A0A087YA37_POEFO Loading...

Immunoglobulin-like domain containing receptor 2

AlphaFold DB , UniProt , Accession A0A087YA37, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 629 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	53.2	Low	59.4	Low	203 Å²	203	137.5 Å²	137.5	100%	1	68%	0.677	S	S	*	*				0	-45.3	0	-64.1	-176.2	-167	0	0	113.8	N3 F4	M1-N3 VanDerWaalsContact C-N 3.28Å; M1-N3 PolarHBondContact O-N 2.91Å; M1-F4 PolarHBondContact O-N 2.66Å
2	M	51.5	Low	59	Low	153 Å²	153	129.6 Å²	129.6	75%	0.754	66%	0.657	S	S	*	*	H	α-helix	trans	-56.2	-29.8	-166	-153.7	143.4	66	0	0	116.5	R6	M2-R6 PolarHBondContact O-N 2.99Å
3	N	63	Low	58.5	Low	133 Å²	133	125.5 Å²	125.5	71%	0.711	66%	0.655	S	S	*	*	H	α-helix	trans	-69.3	-31.3	176.5	-69.5	6.8	0	0	0	113.6	M1 Y5 R6 L7	M1-N3 VanDerWaalsContact C-N 3.28Å; M1-N3 PolarHBondContact O-N 2.91Å; N3-Y5 VanDerWaalsContact C-N 3.35Å; N3-Y5 PolarHBondContact O-N 2.94Å; N3-R6 PolarHBondContact O-N 3.12Å; N3-L7 WeakPolarHBondContact O-CB 3.45Å; N3-L7 PolarHBondContact O-N 2.78Å
4	F	60.8	Low	57.8	Low	164 Å²	164	122.9 Å²	122.9	72%	0.719	65%	0.652	S	S	*	*	H	α-helix	trans	-66.5	-37.4	178.1	-87.7	-85.9	0	0	0	111.8	M1 L7 A8	M1-F4 PolarHBondContact O-N 2.66Å; F4-L7 PolarHBondContact O-N 3.19Å; F4-A8 VanDerWaalsContact O-CB 3.23Å; F4-A8 WeakPolarHBondContact O-CB 3.39Å; F4-A8 PolarHBondContact O-N 2.94Å
5	Y	60.8	Low	57.2	Low	178 Å²	178	121.8 Å²	121.8	70%	0.698	65%	0.652	S	S	*	*	H	α-helix	trans	-67	-38.9	173.9	-78.1	-83.1	0	0	0	112.2	N3 A8 V9	N3-Y5 VanDerWaalsContact C-N 3.35Å; N3-Y5 PolarHBondContact O-N 2.94Å; Y5-A8 PolarHBondContact O-N 3.37Å; Y5-V9 WeakPolarHBondContact O-CB 3.07Å; Y5-V9 VanDerWaalsContact O-CG2 3.26Å; Y5-V9 WeakPolarHBondContact O-CG2 3.42Å; Y5-V9 PolarHBondContact O-N 3.32Å
6	R	59.2	Low	56.7	Low	184 Å²	184	120.1 Å²	120.1	69%	0.694	65%	0.651	S	S	*	*	H	α-helix	trans	-66.3	-39.6	173.3	-74.2	-171.5	172.2	-167.5	-2.7	112.5	M2 N3 V9 L10	M2-R6 PolarHBondContact O-N 2.99Å; N3-R6 PolarHBondContact O-N 3.12Å; R6-V9 PolarHBondContact O-N 2.84Å; R6-L10 WeakPolarHBondContact O-CB 3.44Å; R6-L10 WeakPolarHBondContact O-CG 3.45Å; R6-L10 PolarHBondContact O-N 3.21Å
7	L	63.2	Low	56.2	Low	99 Å²	99	119.6 Å²	119.6	52%	0.518	65%	0.653	S	S	.	*	H	α-helix	trans	-66	-43.1	175.2	-162.8	77.5	0	0	0	111.5	N3 F4 L10 L11	N3-L7 WeakPolarHBondContact O-CB 3.45Å; N3-L7 PolarHBondContact O-N 2.78Å; F4-L7 PolarHBondContact O-N 3.19Å; L7-L10 PolarHBondContact O-N 3.22Å; L7-L11 HydrophobicContact CD2-CD1 4.35Å; L7-L11 HydrophobicContact CG-CD1 4.06Å; L7-L11 WeakPolarHBondContact O-CB 3.3Å; L7-L11 WeakPolarHBondContact O-CG 3.41Å; L7-L11 PolarHBondContact O-N 2.89Å
8	A	64.1	Low	56.1	Low	59 Å²	59	118.4 Å²	118.4	49%	0.488	65%	0.654	S	S	.	*	H	α-helix	trans	-66.2	-33.8	175.7	0	0	0	0	0	113	F4 Y5 G12	F4-A8 VanDerWaalsContact O-CB 3.23Å; F4-A8 WeakPolarHBondContact O-CB 3.39Å; F4-A8 PolarHBondContact O-N 2.94Å; Y5-A8 PolarHBondContact O-N 3.37Å; A8-G12 WeakPolarHBondContact O-CA 2.99Å; A8-G12 PolarHBondContact O-N 2.95Å
9	V	63.8	Low	56.5	Low	103 Å²	103	117.9 Å²	117.9	62%	0.624	65%	0.65	S	S	*	*	H	α-helix	trans	-72.4	-35.1	172.6	168.2	0	0	0	0	111.5	Y5 R6 G12 A13	Y5-V9 WeakPolarHBondContact O-CB 3.07Å; Y5-V9 VanDerWaalsContact O-CG2 3.26Å; Y5-V9 WeakPolarHBondContact O-CG2 3.42Å; Y5-V9 PolarHBondContact O-N 3.32Å; R6-V9 PolarHBondContact O-N 2.84Å; V9-G12 PolarHBondContact O-N 2.8Å; V9-A13 VanDerWaalsContact O-CB 3.27Å; V9-A13 WeakPolarHBondContact O-CB 3.49Å; V9-A13 PolarHBondContact O-N 2.74Å
10	L	57.6	Low	57.1	Low	122 Å²	122	113.3 Å²	113.3	64%	0.639	63%	0.63	S	S	*	*	H	α-helix	trans	-71	-39.8	173.4	-75.1	165.8	0	0	0	112.3	R6 L7 A13 S14	R6-L10 WeakPolarHBondContact O-CB 3.44Å; R6-L10 WeakPolarHBondContact O-CG 3.45Å; R6-L10 PolarHBondContact O-N 3.21Å; L7-L10 PolarHBondContact O-N 3.22Å; L10-A13 PolarHBondContact O-N 2.87Å; L10-S14 WeakPolarHBondContact O-CB 3.47Å; L10-S14 PolarHBondContact O-N 2.88Å
11	L	56.3	Low	58.4	Low	115 Å²	115	108.2 Å²	108.2	60%	0.602	60%	0.601	S	S	*	*	H	α-helix	trans	-69	-33.1	172.4	-72.1	165.6	0	0	0	112	L7 S14 V15	L7-L11 HydrophobicContact CD2-CD1 4.35Å; L7-L11 HydrophobicContact CG-CD1 4.06Å; L7-L11 WeakPolarHBondContact O-CB 3.3Å; L7-L11 WeakPolarHBondContact O-CG 3.41Å; L7-L11 PolarHBondContact O-N 2.89Å; L11-S14 CarbonylContact O-C 3.46Å; L11-S14 WeakPolarHBondContact O-CA 3.44Å; L11-S14 WeakPolarHBondContact O-CB 3.38Å; L11-S14 PolarHBondContact O-N 3.16Å; L11-V15 PolarHBondContact O-N 2.82Å
12	G	54.3	Low	60	Low	42 Å²	42	102.9 Å²	102.9	43%	0.433	57%	0.574	S	S	.	*	H	α-helix	trans	-74.6	-30	173.1	0	0	0	0	0	113.8	A8 V9 S14 V15	A8-G12 WeakPolarHBondContact O-CA 2.99Å; A8-G12 PolarHBondContact O-N 2.95Å; V9-G12 PolarHBondContact O-N 2.8Å; G12-S14 VanDerWaalsContact C-N 3.26Å; G12-V15 VanDerWaalsContact O-CB 3.29Å; G12-V15 WeakPolarHBondContact O-CB 3.46Å; G12-V15 WeakPolarHBondContact O-CG2 3.39Å; G12-V15 PolarHBondContact O-N 3.37Å; G12-V15 VanDerWaalsContact O-N 3.14Å
13	A	52.5	Low	61.8	Low	77 Å²	77	95.6 Å²	95.6	64%	0.636	54%	0.538	S	S	*	.	H	α-helix	trans	-73.8	-22.3	166	0	0	0	0	0	111.8	V9 L10	V9-A13 VanDerWaalsContact O-CB 3.27Å; V9-A13 WeakPolarHBondContact O-CB 3.49Å; V9-A13 PolarHBondContact O-N 2.74Å; L10-A13 PolarHBondContact O-N 2.87Å
14	S	48.5	Very low	63.1	Low	88 Å²	88	91.9 Å²	91.9	62%	0.615	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.8	20.5	164.2	-170.4	0	0	0	0	112.9	L10 L11 G12 C16	L10-S14 WeakPolarHBondContact O-CB 3.47Å; L10-S14 PolarHBondContact O-N 2.88Å; L11-S14 CarbonylContact O-C 3.46Å; L11-S14 WeakPolarHBondContact O-CA 3.44Å; L11-S14 WeakPolarHBondContact O-CB 3.38Å; L11-S14 PolarHBondContact O-N 3.16Å; G12-S14 VanDerWaalsContact C-N 3.26Å; S14-C16 PolarHBondContact O-N 3.48Å; S14-C16 VanDerWaalsContact O-N 3.08Å
15	V	49.9	Very low	64.6	Low	107 Å²	107	84.4 Å²	84.4	65%	0.648	49%	0.488	S	S	*	.	S	Bend	trans	-55.2	116.9	152.6	162.8	0	0	0	0	106.2	L11 G12 V17	L11-V15 PolarHBondContact O-N 2.82Å; G12-V15 VanDerWaalsContact O-CB 3.29Å; G12-V15 WeakPolarHBondContact O-CB 3.46Å; G12-V15 WeakPolarHBondContact O-CG2 3.39Å; G12-V15 PolarHBondContact O-N 3.37Å; G12-V15 VanDerWaalsContact O-N 3.14Å; V15-V17 PolarHBondContact O-N 2.84Å; V15-V17 VanDerWaalsContact O-N 3.08Å
16	C	48.3	Very low	65.8	Low	95 Å²	95	84.4 Å²	84.4	64%	0.642	49%	0.487	S	S	*	.			trans	-52.5	118.5	-171.6	-174.1	0	0	0	0	110.1	S14 C18	S14-C16 PolarHBondContact O-N 3.48Å; S14-C16 VanDerWaalsContact O-N 3.08Å; C16-C18 PolarHBondContact O-N 2.91Å; C16-C18 PolarHBondContact O-SG 3.25Å; C16-C18 VanDerWaalsContact SG-SG 3.69Å
17	V	48.4	Very low	67.2	Low	112 Å²	112	79 Å²	79	68%	0.679	47%	0.47	S	S	*	.			trans	-72	83.6	169	-176.7	0	0	0	0	106.4	V15 N19	V15-V17 PolarHBondContact O-N 2.84Å; V15-V17 VanDerWaalsContact O-N 3.08Å; V17-N19 PolarHBondContact O-N 3Å
18	C	54.5	Low	68.3	Low	98 Å²	98	78.9 Å²	78.9	66%	0.662	47%	0.465	S	S	*	.			trans	-67.1	83.4	176.3	-65.1	0	0	0	0	108.8	C16 G20	C16-C18 PolarHBondContact O-N 2.91Å; C16-C18 PolarHBondContact O-SG 3.25Å; C16-C18 VanDerWaalsContact SG-SG 3.69Å; C18-G20 PolarHBondContact O-N 3.21Å
19	N	63.4	Low	69.5	Low	109 Å²	109	80.8 Å²	80.8	58%	0.583	46%	0.462	S	S	*	.			trans	-64.6	89.4	165.7	-67.5	-37.5	0	0	0	107.5	V17 S47	V17-N19 PolarHBondContact O-N 3Å; N19-S47 WeakPolarHBondContact O-CB 3.29Å; N19-S47 PolarHBondContact O-OG 3.18Å
20	G	69.3	Low	70.7	Confident	24 Å²	24	80.3 Å²	80.3	25%	0.247	45%	0.449	C	S	.	.			trans	-66.2	159	172.9	0	0	0	0	0	111.2	C18 H22 D150 V152	C18-G20 PolarHBondContact O-N 3.21Å; G20-H22 PolarHBondContact O-N 3.47Å; G20-D150 WeakPolarHBondContact CA-OD1 3.32Å; G20-V152 WeakPolarHBondContact CA-O 3.42Å
21	M	83.9	Confident	72.2	Confident	7 Å²	7	80.1 Å²	80.1	3%	0.034	44%	0.441	C	S	.	.			trans	-53.8	121.5	-170.1	178.9	179	51.9	0	0	112.6	Q45 V145 V147 D150 G153 N154	M21-Q45 WeakPolarHBondContact CA-O 3.16Å; M21-V145 VanDerWaalsContact CE-O 3.3Å; M21-V145 WeakPolarHBondContact CE-O 3.3Å; M21-V145 HydrophobicContact SD-CB 3.92Å; M21-V145 HydrophobicContact SD-CG1 3.87Å; M21-V145 VanDerWaalsContact SD-O 3.35Å; M21-V147 HydrophobicContact SD-CG2 3.87Å; M21-D150 WeakPolarHBondContact CB-OD2 3.36Å; M21-D150 WeakPolarHBondContact CE-O 3.38Å; M21-D150 VanDerWaalsContact N-CG 3.31Å; M21-D150 PolarHBondContact N-OD1 3.36Å; M21-D150 PolarHBondContact N-OD2 3.45Å; M21-D150 VanDerWaalsContact N-OD2 3.08Å; M21-G153 CarbonylContact O-C 3.13Å; M21-G153 VanDerWaalsContact O-CA 3.24Å; M21-G153 WeakPolarHBondContact O-CA 3.5Å; M21-N154 CarbonylContact O-C 3.49Å; M21-N154 PolarHBondContact O-N 3.23Å
22	H	86.8	Confident	73.9	Confident	91 Å²	91	75.2 Å²	75.2	42%	0.421	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	125.6	176.2	-166.4	-58.4	0	0	0	110.9	G20 F44 Q45	G20-H22 PolarHBondContact O-N 3.47Å; H22-F44 WeakPolarHBondContact O-CA 3.31Å; H22-Q45 PolarHBondContact N-O 3.08Å; H22-Q45 PolarHBondContact O-N 2.6Å
23	V	90.4	Very high	75.5	Confident	0 Å²	0	77 Å²	77	0%	0	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	130.2	171.9	-178.7	0	0	0	0	109.7	C42 F44 C143 V145 N154 G155 D157	V23-C42 VanDerWaalsContact CG1-SG 3.51Å; V23-F44 HydrophobicContact CG2-CB 4.15Å; V23-C143 HydrophobicContact CG1-CB 4.22Å; V23-V145 HydrophobicContact CG2-CB 3.83Å; V23-V145 HydrophobicContact CG2-CG2 3.69Å; V23-N154 PolarHBondContact N-O 3.17Å; V23-G155 VanDerWaalsContact CG2-C 3.5Å; V23-G155 WeakPolarHBondContact CG2-O 3.47Å; V23-D157 HydrophobicContact CB-CB 4.31Å; V23-D157 HydrophobicContact CG1-CB 3.89Å
24	T	89.1	Confident	77.3	Confident	56 Å²	56	75.1 Å²	75.1	34%	0.344	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	115.4	174.6	44.4	0	0	0	0	111.1	Q43	T24-Q43 PolarHBondContact N-O 2.81Å; T24-Q43 PolarHBondContact O-N 2.78Å; T24-Q43 PolarHBondContact OG1-O 3.42Å
25	V	91.9	Very high	79.3	Confident	6 Å²	6	77.6 Å²	77.6	4%	0.036	39%	0.394	C	S	.	.			trans	-99.1	114.1	165.2	167.2	0	0	0	0	107.8	E27 K28 C42 C143 D157 M159	V25-E27 VanDerWaalsContact CG1-O 3.32Å; V25-E27 WeakPolarHBondContact CG1-O 3.45Å; V25-K28 PolarHBondContact O-NZ 2.71Å; V25-C42 HydrophobicContact CG2-CB 4.24Å; V25-C143 HydrophobicContact CG2-CB 4.12Å; V25-D157 HydrophobicContact CB-CB 4.22Å; V25-D157 WeakPolarHBondContact CB-OD2 3.38Å; V25-D157 HydrophobicContact CG2-CB 3.97Å; V25-D157 PolarHBondContact N-OD2 3.33Å; V25-M159 HydrophobicContact CG1-CB 3.86Å; V25-M159 HydrophobicContact CG1-CE 3.56Å; V25-M159 HydrophobicContact CG1-CG 4.45Å; V25-M159 HydrophobicContact CG1-SD 4.26Å; V25-M159 HydrophobicContact CG2-CE 4.19Å
26	R	85.8	Confident	81.2	Confident	178 Å²	178	77.2 Å²	77.2	67%	0.672	39%	0.385	S	S	*	.	S	Bend	trans	-67.2	-39.1	-171.8	-66.4	-175.6	178.6	-158.9	-1.9	113.3	Q43	R26-Q43 VanDerWaalsContact CZ-OE1 3.31Å
27	E	88.6	Confident	83.3	Confident	72 Å²	72	76.1 Å²	76.1	34%	0.336	38%	0.378	S	S	.	.			trans	-112.3	117.4	-175.3	-66.9	170.7	-158.6	0	0	108.7	V25 K29 R30 M159	V25-E27 VanDerWaalsContact CG1-O 3.32Å; V25-E27 WeakPolarHBondContact CG1-O 3.45Å; E27-K29 VanDerWaalsContact C-N 3.33Å; E27-R30 VanDerWaalsContact CD-NH1 3.32Å; E27-R30 IonicContact OE1-NH1 3.87Å; E27-R30 PolarHBondContact OE1-NH1 2.98Å; E27-R30 WeakPolarHBondContact OE2-CD 3.37Å; E27-R30 IonicContact OE2-CZ 3.58Å; E27-R30 IonicContact OE2-NE 2.74Å; E27-R30 IonicContact OE2-NH1 2.77Å; E27-R30 PolarHBondContact OE2-NH1 2.9Å; E27-M159 WeakPolarHBondContact O-CB 3.09Å
28	K	87.4	Confident	85.5	Confident	95 Å²	95	71 Å²	71	41%	0.413	35%	0.347	S	S	.	.	S	Bend	trans	-80.3	-14.8	179.6	-61.2	-52.7	-176.3	-158	0	113.9	V25 D157 H158 M159 E160	V25-K28 PolarHBondContact O-NZ 2.71Å; K28-D157 IonicContact NZ-OD1 3.71Å; K28-D157 PolarHBondContact NZ-OD1 2.82Å; K28-D157 IonicContact NZ-OD2 2.72Å; K28-D157 PolarHBondContact NZ-OD2 2.86Å; K28-H158 WeakPolarHBondContact CD-O 3.44Å; K28-M159 CarbonylContact O-C 3.59Å; K28-M159 WeakPolarHBondContact O-CA 3.33Å; K28-E160 PolarHBondContact O-N 2.85Å
29	K	88.3	Confident	87.4	Confident	100 Å²	100	69.2 Å²	69.2	44%	0.435	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	134.6	175.1	-64.7	178.6	-179.9	-77.6	0	108.1	E27 Y31 E160	E27-K29 VanDerWaalsContact C-N 3.33Å; K29-Y31 HydrophobicContact CB-CE2 4.22Å; K29-E160 CarbonylContact C-O 3.49Å; K29-E160 WeakPolarHBondContact CA-O 3.21Å; K29-E160 HydrophobicContact CG-CB 4.3Å; K29-E160 IonicContact NZ-OE2 3.61Å; K29-E160 PolarHBondContact NZ-OE2 2.86Å
30	R	89.6	Confident	88.9	Confident	92 Å²	92	64 Å²	64	35%	0.347	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	134.6	172.4	-167.8	75.4	-162.6	-170	3.3	108.8	E27 V38 L40 E160 L161 L162	E27-R30 VanDerWaalsContact CD-NH1 3.32Å; E27-R30 IonicContact OE1-NH1 3.87Å; E27-R30 PolarHBondContact OE1-NH1 2.98Å; E27-R30 WeakPolarHBondContact OE2-CD 3.37Å; E27-R30 IonicContact OE2-CZ 3.58Å; E27-R30 IonicContact OE2-NE 2.74Å; E27-R30 IonicContact OE2-NH1 2.77Å; E27-R30 PolarHBondContact OE2-NH1 2.9Å; R30-V38 HydrophobicContact CG-CG2 3.83Å; R30-L40 HydrophobicContact CB-CD2 4.22Å; R30-L40 HydrophobicContact CG-CD2 4.18Å; R30-E160 PolarHBondContact N-O 2.79Å; R30-L161 HydrophobicContact CB-CD1 4.28Å; R30-L161 HydrophobicContact CG-CD1 4.4Å; R30-L161 WeakPolarHBondContact O-CA 3.5Å; R30-L162 PolarHBondContact O-N 2.97Å
31	Y	89.9	Confident	90.1	Very high	119 Å²	119	63.9 Å²	63.9	47%	0.467	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	145.4	173.3	-55.9	-84.8	0	0	0	108.8	K29 L162 L164	K29-Y31 HydrophobicContact CB-CE2 4.22Å; Y31-L162 HydrophobicContact CD1-CB 3.9Å; Y31-L162 HydrophobicContact CD1-CD2 4.01Å; Y31-L162 HydrophobicContact CD1-CG 4.43Å; Y31-L162 HydrophobicContact CE1-CB 4.06Å; Y31-L162 HydrophobicContact CE1-CD2 3.78Å; Y31-L164 HydrophobicContact CD1-CD1 4.46Å
32	A	90.2	Very high	90.6	Very high	11 Å²	11	63.7 Å²	63.7	9%	0.091	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.3	150.3	174.3	0	0	0	0	0	109.5	V38 L133 L162 V163 L164	A32-V38 HydrophobicContact CB-CB 4.14Å; A32-V38 HydrophobicContact CB-CG2 4.17Å; A32-L133 HydrophobicContact CB-CD1 3.35Å; A32-L162 PolarHBondContact N-O 3.05Å; A32-V163 WeakPolarHBondContact O-CA 3.41Å; A32-L164 PolarHBondContact O-N 3.36Å
33	M	89.6	Confident	90.9	Very high	79 Å²	79	63.1 Å²	63.1	39%	0.389	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	157	178.6	-57.1	-71.2	179.1	0	0	111.8	Q36 L164	M33-Q36 HydrophobicContact CB-CG 3.98Å; M33-Q36 WeakPolarHBondContact O-CB 3.46Å; M33-Q36 PolarHBondContact O-N 3.07Å; M33-Q36 VanDerWaalsContact O-N 3.16Å; M33-L164 CarbonylContact C-O 3.18Å; M33-L164 VanDerWaalsContact CA-O 3.3Å; M33-L164 WeakPolarHBondContact CA-O 3.35Å; M33-L164 HydrophobicContact CE-CD1 4.39Å; M33-L164 HydrophobicContact SD-CB 3.66Å; M33-L164 HydrophobicContact SD-CD1 4.47Å
34	L	90.3	Very high	90.9	Very high	38 Å²	38	65.1 Å²	65.1	20%	0.199	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-50.5	138.9	167.8	-168.2	73.3	0	0	0	111.2	Q36 W135 V163 L164	L34-Q36 PolarHBondContact O-N 2.76Å; L34-Q36 VanDerWaalsContact O-N 3.13Å; L34-W135 HydrophobicContact CD1-CD2 4.16Å; L34-W135 HydrophobicContact CD1-CG 3.85Å; L34-W135 HydrophobicContact CD2-CZ2 4.45Å; L34-V163 HydrophobicContact CB-CG1 4.37Å; L34-V163 HydrophobicContact CD1-CG1 4.13Å; L34-L164 PolarHBondContact N-O 3.09Å
35	F	89.3	Confident	90.8	Very high	141 Å²	141	69.4 Å²	69.4	62%	0.618	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	63	-1.5	-175.2	-48.6	-64.6	0	0	0	116.9	L133	F35-L133 WeakPolarHBondContact CA-O 3.37Å; F35-L133 PolarHBondContact N-O 2.83Å
36	Q	90.8	Very high	90.5	Very high	99 Å²	99	71.2 Å²	71.2	46%	0.463	33%	0.332	S	S	.	.			trans	-76.1	158.6	168.9	-70.1	-180	-22.9	0	0	111.6	M33 L34 L133	M33-Q36 HydrophobicContact CB-CG 3.98Å; M33-Q36 WeakPolarHBondContact O-CB 3.46Å; M33-Q36 PolarHBondContact O-N 3.07Å; M33-Q36 VanDerWaalsContact O-N 3.16Å; L34-Q36 PolarHBondContact O-N 2.76Å; L34-Q36 VanDerWaalsContact O-N 3.13Å; Q36-L133 WeakPolarHBondContact O-CB 3.23Å; Q36-L133 WeakPolarHBondContact O-CG 3.42Å; Q36-L133 PolarHBondContact O-N 2.84Å
37	S	92.3	Very high	90.3	Very high	71 Å²	71	66.7 Å²	66.7	50%	0.497	33%	0.328	S	S	.	.			trans	-87.2	136.2	167.5	73.2	0	0	0	0	111.1	I130 G131	S37-I130 CarbonylContact C-O 3.17Å; S37-I130 WeakPolarHBondContact CA-O 3.27Å; S37-G131 WeakPolarHBondContact CA-O 3.37Å; S37-G131 WeakPolarHBondContact CB-O 3.27Å; S37-G131 PolarHBondContact N-O 3.34Å
38	V	94	Very high	90	Very high	6 Å²	6	64.5 Å²	64.5	4%	0.036	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	148.1	174.3	71.1	0	0	0	0	111.1	R30 A32 L40 R129 I130 L133 L161	R30-V38 HydrophobicContact CG-CG2 3.83Å; A32-V38 HydrophobicContact CB-CB 4.14Å; A32-V38 HydrophobicContact CB-CG2 4.17Å; V38-L40 HydrophobicContact CG1-CD2 4.21Å; V38-L40 HydrophobicContact CG1-CG 4.45Å; V38-L40 HydrophobicContact CG2-CD2 3.93Å; V38-R129 WeakPolarHBondContact O-CA 3.47Å; V38-I130 HydrophobicContact CG1-CB 4.15Å; V38-I130 HydrophobicContact CG1-CD1 4.47Å; V38-I130 PolarHBondContact N-O 2.89Å; V38-I130 PolarHBondContact O-N 3.14Å; V38-L133 HydrophobicContact CB-CD1 3.94Å; V38-L133 HydrophobicContact CG1-CD1 3.78Å; V38-L133 HydrophobicContact CG1-CD2 3.87Å; V38-L133 HydrophobicContact CG1-CG 4.05Å; V38-L161 HydrophobicContact CG1-CD1 4.36Å; V38-L161 HydrophobicContact CG1-CD2 4.1Å; V38-L161 HydrophobicContact CG2-CD1 4.33Å
