A0A5K4FA20_SCHMA Loading...

SEA domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4FA20, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 944 aa.

						>A0A5K4FA20_SCHMA|A0A5K4FA20
MEISVINLLSEIVNTSATVPQVNTTTSFDTSQTSSTGQTQIFTTDRTPATFTSTPSTSTSTPTTLTDNQTSLTSTSSSKLTESVRTTSVPTNITTSSTVATNTSATVPQVNTTTSFDTSQTSSTGQTQIFTTDRTPATFTSTPSTSTSTPTTLTDNQTSLTSTSSSKLTESVRTTSVPTNITTSSTVATNTSATVPQVNTTTSFDTSQTSSTGQTQIFTTDRTPATFTSTPSTSTSTPTTLTDNQTSLTSTSSSKLTESVRTTSVPTNITTSSTVATNTSATVPQVNTTTSFDTSQTSSTGQTQIFTTDRTPATFTSTPSTSTSTPTTLTDNQTSLTSTSSSKLTESVRTTSVPTNITTSSTVATNTSATVPQVNTTTSFDTSQTSSTGQTQIFTTDRTPATFTSTPSTSTSTPTTLTDNQTSLTSTSSSKLTESVRTTSVPTNITTSSTVATNTSATVPQVNTTTSFDTSQTSSTGQTQIFTTDRTPATFTSTPSTSTSTPTTLTDNQTSLTSTSSSKLTESVRTTSVPTNITTSSTVATNTSATVPQVNTTTSFDTSQTSSTGQTQIFTTDRTPATFTSTPSTSTSTPTTLTDNQTSLTSTSSSKLTESVRTTSVPTNITTSSTVATNTTRTVAENSTLSTIKASFTTSTSSMELNTSTTISVLTTIVSTDKLTERTPTFSSQSTQSITDLITTASTLTTTETTTTTTIYVGRVSTTFQVKAIIYAFSTGKYVTWSNDYADKTSSAYKTLSTNYCSLLLQSILTENTRITQGATCTLNRFIRSTLNLQSKRQIQNSNNNTTTDAVQGDAQIELQTLAGSQLNQAQFSQLLFNGYQKLNLSSGNYLSGIESTRISPTITCSQTRSLCGEHASCRNTDNGVTCTCDPMWKDLNPSDPGKNCTLHPGTIALIVFAAILLTIAIIALIYFIIRTESIKQLRLKQMT
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	25.3	Very low	29.7	Very low	226 Å²	226	126.5 Å²	126.5	100%	1.113	68%	0.68	S	S	*	*				0	124.2	0	-175.8	-179.5	-73.9	0	0	106.1	I3	M1-I3 PolarHBondContact O-N 3.1Å
2	E	24	Very low	30.1	Very low	197 Å²	197	127.3 Å²	127.3	92%	0.921	68%	0.681	S	S	*	*			trans	-72	114.1	179.3	-69	176.6	112.7	0	0	109.4
3	I	28.4	Very low	30.6	Very low	137 Å²	137	120.9 Å²	120.9	70%	0.703	65%	0.65	S	S	*	*			trans	-96.4	111.5	163	-63.8	-179.7	0	0	0	105.6	M1	M1-I3 PolarHBondContact O-N 3.1Å
4	S	26.1	Very low	30.8	Very low	103 Å²	103	119.9 Å²	119.9	72%	0.72	64%	0.644	S	S	*	*			trans	-73.7	166	-173.1	-162.5	0	0	0	0	112.5	I6	S4-I6 PolarHBondContact O-N 3.17Å
5	V	25.9	Very low	31.2	Very low	122 Å²	122	115.1 Å²	115.1	74%	0.739	62%	0.621	S	S	*	*			trans	-48.1	112.5	-175.3	174.9	0	0	0	0	112.8	N7	V5-N7 HydrophobicContact CG1-CB 3.5Å; V5-N7 VanDerWaalsContact CG1-CB 3.5Å; V5-N7 PolarHBondContact O-N 3.37Å
6	I	31.9	Very low	31.4	Very low	129 Å²	129	112.9 Å²	112.9	66%	0.662	62%	0.617	S	S	*	*			trans	-89.8	85.3	166.9	-55.5	-179.8	0	0	0	108.2	S4	S4-I6 PolarHBondContact O-N 3.17Å
7	N	29.4	Very low	31.7	Very low	104 Å²	104	108 Å²	108	56%	0.556	60%	0.595	S	S	*	*			trans	-115.4	85.8	179	-176.1	22.1	0	0	0	109.7	V5	V5-N7 HydrophobicContact CG1-CB 3.5Å; V5-N7 VanDerWaalsContact CG1-CB 3.5Å; V5-N7 PolarHBondContact O-N 3.37Å
8	L	31.1	Very low	31.9	Very low	160 Å²	160	108 Å²	108	84%	0.838	60%	0.599	S	S	*	*			trans	-165.5	88	179.2	-114.1	160.5	0	0	0	111.8
9	L	37.3	Very low	32.1	Very low	81 Å²	81	104.2 Å²	104.2	42%	0.424	58%	0.579	S	S	.	*			trans	-175.7	71	151.6	-103.9	168.3	0	0	0	109.2	T36	L9-T36 HydrophobicContact CB-CG2 4.3Å; L9-T36 HydrophobicContact CD2-CG2 4.3Å; L9-T36 WeakPolarHBondContact O-CG2 3.42Å
10	S	31.9	Very low	32.4	Very low	79 Å²	79	104.2 Å²	104.2	55%	0.552	58%	0.583	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-106.3	109.6	172.4	-60.3	0	0	0	0	108.6	T98	S10-T98 WeakPolarHBondContact CA-O 3.01Å
11	E	35.9	Very low	32.7	Very low	53 Å²	53	104.8 Å²	104.8	25%	0.248	58%	0.581	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-97.3	113.2	178.6	-149.1	-163.8	135.5	0	0	109.1	V13 S34 S35 T36 T98 V99 A100	E11-V13 HydrophobicContact CG-CG2 3.93Å; E11-V13 VanDerWaalsContact OE1-CG2 3.3Å; E11-V13 WeakPolarHBondContact OE1-CG2 3.49Å; E11-S34 WeakPolarHBondContact OE1-CA 3.43Å; E11-S34 WeakPolarHBondContact OE1-CB 3.23Å; E11-S34 PolarHBondContact OE1-OG 3.07Å; E11-S35 PolarHBondContact OE2-N 3.35Å; E11-T36 HydrophobicContact CB-CG2 4.31Å; E11-T98 PolarHBondContact N-O 2.95Å; E11-V99 HydrophobicContact CB-CG2 4.46Å; E11-A100 PolarHBondContact O-N 3.47Å
12	I	34.4	Very low	33.4	Very low	136 Å²	136	95.6 Å²	95.6	70%	0.697	54%	0.538	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.1	107.4	175.5	-52.3	-176.9	0	0	0	107.9	A100	I12-A100 WeakPolarHBondContact CA-O 3.48Å; I12-A100 HydrophobicContact CG1-CB 4.33Å
13	V	35.9	Very low	34.2	Very low	45 Å²	45	91.2 Å²	91.2	27%	0.273	52%	0.521	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	114.1	-175.7	-174.1	0	0	0	0	110	E11 Q32 S34 A100 T101 N102	E11-V13 HydrophobicContact CG-CG2 3.93Å; E11-V13 VanDerWaalsContact OE1-CG2 3.3Å; E11-V13 WeakPolarHBondContact OE1-CG2 3.49Å; V13-Q32 VanDerWaalsContact CG1-NE2 3.32Å; V13-Q32 PolarHBondContact O-NE2 2.92Å; V13-S34 WeakPolarHBondContact CG2-OG 3.49Å; V13-A100 PolarHBondContact N-O 3.05Å; V13-T101 WeakPolarHBondContact O-CA 3.44Å; V13-N102 PolarHBondContact O-N 3.32Å; V13-N102 VanDerWaalsContact O-N 3.16Å
14	N	34.3	Very low	34.7	Very low	106 Å²	106	88.9 Å²	88.9	57%	0.567	51%	0.513	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.4	111.5	-177.4	-174.7	42	0	0	0	109.2	N102	N14-N102 CarbonylContact C-O 3.56Å; N14-N102 WeakPolarHBondContact CA-O 3.36Å; N14-N102 WeakPolarHBondContact OD1-CB 3.49Å; N14-N102 PolarHBondContact OD1-ND2 3.09Å; N14-N102 PolarHBondContact OD1-O 3.09Å
15	T	36.4	Very low	35.4	Very low	49 Å²	49	89.5 Å²	89.5	30%	0.301	51%	0.513	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	120.8	-178	-49.9	0	0	0	0	109.5	Q32 N102 T103 S104	T15-Q32 VanDerWaalsContact OG1-CD 3.29Å; T15-Q32 PolarHBondContact OG1-OE1 3.04Å; T15-N102 PolarHBondContact N-O 3.42Å; T15-T103 WeakPolarHBondContact O-CA 3.39Å; T15-S104 PolarHBondContact O-N 3.45Å; T15-S104 PolarHBondContact O-OG 3.22Å
16	S	34.9	Very low	36	Very low	80 Å²	80	85.5 Å²	85.5	56%	0.559	49%	0.489	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-124.8	121	177.6	58	0	0	0	0	110.8	S104	S16-S104 WeakPolarHBondContact CA-O 3.44Å; S16-S104 WeakPolarHBondContact CB-OG 3.45Å
17	A	35.7	Very low	36.2	Very low	29 Å²	29	83.9 Å²	83.9	24%	0.24	49%	0.489	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	121.9	176.5	0	0	0	0	0	110.5	S104 T106	A17-S104 PolarHBondContact N-O 3.42Å; A17-T106 PolarHBondContact O-N 3.41Å
18	T	35.6	Very low	36.7	Very low	108 Å²	108	81.6 Å²	81.6	66%	0.663	47%	0.474	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-128.1	117.3	178.3	-53.3	0	0	0	0	109.4	T106	T18-T106 WeakPolarHBondContact CA-O 3.47Å
19	V	36.4	Very low	36.8	Very low	36 Å²	36	78.9 Å²	78.9	22%	0.218	46%	0.46	C	S	.	.			trans	-112.1	131.2	-174.9	-168.6	0	0	0	0	109.8	V22 F28 V107 P108	V19-V22 HydrophobicContact CG1-CG2 4.04Å; V19-F28 HydrophobicContact CG1-CE1 4.13Å; V19-F28 HydrophobicContact CG1-CZ 4.16Å; V19-F28 HydrophobicContact CG2-CE1 4.35Å; V19-V107 HydrophobicContact CB-CG2 4.49Å; V19-P108 WeakPolarHBondContact O-CD 3.41Å
20	P	37.8	Very low	36.8	Very low	103 Å²	103	76.4 Å²	76.4	67%	0.669	45%	0.449	S	S	*	.			trans	-67.1	167.5	171.6	30.2	-35.5	0	0	0	111.4	V22	P20-V22 WeakPolarHBondContact O-CG2 3.28Å; P20-V22 PolarHBondContact O-N 3.02Å
21	Q	38	Very low	37	Very low	117 Å²	117	76.4 Å²	76.4	55%	0.547	45%	0.448	S	S	.	.			trans	-52.4	135.4	-174.9	-79.3	-173.1	-27.7	0	0	113.9
22	V	40.5	Very low	37	Very low	34 Å²	34	74.3 Å²	74.3	21%	0.206	44%	0.439	C	S	.	.	B	Isolated β-bridge	trans	-124.2	130.2	179.6	-176.1	0	0	0	0	109.8	V19 P20 T26 F28	V19-V22 HydrophobicContact CG1-CG2 4.04Å; P20-V22 WeakPolarHBondContact O-CG2 3.28Å; P20-V22 PolarHBondContact O-N 3.02Å; V22-T26 HydrophobicContact CG1-CG2 3.87Å; V22-F28 HydrophobicContact CG2-CZ 4.2Å
23	N	40.3	Very low	37.1	Very low	104 Å²	104	73 Å²	73	56%	0.556	44%	0.437	S	S	*	.			trans	-118.1	31.1	-177.1	-75.3	-35.2	0	0	0	112.4	N111	N23-N111 PolarHBondContact OD1-ND2 2.97Å; N23-N111 VanDerWaalsContact OD1-ND2 3.09Å
24	T	40	Very low	37.1	Very low	89 Å²	89	70.9 Å²	70.9	55%	0.546	43%	0.425	S	S	.	.	S	Bend	trans	-143.3	151.8	-179.2	48.3	0	0	0	0	110.1	T26 T112	T24-T26 PolarHBondContact O-N 3.24Å; T24-T26 PolarHBondContact O-OG1 3.01Å; T24-T112 VanDerWaalsContact C-OG1 3.26Å; T24-T112 PolarHBondContact N-OG1 2.89Å; T24-T112 PolarHBondContact O-OG1 3.47Å
25	T	39.7	Very low	37.3	Very low	115 Å²	115	69.2 Å²	69.2	71%	0.706	42%	0.421	S	S	*	.			trans	-51.6	121.1	172.3	-49.4	0	0	0	0	110.8
26	T	39.7	Very low	37.3	Very low	38 Å²	38	67.3 Å²	67.3	23%	0.233	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	148.3	-177.4	36.4	0	0	0	0	111.1	V22 T24 F28 T114 S115	V22-T26 HydrophobicContact CG1-CG2 3.87Å; T24-T26 PolarHBondContact O-N 3.24Å; T24-T26 PolarHBondContact O-OG1 3.01Å; T26-F28 HydrophobicContact CG2-CE2 4.4Å; T26-F28 HydrophobicContact CG2-CZ 4.18Å; T26-F28 VanDerWaalsContact OG1-CE2 3.25Å; T26-F28 WeakPolarHBondContact OG1-CE2 3.35Å; T26-T114 WeakPolarHBondContact O-CA 3.48Å; T26-T114 WeakPolarHBondContact O-CG2 3.02Å; T26-S115 PolarHBondContact O-N 3.33Å
27	S	35.8	Very low	37	Very low	95 Å²	95	65.3 Å²	65.3	66%	0.664	40%	0.402	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.6	127.1	171.6	53.8	0	0	0	0	108.6
28	F	39.6	Very low	36.8	Very low	56 Å²	56	69.9 Å²	69.9	25%	0.246	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	121.5	176.8	-63.9	-79.2	0	0	0	109.8	V19 V22 T26 T114 S115 F116 D117	V19-F28 HydrophobicContact CG1-CE1 4.13Å; V19-F28 HydrophobicContact CG1-CZ 4.16Å; V19-F28 HydrophobicContact CG2-CE1 4.35Å; V22-F28 HydrophobicContact CG2-CZ 4.2Å; T26-F28 HydrophobicContact CG2-CE2 4.4Å; T26-F28 HydrophobicContact CG2-CZ 4.18Å; T26-F28 VanDerWaalsContact OG1-CE2 3.25Å; T26-F28 WeakPolarHBondContact OG1-CE2 3.35Å; F28-T114 HydrophobicContact CD2-CG2 4.18Å; F28-T114 HydrophobicContact CE2-CG2 4.3Å; F28-S115 PolarHBondContact N-O 2.92Å; F28-F116 HydrophobicContact CB-CD1 3.86Å; F28-F116 HydrophobicContact CB-CE1 4.12Å; F28-F116 HydrophobicContact CD2-CD1 4Å; F28-F116 AromaticContact CD2-CE1 3.44Å; F28-F116 HydrophobicContact CD2-CE1 3.44Å; F28-F116 VanDerWaalsContact CD2-CE1 3.44Å; F28-F116 HydrophobicContact CD2-CZ 4.16Å; F28-F116 HydrophobicContact CE2-CE1 4.21Å; F28-F116 HydrophobicContact CG-CD1 4.32Å; F28-F116 HydrophobicContact CG-CE1 4.07Å; F28-D117 PolarHBondContact O-N 2.71Å
29	D	32.6	Very low	36.8	Very low	104 Å²	104	67 Å²	67	56%	0.556	40%	0.4	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.2	132.9	172	172.2	-14.1	0	0	0	107.3	S31	D29-S31 PolarHBondContact OD1-N 3.19Å; D29-S31 PolarHBondContact OD1-OG 3.42Å
30	T	37.9	Very low	36.5	Very low	29 Å²	29	70.2 Å²	70.2	18%	0.178	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	92.4	169	-63.7	0	0	0	0	109.3	T103 D117 T118 S119	T30-T103 HydrophobicContact CG2-CG2 4.23Å; T30-D117 PolarHBondContact N-O 3.41Å; T30-T118 WeakPolarHBondContact O-CA 3.45Å; T30-S119 PolarHBondContact O-N 2.95Å; T30-S119 VanDerWaalsContact O-N 3.11Å
31	S	35.8	Very low	36.3	Very low	78 Å²	78	67.1 Å²	67.1	55%	0.545	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	131.4	177.4	36.5	0	0	0	0	112.1	D29 S119	D29-S31 PolarHBondContact OD1-N 3.19Å; D29-S31 PolarHBondContact OD1-OG 3.42Å; S31-S119 CarbonylContact C-O 3.53Å; S31-S119 WeakPolarHBondContact CA-O 3.36Å; S31-S119 WeakPolarHBondContact CB-OG 3.49Å
32	Q	36.2	Very low	35.9	Very low	10 Å²	10	67.8 Å²	67.8	5%	0.047	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	129.2	172.9	178.7	174.8	-19.4	0	0	111	V13 T15 T103 S119 Q120 T121	V13-Q32 VanDerWaalsContact CG1-NE2 3.32Å; V13-Q32 PolarHBondContact O-NE2 2.92Å; T15-Q32 VanDerWaalsContact OG1-CD 3.29Å; T15-Q32 PolarHBondContact OG1-OE1 3.04Å; Q32-T103 PolarHBondContact OE1-OG1 2.92Å; Q32-S119 PolarHBondContact N-O 2.69Å; Q32-Q120 WeakPolarHBondContact O-CA 3.35Å; Q32-T121 PolarHBondContact O-N 2.65Å
33	T	36.1	Very low	35.5	Very low	107 Å²	107	67.9 Å²	67.9	66%	0.656	39%	0.393	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123.5	128.1	172.3	-53.8	0	0	0	0	110.4	T121	T33-T121 WeakPolarHBondContact CA-O 3.45Å
34	S	36.9	Very low	35.1	Very low	2 Å²	2	67 Å²	67	1%	0.014	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	139.7	174.1	-80	0	0	0	0	110.9	E11 V13 T121 S122 S123	E11-S34 WeakPolarHBondContact OE1-CA 3.43Å; E11-S34 WeakPolarHBondContact OE1-CB 3.23Å; E11-S34 PolarHBondContact OE1-OG 3.07Å; V13-S34 WeakPolarHBondContact CG2-OG 3.49Å; S34-T121 PolarHBondContact N-O 3.44Å; S34-S122 WeakPolarHBondContact O-CA 3.35Å; S34-S123 PolarHBondContact O-N 2.89Å; S34-S123 VanDerWaalsContact O-N 3.12Å
35	S	36.6	Very low	34.7	Very low	71 Å²	71	65 Å²	65	50%	0.497	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.5	119.7	-172.9	64.1	0	0	0	0	113.2	E11 S123	E11-S35 PolarHBondContact OE2-N 3.35Å; S35-S123 WeakPolarHBondContact CA-O 3.33Å
36	T	37	Very low	34.3	Very low	8 Å²	8	68.2 Å²	68.2	5%	0.049	38%	0.376	C	S	.	.	P	Polyproline II helix	trans	-78.6	145.4	173.1	46.3	0	0	0	0	112.1	L9 E11 V99 S123 T124 G125	L9-T36 HydrophobicContact CB-CG2 4.3Å; L9-T36 HydrophobicContact CD2-CG2 4.3Å; L9-T36 WeakPolarHBondContact O-CG2 3.42Å; E11-T36 HydrophobicContact CB-CG2 4.31Å; T36-V99 HydrophobicContact CG2-CG2 3.77Å; T36-S123 PolarHBondContact N-O 2.94Å; T36-T124 WeakPolarHBondContact OG1-CA 3.42Å; T36-G125 VanDerWaalsContact O-CA 3.23Å; T36-G125 WeakPolarHBondContact O-CA 3.37Å; T36-G125 PolarHBondContact O-N 3.42Å; T36-G125 VanDerWaalsContact O-N 3.14Å; T36-G125 PolarHBondContact OG1-N 3.49Å
37	G	28.4	Very low	33.9	Very low	39 Å²	39	69.1 Å²	69.1	40%	0.402	38%	0.382	S	S	.	.	P	Polyproline II helix	trans	-65.9	155.5	-178.3	0	0	0	0	0	114.3
38	Q	32.8	Very low	33.4	Very low	124 Å²	124	69.1 Å²	69.1	58%	0.579	38%	0.379	S	S	*	.	P	Polyproline II helix	trans	-67.6	131.1	175.8	-65.3	-177.1	66.3	0	0	111.2	Q126	Q38-Q126 WeakPolarHBondContact CA-O 3.08Å; Q38-Q126 HydrophobicContact CG-CB 4.44Å
39	T	34.2	Very low	32.9	Very low	47 Å²	47	67.4 Å²	67.4	29%	0.288	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	121.2	178.9	-64.7	0	0	0	0	110	I41 T95 Q126 T127 Q128	T39-I41 HydrophobicContact CG2-CD1 4.47Å; T39-I41 HydrophobicContact CG2-CG1 4.2Å; T39-T95 HydrophobicContact CG2-CG2 4.31Å; T39-Q126 PolarHBondContact N-O 3.17Å; T39-T127 WeakPolarHBondContact O-CA 3.33Å; T39-Q128 PolarHBondContact O-N 3.49Å
40	Q	31.4	Very low	32.6	Very low	105 Å²	105	66.9 Å²	66.9	49%	0.491	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	117.5	175.3	-64.3	-172.9	81.8	0	0	110	F42 Q128	Q40-F42 HydrophobicContact CB-CD2 4.47Å; Q40-F42 HydrophobicContact CB-CE2 3.77Å; Q40-F42 HydrophobicContact CB-CZ 4.36Å; Q40-Q128 WeakPolarHBondContact CA-O 3.34Å; Q40-Q128 HydrophobicContact CG-CB 4.38Å
41	I	33.6	Very low	32	Very low	37 Å²	37	72.3 Å²	72.3	19%	0.19	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	117.8	177.6	-62.2	179.9	0	0	0	108.6	T39 T43 I93 T95 Q128 I129 F130	T39-I41 HydrophobicContact CG2-CD1 4.47Å; T39-I41 HydrophobicContact CG2-CG1 4.2Å; I41-T43 HydrophobicContact CG2-CG2 4.35Å; I41-I93 HydrophobicContact CD1-CG2 3.88Å; I41-T95 HydrophobicContact CD1-CG2 3.45Å; I41-T95 VanDerWaalsContact CD1-CG2 3.45Å; I41-Q128 PolarHBondContact N-O 3.47Å; I41-I129 HydrophobicContact CB-CG1 4.44Å; I41-F130 PolarHBondContact O-N 3.34Å
42	F	29	Very low	31.5	Very low	131 Å²	131	74.1 Å²	74.1	58%	0.575	41%	0.406	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.1	113.8	173.6	-62.7	-84.8	0	0	0	109.3	Q40 F130	Q40-F42 HydrophobicContact CB-CD2 4.47Å; Q40-F42 HydrophobicContact CB-CE2 3.77Å; Q40-F42 HydrophobicContact CB-CZ 4.36Å; F42-F130 HydrophobicContact CD1-CB 3.79Å; F42-F130 AromaticContact CD1-CD2 3.74Å; F42-F130 HydrophobicContact CD1-CD2 3.74Å; F42-F130 AromaticContact CD1-CG 4Å; F42-F130 HydrophobicContact CD1-CG 4Å; F42-F130 HydrophobicContact CE1-CB 4.15Å; F42-F130 AromaticContact CE1-CD2 3.29Å; F42-F130 HydrophobicContact CE1-CD2 3.29Å; F42-F130 AromaticContact CE1-CE2 3.79Å; F42-F130 HydrophobicContact CE1-CE2 3.79Å; F42-F130 AromaticContact CE1-CG 3.82Å; F42-F130 HydrophobicContact CE1-CG 3.82Å; F42-F130 AromaticContact CZ-CD2 3.86Å; F42-F130 HydrophobicContact CZ-CD2 3.86Å; F42-F130 HydrophobicContact CZ-CE2 4.03Å
43	T	32.9	Very low	30.8	Very low	37 Å²	37	79.2 Å²	79.2	23%	0.227	44%	0.443	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	125.2	164.8	56.7	0	0	0	0	108.8	I41 F130 T131 T132	I41-T43 HydrophobicContact CG2-CG2 4.35Å; T43-F130 PolarHBondContact N-O 2.99Å; T43-T131 WeakPolarHBondContact OG1-CG2 3.41Å; T43-T132 PolarHBondContact O-N 3.11Å
44	T	30.2	Very low	30	Very low	86 Å²	86	80.6 Å²	80.6	53%	0.528	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	113.2	-177.3	-65.5	0	0	0	0	108.6	R46 T132	T44-R46 HydrophobicContact CG2-CG 3.93Å; T44-T132 WeakPolarHBondContact CA-O 3.35Å
45	D	33.1	Very low	29.2	Very low	47 Å²	47	85.8 Å²	85.8	25%	0.251	49%	0.485	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	133.4	162.6	-162.9	-33.4	0	0	0	107.9	T47 T132	D45-T47 PolarHBondContact OD1-OG1 3.49Å; D45-T132 PolarHBondContact N-O 3.06Å
46	R	30.9	Very low	28.4	Very low	182 Å²	182	87.5 Å²	87.5	69%	0.687	50%	0.496	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-139.9	104.8	173.9	-89.9	-171.1	-173.6	-171	7	108.4	T44 P48	T44-R46 HydrophobicContact CG2-CG 3.93Å; R46-P48 WeakPolarHBondContact O-CD 3.49Å
47	T	30.3	Very low	27.6	Very low	57 Å²	57	93.1 Å²	93.1	35%	0.35	53%	0.531	S	S	.	.			trans	-124.8	84.4	-180	16.1	0	0	0	0	107.5	D45 A49 T86	D45-T47 PolarHBondContact OD1-OG1 3.49Å; T47-A49 PolarHBondContact O-N 3.07Å; T47-T86 HydrophobicContact CG2-CG2 4.33Å; T47-T86 VanDerWaalsContact OG1-CG2 3.3Å; T47-T86 WeakPolarHBondContact OG1-CG2 3.33Å
48	P	26.6	Very low	27.2	Very low	94 Å²	94	96 Å²	96	61%	0.61	55%	0.545	S	S	*	.			trans	-74.6	110.2	178.1	-5.3	22.9	0	0	0	109.2	R46	R46-P48 WeakPolarHBondContact O-CD 3.49Å
49	A	27.7	Very low	26.6	Very low	21 Å²	21	96.7 Å²	96.7	17%	0.174	56%	0.558	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-88.5	109.6	168.9	0	0	0	0	0	108.4	T47 V84	T47-A49 PolarHBondContact O-N 3.07Å; A49-V84 HydrophobicContact CB-CG1 4.23Å; A49-V84 HydrophobicContact CB-CG2 3.96Å
50	T	27.2	Very low	25.9	Very low	93 Å²	93	100.3 Å²	100.3	57%	0.571	59%	0.585	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-136.4	101.1	178.8	-48.5	0	0	0	0	109.5	T52	T50-T52 PolarHBondContact O-N 3.12Å
51	F	25.7	Very low	25.4	Very low	143 Å²	143	101.7 Å²	101.7	63%	0.627	60%	0.601	S	S	*	*			trans	-85.6	86.9	179.3	-67.9	-80.3	0	0	0	110.2	F139	F51-F139 HydrophobicContact CE2-CE1 4.47Å
52	T	25.7	Very low	24.7	Very low	115 Å²	115	105.5 Å²	105.5	71%	0.706	63%	0.628	S	S	*	*			trans	-141.2	126.2	175.2	39.1	0	0	0	0	110.4	T50	T50-T52 PolarHBondContact O-N 3.12Å
53	S	19.8	Very low	24.3	Very low	118 Å²	118	105.9 Å²	105.9	83%	0.825	64%	0.641	S	S	*	*			trans	-108.8	111	-178.1	43.9	0	0	0	0	112.4
54	T	20.6	Very low	23.8	Very low	136 Å²	136	110.3 Å²	110.3	83%	0.834	67%	0.668	S	S	*	*			trans	-159.3	141.6	164.8	8.7	0	0	0	0	109.6
55	P	20.4	Very low	23.3	Very low	111 Å²	111	114.4 Å²	114.4	72%	0.721	69%	0.686	S	S	*	*			trans	-98.8	149.8	-166.9	36.2	-35	0	0	0	115.8
56	S	19.9	Very low	22.7	Very low	106 Å²	106	117.7 Å²	117.7	74%	0.741	71%	0.708	S	S	*	*			trans	64.7	143.7	157.1	42	0	0	0	0	118.8
57	T	19.6	Very low	22.3	Very low	126 Å²	126	115.4 Å²	115.4	77%	0.773	71%	0.709	S	S	*	*			cis	-163.7	142.4	-3.3	12.3	0	0	0	0	111.4
58	S	20.1	Very low	21.9	Very low	100 Å²	100	119.5 Å²	119.5	70%	0.699	73%	0.729	S	S	*	*			trans	41.9	145.5	146.6	62	0	0	0	0	123.2
59	T	19.8	Very low	21.7	Very low	138 Å²	138	123.5 Å²	123.5	85%	0.847	74%	0.74	S	S	*	*			cis	-176.2	146.6	-8.6	26.5	0	0	0	0	109.7
60	S	19.5	Very low	21.4	Very low	123 Å²	123	128.1 Å²	128.1	86%	0.86	77%	0.766	S	S	*	*			trans	-169.9	155.1	132.9	59.3	0	0	0	0	113.2
61	T	20.3	Very low	21	Very low	134 Å²	134	128.8 Å²	128.8	82%	0.822	77%	0.774	S	S	*	*			trans	-74.9	161.9	-170.8	11.6	0	0	0	0	115
62	P	19.9	Very low	20.7	Very low	117 Å²	117	129 Å²	129	76%	0.76	78%	0.782	S	S	*	*				-138.1	167.8	54.1	40.3	-22.1	0	0	0	119.2
63	T	20.9	Very low	20.4	Very low	139 Å²	139	130.2 Å²	130.2	85%	0.853	79%	0.789	S	S	*	*			trans	-18.7	113.6	178	-39.9	0	0	0	0	119.5
64	T	21.6	Very low	20.4	Very low	130 Å²	130	129.1 Å²	129.1	80%	0.798	78%	0.781	S	S	*	*			trans	-142.4	158.4	159.1	50.4	0	0	0	0	110.3
65	L	20.2	Very low	20.3	Very low	173 Å²	173	129.5 Å²	129.5	91%	0.906	78%	0.783	S	S	*	*			trans	-62.6	135.3	-178.3	-86.9	72.8	0	0	0	113.7
66	T	20.5	Very low	20.2	Very low	116 Å²	116	129.7 Å²	129.7	71%	0.712	79%	0.787	S	S	*	*			trans	-74.1	163.5	149.4	27.3	0	0	0	0	110.5
67	D	22.1	Very low	20.2	Very low	133 Å²	133	129.8 Å²	129.8	71%	0.711	79%	0.788	S	S	*	*			cis	-135.9	169.3	6.5	-103.2	-49.5	0	0	0	108.3
68	N	22.7	Very low	20.3	Very low	144 Å²	144	129.4 Å²	129.4	77%	0.77	79%	0.791	S	S	*	*			cis	-161.5	140	43.7	-138.4	-18.7	0	0	0	110.2
69	Q	21.1	Very low	20.4	Very low	178 Å²	178	133.2 Å²	133.2	83%	0.832	80%	0.795	S	S	*	*			trans	-96.2	118.4	171.7	-78.7	-169.8	-3.4	0	0	111.8
70	T	21.1	Very low	20.6	Very low	118 Å²	118	132 Å²	132	72%	0.724	78%	0.783	S	S	*	*			trans	-100.7	90.3	172.2	-48.3	0	0	0	0	110.7	L72	T70-L72 HydrophobicContact CG2-CD1 3.99Å; T70-L72 HydrophobicContact CG2-CG 4.28Å
71	S	20	Very low	21	Very low	106 Å²	106	130.1 Å²	130.1	74%	0.741	77%	0.766	S	S	*	*			trans	-81.1	124.3	167.5	-69.2	0	0	0	0	110.1
72	L	19.9	Very low	21.4	Very low	149 Å²	149	127.2 Å²	127.2	78%	0.78	74%	0.743	S	S	*	*			trans	-127.1	99	179.9	-97.1	163.8	0	0	0	110.8	T70	T70-L72 HydrophobicContact CG2-CD1 3.99Å; T70-L72 HydrophobicContact CG2-CG 4.28Å
73	T	19.4	Very low	21.7	Very low	140 Å²	140	125.4 Å²	125.4	86%	0.859	73%	0.733	S	S	*	*			trans	-86.4	116.2	171.7	-19.8	0	0	0	0	109.3
74	S	19.8	Very low	22.1	Very low	94 Å²	94	120 Å²	120	66%	0.657	70%	0.7	S	S	*	*			trans	-130.7	98.2	-178.5	50	0	0	0	0	112.9
75	T	18.4	Very low	22.5	Very low	144 Å²	144	121.9 Å²	121.9	88%	0.883	69%	0.692	S	S	*	*			trans	-94.3	88	169.9	49.9	0	0	0	0	110.9
76	S	17.6	Very low	23	Very low	115 Å²	115	114.3 Å²	114.3	80%	0.804	65%	0.654	S	S	*	*			trans	-157.7	153.9	168.1	52.8	0	0	0	0	112.5
77	S	20.3	Very low	23.6	Very low	109 Å²	109	111.7 Å²	111.7	76%	0.762	64%	0.637	S	S	*	*			trans	-87.8	151.7	-164	53	0	0	0	0	116
78	S	21.2	Very low	24.3	Very low	118 Å²	118	106.2 Å²	106.2	83%	0.825	61%	0.609	S	S	*	*	S	Bend	trans	75.3	129.8	168.5	79.8	0	0	0	0	117.2
79	K	22.7	Very low	24.8	Very low	180 Å²	180	102.8 Å²	102.8	78%	0.783	59%	0.594	S	S	*	*			trans	58.6	71.9	174.5	-164.8	-163.7	170.7	-166.7	0	115.4
80	L	24	Very low	25.6	Very low	113 Å²	113	95.4 Å²	95.4	59%	0.592	56%	0.561	S	S	*	*			trans	-59	144.4	158.3	-80.3	160.6	0	0	0	110.9
81	T	27.4	Very low	26.4	Very low	83 Å²	83	93.4 Å²	93.4	51%	0.509	55%	0.549	S	S	.	.			trans	-153.6	101.4	171.7	-64.1	0	0	0	0	106.2
82	E	27.6	Very low	27.3	Very low	72 Å²	72	93.3 Å²	93.3	34%	0.336	54%	0.54	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	126.4	-177.7	-67.7	-170.8	-171.4	0	0	110.1	S171	E82-S171 PolarHBondContact O-N 2.83Å; E82-S171 VanDerWaalsContact O-N 3.11Å; E82-S171 PolarHBondContact O-OG 2.97Å
83	S	27.7	Very low	28.1	Very low	80 Å²	80	87.3 Å²	87.3	56%	0.559	51%	0.508	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-136.8	103.9	-178.3	64.7	0	0	0	0	110.2	R85 S171	S83-R85 PolarHBondContact O-N 3.28Å; S83-S171 WeakPolarHBondContact CA-O 3.4Å; S83-S171 WeakPolarHBondContact CB-OG 3.02Å
84	V	28.8	Very low	28.9	Very low	26 Å²	26	84.5 Å²	84.5	16%	0.158	49%	0.491	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	108.3	168	178.9	0	0	0	0	107.1	A49 F139 S171 R173	A49-V84 HydrophobicContact CB-CG1 4.23Å; A49-V84 HydrophobicContact CB-CG2 3.96Å; V84-F139 HydrophobicContact CG2-CZ 4.16Å; V84-S171 PolarHBondContact N-O 3.45Å; V84-S171 VanDerWaalsContact N-O 3.12Å; V84-R173 PolarHBondContact O-N 2.97Å
85	R	30.5	Very low	29.9	Very low	168 Å²	168	80.7 Å²	80.7	63%	0.634	46%	0.464	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.2	121.5	175.2	-179.9	-178.2	173.8	174.5	-1.7	110.2	S83 T87 R173	S83-R85 PolarHBondContact O-N 3.28Å; R85-T87 PolarHBondContact NE-OG1 3.39Å; R85-R173 WeakPolarHBondContact CA-O 3.32Å
86	T	30.5	Very low	30.9	Very low	15 Å²	15	75.9 Å²	75.9	9%	0.092	44%	0.436	C	S	.	.			trans	-122.5	156.8	170.6	61.6	0	0	0	0	109.1	T47 T135 R173 T175	T47-T86 HydrophobicContact CG2-CG2 4.33Å; T47-T86 VanDerWaalsContact OG1-CG2 3.3Å; T47-T86 WeakPolarHBondContact OG1-CG2 3.33Å; T86-T135 HydrophobicContact CG2-CG2 3.43Å; T86-T135 VanDerWaalsContact CG2-CG2 3.43Å; T86-T135 VanDerWaalsContact OG1-CG2 3.25Å; T86-T135 WeakPolarHBondContact OG1-CG2 3.48Å; T86-R173 PolarHBondContact N-O 3.04Å; T86-T175 PolarHBondContact O-N 3.32Å
87	T	33.1	Very low	32.1	Very low	61 Å²	61	70.9 Å²	70.9	37%	0.374	40%	0.401	S	S	.	.			trans	-156.1	75.7	-169	-60.2	0	0	0	0	108.2	R85 V89	R85-T87 PolarHBondContact NE-OG1 3.39Å; T87-V89 HydrophobicContact CG2-CG2 3.62Å; T87-V89 PolarHBondContact O-N 3.49Å
88	S	37.1	Very low	32.9	Very low	17 Å²	17	67.8 Å²	67.8	12%	0.119	38%	0.378	C	S	.	.			trans	-70.1	112.1	176	74.5	0	0	0	0	109.4	P90 D133 S176 V177	S88-P90 WeakPolarHBondContact O-CD 3.28Å; S88-D133 PolarHBondContact OG-OD2 3.4Å; S88-S176 PolarHBondContact OG-OG 3.44Å; S88-V177 PolarHBondContact O-N 3Å
89	V	32.9	Very low	33.6	Very low	73 Å²	73	62.2 Å²	62.2	44%	0.442	34%	0.339	S	S	.	.			trans	-125.8	85.6	-176.3	179.2	0	0	0	0	110.4	T87 T91	T87-V89 HydrophobicContact CG2-CG2 3.62Å; T87-V89 PolarHBondContact O-N 3.49Å; V89-T91 HydrophobicContact CG1-CG2 3.63Å; V89-T91 PolarHBondContact O-N 2.89Å
90	P	37.5	Very low	34.2	Very low	22 Å²	22	55 Å²	55	14%	0.143	31%	0.313	C	S	.	.			trans	-76.5	98.8	160.8	28.2	-25.5	0	0	0	109.3	S88 I93 T131 P178 T179	S88-P90 WeakPolarHBondContact O-CD 3.28Å; P90-I93 HydrophobicContact CB-CD1 3.89Å; P90-I93 HydrophobicContact CB-CG1 4.46Å; P90-T131 HydrophobicContact CG-CG2 4.29Å; P90-P178 HydrophobicContact CG-CB 4.17Å; P90-P178 HydrophobicContact CG-CG 4.46Å; P90-T179 PolarHBondContact O-N 2.95Å; P90-T179 VanDerWaalsContact O-N 3.16Å
91	T	37	Very low	35	Very low	76 Å²	76	49.9 Å²	49.9	47%	0.466	29%	0.286	S	S	.	.	B	Isolated β-bridge	trans	-92.4	142.2	170	40.6	0	0	0	0	111.3	V89 T179	V89-T91 HydrophobicContact CG1-CG2 3.63Å; V89-T91 PolarHBondContact O-N 2.89Å; T91-T179 WeakPolarHBondContact CA-O 3.14Å; T91-T179 WeakPolarHBondContact CG2-OG1 3.43Å
92	N	39.9	Very low	35.6	Very low	104 Å²	104	48.4 Å²	48.4	56%	0.556	28%	0.275	S	S	*	.			trans	62.9	43.9	166.2	-52.2	-22.7	0	0	0	114.5	T94 T179 N180	N92-T94 PolarHBondContact O-N 2.97Å; N92-T94 VanDerWaalsContact O-N 3.14Å; N92-T179 PolarHBondContact N-O 3Å; N92-N180 WeakPolarHBondContact CA-O 3.3Å; N92-N180 WeakPolarHBondContact OD1-CB 3.44Å; N92-N180 PolarHBondContact OD1-ND2 3.35Å
93	I	37.4	Very low	36.4	Very low	24 Å²	24	45 Å²	45	12%	0.123	26%	0.259	C	S	.	.			trans	-75	102.3	169.5	-61.8	178.8	0	0	0	108.5	I41 P90 T95 I129 N180 I181 T182	I41-I93 HydrophobicContact CD1-CG2 3.88Å; P90-I93 HydrophobicContact CB-CD1 3.89Å; P90-I93 HydrophobicContact CB-CG1 4.46Å; I93-T95 HydrophobicContact CG2-CG2 4.34Å; I93-I129 HydrophobicContact CD1-CG2 4.49Å; I93-I129 HydrophobicContact CG2-CD1 4.12Å; I93-N180 PolarHBondContact N-O 3.46Å; I93-I181 CarbonylContact O-C 3.56Å; I93-I181 WeakPolarHBondContact O-CA 3.25Å; I93-T182 PolarHBondContact O-N 3.35Å
94	T	36.4	Very low	37	Very low	81 Å²	81	42.4 Å²	42.4	50%	0.497	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	124.6	168.8	-58.7	0	0	0	0	109.8	N92 T182	N92-T94 PolarHBondContact O-N 2.97Å; N92-T94 VanDerWaalsContact O-N 3.14Å; T94-T182 CarbonylContact C-O 3.48Å; T94-T182 VanDerWaalsContact CA-O 3.31Å; T94-T182 WeakPolarHBondContact CA-O 3.39Å
95	T	39	Very low	37.5	Very low	14 Å²	14	42 Å²	42	9%	0.086	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	121.4	169.4	57.1	0	0	0	0	109.6	T39 I41 I93 T182 T183 S184	T39-T95 HydrophobicContact CG2-CG2 4.31Å; I41-T95 HydrophobicContact CD1-CG2 3.45Å; I41-T95 VanDerWaalsContact CD1-CG2 3.45Å; I93-T95 HydrophobicContact CG2-CG2 4.34Å; T95-T182 PolarHBondContact N-O 3.5Å; T95-T183 WeakPolarHBondContact O-CA 3.21Å; T95-T183 WeakPolarHBondContact OG1-CG2 3.37Å; T95-S184 PolarHBondContact O-N 3.49Å
96	S	39.5	Very low	38	Very low	43 Å²	43	36.9 Å²	36.9	30%	0.301	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	125.5	177.2	54.3	0	0	0	0	110.6	S184	S96-S184 CarbonylContact C-O 3.59Å; S96-S184 WeakPolarHBondContact CA-O 3.38Å; S96-S184 WeakPolarHBondContact CB-OG 3.13Å
97	S	43.6	Very low	38.6	Very low	10 Å²	10	36.7 Å²	36.7	7%	0.07	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	126.2	169.3	62.4	0	0	0	0	109.7	T124 S184 S185 T186	S97-T124 VanDerWaalsContact OG-CB 3.31Å; S97-T124 WeakPolarHBondContact OG-CB 3.29Å; S97-T124 WeakPolarHBondContact OG-CG2 3.48Å; S97-S184 PolarHBondContact N-O 3.37Å; S97-S185 WeakPolarHBondContact O-CA 3.46Å; S97-S185 PolarHBondContact OG-OG 3.42Å; S97-T186 PolarHBondContact O-N 2.93Å
98	T	36.7	Very low	39	Very low	44 Å²	44	36.5 Å²	36.5	27%	0.27	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	120.3	-176.7	-55.9	0	0	0	0	109.9	S10 E11 T186	S10-T98 WeakPolarHBondContact CA-O 3.01Å; E11-T98 PolarHBondContact N-O 2.95Å; T98-T186 WeakPolarHBondContact CA-O 3.47Å
99	V	35.7	Very low	39.3	Very low	0 Å²	0	38.5 Å²	38.5	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	121	169.5	173.9	0	0	0	0	107.9	E11 T36 T101 S123 T124 T186 A188	E11-V99 HydrophobicContact CB-CG2 4.46Å; T36-V99 HydrophobicContact CG2-CG2 3.77Å; V99-T101 HydrophobicContact CG1-CG2 3.87Å; V99-S123 WeakPolarHBondContact CG2-O 3.47Å; V99-T124 HydrophobicContact CG2-CG2 4.18Å; V99-T186 PolarHBondContact N-O 3.48Å; V99-A188 PolarHBondContact O-N 3.26Å
100	A	36.1	Very low	39.9	Very low	30 Å²	30	35.3 Å²	35.3	25%	0.248	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	103.2	177.9	0	0	0	0	0	109.8	E11 I12 V13 A188	E11-A100 PolarHBondContact O-N 3.47Å; I12-A100 WeakPolarHBondContact CA-O 3.48Å; I12-A100 HydrophobicContact CG1-CB 4.33Å; V13-A100 PolarHBondContact N-O 3.05Å; A100-A188 VanDerWaalsContact CA-O 3.29Å; A100-A188 WeakPolarHBondContact CA-O 3.39Å
101	T	40.3	Very low	40.4	Very low	5 Å²	5	37 Å²	37	3%	0.031	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	138.3	-177.7	63	0	0	0	0	112.3	V13 V99 Q120 S122 A188 T189 N190	V13-T101 WeakPolarHBondContact O-CA 3.44Å; V99-T101 HydrophobicContact CG1-CG2 3.87Å; T101-Q120 VanDerWaalsContact OG1-CD 3.26Å; T101-Q120 PolarHBondContact OG1-NE2 3.2Å; T101-S122 WeakPolarHBondContact CG2-OG 3.39Å; T101-S122 PolarHBondContact OG1-OG 3.18Å; T101-S122 VanDerWaalsContact OG1-OG 3.05Å; T101-A188 PolarHBondContact N-O 3.24Å; T101-A188 VanDerWaalsContact N-O 3.17Å; T101-T189 WeakPolarHBondContact O-CA 3.15Å; T101-T189 VanDerWaalsContact OG1-CG2 3.3Å; T101-T189 WeakPolarHBondContact OG1-CG2 3.34Å; T101-N190 PolarHBondContact O-N 2.97Å
102	N	40.9	Very low	41	Very low	52 Å²	52	35.3 Å²	35.3	28%	0.278	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	121.7	173.1	-177.3	45.2	0	0	0	108.4	V13 N14 T15 N190	V13-N102 PolarHBondContact O-N 3.32Å; V13-N102 VanDerWaalsContact O-N 3.16Å; N14-N102 CarbonylContact C-O 3.56Å; N14-N102 WeakPolarHBondContact CA-O 3.36Å; N14-N102 WeakPolarHBondContact OD1-CB 3.49Å; N14-N102 PolarHBondContact OD1-ND2 3.09Å; N14-N102 PolarHBondContact OD1-O 3.09Å; T15-N102 PolarHBondContact N-O 3.42Å; N102-N190 WeakPolarHBondContact CA-O 3.35Å; N102-N190 WeakPolarHBondContact OD1-CB 3.4Å; N102-N190 PolarHBondContact OD1-ND2 2.91Å
103	T	43.3	Very low	41.3	Very low	0 Å²	0	34.3 Å²	34.3	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	124.8	-179.8	-50.3	0	0	0	0	108.2	T15 T30 Q32 T118 Q120 N190 T191 S192	T15-T103 WeakPolarHBondContact O-CA 3.39Å; T30-T103 HydrophobicContact CG2-CG2 4.23Å; Q32-T103 PolarHBondContact OE1-OG1 2.92Å; T103-T118 HydrophobicContact CG2-CG2 3.99Å; T103-Q120 PolarHBondContact OG1-NE2 3.38Å; T103-N190 PolarHBondContact N-O 3.42Å; T103-T191 WeakPolarHBondContact O-CA 3.49Å; T103-S192 PolarHBondContact O-N 3.37Å
104	S	40.2	Very low	41.9	Very low	26 Å²	26	33.5 Å²	33.5	18%	0.182	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	127.6	-174.9	53.2	0	0	0	0	111.9	T15 S16 A17 S192	T15-S104 PolarHBondContact O-N 3.45Å; T15-S104 PolarHBondContact O-OG 3.22Å; S16-S104 WeakPolarHBondContact CA-O 3.44Å; S16-S104 WeakPolarHBondContact CB-OG 3.45Å; A17-S104 PolarHBondContact N-O 3.42Å; S104-S192 WeakPolarHBondContact CA-O 3.33Å
105	A	40.6	Very low	42.3	Very low	17 Å²	17	32.1 Å²	32.1	14%	0.14	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	127.1	176.5	0	0	0	0	0	109.8	S192 T194	A105-S192 PolarHBondContact N-O 3.48Å; A105-T194 PolarHBondContact O-N 3.26Å
106	T	39.9	Very low	42.7	Very low	60 Å²	60	32.4 Å²	32.4	37%	0.368	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	120.8	179.4	-59.4	0	0	0	0	111.3	A17 T18 T194	A17-T106 PolarHBondContact O-N 3.41Å; T18-T106 WeakPolarHBondContact CA-O 3.47Å; T106-T194 WeakPolarHBondContact CA-O 3.42Å
107	V	42.8	Very low	42.8	Very low	11 Å²	11	33.3 Å²	33.3	7%	0.067	20%	0.201	C	C	.	.			trans	-127.4	118.6	-178.3	-177.5	0	0	0	0	109.5	V19 Q109 V110 F116 T194 V195 P196	V19-V107 HydrophobicContact CB-CG2 4.49Å; V107-Q109 PolarHBondContact O-N 3.44Å; V107-V110 HydrophobicContact CG1-CG2 3.79Å; V107-F116 HydrophobicContact CB-CZ 4.5Å; V107-F116 HydrophobicContact CG1-CZ 4.41Å; V107-F116 HydrophobicContact CG2-CE1 3.81Å; V107-F116 HydrophobicContact CG2-CZ 4.19Å; V107-T194 PolarHBondContact N-O 3.48Å; V107-V195 HydrophobicContact CB-CG2 4.36Å; V107-P196 WeakPolarHBondContact O-CD 3.17Å
108	P	42.5	Very low	43	Very low	58 Å²	58	33.1 Å²	33.1	38%	0.377	20%	0.2	S	C	.	.	S	Bend	trans	-64.8	-40.9	-167	-26.6	35.9	0	0	0	116.6	V19 P196	V19-P108 WeakPolarHBondContact O-CD 3.41Å; P108-P196 WeakPolarHBondContact O-CD 3.4Å; P108-P196 WeakPolarHBondContact O-CG 3.33Å
109	Q	43.8	Very low	43.3	Very low	59 Å²	59	32.4 Å²	32.4	28%	0.276	20%	0.197	S	C	.	.			trans	-158.7	149.6	176.4	-83.4	-166.4	-39.9	0	0	110.5	V107 Q197	V107-Q109 PolarHBondContact O-N 3.44Å; Q109-Q197 HydrophobicContact CG-CB 4.47Å
110	V	45.3	Very low	43.7	Very low	6 Å²	6	32.5 Å²	32.5	4%	0.036	20%	0.197	C	C	.	.	B	Isolated β-bridge	trans	-136.4	127.2	179.3	-177.5	0	0	0	0	110.7	V107 T112 T114 F116 V195 Q197 N199	V107-V110 HydrophobicContact CG1-CG2 3.79Å; V110-T112 WeakPolarHBondContact CG1-O 3Å; V110-T114 HydrophobicContact CG1-CG2 4.32Å; V110-T114 WeakPolarHBondContact CG1-OG1 3.37Å; V110-F116 HydrophobicContact CG2-CE2 4.34Å; V110-F116 HydrophobicContact CG2-CZ 4.04Å; V110-V195 HydrophobicContact CG2-CG1 4.35Å; V110-Q197 PolarHBondContact N-O 2.96Å; V110-N199 PolarHBondContact O-N 3.26Å
111	N	47.7	Very low	44.1	Very low	58 Å²	58	34 Å²	34	31%	0.31	20%	0.204	S	C	.	.			trans	-115.8	-1.1	-173.5	-69.8	-41.5	0	0	0	115.2	N23 N199 T200	N23-N111 PolarHBondContact OD1-ND2 2.97Å; N23-N111 VanDerWaalsContact OD1-ND2 3.09Å; N111-N199 PolarHBondContact OD1-ND2 2.92Å; N111-T200 WeakPolarHBondContact O-CG2 3.33Å
112	T	49.1	Very low	44.2	Very low	40 Å²	40	33.9 Å²	33.9	25%	0.245	20%	0.203	C	C	.	.	S	Bend	trans	-138.7	163	-178.8	46.8	0	0	0	0	111.3	T24 V110 T114 T200	T24-T112 VanDerWaalsContact C-OG1 3.26Å; T24-T112 PolarHBondContact N-OG1 2.89Å; T24-T112 PolarHBondContact O-OG1 3.47Å; V110-T112 WeakPolarHBondContact CG1-O 3Å; T112-T114 PolarHBondContact O-N 2.96Å; T112-T114 VanDerWaalsContact O-N 3.17Å; T112-T114 PolarHBondContact O-OG1 2.94Å; T112-T200 WeakPolarHBondContact CA-OG1 3.36Å; T112-T200 PolarHBondContact N-OG1 3.21Å; T112-T200 PolarHBondContact O-OG1 3.07Å
113	T	47.5	Very low	44.2	Very low	83 Å²	83	33.1 Å²	33.1	51%	0.509	20%	0.201	S	C	.	.			trans	-51.8	121.3	177.5	-50.1	0	0	0	0	111.2	T200 T201	T113-T200 PolarHBondContact N-OG1 3.32Å; T113-T201 WeakPolarHBondContact CA-O 3.09Å
114	T	49	Very low	44.1	Very low	6 Å²	6	33.5 Å²	33.5	4%	0.037	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	142.1	-171	-56.7	0	0	0	0	109.5	T26 F28 V110 T112 F116 S203	T26-T114 WeakPolarHBondContact O-CA 3.48Å; T26-T114 WeakPolarHBondContact O-CG2 3.02Å; F28-T114 HydrophobicContact CD2-CG2 4.18Å; F28-T114 HydrophobicContact CE2-CG2 4.3Å; V110-T114 HydrophobicContact CG1-CG2 4.32Å; V110-T114 WeakPolarHBondContact CG1-OG1 3.37Å; T112-T114 PolarHBondContact O-N 2.96Å; T112-T114 VanDerWaalsContact O-N 3.17Å; T112-T114 PolarHBondContact O-OG1 2.94Å; T114-F116 HydrophobicContact CG2-CD2 4.09Å; T114-F116 HydrophobicContact CG2-CE1 4.1Å; T114-F116 HydrophobicContact CG2-CE2 3.41Å; T114-F116 VanDerWaalsContact CG2-CE2 3.41Å; T114-F116 HydrophobicContact CG2-CZ 3.41Å; T114-F116 VanDerWaalsContact CG2-CZ 3.41Å; T114-S203 PolarHBondContact O-N 3.37Å
115	S	44.9	Very low	43.8	Very low	52 Å²	52	32.7 Å²	32.7	36%	0.364	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	132.2	174.3	61.1	0	0	0	0	110.5	T26 F28	T26-S115 PolarHBondContact O-N 3.33Å; F28-S115 PolarHBondContact N-O 2.92Å
116	F	47.6	Very low	43.6	Very low	20 Å²	20	35 Å²	35	9%	0.088	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	122.5	176.8	-64.8	-79.3	0	0	0	109.3	F28 V107 V110 T114 T202 S203 F204 D205	F28-F116 HydrophobicContact CB-CD1 3.86Å; F28-F116 HydrophobicContact CB-CE1 4.12Å; F28-F116 HydrophobicContact CD2-CD1 4Å; F28-F116 AromaticContact CD2-CE1 3.44Å; F28-F116 HydrophobicContact CD2-CE1 3.44Å; F28-F116 VanDerWaalsContact CD2-CE1 3.44Å; F28-F116 HydrophobicContact CD2-CZ 4.16Å; F28-F116 HydrophobicContact CE2-CE1 4.21Å; F28-F116 HydrophobicContact CG-CD1 4.32Å; F28-F116 HydrophobicContact CG-CE1 4.07Å; V107-F116 HydrophobicContact CB-CZ 4.5Å; V107-F116 HydrophobicContact CG1-CZ 4.41Å; V107-F116 HydrophobicContact CG2-CE1 3.81Å; V107-F116 HydrophobicContact CG2-CZ 4.19Å; V110-F116 HydrophobicContact CG2-CE2 4.34Å; V110-F116 HydrophobicContact CG2-CZ 4.04Å; T114-F116 HydrophobicContact CG2-CD2 4.09Å; T114-F116 HydrophobicContact CG2-CE1 4.1Å; T114-F116 HydrophobicContact CG2-CE2 3.41Å; T114-F116 VanDerWaalsContact CG2-CE2 3.41Å; T114-F116 HydrophobicContact CG2-CZ 3.41Å; T114-F116 VanDerWaalsContact CG2-CZ 3.41Å; F116-T202 HydrophobicContact CD2-CG2 4.12Å; F116-T202 HydrophobicContact CE2-CG2 4.16Å; F116-S203 PolarHBondContact N-O 3.23Å; F116-F204 HydrophobicContact CB-CD1 3.81Å; F116-F204 HydrophobicContact CB-CE1 4.18Å; F116-F204 AromaticContact CD2-CD1 3.78Å; F116-F204 HydrophobicContact CD2-CD1 3.78Å; F116-F204 AromaticContact CD2-CE1 3.33Å; F116-F204 HydrophobicContact CD2-CE1 3.33Å; F116-F204 AromaticContact CD2-CZ 4Å; F116-F204 HydrophobicContact CD2-CZ 4Å; F116-F204 AromaticContact CE2-CE1 3.93Å; F116-F204 HydrophobicContact CE2-CE1 3.93Å; F116-F204 HydrophobicContact CE2-CZ 4.29Å; F116-F204 HydrophobicContact CG-CD1 4.09Å; F116-F204 AromaticContact CG-CE1 3.94Å; F116-F204 HydrophobicContact CG-CE1 3.94Å; F116-D205 PolarHBondContact O-N 2.93Å
117	D	42.5	Very low	43.6	Very low	62 Å²	62	32.4 Å²	32.4	33%	0.332	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	133.3	168.5	-172.9	-23.9	0	0	0	107.6	F28 T30	F28-D117 PolarHBondContact O-N 2.71Å; T30-D117 PolarHBondContact N-O 3.41Å
118	T	46	Very low	43.3	Very low	6 Å²	6	33.5 Å²	33.5	4%	0.037	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	108.2	173.2	-64.3	0	0	0	0	108.7	T30 T103 T191 D205 T206 S207	T30-T118 WeakPolarHBondContact O-CA 3.45Å; T103-T118 HydrophobicContact CG2-CG2 3.99Å; T118-T191 HydrophobicContact CG2-CG2 3.89Å; T118-D205 PolarHBondContact N-O 3.22Å; T118-T206 WeakPolarHBondContact O-CA 3.46Å; T118-S207 PolarHBondContact O-N 3.22Å
119	S	43.6	Very low	43.1	Very low	30 Å²	30	30.8 Å²	30.8	21%	0.21	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	132.4	-172.7	54.7	0	0	0	0	111.3	T30 S31 Q32 S207	T30-S119 PolarHBondContact O-N 2.95Å; T30-S119 VanDerWaalsContact O-N 3.11Å; S31-S119 CarbonylContact C-O 3.53Å; S31-S119 WeakPolarHBondContact CA-O 3.36Å; S31-S119 WeakPolarHBondContact CB-OG 3.49Å; Q32-S119 PolarHBondContact N-O 2.69Å; S119-S207 WeakPolarHBondContact CA-O 3.46Å; S119-S207 WeakPolarHBondContact CB-OG 3.35Å
120	Q	44.9	Very low	42.7	Very low	1 Å²	1	30.4 Å²	30.4	1%	0.005	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	121.8	-178.8	-168.4	-167.6	62.1	0	0	110.7	Q32 T101 T103 T189 N190 T191 S207 Q208 T209	Q32-Q120 WeakPolarHBondContact O-CA 3.35Å; T101-Q120 VanDerWaalsContact OG1-CD 3.26Å; T101-Q120 PolarHBondContact OG1-NE2 3.2Å; T103-Q120 PolarHBondContact OG1-NE2 3.38Å; Q120-T189 VanDerWaalsContact OE1-CB 3.29Å; Q120-N190 PolarHBondContact NE2-O 2.74Å; Q120-N190 VanDerWaalsContact NE2-O 3.12Å; Q120-T191 PolarHBondContact OE1-OG1 3.3Å; Q120-T191 VanDerWaalsContact OE1-OG1 3.06Å; Q120-S207 PolarHBondContact N-O 3.49Å; Q120-Q208 HydrophobicContact CB-CG 4.47Å; Q120-Q208 WeakPolarHBondContact O-CA 3.36Å; Q120-T209 PolarHBondContact O-N 3.35Å
121	T	43	Very low	42.4	Very low	63 Å²	63	30.2 Å²	30.2	39%	0.387	18%	0.175	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	117.8	176.8	-60.7	0	0	0	0	110.6	Q32 T33 S34 T209	Q32-T121 PolarHBondContact O-N 2.65Å; T33-T121 WeakPolarHBondContact CA-O 3.45Å; S34-T121 PolarHBondContact N-O 3.44Å; T121-T209 WeakPolarHBondContact CA-O 3.39Å
122	S	43.1	Very low	41.9	Very low	1 Å²	1	29.8 Å²	29.8	1%	0.007	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	129	-178.4	-71.6	0	0	0	0	112	S34 T101 T209 S210 S211	S34-S122 WeakPolarHBondContact O-CA 3.35Å; T101-S122 WeakPolarHBondContact CG2-OG 3.39Å; T101-S122 PolarHBondContact OG1-OG 3.18Å; T101-S122 VanDerWaalsContact OG1-OG 3.05Å; S122-T209 PolarHBondContact N-O 3.43Å; S122-S210 WeakPolarHBondContact O-CA 3.2Å; S122-S211 PolarHBondContact O-N 3.45Å
123	S	41	Very low	41.3	Very low	36 Å²	36	27.9 Å²	27.9	25%	0.252	16%	0.163	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-142	145.8	-177.5	58.9	0	0	0	0	114.4	S34 S35 T36 V99 S211	S34-S123 PolarHBondContact O-N 2.89Å; S34-S123 VanDerWaalsContact O-N 3.12Å; S35-S123 WeakPolarHBondContact CA-O 3.33Å; T36-S123 PolarHBondContact N-O 2.94Å; V99-S123 WeakPolarHBondContact CG2-O 3.47Å; S123-S211 VanDerWaalsContact CA-O 3.25Å; S123-S211 WeakPolarHBondContact CA-O 3.24Å
124	T	40.7	Very low	40.8	Very low	8 Å²	8	28.7 Å²	28.7	5%	0.049	16%	0.156	C	C	.	.	P	Polyproline II helix	trans	-95.1	145.1	166	66.6	0	0	0	0	113	T36 S97 V99 S185 V187 S211 T212 G213	T36-T124 WeakPolarHBondContact OG1-CA 3.42Å; S97-T124 VanDerWaalsContact OG-CB 3.31Å; S97-T124 WeakPolarHBondContact OG-CB 3.29Å; S97-T124 WeakPolarHBondContact OG-CG2 3.48Å; V99-T124 HydrophobicContact CG2-CG2 4.18Å; T124-S185 PolarHBondContact OG1-OG 3.22Å; T124-V187 HydrophobicContact CG2-CG2 3.81Å; T124-S211 PolarHBondContact N-O 3.38Å; T124-S211 VanDerWaalsContact N-O 3.13Å; T124-T212 WeakPolarHBondContact OG1-CA 3.45Å; T124-G213 WeakPolarHBondContact O-CA 3.21Å; T124-G213 PolarHBondContact O-N 3.44Å; T124-G213 VanDerWaalsContact O-N 3.13Å; T124-G213 PolarHBondContact OG1-N 2.83Å
125	G	33.7	Very low	40.1	Very low	10 Å²	10	28.5 Å²	28.5	10%	0.103	16%	0.155	C	C	.	.	P	Polyproline II helix	trans	-63.5	150.5	176.2	0	0	0	0	0	112.9	T36	T36-G125 VanDerWaalsContact O-CA 3.23Å; T36-G125 WeakPolarHBondContact O-CA 3.37Å; T36-G125 PolarHBondContact O-N 3.42Å; T36-G125 VanDerWaalsContact O-N 3.14Å; T36-G125 PolarHBondContact OG1-N 3.49Å
126	Q	37.6	Very low	39.4	Very low	65 Å²	65	28.1 Å²	28.1	30%	0.304	15%	0.152	S	C	.	.	P	Polyproline II helix	trans	-64	140.6	173.1	-63.2	-173	103	0	0	110.9	Q38 T39 Q214	Q38-Q126 WeakPolarHBondContact CA-O 3.08Å; Q38-Q126 HydrophobicContact CG-CB 4.44Å; T39-Q126 PolarHBondContact N-O 3.17Å; Q126-Q214 WeakPolarHBondContact CA-O 3.19Å; Q126-Q214 HydrophobicContact CG-CB 4.4Å
127	T	38.6	Very low	38.6	Very low	6 Å²	6	27.3 Å²	27.3	4%	0.037	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	123.4	176.7	-64.4	0	0	0	0	109.9	T39 I129 T183 Q214 T215 Q216	T39-T127 WeakPolarHBondContact O-CA 3.33Å; T127-I129 HydrophobicContact CG2-CG1 4.29Å; T127-T183 HydrophobicContact CG2-CG2 4.48Å; T127-Q214 PolarHBondContact N-O 2.85Å; T127-T215 WeakPolarHBondContact O-CA 3.38Å; T127-Q216 PolarHBondContact O-N 3.43Å
128	Q	37.2	Very low	38.1	Very low	34 Å²	34	27.8 Å²	27.8	16%	0.159	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	122.8	176.6	-57.1	-170.5	93.2	0	0	110.6	T39 Q40 I41 F130 Q216	T39-Q128 PolarHBondContact O-N 3.49Å; Q40-Q128 WeakPolarHBondContact CA-O 3.34Å; Q40-Q128 HydrophobicContact CG-CB 4.38Å; I41-Q128 PolarHBondContact N-O 3.47Å; Q128-F130 HydrophobicContact CB-CD2 4.34Å; Q128-F130 HydrophobicContact CB-CE2 3.66Å; Q128-F130 HydrophobicContact CB-CZ 4.29Å; Q128-Q216 WeakPolarHBondContact CA-O 3.5Å; Q128-Q216 HydrophobicContact CG-CB 4.41Å
129	I	37.7	Very low	37.4	Very low	0 Å²	0	28 Å²	28	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	116.7	178	-58.2	175.1	0	0	0	108.2	I41 I93 T127 T131 I181 T183 Q216 F218	I41-I129 HydrophobicContact CB-CG1 4.44Å; I93-I129 HydrophobicContact CD1-CG2 4.49Å; I93-I129 HydrophobicContact CG2-CD1 4.12Å; T127-I129 HydrophobicContact CG2-CG1 4.29Å; I129-T131 HydrophobicContact CG2-CG2 4.05Å; I129-I181 HydrophobicContact CD1-CG2 3.75Å; I129-T183 HydrophobicContact CD1-CG2 3.73Å; I129-Q216 PolarHBondContact N-O 2.83Å; I129-F218 PolarHBondContact O-N 2.98Å
130	F	36.1	Very low	36.7	Very low	52 Å²	52	31.5 Å²	31.5	23%	0.228	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	111	176.6	-63.3	-86.2	0	0	0	109.3	I41 F42 T43 Q128 F218	I41-F130 PolarHBondContact O-N 3.34Å; F42-F130 HydrophobicContact CD1-CB 3.79Å; F42-F130 AromaticContact CD1-CD2 3.74Å; F42-F130 HydrophobicContact CD1-CD2 3.74Å; F42-F130 AromaticContact CD1-CG 4Å; F42-F130 HydrophobicContact CD1-CG 4Å; F42-F130 HydrophobicContact CE1-CB 4.15Å; F42-F130 AromaticContact CE1-CD2 3.29Å; F42-F130 HydrophobicContact CE1-CD2 3.29Å; F42-F130 AromaticContact CE1-CE2 3.79Å; F42-F130 HydrophobicContact CE1-CE2 3.79Å; F42-F130 AromaticContact CE1-CG 3.82Å; F42-F130 HydrophobicContact CE1-CG 3.82Å; F42-F130 AromaticContact CZ-CD2 3.86Å; F42-F130 HydrophobicContact CZ-CD2 3.86Å; F42-F130 HydrophobicContact CZ-CE2 4.03Å; T43-F130 PolarHBondContact N-O 2.99Å; Q128-F130 HydrophobicContact CB-CD2 4.34Å; Q128-F130 HydrophobicContact CB-CE2 3.66Å; Q128-F130 HydrophobicContact CB-CZ 4.29Å; F130-F218 HydrophobicContact CD1-CB 3.73Å; F130-F218 AromaticContact CD1-CD2 3.67Å; F130-F218 HydrophobicContact CD1-CD2 3.67Å; F130-F218 AromaticContact CD1-CG 3.92Å; F130-F218 HydrophobicContact CD1-CG 3.92Å; F130-F218 HydrophobicContact CE1-CB 4.12Å; F130-F218 AromaticContact CE1-CD2 3.23Å; F130-F218 HydrophobicContact CE1-CD2 3.23Å; F130-F218 AromaticContact CE1-CE2 3.7Å; F130-F218 HydrophobicContact CE1-CE2 3.7Å; F130-F218 AromaticContact CE1-CG 3.77Å; F130-F218 HydrophobicContact CE1-CG 3.77Å; F130-F218 AromaticContact CZ-CD2 3.8Å; F130-F218 HydrophobicContact CZ-CD2 3.8Å; F130-F218 AromaticContact CZ-CE2 3.95Å; F130-F218 HydrophobicContact CZ-CE2 3.95Å
131	T	39	Very low	36	Very low	2 Å²	2	32.9 Å²	32.9	1%	0.012	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	115.7	172.3	74.1	0	0	0	0	109.3	T43 P90 I129 P178 F218 T219 T220	T43-T131 WeakPolarHBondContact OG1-CG2 3.41Å; P90-T131 HydrophobicContact CG-CG2 4.29Å; I129-T131 HydrophobicContact CG2-CG2 4.05Å; T131-P178 HydrophobicContact CG2-CG 4.5Å; T131-F218 PolarHBondContact N-O 3.34Å; T131-T219 WeakPolarHBondContact OG1-CB 3.44Å; T131-T219 WeakPolarHBondContact OG1-CG2 3.44Å; T131-T220 PolarHBondContact O-N 3.47Å
132	T	36.2	Very low	35.3	Very low	49 Å²	49	34.7 Å²	34.7	30%	0.301	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	119.5	179.5	-57.3	0	0	0	0	111.3	T43 T44 D45 R134 T220	T43-T132 PolarHBondContact O-N 3.11Å; T44-T132 WeakPolarHBondContact CA-O 3.35Å; D45-T132 PolarHBondContact N-O 3.06Å; T132-R134 HydrophobicContact CG2-CB 4.5Å; T132-T220 WeakPolarHBondContact CA-O 3.13Å
133	D	37.4	Very low	34.5	Very low	0 Å²	0	38.4 Å²	38.4	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	134.3	163.9	-166.9	-13.7	0	0	0	108.4	S88 T220 R222	S88-D133 PolarHBondContact OG-OD2 3.4Å; D133-T220 PolarHBondContact N-O 3.32Å; D133-R222 PolarHBondContact O-N 3.16Å
134	R	36	Very low	33.6	Very low	100 Å²	100	39.2 Å²	39.2	38%	0.377	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	98	-179.7	-173.3	179.2	171.8	-179.6	-6	112	T132 P136	T132-R134 HydrophobicContact CG2-CB 4.5Å; R134-P136 WeakPolarHBondContact O-CD 3.45Å
135	T	35.2	Very low	32.9	Very low	1 Å²	1	42.6 Å²	42.6	1%	0.006	25%	0.245	C	C	.	.			trans	-102.2	105.1	163.6	58.6	0	0	0	0	111	T86 T174 T223	T86-T135 HydrophobicContact CG2-CG2 3.43Å; T86-T135 VanDerWaalsContact CG2-CG2 3.43Å; T86-T135 VanDerWaalsContact OG1-CG2 3.25Å; T86-T135 WeakPolarHBondContact OG1-CG2 3.48Å; T135-T174 HydrophobicContact CG2-CG2 4.14Å; T135-T174 WeakPolarHBondContact OG1-CG2 3.41Å; T135-T223 WeakPolarHBondContact OG1-CG2 3.05Å
136	P	30.7	Very low	32.4	Very low	45 Å²	45	45.6 Å²	45.6	29%	0.292	27%	0.265	S	S	.	.			trans	-68.7	132.7	155.7	-4.9	22.9	0	0	0	108.7	R134	R134-P136 WeakPolarHBondContact O-CD 3.45Å
137	A	30.5	Very low	31.7	Very low	2 Å²	2	48.7 Å²	48.7	2%	0.017	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	132.4	171.4	0	0	0	0	0	109.9	F139 V172 P224 A225 T226	A137-F139 HydrophobicContact CB-CE2 3.92Å; A137-V172 HydrophobicContact CB-CG1 4.29Å; A137-V172 HydrophobicContact CB-CG2 3.74Å; A137-P224 PolarHBondContact N-O 2.74Å; A137-A225 WeakPolarHBondContact O-CA 3.37Å; A137-T226 PolarHBondContact O-N 2.94Å; A137-T226 VanDerWaalsContact O-N 3.16Å
138	T	32	Very low	30.9	Very low	72 Å²	72	53.8 Å²	53.8	44%	0.442	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	119	177.7	-56.4	0	0	0	0	108.1
139	F	30.5	Very low	30.3	Very low	12 Å²	12	58.7 Å²	58.7	5%	0.053	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	136.4	177.1	-64.8	-90.1	0	0	0	109.5	F51 V84 A137 E170 V172 T226 F227 T228	F51-F139 HydrophobicContact CE2-CE1 4.47Å; V84-F139 HydrophobicContact CG2-CZ 4.16Å; A137-F139 HydrophobicContact CB-CE2 3.92Å; F139-E170 VanDerWaalsContact CB-OE2 3.23Å; F139-E170 WeakPolarHBondContact CB-OE2 3.41Å; F139-E170 HydrophobicContact CD1-CG 4.48Å; F139-E170 WeakPolarHBondContact CD1-OE2 3.32Å; F139-E170 WeakPolarHBondContact CG-OE2 3.37Å; F139-V172 HydrophobicContact CE2-CG2 3.67Å; F139-V172 HydrophobicContact CZ-CG2 4.31Å; F139-T226 PolarHBondContact N-O 2.82Å; F139-F227 HydrophobicContact CB-CD1 3.86Å; F139-F227 HydrophobicContact CB-CE1 4.2Å; F139-F227 AromaticContact CD2-CD1 3.86Å; F139-F227 HydrophobicContact CD2-CD1 3.86Å; F139-F227 AromaticContact CD2-CE1 3.36Å; F139-F227 HydrophobicContact CD2-CE1 3.36Å; F139-F227 AromaticContact CD2-CZ 3.99Å; F139-F227 HydrophobicContact CD2-CZ 3.99Å; F139-F227 AromaticContact CE2-CE1 3.94Å; F139-F227 HydrophobicContact CE2-CE1 3.94Å; F139-F227 HydrophobicContact CE2-CZ 4.27Å; F139-F227 HydrophobicContact CG-CD1 4.14Å; F139-F227 AromaticContact CG-CE1 3.96Å; F139-F227 HydrophobicContact CG-CE1 3.96Å; F139-T228 PolarHBondContact O-N 2.87Å
