478 V486	F478-P482 WeakPolarHBondContact O-CD 3.48Å; P482-V486 VanDerWaalsContact O-CG2 3.26Å; P482-V486 WeakPolarHBondContact O-CG2 3.38Å; P482-V486 PolarHBondContact O-N 3.31Å; P482-V486 VanDerWaalsContact O-N 3.12Å
483	M	59	Low	58.4	Low	127 Å²	127	106.2 Å²	106.2	63%	0.626	56%	0.563	S	S	*	*	H	α-helix	trans	-64.6	-42	174.1	-94.6	-140.6	-179.5	0	0	112.7	L480 I481 V486 I487	L480-M483 PolarHBondContact O-N 3.41Å; I481-M483 VanDerWaalsContact C-N 3.31Å; I481-M483 PolarHBondContact O-N 2.9Å; M483-V486 PolarHBondContact O-N 3.24Å; M483-I487 VanDerWaalsContact O-CG1 3.27Å; M483-I487 WeakPolarHBondContact O-CG1 3.47Å; M483-I487 PolarHBondContact O-N 3.46Å
484	L	68.2	Low	60.8	Low	112 Å²	112	98.7 Å²	98.7	59%	0.586	54%	0.544	S	S	*	.	H	α-helix	trans	-68.1	-36.3	-179.3	-155.6	77.2	0	0	0	112.1	L480 I481 I487 T488	L480-L484 WeakPolarHBondContact O-CB 3.45Å; L480-L484 PolarHBondContact O-N 3.45Å; I481-L484 PolarHBondContact O-N 3.25Å; L484-I487 PolarHBondContact O-N 3.13Å; L484-T488 WeakPolarHBondContact O-CB 3.3Å; L484-T488 VanDerWaalsContact O-CG2 3.3Å; L484-T488 WeakPolarHBondContact O-CG2 3.36Å; L484-T488 PolarHBondContact O-N 3.25Å; L484-T488 PolarHBondContact O-OG1 3.33Å
485	V	72.2	Confident	62.9	Low	82 Å²	82	99.3 Å²	99.3	50%	0.497	54%	0.542	S	S	.	.	H	α-helix	trans	-66	-39.6	174.6	175.3	0	0	0	0	111.4	I481 T488 T489	I481-V485 WeakPolarHBondContact O-CG2 3.38Å; I481-V485 PolarHBondContact O-N 3.18Å; I481-V485 VanDerWaalsContact O-N 3.1Å; V485-T488 WeakPolarHBondContact CA-OG1 3.42Å; V485-T488 PolarHBondContact O-OG1 3.24Å; V485-T488 VanDerWaalsContact O-OG1 3.09Å; V485-T489 PolarHBondContact O-N 2.92Å; V485-T489 VanDerWaalsContact O-N 3.1Å; V485-T489 PolarHBondContact O-OG1 2.93Å
486	V	73.5	Confident	65.2	Low	88 Å²	88	96.9 Å²	96.9	53%	0.533	54%	0.537	S	S	.	.	H	α-helix	trans	-67.5	-43.2	176	173.6	0	0	0	0	111.3	P482 M483 T489 V490	P482-V486 VanDerWaalsContact O-CG2 3.26Å; P482-V486 WeakPolarHBondContact O-CG2 3.38Å; P482-V486 PolarHBondContact O-N 3.31Å; P482-V486 VanDerWaalsContact O-N 3.12Å; M483-V486 PolarHBondContact O-N 3.24Å; V486-T489 WeakPolarHBondContact CA-OG1 3.42Å; V486-T489 PolarHBondContact O-OG1 3.25Å; V486-V490 HydrophobicContact CG1-CG2 4.49Å; V486-V490 VanDerWaalsContact O-CG2 3.23Å; V486-V490 WeakPolarHBondContact O-CG2 3.43Å; V486-V490 PolarHBondContact O-N 3.22Å
487	I	76.3	Confident	66.7	Low	85 Å²	85	99 Å²	99	44%	0.436	54%	0.535	S	S	.	.	H	α-helix	trans	-65.2	-44.1	178.8	-67.2	164.5	0	0	0	110.9	M483 L484 T489 V490 I491	M483-I487 VanDerWaalsContact O-CG1 3.27Å; M483-I487 WeakPolarHBondContact O-CG1 3.47Å; M483-I487 PolarHBondContact O-N 3.46Å; L484-I487 PolarHBondContact O-N 3.13Å; I487-T489 PolarHBondContact O-N 3.38Å; I487-V490 PolarHBondContact O-N 3.17Å; I487-I491 HydrophobicContact CG2-CD1 3.69Å; I487-I491 HydrophobicContact CG2-CG1 4.42Å; I487-I491 VanDerWaalsContact O-CG1 3.28Å; I487-I491 WeakPolarHBondContact O-CG1 3.09Å; I487-I491 PolarHBondContact O-N 3.03Å