39	V	94.9	Very high	89.7	Confident	60 Å²	60	65.7 Å²	65.7	36%	0.364	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	125	167.6	-177	0	0	0	0	108.1	P41 D127 L128 R129	V39-P41 WeakPolarHBondContact O-CD 3.41Å; V39-D127 HydrophobicContact CG1-CB 3.92Å; V39-L128 CarbonylContact C-O 3.47Å; V39-L128 WeakPolarHBondContact CA-O 3.46Å; V39-R129 HydrophobicContact CG2-CB 4.16Å; V39-R129 HydrophobicContact CG2-CG 4.14Å
40	L	94.8	Very high	89.6	Confident	0 Å²	0	65.5 Å²	65.5	0%	0	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	103.9	179.9	-59	-173.9	0	0	0	108.3	R30 V38 W56 L128 I130 Y141 M159 L161	R30-L40 HydrophobicContact CB-CD2 4.22Å; R30-L40 HydrophobicContact CG-CD2 4.18Å; V38-L40 HydrophobicContact CG1-CD2 4.21Å; V38-L40 HydrophobicContact CG1-CG 4.45Å; V38-L40 HydrophobicContact CG2-CD2 3.93Å; L40-W56 HydrophobicContact CB-CH2 4.17Å; L40-L128 HydrophobicContact CB-CB 4.28Å; L40-L128 HydrophobicContact CD1-CD2 4.16Å; L40-L128 PolarHBondContact N-O 2.82Å; L40-L128 PolarHBondContact O-N 2.78Å; L40-I130 HydrophobicContact CD1-CD1 4.43Å; L40-Y141 HydrophobicContact CD1-CD1 3.68Å; L40-Y141 HydrophobicContact CD1-CD2 4.09Å; L40-Y141 HydrophobicContact CD1-CE1 4.09Å; L40-Y141 HydrophobicContact CD1-CE2 4.48Å; L40-Y141 HydrophobicContact CD1-CG 3.68Å; L40-M159 HydrophobicContact CB-CE 3.65Å; L40-M159 HydrophobicContact CB-SD 3.77Å; L40-M159 HydrophobicContact CD2-SD 3.8Å; L40-M159 HydrophobicContact CG-SD 4.23Å; L40-L161 HydrophobicContact CD1-CD2 4.26Å; L40-L161 HydrophobicContact CD2-CB 4.42Å; L40-L161 HydrophobicContact CD2-CD1 4.22Å; L40-L161 HydrophobicContact CD2-CD2 4.31Å
41	P	94.3	Very high	89.4	Confident	21 Å²	21	65 Å²	65	14%	0.136	35%	0.349	C	S	.	.			trans	-76.7	129.6	-167.9	29.3	-34.6	0	0	0	112.2	V39 D127	V39-P41 WeakPolarHBondContact O-CD 3.41Å; P41-D127 VanDerWaalsContact CA-OD1 3.31Å; P41-D127 WeakPolarHBondContact CA-OD1 3.44Å
42	C	93.6	Very high	89.4	Confident	2 Å²	2	61.2 Å²	61.2	1%	0.014	34%	0.339	C	S	.	.			trans	-137.2	121.6	173.7	178.9	0	0	0	0	110.8	V23 V25 W56 A126 D127 C143	V23-C42 VanDerWaalsContact CG1-SG 3.51Å; V25-C42 HydrophobicContact CG2-CB 4.24Å; C42-W56 HydrophobicContact CB-CH2 3.7Å; C42-W56 HydrophobicContact CB-CZ2 3.34Å; C42-A126 HydrophobicContact CB-CB 4.28Å; C42-A126 WeakPolarHBondContact O-CB 3.4Å; C42-D127 PolarHBondContact N-OD1 3.01Å; C42-C143 HydrophobicContact CB-CB 3.71Å; C42-C143 WeakPolarHBondContact CB-SG 3.35Å; C42-C143 WeakPolarHBondContact SG-CB 3.14Å; C42-C143 CovalentContact SG-SG 2.03Å; C42-C143 PolarHBondContact SG-SG 2.94Å
43	Q	93.1	Very high	89.5	Confident	80 Å²	80	62.3 Å²	62.3	37%	0.374	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	141.9	176.4	-64.3	-179.3	-11.4	0	0	108.5	T24 R26	T24-Q43 PolarHBondContact N-O 2.81Å; T24-Q43 PolarHBondContact O-N 2.78Å; T24-Q43 PolarHBondContact OG1-O 3.42Å; R26-Q43 VanDerWaalsContact CZ-OE1 3.31Å
44	F	90.2	Very high	89.7	Confident	41 Å²	41	58.8 Å²	58.8	18%	0.18	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	148.6	176.3	70.7	-90	0	0	0	110.5	H22 V23 T46 P52 V54 K125 A126 V145	H22-F44 WeakPolarHBondContact O-CA 3.31Å; V23-F44 HydrophobicContact CG2-CB 4.15Å; F44-T46 HydrophobicContact CD2-CG2 4.31Å; F44-T46 HydrophobicContact CE2-CG2 4.24Å; F44-P52 HydrophobicContact CE2-CB 3.96Å; F44-P52 HydrophobicContact CE2-CG 3.75Å; F44-P52 HydrophobicContact CZ-CB 4.12Å; F44-P52 HydrophobicContact CZ-CG 3.62Å; F44-V54 HydrophobicContact CE1-CG2 4.03Å; F44-K125 HydrophobicContact CE1-CB 3.93Å; F44-K125 HydrophobicContact CZ-CB 4.39Å; F44-A126 HydrophobicContact CD1-CB 3.7Å; F44-A126 HydrophobicContact CE1-CB 3.79Å; F44-V145 HydrophobicContact CB-CG2 3.95Å; F44-V145 HydrophobicContact CD1-CG2 4.06Å; F44-V145 HydrophobicContact CD2-CG1 4.06Å; F44-V145 HydrophobicContact CE2-CG1 4.4Å; F44-V145 HydrophobicContact CG-CG1 4.17Å; F44-V145 HydrophobicContact CG-CG2 4.01Å
45	Q	87.9	Confident	89.9	Confident	146 Å²	146	58.8 Å²	58.8	68%	0.682	33%	0.326	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-126.6	137.6	173	-59.4	-175.6	10.8	0	0	107.9	M21 H22	M21-Q45 WeakPolarHBondContact CA-O 3.16Å; H22-Q45 PolarHBondContact N-O 3.08Å; H22-Q45 PolarHBondContact O-N 2.6Å
46	T	85.8	Confident	90.1	Very high	44 Å²	44	52 Å²	52	27%	0.27	30%	0.297	S	S	.	.			trans	-148.3	151.5	176.6	173.7	0	0	0	0	107.7	F44 S48 V147 D150	F44-T46 HydrophobicContact CD2-CG2 4.31Å; F44-T46 HydrophobicContact CE2-CG2 4.24Å; T46-S48 PolarHBondContact OG1-N 2.84Å; T46-V147 HydrophobicContact CG2-CG2 4.28Å; T46-D150 WeakPolarHBondContact CB-OD2 3.34Å; T46-D150 PolarHBondContact OG1-OD2 2.97Å
47	S	81.6	Confident	90.3	Very high	83 Å²	83	50.7 Å²	50.7	58%	0.58	29%	0.287	S	S	*	.			trans	-95.5	-3.4	174.6	45.9	0	0	0	0	113.3	N19 D150	N19-S47 WeakPolarHBondContact O-CB 3.29Å; N19-S47 PolarHBondContact O-OG 3.18Å; S47-D150 PolarHBondContact N-OD2 3.37Å
48	S	81.8	Confident	90.3	Very high	26 Å²	26	48 Å²	48	18%	0.182	27%	0.266	C	S	.	.			trans	-77.2	147.6	178.8	-179.3	0	0	0	0	113	T46 K50	T46-S48 PolarHBondContact OG1-N 2.84Å; S48-K50 PolarHBondContact OG-N 2.88Å
49	S	81.3	Confident	90.1	Very high	120 Å²	120	48.5 Å²	48.5	84%	0.839	27%	0.268	S	S	*	.			trans	-90.1	-6.4	174.1	55.8	0	0	0	0	114.3
50	K	85.8	Confident	89.7	Confident	97 Å²	97	46.7 Å²	46.7	42%	0.422	26%	0.258	S	S	.	.	S	Bend	trans	-80	149.7	177.8	-74	-174.2	-171.7	161.4	0	111.5	S48 V147 A148 D149	S48-K50 PolarHBondContact OG-N 2.88Å; K50-V147 HydrophobicContact CB-CG1 4.24Å; K50-A148 HydrophobicContact CD-CB 4Å; K50-D149 WeakPolarHBondContact CD-OD2 3.43Å; K50-D149 WeakPolarHBondContact CE-OD1 3.14Å; K50-D149 WeakPolarHBondContact CE-OD2 3.35Å; K50-D149 WeakPolarHBondContact CG-OD2 3.11Å; K50-D149 VanDerWaalsContact NZ-CG 3.32Å; K50-D149 IonicContact NZ-OD1 2.66Å; K50-D149 PolarHBondContact NZ-OD1 2.8Å; K50-D149 IonicContact NZ-OD2 2.82Å; K50-D149 PolarHBondContact NZ-OD2 2.74Å
51	P	86.4	Confident	89	Confident	82 Å²	82	49.4 Å²	49.4	53%	0.532	27%	0.269	S	S	.	.	P	Polyproline II helix	trans	-62.1	126.4	179.5	24.6	-33.7	0	0	0	111
52	P	90.3	Very high	87.6	Confident	38 Å²	38	50 Å²	50	25%	0.247	27%	0.273	C	S	.	.	P	Polyproline II helix	trans	-74.6	143.8	177	30.7	-34.8	0	0	0	110.9	F44 V145 V147	F44-P52 HydrophobicContact CE2-CB 3.96Å; F44-P52 HydrophobicContact CE2-CG 3.75Å; F44-P52 HydrophobicContact CZ-CB 4.12Å; F44-P52 HydrophobicContact CZ-CG 3.62Å; P52-V145 HydrophobicContact CB-CG1 4.01Å; P52-V147 HydrophobicContact CB-CG2 3.87Å
53	V	91.9	Very high	86	Confident	35 Å²	35	59.2 Å²	59.2	21%	0.212	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	120.9	167.9	-175.5	0	0	0	0	108.3	Q55 K104 Q105 V145 I146	V53-Q55 HydrophobicContact CG1-CG 4.12Å; V53-K104 WeakPolarHBondContact CA-O 3.44Å; V53-Q105 HydrophobicContact CG2-CG 4.28Å; V53-V145 WeakPolarHBondContact O-CA 3.18Å; V53-I146 PolarHBondContact N-O 2.9Å; V53-I146 PolarHBondContact O-N 3.39Å
54	V	93.4	Very high	84	Confident	4 Å²	4	60.2 Å²	60.2	2%	0.024	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	120.1	179.1	-178.1	0	0	0	0	108.7	F44 S103 K104 A126 V145	F44-V54 HydrophobicContact CE1-CG2 4.03Å; V54-S103 CarbonylContact O-C 3.5Å; V54-S103 WeakPolarHBondContact O-CA 3.47Å; V54-K104 HydrophobicContact CB-CB 4.45Å; V54-K104 PolarHBondContact N-O 2.91Å; V54-K104 PolarHBondContact O-N 2.87Å; V54-A126 HydrophobicContact CG1-CB 3.72Å; V54-A126 HydrophobicContact CG2-CB 4.04Å; V54-V145 HydrophobicContact CG1-CG2 4.43Å; V54-V145 HydrophobicContact CG2-CG1 4.48Å; V54-V145 HydrophobicContact CG2-CG2 4.25Å
55	Q	94.1	Very high	82	Confident	38 Å²	38	61.1 Å²	61.1	18%	0.178	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	129.2	179.2	-60.6	-168.6	-28.9	0	0	111.2	V53 W57 K144	V53-Q55 HydrophobicContact CG1-CG 4.12Å; Q55-W57 VanDerWaalsContact OE1-NE1 3.16Å; Q55-K144 PolarHBondContact N-O 3.22Å; Q55-K144 PolarHBondContact O-N 2.81Å
56	W	94.8	Very high	80.2	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	125.6	171.9	-77.8	93.7	0	0	0	110.9	L40 C42 V101 A102 A126 L128 F142 C143 M159	L40-W56 HydrophobicContact CB-CH2 4.17Å; C42-W56 HydrophobicContact CB-CH2 3.7Å; C42-W56 HydrophobicContact CB-CZ2 3.34Å; W56-V101 HydrophobicContact CB-CB 4.27Å; W56-V101 PolarHBondContact O-N 2.88Å; W56-A102 PolarHBondContact N-O 2.86Å; W56-A126 WeakPolarHBondContact CZ2-O 3.35Å; W56-A126 PolarHBondContact NE1-O 3.16Å; W56-L128 HydrophobicContact CB-CD2 3.82Å; W56-L128 HydrophobicContact CD2-CB 3.73Å; W56-L128 HydrophobicContact CD2-CD2 3.78Å; W56-L128 HydrophobicContact CD2-CG 4.38Å; W56-L128 VanDerWaalsContact CE2-CB 3.44Å; W56-L128 HydrophobicContact CE3-CB 4.4Å; W56-L128 HydrophobicContact CE3-CD2 4.03Å; W56-L128 HydrophobicContact CG-CB 3.92Å; W56-L128 HydrophobicContact CG-CD2 3.71Å; W56-L128 HydrophobicContact CG-CG 4.3Å; W56-L128 HydrophobicContact CH2-CB 4.46Å; W56-L128 HydrophobicContact CZ2-CB 3.81Å; W56-F142 WeakPolarHBondContact CA-O 3.06Å; W56-C143 HydrophobicContact CD2-CB 4.3Å; W56-C143 HydrophobicContact CE3-CB 4.1Å; W56-C143 HydrophobicContact CH2-CB 3.64Å; W56-C143 HydrophobicContact CZ2-CB 3.84Å; W56-C143 HydrophobicContact CZ3-CB 3.76Å; W56-M159 HydrophobicContact CH2-CE 3.47Å; W56-M159 VanDerWaalsContact CH2-CE 3.47Å; W56-M159 HydrophobicContact CZ3-CE 3.78Å
57	W	93.1	Very high	78.4	Confident	70 Å²	70	64.9 Å²	64.9	27%	0.265	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	114	-177.1	-69.8	70.7	0	0	0	109.6	Q55 V98 R99 I100 F142	Q55-W57 VanDerWaalsContact OE1-NE1 3.16Å; W57-V98 HydrophobicContact CE3-CG1 3.62Å; W57-V98 HydrophobicContact CZ3-CG1 3.93Å; W57-R99 CarbonylContact C-O 3.49Å; W57-R99 WeakPolarHBondContact CA-O 3.2Å; W57-I100 HydrophobicContact CD2-CG1 3.92Å; W57-I100 HydrophobicContact CE3-CG1 4.08Å; W57-I100 HydrophobicContact CH2-CD1 4.03Å; W57-I100 HydrophobicContact CH2-CG1 3.99Å; W57-I100 HydrophobicContact CZ2-CD1 3.78Å; W57-I100 HydrophobicContact CZ2-CG1 3.8Å; W57-I100 HydrophobicContact CZ3-CG1 4.12Å; W57-F142 HydrophobicContact CB-CB 4.27Å; W57-F142 PolarHBondContact N-O 2.81Å; W57-F142 PolarHBondContact O-N 2.64Å
58	Y	92.4	Very high	76.6	Confident	15 Å²	15	63.9 Å²	63.9	6%	0.059	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	133.8	168.9	167.9	-92.5	0	0	0	109.5	V98 R99 V101 S138 Y141	Y58-V98 WeakPolarHBondContact O-CA 3.38Å; Y58-R99 HydrophobicContact CD1-CB 4.4Å; Y58-R99 PolarHBondContact N-O 3.48Å; Y58-R99 PolarHBondContact O-N 2.92Å; Y58-V101 VanDerWaalsContact CB-CG2 3.49Å; Y58-S138 PolarHBondContact OH-O 2.74Å; Y58-Y141 HydrophobicContact CD2-CD2 4.43Å; Y58-Y141 HydrophobicContact CD2-CE1 4.34Å; Y58-Y141 AromaticContact CD2-CE2 3.8Å; Y58-Y141 HydrophobicContact CD2-CE2 3.8Å; Y58-Y141 AromaticContact CD2-CZ 3.75Å; Y58-Y141 HydrophobicContact CE2-CE2 4.35Å
59	K	90.2	Very high	74.7	Confident	16 Å²	16	66.9 Å²	66.9	7%	0.07	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	128.6	166.9	-53.1	-162	-172.9	-175.6	0	109.4	D93 T97 V98 V140 F142	K59-D93 IonicContact NZ-OD1 2.68Å; K59-D93 PolarHBondContact NZ-OD1 3.41Å; K59-D93 IonicContact NZ-OD2 3.47Å; K59-D93 PolarHBondContact NZ-OD2 3.38Å; K59-T97 WeakPolarHBondContact CA-O 3.44Å; K59-V98 HydrophobicContact CD-CG2 4.01Å; K59-V98 HydrophobicContact CG-CG1 4.22Å; K59-V98 HydrophobicContact CG-CG2 4.03Å; K59-V140 PolarHBondContact N-O 2.82Å; K59-V140 PolarHBondContact O-N 2.7Å; K59-F142 HydrophobicContact CB-CE2 3.99Å; K59-F142 HydrophobicContact CD-CD2 3.99Å; K59-F142 HydrophobicContact CD-CE2 3.44Å; K59-F142 VanDerWaalsContact CD-CE2 3.44Å; K59-F142 HydrophobicContact CD-CZ 4.01Å; K59-F142 HydrophobicContact CG-CD2 3.84Å; K59-F142 HydrophobicContact CG-CE2 3.59Å
60	S	86.4	Confident	72.9	Confident	23 Å²	23	69.8 Å²	69.8	16%	0.161	36%	0.356	C	S	.	.			trans	-64.1	152.5	173	58	0	0	0	0	111.7	T97	S60-T97 VanDerWaalsContact CB-OG1 3.25Å; S60-T97 WeakPolarHBondContact CB-OG1 3.24Å; S60-T97 PolarHBondContact N-O 3Å; S60-T97 PolarHBondContact OG-N 3.41Å; S60-T97 PolarHBondContact OG-OG1 2.03Å
61	Y	80.4	Confident	70.8	Confident	57 Å²	57	68.8 Å²	68.8	22%	0.224	36%	0.361	C	S	.	.			trans	-52.4	146.3	175.1	-65.6	-72.8	0	0	0	113.6	V140 E160 L161	Y61-V140 HydrophobicContact CD1-CG2 4.35Å; Y61-V140 HydrophobicContact CE1-CG2 4.42Å; Y61-E160 HydrophobicContact CE1-CG 3.79Å; Y61-E160 VanDerWaalsContact CE1-OE1 3.25Å; Y61-E160 WeakPolarHBondContact CE1-OE1 3.42Å; Y61-E160 WeakPolarHBondContact OH-CG 3.44Å; Y61-E160 PolarHBondContact OH-OE1 3.18Å; Y61-E160 VanDerWaalsContact OH-OE1 3.09Å; Y61-L161 PolarHBondContact OH-O 2.7Å
62	C	64.9	Low	68.3	Low	33 Å²	33	72.4 Å²	72.4	22%	0.223	38%	0.375	C	S	.	.	S	Bend	trans	-97.7	-10.9	-177.1	-47.2	0	0	0	0	113.2	Q88 F91 R96	C62-Q88 PolarHBondContact SG-O 2.84Å; C62-F91 HydrophobicContact CB-CB 3.6Å; C62-F91 HydrophobicContact CB-CD1 3.81Å; C62-F91 HydrophobicContact CB-CG 3.88Å; C62-F91 VanDerWaalsContact SG-CB 3.52Å; C62-R96 PolarHBondContact SG-NH1 2.91Å
63	R	59.2	Low	66	Low	195 Å²	195	75.3 Å²	75.3	74%	0.736	39%	0.394	S	S	*	.	S	Bend	trans	-150.4	140.8	-178	-96	-74.9	-179.1	121.9	-1.9	107.7	S65	R63-S65 PolarHBondContact O-N 3.41Å; R63-S65 VanDerWaalsContact O-N 3.14Å
64	D	51.5	Low	63.4	Low	102 Å²	102	81.1 Å²	81.1	55%	0.545	42%	0.424	S	S	.	.			trans	-64.2	112.8	170.7	-50.5	-59.4	0	0	0	109.2	T66 R67	D64-T66 PolarHBondContact O-N 3.23Å; D64-R67 HydrophobicContact CB-CB 4.47Å; D64-R67 PolarHBondContact O-N 3.09Å
65	S	48.4	Very low	61.1	Low	60 Å²	60	87 Å²	87	42%	0.42	46%	0.46	S	S	.	.	H	α-helix	trans	-59.3	-31.7	179.5	-162.5	0	0	0	0	111.6	R63 R67 A68 S69	R63-S65 PolarHBondContact O-N 3.41Å; R63-S65 VanDerWaalsContact O-N 3.14Å; S65-R67 PolarHBondContact O-N 2.85Å; S65-A68 WeakPolarHBondContact O-CB 3.06Å; S65-A68 PolarHBondContact O-N 3.47Å; S65-S69 PolarHBondContact O-N 3.02Å
66	T	50.2	Low	58.4	Low	90 Å²	90	92.5 Å²	92.5	55%	0.552	49%	0.49	S	S	*	.	H	α-helix	trans	-57.4	-31.4	173.5	54.3	0	0	0	0	113.6	D64 A68 S69 F70	D64-T66 PolarHBondContact O-N 3.23Å; T66-A68 VanDerWaalsContact C-N 3.34Å; T66-S69 WeakPolarHBondContact CA-OG 3.36Å; T66-S69 PolarHBondContact O-N 3.09Å; T66-S69 PolarHBondContact O-OG 2.86Å; T66-F70 WeakPolarHBondContact O-CD2 3.01Å; T66-F70 PolarHBondContact O-N 2.83Å
67	R	48.3	Very low	56	Low	179 Å²	179	96.5 Å²	96.5	68%	0.675	53%	0.531	S	S	*	.	H	α-helix	trans	-74.6	-22.2	175.1	-95.6	-178.8	163.4	176.3	-3.9	113.3	D64 S65 S71	D64-R67 HydrophobicContact CB-CB 4.47Å; D64-R67 PolarHBondContact O-N 3.09Å; S65-R67 PolarHBondContact O-N 2.85Å; R67-S71 PolarHBondContact O-N 2.82Å
68	A	44.5	Very low	53.3	Low	61 Å²	61	103.2 Å²	103.2	50%	0.504	56%	0.558	S	S	.	*	H	α-helix	trans	-77.7	-31.3	173.6	0	0	0	0	0	112	S65 T66 F70 S71	S65-A68 WeakPolarHBondContact O-CB 3.06Å; S65-A68 PolarHBondContact O-N 3.47Å; T66-A68 VanDerWaalsContact C-N 3.34Å; A68-F70 VanDerWaalsContact C-N 3.3Å; A68-F70 PolarHBondContact O-N 3.28Å; A68-S71 WeakPolarHBondContact CA-OG 3.35Å; A68-S71 PolarHBondContact O-OG 3.39Å
69	S	42.2	Very low	50.8	Low	90 Å²	90	111.2 Å²	111.2	63%	0.629	59%	0.593	S	S	*	*	H	α-helix	trans	-73.5	-16.9	171.5	44.3	0	0	0	0	114.2	S65 T66	S65-S69 PolarHBondContact O-N 3.02Å; T66-S69 WeakPolarHBondContact CA-OG 3.36Å; T66-S69 PolarHBondContact O-N 3.09Å; T66-S69 PolarHBondContact O-OG 2.86Å
70	F	43.6	Very low	48.2	Very low	180 Å²	180	115.5 Å²	115.5	79%	0.789	63%	0.631	S	S	*	*	S	Bend	trans	-103.2	-5	174.1	-66.1	-56.9	0	0	0	114.4	T66 A68 L72	T66-F70 WeakPolarHBondContact O-CD2 3.01Å; T66-F70 PolarHBondContact O-N 2.83Å; A68-F70 VanDerWaalsContact C-N 3.3Å; A68-F70 PolarHBondContact O-N 3.28Å; F70-L72 PolarHBondContact O-N 2.82Å
71	S	39.9	Very low	45.9	Very low	76 Å²	76	118.1 Å²	118.1	53%	0.531	65%	0.65	S	S	.	*	S	Bend	trans	-78.3	110.3	168.3	50.2	0	0	0	0	109.8	R67 A68	R67-S71 PolarHBondContact O-N 2.82Å; A68-S71 WeakPolarHBondContact CA-OG 3.35Å; A68-S71 PolarHBondContact O-OG 3.39Å
72	L	33.9	Very low	43.9	Very low	158 Å²	158	125 Å²	125	83%	0.827	68%	0.684	S	S	*	*			trans	-51	136.8	169.7	-155.9	74.2	0	0	0	109.5	F70 D74	F70-L72 PolarHBondContact O-N 2.82Å; L72-D74 PolarHBondContact O-N 2.88Å
73	P	42	Very low	42.7	Very low	100 Å²	100	128.1 Å²	128.1	65%	0.649	70%	0.698	S	S	*	*			trans	-62.1	127.5	178.9	24.7	-34.4	0	0	0	110.6	T75	P73-T75 PolarHBondContact O-N 3.29Å
74	D	37.7	Very low	41.7	Very low	156 Å²	156	122 Å²	122	83%	0.834	70%	0.696	S	S	*	*			trans	-66.8	91.3	175.9	-96.9	-42.5	0	0	0	110.2	L72 L76	L72-D74 PolarHBondContact O-N 2.88Å; D74-L76 PolarHBondContact O-N 3.5Å
75	T	44.6	Very low	41.3	Very low	127 Å²	127	121 Å²	121	78%	0.779	70%	0.701	S	S	*	*			trans	-76.6	50.1	177.3	57.8	0	0	0	0	112.4	P73	P73-T75 PolarHBondContact O-N 3.29Å
76	L	38.2	Very low	41	Very low	154 Å²	154	121.3 Å²	121.3	81%	0.806	70%	0.701	S	S	*	*	S	Bend	trans	-134.2	92.7	168.2	-73.8	179.4	0	0	0	108.9	D74 Y78	D74-L76 PolarHBondContact O-N 3.5Å; L76-Y78 PolarHBondContact O-N 3Å
77	G	44.6	Very low	40.5	Very low	84 Å²	84	120.4 Å²	120.4	87%	0.866	70%	0.702	S	S	*	*			trans	-68.9	93.9	-173.6	0	0	0	0	0	113.9