140	T	30	Very low	29.5	Very low	102 Å²	102	64.5 Å²	64.5	63%	0.626	39%	0.394	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-142.6	111.2	-178.4	-59.3	0	0	0	0	108.1
141	S	29.3	Very low	28.8	Very low	31 Å²	31	68.1 Å²	68.1	22%	0.217	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	114.5	-174.5	51.8	0	0	0	0	111.7	T228 T230	S141-T228 PolarHBondContact N-O 2.85Å; S141-T230 PolarHBondContact O-N 3.1Å
142	T	27.9	Very low	27.9	Very low	101 Å²	101	74.7 Å²	74.7	62%	0.62	46%	0.461	S	S	*	.			trans	-128.3	103.4	175.7	42.2	0	0	0	0	109.5	T230	T142-T230 WeakPolarHBondContact CG2-OG1 3.43Å
143	P	26.3	Very low	27	Very low	78 Å²	78	80 Å²	80	51%	0.506	49%	0.487	S	S	.	.	P	Polyproline II helix	trans	-74.9	127.2	178.5	-8.7	24.6	0	0	0	110.7	T230 S232	P143-T230 WeakPolarHBondContact CD-O 3.49Å; P143-S232 WeakPolarHBondContact O-CB 3.48Å; P143-S232 PolarHBondContact O-OG 2.85Å
144	S	22.7	Very low	26.2	Very low	53 Å²	53	85.8 Å²	85.8	37%	0.371	52%	0.522	S	S	.	.	P	Polyproline II helix	trans	-75.9	138.2	-176.6	49.7	0	0	0	0	113.1
145	T	26.1	Very low	25.3	Very low	79 Å²	79	87.5 Å²	87.5	49%	0.485	54%	0.539	S	S	.	.	P	Polyproline II helix	trans	-88.9	136.3	178.7	42.3	0	0	0	0	111.5	T161	T145-T161 WeakPolarHBondContact O-CG2 3.13Å
146	S	22.7	Very low	24.5	Very low	74 Å²	74	94.3 Å²	94.3	52%	0.517	58%	0.576	S	S	.	*			trans	-96.7	107.1	175.2	57.2	0	0	0	0	111.6
147	T	24.2	Very low	23.9	Very low	129 Å²	129	101.3 Å²	101.3	79%	0.791	60%	0.604	S	S	*	*			trans	-104	125.6	163.6	43.8	0	0	0	0	109.2
148	S	21.5	Very low	23.4	Very low	113 Å²	113	107.3 Å²	107.3	79%	0.79	64%	0.641	S	S	*	*			trans	-134.3	104.1	-176.6	60	0	0	0	0	111.9
149	T	23.4	Very low	22.8	Very low	138 Å²	138	109.6 Å²	109.6	85%	0.847	66%	0.66	S	S	*	*			trans	-134.6	140	166.6	44	0	0	0	0	109
150	P	21.6	Very low	22.2	Very low	121 Å²	121	116.9 Å²	116.9	79%	0.786	70%	0.699	S	S	*	*			trans	-95.4	143.8	-167.6	35.3	-35.2	0	0	0	115.1
151	T	21	Very low	21.8	Very low	129 Å²	129	115.6 Å²	115.6	79%	0.791	69%	0.69	S	S	*	*			trans	68.6	89	150	-43.7	0	0	0	0	119.5
152	T	20.3	Very low	21.4	Very low	139 Å²	139	118.9 Å²	118.9	85%	0.853	71%	0.714	S	S	*	*				-167.1	159.8	121.5	11.7	0	0	0	0	111.2
153	L	17.9	Very low	21	Very low	162 Å²	162	119.3 Å²	119.3	85%	0.848	72%	0.716	S	S	*	*			trans	-70.1	155.2	176.3	-86	65.4	0	0	0	110.5
154	T	19.9	Very low	20.7	Very low	120 Å²	120	121 Å²	121	74%	0.736	73%	0.73	S	S	*	*			cis	-155.6	152.8	37.7	-39.3	0	0	0	0	113
155	D	18.1	Very low	20.9	Very low	136 Å²	136	124.5 Å²	124.5	73%	0.727	75%	0.754	S	S	*	*			trans	80.2	140.5	155.9	-121.9	-27.6	0	0	0	122
156	N	18.3	Very low	20.9	Very low	145 Å²	145	124.2 Å²	124.2	78%	0.775	76%	0.756	S	S	*	*			trans	-4	117.6	176.9	-72.4	-64.1	0	0	0	121.5
157	Q	19	Very low	21.1	Very low	191 Å²	191	127 Å²	127	89%	0.893	76%	0.759	S	S	*	*				-173.6	163.2	93.3	-167.2	156.7	83.1	0	0	112.6
158	T	18.5	Very low	21.3	Very low	129 Å²	129	122.6 Å²	122.6	79%	0.791	73%	0.73	S	S	*	*			trans	-89.6	137.1	-168.9	-34.6	0	0	0	0	115
159	S	19.1	Very low	21.9	Very low	119 Å²	119	118.9 Å²	118.9	83%	0.832	70%	0.703	S	S	*	*			trans	-169.6	153.8	142.9	-87.2	0	0	0	0	112.8
160	L	19.5	Very low	22.4	Very low	166 Å²	166	112.9 Å²	112.9	87%	0.869	67%	0.665	S	S	*	*			trans	-117.4	152.2	176	-97.7	159.8	0	0	0	110.8
161	T	20.3	Very low	22.9	Very low	74 Å²	74	108.6 Å²	108.6	45%	0.454	64%	0.638	S	S	.	*			trans	-126.7	147.3	-165	46.9	0	0	0	0	113.5	T145	T145-T161 WeakPolarHBondContact O-CG2 3.13Å
162	S	20.5	Very low	23.5	Very low	101 Å²	101	102.6 Å²	102.6	71%	0.706	60%	0.601	S	S	*	*			trans	-152.6	143.4	164.8	67.5	0	0	0	0	112.2
163	T	19.9	Very low	24.3	Very low	110 Å²	110	101 Å²	101	68%	0.675	58%	0.58	S	S	*	*			trans	-119.3	130.7	-173.3	47.7	0	0	0	0	111.8
164	S	21.1	Very low	25.1	Very low	113 Å²	113	93.3 Å²	93.3	79%	0.79	54%	0.539	S	S	*	.			trans	-167	158.8	157.9	56.2	0	0	0	0	112.3	S166	S164-S166 PolarHBondContact O-N 3.43Å
165	S	26.3	Very low	25.9	Very low	126 Å²	126	88.5 Å²	88.5	88%	0.881	51%	0.51	S	S	*	.			trans	-79.2	99.1	177.1	41.1	0	0	0	0	111.8
166	S	26.4	Very low	27	Very low	74 Å²	74	82.2 Å²	82.2	52%	0.517	48%	0.476	S	S	.	.			trans	-95.1	123.5	-174.9	57.8	0	0	0	0	113.9	S164 L168	S164-S166 PolarHBondContact O-N 3.43Å; S166-L168 PolarHBondContact O-N 3Å
167	K	26.5	Very low	28	Very low	133 Å²	133	76.9 Å²	76.9	58%	0.578	45%	0.449	S	S	*	.			trans	-82.4	98.6	155.7	179.3	-156.4	166.3	-163.3	0	108.2
168	L	28.7	Very low	29	Very low	36 Å²	36	67.8 Å²	67.8	19%	0.188	41%	0.406	C	S	.	.			trans	-80.7	146.5	175	-97.6	157.3	0	0	0	111.5	S166 E170 L256	S166-L168 PolarHBondContact O-N 3Å; L168-E170 HydrophobicContact CD2-CG 4.24Å; L168-L256 HydrophobicContact CB-CD2 3.63Å; L168-L256 HydrophobicContact CB-CG 4.23Å
169	T	33.5	Very low	30.1	Very low	35 Å²	35	62.7 Å²	62.7	22%	0.215	38%	0.375	C	S	.	.			trans	-152.5	104.8	174.3	-60.1	0	0	0	0	107.1	T257	T169-T257 WeakPolarHBondContact CA-O 3.48Å
170	E	33.6	Very low	31.3	Very low	11 Å²	11	60 Å²	60	5%	0.051	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	137.9	-177.5	-67.9	174.1	-160.4	0	0	109.1	F139 L168 F227 T257 S259	F139-E170 VanDerWaalsContact CB-OE2 3.23Å; F139-E170 WeakPolarHBondContact CB-OE2 3.41Å; F139-E170 HydrophobicContact CD1-CG 4.48Å; F139-E170 WeakPolarHBondContact CD1-OE2 3.32Å; F139-E170 WeakPolarHBondContact CG-OE2 3.37Å; L168-E170 HydrophobicContact CD2-CG 4.24Å; E170-F227 HydrophobicContact CB-CE1 4.09Å; E170-F227 WeakPolarHBondContact OE2-CD1 3.33Å; E170-F227 WeakPolarHBondContact OE2-CE1 3.06Å; E170-T257 PolarHBondContact N-O 2.99Å; E170-S259 PolarHBondContact O-N 2.8Å
171	S	32.6	Very low	32.3	Very low	32 Å²	32	52.1 Å²	52.1	22%	0.224	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	128	-176.4	56.1	0	0	0	0	112.6	E82 S83 V84 S259	E82-S171 PolarHBondContact O-N 2.83Å; E82-S171 VanDerWaalsContact O-N 3.11Å; E82-S171 PolarHBondContact O-OG 2.97Å; S83-S171 WeakPolarHBondContact CA-O 3.4Å; S83-S171 WeakPolarHBondContact CB-OG 3.02Å; V84-S171 PolarHBondContact N-O 3.45Å; V84-S171 VanDerWaalsContact N-O 3.12Å; S171-S259 WeakPolarHBondContact CA-O 3.4Å
172	V	33.3	Very low	33.3	Very low	3 Å²	3	50.9 Å²	50.9	2%	0.018	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	124.8	173.3	-178.4	0	0	0	0	108.4	A137 F139 F227 S259 R261	A137-V172 HydrophobicContact CB-CG1 4.29Å; A137-V172 HydrophobicContact CB-CG2 3.74Å; F139-V172 HydrophobicContact CE2-CG2 3.67Å; F139-V172 HydrophobicContact CZ-CG2 4.31Å; V172-F227 HydrophobicContact CG2-CZ 4.34Å; V172-S259 PolarHBondContact N-O 3.23Å; V172-S259 VanDerWaalsContact N-O 3.09Å; V172-R261 PolarHBondContact O-N 3.3Å
173	R	36.7	Very low	34.4	Very low	106 Å²	106	46.2 Å²	46.2	40%	0.4	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	101.6	179.2	-176.3	179.1	172.4	173.3	-0.6	112.7	V84 R85 T86 T175 R261	V84-R173 PolarHBondContact O-N 2.97Å; R85-R173 WeakPolarHBondContact CA-O 3.32Å; T86-R173 PolarHBondContact N-O 3.04Å; R173-T175 PolarHBondContact NE-OG1 3.49Å; R173-R261 WeakPolarHBondContact CA-O 3.31Å
174	T	34.3	Very low	35.6	Very low	0 Å²	0	42.4 Å²	42.4	0%	0	25%	0.247	C	C	.	.			trans	-74.9	161.9	154.2	56.2	0	0	0	0	109.7	T135 D221 T223 T262	T135-T174 HydrophobicContact CG2-CG2 4.14Å; T135-T174 WeakPolarHBondContact OG1-CG2 3.41Å; T174-D221 PolarHBondContact OG1-OD1 3.11Å; T174-D221 VanDerWaalsContact OG1-OD1 3.12Å; T174-D221 PolarHBondContact OG1-OD2 2.94Å; T174-T223 HydrophobicContact CG2-CG2 3.29Å; T174-T262 WeakPolarHBondContact OG1-CG2 3.42Å
175	T	38.1	Very low	36.8	Very low	19 Å²	19	37.1 Å²	37.1	12%	0.117	21%	0.21	C	C	.	.			trans	-154.5	89.4	163.3	-59.5	0	0	0	0	106.2	T86 R173 V177	T86-T175 PolarHBondContact O-N 3.32Å; R173-T175 PolarHBondContact NE-OG1 3.49Å; T175-V177 HydrophobicContact CG2-CG2 3.7Å
176	S	40.7	Very low	37.5	Very low	3 Å²	3	33.1 Å²	33.1	2%	0.021	18%	0.181	C	C	.	.			trans	-84.6	119.3	178.7	-163	0	0	0	0	109.8	S88 V265	S88-S176 PolarHBondContact OG-OG 3.44Å; S176-V265 PolarHBondContact O-N 3.22Å
177	V	39.3	Very low	38.1	Very low	33 Å²	33	29.6 Å²	29.6	20%	0.2	16%	0.156	C	C	.	.			trans	-132.6	80.1	-175.1	-154.6	0	0	0	0	110.5	S88 T175 T179 V265	S88-V177 PolarHBondContact O-N 3Å; T175-V177 HydrophobicContact CG2-CG2 3.7Å; V177-T179 HydrophobicContact CB-CG2 4.36Å; V177-T179 HydrophobicContact CG1-CG2 3.56Å; V177-T179 PolarHBondContact O-N 3.28Å; V177-V265 VanDerWaalsContact CG1-O 3.24Å; V177-V265 WeakPolarHBondContact CG1-O 3.38Å
178	P	40.9	Very low	38.8	Very low	0 Å²	0	25.1 Å²	25.1	0%	0	14%	0.144	C	C	.	.			trans	-64.5	123	165.4	-14.4	29.5	0	0	0	109	P90 T131 I181 T219 P266 T267	P90-P178 HydrophobicContact CG-CB 4.17Å; P90-P178 HydrophobicContact CG-CG 4.46Å; T131-P178 HydrophobicContact CG2-CG 4.5Å; P178-I181 HydrophobicContact CB-CD1 3.9Å; P178-T219 HydrophobicContact CG-CG2 4.13Å; P178-P266 WeakPolarHBondContact O-CA 3.5Å; P178-T267 PolarHBondContact O-N 2.98Å; P178-T267 VanDerWaalsContact O-N 3.09Å
179	T	40	Very low	39.7	Very low	23 Å²	23	23.8 Å²	23.8	14%	0.141	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	140.4	-175	54	0	0	0	0	111.9	P90 T91 N92 V177 T267	P90-T179 PolarHBondContact O-N 2.95Å; P90-T179 VanDerWaalsContact O-N 3.16Å; T91-T179 WeakPolarHBondContact CA-O 3.14Å; T91-T179 WeakPolarHBondContact CG2-OG1 3.43Å; N92-T179 PolarHBondContact N-O 3Å; V177-T179 HydrophobicContact CB-CG2 4.36Å; V177-T179 HydrophobicContact CG1-CG2 3.56Å; V177-T179 PolarHBondContact O-N 3.28Å; T179-T267 WeakPolarHBondContact CA-O 3.43Å; T179-T267 WeakPolarHBondContact CG2-OG1 3.4Å
180	N	44.6	Very low	40.3	Very low	62 Å²	62	24.7 Å²	24.7	33%	0.332	14%	0.141	S	C	.	.	E	Extended strand (participates in β ladder)	trans	56.4	56	-179.6	-51.1	-25.2	0	0	0	112	N92 I93 T267 N268	N92-N180 WeakPolarHBondContact CA-O 3.3Å; N92-N180 WeakPolarHBondContact OD1-CB 3.44Å; N92-N180 PolarHBondContact OD1-ND2 3.35Å; I93-N180 PolarHBondContact N-O 3.46Å; N180-T267 PolarHBondContact N-O 3.43Å; N180-N268 WeakPolarHBondContact CA-O 3.3Å; N180-N268 WeakPolarHBondContact OD1-CB 3.47Å; N180-N268 PolarHBondContact OD1-ND2 3.37Å
181	I	41.2	Very low	41.1	Very low	0 Å²	0	24.1 Å²	24.1	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	117.8	170.5	-57.2	-178.7	0	0	0	107.9	I93 I129 P178 T183 I217 N268 I269 T270	I93-I181 CarbonylContact O-C 3.56Å; I93-I181 WeakPolarHBondContact O-CA 3.25Å; I129-I181 HydrophobicContact CD1-CG2 3.75Å; P178-I181 HydrophobicContact CB-CD1 3.9Å; I181-T183 HydrophobicContact CG2-CG2 4.11Å; I181-I217 HydrophobicContact CD1-CG2 4.49Å; I181-I217 HydrophobicContact CG2-CD1 4.2Å; I181-N268 PolarHBondContact N-O 3.43Å; I181-I269 HydrophobicContact CB-CG1 4.43Å; I181-I269 WeakPolarHBondContact O-CA 3.46Å; I181-T270 PolarHBondContact O-N 3.17Å
182	T	41.4	Very low	41.7	Very low	49 Å²	49	23.9 Å²	23.9	30%	0.301	14%	0.136	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	112.8	177.1	-54.9	0	0	0	0	110.1	I93 T94 T95 T270	I93-T182 PolarHBondContact O-N 3.35Å; T94-T182 CarbonylContact C-O 3.48Å; T94-T182 VanDerWaalsContact CA-O 3.31Å; T94-T182 WeakPolarHBondContact CA-O 3.39Å; T95-T182 PolarHBondContact N-O 3.5Å; T182-T270 WeakPolarHBondContact CA-O 3.45Å
183	T	42.6	Very low	42.4	Very low	3 Å²	3	24.3 Å²	24.3	2%	0.018	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	116.3	176	67.3	0	0	0	0	109.7	T95 T127 I129 I181 T215 T270 T271 S272	T95-T183 WeakPolarHBondContact O-CA 3.21Å; T95-T183 WeakPolarHBondContact OG1-CG2 3.37Å; T127-T183 HydrophobicContact CG2-CG2 4.48Å; I129-T183 HydrophobicContact CD1-CG2 3.73Å; I181-T183 HydrophobicContact CG2-CG2 4.11Å; T183-T215 HydrophobicContact CG2-CG2 4.25Å; T183-T270 PolarHBondContact N-O 3.19Å; T183-T271 WeakPolarHBondContact O-CA 3.35Å; T183-T271 WeakPolarHBondContact OG1-CB 3.49Å; T183-T271 WeakPolarHBondContact OG1-CG2 3.39Å; T183-S272 PolarHBondContact O-N 3.38Å
184	S	45.8	Very low	43	Very low	29 Å²	29	21.8 Å²	21.8	20%	0.203	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	134	176.1	57.3	0	0	0	0	112.1	T95 S96 S97 S272	T95-S184 PolarHBondContact O-N 3.49Å; S96-S184 CarbonylContact C-O 3.59Å; S96-S184 WeakPolarHBondContact CA-O 3.38Å; S96-S184 WeakPolarHBondContact CB-OG 3.13Å; S97-S184 PolarHBondContact N-O 3.37Å; S184-S272 WeakPolarHBondContact CA-O 3.33Å
185	S	45.9	Very low	43.7	Very low	2 Å²	2	22 Å²	22	1%	0.014	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	119.8	171.1	-71.2	0	0	0	0	109	S97 T124 S272 S273 T274	S97-S185 WeakPolarHBondContact O-CA 3.46Å; S97-S185 PolarHBondContact OG-OG 3.42Å; T124-S185 PolarHBondContact OG1-OG 3.22Å; S185-S272 PolarHBondContact N-O 2.84Å; S185-S273 WeakPolarHBondContact O-CA 3.37Å; S185-T274 PolarHBondContact O-N 3.19Å
186	T	41.2	Very low	44.2	Very low	42 Å²	42	23.6 Å²	23.6	26%	0.258	15%	0.149	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	121	-179.8	-55	0	0	0	0	110.3	S97 T98 V99 T274	S97-T186 PolarHBondContact O-N 2.93Å; T98-T186 WeakPolarHBondContact CA-O 3.47Å; V99-T186 PolarHBondContact N-O 3.48Å; T186-T274 WeakPolarHBondContact CA-O 3.34Å
187	V	38.6	Very low	44.5	Very low	0 Å²	0	26.4 Å²	26.4	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	115.2	168.3	176	0	0	0	0	107.6	T124 T189 S211 T212 T274 V275 A276	T124-V187 HydrophobicContact CG2-CG2 3.81Å; V187-T189 HydrophobicContact CG1-CG2 3.61Å; V187-S211 WeakPolarHBondContact CG2-O 3.24Å; V187-T212 HydrophobicContact CG2-CG2 4.09Å; V187-T274 PolarHBondContact N-O 3.37Å; V187-V275 HydrophobicContact CB-CG2 4.41Å; V187-V275 WeakPolarHBondContact O-CA 3.41Å; V187-A276 PolarHBondContact O-N 3.29Å
188	A	42.3	Very low	45.1	Very low	40 Å²	40	24.9 Å²	24.9	33%	0.331	15%	0.152	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	108.1	-179.1	0	0	0	0	0	109.2	V99 A100 T101 A276	V99-A188 PolarHBondContact O-N 3.26Å; A100-A188 VanDerWaalsContact CA-O 3.29Å; A100-A188 WeakPolarHBondContact CA-O 3.39Å; T101-A188 PolarHBondContact N-O 3.24Å; T101-A188 VanDerWaalsContact N-O 3.17Å; A188-A276 WeakPolarHBondContact CA-O 3.38Å
189	T	46.2	Very low	45.6	Very low	7 Å²	7	27.5 Å²	27.5	4%	0.043	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	140.3	-170	70.1	0	0	0	0	113.5	T101 Q120 V187 Q208 S210 A276 T277 N278	T101-T189 WeakPolarHBondContact O-CA 3.15Å; T101-T189 VanDerWaalsContact OG1-CG2 3.3Å; T101-T189 WeakPolarHBondContact OG1-CG2 3.34Å; Q120-T189 VanDerWaalsContact OE1-CB 3.29Å; V187-T189 HydrophobicContact CG1-CG2 3.61Å; T189-Q208 VanDerWaalsContact OG1-CD 3.28Å; T189-Q208 PolarHBondContact OG1-NE2 3.21Å; T189-S210 WeakPolarHBondContact CG2-OG 3.44Å; T189-S210 PolarHBondContact OG1-OG 3.14Å; T189-S210 VanDerWaalsContact OG1-OG 3.1Å; T189-A276 PolarHBondContact N-O 3.22Å; T189-T277 WeakPolarHBondContact O-CA 3.28Å; T189-T277 WeakPolarHBondContact OG1-CG2 3.42Å; T189-N278 PolarHBondContact O-N 2.96Å
190	N	47.7	Very low	46.4	Very low	54 Å²	54	28.4 Å²	28.4	29%	0.289	17%	0.172	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	132	175.1	-167.9	28.2	0	0	0	109.6	T101 N102 T103 Q120 N278	T101-N190 PolarHBondContact O-N 2.97Å; N102-N190 WeakPolarHBondContact CA-O 3.35Å; N102-N190 WeakPolarHBondContact OD1-CB 3.4Å; N102-N190 PolarHBondContact OD1-ND2 2.91Å; T103-N190 PolarHBondContact N-O 3.42Å; Q120-N190 PolarHBondContact NE2-O 2.74Å; Q120-N190 VanDerWaalsContact NE2-O 3.12Å; N190-N278 WeakPolarHBondContact CA-O 3.48Å
191	T	49.4	Very low	46.8	Very low	0 Å²	0	29 Å²	29	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	128.1	173.2	-57.9	0	0	0	0	108.6	T103 T118 Q120 T206 Q208 N278 T279 S280	T103-T191 WeakPolarHBondContact O-CA 3.49Å; T118-T191 HydrophobicContact CG2-CG2 3.89Å; Q120-T191 PolarHBondContact OE1-OG1 3.3Å; Q120-T191 VanDerWaalsContact OE1-OG1 3.06Å; T191-T206 HydrophobicContact CG2-CG2 3.65Å; T191-Q208 PolarHBondContact OG1-NE2 2.92Å; T191-Q208 VanDerWaalsContact OG1-NE2 3.12Å; T191-N278 PolarHBondContact N-O 2.98Å; T191-T279 WeakPolarHBondContact O-CA 3.29Å; T191-S280 PolarHBondContact O-N 3.38Å; T191-S280 PolarHBondContact O-OG 3.09Å
192	S	46.4	Very low	47.5	Very low	26 Å²	26	29.2 Å²	29.2	18%	0.182	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	129.5	-176.9	54.4	0	0	0	0	113	T103 S104 A105 S280	T103-S192 PolarHBondContact O-N 3.37Å; S104-S192 WeakPolarHBondContact CA-O 3.33Å; A105-S192 PolarHBondContact N-O 3.48Å; S192-S280 WeakPolarHBondContact CA-O 3.46Å
193	A	46.8	Very low	48.1	Very low	12 Å²	12	29.2 Å²	29.2	10%	0.099	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	126.6	175.5	0	0	0	0	0	110.1	S280 T282	A193-S280 PolarHBondContact N-O 3.36Å; A193-T282 PolarHBondContact O-N 3.03Å
194	T	48.8	Very low	48.7	Very low	53 Å²	53	29.7 Å²	29.7	33%	0.325	18%	0.183	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	122.2	-179	-58.9	0	0	0	0	111.8	A105 T106 V107 T282	A105-T194 PolarHBondContact O-N 3.26Å; T106-T194 WeakPolarHBondContact CA-O 3.42Å; V107-T194 PolarHBondContact N-O 3.48Å; T194-T282 WeakPolarHBondContact CA-O 3.45Å
195	V	49.4	Very low	49	Very low	6 Å²	6	31.4 Å²	31.4	4%	0.036	19%	0.19	C	C	.	.			trans	-132.4	112.8	177.3	-178.7	0	0	0	0	109.6	V107 V110 Q197 V198 F204 T282 V283 P284	V107-V195 HydrophobicContact CB-CG2 4.36Å; V110-V195 HydrophobicContact CG2-CG1 4.35Å; V195-Q197 PolarHBondContact O-N 3.48Å; V195-V198 HydrophobicContact CG1-CG2 3.77Å; V195-F204 HydrophobicContact CB-CZ 4.26Å; V195-F204 HydrophobicContact CG2-CE1 3.71Å; V195-F204 HydrophobicContact CG2-CZ 3.89Å; V195-T282 PolarHBondContact N-O 3.01Å; V195-V283 HydrophobicContact CB-CG2 4.47Å; V195-P284 WeakPolarHBondContact O-CD 3.3Å
196	P	48.2	Very low	49.3	Very low	52 Å²	52	31.4 Å²	31.4	34%	0.338	19%	0.19	S	C	.	.	S	Bend	trans	-61.8	-38.6	-172.3	-28.1	37.3	0	0	0	116.3	V107 P108 P284	V107-P196 WeakPolarHBondContact O-CD 3.17Å; P108-P196 WeakPolarHBondContact O-CD 3.4Å; P108-P196 WeakPolarHBondContact O-CG 3.33Å; P196-P284 WeakPolarHBondContact O-CB 3.48Å; P196-P284 WeakPolarHBondContact O-CD 3.2Å
197	Q	48.6	Very low	49.6	Very low	62 Å²	62	31 Å²	31	29%	0.29	19%	0.189	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	142.8	177.1	-77	-168.2	-43	0	0	112.4	Q109 V110 V195 Q285	Q109-Q197 HydrophobicContact CG-CB 4.47Å; V110-Q197 PolarHBondContact N-O 2.96Å; V195-Q197 PolarHBondContact O-N 3.48Å; Q197-Q285 HydrophobicContact CG-CB 4.49Å; Q197-Q285 VanDerWaalsContact NE2-OE1 3.13Å
198	V	50.7	Low	50.3	Low	0 Å²	0	31 Å²	31	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	121.5	179.4	177.7	0	0	0	0	110.6	V195 T200 T202 F204 V283 Q285 N287	V195-V198 HydrophobicContact CG1-CG2 3.77Å; V198-T200 WeakPolarHBondContact CG1-O 3.11Å; V198-T202 HydrophobicContact CG1-CG2 4.46Å; V198-T202 WeakPolarHBondContact CG1-OG1 3.39Å; V198-F204 HydrophobicContact CG2-CZ 4.43Å; V198-V283 HydrophobicContact CG2-CG1 4.06Å; V198-Q285 PolarHBondContact N-O 3.27Å; V198-N287 PolarHBondContact O-N 2.82Å
199	N	52.7	Low	50.6	Low	56 Å²	56	32.1 Å²	32.1	30%	0.299	19%	0.191	S	C	.	.			trans	-105.4	-10.6	-174.1	-74.4	-36	0	0	0	115.6	V110 N111 N287 T288	V110-N199 PolarHBondContact O-N 3.26Å; N111-N199 PolarHBondContact OD1-ND2 2.92Å; N199-N287 PolarHBondContact OD1-ND2 2.73Å; N199-T288 WeakPolarHBondContact O-CG2 3.47Å
200	T	55.2	Low	50.6	Low	42 Å²	42	31.8 Å²	31.8	26%	0.258	19%	0.189	S	C	.	.	S	Bend	trans	-144.1	167.1	-177.9	50.1	0	0	0	0	111.4	N111 T112 T113 V198 T202 T288	N111-T200 WeakPolarHBondContact O-CG2 3.33Å; T112-T200 WeakPolarHBondContact CA-OG1 3.36Å; T112-T200 PolarHBondContact N-OG1 3.21Å; T112-T200 PolarHBondContact O-OG1 3.07Å; T113-T200 PolarHBondContact N-OG1 3.32Å; V198-T200 WeakPolarHBondContact CG1-O 3.11Å; T200-T202 PolarHBondContact O-N 2.91Å; T200-T202 PolarHBondContact O-OG1 3.06Å; T200-T288 WeakPolarHBondContact CA-OG1 3.39Å; T200-T288 PolarHBondContact N-OG1 2.91Å; T200-T288 PolarHBondContact O-OG1 3.17Å
201	T	54.5	Low	50.5	Low	75 Å²	75	31 Å²	31	46%	0.46	19%	0.188	S	C	.	.			trans	-47.1	120.4	-177.4	-49.3	0	0	0	0	112.8	T113 T288 T289	T113-T201 WeakPolarHBondContact CA-O 3.09Å; T201-T288 PolarHBondContact N-OG1 2.89Å; T201-T289 WeakPolarHBondContact CA-O 3.37Å
202	T	55.7	Low	50.3	Low	3 Å²	3	31.3 Å²	31.3	2%	0.018	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	140.3	-174.9	-59.1	0	0	0	0	110.1	F116 V198 T200 F204 T290 S291	F116-T202 HydrophobicContact CD2-CG2 4.12Å; F116-T202 HydrophobicContact CE2-CG2 4.16Å; V198-T202 HydrophobicContact CG1-CG2 4.46Å; V198-T202 WeakPolarHBondContact CG1-OG1 3.39Å; T200-T202 PolarHBondContact O-N 2.91Å; T200-T202 PolarHBondContact O-OG1 3.06Å; T202-F204 HydrophobicContact CG2-CD2 4.08Å; T202-F204 HydrophobicContact CG2-CE1 4.35Å; T202-F204 HydrophobicContact CG2-CE2 3.47Å; T202-F204 VanDerWaalsContact CG2-CE2 3.47Å; T202-F204 HydrophobicContact CG2-CZ 3.62Å; T202-T290 WeakPolarHBondContact O-CA 3.4Å; T202-S291 PolarHBondContact O-N 3.02Å
203	S	54.2	Low	49.9	Very low	49 Å²	49	30.5 Å²	30.5	34%	0.343	19%	0.185	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	127.8	175.3	59.5	0	0	0	0	110.2	T114 F116	T114-S203 PolarHBondContact O-N 3.37Å; F116-S203 PolarHBondContact N-O 3.23Å
204	F	53.5	Low	49.6	Very low	14 Å²	14	32.7 Å²	32.7	6%	0.061	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	121.1	171.7	-62.9	-85.4	0	0	0	108.7	F116 V195 V198 T202 V283 T290 S291 F292 D293	F116-F204 HydrophobicContact CB-CD1 3.81Å; F116-F204 HydrophobicContact CB-CE1 4.18Å; F116-F204 AromaticContact CD2-CD1 3.78Å; F116-F204 HydrophobicContact CD2-CD1 3.78Å; F116-F204 AromaticContact CD2-CE1 3.33Å; F116-F204 HydrophobicContact CD2-CE1 3.33Å; F116-F204 AromaticContact CD2-CZ 4Å; F116-F204 HydrophobicContact CD2-CZ 4Å; F116-F204 AromaticContact CE2-CE1 3.93Å; F116-F204 HydrophobicContact CE2-CE1 3.93Å; F116-F204 HydrophobicContact CE2-CZ 4.29Å; F116-F204 HydrophobicContact CG-CD1 4.09Å; F116-F204 AromaticContact CG-CE1 3.94Å; F116-F204 HydrophobicContact CG-CE1 3.94Å; V195-F204 HydrophobicContact CB-CZ 4.26Å; V195-F204 HydrophobicContact CG2-CE1 3.71Å; V195-F204 HydrophobicContact CG2-CZ 3.89Å; V198-F204 HydrophobicContact CG2-CZ 4.43Å; T202-F204 HydrophobicContact CG2-CD2 4.08Å; T202-F204 HydrophobicContact CG2-CE1 4.35Å; T202-F204 HydrophobicContact CG2-CE2 3.47Å; T202-F204 VanDerWaalsContact CG2-CE2 3.47Å; T202-F204 HydrophobicContact CG2-CZ 3.62Å; F204-V283 HydrophobicContact CE2-CG2 4.24Å; F204-V283 HydrophobicContact CZ-CG2 4.3Å; F204-T290 HydrophobicContact CD2-CG2 4.24Å; F204-T290 HydrophobicContact CE2-CG2 4.21Å; F204-S291 PolarHBondContact N-O 2.93Å; F204-F292 HydrophobicContact CB-CD1 3.85Å; F204-F292 HydrophobicContact CB-CE1 4.31Å; F204-F292 AromaticContact CD2-CD1 3.69Å; F204-F292 HydrophobicContact CD2-CD1 3.69Å; F204-F292 AromaticContact CD2-CE1 3.33Å; F204-F292 HydrophobicContact CD2-CE1 3.33Å; F204-F292 HydrophobicContact CD2-CZ 4.03Å; F204-F292 AromaticContact CE2-CE1 3.82Å; F204-F292 HydrophobicContact CE2-CE1 3.82Å; F204-F292 HydrophobicContact CE2-CZ 4.21Å; F204-F292 HydrophobicContact CG-CD1 4.03Å; F204-F292 AromaticContact CG-CE1 3.96Å; F204-F292 HydrophobicContact CG-CE1 3.96Å; F204-D293 PolarHBondContact O-N 2.88Å
205	D	52.2	Low	49.3	Very low	64 Å²	64	30.4 Å²	30.4	34%	0.342	18%	0.18	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	139.9	162	-164.7	-28	0	0	0	107.5	F116 T118	F116-D205 PolarHBondContact O-N 2.93Å; T118-D205 PolarHBondContact N-O 3.22Å
206	T	52.3	Low	48.9	Very low	3 Å²	3	31.8 Å²	31.8	2%	0.018	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	109.5	176.1	-63.8	0	0	0	0	108.8	T118 T191 T279 D293 T294 S295	T118-T206 WeakPolarHBondContact O-CA 3.46Å; T191-T206 HydrophobicContact CG2-CG2 3.65Å; T206-T279 HydrophobicContact CG2-CG2 3.65Å; T206-D293 PolarHBondContact N-O 3.46Å; T206-T294 WeakPolarHBondContact O-CA 3.35Å; T206-S295 PolarHBondContact O-N 3.18Å
207	S	49.3	Very low	48.6	Very low	33 Å²	33	29.3 Å²	29.3	23%	0.231	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	134	-173	58.9	0	0	0	0	111.6	T118 S119 Q120 S295	T118-S207 PolarHBondContact O-N 3.22Å; S119-S207 WeakPolarHBondContact CA-O 3.46Å; S119-S207 WeakPolarHBondContact CB-OG 3.35Å; Q120-S207 PolarHBondContact N-O 3.49Å; S207-S295 WeakPolarHBondContact CA-O 3.4Å; S207-S295 WeakPolarHBondContact CB-OG 3.38Å
208	Q	52.4	Low	48.2	Very low	1 Å²	1	28.8 Å²	28.8	1%	0.005	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	122.7	179.6	-171.1	-177.6	60.7	0	0	111.1	Q120 T189 T191 N278 T279 S295 Q296 T297	Q120-Q208 HydrophobicContact CB-CG 4.47Å; Q120-Q208 WeakPolarHBondContact O-CA 3.36Å; T189-Q208 VanDerWaalsContact OG1-CD 3.28Å; T189-Q208 PolarHBondContact OG1-NE2 3.21Å; T191-Q208 PolarHBondContact OG1-NE2 2.92Å; T191-Q208 VanDerWaalsContact OG1-NE2 3.12Å; Q208-N278 PolarHBondContact NE2-O 3.02Å; Q208-T279 PolarHBondContact OE1-OG1 3.02Å; Q208-S295 PolarHBondContact N-O 3.18Å; Q208-Q296 HydrophobicContact CB-CG 4.43Å; Q208-Q296 WeakPolarHBondContact O-CA 3.48Å; Q208-T297 PolarHBondContact O-N 3.11Å
209	T	48.4	Very low	47.8	Very low	62 Å²	62	28.9 Å²	28.9	38%	0.38	17%	0.167	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	116.7	177.1	-61.4	0	0	0	0	110.4	Q120 T121 S122 T297	Q120-T209 PolarHBondContact O-N 3.35Å; T121-T209 WeakPolarHBondContact CA-O 3.39Å; S122-T209 PolarHBondContact N-O 3.43Å; T209-T297 WeakPolarHBondContact CA-O 3.5Å
210	S	47.3	Very low	47.3	Very low	0 Å²	0	28.4 Å²	28.4	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	126.5	-175.5	-74.3	0	0	0	0	111.6	S122 T189 T297 S298 S299	S122-S210 WeakPolarHBondContact O-CA 3.2Å; T189-S210 WeakPolarHBondContact CG2-OG 3.44Å; T189-S210 PolarHBondContact OG1-OG 3.14Å; T189-S210 VanDerWaalsContact OG1-OG 3.1Å; S210-T297 PolarHBondContact N-O 3.31Å; S210-S298 WeakPolarHBondContact O-CA 3.42Å; S210-S299 PolarHBondContact O-N 3.23Å
211	S	45.5	Very low	46.6	Very low	37 Å²	37	26.4 Å²	26.4	26%	0.259	15%	0.154	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	139.8	-176.4	58.1	0	0	0	0	115.3	S122 S123 T124 V187 S299	S122-S211 PolarHBondContact O-N 3.45Å; S123-S211 VanDerWaalsContact CA-O 3.25Å; S123-S211 WeakPolarHBondContact CA-O 3.24Å; T124-S211 PolarHBondContact N-O 3.38Å; T124-S211 VanDerWaalsContact N-O 3.13Å; V187-S211 WeakPolarHBondContact CG2-O 3.24Å; S211-S299 VanDerWaalsContact CA-O 3.23Å; S211-S299 WeakPolarHBondContact CA-O 3.41Å
212	T	43.5	Very low	46	Very low	8 Å²	8	27.1 Å²	27.1	5%	0.049	15%	0.148	C	C	.	.	P	Polyproline II helix	trans	-89	143.8	169.3	63.1	0	0	0	0	112.2	T124 V187 S273 V275 S299 T300 G301	T124-T212 WeakPolarHBondContact OG1-CA 3.45Å; V187-T212 HydrophobicContact CG2-CG2 4.09Å; T212-S273 VanDerWaalsContact OG1-CB 3.29Å; T212-S273 WeakPolarHBondContact OG1-CB 3.04Å; T212-S273 PolarHBondContact OG1-OG 3.24Å; T212-V275 HydrophobicContact CG2-CG2 3.87Å; T212-S299 PolarHBondContact N-O 3.18Å; T212-S299 VanDerWaalsContact N-O 3.13Å; T212-T300 WeakPolarHBondContact OG1-CA 3.31Å; T212-G301 WeakPolarHBondContact O-CA 3.33Å; T212-G301 PolarHBondContact O-N 3.41Å; T212-G301 VanDerWaalsContact O-N 3.1Å; T212-G301 PolarHBondContact OG1-N 2.84Å
213	G	38.3	Very low	45.2	Very low	8 Å²	8	27 Å²	27	8%	0.082	15%	0.148	C	C	.	.	P	Polyproline II helix	trans	-65	151.2	174.1	0	0	0	0	0	113	T124	T124-G213 WeakPolarHBondContact O-CA 3.21Å; T124-G213 PolarHBondContact O-N 3.44Å; T124-G213 VanDerWaalsContact O-N 3.13Å; T124-G213 PolarHBondContact OG1-N 2.83Å
214	Q	41.6	Very low	44.3	Very low	59 Å²	59	26.1 Å²	26.1	28%	0.276	14%	0.141	S	C	.	.	P	Polyproline II helix	trans	-65.8	145.5	175.7	-56.6	-173.2	107.8	0	0	111.5	Q126 T127 Q302	Q126-Q214 WeakPolarHBondContact CA-O 3.19Å; Q126-Q214 HydrophobicContact CG-CB 4.4Å; T127-Q214 PolarHBondContact N-O 2.85Å; Q214-Q302 WeakPolarHBondContact CA-O 3.45Å; Q214-Q302 HydrophobicContact CG-CB 4.46Å
215	T	41.3	Very low	43.4	Very low	4 Å²	4	25.5 Å²	25.5	3%	0.025	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	124.5	174.7	-62.8	0	0	0	0	110	T127 T183 I217 T271 Q302 T303 Q304	T127-T215 WeakPolarHBondContact O-CA 3.38Å; T183-T215 HydrophobicContact CG2-CG2 4.25Å; T215-I217 HydrophobicContact CG2-CG1 4.27Å; T215-T271 HydrophobicContact CG2-CG2 4.33Å; T215-Q302 PolarHBondContact N-O 3.38Å; T215-T303 WeakPolarHBondContact O-CA 3.41Å; T215-Q304 PolarHBondContact O-N 2.97Å
216	Q	41.4	Very low	42.7	Very low	35 Å²	35	25 Å²	25	16%	0.164	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	123.2	175.4	-54.7	-166.3	102.3	0	0	110.9	T127 Q128 I129 F218 Q304	T127-Q216 PolarHBondContact O-N 3.43Å; Q128-Q216 WeakPolarHBondContact CA-O 3.5Å; Q128-Q216 HydrophobicContact CG-CB 4.41Å; I129-Q216 PolarHBondContact N-O 2.83Å; Q216-F218 HydrophobicContact CB-CD2 4.25Å; Q216-F218 HydrophobicContact CB-CE2 3.59Å; Q216-F218 HydrophobicContact CB-CZ 4.25Å; Q216-F218 HydrophobicContact CG-CE2 4.47Å; Q216-Q304 WeakPolarHBondContact CA-O 3.42Å; Q216-Q304 HydrophobicContact CG-CB 4.49Å
217	I	41.2	Very low	41.8	Very low	0 Å²	0	25 Å²	25	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	115.6	177.3	-57.4	175.7	0	0	0	108.2	I181 T215 T219 I269 T271 Q304 F306	I181-I217 HydrophobicContact CD1-CG2 4.49Å; I181-I217 HydrophobicContact CG2-CD1 4.2Å; T215-I217 HydrophobicContact CG2-CG1 4.27Å; I217-T219 HydrophobicContact CG2-CG2 4.14Å; I217-I269 HydrophobicContact CD1-CG2 3.69Å; I217-T271 HydrophobicContact CD1-CG2 4.07Å; I217-Q304 PolarHBondContact N-O 2.6Å; I217-F306 PolarHBondContact O-N 2.92Å
218	F	40.9	Very low	41.2	Very low	51 Å²	51	25.9 Å²	25.9	22%	0.224	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	110.1	177.6	-63.9	-86.3	0	0	0	109.6	I129 F130 T131 Q216 F306	I129-F218 PolarHBondContact O-N 2.98Å; F130-F218 HydrophobicContact CD1-CB 3.73Å; F130-F218 AromaticContact CD1-CD2 3.67Å; F130-F218 HydrophobicContact CD1-CD2 3.67Å; F130-F218 AromaticContact CD1-CG 3.92Å; F130-F218 HydrophobicContact CD1-CG 3.92Å; F130-F218 HydrophobicContact CE1-CB 4.12Å; F130-F218 AromaticContact CE1-CD2 3.23Å; F130-F218 HydrophobicContact CE1-CD2 3.23Å; F130-F218 AromaticContact CE1-CE2 3.7Å; F130-F218 HydrophobicContact CE1-CE2 3.7Å; F130-F218 AromaticContact CE1-CG 3.77Å; F130-F218 HydrophobicContact CE1-CG 3.77Å; F130-F218 AromaticContact CZ-CD2 3.8Å; F130-F218 HydrophobicContact CZ-CD2 3.8Å; F130-F218 AromaticContact CZ-CE2 3.95Å; F130-F218 HydrophobicContact CZ-CE2 3.95Å; T131-F218 PolarHBondContact N-O 3.34Å; Q216-F218 HydrophobicContact CB-CD2 4.25Å; Q216-F218 HydrophobicContact CB-CE2 3.59Å; Q216-F218 HydrophobicContact CB-CZ 4.25Å; Q216-F218 HydrophobicContact CG-CE2 4.47Å; F218-F306 HydrophobicContact CD1-CB 3.75Å; F218-F306 AromaticContact CD1-CD2 3.59Å; F218-F306 HydrophobicContact CD1-CD2 3.59Å; F218-F306 HydrophobicContact CD1-CE2 4.42Å; F218-F306 AromaticContact CD1-CG 3.86Å; F218-F306 HydrophobicContact CD1-CG 3.86Å; F218-F306 HydrophobicContact CE1-CB 4.18Å; F218-F306 AromaticContact CE1-CD2 3.21Å; F218-F306 HydrophobicContact CE1-CD2 3.21Å; F218-F306 AromaticContact CE1-CE2 3.6Å; F218-F306 HydrophobicContact CE1-CE2 3.6Å; F218-F306 AromaticContact CE1-CG 3.75Å; F218-F306 HydrophobicContact CE1-CG 3.75Å; F218-F306 HydrophobicContact CE1-CZ 4.43Å; F218-F306 HydrophobicContact CG-CD2 4.44Å; F218-F306 AromaticContact CZ-CD2 3.81Å; F218-F306 HydrophobicContact CZ-CD2 3.81Å; F218-F306 AromaticContact CZ-CE2 3.87Å; F218-F306 HydrophobicContact CZ-CE2 3.87Å
219	T	43.5	Very low	40.3	Very low	2 Å²	2	26.4 Å²	26.4	1%	0.012	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	129.9	170.6	75.9	0	0	0	0	109.6	T131 P178 I217 P266 F306 T307 T308	T131-T219 WeakPolarHBondContact OG1-CB 3.44Å; T131-T219 WeakPolarHBondContact OG1-CG2 3.44Å; P178-T219 HydrophobicContact CG-CG2 4.13Å; I217-T219 HydrophobicContact CG2-CG2 4.14Å; T219-P266 HydrophobicContact CG2-CG 4.33Å; T219-F306 PolarHBondContact N-O 2.87Å; T219-T307 WeakPolarHBondContact OG1-CA 3.07Å; T219-T308 PolarHBondContact O-N 3.12Å
220	T	41.3	Very low	39.6	Very low	46 Å²	46	26.4 Å²	26.4	28%	0.282	15%	0.145	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	116.8	180	-62.9	0	0	0	0	110.7	T131 T132 D133 T308	T131-T220 PolarHBondContact O-N 3.47Å; T132-T220 WeakPolarHBondContact CA-O 3.13Å; D133-T220 PolarHBondContact N-O 3.32Å; T220-T308 WeakPolarHBondContact CA-O 3.48Å
221	D	41.4	Very low	38.9	Very low	0 Å²	0	29.3 Å²	29.3	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	132	165.9	-170.5	-14.7	0	0	0	108	T174 T308 R310	T174-D221 PolarHBondContact OG1-OD1 3.11Å; T174-D221 VanDerWaalsContact OG1-OD1 3.12Å; T174-D221 PolarHBondContact OG1-OD2 2.94Å; D221-T308 PolarHBondContact N-O 3.04Å; D221-R310 PolarHBondContact O-N 3.01Å; D221-R310 VanDerWaalsContact O-N 3.12Å
222	R	40.8	Very low	38.1	Very low	90 Å²	90	29.7 Å²	29.7	34%	0.34	17%	0.166	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	105.3	-179.7	-173.3	178.5	174.3	178.5	-3.5	112.3	D133 P224 R310	D133-R222 PolarHBondContact O-N 3.16Å; R222-P224 VanDerWaalsContact O-CD 3.3Å; R222-P224 WeakPolarHBondContact O-CD 3.03Å; R222-R310 WeakPolarHBondContact CA-O 2.97Å
223	T	39.6	Very low	37.4	Very low	1 Å²	1	32.8 Å²	32.8	1%	0.006	19%	0.185	C	C	.	.			trans	-108.7	96.8	171.3	66.6	0	0	0	0	111.6	T135 T174 T262 R310 T311 P312	T135-T223 WeakPolarHBondContact OG1-CG2 3.05Å; T174-T223 HydrophobicContact CG2-CG2 3.29Å; T223-T262 HydrophobicContact CG2-CG2 3.6Å; T223-T262 WeakPolarHBondContact OG1-CG2 3.31Å; T223-R310 PolarHBondContact N-O 3.27Å; T223-T311 WeakPolarHBondContact OG1-CG2 3.03Å; T223-P312 WeakPolarHBondContact O-CD 3.44Å
224	P	34.9	Very low	37	Very low	31 Å²	31	36.7 Å²	36.7	20%	0.201	21%	0.212	C	C	.	.			trans	-70.6	123.2	159.3	-5.4	22.6	0	0	0	108.7	A137 R222 P312	A137-P224 PolarHBondContact N-O 2.74Å; R222-P224 VanDerWaalsContact O-CD 3.3Å; R222-P224 WeakPolarHBondContact O-CD 3.03Å; P224-P312 WeakPolarHBondContact CA-O 3.34Å
225	A	34.5	Very low	36.3	Very low	1 Å²	1	38.7 Å²	38.7	1%	0.008	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	129.3	175.1	0	0	0	0	0	110.4	A137 F227 V260 P312 A313 T314	A137-A225 WeakPolarHBondContact O-CA 3.37Å; A225-F227 HydrophobicContact CB-CE2 3.87Å; A225-V260 HydrophobicContact CB-CG1 4.33Å; A225-V260 HydrophobicContact CB-CG2 3.64Å; A225-P312 PolarHBondContact N-O 2.04Å; A225-A313 WeakPolarHBondContact O-CA 3.43Å; A225-T314 PolarHBondContact O-N 2.66Å
226	T	36.4	Very low	35.7	Very low	54 Å²	54	43.1 Å²	43.1	33%	0.331	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	123.9	174.7	-54.9	0	0	0	0	109.2	A137 F139	A137-T226 PolarHBondContact O-N 2.94Å; A137-T226 VanDerWaalsContact O-N 3.16Å; F139-T226 PolarHBondContact N-O 2.82Å
227	F	35.2	Very low	34.8	Very low	3 Å²	3	47 Å²	47	1%	0.013	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	136.6	175.6	-61.9	-91.5	0	0	0	109.5	F139 E170 V172 A225 E258 V260 T314 F315 T316	F139-F227 HydrophobicContact CB-CD1 3.86Å; F139-F227 HydrophobicContact CB-CE1 4.2Å; F139-F227 AromaticContact CD2-CD1 3.86Å; F139-F227 HydrophobicContact CD2-CD1 3.86Å; F139-F227 AromaticContact CD2-CE1 3.36Å; F139-F227 HydrophobicContact CD2-CE1 3.36Å; F139-F227 AromaticContact CD2-CZ 3.99Å; F139-F227 HydrophobicContact CD2-CZ 3.99Å; F139-F227 AromaticContact CE2-CE1 3.94Å; F139-F227 HydrophobicContact CE2-CE1 3.94Å; F139-F227 HydrophobicContact CE2-CZ 4.27Å; F139-F227 HydrophobicContact CG-CD1 4.14Å; F139-F227 AromaticContact CG-CE1 3.96Å; F139-F227 HydrophobicContact CG-CE1 3.96Å; E170-F227 HydrophobicContact CB-CE1 4.09Å; E170-F227 WeakPolarHBondContact OE2-CD1 3.33Å; E170-F227 WeakPolarHBondContact OE2-CE1 3.06Å; V172-F227 HydrophobicContact CG2-CZ 4.34Å; A225-F227 HydrophobicContact CB-CE2 3.87Å; F227-E258 WeakPolarHBondContact CB-OE2 3.33Å; F227-E258 HydrophobicContact CD1-CG 4.21Å; F227-E258 WeakPolarHBondContact CD1-OE2 3.46Å; F227-E258 HydrophobicContact CE1-CB 4.49Å; F227-E258 HydrophobicContact CE1-CG 4.44Å; F227-E258 WeakPolarHBondContact CG-OE2 3.37Å; F227-V260 HydrophobicContact CE2-CG2 3.7Å; F227-V260 HydrophobicContact CZ-CG2 4.23Å; F227-T314 PolarHBondContact N-O 3.05Å; F227-F315 HydrophobicContact CB-CD1 4.04Å; F227-F315 HydrophobicContact CB-CE1 4.43Å; F227-F315 AromaticContact CD2-CD1 3.79Å; F227-F315 HydrophobicContact CD2-CD1 3.79Å; F227-F315 AromaticContact CD2-CE1 3.37Å; F227-F315 HydrophobicContact CD2-CE1 3.37Å; F227-F315 HydrophobicContact CD2-CZ 4.08Å; F227-F315 AromaticContact CE2-CE1 3.81Å; F227-F315 HydrophobicContact CE2-CE1 3.81Å; F227-F315 HydrophobicContact CE2-CZ 4.22Å; F227-F315 HydrophobicContact CG-CD1 4.19Å; F227-F315 HydrophobicContact CG-CE1 4.06Å; F227-T316 PolarHBondContact O-N 3.12Å
228	T	35.2	Very low	34.1	Very low	51 Å²	51	51.8 Å²	51.8	31%	0.313	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	117.6	178.8	-60.1	0	0	0	0	109.6	F139 S141	F139-T228 PolarHBondContact O-N 2.87Å; S141-T228 PolarHBondContact N-O 2.85Å
229	S	33.9	Very low	33.4	Very low	12 Å²	12	55.5 Å²	55.5	8%	0.084	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	128.2	-176.2	55.6	0	0	0	0	111.9	T316	S229-T316 PolarHBondContact N-O 3.12Å
230	T	34.4	Very low	32.4	Very low	62 Å²	62	61.8 Å²	61.8	38%	0.38	38%	0.382	S	S	.	.			trans	-131.1	102.8	175.6	24	0	0	0	0	109.7	S141 T142 P143 T318	S141-T230 PolarHBondContact O-N 3.1Å; T142-T230 WeakPolarHBondContact CG2-OG1 3.43Å; P143-T230 WeakPolarHBondContact CD-O 3.49Å; T230-T318 VanDerWaalsContact CG2-OG1 3.31Å; T230-T318 WeakPolarHBondContact CG2-OG1 3.45Å
231	P	32	Very low	31.5	Very low	60 Å²	60	67.8 Å²	67.8	39%	0.39	41%	0.411	S	S	.	.	P	Polyproline II helix	trans	-69.7	140.1	174.2	-15.8	32.3	0	0	0	110.9	T318	P231-T318 WeakPolarHBondContact CD-O 3.46Å
232	S	28.2	Very low	30.6	Very low	45 Å²	45	74.2 Å²	74.2	32%	0.315	45%	0.451	S	S	.	.	P	Polyproline II helix	trans	-69.4	148.2	-178.7	-3	0	0	0	0	112.6	P143 S320	P143-S232 WeakPolarHBondContact O-CB 3.48Å; P143-S232 PolarHBondContact O-OG 2.85Å; S232-S320 WeakPolarHBondContact O-CB 3.4Å
233	T	30.2	Very low	29.6	Very low	73 Å²	73	76.4 Å²	76.4	45%	0.448	47%	0.469	S	S	.	.	P	Polyproline II helix	trans	-78.7	144.3	173.4	47.8	0	0	0	0	111.3
234	S	28.6	Very low	28.8	Very low	91 Å²	91	82.7 Å²	82.7	64%	0.636	50%	0.503	S	S	*	.			trans	-112.5	100.5	176.7	61.3	0	0	0	0	111.1
235	T	28.1	Very low	28.2	Very low	101 Å²	101	90.4 Å²	90.4	62%	0.62	54%	0.536	S	S	*	.			trans	-93.2	107.5	171.4	51	0	0	0	0	110.1
236	S	27.6	Very low	27.6	Very low	96 Å²	96	95.5 Å²	95.5	67%	0.671	57%	0.568	S	S	*	*			trans	-108	99.2	-179.8	58.4	0	0	0	0	111.7	P238	S236-P238 WeakPolarHBondContact O-CD 3.5Å
237	T	23.7	Very low	26.9	Very low	116 Å²	116	97.8 Å²	97.8	71%	0.712	59%	0.586	S	S	*	*			trans	-93.1	109.2	168.3	48.6	0	0	0	0	109.7
238	P	26.4	Very low	26.4	Very low	101 Å²	101	103.1 Å²	103.1	66%	0.656	61%	0.614	S	S	*	*	P	Polyproline II helix	trans	-75.3	129.8	-179.8	30.3	-33.4	0	0	0	111.1	S236	S236-P238 WeakPolarHBondContact O-CD 3.5Å
239	T	24.6	Very low	26	Very low	129 Å²	129	104.8 Å²	104.8	79%	0.791	62%	0.624	S	S	*	*	P	Polyproline II helix	trans	-87.8	146.3	166	-50.2	0	0	0	0	108.9	L241	T239-L241 PolarHBondContact O-N 3.37Å
240	T	23	Very low	25.7	Very low	134 Å²	134	107.5 Å²	107.5	82%	0.822	64%	0.643	S	S	*	*	P	Polyproline II helix	trans	-55.9	123	-177.5	49.5	0	0	0	0	112.9
241	L	22.5	Very low	25.2	Very low	172 Å²	172	108.5 Å²	108.5	90%	0.901	65%	0.649	S	S	*	*			trans	-138.3	145.6	160.7	-142.8	81.2	0	0	0	108.9	T239	T239-L241 PolarHBondContact O-N 3.37Å
242	T	22.2	Very low	25.1	Very low	135 Å²	135	109.4 Å²	109.4	83%	0.828	66%	0.657	S	S	*	*			trans	-109.4	152.6	-177	-52.3	0	0	0	0	110.4
243	D	20.5	Very low	25	Very low	136 Å²	136	111.3 Å²	111.3	73%	0.727	67%	0.67	S	S	*	*			trans	102	131	163.8	-149	6.3	0	0	0	117.7
244	N	21.8	Very low	25.2	Very low	134 Å²	134	110.4 Å²	110.4	72%	0.717	67%	0.667	S	S	*	*	S	Bend	trans	23.4	110.7	175.3	-82.3	-67.7	0	0	0	122.8
245	Q	22.4	Very low	25.3	Very low	192 Å²	192	110.9 Å²	110.9	90%	0.897	66%	0.657	S	S	*	*			trans	56.4	100.2	144	-165.9	171.6	100.9	0	0	118
246	T	21.8	Very low	25.5	Very low	109 Å²	109	107.1 Å²	107.1	67%	0.669	63%	0.633	S	S	*	*			trans	-142.8	118.5	171.5	-54.9	0	0	0	0	112.4	L248	T246-L248 PolarHBondContact O-N 2.88Å
247	S	23	Very low	26.1	Very low	101 Å²	101	104.1 Å²	104.1	71%	0.706	61%	0.611	S	S	*	*			trans	-82	107.4	171.9	-63.6	0	0	0	0	111.3	T249	S247-T249 PolarHBondContact O-N 3.11Å; S247-T249 VanDerWaalsContact O-N 3.11Å
248	L	24.4	Very low	26.8	Very low	116 Å²	116	98.9 Å²	98.9	61%	0.607	58%	0.578	S	S	*	*			trans	-84.5	76.2	-178.8	-90.3	162.1	0	0	0	112.9	T246 S250	T246-L248 PolarHBondContact O-N 2.88Å; L248-S250 PolarHBondContact O-N 2.91Å
249	T	26.3	Very low	27.3	Very low	86 Å²	86	95.8 Å²	95.8	53%	0.528	56%	0.56	S	S	.	*			trans	-85.3	92.1	175.7	-45	0	0	0	0	111.7	S247 T251	S247-T249 PolarHBondContact O-N 3.11Å; S247-T249 VanDerWaalsContact O-N 3.11Å; T249-T251 WeakPolarHBondContact CG2-OG1 3.49Å; T249-T251 PolarHBondContact O-N 3.04Å; T249-T251 PolarHBondContact O-OG1 3.42Å
250	S	27.7	Very low	27.9	Very low	68 Å²	68	89.8 Å²	89.8	48%	0.476	52%	0.522	S	S	.	.			trans	-75.4	105.5	173.3	51.4	0	0	0	0	110.9	L248 T339	L248-S250 PolarHBondContact O-N 2.91Å; S250-T339 PolarHBondContact O-N 3.29Å; S250-T339 VanDerWaalsContact O-N 3.13Å
251	T	24.7	Very low	28.8	Very low	83 Å²	83	87.8 Å²	87.8	51%	0.509	50%	0.5	S	S	.	.			trans	-117.7	78.4	-174.7	-41.9	0	0	0	0	111.3	T249 S253	T249-T251 WeakPolarHBondContact CG2-OG1 3.49Å; T249-T251 PolarHBondContact O-N 3.04Å; T249-T251 PolarHBondContact O-OG1 3.42Å; T251-S253 PolarHBondContact O-N 3.34Å
252	S	28.5	Very low	29.6	Very low	79 Å²	79	79.6 Å²	79.6	55%	0.552	46%	0.457	S	S	*	.			trans	-79.8	100.3	170.6	48.3	0	0	0	0	109.8	S341	S252-S341 PolarHBondContact O-N 3.17Å
253	S	27.6	Very low	30.6	Very low	85 Å²	85	73.9 Å²	73.9	59%	0.594	42%	0.422	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.7	114.3	171.5	61.1	0	0	0	0	110.6	T251 S341	T251-S253 PolarHBondContact O-N 3.34Å; S253-S341 WeakPolarHBondContact CA-O 3.29Å
254	S	32.9	Very low	31.7	Very low	55 Å²	55	67.5 Å²	67.5	39%	0.385	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	125.6	172.6	59.8	0	0	0	0	109.6	S341 K343	S254-S341 PolarHBondContact N-O 2.92Å; S254-K343 PolarHBondContact O-N 3.01Å; S254-K343 VanDerWaalsContact O-N 3.08Å
255	K	31.6	Very low	32.8	Very low	100 Å²	100	62.7 Å²	62.7	44%	0.435	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	96.8	170.1	-173.4	-175.2	175.1	-175.5	0	108.4
256	L	33.4	Very low	33.9	Very low	22 Å²	22	53.5 Å²	53.5	12%	0.115	32%	0.32	C	S	.	.			trans	-90.6	145.5	169.1	-101.4	159.5	0	0	0	109.1	L168 E258 K343 L344 T345	L168-L256 HydrophobicContact CB-CD2 3.63Å; L168-L256 HydrophobicContact CB-CG 4.23Å; L256-E258 HydrophobicContact CD2-CG 4.2Å; L256-K343 PolarHBondContact N-O 2.94Å; L256-L344 HydrophobicContact CB-CD1 3.72Å; L256-L344 HydrophobicContact CD1-CD1 4.35Å; L256-T345 PolarHBondContact O-N 3.15Å
257	T	38.2	Very low	35	Very low	34 Å²	34	49.7 Å²	49.7	21%	0.209	30%	0.297	C	S	.	.			trans	-149.4	107.3	175.9	-59.9	0	0	0	0	107.1	T169 E170 T345	T169-T257 WeakPolarHBondContact CA-O 3.48Å; E170-T257 PolarHBondContact N-O 2.99Å; T257-T345 WeakPolarHBondContact CA-O 3.32Å
258	E	38.4	Very low	36.2	Very low	5 Å²	5	47.8 Å²	47.8	2%	0.023	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	136.2	-173.6	-64.5	174.3	-163	0	0	108.7	F227 L256 F315 T345 S347	F227-E258 WeakPolarHBondContact CB-OE2 3.33Å; F227-E258 HydrophobicContact CD1-CG 4.21Å; F227-E258 WeakPolarHBondContact CD1-OE2 3.46Å; F227-E258 HydrophobicContact CE1-CB 4.49Å; F227-E258 HydrophobicContact CE1-CG 4.44Å; F227-E258 WeakPolarHBondContact CG-OE2 3.37Å; L256-E258 HydrophobicContact CD2-CG 4.2Å; E258-F315 HydrophobicContact CB-CE1 3.98Å; E258-F315 VanDerWaalsContact OE2-CD1 3.28Å; E258-F315 WeakPolarHBondContact OE2-CD1 3.36Å; E258-F315 WeakPolarHBondContact OE2-CE1 3.42Å; E258-T345 PolarHBondContact N-O 2.95Å; E258-S347 PolarHBondContact O-N 2.69Å; E258-S347 PolarHBondContact O-OG 2.73Å
259	S	37	Very low	37.2	Very low	37 Å²	37	42.2 Å²	42.2	26%	0.259	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	125.5	-174.2	55.7	0	0	0	0	112.9	E170 S171 V172 S347	E170-S259 PolarHBondContact O-N 2.8Å; S171-S259 WeakPolarHBondContact CA-O 3.4Å; V172-S259 PolarHBondContact N-O 3.23Å; V172-S259 VanDerWaalsContact N-O 3.09Å; S259-S347 WeakPolarHBondContact CA-O 3.45Å
260	V	37.4	Very low	38.2	Very low	2 Å²	2	40.6 Å²	40.6	1%	0.012	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	122.4	173.9	-177	0	0	0	0	108	A225 F227 F315 S347 R349	A225-V260 HydrophobicContact CB-CG1 4.33Å; A225-V260 HydrophobicContact CB-CG2 3.64Å; F227-V260 HydrophobicContact CE2-CG2 3.7Å; F227-V260 HydrophobicContact CZ-CG2 4.23Å; V260-F315 HydrophobicContact CG2-CZ 4.43Å; V260-S347 PolarHBondContact N-O 2.94Å; V260-R349 PolarHBondContact O-N 3.13Å
261	R	41.8	Very low	39.1	Very low	93 Å²	93	37.4 Å²	37.4	35%	0.351	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137	111	177.4	-178.1	179.7	172	169	-0.2	112.9	V172 R173 T263 R349	V172-R261 PolarHBondContact O-N 3.3Å; R173-R261 WeakPolarHBondContact CA-O 3.31Å; R261-T263 PolarHBondContact NE-OG1 2.94Å; R261-R349 VanDerWaalsContact CA-O 3.29Å; R261-R349 WeakPolarHBondContact CA-O 3.42Å
262	T	39.5	Very low	40.3	Very low	0 Å²	0	35 Å²	35	0%	0	20%	0.204	C	C	.	.			trans	-90.1	164.5	160.6	57	0	0	0	0	110.3	T174 T223 D309 T311 R349 T350	T174-T262 WeakPolarHBondContact OG1-CG2 3.42Å; T223-T262 HydrophobicContact CG2-CG2 3.6Å; T223-T262 WeakPolarHBondContact OG1-CG2 3.31Å; T262-D309 WeakPolarHBondContact CB-OD1 3.25Å; T262-D309 VanDerWaalsContact OG1-CG 3.25Å; T262-D309 PolarHBondContact OG1-OD1 2.88Å; T262-D309 PolarHBondContact OG1-OD2 3.03Å; T262-T311 HydrophobicContact CG2-CG2 3.22Å; T262-T311 WeakPolarHBondContact OG1-CG2 3.38Å; T262-R349 PolarHBondContact N-O 3.03Å; T262-T350 WeakPolarHBondContact OG1-CG2 3.3Å
263	T	43.2	Very low	41.2	Very low	15 Å²	15	31.4 Å²	31.4	9%	0.092	18%	0.179	C	C	.	.			trans	-160.2	94.9	174.1	-67.8	0	0	0	0	106.6	R261 V265	R261-T263 PolarHBondContact NE-OG1 2.94Å; T263-V265 HydrophobicContact CG2-CG2 3.54Å
264	S	44	Very low	42	Very low	1 Å²	1	29.6 Å²	29.6	1%	0.007	16%	0.164	C	C	.	.	B	Isolated β-bridge	trans	-96.3	115.2	179.4	-175.5	0	0	0	0	109.7	T351 S352 V353	S264-T351 PolarHBondContact N-O 3.04Å; S264-S352 WeakPolarHBondContact O-CA 3.25Å; S264-V353 PolarHBondContact O-N 3.16Å; S264-V353 VanDerWaalsContact O-N 3.11Å
265	V	45.1	Very low	42.5	Very low	33 Å²	33	27 Å²	27	20%	0.2	15%	0.146	C	C	.	.			trans	-136.7	78.2	-170.8	-168.4	0	0	0	0	110	S176 V177 T263 T267 V353	S176-V265 PolarHBondContact O-N 3.22Å; V177-V265 VanDerWaalsContact CG1-O 3.24Å; V177-V265 WeakPolarHBondContact CG1-O 3.38Å; T263-V265 HydrophobicContact CG2-CG2 3.54Å; V265-T267 HydrophobicContact CG1-CG2 3.67Å; V265-T267 PolarHBondContact O-N 2.87Å; V265-V353 HydrophobicContact CG1-CB 4.48Å; V265-V353 WeakPolarHBondContact CG1-O 3.3Å
266	P	45.4	Very low	43.1	Very low	0 Å²	0	24.1 Å²	24.1	0%	0	14%	0.141	C	C	.	.			trans	-67.8	124.4	170.2	-13.4	29.2	0	0	0	109.4	P178 T219 I269 T307 P354 T355	P178-P266 WeakPolarHBondContact O-CA 3.5Å; T219-P266 HydrophobicContact CG2-CG 4.33Å; P266-I269 HydrophobicContact CB-CD1 3.88Å; P266-T307 HydrophobicContact CG-CG2 3.96Å; P266-P354 WeakPolarHBondContact O-CA 3.48Å; P266-T355 PolarHBondContact O-N 2.94Å; P266-T355 VanDerWaalsContact O-N 3.08Å
267	T	44.7	Very low	44	Very low	28 Å²	28	23.4 Å²	23.4	17%	0.172	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	148.9	179.8	72	0	0	0	0	113.1	P178 T179 N180 V265 T355	P178-T267 PolarHBondContact O-N 2.98Å; P178-T267 VanDerWaalsContact O-N 3.09Å; T179-T267 WeakPolarHBondContact CA-O 3.43Å; T179-T267 WeakPolarHBondContact CG2-OG1 3.4Å; N180-T267 PolarHBondContact N-O 3.43Å; V265-T267 HydrophobicContact CG1-CG2 3.67Å; V265-T267 PolarHBondContact O-N 2.87Å; T267-T355 WeakPolarHBondContact CA-O 3.41Å; T267-T355 WeakPolarHBondContact CG2-OG1 3.11Å
268	N	49.3	Very low	44.6	Very low	61 Å²	61	24.4 Å²	24.4	33%	0.326	14%	0.141	S	C	.	.	E	Extended strand (participates in β ladder)	trans	55.3	57.6	179.2	-53.2	-20.3	0	0	0	111.8	N180 I181 T355 N356	N180-N268 WeakPolarHBondContact CA-O 3.3Å; N180-N268 WeakPolarHBondContact OD1-CB 3.47Å; N180-N268 PolarHBondContact OD1-ND2 3.37Å; I181-N268 PolarHBondContact N-O 3.43Å; N268-T355 PolarHBondContact N-O 3.13Å; N268-N356 WeakPolarHBondContact CA-O 3.14Å; N268-N356 WeakPolarHBondContact OD1-CB 3.18Å; N268-N356 PolarHBondContact OD1-ND2 2.89Å
269	I	45.2	Very low	45.4	Very low	0 Å²	0	24.1 Å²	24.1	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	118	171.5	-59.7	179.8	0	0	0	107.9	I181 I217 P266 T271 I305 N356 I357 T358	I181-I269 HydrophobicContact CB-CG1 4.43Å; I181-I269 WeakPolarHBondContact O-CA 3.46Å; I217-I269 HydrophobicContact CD1-CG2 3.69Å; P266-I269 HydrophobicContact CB-CD1 3.88Å; I269-T271 HydrophobicContact CG2-CG2 4.02Å; I269-I305 HydrophobicContact CG2-CD1 4.15Å; I269-N356 PolarHBondContact N-O 2.9Å; I269-I357 HydrophobicContact CB-CG1 4.43Å; I269-I357 WeakPolarHBondContact O-CA 3.29Å; I269-T358 PolarHBondContact O-N 2.94Å
270	T	46.6	Very low	46.1	Very low	51 Å²	51	23.5 Å²	23.5	31%	0.313	14%	0.136	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	115.4	175.9	-55.9	0	0	0	0	109.8	I181 T182 T183 T358	I181-T270 PolarHBondContact O-N 3.17Å; T182-T270 WeakPolarHBondContact CA-O 3.45Å; T183-T270 PolarHBondContact N-O 3.19Å; T270-T358 WeakPolarHBondContact CA-O 3.37Å
271	T	46.2	Very low	46.8	Very low	2 Å²	2	23.7 Å²	23.7	1%	0.012	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	117.9	176.3	67.6	0	0	0	0	109.5	T183 T215 I217 I269 T303 T358 T359 S360	T183-T271 WeakPolarHBondContact O-CA 3.35Å; T183-T271 WeakPolarHBondContact OG1-CB 3.49Å; T183-T271 WeakPolarHBondContact OG1-CG2 3.39Å; T215-T271 HydrophobicContact CG2-CG2 4.33Å; I217-T271 HydrophobicContact CD1-CG2 4.07Å; I269-T271 HydrophobicContact CG2-CG2 4.02Å; T271-T303 HydrophobicContact CG2-CG2 4.13Å; T271-T358 PolarHBondContact N-O 2.9Å; T271-T359 WeakPolarHBondContact O-CA 3.37Å; T271-T359 WeakPolarHBondContact OG1-CB 3.44Å; T271-T359 WeakPolarHBondContact OG1-CG2 3.17Å; T271-S360 PolarHBondContact O-N 3.02Å