488	T	73.8	Confident	68.3	Low	71 Å²	71	100.2 Å²	100.2	44%	0.436	54%	0.538	S	S	.	.	H	α-helix	trans	-67.9	-35.4	-179.1	49.1	0	0	0	0	113.1	L484 V485 S492	L484-T488 WeakPolarHBondContact O-CB 3.3Å; L484-T488 VanDerWaalsContact O-CG2 3.3Å; L484-T488 WeakPolarHBondContact O-CG2 3.36Å; L484-T488 PolarHBondContact O-N 3.25Å; L484-T488 PolarHBondContact O-OG1 3.33Å; V485-T488 WeakPolarHBondContact CA-OG1 3.42Å; V485-T488 PolarHBondContact O-OG1 3.24Å; V485-T488 VanDerWaalsContact O-OG1 3.09Å; T488-S492 WeakPolarHBondContact O-CB 3.26Å; T488-S492 PolarHBondContact O-N 3.39Å; T488-S492 PolarHBondContact O-OG 3.15Å
489	T	76.6	Confident	69.8	Low	70 Å²	70	97.2 Å²	97.2	43%	0.429	53%	0.528	S	S	.	.	H	α-helix	trans	-67.9	-43.1	173.5	38.1	0	0	0	0	111.8	V485 V486 I487 I491 S492 I493	V485-T489 PolarHBondContact O-N 2.92Å; V485-T489 VanDerWaalsContact O-N 3.1Å; V485-T489 PolarHBondContact O-OG1 2.93Å; V486-T489 WeakPolarHBondContact CA-OG1 3.42Å; V486-T489 PolarHBondContact O-OG1 3.25Å; I487-T489 PolarHBondContact O-N 3.38Å; T489-I491 PolarHBondContact O-N 3.47Å; T489-S492 PolarHBondContact O-N 3.47Å; T489-I493 WeakPolarHBondContact O-CD1 3.37Å; T489-I493 VanDerWaalsContact O-CG1 3.24Å; T489-I493 WeakPolarHBondContact O-CG1 3.1Å; T489-I493 PolarHBondContact O-N 2.95Å
490	V	80.3	Confident	71.1	Confident	88 Å²	88	97.9 Å²	97.9	53%	0.533	53%	0.526	S	S	.	.	H	α-helix	trans	-62.4	-43.3	176.2	173.1	0	0	0	0	111.6	V486 I487 I493 A494	V486-V490 HydrophobicContact CG1-CG2 4.49Å; V486-V490 VanDerWaalsContact O-CG2 3.23Å; V486-V490 WeakPolarHBondContact O-CG2 3.43Å; V486-V490 PolarHBondContact O-N 3.22Å; I487-V490 PolarHBondContact O-N 3.17Å; V490-I493 PolarHBondContact O-N 2.98Å; V490-A494 WeakPolarHBondContact O-CB 3.34Å; V490-A494 PolarHBondContact O-N 3.48Å
491	I	81.4	Confident	72.3	Confident	99 Å²	99	101.5 Å²	101.5	51%	0.508	54%	0.537	S	S	.	.	H	α-helix	trans	-64	-42.7	176.3	-67.7	168.6	0	0	0	111	I487 T489 I493 A494 L495	I487-I491 HydrophobicContact CG2-CD1 3.69Å; I487-I491 HydrophobicContact CG2-CG1 4.42Å; I487-I491 VanDerWaalsContact O-CG1 3.28Å; I487-I491 WeakPolarHBondContact O-CG1 3.09Å; I487-I491 PolarHBondContact O-N 3.03Å; T489-I491 PolarHBondContact O-N 3.47Å; I491-I493 VanDerWaalsContact C-N 3.35Å; I491-I493 PolarHBondContact O-N 3.4Å; I491-A494 PolarHBondContact O-N 3.25Å; I491-L495 WeakPolarHBondContact O-CB 3.46Å; I491-L495 PolarHBondContact O-N 3.33Å