78	Y	36.4	Very low	40.5	Very low	212 Å²	212	114.7 Å²	114.7	83%	0.831	68%	0.683	S	S	*	*	S	Bend	trans	-146.1	95.8	158.1	-134.3	-96	0	0	0	111.8	L76	L76-Y78 PolarHBondContact O-N 3Å
79	K	39.3	Very low	40.9	Very low	182 Å²	182	113.1 Å²	113.1	79%	0.791	67%	0.668	S	S	*	*			trans	55.3	51.9	173.7	-61.3	-167.4	174.7	-170.6	0	116.6	S81	K79-S81 PolarHBondContact O-N 2.91Å
80	A	36.2	Very low	41.5	Very low	107 Å²	107	116.7 Å²	116.7	88%	0.884	67%	0.674	S	S	*	*			trans	-68.2	90.8	143.4	0	0	0	0	0	107.8
81	S	38.5	Very low	42.2	Very low	78 Å²	78	112.8 Å²	112.8	55%	0.545	66%	0.657	S	S	.	*			trans	-64.9	164	-174.6	-59	0	0	0	0	113.1	K79 L83	K79-S81 PolarHBondContact O-N 2.91Å; S81-L83 PolarHBondContact O-N 3.22Å
82	E	37.6	Very low	42.9	Very low	200 Å²	200	112.3 Å²	112.3	94%	0.935	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.2	13.8	176.3	-62.6	156.5	115.3	0	0	114.8
83	L	40.1	Very low	44.4	Very low	100 Å²	100	108.4 Å²	108.4	52%	0.524	63%	0.634	S	S	.	*	T	Hydrogen-bonded Turn	trans	-90.3	7.1	-178.3	-85.6	70.8	0	0	0	113.8	S81 A85 T86 A87	S81-L83 PolarHBondContact O-N 3.22Å; L83-A85 PolarHBondContact O-N 3.43Å; L83-A85 VanDerWaalsContact O-N 3.08Å; L83-T86 PolarHBondContact O-N 3.49Å; L83-T86 VanDerWaalsContact O-N 3.08Å; L83-T86 PolarHBondContact O-OG1 2.79Å; L83-A87 PolarHBondContact O-N 3.25Å; L83-A87 VanDerWaalsContact O-N 3.1Å
84	G	38.2	Very low	45.4	Very low	67 Å²	67	108.7 Å²	108.7	69%	0.691	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.8	-27.6	-175.7	0	0	0	0	0	115
85	A	42.5	Very low	46.7	Very low	80 Å²	80	104.4 Å²	104.4	66%	0.661	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.1	-30.8	176.1	0	0	0	0	0	113.9	L83	L83-A85 PolarHBondContact O-N 3.43Å; L83-A85 VanDerWaalsContact O-N 3.08Å
86	T	41.8	Very low	48.2	Very low	66 Å²	66	99.7 Å²	99.7	41%	0.405	59%	0.588	S	S	.	*	T	Hydrogen-bonded Turn	trans	-86.2	-26.9	-173.9	51	0	0	0	0	113.2	L83 Q88 V89	L83-T86 PolarHBondContact O-N 3.49Å; L83-T86 VanDerWaalsContact O-N 3.08Å; L83-T86 PolarHBondContact O-OG1 2.79Å; T86-Q88 PolarHBondContact O-N 3.47Å; T86-V89 VanDerWaalsContact O-CB 3.3Å; T86-V89 WeakPolarHBondContact O-CB 3.42Å; T86-V89 WeakPolarHBondContact O-CG2 3.46Å; T86-V89 PolarHBondContact O-N 2.84Å
87	A	40.5	Very low	50.1	Low	71 Å²	71	95.4 Å²	95.4	59%	0.587	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.6	-16.6	-178.9	0	0	0	0	0	114.9	L83	L83-A87 PolarHBondContact O-N 3.25Å; L83-A87 VanDerWaalsContact O-N 3.1Å
88	Q	48.9	Very low	52.3	Low	59 Å²	59	93.7 Å²	93.7	28%	0.276	54%	0.541	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-24.9	172.3	-62.3	-168.6	-3.2	0	0	113.1	C62 T86	C62-Q88 PolarHBondContact SG-O 2.84Å; T86-Q88 PolarHBondContact O-N 3.47Å
89	V	52.1	Low	54.8	Low	29 Å²	29	87.9 Å²	87.9	18%	0.176	52%	0.518	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.2	-37.9	-175.2	-168.8	0	0	0	0	110.7	T86 F91 R96 F142 H158	T86-V89 VanDerWaalsContact O-CB 3.3Å; T86-V89 WeakPolarHBondContact O-CB 3.42Å; T86-V89 WeakPolarHBondContact O-CG2 3.46Å; T86-V89 PolarHBondContact O-N 2.84Å; V89-F91 PolarHBondContact O-N 2.8Å; V89-R96 PolarHBondContact O-NH1 2.78Å; V89-R96 PolarHBondContact O-NH2 3.05Å; V89-F142 HydrophobicContact CG1-CE1 3.72Å; V89-F142 HydrophobicContact CG1-CZ 3.68Å; V89-H158 WeakPolarHBondContact CG2-NE2 3.3Å
90	E	54.1	Low	57.3	Low	165 Å²	165	81.6 Å²	81.6	77%	0.771	49%	0.492	S	S	*	.			trans	-91.9	50	-165.7	-160.2	167	-144.6	0	0	113.8
91	F	58.2	Low	59.9	Low	98 Å²	98	76.5 Å²	76.5	43%	0.43	45%	0.45	S	S	.	.	S	Bend	trans	-107.7	150.9	167.9	-167.4	-124.4	0	0	0	110.3	C62 V89 D93 S95 R96	C62-F91 HydrophobicContact CB-CB 3.6Å; C62-F91 HydrophobicContact CB-CD1 3.81Å; C62-F91 HydrophobicContact CB-CG 3.88Å; C62-F91 VanDerWaalsContact SG-CB 3.52Å; V89-F91 PolarHBondContact O-N 2.8Å; F91-D93 PolarHBondContact O-N 3.08Å; F91-S95 WeakPolarHBondContact CE1-OG 3.35Å; F91-S95 WeakPolarHBondContact CZ-OG 3.3Å; F91-R96 VanDerWaalsContact O-CZ 3.27Å; F91-R96 PolarHBondContact O-NH2 3.44Å
92	S	56.4	Low	62.5	Low	66 Å²	66	72.8 Å²	72.8	46%	0.462	42%	0.424	S	S	.	.			trans	-61.1	130.8	-177.5	-174.1	0	0	0	0	111.7	S94 S95	S92-S94 WeakPolarHBondContact CB-OG 3.48Å; S92-S94 PolarHBondContact O-N 3.08Å; S92-S94 VanDerWaalsContact O-N 3.15Å; S92-S94 PolarHBondContact OG-N 3.14Å; S92-S94 PolarHBondContact OG-OG 3.31Å; S92-S95 PolarHBondContact O-N 2.76Å; S92-S95 VanDerWaalsContact O-N 3.1Å; S92-S95 PolarHBondContact O-OG 2.81Å
93	D	63.6	Low	65.2	Low	75 Å²	75	64.1 Å²	64.1	40%	0.401	39%	0.386	S	S	.	.	G	3₁₀ helix	trans	-62.3	-19.9	176.9	-78.2	-9.1	0	0	0	112.7	K59 F91 S95 R96 V98	K59-D93 IonicContact NZ-OD1 2.68Å; K59-D93 PolarHBondContact NZ-OD1 3.41Å; K59-D93 IonicContact NZ-OD2 3.47Å; K59-D93 PolarHBondContact NZ-OD2 3.38Å; F91-D93 PolarHBondContact O-N 3.08Å; D93-S95 PolarHBondContact O-N 3.5Å; D93-R96 IonicContact OD1-CZ 3.34Å; D93-R96 IonicContact OD1-NE 3.64Å; D93-R96 PolarHBondContact OD1-NE 2.89Å; D93-R96 IonicContact OD1-NH2 2.84Å; D93-R96 PolarHBondContact OD1-NH2 2.83Å; D93-V98 HydrophobicContact CB-CG2 4.17Å
94	S	64	Low	67.6	Low	106 Å²	106	60.9 Å²	60.9	74%	0.741	37%	0.367	S	S	*	.	G	3₁₀ helix	trans	-63.6	-18.2	173.5	61.5	0	0	0	0	114.6	S92	S92-S94 WeakPolarHBondContact CB-OG 3.48Å; S92-S94 PolarHBondContact O-N 3.08Å; S92-S94 VanDerWaalsContact O-N 3.15Å; S92-S94 PolarHBondContact OG-N 3.14Å; S92-S94 PolarHBondContact OG-OG 3.31Å
95	S	65.1	Low	70.1	Confident	66 Å²	66	63.2 Å²	63.2	46%	0.462	36%	0.36	S	S	.	.	G	3₁₀ helix	trans	-122.5	13.9	-169.5	34	0	0	0	0	113.7	F91 S92 D93	F91-S95 WeakPolarHBondContact CE1-OG 3.35Å; F91-S95 WeakPolarHBondContact CZ-OG 3.3Å; S92-S95 PolarHBondContact O-N 2.76Å; S92-S95 VanDerWaalsContact O-N 3.1Å; S92-S95 PolarHBondContact O-OG 2.81Å; D93-S95 PolarHBondContact O-N 3.5Å
96	R	75.1	Confident	72	Confident	29 Å²	29	66.5 Å²	66.5	11%	0.109	36%	0.362	C	S	.	.	S	Bend	trans	-135.8	156.9	173	56.9	-176.9	173.8	-168.2	-8	110.5	C62 V89 F91 D93 V98	C62-R96 PolarHBondContact SG-NH1 2.91Å; V89-R96 PolarHBondContact O-NH1 2.78Å; V89-R96 PolarHBondContact O-NH2 3.05Å; F91-R96 VanDerWaalsContact O-CZ 3.27Å; F91-R96 PolarHBondContact O-NH2 3.44Å; D93-R96 IonicContact OD1-CZ 3.34Å; D93-R96 IonicContact OD1-NE 3.64Å; D93-R96 PolarHBondContact OD1-NE 2.89Å; D93-R96 IonicContact OD1-NH2 2.84Å; D93-R96 PolarHBondContact OD1-NH2 2.83Å; R96-V98 HydrophobicContact CG-CG2 4.06Å; R96-V98 PolarHBondContact O-N 2.9Å
97	T	79.6	Confident	73.7	Confident	63 Å²	63	68.4 Å²	68.4	39%	0.387	38%	0.378	S	S	.	.			trans	-75.2	121.1	173.2	62.3	0	0	0	0	109.2	K59 S60	K59-T97 WeakPolarHBondContact CA-O 3.44Å; S60-T97 VanDerWaalsContact CB-OG1 3.25Å; S60-T97 WeakPolarHBondContact CB-OG1 3.24Å; S60-T97 PolarHBondContact N-O 3Å; S60-T97 PolarHBondContact OG-N 3.41Å; S60-T97 PolarHBondContact OG-OG1 2.03Å
98	V	89.5	Confident	75.7	Confident	48 Å²	48	67.7 Å²	67.7	29%	0.291	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	128.2	177	-179.6	0	0	0	0	108.1	W57 Y58 K59 D93 R96	W57-V98 HydrophobicContact CE3-CG1 3.62Å; W57-V98 HydrophobicContact CZ3-CG1 3.93Å; Y58-V98 WeakPolarHBondContact O-CA 3.38Å; K59-V98 HydrophobicContact CD-CG2 4.01Å; K59-V98 HydrophobicContact CG-CG1 4.22Å; K59-V98 HydrophobicContact CG-CG2 4.03Å; D93-V98 HydrophobicContact CB-CG2 4.17Å; R96-V98 HydrophobicContact CG-CG2 4.06Å; R96-V98 PolarHBondContact O-N 2.9Å
99	R	89.9	Confident	77.5	Confident	91 Å²	91	67.6 Å²	67.6	34%	0.343	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	138.5	-177.2	-59.7	179	-175.1	156	3.9	110	W57 Y58 H114	W57-R99 CarbonylContact C-O 3.49Å; W57-R99 WeakPolarHBondContact CA-O 3.2Å; Y58-R99 HydrophobicContact CD1-CB 4.4Å; Y58-R99 PolarHBondContact N-O 3.48Å; Y58-R99 PolarHBondContact O-N 2.92Å; R99-H114 PolarHBondContact NH1-CD2 2.94Å; R99-H114 PolarHBondContact NH1-NE2 3.17Å
100	I	90.8	Very high	79.2	Confident	50 Å²	50	69.9 Å²	69.9	26%	0.256	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	129.1	163.9	-61.2	173.8	0	0	0	106.8	W57 T112	W57-I100 HydrophobicContact CD2-CG1 3.92Å; W57-I100 HydrophobicContact CE3-CG1 4.08Å; W57-I100 HydrophobicContact CH2-CD1 4.03Å; W57-I100 HydrophobicContact CH2-CG1 3.99Å; W57-I100 HydrophobicContact CZ2-CD1 3.78Å; W57-I100 HydrophobicContact CZ2-CG1 3.8Å; W57-I100 HydrophobicContact CZ3-CG1 4.12Å; I100-T112 WeakPolarHBondContact O-CB 3.11Å; I100-T112 PolarHBondContact O-OG1 3.19Å
101	V	92.3	Very high	80.9	Confident	0 Å²	0	64.2 Å²	64.2	0%	0	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	-62.2	177.5	179.9	0	0	0	0	108.9	W56 Y58 Y115 V120 L128 Y141	W56-V101 HydrophobicContact CB-CB 4.27Å; W56-V101 PolarHBondContact O-N 2.88Å; Y58-V101 VanDerWaalsContact CB-CG2 3.49Å; V101-Y115 HydrophobicContact CB-CD2 4.39Å; V101-Y115 HydrophobicContact CB-CE2 4.21Å; V101-Y115 HydrophobicContact CG1-CD1 4.44Å; V101-Y115 HydrophobicContact CG1-CD2 4.15Å; V101-Y115 HydrophobicContact CG1-CE1 4.45Å; V101-Y115 HydrophobicContact CG1-CE2 4.17Å; V101-Y115 HydrophobicContact CG1-CG 4.3Å; V101-Y115 HydrophobicContact CG2-CE2 3.96Å; V101-V120 HydrophobicContact CG1-CG1 3.74Å; V101-L128 HydrophobicContact CG1-CD1 4.36Å; V101-L128 HydrophobicContact CG1-CD2 4.08Å; V101-Y141 HydrophobicContact CG2-CD1 4.35Å; V101-Y141 HydrophobicContact CG2-CE1 3.97Å
102	A	92.8	Very high	82.3	Confident	0 Å²	0	62.1 Å²	62.1	0%	0	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	144.1	179.3	0	0	0	0	0	110	W56 T110 L111 I122 L128	W56-A102 PolarHBondContact N-O 2.86Å; A102-T110 WeakPolarHBondContact CA-O 3.47Å; A102-L111 HydrophobicContact CB-CD2 3.61Å; A102-I122 HydrophobicContact CB-CD1 3.51Å; A102-I122 HydrophobicContact CB-CG1 3.83Å; A102-L128 HydrophobicContact CB-CD1 4.27Å
103	S	93.1	Very high	83.5	Confident	18 Å²	18	66.3 Å²	66.3	13%	0.126	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	118	175	174.2	0	0	0	0	108.9	V54 T110	V54-S103 CarbonylContact O-C 3.5Å; V54-S103 WeakPolarHBondContact O-CA 3.47Å; S103-T110 WeakPolarHBondContact CB-OG1 3.27Å; S103-T110 PolarHBondContact N-O 2.77Å; S103-T110 PolarHBondContact O-N 2.82Å; S103-T110 PolarHBondContact O-OG1 2.73Å
104	K	92.1	Very high	84.4	Confident	31 Å²	31	67.9 Å²	67.9	14%	0.135	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	126.1	178.9	-179	174.5	-178.1	175.4	0	110.5	V53 V54 S108 V109 I122 K125	V53-K104 WeakPolarHBondContact CA-O 3.44Å; V54-K104 HydrophobicContact CB-CB 4.45Å; V54-K104 PolarHBondContact N-O 2.91Å; V54-K104 PolarHBondContact O-N 2.87Å; K104-S108 VanDerWaalsContact CA-O 3.3Å; K104-S108 WeakPolarHBondContact CA-O 3.37Å; K104-V109 HydrophobicContact CB-CG2 4.31Å; K104-V109 HydrophobicContact CD-CG2 4.12Å; K104-V109 HydrophobicContact CG-CG2 4.06Å; K104-I122 HydrophobicContact CB-CB 4.18Å; K104-I122 HydrophobicContact CB-CD1 3.68Å; K104-I122 HydrophobicContact CB-CG2 4.18Å; K104-I122 HydrophobicContact CD-CB 3.84Å; K104-I122 HydrophobicContact CD-CG2 3.54Å; K104-I122 PolarHBondContact NZ-O 3.02Å; K104-K125 WeakPolarHBondContact CD-O 3.42Å; K104-K125 PolarHBondContact NZ-O 2.95Å
105	Q	89.6	Confident	85.4	Confident	117 Å²	117	62.9 Å²	62.9	55%	0.547	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	114.6	173.5	-178.6	169.8	7.1	0	0	107.8	V53 S107 S108	V53-Q105 HydrophobicContact CG2-CG 4.28Å; Q105-S107 PolarHBondContact O-N 2.99Å; Q105-S107 VanDerWaalsContact O-N 3.12Å; Q105-S108 PolarHBondContact N-O 3.34Å; Q105-S108 PolarHBondContact O-N 2.68Å; Q105-S108 PolarHBondContact O-OG 3.34Å
106	E	82.2	Confident	86.3	Confident	149 Å²	149	65.5 Å²	65.5	70%	0.696	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.2	-110.3	-175.7	-165.6	179.3	-179.5	0	0	111.9
107	S	77.1	Confident	86.8	Confident	105 Å²	105	71.7 Å²	71.7	73%	0.734	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.1	-18.8	176.1	57.1	0	0	0	0	113.4	Q105	Q105-S107 PolarHBondContact O-N 2.99Å; Q105-S107 VanDerWaalsContact O-N 3.12Å
108	S	83.3	Confident	87.3	Confident	57 Å²	57	70.8 Å²	70.8	40%	0.399	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	132	-177.1	69.7	0	0	0	0	111.6	K104 Q105	K104-S108 VanDerWaalsContact CA-O 3.3Å; K104-S108 WeakPolarHBondContact CA-O 3.37Å; Q105-S108 PolarHBondContact N-O 3.34Å; Q105-S108 PolarHBondContact O-N 2.68Å; Q105-S108 PolarHBondContact O-OG 3.34Å
109	V	87.6	Confident	87.3	Confident	57 Å²	57	72.1 Å²	72.1	35%	0.345	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	121.6	169.7	-179.5	0	0	0	0	107.8	K104 I122	K104-V109 HydrophobicContact CB-CG2 4.31Å; K104-V109 HydrophobicContact CD-CG2 4.12Å; K104-V109 HydrophobicContact CG-CG2 4.06Å; V109-I122 HydrophobicContact CG2-CB 4.4Å
110	T	87.5	Confident	87.4	Confident	77 Å²	77	67.9 Å²	67.9	47%	0.472	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	132.8	177.5	59.2	0	0	0	0	109.6	A102 S103	A102-T110 WeakPolarHBondContact CA-O 3.47Å; S103-T110 WeakPolarHBondContact CB-OG1 3.27Å; S103-T110 PolarHBondContact N-O 2.77Å; S103-T110 PolarHBondContact O-N 2.82Å; S103-T110 PolarHBondContact O-OG1 2.73Å
111	L	89.1	Confident	87.5	Confident	45 Å²	45	67.9 Å²	67.9	24%	0.236	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	135.8	180	-65.4	175.5	0	0	0	110.5	A102 K116 V120	A102-L111 HydrophobicContact CB-CD2 3.61Å; L111-K116 HydrophobicContact CB-CG 4.32Å; L111-V120 WeakPolarHBondContact CD1-O 3.38Å; L111-V120 HydrophobicContact CD2-CB 4.08Å; L111-V120 HydrophobicContact CD2-CG1 4.06Å; L111-V120 WeakPolarHBondContact CD2-O 3.47Å
112	T	86.8	Confident	87.6	Confident	55 Å²	55	68.2 Å²	68.2	34%	0.337	36%	0.36	S	S	.	.			trans	-66.9	149.9	172	-54.9	0	0	0	0	109.5	I100 H114 Y115 K116	I100-T112 WeakPolarHBondContact O-CB 3.11Å; I100-T112 PolarHBondContact O-OG1 3.19Å; T112-H114 PolarHBondContact O-N 2.81Å; T112-Y115 PolarHBondContact O-N 2.85Å; T112-K116 PolarHBondContact O-N 2.98Å
113	E	83.2	Confident	87.4	Confident	153 Å²	153	71.4 Å²	71.4	72%	0.715	38%	0.376	S	S	*	.	G	3₁₀ helix	trans	-45.4	-39.3	-175.6	-171	164.9	-140	0	0	115	Y115 K116	E113-Y115 PolarHBondContact O-N 3.06Å; E113-K116 PolarHBondContact O-N 2.9Å
114	H	81.6	Confident	87.1	Confident	109 Å²	109	76 Å²	76	51%	0.505	40%	0.399	S	S	.	.	G	3₁₀ helix	trans	-66.5	-15.8	178.5	-166.5	56.1	0	0	0	115.5	R99 T112	R99-H114 PolarHBondContact NH1-CD2 2.94Å; R99-H114 PolarHBondContact NH1-NE2 3.17Å; T112-H114 PolarHBondContact O-N 2.81Å
115	Y	84.7	Confident	86.8	Confident	1 Å²	1	82.2 Å²	82.2	0%	0.004	43%	0.426	C	S	.	.	G	3₁₀ helix	trans	-122.4	2.3	-177.8	-62.2	-77.6	0	0	0	113.4	V101 T112 E113 D117 R118 V120	V101-Y115 HydrophobicContact CB-CD2 4.39Å; V101-Y115 HydrophobicContact CB-CE2 4.21Å; V101-Y115 HydrophobicContact CG1-CD1 4.44Å; V101-Y115 HydrophobicContact CG1-CD2 4.15Å; V101-Y115 HydrophobicContact CG1-CE1 4.45Å; V101-Y115 HydrophobicContact CG1-CE2 4.17Å; V101-Y115 HydrophobicContact CG1-CG 4.3Å; V101-Y115 HydrophobicContact CG2-CE2 3.96Å; T112-Y115 PolarHBondContact O-N 2.85Å; E113-Y115 PolarHBondContact O-N 3.06Å; Y115-D117 VanDerWaalsContact C-N 3.31Å; Y115-D117 PolarHBondContact O-N 3.36Å; Y115-R118 PolarHBondContact O-N 3.4Å; Y115-V120 HydrophobicContact CD1-CG2 4.22Å
116	K	84.3	Confident	86.9	Confident	121 Å²	121	76.7 Å²	76.7	53%	0.526	40%	0.401	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-37.9	-178.4	-74.9	179.1	-174.4	167.9	0	113.4	L111 T112 E113 R118	L111-K116 HydrophobicContact CB-CG 4.32Å; T112-K116 PolarHBondContact O-N 2.98Å; E113-K116 PolarHBondContact O-N 2.9Å; K116-R118 VanDerWaalsContact C-N 3.25Å; K116-R118 PolarHBondContact O-N 3.19Å
117	D	86.3	Confident	87.5	Confident	158 Å²	158	70.3 Å²	70.3	85%	0.845	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91	19.9	-175.4	-51.6	-35.3	0	0	0	112.4	Y115	Y115-D117 VanDerWaalsContact C-N 3.31Å; Y115-D117 PolarHBondContact O-N 3.36Å
118	R	88.8	Confident	88.3	Confident	45 Å²	45	65.3 Å²	65.3	17%	0.17	34%	0.336	C	S	.	.	S	Bend	trans	-132	148.3	-176.8	-64	-178	65.6	-162.5	-4.4	110.6	Y115 K116 V120 E132 D137	Y115-R118 PolarHBondContact O-N 3.4Å; K116-R118 VanDerWaalsContact C-N 3.25Å; K116-R118 PolarHBondContact O-N 3.19Å; R118-V120 VanDerWaalsContact C-N 3.35Å; R118-V120 HydrophobicContact CB-CG2 4.07Å; R118-V120 PolarHBondContact O-N 3.05Å; R118-E132 PolarHBondContact NH2-O 2.91Å; R118-D137 IonicContact CZ-OD1 2.71Å; R118-D137 IonicContact CZ-OD2 3.17Å; R118-D137 IonicContact NH1-OD1 3.75Å; R118-D137 PolarHBondContact NH1-OD1 2.87Å; R118-D137 IonicContact NH1-OD2 3.61Å; R118-D137 PolarHBondContact NH1-OD2 3.17Å; R118-D137 IonicContact NH2-OD1 3.18Å; R118-D137 IonicContact NH2-OD2 2.81Å; R118-D137 PolarHBondContact NH2-OD2 3Å
119	D	90	Very high	88.8	Confident	76 Å²	76	65.7 Å²	65.7	41%	0.406	33%	0.329	S	S	.	.			trans	-69.6	89.8	172.4	178.5	13.9	0	0	0	110.3	R129 G131	D119-R129 IonicContact OD1-CZ 3.16Å; D119-R129 IonicContact OD1-NH1 2.76Å; D119-R129 PolarHBondContact OD1-NH1 2.84Å; D119-R129 IonicContact OD2-CZ 3.21Å; D119-R129 IonicContact OD2-NH1 2.71Å; D119-R129 PolarHBondContact OD2-NH1 2.85Å; D119-R129 IonicContact OD2-NH2 3.91Å; D119-R129 PolarHBondContact OD2-NH2 2.94Å; D119-G131 PolarHBondContact O-N 3.39Å