272	S	49.5	Very low	47.4	Very low	33 Å²	33	21.8 Å²	21.8	23%	0.231	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	132.2	177.6	56.6	0	0	0	0	112	T183 S184 S185 S360	T183-S272 PolarHBondContact O-N 3.38Å; S184-S272 WeakPolarHBondContact CA-O 3.33Å; S185-S272 PolarHBondContact N-O 2.84Å; S272-S360 WeakPolarHBondContact CA-O 3.26Å; S272-S360 WeakPolarHBondContact CB-OG 3.48Å
273	S	48.2	Very low	48.1	Very low	3 Å²	3	21.9 Å²	21.9	2%	0.021	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	126.9	166.4	-84.8	0	0	0	0	110	S185 T212 S360 S361 T362	S185-S273 WeakPolarHBondContact O-CA 3.37Å; T212-S273 VanDerWaalsContact OG1-CB 3.29Å; T212-S273 WeakPolarHBondContact OG1-CB 3.04Å; T212-S273 PolarHBondContact OG1-OG 3.24Å; S273-S360 PolarHBondContact N-O 3.01Å; S273-S361 WeakPolarHBondContact O-CA 3.38Å; S273-T362 PolarHBondContact O-N 3.01Å
274	T	44.5	Very low	48.5	Very low	46 Å²	46	23.7 Å²	23.7	28%	0.282	15%	0.149	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	122.4	178.7	-56.4	0	0	0	0	109.7	S185 T186 V187 T362	S185-T274 PolarHBondContact O-N 3.19Å; T186-T274 WeakPolarHBondContact CA-O 3.34Å; V187-T274 PolarHBondContact N-O 3.37Å; T274-T362 WeakPolarHBondContact CA-O 3.41Å
275	V	42.6	Very low	48.9	Very low	0 Å²	0	26.7 Å²	26.7	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	117.2	168.7	176.1	0	0	0	0	107.5	V187 T212 T277 S299 T300 T362 V363 A364	V187-V275 HydrophobicContact CB-CG2 4.41Å; V187-V275 WeakPolarHBondContact O-CA 3.41Å; T212-V275 HydrophobicContact CG2-CG2 3.87Å; V275-T277 HydrophobicContact CG1-CG2 3.58Å; V275-S299 WeakPolarHBondContact CG2-O 3.49Å; V275-T300 HydrophobicContact CG2-CG2 4.12Å; V275-T362 PolarHBondContact N-O 3.13Å; V275-V363 HydrophobicContact CB-CG2 4.4Å; V275-V363 WeakPolarHBondContact O-CA 3.25Å; V275-A364 PolarHBondContact O-N 3.24Å
276	A	45.9	Very low	49.2	Very low	40 Å²	40	25.2 Å²	25.2	33%	0.331	15%	0.154	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	109	-178.7	0	0	0	0	0	109.1	V187 A188 T189 A364	V187-A276 PolarHBondContact O-N 3.29Å; A188-A276 WeakPolarHBondContact CA-O 3.38Å; T189-A276 PolarHBondContact N-O 3.22Å; A276-A364 WeakPolarHBondContact CA-O 3.35Å
277	T	50.4	Low	49.6	Very low	7 Å²	7	27.9 Å²	27.9	4%	0.043	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	136.8	-167.8	68.6	0	0	0	0	112.8	T189 V275 Q296 S298 A364 T365 N366	T189-T277 WeakPolarHBondContact O-CA 3.28Å; T189-T277 WeakPolarHBondContact OG1-CG2 3.42Å; V275-T277 HydrophobicContact CG1-CG2 3.58Å; T277-Q296 PolarHBondContact O-NE2 3.45Å; T277-Q296 PolarHBondContact OG1-NE2 2.04Å; T277-S298 WeakPolarHBondContact CG2-OG 3.37Å; T277-S298 PolarHBondContact OG1-OG 3.42Å; T277-A364 PolarHBondContact N-O 2.85Å; T277-T365 WeakPolarHBondContact O-CA 3.31Å; T277-T365 WeakPolarHBondContact OG1-CG2 3.43Å; T277-N366 PolarHBondContact O-N 3.5Å
278	N	52.6	Low	50.3	Low	55 Å²	55	28.6 Å²	28.6	29%	0.294	17%	0.173	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	132.8	176	-166.8	21.4	0	0	0	110.2	T189 N190 T191 Q208 N366	T189-N278 PolarHBondContact O-N 2.96Å; N190-N278 WeakPolarHBondContact CA-O 3.48Å; T191-N278 PolarHBondContact N-O 2.98Å; Q208-N278 PolarHBondContact NE2-O 3.02Å; N278-N366 WeakPolarHBondContact CA-O 3.4Å
279	T	54.5	Low	50.7	Low	0 Å²	0	29.2 Å²	29.2	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	129.5	173.7	-52.7	0	0	0	0	108.8	T191 T206 Q208 T294 Q296 N366 T367 S368	T191-T279 WeakPolarHBondContact O-CA 3.29Å; T206-T279 HydrophobicContact CG2-CG2 3.65Å; Q208-T279 PolarHBondContact OE1-OG1 3.02Å; T279-T294 HydrophobicContact CG2-CG2 3.52Å; T279-Q296 PolarHBondContact OG1-NE2 3.41Å; T279-Q296 VanDerWaalsContact OG1-NE2 3.13Å; T279-N366 PolarHBondContact N-O 2.84Å; T279-T367 WeakPolarHBondContact O-CA 3.24Å; T279-S368 PolarHBondContact O-N 3.23Å
280	S	50.9	Low	51.3	Low	23 Å²	23	29.2 Å²	29.2	16%	0.161	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	132.2	-176	54.3	0	0	0	0	113.3	T191 S192 A193 S368	T191-S280 PolarHBondContact O-N 3.38Å; T191-S280 PolarHBondContact O-OG 3.09Å; S192-S280 WeakPolarHBondContact CA-O 3.46Å; A193-S280 PolarHBondContact N-O 3.36Å; S280-S368 WeakPolarHBondContact CA-O 3.38Å
281	A	52.1	Low	51.9	Low	7 Å²	7	29.1 Å²	29.1	6%	0.058	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	125.2	174.6	0	0	0	0	0	110	F292 S368 T370	A281-F292 HydrophobicContact CB-CD1 4.5Å; A281-S368 PolarHBondContact N-O 3.16Å; A281-T370 PolarHBondContact O-N 2.97Å
282	T	55.3	Low	52.5	Low	52 Å²	52	29.4 Å²	29.4	32%	0.319	18%	0.181	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	121	-178.2	-58.9	0	0	0	0	111.7	A193 T194 V195 T370	A193-T282 PolarHBondContact O-N 3.03Å; T194-T282 WeakPolarHBondContact CA-O 3.45Å; V195-T282 PolarHBondContact N-O 3.01Å; T282-T370 WeakPolarHBondContact CA-O 3.47Å
283	V	53.7	Low	52.8	Low	3 Å²	3	30.8 Å²	30.8	2%	0.018	19%	0.186	C	C	.	.			trans	-132.3	106.4	177.7	-179.6	0	0	0	0	109.6	V195 V198 F204 Q285 V286 F292 T370 V371 P372	V195-V283 HydrophobicContact CB-CG2 4.47Å; V198-V283 HydrophobicContact CG2-CG1 4.06Å; F204-V283 HydrophobicContact CE2-CG2 4.24Å; F204-V283 HydrophobicContact CZ-CG2 4.3Å; V283-Q285 PolarHBondContact O-N 3.04Å; V283-V286 HydrophobicContact CB-CG2 4.4Å; V283-V286 HydrophobicContact CG1-CG2 3.64Å; V283-F292 HydrophobicContact CB-CZ 4.18Å; V283-F292 HydrophobicContact CG2-CE1 3.72Å; V283-F292 HydrophobicContact CG2-CZ 3.75Å; V283-T370 PolarHBondContact N-O 2.97Å; V283-V371 HydrophobicContact CB-CG2 4.49Å; V283-P372 WeakPolarHBondContact O-CD 3.23Å
284	P	51.5	Low	53.2	Low	52 Å²	52	30.8 Å²	30.8	34%	0.338	19%	0.186	S	C	.	.	S	Bend	trans	-59.1	-37.5	-173.8	-29.4	37.7	0	0	0	116.4	V195 P196 P372	V195-P284 WeakPolarHBondContact O-CD 3.3Å; P196-P284 WeakPolarHBondContact O-CB 3.48Å; P196-P284 WeakPolarHBondContact O-CD 3.2Å; P284-P372 WeakPolarHBondContact O-CB 3.45Å; P284-P372 WeakPolarHBondContact O-CD 3.32Å
285	Q	51.8	Low	53.6	Low	65 Å²	65	30.2 Å²	30.2	30%	0.304	18%	0.184	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	139	175.1	-76.2	-167.3	-42	0	0	113.1	Q197 V198 V283 Q373	Q197-Q285 HydrophobicContact CG-CB 4.49Å; Q197-Q285 VanDerWaalsContact NE2-OE1 3.13Å; V198-Q285 PolarHBondContact N-O 3.27Å; V283-Q285 PolarHBondContact O-N 3.04Å; Q285-Q373 HydrophobicContact CG-CB 4.48Å
286	V	52.5	Low	54.3	Low	1 Å²	1	30.3 Å²	30.3	1%	0.006	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	118.7	179	175.3	0	0	0	0	110.6	V283 T288 T290 V371 Q373 N375	V283-V286 HydrophobicContact CB-CG2 4.4Å; V283-V286 HydrophobicContact CG1-CG2 3.64Å; V286-T288 WeakPolarHBondContact CG1-O 3.41Å; V286-T290 WeakPolarHBondContact CG1-OG1 3.29Å; V286-V371 HydrophobicContact CG2-CG1 3.87Å; V286-Q373 PolarHBondContact N-O 2.87Å; V286-N375 PolarHBondContact O-N 3.48Å; V286-N375 VanDerWaalsContact O-N 3.14Å
287	N	54.6	Low	54.5	Low	57 Å²	57	31.3 Å²	31.3	31%	0.305	19%	0.186	S	C	.	.			trans	-92.9	-29	-179.2	-75.7	-37.4	0	0	0	114.3	V198 N199 N375 T376	V198-N287 PolarHBondContact O-N 2.82Å; N199-N287 PolarHBondContact OD1-ND2 2.73Å; N287-N375 PolarHBondContact OD1-ND2 3.34Å; N287-T376 PolarHBondContact O-OG1 3.04Å
288	T	58.5	Low	54.4	Low	43 Å²	43	31 Å²	31	26%	0.264	18%	0.184	S	C	.	.	S	Bend	trans	-133.7	167	-173.1	53.1	0	0	0	0	112.1	N199 T200 T201 V286 T290 T376	N199-T288 WeakPolarHBondContact O-CG2 3.47Å; T200-T288 WeakPolarHBondContact CA-OG1 3.39Å; T200-T288 PolarHBondContact N-OG1 2.91Å; T200-T288 PolarHBondContact O-OG1 3.17Å; T201-T288 PolarHBondContact N-OG1 2.89Å; V286-T288 WeakPolarHBondContact CG1-O 3.41Å; T288-T290 PolarHBondContact O-N 2.99Å; T288-T290 PolarHBondContact O-OG1 3.09Å; T288-T376 VanDerWaalsContact C-OG1 3.32Å; T288-T376 WeakPolarHBondContact CA-OG1 3.42Å
289	T	57	Low	54.3	Low	73 Å²	73	30.1 Å²	30.1	45%	0.448	18%	0.183	S	C	.	.			trans	-40.6	119.5	-179.1	-48.5	0	0	0	0	113.8	T201 T376 T377	T201-T289 WeakPolarHBondContact CA-O 3.37Å; T289-T376 PolarHBondContact N-OG1 3.45Å; T289-T377 VanDerWaalsContact CA-O 3.29Å; T289-T377 WeakPolarHBondContact CA-O 3.38Å
290	T	58.5	Low	53.8	Low	1 Å²	1	30.5 Å²	30.5	1%	0.006	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	138.4	-178	-60.7	0	0	0	0	110.2	T202 F204 V286 T288 F292 T377 T378 S379	T202-T290 WeakPolarHBondContact O-CA 3.4Å; F204-T290 HydrophobicContact CD2-CG2 4.24Å; F204-T290 HydrophobicContact CE2-CG2 4.21Å; V286-T290 WeakPolarHBondContact CG1-OG1 3.29Å; T288-T290 PolarHBondContact O-N 2.99Å; T288-T290 PolarHBondContact O-OG1 3.09Å; T290-F292 HydrophobicContact CG2-CD2 4.14Å; T290-F292 HydrophobicContact CG2-CE1 4.44Å; T290-F292 HydrophobicContact CG2-CE2 3.51Å; T290-F292 HydrophobicContact CG2-CZ 3.69Å; T290-T377 PolarHBondContact N-O 3.42Å; T290-T378 WeakPolarHBondContact O-CA 3.12Å; T290-S379 PolarHBondContact O-N 3.4Å; T290-S379 VanDerWaalsContact O-N 3.15Å
291	S	58.6	Low	53.3	Low	49 Å²	49	29.9 Å²	29.9	34%	0.343	18%	0.182	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	128.2	175.8	59.6	0	0	0	0	110.4	T202 F204 S379	T202-S291 PolarHBondContact O-N 3.02Å; F204-S291 PolarHBondContact N-O 2.93Å; S291-S379 WeakPolarHBondContact CA-O 3.33Å
292	F	58.9	Low	52.9	Low	7 Å²	7	32.3 Å²	32.3	3%	0.031	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	120.4	168.9	-59.5	-89.5	0	0	0	108	F204 A281 V283 T290 V371 T378 S379 F380 D381	F204-F292 HydrophobicContact CB-CD1 3.85Å; F204-F292 HydrophobicContact CB-CE1 4.31Å; F204-F292 AromaticContact CD2-CD1 3.69Å; F204-F292 HydrophobicContact CD2-CD1 3.69Å; F204-F292 AromaticContact CD2-CE1 3.33Å; F204-F292 HydrophobicContact CD2-CE1 3.33Å; F204-F292 HydrophobicContact CD2-CZ 4.03Å; F204-F292 AromaticContact CE2-CE1 3.82Å; F204-F292 HydrophobicContact CE2-CE1 3.82Å; F204-F292 HydrophobicContact CE2-CZ 4.21Å; F204-F292 HydrophobicContact CG-CD1 4.03Å; F204-F292 AromaticContact CG-CE1 3.96Å; F204-F292 HydrophobicContact CG-CE1 3.96Å; A281-F292 HydrophobicContact CB-CD1 4.5Å; V283-F292 HydrophobicContact CB-CZ 4.18Å; V283-F292 HydrophobicContact CG2-CE1 3.72Å; V283-F292 HydrophobicContact CG2-CZ 3.75Å; T290-F292 HydrophobicContact CG2-CD2 4.14Å; T290-F292 HydrophobicContact CG2-CE1 4.44Å; T290-F292 HydrophobicContact CG2-CE2 3.51Å; T290-F292 HydrophobicContact CG2-CZ 3.69Å; F292-V371 HydrophobicContact CE2-CG2 3.94Å; F292-V371 HydrophobicContact CZ-CG2 3.98Å; F292-T378 HydrophobicContact CD2-CG2 4.29Å; F292-T378 HydrophobicContact CE2-CG2 4.16Å; F292-S379 PolarHBondContact N-O 3.4Å; F292-F380 HydrophobicContact CB-CD1 3.9Å; F292-F380 HydrophobicContact CB-CE1 4.4Å; F292-F380 AromaticContact CD2-CD1 3.62Å; F292-F380 HydrophobicContact CD2-CD1 3.62Å; F292-F380 AromaticContact CD2-CE1 3.32Å; F292-F380 HydrophobicContact CD2-CE1 3.32Å; F292-F380 HydrophobicContact CD2-CZ 4.04Å; F292-F380 HydrophobicContact CE2-CD1 4.47Å; F292-F380 AromaticContact CE2-CE1 3.73Å; F292-F380 HydrophobicContact CE2-CE1 3.73Å; F292-F380 HydrophobicContact CE2-CZ 4.15Å; F292-F380 AromaticContact CG-CD1 4Å; F292-F380 HydrophobicContact CG-CD1 4Å; F292-F380 AromaticContact CG-CE1 3.99Å; F292-F380 HydrophobicContact CG-CE1 3.99Å; F292-D381 PolarHBondContact O-N 3.39Å
293	D	56.6	Low	52.3	Low	62 Å²	62	30.1 Å²	30.1	33%	0.332	18%	0.179	S	C	.	.			trans	-102.7	142.2	158	-161.6	-30	0	0	0	107.1	F204 T206	F204-D293 PolarHBondContact O-N 2.88Å; T206-D293 PolarHBondContact N-O 3.46Å
294	T	56.3	Low	51.8	Low	4 Å²	4	31.6 Å²	31.6	3%	0.025	19%	0.185	C	C	.	.			trans	-150.6	111.8	176.4	-58.5	0	0	0	0	109.1	T206 T279 T367 D381 T382 S383	T206-T294 WeakPolarHBondContact O-CA 3.35Å; T279-T294 HydrophobicContact CG2-CG2 3.52Å; T294-T367 HydrophobicContact CG2-CG2 3.47Å; T294-T367 VanDerWaalsContact CG2-CG2 3.47Å; T294-D381 PolarHBondContact N-O 3.29Å; T294-T382 WeakPolarHBondContact O-CA 3.44Å; T294-S383 PolarHBondContact O-N 3.2Å
295	S	53.5	Low	51.4	Low	34 Å²	34	29.1 Å²	29.1	24%	0.238	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	131.6	-172.9	59.2	0	0	0	0	111.6	T206 S207 Q208 S383	T206-S295 PolarHBondContact O-N 3.18Å; S207-S295 WeakPolarHBondContact CA-O 3.4Å; S207-S295 WeakPolarHBondContact CB-OG 3.38Å; Q208-S295 PolarHBondContact N-O 3.18Å; S295-S383 WeakPolarHBondContact CA-O 3.23Å; S295-S383 WeakPolarHBondContact CB-OG 3.47Å
296	Q	56.1	Low	51	Low	2 Å²	2	28.5 Å²	28.5	1%	0.009	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	120.1	-178.1	-167.3	179.5	49.6	0	0	111.1	Q208 T277 T279 N366 T367 S383 Q384 T385	Q208-Q296 HydrophobicContact CB-CG 4.43Å; Q208-Q296 WeakPolarHBondContact O-CA 3.48Å; T277-Q296 PolarHBondContact O-NE2 3.45Å; T277-Q296 PolarHBondContact OG1-NE2 2.04Å; T279-Q296 PolarHBondContact OG1-NE2 3.41Å; T279-Q296 VanDerWaalsContact OG1-NE2 3.13Å; Q296-N366 PolarHBondContact NE2-O 3.17Å; Q296-N366 PolarHBondContact OE1-O 2.95Å; Q296-T367 PolarHBondContact OE1-OG1 2.99Å; Q296-S383 PolarHBondContact N-O 3.29Å; Q296-Q384 HydrophobicContact CB-CG 4.39Å; Q296-Q384 WeakPolarHBondContact O-CA 3.41Å; Q296-T385 PolarHBondContact O-N 3.47Å
297	T	51.7	Low	50.6	Low	61 Å²	61	28.4 Å²	28.4	37%	0.374	17%	0.165	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	120.9	176.5	-61.6	0	0	0	0	110.2	Q208 T209 S210 T385	Q208-T297 PolarHBondContact O-N 3.11Å; T209-T297 WeakPolarHBondContact CA-O 3.5Å; S210-T297 PolarHBondContact N-O 3.31Å; T297-T385 WeakPolarHBondContact CA-O 3.25Å
298	S	48.4	Very low	50.1	Low	0 Å²	0	27.9 Å²	27.9	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	127	-177.4	-74.3	0	0	0	0	112.4	S210 T277 T385 S386 S387	S210-S298 WeakPolarHBondContact O-CA 3.42Å; T277-S298 WeakPolarHBondContact CG2-OG 3.37Å; T277-S298 PolarHBondContact OG1-OG 3.42Å; S298-T385 PolarHBondContact N-O 2.86Å; S298-S386 WeakPolarHBondContact O-CA 3.35Å; S298-S387 PolarHBondContact O-N 3.5Å
299	S	48.7	Very low	49.4	Very low	37 Å²	37	25.9 Å²	25.9	26%	0.259	15%	0.152	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	138.3	-176.9	60.6	0	0	0	0	114.9	S210 S211 T212 V275 S387	S210-S299 PolarHBondContact O-N 3.23Å; S211-S299 VanDerWaalsContact CA-O 3.23Å; S211-S299 WeakPolarHBondContact CA-O 3.41Å; T212-S299 PolarHBondContact N-O 3.18Å; T212-S299 VanDerWaalsContact N-O 3.13Å; V275-S299 WeakPolarHBondContact CG2-O 3.49Å; S299-S387 VanDerWaalsContact CA-O 3.27Å; S299-S387 WeakPolarHBondContact CA-O 3.32Å; S299-S387 WeakPolarHBondContact CB-OG 3.45Å
300	T	44.6	Very low	48.7	Very low	8 Å²	8	26.6 Å²	26.6	5%	0.049	15%	0.146	C	C	.	.	P	Polyproline II helix	trans	-89.9	143.4	167.9	65	0	0	0	0	112.2	T212 V275 S361 V363 S387 T388 G389	T212-T300 WeakPolarHBondContact OG1-CA 3.31Å; V275-T300 HydrophobicContact CG2-CG2 4.12Å; T300-S361 VanDerWaalsContact OG1-CB 3.24Å; T300-S361 WeakPolarHBondContact OG1-CB 3.24Å; T300-S361 PolarHBondContact OG1-OG 2.99Å; T300-V363 HydrophobicContact CG2-CG2 3.9Å; T300-S387 PolarHBondContact N-O 2.04Å; T300-S387 VanDerWaalsContact N-O 3.12Å; T300-T388 WeakPolarHBondContact OG1-CA 3.3Å; T300-G389 WeakPolarHBondContact O-CA 3.47Å; T300-G389 PolarHBondContact O-N 3.35Å; T300-G389 VanDerWaalsContact O-N 3.09Å; T300-G389 PolarHBondContact OG1-N 3.3Å
301	G	40.9	Very low	47.9	Very low	9 Å²	9	26.5 Å²	26.5	9%	0.093	15%	0.146	C	C	.	.	P	Polyproline II helix	trans	-65.3	152	174.2	0	0	0	0	0	113.1	T212	T212-G301 WeakPolarHBondContact O-CA 3.33Å; T212-G301 PolarHBondContact O-N 3.41Å; T212-G301 VanDerWaalsContact O-N 3.1Å; T212-G301 PolarHBondContact OG1-N 2.84Å
302	Q	44.2	Very low	46.9	Very low	58 Å²	58	25.7 Å²	25.7	27%	0.271	14%	0.139	S	C	.	.	P	Polyproline II helix	trans	-69.2	148.1	176.9	-56.2	-173.9	106	0	0	111.6	Q214 T215 Q390	Q214-Q302 WeakPolarHBondContact CA-O 3.45Å; Q214-Q302 HydrophobicContact CG-CB 4.46Å; T215-Q302 PolarHBondContact N-O 3.38Å; Q302-Q390 WeakPolarHBondContact CA-O 3.4Å; Q302-Q390 HydrophobicContact CG-CB 4.48Å
303	T	42.4	Very low	45.9	Very low	7 Å²	7	25.4 Å²	25.4	4%	0.043	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	125	173.7	-62.7	0	0	0	0	110	T215 T271 I305 T359 Q390 T391 Q392	T215-T303 WeakPolarHBondContact O-CA 3.41Å; T271-T303 HydrophobicContact CG2-CG2 4.13Å; T303-I305 HydrophobicContact CG2-CG1 4.31Å; T303-T359 HydrophobicContact CG2-CG2 4.18Å; T303-Q390 PolarHBondContact N-O 2.7Å; T303-T391 WeakPolarHBondContact O-CA 3.42Å; T303-Q392 PolarHBondContact O-N 3.21Å
304	Q	43.7	Very low	45	Very low	33 Å²	33	25 Å²	25	15%	0.154	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	124	176.5	-55.7	-166.8	98.3	0	0	111	T215 Q216 I217 F306 Q392	T215-Q304 PolarHBondContact O-N 2.97Å; Q216-Q304 WeakPolarHBondContact CA-O 3.42Å; Q216-Q304 HydrophobicContact CG-CB 4.49Å; I217-Q304 PolarHBondContact N-O 2.6Å; Q304-F306 HydrophobicContact CB-CD2 4.28Å; Q304-F306 HydrophobicContact CB-CE2 3.59Å; Q304-F306 HydrophobicContact CB-CZ 4.25Å; Q304-Q392 WeakPolarHBondContact CA-O 3.43Å; Q304-Q392 HydrophobicContact CG-CB 4.49Å
305	I	42.5	Very low	44.2	Very low	1 Å²	1	25 Å²	25	1%	0.005	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	117.5	178.1	-58	174.6	0	0	0	108.3	I269 T303 T307 I357 T359 Q392 F394	I269-I305 HydrophobicContact CG2-CD1 4.15Å; T303-I305 HydrophobicContact CG2-CG1 4.31Å; I305-T307 HydrophobicContact CG2-CG2 4.1Å; I305-I357 HydrophobicContact CD1-CD1 4.42Å; I305-I357 HydrophobicContact CD1-CG2 3.66Å; I305-T359 HydrophobicContact CD1-CG2 4.43Å; I305-Q392 PolarHBondContact N-O 3.43Å; I305-F394 PolarHBondContact O-N 3.14Å
306	F	43.5	Very low	43.4	Very low	51 Å²	51	25.6 Å²	25.6	22%	0.224	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	116.6	178.7	-63.4	-89.3	0	0	0	109.7	I217 F218 T219 Q304 F394	I217-F306 PolarHBondContact O-N 2.92Å; F218-F306 HydrophobicContact CD1-CB 3.75Å; F218-F306 AromaticContact CD1-CD2 3.59Å; F218-F306 HydrophobicContact CD1-CD2 3.59Å; F218-F306 HydrophobicContact CD1-CE2 4.42Å; F218-F306 AromaticContact CD1-CG 3.86Å; F218-F306 HydrophobicContact CD1-CG 3.86Å; F218-F306 HydrophobicContact CE1-CB 4.18Å; F218-F306 AromaticContact CE1-CD2 3.21Å; F218-F306 HydrophobicContact CE1-CD2 3.21Å; F218-F306 AromaticContact CE1-CE2 3.6Å; F218-F306 HydrophobicContact CE1-CE2 3.6Å; F218-F306 AromaticContact CE1-CG 3.75Å; F218-F306 HydrophobicContact CE1-CG 3.75Å; F218-F306 HydrophobicContact CE1-CZ 4.43Å; F218-F306 HydrophobicContact CG-CD2 4.44Å; F218-F306 AromaticContact CZ-CD2 3.81Å; F218-F306 HydrophobicContact CZ-CD2 3.81Å; F218-F306 AromaticContact CZ-CE2 3.87Å; F218-F306 HydrophobicContact CZ-CE2 3.87Å; T219-F306 PolarHBondContact N-O 2.87Å; Q304-F306 HydrophobicContact CB-CD2 4.28Å; Q304-F306 HydrophobicContact CB-CE2 3.59Å; Q304-F306 HydrophobicContact CB-CZ 4.25Å; F306-F394 WeakPolarHBondContact CA-O 3.23Å; F306-F394 HydrophobicContact CD1-CB 3.62Å; F306-F394 AromaticContact CD1-CD2 3.66Å; F306-F394 HydrophobicContact CD1-CD2 3.66Å; F306-F394 AromaticContact CD1-CG 3.86Å; F306-F394 HydrophobicContact CD1-CG 3.86Å; F306-F394 HydrophobicContact CE1-CB 4.03Å; F306-F394 AromaticContact CE1-CD2 3.21Å; F306-F394 HydrophobicContact CE1-CD2 3.21Å; F306-F394 AromaticContact CE1-CE2 3.71Å; F306-F394 HydrophobicContact CE1-CE2 3.71Å; F306-F394 AromaticContact CE1-CG 3.71Å; F306-F394 HydrophobicContact CE1-CG 3.71Å; F306-F394 HydrophobicContact CG-CB 4.44Å; F306-F394 HydrophobicContact CG-CD2 4.5Å; F306-F394 AromaticContact CZ-CD2 3.75Å; F306-F394 HydrophobicContact CZ-CD2 3.75Å; F306-F394 AromaticContact CZ-CE2 3.96Å; F306-F394 HydrophobicContact CZ-CE2 3.96Å
307	T	44.6	Very low	42.5	Very low	0 Å²	0	26.3 Å²	26.3	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	110.8	176.6	71.7	0	0	0	0	109.7	T219 P266 I305 P354 F394 T396	T219-T307 WeakPolarHBondContact OG1-CA 3.07Å; P266-T307 HydrophobicContact CG-CG2 3.96Å; I305-T307 HydrophobicContact CG2-CG2 4.1Å; T307-P354 HydrophobicContact CG2-CG 4.19Å; T307-F394 PolarHBondContact N-O 2.84Å; T307-T396 PolarHBondContact O-N 2.66Å
308	T	43.8	Very low	41.8	Very low	46 Å²	46	26 Å²	26	28%	0.282	14%	0.144	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	122.7	-179.4	-55.9	0	0	0	0	111.4	T219 T220 D221 T396	T219-T308 PolarHBondContact O-N 3.12Å; T220-T308 WeakPolarHBondContact CA-O 3.48Å; D221-T308 PolarHBondContact N-O 3.04Å; T308-T396 WeakPolarHBondContact CA-O 3.38Å
309	D	42.6	Very low	41.2	Very low	0 Å²	0	28.4 Å²	28.4	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	127.2	168.2	-169.4	-10.9	0	0	0	108.1	T262 T350 T351 T396 R398	T262-D309 WeakPolarHBondContact CB-OD1 3.25Å; T262-D309 VanDerWaalsContact OG1-CG 3.25Å; T262-D309 PolarHBondContact OG1-OD1 2.88Å; T262-D309 PolarHBondContact OG1-OD2 3.03Å; D309-T350 WeakPolarHBondContact OD2-CB 3.37Å; D309-T351 PolarHBondContact OD2-N 3.43Å; D309-T396 PolarHBondContact N-O 2.97Å; D309-R398 PolarHBondContact O-N 2.97Å
310	R	43.4	Very low	40.5	Very low	88 Å²	88	28.9 Å²	28.9	33%	0.332	16%	0.163	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	109.5	-176.2	-172.2	178.1	175.3	177.6	-2.3	113.6	D221 R222 T223 P312 R398	D221-R310 PolarHBondContact O-N 3.01Å; D221-R310 VanDerWaalsContact O-N 3.12Å; R222-R310 WeakPolarHBondContact CA-O 2.97Å; T223-R310 PolarHBondContact N-O 3.27Å; R310-P312 WeakPolarHBondContact O-CD 3.47Å; R310-R398 WeakPolarHBondContact CA-O 3.4Å
311	T	42.1	Very low	39.9	Very low	0 Å²	0	31.2 Å²	31.2	0%	0	18%	0.177	C	C	.	.			trans	-116.1	92.2	177.8	67.9	0	0	0	0	112	T223 T262 A313 V348 T350 R398 T399	T223-T311 WeakPolarHBondContact OG1-CG2 3.03Å; T262-T311 HydrophobicContact CG2-CG2 3.22Å; T262-T311 WeakPolarHBondContact OG1-CG2 3.38Å; T311-A313 PolarHBondContact O-N 2.91Å; T311-V348 WeakPolarHBondContact OG1-CG1 3.41Å; T311-T350 HydrophobicContact CG2-CG2 3.53Å; T311-T350 WeakPolarHBondContact OG1-CG2 3.39Å; T311-R398 PolarHBondContact N-O 3.14Å; T311-T399 WeakPolarHBondContact OG1-CG2 3.46Å
312	P	37.5	Very low	39.4	Very low	32 Å²	32	34 Å²	34	21%	0.208	19%	0.194	C	C	.	.			trans	-71	120.3	162.5	-7.5	25	0	0	0	108.8	T223 P224 A225 R310 P400	T223-P312 WeakPolarHBondContact O-CD 3.44Å; P224-P312 WeakPolarHBondContact CA-O 3.34Å; A225-P312 PolarHBondContact N-O 2.04Å; R310-P312 WeakPolarHBondContact O-CD 3.47Å; P312-P400 WeakPolarHBondContact CA-O 3.4Å
313	A	36.4	Very low	38.8	Very low	1 Å²	1	34.4 Å²	34.4	1%	0.008	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	131.1	175.5	0	0	0	0	0	110.4	A225 T311 F315 V348 P400 A401 T402	A225-A313 WeakPolarHBondContact O-CA 3.43Å; T311-A313 PolarHBondContact O-N 2.91Å; A313-F315 HydrophobicContact CB-CD2 4.49Å; A313-F315 HydrophobicContact CB-CE2 3.73Å; A313-F315 HydrophobicContact CB-CZ 4.32Å; A313-V348 HydrophobicContact CB-CG1 4.46Å; A313-V348 HydrophobicContact CB-CG2 3.65Å; A313-P400 PolarHBondContact N-O 3.01Å; A313-A401 WeakPolarHBondContact O-CA 3.48Å; A313-T402 PolarHBondContact O-N 2.91Å
314	T	39.2	Very low	38.2	Very low	54 Å²	54	37.6 Å²	37.6	33%	0.331	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	122.6	175.7	-56	0	0	0	0	109.4	A225 F227	A225-T314 PolarHBondContact O-N 2.66Å; F227-T314 PolarHBondContact N-O 3.05Å
315	F	37.7	Very low	37.5	Very low	2 Å²	2	40.2 Å²	40.2	1%	0.009	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	134.5	177.6	-61.1	-87.3	0	0	0	109.5	F227 E258 V260 A313 E346 V348 T402 F403 T404	F227-F315 HydrophobicContact CB-CD1 4.04Å; F227-F315 HydrophobicContact CB-CE1 4.43Å; F227-F315 AromaticContact CD2-CD1 3.79Å; F227-F315 HydrophobicContact CD2-CD1 3.79Å; F227-F315 AromaticContact CD2-CE1 3.37Å; F227-F315 HydrophobicContact CD2-CE1 3.37Å; F227-F315 HydrophobicContact CD2-CZ 4.08Å; F227-F315 AromaticContact CE2-CE1 3.81Å; F227-F315 HydrophobicContact CE2-CE1 3.81Å; F227-F315 HydrophobicContact CE2-CZ 4.22Å; F227-F315 HydrophobicContact CG-CD1 4.19Å; F227-F315 HydrophobicContact CG-CE1 4.06Å; E258-F315 HydrophobicContact CB-CE1 3.98Å; E258-F315 VanDerWaalsContact OE2-CD1 3.28Å; E258-F315 WeakPolarHBondContact OE2-CD1 3.36Å; E258-F315 WeakPolarHBondContact OE2-CE1 3.42Å; V260-F315 HydrophobicContact CG2-CZ 4.43Å; A313-F315 HydrophobicContact CB-CD2 4.49Å; A313-F315 HydrophobicContact CB-CE2 3.73Å; A313-F315 HydrophobicContact CB-CZ 4.32Å; F315-E346 WeakPolarHBondContact CB-OE2 3.41Å; F315-E346 HydrophobicContact CD1-CB 4.38Å; F315-E346 HydrophobicContact CD1-CG 4.02Å; F315-E346 HydrophobicContact CE1-CB 4.3Å; F315-E346 HydrophobicContact CE1-CG 4.25Å; F315-E346 HydrophobicContact CG-CG 4.49Å; F315-E346 VanDerWaalsContact CG-OE2 3.25Å; F315-E346 WeakPolarHBondContact CG-OE2 3.42Å; F315-E346 HydrophobicContact CZ-CB 4.48Å; F315-V348 HydrophobicContact CE2-CG2 3.75Å; F315-V348 HydrophobicContact CZ-CG2 4.16Å; F315-T402 PolarHBondContact N-O 3.06Å; F315-F403 HydrophobicContact CB-CD1 3.98Å; F315-F403 HydrophobicContact CB-CE1 4.41Å; F315-F403 AromaticContact CD2-CD1 3.67Å; F315-F403 HydrophobicContact CD2-CD1 3.67Å; F315-F403 AromaticContact CD2-CE1 3.3Å; F315-F403 HydrophobicContact CD2-CE1 3.3Å; F315-F403 HydrophobicContact CD2-CZ 4.06Å; F315-F403 AromaticContact CE2-CE1 3.72Å; F315-F403 HydrophobicContact CE2-CE1 3.72Å; F315-F403 HydrophobicContact CE2-CZ 4.17Å; F315-F403 HydrophobicContact CG-CD1 4.09Å; F315-F403 HydrophobicContact CG-CE1 4.01Å; F315-T404 PolarHBondContact O-N 3.03Å; F315-T404 VanDerWaalsContact O-N 3.14Å
316	T	38.2	Very low	36.7	Very low	48 Å²	48	43.6 Å²	43.6	29%	0.294	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	117.1	179.8	-62.3	0	0	0	0	110.1	F227 S229 T404	F227-T316 PolarHBondContact O-N 3.12Å; S229-T316 PolarHBondContact N-O 3.12Å; T316-T404 WeakPolarHBondContact CA-O 3.47Å
317	S	36.4	Very low	35.9	Very low	17 Å²	17	46 Å²	46	12%	0.119	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	129.8	-176.9	60.2	0	0	0	0	112.4	T404 T406	S317-T404 PolarHBondContact N-O 3.01Å; S317-T404 VanDerWaalsContact N-O 3.07Å; S317-T406 PolarHBondContact O-N 3.33Å
318	T	38	Very low	34.9	Very low	55 Å²	55	51.4 Å²	51.4	34%	0.337	32%	0.316	S	S	.	.			trans	-130.8	99.5	178.3	25.9	0	0	0	0	109.2	T230 P231	T230-T318 VanDerWaalsContact CG2-OG1 3.31Å; T230-T318 WeakPolarHBondContact CG2-OG1 3.45Å; P231-T318 WeakPolarHBondContact CD-O 3.46Å
319	P	35.2	Very low	34.1	Very low	50 Å²	50	55.5 Å²	55.5	33%	0.325	34%	0.336	S	S	.	.	P	Polyproline II helix	trans	-65.2	149.5	178.8	-22.5	36.2	0	0	0	112.7	T406 S408	P319-T406 WeakPolarHBondContact CD-O 3.19Å; P319-S408 WeakPolarHBondContact O-CB 3.31Å
320	S	33	Very low	33.2	Very low	47 Å²	47	61.8 Å²	61.8	33%	0.329	37%	0.374	S	S	.	.	P	Polyproline II helix	trans	-61.3	136.2	178	53.1	0	0	0	0	112.8	S232 S408	S232-S320 WeakPolarHBondContact O-CB 3.4Å; S320-S408 WeakPolarHBondContact O-CB 3.04Å; S320-S408 PolarHBondContact O-OG 2.95Å; S320-S408 VanDerWaalsContact O-OG 3.05Å
321	T	31.8	Very low	32.2	Very low	57 Å²	57	62.9 Å²	62.9	35%	0.35	39%	0.387	S	S	.	.	P	Polyproline II helix	trans	-76.2	145.9	165.4	52.2	0	0	0	0	110.7	T409	T321-T409 WeakPolarHBondContact CG2-O 3.35Å
322	S	32	Very low	31.3	Very low	66 Å²	66	68.5 Å²	68.5	46%	0.462	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	132.4	169.7	53.1	0	0	0	0	110.3
323	T	31.2	Very low	30.8	Very low	68 Å²	68	74.7 Å²	74.7	42%	0.417	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	127.5	172.2	44.8	0	0	0	0	107.8
324	S	30.5	Very low	30.3	Very low	73 Å²	73	77.3 Å²	77.3	51%	0.51	46%	0.459	S	S	.	.			trans	-134.9	106.2	-177.2	59.1	0	0	0	0	110.2	P326	S324-P326 WeakPolarHBondContact O-CD 3.41Å
325	T	27.5	Very low	29.7	Very low	88 Å²	88	78.3 Å²	78.3	54%	0.54	47%	0.468	S	S	.	.			trans	-97.6	105.8	174.1	39.5	0	0	0	0	109.6
326	P	27.1	Very low	29.3	Very low	72 Å²	72	82 Å²	82	47%	0.468	49%	0.487	S	S	.	.			trans	-68.2	141.6	176.9	29.6	-33.9	0	0	0	110.3	S324	S324-P326 WeakPolarHBondContact O-CD 3.41Å
327	T	26.4	Very low	29	Very low	101 Å²	101	82 Å²	82	62%	0.62	49%	0.488	S	S	*	.			trans	-120.6	150.4	167.5	-51.9	0	0	0	0	107.7	L329	T327-L329 PolarHBondContact O-N 3.05Å
328	T	24.3	Very low	28.6	Very low	115 Å²	115	83.9 Å²	83.9	71%	0.706	50%	0.501	S	S	*	.			trans	-43.6	129.6	-167.8	50	0	0	0	0	115
329	L	25.2	Very low	28.2	Very low	132 Å²	132	83.3 Å²	83.3	69%	0.691	50%	0.497	S	S	*	.			trans	-133.6	150.1	170	-150.5	80.3	0	0	0	109.2	T327	T327-L329 PolarHBondContact O-N 3.05Å
330	T	24.1	Very low	27.9	Very low	131 Å²	131	83.6 Å²	83.6	80%	0.804	50%	0.5	S	S	*	.			trans	-131.3	121.2	179.3	-55	0	0	0	0	108.8
331	D	22.2	Very low	27.8	Very low	111 Å²	111	83.4 Å²	83.4	59%	0.594	50%	0.499	S	S	*	.	S	Bend	trans	37.7	120.8	163.7	-138.7	25.5	0	0	0	118.1
332	N	23.9	Very low	28	Very low	119 Å²	119	82.6 Å²	82.6	64%	0.636	50%	0.496	S	S	*	.	S	Bend	cis	-147.9	147.1	36	-132.7	-71	0	0	0	112
333	Q	26.2	Very low	28.1	Very low	162 Å²	162	83.8 Å²	83.8	76%	0.757	49%	0.493	S	S	*	.			trans	40.2	100.4	165.4	-165.7	173.9	105.3	0	0	118.1
334	T	26.6	Very low	28.3	Very low	56 Å²	56	81.5 Å²	81.5	34%	0.344	48%	0.478	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	134.2	174.5	-56.5	0	0	0	0	112.2	L336	T334-L336 HydrophobicContact CG2-CG 4.45Å
335	S	27.5	Very low	28.7	Very low	75 Å²	75	79.7 Å²	79.7	52%	0.524	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	122.6	169.1	-69.6	0	0	0	0	110.8
336	L	27.5	Very low	29.3	Very low	78 Å²	78	75.8 Å²	75.8	41%	0.408	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	99.1	178.8	-90.1	160.6	0	0	0	110.2	T334 L424	T334-L336 HydrophobicContact CG2-CG 4.45Å; L336-L424 HydrophobicContact CB-CD2 3.76Å; L336-L424 HydrophobicContact CD1-CD2 4.45Å
337	T	31.7	Very low	29.9	Very low	50 Å²	50	74.2 Å²	74.2	31%	0.307	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	97.7	177.8	-52.3	0	0	0	0	109.8
338	S	29.5	Very low	30.5	Very low	56 Å²	56	69.5 Å²	69.5	39%	0.392	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	108	171.7	62.1	0	0	0	0	109.5
339	T	28.4	Very low	31.4	Very low	42 Å²	42	68.3 Å²	68.3	26%	0.258	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	94.8	179.3	-50.2	0	0	0	0	110	S250	S250-T339 PolarHBondContact O-N 3.29Å; S250-T339 VanDerWaalsContact O-N 3.13Å
340	S	29.4	Very low	32.1	Very low	56 Å²	56	62 Å²	62	39%	0.392	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	118.7	169.8	53.1	0	0	0	0	109.5	S429	S340-S429 PolarHBondContact O-N 2.92Å
341	S	31.6	Very low	33.1	Very low	44 Å²	44	56.4 Å²	56.4	31%	0.308	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	111.1	175	58	0	0	0	0	110.6	S252 S253 S254 S429	S252-S341 PolarHBondContact O-N 3.17Å; S253-S341 WeakPolarHBondContact CA-O 3.29Å; S254-S341 PolarHBondContact N-O 2.92Å; S341-S429 WeakPolarHBondContact CA-O 3.46Å
342	S	34.4	Very low	34.2	Very low	40 Å²	40	51.2 Å²	51.2	28%	0.28	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	125.3	172.3	56.9	0	0	0	0	109.3	S429 K431	S342-S429 PolarHBondContact N-O 3.02Å; S342-K431 PolarHBondContact O-N 3.19Å
343	K	34.7	Very low	35.2	Very low	91 Å²	91	47 Å²	47	40%	0.396	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	95.9	168.2	-172.9	177.9	177.8	180	0	109.1	S254 L256	S254-K343 PolarHBondContact O-N 3.01Å; S254-K343 VanDerWaalsContact O-N 3.08Å; L256-K343 PolarHBondContact N-O 2.94Å
344	L	35.5	Very low	36.2	Very low	19 Å²	19	39.4 Å²	39.4	10%	0.099	23%	0.232	C	C	.	.			trans	-81.1	148.1	167.5	-122	65.4	0	0	0	109.5	L256 E346 K431 L432	L256-L344 HydrophobicContact CB-CD1 3.72Å; L256-L344 HydrophobicContact CD1-CD1 4.35Å; L344-E346 HydrophobicContact CD2-CG 4.42Å; L344-E346 WeakPolarHBondContact CD2-OE1 3.43Å; L344-E346 HydrophobicContact CG-CG 4.45Å; L344-K431 PolarHBondContact N-O 3.24Å; L344-L432 HydrophobicContact CB-CD2 3.66Å; L344-L432 HydrophobicContact CB-CG 4.28Å; L344-L432 HydrophobicContact CD2-CD2 3.62Å; L344-L432 HydrophobicContact CG-CD2 4.29Å
345	T	40.2	Very low	37.1	Very low	35 Å²	35	37.9 Å²	37.9	22%	0.215	22%	0.222	C	C	.	.			trans	-150.9	108.1	169.1	-59.8	0	0	0	0	107.1	L256 T257 E258 T433	L256-T345 PolarHBondContact O-N 3.15Å; T257-T345 WeakPolarHBondContact CA-O 3.32Å; E258-T345 PolarHBondContact N-O 2.95Å; T345-T433 WeakPolarHBondContact CA-O 3.4Å
346	E	40	Very low	38.2	Very low	7 Å²	7	37.2 Å²	37.2	3%	0.033	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	136.1	-173.3	-64.9	177	178	0	0	109	F315 L344 F403 T433 E434 S435	F315-E346 WeakPolarHBondContact CB-OE2 3.41Å; F315-E346 HydrophobicContact CD1-CB 4.38Å; F315-E346 HydrophobicContact CD1-CG 4.02Å; F315-E346 HydrophobicContact CE1-CB 4.3Å; F315-E346 HydrophobicContact CE1-CG 4.25Å; F315-E346 HydrophobicContact CG-CG 4.49Å; F315-E346 VanDerWaalsContact CG-OE2 3.25Å; F315-E346 WeakPolarHBondContact CG-OE2 3.42Å; F315-E346 HydrophobicContact CZ-CB 4.48Å; L344-E346 HydrophobicContact CD2-CG 4.42Å; L344-E346 WeakPolarHBondContact CD2-OE1 3.43Å; L344-E346 HydrophobicContact CG-CG 4.45Å; E346-F403 HydrophobicContact CB-CE1 4.04Å; E346-F403 WeakPolarHBondContact OE2-CD1 3.3Å; E346-F403 WeakPolarHBondContact OE2-CE1 3.41Å; E346-T433 PolarHBondContact N-O 3.01Å; E346-E434 HydrophobicContact CB-CG 4.42Å; E346-S435 PolarHBondContact O-N 3Å; E346-S435 PolarHBondContact O-OG 3.47Å
347	S	39.2	Very low	39.1	Very low	38 Å²	38	33.5 Å²	33.5	27%	0.266	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	126.5	-172.9	55	0	0	0	0	112.9	E258 S259 V260 S435	E258-S347 PolarHBondContact O-N 2.69Å; E258-S347 PolarHBondContact O-OG 2.73Å; S259-S347 WeakPolarHBondContact CA-O 3.45Å; V260-S347 PolarHBondContact N-O 2.94Å; S347-S435 WeakPolarHBondContact CA-O 3.32Å
348	V	38	Very low	39.9	Very low	2 Å²	2	33.7 Å²	33.7	1%	0.012	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	122.2	174.8	-176.4	0	0	0	0	108.1	T311 A313 F315 S435 R437	T311-V348 WeakPolarHBondContact OG1-CG1 3.41Å; A313-V348 HydrophobicContact CB-CG1 4.46Å; A313-V348 HydrophobicContact CB-CG2 3.65Å; F315-V348 HydrophobicContact CE2-CG2 3.75Å; F315-V348 HydrophobicContact CZ-CG2 4.16Å; V348-S435 PolarHBondContact N-O 3.05Å; V348-R437 PolarHBondContact O-N 3.03Å
349	R	43.6	Very low	40.7	Very low	90 Å²	90	31.1 Å²	31.1	34%	0.34	18%	0.177	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	115.7	178	-178.4	178.6	171.9	167.7	0.7	113	V260 R261 T262 T351 R437	V260-R349 PolarHBondContact O-N 3.13Å; R261-R349 VanDerWaalsContact CA-O 3.29Å; R261-R349 WeakPolarHBondContact CA-O 3.42Å; T262-R349 PolarHBondContact N-O 3.03Å; R349-T351 PolarHBondContact NE-OG1 3.02Å; R349-R437 VanDerWaalsContact CA-O 3.32Å; R349-R437 WeakPolarHBondContact CA-O 3.37Å
350	T	40.3	Very low	41.7	Very low	0 Å²	0	30.7 Å²	30.7	0%	0	18%	0.176	C	C	.	.			trans	-95.3	164.2	163.1	49.6	0	0	0	0	110.5	T262 D309 T311 D397 T399 R437 T438	T262-T350 WeakPolarHBondContact OG1-CG2 3.3Å; D309-T350 WeakPolarHBondContact OD2-CB 3.37Å; T311-T350 HydrophobicContact CG2-CG2 3.53Å; T311-T350 WeakPolarHBondContact OG1-CG2 3.39Å; T350-D397 WeakPolarHBondContact CB-OD1 3.26Å; T350-D397 WeakPolarHBondContact CG2-OD1 3.5Å; T350-D397 PolarHBondContact OG1-OD1 3.4Å; T350-D397 PolarHBondContact OG1-OD2 3.21Å; T350-T399 HydrophobicContact CG2-CG2 3.25Å; T350-T399 WeakPolarHBondContact OG1-CG2 3.49Å; T350-R437 PolarHBondContact N-O 3.1Å; T350-T438 WeakPolarHBondContact OG1-CA 3.18Å; T350-T438 WeakPolarHBondContact OG1-CG2 3.37Å
351	T	44.8	Very low	42.6	Very low	14 Å²	14	28.3 Å²	28.3	9%	0.086	16%	0.159	C	C	.	.			trans	-161.9	103	174.2	-66.8	0	0	0	0	107.7	S264 D309 R349 V353	S264-T351 PolarHBondContact N-O 3.04Å; D309-T351 PolarHBondContact OD2-N 3.43Å; R349-T351 PolarHBondContact NE-OG1 3.02Å; T351-V353 HydrophobicContact CG2-CG2 3.58Å
352	S	45.2	Very low	43.3	Very low	1 Å²	1	28.4 Å²	28.4	1%	0.007	16%	0.158	C	C	.	.	B	Isolated β-bridge	trans	-104.8	116.5	179.5	-178.7	0	0	0	0	110.3	S264 T439 S440 V441	S264-S352 WeakPolarHBondContact O-CA 3.25Å; S352-T439 PolarHBondContact N-O 3.42Å; S352-S440 WeakPolarHBondContact O-CA 3.43Å; S352-V441 PolarHBondContact O-N 3.13Å; S352-V441 VanDerWaalsContact O-N 3.13Å
353	V	46.1	Very low	43.7	Very low	32 Å²	32	26.5 Å²	26.5	19%	0.194	14%	0.144	C	C	.	.			trans	-139.4	79.8	-170.8	-167.5	0	0	0	0	110.4	S264 V265 T351 T355 V441	S264-V353 PolarHBondContact O-N 3.16Å; S264-V353 VanDerWaalsContact O-N 3.11Å; V265-V353 HydrophobicContact CG1-CB 4.48Å; V265-V353 WeakPolarHBondContact CG1-O 3.3Å; T351-V353 HydrophobicContact CG2-CG2 3.58Å; V353-T355 HydrophobicContact CG1-CG2 3.68Å; V353-T355 PolarHBondContact O-N 3.21Å; V353-V441 VanDerWaalsContact CG1-O 3.3Å; V353-V441 WeakPolarHBondContact CG1-O 3.18Å
354	P	45.9	Very low	44.3	Very low	1 Å²	1	24.1 Å²	24.1	1%	0.006	14%	0.141	C	C	.	.			trans	-69.2	126.9	169.9	-10.6	26.3	0	0	0	109.7	P266 T307 I357 T395 P442 T443	P266-P354 WeakPolarHBondContact O-CA 3.48Å; T307-P354 HydrophobicContact CG2-CG 4.19Å; P354-I357 HydrophobicContact CB-CD1 3.84Å; P354-T395 HydrophobicContact CG-CG2 3.79Å; P354-P442 WeakPolarHBondContact O-CA 3.5Å; P354-T443 PolarHBondContact O-N 3.47Å; P354-T443 VanDerWaalsContact O-N 3.12Å
355	T	46.6	Very low	45	Very low	24 Å²	24	23.6 Å²	23.6	15%	0.147	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	150.5	-179.8	72.3	0	0	0	0	113.2	P266 T267 N268 V353 T443	P266-T355 PolarHBondContact O-N 2.94Å; P266-T355 VanDerWaalsContact O-N 3.08Å; T267-T355 WeakPolarHBondContact CA-O 3.41Å; T267-T355 WeakPolarHBondContact CG2-OG1 3.11Å; N268-T355 PolarHBondContact N-O 3.13Å; V353-T355 HydrophobicContact CG1-CG2 3.68Å; V353-T355 PolarHBondContact O-N 3.21Å; T355-T443 WeakPolarHBondContact CA-O 3.43Å; T355-T443 WeakPolarHBondContact CG2-OG1 3.38Å
356	N	50.7	Low	45.6	Very low	62 Å²	62	24.4 Å²	24.4	33%	0.332	14%	0.142	S	C	.	.	E	Extended strand (participates in β ladder)	trans	54.4	56.8	179.2	-54.8	-18.4	0	0	0	112	N268 I269 T443 N444	N268-N356 WeakPolarHBondContact CA-O 3.14Å; N268-N356 WeakPolarHBondContact OD1-CB 3.18Å; N268-N356 PolarHBondContact OD1-ND2 2.89Å; I269-N356 PolarHBondContact N-O 2.9Å; N356-T443 PolarHBondContact N-O 2.92Å; N356-N444 VanDerWaalsContact CA-O 3.3Å; N356-N444 WeakPolarHBondContact CA-O 3.29Å; N356-N444 PolarHBondContact N-O 3.38Å; N356-N444 WeakPolarHBondContact OD1-CB 3.48Å; N356-N444 PolarHBondContact OD1-ND2 2.97Å
357	I	45.7	Very low	46.4	Very low	0 Å²	0	24.1 Å²	24.1	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	121.2	172.8	-59.5	179.7	0	0	0	108.2	I269 I305 P354 T359 I393 N444 I445 T446	I269-I357 HydrophobicContact CB-CG1 4.43Å; I269-I357 WeakPolarHBondContact O-CA 3.29Å; I305-I357 HydrophobicContact CD1-CD1 4.42Å; I305-I357 HydrophobicContact CD1-CG2 3.66Å; P354-I357 HydrophobicContact CB-CD1 3.84Å; I357-T359 HydrophobicContact CG2-CG2 4.01Å; I357-I393 HydrophobicContact CG2-CD1 4.18Å; I357-N444 PolarHBondContact N-O 2.99Å; I357-I445 HydrophobicContact CB-CG1 4.36Å; I357-I445 WeakPolarHBondContact O-CA 3.34Å; I357-T446 PolarHBondContact O-N 3.06Å
358	T	47.6	Very low	47	Very low	53 Å²	53	23.6 Å²	23.6	33%	0.325	14%	0.137	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	116.1	174.7	-56.4	0	0	0	0	109.9	I269 T270 T271 T446	I269-T358 PolarHBondContact O-N 2.94Å; T270-T358 WeakPolarHBondContact CA-O 3.37Å; T271-T358 PolarHBondContact N-O 2.9Å; T358-T446 WeakPolarHBondContact CA-O 3.24Å
359	T	46.3	Very low	47.7	Very low	3 Å²	3	23.8 Å²	23.8	2%	0.018	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	119.1	175.1	68.2	0	0	0	0	109.6	T271 T303 I305 I357 T391 T446 T447 S448	T271-T359 WeakPolarHBondContact O-CA 3.37Å; T271-T359 WeakPolarHBondContact OG1-CB 3.44Å; T271-T359 WeakPolarHBondContact OG1-CG2 3.17Å; T303-T359 HydrophobicContact CG2-CG2 4.18Å; I305-T359 HydrophobicContact CD1-CG2 4.43Å; I357-T359 HydrophobicContact CG2-CG2 4.01Å; T359-T391 HydrophobicContact CG2-CG2 3.95Å; T359-T446 PolarHBondContact N-O 3.49Å; T359-T447 WeakPolarHBondContact O-CA 3.47Å; T359-T447 WeakPolarHBondContact OG1-CB 3.4Å; T359-T447 WeakPolarHBondContact OG1-CG2 3.44Å; T359-S448 PolarHBondContact O-N 2.86Å
360	S	50.9	Low	48.3	Very low	33 Å²	33	21.9 Å²	21.9	23%	0.231	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	133.8	176.9	57.2	0	0	0	0	111.9	T271 S272 S273 S448	T271-S360 PolarHBondContact O-N 3.02Å; S272-S360 WeakPolarHBondContact CA-O 3.26Å; S272-S360 WeakPolarHBondContact CB-OG 3.48Å; S273-S360 PolarHBondContact N-O 3.01Å; S360-S448 WeakPolarHBondContact CA-O 3.44Å
361	S	48.3	Very low	48.9	Very low	5 Å²	5	22 Å²	22	4%	0.035	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	124.3	168.1	-85.4	0	0	0	0	110.1	S273 T300 S448 S449 T450	S273-S361 WeakPolarHBondContact O-CA 3.38Å; T300-S361 VanDerWaalsContact OG1-CB 3.24Å; T300-S361 WeakPolarHBondContact OG1-CB 3.24Å; T300-S361 PolarHBondContact OG1-OG 2.99Å; S361-S448 PolarHBondContact N-O 2.87Å; S361-S449 WeakPolarHBondContact O-CA 3.45Å; S361-T450 PolarHBondContact O-N 3.43Å
362	T	45.4	Very low	49.2	Very low	47 Å²	47	23.8 Å²	23.8	29%	0.288	15%	0.15	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	122.5	178.7	-55.7	0	0	0	0	109.6	S273 T274 V275 T450	S273-T362 PolarHBondContact O-N 3.01Å; T274-T362 WeakPolarHBondContact CA-O 3.41Å; V275-T362 PolarHBondContact N-O 3.13Å; T362-T450 WeakPolarHBondContact CA-O 3.16Å
363	V	42.8	Very low	49.5	Very low	0 Å²	0	27.1 Å²	27.1	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	122.3	165.8	177.5	0	0	0	0	107.9	V275 T300 T365 S387 T388 T450 V451 A452	V275-V363 HydrophobicContact CB-CG2 4.4Å; V275-V363 WeakPolarHBondContact O-CA 3.25Å; T300-V363 HydrophobicContact CG2-CG2 3.9Å; V363-T365 HydrophobicContact CG1-CG2 3.73Å; V363-S387 WeakPolarHBondContact CG2-O 3.42Å; V363-T388 HydrophobicContact CG2-CG2 4.16Å; V363-T450 PolarHBondContact N-O 3.5Å; V363-V451 HydrophobicContact CB-CG2 4.43Å; V363-V451 WeakPolarHBondContact O-CA 3.24Å; V363-A452 PolarHBondContact O-N 3.46Å
364	A	46.9	Very low	49.8	Very low	40 Å²	40	25.7 Å²	25.7	33%	0.331	16%	0.157	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	108.3	177.5	0	0	0	0	0	109.1	V275 A276 T277 A452	V275-A364 PolarHBondContact O-N 3.24Å; A276-A364 WeakPolarHBondContact CA-O 3.35Å; T277-A364 PolarHBondContact N-O 2.85Å; A364-A452 WeakPolarHBondContact CA-O 3.43Å
365	T	51.2	Low	50.2	Low	8 Å²	8	28.7 Å²	28.7	5%	0.049	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	144.9	-176.6	69.9	0	0	0	0	112.3	T277 V363 Q384 S386 A452 T453 N454	T277-T365 WeakPolarHBondContact O-CA 3.31Å; T277-T365 WeakPolarHBondContact OG1-CG2 3.43Å; V363-T365 HydrophobicContact CG1-CG2 3.73Å; T365-Q384 PolarHBondContact OG1-OE1 2.95Å; T365-S386 VanDerWaalsContact CG2-OG 3.25Å; T365-S386 WeakPolarHBondContact CG2-OG 3.45Å; T365-A452 PolarHBondContact N-O 3.44Å; T365-T453 WeakPolarHBondContact OG1-CG2 3.42Å; T365-N454 PolarHBondContact O-N 2.78Å
366	N	53.2	Low	50.7	Low	52 Å²	52	29.8 Å²	29.8	28%	0.278	18%	0.179	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	134.5	169.6	-165.1	14.3	0	0	0	109.9	T277 N278 T279 Q296 N454	T277-N366 PolarHBondContact O-N 3.5Å; N278-N366 WeakPolarHBondContact CA-O 3.4Å; T279-N366 PolarHBondContact N-O 2.84Å; Q296-N366 PolarHBondContact NE2-O 3.17Å; Q296-N366 PolarHBondContact OE1-O 2.95Å; N366-N454 WeakPolarHBondContact CA-O 3.42Å; N366-N454 PolarHBondContact OD1-O 3.34Å
367	T	55	Low	51	Low	2 Å²	2	29.9 Å²	29.9	1%	0.012	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	131.7	167.8	-51.1	0	0	0	0	109.1	T279 T294 Q296 T382 Q384 N454 T455 S456	T279-T367 WeakPolarHBondContact O-CA 3.24Å; T294-T367 HydrophobicContact CG2-CG2 3.47Å; T294-T367 VanDerWaalsContact CG2-CG2 3.47Å; Q296-T367 PolarHBondContact OE1-OG1 2.99Å; T367-T382 HydrophobicContact CG2-CG2 3.7Å; T367-Q384 PolarHBondContact OG1-NE2 3.36Å; T367-N454 PolarHBondContact N-O 3.3Å; T367-T455 WeakPolarHBondContact O-CA 3.23Å; T367-S456 PolarHBondContact O-N 2.99Å
368	S	52.4	Low	51.6	Low	27 Å²	27	29.9 Å²	29.9	19%	0.189	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	131.9	-177.4	55.7	0	0	0	0	112.5	T279 S280 A281 S456	T279-S368 PolarHBondContact O-N 3.23Å; S280-S368 WeakPolarHBondContact CA-O 3.38Å; A281-S368 PolarHBondContact N-O 3.16Å; S368-S456 WeakPolarHBondContact CA-O 3.18Å
369	A	52	Low	52.1	Low	6 Å²	6	29.6 Å²	29.6	5%	0.05	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	122.8	174.3	0	0	0	0	0	109.5	F380 S456 T458	A369-F380 HydrophobicContact CB-CD1 4.01Å; A369-F380 HydrophobicContact CB-CE1 4.19Å; A369-S456 PolarHBondContact N-O 3.08Å; A369-T458 PolarHBondContact O-N 2.93Å
370	T	56.1	Low	52.6	Low	50 Å²	50	29.8 Å²	29.8	31%	0.307	18%	0.183	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	119.3	-176.6	-56.9	0	0	0	0	111.5	A281 T282 V283	A281-T370 PolarHBondContact O-N 2.97Å; T282-T370 WeakPolarHBondContact CA-O 3.47Å; V283-T370 PolarHBondContact N-O 2.97Å
371	V	53.6	Low	52.8	Low	2 Å²	2	31.4 Å²	31.4	1%	0.012	19%	0.189	C	C	.	.			trans	-132.1	102.6	177.7	-177	0	0	0	0	109.6	V283 V286 F292 Q373 V374 F380 T458 V459 P460	V283-V371 HydrophobicContact CB-CG2 4.49Å; V286-V371 HydrophobicContact CG2-CG1 3.87Å; F292-V371 HydrophobicContact CE2-CG2 3.94Å; F292-V371 HydrophobicContact CZ-CG2 3.98Å; V371-Q373 PolarHBondContact O-N 3.44Å; V371-V374 HydrophobicContact CB-CG2 4.29Å; V371-V374 HydrophobicContact CG1-CG2 3.54Å; V371-F380 HydrophobicContact CB-CZ 4.25Å; V371-F380 HydrophobicContact CG2-CE1 3.84Å; V371-F380 HydrophobicContact CG2-CZ 3.71Å; V371-T458 PolarHBondContact N-O 3.14Å; V371-V459 HydrophobicContact CB-CG2 4.5Å; V371-P460 VanDerWaalsContact O-CD 3.24Å; V371-P460 WeakPolarHBondContact O-CD 3.31Å
372	P	52	Low	53	Low	52 Å²	52	31.4 Å²	31.4	34%	0.338	19%	0.189	S	C	.	.	S	Bend	trans	-59	-36.5	-174.4	-29.1	37.1	0	0	0	116.4	V283 P284 P460	V283-P372 WeakPolarHBondContact O-CD 3.23Å; P284-P372 WeakPolarHBondContact O-CB 3.45Å; P284-P372 WeakPolarHBondContact O-CD 3.32Å; P372-P460 WeakPolarHBondContact O-CB 3.41Å; P372-P460 WeakPolarHBondContact O-CD 3.5Å
373	Q	51.7	Low	53.4	Low	70 Å²	70	30.8 Å²	30.8	33%	0.327	19%	0.187	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	137	174.6	-76.5	-168.6	-44.3	0	0	113.1	Q285 V286 V371	Q285-Q373 HydrophobicContact CG-CB 4.48Å; V286-Q373 PolarHBondContact N-O 2.87Å; V371-Q373 PolarHBondContact O-N 3.44Å
374	V	51.8	Low	53.9	Low	3 Å²	3	30.9 Å²	30.9	2%	0.018	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	114.5	-178.7	174.4	0	0	0	0	110.8	V371 T376 T378 V459 Q461 N463	V371-V374 HydrophobicContact CB-CG2 4.29Å; V371-V374 HydrophobicContact CG1-CG2 3.54Å; V374-T376 WeakPolarHBondContact CG1-O 3.38Å; V374-T378 WeakPolarHBondContact CG1-OG1 3.42Å; V374-V459 HydrophobicContact CB-CG1 4.47Å; V374-V459 HydrophobicContact CG2-CG1 3.85Å; V374-Q461 PolarHBondContact N-O 2.91Å; V374-N463 PolarHBondContact O-N 3.46Å
375	N	54.1	Low	54.1	Low	63 Å²	63	32 Å²	32	34%	0.337	19%	0.19	S	C	.	.			trans	-85.8	-30.8	179	-78.3	-37.2	0	0	0	114	V286 N287 N463 T464	V286-N375 PolarHBondContact O-N 3.48Å; V286-N375 VanDerWaalsContact O-N 3.14Å; N287-N375 PolarHBondContact OD1-ND2 3.34Å; N375-N463 PolarHBondContact OD1-ND2 2.92Å; N375-T464 PolarHBondContact O-OG1 3.44Å
376	T	58	Low	53.9	Low	47 Å²	47	31.7 Å²	31.7	29%	0.288	19%	0.188	S	C	.	.	S	Bend	trans	-141.4	173	-177.6	53.7	0	0	0	0	113.3	N287 T288 T289 V374 T378 T464	N287-T376 PolarHBondContact O-OG1 3.04Å; T288-T376 VanDerWaalsContact C-OG1 3.32Å; T288-T376 WeakPolarHBondContact CA-OG1 3.42Å; T289-T376 PolarHBondContact N-OG1 3.45Å; V374-T376 WeakPolarHBondContact CG1-O 3.38Å; T376-T378 PolarHBondContact O-N 3.46Å; T376-T378 PolarHBondContact O-OG1 2.92Å; T376-T378 VanDerWaalsContact O-OG1 3.11Å; T376-T464 WeakPolarHBondContact CA-OG1 3.49Å
377	T	56.8	Low	53.7	Low	64 Å²	64	31 Å²	31	39%	0.393	19%	0.187	S	C	.	.			trans	-38.6	113.9	-172.1	-51.3	0	0	0	0	114.3	T289 T290 T465	T289-T377 VanDerWaalsContact CA-O 3.29Å; T289-T377 WeakPolarHBondContact CA-O 3.38Å; T290-T377 PolarHBondContact N-O 3.42Å; T377-T465 WeakPolarHBondContact CA-O 3.43Å; T377-T465 HydrophobicContact CG2-CG2 4.43Å
378	T	57.8	Low	53.2	Low	0 Å²	0	31.3 Å²	31.3	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	138	176.6	-60.7	0	0	0	0	110.5	T290 F292 V374 T376 F380 T465 T466 S467	T290-T378 WeakPolarHBondContact O-CA 3.12Å; F292-T378 HydrophobicContact CD2-CG2 4.29Å; F292-T378 HydrophobicContact CE2-CG2 4.16Å; V374-T378 WeakPolarHBondContact CG1-OG1 3.42Å; T376-T378 PolarHBondContact O-N 3.46Å; T376-T378 PolarHBondContact O-OG1 2.92Å; T376-T378 VanDerWaalsContact O-OG1 3.11Å; T378-F380 HydrophobicContact CG2-CD2 4.17Å; T378-F380 HydrophobicContact CG2-CE1 4.47Å; T378-F380 HydrophobicContact CG2-CE2 3.53Å; T378-F380 HydrophobicContact CG2-CZ 3.7Å; T378-T465 PolarHBondContact N-O 2.94Å; T378-T466 WeakPolarHBondContact O-CA 3.39Å; T378-S467 PolarHBondContact O-N 3.4Å; T378-S467 VanDerWaalsContact O-N 3.13Å
379	S	57.3	Low	52.6	Low	48 Å²	48	30.4 Å²	30.4	34%	0.336	18%	0.184	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	130.3	175.8	59.6	0	0	0	0	110.6	T290 S291 F292 S467	T290-S379 PolarHBondContact O-N 3.4Å; T290-S379 VanDerWaalsContact O-N 3.15Å; S291-S379 WeakPolarHBondContact CA-O 3.33Å; F292-S379 PolarHBondContact N-O 3.4Å; S379-S467 WeakPolarHBondContact CA-O 3.42Å
380	F	56.5	Low	52.3	Low	7 Å²	7	32.7 Å²	32.7	3%	0.031	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	120.2	168.8	-57.8	-92.2	0	0	0	107.8	F292 A369 V371 T378 V459 T466 S467 F468 D469	F292-F380 HydrophobicContact CB-CD1 3.9Å; F292-F380 HydrophobicContact CB-CE1 4.4Å; F292-F380 AromaticContact CD2-CD1 3.62Å; F292-F380 HydrophobicContact CD2-CD1 3.62Å; F292-F380 AromaticContact CD2-CE1 3.32Å; F292-F380 HydrophobicContact CD2-CE1 3.32Å; F292-F380 HydrophobicContact CD2-CZ 4.04Å; F292-F380 HydrophobicContact CE2-CD1 4.47Å; F292-F380 AromaticContact CE2-CE1 3.73Å; F292-F380 HydrophobicContact CE2-CE1 3.73Å; F292-F380 HydrophobicContact CE2-CZ 4.15Å; F292-F380 AromaticContact CG-CD1 4Å; F292-F380 HydrophobicContact CG-CD1 4Å; F292-F380 AromaticContact CG-CE1 3.99Å; F292-F380 HydrophobicContact CG-CE1 3.99Å; A369-F380 HydrophobicContact CB-CD1 4.01Å; A369-F380 HydrophobicContact CB-CE1 4.19Å; V371-F380 HydrophobicContact CB-CZ 4.25Å; V371-F380 HydrophobicContact CG2-CE1 3.84Å; V371-F380 HydrophobicContact CG2-CZ 3.71Å; T378-F380 HydrophobicContact CG2-CD2 4.17Å; T378-F380 HydrophobicContact CG2-CE1 4.47Å; T378-F380 HydrophobicContact CG2-CE2 3.53Å; T378-F380 HydrophobicContact CG2-CZ 3.7Å; F380-V459 HydrophobicContact CE2-CG2 3.89Å; F380-V459 HydrophobicContact CZ-CG2 3.92Å; F380-T466 HydrophobicContact CD2-CG2 4.19Å; F380-T466 HydrophobicContact CE2-CG2 4.04Å; F380-S467 PolarHBondContact N-O 2.84Å; F380-F468 HydrophobicContact CB-CD1 3.88Å; F380-F468 HydrophobicContact CB-CE1 4.4Å; F380-F468 AromaticContact CD2-CD1 3.55Å; F380-F468 HydrophobicContact CD2-CD1 3.55Å; F380-F468 AromaticContact CD2-CE1 3.27Å; F380-F468 HydrophobicContact CD2-CE1 3.27Å; F380-F468 HydrophobicContact CD2-CG 4.45Å; F380-F468 HydrophobicContact CD2-CZ 4.02Å; F380-F468 HydrophobicContact CE2-CD1 4.36Å; F380-F468 AromaticContact CE2-CE1 3.63Å; F380-F468 HydrophobicContact CE2-CE1 3.63Å; F380-F468 HydrophobicContact CE2-CZ 4.07Å; F380-F468 AromaticContact CG-CD1 3.94Å; F380-F468 HydrophobicContact CG-CD1 3.94Å; F380-F468 AromaticContact CG-CE1 3.95Å; F380-F468 HydrophobicContact CG-CE1 3.95Å; F380-D469 PolarHBondContact O-N 3.46Å