492	S	79.9	Confident	73.2	Confident	78 Å²	78	103.7 Å²	103.7	55%	0.545	55%	0.548	S	S	.	.	H	α-helix	trans	-64.2	-39.7	179.3	-60.7	0	0	0	0	112.2	T488 T489 L495 F496	T488-S492 WeakPolarHBondContact O-CB 3.26Å; T488-S492 PolarHBondContact O-N 3.39Å; T488-S492 PolarHBondContact O-OG 3.15Å; T489-S492 PolarHBondContact O-N 3.47Å; S492-L495 PolarHBondContact O-N 2.77Å; S492-F496 WeakPolarHBondContact O-CB 3.41Å; S492-F496 PolarHBondContact O-N 2.9Å
493	I	79.6	Confident	73.8	Confident	99 Å²	99	111.2 Å²	111.2	51%	0.508	57%	0.574	S	S	.	*	H	α-helix	trans	-64.7	-46.8	174.9	-67.3	165	0	0	0	110	T489 V490 I491 L495 F496 F497	T489-I493 WeakPolarHBondContact O-CD1 3.37Å; T489-I493 VanDerWaalsContact O-CG1 3.24Å; T489-I493 WeakPolarHBondContact O-CG1 3.1Å; T489-I493 PolarHBondContact O-N 2.95Å; V490-I493 PolarHBondContact O-N 2.98Å; I491-I493 VanDerWaalsContact C-N 3.35Å; I491-I493 PolarHBondContact O-N 3.4Å; I493-L495 VanDerWaalsContact C-N 3.35Å; I493-L495 PolarHBondContact O-N 3.32Å; I493-F496 PolarHBondContact O-N 3.3Å; I493-F497 HydrophobicContact CG2-CD2 3.79Å; I493-F497 HydrophobicContact CG2-CE2 3.67Å; I493-F497 WeakPolarHBondContact O-CD2 2.89Å; I493-F497 PolarHBondContact O-N 2.74Å
494	A	79.8	Confident	74.5	Confident	51 Å²	51	110.4 Å²	110.4	42%	0.421	57%	0.571	S	S	.	*	H	α-helix	trans	-61	-41.9	177.9	0	0	0	0	0	112.3	V490 I491 F497 L498	V490-A494 WeakPolarHBondContact O-CB 3.34Å; V490-A494 PolarHBondContact O-N 3.48Å; I491-A494 PolarHBondContact O-N 3.25Å; A494-F497 PolarHBondContact O-N 3.4Å; A494-L498 PolarHBondContact O-N 3.28Å
495	L	78.3	Confident	74.9	Confident	105 Å²	105	110.3 Å²	110.3	55%	0.55	57%	0.57	S	S	.	*	H	α-helix	trans	-66.5	-39.9	178	-148.8	83.4	0	0	0	111.6	I491 S492 I493 F497 L498 I499	I491-L495 WeakPolarHBondContact O-CB 3.46Å; I491-L495 PolarHBondContact O-N 3.33Å; S492-L495 PolarHBondContact O-N 2.77Å; I493-L495 VanDerWaalsContact C-N 3.35Å; I493-L495 PolarHBondContact O-N 3.32Å; L495-F497 VanDerWaalsContact C-N 3.34Å; L495-F497 PolarHBondContact O-N 3.38Å; L495-L498 PolarHBondContact O-N 2.97Å; L495-I499 HydrophobicContact CD2-CD1 4.32Å; L495-I499 HydrophobicContact CG-CD1 4.33Å; L495-I499 VanDerWaalsContact O-CG1 3.3Å; L495-I499 WeakPolarHBondContact O-CG1 2.82Å; L495-I499 PolarHBondContact O-N 2.93Å
496	F	82.3	Confident	75	Confident	132 Å²	132	111.9 Å²	111.9	58%	0.579	57%	0.574	S	S	*	*	H	α-helix	trans	-60.4	-42.9	174.8	-176.8	-97.7	0	0	0	111.7	S492 I493 K500	S492-F496 WeakPolarHBondContact O-CB 3.41Å; S492-F496 PolarHBondContact O-N 2.9Å; I493-F496 PolarHBondContact O-N 3.3Å; F496-K500 HydrophobicContact CE1-CD 4.4Å; F496-K500 WeakPolarHBondContact O-CB 3.33Å; F496-K500 PolarHBondContact O-N 2.93Å