120	V	92.6	Very high	89.2	Confident	2 Å²	2	63 Å²	63	1%	0.012	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	121.8	177.7	-178	0	0	0	0	108.2	V101 L111 Y115 R118 L128 R129 I130	V101-V120 HydrophobicContact CG1-CG1 3.74Å; L111-V120 WeakPolarHBondContact CD1-O 3.38Å; L111-V120 HydrophobicContact CD2-CB 4.08Å; L111-V120 HydrophobicContact CD2-CG1 4.06Å; L111-V120 WeakPolarHBondContact CD2-O 3.47Å; Y115-V120 HydrophobicContact CD1-CG2 4.22Å; R118-V120 VanDerWaalsContact C-N 3.35Å; R118-V120 HydrophobicContact CB-CG2 4.07Å; R118-V120 PolarHBondContact O-N 3.05Å; V120-L128 HydrophobicContact CG1-CD1 3.71Å; V120-R129 WeakPolarHBondContact CA-O 3.31Å; V120-I130 HydrophobicContact CG1-CG1 4.42Å; V120-I130 HydrophobicContact CG2-CG2 4.4Å
121	T	92.6	Very high	89.4	Confident	49 Å²	49	59.8 Å²	59.8	30%	0.301	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	155	-169.2	43.9	0	0	0	0	112.5	R129	T121-R129 PolarHBondContact N-O 2.96Å; T121-R129 PolarHBondContact O-N 2.95Å
122	I	93.4	Very high	89.5	Confident	8 Å²	8	63.4 Å²	63.4	4%	0.041	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	105.5	178.8	-61.5	166.6	0	0	0	110.5	A102 K104 V109 D127 L128	A102-I122 HydrophobicContact CB-CD1 3.51Å; A102-I122 HydrophobicContact CB-CG1 3.83Å; K104-I122 HydrophobicContact CB-CB 4.18Å; K104-I122 HydrophobicContact CB-CD1 3.68Å; K104-I122 HydrophobicContact CB-CG2 4.18Å; K104-I122 HydrophobicContact CD-CB 3.84Å; K104-I122 HydrophobicContact CD-CG2 3.54Å; K104-I122 PolarHBondContact NZ-O 3.02Å; V109-I122 HydrophobicContact CG2-CB 4.4Å; I122-D127 CarbonylContact C-O 3.54Å; I122-D127 WeakPolarHBondContact CA-O 3.26Å; I122-L128 HydrophobicContact CG1-CD1 4.3Å
123	I	90.4	Very high	89.7	Confident	66 Å²	66	60.8 Å²	60.8	34%	0.338	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	176.5	-173.7	-54.8	-174	0	0	0	109.3	K125 A126 D127 R129	I123-K125 VanDerWaalsContact C-N 3.32Å; I123-K125 CarbonylContact O-C 3.58Å; I123-K125 PolarHBondContact O-N 3.13Å; I123-A126 PolarHBondContact O-N 3.39Å; I123-D127 PolarHBondContact N-O 3.44Å; I123-D127 PolarHBondContact O-N 2.8Å; I123-R129 HydrophobicContact CD1-CB 3.74Å; I123-R129 HydrophobicContact CD1-CG 4.3Å; I123-R129 HydrophobicContact CG1-CB 4.3Å
124	N	85.4	Confident	90.1	Very high	116 Å²	116	57.6 Å²	57.6	62%	0.62	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	43.7	47.8	166.7	-65.4	-19.1	0	0	0	115.7	A126 D127	N124-A126 PolarHBondContact O-N 2.88Å; N124-D127 HydrophobicContact CB-CB 4.13Å; N124-D127 WeakPolarHBondContact CB-OD2 3.44Å; N124-D127 PolarHBondContact ND2-OD2 3.4Å
125	K	86.7	Confident	90.2	Very high	161 Å²	161	59.9 Å²	59.9	70%	0.7	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.2	-65.4	-164.1	-46.6	176.5	-175.5	179.3	0	112.5	F44 K104 I123	F44-K125 HydrophobicContact CE1-CB 3.93Å; F44-K125 HydrophobicContact CZ-CB 4.39Å; K104-K125 WeakPolarHBondContact CD-O 3.42Å; K104-K125 PolarHBondContact NZ-O 2.95Å; I123-K125 VanDerWaalsContact C-N 3.32Å; I123-K125 CarbonylContact O-C 3.58Å; I123-K125 PolarHBondContact O-N 3.13Å
126	A	92	Very high	90.3	Very high	1 Å²	1	62.2 Å²	62.2	1%	0.008	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	-128	-7.9	-170.1	0	0	0	0	0	117.8	C42 F44 V54 W56 I123 N124 L128	C42-A126 HydrophobicContact CB-CB 4.28Å; C42-A126 WeakPolarHBondContact O-CB 3.4Å; F44-A126 HydrophobicContact CD1-CB 3.7Å; F44-A126 HydrophobicContact CE1-CB 3.79Å; V54-A126 HydrophobicContact CG1-CB 3.72Å; V54-A126 HydrophobicContact CG2-CB 4.04Å; W56-A126 WeakPolarHBondContact CZ2-O 3.35Å; W56-A126 PolarHBondContact NE1-O 3.16Å; I123-A126 PolarHBondContact O-N 3.39Å; N124-A126 PolarHBondContact O-N 2.88Å; A126-L128 PolarHBondContact O-N 2.95Å
127	D	94.2	Very high	90.5	Very high	15 Å²	15	56.6 Å²	56.6	8%	0.08	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	130	180	-65.6	-20.3	0	0	0	111.4	V39 P41 C42 I122 I123 N124	V39-D127 HydrophobicContact CG1-CB 3.92Å; P41-D127 VanDerWaalsContact CA-OD1 3.31Å; P41-D127 WeakPolarHBondContact CA-OD1 3.44Å; C42-D127 PolarHBondContact N-OD1 3.01Å; I122-D127 CarbonylContact C-O 3.54Å; I122-D127 WeakPolarHBondContact CA-O 3.26Å; I123-D127 PolarHBondContact N-O 3.44Å; I123-D127 PolarHBondContact O-N 2.8Å; N124-D127 HydrophobicContact CB-CB 4.13Å; N124-D127 WeakPolarHBondContact CB-OD2 3.44Å; N124-D127 PolarHBondContact ND2-OD2 3.4Å
128	L	93.9	Very high	90.7	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	117.6	177.7	170.4	63.5	0	0	0	110.7	V39 L40 W56 V101 A102 V120 I122 A126 I130 Y141	V39-L128 CarbonylContact C-O 3.47Å; V39-L128 WeakPolarHBondContact CA-O 3.46Å; L40-L128 HydrophobicContact CB-CB 4.28Å; L40-L128 HydrophobicContact CD1-CD2 4.16Å; L40-L128 PolarHBondContact N-O 2.82Å; L40-L128 PolarHBondContact O-N 2.78Å; W56-L128 HydrophobicContact CB-CD2 3.82Å; W56-L128 HydrophobicContact CD2-CB 3.73Å; W56-L128 HydrophobicContact CD2-CD2 3.78Å; W56-L128 HydrophobicContact CD2-CG 4.38Å; W56-L128 VanDerWaalsContact CE2-CB 3.44Å; W56-L128 HydrophobicContact CE3-CB 4.4Å; W56-L128 HydrophobicContact CE3-CD2 4.03Å; W56-L128 HydrophobicContact CG-CB 3.92Å; W56-L128 HydrophobicContact CG-CD2 3.71Å; W56-L128 HydrophobicContact CG-CG 4.3Å; W56-L128 HydrophobicContact CH2-CB 4.46Å; W56-L128 HydrophobicContact CZ2-CB 3.81Å; V101-L128 HydrophobicContact CG1-CD1 4.36Å; V101-L128 HydrophobicContact CG1-CD2 4.08Å; A102-L128 HydrophobicContact CB-CD1 4.27Å; V120-L128 HydrophobicContact CG1-CD1 3.71Å; I122-L128 HydrophobicContact CG1-CD1 4.3Å; A126-L128 PolarHBondContact O-N 2.95Å; L128-I130 HydrophobicContact CG-CG1 4.37Å; L128-Y141 HydrophobicContact CD2-CD1 3.88Å; L128-Y141 HydrophobicContact CD2-CE1 4.11Å
129	R	94.6	Very high	90.8	Very high	65 Å²	65	48.4 Å²	48.4	25%	0.245	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	134.8	169.3	179.8	171.5	165.2	-80.4	-9.1	110.5	V38 V39 D119 V120 T121 I123	V38-R129 WeakPolarHBondContact O-CA 3.47Å; V39-R129 HydrophobicContact CG2-CB 4.16Å; V39-R129 HydrophobicContact CG2-CG 4.14Å; D119-R129 IonicContact OD1-CZ 3.16Å; D119-R129 IonicContact OD1-NH1 2.76Å; D119-R129 PolarHBondContact OD1-NH1 2.84Å; D119-R129 IonicContact OD2-CZ 3.21Å; D119-R129 IonicContact OD2-NH1 2.71Å; D119-R129 PolarHBondContact OD2-NH1 2.85Å; D119-R129 IonicContact OD2-NH2 3.91Å; D119-R129 PolarHBondContact OD2-NH2 2.94Å; V120-R129 WeakPolarHBondContact CA-O 3.31Å; T121-R129 PolarHBondContact N-O 2.96Å; T121-R129 PolarHBondContact O-N 2.95Å; I123-R129 HydrophobicContact CD1-CB 3.74Å; I123-R129 HydrophobicContact CD1-CG 4.3Å; I123-R129 HydrophobicContact CG1-CB 4.3Å
130	I	94.4	Very high	90.9	Very high	1 Å²	1	45.2 Å²	45.2	1%	0.005	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	123.2	167.8	-58.4	169.3	0	0	0	106.3	S37 V38 L40 V120 L128 L133 Y141 L161	S37-I130 CarbonylContact C-O 3.17Å; S37-I130 WeakPolarHBondContact CA-O 3.27Å; V38-I130 HydrophobicContact CG1-CB 4.15Å; V38-I130 HydrophobicContact CG1-CD1 4.47Å; V38-I130 PolarHBondContact N-O 2.89Å; V38-I130 PolarHBondContact O-N 3.14Å; L40-I130 HydrophobicContact CD1-CD1 4.43Å; V120-I130 HydrophobicContact CG1-CG1 4.42Å; V120-I130 HydrophobicContact CG2-CG2 4.4Å; L128-I130 HydrophobicContact CG-CG1 4.37Å; I130-L133 HydrophobicContact CB-CD2 4.34Å; I130-L133 HydrophobicContact CD1-CD2 4.37Å; I130-L133 HydrophobicContact CG2-CD2 3.9Å; I130-L133 HydrophobicContact CG2-CG 4.45Å; I130-Y141 HydrophobicContact CD1-CE1 3.98Å; I130-L161 HydrophobicContact CD1-CD2 4.34Å
131	G	91.7	Very high	90.9	Very high	9 Å²	9	45.1 Å²	45.1	9%	0.093	23%	0.228	C	C	.	.	S	Bend	trans	-80.2	-45.2	-170	0	0	0	0	0	114.6	S37 D119	S37-G131 WeakPolarHBondContact CA-O 3.37Å; S37-G131 WeakPolarHBondContact CB-O 3.27Å; S37-G131 PolarHBondContact N-O 3.34Å; D119-G131 PolarHBondContact O-N 3.39Å
132	E	92.3	Very high	90.9	Very high	121 Å²	121	43.3 Å²	43.3	57%	0.565	22%	0.217	S	C	*	.	S	Bend	trans	-125	113.3	173.5	-69.2	-178.4	-179.9	0	0	109.1	R118	R118-E132 PolarHBondContact NH2-O 2.91Å
133	L	91.5	Very high	90.9	Very high	0 Å²	0	43 Å²	43	0%	0	22%	0.215	C	C	.	.			trans	-76.4	139.7	176.7	-77.8	171.2	0	0	0	113.4	A32 F35 Q36 V38 I130 D137 L161 V163	A32-L133 HydrophobicContact CB-CD1 3.35Å; F35-L133 WeakPolarHBondContact CA-O 3.37Å; F35-L133 PolarHBondContact N-O 2.83Å; Q36-L133 WeakPolarHBondContact O-CB 3.23Å; Q36-L133 WeakPolarHBondContact O-CG 3.42Å; Q36-L133 PolarHBondContact O-N 2.84Å; V38-L133 HydrophobicContact CB-CD1 3.94Å; V38-L133 HydrophobicContact CG1-CD1 3.78Å; V38-L133 HydrophobicContact CG1-CD2 3.87Å; V38-L133 HydrophobicContact CG1-CG 4.05Å; I130-L133 HydrophobicContact CB-CD2 4.34Å; I130-L133 HydrophobicContact CD1-CD2 4.37Å; I130-L133 HydrophobicContact CG2-CD2 3.9Å; I130-L133 HydrophobicContact CG2-CG 4.45Å; L133-D137 HydrophobicContact CD2-CB 4.06Å; L133-L161 HydrophobicContact CD2-CD2 3.85Å; L133-V163 HydrophobicContact CB-CG1 4.3Å; L133-V163 HydrophobicContact CB-CG2 4.39Å; L133-V163 HydrophobicContact CD1-CG2 4.38Å; L133-V163 HydrophobicContact CD2-CG2 4.06Å
134	Q	89.9	Confident	91	Very high	85 Å²	85	43.1 Å²	43.1	40%	0.397	21%	0.213	S	C	.	.			trans	-121.6	153.5	175.6	-62.9	177.8	0.6	0	0	109.6	G136 D137	Q134-G136 PolarHBondContact O-N 3.04Å; Q134-D137 PolarHBondContact N-OD2 2.97Å; Q134-D137 WeakPolarHBondContact O-CB 3.43Å; Q134-D137 PolarHBondContact O-N 3.35Å
135	W	84.7	Confident	91.3	Very high	157 Å²	157	37.7 Å²	37.7	60%	0.595	18%	0.184	S	C	*	.	G	3₁₀ helix	trans	-49.3	-36.2	178.6	-70.8	108.3	0	0	0	114.1	L34 D137 S138 G165	L34-W135 HydrophobicContact CD1-CD2 4.16Å; L34-W135 HydrophobicContact CD1-CG 3.85Å; L34-W135 HydrophobicContact CD2-CZ2 4.45Å; W135-D137 VanDerWaalsContact C-N 3.26Å; W135-D137 PolarHBondContact O-N 2.79Å; W135-S138 PolarHBondContact O-N 3Å; W135-S138 PolarHBondContact O-OG 2.99Å; W135-G165 VanDerWaalsContact CH2-CA 3.43Å
136	G	86.4	Confident	91.4	Very high	51 Å²	51	32.9 Å²	32.9	53%	0.526	17%	0.165	S	C	.	.	G	3₁₀ helix	trans	-74.8	-3.1	179.3	0	0	0	0	0	115.9	Q134	Q134-G136 PolarHBondContact O-N 3.04Å
137	D	89.8	Confident	91.3	Very high	3 Å²	3	32.9 Å²	32.9	2%	0.016	17%	0.165	C	C	.	.	G	3₁₀ helix	trans	-87	-7.7	172.6	-58.8	-46.1	0	0	0	112.6	R118 L133 Q134 W135 G139 Y141 V163	R118-D137 IonicContact CZ-OD1 2.71Å; R118-D137 IonicContact CZ-OD2 3.17Å; R118-D137 IonicContact NH1-OD1 3.75Å; R118-D137 PolarHBondContact NH1-OD1 2.87Å; R118-D137 IonicContact NH1-OD2 3.61Å; R118-D137 PolarHBondContact NH1-OD2 3.17Å; R118-D137 IonicContact NH2-OD1 3.18Å; R118-D137 IonicContact NH2-OD2 2.81Å; R118-D137 PolarHBondContact NH2-OD2 3Å; L133-D137 HydrophobicContact CD2-CB 4.06Å; Q134-D137 PolarHBondContact N-OD2 2.97Å; Q134-D137 WeakPolarHBondContact O-CB 3.43Å; Q134-D137 PolarHBondContact O-N 3.35Å; W135-D137 VanDerWaalsContact C-N 3.26Å; W135-D137 PolarHBondContact O-N 2.79Å; D137-G139 PolarHBondContact O-N 2.83Å; D137-Y141 VanDerWaalsContact O-CE2 3.27Å; D137-Y141 WeakPolarHBondContact O-CE2 3.47Å; D137-Y141 PolarHBondContact O-OH 2.98Å; D137-V163 HydrophobicContact CB-CG2 4.29Å
138	S	90.3	Very high	90.7	Very high	31 Å²	31	35.8 Å²	35.8	22%	0.217	19%	0.191	C	C	.	.			trans	-67.4	123.5	178.3	56.9	0	0	0	0	111.6	Y58 W135 L161	Y58-S138 PolarHBondContact OH-O 2.74Å; W135-S138 PolarHBondContact O-N 3Å; W135-S138 PolarHBondContact O-OG 2.99Å; S138-L161 WeakPolarHBondContact CA-O 3.35Å
139	G	90.3	Very high	90.1	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	165.5	-167.5	-173.9	0	0	0	0	0	114.8	D137 L161	D137-G139 PolarHBondContact O-N 2.83Å; G139-L161 PolarHBondContact N-O 2.72Å; G139-L161 PolarHBondContact O-N 2.92Å
140	V	91.4	Very high	89.2	Confident	8 Å²	8	37.8 Å²	37.8	5%	0.048	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	118.1	-178.2	-172.1	0	0	0	0	110	K59 Y61 F142 H158 M159	K59-V140 PolarHBondContact N-O 2.82Å; K59-V140 PolarHBondContact O-N 2.7Å; Y61-V140 HydrophobicContact CD1-CG2 4.35Å; Y61-V140 HydrophobicContact CE1-CG2 4.42Å; V140-F142 HydrophobicContact CB-CE2 4.06Å; V140-F142 HydrophobicContact CG1-CD2 4.14Å; V140-F142 HydrophobicContact CG1-CE2 3.51Å; V140-F142 HydrophobicContact CG1-CZ 3.91Å; V140-H158 HydrophobicContact CG1-CB 4.23Å; V140-M159 CarbonylContact C-O 3.59Å; V140-M159 WeakPolarHBondContact CA-O 3.25Å
141	Y	93.2	Very high	88	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	121.8	179.4	-73.5	-104.8	0	0	0	109.9	L40 Y58 V101 L128 I130 D137 H158 M159 L161	L40-Y141 HydrophobicContact CD1-CD1 3.68Å; L40-Y141 HydrophobicContact CD1-CD2 4.09Å; L40-Y141 HydrophobicContact CD1-CE1 4.09Å; L40-Y141 HydrophobicContact CD1-CE2 4.48Å; L40-Y141 HydrophobicContact CD1-CG 3.68Å; Y58-Y141 HydrophobicContact CD2-CD2 4.43Å; Y58-Y141 HydrophobicContact CD2-CE1 4.34Å; Y58-Y141 AromaticContact CD2-CE2 3.8Å; Y58-Y141 HydrophobicContact CD2-CE2 3.8Å; Y58-Y141 AromaticContact CD2-CZ 3.75Å; Y58-Y141 HydrophobicContact CE2-CE2 4.35Å; V101-Y141 HydrophobicContact CG2-CD1 4.35Å; V101-Y141 HydrophobicContact CG2-CE1 3.97Å; L128-Y141 HydrophobicContact CD2-CD1 3.88Å; L128-Y141 HydrophobicContact CD2-CE1 4.11Å; I130-Y141 HydrophobicContact CD1-CE1 3.98Å; D137-Y141 VanDerWaalsContact O-CE2 3.27Å; D137-Y141 WeakPolarHBondContact O-CE2 3.47Å; D137-Y141 PolarHBondContact O-OH 2.98Å; Y141-H158 CarbonylContact O-C 3.49Å; Y141-H158 VanDerWaalsContact O-CA 3.31Å; Y141-H158 WeakPolarHBondContact O-CA 3.47Å; Y141-M159 PolarHBondContact N-O 3Å; Y141-M159 PolarHBondContact O-N 2.96Å; Y141-L161 HydrophobicContact CD2-CB 3.82Å; Y141-L161 HydrophobicContact CD2-CD2 4.45Å; Y141-L161 HydrophobicContact CE2-CB 3.78Å; Y141-L161 HydrophobicContact CE2-CD2 3.78Å; Y141-L161 HydrophobicContact CE2-CG 4.34Å
142	F	93.1	Very high	86.8	Confident	12 Å²	12	49.1 Å²	49.1	5%	0.053	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	124.6	174.9	-62.2	-107.5	0	0	0	109.7	W56 W57 K59 V89 V140 Q156 D157 H158	W56-F142 WeakPolarHBondContact CA-O 3.06Å; W57-F142 HydrophobicContact CB-CB 4.27Å; W57-F142 PolarHBondContact N-O 2.81Å; W57-F142 PolarHBondContact O-N 2.64Å; K59-F142 HydrophobicContact CB-CE2 3.99Å; K59-F142 HydrophobicContact CD-CD2 3.99Å; K59-F142 HydrophobicContact CD-CE2 3.44Å; K59-F142 VanDerWaalsContact CD-CE2 3.44Å; K59-F142 HydrophobicContact CD-CZ 4.01Å; K59-F142 HydrophobicContact CG-CD2 3.84Å; K59-F142 HydrophobicContact CG-CE2 3.59Å; V89-F142 HydrophobicContact CG1-CE1 3.72Å; V89-F142 HydrophobicContact CG1-CZ 3.68Å; V140-F142 HydrophobicContact CB-CE2 4.06Å; V140-F142 HydrophobicContact CG1-CD2 4.14Å; V140-F142 HydrophobicContact CG1-CE2 3.51Å; V140-F142 HydrophobicContact CG1-CZ 3.91Å; F142-Q156 HydrophobicContact CB-CG 4.38Å; F142-Q156 HydrophobicContact CD1-CG 4.31Å; F142-Q156 VanDerWaalsContact CD1-NE2 3.28Å; F142-D157 CarbonylContact C-O 3.58Å; F142-D157 VanDerWaalsContact CA-O 3.27Å; F142-D157 WeakPolarHBondContact CA-O 3.25Å; F142-H158 HydrophobicContact CD1-CB 3.62Å; F142-H158 HydrophobicContact CE1-CB 3.8Å; F142-H158 HydrophobicContact CG-CB 4.05Å; F142-H158 HydrophobicContact CZ-CB 4.34Å
143	C	93.9	Very high	85.7	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	114	165.3	-172.2	0	0	0	0	107.8	V23 V25 C42 W56 Q156 D157	V23-C143 HydrophobicContact CG1-CB 4.22Å; V25-C143 HydrophobicContact CG2-CB 4.12Å; C42-C143 HydrophobicContact CB-CB 3.71Å; C42-C143 WeakPolarHBondContact CB-SG 3.35Å; C42-C143 WeakPolarHBondContact SG-CB 3.14Å; C42-C143 CovalentContact SG-SG 2.03Å; C42-C143 PolarHBondContact SG-SG 2.94Å; W56-C143 HydrophobicContact CD2-CB 4.3Å; W56-C143 HydrophobicContact CE3-CB 4.1Å; W56-C143 HydrophobicContact CH2-CB 3.64Å; W56-C143 HydrophobicContact CZ2-CB 3.84Å; W56-C143 HydrophobicContact CZ3-CB 3.76Å; C143-Q156 WeakPolarHBondContact O-CA 3.32Å; C143-D157 PolarHBondContact N-O 2.99Å; C143-D157 PolarHBondContact O-N 3.22Å
144	K	92.2	Very high	85.2	Confident	70 Å²	70	49.7 Å²	49.7	30%	0.304	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	121.6	174.9	-173.7	177.6	-173.6	174.2	0	109.1	Q55 I146 Q156	Q55-K144 PolarHBondContact N-O 3.22Å; Q55-K144 PolarHBondContact O-N 2.81Å; K144-I146 HydrophobicContact CD-CD1 4.26Å; K144-I146 HydrophobicContact CD-CG1 4.43Å; K144-I146 HydrophobicContact CG-CG1 4.19Å; K144-Q156 HydrophobicContact CB-CB 4.49Å; K144-Q156 HydrophobicContact CB-CG 4.13Å; K144-Q156 HydrophobicContact CG-CB 4.33Å; K144-Q156 HydrophobicContact CG-CG 4.37Å
145	V	91.4	Very high	84.9	Confident	2 Å²	2	46.2 Å²	46.2	1%	0.012	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	139	173.7	-174.1	0	0	0	0	108.2	M21 V23 F44 P52 V53 V54 V147 G155	M21-V145 VanDerWaalsContact CE-O 3.3Å; M21-V145 WeakPolarHBondContact CE-O 3.3Å; M21-V145 HydrophobicContact SD-CB 3.92Å; M21-V145 HydrophobicContact SD-CG1 3.87Å; M21-V145 VanDerWaalsContact SD-O 3.35Å; V23-V145 HydrophobicContact CG2-CB 3.83Å; V23-V145 HydrophobicContact CG2-CG2 3.69Å; F44-V145 HydrophobicContact CB-CG2 3.95Å; F44-V145 HydrophobicContact CD1-CG2 4.06Å; F44-V145 HydrophobicContact CD2-CG1 4.06Å; F44-V145 HydrophobicContact CE2-CG1 4.4Å; F44-V145 HydrophobicContact CG-CG1 4.17Å; F44-V145 HydrophobicContact CG-CG2 4.01Å; P52-V145 HydrophobicContact CB-CG1 4.01Å; V53-V145 WeakPolarHBondContact O-CA 3.18Å; V54-V145 HydrophobicContact CG1-CG2 4.43Å; V54-V145 HydrophobicContact CG2-CG1 4.48Å; V54-V145 HydrophobicContact CG2-CG2 4.25Å; V145-V147 HydrophobicContact CG1-CG2 4.37Å; V145-G155 PolarHBondContact N-O 3.35Å