381	D	55.3	Low	51.6	Low	67 Å²	67	30.7 Å²	30.7	36%	0.358	18%	0.182	S	C	.	.			trans	-101.2	143.7	156.1	-157.7	-31.3	0	0	0	107.3	F292 T294	F292-D381 PolarHBondContact O-N 3.39Å; T294-D381 PolarHBondContact N-O 3.29Å
382	T	53.8	Low	51.1	Low	5 Å²	5	32.1 Å²	32.1	3%	0.031	19%	0.188	C	C	.	.			trans	-152.8	116.3	177.8	-59.6	0	0	0	0	109.4	T294 T367 T455 D469 T470 S471	T294-T382 WeakPolarHBondContact O-CA 3.44Å; T367-T382 HydrophobicContact CG2-CG2 3.7Å; T382-T455 HydrophobicContact CG2-CG2 3.55Å; T382-D469 PolarHBondContact N-O 2.84Å; T382-T470 WeakPolarHBondContact O-CA 3.39Å; T382-S471 PolarHBondContact O-N 3.06Å
383	S	52.3	Low	50.6	Low	34 Å²	34	29.7 Å²	29.7	24%	0.238	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	127.3	-174.5	57.6	0	0	0	0	111.7	T294 S295 Q296 S471	T294-S383 PolarHBondContact O-N 3.2Å; S295-S383 WeakPolarHBondContact CA-O 3.23Å; S295-S383 WeakPolarHBondContact CB-OG 3.47Å; Q296-S383 PolarHBondContact N-O 3.29Å; S383-S471 WeakPolarHBondContact CA-O 3.47Å; S383-S471 WeakPolarHBondContact CB-OG 3.34Å
384	Q	54.4	Low	50.2	Low	2 Å²	2	28.8 Å²	28.8	1%	0.009	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	129.3	173	-71.4	-173.2	3.4	0	0	111.3	Q296 T365 T367 N454 T455 S471 Q472 T473	Q296-Q384 HydrophobicContact CB-CG 4.39Å; Q296-Q384 WeakPolarHBondContact O-CA 3.41Å; T365-Q384 PolarHBondContact OG1-OE1 2.95Å; T367-Q384 PolarHBondContact OG1-NE2 3.36Å; Q384-N454 PolarHBondContact NE2-O 3.21Å; Q384-T455 PolarHBondContact NE2-OG1 3.19Å; Q384-T455 PolarHBondContact OE1-OG1 3.04Å; Q384-S471 PolarHBondContact N-O 2.96Å; Q384-Q472 HydrophobicContact CB-CG 4.37Å; Q384-T473 PolarHBondContact O-N 3.39Å
385	T	50.9	Low	49.8	Very low	63 Å²	63	28.7 Å²	28.7	39%	0.387	17%	0.167	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	116.2	168.5	-61.1	0	0	0	0	110.2	Q296 T297 S298 T473	Q296-T385 PolarHBondContact O-N 3.47Å; T297-T385 WeakPolarHBondContact CA-O 3.25Å; S298-T385 PolarHBondContact N-O 2.86Å; T385-T473 WeakPolarHBondContact CA-O 3.36Å
386	S	47.3	Very low	49.2	Very low	1 Å²	1	28 Å²	28	1%	0.007	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	131.9	-179.4	-74.1	0	0	0	0	112	S298 T365 T453 T473 S474 S475	S298-S386 WeakPolarHBondContact O-CA 3.35Å; T365-S386 VanDerWaalsContact CG2-OG 3.25Å; T365-S386 WeakPolarHBondContact CG2-OG 3.45Å; S386-T453 WeakPolarHBondContact OG-CG2 3.46Å; S386-T473 PolarHBondContact N-O 2.84Å; S386-S474 WeakPolarHBondContact O-CA 3.38Å; S386-S475 PolarHBondContact O-N 3.12Å; S386-S475 PolarHBondContact O-OG 3.03Å
387	S	48.6	Very low	48.5	Very low	37 Å²	37	25.7 Å²	25.7	26%	0.259	15%	0.151	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	139.1	-178.1	55	0	0	0	0	113.7	S298 S299 T300 V363 S475	S298-S387 PolarHBondContact O-N 3.5Å; S299-S387 VanDerWaalsContact CA-O 3.27Å; S299-S387 WeakPolarHBondContact CA-O 3.32Å; S299-S387 WeakPolarHBondContact CB-OG 3.45Å; T300-S387 PolarHBondContact N-O 2.04Å; T300-S387 VanDerWaalsContact N-O 3.12Å; V363-S387 WeakPolarHBondContact CG2-O 3.42Å; S387-S475 VanDerWaalsContact CA-O 3.32Å; S387-S475 WeakPolarHBondContact CA-O 3.37Å; S387-S475 WeakPolarHBondContact CB-OG 3.46Å
388	T	43.8	Very low	47.8	Very low	10 Å²	10	27 Å²	27	6%	0.061	15%	0.148	C	C	.	.	P	Polyproline II helix	trans	-95.4	143	166.1	64.7	0	0	0	0	112.2	T300 V363 S449 V451 S475 T476 G477	T300-T388 WeakPolarHBondContact OG1-CA 3.3Å; V363-T388 HydrophobicContact CG2-CG2 4.16Å; T388-S449 VanDerWaalsContact OG1-CB 3.24Å; T388-S449 WeakPolarHBondContact OG1-CB 3.34Å; T388-S449 PolarHBondContact OG1-OG 2.68Å; T388-V451 HydrophobicContact CG2-CG2 3.87Å; T388-S475 PolarHBondContact N-O 3.21Å; T388-S475 VanDerWaalsContact N-O 3.11Å; T388-T476 WeakPolarHBondContact OG1-CA 3.33Å; T388-G477 WeakPolarHBondContact O-CA 3.4Å; T388-G477 PolarHBondContact O-N 3.35Å; T388-G477 VanDerWaalsContact O-N 3.12Å; T388-G477 PolarHBondContact OG1-N 3.32Å
389	G	40.6	Very low	47	Very low	8 Å²	8	27 Å²	27	8%	0.082	15%	0.148	C	C	.	.	P	Polyproline II helix	trans	-64.9	151.6	174.9	0	0	0	0	0	113.1	T300	T300-G389 WeakPolarHBondContact O-CA 3.47Å; T300-G389 PolarHBondContact O-N 3.35Å; T300-G389 VanDerWaalsContact O-N 3.09Å; T300-G389 PolarHBondContact OG1-N 3.3Å
390	Q	44.6	Very low	46	Very low	54 Å²	54	26.2 Å²	26.2	25%	0.252	14%	0.142	S	C	.	.	P	Polyproline II helix	trans	-72	150.1	177.5	-54.5	-173.9	108.1	0	0	111.6	Q302 T303 Q478	Q302-Q390 WeakPolarHBondContact CA-O 3.4Å; Q302-Q390 HydrophobicContact CG-CB 4.48Å; T303-Q390 PolarHBondContact N-O 2.7Å; Q390-Q478 WeakPolarHBondContact CA-O 3.35Å; Q390-Q478 WeakPolarHBondContact CB-O 3.45Å
391	T	41.6	Very low	45	Very low	8 Å²	8	25.9 Å²	25.9	5%	0.049	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	125.4	171.8	-63.4	0	0	0	0	110	T303 T359 I393 T447 Q478 T479 Q480	T303-T391 WeakPolarHBondContact O-CA 3.42Å; T359-T391 HydrophobicContact CG2-CG2 3.95Å; T391-I393 HydrophobicContact CG2-CG1 4.28Å; T391-T447 HydrophobicContact CG2-CG2 4.16Å; T391-Q478 PolarHBondContact N-O 3.41Å; T391-T479 WeakPolarHBondContact O-CA 3.39Å; T391-Q480 PolarHBondContact O-N 3.26Å
392	Q	43.3	Very low	44.3	Very low	32 Å²	32	25.2 Å²	25.2	15%	0.15	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	126.1	175.8	-57.2	-168.7	99.5	0	0	111	T303 Q304 I305 F394 Q480	T303-Q392 PolarHBondContact O-N 3.21Å; Q304-Q392 WeakPolarHBondContact CA-O 3.43Å; Q304-Q392 HydrophobicContact CG-CB 4.49Å; I305-Q392 PolarHBondContact N-O 3.43Å; Q392-F394 HydrophobicContact CB-CD2 4.21Å; Q392-F394 HydrophobicContact CB-CE2 3.58Å; Q392-F394 HydrophobicContact CB-CZ 4.29Å; Q392-F394 HydrophobicContact CG-CE2 4.42Å; Q392-Q480 WeakPolarHBondContact CA-O 3.44Å; Q392-Q480 HydrophobicContact CG-CB 4.46Å; Q392-Q480 VanDerWaalsContact OE1-NE2 3.15Å
393	I	41.8	Very low	43.5	Very low	0 Å²	0	25.2 Å²	25.2	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	112.9	178.5	-57.2	176.8	0	0	0	108.4	I357 T391 T395 I445 Q480 I481 F482	I357-I393 HydrophobicContact CG2-CD1 4.18Å; T391-I393 HydrophobicContact CG2-CG1 4.28Å; I393-T395 HydrophobicContact CG2-CG2 4.22Å; I393-I445 HydrophobicContact CD1-CD1 4.07Å; I393-I445 HydrophobicContact CD1-CG2 3.75Å; I393-Q480 PolarHBondContact N-O 2.97Å; I393-I481 HydrophobicContact CB-CG1 4.46Å; I393-F482 PolarHBondContact O-N 3.02Å
394	F	42.8	Very low	42.9	Very low	52 Å²	52	25.8 Å²	25.8	23%	0.228	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	114.7	180	-66.7	-85.6	0	0	0	110.2	I305 F306 T307 Q392 F482	I305-F394 PolarHBondContact O-N 3.14Å; F306-F394 WeakPolarHBondContact CA-O 3.23Å; F306-F394 HydrophobicContact CD1-CB 3.62Å; F306-F394 AromaticContact CD1-CD2 3.66Å; F306-F394 HydrophobicContact CD1-CD2 3.66Å; F306-F394 AromaticContact CD1-CG 3.86Å; F306-F394 HydrophobicContact CD1-CG 3.86Å; F306-F394 HydrophobicContact CE1-CB 4.03Å; F306-F394 AromaticContact CE1-CD2 3.21Å; F306-F394 HydrophobicContact CE1-CD2 3.21Å; F306-F394 AromaticContact CE1-CE2 3.71Å; F306-F394 HydrophobicContact CE1-CE2 3.71Å; F306-F394 AromaticContact CE1-CG 3.71Å; F306-F394 HydrophobicContact CE1-CG 3.71Å; F306-F394 HydrophobicContact CG-CB 4.44Å; F306-F394 HydrophobicContact CG-CD2 4.5Å; F306-F394 AromaticContact CZ-CD2 3.75Å; F306-F394 HydrophobicContact CZ-CD2 3.75Å; F306-F394 AromaticContact CZ-CE2 3.96Å; F306-F394 HydrophobicContact CZ-CE2 3.96Å; T307-F394 PolarHBondContact N-O 2.84Å; Q392-F394 HydrophobicContact CB-CD2 4.21Å; Q392-F394 HydrophobicContact CB-CE2 3.58Å; Q392-F394 HydrophobicContact CB-CZ 4.29Å; Q392-F394 HydrophobicContact CG-CE2 4.42Å; F394-F482 HydrophobicContact CD1-CB 3.71Å; F394-F482 AromaticContact CD1-CD2 3.64Å; F394-F482 HydrophobicContact CD1-CD2 3.64Å; F394-F482 AromaticContact CD1-CG 3.88Å; F394-F482 HydrophobicContact CD1-CG 3.88Å; F394-F482 HydrophobicContact CE1-CB 4.11Å; F394-F482 AromaticContact CE1-CD2 3.2Å; F394-F482 HydrophobicContact CE1-CD2 3.2Å; F394-F482 AromaticContact CE1-CE2 3.66Å; F394-F482 HydrophobicContact CE1-CE2 3.66Å; F394-F482 AromaticContact CE1-CG 3.73Å; F394-F482 HydrophobicContact CE1-CG 3.73Å; F394-F482 HydrophobicContact CG-CD2 4.5Å; F394-F482 AromaticContact CZ-CD2 3.77Å; F394-F482 HydrophobicContact CZ-CD2 3.77Å; F394-F482 AromaticContact CZ-CE2 3.92Å; F394-F482 HydrophobicContact CZ-CE2 3.92Å
395	T	43.2	Very low	42	Very low	1 Å²	1	26.6 Å²	26.6	1%	0.006	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	127.6	175.4	64.1	0	0	0	0	109.1	P354 I393 F482 T483 T484	P354-T395 HydrophobicContact CG-CG2 3.79Å; I393-T395 HydrophobicContact CG2-CG2 4.22Å; T395-F482 PolarHBondContact N-O 2.97Å; T395-F482 PolarHBondContact OG1-O 3.24Å; T395-T483 WeakPolarHBondContact OG1-CA 3.44Å; T395-T483 WeakPolarHBondContact OG1-CG2 3.38Å; T395-T484 PolarHBondContact O-N 2.89Å; T395-T484 VanDerWaalsContact O-N 3.08Å
396	T	43.3	Very low	41.4	Very low	47 Å²	47	26.4 Å²	26.4	29%	0.288	15%	0.146	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	121	-178.3	-62.8	0	0	0	0	111.3	T307 T308 D309 T484	T307-T396 PolarHBondContact O-N 2.66Å; T308-T396 WeakPolarHBondContact CA-O 3.38Å; D309-T396 PolarHBondContact N-O 2.97Å; T396-T484 WeakPolarHBondContact CA-O 3.27Å
397	D	41.9	Very low	40.8	Very low	0 Å²	0	28.9 Å²	28.9	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	123.5	176	-175.7	-3.7	0	0	0	108.1	T350 T438 T439 S440 T484 R486	T350-D397 WeakPolarHBondContact CB-OD1 3.26Å; T350-D397 WeakPolarHBondContact CG2-OD1 3.5Å; T350-D397 PolarHBondContact OG1-OD1 3.4Å; T350-D397 PolarHBondContact OG1-OD2 3.21Å; D397-T438 WeakPolarHBondContact OD1-CG2 3.28Å; D397-T438 VanDerWaalsContact OD2-CB 3.27Å; D397-T438 WeakPolarHBondContact OD2-CB 3.36Å; D397-T439 PolarHBondContact OD2-N 3.27Å; D397-T439 VanDerWaalsContact OD2-N 3.1Å; D397-S440 WeakPolarHBondContact CB-OG 3.16Å; D397-T484 PolarHBondContact N-O 3.46Å; D397-T484 VanDerWaalsContact N-O 3.1Å; D397-R486 PolarHBondContact O-N 2.93Å
398	R	42.4	Very low	40.2	Very low	91 Å²	91	29.4 Å²	29.4	34%	0.343	17%	0.165	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	112.2	-174	-171.4	176.4	176.4	177	-0.8	113.5	D309 R310 T311 P400 R486	D309-R398 PolarHBondContact O-N 2.97Å; R310-R398 WeakPolarHBondContact CA-O 3.4Å; T311-R398 PolarHBondContact N-O 3.14Å; R398-P400 VanDerWaalsContact O-CD 3.32Å; R398-P400 WeakPolarHBondContact O-CD 3.29Å; R398-R486 WeakPolarHBondContact CA-O 3.25Å
399	T	41.4	Very low	39.6	Very low	0 Å²	0	31.7 Å²	31.7	0%	0	18%	0.179	C	C	.	.			trans	-119.4	85.6	-176.9	60.8	0	0	0	0	112.3	T311 T350 A401 V436 T438 R486 T487	T311-T399 WeakPolarHBondContact OG1-CG2 3.46Å; T350-T399 HydrophobicContact CG2-CG2 3.25Å; T350-T399 WeakPolarHBondContact OG1-CG2 3.49Å; T399-A401 PolarHBondContact O-N 3.33Å; T399-V436 WeakPolarHBondContact OG1-CG1 3.18Å; T399-T438 HydrophobicContact CG2-CG2 3.56Å; T399-T438 WeakPolarHBondContact OG1-CG2 3.17Å; T399-R486 PolarHBondContact N-O 3.13Å; T399-T487 WeakPolarHBondContact OG1-CG2 3.36Å
400	P	36.5	Very low	39.3	Very low	31 Å²	31	34.7 Å²	34.7	20%	0.201	20%	0.199	C	C	.	.			trans	-69.9	119.2	165.9	-9.6	26.5	0	0	0	109.2	P312 A313 R398 P488	P312-P400 WeakPolarHBondContact CA-O 3.4Å; A313-P400 PolarHBondContact N-O 3.01Å; R398-P400 VanDerWaalsContact O-CD 3.32Å; R398-P400 WeakPolarHBondContact O-CD 3.29Å; P400-P488 WeakPolarHBondContact CA-O 3.41Å
401	A	35.8	Very low	38.6	Very low	1 Å²	1	35.2 Å²	35.2	1%	0.008	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	130.9	175.3	0	0	0	0	0	110.5	A313 T399 F403 V436 P488 A489 T490	A313-A401 WeakPolarHBondContact O-CA 3.48Å; T399-A401 PolarHBondContact O-N 3.33Å; A401-F403 HydrophobicContact CB-CD2 4.41Å; A401-F403 HydrophobicContact CB-CE2 3.63Å; A401-F403 HydrophobicContact CB-CZ 4.11Å; A401-V436 HydrophobicContact CB-CG2 3.74Å; A401-P488 PolarHBondContact N-O 2.98Å; A401-A489 WeakPolarHBondContact O-CA 3.08Å; A401-T490 PolarHBondContact O-N 3.44Å
402	T	39.2	Very low	38.1	Very low	52 Å²	52	38.3 Å²	38.3	32%	0.319	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	122.4	176.9	-55.9	0	0	0	0	109.6	A313 F315	A313-T402 PolarHBondContact O-N 2.91Å; F315-T402 PolarHBondContact N-O 3.06Å
403	F	38	Very low	37.4	Very low	5 Å²	5	40.7 Å²	40.7	2%	0.022	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	124.3	-178.9	-61.3	-83.1	0	0	0	109.6	F315 E346 A401 E434 V436 T490 F491 T492	F315-F403 HydrophobicContact CB-CD1 3.98Å; F315-F403 HydrophobicContact CB-CE1 4.41Å; F315-F403 AromaticContact CD2-CD1 3.67Å; F315-F403 HydrophobicContact CD2-CD1 3.67Å; F315-F403 AromaticContact CD2-CE1 3.3Å; F315-F403 HydrophobicContact CD2-CE1 3.3Å; F315-F403 HydrophobicContact CD2-CZ 4.06Å; F315-F403 AromaticContact CE2-CE1 3.72Å; F315-F403 HydrophobicContact CE2-CE1 3.72Å; F315-F403 HydrophobicContact CE2-CZ 4.17Å; F315-F403 HydrophobicContact CG-CD1 4.09Å; F315-F403 HydrophobicContact CG-CE1 4.01Å; E346-F403 HydrophobicContact CB-CE1 4.04Å; E346-F403 WeakPolarHBondContact OE2-CD1 3.3Å; E346-F403 WeakPolarHBondContact OE2-CE1 3.41Å; A401-F403 HydrophobicContact CB-CD2 4.41Å; A401-F403 HydrophobicContact CB-CE2 3.63Å; A401-F403 HydrophobicContact CB-CZ 4.11Å; F403-E434 VanDerWaalsContact CB-OE2 3.27Å; F403-E434 WeakPolarHBondContact CB-OE2 3.3Å; F403-E434 HydrophobicContact CD1-CG 4.02Å; F403-E434 WeakPolarHBondContact CD1-OE2 3.34Å; F403-E434 HydrophobicContact CE1-CB 4.38Å; F403-E434 HydrophobicContact CE1-CG 4.1Å; F403-E434 WeakPolarHBondContact CG-OE2 3.39Å; F403-E434 HydrophobicContact CZ-CB 4.49Å; F403-V436 HydrophobicContact CE2-CG2 3.96Å; F403-V436 HydrophobicContact CZ-CG2 4.19Å; F403-T490 PolarHBondContact N-O 2.95Å; F403-F491 HydrophobicContact CB-CD1 3.96Å; F403-F491 HydrophobicContact CB-CE1 4.46Å; F403-F491 AromaticContact CD2-CD1 3.64Å; F403-F491 HydrophobicContact CD2-CD1 3.64Å; F403-F491 AromaticContact CD2-CE1 3.33Å; F403-F491 HydrophobicContact CD2-CE1 3.33Å; F403-F491 HydrophobicContact CD2-CZ 4.03Å; F403-F491 HydrophobicContact CE2-CD1 4.48Å; F403-F491 AromaticContact CE2-CE1 3.73Å; F403-F491 HydrophobicContact CE2-CE1 3.73Å; F403-F491 HydrophobicContact CE2-CZ 4.15Å; F403-F491 HydrophobicContact CG-CD1 4.06Å; F403-F491 HydrophobicContact CG-CE1 4.05Å; F403-T492 PolarHBondContact O-N 3.06Å
404	T	38.7	Very low	36.7	Very low	47 Å²	47	45 Å²	45	29%	0.288	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	119.6	180	-58	0	0	0	0	110.2	F315 T316 S317	F315-T404 PolarHBondContact O-N 3.03Å; F315-T404 VanDerWaalsContact O-N 3.14Å; T316-T404 WeakPolarHBondContact CA-O 3.47Å; S317-T404 PolarHBondContact N-O 3.01Å; S317-T404 VanDerWaalsContact N-O 3.07Å
405	S	35.7	Very low	35.9	Very low	18 Å²	18	47.5 Å²	47.5	13%	0.126	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	132.7	179.1	63	0	0	0	0	112.6	T492	S405-T492 PolarHBondContact N-O 2.89Å; S405-T492 VanDerWaalsContact N-O 3.12Å
406	T	38.8	Very low	35	Very low	60 Å²	60	52.6 Å²	52.6	37%	0.368	32%	0.323	S	S	.	.			trans	-128.6	89.4	-177.7	-44.2	0	0	0	0	109.6	S317 P319	S317-T406 PolarHBondContact O-N 3.33Å; P319-T406 WeakPolarHBondContact CD-O 3.19Å
407	P	35.3	Very low	34.1	Very low	53 Å²	53	55.8 Å²	55.8	34%	0.344	34%	0.338	S	S	.	.	P	Polyproline II helix	trans	-57.4	147.5	-178.4	23.6	-36.2	0	0	0	113.2	T494	P407-T494 VanDerWaalsContact CD-O 3.24Å; P407-T494 WeakPolarHBondContact CD-O 3.18Å; P407-T494 WeakPolarHBondContact CG-O 3.07Å
408	S	34.8	Very low	33.3	Very low	47 Å²	47	62.1 Å²	62.1	33%	0.329	38%	0.377	S	S	.	.	P	Polyproline II helix	trans	-70.8	150.8	-176.6	38.3	0	0	0	0	113.8	P319 S320 S496	P319-S408 WeakPolarHBondContact O-CB 3.31Å; S320-S408 WeakPolarHBondContact O-CB 3.04Å; S320-S408 PolarHBondContact O-OG 2.95Å; S320-S408 VanDerWaalsContact O-OG 3.05Å; S408-S496 WeakPolarHBondContact O-CB 3.12Å; S408-S496 PolarHBondContact O-OG 3.02Å
409	T	32.9	Very low	32.3	Very low	58 Å²	58	62.1 Å²	62.1	36%	0.356	38%	0.384	S	S	.	.	P	Polyproline II helix	trans	-88.1	148.1	163.3	49.3	0	0	0	0	110.1	T321 T497	T321-T409 WeakPolarHBondContact CG2-O 3.35Å; T409-T497 WeakPolarHBondContact CG2-O 3.43Å
410	S	32.7	Very low	31.5	Very low	71 Å²	71	67.5 Å²	67.5	50%	0.497	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	141.1	163.1	52.6	0	0	0	0	109.1
411	T	31.4	Very low	31	Very low	66 Å²	66	73.1 Å²	73.1	41%	0.405	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	133.5	173.7	47.6	0	0	0	0	109.4
412	S	30.3	Very low	30.6	Very low	72 Å²	72	75.5 Å²	75.5	50%	0.503	45%	0.451	S	S	.	.			trans	-138.9	129.6	180	51	0	0	0	0	110.2
413	T	29.1	Very low	30	Very low	83 Å²	83	76.1 Å²	76.1	51%	0.509	46%	0.457	S	S	.	.			trans	-121.7	99.9	178.4	37.2	0	0	0	0	108.2
414	P	26.7	Very low	29.5	Very low	90 Å²	90	79.7 Å²	79.7	58%	0.584	48%	0.476	S	S	*	.			trans	-75.9	145.2	-178.7	31.4	-34.1	0	0	0	110.9
415	T	26.4	Very low	29.2	Very low	104 Å²	104	79.9 Å²	79.9	64%	0.638	48%	0.478	S	S	*	.			trans	-131.9	118	167	-52.1	0	0	0	0	108.1
416	T	24.1	Very low	28.8	Very low	108 Å²	108	81.7 Å²	81.7	66%	0.663	49%	0.49	S	S	*	.			trans	28.5	112.1	169.8	55.9	0	0	0	0	118.7
417	L	24.9	Very low	28.4	Very low	115 Å²	115	80.8 Å²	80.8	60%	0.602	48%	0.484	S	S	*	.			trans	-132.7	162.2	163.9	-142.9	82.8	0	0	0	109.9
418	T	24.1	Very low	28	Very low	133 Å²	133	80.9 Å²	80.9	82%	0.816	49%	0.486	S	S	*	.			trans	-129.3	155	177.2	-49.1	0	0	0	0	109
419	D	22.6	Very low	27.9	Very low	91 Å²	91	80.8 Å²	80.8	49%	0.487	49%	0.486	S	S	.	.	S	Bend	trans	-36	149.3	-175.3	-89.9	-33.8	0	0	0	117.1
420	N	24.2	Very low	27.9	Very low	113 Å²	113	79.8 Å²	79.8	60%	0.604	48%	0.481	S	S	*	.	S	Bend	cis	-131.3	154.8	20.6	-93.4	-81	0	0	0	114.6
421	Q	26.1	Very low	28	Very low	148 Å²	148	80.7 Å²	80.7	69%	0.692	48%	0.476	S	S	*	.			trans	36.6	109.1	168.3	-74.9	-165.7	11.9	0	0	118.4
422	T	26.8	Very low	28.1	Very low	52 Å²	52	78.5 Å²	78.5	32%	0.319	46%	0.462	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	134.4	164.4	-58	0	0	0	0	110.5	L424	T422-L424 HydrophobicContact CG2-CG 4.37Å
423	S	26.3	Very low	28.5	Very low	65 Å²	65	76.9 Å²	76.9	46%	0.455	45%	0.449	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	125.2	166.8	-72.7	0	0	0	0	109.9
424	L	27.5	Very low	29	Very low	80 Å²	80	73.2 Å²	73.2	42%	0.419	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	106.7	176.7	-89	162.3	0	0	0	109.2	L336 T422 L512	L336-L424 HydrophobicContact CB-CD2 3.76Å; L336-L424 HydrophobicContact CD1-CD2 4.45Å; T422-L424 HydrophobicContact CG2-CG 4.37Å; L424-L512 HydrophobicContact CB-CD2 3.91Å
425	T	31.6	Very low	29.5	Very low	51 Å²	51	70.7 Å²	70.7	31%	0.313	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	107.9	179.4	-55.5	0	0	0	0	109.2
426	S	29.2	Very low	29.9	Very low	55 Å²	55	65.9 Å²	65.9	39%	0.385	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	93.7	177.9	50.5	0	0	0	0	110.4
427	T	28.5	Very low	30.7	Very low	41 Å²	41	65.1 Å²	65.1	25%	0.252	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	95.7	-179	-48.9	0	0	0	0	110.2
428	S	28.9	Very low	31.4	Very low	55 Å²	55	59.6 Å²	59.6	39%	0.385	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	117.6	168.7	54.3	0	0	0	0	110.2	S517	S428-S517 PolarHBondContact O-N 2.93Å; S428-S517 VanDerWaalsContact O-N 3.14Å
429	S	31.7	Very low	32.3	Very low	45 Å²	45	54 Å²	54	32%	0.315	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	112.1	174.1	61.3	0	0	0	0	110.6	S340 S341 S342	S340-S429 PolarHBondContact O-N 2.92Å; S341-S429 WeakPolarHBondContact CA-O 3.46Å; S342-S429 PolarHBondContact N-O 3.02Å
430	S	33.6	Very low	33.3	Very low	37 Å²	37	49.7 Å²	49.7	26%	0.259	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	126.3	172	56.2	0	0	0	0	109.4	S518 K519	S430-S518 WeakPolarHBondContact O-CA 3.48Å; S430-K519 PolarHBondContact O-N 3.47Å
431	K	34.1	Very low	34.3	Very low	90 Å²	90	45.9 Å²	45.9	39%	0.391	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	97.4	169.7	-173.2	171.9	-178.8	175.1	0	109.5	S342 L344	S342-K431 PolarHBondContact O-N 3.19Å; L344-K431 PolarHBondContact N-O 3.24Å
432	L	34.4	Very low	35.1	Very low	20 Å²	20	38.8 Å²	38.8	11%	0.105	23%	0.227	C	C	.	.			trans	-84.7	147.7	168.7	-77	138.5	0	0	0	109.5	L344 E434 K519 L520	L344-L432 HydrophobicContact CB-CD2 3.66Å; L344-L432 HydrophobicContact CB-CG 4.28Å; L344-L432 HydrophobicContact CD2-CD2 3.62Å; L344-L432 HydrophobicContact CG-CD2 4.29Å; L432-E434 WeakPolarHBondContact CD2-OE1 3.35Å; L432-K519 PolarHBondContact N-O 3.01Å; L432-L520 HydrophobicContact CB-CD1 4.02Å; L432-L520 HydrophobicContact CB-CG 4.13Å; L432-L520 HydrophobicContact CD1-CD1 3.82Å
433	T	38.8	Very low	36	Very low	38 Å²	38	37.5 Å²	37.5	23%	0.233	22%	0.219	C	C	.	.			trans	-151.9	108.1	174.1	-60.6	0	0	0	0	106.8	T345 E346 T521	T345-T433 WeakPolarHBondContact CA-O 3.4Å; E346-T433 PolarHBondContact N-O 3.01Å; T433-T521 WeakPolarHBondContact CA-O 3.36Å
434	E	37.8	Very low	37	Very low	7 Å²	7	37.5 Å²	37.5	3%	0.033	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	134.7	-169.7	-73.3	161.2	-130.8	0	0	109.1	E346 F403 L432 F491 T521 S523	E346-E434 HydrophobicContact CB-CG 4.42Å; F403-E434 VanDerWaalsContact CB-OE2 3.27Å; F403-E434 WeakPolarHBondContact CB-OE2 3.3Å; F403-E434 HydrophobicContact CD1-CG 4.02Å; F403-E434 WeakPolarHBondContact CD1-OE2 3.34Å; F403-E434 HydrophobicContact CE1-CB 4.38Å; F403-E434 HydrophobicContact CE1-CG 4.1Å; F403-E434 WeakPolarHBondContact CG-OE2 3.39Å; F403-E434 HydrophobicContact CZ-CB 4.49Å; L432-E434 WeakPolarHBondContact CD2-OE1 3.35Å; E434-F491 HydrophobicContact CB-CE1 4.19Å; E434-F491 VanDerWaalsContact OE2-CD1 3.31Å; E434-F491 WeakPolarHBondContact OE2-CD1 3.37Å; E434-F491 WeakPolarHBondContact OE2-CE1 3.45Å; E434-T521 PolarHBondContact N-O 3.04Å; E434-T521 VanDerWaalsContact N-O 3.1Å; E434-S523 PolarHBondContact O-N 2.91Å; E434-S523 VanDerWaalsContact O-N 3.1Å; E434-S523 PolarHBondContact O-OG 2.94Å
435	S	37.6	Very low	37.8	Very low	37 Å²	37	33.7 Å²	33.7	26%	0.259	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	126.2	-171.6	55.1	0	0	0	0	112.9	E346 S347 V348 S523	E346-S435 PolarHBondContact O-N 3Å; E346-S435 PolarHBondContact O-OG 3.47Å; S347-S435 WeakPolarHBondContact CA-O 3.32Å; V348-S435 PolarHBondContact N-O 3.05Å; S435-S523 WeakPolarHBondContact CA-O 3.38Å
436	V	34.9	Very low	38.4	Very low	3 Å²	3	33.9 Å²	33.9	2%	0.018	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	123.4	174.8	-176.4	0	0	0	0	108.5	T399 A401 F403 T487 S523 R525	T399-V436 WeakPolarHBondContact OG1-CG1 3.18Å; A401-V436 HydrophobicContact CB-CG2 3.74Å; F403-V436 HydrophobicContact CE2-CG2 3.96Å; F403-V436 HydrophobicContact CZ-CG2 4.19Å; V436-T487 HydrophobicContact CG1-CG2 4.29Å; V436-S523 PolarHBondContact N-O 2.95Å; V436-R525 PolarHBondContact O-N 2.99Å
437	R	42.1	Very low	39.1	Very low	91 Å²	91	31.4 Å²	31.4	34%	0.343	18%	0.178	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	116.5	179.3	-178.8	178.2	172.8	165.7	1.7	112.7	V348 R349 T350 T439 R525	V348-R437 PolarHBondContact O-N 3.03Å; R349-R437 VanDerWaalsContact CA-O 3.32Å; R349-R437 WeakPolarHBondContact CA-O 3.37Å; T350-R437 PolarHBondContact N-O 3.1Å; R437-T439 PolarHBondContact NE-OG1 2.97Å; R437-R525 WeakPolarHBondContact CA-O 3.48Å
438	T	38.2	Very low	40.1	Very low	0 Å²	0	31.1 Å²	31.1	0%	0	18%	0.178	C	C	.	.			trans	-95	162.9	165.5	47.1	0	0	0	0	110.7	T350 D397 T399 D485 T487 R525 T526	T350-T438 WeakPolarHBondContact OG1-CA 3.18Å; T350-T438 WeakPolarHBondContact OG1-CG2 3.37Å; D397-T438 WeakPolarHBondContact OD1-CG2 3.28Å; D397-T438 VanDerWaalsContact OD2-CB 3.27Å; D397-T438 WeakPolarHBondContact OD2-CB 3.36Å; T399-T438 HydrophobicContact CG2-CG2 3.56Å; T399-T438 WeakPolarHBondContact OG1-CG2 3.17Å; T438-D485 WeakPolarHBondContact CB-OD1 3.39Å; T438-D485 WeakPolarHBondContact CG2-OD1 3.37Å; T438-D485 PolarHBondContact OG1-OD1 2.98Å; T438-D485 PolarHBondContact OG1-OD2 3.13Å; T438-T487 HydrophobicContact CG2-CG2 3.42Å; T438-T487 VanDerWaalsContact CG2-CG2 3.42Å; T438-T487 WeakPolarHBondContact OG1-CG2 3.29Å; T438-R525 PolarHBondContact N-O 2.98Å; T438-T526 WeakPolarHBondContact OG1-CA 3.18Å; T438-T526 WeakPolarHBondContact OG1-CG2 3.35Å
439	T	43.7	Very low	41	Very low	15 Å²	15	28.9 Å²	28.9	9%	0.092	16%	0.162	C	C	.	.			trans	-162.5	109.1	174.5	-66.7	0	0	0	0	109	S352 D397 R437 V441	S352-T439 PolarHBondContact N-O 3.42Å; D397-T439 PolarHBondContact OD2-N 3.27Å; D397-T439 VanDerWaalsContact OD2-N 3.1Å; R437-T439 PolarHBondContact NE-OG1 2.97Å; T439-V441 HydrophobicContact CG2-CG2 3.67Å
440	S	43.9	Very low	41.5	Very low	0 Å²	0	29 Å²	29	0%	0	16%	0.161	C	C	.	.	B	Isolated β-bridge	trans	-113.7	113.1	179	-76.7	0	0	0	0	111.3	S352 D397 T527 S528 V529	S352-S440 WeakPolarHBondContact O-CA 3.43Å; D397-S440 WeakPolarHBondContact CB-OG 3.16Å; S440-T527 PolarHBondContact N-O 2.83Å; S440-S528 WeakPolarHBondContact O-CA 3.4Å; S440-V529 PolarHBondContact O-N 3.43Å
441	V	44.2	Very low	41.9	Very low	33 Å²	33	27.3 Å²	27.3	20%	0.2	15%	0.149	C	C	.	.			trans	-140.2	79.4	-169.9	-172.4	0	0	0	0	110.2	S352 V353 T439 T443 V529	S352-V441 PolarHBondContact O-N 3.13Å; S352-V441 VanDerWaalsContact O-N 3.13Å; V353-V441 VanDerWaalsContact CG1-O 3.3Å; V353-V441 WeakPolarHBondContact CG1-O 3.18Å; T439-V441 HydrophobicContact CG2-CG2 3.67Å; V441-T443 HydrophobicContact CG1-CG2 3.76Å; V441-V529 WeakPolarHBondContact CG1-O 3.35Å
442	P	44	Very low	42.3	Very low	0 Å²	0	24.9 Å²	24.9	0%	0	15%	0.146	C	C	.	.			trans	-69.6	131	170.5	28.7	-32.5	0	0	0	110.6	P354 I445 T483 P530 T531	P354-P442 WeakPolarHBondContact O-CA 3.5Å; P442-I445 HydrophobicContact CB-CD1 3.93Å; P442-T483 HydrophobicContact CG-CG2 3.63Å; P442-P530 HydrophobicContact CG-CB 4.19Å; P442-T531 PolarHBondContact O-N 3.31Å
443	T	44.9	Very low	43	Very low	25 Å²	25	24.1 Å²	24.1	15%	0.153	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	152.9	-179.1	70.9	0	0	0	0	113.3	P354 T355 N356 V441 T531	P354-T443 PolarHBondContact O-N 3.47Å; P354-T443 VanDerWaalsContact O-N 3.12Å; T355-T443 WeakPolarHBondContact CA-O 3.43Å; T355-T443 WeakPolarHBondContact CG2-OG1 3.38Å; N356-T443 PolarHBondContact N-O 2.92Å; V441-T443 HydrophobicContact CG1-CG2 3.76Å; T443-T531 VanDerWaalsContact CA-O 3.32Å; T443-T531 WeakPolarHBondContact CA-O 3.38Å; T443-T531 WeakPolarHBondContact CG2-OG1 3.42Å
444	N	48.3	Very low	43.5	Very low	64 Å²	64	24.9 Å²	24.9	34%	0.342	15%	0.145	S	C	.	.	E	Extended strand (participates in β ladder)	trans	53.3	60.6	178.8	-58.4	-14.3	0	0	0	112.1	N356 I357 T531 N532	N356-N444 VanDerWaalsContact CA-O 3.3Å; N356-N444 WeakPolarHBondContact CA-O 3.29Å; N356-N444 PolarHBondContact N-O 3.38Å; N356-N444 WeakPolarHBondContact OD1-CB 3.48Å; N356-N444 PolarHBondContact OD1-ND2 2.97Å; I357-N444 PolarHBondContact N-O 2.99Å; N444-T531 PolarHBondContact N-O 3.5Å; N444-N532 VanDerWaalsContact CA-O 3.27Å; N444-N532 WeakPolarHBondContact CA-O 3.37Å; N444-N532 PolarHBondContact N-O 3.04Å; N444-N532 WeakPolarHBondContact OD1-CB 3.34Å; N444-N532 PolarHBondContact OD1-ND2 2.9Å
445	I	43.2	Very low	44.2	Very low	0 Å²	0	24.8 Å²	24.8	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	123.6	174.7	-61.7	-179.6	0	0	0	108.4	I357 I393 P442 T447 I481 N532 I533 T534	I357-I445 HydrophobicContact CB-CG1 4.36Å; I357-I445 WeakPolarHBondContact O-CA 3.34Å; I393-I445 HydrophobicContact CD1-CD1 4.07Å; I393-I445 HydrophobicContact CD1-CG2 3.75Å; P442-I445 HydrophobicContact CB-CD1 3.93Å; I445-T447 HydrophobicContact CG2-CG2 3.99Å; I445-I481 HydrophobicContact CD1-CD1 4.33Å; I445-I481 HydrophobicContact CG2-CD1 4.26Å; I445-N532 PolarHBondContact N-O 2.89Å; I445-N532 VanDerWaalsContact N-O 3.16Å; I445-I533 HydrophobicContact CB-CG1 4.43Å; I445-I533 WeakPolarHBondContact O-CA 3.43Å; I445-T534 PolarHBondContact O-N 2.91Å
446	T	45	Very low	44.7	Very low	55 Å²	55	24.3 Å²	24.3	34%	0.337	14%	0.141	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	118	175.7	-56.2	0	0	0	0	109.7	I357 T358 T359 T534	I357-T446 PolarHBondContact O-N 3.06Å; T358-T446 WeakPolarHBondContact CA-O 3.24Å; T359-T446 PolarHBondContact N-O 3.49Å; T446-T534 WeakPolarHBondContact CA-O 3.35Å
447	T	43.9	Very low	45.3	Very low	4 Å²	4	24.6 Å²	24.6	3%	0.025	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	117.4	176.5	66.9	0	0	0	0	109.7	T359 T391 I445 T479 T534 T535 S536	T359-T447 WeakPolarHBondContact O-CA 3.47Å; T359-T447 WeakPolarHBondContact OG1-CB 3.4Å; T359-T447 WeakPolarHBondContact OG1-CG2 3.44Å; T391-T447 HydrophobicContact CG2-CG2 4.16Å; I445-T447 HydrophobicContact CG2-CG2 3.99Å; T447-T479 HydrophobicContact CG2-CG2 3.87Å; T447-T479 PolarHBondContact OG1-OG1 3.44Å; T447-T534 PolarHBondContact N-O 2.81Å; T447-T535 VanDerWaalsContact OG1-CG2 3.29Å; T447-T535 WeakPolarHBondContact OG1-CG2 3.37Å; T447-S536 PolarHBondContact O-N 2.99Å
448	S	49.2	Very low	45.8	Very low	34 Å²	34	22.4 Å²	22.4	24%	0.238	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	134.1	177.6	57.2	0	0	0	0	112	T359 S360 S361 S536	T359-S448 PolarHBondContact O-N 2.86Å; S360-S448 WeakPolarHBondContact CA-O 3.44Å; S361-S448 PolarHBondContact N-O 2.87Å; S448-S536 WeakPolarHBondContact CA-O 3.33Å
449	S	46.6	Very low	46.3	Very low	9 Å²	9	22.5 Å²	22.5	6%	0.063	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	123.6	168.7	-85	0	0	0	0	110.3	S361 T388 S536 S537 T538	S361-S449 WeakPolarHBondContact O-CA 3.45Å; T388-S449 VanDerWaalsContact OG1-CB 3.24Å; T388-S449 WeakPolarHBondContact OG1-CB 3.34Å; T388-S449 PolarHBondContact OG1-OG 2.68Å; S449-S536 PolarHBondContact N-O 2.99Å; S449-S537 WeakPolarHBondContact O-CA 3.4Å; S449-T538 PolarHBondContact O-N 3.06Å
450	T	43.9	Very low	46.5	Very low	48 Å²	48	24.1 Å²	24.1	29%	0.294	15%	0.152	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	123	179	-56.4	0	0	0	0	109.6	S361 T362 V363 T538	S361-T450 PolarHBondContact O-N 3.43Å; T362-T450 WeakPolarHBondContact CA-O 3.16Å; V363-T450 PolarHBondContact N-O 3.5Å; T450-T538 WeakPolarHBondContact CA-O 3.27Å
451	V	40.5	Very low	46.7	Very low	0 Å²	0	28 Å²	28	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	120.3	168.2	176	0	0	0	0	108	V363 T388 T453 S475 T476 T538 V539 A540	V363-V451 HydrophobicContact CB-CG2 4.43Å; V363-V451 WeakPolarHBondContact O-CA 3.24Å; T388-V451 HydrophobicContact CG2-CG2 3.87Å; V451-T453 HydrophobicContact CG1-CG2 3.79Å; V451-S475 WeakPolarHBondContact CG2-O 3.39Å; V451-T476 HydrophobicContact CG2-CG2 4.17Å; V451-T538 PolarHBondContact N-O 3.03Å; V451-V539 HydrophobicContact CB-CG2 4.49Å; V451-V539 WeakPolarHBondContact O-CA 3.48Å; V451-A540 PolarHBondContact O-N 3.33Å
452	A	44.3	Very low	46.9	Very low	40 Å²	40	26.5 Å²	26.5	33%	0.331	16%	0.161	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	108.2	176.6	0	0	0	0	0	109.1	V363 A364 T365 A540	V363-A452 PolarHBondContact O-N 3.46Å; A364-A452 WeakPolarHBondContact CA-O 3.43Å; T365-A452 PolarHBondContact N-O 3.44Å; A452-A540 WeakPolarHBondContact CA-O 3.42Å
453	T	47.4	Very low	47.2	Very low	4 Å²	4	29.7 Å²	29.7	3%	0.025	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	135	-177.7	60.2	0	0	0	0	111.2	T365 S386 V451 Q472 S474 A540 T541 N542	T365-T453 WeakPolarHBondContact OG1-CG2 3.42Å; S386-T453 WeakPolarHBondContact OG-CG2 3.46Å; V451-T453 HydrophobicContact CG1-CG2 3.79Å; T453-Q472 PolarHBondContact OG1-OE1 3.28Å; T453-S474 VanDerWaalsContact CG2-OG 3.24Å; T453-S474 WeakPolarHBondContact CG2-OG 3.33Å; T453-S474 PolarHBondContact OG1-OG 2.64Å; T453-A540 PolarHBondContact N-O 3.09Å; T453-T541 WeakPolarHBondContact OG1-CG2 3.39Å; T453-N542 PolarHBondContact O-N 2.94Å
454	N	50.7	Low	47.7	Very low	54 Å²	54	31.5 Å²	31.5	29%	0.289	19%	0.189	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	132.5	172.1	-167	12.9	0	0	0	110.5	T365 N366 T367 Q384 N542	T365-N454 PolarHBondContact O-N 2.78Å; N366-N454 WeakPolarHBondContact CA-O 3.42Å; N366-N454 PolarHBondContact OD1-O 3.34Å; T367-N454 PolarHBondContact N-O 3.3Å; Q384-N454 PolarHBondContact NE2-O 3.21Å; N454-N542 WeakPolarHBondContact CA-O 3.32Å
455	T	51.2	Low	47.9	Very low	4 Å²	4	31 Å²	31	3%	0.025	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	129.3	168.2	-47.6	0	0	0	0	109.3	T367 T382 Q384 T470 Q472 N542 T543 S544	T367-T455 WeakPolarHBondContact O-CA 3.23Å; T382-T455 HydrophobicContact CG2-CG2 3.55Å; Q384-T455 PolarHBondContact NE2-OG1 3.19Å; Q384-T455 PolarHBondContact OE1-OG1 3.04Å; T455-T470 HydrophobicContact CG2-CG2 3.94Å; T455-Q472 VanDerWaalsContact CB-NE2 3.34Å; T455-Q472 PolarHBondContact OG1-NE2 2.68Å; T455-N542 PolarHBondContact N-O 3.01Å; T455-T543 WeakPolarHBondContact O-CA 3.31Å; T455-S544 PolarHBondContact O-N 3.45Å
456	S	49.1	Very low	48.2	Very low	27 Å²	27	31 Å²	31	19%	0.189	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	125.7	178.5	61.5	0	0	0	0	112.7	T367 S368 A369 S544	T367-S456 PolarHBondContact O-N 2.99Å; S368-S456 WeakPolarHBondContact CA-O 3.18Å; A369-S456 PolarHBondContact N-O 3.08Å; S456-S544 WeakPolarHBondContact CA-O 3.24Å; S456-S544 VanDerWaalsContact CB-OG 3.3Å; S456-S544 WeakPolarHBondContact CB-OG 3.42Å
457	A	47.2	Very low	48.4	Very low	9 Å²	9	30.4 Å²	30.4	7%	0.074	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	123.4	171.6	0	0	0	0	0	109.8	F468 S544 A545 T546	A457-F468 HydrophobicContact CB-CD1 3.77Å; A457-F468 HydrophobicContact CB-CE1 3.77Å; A457-S544 PolarHBondContact N-O 2.91Å; A457-A545 WeakPolarHBondContact O-CA 3.42Å; A457-T546 PolarHBondContact O-N 3.23Å; A457-T546 VanDerWaalsContact O-N 3.09Å
458	T	51.8	Low	48.6	Very low	46 Å²	46	30.6 Å²	30.6	28%	0.282	19%	0.187	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	119	-176	-57	0	0	0	0	111.6	A369 V371	A369-T458 PolarHBondContact O-N 2.93Å; V371-T458 PolarHBondContact N-O 3.14Å
459	V	49.6	Very low	48.5	Very low	1 Å²	1	32.3 Å²	32.3	1%	0.006	19%	0.194	C	C	.	.			trans	-133.5	103.7	177.1	-176.7	0	0	0	0	109.4	V371 V374 F380 Q461 V462 F468 T546 P548	V371-V459 HydrophobicContact CB-CG2 4.5Å; V374-V459 HydrophobicContact CB-CG1 4.47Å; V374-V459 HydrophobicContact CG2-CG1 3.85Å; F380-V459 HydrophobicContact CE2-CG2 3.89Å; F380-V459 HydrophobicContact CZ-CG2 3.92Å; V459-Q461 PolarHBondContact O-N 2.88Å; V459-V462 HydrophobicContact CB-CG2 4.39Å; V459-V462 HydrophobicContact CG1-CG2 3.56Å; V459-F468 HydrophobicContact CB-CZ 4.41Å; V459-F468 HydrophobicContact CG2-CE1 4.1Å; V459-F468 HydrophobicContact CG2-CZ 3.78Å; V459-T546 PolarHBondContact N-O 3.24Å; V459-P548 WeakPolarHBondContact O-CD 3.25Å
460	P	48.5	Very low	48.5	Very low	49 Å²	49	32.3 Å²	32.3	32%	0.318	19%	0.193	S	C	.	.	S	Bend	trans	-60.8	-35.7	-177	-27.9	36.8	0	0	0	116	V371 P372	V371-P460 VanDerWaalsContact O-CD 3.24Å; V371-P460 WeakPolarHBondContact O-CD 3.31Å; P372-P460 WeakPolarHBondContact O-CB 3.41Å; P372-P460 WeakPolarHBondContact O-CD 3.5Å
461	Q	47.4	Very low	48.7	Very low	83 Å²	83	31.7 Å²	31.7	39%	0.388	19%	0.191	S	C	.	.			trans	-145.7	135.7	178	-62.3	-164.4	-58.3	0	0	113.5	V374 V459 Q549	V374-Q461 PolarHBondContact N-O 2.91Å; V459-Q461 PolarHBondContact O-N 2.88Å; Q461-Q549 HydrophobicContact CG-CB 4.13Å; Q461-Q549 HydrophobicContact CG-CG 4.39Å
462	V	49.1	Very low	49	Very low	1 Å²	1	31.8 Å²	31.8	1%	0.006	19%	0.191	C	C	.	.	B	Isolated β-bridge	trans	-129.3	125.6	178	175.3	0	0	0	0	111.5	V459 T466 V547 Q549 V550 N551	V459-V462 HydrophobicContact CB-CG2 4.39Å; V459-V462 HydrophobicContact CG1-CG2 3.56Å; V462-T466 WeakPolarHBondContact CG1-OG1 3.4Å; V462-V547 HydrophobicContact CG2-CG1 4.11Å; V462-Q549 PolarHBondContact N-O 2.84Å; V462-Q549 VanDerWaalsContact N-O 3.09Å; V462-V550 HydrophobicContact CB-CG2 4.5Å; V462-N551 PolarHBondContact O-N 2.88Å
463	N	50.5	Low	49.1	Very low	67 Å²	67	32.9 Å²	32.9	36%	0.358	19%	0.194	S	C	.	.	S	Bend	trans	-92.5	-37.5	-176.7	-85.9	-35.9	0	0	0	116.6	V374 N375 N551 T552	V374-N463 PolarHBondContact O-N 3.46Å; N375-N463 PolarHBondContact OD1-ND2 2.92Å; N463-N551 PolarHBondContact OD1-ND2 2.92Å; N463-T552 PolarHBondContact O-OG1 2.85Å
464	T	54.1	Low	48.9	Very low	62 Å²	62	32.8 Å²	32.8	38%	0.38	19%	0.193	S	C	.	.	S	Bend	trans	-133.5	-46.7	-170.2	42.5	0	0	0	0	116.7	N375 T376 T552	N375-T464 PolarHBondContact O-OG1 3.44Å; T376-T464 WeakPolarHBondContact CA-OG1 3.49Å; T464-T552 WeakPolarHBondContact CA-OG1 3.48Å; T464-T552 PolarHBondContact N-OG1 2.82Å; T464-T552 PolarHBondContact O-OG1 2.79Å
465	T	52.1	Low	48.7	Very low	54 Å²	54	31.8 Å²	31.8	33%	0.331	19%	0.191	S	C	.	.			trans	-157.8	140	174.4	-50.4	0	0	0	0	110.7	T377 T378 T553	T377-T465 WeakPolarHBondContact CA-O 3.43Å; T377-T465 HydrophobicContact CG2-CG2 4.43Å; T378-T465 PolarHBondContact N-O 2.94Å; T465-T553 WeakPolarHBondContact CA-O 3.5Å
466	T	50.9	Low	48.2	Very low	0 Å²	0	32.1 Å²	32.1	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	140	165.2	-58	0	0	0	0	110.7	T378 F380 V462 F468 T553 T554 S555	T378-T466 WeakPolarHBondContact O-CA 3.39Å; F380-T466 HydrophobicContact CD2-CG2 4.19Å; F380-T466 HydrophobicContact CE2-CG2 4.04Å; V462-T466 WeakPolarHBondContact CG1-OG1 3.4Å; T466-F468 HydrophobicContact CG2-CD2 4.07Å; T466-F468 HydrophobicContact CG2-CE1 4.35Å; T466-F468 HydrophobicContact CG2-CE2 3.46Å; T466-F468 VanDerWaalsContact CG2-CE2 3.46Å; T466-F468 HydrophobicContact CG2-CZ 3.62Å; T466-T553 PolarHBondContact N-O 3.18Å; T466-T554 VanDerWaalsContact O-CA 3.29Å; T466-T554 WeakPolarHBondContact O-CA 3.36Å; T466-T554 WeakPolarHBondContact O-CG2 3.48Å; T466-S555 PolarHBondContact O-N 2.93Å
467	S	49.3	Very low	47.7	Very low	43 Å²	43	31.2 Å²	31.2	30%	0.301	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	129.9	173.3	58.9	0	0	0	0	110.3	T378 S379 F380 S555	T378-S467 PolarHBondContact O-N 3.4Å; T378-S467 VanDerWaalsContact O-N 3.13Å; S379-S467 WeakPolarHBondContact CA-O 3.42Å; F380-S467 PolarHBondContact N-O 2.84Å; S467-S555 WeakPolarHBondContact CA-O 3.39Å; S467-S555 VanDerWaalsContact CB-OG 3.31Å; S467-S555 WeakPolarHBondContact CB-OG 3.4Å
468	F	47.4	Very low	47.4	Very low	7 Å²	7	33.4 Å²	33.4	3%	0.031	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	122.1	168.5	-56.2	-93	0	0	0	108.3	F380 A457 V459 T466 V547 T554 S555 F556 D557	F380-F468 HydrophobicContact CB-CD1 3.88Å; F380-F468 HydrophobicContact CB-CE1 4.4Å; F380-F468 AromaticContact CD2-CD1 3.55Å; F380-F468 HydrophobicContact CD2-CD1 3.55Å; F380-F468 AromaticContact CD2-CE1 3.27Å; F380-F468 HydrophobicContact CD2-CE1 3.27Å; F380-F468 HydrophobicContact CD2-CG 4.45Å; F380-F468 HydrophobicContact CD2-CZ 4.02Å; F380-F468 HydrophobicContact CE2-CD1 4.36Å; F380-F468 AromaticContact CE2-CE1 3.63Å; F380-F468 HydrophobicContact CE2-CE1 3.63Å; F380-F468 HydrophobicContact CE2-CZ 4.07Å; F380-F468 AromaticContact CG-CD1 3.94Å; F380-F468 HydrophobicContact CG-CD1 3.94Å; F380-F468 AromaticContact CG-CE1 3.95Å; F380-F468 HydrophobicContact CG-CE1 3.95Å; A457-F468 HydrophobicContact CB-CD1 3.77Å; A457-F468 HydrophobicContact CB-CE1 3.77Å; V459-F468 HydrophobicContact CB-CZ 4.41Å; V459-F468 HydrophobicContact CG2-CE1 4.1Å; V459-F468 HydrophobicContact CG2-CZ 3.78Å; T466-F468 HydrophobicContact CG2-CD2 4.07Å; T466-F468 HydrophobicContact CG2-CE1 4.35Å; T466-F468 HydrophobicContact CG2-CE2 3.46Å; T466-F468 VanDerWaalsContact CG2-CE2 3.46Å; T466-F468 HydrophobicContact CG2-CZ 3.62Å; F468-V547 HydrophobicContact CE2-CG2 4.05Å; F468-V547 HydrophobicContact CZ-CG2 4.17Å; F468-T554 HydrophobicContact CD2-CG2 4.19Å; F468-T554 HydrophobicContact CE2-CG2 3.99Å; F468-S555 PolarHBondContact N-O 2.87Å; F468-F556 HydrophobicContact CB-CD1 3.87Å; F468-F556 HydrophobicContact CB-CE1 4.48Å; F468-F556 AromaticContact CD2-CD1 3.43Å; F468-F556 HydrophobicContact CD2-CD1 3.43Å; F468-F556 VanDerWaalsContact CD2-CD1 3.43Å; F468-F556 AromaticContact CD2-CE1 3.25Å; F468-F556 HydrophobicContact CD2-CE1 3.25Å; F468-F556 HydrophobicContact CD2-CG 4.27Å; F468-F556 HydrophobicContact CD2-CZ 4.01Å; F468-F556 HydrophobicContact CE2-CD1 4.22Å; F468-F556 AromaticContact CE2-CE1 3.56Å; F468-F556 HydrophobicContact CE2-CE1 3.56Å; F468-F556 HydrophobicContact CE2-CZ 4.03Å; F468-F556 AromaticContact CG-CD1 3.89Å; F468-F556 HydrophobicContact CG-CD1 3.89Å; F468-F556 AromaticContact CG-CE1 4Å; F468-F556 HydrophobicContact CG-CE1 4Å; F468-F556 WeakPolarHBondContact O-CA 3.36Å; F468-D557 PolarHBondContact O-N 2.84Å
469	D	47.1	Very low	46.8	Very low	71 Å²	71	31.8 Å²	31.8	38%	0.38	19%	0.186	S	C	.	.			trans	-101.6	146.5	153.9	-151	-35.8	0	0	0	107.8	F380 T382	F380-D469 PolarHBondContact O-N 3.46Å; T382-D469 PolarHBondContact N-O 2.84Å
470	T	46.8	Very low	46.5	Very low	9 Å²	9	33.2 Å²	33.2	6%	0.055	19%	0.193	C	C	.	.			trans	-154.7	118.2	-179.9	-59.9	0	0	0	0	109.4	T382 T455 T543 T558 S559	T382-T470 WeakPolarHBondContact O-CA 3.39Å; T455-T470 HydrophobicContact CG2-CG2 3.94Å; T470-T543 HydrophobicContact CG2-CG2 3.79Å; T470-T558 WeakPolarHBondContact O-CA 3.47Å; T470-S559 PolarHBondContact O-N 2.94Å
471	S	47.6	Very low	46	Very low	34 Å²	34	30.9 Å²	30.9	24%	0.238	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	125.5	-178.6	56.8	0	0	0	0	111.3	T382 S383 Q384 S559	T382-S471 PolarHBondContact O-N 3.06Å; S383-S471 WeakPolarHBondContact CA-O 3.47Å; S383-S471 WeakPolarHBondContact CB-OG 3.34Å; Q384-S471 PolarHBondContact N-O 2.96Å; S471-S559 WeakPolarHBondContact CB-OG 3.45Å
472	Q	46.5	Very low	45.6	Very low	3 Å²	3	29.4 Å²	29.4	1%	0.014	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	126	170.8	-67.4	-170.8	12.9	0	0	110.5	Q384 T453 T455 N542 T543 S559 Q560 T561	Q384-Q472 HydrophobicContact CB-CG 4.37Å; T453-Q472 PolarHBondContact OG1-OE1 3.28Å; T455-Q472 VanDerWaalsContact CB-NE2 3.34Å; T455-Q472 PolarHBondContact OG1-NE2 2.68Å; Q472-N542 PolarHBondContact NE2-O 2.91Å; Q472-T543 PolarHBondContact NE2-OG1 2.89Å; Q472-S559 PolarHBondContact N-O 2.85Å; Q472-Q560 HydrophobicContact CB-CG 4.5Å; Q472-Q560 WeakPolarHBondContact O-CA 3.33Å; Q472-T561 PolarHBondContact O-N 2.96Å
473	T	46.9	Very low	45.1	Very low	62 Å²	62	29.4 Å²	29.4	38%	0.38	17%	0.17	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	114.3	169.3	-60.1	0	0	0	0	109.8	Q384 T385 S386 T561	Q384-T473 PolarHBondContact O-N 3.39Å; T385-T473 WeakPolarHBondContact CA-O 3.36Å; S386-T473 PolarHBondContact N-O 2.84Å; T473-T561 WeakPolarHBondContact CA-O 3.46Å
474	S	43.2	Very low	44.6	Very low	2 Å²	2	28.6 Å²	28.6	1%	0.014	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	127.5	-175.4	-72.2	0	0	0	0	111.2	S386 T453 T561 S562 S563	S386-S474 WeakPolarHBondContact O-CA 3.38Å; T453-S474 VanDerWaalsContact CG2-OG 3.24Å; T453-S474 WeakPolarHBondContact CG2-OG 3.33Å; T453-S474 PolarHBondContact OG1-OG 2.64Å; S474-T561 PolarHBondContact N-O 3.26Å; S474-S562 WeakPolarHBondContact O-CA 3.33Å; S474-S563 PolarHBondContact O-N 3.22Å
475	S	45.8	Very low	43.8	Very low	34 Å²	34	25.6 Å²	25.6	24%	0.238	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	140.9	-174.6	56.8	0	0	0	0	113.7	S386 S387 T388 V451 S563	S386-S475 PolarHBondContact O-N 3.12Å; S386-S475 PolarHBondContact O-OG 3.03Å; S387-S475 VanDerWaalsContact CA-O 3.32Å; S387-S475 WeakPolarHBondContact CA-O 3.37Å; S387-S475 WeakPolarHBondContact CB-OG 3.46Å; T388-S475 PolarHBondContact N-O 3.21Å; T388-S475 VanDerWaalsContact N-O 3.11Å; V451-S475 WeakPolarHBondContact CG2-O 3.39Å; S475-S563 WeakPolarHBondContact CA-O 3.4Å; S475-S563 WeakPolarHBondContact CB-OG 3.4Å
476	T	41.3	Very low	43.1	Very low	10 Å²	10	28.1 Å²	28.1	6%	0.061	15%	0.153	C	C	.	.	P	Polyproline II helix	trans	-100.1	142.6	168.8	65.8	0	0	0	0	112.8	T388 V451 S537 V539 S563 T564 G565	T388-T476 WeakPolarHBondContact OG1-CA 3.33Å; V451-T476 HydrophobicContact CG2-CG2 4.17Å; T476-S537 VanDerWaalsContact OG1-CB 3.31Å; T476-S537 WeakPolarHBondContact OG1-CB 3.36Å; T476-S537 PolarHBondContact OG1-OG 3.01Å; T476-V539 HydrophobicContact CG2-CG2 3.84Å; T476-S563 PolarHBondContact N-O 3Å; T476-S563 VanDerWaalsContact N-O 3.16Å; T476-T564 WeakPolarHBondContact OG1-CA 3.46Å; T476-G565 WeakPolarHBondContact O-CA 3.38Å; T476-G565 PolarHBondContact O-N 3.33Å; T476-G565 VanDerWaalsContact O-N 3.11Å; T476-G565 PolarHBondContact OG1-N 3.19Å
477	G	37.8	Very low	42.5	Very low	8 Å²	8	28.2 Å²	28.2	8%	0.082	15%	0.153	C	C	.	.	P	Polyproline II helix	trans	-65.8	150.6	176.5	0	0	0	0	0	113.5	T388	T388-G477 WeakPolarHBondContact O-CA 3.4Å; T388-G477 PolarHBondContact O-N 3.35Å; T388-G477 VanDerWaalsContact O-N 3.12Å; T388-G477 PolarHBondContact OG1-N 3.32Å
478	Q	42.3	Very low	41.7	Very low	55 Å²	55	27.6 Å²	27.6	26%	0.257	15%	0.148	S	C	.	.	P	Polyproline II helix	trans	-73.9	152.9	177.1	-54.9	-174.3	103.1	0	0	111.8	Q390 T391 Q566	Q390-Q478 WeakPolarHBondContact CA-O 3.35Å; Q390-Q478 WeakPolarHBondContact CB-O 3.45Å; T391-Q478 PolarHBondContact N-O 3.41Å; Q478-Q566 WeakPolarHBondContact CA-O 3.37Å
479	T	39.7	Very low	41	Very low	12 Å²	12	27.3 Å²	27.3	7%	0.074	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	123.2	172.6	-62.7	0	0	0	0	110	T391 T447 I481 T535 Q566 T567 Q568	T391-T479 WeakPolarHBondContact O-CA 3.39Å; T447-T479 HydrophobicContact CG2-CG2 3.87Å; T447-T479 PolarHBondContact OG1-OG1 3.44Å; T479-I481 HydrophobicContact CG2-CG1 4.41Å; T479-T535 HydrophobicContact CG2-CG2 4.19Å; T479-Q566 PolarHBondContact N-O 3.28Å; T479-T567 WeakPolarHBondContact O-CA 3.48Å; T479-Q568 PolarHBondContact O-N 3.45Å
480	Q	41.4	Very low	40.4	Very low	32 Å²	32	26.4 Å²	26.4	15%	0.15	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	126.8	178	-61.9	-175.3	84.8	0	0	111	T391 Q392 I393 F482 Q568	T391-Q480 PolarHBondContact O-N 3.26Å; Q392-Q480 WeakPolarHBondContact CA-O 3.44Å; Q392-Q480 HydrophobicContact CG-CB 4.46Å; Q392-Q480 VanDerWaalsContact OE1-NE2 3.15Å; I393-Q480 PolarHBondContact N-O 2.97Å; Q480-F482 HydrophobicContact CB-CD2 4.3Å; Q480-F482 HydrophobicContact CB-CE2 3.67Å; Q480-F482 HydrophobicContact CB-CZ 4.39Å; Q480-F482 HydrophobicContact CG-CE2 4.48Å; Q480-Q568 WeakPolarHBondContact CA-O 3.31Å; Q480-Q568 HydrophobicContact CG-CB 4.46Å
481	I	39	Very low	39.8	Very low	0 Å²	0	26.3 Å²	26.3	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	115.4	178.6	-58	175.4	0	0	0	108.8	I393 I445 T479 I533 Q568 I569 F570	I393-I481 HydrophobicContact CB-CG1 4.46Å; I445-I481 HydrophobicContact CD1-CD1 4.33Å; I445-I481 HydrophobicContact CG2-CD1 4.26Å; T479-I481 HydrophobicContact CG2-CG1 4.41Å; I481-I533 HydrophobicContact CD1-CD1 4.01Å; I481-I533 HydrophobicContact CD1-CG2 3.87Å; I481-Q568 PolarHBondContact N-O 2.88Å; I481-I569 HydrophobicContact CB-CG1 4.36Å; I481-I569 WeakPolarHBondContact O-CA 3.48Å; I481-F570 PolarHBondContact O-N 3.02Å
482	F	39.7	Very low	39.2	Very low	52 Å²	52	27 Å²	27	23%	0.228	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	126	178.6	-66.1	-86.7	0	0	0	110.5	I393 F394 T395 Q480 F570	I393-F482 PolarHBondContact O-N 3.02Å; F394-F482 HydrophobicContact CD1-CB 3.71Å; F394-F482 AromaticContact CD1-CD2 3.64Å; F394-F482 HydrophobicContact CD1-CD2 3.64Å; F394-F482 AromaticContact CD1-CG 3.88Å; F394-F482 HydrophobicContact CD1-CG 3.88Å; F394-F482 HydrophobicContact CE1-CB 4.11Å; F394-F482 AromaticContact CE1-CD2 3.2Å; F394-F482 HydrophobicContact CE1-CD2 3.2Å; F394-F482 AromaticContact CE1-CE2 3.66Å; F394-F482 HydrophobicContact CE1-CE2 3.66Å; F394-F482 AromaticContact CE1-CG 3.73Å; F394-F482 HydrophobicContact CE1-CG 3.73Å; F394-F482 HydrophobicContact CG-CD2 4.5Å; F394-F482 AromaticContact CZ-CD2 3.77Å; F394-F482 HydrophobicContact CZ-CD2 3.77Å; F394-F482 AromaticContact CZ-CE2 3.92Å; F394-F482 HydrophobicContact CZ-CE2 3.92Å; T395-F482 PolarHBondContact N-O 2.97Å; T395-F482 PolarHBondContact OG1-O 3.24Å; Q480-F482 HydrophobicContact CB-CD2 4.3Å; Q480-F482 HydrophobicContact CB-CE2 3.67Å; Q480-F482 HydrophobicContact CB-CZ 4.39Å; Q480-F482 HydrophobicContact CG-CE2 4.48Å; F482-F570 HydrophobicContact CD1-CB 3.75Å; F482-F570 AromaticContact CD1-CD2 3.8Å; F482-F570 HydrophobicContact CD1-CD2 3.8Å; F482-F570 HydrophobicContact CD1-CG 4.09Å; F482-F570 HydrophobicContact CE1-CB 4.05Å; F482-F570 AromaticContact CE1-CD2 3.26Å; F482-F570 HydrophobicContact CE1-CD2 3.26Å; F482-F570 AromaticContact CE1-CE2 3.9Å; F482-F570 HydrophobicContact CE1-CE2 3.9Å; F482-F570 AromaticContact CE1-CG 3.86Å; F482-F570 HydrophobicContact CE1-CG 3.86Å; F482-F570 AromaticContact CZ-CD2 3.77Å; F482-F570 HydrophobicContact CZ-CD2 3.77Å; F482-F570 HydrophobicContact CZ-CE2 4.09Å
483	T	38.6	Very low	38.5	Very low	1 Å²	1	28.9 Å²	28.9	1%	0.006	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	116.3	174.9	46.9	0	0	0	0	108.9	T395 P442 P530 F570 T571 T572	T395-T483 WeakPolarHBondContact OG1-CA 3.44Å; T395-T483 WeakPolarHBondContact OG1-CG2 3.38Å; P442-T483 HydrophobicContact CG-CG2 3.63Å; T483-P530 HydrophobicContact CG2-CG 4.49Å; T483-F570 PolarHBondContact N-O 3.21Å; T483-F570 PolarHBondContact OG1-O 3.24Å; T483-T571 VanDerWaalsContact OG1-CA 3.29Å; T483-T571 WeakPolarHBondContact OG1-CA 3.43Å; T483-T571 VanDerWaalsContact OG1-CG2 3.31Å; T483-T571 WeakPolarHBondContact OG1-CG2 3.26Å; T483-T572 PolarHBondContact O-N 3.5Å
484	T	39.2	Very low	37.8	Very low	49 Å²	49	28.9 Å²	28.9	30%	0.301	16%	0.16	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	118.2	-179.2	-61.5	0	0	0	0	111.2	T395 T396 D397 T572	T395-T484 PolarHBondContact O-N 2.89Å; T395-T484 VanDerWaalsContact O-N 3.08Å; T396-T484 WeakPolarHBondContact CA-O 3.27Å; D397-T484 PolarHBondContact N-O 3.46Å; D397-T484 VanDerWaalsContact N-O 3.1Å; T484-T572 WeakPolarHBondContact CA-O 3.49Å
485	D	37.3	Very low	37.1	Very low	0 Å²	0	31.9 Å²	31.9	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	122.4	178	-175.1	-10.6	0	0	0	108.4	T438 T526 T527 S528 T572 R574	T438-D485 WeakPolarHBondContact CB-OD1 3.39Å; T438-D485 WeakPolarHBondContact CG2-OD1 3.37Å; T438-D485 PolarHBondContact OG1-OD1 2.98Å; T438-D485 PolarHBondContact OG1-OD2 3.13Å; D485-T526 WeakPolarHBondContact OD1-CG2 3.33Å; D485-T526 WeakPolarHBondContact OD2-CA 3.2Å; D485-T526 VanDerWaalsContact OD2-CB 3.26Å; D485-T526 WeakPolarHBondContact OD2-CB 3.46Å; D485-T527 PolarHBondContact OD2-N 2.9Å; D485-T527 VanDerWaalsContact OD2-N 3.08Å; D485-S528 WeakPolarHBondContact CB-OG 3.43Å; D485-T572 PolarHBondContact N-O 2.81Å; D485-R574 PolarHBondContact O-N 3.33Å