497	F	73	Confident	75.1	Confident	134 Å²	134	113.3 Å²	113.3	59%	0.588	58%	0.577	S	S	*	*	H	α-helix	trans	-67.3	-36.1	175.1	-81.9	-71	0	0	0	113.1	I493 A494 L495 K501	I493-F497 HydrophobicContact CG2-CD2 3.79Å; I493-F497 HydrophobicContact CG2-CE2 3.67Å; I493-F497 WeakPolarHBondContact O-CD2 2.89Å; I493-F497 PolarHBondContact O-N 2.74Å; A494-F497 PolarHBondContact O-N 3.4Å; L495-F497 VanDerWaalsContact C-N 3.34Å; L495-F497 PolarHBondContact O-N 3.38Å; F497-K501 PolarHBondContact O-N 3.16Å
498	L	70.8	Confident	75	Confident	109 Å²	109	115.1 Å²	115.1	57%	0.571	59%	0.586	S	S	*	*	H	α-helix	trans	-66.8	-44.8	175.4	-113.5	118.6	0	0	0	112.1	A494 L495 K500 K501 L502	A494-L498 PolarHBondContact O-N 3.28Å; L495-L498 PolarHBondContact O-N 2.97Å; L498-K500 VanDerWaalsContact C-N 3.3Å; L498-K500 PolarHBondContact O-N 3.26Å; L498-K501 PolarHBondContact O-N 2.99Å; L498-K501 VanDerWaalsContact O-N 3.12Å; L498-L502 HydrophobicContact CD2-CD1 4.43Å; L498-L502 PolarHBondContact O-N 3.28Å
499	I	74.7	Confident	75.1	Confident	93 Å²	93	118 Å²	118	48%	0.477	60%	0.596	S	S	.	*	H	α-helix	trans	-63.8	-38.4	177.9	-66.7	165.6	0	0	0	110.7	L495 K501 L502 K503	L495-I499 HydrophobicContact CD2-CD1 4.32Å; L495-I499 HydrophobicContact CG-CD1 4.33Å; L495-I499 VanDerWaalsContact O-CG1 3.3Å; L495-I499 WeakPolarHBondContact O-CG1 2.82Å; L495-I499 PolarHBondContact O-N 2.93Å; I499-K501 PolarHBondContact O-N 2.83Å; I499-L502 PolarHBondContact O-N 3.23Å; I499-K503 PolarHBondContact O-N 3.12Å
500	K	72.8	Confident	75	Confident	147 Å²	147	121.4 Å²	121.4	64%	0.639	61%	0.607	S	S	*	*	H	α-helix	trans	-70.4	-14.6	177.4	-150.2	-178.2	-175.5	-174.8	0	113.7	F496 L498	F496-K500 HydrophobicContact CE1-CD 4.4Å; F496-K500 WeakPolarHBondContact O-CB 3.33Å; F496-K500 PolarHBondContact O-N 2.93Å; L498-K500 VanDerWaalsContact C-N 3.3Å; L498-K500 PolarHBondContact O-N 3.26Å
501	K	68.5	Low	74.6	Confident	189 Å²	189	124 Å²	124	82%	0.822	61%	0.613	S	S	*	*	H	α-helix	trans	-97	-14.8	175.8	-147.4	179.9	-175.9	-175.4	0	112.8	F497 L498 I499	F497-K501 PolarHBondContact O-N 3.16Å; L498-K501 PolarHBondContact O-N 2.99Å; L498-K501 VanDerWaalsContact O-N 3.12Å; I499-K501 PolarHBondContact O-N 2.83Å
502	L	67.2	Low	74	Confident	144 Å²	144	126.1 Å²	126.1	75%	0.754	62%	0.622	S	S	*	*	H	α-helix	trans	-97	-17.6	178	-80.5	160.2	0	0	0	113.3	L498 I499	L498-L502 HydrophobicContact CD2-CD1 4.43Å; L498-L502 PolarHBondContact O-N 3.28Å; I499-L502 PolarHBondContact O-N 3.23Å
503	K	61.6	Low	73.5	Confident	232 Å²	232	130.5 Å²	130.5	100%	1.009	63%	0.629	S	S	*	*			trans	-90.3	0	160.8	-78.2	-176.2	174.5	-177.8	0	109.3	I499	I499-K503 PolarHBondContact O-N 3.12Å

Retrieved 503 of 503 residues in 405.1 ms (Link to these results)

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