146	I	88.6	Confident	85.2	Confident	60 Å²	60	41.7 Å²	41.7	31%	0.308	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	124.2	179.6	-51.2	177.6	0	0	0	107.7	V53 K144 L151	V53-I146 PolarHBondContact N-O 2.9Å; V53-I146 PolarHBondContact O-N 3.39Å; K144-I146 HydrophobicContact CD-CD1 4.26Å; K144-I146 HydrophobicContact CD-CG1 4.43Å; K144-I146 HydrophobicContact CG-CG1 4.19Å; I146-L151 HydrophobicContact CG2-CD2 4.3Å
147	V	89	Confident	85.4	Confident	1 Å²	1	40.3 Å²	40.3	1%	0.006	24%	0.239	C	C	.	.	B	Isolated β-bridge	trans	-123.7	137.8	173.3	-158.4	0	0	0	0	108.7	M21 T46 K50 P52 V145 D149 D150 L151	M21-V147 HydrophobicContact SD-CG2 3.87Å; T46-V147 HydrophobicContact CG2-CG2 4.28Å; K50-V147 HydrophobicContact CB-CG1 4.24Å; P52-V147 HydrophobicContact CB-CG2 3.87Å; V145-V147 HydrophobicContact CG1-CG2 4.37Å; V147-D149 PolarHBondContact O-N 3.1Å; V147-D149 VanDerWaalsContact O-N 3.16Å; V147-D150 HydrophobicContact CB-CB 4.42Å; V147-D150 PolarHBondContact O-N 3.15Å; V147-L151 WeakPolarHBondContact O-CD2 3.42Å
148	A	82.8	Confident	85.5	Confident	76 Å²	76	42.4 Å²	42.4	63%	0.628	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.9	-17.3	-167.5	0	0	0	0	0	115.1	K50	K50-A148 HydrophobicContact CD-CB 4Å
149	D	81.2	Confident	85.5	Confident	94 Å²	94	41 Å²	41	50%	0.503	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-112.1	-13.8	179.4	-59.4	-32.9	0	0	0	114	K50 V147	K50-D149 WeakPolarHBondContact CD-OD2 3.43Å; K50-D149 WeakPolarHBondContact CE-OD1 3.14Å; K50-D149 WeakPolarHBondContact CE-OD2 3.35Å; K50-D149 WeakPolarHBondContact CG-OD2 3.11Å; K50-D149 VanDerWaalsContact NZ-CG 3.32Å; K50-D149 IonicContact NZ-OD1 2.66Å; K50-D149 PolarHBondContact NZ-OD1 2.8Å; K50-D149 IonicContact NZ-OD2 2.82Å; K50-D149 PolarHBondContact NZ-OD2 2.74Å; V147-D149 PolarHBondContact O-N 3.1Å; V147-D149 VanDerWaalsContact O-N 3.16Å
150	D	74.4	Confident	85.6	Confident	12 Å²	12	41.7 Å²	41.7	6%	0.064	24%	0.242	C	C	.	.	B	Isolated β-bridge	trans	-127	82.4	-169.6	-177	7	0	0	0	109	G20 M21 T46 S47 V147	G20-D150 WeakPolarHBondContact CA-OD1 3.32Å; M21-D150 WeakPolarHBondContact CB-OD2 3.36Å; M21-D150 WeakPolarHBondContact CE-O 3.38Å; M21-D150 VanDerWaalsContact N-CG 3.31Å; M21-D150 PolarHBondContact N-OD1 3.36Å; M21-D150 PolarHBondContact N-OD2 3.45Å; M21-D150 VanDerWaalsContact N-OD2 3.08Å; T46-D150 WeakPolarHBondContact CB-OD2 3.34Å; T46-D150 PolarHBondContact OG1-OD2 2.97Å; S47-D150 PolarHBondContact N-OD2 3.37Å; V147-D150 HydrophobicContact CB-CB 4.42Å; V147-D150 PolarHBondContact O-N 3.15Å
151	L	69.6	Low	85.6	Confident	121 Å²	121	41.3 Å²	41.3	63%	0.634	24%	0.24	S	C	*	.			trans	-103.9	2.7	176.2	-59.2	178.7	0	0	0	112.3	I146 V147 G153	I146-L151 HydrophobicContact CG2-CD2 4.3Å; V147-L151 WeakPolarHBondContact O-CD2 3.42Å; L151-G153 PolarHBondContact O-N 3.47Å
152	V	66.9	Low	85.5	Confident	128 Å²	128	44 Å²	44	78%	0.776	25%	0.254	S	S	*	.	S	Bend	trans	-100.3	68	-170	-171.1	0	0	0	0	109.8	G20	G20-V152 WeakPolarHBondContact CA-O 3.42Å
153	G	69.4	Low	85.4	Confident	44 Å²	44	43.6 Å²	43.6	45%	0.454	25%	0.253	S	S	.	.	S	Bend	trans	177.5	-179.6	179.3	0	0	0	0	0	113.6	M21 L151 G155	M21-G153 CarbonylContact O-C 3.13Å; M21-G153 VanDerWaalsContact O-CA 3.24Å; M21-G153 WeakPolarHBondContact O-CA 3.5Å; L151-G153 PolarHBondContact O-N 3.47Å; G153-G155 VanDerWaalsContact C-N 3.28Å; G153-G155 PolarHBondContact O-N 2.71Å
154	N	79.9	Confident	85.1	Confident	89 Å²	89	46.7 Å²	46.7	48%	0.476	27%	0.269	S	S	.	.			trans	-79.4	77	178.3	-167.8	58.9	0	0	0	111.3	M21 V23 Q156	M21-N154 CarbonylContact O-C 3.49Å; M21-N154 PolarHBondContact O-N 3.23Å; V23-N154 PolarHBondContact N-O 3.17Å; N154-Q156 PolarHBondContact ND2-O 3.35Å; N154-Q156 PolarHBondContact O-N 3.18Å; N154-Q156 VanDerWaalsContact O-N 3.14Å
155	G	85.2	Confident	84.6	Confident	12 Å²	12	44.3 Å²	44.3	12%	0.124	26%	0.264	C	S	.	.			trans	-71.2	6.8	-179.7	0	0	0	0	0	116.4	V23 V145 G153	V23-G155 VanDerWaalsContact CG2-C 3.5Å; V23-G155 WeakPolarHBondContact CG2-O 3.47Å; V145-G155 PolarHBondContact N-O 3.35Å; G153-G155 VanDerWaalsContact C-N 3.28Å; G153-G155 PolarHBondContact O-N 2.71Å
156	Q	90.3	Very high	83.5	Confident	62 Å²	62	53 Å²	53	29%	0.29	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147	135.5	-177.3	-172	168.5	-19.2	0	0	111.5	F142 C143 K144 N154	F142-Q156 HydrophobicContact CB-CG 4.38Å; F142-Q156 HydrophobicContact CD1-CG 4.31Å; F142-Q156 VanDerWaalsContact CD1-NE2 3.28Å; C143-Q156 WeakPolarHBondContact O-CA 3.32Å; K144-Q156 HydrophobicContact CB-CB 4.49Å; K144-Q156 HydrophobicContact CB-CG 4.13Å; K144-Q156 HydrophobicContact CG-CB 4.33Å; K144-Q156 HydrophobicContact CG-CG 4.37Å; N154-Q156 PolarHBondContact ND2-O 3.35Å; N154-Q156 PolarHBondContact O-N 3.18Å; N154-Q156 VanDerWaalsContact O-N 3.14Å
157	D	91.4	Very high	81.7	Confident	22 Å²	22	56.5 Å²	56.5	12%	0.118	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	170.2	173.7	-162.3	-0.2	0	0	0	109.7	V23 V25 K28 F142 C143	V23-D157 HydrophobicContact CB-CB 4.31Å; V23-D157 HydrophobicContact CG1-CB 3.89Å; V25-D157 HydrophobicContact CB-CB 4.22Å; V25-D157 WeakPolarHBondContact CB-OD2 3.38Å; V25-D157 HydrophobicContact CG2-CB 3.97Å; V25-D157 PolarHBondContact N-OD2 3.33Å; K28-D157 IonicContact NZ-OD1 3.71Å; K28-D157 PolarHBondContact NZ-OD1 2.82Å; K28-D157 IonicContact NZ-OD2 2.72Å; K28-D157 PolarHBondContact NZ-OD2 2.86Å; F142-D157 CarbonylContact C-O 3.58Å; F142-D157 VanDerWaalsContact CA-O 3.27Å; F142-D157 WeakPolarHBondContact CA-O 3.25Å; C143-D157 PolarHBondContact N-O 2.99Å; C143-D157 PolarHBondContact O-N 3.22Å
158	H	90.7	Very high	79.8	Confident	47 Å²	47	59.8 Å²	59.8	22%	0.218	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	157	-170.3	67.3	-74	0	0	0	113.7	K28 V89 V140 Y141 F142	K28-H158 WeakPolarHBondContact CD-O 3.44Å; V89-H158 WeakPolarHBondContact CG2-NE2 3.3Å; V140-H158 HydrophobicContact CG1-CB 4.23Å; Y141-H158 CarbonylContact O-C 3.49Å; Y141-H158 VanDerWaalsContact O-CA 3.31Å; Y141-H158 WeakPolarHBondContact O-CA 3.47Å; F142-H158 HydrophobicContact CD1-CB 3.62Å; F142-H158 HydrophobicContact CE1-CB 3.8Å; F142-H158 HydrophobicContact CG-CB 4.05Å; F142-H158 HydrophobicContact CZ-CB 4.34Å
159	M	91.6	Very high	77.8	Confident	0 Å²	0	65 Å²	65	0%	0	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	159.1	160.7	70.8	-166.2	96.1	0	0	111.2	V25 E27 K28 L40 W56 V140 Y141	V25-M159 HydrophobicContact CG1-CB 3.86Å; V25-M159 HydrophobicContact CG1-CE 3.56Å; V25-M159 HydrophobicContact CG1-CG 4.45Å; V25-M159 HydrophobicContact CG1-SD 4.26Å; V25-M159 HydrophobicContact CG2-CE 4.19Å; E27-M159 WeakPolarHBondContact O-CB 3.09Å; K28-M159 CarbonylContact O-C 3.59Å; K28-M159 WeakPolarHBondContact O-CA 3.33Å; L40-M159 HydrophobicContact CB-CE 3.65Å; L40-M159 HydrophobicContact CB-SD 3.77Å; L40-M159 HydrophobicContact CD2-SD 3.8Å; L40-M159 HydrophobicContact CG-SD 4.23Å; W56-M159 HydrophobicContact CH2-CE 3.47Å; W56-M159 VanDerWaalsContact CH2-CE 3.47Å; W56-M159 HydrophobicContact CZ3-CE 3.78Å; V140-M159 CarbonylContact C-O 3.59Å; V140-M159 WeakPolarHBondContact CA-O 3.25Å; Y141-M159 PolarHBondContact N-O 3Å; Y141-M159 PolarHBondContact O-N 2.96Å
160	E	91.5	Very high	76.1	Confident	16 Å²	16	69.5 Å²	69.5	8%	0.075	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	132	165.6	177.9	178.3	-172.2	0	0	110.2	K28 K29 R30 Y61	K28-E160 PolarHBondContact O-N 2.85Å; K29-E160 CarbonylContact C-O 3.49Å; K29-E160 WeakPolarHBondContact CA-O 3.21Å; K29-E160 HydrophobicContact CG-CB 4.3Å; K29-E160 IonicContact NZ-OE2 3.61Å; K29-E160 PolarHBondContact NZ-OE2 2.86Å; R30-E160 PolarHBondContact N-O 2.79Å; Y61-E160 HydrophobicContact CE1-CG 3.79Å; Y61-E160 VanDerWaalsContact CE1-OE1 3.25Å; Y61-E160 WeakPolarHBondContact CE1-OE1 3.42Å; Y61-E160 WeakPolarHBondContact OH-CG 3.44Å; Y61-E160 PolarHBondContact OH-OE1 3.18Å; Y61-E160 VanDerWaalsContact OH-OE1 3.09Å
161	L	91.9	Very high	74.6	Confident	0 Å²	0	76.5 Å²	76.5	0%	0	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	116.2	167	171.4	62.5	0	0	0	108.5	R30 V38 L40 Y61 I130 L133 S138 G139 Y141	R30-L161 HydrophobicContact CB-CD1 4.28Å; R30-L161 HydrophobicContact CG-CD1 4.4Å; R30-L161 WeakPolarHBondContact O-CA 3.5Å; V38-L161 HydrophobicContact CG1-CD1 4.36Å; V38-L161 HydrophobicContact CG1-CD2 4.1Å; V38-L161 HydrophobicContact CG2-CD1 4.33Å; L40-L161 HydrophobicContact CD1-CD2 4.26Å; L40-L161 HydrophobicContact CD2-CB 4.42Å; L40-L161 HydrophobicContact CD2-CD1 4.22Å; L40-L161 HydrophobicContact CD2-CD2 4.31Å; Y61-L161 PolarHBondContact OH-O 2.7Å; I130-L161 HydrophobicContact CD1-CD2 4.34Å; L133-L161 HydrophobicContact CD2-CD2 3.85Å; S138-L161 WeakPolarHBondContact CA-O 3.35Å; G139-L161 PolarHBondContact N-O 2.72Å; G139-L161 PolarHBondContact O-N 2.92Å; Y141-L161 HydrophobicContact CD2-CB 3.82Å; Y141-L161 HydrophobicContact CD2-CD2 4.45Å; Y141-L161 HydrophobicContact CE2-CB 3.78Å; Y141-L161 HydrophobicContact CE2-CD2 3.78Å; Y141-L161 HydrophobicContact CE2-CG 4.34Å
162	L	90.3	Very high	73.2	Confident	55 Å²	55	75.7 Å²	75.7	29%	0.288	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	117.9	171.8	-172.8	66.7	0	0	0	109.9	R30 Y31 A32 L164	R30-L162 PolarHBondContact O-N 2.97Å; Y31-L162 HydrophobicContact CD1-CB 3.9Å; Y31-L162 HydrophobicContact CD1-CD2 4.01Å; Y31-L162 HydrophobicContact CD1-CG 4.43Å; Y31-L162 HydrophobicContact CE1-CB 4.06Å; Y31-L162 HydrophobicContact CE1-CD2 3.78Å; A32-L162 PolarHBondContact N-O 3.05Å; L162-L164 HydrophobicContact CD2-CD2 3.86Å; L162-L164 HydrophobicContact CG-CD2 4.13Å
163	V	91.5	Very high	72.3	Confident	5 Å²	5	77.8 Å²	77.8	3%	0.03	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	113.6	173.1	-176.5	0	0	0	0	108.4	A32 L34 L133 D137	A32-V163 WeakPolarHBondContact O-CA 3.41Å; L34-V163 HydrophobicContact CB-CG1 4.37Å; L34-V163 HydrophobicContact CD1-CG1 4.13Å; L133-V163 HydrophobicContact CB-CG1 4.3Å; L133-V163 HydrophobicContact CB-CG2 4.39Å; L133-V163 HydrophobicContact CD1-CG2 4.38Å; L133-V163 HydrophobicContact CD2-CG2 4.06Å; D137-V163 HydrophobicContact CB-CG2 4.29Å
164	L	88.4	Confident	71	Confident	65 Å²	65	81.4 Å²	81.4	34%	0.34	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	137.6	176.6	-60.9	178.8	0	0	0	109.7	Y31 A32 M33 L34 L162	Y31-L164 HydrophobicContact CD1-CD1 4.46Å; A32-L164 PolarHBondContact O-N 3.36Å; M33-L164 CarbonylContact C-O 3.18Å; M33-L164 VanDerWaalsContact CA-O 3.3Å; M33-L164 WeakPolarHBondContact CA-O 3.35Å; M33-L164 HydrophobicContact CE-CD1 4.39Å; M33-L164 HydrophobicContact SD-CB 3.66Å; M33-L164 HydrophobicContact SD-CD1 4.47Å; L34-L164 PolarHBondContact N-O 3.09Å; L162-L164 HydrophobicContact CD2-CD2 3.86Å; L162-L164 HydrophobicContact CG-CD2 4.13Å
165	G	81.3	Confident	69.6	Low	19 Å²	19	82.9 Å²	82.9	20%	0.196	45%	0.446	C	S	.	.			trans	-104.9	143.7	168.2	0	0	0	0	0	110.5	W135 T167	W135-G165 VanDerWaalsContact CH2-CA 3.43Å; G165-T167 PolarHBondContact O-N 2.86Å
166	R	66.9	Low	67.7	Low	184 Å²	184	90.3 Å²	90.3	69%	0.694	48%	0.478	S	S	*	.			trans	-69.8	95.4	174.4	-164.1	176	-158.3	160	11.7	110	G168 D172	R166-G168 PolarHBondContact O-N 3.17Å; R166-D172 IonicContact CZ-OD2 2.79Å; R166-D172 IonicContact NE-OD2 2.6Å; R166-D172 VanDerWaalsContact NH2-CG 3.34Å; R166-D172 IonicContact NH2-OD2 3.77Å; R166-D172 PolarHBondContact NH2-OD2 3.41Å
167	T	52.7	Low	65.3	Low	135 Å²	135	94.5 Å²	94.5	83%	0.828	50%	0.496	S	S	*	.			trans	-67.6	98	165.1	46.5	0	0	0	0	108	G165 E169	G165-T167 PolarHBondContact O-N 2.86Å; T167-E169 PolarHBondContact O-N 3.11Å
168	G	47.3	Very low	63	Low	69 Å²	69	100.2 Å²	100.2	71%	0.711	53%	0.526	S	S	*	.			trans	-75.1	83.8	-171.7	0	0	0	0	0	113.7	R166	R166-G168 PolarHBondContact O-N 3.17Å
169	E	41.7	Very low	60.9	Low	186 Å²	186	106.3 Å²	106.3	87%	0.869	56%	0.557	S	S	*	*			trans	-88.7	145.9	149.2	-150.5	138.4	134.5	0	0	108.4	T167 D171	T167-E169 PolarHBondContact O-N 3.11Å; E169-D171 PolarHBondContact O-N 3.17Å
170	Q	45	Very low	58.8	Low	189 Å²	189	113.5 Å²	113.5	88%	0.883	59%	0.59	S	S	*	*	S	Bend	trans	-96.2	80.7	-160.1	-64.5	-178.7	10	0	0	113.6
171	D	42.9	Very low	56.9	Low	159 Å²	159	119.3 Å²	119.3	85%	0.85	62%	0.62	S	S	*	*			trans	-140	-1.1	170.6	-94.8	-46.8	0	0	0	116.3	E169 L173	E169-D171 PolarHBondContact O-N 3.17Å; D171-L173 PolarHBondContact O-N 3.39Å
172	D	40.5	Very low	55.1	Low	104 Å²	104	125.1 Å²	125.1	56%	0.556	65%	0.649	S	S	*	*			trans	-91.1	68	179.5	-71.5	-31.3	0	0	0	113.9	R166 L174	R166-D172 IonicContact CZ-OD2 2.79Å; R166-D172 IonicContact NE-OD2 2.6Å; R166-D172 VanDerWaalsContact NH2-CG 3.34Å; R166-D172 IonicContact NH2-OD2 3.77Å; R166-D172 PolarHBondContact NH2-OD2 3.41Å; D172-L174 VanDerWaalsContact C-N 3.32Å; D172-L174 PolarHBondContact O-N 3.48Å
173	L	47.4	Very low	54.1	Low	172 Å²	172	125.8 Å²	125.8	90%	0.901	66%	0.657	S	S	*	*			trans	-84.1	68	166.2	-76.1	177.7	0	0	0	112	D171	D171-L173 PolarHBondContact O-N 3.39Å
174	L	43.7	Very low	53.1	Low	119 Å²	119	133 Å²	133	62%	0.623	69%	0.69	S	S	*	*			trans	-178.9	130.5	152.9	-102.9	166.3	0	0	0	111.9	D172 E176 F177	D172-L174 VanDerWaalsContact C-N 3.32Å; D172-L174 PolarHBondContact O-N 3.48Å; L174-E176 PolarHBondContact O-N 3.25Å; L174-F177 HydrophobicContact CD1-CD2 4.4Å; L174-F177 HydrophobicContact CD1-CE2 4.42Å
175	P	50.2	Low	52.8	Low	120 Å²	120	140.1 Å²	140.1	78%	0.779	71%	0.712	S	S	*	*	S	Bend	trans	-96.8	81.4	175.1	36.2	-30.8	0	0	0	112.1
176	E	43.7	Very low	52.8	Low	169 Å²	169	141.1 Å²	141.1	79%	0.79	72%	0.719	S	S	*	*	S	Bend	trans	-169.2	-18.1	162.9	-153.9	72.5	-125.3	0	0	112.1	L174	L174-E176 PolarHBondContact O-N 3.25Å
177	F	41.5	Very low	53.4	Low	150 Å²	150	138.3 Å²	138.3	66%	0.658	71%	0.712	S	S	*	*			trans	-105.5	103.3	-176.1	-62.5	-74	0	0	0	111.9	L174 M179	L174-F177 HydrophobicContact CD1-CD2 4.4Å; L174-F177 HydrophobicContact CD1-CE2 4.42Å; F177-M179 PolarHBondContact O-N 3Å; F177-M179 VanDerWaalsContact O-N 3.07Å
178	D	41.9	Very low	55.2	Low	142 Å²	142	136 Å²	136	76%	0.759	70%	0.698	S	S	*	*			trans	-63.3	105.9	160.9	-68.9	-49.3	0	0	0	108.8	E180	D178-E180 HydrophobicContact CB-CB 4.34Å; D178-E180 PolarHBondContact O-N 3.27Å
179	M	47.4	Very low	57.2	Low	174 Å²	174	134.5 Å²	134.5	86%	0.857	68%	0.682	S	S	*	*			trans	-75.2	36	163.2	-70.5	-154.8	-179.4	0	0	111.6	F177 I181	F177-M179 PolarHBondContact O-N 3Å; F177-M179 VanDerWaalsContact O-N 3.07Å; M179-I181 PolarHBondContact O-N 3.33Å
180	E	48	Very low	59.3	Low	151 Å²	151	129.2 Å²	129.2	71%	0.706	67%	0.666	S	S	*	*	S	Bend	trans	-71.8	94.5	170.6	-172.5	168.5	-165.2	0	0	108.7	D178	D178-E180 HydrophobicContact CB-CB 4.34Å; D178-E180 PolarHBondContact O-N 3.27Å
181	I	50.6	Low	61.6	Low	138 Å²	138	124 Å²	124	71%	0.708	65%	0.647	S	S	*	*			trans	66.5	88.3	175	-46.5	160.4	0	0	0	112.4	M179 P183	M179-I181 PolarHBondContact O-N 3.33Å; I181-P183 WeakPolarHBondContact O-CD 3.46Å; I181-P183 VanDerWaalsContact O-N 3.12Å
182	M	53.7	Low	64	Low	122 Å²	122	118.8 Å²	118.8	60%	0.601	63%	0.626	S	S	*	*			trans	-60.8	114.9	154.2	179.8	164.7	60.7	0	0	107.3	A186 F187	M182-A186 HydrophobicContact CG-CB 3.7Å; M182-A186 HydrophobicContact SD-CB 4.25Å; M182-F187 HydrophobicContact CE-CB 4.15Å; M182-F187 HydrophobicContact CE-CD2 4.09Å
183	P	69.1	Low	66.5	Low	69 Å²	69	119.1 Å²	119.1	45%	0.448	63%	0.627	S	S	.	*			trans	-65.3	150.3	-173.8	26.2	-33.9	0	0	0	110	I181 W185 A186 F187	I181-P183 WeakPolarHBondContact O-CD 3.46Å; I181-P183 VanDerWaalsContact O-N 3.12Å; P183-W185 PolarHBondContact O-N 3.35Å; P183-A186 HydrophobicContact CG-CB 3.81Å; P183-A186 WeakPolarHBondContact O-CA 3.05Å; P183-A186 WeakPolarHBondContact O-CB 3.38Å; P183-A186 PolarHBondContact O-N 3.05Å; P183-F187 PolarHBondContact O-N 3.41Å
184	E	71.2	Confident	68.7	Low	157 Å²	157	112.8 Å²	112.8	73%	0.734	60%	0.603	S	S	*	*	H	α-helix	trans	-51.3	-37.3	-177.6	-60.5	177.2	164.6	0	0	111.9	A186 F187 V188	E184-A186 PolarHBondContact O-N 3.12Å; E184-F187 PolarHBondContact O-N 3.09Å; E184-V188 WeakPolarHBondContact O-CB 3.34Å; E184-V188 WeakPolarHBondContact O-CG2 3.49Å; E184-V188 PolarHBondContact O-N 3.47Å
185	W	81.1	Confident	71	Confident	214 Å²	214	110.1 Å²	110.1	81%	0.811	59%	0.594	S	S	*	*	H	α-helix	trans	-62.7	-31.9	174.5	-54.3	109.9	0	0	0	114.8	P183 G189	P183-W185 PolarHBondContact O-N 3.35Å; W185-G189 WeakPolarHBondContact O-CA 3.39Å; W185-G189 PolarHBondContact O-N 3.4Å
186	A	81.5	Confident	73	Confident	41 Å²	41	108.7 Å²	108.7	34%	0.339	58%	0.583	S	S	.	*	H	α-helix	trans	-78.8	-35.7	175.9	0	0	0	0	0	111.6	M182 P183 E184 G189 S190	M182-A186 HydrophobicContact CG-CB 3.7Å; M182-A186 HydrophobicContact SD-CB 4.25Å; P183-A186 HydrophobicContact CG-CB 3.81Å; P183-A186 WeakPolarHBondContact O-CA 3.05Å; P183-A186 WeakPolarHBondContact O-CB 3.38Å; P183-A186 PolarHBondContact O-N 3.05Å; E184-A186 PolarHBondContact O-N 3.12Å; A186-G189 PolarHBondContact O-N 3.19Å; A186-S190 VanDerWaalsContact O-CB 3.29Å; A186-S190 WeakPolarHBondContact O-CB 3.43Å; A186-S190 PolarHBondContact O-N 3.07Å