486	R	38.5	Very low	36.4	Very low	107 Å²	107	33 Å²	33	40%	0.404	19%	0.186	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	114.6	-174.7	-166.4	173.1	179.8	174.7	0.4	113.3	D397 R398 T399 P488 R574	D397-R486 PolarHBondContact O-N 2.93Å; R398-R486 WeakPolarHBondContact CA-O 3.25Å; T399-R486 PolarHBondContact N-O 3.13Å; R486-P488 HydrophobicContact CG-CG 4.45Å; R486-P488 VanDerWaalsContact O-CD 3.28Å; R486-P488 WeakPolarHBondContact O-CD 3.4Å; R486-R574 WeakPolarHBondContact CA-O 3.44Å
487	T	37.1	Very low	35.8	Very low	1 Å²	1	36.5 Å²	36.5	1%	0.006	21%	0.208	C	C	.	.			trans	-117.6	78.4	-174	40.1	0	0	0	0	112.2	T399 V436 T438 A489 V524 T526 R574 T575	T399-T487 WeakPolarHBondContact OG1-CG2 3.36Å; V436-T487 HydrophobicContact CG1-CG2 4.29Å; T438-T487 HydrophobicContact CG2-CG2 3.42Å; T438-T487 VanDerWaalsContact CG2-CG2 3.42Å; T438-T487 WeakPolarHBondContact OG1-CG2 3.29Å; T487-A489 PolarHBondContact O-N 3.13Å; T487-V524 HydrophobicContact CG2-CG1 4.36Å; T487-T526 HydrophobicContact CG2-CG2 3.58Å; T487-T526 WeakPolarHBondContact OG1-CG2 3.47Å; T487-R574 PolarHBondContact N-O 2.58Å; T487-T575 WeakPolarHBondContact OG1-CA 3.47Å; T487-T575 WeakPolarHBondContact OG1-CG2 3.16Å
488	P	33	Very low	35.3	Very low	30 Å²	30	41.1 Å²	41.1	20%	0.195	24%	0.239	C	C	.	.			trans	-73.5	119.8	168.3	-8	25.3	0	0	0	109.9	P400 A401 R486 P576	P400-P488 WeakPolarHBondContact CA-O 3.41Å; A401-P488 PolarHBondContact N-O 2.98Å; R486-P488 HydrophobicContact CG-CG 4.45Å; R486-P488 VanDerWaalsContact O-CD 3.28Å; R486-P488 WeakPolarHBondContact O-CD 3.4Å; P488-P576 WeakPolarHBondContact CA-O 3.49Å; P488-P576 HydrophobicContact CB-CG 4.36Å
489	A	31.7	Very low	34.6	Very low	1 Å²	1	43.6 Å²	43.6	1%	0.008	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	131.3	177.1	0	0	0	0	0	110.5	A401 T487 F491 V524 P576 A577 T578	A401-A489 WeakPolarHBondContact O-CA 3.08Å; T487-A489 PolarHBondContact O-N 3.13Å; A489-F491 HydrophobicContact CB-CD2 4.47Å; A489-F491 HydrophobicContact CB-CE2 3.62Å; A489-F491 HydrophobicContact CB-CZ 4.03Å; A489-V524 HydrophobicContact CB-CG2 4.16Å; A489-P576 PolarHBondContact N-O 2.83Å; A489-A577 CarbonylContact O-C 3.52Å; A489-A577 WeakPolarHBondContact O-CA 3.32Å; A489-T578 PolarHBondContact O-N 2.84Å
490	T	35.7	Very low	34	Very low	52 Å²	52	48 Å²	48	32%	0.319	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	121	178.7	-56	0	0	0	0	110.4	A401 F403 T578	A401-T490 PolarHBondContact O-N 3.44Å; F403-T490 PolarHBondContact N-O 2.95Å; T490-T578 WeakPolarHBondContact CA-O 3.43Å
491	F	33.4	Very low	33.1	Very low	8 Å²	8	51.7 Å²	51.7	4%	0.035	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	123.2	-177.5	-58.2	-89.1	0	0	0	109.5	F403 E434 A489 E522 T578 F579 T580	F403-F491 HydrophobicContact CB-CD1 3.96Å; F403-F491 HydrophobicContact CB-CE1 4.46Å; F403-F491 AromaticContact CD2-CD1 3.64Å; F403-F491 HydrophobicContact CD2-CD1 3.64Å; F403-F491 AromaticContact CD2-CE1 3.33Å; F403-F491 HydrophobicContact CD2-CE1 3.33Å; F403-F491 HydrophobicContact CD2-CZ 4.03Å; F403-F491 HydrophobicContact CE2-CD1 4.48Å; F403-F491 AromaticContact CE2-CE1 3.73Å; F403-F491 HydrophobicContact CE2-CE1 3.73Å; F403-F491 HydrophobicContact CE2-CZ 4.15Å; F403-F491 HydrophobicContact CG-CD1 4.06Å; F403-F491 HydrophobicContact CG-CE1 4.05Å; E434-F491 HydrophobicContact CB-CE1 4.19Å; E434-F491 VanDerWaalsContact OE2-CD1 3.31Å; E434-F491 WeakPolarHBondContact OE2-CD1 3.37Å; E434-F491 WeakPolarHBondContact OE2-CE1 3.45Å; A489-F491 HydrophobicContact CB-CD2 4.47Å; A489-F491 HydrophobicContact CB-CE2 3.62Å; A489-F491 HydrophobicContact CB-CZ 4.03Å; F491-E522 HydrophobicContact CD1-CG 4.17Å; F491-E522 VanDerWaalsContact CD1-OE1 3.3Å; F491-E522 WeakPolarHBondContact CD1-OE1 3.33Å; F491-E522 HydrophobicContact CE1-CB 4.43Å; F491-E522 HydrophobicContact CE1-CG 4.06Å; F491-E522 WeakPolarHBondContact CG-OE1 3Å; F491-E522 HydrophobicContact CZ-CB 4.48Å; F491-T578 PolarHBondContact N-O 2.86Å; F491-F579 HydrophobicContact CB-CD1 3.94Å; F491-F579 AromaticContact CD2-CD1 3.54Å; F491-F579 HydrophobicContact CD2-CD1 3.54Å; F491-F579 AromaticContact CD2-CE1 3.36Å; F491-F579 HydrophobicContact CD2-CE1 3.36Å; F491-F579 HydrophobicContact CD2-CZ 4.24Å; F491-F579 HydrophobicContact CE2-CD1 4.34Å; F491-F579 AromaticContact CE2-CE1 3.7Å; F491-F579 HydrophobicContact CE2-CE1 3.7Å; F491-F579 HydrophobicContact CE2-CZ 4.3Å; F491-F579 AromaticContact CG-CD1 3.98Å; F491-F579 HydrophobicContact CG-CD1 3.98Å; F491-F579 HydrophobicContact CG-CE1 4.08Å; F491-T580 PolarHBondContact O-N 3.14Å
492	T	35.6	Very low	32.3	Very low	48 Å²	48	57.6 Å²	57.6	29%	0.294	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	124.6	-179.7	-55.6	0	0	0	0	110.8	F403 S405	F403-T492 PolarHBondContact O-N 3.06Å; S405-T492 PolarHBondContact N-O 2.89Å; S405-T492 VanDerWaalsContact N-O 3.12Å
493	S	31	Very low	31.5	Very low	42 Å²	42	60.3 Å²	60.3	29%	0.294	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	141.9	178.6	61	0	0	0	0	112.5	T580	S493-T580 PolarHBondContact N-O 3.37Å; S493-T580 VanDerWaalsContact N-O 3.15Å
494	T	32.9	Very low	30.6	Very low	63 Å²	63	66.6 Å²	66.6	39%	0.387	41%	0.412	S	S	.	.			trans	-130.8	99.6	-175.5	-44	0	0	0	0	110.3	P407	P407-T494 VanDerWaalsContact CD-O 3.24Å; P407-T494 WeakPolarHBondContact CD-O 3.18Å; P407-T494 WeakPolarHBondContact CG-O 3.07Å
495	P	28.2	Very low	29.8	Very low	64 Å²	64	71.9 Å²	71.9	42%	0.416	44%	0.438	S	S	.	.	P	Polyproline II helix	trans	-65.8	137.5	-176.3	26.8	-34	0	0	0	111.9	T582	P495-T582 WeakPolarHBondContact CD-O 3.34Å; P495-T582 WeakPolarHBondContact CG-O 3.31Å
496	S	31.2	Very low	29	Very low	57 Å²	57	78.5 Å²	78.5	40%	0.399	48%	0.478	S	S	.	.	P	Polyproline II helix	trans	-79.1	141.1	-177	39.3	0	0	0	0	113	S408	S408-S496 WeakPolarHBondContact O-CB 3.12Å; S408-S496 PolarHBondContact O-OG 3.02Å
497	T	28.3	Very low	28.2	Very low	85 Å²	85	78.9 Å²	78.9	52%	0.521	49%	0.489	S	S	.	.	P	Polyproline II helix	trans	-93.1	141.4	174.3	48	0	0	0	0	111.2	T409 S584	T409-T497 WeakPolarHBondContact CG2-O 3.43Å; T497-S584 WeakPolarHBondContact CG2-OG 3.42Å
498	S	27.9	Very low	27.5	Very low	104 Å²	104	84.6 Å²	84.6	73%	0.727	52%	0.519	S	S	*	.	P	Polyproline II helix	trans	-94.9	142	166.2	52.6	0	0	0	0	110.1
499	T	26.5	Very low	27	Very low	108 Å²	108	91.2 Å²	91.2	66%	0.663	55%	0.547	S	S	*	.			trans	-137.1	136.7	169	49.7	0	0	0	0	109
500	S	26.8	Very low	26.6	Very low	103 Å²	103	95.6 Å²	95.6	72%	0.72	57%	0.574	S	S	*	*			trans	-139.9	145.8	174.7	55	0	0	0	0	109
501	T	23.1	Very low	26	Very low	110 Å²	110	97.1 Å²	97.1	68%	0.675	59%	0.587	S	S	*	*			trans	-121.9	129	177.3	36.7	0	0	0	0	108.6
502	P	22.8	Very low	25.5	Very low	125 Å²	125	103 Å²	103	81%	0.812	62%	0.618	S	S	*	*			trans	-89.8	140.3	-172.4	33.7	-34	0	0	0	112.5
503	T	22.7	Very low	25	Very low	109 Å²	109	104.3 Å²	104.3	67%	0.669	63%	0.626	S	S	*	*			trans	-135.3	109	167.1	-51.2	0	0	0	0	109.4
504	T	20.4	Very low	24.8	Very low	132 Å²	132	107 Å²	107	81%	0.81	64%	0.644	S	S	*	*			trans	48.7	120.8	168.5	52.7	0	0	0	0	118.7
505	L	21.3	Very low	24.5	Very low	160 Å²	160	107.6 Å²	107.6	84%	0.838	65%	0.648	S	S	*	*			trans	-124.9	151.8	-178.5	-158.8	94	0	0	0	111.5
506	T	21.7	Very low	24.4	Very low	139 Å²	139	109.3 Å²	109.3	85%	0.853	66%	0.662	S	S	*	*			trans	-143.2	140.5	165	-55.5	0	0	0	0	108.1
507	D	21.4	Very low	24.3	Very low	116 Å²	116	109.9 Å²	109.9	62%	0.62	67%	0.666	S	S	*	*			trans	-66.7	154.8	-176	-95.5	-60.6	0	0	0	113.3
508	N	22	Very low	24.4	Very low	121 Å²	121	109.5 Å²	109.5	65%	0.647	67%	0.667	S	S	*	*	S	Bend	cis	-132.9	145.2	36.3	-74.8	-92.9	0	0	0	117.2
509	Q	23.4	Very low	24.4	Very low	168 Å²	168	109.1 Å²	109.1	79%	0.785	65%	0.652	S	S	*	*			trans	53.3	91.6	151.7	-164.8	171.2	111.1	0	0	117.7
510	T	21.9	Very low	24.5	Very low	94 Å²	94	105.6 Å²	105.6	58%	0.577	63%	0.629	S	S	*	*			trans	-122.9	131.1	169.4	-60.7	0	0	0	0	111.5	L512	T510-L512 HydrophobicContact CG2-CG 4.36Å
511	S	22.7	Very low	24.8	Very low	83 Å²	83	102.7 Å²	102.7	58%	0.58	61%	0.607	S	S	*	*			trans	-99.7	102.6	173.1	-71.2	0	0	0	0	111.2
512	L	23.6	Very low	25.2	Very low	133 Å²	133	98.3 Å²	98.3	70%	0.696	58%	0.579	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-91.6	117.2	171.1	-83.3	160.1	0	0	0	110.1	L424 T510	L424-L512 HydrophobicContact CB-CD2 3.91Å; T510-L512 HydrophobicContact CG2-CG 4.36Å
513	T	25.9	Very low	25.8	Very low	74 Å²	74	94.7 Å²	94.7	45%	0.454	56%	0.556	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-124.5	108.7	175.2	-50.6	0	0	0	0	110.5	T515	T513-T515 HydrophobicContact CG2-CG2 4.37Å
514	S	26.1	Very low	26.1	Very low	98 Å²	98	89.8 Å²	89.8	69%	0.685	53%	0.526	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.8	107.1	173.4	58.8	0	0	0	0	110.3
515	T	26.4	Very low	26.9	Very low	76 Å²	76	88.2 Å²	88.2	47%	0.466	51%	0.505	S	S	.	.			trans	-117.7	83.2	-179	28.7	0	0	0	0	111.1	T513 S517	T513-T515 HydrophobicContact CG2-CG2 4.37Å; T515-S517 PolarHBondContact O-N 2.93Å
516	S	26.8	Very low	27.4	Very low	101 Å²	101	80.6 Å²	80.6	71%	0.706	47%	0.466	S	S	*	.			trans	-67.2	122.4	167.3	49.1	0	0	0	0	110
517	S	28.9	Very low	28.2	Very low	69 Å²	69	75 Å²	75	48%	0.483	43%	0.431	S	S	.	.			trans	-133.7	90.4	176.9	50.7	0	0	0	0	111.1	S428 T515	S428-S517 PolarHBondContact O-N 2.93Å; S428-S517 VanDerWaalsContact O-N 3.14Å; T515-S517 PolarHBondContact O-N 2.93Å
518	S	30	Very low	29.1	Very low	76 Å²	76	69.4 Å²	69.4	53%	0.531	40%	0.401	S	S	.	.			trans	-81.1	134.1	168.7	51.3	0	0	0	0	110.1	S430	S430-S518 WeakPolarHBondContact O-CA 3.48Å
519	K	28.8	Very low	29.9	Very low	97 Å²	97	65.4 Å²	65.4	42%	0.422	38%	0.381	S	S	.	.			trans	-126.8	98.6	166.4	-175.8	168.8	-177.3	170.4	0	110.1	S430 L432	S430-K519 PolarHBondContact O-N 3.47Å; L432-K519 PolarHBondContact N-O 3.01Å
520	L	28.4	Very low	30.7	Very low	33 Å²	33	57.4 Å²	57.4	17%	0.173	34%	0.344	C	S	.	.			trans	-74.3	157.7	164.8	-100.8	72.9	0	0	0	111.1	L432 E522 L608	L432-L520 HydrophobicContact CB-CD1 4.02Å; L432-L520 HydrophobicContact CB-CG 4.13Å; L432-L520 HydrophobicContact CD1-CD1 3.82Å; L520-E522 HydrophobicContact CD2-CG 4.3Å; L520-E522 WeakPolarHBondContact CD2-OE1 3.39Å; L520-L608 HydrophobicContact CB-CD2 4.07Å
521	T	33.3	Very low	31.5	Very low	42 Å²	42	54.4 Å²	54.4	26%	0.258	33%	0.325	S	S	.	.			trans	-155.7	108.5	166.7	-59.3	0	0	0	0	106.7	T433 E434	T433-T521 WeakPolarHBondContact CA-O 3.36Å; E434-T521 PolarHBondContact N-O 3.04Å; E434-T521 VanDerWaalsContact N-O 3.1Å
522	E	31.6	Very low	32.4	Very low	19 Å²	19	53.6 Å²	53.6	9%	0.089	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	138.5	-174.6	-66.3	167	153.3	0	0	109.3	F491 L520 F579 S611	F491-E522 HydrophobicContact CD1-CG 4.17Å; F491-E522 VanDerWaalsContact CD1-OE1 3.3Å; F491-E522 WeakPolarHBondContact CD1-OE1 3.33Å; F491-E522 HydrophobicContact CE1-CB 4.43Å; F491-E522 HydrophobicContact CE1-CG 4.06Å; F491-E522 WeakPolarHBondContact CG-OE1 3Å; F491-E522 HydrophobicContact CZ-CB 4.48Å; L520-E522 HydrophobicContact CD2-CG 4.3Å; L520-E522 WeakPolarHBondContact CD2-OE1 3.39Å; E522-F579 WeakPolarHBondContact OE2-CD1 3.48Å; E522-F579 VanDerWaalsContact OE2-CE1 3.26Å; E522-F579 WeakPolarHBondContact OE2-CE1 3.45Å; E522-S611 PolarHBondContact O-N 2.91Å
523	S	33.8	Very low	33.1	Very low	48 Å²	48	47.3 Å²	47.3	34%	0.336	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	130.1	-178.1	55.1	0	0	0	0	113.2	E434 S435 V436	E434-S523 PolarHBondContact O-N 2.91Å; E434-S523 VanDerWaalsContact O-N 3.1Å; E434-S523 PolarHBondContact O-OG 2.94Å; S435-S523 WeakPolarHBondContact CA-O 3.38Å; V436-S523 PolarHBondContact N-O 2.95Å
524	V	29.7	Very low	33.8	Very low	7 Å²	7	46.5 Å²	46.5	4%	0.042	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	123.5	176.1	-177.1	0	0	0	0	108.8	T487 A489 T575 S611 V612 R613	T487-V524 HydrophobicContact CG2-CG1 4.36Å; A489-V524 HydrophobicContact CB-CG2 4.16Å; V524-T575 HydrophobicContact CG1-CG2 4.41Å; V524-S611 PolarHBondContact N-O 2.91Å; V524-S611 VanDerWaalsContact N-O 3.16Å; V524-V612 WeakPolarHBondContact O-CA 3.35Å; V524-R613 PolarHBondContact O-N 2.9Å; V524-R613 VanDerWaalsContact O-N 3.15Å
525	R	37.3	Very low	34.4	Very low	99 Å²	99	42 Å²	42	37%	0.374	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	118.3	-178.9	-178.3	176.5	176.3	162.3	2.6	112.2	V436 R437 T438	V436-R525 PolarHBondContact O-N 2.99Å; R437-R525 WeakPolarHBondContact CA-O 3.48Å; T438-R525 PolarHBondContact N-O 2.98Å
526	T	31.7	Very low	35.2	Very low	0 Å²	0	40 Å²	40	0%	0	23%	0.234	C	C	.	.			trans	-99.4	157.7	169.7	46.6	0	0	0	0	110	T438 D485 T487 D573 T575 R613 T614	T438-T526 WeakPolarHBondContact OG1-CA 3.18Å; T438-T526 WeakPolarHBondContact OG1-CG2 3.35Å; D485-T526 WeakPolarHBondContact OD1-CG2 3.33Å; D485-T526 WeakPolarHBondContact OD2-CA 3.2Å; D485-T526 VanDerWaalsContact OD2-CB 3.26Å; D485-T526 WeakPolarHBondContact OD2-CB 3.46Å; T487-T526 HydrophobicContact CG2-CG2 3.58Å; T487-T526 WeakPolarHBondContact OG1-CG2 3.47Å; T526-D573 WeakPolarHBondContact CB-OD1 3.21Å; T526-D573 WeakPolarHBondContact CB-OD2 3.44Å; T526-D573 WeakPolarHBondContact CG2-OD1 3.24Å; T526-D573 PolarHBondContact OG1-OD1 3.02Å; T526-D573 PolarHBondContact OG1-OD2 3.15Å; T526-T575 HydrophobicContact CG2-CG2 3.45Å; T526-T575 VanDerWaalsContact CG2-CG2 3.45Å; T526-T575 WeakPolarHBondContact OG1-CG2 3.34Å; T526-R613 PolarHBondContact N-O 2.83Å; T526-T614 WeakPolarHBondContact OG1-CA 3.37Å
527	T	39	Very low	35.9	Very low	20 Å²	20	36 Å²	36	12%	0.123	21%	0.206	C	C	.	.			trans	-161.1	114.8	175.2	-61.8	0	0	0	0	109.5	S440 D485 V529	S440-T527 PolarHBondContact N-O 2.83Å; D485-T527 PolarHBondContact OD2-N 2.9Å; D485-T527 VanDerWaalsContact OD2-N 3.08Å; T527-V529 HydrophobicContact CG2-CG2 4.16Å
528	S	40	Very low	36.5	Very low	0 Å²	0	35.1 Å²	35.1	0%	0	20%	0.198	C	C	.	.	B	Isolated β-bridge	trans	-126.2	108.9	-179.2	-74.5	0	0	0	0	111.4	S440 D485 T615 S616	S440-S528 WeakPolarHBondContact O-CA 3.4Å; D485-S528 WeakPolarHBondContact CB-OG 3.43Å; S528-T615 PolarHBondContact N-O 3.38Å; S528-T615 VanDerWaalsContact N-O 3.14Å; S528-S616 WeakPolarHBondContact O-CA 3.36Å
529	V	39.6	Very low	36.8	Very low	37 Å²	37	31.5 Å²	31.5	22%	0.224	17%	0.173	C	C	.	.			trans	-139.7	96.6	-171	174	0	0	0	0	110.2	S440 V441 T527 T531	S440-V529 PolarHBondContact O-N 3.43Å; V441-V529 WeakPolarHBondContact CG1-O 3.35Å; T527-V529 HydrophobicContact CG2-CG2 4.16Å; V529-T531 HydrophobicContact CG1-CG2 4Å
530	P	38.5	Very low	37.2	Very low	0 Å²	0	28.8 Å²	28.8	0%	0	17%	0.168	C	C	.	.			trans	-74.8	136.6	171.7	-11.4	27.5	0	0	0	111	P442 T483 I533 T571 T619	P442-P530 HydrophobicContact CG-CB 4.19Å; T483-P530 HydrophobicContact CG2-CG 4.49Å; P530-I533 HydrophobicContact CB-CD1 3.77Å; P530-T571 HydrophobicContact CG-CG2 3.76Å; P530-T619 PolarHBondContact O-N 2.91Å
531	T	39.9	Very low	37.9	Very low	30 Å²	30	27.4 Å²	27.4	18%	0.184	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	152.2	175	56.8	0	0	0	0	114.8	P442 T443 N444 V529 T619	P442-T531 PolarHBondContact O-N 3.31Å; T443-T531 VanDerWaalsContact CA-O 3.32Å; T443-T531 WeakPolarHBondContact CA-O 3.38Å; T443-T531 WeakPolarHBondContact CG2-OG1 3.42Å; N444-T531 PolarHBondContact N-O 3.5Å; V529-T531 HydrophobicContact CG1-CG2 4Å; T531-T619 VanDerWaalsContact CA-O 3.3Å; T531-T619 WeakPolarHBondContact CA-O 3.48Å; T531-T619 WeakPolarHBondContact CG2-OG1 3.35Å
532	N	41.6	Very low	38.3	Very low	67 Å²	67	28 Å²	28	36%	0.358	16%	0.163	S	C	.	.	E	Extended strand (participates in β ladder)	trans	53.8	62.1	179.5	-59.4	-15.9	0	0	0	112.2	N444 I445 N620	N444-N532 VanDerWaalsContact CA-O 3.27Å; N444-N532 WeakPolarHBondContact CA-O 3.37Å; N444-N532 PolarHBondContact N-O 3.04Å; N444-N532 WeakPolarHBondContact OD1-CB 3.34Å; N444-N532 PolarHBondContact OD1-ND2 2.9Å; I445-N532 PolarHBondContact N-O 2.89Å; I445-N532 VanDerWaalsContact N-O 3.16Å; N532-N620 VanDerWaalsContact CA-O 3.23Å; N532-N620 WeakPolarHBondContact CA-O 3.31Å; N532-N620 PolarHBondContact N-O 2.95Å; N532-N620 VanDerWaalsContact N-O 3.12Å; N532-N620 WeakPolarHBondContact OD1-CB 3.45Å; N532-N620 PolarHBondContact OD1-ND2 3.24Å
533	I	38.1	Very low	38.9	Very low	0 Å²	0	27.5 Å²	27.5	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	122.6	174.7	-61.2	171.6	0	0	0	108.2	I445 I481 P530 T535 I569 N620 I621 T622	I445-I533 HydrophobicContact CB-CG1 4.43Å; I445-I533 WeakPolarHBondContact O-CA 3.43Å; I481-I533 HydrophobicContact CD1-CD1 4.01Å; I481-I533 HydrophobicContact CD1-CG2 3.87Å; P530-I533 HydrophobicContact CB-CD1 3.77Å; I533-T535 HydrophobicContact CG2-CG2 4.03Å; I533-I569 HydrophobicContact CD1-CD1 4Å; I533-I569 HydrophobicContact CG2-CD1 4.37Å; I533-N620 PolarHBondContact N-O 2.86Å; I533-I621 HydrophobicContact CB-CG1 4.39Å; I533-I621 WeakPolarHBondContact O-CA 3.48Å; I533-T622 PolarHBondContact O-N 3.2Å
534	T	39.8	Very low	39.3	Very low	58 Å²	58	26.5 Å²	26.5	36%	0.356	15%	0.154	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	116.6	175.4	-55.6	0	0	0	0	109.7	I445 T446 T447 T622	I445-T534 PolarHBondContact O-N 2.91Å; T446-T534 WeakPolarHBondContact CA-O 3.35Å; T447-T534 PolarHBondContact N-O 2.81Å; T534-T622 WeakPolarHBondContact CA-O 3.49Å
535	T	39.3	Very low	39.8	Very low	4 Å²	4	26.8 Å²	26.8	3%	0.025	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	126.9	174.4	68.6	0	0	0	0	110.2	T447 T479 I533 T567 T622 T623 S624	T447-T535 VanDerWaalsContact OG1-CG2 3.29Å; T447-T535 WeakPolarHBondContact OG1-CG2 3.37Å; T479-T535 HydrophobicContact CG2-CG2 4.19Å; I533-T535 HydrophobicContact CG2-CG2 4.03Å; T535-T567 WeakPolarHBondContact CB-OG1 3.4Å; T535-T567 HydrophobicContact CG2-CG2 3.73Å; T535-T567 PolarHBondContact OG1-OG1 2.88Å; T535-T622 PolarHBondContact N-O 2.93Å; T535-T623 WeakPolarHBondContact O-CA 3.43Å; T535-T623 WeakPolarHBondContact OG1-CB 3.42Å; T535-T623 WeakPolarHBondContact OG1-CG2 3.44Å; T535-T623 PolarHBondContact OG1-OG1 2.9Å; T535-S624 PolarHBondContact O-N 2.98Å
536	S	43.3	Very low	40	Very low	33 Å²	33	24.4 Å²	24.4	23%	0.231	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	133.6	178.1	59.4	0	0	0	0	112.1	T447 S448 S449 S624	T447-S536 PolarHBondContact O-N 2.99Å; S448-S536 WeakPolarHBondContact CA-O 3.33Å; S449-S536 PolarHBondContact N-O 2.99Å; S536-S624 WeakPolarHBondContact CA-O 3.43Å
537	S	42.1	Very low	40.5	Very low	16 Å²	16	24.5 Å²	24.5	11%	0.112	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	120.7	172.3	-84.7	0	0	0	0	110.1	S449 T476 S624 S625 T626	S449-S537 WeakPolarHBondContact O-CA 3.4Å; T476-S537 VanDerWaalsContact OG1-CB 3.31Å; T476-S537 WeakPolarHBondContact OG1-CB 3.36Å; T476-S537 PolarHBondContact OG1-OG 3.01Å; S537-S624 PolarHBondContact N-O 2.9Å; S537-S625 WeakPolarHBondContact O-CA 3.46Å; S537-T626 PolarHBondContact O-N 3.42Å
538	T	40	Very low	40.4	Very low	52 Å²	52	26.4 Å²	26.4	32%	0.319	17%	0.167	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	120.8	178.8	-56.2	0	0	0	0	109.6	S449 T450 V451 T626	S449-T538 PolarHBondContact O-N 3.06Å; T450-T538 WeakPolarHBondContact CA-O 3.27Å; V451-T538 PolarHBondContact N-O 3.03Å; T538-T626 WeakPolarHBondContact CA-O 3.4Å
539	V	36.4	Very low	40.3	Very low	0 Å²	0	31.1 Å²	31.1	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	116.7	169.5	179.8	0	0	0	0	107.9	V451 T476 T541 T564 T626 V627 A628	V451-V539 HydrophobicContact CB-CG2 4.49Å; V451-V539 WeakPolarHBondContact O-CA 3.48Å; T476-V539 HydrophobicContact CG2-CG2 3.84Å; V539-T541 HydrophobicContact CG1-CG2 3.87Å; V539-T564 HydrophobicContact CG2-CG2 4.1Å; V539-T626 PolarHBondContact N-O 2.92Å; V539-V627 HydrophobicContact CB-CG2 4.43Å; V539-V627 CarbonylContact O-C 3.49Å; V539-V627 WeakPolarHBondContact O-CA 3.38Å; V539-A628 PolarHBondContact O-N 2.82Å
540	A	38.9	Very low	40.2	Very low	39 Å²	39	30.1 Å²	30.1	32%	0.322	18%	0.183	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	110.5	175.9	0	0	0	0	0	108.8	V451 A452 T453 A628	V451-A540 PolarHBondContact O-N 3.33Å; A452-A540 WeakPolarHBondContact CA-O 3.42Å; T453-A540 PolarHBondContact N-O 3.09Å; A540-A628 WeakPolarHBondContact CA-O 3.37Å
541	T	41.2	Very low	40.3	Very low	5 Å²	5	35.4 Å²	35.4	3%	0.031	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	138.4	178.8	66.8	0	0	0	0	110.4	T453 V539 Q560 S562 A628 T629 N630	T453-T541 WeakPolarHBondContact OG1-CG2 3.39Å; V539-T541 HydrophobicContact CG1-CG2 3.87Å; T541-Q560 PolarHBondContact OG1-OE1 2.76Å; T541-S562 WeakPolarHBondContact CG2-OG 3.45Å; T541-A628 PolarHBondContact N-O 2.97Å; T541-T629 WeakPolarHBondContact OG1-CG2 3.39Å; T541-N630 PolarHBondContact O-N 2.99Å
542	N	42.8	Very low	40.6	Very low	55 Å²	55	36.6 Å²	36.6	29%	0.294	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	130.8	170	-163.3	-0.6	0	0	0	109.4	T453 N454 T455 Q472	T453-N542 PolarHBondContact O-N 2.94Å; N454-N542 WeakPolarHBondContact CA-O 3.32Å; T455-N542 PolarHBondContact N-O 3.01Å; Q472-N542 PolarHBondContact NE2-O 2.91Å
543	T	43.2	Very low	40.5	Very low	8 Å²	8	36.4 Å²	36.4	5%	0.049	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	128.1	167.9	-50.7	0	0	0	0	108.4	T455 T470 Q472 T558 Q560 N630 T631 T632	T455-T543 WeakPolarHBondContact O-CA 3.31Å; T470-T543 HydrophobicContact CG2-CG2 3.79Å; Q472-T543 PolarHBondContact NE2-OG1 2.89Å; T543-T558 HydrophobicContact CG2-CG2 4.11Å; T543-Q560 PolarHBondContact OG1-NE2 3.06Å; T543-N630 PolarHBondContact N-O 2.96Å; T543-T631 WeakPolarHBondContact O-CA 3.39Å; T543-T632 PolarHBondContact O-N 3.05Å; T543-T632 VanDerWaalsContact O-N 3.15Å
544	S	43.1	Very low	40.5	Very low	26 Å²	26	37 Å²	37	18%	0.182	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	133.8	-179.5	56.5	0	0	0	0	111.6	T455 S456 A457 T632	T455-S544 PolarHBondContact O-N 3.45Å; S456-S544 WeakPolarHBondContact CA-O 3.24Å; S456-S544 VanDerWaalsContact CB-OG 3.3Å; S456-S544 WeakPolarHBondContact CB-OG 3.42Å; A457-S544 PolarHBondContact N-O 2.91Å; S544-T632 WeakPolarHBondContact CA-O 3.24Å
545	A	40.4	Very low	40.5	Very low	14 Å²	14	36.8 Å²	36.8	12%	0.116	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	116.5	177.7	0	0	0	0	0	109.3	A457 F556 T632 T634	A457-A545 WeakPolarHBondContact O-CA 3.42Å; A545-F556 HydrophobicContact CB-CD1 4.02Å; A545-F556 HydrophobicContact CB-CE1 3.8Å; A545-T632 PolarHBondContact N-O 2.97Å; A545-T634 PolarHBondContact O-N 2.95Å
546	T	41.4	Very low	40.4	Very low	48 Å²	48	37.2 Å²	37.2	29%	0.294	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	115.7	-170.6	-53.7	0	0	0	0	110.5	A457 V459	A457-T546 PolarHBondContact O-N 3.23Å; A457-T546 VanDerWaalsContact O-N 3.09Å; V459-T546 PolarHBondContact N-O 3.24Å
547	V	41.3	Very low	40.2	Very low	2 Å²	2	38.2 Å²	38.2	1%	0.012	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	97.1	178.5	-168.7	0	0	0	0	109.9	V462 F468 Q549 V550 F556 T634	V462-V547 HydrophobicContact CG2-CG1 4.11Å; F468-V547 HydrophobicContact CE2-CG2 4.05Å; F468-V547 HydrophobicContact CZ-CG2 4.17Å; V547-Q549 PolarHBondContact O-N 2.96Å; V547-V550 HydrophobicContact CB-CG2 4.29Å; V547-V550 HydrophobicContact CG1-CG2 3.37Å; V547-F556 HydrophobicContact CG2-CE1 4.25Å; V547-F556 HydrophobicContact CG2-CZ 3.87Å; V547-T634 PolarHBondContact N-O 3.44Å
548	P	37.4	Very low	39.9	Very low	60 Å²	60	38 Å²	38	39%	0.39	23%	0.226	S	C	.	.	S	Bend	trans	-69.3	-24.3	-176.1	-22	33.8	0	0	0	116	V459 A636	V459-P548 WeakPolarHBondContact O-CD 3.25Å; P548-A636 WeakPolarHBondContact O-CB 3.19Å
549	Q	37	Very low	40	Very low	100 Å²	100	37.2 Å²	37.2	47%	0.467	22%	0.223	S	C	.	.			trans	-146	124	-176.1	-66.3	-73.4	-92.4	0	0	111.3	Q461 V462 V547	Q461-Q549 HydrophobicContact CG-CB 4.13Å; Q461-Q549 HydrophobicContact CG-CG 4.39Å; V462-Q549 PolarHBondContact N-O 2.84Å; V462-Q549 VanDerWaalsContact N-O 3.09Å; V547-Q549 PolarHBondContact O-N 2.96Å
550	V	38.7	Very low	40	Very low	15 Å²	15	37.4 Å²	37.4	9%	0.091	22%	0.224	C	C	.	.	B	Isolated β-bridge	trans	-138	122.5	177.9	177.5	0	0	0	0	110	V462 V547 T554 S639	V462-V550 HydrophobicContact CB-CG2 4.5Å; V547-V550 HydrophobicContact CB-CG2 4.29Å; V547-V550 HydrophobicContact CG1-CG2 3.37Å; V550-T554 VanDerWaalsContact CG1-OG1 3.25Å; V550-T554 WeakPolarHBondContact CG1-OG1 3.26Å; V550-S639 PolarHBondContact O-OG 3.1Å
551	N	40.4	Very low	40	Very low	112 Å²	112	38.4 Å²	38.4	60%	0.599	23%	0.226	S	C	*	.	S	Bend	trans	-91	-10.4	-176	-76.8	-29.2	0	0	0	115.5	V462 N463	V462-N551 PolarHBondContact O-N 2.88Å; N463-N551 PolarHBondContact OD1-ND2 2.92Å
552	T	45.5	Very low	39.9	Very low	55 Å²	55	38.3 Å²	38.3	34%	0.337	23%	0.225	S	C	.	.	S	Bend	trans	-152.1	-80	-164.1	34.3	0	0	0	0	113.7	N463 T464	N463-T552 PolarHBondContact O-OG1 2.85Å; T464-T552 WeakPolarHBondContact CA-OG1 3.48Å; T464-T552 PolarHBondContact N-OG1 2.82Å; T464-T552 PolarHBondContact O-OG1 2.79Å
553	T	39.8	Very low	39.8	Very low	63 Å²	63	37.9 Å²	37.9	39%	0.387	23%	0.227	S	C	.	.			trans	-146.3	131	-174.6	-53.1	0	0	0	0	112.3	T465 T466	T465-T553 WeakPolarHBondContact CA-O 3.5Å; T466-T553 PolarHBondContact N-O 3.18Å
554	T	39.2	Very low	39.5	Very low	12 Å²	12	38.2 Å²	38.2	7%	0.074	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	133	168.4	-50.8	0	0	0	0	110.3	T466 F468 V550 F556	T466-T554 VanDerWaalsContact O-CA 3.29Å; T466-T554 WeakPolarHBondContact O-CA 3.36Å; T466-T554 WeakPolarHBondContact O-CG2 3.48Å; F468-T554 HydrophobicContact CD2-CG2 4.19Å; F468-T554 HydrophobicContact CE2-CG2 3.99Å; V550-T554 VanDerWaalsContact CG1-OG1 3.25Å; V550-T554 WeakPolarHBondContact CG1-OG1 3.26Å; T554-F556 HydrophobicContact CG2-CD2 4.03Å; T554-F556 HydrophobicContact CG2-CE1 4.34Å; T554-F556 HydrophobicContact CG2-CE2 3.4Å; T554-F556 VanDerWaalsContact CG2-CE2 3.4Å; T554-F556 HydrophobicContact CG2-CZ 3.59Å
555	S	39.1	Very low	39	Very low	53 Å²	53	37.9 Å²	37.9	37%	0.371	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	147.1	169.4	58.9	0	0	0	0	110.7	T466 S467 F468	T466-S555 PolarHBondContact O-N 2.93Å; S467-S555 WeakPolarHBondContact CA-O 3.39Å; S467-S555 VanDerWaalsContact CB-OG 3.31Å; S467-S555 WeakPolarHBondContact CB-OG 3.4Å; F468-S555 PolarHBondContact N-O 2.87Å
556	F	38	Very low	38.9	Very low	14 Å²	14	41 Å²	41	6%	0.061	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	117.1	170.7	-54.5	-101.8	0	0	0	107.2	F468 A545 V547 T554	F468-F556 HydrophobicContact CB-CD1 3.87Å; F468-F556 HydrophobicContact CB-CE1 4.48Å; F468-F556 AromaticContact CD2-CD1 3.43Å; F468-F556 HydrophobicContact CD2-CD1 3.43Å; F468-F556 VanDerWaalsContact CD2-CD1 3.43Å; F468-F556 AromaticContact CD2-CE1 3.25Å; F468-F556 HydrophobicContact CD2-CE1 3.25Å; F468-F556 HydrophobicContact CD2-CG 4.27Å; F468-F556 HydrophobicContact CD2-CZ 4.01Å; F468-F556 HydrophobicContact CE2-CD1 4.22Å; F468-F556 AromaticContact CE2-CE1 3.56Å; F468-F556 HydrophobicContact CE2-CE1 3.56Å; F468-F556 HydrophobicContact CE2-CZ 4.03Å; F468-F556 AromaticContact CG-CD1 3.89Å; F468-F556 HydrophobicContact CG-CD1 3.89Å; F468-F556 AromaticContact CG-CE1 4Å; F468-F556 HydrophobicContact CG-CE1 4Å; F468-F556 WeakPolarHBondContact O-CA 3.36Å; A545-F556 HydrophobicContact CB-CD1 4.02Å; A545-F556 HydrophobicContact CB-CE1 3.8Å; V547-F556 HydrophobicContact CG2-CE1 4.25Å; V547-F556 HydrophobicContact CG2-CZ 3.87Å; T554-F556 HydrophobicContact CG2-CD2 4.03Å; T554-F556 HydrophobicContact CG2-CE1 4.34Å; T554-F556 HydrophobicContact CG2-CE2 3.4Å; T554-F556 VanDerWaalsContact CG2-CE2 3.4Å; T554-F556 HydrophobicContact CG2-CZ 3.59Å
557	D	37.6	Very low	38.6	Very low	54 Å²	54	39.7 Å²	39.7	29%	0.289	23%	0.233	S	C	.	.			trans	-97.3	152.1	155.7	-139.7	-43.7	0	0	0	108.3	F468 K645	F468-D557 PolarHBondContact O-N 2.84Å; D557-K645 WeakPolarHBondContact OD1-CB 3.2Å; D557-K645 VanDerWaalsContact OD2-CD 3.23Å; D557-K645 WeakPolarHBondContact OD2-CD 3.46Å
558	T	37.4	Very low	38.4	Very low	10 Å²	10	42.7 Å²	42.7	6%	0.061	25%	0.248	C	C	.	.			trans	-155.2	119.7	-177.5	-50.5	0	0	0	0	109.1	T470 T543 A646 S647	T470-T558 WeakPolarHBondContact O-CA 3.47Å; T543-T558 HydrophobicContact CG2-CG2 4.11Å; T558-A646 WeakPolarHBondContact O-CA 3.49Å; T558-S647 PolarHBondContact O-N 2.91Å
559	S	40.5	Very low	38.3	Very low	36 Å²	36	41.4 Å²	41.4	25%	0.252	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	126.6	-179.6	56.7	0	0	0	0	110.9	T470 S471 Q472	T470-S559 PolarHBondContact O-N 2.94Å; S471-S559 WeakPolarHBondContact CB-OG 3.45Å; Q472-S559 PolarHBondContact N-O 2.85Å
560	Q	37	Very low	38.2	Very low	4 Å²	4	40.8 Å²	40.8	2%	0.019	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	120.3	173.9	-69.3	-170.8	2.1	0	0	110.1	Q472 T541 T543 T631 S647 F648 T649	Q472-Q560 HydrophobicContact CB-CG 4.5Å; Q472-Q560 WeakPolarHBondContact O-CA 3.33Å; T541-Q560 PolarHBondContact OG1-OE1 2.76Å; T543-Q560 PolarHBondContact OG1-NE2 3.06Å; Q560-T631 PolarHBondContact NE2-OG1 3.35Å; Q560-S647 PolarHBondContact N-O 3.33Å; Q560-F648 HydrophobicContact CB-CD1 4.01Å; Q560-F648 HydrophobicContact CB-CE1 4.4Å; Q560-F648 HydrophobicContact CG-CD1 4.43Å; Q560-F648 HydrophobicContact CG-CE1 4.34Å; Q560-T649 PolarHBondContact O-N 2.88Å
561	T	40	Very low	37.9	Very low	61 Å²	61	42.5 Å²	42.5	37%	0.374	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	121.4	170.7	-57.4	0	0	0	0	108.9	Q472 T473 S474	Q472-T561 PolarHBondContact O-N 2.96Å; T473-T561 WeakPolarHBondContact CA-O 3.46Å; S474-T561 PolarHBondContact N-O 3.26Å
562	S	37.6	Very low	37.5	Very low	2 Å²	2	40.1 Å²	40.1	1%	0.014	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	121.9	-177.6	-74.5	0	0	0	0	111.8	S474 T541 T649 T650 S651	S474-S562 WeakPolarHBondContact O-CA 3.33Å; T541-S562 WeakPolarHBondContact CG2-OG 3.45Å; S562-T649 PolarHBondContact N-O 2.77Å; S562-T650 WeakPolarHBondContact O-CA 3.49Å; S562-S651 PolarHBondContact O-N 2.85Å
563	S	40.8	Very low	37	Very low	46 Å²	46	39 Å²	39	32%	0.322	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	147.1	-176.9	61.7	0	0	0	0	112.5	S474 S475 T476	S474-S563 PolarHBondContact O-N 3.22Å; S475-S563 WeakPolarHBondContact CA-O 3.4Å; S475-S563 WeakPolarHBondContact CB-OG 3.4Å; T476-S563 PolarHBondContact N-O 3Å; T476-S563 VanDerWaalsContact N-O 3.16Å
564	T	36.7	Very low	36.7	Very low	15 Å²	15	43.8 Å²	43.8	9%	0.092	24%	0.236	C	C	.	.			trans	-114.2	133	176.5	53.4	0	0	0	0	111.3	T476 V539 V627	T476-T564 WeakPolarHBondContact OG1-CA 3.46Å; V539-T564 HydrophobicContact CG2-CG2 4.1Å; T564-V627 HydrophobicContact CG2-CG2 3.71Å
565	G	33.8	Very low	36.3	Very low	19 Å²	19	45 Å²	45	20%	0.196	24%	0.243	C	C	.	.			trans	-62.8	147.9	-180	0	0	0	0	0	114.1	T476	T476-G565 WeakPolarHBondContact O-CA 3.38Å; T476-G565 PolarHBondContact O-N 3.33Å; T476-G565 VanDerWaalsContact O-N 3.11Å; T476-G565 PolarHBondContact OG1-N 3.19Å
566	Q	37.7	Very low	35.8	Very low	80 Å²	80	45.2 Å²	45.2	37%	0.374	24%	0.244	S	C	.	.			trans	-78	149.3	-179.8	-57	-177.1	110.4	0	0	111.8	Q478 T479 S653	Q478-Q566 WeakPolarHBondContact CA-O 3.37Å; T479-Q566 PolarHBondContact N-O 3.28Å; Q566-S653 PolarHBondContact OE1-OG 2.92Å
567	T	35.2	Very low	35.3	Very low	20 Å²	20	46 Å²	46	12%	0.123	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	124.8	166.9	-61	0	0	0	0	109.1	T479 T535 I569	T479-T567 WeakPolarHBondContact O-CA 3.48Å; T535-T567 WeakPolarHBondContact CB-OG1 3.4Å; T535-T567 HydrophobicContact CG2-CG2 3.73Å; T535-T567 PolarHBondContact OG1-OG1 2.88Å; T567-I569 HydrophobicContact CG2-CD1 4.41Å; T567-I569 HydrophobicContact CG2-CG1 4.33Å
568	Q	37.1	Very low	34.9	Very low	66 Å²	66	47.1 Å²	47.1	31%	0.308	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	132.7	175.1	-64.1	-179.7	66.8	0	0	110.4	T479 Q480 I481 F570	T479-Q568 PolarHBondContact O-N 3.45Å; Q480-Q568 WeakPolarHBondContact CA-O 3.31Å; Q480-Q568 HydrophobicContact CG-CB 4.46Å; I481-Q568 PolarHBondContact N-O 2.88Å; Q568-F570 HydrophobicContact CB-CD2 4.39Å; Q568-F570 HydrophobicContact CB-CE2 3.72Å; Q568-F570 HydrophobicContact CB-CZ 4.33Å
569	I	34.6	Very low	34.4	Very low	33 Å²	33	50 Å²	50	17%	0.169	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	115.8	-178.1	-60.1	170.2	0	0	0	108.5	I481 I533 T567 I621	I481-I569 HydrophobicContact CB-CG1 4.36Å; I481-I569 WeakPolarHBondContact O-CA 3.48Å; I533-I569 HydrophobicContact CD1-CD1 4Å; I533-I569 HydrophobicContact CG2-CD1 4.37Å; T567-I569 HydrophobicContact CG2-CD1 4.41Å; T567-I569 HydrophobicContact CG2-CG1 4.33Å; I569-I621 HydrophobicContact CD1-CD1 3.75Å; I569-I621 HydrophobicContact CD1-CG1 4.19Å; I569-I621 HydrophobicContact CD1-CG2 4.04Å
570	F	34.4	Very low	33.9	Very low	87 Å²	87	51.8 Å²	51.8	38%	0.382	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	115.3	-178.7	-65.7	-78.6	0	0	0	110.8	I481 F482 T483 Q568	I481-F570 PolarHBondContact O-N 3.02Å; F482-F570 HydrophobicContact CD1-CB 3.75Å; F482-F570 AromaticContact CD1-CD2 3.8Å; F482-F570 HydrophobicContact CD1-CD2 3.8Å; F482-F570 HydrophobicContact CD1-CG 4.09Å; F482-F570 HydrophobicContact CE1-CB 4.05Å; F482-F570 AromaticContact CE1-CD2 3.26Å; F482-F570 HydrophobicContact CE1-CD2 3.26Å; F482-F570 AromaticContact CE1-CE2 3.9Å; F482-F570 HydrophobicContact CE1-CE2 3.9Å; F482-F570 AromaticContact CE1-CG 3.86Å; F482-F570 HydrophobicContact CE1-CG 3.86Å; F482-F570 AromaticContact CZ-CD2 3.77Å; F482-F570 HydrophobicContact CZ-CD2 3.77Å; F482-F570 HydrophobicContact CZ-CE2 4.09Å; T483-F570 PolarHBondContact N-O 3.21Å; T483-F570 PolarHBondContact OG1-O 3.24Å; Q568-F570 HydrophobicContact CB-CD2 4.39Å; Q568-F570 HydrophobicContact CB-CE2 3.72Å; Q568-F570 HydrophobicContact CB-CZ 4.33Å
571	T	32.5	Very low	33.4	Very low	50 Å²	50	55.1 Å²	55.1	31%	0.307	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	130.1	166.8	50.4	0	0	0	0	109.8	T483 P530	T483-T571 VanDerWaalsContact OG1-CA 3.29Å; T483-T571 WeakPolarHBondContact OG1-CA 3.43Å; T483-T571 VanDerWaalsContact OG1-CG2 3.31Å; T483-T571 WeakPolarHBondContact OG1-CG2 3.26Å; P530-T571 HydrophobicContact CG-CG2 3.76Å
572	T	33.9	Very low	32.7	Very low	62 Å²	62	56.3 Å²	56.3	38%	0.38	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	119.9	174.9	-57.1	0	0	0	0	111.4	T483 T484 D485 R574	T483-T572 PolarHBondContact O-N 3.5Å; T484-T572 WeakPolarHBondContact CA-O 3.49Å; D485-T572 PolarHBondContact N-O 2.81Å; T572-R574 HydrophobicContact CG2-CG 4.41Å
573	D	33.4	Very low	32	Very low	31 Å²	31	60.9 Å²	60.9	17%	0.166	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	125.3	-177.9	-174.9	-14.9	0	0	0	108.4	T526 T614 T615	T526-D573 WeakPolarHBondContact CB-OD1 3.21Å; T526-D573 WeakPolarHBondContact CB-OD2 3.44Å; T526-D573 WeakPolarHBondContact CG2-OD1 3.24Å; T526-D573 PolarHBondContact OG1-OD1 3.02Å; T526-D573 PolarHBondContact OG1-OD2 3.15Å; D573-T614 WeakPolarHBondContact OD2-CA 3.39Å; D573-T614 WeakPolarHBondContact OD2-CB 3.48Å; D573-T614 WeakPolarHBondContact OD2-CG2 3.48Å; D573-T615 PolarHBondContact OD2-N 2.81Å
574	R	33.2	Very low	31.2	Very low	164 Å²	164	62.2 Å²	62.2	62%	0.619	35%	0.353	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-140.2	111.2	179	-76.2	-172.1	171.9	-177.7	-2.7	112.5	D485 R486 T487 T572 P576	D485-R574 PolarHBondContact O-N 3.33Å; R486-R574 WeakPolarHBondContact CA-O 3.44Å; T487-R574 PolarHBondContact N-O 2.58Å; T572-R574 HydrophobicContact CG2-CG 4.41Å; R574-P576 WeakPolarHBondContact O-CD 3.36Å
575	T	31.4	Very low	30.4	Very low	38 Å²	38	68.3 Å²	68.3	23%	0.233	39%	0.39	C	S	.	.			trans	-107.2	68.6	-178.9	54.2	0	0	0	0	113.7	T487 V524 T526 A577 V612 T614	T487-T575 WeakPolarHBondContact OG1-CA 3.47Å; T487-T575 WeakPolarHBondContact OG1-CG2 3.16Å; V524-T575 HydrophobicContact CG1-CG2 4.41Å; T526-T575 HydrophobicContact CG2-CG2 3.45Å; T526-T575 VanDerWaalsContact CG2-CG2 3.45Å; T526-T575 WeakPolarHBondContact OG1-CG2 3.34Å; T575-A577 PolarHBondContact O-N 3.41Å; T575-A577 VanDerWaalsContact O-N 3.14Å; T575-V612 HydrophobicContact CG2-CG1 4.13Å; T575-T614 HydrophobicContact CG2-CG2 3.87Å
576	P	28.5	Very low	29.8	Very low	58 Å²	58	72.9 Å²	72.9	38%	0.377	42%	0.419	S	S	.	.			trans	-77	98.8	174.6	31.7	-32.6	0	0	0	110.8	P488 A489 R574	P488-P576 WeakPolarHBondContact CA-O 3.49Å; P488-P576 HydrophobicContact CB-CG 4.36Å; A489-P576 PolarHBondContact N-O 2.83Å; R574-P576 WeakPolarHBondContact O-CD 3.36Å
577	A	27.5	Very low	28.9	Very low	31 Å²	31	75.6 Å²	75.6	26%	0.256	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	152.4	168.8	0	0	0	0	0	111	A489 T575 F579	A489-A577 CarbonylContact O-C 3.52Å; A489-A577 WeakPolarHBondContact O-CA 3.32Å; T575-A577 PolarHBondContact O-N 3.41Å; T575-A577 VanDerWaalsContact O-N 3.14Å; A577-F579 HydrophobicContact CB-CE2 3.77Å; A577-F579 HydrophobicContact CB-CZ 3.89Å
578	T	29.6	Very low	28.2	Very low	76 Å²	76	80.6 Å²	80.6	47%	0.466	48%	0.477	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	120	172.7	-57.7	0	0	0	0	109.6	A489 T490 F491	A489-T578 PolarHBondContact O-N 2.84Å; T490-T578 WeakPolarHBondContact CA-O 3.43Å; F491-T578 PolarHBondContact N-O 2.86Å
579	F	27.8	Very low	27.3	Very low	72 Å²	72	84.2 Å²	84.2	32%	0.316	50%	0.504	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	133.5	-179.9	-52	-86.5	0	0	0	108.6	F491 E522 A577	F491-F579 HydrophobicContact CB-CD1 3.94Å; F491-F579 AromaticContact CD2-CD1 3.54Å; F491-F579 HydrophobicContact CD2-CD1 3.54Å; F491-F579 AromaticContact CD2-CE1 3.36Å; F491-F579 HydrophobicContact CD2-CE1 3.36Å; F491-F579 HydrophobicContact CD2-CZ 4.24Å; F491-F579 HydrophobicContact CE2-CD1 4.34Å; F491-F579 AromaticContact CE2-CE1 3.7Å; F491-F579 HydrophobicContact CE2-CE1 3.7Å; F491-F579 HydrophobicContact CE2-CZ 4.3Å; F491-F579 AromaticContact CG-CD1 3.98Å; F491-F579 HydrophobicContact CG-CD1 3.98Å; F491-F579 HydrophobicContact CG-CE1 4.08Å; E522-F579 WeakPolarHBondContact OE2-CD1 3.48Å; E522-F579 VanDerWaalsContact OE2-CE1 3.26Å; E522-F579 WeakPolarHBondContact OE2-CE1 3.45Å; A577-F579 HydrophobicContact CB-CE2 3.77Å; A577-F579 HydrophobicContact CB-CZ 3.89Å
580	T	28.3	Very low	26.6	Very low	72 Å²	72	88 Å²	88	44%	0.442	53%	0.531	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	116.3	178.2	-58.7	0	0	0	0	109.9	F491 S493	F491-T580 PolarHBondContact O-N 3.14Å; S493-T580 PolarHBondContact N-O 3.37Å; S493-T580 VanDerWaalsContact N-O 3.15Å
581	S	27.1	Very low	25.9	Very low	75 Å²	75	90.6 Å²	90.6	52%	0.524	55%	0.554	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-130	144.5	176.3	58.8	0	0	0	0	109.9
582	T	25.1	Very low	25.3	Very low	85 Å²	85	93.9 Å²	93.9	52%	0.521	57%	0.574	S	S	.	*			trans	-118.1	97.4	-177.8	-26.2	0	0	0	0	109.3	P495	P495-T582 WeakPolarHBondContact CD-O 3.34Å; P495-T582 WeakPolarHBondContact CG-O 3.31Å
583	P	23.6	Very low	24.7	Very low	99 Å²	99	97.9 Å²	97.9	64%	0.643	59%	0.592	S	S	*	*	P	Polyproline II helix	trans	-73.7	133.2	-177.5	28.5	-33.3	0	0	0	111.4
584	S	23.2	Very low	24.1	Very low	73 Å²	73	101.4 Å²	101.4	51%	0.51	62%	0.615	S	S	.	*	P	Polyproline II helix	trans	-76.1	142.7	168.7	-68.9	0	0	0	0	110.5	T497 S586	T497-S584 WeakPolarHBondContact CG2-OG 3.42Å; S584-S586 PolarHBondContact O-N 3.49Å
585	T	19.8	Very low	23.4	Very low	144 Å²	144	99.5 Å²	99.5	88%	0.883	62%	0.617	S	S	*	*	P	Polyproline II helix	trans	-75.4	123.5	-167.8	51.1	0	0	0	0	114.3
586	S	21.5	Very low	22.9	Very low	114 Å²	114	103.9 Å²	103.9	80%	0.797	64%	0.639	S	S	*	*			trans	-134.7	153	153.1	65.2	0	0	0	0	109.3	S584	S584-S586 PolarHBondContact O-N 3.49Å
587	T	19.2	Very low	22.6	Very low	138 Å²	138	109.6 Å²	109.6	85%	0.847	66%	0.661	S	S	*	*			trans	-106.5	120.6	-157.4	51.1	0	0	0	0	114.8
588	S	19.8	Very low	22.3	Very low	124 Å²	124	113.4 Å²	113.4	87%	0.867	68%	0.681	S	S	*	*			trans	-163.8	166.9	150.1	43.6	0	0	0	0	111.3
589	T	19.2	Very low	21.9	Very low	142 Å²	142	116 Å²	116	87%	0.871	70%	0.702	S	S	*	*			trans	-99.6	165.6	-157.6	30.4	0	0	0	0	115.8
590	P	20.5	Very low	21.6	Very low	114 Å²	114	117.8 Å²	117.8	74%	0.74	71%	0.714	S	S	*	*			trans	-111	171.2	-154.4	41.9	-36.5	0	0	0	116.8
591	T	19.4	Very low	21.2	Very low	141 Å²	141	120.8 Å²	120.8	87%	0.865	73%	0.733	S	S	*	*			trans	-141.3	149.7	164.6	-39.9	0	0	0	0	111
592	T	19.5	Very low	21	Very low	119 Å²	119	122.1 Å²	122.1	73%	0.73	74%	0.742	S	S	*	*			trans	-148.1	162.8	-173.8	49.5	0	0	0	0	109.7
593	L	20.7	Very low	20.7	Very low	146 Å²	146	124.3 Å²	124.3	76%	0.764	76%	0.756	S	S	*	*			cis	-150.2	174.8	5.7	-144.5	60.7	0	0	0	105.8
594	T	20.7	Very low	20.5	Very low	104 Å²	104	124.3 Å²	124.3	64%	0.638	76%	0.758	S	S	*	*			cis	-137.2	-147.6	8.6	-24.7	0	0	0	0	107.9
595	D	19.2	Very low	20.4	Very low	124 Å²	124	126.8 Å²	126.8	66%	0.663	78%	0.775	S	S	*	*			cis	-154.7	159.1	3.1	-124.4	-57.7	0	0	0	106.5
596	N	21.6	Very low	20.6	Very low	130 Å²	130	123.8 Å²	123.8	70%	0.695	76%	0.76	S	S	*	*			cis	-137.4	-129.2	6.7	-175.2	-102.8	0	0	0	109.8	T598	N596-T598 PolarHBondContact O-N 3Å
597	Q	21.4	Very low	20.8	Very low	179 Å²	179	126.8 Å²	126.8	84%	0.836	76%	0.759	S	S	*	*	S	Bend	trans	-75.4	79.6	-178.6	-72.3	-163.3	1.9	0	0	113.8
598	T	22.1	Very low	21	Very low	111 Å²	111	124 Å²	124	68%	0.681	74%	0.738	S	S	*	*			trans	-145.5	118.6	146.5	-65	0	0	0	0	107.5	N596 L600	N596-T598 PolarHBondContact O-N 3Å; T598-L600 HydrophobicContact CG2-CD1 4.03Å; T598-L600 HydrophobicContact CG2-CG 4.14Å; T598-L600 PolarHBondContact O-N 2.97Å
599	S	20	Very low	21.4	Very low	131 Å²	131	121.2 Å²	121.2	92%	0.916	72%	0.716	S	S	*	*			trans	-76.6	97.5	-177.8	-63.4	0	0	0	0	110.7
600	L	22.4	Very low	21.7	Very low	108 Å²	108	118.7 Å²	118.7	57%	0.565	70%	0.695	S	S	*	*			trans	-124.7	127.1	172.9	-78.2	164.8	0	0	0	110	T598	T598-L600 HydrophobicContact CG2-CD1 4.03Å; T598-L600 HydrophobicContact CG2-CG 4.14Å; T598-L600 PolarHBondContact O-N 2.97Å
601	T	19.8	Very low	22	Very low	136 Å²	136	116.8 Å²	116.8	83%	0.834	68%	0.684	S	S	*	*			trans	-131.2	107.4	172.1	47	0	0	0	0	108.7
602	S	22.4	Very low	22.4	Very low	102 Å²	102	113.9 Å²	113.9	71%	0.713	67%	0.666	S	S	*	*			trans	-152.6	132.3	176.4	57.6	0	0	0	0	110.7
603	T	18.8	Very low	22.8	Very low	132 Å²	132	115.7 Å²	115.7	81%	0.81	66%	0.659	S	S	*	*			trans	-114.8	145.3	178.6	20.6	0	0	0	0	111.6
604	S	19.8	Very low	23.1	Very low	99 Å²	99	112.3 Å²	112.3	69%	0.692	65%	0.645	S	S	*	*	S	Bend	trans	63.4	117.2	165.2	44.4	0	0	0	0	120.2	S606	S604-S606 PolarHBondContact O-N 2.85Å
605	S	21.7	Very low	23.6	Very low	124 Å²	124	109.7 Å²	109.7	87%	0.867	63%	0.629	S	S	*	*			trans	53.1	57.9	139.5	63	0	0	0	0	120
606	S	23.9	Very low	24.2	Very low	82 Å²	82	106.4 Å²	106.4	57%	0.573	62%	0.615	S	S	*	*			trans	-133.6	147	143	71.3	0	0	0	0	110	S604 L608	S604-S606 PolarHBondContact O-N 2.85Å; S606-L608 VanDerWaalsContact C-N 3.32Å; S606-L608 PolarHBondContact O-N 3.37Å; S606-L608 VanDerWaalsContact O-N 3.09Å
607	K	24.1	Very low	24.5	Very low	177 Å²	177	104.1 Å²	104.1	77%	0.77	61%	0.606	S	S	*	*			trans	-88.7	70.8	-177.1	-166.8	169.3	-176.5	168.3	0	111.3
608	L	24.7	Very low	25	Very low	79 Å²	79	96.5 Å²	96.5	41%	0.414	57%	0.572	S	S	.	*			trans	-58.5	157	163.9	-89.8	162.2	0	0	0	111.2	L520 S606	L520-L608 HydrophobicContact CB-CD2 4.07Å; S606-L608 VanDerWaalsContact C-N 3.32Å; S606-L608 PolarHBondContact O-N 3.37Å; S606-L608 VanDerWaalsContact O-N 3.09Å
609	T	26.8	Very low	25.5	Very low	66 Å²	66	94.7 Å²	94.7	41%	0.405	56%	0.561	S	S	.	*			trans	-154.7	87.7	174.3	-57.2	0	0	0	0	107.2
610	E	26.3	Very low	26.1	Very low	88 Å²	88	93.9 Å²	93.9	41%	0.411	55%	0.546	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	150.9	175.3	-68.7	148.8	-126.7	0	0	110
611	S	27.5	Very low	26.6	Very low	75 Å²	75	91 Å²	91	52%	0.524	53%	0.531	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.3	116.9	174	-75.1	0	0	0	0	112.2	E522 V524	E522-S611 PolarHBondContact O-N 2.91Å; V524-S611 PolarHBondContact N-O 2.91Å; V524-S611 VanDerWaalsContact N-O 3.16Å
612	V	26.3	Very low	27.2	Very low	79 Å²	79	88.5 Å²	88.5	48%	0.479	52%	0.516	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	131.7	169.6	-177.4	0	0	0	0	108.4	V524 T575	V524-V612 WeakPolarHBondContact O-CA 3.35Å; T575-V612 HydrophobicContact CG2-CG1 4.13Å
613	R	28.9	Very low	27.7	Very low	158 Å²	158	86.6 Å²	86.6	60%	0.596	50%	0.5	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-142.5	109.1	178.1	-176.6	174	177.6	159.5	3.2	112	V524 T526	V524-R613 PolarHBondContact O-N 2.9Å; V524-R613 VanDerWaalsContact O-N 3.15Å; T526-R613 PolarHBondContact N-O 2.83Å
614	T	26.3	Very low	28.5	Very low	74 Å²	74	83 Å²	83	45%	0.454	48%	0.48	S	S	.	.			trans	-82.8	155.6	166.1	54.5	0	0	0	0	110.5	T526 D573 T575	T526-T614 WeakPolarHBondContact OG1-CA 3.37Å; D573-T614 WeakPolarHBondContact OD2-CA 3.39Å; D573-T614 WeakPolarHBondContact OD2-CB 3.48Å; D573-T614 WeakPolarHBondContact OD2-CG2 3.48Å; T575-T614 HydrophobicContact CG2-CG2 3.87Å
615	T	30.8	Very low	29.3	Very low	49 Å²	49	81.1 Å²	81.1	30%	0.301	47%	0.467	S	S	.	.			trans	-160.1	118.9	170.4	-41.2	0	0	0	0	111.2	S528 D573	S528-T615 PolarHBondContact N-O 3.38Å; S528-T615 VanDerWaalsContact N-O 3.14Å; D573-T615 PolarHBondContact OD2-N 2.81Å
616	S	31.8	Very low	29.9	Very low	55 Å²	55	78.9 Å²	78.9	39%	0.385	45%	0.448	S	S	.	.			trans	-144	112.7	-178.3	57.3	0	0	0	0	112.1	S528	S528-S616 WeakPolarHBondContact O-CA 3.36Å
617	V	29.2	Very low	30.3	Very low	83 Å²	83	77 Å²	77	50%	0.503	43%	0.433	S	S	.	.			trans	-148	118.5	174	-177.2	0	0	0	0	108.2
618	P	32.2	Very low	30.6	Very low	18 Å²	18	71.1 Å²	71.1	12%	0.117	42%	0.418	C	S	.	.			trans	-77.3	149.4	172.8	32	-33.5	0	0	0	111.3	I621	P618-I621 HydrophobicContact CB-CD1 3.8Å; P618-I621 HydrophobicContact CG-CD1 4.39Å
619	T	32.6	Very low	31.1	Very low	73 Å²	73	70.3 Å²	70.3	45%	0.448	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	149.6	173.8	32.6	0	0	0	0	111.4	P530 T531	P530-T619 PolarHBondContact O-N 2.91Å; T531-T619 VanDerWaalsContact CA-O 3.3Å; T531-T619 WeakPolarHBondContact CA-O 3.48Å; T531-T619 WeakPolarHBondContact CG2-OG1 3.35Å
620	N	31.4	Very low	31.3	Very low	114 Å²	114	71.5 Å²	71.5	61%	0.61	42%	0.42	S	S	*	.	E	Extended strand (participates in β ladder)	trans	53.5	71.4	-174.2	-60.9	-7.6	0	0	0	113.7	N532 I533	N532-N620 VanDerWaalsContact CA-O 3.23Å; N532-N620 WeakPolarHBondContact CA-O 3.31Å; N532-N620 PolarHBondContact N-O 2.95Å; N532-N620 VanDerWaalsContact N-O 3.12Å; N532-N620 WeakPolarHBondContact OD1-CB 3.45Å; N532-N620 PolarHBondContact OD1-ND2 3.24Å; I533-N620 PolarHBondContact N-O 2.86Å
621	I	32.4	Very low	31.8	Very low	48 Å²	48	69.4 Å²	69.4	25%	0.246	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	127.9	166.6	-62.3	163.3	0	0	0	108.1	I533 I569 P618	I533-I621 HydrophobicContact CB-CG1 4.39Å; I533-I621 WeakPolarHBondContact O-CA 3.48Å; I569-I621 HydrophobicContact CD1-CD1 3.75Å; I569-I621 HydrophobicContact CD1-CG1 4.19Å; I569-I621 HydrophobicContact CD1-CG2 4.04Å; P618-I621 HydrophobicContact CB-CD1 3.8Å; P618-I621 HydrophobicContact CG-CD1 4.39Å
622	T	33.3	Very low	32	Very low	84 Å²	84	68.9 Å²	68.9	52%	0.515	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	121.3	176.5	-57.4	0	0	0	0	109.1	I533 T534 T535	I533-T622 PolarHBondContact O-N 3.2Å; T534-T622 WeakPolarHBondContact CA-O 3.49Å; T535-T622 PolarHBondContact N-O 2.93Å
623	T	33	Very low	32.3	Very low	62 Å²	62	68.3 Å²	68.3	38%	0.38	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	127.7	175.6	-65.8	0	0	0	0	109.5	T535 M655	T535-T623 WeakPolarHBondContact O-CA 3.43Å; T535-T623 WeakPolarHBondContact OG1-CB 3.42Å; T535-T623 WeakPolarHBondContact OG1-CG2 3.44Å; T535-T623 PolarHBondContact OG1-OG1 2.9Å; T623-M655 HydrophobicContact CG2-CE 4.33Å; T623-M655 WeakPolarHBondContact OG1-CE 3.49Å
624	S	35.8	Very low	32.5	Very low	57 Å²	57	64.5 Å²	64.5	40%	0.399	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	131.1	174.7	56	0	0	0	0	111.7	T535 S536 S537	T535-S624 PolarHBondContact O-N 2.98Å; S536-S624 WeakPolarHBondContact CA-O 3.43Å; S537-S624 PolarHBondContact N-O 2.9Å
625	S	36.9	Very low	32.7	Very low	59 Å²	59	64.8 Å²	64.8	41%	0.413	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	122.9	173.2	56.1	0	0	0	0	108.9	S537	S537-S625 WeakPolarHBondContact O-CA 3.46Å
626	T	33.7	Very low	32.6	Very low	76 Å²	76	64.7 Å²	64.7	47%	0.466	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	121.3	-178.5	-54.8	0	0	0	0	109.3	S537 T538 V539	S537-T626 PolarHBondContact O-N 3.42Å; T538-T626 WeakPolarHBondContact CA-O 3.4Å; V539-T626 PolarHBondContact N-O 2.92Å
627	V	31.9	Very low	32.3	Very low	43 Å²	43	71.2 Å²	71.2	26%	0.261	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	119.4	173.8	-177.6	0	0	0	0	108	V539 T564 T629 T650	V539-V627 HydrophobicContact CB-CG2 4.43Å; V539-V627 CarbonylContact O-C 3.49Å; V539-V627 WeakPolarHBondContact O-CA 3.38Å; T564-V627 HydrophobicContact CG2-CG2 3.71Å; V627-T629 HydrophobicContact CG1-CG2 4.1Å; V627-T650 HydrophobicContact CG1-CG2 3.95Å
628	A	31.8	Very low	32.1	Very low	54 Å²	54	74.9 Å²	74.9	45%	0.446	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	97.4	-179.6	0	0	0	0	0	109.3	V539 A540 T541	V539-A628 PolarHBondContact O-N 2.82Å; A540-A628 WeakPolarHBondContact CA-O 3.37Å; T541-A628 PolarHBondContact N-O 2.97Å
629	T	33.6	Very low	31.9	Very low	62 Å²	62	76.5 Å²	76.5	38%	0.38	45%	0.449	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	121.4	177.2	53.3	0	0	0	0	109.6	T541 V627 T650	T541-T629 WeakPolarHBondContact OG1-CG2 3.39Å; V627-T629 HydrophobicContact CG1-CG2 4.1Å; T629-T650 HydrophobicContact CG2-CG2 4.34Å
630	N	32.4	Very low	31.7	Very low	90 Å²	90	78.6 Å²	78.6	48%	0.481	46%	0.462	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	143.3	169.5	-161.4	-10.4	0	0	0	110.5	T541 T543	T541-N630 PolarHBondContact O-N 2.99Å; T543-N630 PolarHBondContact N-O 2.96Å
631	T	35	Very low	31.5	Very low	44 Å²	44	78.5 Å²	78.5	27%	0.27	46%	0.461	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	102.8	178.2	-61.8	0	0	0	0	108.7	T543 Q560 R633 F648	T543-T631 WeakPolarHBondContact O-CA 3.39Å; Q560-T631 PolarHBondContact NE2-OG1 3.35Å; T631-R633 HydrophobicContact CG2-CG 4.34Å; T631-F648 HydrophobicContact CG2-CZ 4.44Å; T631-F648 WeakPolarHBondContact OG1-CE1 3.39Å
632	T	32.7	Very low	31.4	Very low	64 Å²	64	80.1 Å²	80.1	39%	0.393	48%	0.477	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	122.2	-179.6	-58.3	0	0	0	0	109.8	T543 S544 A545	T543-T632 PolarHBondContact O-N 3.05Å; T543-T632 VanDerWaalsContact O-N 3.15Å; S544-T632 WeakPolarHBondContact CA-O 3.24Å; A545-T632 PolarHBondContact N-O 2.97Å
633	R	33.3	Very low	31.2	Very low	67 Å²	67	80.6 Å²	80.6	25%	0.253	48%	0.48	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	126.6	178.5	-68.4	175.5	61.1	144.3	-3	109	T631	T631-R633 HydrophobicContact CG2-CG 4.34Å
634	T	31.6	Very low	31	Very low	79 Å²	79	81.8 Å²	81.8	49%	0.485	48%	0.483	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	122.8	-177.9	-52.4	0	0	0	0	109.8	A545 V547	A545-T634 PolarHBondContact O-N 2.95Å; V547-T634 PolarHBondContact N-O 3.44Å
635	V	30.7	Very low	30.7	Very low	79 Å²	79	84.9 Å²	84.9	48%	0.479	49%	0.489	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	134.5	-178.7	-175.6	0	0	0	0	107.2
636	A	28.6	Very low	30.3	Very low	48 Å²	48	84.6 Å²	84.6	40%	0.397	49%	0.49	S	S	.	.			trans	-81.7	155.1	177.1	0	0	0	0	0	112.1	P548 N638	P548-A636 WeakPolarHBondContact O-CB 3.19Å; A636-N638 PolarHBondContact O-N 2.9Å
637	E	25.6	Very low	30.1	Very low	192 Å²	192	83.9 Å²	83.9	90%	0.897	49%	0.488	S	S	*	.	S	Bend	trans	-70.4	94.9	178.2	-62.5	-178.4	127.7	0	0	111.5
638	N	26.2	Very low	30	Very low	159 Å²	159	86.7 Å²	86.7	85%	0.85	50%	0.497	S	S	*	.	S	Bend	trans	178	48.8	151	-93.2	-31	0	0	0	113	A636	A636-N638 PolarHBondContact O-N 2.9Å
639	S	28	Very low	29.8	Very low	53 Å²	53	87.9 Å²	87.9	37%	0.371	50%	0.499	S	S	.	.			trans	-142.5	137.5	-176	-49.3	0	0	0	0	114.4	V550 L641	V550-S639 PolarHBondContact O-OG 3.1Å; S639-L641 PolarHBondContact O-N 3.1Å
640	T	27.3	Very low	29.5	Very low	117 Å²	117	88.9 Å²	88.9	72%	0.718	51%	0.505	S	S	*	.			trans	-79.3	106.7	172.5	42.8	0	0	0	0	111.2
641	L	28.6	Very low	29.4	Very low	112 Å²	112	88 Å²	88	59%	0.586	51%	0.506	S	S	*	.			trans	-83	120.3	-174.8	-176.6	65.7	0	0	0	112.3	S639 I644	S639-L641 PolarHBondContact O-N 3.1Å; L641-I644 HydrophobicContact CD1-CD1 4.23Å; L641-I644 HydrophobicContact CD1-CG1 3.99Å; L641-I644 HydrophobicContact CD2-CD1 3.74Å; L641-I644 HydrophobicContact CD2-CG1 3.99Å; L641-I644 HydrophobicContact CG-CD1 4.48Å; L641-I644 HydrophobicContact CG-CG1 4.28Å
642	S	29	Very low	29.1	Very low	82 Å²	82	90.7 Å²	90.7	57%	0.573	52%	0.523	S	S	*	.			trans	-111.8	63.4	-171.2	-161.1	0	0	0	0	113.1
643	T	29.9	Very low	29	Very low	94 Å²	94	91.1 Å²	91.1	58%	0.577	53%	0.528	S	S	*	.			trans	87.4	128.9	-174.2	-44.5	0	0	0	0	114.8	K645	T643-K645 HydrophobicContact CG2-CG 4.18Å
644	I	28.4	Very low	28.8	Very low	86 Å²	86	93 Å²	93	44%	0.441	55%	0.551	S	S	.	*	B	Isolated β-bridge	trans	-111.5	131.8	157.1	-68.7	-178.2	0	0	0	107.1	L641	L641-I644 HydrophobicContact CD1-CD1 4.23Å; L641-I644 HydrophobicContact CD1-CG1 3.99Å; L641-I644 HydrophobicContact CD2-CD1 3.74Å; L641-I644 HydrophobicContact CD2-CG1 3.99Å; L641-I644 HydrophobicContact CG-CD1 4.48Å; L641-I644 HydrophobicContact CG-CG1 4.28Å
645	K	29.8	Very low	28.7	Very low	123 Å²	123	92.5 Å²	92.5	54%	0.535	55%	0.545	S	S	.	.			trans	-115.1	140.9	159.6	-75.5	172.7	179.7	175.1	0	108.6	D557 T643	D557-K645 WeakPolarHBondContact OD1-CB 3.2Å; D557-K645 VanDerWaalsContact OD2-CD 3.23Å; D557-K645 WeakPolarHBondContact OD2-CD 3.46Å; T643-K645 HydrophobicContact CG2-CG 4.18Å
646	A	28.4	Very low	28.5	Very low	52 Å²	52	97.8 Å²	97.8	43%	0.43	56%	0.564	S	S	.	*			trans	-145.6	127	169.6	0	0	0	0	0	106.2	T558 F648	T558-A646 WeakPolarHBondContact O-CA 3.49Å; A646-F648 HydrophobicContact CB-CE2 3.71Å; A646-F648 HydrophobicContact CB-CZ 4.12Å
647	S	30.2	Very low	28.4	Very low	62 Å²	62	98.4 Å²	98.4	43%	0.434	56%	0.56	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-125.9	122.2	-179	56	0	0	0	0	110.2	T558 Q560	T558-S647 PolarHBondContact O-N 2.91Å; Q560-S647 PolarHBondContact N-O 3.33Å
648	F	28.2	Very low	28.5	Very low	101 Å²	101	97 Å²	97	44%	0.443	56%	0.559	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-120.9	119	-176.6	-58.7	-80.8	0	0	0	108.6	Q560 T631 A646	Q560-F648 HydrophobicContact CB-CD1 4.01Å; Q560-F648 HydrophobicContact CB-CE1 4.4Å; Q560-F648 HydrophobicContact CG-CD1 4.43Å; Q560-F648 HydrophobicContact CG-CE1 4.34Å; T631-F648 HydrophobicContact CG2-CZ 4.44Å; T631-F648 WeakPolarHBondContact OG1-CE1 3.39Å; A646-F648 HydrophobicContact CB-CE2 3.71Å; A646-F648 HydrophobicContact CB-CZ 4.12Å
649	T	29.1	Very low	28.5	Very low	79 Å²	79	93.8 Å²	93.8	49%	0.485	55%	0.545	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	106.1	171.5	-56.1	0	0	0	0	109.3	Q560 S562	Q560-T649 PolarHBondContact O-N 2.88Å; S562-T649 PolarHBondContact N-O 2.77Å
650	T	27.6	Very low	28.3	Very low	83 Å²	83	97.2 Å²	97.2	51%	0.509	57%	0.569	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-105.8	142.4	171	50.5	0	0	0	0	109.8	S562 V627 T629	S562-T650 WeakPolarHBondContact O-CA 3.49Å; V627-T650 HydrophobicContact CG1-CG2 3.95Å; T629-T650 HydrophobicContact CG2-CG2 4.34Å
651	S	29.2	Very low	28.2	Very low	72 Å²	72	95.8 Å²	95.8	50%	0.503	56%	0.561	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-143.6	114.3	178.9	-68	0	0	0	0	111.1	S562	S562-S651 PolarHBondContact O-N 2.85Å
652	T	29.3	Very low	27.9	Very low	101 Å²	101	97.1 Å²	97.1	62%	0.62	57%	0.574	S	S	*	*			trans	-105.5	130.4	170.3	44.6	0	0	0	0	108.7
653	S	30.9	Very low	27.7	Very low	72 Å²	72	98.3 Å²	98.3	50%	0.503	57%	0.572	S	S	.	*			trans	-104.2	142.4	-178.9	-170.2	0	0	0	0	111.5	Q566	Q566-S653 PolarHBondContact OE1-OG 2.92Å
654	S	28	Very low	27.4	Very low	106 Å²	106	99.6 Å²	99.6	74%	0.741	59%	0.585	S	S	*	*	P	Polyproline II helix	trans	-86.7	143.4	179.2	52.5	0	0	0	0	112.5
655	M	28.9	Very low	27.2	Very low	70 Å²	70	101 Å²	101	35%	0.345	60%	0.598	S	S	.	*	P	Polyproline II helix	trans	-76.5	124.5	178.7	-173.1	-172.7	-61.5	0	0	111.8	T623 L657	T623-M655 HydrophobicContact CG2-CE 4.33Å; T623-M655 WeakPolarHBondContact OG1-CE 3.49Å; M655-L657 HydrophobicContact SD-CD1 4.05Å
656	E	27.4	Very low	26.9	Very low	189 Å²	189	102.6 Å²	102.6	88%	0.883	61%	0.611	S	S	*	*	P	Polyproline II helix	trans	-79.5	127.2	160.8	-75.4	-164.6	131.5	0	0	109.9
657	L	27.5	Very low	26.8	Very low	61 Å²	61	105.4 Å²	105.4	32%	0.319	62%	0.623	S	S	.	*			trans	-130.9	105.5	178.3	-159	81.8	0	0	0	111	M655 T659	M655-L657 HydrophobicContact SD-CD1 4.05Å; L657-T659 PolarHBondContact O-N 3.09Å
658	N	27.7	Very low	26.6	Very low	162 Å²	162	107.4 Å²	107.4	87%	0.866	63%	0.633	S	S	*	*	S	Bend	trans	-79.8	58.9	179.2	-92.9	-41.8	0	0	0	112.9
659	T	25	Very low	26.5	Very low	93 Å²	93	109.8 Å²	109.8	57%	0.571	65%	0.648	S	S	*	*	S	Bend	trans	-174.9	152.4	151.6	12.4	0	0	0	0	110.6	L657 T661	L657-T659 PolarHBondContact O-N 3.09Å; T659-T661 PolarHBondContact O-N 3.12Å
660	S	23.6	Very low	26.2	Very low	125 Å²	125	111.5 Å²	111.5	87%	0.874	66%	0.659	S	S	*	*			trans	-72.7	115.5	-173.1	-171.5	0	0	0	0	112.8
661	T	25.1	Very low	26.1	Very low	87 Å²	87	113.1 Å²	113.1	53%	0.534	67%	0.673	S	S	.	*			trans	-154.9	144.8	166.3	-62.9	0	0	0	0	109.4	T659	T659-T661 PolarHBondContact O-N 3.12Å
662	T	22.2	Very low	25.8	Very low	140 Å²	140	115.2 Å²	115.2	86%	0.859	68%	0.683	S	S	*	*			trans	-71.3	132.9	-175.3	-30.6	0	0	0	0	112.4
663	I	24.8	Very low	25.6	Very low	106 Å²	106	116.9 Å²	116.9	54%	0.544	69%	0.688	S	S	.	*			trans	-113.9	130.2	177	-54.6	177.3	0	0	0	109.7	V665	I663-V665 HydrophobicContact CG2-CG2 3.77Å
664	S	24	Very low	25.2	Very low	122 Å²	122	122 Å²	122	85%	0.853	70%	0.701	S	S	*	*			trans	-103.2	105.5	167.5	-68	0	0	0	0	109.8
665	V	24.5	Very low	25.1	Very low	115 Å²	115	125.3 Å²	125.3	70%	0.697	71%	0.71	S	S	*	*			trans	-94.3	122.9	174.1	-174.5	0	0	0	0	109.2	I663	I663-V665 HydrophobicContact CG2-CG2 3.77Å
666	L	24.2	Very low	24.8	Very low	157 Å²	157	127.5 Å²	127.5	82%	0.822	73%	0.727	S	S	*	*			trans	-109.8	91.6	175.1	-177	63.7	0	0	0	110.4	T668	L666-T668 PolarHBondContact O-N 3.39Å
667	T	25.7	Very low	24.6	Very low	110 Å²	110	125.2 Å²	125.2	68%	0.675	72%	0.717	S	S	*	*			trans	-90.8	90.6	178.2	-49.3	0	0	0	0	110.5	I669	T667-I669 HydrophobicContact CG2-CG1 4.38Å; T667-I669 PolarHBondContact O-N 2.88Å
668	T	25.4	Very low	24.3	Very low	104 Å²	104	132.8 Å²	132.8	64%	0.638	74%	0.741	S	S	*	*			trans	-88.9	97.9	178	-49.8	0	0	0	0	111.1	L666 V670	L666-T668 PolarHBondContact O-N 3.39Å; T668-V670 HydrophobicContact CG2-CG2 3.87Å; T668-V670 PolarHBondContact O-N 2.98Å
669	I	25.5	Very low	24.1	Very low	151 Å²	151	131 Å²	131	77%	0.774	74%	0.737	S	S	*	*			trans	-83.4	109.8	168.9	-56.5	175.8	0	0	0	108.2	T667	T667-I669 HydrophobicContact CG2-CG1 4.38Å; T667-I669 PolarHBondContact O-N 2.88Å
670	V	23.6	Very low	24.2	Very low	116 Å²	116	132.1 Å²	132.1	70%	0.703	75%	0.745	S	S	*	*			trans	-100.4	113.4	170.8	-174.3	0	0	0	0	108.7	T668 T672	T668-V670 HydrophobicContact CG2-CG2 3.87Å; T668-V670 PolarHBondContact O-N 2.98Å; V670-T672 HydrophobicContact CG1-CG2 4.45Å
671	S	25.5	Very low	24.1	Very low	116 Å²	116	131.7 Å²	131.7	81%	0.811	74%	0.737	S	S	*	*			trans	-123.7	120.8	167.1	-177.1	0	0	0	0	108
672	T	23.6	Very low	24.1	Very low	116 Å²	116	137.9 Å²	137.9	71%	0.712	76%	0.757	S	S	*	*			trans	-110.9	127.4	-176.8	30.6	0	0	0	0	111.7	V670	V670-T672 HydrophobicContact CG1-CG2 4.45Å
673	D	23.6	Very low	24.1	Very low	137 Å²	137	136.3 Å²	136.3	73%	0.733	75%	0.752	S	S	*	*			trans	66.3	96.6	161.4	-79.2	-55.1	0	0	0	120.5
674	K	23	Very low	24.1	Very low	178 Å²	178	136.7 Å²	136.7	77%	0.774	76%	0.764	S	S	*	*				68.1	100	101.9	-172.7	-173.4	-174.8	-179.7	0	118
675	L	25.6	Very low	24.2	Very low	176 Å²	176	139.2 Å²	139.2	92%	0.921	76%	0.762	S	S	*	*			trans	-143.1	153.9	146.7	-133.3	131.4	0	0	0	111.3
676	T	23.5	Very low	24.2	Very low	116 Å²	116	138.3 Å²	138.3	71%	0.712	76%	0.761	S	S	*	*			trans	-110.8	137	-161.3	-58	0	0	0	0	112.7
677	E	22	Very low	24.1	Very low	141 Å²	141	137.4 Å²	137.4	66%	0.659	76%	0.762	S	S	*	*			trans	34.3	103	155.8	-152.5	-153.6	133.2	0	0	118.7
678	R	23.2	Very low	24.2	Very low	220 Å²	220	140.6 Å²	140.6	83%	0.83	77%	0.769	S	S	*	*				179.3	132.4	103	-94.5	-172.8	178.1	-150.9	-9.8	114
679	T	23.1	Very low	24	Very low	126 Å²	126	141.2 Å²	141.2	77%	0.773	78%	0.778	S	S	*	*			trans	-87.2	161.2	170.3	-14.1	0	0	0	0	110.6
680	P	26.5	Very low	24.1	Very low	116 Å²	116	141.4 Å²	141.4	75%	0.753	78%	0.779	S	S	*	*				-143.3	128.9	86.4	35	-17.5	0	0	0	116.4
681	T	22.3	Very low	24	Very low	115 Å²	115	141.8 Å²	141.8	71%	0.706	78%	0.782	S	S	*	*			trans	38.9	109.7	144.1	57.4	0	0	0	0	120.5
682	F	24.2	Very low	24	Very low	218 Å²	218	142.8 Å²	142.8	96%	0.956	78%	0.778	S	S	*	*				-113.9	141.4	126.3	-107.8	-96.1	0	0	0	108.4
683	S	22.5	Very low	23.9	Very low	106 Å²	106	144.6 Å²	144.6	74%	0.741	78%	0.783	S	S	*	*			trans	-101.8	131	-174.6	-173.8	0	0	0	0	111.6
684	S	23.4	Very low	24.1	Very low	115 Å²	115	145 Å²	145	80%	0.804	78%	0.783	S	S	*	*			trans	-136.9	101.1	166.4	50.7	0	0	0	0	110.2
685	Q	26.7	Very low	24.1	Very low	174 Å²	174	143.3 Å²	143.3	81%	0.813	79%	0.788	S	S	*	*			trans	-87.3	104.3	163.6	-75.5	178.5	-10.4	0	0	106.5
686	S	24.6	Very low	24.2	Very low	97 Å²	97	140.9 Å²	140.9	68%	0.678	78%	0.781	S	S	*	*				94.7	118.4	72	66.8	0	0	0	0	110.9
687	T	22.7	Very low	24.3	Very low	137 Å²	137	139.7 Å²	139.7	84%	0.84	78%	0.783	S	S	*	*			trans	-60.6	149.7	174.1	33.4	0	0	0	0	112.6
688	Q	26.8	Very low	24.4	Very low	177 Å²	177	138.9 Å²	138.9	83%	0.827	79%	0.793	S	S	*	*			trans	-152.6	122.7	153.8	-121.7	165.5	101.3	0	0	110
689	S	22.4	Very low	24.5	Very low	118 Å²	118	134.6 Å²	134.6	83%	0.825	79%	0.791	S	S	*	*			trans	-87.4	135.6	171.3	-56.2	0	0	0	0	109.2
690	I	26.5	Very low	24.5	Very low	154 Å²	154	135.9 Å²	135.9	79%	0.79	79%	0.793	S	S	*	*			trans	-132.4	122.4	162.5	-57.9	-179.2	0	0	0	108
691	T	23.1	Very low	24.3	Very low	125 Å²	125	136 Å²	136	77%	0.767	79%	0.791	S	S	*	*			trans	-119.6	114.7	163.8	-60.1	0	0	0	0	106.3
692	D	23.8	Very low	24.5	Very low	136 Å²	136	136.6 Å²	136.6	73%	0.727	80%	0.795	S	S	*	*			trans	179.8	146.4	136.4	-102.5	-24.4	0	0	0	113.4
693	L	22.9	Very low	24.4	Very low	154 Å²	154	132 Å²	132	81%	0.806	79%	0.785	S	S	*	*			trans	57.5	145.7	166	-89.2	56.4	0	0	0	117
694	I	26.9	Very low	24.5	Very low	146 Å²	146	135.2 Å²	135.2	75%	0.749	79%	0.788	S	S	*	*			cis	-136.6	150.3	41	-73.8	167.5	0	0	0	111.3
695	T	23	Very low	24.6	Very low	142 Å²	142	134.8 Å²	134.8	87%	0.871	78%	0.781	S	S	*	*			trans	-116.7	102.9	167.2	-61.4	0	0	0	0	110.9
696	T	27	Very low	24.5	Very low	125 Å²	125	132.5 Å²	132.5	77%	0.767	78%	0.779	S	S	*	*			trans	-150.8	135	160.1	-27.1	0	0	0	0	110.1
697	A	26.9	Very low	24.5	Very low	92 Å²	92	132.4 Å²	132.4	76%	0.76	77%	0.774	S	S	*	*			trans	-99.4	137	172.1	0	0	0	0	0	110.8
698	S	23.9	Very low	24.7	Very low	124 Å²	124	131.8 Å²	131.8	87%	0.867	77%	0.77	S	S	*	*			trans	-159.3	150	155.6	-83.1	0	0	0	0	110.3
699	T	25.3	Very low	24.6	Very low	129 Å²	129	127.7 Å²	127.7	79%	0.791	76%	0.758	S	S	*	*			trans	-78.4	149.7	-174.9	44.7	0	0	0	0	112.7
700	L	22.8	Very low	24.8	Very low	154 Å²	154	127.6 Å²	127.6	81%	0.806	75%	0.752	S	S	*	*				-162	137.1	121.2	-129.4	71.4	0	0	0	113.8
701	T	22.5	Very low	24.8	Very low	118 Å²	118	125.6 Å²	125.6	72%	0.724	74%	0.742	S	S	*	*			trans	27.3	129	150.1	49.5	0	0	0	0	122.7
702	T	26.1	Very low	25.1	Very low	127 Å²	127	129.3 Å²	129.3	78%	0.779	74%	0.744	S	S	*	*			trans	-48.5	138.1	159	-45.7	0	0	0	0	114.7	E704	T702-E704 HydrophobicContact CG2-CG 4.33Å
703	T	23.4	Very low	25.8	Very low	121 Å²	121	125 Å²	125	74%	0.742	72%	0.722	S	S	*	*			trans	-133	126.7	148.5	-57.6	0	0	0	0	108.1	T705	T703-T705 VanDerWaalsContact C-N 3.32Å; T703-T705 PolarHBondContact O-N 2.94Å
704	E	24.6	Very low	26.9	Very low	175 Å²	175	120.2 Å²	120.2	82%	0.818	71%	0.71	S	S	*	*			trans	-77.7	78	177.5	-67.8	-172	137.8	0	0	111.4	T702 T706	T702-E704 HydrophobicContact CG2-CG 4.33Å; E704-T706 PolarHBondContact O-N 2.96Å; E704-T706 VanDerWaalsContact O-N 3.12Å
705	T	23.6	Very low	28.2	Very low	105 Å²	105	121 Å²	121	64%	0.644	70%	0.703	S	S	*	*			trans	-77.4	96	168.2	-45.9	0	0	0	0	109.1	T703 T707	T703-T705 VanDerWaalsContact C-N 3.32Å; T703-T705 PolarHBondContact O-N 2.94Å; T705-T707 VanDerWaalsContact CG2-OG1 3.31Å; T705-T707 WeakPolarHBondContact CG2-OG1 3.36Å; T705-T707 PolarHBondContact O-N 3Å
706	T	26.1	Very low	30.2	Very low	127 Å²	127	114.4 Å²	114.4	78%	0.779	66%	0.662	S	S	*	*			trans	-69.9	69.8	168.4	-55.1	0	0	0	0	109.9	E704 T708	E704-T706 PolarHBondContact O-N 2.96Å; E704-T706 VanDerWaalsContact O-N 3.12Å; T706-T708 PolarHBondContact O-N 2.97Å; T706-T708 VanDerWaalsContact O-N 3.16Å
707	T	23.2	Very low	32.6	Very low	94 Å²	94	110.5 Å²	110.5	58%	0.577	64%	0.641	S	S	*	*			trans	-72	106.1	171.7	-47.3	0	0	0	0	107.6	T705 T709	T705-T707 VanDerWaalsContact CG2-OG1 3.31Å; T705-T707 WeakPolarHBondContact CG2-OG1 3.36Å; T705-T707 PolarHBondContact O-N 3Å; T707-T709 VanDerWaalsContact CG2-OG1 3.26Å; T707-T709 WeakPolarHBondContact CG2-OG1 3.46Å; T707-T709 PolarHBondContact O-N 2.92Å; T707-T709 PolarHBondContact O-OG1 2.96Å
708	T	27.4	Very low	35.2	Very low	124 Å²	124	106.1 Å²	106.1	76%	0.761	60%	0.604	S	S	*	*			trans	-71.4	67	169.3	-49.9	0	0	0	0	109.5	T706 T710	T706-T708 PolarHBondContact O-N 2.97Å; T706-T708 VanDerWaalsContact O-N 3.16Å; T708-T710 PolarHBondContact O-N 2.89Å
709	T	24.6	Very low	38.3	Very low	92 Å²	92	101.6 Å²	101.6	56%	0.564	57%	0.571	S	S	*	*			trans	-67.9	101.3	179.4	-48.3	0	0	0	0	108.3	T707 I711	T707-T709 VanDerWaalsContact CG2-OG1 3.26Å; T707-T709 WeakPolarHBondContact CG2-OG1 3.46Å; T707-T709 PolarHBondContact O-N 2.92Å; T707-T709 PolarHBondContact O-OG1 2.96Å; T709-I711 HydrophobicContact CG2-CG1 3.88Å; T709-I711 PolarHBondContact O-N 2.93Å
710	T	27.1	Very low	41.5	Very low	116 Å²	116	95.4 Å²	95.4	71%	0.712	53%	0.534	S	S	*	.			trans	-68.8	82.1	166.8	45.6	0	0	0	0	109	T708 Y712	T708-T710 PolarHBondContact O-N 2.89Å; T710-Y712 PolarHBondContact O-N 2.9Å
711	I	27.2	Very low	44.9	Very low	111 Å²	111	89.8 Å²	89.8	57%	0.569	50%	0.503	S	S	*	.			trans	-62.7	128.4	174.2	-60.9	170.7	0	0	0	107.9	T709 V713	T709-I711 HydrophobicContact CG2-CG1 3.88Å; T709-I711 PolarHBondContact O-N 2.93Å; I711-V713 VanDerWaalsContact C-N 3.28Å; I711-V713 HydrophobicContact CB-CG2 4.09Å; I711-V713 HydrophobicContact CG2-CG2 3.83Å; I711-V713 PolarHBondContact O-N 2.91Å
712	Y	28.7	Very low	48.4	Very low	204 Å²	204	84.2 Å²	84.2	80%	0.8	47%	0.469	S	S	*	.			trans	-72.1	86.9	165.6	-88.3	-96	0	0	0	108.7	T710 G714	T710-Y712 PolarHBondContact O-N 2.9Å; Y712-G714 PolarHBondContact O-N 2.86Å
713	V	39.1	Very low	51.7	Low	45 Å²	45	80.8 Å²	80.8	27%	0.273	44%	0.443	S	S	.	.			trans	-74.6	73.1	-179	-173.4	0	0	0	0	109.9	I711 R715 V716 L867	I711-V713 VanDerWaalsContact C-N 3.28Å; I711-V713 HydrophobicContact CB-CG2 4.09Å; I711-V713 HydrophobicContact CG2-CG2 3.83Å; I711-V713 PolarHBondContact O-N 2.91Å; V713-R715 WeakPolarHBondContact CG1-O 3.38Å; V713-R715 PolarHBondContact O-N 2.93Å; V713-V716 HydrophobicContact CG1-CG2 3.93Å; V713-L867 HydrophobicContact CB-CD1 3.91Å; V713-L867 HydrophobicContact CB-CG 4.45Å; V713-L867 HydrophobicContact CG1-CD1 4Å; V713-L867 WeakPolarHBondContact O-CD2 3.4Å; V713-L867 WeakPolarHBondContact O-CG 3.45Å
714	G	45.7	Very low	55	Low	53 Å²	53	75 Å²	75	55%	0.546	41%	0.408	S	S	.	.	S	Bend	trans	-67.6	-16.6	180	0	0	0	0	0	114.5	Y712	Y712-G714 PolarHBondContact O-N 2.86Å
715	R	54.7	Low	58.2	Low	164 Å²	164	67.9 Å²	67.9	62%	0.619	38%	0.375	S	S	*	.	S	Bend	trans	-142.7	145	171.3	-65.6	-174.5	177.9	-165.9	-3	109.1	V713	V713-R715 WeakPolarHBondContact CG1-O 3.38Å; V713-R715 PolarHBondContact O-N 2.93Å
716	V	65.3	Low	61.5	Low	2 Å²	2	63 Å²	63	1%	0.012	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	122.9	-177.6	178.8	0	0	0	0	109.9	V713 T817 Q822 I859 L867	V713-V716 HydrophobicContact CG1-CG2 3.93Å; V716-T817 PolarHBondContact N-O 3.25Å; V716-T817 WeakPolarHBondContact O-CA 3.27Å; V716-T817 PolarHBondContact O-N 3.13Å; V716-T817 VanDerWaalsContact O-O 3.04Å; V716-T817 PolarHBondContact O-OG1 2.95Å; V716-Q822 HydrophobicContact CG1-CG 4.18Å; V716-I859 HydrophobicContact CG1-CD1 3.56Å; V716-I859 HydrophobicContact CG1-CG1 4.48Å; V716-I859 HydrophobicContact CG2-CD1 4.43Å; V716-L867 HydrophobicContact CG2-CD1 3.94Å; V716-L867 HydrophobicContact CG2-CD2 4.18Å
717	S	76.1	Confident	64.5	Low	44 Å²	44	58.9 Å²	58.9	31%	0.308	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	128.6	170.2	177.6	0	0	0	0	110.8	E814 L815	S717-E814 VanDerWaalsContact CB-OE1 3.3Å; S717-E814 WeakPolarHBondContact CB-OE1 3.42Å; S717-E814 VanDerWaalsContact OG-CD 3.27Å; S717-E814 WeakPolarHBondContact OG-CG 3.14Å; S717-E814 PolarHBondContact OG-OE1 2.98Å; S717-L815 WeakPolarHBondContact CA-O 3.32Å
718	T	81.8	Confident	67.3	Low	0 Å²	0	55.2 Å²	55.2	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	126.6	166.1	-52.2	0	0	0	0	108.9	F720 L815 T817 Q822 S856	T718-F720 HydrophobicContact CG2-CE2 3.55Å; T718-F720 HydrophobicContact CG2-CZ 3.57Å; T718-L815 PolarHBondContact N-O 2.96Å; T718-L815 PolarHBondContact O-N 3.27Å; T718-T817 PolarHBondContact OG1-OG1 2.82Å; T718-Q822 HydrophobicContact CG2-CB 4.35Å; T718-Q822 WeakPolarHBondContact OG1-CB 3.39Å; T718-Q822 WeakPolarHBondContact OG1-CG 3.44Å; T718-S856 WeakPolarHBondContact CG2-OG 3.4Å
719	T	89.6	Confident	69.6	Low	28 Å²	28	53.9 Å²	53.9	17%	0.172	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	136	-169.9	-27.8	0	0	0	0	111.9	Q812 I813 E814 I855 S856	T719-Q812 HydrophobicContact CG2-CB 4.39Å; T719-I813 WeakPolarHBondContact CA-O 3.34Å; T719-E814 HydrophobicContact CG2-CB 4.46Å; T719-E814 HydrophobicContact CG2-CG 4.46Å; T719-I855 HydrophobicContact CG2-CD1 4.06Å; T719-I855 HydrophobicContact CG2-CG1 4.28Å; T719-I855 VanDerWaalsContact O-CG1 3.28Å; T719-I855 WeakPolarHBondContact O-CG1 3.25Å; T719-I855 PolarHBondContact O-N 2.85Å; T719-S856 PolarHBondContact N-OG 2.88Å; T719-S856 PolarHBondContact O-N 2.95Å; T719-S856 PolarHBondContact O-OG 3.12Å
720	F	92	Very high	71.9	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	135.8	-178.7	-56.5	-94.6	0	0	0	110.8	T718 Q812 I813 L815 L823 F828 T853 R854	T718-F720 HydrophobicContact CG2-CE2 3.55Å; T718-F720 HydrophobicContact CG2-CZ 3.57Å; F720-Q812 CarbonylContact O-C 3.5Å; F720-Q812 VanDerWaalsContact O-CA 3.29Å; F720-Q812 WeakPolarHBondContact O-CA 3.35Å; F720-I813 PolarHBondContact N-O 3.47Å; F720-I813 PolarHBondContact O-N 3.42Å; F720-L815 HydrophobicContact CD2-CD1 4.4Å; F720-L815 HydrophobicContact CE2-CD1 3.84Å; F720-L815 HydrophobicContact CE2-CG 4.27Å; F720-L823 HydrophobicContact CZ-CB 3.89Å; F720-L823 WeakPolarHBondContact CZ-O 3.5Å; F720-F828 HydrophobicContact CB-CD1 3.84Å; F720-F828 HydrophobicContact CB-CE1 3.63Å; F720-F828 HydrophobicContact CB-CG 4.49Å; F720-F828 HydrophobicContact CB-CZ 4.13Å; F720-F828 HydrophobicContact CD1-CB 3.84Å; F720-F828 AromaticContact CD1-CD1 3.49Å; F720-F828 HydrophobicContact CD1-CD1 3.49Å; F720-F828 VanDerWaalsContact CD1-CD1 3.49Å; F720-F828 HydrophobicContact CD1-CD2 4.46Å; F720-F828 HydrophobicContact CD1-CE1 4.2Å; F720-F828 AromaticContact CD1-CG 3.65Å; F720-F828 HydrophobicContact CD1-CG 3.65Å; F720-F828 HydrophobicContact CD2-CD1 4.11Å; F720-F828 AromaticContact CD2-CD2 3.89Å; F720-F828 HydrophobicContact CD2-CD2 3.89Å; F720-F828 HydrophobicContact CD2-CE1 4.3Å; F720-F828 HydrophobicContact CD2-CE2 4.08Å; F720-F828 AromaticContact CD2-CG 3.91Å; F720-F828 HydrophobicContact CD2-CG 3.91Å; F720-F828 HydrophobicContact CD2-CZ 4.29Å; F720-F828 HydrophobicContact CE1-CB 3.43Å; F720-F828 VanDerWaalsContact CE1-CB 3.43Å; F720-F828 HydrophobicContact CE1-CD1 4.03Å; F720-F828 HydrophobicContact CE1-CD2 4.47Å; F720-F828 AromaticContact CE1-CG 3.71Å; F720-F828 HydrophobicContact CE1-CG 3.71Å; F720-F828 HydrophobicContact CE2-CB 4.25Å; F720-F828 AromaticContact CE2-CD2 3.92Å; F720-F828 HydrophobicContact CE2-CD2 3.92Å; F720-F828 HydrophobicContact CE2-CE2 4.48Å; F720-F828 AromaticContact CE2-CG 3.98Å; F720-F828 HydrophobicContact CE2-CG 3.98Å; F720-F828 HydrophobicContact CG-CB 4.4Å; F720-F828 AromaticContact CG-CD1 3.53Å; F720-F828 HydrophobicContact CG-CD1 3.53Å; F720-F828 HydrophobicContact CG-CD2 4.18Å; F720-F828 AromaticContact CG-CE1 3.8Å; F720-F828 HydrophobicContact CG-CE1 3.8Å; F720-F828 HydrophobicContact CG-CE2 4.4Å; F720-F828 AromaticContact CG-CG 3.75Å; F720-F828 HydrophobicContact CG-CG 3.75Å; F720-F828 HydrophobicContact CG-CZ 4.23Å; F720-F828 HydrophobicContact CZ-CB 3.66Å; F720-F828 HydrophobicContact CZ-CD2 4.21Å; F720-F828 AromaticContact CZ-CG 3.88Å; F720-F828 HydrophobicContact CZ-CG 3.88Å; F720-T853 CarbonylContact C-O 3.55Å; F720-T853 VanDerWaalsContact CA-O 3.3Å; F720-T853 WeakPolarHBondContact CA-O 3.28Å; F720-R854 HydrophobicContact CD1-CB 3.8Å; F720-R854 HydrophobicContact CD1-CG 4.05Å; F720-R854 HydrophobicContact CE1-CB 3.79Å; F720-R854 HydrophobicContact CE1-CG 3.77Å; F720-R854 HydrophobicContact CZ-CG 4.35Å
721	Q	94.7	Very high	74.2	Confident	36 Å²	36	53.2 Å²	53.2	17%	0.168	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	136.9	163	-173.4	174.6	48.6	0	0	108.8	K723 D810 A811 S852 T853 I855	Q721-K723 VanDerWaalsContact OE1-CE 3.29Å; Q721-D810 PolarHBondContact NE2-OD1 3.2Å; Q721-D810 PolarHBondContact NE2-OD2 2.9Å; Q721-A811 CarbonylContact C-O 3.52Å; Q721-A811 WeakPolarHBondContact CA-O 3.31Å; Q721-S852 CarbonylContact O-C 3.58Å; Q721-S852 VanDerWaalsContact O-CA 3.25Å; Q721-S852 WeakPolarHBondContact O-CA 3.03Å; Q721-T853 PolarHBondContact N-O 3.08Å; Q721-T853 PolarHBondContact O-N 3.01Å; Q721-I855 HydrophobicContact CB-CD1 4.23Å; Q721-I855 HydrophobicContact CB-CG2 4.4Å
722	V	95.5	Very high	76.5	Confident	0 Å²	0	50 Å²	50	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	125.6	175.1	-174.7	0	0	0	0	110.2	Y756 L760 A811 I813 F828 L832 I850 E851	V722-Y756 PolarHBondContact O-OH 2.89Å; V722-L760 HydrophobicContact CB-CD1 4.01Å; V722-L760 HydrophobicContact CG1-CD1 3.86Å; V722-L760 HydrophobicContact CG1-CD2 3.82Å; V722-A811 PolarHBondContact N-O 2.94Å; V722-A811 PolarHBondContact O-N 3.2Å; V722-I813 HydrophobicContact CG2-CB 4.5Å; V722-I813 HydrophobicContact CG2-CG1 3.74Å; V722-F828 HydrophobicContact CG2-CE1 3.73Å; V722-F828 HydrophobicContact CG2-CZ 4.1Å; V722-L832 HydrophobicContact CG1-CD2 3.94Å; V722-L832 HydrophobicContact CG2-CD2 4.32Å; V722-I850 HydrophobicContact CG1-CG2 4.07Å; V722-E851 WeakPolarHBondContact CA-O 3.38Å
723	K	95	Very high	78.9	Confident	55 Å²	55	46.6 Å²	46.6	24%	0.239	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	134.8	176.9	-63.3	172.6	-169.6	153.2	0	110.1	Q721 G809 D810 I850 E851	Q721-K723 VanDerWaalsContact OE1-CE 3.29Å; K723-G809 VanDerWaalsContact CA-O 3.26Å; K723-G809 WeakPolarHBondContact CA-O 3.34Å; K723-D810 HydrophobicContact CG-CB 4.49Å; K723-I850 WeakPolarHBondContact O-CA 3.42Å; K723-E851 PolarHBondContact N-O 3.02Å; K723-E851 PolarHBondContact O-N 2.74Å
724	A	93.7	Very high	81.1	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.2	146.7	176.2	0	0	0	0	0	111.2	Y756 Q808 G809 L847 I850	A724-Y756 HydrophobicContact CB-CE2 4.07Å; A724-Y756 PolarHBondContact N-OH 2.94Å; A724-Q808 CarbonylContact O-C 3.59Å; A724-Q808 WeakPolarHBondContact O-CA 3.41Å; A724-G809 PolarHBondContact N-O 2.95Å; A724-G809 PolarHBondContact O-N 3.15Å; A724-L847 HydrophobicContact CB-CB 4.12Å; A724-L847 HydrophobicContact CB-CD1 4.37Å; A724-L847 HydrophobicContact CB-CD2 4.25Å; A724-L847 HydrophobicContact CB-CG 4.48Å; A724-I850 HydrophobicContact CB-CB 4.38Å; A724-I850 HydrophobicContact CB-CG1 3.91Å
725	I	91.7	Very high	83.1	Confident	26 Å²	26	44.8 Å²	44.8	13%	0.133	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	134.6	173.6	-62.8	157.8	0	0	0	108.7	Y727 L787 A806 Q808 L847 S848	I725-Y727 HydrophobicContact CB-CE2 4.45Å; I725-Y727 HydrophobicContact CG2-CD2 4.11Å; I725-Y727 HydrophobicContact CG2-CE2 3.73Å; I725-L787 HydrophobicContact CD1-CD2 3.8Å; I725-L787 HydrophobicContact CG2-CD1 4.07Å; I725-A806 HydrophobicContact CG2-CB 4.07Å; I725-Q808 HydrophobicContact CG1-CG 4.43Å; I725-L847 CarbonylContact O-C 3.58Å; I725-L847 WeakPolarHBondContact O-CA 3.39Å; I725-S848 WeakPolarHBondContact CB-O 3.41Å; I725-S848 PolarHBondContact N-O 3.04Å; I725-S848 PolarHBondContact O-N 3.16Å
726	I	92.2	Very high	84.7	Confident	2 Å²	2	41.5 Å²	41.5	1%	0.01	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	132.4	-176.4	-45.1	179.9	0	0	0	110.4	Y734 V735 L752 Y756 F782 V807 N845 L847	I726-Y734 WeakPolarHBondContact O-CA 3.4Å; I726-V735 HydrophobicContact CB-CB 4.41Å; I726-V735 HydrophobicContact CB-CG2 4.11Å; I726-V735 HydrophobicContact CG2-CG2 3.72Å; I726-V735 PolarHBondContact O-N 3.01Å; I726-L752 HydrophobicContact CD1-CD1 4.22Å; I726-L752 HydrophobicContact CD1-CD2 4.22Å; I726-L752 HydrophobicContact CD1-CG 4.14Å; I726-L752 HydrophobicContact CG2-CD1 4.37Å; I726-Y756 HydrophobicContact CD1-CD2 3.53Å; I726-Y756 HydrophobicContact CD1-CE2 4.21Å; I726-Y756 HydrophobicContact CD1-CG 4.28Å; I726-Y756 HydrophobicContact CG1-CD2 3.8Å; I726-Y756 HydrophobicContact CG1-CE2 4.11Å; I726-F782 HydrophobicContact CD1-CD1 4.31Å; I726-F782 HydrophobicContact CD1-CE1 3.71Å; I726-V807 HydrophobicContact CD1-CG1 3.98Å; I726-V807 PolarHBondContact N-O 2.98Å; I726-N845 HydrophobicContact CG2-CB 3.87Å; I726-L847 HydrophobicContact CG1-CD2 4.21Å
727	Y	89.1	Confident	86	Confident	40 Å²	40	43.7 Å²	43.7	16%	0.157	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	144.7	172.8	-74.2	-116.7	0	0	0	110.3	I725 K733 Y734 N845 Y846 S848	I725-Y727 HydrophobicContact CB-CE2 4.45Å; I725-Y727 HydrophobicContact CG2-CD2 4.11Å; I725-Y727 HydrophobicContact CG2-CE2 3.73Å; Y727-K733 CarbonylContact C-O 3.44Å; Y727-K733 VanDerWaalsContact CA-O 3.29Å; Y727-K733 WeakPolarHBondContact CA-O 3.49Å; Y727-K733 VanDerWaalsContact CD1-C 3.46Å; Y727-Y734 HydrophobicContact CD1-CD1 4.07Å; Y727-Y734 HydrophobicContact CD1-CE1 4.42Å; Y727-Y734 AromaticContact CE1-CD1 3.38Å; Y727-Y734 HydrophobicContact CE1-CD1 3.38Å; Y727-Y734 AromaticContact CE1-CE1 3.46Å; Y727-Y734 HydrophobicContact CE1-CE1 3.46Å; Y727-Y734 VanDerWaalsContact CE1-CE1 3.46Å; Y727-Y734 HydrophobicContact CE1-CG 4.33Å; Y727-Y734 HydrophobicContact CE2-CD1 4.03Å; Y727-Y734 AromaticContact CZ-CD1 3.37Å; Y727-Y734 AromaticContact CZ-CE1 3.62Å; Y727-Y734 WeakPolarHBondContact OH-CD1 3.37Å; Y727-Y734 WeakPolarHBondContact OH-CE1 3.47Å; Y727-N845 CarbonylContact O-C 3.59Å; Y727-N845 WeakPolarHBondContact O-CA 3.44Å; Y727-N845 WeakPolarHBondContact O-CB 3.39Å; Y727-N845 PolarHBondContact O-OD1 2.88Å; Y727-Y846 VanDerWaalsContact CB-CE1 3.41Å; Y727-Y846 HydrophobicContact CD1-CE1 4.3Å; Y727-Y846 AromaticContact CD1-CE2 3.9Å; Y727-Y846 HydrophobicContact CD1-CE2 3.9Å; Y727-Y846 AromaticContact CD1-CZ 3.55Å; Y727-Y846 WeakPolarHBondContact CD1-OH 3.42Å; Y727-Y846 HydrophobicContact CD2-CE2 4.07Å; Y727-Y846 HydrophobicContact CG-CD2 4.24Å; Y727-Y846 HydrophobicContact CG-CE1 4.17Å; Y727-Y846 AromaticContact CG-CE2 3.61Å; Y727-Y846 HydrophobicContact CG-CE2 3.61Å; Y727-Y846 AromaticContact CG-CZ 3.58Å; Y727-Y846 PolarHBondContact N-O 3.06Å; Y727-Y846 PolarHBondContact O-N 3.22Å; Y727-S848 VanDerWaalsContact CE2-CB 3.47Å
728	A	83.1	Confident	86.7	Confident	17 Å²	17	43.5 Å²	43.5	14%	0.14	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	115.1	173.4	0	0	0	0	0	110.2	S730 T731 G732 K733 V735	A728-S730 PolarHBondContact O-N 2.97Å; A728-T731 PolarHBondContact O-N 3.24Å; A728-T731 PolarHBondContact O-OG1 2.87Å; A728-G732 PolarHBondContact O-N 2.62Å; A728-K733 PolarHBondContact N-O 2.92Å; A728-V735 HydrophobicContact CB-CG2 4.27Å
729	F	75.4	Confident	87.2	Confident	96 Å²	96	49.2 Å²	49.2	42%	0.421	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58	-37.2	-176.9	-168.1	-91.3	0	0	0	112.2	T731 G732 L841 S842 G844 Y846	F729-T731 PolarHBondContact O-N 3.16Å; F729-T731 VanDerWaalsContact O-N 3.09Å; F729-G732 PolarHBondContact O-N 2.86Å; F729-L841 WeakPolarHBondContact CE2-O 3.3Å; F729-L841 WeakPolarHBondContact CZ-O 3.45Å; F729-S842 WeakPolarHBondContact CE1-O 3.25Å; F729-G844 WeakPolarHBondContact CB-O 3.38Å; F729-G844 PolarHBondContact N-O 2.75Å; F729-Y846 HydrophobicContact CB-CD1 4.35Å; F729-Y846 HydrophobicContact CD2-CD1 4.13Å
730	S	73.4	Confident	87.3	Confident	109 Å²	109	51.9 Å²	51.9	76%	0.762	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-12.8	177.7	57.1	0	0	0	0	115.5	A728	A728-S730 PolarHBondContact O-N 2.97Å
731	T	75.5	Confident	87.3	Confident	85 Å²	85	53.7 Å²	53.7	52%	0.521	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-127.4	-13.4	-179.9	65.2	0	0	0	0	114.1	A728 F729 K733	A728-T731 PolarHBondContact O-N 3.24Å; A728-T731 PolarHBondContact O-OG1 2.87Å; F729-T731 PolarHBondContact O-N 3.16Å; F729-T731 VanDerWaalsContact O-N 3.09Å; T731-K733 PolarHBondContact O-N 3.41Å; T731-K733 PolarHBondContact OG1-N 3.46Å
732	G	74.2	Confident	87.1	Confident	44 Å²	44	55.4 Å²	55.4	45%	0.454	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.7	10.1	-170.6	0	0	0	0	0	114.6	A728 F729	A728-G732 PolarHBondContact O-N 2.62Å; F729-G732 PolarHBondContact O-N 2.86Å
733	K	80	Confident	86.9	Confident	133 Å²	133	58.8 Å²	58.8	58%	0.578	33%	0.331	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.9	159.6	-175.4	-64.5	-179.2	-178.5	-176	0	111.9	Y727 A728 T731	Y727-K733 CarbonylContact C-O 3.44Å; Y727-K733 VanDerWaalsContact CA-O 3.29Å; Y727-K733 WeakPolarHBondContact CA-O 3.49Å; Y727-K733 VanDerWaalsContact CD1-C 3.46Å; A728-K733 PolarHBondContact N-O 2.92Å; T731-K733 PolarHBondContact O-N 3.41Å; T731-K733 PolarHBondContact OG1-N 3.46Å
734	Y	85.6	Confident	86.7	Confident	43 Å²	43	61.8 Å²	61.8	17%	0.169	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-51.6	143.2	167.1	-8.5	-85.5	0	0	0	110.1	I726 Y727 T736 L787 L789 T804 A806	I726-Y734 WeakPolarHBondContact O-CA 3.4Å; Y727-Y734 HydrophobicContact CD1-CD1 4.07Å; Y727-Y734 HydrophobicContact CD1-CE1 4.42Å; Y727-Y734 AromaticContact CE1-CD1 3.38Å; Y727-Y734 HydrophobicContact CE1-CD1 3.38Å; Y727-Y734 AromaticContact CE1-CE1 3.46Å; Y727-Y734 HydrophobicContact CE1-CE1 3.46Å; Y727-Y734 VanDerWaalsContact CE1-CE1 3.46Å; Y727-Y734 HydrophobicContact CE1-CG 4.33Å; Y727-Y734 HydrophobicContact CE2-CD1 4.03Å; Y727-Y734 AromaticContact CZ-CD1 3.37Å; Y727-Y734 AromaticContact CZ-CE1 3.62Å; Y727-Y734 WeakPolarHBondContact OH-CD1 3.37Å; Y727-Y734 WeakPolarHBondContact OH-CE1 3.47Å; Y734-T736 PolarHBondContact O-N 2.77Å; Y734-T736 VanDerWaalsContact O-N 3.15Å; Y734-L787 HydrophobicContact CD1-CD1 3.47Å; Y734-L787 VanDerWaalsContact CD1-CD1 3.47Å; Y734-L787 HydrophobicContact CE1-CD1 4.09Å; Y734-L787 HydrophobicContact CG-CD1 4Å; Y734-L789 HydrophobicContact CE1-CD2 4.27Å; Y734-L789 HydrophobicContact CE2-CD1 3.89Å; Y734-L789 VanDerWaalsContact OH-CD1 3.27Å; Y734-L789 WeakPolarHBondContact OH-CD1 3.23Å; Y734-L789 WeakPolarHBondContact OH-CD2 3.41Å; Y734-T804 HydrophobicContact CD2-CG2 3.7Å; Y734-T804 HydrophobicContact CE2-CG2 4.06Å; Y734-A806 HydrophobicContact CG-CB 4.25Å
735	V	87	Confident	86.6	Confident	17 Å²	17	66.5 Å²	66.5	10%	0.103	37%	0.373	C	S	.	.			trans	-66	112.6	164.3	178.5	0	0	0	0	106.9	I726 A728 Y741 L752 A806 V807	I726-V735 HydrophobicContact CB-CB 4.41Å; I726-V735 HydrophobicContact CB-CG2 4.11Å; I726-V735 HydrophobicContact CG2-CG2 3.72Å; I726-V735 PolarHBondContact O-N 3.01Å; A728-V735 HydrophobicContact CB-CG2 4.27Å; V735-Y741 HydrophobicContact CG1-CE2 4.13Å; V735-L752 HydrophobicContact CG1-CD2 4.2Å; V735-A806 CarbonylContact O-C 3.59Å; V735-A806 WeakPolarHBondContact O-CA 3.41Å; V735-V807 HydrophobicContact CB-CB 4.38Å; V735-V807 HydrophobicContact CB-CG2 4.36Å; V735-V807 HydrophobicContact CG1-CB 4.36Å; V735-V807 HydrophobicContact CG1-CG2 3.91Å; V735-V807 PolarHBondContact O-N 3.16Å
736	T	88.4	Confident	86.6	Confident	94 Å²	94	66 Å²	66	58%	0.577	37%	0.372	S	S	*	.	B	Isolated β-bridge	trans	-63.5	142.9	-179.6	-11.1	0	0	0	0	110.6	Y734 S738 T804 D805	Y734-T736 PolarHBondContact O-N 2.77Å; Y734-T736 VanDerWaalsContact O-N 3.15Å; T736-S738 PolarHBondContact O-N 2.78Å; T736-T804 HydrophobicContact CG2-CG2 4.49Å; T736-D805 CarbonylContact C-O 3.6Å; T736-D805 WeakPolarHBondContact CA-O 3.32Å
737	W	91.7	Very high	86.6	Confident	48 Å²	48	70.5 Å²	70.5	18%	0.182	40%	0.403	C	S	.	.			trans	-63.5	127.1	175.8	-178.1	-93.2	0	0	0	112.2	N739 A742 F782 I783 R784 D805 V807	W737-N739 PolarHBondContact NE1-OD1 2.92Å; W737-A742 HydrophobicContact CZ2-CB 4.3Å; W737-F782 HydrophobicContact CH2-CB 4.3Å; W737-F782 HydrophobicContact CZ3-CB 3.91Å; W737-I783 VanDerWaalsContact CZ3-C 3.44Å; W737-R784 HydrophobicContact CB-CG 4.11Å; W737-R784 HydrophobicContact CD2-CB 3.61Å; W737-R784 HydrophobicContact CD2-CG 3.84Å; W737-R784 VanDerWaalsContact CE3-CA 3.49Å; W737-R784 HydrophobicContact CE3-CB 3.67Å; W737-R784 HydrophobicContact CE3-CG 4.25Å; W737-R784 HydrophobicContact CG-CB 4.09Å; W737-R784 HydrophobicContact CG-CG 3.73Å; W737-R784 HydrophobicContact CH2-CB 4.38Å; W737-R784 HydrophobicContact CZ2-CB 4.33Å; W737-R784 HydrophobicContact CZ3-CB 4.06Å; W737-R784 VanDerWaalsContact CZ3-N 3.35Å; W737-D805 HydrophobicContact CB-CB 3.92Å; W737-D805 PolarHBondContact N-O 2.89Å; W737-V807 HydrophobicContact CE3-CG2 4.07Å
738	S	91.3	Very high	86.7	Confident	41 Å²	41	69.9 Å²	69.9	29%	0.287	41%	0.407	S	S	.	.			trans	-115.8	151.1	160.8	-172.8	0	0	0	0	110.1	T736 D740 Y741	T736-S738 PolarHBondContact O-N 2.78Å; S738-D740 WeakPolarHBondContact CB-OD2 3.29Å; S738-D740 PolarHBondContact O-N 3.08Å; S738-D740 PolarHBondContact OG-N 3.16Å; S738-D740 PolarHBondContact OG-OD2 3.36Å; S738-Y741 WeakPolarHBondContact O-CB 3.42Å; S738-Y741 WeakPolarHBondContact O-CD2 3.48Å; S738-Y741 PolarHBondContact O-N 3.4Å; S738-Y741 VanDerWaalsContact O-N 3.13Å
739	N	91.6	Very high	87.2	Confident	120 Å²	120	69.8 Å²	69.8	64%	0.642	40%	0.402	S	S	*	.	G	3₁₀ helix	trans	-64.2	-20.8	173	-69	-18.3	0	0	0	112.5	W737 Y741 A742	W737-N739 PolarHBondContact NE1-OD1 2.92Å; N739-Y741 PolarHBondContact O-N 2.81Å; N739-Y741 VanDerWaalsContact O-N 3.14Å; N739-A742 WeakPolarHBondContact O-CB 3.24Å; N739-A742 PolarHBondContact O-N 2.91Å
740	D	92	Very high	87.9	Confident	83 Å²	83	70.4 Å²	70.4	44%	0.444	41%	0.405	S	S	.	.	G	3₁₀ helix	trans	-59.3	-24.4	173.4	-44.2	-56.4	0	0	0	112.4	S738 A742 D743 S746 A748	S738-D740 WeakPolarHBondContact CB-OD2 3.29Å; S738-D740 PolarHBondContact O-N 3.08Å; S738-D740 PolarHBondContact OG-N 3.16Å; S738-D740 PolarHBondContact OG-OD2 3.36Å; D740-A742 VanDerWaalsContact C-N 3.3Å; D740-D743 PolarHBondContact O-N 3.14Å; D740-S746 PolarHBondContact O-OG 3.26Å; D740-A748 HydrophobicContact CB-CB 3.75Å
741	Y	92.1	Very high	88.8	Confident	39 Å²	39	69.5 Å²	69.5	15%	0.153	40%	0.395	C	S	.	.	G	3₁₀ helix	trans	-81.5	-5	176.2	-54.7	-47.7	0	0	0	113.8	V735 S738 N739 A748 Y749 L752 F782 V807	V735-Y741 HydrophobicContact CG1-CE2 4.13Å; S738-Y741 WeakPolarHBondContact O-CB 3.42Å; S738-Y741 WeakPolarHBondContact O-CD2 3.48Å; S738-Y741 PolarHBondContact O-N 3.4Å; S738-Y741 VanDerWaalsContact O-N 3.13Å; N739-Y741 PolarHBondContact O-N 2.81Å; N739-Y741 VanDerWaalsContact O-N 3.14Å; Y741-A748 HydrophobicContact CD1-CB 4.26Å; Y741-A748 HydrophobicContact CE1-CB 3.82Å; Y741-Y749 WeakPolarHBondContact O-CD2 3.46Å; Y741-L752 HydrophobicContact CD1-CD2 3.84Å; Y741-L752 HydrophobicContact CE1-CB 4.13Å; Y741-L752 HydrophobicContact CE1-CD2 3.49Å; Y741-L752 VanDerWaalsContact CE1-CD2 3.49Å; Y741-L752 HydrophobicContact CE1-CG 4.44Å; Y741-L752 HydrophobicContact CE2-CD2 4.28Å; Y741-L752 HydrophobicContact CG-CD2 4.37Å; Y741-F782 HydrophobicContact CD1-CD2 4.37Å; Y741-F782 HydrophobicContact CD1-CE2 4.47Å; Y741-F782 HydrophobicContact CG-CD2 4.4Å; Y741-V807 HydrophobicContact CD2-CG2 3.46Å; Y741-V807 VanDerWaalsContact CD2-CG2 3.46Å; Y741-V807 HydrophobicContact CE2-CG2 3.62Å; Y741-V807 HydrophobicContact CG-CG2 4.33Å
742	A	90.6	Very high	89.6	Confident	72 Å²	72	66 Å²	66	60%	0.595	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.7	-30.6	166.1	0	0	0	0	0	112.1	W737 N739 D740	W737-A742 HydrophobicContact CZ2-CB 4.3Å; N739-A742 WeakPolarHBondContact O-CB 3.24Å; N739-A742 PolarHBondContact O-N 2.91Å; D740-A742 VanDerWaalsContact C-N 3.3Å
743	D	90.6	Very high	90.5	Very high	70 Å²	70	65 Å²	65	37%	0.374	36%	0.359	S	S	.	.			trans	-87.4	110.7	179	171.8	25	0	0	0	111.8	D740 T745 S746 Y749	D740-D743 PolarHBondContact O-N 3.14Å; D743-T745 VanDerWaalsContact CG-OG1 3.26Å; D743-T745 PolarHBondContact O-N 3.33Å; D743-T745 WeakPolarHBondContact OD1-CA 3.36Å; D743-T745 WeakPolarHBondContact OD1-CB 3.36Å; D743-T745 PolarHBondContact OD1-N 3.15Å; D743-T745 PolarHBondContact OD1-OG1 2.85Å; D743-T745 PolarHBondContact OD2-OG1 2.95Å; D743-S746 WeakPolarHBondContact O-CB 3.39Å; D743-S746 PolarHBondContact O-N 2.81Å; D743-S746 PolarHBondContact O-OG 3.4Å; D743-S746 PolarHBondContact OD2-N 2.9Å; D743-Y749 WeakPolarHBondContact O-CB 3.35Å
744	K	91	Very high	91	Very high	118 Å²	118	63.3 Å²	63.3	51%	0.513	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64	-18.2	176.9	-61.9	-164.2	170.6	-169.4	0	114.1	Y749 N780	K744-Y749 HydrophobicContact CB-CD1 4.38Å; K744-Y749 HydrophobicContact CB-CE1 4.25Å; K744-Y749 HydrophobicContact CG-CD2 4.42Å; K744-Y749 HydrophobicContact CG-CE1 4.11Å; K744-Y749 HydrophobicContact CG-CE2 3.91Å; K744-N780 VanDerWaalsContact CE-O 3.24Å; K744-N780 WeakPolarHBondContact CE-O 3.27Å; K744-N780 PolarHBondContact NZ-O 3.48Å
745	T	91.3	Very high	91.3	Very high	99 Å²	99	64.2 Å²	64.2	61%	0.607	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.4	-21.2	179.2	79.3	0	0	0	0	112.7	D743 K750	D743-T745 VanDerWaalsContact CG-OG1 3.26Å; D743-T745 PolarHBondContact O-N 3.33Å; D743-T745 WeakPolarHBondContact OD1-CA 3.36Å; D743-T745 WeakPolarHBondContact OD1-CB 3.36Å; D743-T745 PolarHBondContact OD1-N 3.15Å; D743-T745 PolarHBondContact OD1-OG1 2.85Å; D743-T745 PolarHBondContact OD2-OG1 2.95Å; T745-K750 VanDerWaalsContact O-CE 3.27Å; T745-K750 WeakPolarHBondContact O-CE 3.38Å; T745-K750 PolarHBondContact O-NZ 3.31Å
746	S	93.5	Very high	91.6	Very high	17 Å²	17	63.5 Å²	63.5	12%	0.119	36%	0.363	C	S	.	.	S	Bend	trans	-64.1	150.5	-176.5	88.9	0	0	0	0	113.1	D740 D743 A748 Y749 K750	D740-S746 PolarHBondContact O-OG 3.26Å; D743-S746 WeakPolarHBondContact O-CB 3.39Å; D743-S746 PolarHBondContact O-N 2.81Å; D743-S746 PolarHBondContact O-OG 3.4Å; D743-S746 PolarHBondContact OD2-N 2.9Å; S746-A748 VanDerWaalsContact C-N 3.29Å; S746-A748 PolarHBondContact O-N 3.28Å; S746-Y749 WeakPolarHBondContact OG-CB 3.35Å; S746-Y749 PolarHBondContact OG-N 2.81Å; S746-K750 WeakPolarHBondContact O-CD 3.49Å; S746-K750 WeakPolarHBondContact O-CG 3.48Å; S746-K750 PolarHBondContact O-N 3.25Å; S746-K750 VanDerWaalsContact O-N 3.15Å
747	S	92.1	Very high	91.8	Very high	95 Å²	95	59.7 Å²	59.7	66%	0.664	34%	0.34	S	S	*	.	H	α-helix	trans	-66.4	-32.5	174.3	54.9	0	0	0	0	112.3	T751	S747-T751 VanDerWaalsContact O-CB 3.31Å; S747-T751 WeakPolarHBondContact O-CB 3.47Å; S747-T751 PolarHBondContact O-N 3.47Å; S747-T751 PolarHBondContact O-OG1 2.84Å
748	A	89.5	Confident	91.8	Very high	28 Å²	28	59.9 Å²	59.9	23%	0.231	35%	0.349	C	S	.	.	H	α-helix	trans	-66.5	-45.8	177.3	0	0	0	0	0	111.7	D740 Y741 S746 L752	D740-A748 HydrophobicContact CB-CB 3.75Å; Y741-A748 HydrophobicContact CD1-CB 4.26Å; Y741-A748 HydrophobicContact CE1-CB 3.82Å; S746-A748 VanDerWaalsContact C-N 3.29Å; S746-A748 PolarHBondContact O-N 3.28Å; A748-L752 VanDerWaalsContact O-CB 3.26Å; A748-L752 WeakPolarHBondContact O-CB 3.38Å; A748-L752 PolarHBondContact O-N 3.23Å; A748-L752 VanDerWaalsContact O-N 3.08Å
749	Y	93.7	Very high	91.7	Very high	14 Å²	14	58.5 Å²	58.5	6%	0.055	34%	0.338	C	S	.	.	H	α-helix	trans	-58.9	-52.8	173.1	-177.4	-78.8	0	0	0	110.6	Y741 D743 K744 S746 L752 S753 L779 F782	Y741-Y749 WeakPolarHBondContact O-CD2 3.46Å; D743-Y749 WeakPolarHBondContact O-CB 3.35Å; K744-Y749 HydrophobicContact CB-CD1 4.38Å; K744-Y749 HydrophobicContact CB-CE1 4.25Å; K744-Y749 HydrophobicContact CG-CD2 4.42Å; K744-Y749 HydrophobicContact CG-CE1 4.11Å; K744-Y749 HydrophobicContact CG-CE2 3.91Å; S746-Y749 WeakPolarHBondContact OG-CB 3.35Å; S746-Y749 PolarHBondContact OG-N 2.81Å; Y749-L752 PolarHBondContact O-N 3.48Å; Y749-S753 WeakPolarHBondContact O-CB 3.49Å; Y749-S753 PolarHBondContact O-N 3.33Å; Y749-S753 PolarHBondContact O-OG 3.47Å; Y749-L779 HydrophobicContact CE1-CD2 4.17Å; Y749-L779 HydrophobicContact CE2-CD2 4.22Å; Y749-L779 PolarHBondContact OH-O 3.42Å; Y749-F782 AromaticContact CD2-CD2 3.64Å; Y749-F782 HydrophobicContact CD2-CD2 3.64Å; Y749-F782 AromaticContact CD2-CE2 3.93Å; Y749-F782 HydrophobicContact CD2-CE2 3.93Å; Y749-F782 AromaticContact CE2-CD2 3.73Å; Y749-F782 HydrophobicContact CE2-CD2 3.73Å; Y749-F782 HydrophobicContact CE2-CE2 4.11Å; Y749-F782 HydrophobicContact CG-CD2 4.39Å; Y749-F782 HydrophobicContact CG-CE2 4.24Å
750	K	92	Very high	91.8	Very high	109 Å²	109	52.8 Å²	52.8	47%	0.474	31%	0.308	S	S	.	.	H	α-helix	trans	-57.6	-56.2	-176.9	-72.4	165.4	178.5	164.6	0	111.2	T745 S746 L752 S753 T754	T745-K750 VanDerWaalsContact O-CE 3.27Å; T745-K750 WeakPolarHBondContact O-CE 3.38Å; T745-K750 PolarHBondContact O-NZ 3.31Å; S746-K750 WeakPolarHBondContact O-CD 3.49Å; S746-K750 WeakPolarHBondContact O-CG 3.48Å; S746-K750 PolarHBondContact O-N 3.25Å; S746-K750 VanDerWaalsContact O-N 3.15Å; K750-L752 VanDerWaalsContact C-N 3.34Å; K750-L752 PolarHBondContact O-N 2.94Å; K750-S753 PolarHBondContact O-N 2.9Å; K750-S753 VanDerWaalsContact O-N 3.15Å; K750-S753 PolarHBondContact O-OG 3.45Å; K750-T754 PolarHBondContact O-N 3.09Å; K750-T754 PolarHBondContact O-OG1 3.04Å; K750-T754 VanDerWaalsContact O-OG1 3.13Å
751	T	91.3	Very high	91.7	Very high	91 Å²	91	50.8 Å²	50.8	56%	0.558	30%	0.297	S	S	*	.	H	α-helix	trans	-58.5	-41.2	-179.8	-56	0	0	0	0	113.1	S747 N755	S747-T751 VanDerWaalsContact O-CB 3.31Å; S747-T751 WeakPolarHBondContact O-CB 3.47Å; S747-T751 PolarHBondContact O-N 3.47Å; S747-T751 PolarHBondContact O-OG1 2.84Å; T751-N755 PolarHBondContact O-N 3.19Å; T751-N755 PolarHBondContact O-ND2 3.05Å
752	L	91.8	Very high	91.6	Very high	12 Å²	12	53.6 Å²	53.6	6%	0.063	31%	0.312	C	S	.	.	H	α-helix	trans	-72.1	-35.9	178.6	-169.5	61.5	0	0	0	111.7	I726 V735 Y741 A748 Y749 K750 N755 Y756 F782 V807 N845	I726-L752 HydrophobicContact CD1-CD1 4.22Å; I726-L752 HydrophobicContact CD1-CD2 4.22Å; I726-L752 HydrophobicContact CD1-CG 4.14Å; I726-L752 HydrophobicContact CG2-CD1 4.37Å; V735-L752 HydrophobicContact CG1-CD2 4.2Å; Y741-L752 HydrophobicContact CD1-CD2 3.84Å; Y741-L752 HydrophobicContact CE1-CB 4.13Å; Y741-L752 HydrophobicContact CE1-CD2 3.49Å; Y741-L752 VanDerWaalsContact CE1-CD2 3.49Å; Y741-L752 HydrophobicContact CE1-CG 4.44Å; Y741-L752 HydrophobicContact CE2-CD2 4.28Å; Y741-L752 HydrophobicContact CG-CD2 4.37Å; A748-L752 VanDerWaalsContact O-CB 3.26Å; A748-L752 WeakPolarHBondContact O-CB 3.38Å; A748-L752 PolarHBondContact O-N 3.23Å; A748-L752 VanDerWaalsContact O-N 3.08Å; Y749-L752 PolarHBondContact O-N 3.48Å; K750-L752 VanDerWaalsContact C-N 3.34Å; K750-L752 PolarHBondContact O-N 2.94Å; L752-N755 PolarHBondContact O-N 3.45Å; L752-Y756 WeakPolarHBondContact O-CB 3.27Å; L752-Y756 PolarHBondContact O-N 3.29Å; L752-F782 HydrophobicContact CB-CE2 4.02Å; L752-F782 HydrophobicContact CB-CZ 3.74Å; L752-F782 HydrophobicContact CD2-CE1 4Å; L752-F782 HydrophobicContact CD2-CE2 4.05Å; L752-F782 HydrophobicContact CD2-CZ 3.73Å; L752-F782 HydrophobicContact CG-CE1 4.02Å; L752-F782 HydrophobicContact CG-CE2 4.14Å; L752-F782 HydrophobicContact CG-CZ 3.52Å; L752-V807 HydrophobicContact CD2-CG1 3.99Å; L752-V807 HydrophobicContact CD2-CG2 4.49Å; L752-N845 VanDerWaalsContact CD1-ND2 3.32Å; L752-N845 WeakPolarHBondContact CD1-ND2 3.22Å
753	S	93.2	Very high	91.5	Very high	22 Å²	22	50.2 Å²	50.2	15%	0.154	28%	0.283	C	S	.	.	H	α-helix	trans	-66	-44.5	178.4	72.8	0	0	0	0	112	Y749 K750 N755 Y756 C757	Y749-S753 WeakPolarHBondContact O-CB 3.49Å; Y749-S753 PolarHBondContact O-N 3.33Å; Y749-S753 PolarHBondContact O-OG 3.47Å; K750-S753 PolarHBondContact O-N 2.9Å; K750-S753 VanDerWaalsContact O-N 3.15Å; K750-S753 PolarHBondContact O-OG 3.45Å; S753-N755 PolarHBondContact O-N 2.04Å; S753-Y756 PolarHBondContact O-N 2.91Å; S753-C757 PolarHBondContact O-N 2.85Å
754	T	91.8	Very high	91.5	Very high	98 Å²	98	46.9 Å²	46.9	60%	0.601	27%	0.265	S	S	*	.	H	α-helix	trans	-61.6	-42.1	173.2	-51.5	0	0	0	0	111.5	K750 S758	K750-T754 PolarHBondContact O-N 3.09Å; K750-T754 PolarHBondContact O-OG1 3.04Å; K750-T754 VanDerWaalsContact O-OG1 3.13Å; T754-S758 WeakPolarHBondContact O-CB 3.43Å; T754-S758 PolarHBondContact O-N 2.89Å
755	N	90.5	Very high	91.2	Very high	62 Å²	62	44.5 Å²	44.5	33%	0.332	26%	0.258	S	S	.	.	H	α-helix	trans	-59.6	-53	173.6	-103.8	-90.2	0	0	0	111.8	T751 L752 S753 C757 S758 L759	T751-N755 PolarHBondContact O-N 3.19Å; T751-N755 PolarHBondContact O-ND2 3.05Å; L752-N755 PolarHBondContact O-N 3.45Å; S753-N755 PolarHBondContact O-N 2.04Å; N755-C757 PolarHBondContact O-N 2.85Å; N755-S758 PolarHBondContact O-N 2.94Å; N755-L759 WeakPolarHBondContact O-CB 3.34Å; N755-L759 PolarHBondContact O-N 2.92Å
756	Y	93	Very high	90.8	Very high	2 Å²	2	43 Å²	43	1%	0.008	25%	0.249	C	C	.	.	H	α-helix	trans	-58.8	-47.5	-177.7	-175.6	-95.8	0	0	0	112	V722 A724 I726 L752 S753 L760 L779 G809 A811 L847	V722-Y756 PolarHBondContact O-OH 2.89Å; A724-Y756 HydrophobicContact CB-CE2 4.07Å; A724-Y756 PolarHBondContact N-OH 2.94Å; I726-Y756 HydrophobicContact CD1-CD2 3.53Å; I726-Y756 HydrophobicContact CD1-CE2 4.21Å; I726-Y756 HydrophobicContact CD1-CG 4.28Å; I726-Y756 HydrophobicContact CG1-CD2 3.8Å; I726-Y756 HydrophobicContact CG1-CE2 4.11Å; L752-Y756 WeakPolarHBondContact O-CB 3.27Å; L752-Y756 PolarHBondContact O-N 3.29Å; S753-Y756 PolarHBondContact O-N 2.91Å; Y756-L760 HydrophobicContact CD1-CD1 3.98Å; Y756-L760 HydrophobicContact CE1-CD1 3.48Å; Y756-L760 VanDerWaalsContact CE1-CD1 3.48Å; Y756-L760 HydrophobicContact CE1-CG 4.4Å; Y756-L760 WeakPolarHBondContact O-CG 3.49Å; Y756-L760 PolarHBondContact O-N 2.91Å; Y756-L760 VanDerWaalsContact O-N 3.14Å; Y756-L779 HydrophobicContact CD1-CD1 3.69Å; Y756-L779 HydrophobicContact CE1-CD1 3.98Å; Y756-L779 HydrophobicContact CG-CD1 4.43Å; Y756-G809 PolarHBondContact OH-O 2.87Å; Y756-A811 HydrophobicContact CD1-CB 4.17Å; Y756-A811 HydrophobicContact CE1-CB 3.69Å; Y756-L847 HydrophobicContact CD2-CD2 3.74Å; Y756-L847 HydrophobicContact CE2-CD2 3.75Å
757	C	93.7	Very high	90.1	Very high	13 Å²	13	44.8 Å²	44.8	9%	0.088	26%	0.255	C	S	.	.	H	α-helix	trans	-69.9	-36.4	178.1	-92.4	0	0	0	0	113.5	S753 N755 L760 L761 C777	S753-C757 PolarHBondContact O-N 2.85Å; N755-C757 PolarHBondContact O-N 2.85Å; C757-L760 PolarHBondContact O-N 2.95Å; C757-L761 WeakPolarHBondContact O-CB 3.37Å; C757-L761 WeakPolarHBondContact O-CG 3.39Å; C757-L761 PolarHBondContact O-N 3.46Å; C757-C777 WeakPolarHBondContact CA-SG 3.3Å; C757-C777 HydrophobicContact CB-CB 3.55Å; C757-C777 WeakPolarHBondContact CB-SG 3.44Å; C757-C777 WeakPolarHBondContact SG-CB 3.46Å; C757-C777 PolarHBondContact SG-O 2.92Å; C757-C777 CovalentContact SG-SG 2.04Å; C757-C777 PolarHBondContact SG-SG 2.72Å
758	S	90.9	Very high	89	Confident	53 Å²	53	43 Å²	43	37%	0.371	24%	0.239	S	C	.	.	H	α-helix	trans	-64.2	-42.6	175.5	-170	0	0	0	0	111.5	T754 N755 L760 L761 Q762	T754-S758 WeakPolarHBondContact O-CB 3.43Å; T754-S758 PolarHBondContact O-N 2.89Å; N755-S758 PolarHBondContact O-N 2.94Å; S758-L760 PolarHBondContact O-N 3.12Å; S758-L761 PolarHBondContact O-N 2.89Å; S758-Q762 WeakPolarHBondContact O-CB 3.3Å; S758-Q762 WeakPolarHBondContact O-CG 3.48Å; S758-Q762 PolarHBondContact O-N 3.11Å
759	L	90.4	Very high	87.8	Confident	11 Å²	11	45.9 Å²	45.9	6%	0.058	25%	0.253	C	S	.	.	H	α-helix	trans	-56.8	-49.3	172.3	-96.8	138	0	0	0	112	N755 S763 Y836 L839 L841 N845 L847	N755-L759 WeakPolarHBondContact O-CB 3.34Å; N755-L759 PolarHBondContact O-N 2.92Å; L759-S763 WeakPolarHBondContact O-CB 3.38Å; L759-S763 PolarHBondContact O-N 3.06Å; L759-S763 PolarHBondContact O-OG 3.28Å; L759-Y836 HydrophobicContact CD2-CE2 3.91Å; L759-L839 HydrophobicContact CD2-CD1 4.49Å; L759-L841 HydrophobicContact CD2-CD2 3.71Å; L759-N845 HydrophobicContact CD1-CB 4.11Å; L759-N845 WeakPolarHBondContact CD1-O 3.47Å; L759-L847 HydrophobicContact CB-CD1 4.39Å