187	F	80.8	Confident	75.2	Confident	125 Å²	125	104.9 Å²	104.9	55%	0.548	57%	0.568	S	S	.	*	H	α-helix	trans	-63.1	-51.7	169.7	179.1	-103.2	0	0	0	111.1	M182 P183 E184 G189 S190 V191	M182-F187 HydrophobicContact CE-CB 4.15Å; M182-F187 HydrophobicContact CE-CD2 4.09Å; P183-F187 PolarHBondContact O-N 3.41Å; E184-F187 PolarHBondContact O-N 3.09Å; F187-G189 VanDerWaalsContact C-N 3.3Å; F187-G189 PolarHBondContact O-N 3.2Å; F187-S190 PolarHBondContact O-N 2.79Å; F187-V191 HydrophobicContact CD1-CG2 4.49Å; F187-V191 HydrophobicContact CE1-CG2 4.09Å; F187-V191 HydrophobicContact CE2-CG2 4.14Å; F187-V191 HydrophobicContact CZ-CG2 3.9Å; F187-V191 WeakPolarHBondContact O-CG2 3.29Å; F187-V191 PolarHBondContact O-N 2.96Å
188	V	89.9	Confident	77.3	Confident	87 Å²	87	103.9 Å²	103.9	53%	0.527	56%	0.563	S	S	.	*	H	α-helix	trans	-59.5	-41	175.6	170.9	0	0	0	0	111.1	E184 V191 A192	E184-V188 WeakPolarHBondContact O-CB 3.34Å; E184-V188 WeakPolarHBondContact O-CG2 3.49Å; E184-V188 PolarHBondContact O-N 3.47Å; V188-V191 PolarHBondContact O-N 3.36Å; V188-A192 WeakPolarHBondContact O-CB 3.22Å; V188-A192 PolarHBondContact O-N 2.6Å
189	G	89.3	Confident	79.4	Confident	37 Å²	37	102.1 Å²	102.1	38%	0.381	55%	0.553	S	S	.	*	H	α-helix	trans	-63	-41.8	175.7	0	0	0	0	0	113.3	W185 A186 F187 A192 L193	W185-G189 WeakPolarHBondContact O-CA 3.39Å; W185-G189 PolarHBondContact O-N 3.4Å; A186-G189 PolarHBondContact O-N 3.19Å; F187-G189 VanDerWaalsContact C-N 3.3Å; F187-G189 PolarHBondContact O-N 3.2Å; G189-A192 PolarHBondContact O-N 3.08Å; G189-L193 VanDerWaalsContact O-CB 3.23Å; G189-L193 WeakPolarHBondContact O-CB 3.43Å; G189-L193 PolarHBondContact O-N 3.19Å
190	S	85.9	Confident	81.1	Confident	74 Å²	74	98.2 Å²	98.2	52%	0.517	54%	0.535	S	S	.	.	H	α-helix	trans	-65.3	-46.6	175.7	-175.6	0	0	0	0	111.8	A186 F187 A192 L193 G194	A186-S190 VanDerWaalsContact O-CB 3.29Å; A186-S190 WeakPolarHBondContact O-CB 3.43Å; A186-S190 PolarHBondContact O-N 3.07Å; F187-S190 PolarHBondContact O-N 2.79Å; S190-A192 PolarHBondContact O-N 3.05Å; S190-L193 PolarHBondContact O-N 2.95Å; S190-G194 PolarHBondContact O-N 3.06Å
191	V	93.3	Very high	82.3	Confident	81 Å²	81	96.4 Å²	96.4	49%	0.491	53%	0.53	S	S	.	.	H	α-helix	trans	-64.3	-40	176.3	174.4	0	0	0	0	111.4	F187 V188 S195	F187-V191 HydrophobicContact CD1-CG2 4.49Å; F187-V191 HydrophobicContact CE1-CG2 4.09Å; F187-V191 HydrophobicContact CE2-CG2 4.14Å; F187-V191 HydrophobicContact CZ-CG2 3.9Å; F187-V191 WeakPolarHBondContact O-CG2 3.29Å; F187-V191 PolarHBondContact O-N 2.96Å; V188-V191 PolarHBondContact O-N 3.36Å; V191-S195 VanDerWaalsContact O-CB 3.27Å; V191-S195 WeakPolarHBondContact O-CB 3.46Å; V191-S195 PolarHBondContact O-N 3.1Å
192	A	93.8	Very high	83.6	Confident	49 Å²	49	92.1 Å²	92.1	41%	0.405	51%	0.508	S	S	.	.	H	α-helix	trans	-66.5	-44.4	175.5	0	0	0	0	0	112.1	V188 G189 S190 S195 V196	V188-A192 WeakPolarHBondContact O-CB 3.22Å; V188-A192 PolarHBondContact O-N 2.6Å; G189-A192 PolarHBondContact O-N 3.08Å; S190-A192 PolarHBondContact O-N 3.05Å; A192-S195 PolarHBondContact O-N 3.03Å; A192-V196 WeakPolarHBondContact O-CB 3.23Å; A192-V196 WeakPolarHBondContact O-CG2 3.18Å; A192-V196 PolarHBondContact O-N 3.3Å
193	L	91.7	Very high	84.3	Confident	111 Å²	111	87.7 Å²	87.7	58%	0.581	49%	0.494	S	S	*	.	H	α-helix	trans	-61.9	-45.7	175.6	-174.7	73.1	0	0	0	111.1	G189 S190 V196 L197	G189-L193 VanDerWaalsContact O-CB 3.23Å; G189-L193 WeakPolarHBondContact O-CB 3.43Å; G189-L193 PolarHBondContact O-N 3.19Å; S190-L193 PolarHBondContact O-N 2.95Å; L193-V196 PolarHBondContact O-N 3.14Å; L193-L197 HydrophobicContact CG-CD1 4.05Å; L193-L197 WeakPolarHBondContact O-CB 3.41Å; L193-L197 VanDerWaalsContact O-CG 3.29Å; L193-L197 WeakPolarHBondContact O-CG 3.32Å; L193-L197 PolarHBondContact O-N 2.91Å
194	G	93.8	Very high	84.4	Confident	39 Å²	39	87.8 Å²	87.8	40%	0.402	49%	0.49	S	S	.	.	H	α-helix	trans	-61	-42.5	175.5	0	0	0	0	0	112.6	S190 L197 F198	S190-G194 PolarHBondContact O-N 3.06Å; G194-L197 PolarHBondContact O-N 3.26Å; G194-F198 VanDerWaalsContact O-CB 3.25Å; G194-F198 WeakPolarHBondContact O-CB 3.44Å; G194-F198 PolarHBondContact O-N 3.26Å
195	S	92.8	Very high	83.8	Confident	63 Å²	63	81.8 Å²	81.8	44%	0.441	47%	0.465	S	S	.	.	H	α-helix	trans	-63.4	-45.5	174.6	-176	0	0	0	0	112.1	V191 A192 F198 L199	V191-S195 VanDerWaalsContact O-CB 3.27Å; V191-S195 WeakPolarHBondContact O-CB 3.46Å; V191-S195 PolarHBondContact O-N 3.1Å; A192-S195 PolarHBondContact O-N 3.03Å; S195-F198 PolarHBondContact O-N 2.98Å; S195-L199 WeakPolarHBondContact O-CB 3.38Å; S195-L199 WeakPolarHBondContact O-CG 3.29Å; S195-L199 PolarHBondContact O-N 2.91Å
196	V	93.1	Very high	82.7	Confident	89 Å²	89	79.7 Å²	79.7	54%	0.539	46%	0.457	S	S	.	.	H	α-helix	trans	-62.5	-45	175.8	168.9	0	0	0	0	111.1	A192 L193 L199 L200	A192-V196 WeakPolarHBondContact O-CB 3.23Å; A192-V196 WeakPolarHBondContact O-CG2 3.18Å; A192-V196 PolarHBondContact O-N 3.3Å; L193-V196 PolarHBondContact O-N 3.14Å; V196-L199 PolarHBondContact O-N 3.22Å; V196-L200 VanDerWaalsContact O-CB 3.26Å; V196-L200 WeakPolarHBondContact O-CB 3.39Å; V196-L200 PolarHBondContact O-N 3.16Å
197	L	88.5	Confident	81.3	Confident	89 Å²	89	82 Å²	82	47%	0.466	47%	0.469	S	S	.	.	H	α-helix	trans	-64.4	-39	176.5	-72.7	170.9	0	0	0	112.1	L193 G194 L200 L201	L193-L197 HydrophobicContact CG-CD1 4.05Å; L193-L197 WeakPolarHBondContact O-CB 3.41Å; L193-L197 VanDerWaalsContact O-CG 3.29Å; L193-L197 WeakPolarHBondContact O-CG 3.32Å; L193-L197 PolarHBondContact O-N 2.91Å; G194-L197 PolarHBondContact O-N 3.26Å; L197-L200 PolarHBondContact O-N 3.14Å; L197-L201 WeakPolarHBondContact O-CB 3.26Å; L197-L201 VanDerWaalsContact O-CG 3.29Å; L197-L201 WeakPolarHBondContact O-CG 3.29Å; L197-L201 PolarHBondContact O-N 2.96Å
198	F	86.8	Confident	79.9	Confident	130 Å²	130	79.4 Å²	79.4	57%	0.57	46%	0.459	S	S	*	.	H	α-helix	trans	-65.4	-42.9	175.4	-178.3	-107.4	0	0	0	112	G194 S195 L200 L201 L202	G194-F198 VanDerWaalsContact O-CB 3.25Å; G194-F198 WeakPolarHBondContact O-CB 3.44Å; G194-F198 PolarHBondContact O-N 3.26Å; S195-F198 PolarHBondContact O-N 2.98Å; F198-L200 VanDerWaalsContact C-N 3.33Å; F198-L201 PolarHBondContact O-N 3.34Å; F198-L202 HydrophobicContact CD1-CD1 3.93Å; F198-L202 HydrophobicContact CE1-CD1 3.47Å; F198-L202 VanDerWaalsContact CE1-CD1 3.47Å; F198-L202 HydrophobicContact CE1-CG 4.26Å; F198-L202 HydrophobicContact CZ-CD1 3.84Å; F198-L202 HydrophobicContact CZ-CG 4.27Å; F198-L202 WeakPolarHBondContact O-CB 3.44Å; F198-L202 WeakPolarHBondContact O-CG 3.32Å; F198-L202 PolarHBondContact O-N 2.78Å
199	L	85.1	Confident	78	Confident	105 Å²	105	78.5 Å²	78.5	55%	0.55	46%	0.455	S	S	.	.	H	α-helix	trans	-67	-32.3	173.3	-70.7	171.8	0	0	0	112.6	S195 V196 G203	S195-L199 WeakPolarHBondContact O-CB 3.38Å; S195-L199 WeakPolarHBondContact O-CG 3.29Å; S195-L199 PolarHBondContact O-N 2.91Å; V196-L199 PolarHBondContact O-N 3.22Å; L199-G203 PolarHBondContact O-N 3.38Å
200	L	83.1	Confident	76	Confident	91 Å²	91	80.4 Å²	80.4	48%	0.476	46%	0.462	S	S	.	.	H	α-helix	trans	-69	-43.6	174	-157.1	173.7	0	0	0	110.4	V196 L197 F198 G203 I204	V196-L200 VanDerWaalsContact O-CB 3.26Å; V196-L200 WeakPolarHBondContact O-CB 3.39Å; V196-L200 PolarHBondContact O-N 3.16Å; L197-L200 PolarHBondContact O-N 3.14Å; F198-L200 VanDerWaalsContact C-N 3.33Å; L200-G203 PolarHBondContact O-N 3.48Å; L200-I204 HydrophobicContact CD2-CD1 3.39Å; L200-I204 HydrophobicContact CD2-CG1 3.95Å; L200-I204 WeakPolarHBondContact O-CG1 3.43Å; L200-I204 PolarHBondContact O-N 3.32Å
201	L	74.4	Confident	74.3	Confident	114 Å²	114	83 Å²	83	60%	0.597	48%	0.478	S	S	*	.	H	α-helix	trans	-65.3	-43.3	174.9	-73	168.7	0	0	0	112.3	L197 F198 I204 C205	L197-L201 WeakPolarHBondContact O-CB 3.26Å; L197-L201 VanDerWaalsContact O-CG 3.29Å; L197-L201 WeakPolarHBondContact O-CG 3.29Å; L197-L201 PolarHBondContact O-N 2.96Å; F198-L201 PolarHBondContact O-N 3.34Å; L201-I204 PolarHBondContact O-N 3.08Å; L201-C205 VanDerWaalsContact O-CB 3.27Å; L201-C205 WeakPolarHBondContact O-CB 3.33Å; L201-C205 PolarHBondContact O-N 2.68Å
202	L	75.9	Confident	72.2	Confident	48 Å²	48	87.8 Å²	87.8	25%	0.251	49%	0.494	S	S	.	.	H	α-helix	trans	-61.8	-43	170.8	-76.2	177.6	0	0	0	111.3	F198 C205 W206	F198-L202 HydrophobicContact CD1-CD1 3.93Å; F198-L202 HydrophobicContact CE1-CD1 3.47Å; F198-L202 VanDerWaalsContact CE1-CD1 3.47Å; F198-L202 HydrophobicContact CE1-CG 4.26Å; F198-L202 HydrophobicContact CZ-CD1 3.84Å; F198-L202 HydrophobicContact CZ-CG 4.27Å; F198-L202 WeakPolarHBondContact O-CB 3.44Å; F198-L202 WeakPolarHBondContact O-CG 3.32Å; F198-L202 PolarHBondContact O-N 2.78Å; L202-C205 PolarHBondContact O-N 2.94Å; L202-W206 HydrophobicContact CB-CZ2 4.36Å; L202-W206 HydrophobicContact CD1-CZ2 4.25Å; L202-W206 HydrophobicContact CD2-CZ2 4.23Å; L202-W206 WeakPolarHBondContact O-CB 3.48Å; L202-W206 PolarHBondContact O-N 2.81Å
203	G	70.2	Confident	70.1	Confident	28 Å²	28	90.5 Å²	90.5	29%	0.289	51%	0.51	S	S	.	.	H	α-helix	trans	-60	-46.6	176.5	0	0	0	0	0	112.8	L199 L200 W206 C207	L199-G203 PolarHBondContact O-N 3.38Å; L200-G203 PolarHBondContact O-N 3.48Å; G203-W206 PolarHBondContact O-N 2.95Å; G203-C207 VanDerWaalsContact O-CB 3.25Å; G203-C207 WeakPolarHBondContact O-CB 3.25Å; G203-C207 PolarHBondContact O-N 3.22Å; G203-C207 PolarHBondContact O-SG 3.01Å
204	I	70.9	Confident	68.1	Low	71 Å²	71	89.1 Å²	89.1	36%	0.364	51%	0.509	S	S	.	.	H	α-helix	trans	-59.7	-49.1	173.2	-72.7	171.5	0	0	0	110.3	L200 L201 W206 C207 Q208	L200-I204 HydrophobicContact CD2-CD1 3.39Å; L200-I204 HydrophobicContact CD2-CG1 3.95Å; L200-I204 WeakPolarHBondContact O-CG1 3.43Å; L200-I204 PolarHBondContact O-N 3.32Å; L201-I204 PolarHBondContact O-N 3.08Å; I204-W206 PolarHBondContact O-N 3.22Å; I204-C207 PolarHBondContact O-N 2.99Å; I204-Q208 HydrophobicContact CG2-CG 4.48Å; I204-Q208 WeakPolarHBondContact O-CB 3.27Å; I204-Q208 WeakPolarHBondContact O-CG 3.4Å; I204-Q208 PolarHBondContact O-N 3.36Å
205	C	57.2	Low	66	Low	31 Å²	31	91.6 Å²	91.6	21%	0.209	52%	0.519	C	S	.	.	H	α-helix	trans	-60.2	-45.6	-179.7	-169.8	0	0	0	0	111.9	L201 L202 Q208 C209	L201-C205 VanDerWaalsContact O-CB 3.27Å; L201-C205 WeakPolarHBondContact O-CB 3.33Å; L201-C205 PolarHBondContact O-N 2.68Å; L202-C205 PolarHBondContact O-N 2.94Å; C205-Q208 PolarHBondContact O-N 3.11Å; C205-C209 VanDerWaalsContact O-CB 3.27Å; C205-C209 WeakPolarHBondContact O-CB 3.47Å; C205-C209 PolarHBondContact O-N 2.79Å; C205-C209 PolarHBondContact O-SG 3.46Å; C205-C209 VanDerWaalsContact O-SG 3.33Å
206	W	58.9	Low	64	Low	171 Å²	171	90.7 Å²	90.7	65%	0.648	51%	0.512	S	S	*	.	H	α-helix	trans	-69.4	-41.4	179.1	-64.2	-8.3	0	0	0	112.2	L202 G203 I204 Q208 C209 C210	L202-W206 HydrophobicContact CB-CZ2 4.36Å; L202-W206 HydrophobicContact CD1-CZ2 4.25Å; L202-W206 HydrophobicContact CD2-CZ2 4.23Å; L202-W206 WeakPolarHBondContact O-CB 3.48Å; L202-W206 PolarHBondContact O-N 2.81Å; G203-W206 PolarHBondContact O-N 2.95Å; I204-W206 PolarHBondContact O-N 3.22Å; W206-Q208 PolarHBondContact O-N 3.17Å; W206-C209 PolarHBondContact O-N 3.37Å; W206-C210 PolarHBondContact O-N 3.3Å; W206-C210 PolarHBondContact O-SG 3.2Å; W206-C210 VanDerWaalsContact O-SG 3.41Å
207	C	51.4	Low	61.9	Low	88 Å²	88	96 Å²	96	60%	0.595	52%	0.524	S	S	*	.	H	α-helix	trans	-64.4	-27.5	174.5	-74	0	0	0	0	113.3	G203 I204	G203-C207 VanDerWaalsContact O-CB 3.25Å; G203-C207 WeakPolarHBondContact O-CB 3.25Å; G203-C207 PolarHBondContact O-N 3.22Å; G203-C207 PolarHBondContact O-SG 3.01Å; I204-C207 PolarHBondContact O-N 2.99Å
208	Q	51.9	Low	60	Low	71 Å²	71	97.2 Å²	97.2	33%	0.332	53%	0.534	S	S	.	.	H	α-helix	trans	-89.4	-23.8	178.7	-68.8	176.7	-11.9	0	0	113.4	I204 C205 W206 C220	I204-Q208 HydrophobicContact CG2-CG 4.48Å; I204-Q208 WeakPolarHBondContact O-CB 3.27Å; I204-Q208 WeakPolarHBondContact O-CG 3.4Å; I204-Q208 PolarHBondContact O-N 3.36Å; C205-Q208 PolarHBondContact O-N 3.11Å; W206-Q208 PolarHBondContact O-N 3.17Å; Q208-C220 PolarHBondContact OE1-SG 3.24Å
209	C	49.7	Very low	58.2	Low	68 Å²	68	95.9 Å²	95.9	46%	0.459	54%	0.542	S	S	.	.	S	Bend	trans	-97.2	7.4	-179.6	-68.7	0	0	0	0	114.7	C205 W206 P211	C205-C209 VanDerWaalsContact O-CB 3.27Å; C205-C209 WeakPolarHBondContact O-CB 3.47Å; C205-C209 PolarHBondContact O-N 2.79Å; C205-C209 PolarHBondContact O-SG 3.46Å; C205-C209 VanDerWaalsContact O-SG 3.33Å; W206-C209 PolarHBondContact O-N 3.37Å; C209-P211 WeakPolarHBondContact O-CD 3.33Å
210	C	46.9	Very low	56.6	Low	77 Å²	77	92.3 Å²	92.3	52%	0.52	53%	0.525	S	S	.	.			trans	-66.1	116.2	172.7	-82.7	0	0	0	0	111.3	W206 H212	W206-C210 PolarHBondContact O-N 3.3Å; W206-C210 PolarHBondContact O-SG 3.2Å; W206-C210 VanDerWaalsContact O-SG 3.41Å; C210-H212 PolarHBondContact O-N 2.89Å
211	P	51.2	Low	55.3	Low	130 Å²	130	94.3 Å²	94.3	84%	0.844	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.1	14.8	-161.8	32.2	-38.6	0	0	0	115.6	C209	C209-P211 WeakPolarHBondContact O-CD 3.33Å
212	H	49	Very low	54	Low	181 Å²	181	92.8 Å²	92.8	84%	0.838	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	-138.2	6	-163.6	-130.4	-65.6	0	0	0	118.7	C210	C210-H212 PolarHBondContact O-N 2.89Å
213	S	49.4	Very low	52.8	Low	106 Å²	106	92.2 Å²	92.2	74%	0.741	54%	0.542	S	S	*	.			trans	147.8	83.7	152.8	176.4	0	0	0	0	113.9
214	C	49.4	Very low	51.8	Low	81 Å²	81	95.5 Å²	95.5	55%	0.547	56%	0.559	S	S	.	*			trans	-132.4	109.3	162.7	-79.8	0	0	0	0	110.3	C216	C214-C216 PolarHBondContact O-N 3.49Å
215	C	49.8	Very low	50.8	Low	91 Å²	91	99.4 Å²	99.4	62%	0.615	58%	0.581	S	S	*	*			trans	-76.9	117.2	177.6	-71.1	0	0	0	0	110.9
216	C	51.8	Low	50.4	Low	45 Å²	45	102.3 Å²	102.3	30%	0.304	60%	0.597	S	S	.	*			trans	-99	124.6	177	-64.6	0	0	0	0	111.2	C214 C229	C214-C216 PolarHBondContact O-N 3.49Å; C216-C229 PolarHBondContact O-SG 3.32Å
217	Y	47.6	Very low	50	Low	201 Å²	201	97.7 Å²	97.7	79%	0.788	59%	0.591	S	S	*	*	S	Bend	trans	-99.3	11.6	178.1	-147.9	-94.9	0	0	0	112.9
218	V	49	Very low	49.9	Very low	113 Å²	113	98.9 Å²	98.9	69%	0.685	60%	0.599	S	S	*	*	S	Bend	trans	-137	135.8	-178.9	-175.4	0	0	0	0	108.3
219	S	48.4	Very low	49.7	Very low	103 Å²	103	97.6 Å²	97.6	72%	0.72	60%	0.597	S	S	*	*			trans	-72.5	142	178.3	50.6	0	0	0	0	112.3
220	C	52.3	Low	49.6	Very low	30 Å²	30	97.5 Å²	97.5	20%	0.203	60%	0.595	C	S	.	*			trans	-122.2	141.3	-179.8	-177.4	0	0	0	0	112.5	Q208 C222 C223	Q208-C220 PolarHBondContact OE1-SG 3.24Å; C220-C222 PolarHBondContact O-N 3.04Å; C220-C222 VanDerWaalsContact O-N 3.17Å; C220-C223 CarbonylContact O-C 3.55Å; C220-C223 PolarHBondContact O-N 3.17Å
221	C	54.8	Low	49.8	Very low	133 Å²	133	102.7 Å²	102.7	90%	0.899	60%	0.604	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.6	-22.4	-179.4	-53.9	0	0	0	0	114.1
222	C	48	Very low	49.9	Very low	81 Å²	81	104.3 Å²	104.3	55%	0.547	60%	0.6	S	S	.	*	T	Hydrogen-bonded Turn	trans	-85.6	-11.8	-179.6	-61.2	0	0	0	0	114.1	C220	C220-C222 PolarHBondContact O-N 3.04Å; C220-C222 VanDerWaalsContact O-N 3.17Å
223	C	50.3	Low	50	Low	36 Å²	36	101.8 Å²	101.8	24%	0.243	59%	0.592	C	S	.	*			trans	-148.6	72.5	-176.8	-83	0	0	0	0	110.6	C220 D225 T226	C220-C223 CarbonylContact O-C 3.55Å; C220-C223 PolarHBondContact O-N 3.17Å; C223-D225 VanDerWaalsContact C-N 3.32Å; C223-D225 PolarHBondContact O-N 2.74Å; C223-T226 WeakPolarHBondContact CB-OG1 3.38Å; C223-T226 PolarHBondContact SG-OG1 3Å; C223-T226 VanDerWaalsContact SG-OG1 3.39Å
224	P	50.1	Low	50.2	Low	98 Å²	98	104.4 Å²	104.4	64%	0.636	59%	0.587	S	S	*	*	S	Bend	trans	-62.9	-37.7	178.8	24.6	-33.1	0	0	0	112.7
225	D	49.6	Very low	50.6	Low	153 Å²	153	105.6 Å²	105.6	82%	0.818	58%	0.584	S	S	*	*	S	Bend	trans	-99.8	-16.5	-168.3	-55.1	-52.4	0	0	0	114.6	C223	C223-D225 VanDerWaalsContact C-N 3.32Å; C223-D225 PolarHBondContact O-N 2.74Å
226	T	47.9	Very low	50.8	Low	91 Å²	91	103.9 Å²	103.9	56%	0.558	58%	0.576	S	S	*	*			trans	-110.6	39.7	-169.4	50.3	0	0	0	0	113.7	C223 C228	C223-T226 WeakPolarHBondContact CB-OG1 3.38Å; C223-T226 PolarHBondContact SG-OG1 3Å; C223-T226 VanDerWaalsContact SG-OG1 3.39Å; T226-C228 VanDerWaalsContact C-N 3.34Å; T226-C228 PolarHBondContact O-N 2.82Å
227	C	51.8	Low	51.1	Low	75 Å²	75	103.8 Å²	103.8	51%	0.507	58%	0.583	S	S	.	*			trans	-69.5	84.5	172.7	-74.8	0	0	0	0	111.9	C229	C227-C229 PolarHBondContact O-N 3.09Å
228	C	49.6	Very low	51.1	Low	113 Å²	113	101.8 Å²	101.8	76%	0.764	58%	0.578	S	S	*	*			trans	-70	62.2	177.1	-74.4	0	0	0	0	113.9	T226	T226-C228 VanDerWaalsContact C-N 3.34Å; T226-C228 PolarHBondContact O-N 2.82Å
229	C	46.1	Very low	51.3	Low	44 Å²	44	103 Å²	103	30%	0.297	58%	0.578	S	S	.	*			trans	-99.6	134.5	159.6	-102.3	0	0	0	0	109.4	C216 C227 R231	C216-C229 PolarHBondContact O-SG 3.32Å; C227-C229 PolarHBondContact O-N 3.09Å; C229-R231 VanDerWaalsContact C-N 3.27Å; C229-R231 PolarHBondContact O-N 3.22Å
230	P	48.5	Very low	51.4	Low	66 Å²	66	101.2 Å²	101.2	43%	0.429	57%	0.57	S	S	.	*			trans	-76.1	75.3	-178.1	32.2	-36.2	0	0	0	111.5	H232 L233 Y234	P230-H232 PolarHBondContact O-N 3.03Å; P230-L233 HydrophobicContact CB-CB 4.22Å; P230-L233 HydrophobicContact CB-CD1 4.03Å; P230-L233 HydrophobicContact CB-CG 4.16Å; P230-L233 HydrophobicContact CG-CD1 4.26Å; P230-L233 PolarHBondContact O-N 3.29Å; P230-Y234 PolarHBondContact O-N 3.34Å