760	L	92.3	Very high	86.4	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-64.8	-41	179.1	-68.5	180	0	0	0	112.7	V722 Y756 C757 S758 S763 I764 A811 I813 L832 L847	V722-L760 HydrophobicContact CB-CD1 4.01Å; V722-L760 HydrophobicContact CG1-CD1 3.86Å; V722-L760 HydrophobicContact CG1-CD2 3.82Å; Y756-L760 HydrophobicContact CD1-CD1 3.98Å; Y756-L760 HydrophobicContact CE1-CD1 3.48Å; Y756-L760 VanDerWaalsContact CE1-CD1 3.48Å; Y756-L760 HydrophobicContact CE1-CG 4.4Å; Y756-L760 WeakPolarHBondContact O-CG 3.49Å; Y756-L760 PolarHBondContact O-N 2.91Å; Y756-L760 VanDerWaalsContact O-N 3.14Å; C757-L760 PolarHBondContact O-N 2.95Å; S758-L760 PolarHBondContact O-N 3.12Å; L760-S763 WeakPolarHBondContact O-CB 3.36Å; L760-S763 PolarHBondContact O-N 3.01Å; L760-I764 PolarHBondContact O-N 2.85Å; L760-A811 HydrophobicContact CD1-CB 4.36Å; L760-I813 HydrophobicContact CB-CD1 3.91Å; L760-I813 HydrophobicContact CD1-CD1 4.23Å; L760-L832 HydrophobicContact CD2-CD1 3.99Å; L760-L832 HydrophobicContact CD2-CD2 4.47Å; L760-L847 HydrophobicContact CD2-CD1 3.73Å; L760-L847 HydrophobicContact CG-CD1 4.32Å
761	L	90.9	Very high	85.2	Confident	42 Å²	42	51.6 Å²	51.6	22%	0.22	28%	0.275	C	S	.	.	H	α-helix	trans	-66.4	-45.4	177.1	-75.9	167.2	0	0	0	112	C757 S758 S763 I764 L765 A775 C777	C757-L761 WeakPolarHBondContact O-CB 3.37Å; C757-L761 WeakPolarHBondContact O-CG 3.39Å; C757-L761 PolarHBondContact O-N 3.46Å; S758-L761 PolarHBondContact O-N 2.89Å; L761-S763 VanDerWaalsContact C-N 3.32Å; L761-S763 PolarHBondContact O-N 3.01Å; L761-I764 HydrophobicContact CD2-CD1 4.36Å; L761-I764 VanDerWaalsContact O-CG1 3.26Å; L761-I764 WeakPolarHBondContact O-CG1 3.19Å; L761-I764 PolarHBondContact O-N 3.37Å; L761-L765 WeakPolarHBondContact O-CB 3.33Å; L761-L765 WeakPolarHBondContact O-CD1 3.37Å; L761-L765 VanDerWaalsContact O-CG 3.3Å; L761-L765 WeakPolarHBondContact O-CG 3.47Å; L761-L765 PolarHBondContact O-N 2.91Å; L761-A775 HydrophobicContact CD2-CB 3.98Å; L761-A775 WeakPolarHBondContact CD2-O 3.37Å; L761-C777 HydrophobicContact CD1-CB 3.78Å; L761-C777 HydrophobicContact CD2-CB 4.21Å; L761-C777 HydrophobicContact CG-CB 3.78Å
762	Q	89.2	Confident	84	Confident	98 Å²	98	47.4 Å²	47.4	46%	0.458	25%	0.249	S	C	.	.	H	α-helix	trans	-59	-44.8	174.3	-75.5	-175.5	-5.3	0	0	111	S758 I764 L765 T766 L839	S758-Q762 WeakPolarHBondContact O-CB 3.3Å; S758-Q762 WeakPolarHBondContact O-CG 3.48Å; S758-Q762 PolarHBondContact O-N 3.11Å; Q762-I764 VanDerWaalsContact C-N 3.34Å; Q762-I764 PolarHBondContact O-N 2.95Å; Q762-L765 PolarHBondContact O-N 2.91Å; Q762-T766 WeakPolarHBondContact O-CB 3.35Å; Q762-T766 PolarHBondContact O-N 2.83Å; Q762-T766 PolarHBondContact O-OG1 3.16Å; Q762-L839 HydrophobicContact CB-CD1 4.34Å; Q762-L839 HydrophobicContact CB-CD2 3.95Å
763	S	89.7	Confident	82.9	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-52.7	-50.6	179.3	-55.6	0	0	0	0	112	L759 L760 L761 G835 Y836 L839	L759-S763 WeakPolarHBondContact O-CB 3.38Å; L759-S763 PolarHBondContact O-N 3.06Å; L759-S763 PolarHBondContact O-OG 3.28Å; L760-S763 WeakPolarHBondContact O-CB 3.36Å; L760-S763 PolarHBondContact O-N 3.01Å; L761-S763 VanDerWaalsContact C-N 3.32Å; L761-S763 PolarHBondContact O-N 3.01Å; S763-G835 CarbonylContact O-C 3.57Å; S763-G835 VanDerWaalsContact O-CA 3.25Å; S763-G835 WeakPolarHBondContact O-CA 3.48Å; S763-Y836 WeakPolarHBondContact OG-CD2 3.35Å; S763-L839 WeakPolarHBondContact OG-CD1 3.23Å
764	I	88.7	Confident	81.9	Confident	0 Å²	0	55 Å²	55	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-74	-34.4	-177.6	64.3	177.9	0	0	0	112.3	L760 L761 Q762 E767 N768 T772 A775 I813 L815 F828 L831 L832	L760-I764 PolarHBondContact O-N 2.85Å; L761-I764 HydrophobicContact CD2-CD1 4.36Å; L761-I764 VanDerWaalsContact O-CG1 3.26Å; L761-I764 WeakPolarHBondContact O-CG1 3.19Å; L761-I764 PolarHBondContact O-N 3.37Å; Q762-I764 VanDerWaalsContact C-N 3.34Å; Q762-I764 PolarHBondContact O-N 2.95Å; I764-E767 PolarHBondContact O-N 2.89Å; I764-N768 PolarHBondContact O-N 2.97Å; I764-T772 HydrophobicContact CB-CG2 3.75Å; I764-T772 HydrophobicContact CD1-CG2 4.1Å; I764-T772 HydrophobicContact CG1-CG2 3.92Å; I764-A775 HydrophobicContact CD1-CB 3.88Å; I764-I813 HydrophobicContact CD1-CG2 3.92Å; I764-L815 HydrophobicContact CD1-CD2 3.85Å; I764-F828 HydrophobicContact CG2-CE2 4.13Å; I764-F828 HydrophobicContact CG2-CZ 4.49Å; I764-L831 HydrophobicContact CB-CD2 3.68Å; I764-L831 HydrophobicContact CG2-CD2 3.85Å; I764-L832 HydrophobicContact CG2-CB 4.2Å; I764-L832 HydrophobicContact CG2-CD1 3.66Å
765	L	85.7	Confident	81.6	Confident	68 Å²	68	51.1 Å²	51.1	36%	0.356	27%	0.274	S	S	.	.	H	α-helix	trans	-65.2	-35.4	175.2	-77.2	163.4	0	0	0	112.6	L761 Q762 E767 T769 T772	L761-L765 WeakPolarHBondContact O-CB 3.33Å; L761-L765 WeakPolarHBondContact O-CD1 3.37Å; L761-L765 VanDerWaalsContact O-CG 3.3Å; L761-L765 WeakPolarHBondContact O-CG 3.47Å; L761-L765 PolarHBondContact O-N 2.91Å; Q762-L765 PolarHBondContact O-N 2.91Å; L765-E767 VanDerWaalsContact C-N 3.28Å; L765-E767 PolarHBondContact O-N 3Å; L765-T769 VanDerWaalsContact O-CG2 3.24Å; L765-T769 WeakPolarHBondContact O-CG2 3.49Å; L765-T772 WeakPolarHBondContact CD2-OG1 3.48Å
766	T	83.5	Confident	81.6	Confident	67 Å²	67	51 Å²	51	41%	0.411	28%	0.276	S	S	.	.	H	α-helix	trans	-65.4	-27.9	176.9	-64.4	0	0	0	0	113	Q762 K838 L839	Q762-T766 WeakPolarHBondContact O-CB 3.35Å; Q762-T766 PolarHBondContact O-N 2.83Å; Q762-T766 PolarHBondContact O-OG1 3.16Å; T766-K838 HydrophobicContact CG2-CB 3.63Å; T766-K838 HydrophobicContact CG2-CD 4.38Å; T766-L839 WeakPolarHBondContact OG1-CD2 3.31Å
767	E	79.1	Confident	81.7	Confident	56 Å²	56	52 Å²	52	26%	0.262	28%	0.283	S	S	.	.	H	α-helix	trans	-92.5	-41.2	-178.7	-161.5	67.4	-171.9	0	0	113.5	I764 L765 L831 N834 G835 K838	I764-E767 PolarHBondContact O-N 2.89Å; L765-E767 VanDerWaalsContact C-N 3.28Å; L765-E767 PolarHBondContact O-N 3Å; E767-L831 HydrophobicContact CB-CD2 4.08Å; E767-L831 HydrophobicContact CB-CG 4.04Å; E767-L831 HydrophobicContact CG-CG 4.1Å; E767-N834 VanDerWaalsContact CD-CB 3.41Å; E767-N834 HydrophobicContact CG-CB 4.12Å; E767-N834 WeakPolarHBondContact OE1-CB 3.36Å; E767-N834 PolarHBondContact OE1-ND2 3.36Å; E767-G835 PolarHBondContact OE2-N 3.23Å; E767-K838 IonicContact OE1-NZ 3.46Å; E767-K838 PolarHBondContact OE1-NZ 2.93Å; E767-K838 WeakPolarHBondContact OE2-CD 3.4Å; E767-K838 VanDerWaalsContact OE2-CE 3.32Å; E767-K838 WeakPolarHBondContact OE2-CE 3.45Å; E767-K838 IonicContact OE2-NZ 3.32Å; E767-K838 PolarHBondContact OE2-NZ 2.86Å
768	N	69.1	Low	81.6	Confident	58 Å²	58	55.4 Å²	55.4	31%	0.31	30%	0.303	S	S	.	.			trans	-153.5	90.6	-179.9	-165	-46.3	0	0	0	113	I764 R770 I771 T772 L831	I764-N768 PolarHBondContact O-N 2.97Å; N768-R770 PolarHBondContact O-N 2.97Å; N768-R770 PolarHBondContact OD1-N 3.12Å; N768-I771 WeakPolarHBondContact ND2-CD1 3.44Å; N768-I771 PolarHBondContact O-N 2.85Å; N768-I771 PolarHBondContact OD1-N 2.67Å; N768-I771 VanDerWaalsContact OD1-N 3.14Å; N768-T772 WeakPolarHBondContact O-CB 3.45Å; N768-T772 WeakPolarHBondContact O-CG2 3.33Å; N768-T772 PolarHBondContact O-N 3.14Å; N768-T772 PolarHBondContact O-OG1 2.9Å; N768-L831 HydrophobicContact CB-CD1 4.13Å
769	T	63.4	Low	81.7	Confident	88 Å²	88	53.7 Å²	53.7	54%	0.54	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-26.1	179.6	53.6	0	0	0	0	114.6	L765 Q773	L765-T769 VanDerWaalsContact O-CG2 3.24Å; L765-T769 WeakPolarHBondContact O-CG2 3.49Å; T769-Q773 VanDerWaalsContact O-CB 3.31Å; T769-Q773 WeakPolarHBondContact O-CB 3.32Å; T769-Q773 WeakPolarHBondContact O-CG 3.33Å; T769-Q773 PolarHBondContact O-N 2.92Å
770	R	64.9	Low	81.7	Confident	193 Å²	193	55.4 Å²	55.4	73%	0.728	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.1	-43.5	-179.1	-71	-170.5	178.3	-159.3	1.1	112.8	N768 T772	N768-R770 PolarHBondContact O-N 2.97Å; N768-R770 PolarHBondContact OD1-N 3.12Å; R770-T772 VanDerWaalsContact C-N 3.34Å
771	I	65.6	Low	81.8	Confident	50 Å²	50	61.6 Å²	61.6	26%	0.256	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.7	-23.9	-178.6	-55.3	172.6	0	0	0	111.3	N768 T817 L823	N768-I771 WeakPolarHBondContact ND2-CD1 3.44Å; N768-I771 PolarHBondContact O-N 2.85Å; N768-I771 PolarHBondContact OD1-N 2.67Å; N768-I771 VanDerWaalsContact OD1-N 3.14Å; I771-T817 HydrophobicContact CG2-CG2 4.24Å; I771-L823 HydrophobicContact CG2-CD1 3.8Å; I771-L823 HydrophobicContact CG2-CG 4.42Å
772	T	67.4	Low	82	Confident	2 Å²	2	60.2 Å²	60.2	1%	0.012	31%	0.314	C	S	.	.	S	Bend	trans	-104.6	4.6	-174.7	63.8	0	0	0	0	113.6	I764 L765 N768 R770 G774 A775 L815 L831	I764-T772 HydrophobicContact CB-CG2 3.75Å; I764-T772 HydrophobicContact CD1-CG2 4.1Å; I764-T772 HydrophobicContact CG1-CG2 3.92Å; L765-T772 WeakPolarHBondContact CD2-OG1 3.48Å; N768-T772 WeakPolarHBondContact O-CB 3.45Å; N768-T772 WeakPolarHBondContact O-CG2 3.33Å; N768-T772 PolarHBondContact O-N 3.14Å; N768-T772 PolarHBondContact O-OG1 2.9Å; R770-T772 VanDerWaalsContact C-N 3.34Å; T772-G774 PolarHBondContact O-N 2.92Å; T772-A775 WeakPolarHBondContact O-CB 3.4Å; T772-A775 PolarHBondContact O-N 2.97Å; T772-L815 HydrophobicContact CG2-CD2 4.4Å; T772-L831 HydrophobicContact CG2-CD2 4.26Å
773	Q	67.1	Low	82.2	Confident	140 Å²	140	57.9 Å²	57.9	65%	0.654	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.1	119.5	177	-122.4	-176.6	8.1	0	0	110.8	T769 A775	T769-Q773 VanDerWaalsContact O-CB 3.31Å; T769-Q773 WeakPolarHBondContact O-CB 3.32Å; T769-Q773 WeakPolarHBondContact O-CG 3.33Å; T769-Q773 PolarHBondContact O-N 2.92Å; Q773-A775 VanDerWaalsContact C-N 3.32Å
774	G	72.8	Confident	82.3	Confident	53 Å²	53	64.6 Å²	64.6	55%	0.546	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.9	19.2	-172.5	0	0	0	0	0	114.1	T772	T772-G774 PolarHBondContact O-N 2.92Å
775	A	85.6	Confident	82.3	Confident	17 Å²	17	65.9 Å²	65.9	14%	0.14	34%	0.339	C	S	.	.			trans	-61.1	141.7	166.2	0	0	0	0	0	111.1	L761 I764 T772 Q773 E814 L815	L761-A775 HydrophobicContact CD2-CB 3.98Å; L761-A775 WeakPolarHBondContact CD2-O 3.37Å; I764-A775 HydrophobicContact CD1-CB 3.88Å; T772-A775 WeakPolarHBondContact O-CB 3.4Å; T772-A775 PolarHBondContact O-N 2.97Å; Q773-A775 VanDerWaalsContact C-N 3.32Å; A775-E814 CarbonylContact C-O 3.57Å; A775-E814 WeakPolarHBondContact CA-O 3.43Å; A775-L815 HydrophobicContact CB-CD2 3.6Å
776	T	91.1	Very high	82.3	Confident	61 Å²	61	66.5 Å²	66.5	37%	0.374	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	155.8	175.7	79.1	0	0	0	0	110.6	I813 E814	T776-I813 WeakPolarHBondContact O-CA 3.47Å; T776-E814 PolarHBondContact N-O 3.42Å; T776-E814 PolarHBondContact O-N 2.58Å; T776-E814 VanDerWaalsContact OG1-CB 3.31Å; T776-E814 WeakPolarHBondContact OG1-CB 3.43Å; T776-E814 PolarHBondContact OG1-OE2 3.34Å
777	C	93.6	Very high	82	Confident	23 Å²	23	64.8 Å²	64.8	16%	0.155	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	128.6	171.6	-178.3	0	0	0	0	110.2	C757 L761 Q812 I813	C757-C777 WeakPolarHBondContact CA-SG 3.3Å; C757-C777 HydrophobicContact CB-CB 3.55Å; C757-C777 WeakPolarHBondContact CB-SG 3.44Å; C757-C777 WeakPolarHBondContact SG-CB 3.46Å; C757-C777 PolarHBondContact SG-O 2.92Å; C757-C777 CovalentContact SG-SG 2.04Å; C757-C777 PolarHBondContact SG-SG 2.72Å; L761-C777 HydrophobicContact CD1-CB 3.78Å; L761-C777 HydrophobicContact CD2-CB 4.21Å; L761-C777 HydrophobicContact CG-CB 3.78Å; C777-Q812 WeakPolarHBondContact CA-O 3.48Å; C777-I813 HydrophobicContact CB-CD1 3.58Å; C777-I813 VanDerWaalsContact SG-CD1 3.53Å
778	T	93	Very high	81.6	Confident	83 Å²	83	66.8 Å²	66.8	51%	0.509	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	115.6	178.4	-56	0	0	0	0	109.6	N780 A811 Q812	T778-N780 PolarHBondContact O-N 3Å; T778-A811 CarbonylContact O-C 3.6Å; T778-A811 VanDerWaalsContact O-CA 3.25Å; T778-A811 WeakPolarHBondContact O-CA 3.22Å; T778-A811 WeakPolarHBondContact O-CB 3.49Å; T778-Q812 PolarHBondContact N-O 2.92Å; T778-Q812 PolarHBondContact O-N 2.9Å
779	L	93.5	Very high	81.1	Confident	18 Å²	18	66.9 Å²	66.9	9%	0.094	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	113.6	173.8	-173.5	80.7	0	0	0	110.3	Y749 Y756 R781 F782 D810 A811	Y749-L779 HydrophobicContact CE1-CD2 4.17Å; Y749-L779 HydrophobicContact CE2-CD2 4.22Å; Y749-L779 PolarHBondContact OH-O 3.42Å; Y756-L779 HydrophobicContact CD1-CD1 3.69Å; Y756-L779 HydrophobicContact CE1-CD1 3.98Å; Y756-L779 HydrophobicContact CG-CD1 4.43Å; L779-R781 WeakPolarHBondContact CD1-O 3.48Å; L779-F782 HydrophobicContact CD1-CD1 4.46Å; L779-F782 HydrophobicContact CD1-CE1 4.1Å; L779-F782 HydrophobicContact CD2-CD1 4.07Å; L779-F782 HydrophobicContact CD2-CD2 3.89Å; L779-F782 HydrophobicContact CD2-CE1 3.62Å; L779-F782 HydrophobicContact CD2-CE2 3.43Å; L779-F782 VanDerWaalsContact CD2-CE2 3.43Å; L779-F782 HydrophobicContact CD2-CG 4.19Å; L779-F782 HydrophobicContact CD2-CZ 3.28Å; L779-D810 WeakPolarHBondContact CD1-O 3.48Å; L779-A811 HydrophobicContact CD1-CB 4.15Å
780	N	90.1	Very high	80.6	Confident	47 Å²	47	69.3 Å²	69.3	25%	0.251	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	-46.2	175.5	-68	-31.5	0	0	0	111.3	K744 T778 D810	K744-N780 VanDerWaalsContact CE-O 3.24Å; K744-N780 WeakPolarHBondContact CE-O 3.27Å; K744-N780 PolarHBondContact NZ-O 3.48Å; T778-N780 PolarHBondContact O-N 3Å; N780-D810 WeakPolarHBondContact CA-O 3.4Å; N780-D810 VanDerWaalsContact CB-O 3.31Å; N780-D810 WeakPolarHBondContact CB-O 3.41Å; N780-D810 PolarHBondContact N-O 2.98Å; N780-D810 PolarHBondContact ND2-OD1 2.92Å; N780-D810 VanDerWaalsContact ND2-OD1 3.14Å
781	R	93.9	Very high	79.5	Confident	130 Å²	130	65.3 Å²	65.3	49%	0.491	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-170.6	168.8	-178.3	59.7	-176	166.6	-149.5	-11	110.8	L779 I783 D810	L779-R781 WeakPolarHBondContact CD1-O 3.48Å; R781-I783 HydrophobicContact CG-CG1 4.09Å; R781-D810 HydrophobicContact CG-CB 3.95Å; R781-D810 IonicContact CZ-OD2 2.99Å; R781-D810 PolarHBondContact N-O 3Å; R781-D810 IonicContact NE-OD2 2.66Å; R781-D810 PolarHBondContact NE-OD2 3.15Å; R781-D810 IonicContact NH2-OD2 2.68Å; R781-D810 PolarHBondContact NH2-OD2 2.83Å; R781-D810 PolarHBondContact O-N 2.94Å; R781-D810 VanDerWaalsContact O-N 3.08Å
782	F	94.9	Very high	78.3	Confident	12 Å²	12	72.4 Å²	72.4	5%	0.053	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	154	153.6	-67.1	-62.6	0	0	0	110.8	I726 W737 Y741 Y749 L752 L779 V807 Q808	I726-F782 HydrophobicContact CD1-CD1 4.31Å; I726-F782 HydrophobicContact CD1-CE1 3.71Å; W737-F782 HydrophobicContact CH2-CB 4.3Å; W737-F782 HydrophobicContact CZ3-CB 3.91Å; Y741-F782 HydrophobicContact CD1-CD2 4.37Å; Y741-F782 HydrophobicContact CD1-CE2 4.47Å; Y741-F782 HydrophobicContact CG-CD2 4.4Å; Y749-F782 AromaticContact CD2-CD2 3.64Å; Y749-F782 HydrophobicContact CD2-CD2 3.64Å; Y749-F782 AromaticContact CD2-CE2 3.93Å; Y749-F782 HydrophobicContact CD2-CE2 3.93Å; Y749-F782 AromaticContact CE2-CD2 3.73Å; Y749-F782 HydrophobicContact CE2-CD2 3.73Å; Y749-F782 HydrophobicContact CE2-CE2 4.11Å; Y749-F782 HydrophobicContact CG-CD2 4.39Å; Y749-F782 HydrophobicContact CG-CE2 4.24Å; L752-F782 HydrophobicContact CB-CE2 4.02Å; L752-F782 HydrophobicContact CB-CZ 3.74Å; L752-F782 HydrophobicContact CD2-CE1 4Å; L752-F782 HydrophobicContact CD2-CE2 4.05Å; L752-F782 HydrophobicContact CD2-CZ 3.73Å; L752-F782 HydrophobicContact CG-CE1 4.02Å; L752-F782 HydrophobicContact CG-CE2 4.14Å; L752-F782 HydrophobicContact CG-CZ 3.52Å; L779-F782 HydrophobicContact CD1-CD1 4.46Å; L779-F782 HydrophobicContact CD1-CE1 4.1Å; L779-F782 HydrophobicContact CD2-CD1 4.07Å; L779-F782 HydrophobicContact CD2-CD2 3.89Å; L779-F782 HydrophobicContact CD2-CE1 3.62Å; L779-F782 HydrophobicContact CD2-CE2 3.43Å; L779-F782 VanDerWaalsContact CD2-CE2 3.43Å; L779-F782 HydrophobicContact CD2-CG 4.19Å; L779-F782 HydrophobicContact CD2-CZ 3.28Å; F782-V807 HydrophobicContact CB-CG1 3.93Å; F782-V807 HydrophobicContact CD1-CG1 3.31Å; F782-V807 HydrophobicContact CE1-CG1 3.97Å; F782-V807 HydrophobicContact CG-CG1 3.72Å; F782-Q808 CarbonylContact C-O 3.38Å; F782-Q808 WeakPolarHBondContact CA-O 3.39Å
783	I	92.8	Very high	76.8	Confident	50 Å²	50	83.8 Å²	83.8	26%	0.256	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	133.2	178	-55.3	177.7	0	0	0	107.9	W737 R781 S785 Q808 D810	W737-I783 VanDerWaalsContact CZ3-C 3.44Å; R781-I783 HydrophobicContact CG-CG1 4.09Å; I783-S785 PolarHBondContact O-N 3.36Å; I783-Q808 HydrophobicContact CB-CB 4.38Å; I783-Q808 PolarHBondContact N-O 2.86Å; I783-Q808 PolarHBondContact O-N 3.23Å; I783-D810 HydrophobicContact CD1-CB 3.94Å; I783-D810 HydrophobicContact CG1-CB 4.34Å
784	R	92.4	Very high	75.2	Confident	141 Å²	141	85.8 Å²	85.8	53%	0.532	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	119.1	171.5	-175.7	176.7	179.5	171.9	0.8	108.7	W737 D805	W737-R784 HydrophobicContact CB-CG 4.11Å; W737-R784 HydrophobicContact CD2-CB 3.61Å; W737-R784 HydrophobicContact CD2-CG 3.84Å; W737-R784 VanDerWaalsContact CE3-CA 3.49Å; W737-R784 HydrophobicContact CE3-CB 3.67Å; W737-R784 HydrophobicContact CE3-CG 4.25Å; W737-R784 HydrophobicContact CG-CB 4.09Å; W737-R784 HydrophobicContact CG-CG 3.73Å; W737-R784 HydrophobicContact CH2-CB 4.38Å; W737-R784 HydrophobicContact CZ2-CB 4.33Å; W737-R784 HydrophobicContact CZ3-CB 4.06Å; W737-R784 VanDerWaalsContact CZ3-N 3.35Å; R784-D805 HydrophobicContact CG-CB 4.23Å; R784-D805 IonicContact CZ-OD2 3.2Å; R784-D805 VanDerWaalsContact NE-CG 3.31Å; R784-D805 IonicContact NE-OD1 3.68Å; R784-D805 IonicContact NE-OD2 2.92Å; R784-D805 PolarHBondContact NE-OD2 3.25Å; R784-D805 IonicContact NH2-OD2 2.67Å; R784-D805 PolarHBondContact NH2-OD2 3.29Å
785	S	88.1	Confident	73.5	Confident	27 Å²	27	91.2 Å²	91.2	19%	0.189	45%	0.449	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	113.1	-177.2	-168.3	0	0	0	0	110.4	I783 L787 A806	I783-S785 PolarHBondContact O-N 3.36Å; S785-L787 PolarHBondContact O-N 3.18Å; S785-A806 PolarHBondContact N-O 3.33Å; S785-A806 PolarHBondContact O-N 3.36Å
786	T	85.4	Confident	71.2	Confident	80 Å²	80	99.2 Å²	99.2	49%	0.491	48%	0.484	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	108.3	-175.4	-49.6	0	0	0	0	110.7	T803 D805	T786-T803 HydrophobicContact CG2-CG2 4.22Å; T786-D805 WeakPolarHBondContact CA-OD1 3.34Å; T786-D805 WeakPolarHBondContact CB-OD1 3.42Å; T786-D805 PolarHBondContact OG1-OD1 3.08Å
787	L	79	Confident	68.7	Low	31 Å²	31	104.2 Å²	104.2	16%	0.162	51%	0.508	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	121.7	-176.3	-58.1	179.8	0	0	0	111.6	I725 Y734 S785 L789 T803 T804 A806	I725-L787 HydrophobicContact CD1-CD2 3.8Å; I725-L787 HydrophobicContact CG2-CD1 4.07Å; Y734-L787 HydrophobicContact CD1-CD1 3.47Å; Y734-L787 VanDerWaalsContact CD1-CD1 3.47Å; Y734-L787 HydrophobicContact CE1-CD1 4.09Å; Y734-L787 HydrophobicContact CG-CD1 4Å; S785-L787 PolarHBondContact O-N 3.18Å; L787-L789 PolarHBondContact O-N 3.18Å; L787-T803 WeakPolarHBondContact O-CA 3.38Å; L787-T804 PolarHBondContact N-O 3.38Å; L787-T804 PolarHBondContact O-N 2.75Å; L787-A806 HydrophobicContact CD1-CB 3.58Å; L787-A806 HydrophobicContact CG-CB 3.99Å
788	N	69.8	Low	66.2	Low	98 Å²	98	107.4 Å²	107.4	52%	0.524	53%	0.531	S	S	.	.			trans	-81.7	101.6	172.7	-97.3	-71.8	0	0	0	110.9	Q790 T803	N788-Q790 PolarHBondContact O-N 2.96Å; N788-T803 WeakPolarHBondContact OD1-CG2 3.28Å
789	L	59.5	Low	63.9	Low	60 Å²	60	111.6 Å²	111.6	31%	0.314	55%	0.55	S	S	.	.			trans	-78.9	84.2	176.8	-73.7	162.2	0	0	0	111.6	Y734 L787 S791	Y734-L789 HydrophobicContact CE1-CD2 4.27Å; Y734-L789 HydrophobicContact CE2-CD1 3.89Å; Y734-L789 VanDerWaalsContact OH-CD1 3.27Å; Y734-L789 WeakPolarHBondContact OH-CD1 3.23Å; Y734-L789 WeakPolarHBondContact OH-CD2 3.41Å; L787-L789 PolarHBondContact O-N 3.18Å; L789-S791 PolarHBondContact O-N 3.05Å
790	Q	51.7	Low	61.6	Low	140 Å²	140	116.2 Å²	116.2	65%	0.654	58%	0.575	S	S	*	*			trans	-61.4	100.6	161.7	-75.9	-81.7	-72.3	0	0	109.3	N788 K792 N801	N788-Q790 PolarHBondContact O-N 2.96Å; Q790-K792 PolarHBondContact O-N 3.04Å; Q790-N801 PolarHBondContact NE2-OD1 2.94Å; Q790-N801 VanDerWaalsContact NE2-OD1 3.1Å
791	S	42	Very low	59.8	Low	109 Å²	109	118.2 Å²	118.2	76%	0.762	59%	0.586	S	S	*	*			trans	-66.2	94.7	-176.6	-170.7	0	0	0	0	111.6	L789 R793	L789-S791 PolarHBondContact O-N 3.05Å; S791-R793 PolarHBondContact O-N 3.01Å
792	K	39.6	Very low	58.1	Low	199 Å²	199	115.9 Å²	115.9	87%	0.865	59%	0.586	S	S	*	*			trans	-74	93.7	179.2	-79.8	-173.3	175	178.9	0	110.9	Q790	Q790-K792 PolarHBondContact O-N 3.04Å
793	R	36.3	Very low	56.9	Low	240 Å²	240	119.1 Å²	119.1	91%	0.906	61%	0.607	S	S	*	*	S	Bend	trans	62.2	88.6	169.4	-65.1	-178.7	168	-169.3	-3.5	115.9	S791	S791-R793 PolarHBondContact O-N 3.01Å
794	Q	33.2	Very low	56	Low	183 Å²	183	118.3 Å²	118.3	86%	0.855	60%	0.604	S	S	*	*			trans	-146.4	162.6	132.6	-116.8	173.1	12.6	0	0	111.1
795	I	38	Very low	55.7	Low	166 Å²	166	113.5 Å²	113.5	85%	0.851	59%	0.589	S	S	*	*			trans	-100.2	101.1	-157.9	-56.8	164.3	0	0	0	110.7
796	Q	36.3	Very low	55.8	Low	186 Å²	186	112.2 Å²	112.2	87%	0.869	58%	0.58	S	S	*	*	S	Bend	trans	-178.6	163.1	140.7	-104.1	172	9.2	0	0	112.1	S798	Q796-S798 PolarHBondContact O-N 2.87Å
797	N	39.2	Very low	56.2	Low	165 Å²	165	108.4 Å²	108.4	88%	0.882	56%	0.556	S	S	*	*			trans	-66.7	107.7	-172.5	-72.2	-18.5	0	0	0	113.6
798	S	41.8	Very low	56.9	Low	90 Å²	90	108.5 Å²	108.5	63%	0.629	56%	0.556	S	S	*	*			trans	-163.7	125.1	148.1	-84	0	0	0	0	110.7	Q796 N800	Q796-S798 PolarHBondContact O-N 2.87Å; S798-N800 PolarHBondContact O-N 2.92Å
799	N	45.2	Very low	58	Low	171 Å²	171	103.8 Å²	103.8	91%	0.914	53%	0.531	S	S	*	.			trans	-78.9	35.3	179.1	-66.8	-14.4	0	0	0	112.6	N801	N799-N801 PolarHBondContact O-N 2.85Å
800	N	45	Very low	59.7	Low	116 Å²	116	101 Å²	101	62%	0.62	52%	0.516	S	S	*	.			trans	-81	81.7	-175.3	-69.3	0.5	0	0	0	110	S798 T802	S798-N800 PolarHBondContact O-N 2.92Å; N800-T802 PolarHBondContact O-N 2.94Å; N800-T802 PolarHBondContact O-OG1 2.92Å
801	N	51	Low	61.8	Low	89 Å²	89	94.3 Å²	94.3	48%	0.476	49%	0.485	S	S	.	.			trans	-54.9	94.3	158.1	-103	-1.7	0	0	0	107.4	Q790 N799 T803	Q790-N801 PolarHBondContact NE2-OD1 2.94Å; Q790-N801 VanDerWaalsContact NE2-OD1 3.1Å; N799-N801 PolarHBondContact O-N 2.85Å; N801-T803 VanDerWaalsContact C-N 3.3Å; N801-T803 PolarHBondContact O-N 3.35Å
802	T	58.4	Low	64.3	Low	80 Å²	80	92.7 Å²	92.7	49%	0.491	47%	0.465	S	S	.	.			trans	-87.6	76	-168.8	-55.9	0	0	0	0	108.5	N800 T804	N800-T802 PolarHBondContact O-N 2.94Å; N800-T802 PolarHBondContact O-OG1 2.92Å; T802-T804 PolarHBondContact O-N 2.95Å; T802-T804 VanDerWaalsContact O-N 3.16Å; T802-T804 PolarHBondContact O-OG1 3.11Å
803	T	69.4	Low	66.8	Low	81 Å²	81	83.2 Å²	83.2	50%	0.497	42%	0.424	S	S	.	.			trans	-57.3	115.8	177.5	46.3	0	0	0	0	110.3	T786 L787 N788 N801	T786-T803 HydrophobicContact CG2-CG2 4.22Å; L787-T803 WeakPolarHBondContact O-CA 3.38Å; N788-T803 WeakPolarHBondContact OD1-CG2 3.28Å; N801-T803 VanDerWaalsContact C-N 3.3Å; N801-T803 PolarHBondContact O-N 3.35Å
804	T	75.7	Confident	69.3	Low	33 Å²	33	75 Å²	75	20%	0.202	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	125.2	179.5	-55	0	0	0	0	109.3	Y734 T736 L787 T802 A806	Y734-T804 HydrophobicContact CD2-CG2 3.7Å; Y734-T804 HydrophobicContact CE2-CG2 4.06Å; T736-T804 HydrophobicContact CG2-CG2 4.49Å; L787-T804 PolarHBondContact N-O 3.38Å; L787-T804 PolarHBondContact O-N 2.75Å; T802-T804 PolarHBondContact O-N 2.95Å; T802-T804 VanDerWaalsContact O-N 3.16Å; T802-T804 PolarHBondContact O-OG1 3.11Å; T804-A806 PolarHBondContact O-N 2.82Å
805	D	85.8	Confident	71.8	Confident	39 Å²	39	66.3 Å²	66.3	21%	0.209	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	113.6	175.3	-75.1	-40	0	0	0	110.8	T736 W737 R784 T786	T736-D805 CarbonylContact C-O 3.6Å; T736-D805 WeakPolarHBondContact CA-O 3.32Å; W737-D805 HydrophobicContact CB-CB 3.92Å; W737-D805 PolarHBondContact N-O 2.89Å; R784-D805 HydrophobicContact CG-CB 4.23Å; R784-D805 IonicContact CZ-OD2 3.2Å; R784-D805 VanDerWaalsContact NE-CG 3.31Å; R784-D805 IonicContact NE-OD1 3.68Å; R784-D805 IonicContact NE-OD2 2.92Å; R784-D805 PolarHBondContact NE-OD2 3.25Å; R784-D805 IonicContact NH2-OD2 2.67Å; R784-D805 PolarHBondContact NH2-OD2 3.29Å; T786-D805 WeakPolarHBondContact CA-OD1 3.34Å; T786-D805 WeakPolarHBondContact CB-OD1 3.42Å; T786-D805 PolarHBondContact OG1-OD1 3.08Å
806	A	90.3	Very high	73.6	Confident	0 Å²	0	61.7 Å²	61.7	0%	0	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	158.9	176.9	0	0	0	0	0	111.7	I725 Y734 V735 S785 L787 T804	I725-A806 HydrophobicContact CG2-CB 4.07Å; Y734-A806 HydrophobicContact CG-CB 4.25Å; V735-A806 CarbonylContact O-C 3.59Å; V735-A806 WeakPolarHBondContact O-CA 3.41Å; S785-A806 PolarHBondContact N-O 3.33Å; S785-A806 PolarHBondContact O-N 3.36Å; L787-A806 HydrophobicContact CD1-CB 3.58Å; L787-A806 HydrophobicContact CG-CB 3.99Å; T804-A806 PolarHBondContact O-N 2.82Å
807	V	92.8	Very high	74.8	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	122.9	168	-179.3	0	0	0	0	110.2	I726 V735 W737 Y741 L752 F782	I726-V807 HydrophobicContact CD1-CG1 3.98Å; I726-V807 PolarHBondContact N-O 2.98Å; V735-V807 HydrophobicContact CB-CB 4.38Å; V735-V807 HydrophobicContact CB-CG2 4.36Å; V735-V807 HydrophobicContact CG1-CB 4.36Å; V735-V807 HydrophobicContact CG1-CG2 3.91Å; V735-V807 PolarHBondContact O-N 3.16Å; W737-V807 HydrophobicContact CE3-CG2 4.07Å; Y741-V807 HydrophobicContact CD2-CG2 3.46Å; Y741-V807 VanDerWaalsContact CD2-CG2 3.46Å; Y741-V807 HydrophobicContact CE2-CG2 3.62Å; Y741-V807 HydrophobicContact CG-CG2 4.33Å; L752-V807 HydrophobicContact CD2-CG1 3.99Å; L752-V807 HydrophobicContact CD2-CG2 4.49Å; F782-V807 HydrophobicContact CB-CG1 3.93Å; F782-V807 HydrophobicContact CD1-CG1 3.31Å; F782-V807 HydrophobicContact CE1-CG1 3.97Å; F782-V807 HydrophobicContact CG-CG1 3.72Å
808	Q	93.7	Very high	75.6	Confident	33 Å²	33	48.4 Å²	48.4	15%	0.154	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	129.5	164.1	-172.8	178.7	21.8	0	0	109.1	A724 I725 F782 I783	A724-Q808 CarbonylContact O-C 3.59Å; A724-Q808 WeakPolarHBondContact O-CA 3.41Å; I725-Q808 HydrophobicContact CG1-CG 4.43Å; F782-Q808 CarbonylContact C-O 3.38Å; F782-Q808 WeakPolarHBondContact CA-O 3.39Å; I783-Q808 HydrophobicContact CB-CB 4.38Å; I783-Q808 PolarHBondContact N-O 2.86Å; I783-Q808 PolarHBondContact O-N 3.23Å
809	G	93.6	Very high	75.9	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	148	171	0	0	0	0	0	111.7	K723 A724 Y756	K723-G809 VanDerWaalsContact CA-O 3.26Å; K723-G809 WeakPolarHBondContact CA-O 3.34Å; A724-G809 PolarHBondContact N-O 2.95Å; A724-G809 PolarHBondContact O-N 3.15Å; Y756-G809 PolarHBondContact OH-O 2.87Å
810	D	94.4	Very high	76.1	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	103.2	170.7	177.7	-17.1	0	0	0	106.7	Q721 K723 L779 N780 R781 I783	Q721-D810 PolarHBondContact NE2-OD1 3.2Å; Q721-D810 PolarHBondContact NE2-OD2 2.9Å; K723-D810 HydrophobicContact CG-CB 4.49Å; L779-D810 WeakPolarHBondContact CD1-O 3.48Å; N780-D810 WeakPolarHBondContact CA-O 3.4Å; N780-D810 VanDerWaalsContact CB-O 3.31Å; N780-D810 WeakPolarHBondContact CB-O 3.41Å; N780-D810 PolarHBondContact N-O 2.98Å; N780-D810 PolarHBondContact ND2-OD1 2.92Å; N780-D810 VanDerWaalsContact ND2-OD1 3.14Å; R781-D810 HydrophobicContact CG-CB 3.95Å; R781-D810 IonicContact CZ-OD2 2.99Å; R781-D810 PolarHBondContact N-O 3Å; R781-D810 IonicContact NE-OD2 2.66Å; R781-D810 PolarHBondContact NE-OD2 3.15Å; R781-D810 IonicContact NH2-OD2 2.68Å; R781-D810 PolarHBondContact NH2-OD2 2.83Å; R781-D810 PolarHBondContact O-N 2.94Å; R781-D810 VanDerWaalsContact O-N 3.08Å; I783-D810 HydrophobicContact CD1-CB 3.94Å; I783-D810 HydrophobicContact CG1-CB 4.34Å
811	A	95.3	Very high	76.8	Confident	0 Å²	0	34.5 Å²	34.5	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	159.6	-178.4	0	0	0	0	0	112.1	Q721 V722 Y756 L760 T778 L779	Q721-A811 CarbonylContact C-O 3.52Å; Q721-A811 WeakPolarHBondContact CA-O 3.31Å; V722-A811 PolarHBondContact N-O 2.94Å; V722-A811 PolarHBondContact O-N 3.2Å; Y756-A811 HydrophobicContact CD1-CB 4.17Å; Y756-A811 HydrophobicContact CE1-CB 3.69Å; L760-A811 HydrophobicContact CD1-CB 4.36Å; T778-A811 CarbonylContact O-C 3.6Å; T778-A811 VanDerWaalsContact O-CA 3.25Å; T778-A811 WeakPolarHBondContact O-CA 3.22Å; T778-A811 WeakPolarHBondContact O-CB 3.49Å; L779-A811 HydrophobicContact CD1-CB 4.15Å
812	Q	94.9	Very high	77.8	Confident	75 Å²	75	30.5 Å²	30.5	35%	0.35	17%	0.172	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	132.8	163.7	-65.3	-177	-11.6	0	0	109.8	T719 F720 C777 T778 I855	T719-Q812 HydrophobicContact CG2-CB 4.39Å; F720-Q812 CarbonylContact O-C 3.5Å; F720-Q812 VanDerWaalsContact O-CA 3.29Å; F720-Q812 WeakPolarHBondContact O-CA 3.35Å; C777-Q812 WeakPolarHBondContact CA-O 3.48Å; T778-Q812 PolarHBondContact N-O 2.92Å; T778-Q812 PolarHBondContact O-N 2.9Å; Q812-I855 HydrophobicContact CG-CD1 3.75Å
813	I	92.8	Very high	78.8	Confident	1 Å²	1	27.4 Å²	27.4	1%	0.005	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	128	166.7	-61	-65.3	0	0	0	107.5	T719 F720 V722 L760 I764 T776 C777 L815 F828	T719-I813 WeakPolarHBondContact CA-O 3.34Å; F720-I813 PolarHBondContact N-O 3.47Å; F720-I813 PolarHBondContact O-N 3.42Å; V722-I813 HydrophobicContact CG2-CB 4.5Å; V722-I813 HydrophobicContact CG2-CG1 3.74Å; L760-I813 HydrophobicContact CB-CD1 3.91Å; L760-I813 HydrophobicContact CD1-CD1 4.23Å; I764-I813 HydrophobicContact CD1-CG2 3.92Å; T776-I813 WeakPolarHBondContact O-CA 3.47Å; C777-I813 HydrophobicContact CB-CD1 3.58Å; C777-I813 VanDerWaalsContact SG-CD1 3.53Å; I813-L815 HydrophobicContact CG2-CD2 3.84Å; I813-L815 HydrophobicContact CG2-CG 4.31Å; I813-F828 HydrophobicContact CB-CZ 3.99Å; I813-F828 HydrophobicContact CG1-CZ 4.14Å; I813-F828 HydrophobicContact CG2-CE2 3.98Å; I813-F828 HydrophobicContact CG2-CZ 3.89Å
814	E	89.7	Confident	79.3	Confident	66 Å²	66	26 Å²	26	31%	0.308	14%	0.142	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	129.1	174.7	-161.1	-172	-179.5	0	0	109.6	S717 T719 A775 T776	S717-E814 VanDerWaalsContact CB-OE1 3.3Å; S717-E814 WeakPolarHBondContact CB-OE1 3.42Å; S717-E814 VanDerWaalsContact OG-CD 3.27Å; S717-E814 WeakPolarHBondContact OG-CG 3.14Å; S717-E814 PolarHBondContact OG-OE1 2.98Å; T719-E814 HydrophobicContact CG2-CB 4.46Å; T719-E814 HydrophobicContact CG2-CG 4.46Å; A775-E814 CarbonylContact C-O 3.57Å; A775-E814 WeakPolarHBondContact CA-O 3.43Å; T776-E814 PolarHBondContact N-O 3.42Å; T776-E814 PolarHBondContact O-N 2.58Å; T776-E814 VanDerWaalsContact OG1-CB 3.31Å; T776-E814 WeakPolarHBondContact OG1-CB 3.43Å; T776-E814 PolarHBondContact OG1-OE2 3.34Å
815	L	84.9	Confident	79.8	Confident	1 Å²	1	28.5 Å²	28.5	1%	0.005	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	127.1	179.3	-58.4	-174.3	0	0	0	111.1	S717 T718 F720 I764 T772 A775 I813 T817 L823 F828	S717-L815 WeakPolarHBondContact CA-O 3.32Å; T718-L815 PolarHBondContact N-O 2.96Å; T718-L815 PolarHBondContact O-N 3.27Å; F720-L815 HydrophobicContact CD2-CD1 4.4Å; F720-L815 HydrophobicContact CE2-CD1 3.84Å; F720-L815 HydrophobicContact CE2-CG 4.27Å; I764-L815 HydrophobicContact CD1-CD2 3.85Å; T772-L815 HydrophobicContact CG2-CD2 4.4Å; A775-L815 HydrophobicContact CB-CD2 3.6Å; I813-L815 HydrophobicContact CG2-CD2 3.84Å; I813-L815 HydrophobicContact CG2-CG 4.31Å; L815-T817 HydrophobicContact CB-CG2 3.97Å; L815-T817 PolarHBondContact O-N 3.14Å; L815-L823 HydrophobicContact CD1-CD1 3.58Å; L815-F828 HydrophobicContact CD1-CD2 3.86Å; L815-F828 HydrophobicContact CD1-CE2 4.04Å
816	Q	75.5	Confident	79.8	Confident	69 Å²	69	29.7 Å²	29.7	32%	0.322	17%	0.167	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	66.3	173.7	-74.1	-82.3	-38.2	0	0	110.8
817	T	62.3	Low	79.6	Confident	2 Å²	2	33.2 Å²	33.2	1%	0.012	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	145.3	-177.3	47.9	0	0	0	0	113.5	V716 T718 I771 L815 S821	V716-T817 PolarHBondContact N-O 3.25Å; V716-T817 WeakPolarHBondContact O-CA 3.27Å; V716-T817 PolarHBondContact O-N 3.13Å; V716-T817 VanDerWaalsContact O-O 3.04Å; V716-T817 PolarHBondContact O-OG1 2.95Å; T718-T817 PolarHBondContact OG1-OG1 2.82Å; I771-T817 HydrophobicContact CG2-CG2 4.24Å; L815-T817 HydrophobicContact CB-CG2 3.97Å; L815-T817 PolarHBondContact O-N 3.14Å; T817-S821 WeakPolarHBondContact CG2-O 3.48Å
818	L	54.7	Low	79.4	Confident	71 Å²	71	33.2 Å²	33.2	37%	0.372	18%	0.183	S	C	.	.	P	Polyproline II helix	trans	-73.1	164.7	170.2	-77.3	148.5	0	0	0	111.4	G820 S821 D896	L818-G820 PolarHBondContact O-N 2.95Å; L818-S821 PolarHBondContact O-N 3.2Å; L818-S821 VanDerWaalsContact O-N 3.17Å; L818-D896 HydrophobicContact CD2-CB 4.34Å
819	A	48.2	Very low	79.3	Confident	10 Å²	10	33 Å²	33	8%	0.083	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.6	139.5	172.7	0	0	0	0	0	110.6	S821 L867	A819-S821 PolarHBondContact O-N 3.22Å; A819-S821 PolarHBondContact O-OG 3.43Å; A819-L867 HydrophobicContact CB-CD2 3.62Å
820	G	50.1	Low	79	Confident	18 Å²	18	39 Å²	39	19%	0.186	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	66.3	-4.1	-179.5	0	0	0	0	0	117	L818 V881	L818-G820 PolarHBondContact O-N 2.95Å; G820-V881 WeakPolarHBondContact CA-O 3.12Å; G820-V881 PolarHBondContact N-O 3.07Å
821	S	60	Low	78.8	Confident	57 Å²	57	39.9 Å²	39.9	40%	0.399	22%	0.218	S	C	.	.			trans	-116.8	32	-172.7	-57.2	0	0	0	0	112.7	T817 L818 A819 L823	T817-S821 WeakPolarHBondContact CG2-O 3.48Å; L818-S821 PolarHBondContact O-N 3.2Å; L818-S821 VanDerWaalsContact O-N 3.17Å; A819-S821 PolarHBondContact O-N 3.22Å; A819-S821 PolarHBondContact O-OG 3.43Å; S821-L823 PolarHBondContact O-N 3.19Å
822	Q	72	Confident	78.6	Confident	4 Å²	4	39.9 Å²	39.9	2%	0.019	22%	0.218	C	C	.	.	P	Polyproline II helix	trans	-70	129.7	170.7	-53.9	-178	26.2	0	0	108.8	V716 T718 N879	V716-Q822 HydrophobicContact CG1-CG 4.18Å; T718-Q822 HydrophobicContact CG2-CB 4.35Å; T718-Q822 WeakPolarHBondContact OG1-CB 3.39Å; T718-Q822 WeakPolarHBondContact OG1-CG 3.44Å; Q822-N879 WeakPolarHBondContact CB-O 3.45Å
823	L	78.1	Confident	78.3	Confident	15 Å²	15	40.3 Å²	40.3	8%	0.079	22%	0.219	C	C	.	.	P	Polyproline II helix	trans	-70.9	137.3	172.9	-73.8	159.5	0	0	0	109.6	F720 I771 L815 S821 Q827 F828 L831 R854	F720-L823 HydrophobicContact CZ-CB 3.89Å; F720-L823 WeakPolarHBondContact CZ-O 3.5Å; I771-L823 HydrophobicContact CG2-CD1 3.8Å; I771-L823 HydrophobicContact CG2-CG 4.42Å; L815-L823 HydrophobicContact CD1-CD1 3.58Å; S821-L823 PolarHBondContact O-N 3.19Å; L823-Q827 HydrophobicContact CD2-CB 3.54Å; L823-Q827 HydrophobicContact CD2-CG 4.5Å; L823-F828 HydrophobicContact CB-CB 4.31Å; L823-L831 HydrophobicContact CD1-CD1 4.04Å; L823-R854 PolarHBondContact O-NE 2.85Å
824	N	80.8	Confident	78.1	Confident	52 Å²	52	43.3 Å²	43.3	28%	0.278	24%	0.235	S	C	.	.	P	Polyproline II helix	trans	-80.1	171.2	161.9	71.4	46.5	0	0	0	110.8	A826 Q827 F828 N879	N824-A826 PolarHBondContact O-N 3.13Å; N824-A826 PolarHBondContact OD1-N 3.15Å; N824-A826 VanDerWaalsContact OD1-N 3.09Å; N824-Q827 PolarHBondContact ND2-OE1 2.71Å; N824-Q827 PolarHBondContact O-N 3.12Å; N824-Q827 WeakPolarHBondContact OD1-CG 3.34Å; N824-Q827 PolarHBondContact OD1-N 3.05Å; N824-F828 WeakPolarHBondContact O-CB 3.19Å; N824-F828 PolarHBondContact O-N 2.98Å; N824-N879 WeakPolarHBondContact CB-OD1 3.44Å; N824-N879 PolarHBondContact ND2-OD1 3.49Å
825	Q	86.4	Confident	78	Confident	85 Å²	85	40.2 Å²	40.2	40%	0.397	22%	0.22	S	C	.	.	H	α-helix	trans	-57.1	-46.7	-176.9	-178.3	172.1	-34.3	0	0	112.5	F828 S829 S852 R854	Q825-F828 PolarHBondContact O-N 2.94Å; Q825-S829 PolarHBondContact O-N 2.75Å; Q825-S829 PolarHBondContact O-OG 3.48Å; Q825-S852 VanDerWaalsContact CD-O 3.26Å; Q825-S852 VanDerWaalsContact CG-O 3.28Å; Q825-S852 WeakPolarHBondContact CG-O 3.5Å; Q825-S852 PolarHBondContact NE2-O 3.02Å; Q825-R854 HydrophobicContact CB-CB 4.16Å
826	A	86.1	Confident	78.2	Confident	65 Å²	65	41.4 Å²	41.4	54%	0.537	23%	0.225	S	C	.	.	H	α-helix	trans	-65.5	-44.3	-177.5	0	0	0	0	0	112	N824 F828 S829 Q830	N824-A826 PolarHBondContact O-N 3.13Å; N824-A826 PolarHBondContact OD1-N 3.15Å; N824-A826 VanDerWaalsContact OD1-N 3.09Å; A826-F828 VanDerWaalsContact C-N 3.33Å; A826-F828 PolarHBondContact O-N 2.86Å; A826-S829 PolarHBondContact O-N 3.26Å; A826-Q830 VanDerWaalsContact O-CB 3.31Å; A826-Q830 WeakPolarHBondContact O-CB 3.47Å; A826-Q830 PolarHBondContact O-N 3.19Å
827	Q	85.4	Confident	78.8	Confident	74 Å²	74	45 Å²	45	35%	0.346	24%	0.242	S	C	.	.	H	α-helix	trans	-61.3	-41.8	175.5	-65.1	172.2	-50.8	0	0	111.6	L823 N824 Q830 L831 N879	L823-Q827 HydrophobicContact CD2-CB 3.54Å; L823-Q827 HydrophobicContact CD2-CG 4.5Å; N824-Q827 PolarHBondContact ND2-OE1 2.71Å; N824-Q827 PolarHBondContact O-N 3.12Å; N824-Q827 WeakPolarHBondContact OD1-CG 3.34Å; N824-Q827 PolarHBondContact OD1-N 3.05Å; Q827-Q830 PolarHBondContact O-N 2.88Å; Q827-L831 VanDerWaalsContact O-CB 3.29Å; Q827-L831 WeakPolarHBondContact O-CB 3.35Å; Q827-L831 PolarHBondContact O-N 2.96Å; Q827-N879 PolarHBondContact OE1-ND2 3.04Å
828	F	89	Confident	80	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-66.8	-43.8	176.2	177.8	-101.3	0	0	0	112.4	F720 V722 I764 I813 L815 L823 N824 Q825 A826 Q830 L831 L832	F720-F828 HydrophobicContact CB-CD1 3.84Å; F720-F828 HydrophobicContact CB-CE1 3.63Å; F720-F828 HydrophobicContact CB-CG 4.49Å; F720-F828 HydrophobicContact CB-CZ 4.13Å; F720-F828 HydrophobicContact CD1-CB 3.84Å; F720-F828 AromaticContact CD1-CD1 3.49Å; F720-F828 HydrophobicContact CD1-CD1 3.49Å; F720-F828 VanDerWaalsContact CD1-CD1 3.49Å; F720-F828 HydrophobicContact CD1-CD2 4.46Å; F720-F828 HydrophobicContact CD1-CE1 4.2Å; F720-F828 AromaticContact CD1-CG 3.65Å; F720-F828 HydrophobicContact CD1-CG 3.65Å; F720-F828 HydrophobicContact CD2-CD1 4.11Å; F720-F828 AromaticContact CD2-CD2 3.89Å; F720-F828 HydrophobicContact CD2-CD2 3.89Å; F720-F828 HydrophobicContact CD2-CE1 4.3Å; F720-F828 HydrophobicContact CD2-CE2 4.08Å; F720-F828 AromaticContact CD2-CG 3.91Å; F720-F828 HydrophobicContact CD2-CG 3.91Å; F720-F828 HydrophobicContact CD2-CZ 4.29Å; F720-F828 HydrophobicContact CE1-CB 3.43Å; F720-F828 VanDerWaalsContact CE1-CB 3.43Å; F720-F828 HydrophobicContact CE1-CD1 4.03Å; F720-F828 HydrophobicContact CE1-CD2 4.47Å; F720-F828 AromaticContact CE1-CG 3.71Å; F720-F828 HydrophobicContact CE1-CG 3.71Å; F720-F828 HydrophobicContact CE2-CB 4.25Å; F720-F828 AromaticContact CE2-CD2 3.92Å; F720-F828 HydrophobicContact CE2-CD2 3.92Å; F720-F828 HydrophobicContact CE2-CE2 4.48Å; F720-F828 AromaticContact CE2-CG 3.98Å; F720-F828 HydrophobicContact CE2-CG 3.98Å; F720-F828 HydrophobicContact CG-CB 4.4Å; F720-F828 AromaticContact CG-CD1 3.53Å; F720-F828 HydrophobicContact CG-CD1 3.53Å; F720-F828 HydrophobicContact CG-CD2 4.18Å; F720-F828 AromaticContact CG-CE1 3.8Å; F720-F828 HydrophobicContact CG-CE1 3.8Å; F720-F828 HydrophobicContact CG-CE2 4.4Å; F720-F828 AromaticContact CG-CG 3.75Å; F720-F828 HydrophobicContact CG-CG 3.75Å; F720-F828 HydrophobicContact CG-CZ 4.23Å; F720-F828 HydrophobicContact CZ-CB 3.66Å; F720-F828 HydrophobicContact CZ-CD2 4.21Å; F720-F828 AromaticContact CZ-CG 3.88Å; F720-F828 HydrophobicContact CZ-CG 3.88Å; V722-F828 HydrophobicContact CG2-CE1 3.73Å; V722-F828 HydrophobicContact CG2-CZ 4.1Å; I764-F828 HydrophobicContact CG2-CE2 4.13Å; I764-F828 HydrophobicContact CG2-CZ 4.49Å; I813-F828 HydrophobicContact CB-CZ 3.99Å; I813-F828 HydrophobicContact CG1-CZ 4.14Å; I813-F828 HydrophobicContact CG2-CE2 3.98Å; I813-F828 HydrophobicContact CG2-CZ 3.89Å; L815-F828 HydrophobicContact CD1-CD2 3.86Å; L815-F828 HydrophobicContact CD1-CE2 4.04Å; L823-F828 HydrophobicContact CB-CB 4.31Å; N824-F828 WeakPolarHBondContact O-CB 3.19Å; N824-F828 PolarHBondContact O-N 2.98Å; Q825-F828 PolarHBondContact O-N 2.94Å; A826-F828 VanDerWaalsContact C-N 3.33Å; A826-F828 PolarHBondContact O-N 2.86Å; F828-Q830 VanDerWaalsContact C-N 3.29Å; F828-Q830 PolarHBondContact O-N 2.83Å; F828-L831 PolarHBondContact O-N 2.94Å; F828-L832 HydrophobicContact CE1-CD2 4.17Å; F828-L832 HydrophobicContact CZ-CD2 4.43Å; F828-L832 VanDerWaalsContact O-CB 3.23Å; F828-L832 WeakPolarHBondContact O-CB 3.29Å; F828-L832 PolarHBondContact O-N 2.93Å
829	S	90.7	Very high	81.4	Confident	28 Å²	28	48.7 Å²	48.7	20%	0.196	26%	0.256	C	S	.	.	H	α-helix	trans	-56.9	-44.1	172.9	-55.2	0	0	0	0	111.3	Q825 A826 L832 F833 S852	Q825-S829 PolarHBondContact O-N 2.75Å; Q825-S829 PolarHBondContact O-OG 3.48Å; A826-S829 PolarHBondContact O-N 3.26Å; S829-L832 PolarHBondContact O-N 2.9Å; S829-F833 WeakPolarHBondContact O-CB 3.29Å; S829-F833 WeakPolarHBondContact O-CD2 3.46Å; S829-F833 PolarHBondContact O-N 2.84Å; S829-S852 WeakPolarHBondContact CA-OG 3.44Å; S829-S852 PolarHBondContact OG-OG 3.1Å
830	Q	89	Confident	82.7	Confident	127 Å²	127	55.2 Å²	55.2	59%	0.593	29%	0.289	S	S	*	.	H	α-helix	trans	-70.1	-42	-177.2	-163.2	168	24.8	0	0	112.2	A826 Q827 F828 F833 N834	A826-Q830 VanDerWaalsContact O-CB 3.31Å; A826-Q830 WeakPolarHBondContact O-CB 3.47Å; A826-Q830 PolarHBondContact O-N 3.19Å; Q827-Q830 PolarHBondContact O-N 2.88Å; F828-Q830 VanDerWaalsContact C-N 3.29Å; F828-Q830 PolarHBondContact O-N 2.83Å; Q830-F833 PolarHBondContact O-N 3.23Å; Q830-N834 WeakPolarHBondContact O-CB 3.31Å; Q830-N834 VanDerWaalsContact O-CG 3.25Å; Q830-N834 PolarHBondContact O-N 2.84Å; Q830-N834 PolarHBondContact O-OD1 3.09Å
831	L	88.5	Confident	83.8	Confident	17 Å²	17	56.3 Å²	56.3	9%	0.089	29%	0.291	C	S	.	.	H	α-helix	trans	-60.9	-46.1	173.2	-171.5	160.4	0	0	0	110.9	I764 E767 N768 T772 L823 Q827 F828 G835	I764-L831 HydrophobicContact CB-CD2 3.68Å; I764-L831 HydrophobicContact CG2-CD2 3.85Å; E767-L831 HydrophobicContact CB-CD2 4.08Å; E767-L831 HydrophobicContact CB-CG 4.04Å; E767-L831 HydrophobicContact CG-CG 4.1Å; N768-L831 HydrophobicContact CB-CD1 4.13Å; T772-L831 HydrophobicContact CG2-CD2 4.26Å; L823-L831 HydrophobicContact CD1-CD1 4.04Å; Q827-L831 VanDerWaalsContact O-CB 3.29Å; Q827-L831 WeakPolarHBondContact O-CB 3.35Å; Q827-L831 PolarHBondContact O-N 2.96Å; F828-L831 PolarHBondContact O-N 2.94Å; L831-G835 PolarHBondContact O-N 3.25Å; L831-G835 VanDerWaalsContact O-N 3.12Å
832	L	90.7	Very high	84.1	Confident	1 Å²	1	57.7 Å²	57.7	1%	0.005	30%	0.3	C	S	.	.	H	α-helix	trans	-62.1	-47.3	176.4	179.1	64	0	0	0	112.1	V722 L760 I764 F828 S829 Y836 I850	V722-L832 HydrophobicContact CG1-CD2 3.94Å; V722-L832 HydrophobicContact CG2-CD2 4.32Å; L760-L832 HydrophobicContact CD2-CD1 3.99Å; L760-L832 HydrophobicContact CD2-CD2 4.47Å; I764-L832 HydrophobicContact CG2-CB 4.2Å; I764-L832 HydrophobicContact CG2-CD1 3.66Å; F828-L832 HydrophobicContact CE1-CD2 4.17Å; F828-L832 HydrophobicContact CZ-CD2 4.43Å; F828-L832 VanDerWaalsContact O-CB 3.23Å; F828-L832 WeakPolarHBondContact O-CB 3.29Å; F828-L832 PolarHBondContact O-N 2.93Å; S829-L832 PolarHBondContact O-N 2.9Å; L832-Y836 WeakPolarHBondContact O-CB 3.35Å; L832-Y836 PolarHBondContact O-N 3.3Å; L832-I850 HydrophobicContact CD2-CG2 3.66Å; L832-I850 HydrophobicContact CG-CG2 4.37Å
833	F	90.2	Very high	83.6	Confident	84 Å²	84	62 Å²	62	37%	0.368	33%	0.331	S	S	.	.	H	α-helix	trans	-70	-37.8	-178.8	-96.3	-72.1	0	0	0	113.9	S829 Q830 Q837 I850	S829-F833 WeakPolarHBondContact O-CB 3.29Å; S829-F833 WeakPolarHBondContact O-CD2 3.46Å; S829-F833 PolarHBondContact O-N 2.84Å; Q830-F833 PolarHBondContact O-N 3.23Å; F833-Q837 WeakPolarHBondContact O-CG 3.48Å; F833-Q837 PolarHBondContact O-N 3.48Å; F833-Q837 VanDerWaalsContact O-N 3.14Å; F833-Q837 PolarHBondContact O-NE2 2.95Å; F833-Q837 VanDerWaalsContact O-NE2 3.08Å; F833-I850 HydrophobicContact CE1-CB 4.2Å; F833-I850 HydrophobicContact CE1-CD1 4.37Å; F833-I850 HydrophobicContact CE2-CB 4.14Å; F833-I850 VanDerWaalsContact CE2-O 3.24Å; F833-I850 WeakPolarHBondContact CE2-O 3.37Å; F833-I850 HydrophobicContact CZ-CB 3.73Å; F833-I850 VanDerWaalsContact CZ-O 3.29Å; F833-I850 WeakPolarHBondContact CZ-O 3.3Å
834	N	88.8	Confident	83.5	Confident	64 Å²	64	63 Å²	63	34%	0.342	34%	0.344	S	S	.	.	H	α-helix	trans	-66.9	-49.8	177.2	-75.9	6.3	0	0	0	110.7	E767 Q830 Y836 Q837 K838	E767-N834 VanDerWaalsContact CD-CB 3.41Å; E767-N834 HydrophobicContact CG-CB 4.12Å; E767-N834 WeakPolarHBondContact OE1-CB 3.36Å; E767-N834 PolarHBondContact OE1-ND2 3.36Å; Q830-N834 WeakPolarHBondContact O-CB 3.31Å; Q830-N834 VanDerWaalsContact O-CG 3.25Å; Q830-N834 PolarHBondContact O-N 2.84Å; Q830-N834 PolarHBondContact O-OD1 3.09Å; N834-Y836 VanDerWaalsContact C-N 3.34Å; N834-Y836 PolarHBondContact O-N 3.41Å; N834-Q837 PolarHBondContact O-N 2.88Å; N834-K838 WeakPolarHBondContact O-CG 3.3Å; N834-K838 PolarHBondContact O-N 2.96Å
835	G	87.7	Confident	83.6	Confident	0 Å²	0	61.6 Å²	61.6	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-64.8	-38.4	178.7	0	0	0	0	0	112.4	S763 E767 L831 Q837 K838 L839	S763-G835 CarbonylContact O-C 3.57Å; S763-G835 VanDerWaalsContact O-CA 3.25Å; S763-G835 WeakPolarHBondContact O-CA 3.48Å; E767-G835 PolarHBondContact OE2-N 3.23Å; L831-G835 PolarHBondContact O-N 3.25Å; L831-G835 VanDerWaalsContact O-N 3.12Å; G835-Q837 VanDerWaalsContact C-N 3.33Å; G835-Q837 PolarHBondContact O-N 3.01Å; G835-K838 PolarHBondContact O-N 2.95Å; G835-L839 PolarHBondContact O-N 3.2Å
836	Y	88.9	Confident	83.6	Confident	26 Å²	26	60.7 Å²	60.7	10%	0.102	33%	0.33	C	S	.	.	H	α-helix	trans	-57.9	-41.9	172.6	-173	-94.8	0	0	0	112.6	L759 S763 L832 N834 K838 L839 L841 Y846 L847 I850	L759-Y836 HydrophobicContact CD2-CE2 3.91Å; S763-Y836 WeakPolarHBondContact OG-CD2 3.35Å; L832-Y836 WeakPolarHBondContact O-CB 3.35Å; L832-Y836 PolarHBondContact O-N 3.3Å; N834-Y836 VanDerWaalsContact C-N 3.34Å; N834-Y836 PolarHBondContact O-N 3.41Å; Y836-K838 VanDerWaalsContact C-N 3.26Å; Y836-K838 PolarHBondContact O-N 2.97Å; Y836-L839 HydrophobicContact CD2-CD1 4.22Å; Y836-L839 PolarHBondContact O-N 3.08Å; Y836-L841 HydrophobicContact CE1-CD1 4.39Å; Y836-L841 HydrophobicContact CE2-CD1 4.18Å; Y836-L841 WeakPolarHBondContact OH-CD1 3.32Å; Y836-Y846 WeakPolarHBondContact OH-CA 3.37Å; Y836-Y846 WeakPolarHBondContact OH-CB 3.41Å; Y836-L847 HydrophobicContact CE2-CB 3.97Å; Y836-L847 HydrophobicContact CE2-CD1 4.07Å; Y836-L847 HydrophobicContact CE2-CG 4.07Å; Y836-L847 PolarHBondContact OH-N 3.21Å; Y836-I850 HydrophobicContact CD1-CD1 4.03Å; Y836-I850 HydrophobicContact CD2-CD1 4.11Å; Y836-I850 HydrophobicContact CE1-CD1 4.36Å; Y836-I850 HydrophobicContact CE2-CD1 4.47Å; Y836-I850 HydrophobicContact CG-CD1 3.93Å
837	Q	87.7	Confident	83.8	Confident	145 Å²	145	58 Å²	58	68%	0.678	31%	0.307	S	S	*	.	H	α-helix	trans	-69.5	-20.5	176.5	-77.1	172.3	80	0	0	113.7	F833 N834 G835	F833-Q837 WeakPolarHBondContact O-CG 3.48Å; F833-Q837 PolarHBondContact O-N 3.48Å; F833-Q837 VanDerWaalsContact O-N 3.14Å; F833-Q837 PolarHBondContact O-NE2 2.95Å; F833-Q837 VanDerWaalsContact O-NE2 3.08Å; N834-Q837 PolarHBondContact O-N 2.88Å; G835-Q837 VanDerWaalsContact C-N 3.33Å; G835-Q837 PolarHBondContact O-N 3.01Å
838	K	87	Confident	83.8	Confident	126 Å²	126	56.8 Å²	56.8	55%	0.548	31%	0.307	S	S	.	.	H	α-helix	trans	-87.3	-10.4	174.8	-68.2	172.3	-174	168.7	0	113.3	T766 E767 N834 G835 Y836 N840	T766-K838 HydrophobicContact CG2-CB 3.63Å; T766-K838 HydrophobicContact CG2-CD 4.38Å; E767-K838 IonicContact OE1-NZ 3.46Å; E767-K838 PolarHBondContact OE1-NZ 2.93Å; E767-K838 WeakPolarHBondContact OE2-CD 3.4Å; E767-K838 VanDerWaalsContact OE2-CE 3.32Å; E767-K838 WeakPolarHBondContact OE2-CE 3.45Å; E767-K838 IonicContact OE2-NZ 3.32Å; E767-K838 PolarHBondContact OE2-NZ 2.86Å; N834-K838 WeakPolarHBondContact O-CG 3.3Å; N834-K838 PolarHBondContact O-N 2.96Å; G835-K838 PolarHBondContact O-N 2.95Å; Y836-K838 VanDerWaalsContact C-N 3.26Å; Y836-K838 PolarHBondContact O-N 2.97Å; K838-N840 PolarHBondContact O-N 3Å
839	L	84.4	Confident	83.6	Confident	25 Å²	25	59 Å²	59	13%	0.131	33%	0.329	C	S	.	.	S	Bend	trans	-69.7	120.1	175.2	-67	-178.9	0	0	0	110.8	L759 Q762 S763 T766 G835 Y836 L841	L759-L839 HydrophobicContact CD2-CD1 4.49Å; Q762-L839 HydrophobicContact CB-CD1 4.34Å; Q762-L839 HydrophobicContact CB-CD2 3.95Å; S763-L839 WeakPolarHBondContact OG-CD1 3.23Å; T766-L839 WeakPolarHBondContact OG1-CD2 3.31Å; G835-L839 PolarHBondContact O-N 3.2Å; Y836-L839 HydrophobicContact CD2-CD1 4.22Å; Y836-L839 PolarHBondContact O-N 3.08Å; L839-L841 HydrophobicContact CB-CD2 4.11Å; L839-L841 HydrophobicContact CB-CG 4Å; L839-L841 HydrophobicContact CD1-CD2 4.44Å; L839-L841 PolarHBondContact O-N 2.8Å
840	N	75	Confident	83.6	Confident	146 Å²	146	58.2 Å²	58.2	78%	0.781	32%	0.323	S	S	*	.			trans	-78.6	73.5	175.4	-168.4	-1.3	0	0	0	111.2	K838 S842	K838-N840 PolarHBondContact O-N 3Å; N840-S842 VanDerWaalsContact C-N 3.31Å; N840-S842 PolarHBondContact O-N 3.25Å; N840-S842 PolarHBondContact O-OG 3.48Å; N840-S842 PolarHBondContact OD1-OG 2.86Å
841	L	73.5	Confident	83.7	Confident	42 Å²	42	57.8 Å²	57.8	22%	0.22	32%	0.321	C	S	.	.			trans	-69.1	81.6	-175.7	-64.2	172.9	0	0	0	111.6	F729 L759 Y836 L839	F729-L841 WeakPolarHBondContact CE2-O 3.3Å; F729-L841 WeakPolarHBondContact CZ-O 3.45Å; L759-L841 HydrophobicContact CD2-CD2 3.71Å; Y836-L841 HydrophobicContact CE1-CD1 4.39Å; Y836-L841 HydrophobicContact CE2-CD1 4.18Å; Y836-L841 WeakPolarHBondContact OH-CD1 3.32Å; L839-L841 HydrophobicContact CB-CD2 4.11Å; L839-L841 HydrophobicContact CB-CG 4Å; L839-L841 HydrophobicContact CD1-CD2 4.44Å; L839-L841 PolarHBondContact O-N 2.8Å
842	S	65.8	Low	83.9	Confident	85 Å²	85	57.3 Å²	57.3	59%	0.594	32%	0.319	S	S	*	.			trans	-84.8	-17.1	-178.7	-61.9	0	0	0	0	113.9	F729 N840	F729-S842 WeakPolarHBondContact CE1-O 3.25Å; N840-S842 VanDerWaalsContact C-N 3.31Å; N840-S842 PolarHBondContact O-N 3.25Å; N840-S842 PolarHBondContact O-OG 3.48Å; N840-S842 PolarHBondContact OD1-OG 2.86Å
843	S	62.9	Low	83.9	Confident	95 Å²	95	59.9 Å²	59.9	66%	0.664	34%	0.335	S	S	*	.	S	Bend	trans	-163.1	176.2	177.1	67	0	0	0	0	111.3
844	G	76	Confident	83.9	Confident	35 Å²	35	58.1 Å²	58.1	36%	0.361	33%	0.326	S	S	.	.	S	Bend	trans	88.8	-131.8	177.3	0	0	0	0	0	113.2	F729	F729-G844 WeakPolarHBondContact CB-O 3.38Å; F729-G844 PolarHBondContact N-O 2.75Å
845	N	81	Confident	83.9	Confident	24 Å²	24	58.7 Å²	58.7	13%	0.128	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	155.6	-179.4	-70	-26.4	0	0	0	111.5	I726 Y727 L752 L759	I726-N845 HydrophobicContact CG2-CB 3.87Å; Y727-N845 CarbonylContact O-C 3.59Å; Y727-N845 WeakPolarHBondContact O-CA 3.44Å; Y727-N845 WeakPolarHBondContact O-CB 3.39Å; Y727-N845 PolarHBondContact O-OD1 2.88Å; L752-N845 VanDerWaalsContact CD1-ND2 3.32Å; L752-N845 WeakPolarHBondContact CD1-ND2 3.22Å; L759-N845 HydrophobicContact CD1-CB 4.11Å; L759-N845 WeakPolarHBondContact CD1-O 3.47Å