231	R	51.2	Low	51.2	Low	186 Å²	186	108.2 Å²	108.2	70%	0.702	60%	0.597	S	S	*	*	H	α-helix	trans	-50.1	-41.4	174.3	-80.7	-170.6	176.1	166.9	-0.2	111.7	C229 L233 Y234 E235	C229-R231 VanDerWaalsContact C-N 3.27Å; C229-R231 PolarHBondContact O-N 3.22Å; R231-L233 PolarHBondContact O-N 2.78Å; R231-Y234 PolarHBondContact O-N 3.43Å; R231-Y234 VanDerWaalsContact O-N 3.1Å; R231-E235 WeakPolarHBondContact O-CB 3.34Å; R231-E235 WeakPolarHBondContact O-CG 3.2Å; R231-E235 PolarHBondContact O-N 2.99Å
232	H	52.9	Low	50.7	Low	163 Å²	163	105.7 Å²	105.7	76%	0.755	58%	0.581	S	S	*	*	H	α-helix	trans	-53.3	-34.4	174.5	-70.4	-71.7	0	0	0	114.5	P230 A236	P230-H232 PolarHBondContact O-N 3.03Å; H232-A236 WeakPolarHBondContact O-CB 3.37Å; H232-A236 PolarHBondContact O-N 3.34Å; H232-A236 VanDerWaalsContact O-N 3.12Å
233	L	52.3	Low	50.6	Low	128 Å²	128	112.7 Å²	112.7	67%	0.67	60%	0.596	S	S	*	*	H	α-helix	trans	-82	-37	176.7	-67.2	179.5	0	0	0	112.4	P230 R231 G237	P230-L233 HydrophobicContact CB-CB 4.22Å; P230-L233 HydrophobicContact CB-CD1 4.03Å; P230-L233 HydrophobicContact CB-CG 4.16Å; P230-L233 HydrophobicContact CG-CD1 4.26Å; P230-L233 PolarHBondContact O-N 3.29Å; R231-L233 PolarHBondContact O-N 2.78Å; L233-G237 PolarHBondContact O-N 2.85Å
234	Y	53.6	Low	50.5	Low	162 Å²	162	119.4 Å²	119.4	64%	0.635	62%	0.623	S	S	*	*	H	α-helix	trans	-69.9	-38.9	177.7	-164.1	-99.3	0	0	0	111.9	P230 R231 K238	P230-Y234 PolarHBondContact O-N 3.34Å; R231-Y234 PolarHBondContact O-N 3.43Å; R231-Y234 VanDerWaalsContact O-N 3.1Å; Y234-K238 WeakPolarHBondContact O-CB 3.27Å; Y234-K238 PolarHBondContact O-N 3.36Å
235	E	57.2	Low	49.8	Very low	106 Å²	106	118.8 Å²	118.8	50%	0.495	63%	0.626	S	S	.	*	H	α-helix	trans	-71.1	-42.1	175.1	-69.8	167.3	-166.7	0	0	111.4	R231 G237 K238 M239	R231-E235 WeakPolarHBondContact O-CB 3.34Å; R231-E235 WeakPolarHBondContact O-CG 3.2Å; R231-E235 PolarHBondContact O-N 2.99Å; E235-G237 PolarHBondContact O-N 2.84Å; E235-K238 PolarHBondContact O-N 3.48Å; E235-M239 WeakPolarHBondContact O-CG 3.33Å; E235-M239 PolarHBondContact O-N 3.49Å
236	A	54.3	Low	49	Very low	54 Å²	54	115.9 Å²	115.9	45%	0.446	62%	0.623	S	S	.	*	H	α-helix	trans	-60.6	-43.3	171.6	0	0	0	0	0	112.2	H232 K238 M239 A240	H232-A236 WeakPolarHBondContact O-CB 3.37Å; H232-A236 PolarHBondContact O-N 3.34Å; H232-A236 VanDerWaalsContact O-N 3.12Å; A236-K238 VanDerWaalsContact C-N 3.3Å; A236-K238 PolarHBondContact O-N 2.85Å; A236-M239 PolarHBondContact O-N 2.84Å; A236-A240 WeakPolarHBondContact O-CB 3.44Å; A236-A240 PolarHBondContact O-N 3.21Å
237	G	57.2	Low	48.5	Very low	43 Å²	43	117.5 Å²	117.5	44%	0.443	64%	0.636	S	S	.	*	H	α-helix	trans	-61.6	-36.5	175.5	0	0	0	0	0	113.2	L233 E235 A240 K241	L233-G237 PolarHBondContact O-N 2.85Å; E235-G237 PolarHBondContact O-N 2.84Å; G237-A240 PolarHBondContact O-N 2.86Å; G237-K241 PolarHBondContact O-N 3.39Å
238	K	48.4	Very low	47.6	Very low	159 Å²	159	120.4 Å²	120.4	69%	0.691	65%	0.651	S	S	*	*	H	α-helix	trans	-70.5	-34.5	176	-161.1	172.4	-176.4	179.7	0	112.5	Y234 E235 A236	Y234-K238 WeakPolarHBondContact O-CB 3.27Å; Y234-K238 PolarHBondContact O-N 3.36Å; E235-K238 PolarHBondContact O-N 3.48Å; A236-K238 VanDerWaalsContact C-N 3.3Å; A236-K238 PolarHBondContact O-N 2.85Å
239	M	52.5	Low	46.9	Very low	138 Å²	138	120.8 Å²	120.8	68%	0.68	65%	0.652	S	S	*	*	H	α-helix	trans	-72.6	-33.7	172.7	-68.2	-65.7	-170.6	0	0	113.1	E235 A236 S242	E235-M239 WeakPolarHBondContact O-CG 3.33Å; E235-M239 PolarHBondContact O-N 3.49Å; A236-M239 PolarHBondContact O-N 2.84Å; M239-S242 PolarHBondContact O-OG 3.47Å
240	A	51.6	Low	46.2	Very low	66 Å²	66	122 Å²	122	55%	0.545	67%	0.665	S	S	.	*	H	α-helix	trans	-65.8	-39.3	179.7	0	0	0	0	0	112.4	A236 G237	A236-A240 WeakPolarHBondContact O-CB 3.44Å; A236-A240 PolarHBondContact O-N 3.21Å; G237-A240 PolarHBondContact O-N 2.86Å
241	K	46.3	Very low	45.2	Very low	178 Å²	178	127.1 Å²	127.1	77%	0.774	68%	0.683	S	S	*	*	H	α-helix	trans	-81.3	-19.2	-174.9	-160.7	166.4	-175.9	175.5	0	114.5	G237	G237-K241 PolarHBondContact O-N 3.39Å
242	S	45.8	Very low	44.2	Very low	80 Å²	80	124.9 Å²	124.9	56%	0.559	69%	0.69	S	S	*	*	H	α-helix	trans	-79.5	-17	178.6	61	0	0	0	0	114.2	M239	M239-S242 PolarHBondContact O-OG 3.47Å
243	R	44.7	Very low	43.7	Very low	228 Å²	228	122.8 Å²	122.8	86%	0.86	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.3	-1.2	-179.3	-75.2	-168.8	172	-158.2	-1.4	115.6
244	Q	48.8	Very low	42.6	Very low	177 Å²	177	122.2 Å²	122.2	83%	0.827	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102	20.7	-179.3	-73	-174.7	-34.3	0	0	114
245	A	36.6	Very low	41.4	Very low	84 Å²	84	125.1 Å²	125.1	69%	0.694	70%	0.704	S	S	*	*	S	Bend	trans	-111.6	51.6	-179.5	0	0	0	0	0	113.6
246	A	31.3	Very low	41.3	Very low	92 Å²	92	124.6 Å²	124.6	76%	0.76	71%	0.709	S	S	*	*			trans	64.6	166.3	166.8	0	0	0	0	0	118.3
247	P	38.5	Very low	40	Very low	125 Å²	125	132.4 Å²	132.4	81%	0.812	73%	0.729	S	S	*	*			cis	-118.9	176.7	-26.6	25.5	-4.9	0	0	0	113.3
248	V	32.2	Very low	38.8	Very low	136 Å²	136	140.6 Å²	140.6	82%	0.824	75%	0.748	S	S	*	*			trans	-87.6	148.5	-176.8	-166.6	0	0	0	0	110.9
249	P	36	Very low	37.9	Very low	122 Å²	122	140 Å²	140	79%	0.792	75%	0.751	S	S	*	*				-138.1	147.8	103.5	36.8	-24.9	0	0	0	114.8
250	A	29.8	Very low	36.7	Very low	69 Å²	69	138.4 Å²	138.4	57%	0.57	75%	0.754	S	S	*	*			trans	18.9	141.5	158.5	0	0	0	0	0	121.4
251	Q	29.1	Very low	35.6	Very low	173 Å²	173	140.5 Å²	140.5	81%	0.808	76%	0.764	S	S	*	*			cis	-142	164.7	35.5	-42	-74.3	-23	0	0	112.1
252	V	30.1	Very low	35.1	Very low	140 Å²	140	138.6 Å²	138.6	85%	0.848	77%	0.767	S	S	*	*			trans	-136.3	115.7	168.6	171.3	0	0	0	0	109.8
253	P	41.7	Very low	35.1	Very low	118 Å²	118	140.1 Å²	140.1	77%	0.766	78%	0.775	S	S	*	*				-151.3	171.1	124.3	35.7	-18	0	0	0	115.1
254	V	29.4	Very low	34.5	Very low	117 Å²	117	135.3 Å²	135.3	71%	0.709	77%	0.771	S	S	*	*			cis	-161.6	127.7	-34.5	131.2	0	0	0	0	108.6
255	Y	27.2	Very low	33.8	Very low	223 Å²	223	133 Å²	133	88%	0.875	77%	0.769	S	S	*	*			trans	60.7	162.6	157.4	-81.2	-110.7	0	0	0	122.5
256	P	55.8	Low	33.7	Very low	94 Å²	94	134.8 Å²	134.8	61%	0.61	77%	0.771	S	S	*	*			trans	-120.8	171.5	-165.8	43.3	-32	0	0	0	115.7
257	Y	27.7	Very low	34.9	Very low	219 Å²	219	135.9 Å²	135.9	86%	0.859	77%	0.77	S	S	*	*			trans	-167.4	144.3	155.4	-80.6	-56.3	0	0	0	116.1
258	Y	31.2	Very low	34.5	Very low	214 Å²	214	138.3 Å²	138.3	84%	0.839	78%	0.776	S	S	*	*			trans	59.2	172.4	151.8	-84.7	-132.6	0	0	0	118.7
259	I	30.6	Very low	34.2	Very low	146 Å²	146	136 Å²	136	75%	0.749	77%	0.771	S	S	*	*			cis	-138.4	155	-5	-40	161.7	0	0	0	106.1
260	S	26.5	Very low	34.6	Very low	106 Å²	106	135.8 Å²	135.8	74%	0.741	77%	0.769	S	S	*	*			cis	118.5	152	-4	-151.6	0	0	0	0	117.5
261	S	28.7	Very low	34.4	Very low	109 Å²	109	138 Å²	138	76%	0.762	78%	0.781	S	S	*	*			trans	71.9	125.7	166.8	41.4	0	0	0	0	124.7
262	V	36.5	Very low	34.3	Very low	138 Å²	138	134.7 Å²	134.7	84%	0.836	78%	0.777	S	S	*	*			trans	-66.8	-172.5	163.8	-82.2	0	0	0	0	114.4
263	P	44	Very low	34.2	Very low	113 Å²	113	136.2 Å²	136.2	73%	0.734	78%	0.775	S	S	*	*			cis	-149.3	171.6	17.9	40.4	-16	0	0	0	123.1
264	T	32.5	Very low	33.8	Very low	127 Å²	127	138.2 Å²	138.2	78%	0.779	78%	0.778	S	S	*	*			trans	2.3	152.5	146.2	-27.6	0	0	0	0	124.4
265	V	34.3	Very low	33.8	Very low	128 Å²	128	140 Å²	140	78%	0.776	78%	0.783	S	S	*	*				172.2	118.7	126.1	151.9	0	0	0	0	117.4
266	V	35.4	Very low	34.1	Very low	122 Å²	122	135.2 Å²	135.2	74%	0.739	78%	0.78	S	S	*	*			trans	57.7	143.4	138.1	-174.2	0	0	0	0	124.8
267	P	55.7	Low	32.7	Very low	115 Å²	115	139.9 Å²	139.9	75%	0.747	79%	0.791	S	S	*	*			trans	-119.2	172.4	-179.3	44	-33.7	0	0	0	117.6
268	L	29.3	Very low	32.7	Very low	176 Å²	176	137.9 Å²	137.9	92%	0.921	79%	0.791	S	S	*	*			trans	-155.8	162.2	168.9	-92.8	119.5	0	0	0	115
269	A	26.8	Very low	32.5	Very low	88 Å²	88	133.5 Å²	133.5	73%	0.727	79%	0.792	S	S	*	*			trans	-159.7	-178.2	171.9	0	0	0	0	0	108.7
270	P	44.3	Very low	32.3	Very low	116 Å²	116	131 Å²	131	75%	0.753	79%	0.787	S	S	*	*			cis	-140	-155.7	3	45.2	-25.2	0	0	0	115.2
271	S	25.4	Very low	32.5	Very low	117 Å²	117	133.4 Å²	133.4	82%	0.818	79%	0.79	S	S	*	*			trans	81.7	152.1	166.5	83.1	0	0	0	0	117.6
272	S	27.6	Very low	32.3	Very low	103 Å²	103	134 Å²	134	72%	0.72	79%	0.789	S	S	*	*			cis	-148.8	148	3.2	55.7	0	0	0	0	114.9
273	Q	28.4	Very low	31.8	Very low	172 Å²	172	132.6 Å²	132.6	80%	0.804	79%	0.786	S	S	*	*			trans	34.7	122	136.7	-165.5	-179.2	38.8	0	0	122
274	L	32.1	Very low	31	Very low	160 Å²	160	132.5 Å²	132.5	84%	0.838	78%	0.783	S	S	*	*				172.8	131.1	120.6	-93.2	172.7	0	0	0	112.9
275	D	29	Very low	30.8	Very low	153 Å²	153	134.2 Å²	134.2	82%	0.818	78%	0.782	S	S	*	*			trans	-92.2	155.9	165.9	-84.1	-63.1	0	0	0	111.1
276	P	35.2	Very low	30.6	Very low	124 Å²	124	133.5 Å²	133.5	81%	0.805	77%	0.774	S	S	*	*				-150.7	128.2	108.7	34.8	-16.3	0	0	0	117.8
277	K	25.3	Very low	30.4	Very low	192 Å²	192	133.9 Å²	133.9	84%	0.835	77%	0.772	S	S	*	*				54.6	88.2	126.8	-160.5	176.3	-176.8	175.4	0	120.7
278	M	28	Very low	29.4	Very low	177 Å²	177	136.7 Å²	136.7	87%	0.872	78%	0.78	S	S	*	*				43.6	113	121.6	-164.3	136	-179.5	0	0	121.3
279	S	26.7	Very low	29.6	Very low	122 Å²	122	133.2 Å²	133.2	85%	0.853	78%	0.776	S	S	*	*			trans	-151.9	170.4	145.8	57.6	0	0	0	0	110
280	S	27.3	Very low	29.8	Very low	92 Å²	92	132.7 Å²	132.7	64%	0.643	78%	0.78	S	S	*	*			trans	-155.4	147.9	-150.1	60.6	0	0	0	0	116.5
281	I	29	Very low	29.2	Very low	158 Å²	158	134.3 Å²	134.3	81%	0.81	79%	0.787	S	S	*	*			trans	58.5	153.1	164	12.8	175.1	0	0	0	117.1
282	T	26.1	Very low	29.7	Very low	121 Å²	121	140.7 Å²	140.7	74%	0.742	79%	0.793	S	S	*	*			cis	-150.8	157.9	-3.3	-39.3	0	0	0	0	109.2
283	S	24.9	Very low	30	Very low	109 Å²	109	139.9 Å²	139.9	76%	0.762	79%	0.787	S	S	*	*			trans	-158.7	114.4	147.7	24.6	0	0	0	0	114.7
284	T	28.8	Very low	30.1	Very low	111 Å²	111	135.3 Å²	135.3	68%	0.681	79%	0.786	S	S	*	*			trans	39.4	119.7	137.8	55.6	0	0	0	0	122.8
285	E	27.5	Very low	30.2	Very low	163 Å²	163	137.4 Å²	137.4	76%	0.762	78%	0.784	S	S	*	*				73.1	145.4	124.3	-68.1	-158.2	86.8	0	0	121.7
286	N	30.8	Very low	30.4	Very low	112 Å²	112	141.2 Å²	141.2	60%	0.599	79%	0.787	S	S	*	*			cis	-160.7	160.7	-20.9	-132.2	-25.3	0	0	0	112
287	N	31	Very low	30.5	Very low	130 Å²	130	143.2 Å²	143.2	70%	0.695	79%	0.79	S	S	*	*			trans	52.9	102.7	155.5	-62.6	-45.5	0	0	0	121.4
288	L	33.3	Very low	31.1	Very low	175 Å²	175	140.1 Å²	140.1	92%	0.916	79%	0.788	S	S	*	*				170.2	153	105.9	-92.9	162.8	0	0	0	114.2
289	A	34.3	Very low	31.3	Very low	103 Å²	103	137.3 Å²	137.3	85%	0.851	79%	0.785	S	S	*	*			trans	60.6	114.1	169.1	0	0	0	0	0	118.7
290	G	30	Very low	31.7	Very low	77 Å²	77	136.8 Å²	136.8	79%	0.794	78%	0.782	S	S	*	*			trans	179.5	73	173.5	0	0	0	0	0	116.7
291	V	33.1	Very low	32.6	Very low	149 Å²	149	141.1 Å²	141.1	90%	0.903	79%	0.792	S	S	*	*			trans	-121.9	73.3	164	-171.4	0	0	0	0	110.2
292	R	35.6	Very low	33.4	Very low	252 Å²	252	140.3 Å²	140.3	95%	0.951	79%	0.789	S	S	*	*			trans	-139.1	75.5	162.2	-85.4	-172.1	171.1	172.9	-2.4	108.1
293	S	33.8	Very low	34.4	Very low	85 Å²	85	143.3 Å²	143.3	59%	0.594	80%	0.795	S	S	*	*			trans	-90.3	113	173	-166.2	0	0	0	0	110	Y295	S293-Y295 WeakPolarHBondContact OG-CD2 3.45Å; S293-Y295 WeakPolarHBondContact OG-CE2 3.28Å
294	G	30.9	Very low	35.8	Very low	76 Å²	76	141.9 Å²	141.9	78%	0.784	78%	0.779	S	S	*	*			trans	-124.9	94.4	173	0	0	0	0	0	109.5
295	Y	34.8	Very low	37.1	Very low	204 Å²	204	141.5 Å²	141.5	80%	0.8	78%	0.781	S	S	*	*			trans	-87.9	110.2	177.7	-67.4	-57.6	0	0	0	111.2	S293 L297	S293-Y295 WeakPolarHBondContact OG-CD2 3.45Å; S293-Y295 WeakPolarHBondContact OG-CE2 3.28Å; Y295-L297 PolarHBondContact O-N 3.48Å
296	R	33.2	Very low	38.7	Very low	234 Å²	234	141.3 Å²	141.3	88%	0.883	78%	0.782	S	S	*	*			trans	-73.3	105.9	157.7	-87.7	-173.9	165.2	113.6	-4.9	108.4	T298	R296-T298 PolarHBondContact O-N 2.95Å
297	L	36.2	Very low	40	Very low	165 Å²	165	142.2 Å²	142.2	86%	0.864	78%	0.78	S	S	*	*			trans	-81.7	99	165.5	-77.4	163.8	0	0	0	109.3	Y295 S299	Y295-L297 PolarHBondContact O-N 3.48Å; L297-S299 PolarHBondContact O-N 2.89Å
298	T	37.5	Very low	41.9	Very low	127 Å²	127	140.1 Å²	140.1	78%	0.779	77%	0.772	S	S	*	*			trans	-86.2	97.4	165.1	49.3	0	0	0	0	108.9	R296 S300	R296-T298 PolarHBondContact O-N 2.95Å; T298-S300 PolarHBondContact O-N 3Å; T298-S300 VanDerWaalsContact O-N 3.12Å
299	S	33.3	Very low	43.6	Very low	118 Å²	118	137.5 Å²	137.5	83%	0.825	76%	0.758	S	S	*	*			trans	-72.5	99.9	176.8	55	0	0	0	0	111	L297	L297-S299 PolarHBondContact O-N 2.89Å
300	S	33.7	Very low	45	Very low	112 Å²	112	139.9 Å²	139.9	78%	0.783	75%	0.746	S	S	*	*			trans	-66.8	145.2	158.8	51.9	0	0	0	0	109.8	T298	T298-S300 PolarHBondContact O-N 3Å; T298-S300 VanDerWaalsContact O-N 3.12Å
301	Q	47.1	Very low	46.5	Very low	183 Å²	183	143.8 Å²	143.8	86%	0.855	74%	0.738	S	S	*	*	S	Bend	trans	-78.8	156.7	-174.5	-166	163.7	-36.8	0	0	112.5
302	D	46.6	Very low	48.5	Very low	141 Å²	141	141 Å²	141	75%	0.754	72%	0.717	S	S	*	*	S	Bend	trans	74	131.3	179.7	-78.4	-8.8	0	0	0	119.7
303	Q	46.2	Very low	50.2	Low	184 Å²	184	135.2 Å²	135.2	86%	0.86	70%	0.701	S	S	*	*	S	Bend	trans	61.7	47	159.1	-58.1	-163.3	8	0	0	121.5
304	D	53.6	Low	52	Low	79 Å²	79	136.7 Å²	136.7	42%	0.422	70%	0.697	S	S	.	*			trans	-153.9	20	150.8	-123	-11.4	0	0	0	120.2	M306 K307 V308	D304-M306 PolarHBondContact O-N 3.36Å; D304-M306 VanDerWaalsContact O-N 3.09Å; D304-K307 PolarHBondContact O-N 2.88Å; D304-K307 VanDerWaalsContact O-N 3.15Å; D304-K307 WeakPolarHBondContact OD1-CB 3.23Å; D304-K307 WeakPolarHBondContact OD1-CD 3.35Å; D304-K307 WeakPolarHBondContact OD1-CG 3.3Å; D304-K307 IonicContact OD1-NZ 2.64Å; D304-K307 PolarHBondContact OD1-NZ 2.85Å; D304-K307 WeakPolarHBondContact OD2-CD 3.48Å; D304-K307 IonicContact OD2-NZ 2.68Å; D304-K307 PolarHBondContact OD2-NZ 2.95Å; D304-V308 PolarHBondContact O-N 3.19Å
305	S	56.1	Low	53.2	Low	103 Å²	103	138.4 Å²	138.4	72%	0.72	68%	0.684	S	S	*	*	H	α-helix	trans	-55.2	-32.1	-177.7	52.8	0	0	0	0	114.7
306	M	61.5	Low	54.1	Low	159 Å²	159	134.5 Å²	134.5	78%	0.783	68%	0.677	S	S	*	*	H	α-helix	trans	-80.4	-28.9	-178.8	-161.9	160.6	-129.4	0	0	113.6	D304 Y310	D304-M306 PolarHBondContact O-N 3.36Å; D304-M306 VanDerWaalsContact O-N 3.09Å; M306-Y310 PolarHBondContact O-N 2.85Å
307	K	59.6	Low	54.8	Low	131 Å²	131	127 Å²	127	57%	0.57	67%	0.665	S	S	*	*	H	α-helix	trans	-68.3	-37.5	171	-79.7	-162.1	-151.7	79.7	0	111.6	D304 L309 Y310 Y311	D304-K307 PolarHBondContact O-N 2.88Å; D304-K307 VanDerWaalsContact O-N 3.15Å; D304-K307 WeakPolarHBondContact OD1-CB 3.23Å; D304-K307 WeakPolarHBondContact OD1-CD 3.35Å; D304-K307 WeakPolarHBondContact OD1-CG 3.3Å; D304-K307 IonicContact OD1-NZ 2.64Å; D304-K307 PolarHBondContact OD1-NZ 2.85Å; D304-K307 WeakPolarHBondContact OD2-CD 3.48Å; D304-K307 IonicContact OD2-NZ 2.68Å; D304-K307 PolarHBondContact OD2-NZ 2.95Å; K307-L309 PolarHBondContact O-N 2.86Å; K307-Y310 PolarHBondContact O-N 3.32Å; K307-Y311 WeakPolarHBondContact O-CB 3.49Å; K307-Y311 PolarHBondContact O-N 3.31Å
308	V	69.1	Low	55.5	Low	86 Å²	86	125.2 Å²	125.2	52%	0.521	65%	0.652	S	S	.	*	H	α-helix	trans	-61.4	-44.7	-179.9	177.4	0	0	0	0	111	D304 Y311 I312	D304-V308 PolarHBondContact O-N 3.19Å; V308-Y311 PolarHBondContact O-N 3.17Å; V308-I312 HydrophobicContact CG1-CD1 3.91Å; V308-I312 WeakPolarHBondContact O-CG1 3.49Å; V308-I312 PolarHBondContact O-N 3.37Å; V308-I312 VanDerWaalsContact O-N 3.09Å
309	L	69.7	Low	55.8	Low	119 Å²	119	126 Å²	126	62%	0.623	65%	0.645	S	S	*	*	H	α-helix	trans	-60.3	-48.6	173.6	-78.5	166.7	0	0	0	112	K307 Y311 I312 E313	K307-L309 PolarHBondContact O-N 2.86Å; L309-Y311 VanDerWaalsContact C-N 3.26Å; L309-Y311 PolarHBondContact O-N 3.37Å; L309-I312 PolarHBondContact O-N 2.87Å; L309-E313 WeakPolarHBondContact O-CB 3.1Å; L309-E313 PolarHBondContact O-N 3.3Å
310	Y	63.7	Low	56.2	Low	153 Å²	153	125.7 Å²	125.7	60%	0.6	64%	0.64	S	S	*	*	H	α-helix	trans	-62.2	-31.5	179.1	-169.3	-104.8	0	0	0	113.1	M306 K307 K314	M306-Y310 PolarHBondContact O-N 2.85Å; K307-Y310 PolarHBondContact O-N 3.32Å; Y310-K314 WeakPolarHBondContact O-CB 3.25Å; Y310-K314 PolarHBondContact O-N 2.73Å; Y310-K314 VanDerWaalsContact O-N 3.07Å
311	Y	61.8	Low	56.8	Low	159 Å²	159	127.4 Å²	127.4	62%	0.624	65%	0.646	S	S	*	*	H	α-helix	trans	-71.9	-42	175.5	-137.7	-77.7	0	0	0	112	K307 V308 L309 K314 E315	K307-Y311 WeakPolarHBondContact O-CB 3.49Å; K307-Y311 PolarHBondContact O-N 3.31Å; V308-Y311 PolarHBondContact O-N 3.17Å; L309-Y311 VanDerWaalsContact C-N 3.26Å; L309-Y311 PolarHBondContact O-N 3.37Å; Y311-K314 PolarHBondContact O-N 3.44Å; Y311-E315 HydrophobicContact CD1-CG 4.11Å; Y311-E315 HydrophobicContact CE1-CG 4.46Å; Y311-E315 VanDerWaalsContact O-CG 3.29Å; Y311-E315 WeakPolarHBondContact O-CG 3.27Å; Y311-E315 PolarHBondContact O-N 2.84Å