846	Y	87.6	Confident	83.6	Confident	65 Å²	65	59.4 Å²	59.4	26%	0.255	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	164.8	168.1	73	-94.3	0	0	0	111	Y727 F729 Y836	Y727-Y846 VanDerWaalsContact CB-CE1 3.41Å; Y727-Y846 HydrophobicContact CD1-CE1 4.3Å; Y727-Y846 AromaticContact CD1-CE2 3.9Å; Y727-Y846 HydrophobicContact CD1-CE2 3.9Å; Y727-Y846 AromaticContact CD1-CZ 3.55Å; Y727-Y846 WeakPolarHBondContact CD1-OH 3.42Å; Y727-Y846 HydrophobicContact CD2-CE2 4.07Å; Y727-Y846 HydrophobicContact CG-CD2 4.24Å; Y727-Y846 HydrophobicContact CG-CE1 4.17Å; Y727-Y846 AromaticContact CG-CE2 3.61Å; Y727-Y846 HydrophobicContact CG-CE2 3.61Å; Y727-Y846 AromaticContact CG-CZ 3.58Å; Y727-Y846 PolarHBondContact N-O 3.06Å; Y727-Y846 PolarHBondContact O-N 3.22Å; F729-Y846 HydrophobicContact CB-CD1 4.35Å; F729-Y846 HydrophobicContact CD2-CD1 4.13Å; Y836-Y846 WeakPolarHBondContact OH-CA 3.37Å; Y836-Y846 WeakPolarHBondContact OH-CB 3.41Å
847	L	89	Confident	83	Confident	10 Å²	10	63.1 Å²	63.1	5%	0.052	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	146.5	-171	-60	-177.7	0	0	0	110.4	A724 I725 I726 Y756 L759 L760 Y836 I850	A724-L847 HydrophobicContact CB-CB 4.12Å; A724-L847 HydrophobicContact CB-CD1 4.37Å; A724-L847 HydrophobicContact CB-CD2 4.25Å; A724-L847 HydrophobicContact CB-CG 4.48Å; I725-L847 CarbonylContact O-C 3.58Å; I725-L847 WeakPolarHBondContact O-CA 3.39Å; I726-L847 HydrophobicContact CG1-CD2 4.21Å; Y756-L847 HydrophobicContact CD2-CD2 3.74Å; Y756-L847 HydrophobicContact CE2-CD2 3.75Å; L759-L847 HydrophobicContact CB-CD1 4.39Å; L760-L847 HydrophobicContact CD2-CD1 3.73Å; L760-L847 HydrophobicContact CG-CD1 4.32Å; Y836-L847 HydrophobicContact CE2-CB 3.97Å; Y836-L847 HydrophobicContact CE2-CD1 4.07Å; Y836-L847 HydrophobicContact CE2-CG 4.07Å; Y836-L847 PolarHBondContact OH-N 3.21Å; L847-I850 HydrophobicContact CB-CD1 3.97Å; L847-I850 HydrophobicContact CB-CG1 4.02Å; L847-I850 HydrophobicContact CD1-CD1 4.47Å
848	S	86.9	Confident	82.3	Confident	48 Å²	48	58.9 Å²	58.9	34%	0.336	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	149.4	178.2	-167	0	0	0	0	110.5	I725 Y727	I725-S848 WeakPolarHBondContact CB-O 3.41Å; I725-S848 PolarHBondContact N-O 3.04Å; I725-S848 PolarHBondContact O-N 3.16Å; Y727-S848 VanDerWaalsContact CE2-CB 3.47Å
849	G	84.2	Confident	81.7	Confident	46 Å²	46	54.5 Å²	54.5	47%	0.474	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	57.8	50	-174.8	0	0	0	0	0	111.9	E851	G849-E851 PolarHBondContact O-N 3.47Å
850	I	90	Very high	81.3	Confident	12 Å²	12	55.2 Å²	55.2	6%	0.062	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	111.4	178.5	-52.2	174.7	0	0	0	108.4	V722 K723 A724 L832 F833 Y836 L847	V722-I850 HydrophobicContact CG1-CG2 4.07Å; K723-I850 WeakPolarHBondContact O-CA 3.42Å; A724-I850 HydrophobicContact CB-CB 4.38Å; A724-I850 HydrophobicContact CB-CG1 3.91Å; L832-I850 HydrophobicContact CD2-CG2 3.66Å; L832-I850 HydrophobicContact CG-CG2 4.37Å; F833-I850 HydrophobicContact CE1-CB 4.2Å; F833-I850 HydrophobicContact CE1-CD1 4.37Å; F833-I850 HydrophobicContact CE2-CB 4.14Å; F833-I850 VanDerWaalsContact CE2-O 3.24Å; F833-I850 WeakPolarHBondContact CE2-O 3.37Å; F833-I850 HydrophobicContact CZ-CB 3.73Å; F833-I850 VanDerWaalsContact CZ-O 3.29Å; F833-I850 WeakPolarHBondContact CZ-O 3.3Å; Y836-I850 HydrophobicContact CD1-CD1 4.03Å; Y836-I850 HydrophobicContact CD2-CD1 4.11Å; Y836-I850 HydrophobicContact CE1-CD1 4.36Å; Y836-I850 HydrophobicContact CE2-CD1 4.47Å; Y836-I850 HydrophobicContact CG-CD1 3.93Å; L847-I850 HydrophobicContact CB-CD1 3.97Å; L847-I850 HydrophobicContact CB-CG1 4.02Å; L847-I850 HydrophobicContact CD1-CD1 4.47Å
851	E	92.1	Very high	81.4	Confident	117 Å²	117	49.3 Å²	49.3	55%	0.547	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	137.3	172	-65.2	179.9	162.5	0	0	109	V722 K723 G849	V722-E851 WeakPolarHBondContact CA-O 3.38Å; K723-E851 PolarHBondContact N-O 3.02Å; K723-E851 PolarHBondContact O-N 2.74Å; G849-E851 PolarHBondContact O-N 3.47Å
852	S	92.3	Very high	81.3	Confident	7 Å²	7	52.2 Å²	52.2	5%	0.049	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	139.5	171.4	60.6	0	0	0	0	112.5	Q721 Q825 S829	Q721-S852 CarbonylContact O-C 3.58Å; Q721-S852 VanDerWaalsContact O-CA 3.25Å; Q721-S852 WeakPolarHBondContact O-CA 3.03Å; Q825-S852 VanDerWaalsContact CD-O 3.26Å; Q825-S852 VanDerWaalsContact CG-O 3.28Å; Q825-S852 WeakPolarHBondContact CG-O 3.5Å; Q825-S852 PolarHBondContact NE2-O 3.02Å; S829-S852 WeakPolarHBondContact CA-OG 3.44Å; S829-S852 PolarHBondContact OG-OG 3.1Å
853	T	91.8	Very high	81.4	Confident	56 Å²	56	54.4 Å²	54.4	34%	0.344	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	129.5	-175.1	-45.2	0	0	0	0	109.7	F720 Q721	F720-T853 CarbonylContact C-O 3.55Å; F720-T853 VanDerWaalsContact CA-O 3.3Å; F720-T853 WeakPolarHBondContact CA-O 3.28Å; Q721-T853 PolarHBondContact N-O 3.08Å; Q721-T853 PolarHBondContact O-N 3.01Å
854	R	88.8	Confident	81.4	Confident	46 Å²	46	50.4 Å²	50.4	17%	0.174	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	131.2	176.3	-170.3	168.7	174.3	-86.8	-6.2	109.9	F720 L823 Q825 S856 P857 T858	F720-R854 HydrophobicContact CD1-CB 3.8Å; F720-R854 HydrophobicContact CD1-CG 4.05Å; F720-R854 HydrophobicContact CE1-CB 3.79Å; F720-R854 HydrophobicContact CE1-CG 3.77Å; F720-R854 HydrophobicContact CZ-CG 4.35Å; L823-R854 PolarHBondContact O-NE 2.85Å; Q825-R854 HydrophobicContact CB-CB 4.16Å; R854-S856 PolarHBondContact NH1-O 2.89Å; R854-S856 PolarHBondContact NH2-O 2.93Å; R854-P857 PolarHBondContact NH2-O 2.87Å; R854-T858 PolarHBondContact NH1-OG1 2.95Å
855	I	89	Confident	80.6	Confident	76 Å²	76	60 Å²	60	39%	0.39	32%	0.324	S	S	.	.			trans	-120.4	-22.7	-176.4	42.1	169.9	0	0	0	113.4	T719 Q721 Q812	T719-I855 HydrophobicContact CG2-CD1 4.06Å; T719-I855 HydrophobicContact CG2-CG1 4.28Å; T719-I855 VanDerWaalsContact O-CG1 3.28Å; T719-I855 WeakPolarHBondContact O-CG1 3.25Å; T719-I855 PolarHBondContact O-N 2.85Å; Q721-I855 HydrophobicContact CB-CD1 4.23Å; Q721-I855 HydrophobicContact CB-CG2 4.4Å; Q812-I855 HydrophobicContact CG-CD1 3.75Å
856	S	82.4	Confident	79.7	Confident	15 Å²	15	62 Å²	62	11%	0.105	34%	0.34	C	S	.	.	S	Bend	trans	-68.8	139.1	165.9	56.1	0	0	0	0	110.7	T718 T719 R854	T718-S856 WeakPolarHBondContact CG2-OG 3.4Å; T719-S856 PolarHBondContact N-OG 2.88Å; T719-S856 PolarHBondContact O-N 2.95Å; T719-S856 PolarHBondContact O-OG 3.12Å; R854-S856 PolarHBondContact NH1-O 2.89Å; R854-S856 PolarHBondContact NH2-O 2.93Å
857	P	75.2	Confident	78.7	Confident	105 Å²	105	59.4 Å²	59.4	68%	0.682	33%	0.33	S	S	*	.	P	Polyproline II helix	trans	-64.6	158.9	172.3	28.8	-35.1	0	0	0	111.7	R854	R854-P857 PolarHBondContact NH2-O 2.87Å
858	T	74.1	Confident	78	Confident	56 Å²	56	59.9 Å²	59.9	34%	0.344	33%	0.334	S	S	.	.	P	Polyproline II helix	trans	-78.2	122.2	170.1	-55.3	0	0	0	0	109.2	R854	R854-T858 PolarHBondContact NH1-OG1 2.95Å
859	I	74.6	Confident	77.4	Confident	33 Å²	33	58.5 Å²	58.5	17%	0.169	33%	0.328	C	S	.	.	P	Polyproline II helix	trans	-71.3	144.6	176.1	-61.9	-170.6	0	0	0	109.7	V716 T864 G880 V881	V716-I859 HydrophobicContact CG1-CD1 3.56Å; V716-I859 HydrophobicContact CG1-CG1 4.48Å; V716-I859 HydrophobicContact CG2-CD1 4.43Å; I859-T864 HydrophobicContact CG2-CG2 3.43Å; I859-T864 VanDerWaalsContact CG2-CG2 3.43Å; I859-G880 CarbonylContact O-C 3.46Å; I859-G880 WeakPolarHBondContact O-CA 3.12Å; I859-V881 HydrophobicContact CB-CG2 4.47Å; I859-V881 HydrophobicContact CG2-CG1 4.45Å; I859-V881 HydrophobicContact CG2-CG2 4.04Å
860	T	75.1	Confident	77	Confident	41 Å²	41	64.1 Å²	64.1	25%	0.252	34%	0.341	S	S	.	.			trans	-126.6	153.6	179.3	52	0	0	0	0	111.6	S862 Q863 T864 N876	T860-S862 PolarHBondContact O-N 3Å; T860-S862 PolarHBondContact OG1-OG 3.28Å; T860-S862 VanDerWaalsContact OG1-OG 3.13Å; T860-Q863 WeakPolarHBondContact O-CB 3.44Å; T860-Q863 PolarHBondContact O-N 3.28Å; T860-Q863 PolarHBondContact OG1-OE1 3.37Å; T860-Q863 VanDerWaalsContact OG1-OE1 3.13Å; T860-T864 PolarHBondContact O-OG1 3.46Å; T860-N876 WeakPolarHBondContact CA-OD1 3.11Å
861	C	76.1	Confident	76.8	Confident	22 Å²	22	67.4 Å²	67.4	15%	0.149	36%	0.356	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-22.8	-173.9	-68.4	0	0	0	0	114	Q863 T864 C874 R875 N876 V881	C861-Q863 VanDerWaalsContact C-N 3.26Å; C861-Q863 PolarHBondContact O-N 3.28Å; C861-T864 PolarHBondContact O-N 3.49Å; C861-C874 VanDerWaalsContact CA-SG 3.59Å; C861-C874 HydrophobicContact CB-CB 3.82Å; C861-C874 WeakPolarHBondContact CB-SG 3.1Å; C861-C874 WeakPolarHBondContact SG-CB 3.39Å; C861-C874 CovalentContact SG-SG 2.04Å; C861-C874 PolarHBondContact SG-SG 3.41Å; C861-R875 PolarHBondContact SG-N 3.27Å; C861-R875 VanDerWaalsContact SG-N 3.38Å; C861-N876 PolarHBondContact N-OD1 3.16Å; C861-N876 PolarHBondContact SG-OD1 2.88Å; C861-V881 HydrophobicContact CB-CG1 4.32Å
862	S	72.9	Confident	76.4	Confident	103 Å²	103	62.7 Å²	62.7	72%	0.72	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-25	172.4	43.2	0	0	0	0	113.3	T860	T860-S862 PolarHBondContact O-N 3Å; T860-S862 PolarHBondContact OG1-OG 3.28Å; T860-S862 VanDerWaalsContact OG1-OG 3.13Å
863	Q	67.5	Low	76	Confident	130 Å²	130	65.2 Å²	65.2	61%	0.607	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.8	-22.2	179	-63.2	166.6	-38.8	0	0	112.6	T860 C861	T860-Q863 WeakPolarHBondContact O-CB 3.44Å; T860-Q863 PolarHBondContact O-N 3.28Å; T860-Q863 PolarHBondContact OG1-OE1 3.37Å; T860-Q863 VanDerWaalsContact OG1-OE1 3.13Å; C861-Q863 VanDerWaalsContact C-N 3.26Å; C861-Q863 PolarHBondContact O-N 3.28Å
864	T	63.5	Low	75.5	Confident	12 Å²	12	64.5 Å²	64.5	7%	0.074	35%	0.352	C	S	.	.			trans	-139.4	57.4	-165.3	57.6	0	0	0	0	114.4	I859 T860 C861 S866 L867	I859-T864 HydrophobicContact CG2-CG2 3.43Å; I859-T864 VanDerWaalsContact CG2-CG2 3.43Å; T860-T864 PolarHBondContact O-OG1 3.46Å; C861-T864 PolarHBondContact O-N 3.49Å; T864-S866 PolarHBondContact O-N 3.11Å; T864-S866 VanDerWaalsContact O-N 3.16Å; T864-L867 HydrophobicContact CG2-CD1 3.71Å; T864-L867 PolarHBondContact O-N 3.12Å
865	R	57.4	Low	75	Confident	237 Å²	237	70.8 Å²	70.8	89%	0.894	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-20.3	175.7	-83.4	-173.9	171.3	-179	-2.5	115.1
866	S	63	Low	74.5	Confident	66 Å²	66	71.7 Å²	71.7	46%	0.462	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.9	7.6	-177	52.6	0	0	0	0	115	T864	T864-S866 PolarHBondContact O-N 3.11Å; T864-S866 VanDerWaalsContact O-N 3.16Å
867	L	66.2	Low	74	Confident	9 Å²	9	73.7 Å²	73.7	5%	0.047	39%	0.393	C	S	.	.	S	Bend	trans	-93.4	-17.3	-174	-117.7	153.7	0	0	0	114	V713 V716 A819 T864	V713-L867 HydrophobicContact CB-CD1 3.91Å; V713-L867 HydrophobicContact CB-CG 4.45Å; V713-L867 HydrophobicContact CG1-CD1 4Å; V713-L867 WeakPolarHBondContact O-CD2 3.4Å; V713-L867 WeakPolarHBondContact O-CG 3.45Å; V716-L867 HydrophobicContact CG2-CD1 3.94Å; V716-L867 HydrophobicContact CG2-CD2 4.18Å; A819-L867 HydrophobicContact CB-CD2 3.62Å; T864-L867 HydrophobicContact CG2-CD1 3.71Å; T864-L867 PolarHBondContact O-N 3.12Å
868	C	75.2	Confident	73.6	Confident	21 Å²	21	76.2 Å²	76.2	14%	0.142	40%	0.401	C	S	.	.	S	Bend	trans	-93.6	156.8	169.4	-53.5	0	0	0	0	110.8	A872 C874 C883	C868-A872 HydrophobicContact CB-CB 4.02Å; C868-C874 VanDerWaalsContact SG-CB 3.55Å; C868-C883 WeakPolarHBondContact CA-SG 3.06Å; C868-C883 HydrophobicContact CB-CB 3.68Å; C868-C883 WeakPolarHBondContact CB-SG 3.38Å; C868-C883 WeakPolarHBondContact SG-CB 3.32Å; C868-C883 CovalentContact SG-SG 2.04Å; C868-C883 PolarHBondContact SG-SG 3.02Å
869	G	74	Confident	73.2	Confident	19 Å²	19	75.5 Å²	75.5	20%	0.196	40%	0.395	C	S	.	.	P	Polyproline II helix	trans	-72.3	172.7	176.3	0	0	0	0	0	113.2	A872 G898 K899	G869-A872 PolarHBondContact O-N 3.48Å; G869-G898 WeakPolarHBondContact CA-O 3.18Å; G869-G898 PolarHBondContact N-O 3.13Å; G869-K899 WeakPolarHBondContact CA-O 3.27Å
870	E	76.1	Confident	73.1	Confident	163 Å²	163	74 Å²	74	76%	0.762	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	135.9	171.2	-156.3	164.3	-154.4	0	0	109.5
871	H	84.8	Confident	73.1	Confident	81 Å²	81	72 Å²	72	38%	0.375	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.1	35.7	-171.1	-42.4	-67.6	0	0	0	115.4	D886 W889	H871-D886 PolarHBondContact O-N 3.31Å; H871-W889 HydrophobicContact CB-CD2 3.6Å; H871-W889 HydrophobicContact CB-CE3 3.97Å; H871-W889 HydrophobicContact CB-CG 4Å; H871-W889 HydrophobicContact CB-CH2 4.33Å; H871-W889 HydrophobicContact CB-CZ2 3.96Å; H871-W889 HydrophobicContact CB-CZ3 4.32Å; H871-W889 AromaticContact CD2-CE2 3.94Å; H871-W889 AromaticContact CD2-CE3 3.97Å; H871-W889 AromaticContact CD2-CH2 3.14Å; H871-W889 WeakPolarHBondContact CD2-CH2 3.47Å; H871-W889 AromaticContact CD2-CZ2 3.42Å; H871-W889 VanDerWaalsContact CD2-CZ2 3.42Å; H871-W889 WeakPolarHBondContact CD2-CZ2 3.45Å; H871-W889 AromaticContact CD2-CZ3 3.43Å; H871-W889 VanDerWaalsContact CD2-CZ3 3.43Å; H871-W889 WeakPolarHBondContact CD2-CZ3 3.43Å; H871-W889 AromaticContact CE1-CH2 3.96Å; H871-W889 AromaticContact CE1-CZ2 3.73Å; H871-W889 AromaticContact CG-CD2 3.94Å; H871-W889 AromaticContact CG-CE2 3.5Å; H871-W889 AromaticContact CG-CH2 3.61Å; H871-W889 AromaticContact CG-CZ2 3.35Å; H871-W889 AromaticContact CG-CZ3 3.97Å; H871-W889 AromaticContact ND1-CE2 3.93Å; H871-W889 AromaticContact ND1-CZ2 3.57Å; H871-W889 AromaticContact NE2-CH2 3.38Å; H871-W889 WeakPolarHBondContact NE2-CH2 3.18Å; H871-W889 AromaticContact NE2-CZ2 3.63Å
872	A	83.8	Confident	73	Confident	18 Å²	18	72.8 Å²	72.8	15%	0.149	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	132.6	169.3	0	0	0	0	0	113.5	C868 G869 T884 G898	C868-A872 HydrophobicContact CB-CB 4.02Å; G869-A872 PolarHBondContact O-N 3.48Å; A872-T884 CarbonylContact C-O 3.52Å; A872-T884 WeakPolarHBondContact CA-O 3.48Å; A872-G898 WeakPolarHBondContact CB-O 3.41Å
873	S	83.9	Confident	73.3	Confident	61 Å²	61	68.1 Å²	68.1	43%	0.427	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	133.3	171.8	-76.2	0	0	0	0	112	T884 D886	S873-T884 PolarHBondContact N-O 3.01Å; S873-T884 PolarHBondContact O-N 3.03Å; S873-T884 PolarHBondContact O-OG1 3.45Å; S873-D886 WeakPolarHBondContact CB-OD1 3.44Å; S873-D886 PolarHBondContact N-OD1 3.04Å; S873-D886 VanDerWaalsContact N-OD1 3.16Å; S873-D886 PolarHBondContact OG-OD1 2.85Å
874	C	81.5	Confident	74	Confident	41 Å²	41	65 Å²	65	28%	0.277	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	134.5	170.3	-172	0	0	0	0	111	C861 C868	C861-C874 VanDerWaalsContact CA-SG 3.59Å; C861-C874 HydrophobicContact CB-CB 3.82Å; C861-C874 WeakPolarHBondContact CB-SG 3.1Å; C861-C874 WeakPolarHBondContact SG-CB 3.39Å; C861-C874 CovalentContact SG-SG 2.04Å; C861-C874 PolarHBondContact SG-SG 3.41Å; C868-C874 VanDerWaalsContact SG-CB 3.55Å
875	R	80	Confident	75	Confident	177 Å²	177	65.7 Å²	65.7	67%	0.668	34%	0.341	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123.8	133.3	169.6	-89.5	-175.7	165.6	-161.1	-3.2	111.2	C861 V881 T882	C861-R875 PolarHBondContact SG-N 3.27Å; C861-R875 VanDerWaalsContact SG-N 3.38Å; R875-V881 CarbonylContact O-C 3.53Å; R875-V881 WeakPolarHBondContact O-CA 3.36Å; R875-T882 HydrophobicContact CB-CG2 3.8Å; R875-T882 PolarHBondContact N-O 3.36Å; R875-T882 PolarHBondContact O-N 3.31Å
876	N	77.9	Confident	76.4	Confident	96 Å²	96	56.6 Å²	56.6	51%	0.513	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64	141.9	164.9	-67.8	-16.6	0	0	0	109.8	T860 C861 G880	T860-N876 WeakPolarHBondContact CA-OD1 3.11Å; C861-N876 PolarHBondContact N-OD1 3.16Å; C861-N876 PolarHBondContact SG-OD1 2.88Å; N876-G880 CarbonylContact C-O 3.6Å; N876-G880 WeakPolarHBondContact CA-O 3.36Å
877	T	72	Confident	77.2	Confident	57 Å²	57	59 Å²	59	35%	0.35	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	165.7	166.8	64.8	0	0	0	0	108.5	N879 G880 T882	T877-N879 PolarHBondContact O-N 2.88Å; T877-N879 PolarHBondContact OG1-N 3.39Å; T877-G880 PolarHBondContact N-O 2.92Å; T877-G880 PolarHBondContact O-N 3.39Å; T877-G880 PolarHBondContact OG1-N 3.04Å; T877-T882 HydrophobicContact CG2-CG2 3.66Å
878	D	66.6	Low	78	Confident	157 Å²	157	63.8 Å²	63.8	84%	0.84	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58	-23.4	175.6	-50.1	-45.6	0	0	0	112.3
879	N	65.8	Low	78.4	Confident	42 Å²	42	66.3 Å²	66.3	23%	0.225	36%	0.355	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.4	20.5	179.2	-65.6	-7.2	0	0	0	113.1	Q822 N824 Q827 T877	Q822-N879 WeakPolarHBondContact CB-O 3.45Å; N824-N879 WeakPolarHBondContact CB-OD1 3.44Å; N824-N879 PolarHBondContact ND2-OD1 3.49Å; Q827-N879 PolarHBondContact OE1-ND2 3.04Å; T877-N879 PolarHBondContact O-N 2.88Å; T877-N879 PolarHBondContact OG1-N 3.39Å
880	G	73	Confident	78.8	Confident	0 Å²	0	70.6 Å²	70.6	0%	0	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	117.9	-120.7	173.3	0	0	0	0	0	114.9	I859 N876 T877	I859-G880 CarbonylContact O-C 3.46Å; I859-G880 WeakPolarHBondContact O-CA 3.12Å; N876-G880 CarbonylContact C-O 3.6Å; N876-G880 WeakPolarHBondContact CA-O 3.36Å; T877-G880 PolarHBondContact N-O 2.92Å; T877-G880 PolarHBondContact O-N 3.39Å; T877-G880 PolarHBondContact OG1-N 3.04Å
881	V	75	Confident	79	Confident	1 Å²	1	64.9 Å²	64.9	1%	0.006	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	99.4	-169.2	-78.4	0	0	0	0	111.7	G820 I859 C861 R875	G820-V881 WeakPolarHBondContact CA-O 3.12Å; G820-V881 PolarHBondContact N-O 3.07Å; I859-V881 HydrophobicContact CB-CG2 4.47Å; I859-V881 HydrophobicContact CG2-CG1 4.45Å; I859-V881 HydrophobicContact CG2-CG2 4.04Å; C861-V881 HydrophobicContact CB-CG1 4.32Å; R875-V881 CarbonylContact O-C 3.53Å; R875-V881 WeakPolarHBondContact O-CA 3.36Å
882	T	74.3	Confident	78.5	Confident	38 Å²	38	65.6 Å²	65.6	23%	0.233	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	144.4	173.1	-164.7	0	0	0	0	110.8	R875 T877	R875-T882 HydrophobicContact CB-CG2 3.8Å; R875-T882 PolarHBondContact N-O 3.36Å; R875-T882 PolarHBondContact O-N 3.31Å; T877-T882 HydrophobicContact CG2-CG2 3.66Å
883	C	78.7	Confident	77.8	Confident	4 Å²	4	67.8 Å²	67.8	3%	0.027	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	134.7	174.5	-64.9	0	0	0	0	108.7	C868 P897	C868-C883 WeakPolarHBondContact CA-SG 3.06Å; C868-C883 HydrophobicContact CB-CB 3.68Å; C868-C883 WeakPolarHBondContact CB-SG 3.38Å; C868-C883 WeakPolarHBondContact SG-CB 3.32Å; C868-C883 CovalentContact SG-SG 2.04Å; C868-C883 PolarHBondContact SG-SG 3.02Å; C883-P897 WeakPolarHBondContact CB-O 3.41Å; C883-P897 CarbonylContact O-C 3.56Å
884	T	81.2	Confident	76.8	Confident	64 Å²	64	70.8 Å²	70.8	39%	0.393	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	128.6	178.3	46	0	0	0	0	109.5	A872 S873	A872-T884 CarbonylContact C-O 3.52Å; A872-T884 WeakPolarHBondContact CA-O 3.48Å; S873-T884 PolarHBondContact N-O 3.01Å; S873-T884 PolarHBondContact O-N 3.03Å; S873-T884 PolarHBondContact O-OG1 3.45Å
885	C	85	Confident	75.7	Confident	27 Å²	27	72 Å²	72	18%	0.182	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-53.6	141	174	-61.4	0	0	0	0	111.4	W889 C901	C885-W889 HydrophobicContact CB-CB 4.03Å; C885-C901 WeakPolarHBondContact CA-SG 3.26Å; C885-C901 HydrophobicContact CB-CB 3.81Å; C885-C901 WeakPolarHBondContact CB-SG 3.46Å; C885-C901 VanDerWaalsContact SG-CA 3.57Å; C885-C901 WeakPolarHBondContact SG-CB 3.47Å; C885-C901 CovalentContact SG-SG 2.04Å; C885-C901 PolarHBondContact SG-SG 3.24Å
886	D	87.1	Confident	74.9	Confident	46 Å²	46	64.5 Å²	64.5	25%	0.246	36%	0.358	C	S	.	.	P	Polyproline II helix	trans	-66.5	159.3	-179.2	-69.3	-35.6	0	0	0	111.7	H871 S873 M888 W889	H871-D886 PolarHBondContact O-N 3.31Å; S873-D886 WeakPolarHBondContact CB-OD1 3.44Å; S873-D886 PolarHBondContact N-OD1 3.04Å; S873-D886 VanDerWaalsContact N-OD1 3.16Å; S873-D886 PolarHBondContact OG-OD1 2.85Å; D886-M888 PolarHBondContact O-N 3.04Å; D886-W889 WeakPolarHBondContact O-CB 3.44Å; D886-W889 PolarHBondContact O-N 3.06Å
887	P	79.3	Confident	74.3	Confident	118 Å²	118	62.2 Å²	62.2	77%	0.766	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.2	143.3	174.4	-26.5	35.2	0	0	0	111.8	W889	P887-W889 VanDerWaalsContact C-N 3.27Å; P887-W889 PolarHBondContact O-N 3.02Å
888	M	82.2	Confident	74.3	Confident	108 Å²	108	59.5 Å²	59.5	53%	0.532	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.8	-3.6	-171.3	-46.4	-161.4	98.4	0	0	116.3	D886 H904 T907 L910	D886-M888 PolarHBondContact O-N 3.04Å; M888-H904 VanDerWaalsContact O-CB 3.24Å; M888-H904 WeakPolarHBondContact O-CB 3.42Å; M888-H904 PolarHBondContact O-N 3.28Å; M888-T907 HydrophobicContact CB-CG2 3.84Å; M888-T907 WeakPolarHBondContact CB-OG1 3.42Å; M888-T907 HydrophobicContact CE-CG2 3.8Å; M888-T907 HydrophobicContact CG-CG2 4.47Å; M888-T907 PolarHBondContact O-OG1 3.25Å; M888-T907 HydrophobicContact SD-CG2 4.03Å; M888-L910 HydrophobicContact CE-CD1 4.45Å
889	W	84.4	Confident	74.7	Confident	74 Å²	74	55.7 Å²	55.7	28%	0.28	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	151.1	173.2	-59.6	79.5	0	0	0	112	H871 C885 D886 P887 C901 T902 L903	H871-W889 HydrophobicContact CB-CD2 3.6Å; H871-W889 HydrophobicContact CB-CE3 3.97Å; H871-W889 HydrophobicContact CB-CG 4Å; H871-W889 HydrophobicContact CB-CH2 4.33Å; H871-W889 HydrophobicContact CB-CZ2 3.96Å; H871-W889 HydrophobicContact CB-CZ3 4.32Å; H871-W889 AromaticContact CD2-CE2 3.94Å; H871-W889 AromaticContact CD2-CE3 3.97Å; H871-W889 AromaticContact CD2-CH2 3.14Å; H871-W889 WeakPolarHBondContact CD2-CH2 3.47Å; H871-W889 AromaticContact CD2-CZ2 3.42Å; H871-W889 VanDerWaalsContact CD2-CZ2 3.42Å; H871-W889 WeakPolarHBondContact CD2-CZ2 3.45Å; H871-W889 AromaticContact CD2-CZ3 3.43Å; H871-W889 VanDerWaalsContact CD2-CZ3 3.43Å; H871-W889 WeakPolarHBondContact CD2-CZ3 3.43Å; H871-W889 AromaticContact CE1-CH2 3.96Å; H871-W889 AromaticContact CE1-CZ2 3.73Å; H871-W889 AromaticContact CG-CD2 3.94Å; H871-W889 AromaticContact CG-CE2 3.5Å; H871-W889 AromaticContact CG-CH2 3.61Å; H871-W889 AromaticContact CG-CZ2 3.35Å; H871-W889 AromaticContact CG-CZ3 3.97Å; H871-W889 AromaticContact ND1-CE2 3.93Å; H871-W889 AromaticContact ND1-CZ2 3.57Å; H871-W889 AromaticContact NE2-CH2 3.38Å; H871-W889 WeakPolarHBondContact NE2-CH2 3.18Å; H871-W889 AromaticContact NE2-CZ2 3.63Å; C885-W889 HydrophobicContact CB-CB 4.03Å; D886-W889 WeakPolarHBondContact O-CB 3.44Å; D886-W889 PolarHBondContact O-N 3.06Å; P887-W889 VanDerWaalsContact C-N 3.27Å; P887-W889 PolarHBondContact O-N 3.02Å; W889-C901 HydrophobicContact CB-CB 4.24Å; W889-C901 HydrophobicContact CE3-CB 4.29Å; W889-T902 CarbonylContact C-O 3.53Å; W889-T902 WeakPolarHBondContact CA-O 3.35Å; W889-L903 HydrophobicContact CD2-CD1 3.94Å; W889-L903 HydrophobicContact CE3-CD1 4.2Å; W889-L903 HydrophobicContact CH2-CD1 3.75Å; W889-L903 HydrophobicContact CZ2-CD1 3.47Å; W889-L903 VanDerWaalsContact CZ2-CD1 3.47Å; W889-L903 HydrophobicContact CZ3-CD1 4.12Å
890	K	81.7	Confident	75.3	Confident	109 Å²	109	57.8 Å²	57.8	47%	0.474	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	134.4	175.3	-178.2	-174.1	168.6	-172.9	0	109.3	T902 H904	K890-T902 PolarHBondContact N-O 3.1Å; K890-T902 PolarHBondContact O-N 3.02Å; K890-T902 PolarHBondContact O-OG1 2.62Å; K890-H904 HydrophobicContact CB-CB 4.36Å
891	D	80.6	Confident	75.8	Confident	44 Å²	44	58.4 Å²	58.4	24%	0.235	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	132.6	168.9	-152.7	-36.2	0	0	0	111.8	N893 P897 G898	D891-N893 PolarHBondContact OD1-N 3.35Å; D891-P897 WeakPolarHBondContact OD2-CA 3.37Å; D891-P897 WeakPolarHBondContact OD2-CB 3.4Å; D891-G898 PolarHBondContact OD2-N 2.93Å
892	L	75.9	Confident	76.4	Confident	95 Å²	95	60.8 Å²	60.8	50%	0.497	34%	0.338	S	S	.	.	S	Bend	trans	-92.2	-18.3	171.3	-69.2	-172.3	0	0	0	113.7	P894 N900 T902	L892-P894 WeakPolarHBondContact O-CD 3.5Å; L892-N900 PolarHBondContact N-O 3.12Å; L892-N900 VanDerWaalsContact N-O 3.1Å; L892-T902 HydrophobicContact CD1-CG2 3.5Å; L892-T902 VanDerWaalsContact CD1-CG2 3.5Å; L892-T902 HydrophobicContact CG-CG2 3.88Å; L892-T902 WeakPolarHBondContact CG-OG1 3.06Å
893	N	67.7	Low	76.8	Confident	65 Å²	65	61.7 Å²	61.7	35%	0.348	34%	0.341	S	S	.	.			trans	-126.8	82.2	-164.7	-164.7	8.1	0	0	0	112.5	D891 S895 D896	D891-N893 PolarHBondContact OD1-N 3.35Å; N893-S895 PolarHBondContact O-N 3.11Å; N893-D896 CarbonylContact O-C 3.58Å; N893-D896 PolarHBondContact O-N 3.09Å
894	P	63.6	Low	77	Confident	123 Å²	123	65.8 Å²	65.8	80%	0.799	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-5	-176.3	27.7	-36.2	0	0	0	114.7	L892	L892-P894 WeakPolarHBondContact O-CD 3.5Å
895	S	58.1	Low	77	Confident	68 Å²	68	66.7 Å²	66.7	48%	0.476	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.8	-12.6	173.3	-60.1	0	0	0	0	114	N893	N893-S895 PolarHBondContact O-N 3.11Å
896	D	63.3	Low	76.9	Confident	18 Å²	18	67 Å²	67	10%	0.096	38%	0.375	C	S	.	.	S	Bend	trans	-152.6	67.5	-177.4	-166	9.4	0	0	0	108.8	L818 N893 K899	L818-D896 HydrophobicContact CD2-CB 4.34Å; N893-D896 CarbonylContact O-C 3.58Å; N893-D896 PolarHBondContact O-N 3.09Å; D896-K899 WeakPolarHBondContact O-CB 3.19Å; D896-K899 PolarHBondContact O-N 2.98Å; D896-K899 IonicContact OD1-NZ 3.01Å; D896-K899 PolarHBondContact OD1-NZ 3.33Å; D896-K899 VanDerWaalsContact OD2-CD 3.3Å; D896-K899 WeakPolarHBondContact OD2-CD 3.45Å; D896-K899 VanDerWaalsContact OD2-CE 3.24Å; D896-K899 WeakPolarHBondContact OD2-CE 3.4Å; D896-K899 IonicContact OD2-NZ 2.77Å; D896-K899 PolarHBondContact OD2-NZ 3.02Å
897	P	65.9	Low	76.7	Confident	49 Å²	49	65.3 Å²	65.3	32%	0.318	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.5	148.5	-164	26.4	-35.2	0	0	0	112.7	C883 D891 K899	C883-P897 WeakPolarHBondContact CB-O 3.41Å; C883-P897 CarbonylContact O-C 3.56Å; D891-P897 WeakPolarHBondContact OD2-CA 3.37Å; D891-P897 WeakPolarHBondContact OD2-CB 3.4Å; P897-K899 PolarHBondContact O-N 3.22Å
898	G	71.8	Confident	76.9	Confident	0 Å²	0	63.7 Å²	63.7	0%	0	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	69.7	9.4	-177	0	0	0	0	0	114.6	G869 A872 D891	G869-G898 WeakPolarHBondContact CA-O 3.18Å; G869-G898 PolarHBondContact N-O 3.13Å; A872-G898 WeakPolarHBondContact CB-O 3.41Å; D891-G898 PolarHBondContact OD2-N 2.93Å
899	K	73.6	Confident	77	Confident	77 Å²	77	60.8 Å²	60.8	34%	0.335	34%	0.343	S	S	.	.	S	Bend	trans	-92.3	-30.3	173.9	-169.9	173.7	-73.1	164.9	0	113.9	G869 D896 P897	G869-K899 WeakPolarHBondContact CA-O 3.27Å; D896-K899 WeakPolarHBondContact O-CB 3.19Å; D896-K899 PolarHBondContact O-N 2.98Å; D896-K899 IonicContact OD1-NZ 3.01Å; D896-K899 PolarHBondContact OD1-NZ 3.33Å; D896-K899 VanDerWaalsContact OD2-CD 3.3Å; D896-K899 WeakPolarHBondContact OD2-CD 3.45Å; D896-K899 VanDerWaalsContact OD2-CE 3.24Å; D896-K899 WeakPolarHBondContact OD2-CE 3.4Å; D896-K899 IonicContact OD2-NZ 2.77Å; D896-K899 PolarHBondContact OD2-NZ 3.02Å; P897-K899 PolarHBondContact O-N 3.22Å
900	N	79.2	Confident	77.1	Confident	86 Å²	86	62.5 Å²	62.5	46%	0.46	36%	0.357	S	S	.	.	S	Bend	trans	-132.2	80.9	-178.3	-165	10.5	0	0	0	111.4	L892	L892-N900 PolarHBondContact N-O 3.12Å; L892-N900 VanDerWaalsContact N-O 3.1Å
901	C	83.7	Confident	77.4	Confident	13 Å²	13	62.1 Å²	62.1	9%	0.088	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	132.9	-177.4	-58.7	0	0	0	0	110.8	C885 W889	C885-C901 WeakPolarHBondContact CA-SG 3.26Å; C885-C901 HydrophobicContact CB-CB 3.81Å; C885-C901 WeakPolarHBondContact CB-SG 3.46Å; C885-C901 VanDerWaalsContact SG-CA 3.57Å; C885-C901 WeakPolarHBondContact SG-CB 3.47Å; C885-C901 CovalentContact SG-SG 2.04Å; C885-C901 PolarHBondContact SG-SG 3.24Å; W889-C901 HydrophobicContact CB-CB 4.24Å; W889-C901 HydrophobicContact CE3-CB 4.29Å
902	T	87.1	Confident	77.8	Confident	50 Å²	50	63.5 Å²	63.5	31%	0.307	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	154.4	177	53.7	0	0	0	0	111.2	W889 K890 L892 H904	W889-T902 CarbonylContact C-O 3.53Å; W889-T902 WeakPolarHBondContact CA-O 3.35Å; K890-T902 PolarHBondContact N-O 3.1Å; K890-T902 PolarHBondContact O-N 3.02Å; K890-T902 PolarHBondContact O-OG1 2.62Å; L892-T902 HydrophobicContact CD1-CG2 3.5Å; L892-T902 VanDerWaalsContact CD1-CG2 3.5Å; L892-T902 HydrophobicContact CG-CG2 3.88Å; L892-T902 WeakPolarHBondContact CG-OG1 3.06Å; T902-H904 PolarHBondContact O-N 3.29Å
903	L	82.8	Confident	78.4	Confident	57 Å²	57	65.5 Å²	65.5	30%	0.298	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.3	127.4	-174.8	-146.6	76.9	0	0	0	110.6	W889 T907 I908 I911	W889-L903 HydrophobicContact CD2-CD1 3.94Å; W889-L903 HydrophobicContact CE3-CD1 4.2Å; W889-L903 HydrophobicContact CH2-CD1 3.75Å; W889-L903 HydrophobicContact CZ2-CD1 3.47Å; W889-L903 VanDerWaalsContact CZ2-CD1 3.47Å; W889-L903 HydrophobicContact CZ3-CD1 4.12Å; L903-T907 HydrophobicContact CD1-CG2 4.22Å; L903-T907 HydrophobicContact CD2-CG2 3.77Å; L903-T907 HydrophobicContact CG-CG2 3.81Å; L903-I908 HydrophobicContact CB-CD1 4.46Å; L903-I908 HydrophobicContact CB-CG1 4.21Å; L903-I908 HydrophobicContact CD2-CG1 3.85Å; L903-I908 HydrophobicContact CG-CG1 4.4Å; L903-I911 HydrophobicContact CD2-CD1 3.89Å
904	H	83.5	Confident	79.5	Confident	90 Å²	90	65.3 Å²	65.3	42%	0.417	38%	0.381	S	S	.	.			trans	-63	138.2	-177.3	-178.8	-99.9	0	0	0	110.4	M888 K890 T902 G906 T907 I908	M888-H904 VanDerWaalsContact O-CB 3.24Å; M888-H904 WeakPolarHBondContact O-CB 3.42Å; M888-H904 PolarHBondContact O-N 3.28Å; K890-H904 HydrophobicContact CB-CB 4.36Å; T902-H904 PolarHBondContact O-N 3.29Å; H904-G906 PolarHBondContact ND1-N 3.05Å; H904-G906 PolarHBondContact O-N 3.24Å; H904-G906 VanDerWaalsContact O-N 3.11Å; H904-T907 WeakPolarHBondContact O-CA 3.31Å; H904-T907 WeakPolarHBondContact O-CB 3.21Å; H904-T907 PolarHBondContact O-N 3.12Å; H904-T907 PolarHBondContact O-OG1 3.28Å; H904-I908 PolarHBondContact O-N 3.31Å
905	P	81.4	Confident	80.8	Confident	84 Å²	84	61.8 Å²	61.8	55%	0.545	36%	0.363	S	S	.	.	H	α-helix	trans	-56	-35	-174.8	-29.6	36.4	0	0	0	114.6	T907 I908 A909	P905-T907 VanDerWaalsContact C-N 3.3Å; P905-T907 PolarHBondContact O-N 3.06Å; P905-I908 PolarHBondContact O-N 3.32Å; P905-A909 PolarHBondContact O-N 3.14Å
906	G	81.7	Confident	82.5	Confident	34 Å²	34	62.6 Å²	62.6	35%	0.351	36%	0.361	S	S	.	.	H	α-helix	trans	-65.4	-29.2	173.6	0	0	0	0	0	114.1	H904 L910	H904-G906 PolarHBondContact ND1-N 3.05Å; H904-G906 PolarHBondContact O-N 3.24Å; H904-G906 VanDerWaalsContact O-N 3.11Å; G906-L910 WeakPolarHBondContact O-CB 3.3Å; G906-L910 PolarHBondContact O-N 3.03Å
907	T	84.2	Confident	83.9	Confident	9 Å²	9	67.2 Å²	67.2	6%	0.055	39%	0.385	C	S	.	.	H	α-helix	trans	-68.2	-45.9	172.5	-50.8	0	0	0	0	110.5	M888 L903 H904 P905 A909 L910 I911	M888-T907 HydrophobicContact CB-CG2 3.84Å; M888-T907 WeakPolarHBondContact CB-OG1 3.42Å; M888-T907 HydrophobicContact CE-CG2 3.8Å; M888-T907 HydrophobicContact CG-CG2 4.47Å; M888-T907 PolarHBondContact O-OG1 3.25Å; M888-T907 HydrophobicContact SD-CG2 4.03Å; L903-T907 HydrophobicContact CD1-CG2 4.22Å; L903-T907 HydrophobicContact CD2-CG2 3.77Å; L903-T907 HydrophobicContact CG-CG2 3.81Å; H904-T907 WeakPolarHBondContact O-CA 3.31Å; H904-T907 WeakPolarHBondContact O-CB 3.21Å; H904-T907 PolarHBondContact O-N 3.12Å; H904-T907 PolarHBondContact O-OG1 3.28Å; P905-T907 VanDerWaalsContact C-N 3.3Å; P905-T907 PolarHBondContact O-N 3.06Å; T907-A909 VanDerWaalsContact C-N 3.31Å; T907-A909 PolarHBondContact O-N 3.41Å; T907-L910 PolarHBondContact O-N 3.26Å; T907-I911 HydrophobicContact CG2-CD1 3.96Å; T907-I911 WeakPolarHBondContact O-CG1 3.39Å; T907-I911 PolarHBondContact O-N 3.03Å
908	I	83.6	Confident	85.2	Confident	85 Å²	85	70.3 Å²	70.3	44%	0.436	40%	0.398	S	S	.	.	H	α-helix	trans	-58.7	-46.7	176.5	-58.2	170.9	0	0	0	109.5	L903 H904 P905 L910 I911 V912	L903-I908 HydrophobicContact CB-CD1 4.46Å; L903-I908 HydrophobicContact CB-CG1 4.21Å; L903-I908 HydrophobicContact CD2-CG1 3.85Å; L903-I908 HydrophobicContact CG-CG1 4.4Å; H904-I908 PolarHBondContact O-N 3.31Å; P905-I908 PolarHBondContact O-N 3.32Å; I908-L910 PolarHBondContact O-N 2.92Å; I908-I911 PolarHBondContact O-N 3.3Å; I908-V912 WeakPolarHBondContact O-CG2 3.46Å; I908-V912 PolarHBondContact O-N 3.25Å
909	A	83.2	Confident	86.2	Confident	46 Å²	46	74 Å²	74	38%	0.38	42%	0.42	S	S	.	.	H	α-helix	trans	-59.3	-45.4	176	0	0	0	0	0	112.6	P905 T907 I911 V912 F913	P905-A909 PolarHBondContact O-N 3.14Å; T907-A909 VanDerWaalsContact C-N 3.31Å; T907-A909 PolarHBondContact O-N 3.41Å; A909-I911 PolarHBondContact O-N 3.42Å; A909-V912 PolarHBondContact O-N 2.97Å; A909-F913 WeakPolarHBondContact O-CD2 3.45Å; A909-F913 PolarHBondContact O-N 2.7Å
910	L	86.3	Confident	87.1	Confident	111 Å²	111	75 Å²	75	58%	0.581	43%	0.429	S	S	*	.	H	α-helix	trans	-61	-42.8	176.5	-91.9	167.5	0	0	0	112.9	M888 G906 T907 I908 F913 A914	M888-L910 HydrophobicContact CE-CD1 4.45Å; G906-L910 WeakPolarHBondContact O-CB 3.3Å; G906-L910 PolarHBondContact O-N 3.03Å; T907-L910 PolarHBondContact O-N 3.26Å; I908-L910 PolarHBondContact O-N 2.92Å; L910-F913 PolarHBondContact O-N 2.97Å; L910-A914 WeakPolarHBondContact O-CB 3.5Å; L910-A914 PolarHBondContact O-N 3.38Å
911	I	88.1	Confident	87.8	Confident	100 Å²	100	73.7 Å²	73.7	51%	0.513	43%	0.43	S	S	.	.	H	α-helix	trans	-63.3	-43.6	176.9	-68.2	166.5	0	0	0	110.5	L903 T907 I908 A909 A914 A915	L903-I911 HydrophobicContact CD2-CD1 3.89Å; T907-I911 HydrophobicContact CG2-CD1 3.96Å; T907-I911 WeakPolarHBondContact O-CG1 3.39Å; T907-I911 PolarHBondContact O-N 3.03Å; I908-I911 PolarHBondContact O-N 3.3Å; A909-I911 PolarHBondContact O-N 3.42Å; I911-A914 PolarHBondContact O-N 3.23Å; I911-A915 WeakPolarHBondContact O-CB 3.45Å; I911-A915 PolarHBondContact O-N 2.97Å
912	V	89.3	Confident	88.3	Confident	74 Å²	74	77.4 Å²	77.4	45%	0.448	45%	0.447	S	S	.	.	H	α-helix	trans	-64	-45	176.8	170.8	0	0	0	0	111.4	I908 A909 A914 A915 I916	I908-V912 WeakPolarHBondContact O-CG2 3.46Å; I908-V912 PolarHBondContact O-N 3.25Å; A909-V912 PolarHBondContact O-N 2.97Å; V912-A914 PolarHBondContact O-N 3.01Å; V912-A915 PolarHBondContact O-N 3.26Å; V912-I916 HydrophobicContact CG1-CD1 3.78Å; V912-I916 HydrophobicContact CG1-CG1 4.49Å; V912-I916 VanDerWaalsContact O-CG1 3.28Å; V912-I916 WeakPolarHBondContact O-CG1 3.08Å; V912-I916 PolarHBondContact O-N 3.24Å
913	F	89.2	Confident	88.6	Confident	137 Å²	137	80.1 Å²	80.1	60%	0.601	46%	0.459	S	S	*	.	H	α-helix	trans	-61.8	-42.5	175.1	-90.5	-70.3	0	0	0	112.5	A909 L910 I916 L917	A909-F913 WeakPolarHBondContact O-CD2 3.45Å; A909-F913 PolarHBondContact O-N 2.7Å; L910-F913 PolarHBondContact O-N 2.97Å; F913-I916 PolarHBondContact O-N 3.08Å; F913-L917 WeakPolarHBondContact O-CB 3.17Å; F913-L917 WeakPolarHBondContact O-CG 3.42Å; F913-L917 PolarHBondContact O-N 2.85Å
914	A	90.3	Very high	89	Confident	60 Å²	60	79.5 Å²	79.5	50%	0.496	46%	0.462	S	S	.	.	H	α-helix	trans	-63.1	-42.1	176.2	0	0	0	0	0	112.1	L910 I911 V912 L917 L918	L910-A914 WeakPolarHBondContact O-CB 3.5Å; L910-A914 PolarHBondContact O-N 3.38Å; I911-A914 PolarHBondContact O-N 3.23Å; V912-A914 PolarHBondContact O-N 3.01Å; A914-L917 PolarHBondContact O-N 3.03Å; A914-L918 WeakPolarHBondContact O-CB 3.44Å; A914-L918 PolarHBondContact O-N 2.96Å
915	A	91	Very high	89.4	Confident	50 Å²	50	80.3 Å²	80.3	41%	0.413	47%	0.469	S	S	.	.	H	α-helix	trans	-64.3	-41.6	175.9	0	0	0	0	0	112.4	I911 V912 L918 T919	I911-A915 WeakPolarHBondContact O-CB 3.45Å; I911-A915 PolarHBondContact O-N 2.97Å; V912-A915 PolarHBondContact O-N 3.26Å; A915-L918 PolarHBondContact O-N 2.94Å; A915-T919 WeakPolarHBondContact O-CB 3.47Å; A915-T919 PolarHBondContact O-N 3.24Å; A915-T919 PolarHBondContact O-OG1 3.07Å
916	I	92.9	Very high	89.9	Confident	85 Å²	85	80.5 Å²	80.5	44%	0.436	46%	0.464	S	S	.	.	H	α-helix	trans	-62.1	-47.5	175.2	-70.3	165.7	0	0	0	110.5	V912 F913 L918 T919 I920	V912-I916 HydrophobicContact CG1-CD1 3.78Å; V912-I916 HydrophobicContact CG1-CG1 4.49Å; V912-I916 VanDerWaalsContact O-CG1 3.28Å; V912-I916 WeakPolarHBondContact O-CG1 3.08Å; V912-I916 PolarHBondContact O-N 3.24Å; F913-I916 PolarHBondContact O-N 3.08Å; I916-L918 PolarHBondContact O-N 3.32Å; I916-T919 PolarHBondContact O-N 3.12Å; I916-I920 HydrophobicContact CG2-CD1 3.79Å; I916-I920 WeakPolarHBondContact O-CG1 3.37Å; I916-I920 PolarHBondContact O-N 2.97Å
917	L	92.7	Very high	90.4	Very high	115 Å²	115	85.1 Å²	85.1	60%	0.602	47%	0.472	S	S	*	.	H	α-helix	trans	-62.6	-41.5	178	-72.4	171.4	0	0	0	112.4	F913 A914 T919 I920 A921	F913-L917 WeakPolarHBondContact O-CB 3.17Å; F913-L917 WeakPolarHBondContact O-CG 3.42Å; F913-L917 PolarHBondContact O-N 2.85Å; A914-L917 PolarHBondContact O-N 3.03Å; L917-T919 VanDerWaalsContact C-N 3.34Å; L917-T919 PolarHBondContact O-N 3.03Å; L917-I920 PolarHBondContact O-N 2.6Å; L917-A921 WeakPolarHBondContact O-CB 3.36Å; L917-A921 PolarHBondContact O-N 3.48Å
918	L	93.9	Very high	90.7	Very high	114 Å²	114	91.1 Å²	91.1	60%	0.597	50%	0.498	S	S	*	.	H	α-helix	trans	-60.4	-44.2	173.9	-169.8	80	0	0	0	111.3	A914 A915 I916 A921 I922	A914-L918 WeakPolarHBondContact O-CB 3.44Å; A914-L918 PolarHBondContact O-N 2.96Å; A915-L918 PolarHBondContact O-N 2.94Å; I916-L918 PolarHBondContact O-N 3.32Å; L918-A921 PolarHBondContact O-N 3.47Å; L918-I922 HydrophobicContact CD2-CD1 4.4Å; L918-I922 HydrophobicContact CG-CD1 4.08Å; L918-I922 WeakPolarHBondContact O-CG1 3.33Å; L918-I922 PolarHBondContact O-N 3.31Å
919	T	92.2	Very high	90.8	Very high	76 Å²	76	91.7 Å²	91.7	47%	0.466	50%	0.501	S	S	.	.	H	α-helix	trans	-63.9	-43	179.4	-52	0	0	0	0	111.2	A915 I916 L917 A921 I922 I923	A915-T919 WeakPolarHBondContact O-CB 3.47Å; A915-T919 PolarHBondContact O-N 3.24Å; A915-T919 PolarHBondContact O-OG1 3.07Å; I916-T919 PolarHBondContact O-N 3.12Å; L917-T919 VanDerWaalsContact C-N 3.34Å; L917-T919 PolarHBondContact O-N 3.03Å; T919-A921 PolarHBondContact O-N 2.97Å; T919-I922 PolarHBondContact O-N 3.14Å; T919-I923 HydrophobicContact CG2-CD1 4.02Å; T919-I923 VanDerWaalsContact O-CG1 3.3Å; T919-I923 WeakPolarHBondContact O-CG1 3.43Å; T919-I923 PolarHBondContact O-N 3.18Å
920	I	93.4	Very high	91	Very high	100 Å²	100	94.8 Å²	94.8	51%	0.513	51%	0.51	S	S	.	.	H	α-helix	trans	-61.8	-43.1	174.6	-68.4	166	0	0	0	110.9	I916 L917 I922 I923 A924	I916-I920 HydrophobicContact CG2-CD1 3.79Å; I916-I920 WeakPolarHBondContact O-CG1 3.37Å; I916-I920 PolarHBondContact O-N 2.97Å; L917-I920 PolarHBondContact O-N 2.6Å; I920-I922 PolarHBondContact O-N 2.9Å; I920-I923 PolarHBondContact O-N 3.15Å; I920-A924 WeakPolarHBondContact O-CB 3.48Å; I920-A924 PolarHBondContact O-N 3.16Å
921	A	93.3	Very high	91	Very high	58 Å²	58	95.7 Å²	95.7	48%	0.479	51%	0.506	S	S	.	.	H	α-helix	trans	-62.8	-41.2	177.6	0	0	0	0	0	112.4	L917 L918 T919 A924 L925	L917-A921 WeakPolarHBondContact O-CB 3.36Å; L917-A921 PolarHBondContact O-N 3.48Å; L918-A921 PolarHBondContact O-N 3.47Å; T919-A921 PolarHBondContact O-N 2.97Å; A921-A924 PolarHBondContact O-N 2.87Å; A921-L925 WeakPolarHBondContact O-CB 3.45Å; A921-L925 PolarHBondContact O-N 2.67Å
922	I	94	Very high	90.6	Very high	90 Å²	90	94.1 Å²	94.1	46%	0.462	50%	0.501	S	S	.	.	H	α-helix	trans	-63.9	-46.2	175.3	-68.8	164	0	0	0	110.8	L918 T919 I920 A924 L925 I926	L918-I922 HydrophobicContact CD2-CD1 4.4Å; L918-I922 HydrophobicContact CG-CD1 4.08Å; L918-I922 WeakPolarHBondContact O-CG1 3.33Å; L918-I922 PolarHBondContact O-N 3.31Å; T919-I922 PolarHBondContact O-N 3.14Å; I920-I922 PolarHBondContact O-N 2.9Å; I922-A924 PolarHBondContact O-N 3.04Å; I922-L925 PolarHBondContact O-N 3.28Å; I922-I926 HydrophobicContact CG2-CD1 3.81Å; I922-I926 WeakPolarHBondContact O-CG1 3.24Å; I922-I926 PolarHBondContact O-N 3.18Å
923	I	93.2	Very high	90.2	Very high	107 Å²	107	94.9 Å²	94.9	55%	0.549	50%	0.499	S	S	.	.	H	α-helix	trans	-61	-44.1	177.3	-69.3	165.5	0	0	0	111	T919 I920 L925 I926 Y927	T919-I923 HydrophobicContact CG2-CD1 4.02Å; T919-I923 VanDerWaalsContact O-CG1 3.3Å; T919-I923 WeakPolarHBondContact O-CG1 3.43Å; T919-I923 PolarHBondContact O-N 3.18Å; I920-I923 PolarHBondContact O-N 3.15Å; I923-L925 PolarHBondContact O-N 3.4Å; I923-I926 PolarHBondContact O-N 3.37Å; I923-Y927 WeakPolarHBondContact O-CB 3.47Å; I923-Y927 PolarHBondContact O-N 3.4Å
924	A	91.7	Very high	89.6	Confident	44 Å²	44	91 Å²	91	36%	0.364	49%	0.49	S	S	.	.	H	α-helix	trans	-62.4	-41.2	177	0	0	0	0	0	112.1	I920 A921 I922 Y927 F928	I920-A924 WeakPolarHBondContact O-CB 3.48Å; I920-A924 PolarHBondContact O-N 3.16Å; A921-A924 PolarHBondContact O-N 2.87Å; I922-A924 PolarHBondContact O-N 3.04Å; A924-Y927 PolarHBondContact O-N 3.04Å; A924-F928 WeakPolarHBondContact O-CD2 3.15Å; A924-F928 PolarHBondContact O-N 3.15Å
925	L	92.7	Very high	88.9	Confident	107 Å²	107	92.3 Å²	92.3	56%	0.56	49%	0.487	S	S	*	.	H	α-helix	trans	-66.1	-43.2	178	-171.1	149.9	0	0	0	111.7	A921 I922 I923 F928 I929	A921-L925 WeakPolarHBondContact O-CB 3.45Å; A921-L925 PolarHBondContact O-N 2.67Å; I922-L925 PolarHBondContact O-N 3.28Å; I923-L925 PolarHBondContact O-N 3.4Å; L925-F928 PolarHBondContact O-N 3.21Å; L925-I929 HydrophobicContact CD2-CD1 3.67Å; L925-I929 HydrophobicContact CD2-CG1 4.47Å; L925-I929 WeakPolarHBondContact O-CG1 3.17Å; L925-I929 PolarHBondContact O-N 3.46Å
926	I	91.9	Very high	88.1	Confident	88 Å²	88	95.4 Å²	95.4	45%	0.451	49%	0.491	S	S	.	.	H	α-helix	trans	-60.5	-45.4	173.4	-68.3	166.2	0	0	0	110.7	I922 I923 F928 I929 I930	I922-I926 HydrophobicContact CG2-CD1 3.81Å; I922-I926 WeakPolarHBondContact O-CG1 3.24Å; I922-I926 PolarHBondContact O-N 3.18Å; I923-I926 PolarHBondContact O-N 3.37Å; I926-F928 VanDerWaalsContact C-N 3.34Å; I926-F928 PolarHBondContact O-N 3.06Å; I926-I929 PolarHBondContact O-N 3.05Å; I926-I930 HydrophobicContact CG2-CD1 3.82Å; I926-I930 WeakPolarHBondContact O-CG1 3.49Å; I926-I930 PolarHBondContact O-N 3.31Å
927	Y	91.9	Very high	87	Confident	131 Å²	131	97 Å²	97	51%	0.514	50%	0.497	S	S	.	.	H	α-helix	trans	-59.7	-42.6	176.1	176.6	-95.1	0	0	0	112.1	I923 A924 I929 I930 R931	I923-Y927 WeakPolarHBondContact O-CB 3.47Å; I923-Y927 PolarHBondContact O-N 3.4Å; A924-Y927 PolarHBondContact O-N 3.04Å; Y927-I929 PolarHBondContact O-N 3.39Å; Y927-I930 PolarHBondContact O-N 3.14Å; Y927-R931 VanDerWaalsContact O-CB 3.28Å; Y927-R931 WeakPolarHBondContact O-CB 3.43Å; Y927-R931 PolarHBondContact O-N 3.38Å
928	F	89.2	Confident	85.7	Confident	135 Å²	135	97 Å²	97	59%	0.592	50%	0.497	S	S	*	.	H	α-helix	trans	-62.8	-39.5	175.8	-98.4	-76.5	0	0	0	112.9	A924 L925 I926 T932	A924-F928 WeakPolarHBondContact O-CD2 3.15Å; A924-F928 PolarHBondContact O-N 3.15Å; L925-F928 PolarHBondContact O-N 3.21Å; I926-F928 VanDerWaalsContact C-N 3.34Å; I926-F928 PolarHBondContact O-N 3.06Å; F928-T932 WeakPolarHBondContact O-CB 3.26Å; F928-T932 PolarHBondContact O-N 2.89Å; F928-T932 PolarHBondContact O-OG1 3.44Å
929	I	87.3	Confident	84.3	Confident	97 Å²	97	99.6 Å²	99.6	50%	0.497	50%	0.499	S	S	.	.	H	α-helix	trans	-62.3	-52	175.2	-68.4	170	0	0	0	110.4	L925 I926 Y927 R931 T932 E933	L925-I929 HydrophobicContact CD2-CD1 3.67Å; L925-I929 HydrophobicContact CD2-CG1 4.47Å; L925-I929 WeakPolarHBondContact O-CG1 3.17Å; L925-I929 PolarHBondContact O-N 3.46Å; I926-I929 PolarHBondContact O-N 3.05Å; Y927-I929 PolarHBondContact O-N 3.39Å; I929-R931 VanDerWaalsContact C-N 3.31Å; I929-R931 PolarHBondContact O-N 3.1Å; I929-T932 WeakPolarHBondContact O-CB 3.45Å; I929-T932 PolarHBondContact O-N 3.1Å; I929-T932 VanDerWaalsContact O-N 3.07Å; I929-E933 PolarHBondContact O-N 3.47Å
930	I	86.4	Confident	82.8	Confident	111 Å²	111	101.6 Å²	101.6	57%	0.569	51%	0.506	S	S	*	.	H	α-helix	trans	-60.6	-40.4	-179.9	-64.6	167.8	0	0	0	111.3	I926 Y927 T932 S934	I926-I930 HydrophobicContact CG2-CD1 3.82Å; I926-I930 WeakPolarHBondContact O-CG1 3.49Å; I926-I930 PolarHBondContact O-N 3.31Å; Y927-I930 PolarHBondContact O-N 3.14Å; I930-T932 VanDerWaalsContact C-N 3.33Å; I930-T932 PolarHBondContact O-N 3.44Å; I930-S934 PolarHBondContact O-N 3.47Å; I930-S934 VanDerWaalsContact O-N 3.11Å; I930-S934 PolarHBondContact O-OG 3.08Å
931	R	85.6	Confident	81.2	Confident	131 Å²	131	104.2 Å²	104.2	49%	0.494	51%	0.514	S	S	.	.	H	α-helix	trans	-67.3	-33.3	176.5	-165.1	174.8	-174.9	-168.4	2.6	112.3	Y927 I929 S934 I935	Y927-R931 VanDerWaalsContact O-CB 3.28Å; Y927-R931 WeakPolarHBondContact O-CB 3.43Å; Y927-R931 PolarHBondContact O-N 3.38Å; I929-R931 VanDerWaalsContact C-N 3.31Å; I929-R931 PolarHBondContact O-N 3.1Å; R931-S934 WeakPolarHBondContact CA-OG 3.36Å; R931-S934 PolarHBondContact O-OG 3.17Å; R931-S934 VanDerWaalsContact O-OG 3.12Å; R931-I935 HydrophobicContact CG-CD1 4.11Å; R931-I935 WeakPolarHBondContact O-CB 3.47Å; R931-I935 WeakPolarHBondContact O-CD1 3.45Å; R931-I935 VanDerWaalsContact O-CG1 3.23Å; R931-I935 WeakPolarHBondContact O-CG1 3.34Å; R931-I935 PolarHBondContact O-N 2.81Å; R931-I935 VanDerWaalsContact O-N 3.09Å
932	T	81.8	Confident	79.6	Confident	67 Å²	67	109.1 Å²	109.1	41%	0.411	53%	0.526	S	S	.	.	H	α-helix	trans	-69.8	-43.6	177.5	-57.8	0	0	0	0	111.4	F928 I929 I930 I935 K936	F928-T932 WeakPolarHBondContact O-CB 3.26Å; F928-T932 PolarHBondContact O-N 2.89Å; F928-T932 PolarHBondContact O-OG1 3.44Å; I929-T932 WeakPolarHBondContact O-CB 3.45Å; I929-T932 PolarHBondContact O-N 3.1Å; I929-T932 VanDerWaalsContact O-N 3.07Å; I930-T932 VanDerWaalsContact C-N 3.33Å; I930-T932 PolarHBondContact O-N 3.44Å; T932-I935 PolarHBondContact O-N 3.02Å; T932-K936 WeakPolarHBondContact O-CG 3.43Å; T932-K936 PolarHBondContact O-N 3.19Å
933	E	79.4	Confident	78	Confident	89 Å²	89	112.3 Å²	112.3	42%	0.416	54%	0.541	S	S	.	.	H	α-helix	trans	-65.7	-40.3	176.4	-67.6	-49.3	126.8	0	0	112.9	I929 I935 K936 Q937	I929-E933 PolarHBondContact O-N 3.47Å; E933-I935 VanDerWaalsContact C-N 3.33Å; E933-I935 PolarHBondContact O-N 3.24Å; E933-K936 WeakPolarHBondContact O-CB 3.45Å; E933-K936 PolarHBondContact O-N 3.45Å; E933-K936 WeakPolarHBondContact OE1-CE 3.45Å; E933-K936 IonicContact OE1-NZ 2.65Å; E933-K936 PolarHBondContact OE1-NZ 3.49Å; E933-K936 WeakPolarHBondContact OE2-CD 3.46Å; E933-K936 IonicContact OE2-NZ 3.68Å; E933-Q937 WeakPolarHBondContact O-CG 3.47Å; E933-Q937 PolarHBondContact O-N 3.48Å
934	S	76.7	Confident	75.8	Confident	57 Å²	57	115.1 Å²	115.1	40%	0.399	56%	0.564	S	S	.	*	H	α-helix	trans	-66.5	-32.7	175.3	45.2	0	0	0	0	112.9	I930 R931 L938	I930-S934 PolarHBondContact O-N 3.47Å; I930-S934 VanDerWaalsContact O-N 3.11Å; I930-S934 PolarHBondContact O-OG 3.08Å; R931-S934 WeakPolarHBondContact CA-OG 3.36Å; R931-S934 PolarHBondContact O-OG 3.17Å; R931-S934 VanDerWaalsContact O-OG 3.12Å; S934-L938 WeakPolarHBondContact O-CB 3.45Å; S934-L938 WeakPolarHBondContact O-CG 3.47Å; S934-L938 PolarHBondContact O-N 3.47Å
935	I	75.4	Confident	75	Confident	87 Å²	87	118.7 Å²	118.7	45%	0.446	57%	0.574	S	S	.	*	H	α-helix	trans	-68.7	-38.6	171.5	-71.5	167.1	0	0	0	111.8	R931 T932 E933 L938 R939	R931-I935 HydrophobicContact CG-CD1 4.11Å; R931-I935 WeakPolarHBondContact O-CB 3.47Å; R931-I935 WeakPolarHBondContact O-CD1 3.45Å; R931-I935 VanDerWaalsContact O-CG1 3.23Å; R931-I935 WeakPolarHBondContact O-CG1 3.34Å; R931-I935 PolarHBondContact O-N 2.81Å; R931-I935 VanDerWaalsContact O-N 3.09Å; T932-I935 PolarHBondContact O-N 3.02Å; E933-I935 VanDerWaalsContact C-N 3.33Å; E933-I935 PolarHBondContact O-N 3.24Å; I935-L938 PolarHBondContact O-N 3.3Å; I935-R939 PolarHBondContact O-N 3.13Å
936	K	74.7	Confident	74.1	Confident	114 Å²	114	119.3 Å²	119.3	50%	0.496	58%	0.575	S	S	.	*	H	α-helix	trans	-60.7	-48	172.9	-71.6	170.2	179.1	174	0	111.4	T932 E933 L938 R939 L940	T932-K936 WeakPolarHBondContact O-CG 3.43Å; T932-K936 PolarHBondContact O-N 3.19Å; E933-K936 WeakPolarHBondContact O-CB 3.45Å; E933-K936 PolarHBondContact O-N 3.45Å; E933-K936 WeakPolarHBondContact OE1-CE 3.45Å; E933-K936 IonicContact OE1-NZ 2.65Å; E933-K936 PolarHBondContact OE1-NZ 3.49Å; E933-K936 WeakPolarHBondContact OE2-CD 3.46Å; E933-K936 IonicContact OE2-NZ 3.68Å; K936-L938 VanDerWaalsContact C-N 3.33Å; K936-L938 PolarHBondContact O-N 3.09Å; K936-R939 PolarHBondContact O-N 3.27Å; K936-L940 PolarHBondContact O-N 3.06Å
937	Q	69.5	Low	73.1	Confident	118 Å²	118	121.1 Å²	121.1	55%	0.551	58%	0.581	S	S	*	*	H	α-helix	trans	-58.8	-41.7	176.9	-72.8	-74.4	-9.7	0	0	112.3	E933 L940 K941	E933-Q937 WeakPolarHBondContact O-CG 3.47Å; E933-Q937 PolarHBondContact O-N 3.48Å; Q937-L940 PolarHBondContact O-N 3.4Å; Q937-K941 PolarHBondContact O-N 3.36Å
938	L	66.1	Low	72	Confident	115 Å²	115	120.5 Å²	120.5	60%	0.602	59%	0.585	S	S	*	*	H	α-helix	trans	-64.3	-41.4	175.6	-82.1	163.7	0	0	0	112.7	S934 I935 K936 K941 Q942	S934-L938 WeakPolarHBondContact O-CB 3.45Å; S934-L938 WeakPolarHBondContact O-CG 3.47Å; S934-L938 PolarHBondContact O-N 3.47Å; I935-L938 PolarHBondContact O-N 3.3Å; K936-L938 VanDerWaalsContact C-N 3.33Å; K936-L938 PolarHBondContact O-N 3.09Å; L938-K941 PolarHBondContact O-N 3.19Å; L938-Q942 PolarHBondContact O-N 3.47Å
939	R	64.3	Low	70.9	Confident	170 Å²	170	119.6 Å²	119.6	64%	0.642	59%	0.585	S	S	*	*	H	α-helix	trans	-68.7	-35	175.9	-78.1	-163.3	172.7	-157.2	-1.3	113.1	I935 K936 K941 Q942	I935-R939 PolarHBondContact O-N 3.13Å; K936-R939 PolarHBondContact O-N 3.27Å; R939-K941 VanDerWaalsContact C-N 3.31Å; R939-K941 PolarHBondContact O-N 3.14Å; R939-Q942 PolarHBondContact O-N 3.29Å; R939-Q942 VanDerWaalsContact O-N 3.1Å
940	L	59.6	Low	69.8	Low	117 Å²	117	121.1 Å²	121.1	61%	0.613	59%	0.591	S	S	*	*	H	α-helix	trans	-60.2	-44.2	174.4	-133.2	76.2	0	0	0	110.9	K936 Q937 Q942 M943	K936-L940 PolarHBondContact O-N 3.06Å; Q937-L940 PolarHBondContact O-N 3.4Å; L940-Q942 PolarHBondContact O-N 3.43Å; L940-M943 PolarHBondContact O-N 3.11Å
941	K	60.4	Low	68.6	Low	156 Å²	156	121.8 Å²	121.8	68%	0.678	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.4	-0	174.7	-73.1	-170.7	173.7	-172.1	0	115.6	Q937 L938 R939	Q937-K941 PolarHBondContact O-N 3.36Å; L938-K941 PolarHBondContact O-N 3.19Å; R939-K941 VanDerWaalsContact C-N 3.31Å; R939-K941 PolarHBondContact O-N 3.14Å
942	Q	61	Low	67.3	Low	160 Å²	160	121.1 Å²	121.1	75%	0.748	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.7	2.4	170	-70.5	-172.6	-52.5	0	0	112.5	L938 R939 L940	L938-Q942 PolarHBondContact O-N 3.47Å; R939-Q942 PolarHBondContact O-N 3.29Å; R939-Q942 VanDerWaalsContact O-N 3.1Å; L940-Q942 PolarHBondContact O-N 3.43Å
943	M	59.2	Low	66.1	Low	157 Å²	157	125.6 Å²	125.6	77%	0.773	62%	0.616	S	S	*	*			trans	-116	8.4	177.4	-63.2	-179.5	176.9	0	0	112.5	L940	L940-M943 PolarHBondContact O-N 3.11Å
944	T	47.5	Very low	64.9	Low	167 Å²	167	128.9 Å²	128.9	100%	1.025	63%	0.634	S	S	*	*			trans	-129.2	0	174.7	57.4	0	0	0	0	109.3

Retrieved 944 of 944 residues in 1435.1 ms (Link to these results)

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