312	I	74	Confident	56.4	Low	92 Å²	92	123.3 Å²	123.3	47%	0.472	64%	0.638	S	S	.	*	H	α-helix	trans	-66	-44.1	177.2	-67.1	165.1	0	0	0	110.8	V308 L309 K314 E315 L316	V308-I312 HydrophobicContact CG1-CD1 3.91Å; V308-I312 WeakPolarHBondContact O-CG1 3.49Å; V308-I312 PolarHBondContact O-N 3.37Å; V308-I312 VanDerWaalsContact O-N 3.09Å; L309-I312 PolarHBondContact O-N 2.87Å; I312-K314 VanDerWaalsContact C-N 3.33Å; I312-K314 PolarHBondContact O-N 2.88Å; I312-E315 PolarHBondContact O-N 2.9Å; I312-L316 HydrophobicContact CG2-CD1 4.01Å; I312-L316 WeakPolarHBondContact O-CB 3.41Å; I312-L316 VanDerWaalsContact O-CG 3.3Å; I312-L316 WeakPolarHBondContact O-CG 3.03Å; I312-L316 PolarHBondContact O-N 3.34Å
313	E	72.3	Confident	56.1	Low	130 Å²	130	127.9 Å²	127.9	61%	0.607	64%	0.644	S	S	*	*	H	α-helix	trans	-59.7	-43.1	174.9	-176	176	-161.4	0	0	111.5	L309 L316 A317	L309-E313 WeakPolarHBondContact O-CB 3.1Å; L309-E313 PolarHBondContact O-N 3.3Å; E313-L316 PolarHBondContact O-N 2.69Å; E313-A317 PolarHBondContact O-N 3.17Å; E313-A317 VanDerWaalsContact O-N 3.1Å
314	K	70.6	Confident	55.7	Low	116 Å²	116	127.8 Å²	127.8	50%	0.504	65%	0.649	S	S	.	*	H	α-helix	trans	-67.6	-41.1	178.2	-176.1	173.7	-179.3	-178.3	0	113.4	Y310 Y311 I312 A317 Q318	Y310-K314 WeakPolarHBondContact O-CB 3.25Å; Y310-K314 PolarHBondContact O-N 2.73Å; Y310-K314 VanDerWaalsContact O-N 3.07Å; Y311-K314 PolarHBondContact O-N 3.44Å; I312-K314 VanDerWaalsContact C-N 3.33Å; I312-K314 PolarHBondContact O-N 2.88Å; K314-A317 PolarHBondContact O-N 3.39Å; K314-Q318 PolarHBondContact O-NE2 3.05Å; K314-Q318 PolarHBondContact O-OE1 3.4Å
315	E	57.3	Low	55	Low	112 Å²	112	129.1 Å²	129.1	52%	0.523	67%	0.671	S	S	.	*	H	α-helix	trans	-62.3	-45.2	173.8	-72.5	-105.1	130.4	0	0	111.1	Y311 I312 A317 Q318 F319	Y311-E315 HydrophobicContact CD1-CG 4.11Å; Y311-E315 HydrophobicContact CE1-CG 4.46Å; Y311-E315 VanDerWaalsContact O-CG 3.29Å; Y311-E315 WeakPolarHBondContact O-CG 3.27Å; Y311-E315 PolarHBondContact O-N 2.84Å; I312-E315 PolarHBondContact O-N 2.9Å; E315-A317 VanDerWaalsContact C-N 3.25Å; E315-A317 PolarHBondContact O-N 3.01Å; E315-Q318 PolarHBondContact O-N 3.23Å; E315-F319 VanDerWaalsContact O-CD2 3.23Å; E315-F319 WeakPolarHBondContact O-CD2 3.49Å; E315-F319 VanDerWaalsContact O-CE2 3.28Å; E315-F319 WeakPolarHBondContact O-CE2 3.29Å
316	L	53.6	Low	54.2	Low	122 Å²	122	129.4 Å²	129.4	64%	0.639	67%	0.673	S	S	*	*	H	α-helix	trans	-59.7	-35.6	177.3	-74.4	167.7	0	0	0	112.4	I312 E313 Q318	I312-L316 HydrophobicContact CG2-CD1 4.01Å; I312-L316 WeakPolarHBondContact O-CB 3.41Å; I312-L316 VanDerWaalsContact O-CG 3.3Å; I312-L316 WeakPolarHBondContact O-CG 3.03Å; I312-L316 PolarHBondContact O-N 3.34Å; E313-L316 PolarHBondContact O-N 2.69Å; L316-Q318 PolarHBondContact O-N 3.24Å
317	A	48.5	Very low	52.9	Low	76 Å²	76	130.3 Å²	130.3	63%	0.628	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.9	2.2	175.8	0	0	0	0	0	114.8	E313 K314 E315	E313-A317 PolarHBondContact O-N 3.17Å; E313-A317 VanDerWaalsContact O-N 3.1Å; K314-A317 PolarHBondContact O-N 3.39Å; E315-A317 VanDerWaalsContact C-N 3.25Å; E315-A317 PolarHBondContact O-N 3.01Å
318	Q	50.1	Low	51.5	Low	128 Å²	128	133.3 Å²	133.3	60%	0.598	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.1	-2	-178	-103.5	81	116.2	0	0	114.8	K314 E315 L316	K314-Q318 PolarHBondContact O-NE2 3.05Å; K314-Q318 PolarHBondContact O-OE1 3.4Å; E315-Q318 PolarHBondContact O-N 3.23Å; L316-Q318 PolarHBondContact O-N 3.24Å
319	F	42.9	Very low	49.6	Very low	143 Å²	143	134.5 Å²	134.5	63%	0.627	71%	0.705	S	S	*	*			trans	-87.8	123.1	-176.7	-72.1	-82.5	0	0	0	114.3	E315 T321	E315-F319 VanDerWaalsContact O-CD2 3.23Å; E315-F319 WeakPolarHBondContact O-CD2 3.49Å; E315-F319 VanDerWaalsContact O-CE2 3.28Å; E315-F319 WeakPolarHBondContact O-CE2 3.29Å; F319-T321 PolarHBondContact O-N 3.48Å
320	P	42.1	Very low	47.6	Very low	111 Å²	111	134.3 Å²	134.3	72%	0.721	71%	0.713	S	S	*	*			trans	-82.9	107.3	-179.5	31.4	-34.1	0	0	0	113.3	S322	P320-S322 VanDerWaalsContact C-N 3.34Å; P320-S322 PolarHBondContact O-N 2.82Å
321	T	46.7	Very low	45.9	Very low	149 Å²	149	132.9 Å²	132.9	91%	0.914	73%	0.726	S	S	*	*			trans	-80.4	58.6	-176.1	44.1	0	0	0	0	114.5	F319	F319-T321 PolarHBondContact O-N 3.48Å
322	S	39.3	Very low	44.4	Very low	97 Å²	97	133.7 Å²	133.7	68%	0.678	74%	0.738	S	S	*	*			trans	-143.4	7.8	-172.7	64.2	0	0	0	0	118.6	P320	P320-S322 VanDerWaalsContact C-N 3.34Å; P320-S322 PolarHBondContact O-N 2.82Å
323	R	39.4	Very low	42.3	Very low	237 Å²	237	135.4 Å²	135.4	89%	0.894	76%	0.758	S	S	*	*	S	Bend	trans	-134.2	44.7	-174.2	-72.3	-168.1	173.4	-178	-0.7	116.8
324	L	37.3	Very low	40.9	Very low	182 Å²	182	137.6 Å²	137.6	95%	0.953	77%	0.768	S	S	*	*			trans	-134.5	22.8	170.1	-114.8	117.9	0	0	0	115.1
325	A	38.9	Very low	39.1	Very low	107 Å²	107	139.9 Å²	139.9	88%	0.884	79%	0.785	S	S	*	*			trans	-112.7	45.3	-179.9	0	0	0	0	0	113.1
326	S	40.2	Very low	37.8	Very low	109 Å²	109	140.6 Å²	140.6	76%	0.762	80%	0.802	S	S	*	*			trans	-161.2	108.5	169.2	-174.6	0	0	0	0	112.5
327	L	34	Very low	36.7	Very low	178 Å²	178	140.2 Å²	140.2	93%	0.932	81%	0.809	S	S	*	*			trans	175.4	135.7	148.4	-98.2	161.5	0	0	0	108.1
328	K	30.5	Very low	36.1	Very low	193 Å²	193	144.8 Å²	144.8	84%	0.839	82%	0.822	S	S	*	*			trans	-148.7	153.2	179.4	-179.4	171.5	179.1	176.4	0	110.8
329	S	28.8	Very low	35.5	Very low	111 Å²	111	147.5 Å²	147.5	78%	0.776	84%	0.835	S	S	*	*			trans	75.5	147.1	175	84.1	0	0	0	0	114.1
330	S	27.6	Very low	35.4	Very low	115 Å²	115	148.7 Å²	148.7	80%	0.804	85%	0.848	S	S	*	*			cis	-158.3	141.1	-3.8	47.7	0	0	0	0	112.1
331	S	28.1	Very low	35	Very low	124 Å²	124	147 Å²	147	87%	0.867	85%	0.85	S	S	*	*			trans	-164	159.9	143.5	-164.5	0	0	0	0	109.3
332	M	31.1	Very low	34.5	Very low	176 Å²	176	142.9 Å²	142.9	87%	0.867	84%	0.838	S	S	*	*			trans	-109.6	140.7	179.8	-52	-158.7	-48.5	0	0	111.9
333	S	29.2	Very low	34.7	Very low	127 Å²	127	144.9 Å²	144.9	89%	0.888	84%	0.841	S	S	*	*			trans	-157.2	158.2	144.6	-157.4	0	0	0	0	108.6
334	E	42	Very low	35.1	Very low	176 Å²	176	136.9 Å²	136.9	82%	0.822	83%	0.826	S	S	*	*			trans	-99.4	173.3	-160.4	-59.2	-176.6	141.4	0	0	114.5
335	L	33.7	Very low	35.7	Very low	165 Å²	165	132.9 Å²	132.9	86%	0.864	81%	0.805	S	S	*	*			trans	89.8	139.6	170.8	-49.1	-180	0	0	0	118.1
336	S	29.5	Very low	35.9	Very low	126 Å²	126	134.6 Å²	134.6	88%	0.881	79%	0.793	S	S	*	*			trans	66.4	64.4	163.5	-60.2	0	0	0	0	119.9
337	S	30.7	Very low	36.3	Very low	114 Å²	114	139.8 Å²	139.8	80%	0.797	80%	0.796	S	S	*	*			trans	-164.5	128.7	130.8	-172.4	0	0	0	0	111.1
338	L	36.1	Very low	36.8	Very low	172 Å²	172	139.4 Å²	139.4	90%	0.901	78%	0.782	S	S	*	*			trans	-141.8	76.6	169.7	-168	82	0	0	0	110.3
339	H	37.5	Very low	37.6	Very low	185 Å²	185	135.1 Å²	135.1	86%	0.856	77%	0.768	S	S	*	*			trans	-139	143.9	164.6	-108.4	-83.4	0	0	0	111.4
340	D	39.7	Very low	38.5	Very low	169 Å²	169	138.2 Å²	138.2	90%	0.904	76%	0.764	S	S	*	*			trans	67.8	137.9	-175.3	-152.4	5.9	0	0	0	116.6
341	G	34.6	Very low	39.4	Very low	74 Å²	74	139.7 Å²	139.7	76%	0.763	76%	0.758	S	S	*	*			trans	154.2	48.1	-167.2	0	0	0	0	0	117.5
342	G	36	Very low	40.3	Very low	64 Å²	64	138.2 Å²	138.2	66%	0.66	74%	0.744	S	S	*	*			trans	72.1	64.8	148.3	0	0	0	0	0	119.1	A344	G342-A344 PolarHBondContact O-N 3.1Å
343	N	43.6	Very low	41.1	Very low	138 Å²	138	135.2 Å²	135.2	74%	0.738	74%	0.735	S	S	*	*			trans	-79.8	51.1	178.7	-143.8	-4.3	0	0	0	114.3	F346	N343-F346 WeakPolarHBondContact OD1-CD2 3.48Å
344	A	48.3	Very low	41.7	Very low	70 Å²	70	137.3 Å²	137.3	58%	0.579	73%	0.731	S	S	*	*			trans	-83	-36.8	-173.5	0	0	0	0	0	114.2	G342	G342-A344 PolarHBondContact O-N 3.1Å
345	D	48.5	Very low	41.7	Very low	97 Å²	97	136.7 Å²	136.7	52%	0.519	73%	0.73	S	S	.	*	T	Hydrogen-bonded Turn	trans	-86.1	-21.9	-165.5	-67	-55.6	0	0	0	115	R347 R348	D345-R347 PolarHBondContact O-N 3.15Å; D345-R348 PolarHBondContact O-N 3.17Å; D345-R348 IonicContact OD1-NH1 2.7Å
346	F	44.8	Very low	42	Very low	143 Å²	143	138.1 Å²	138.1	63%	0.627	73%	0.73	S	S	*	*	H	α-helix	trans	-59.1	-30.9	178.1	-86.2	-91	0	0	0	113.3	N343	N343-F346 WeakPolarHBondContact OD1-CD2 3.48Å
347	R	47.3	Very low	42.5	Very low	218 Å²	218	136.5 Å²	136.5	82%	0.823	72%	0.724	S	S	*	*	H	α-helix	trans	-67.6	-33.6	176.2	-85.9	-176.8	170.9	155.4	-1	113.2	D345 Q351	D345-R347 PolarHBondContact O-N 3.15Å; R347-Q351 PolarHBondContact O-N 3.45Å
348	R	45.2	Very low	43	Very low	170 Å²	170	138.9 Å²	138.9	64%	0.642	73%	0.726	S	S	*	*	H	α-helix	trans	-68.3	-41.2	179.7	-79	179.3	166.4	143.1	-5	111.8	D345 Y350 Q351 T352	D345-R348 PolarHBondContact O-N 3.17Å; D345-R348 IonicContact OD1-NH1 2.7Å; R348-Y350 PolarHBondContact O-N 3.04Å; R348-Q351 PolarHBondContact O-N 2.79Å; R348-T352 PolarHBondContact O-N 3.39Å; R348-T352 PolarHBondContact O-OG1 2.94Å
349	N	47.8	Very low	43.1	Very low	103 Å²	103	135.8 Å²	135.8	55%	0.551	72%	0.717	S	S	*	*	H	α-helix	trans	-64	-44.1	-176.5	-69.3	-13.6	0	0	0	112.5	Q351 T352 V353	N349-Q351 VanDerWaalsContact C-N 3.32Å; N349-Q351 PolarHBondContact O-N 3.41Å; N349-T352 PolarHBondContact O-N 3.26Å; N349-T352 PolarHBondContact O-OG1 3.41Å; N349-V353 WeakPolarHBondContact O-CG2 3.33Å; N349-V353 PolarHBondContact O-N 3.46Å; N349-V353 VanDerWaalsContact O-N 3.17Å
350	Y	46.7	Very low	43	Very low	177 Å²	177	133 Å²	133	69%	0.694	72%	0.715	S	S	*	*	H	α-helix	trans	-63.1	-36.8	174.4	-84.3	-83.6	0	0	0	113	R348 V353 Q354	R348-Y350 PolarHBondContact O-N 3.04Å; Y350-V353 PolarHBondContact O-N 2.79Å; Y350-Q354 PolarHBondContact O-N 2.84Å
351	Q	46.4	Very low	42.7	Very low	146 Å²	146	132.2 Å²	132.2	68%	0.682	71%	0.709	S	S	*	*	H	α-helix	trans	-71.6	-32.9	-179.5	-152.5	170.3	25.2	0	0	112.4	R347 R348 N349	R347-Q351 PolarHBondContact O-N 3.45Å; R348-Q351 PolarHBondContact O-N 2.79Å; N349-Q351 VanDerWaalsContact C-N 3.32Å; N349-Q351 PolarHBondContact O-N 3.41Å
352	T	47.8	Very low	42.8	Very low	92 Å²	92	134.4 Å²	134.4	56%	0.564	71%	0.71	S	S	*	*	H	α-helix	trans	-75.5	-29.1	174.6	51.3	0	0	0	0	114.1	R348 N349	R348-T352 PolarHBondContact O-N 3.39Å; R348-T352 PolarHBondContact O-OG1 2.94Å; N349-T352 PolarHBondContact O-N 3.26Å; N349-T352 PolarHBondContact O-OG1 3.41Å
353	V	47.7	Very low	42.5	Very low	114 Å²	114	139 Å²	139	69%	0.691	72%	0.72	S	S	*	*	H	α-helix	trans	-75	-33.7	178.9	171.7	0	0	0	0	111.9	N349 Y350 M355	N349-V353 WeakPolarHBondContact O-CG2 3.33Å; N349-V353 PolarHBondContact O-N 3.46Å; N349-V353 VanDerWaalsContact O-N 3.17Å; Y350-V353 PolarHBondContact O-N 2.79Å; V353-M355 PolarHBondContact O-N 3.49Å
354	Q	42.2	Very low	41.9	Very low	171 Å²	171	143.9 Å²	143.9	80%	0.799	73%	0.728	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70	-9.3	177.6	-79.7	-166.7	-9.2	0	0	115.3	Y350	Y350-Q354 PolarHBondContact O-N 2.84Å
355	M	42.8	Very low	41.1	Very low	162 Å²	162	149 Å²	149	80%	0.798	74%	0.74	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.9	5.1	-172.8	-77.6	-69	177.8	0	0	115.4	V353 A357	V353-M355 PolarHBondContact O-N 3.49Å; M355-A357 PolarHBondContact O-N 2.87Å
356	K	39.1	Very low	40.2	Very low	196 Å²	196	152.2 Å²	152.2	85%	0.852	75%	0.751	S	S	*	*			trans	-87.6	73	170.6	-79.2	-170.9	173.9	-179.1	0	112.1
357	A	39.1	Very low	39.5	Very low	92 Å²	92	152.4 Å²	152.4	76%	0.76	75%	0.754	S	S	*	*	P	Polyproline II helix	trans	-66.8	148.9	159.5	0	0	0	0	0	110.3	M355	M355-A357 PolarHBondContact O-N 2.87Å
358	L	41.7	Very low	38.7	Very low	163 Å²	163	147.3 Å²	147.3	85%	0.853	75%	0.747	S	S	*	*	P	Polyproline II helix	trans	-68.7	147.3	172.7	-67.7	170	0	0	0	110.5
359	P	38.9	Very low	37.9	Very low	108 Å²	108	150.2 Å²	150.2	70%	0.701	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-66.8	145.6	175.5	29.2	-34.9	0	0	0	111
360	P	35.3	Very low	37	Very low	126 Å²	126	150.3 Å²	150.3	82%	0.818	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-68.3	132.5	174.5	29.2	-33.9	0	0	0	110.5
361	I	33.7	Very low	36.2	Very low	153 Å²	153	146.5 Å²	146.5	79%	0.785	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-82	133	169.7	-59.9	174.5	0	0	0	107.2
362	P	36.9	Very low	35.8	Very low	119 Å²	119	145.2 Å²	145.2	77%	0.773	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-73.7	135.1	179.6	29.6	-34.4	0	0	0	111.6
363	D	29.5	Very low	35.2	Very low	162 Å²	162	147.1 Å²	147.1	87%	0.866	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-64.7	148	171.2	-68	-60.6	0	0	0	111.7
364	R	29.7	Very low	34.4	Very low	239 Å²	239	147.6 Å²	147.6	90%	0.902	81%	0.805	S	S	*	*			trans	-138.4	123.1	165.7	-174.2	172.7	176.5	167.4	-0.4	109.8
365	E	32.5	Very low	33.7	Very low	179 Å²	179	148 Å²	148	84%	0.836	81%	0.807	S	S	*	*			trans	-86.8	143.2	-171.5	-57.2	171.5	-156.6	0	0	112.8
366	E	29.9	Very low	33	Very low	163 Å²	163	144.7 Å²	144.7	76%	0.762	80%	0.8	S	S	*	*			trans	175.5	136.2	146.5	-98.2	-179.1	139.5	0	0	107.5
367	Q	29.7	Very low	32.5	Very low	148 Å²	148	147 Å²	147	69%	0.692	80%	0.803	S	S	*	*			cis	-163.9	139.2	-3.7	-135.6	168.3	45.5	0	0	110.1
368	V	29.8	Very low	32.4	Very low	111 Å²	111	153.9 Å²	153.9	67%	0.673	81%	0.809	S	S	*	*			trans	53.8	132.4	137.1	170	0	0	0	0	119.3
369	R	28	Very low	32.2	Very low	231 Å²	231	152.1 Å²	152.1	87%	0.872	81%	0.808	S	S	*	*			cis	-166.1	149.5	24.6	-156.6	173.5	-76.9	157.8	-2.7	111.6
370	A	28.8	Very low	31.8	Very low	104 Å²	104	158 Å²	158	86%	0.86	82%	0.816	S	S	*	*			trans	-175.4	163.9	145.7	0	0	0	0	0	111.9
371	A	30.2	Very low	31.6	Very low	97 Å²	97	161.3 Å²	161.3	80%	0.802	81%	0.812	S	S	*	*			trans	-127.6	168.9	-171.1	0	0	0	0	0	113
372	P	39.1	Very low	31.4	Very low	120 Å²	120	161.6 Å²	161.6	78%	0.779	82%	0.816	S	S	*	*			trans	-96.3	163.7	-159.6	37.6	-36.9	0	0	0	116.1
373	P	35	Very low	31.1	Very low	131 Å²	131	161.6 Å²	161.6	85%	0.851	81%	0.809	S	S	*	*			trans	-85.9	157.6	169.5	35.5	-34.4	0	0	0	113.4
374	S	29.6	Very low	31	Very low	125 Å²	125	156.9 Å²	156.9	87%	0.874	80%	0.799	S	S	*	*			trans	-113.4	-173.4	-171.5	63.9	0	0	0	0	114.3
375	Q	29.5	Very low	31	Very low	178 Å²	178	150.8 Å²	150.8	83%	0.832	79%	0.793	S	S	*	*			trans	-92.7	150	-164.4	-51.6	174.4	-8.9	0	0	116.2
376	S	27.1	Very low	31	Very low	94 Å²	94	150 Å²	150	66%	0.657	79%	0.794	S	S	*	*			trans	86.5	148.2	134	94.4	0	0	0	0	123.6
377	R	27.9	Very low	31.3	Very low	243 Å²	243	147.4 Å²	147.4	92%	0.917	79%	0.794	S	S	*	*			trans	98.4	150.4	151.6	-71.5	169.2	-167.8	-136.3	-0.4	120.2
378	R	37.5	Very low	31.7	Very low	237 Å²	237	148.3 Å²	148.3	89%	0.894	80%	0.803	S	S	*	*			trans	-114.9	156.7	-170.9	-53.8	171.1	172.3	165.3	-6.3	111.8
379	P	38.4	Very low	31.9	Very low	127 Å²	127	148.7 Å²	148.7	83%	0.825	80%	0.801	S	S	*	*			trans	-77.1	-174.6	150.4	35.6	-34.9	0	0	0	111.8
380	R	29.4	Very low	32.4	Very low	230 Å²	230	146.6 Å²	146.6	87%	0.868	80%	0.802	S	S	*	*			trans	-157.7	133.4	-171.6	-165.6	-168.3	175.3	-170.1	-0.2	114.5
381	R	30.7	Very low	32.9	Very low	196 Å²	196	149.9 Å²	149.9	74%	0.74	80%	0.803	S	S	*	*			trans	76.7	140.3	157	-144.5	179.9	179.7	-175.6	-5.5	119.2	D383	R381-D383 IonicContact CZ-OD2 3.66Å; R381-D383 IonicContact NE-OD2 3.69Å; R381-D383 IonicContact NH2-OD2 2.91Å; R381-D383 PolarHBondContact NH2-OD2 3.47Å
382	N	29.7	Very low	33.2	Very low	160 Å²	160	153.2 Å²	153.2	86%	0.856	80%	0.803	S	S	*	*				-144.8	179	127	-157	15.1	0	0	0	109.7
383	D	31.5	Very low	33.1	Very low	118 Å²	118	157.8 Å²	157.8	63%	0.631	80%	0.804	S	S	*	*			trans	-135.2	153.1	-166.3	-136.2	-46.4	0	0	0	110.9	R381	R381-D383 IonicContact CZ-OD2 3.66Å; R381-D383 IonicContact NE-OD2 3.69Å; R381-D383 IonicContact NH2-OD2 2.91Å; R381-D383 PolarHBondContact NH2-OD2 3.47Å
384	G	26.5	Very low	33.2	Very low	64 Å²	64	162 Å²	162	66%	0.66	80%	0.803	S	S	*	*			trans	147.7	136.4	168.4	0	0	0	0	0	120.6
385	S	29.5	Very low	33.5	Very low	110 Å²	110	166.6 Å²	166.6	77%	0.769	80%	0.802	S	S	*	*			trans	58.2	98.4	153.7	65.1	0	0	0	0	123.5
386	L	33.2	Very low	33.6	Very low	163 Å²	163	165.4 Å²	165.4	85%	0.853	80%	0.801	S	S	*	*				46.7	140.6	128.4	-78.6	91.3	0	0	0	124.8
387	S	35.7	Very low	33.8	Very low	109 Å²	109	165.9 Å²	165.9	76%	0.762	80%	0.802	S	S	*	*			trans	91.2	136.4	142	60.5	0	0	0	0	122.3
388	D	37.7	Very low	34.2	Very low	166 Å²	166	166.5 Å²	166.5	89%	0.888	80%	0.804	S	S	*	*			trans	79.8	25.5	155.4	-124.8	32.3	0	0	0	122.8
389	D	35.6	Very low	34.3	Very low	120 Å²	120	160.4 Å²	160.4	64%	0.642	80%	0.797	S	S	*	*			trans	-115.7	44.1	179.5	-93.3	-38.4	0	0	0	115.5	R393	D389-R393 PolarHBondContact O-NE 3.28Å
390	E	37.5	Very low	34.2	Very low	187 Å²	187	163.4 Å²	163.4	87%	0.874	80%	0.801	S	S	*	*	S	Bend	trans	-106.7	-3.1	-179.2	-148.3	168.2	170.5	0	0	115.6
391	L	38.9	Very low	34.5	Very low	172 Å²	172	160.5 Å²	160.5	90%	0.901	80%	0.797	S	S	*	*	S	Bend	trans	-99.2	-23.9	-179.7	-79.5	168.8	0	0	0	116.1
392	E	37.5	Very low	34.6	Very low	168 Å²	168	159.2 Å²	159.2	79%	0.785	80%	0.803	S	S	*	*	S	Bend	trans	-81.6	-14.6	-175.9	-74.4	-146.2	133.5	0	0	115.4	R394	E392-R394 PolarHBondContact O-N 2.81Å
393	R	35.6	Very low	34.7	Very low	216 Å²	216	160 Å²	160	82%	0.815	80%	0.802	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.7	14	-166.3	-58.9	-171.9	-171.3	-127.1	-2.4	116.2	D389	D389-R393 PolarHBondContact O-NE 3.28Å
394	R	38.4	Very low	34.9	Very low	220 Å²	220	165.5 Å²	165.5	83%	0.83	81%	0.814	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.8	-13.4	-178	-158.5	165.3	-169.5	-131	-1.9	115.4	E392	E392-R394 PolarHBondContact O-N 2.81Å
395	W	35.3	Very low	35.4	Very low	221 Å²	221	171.7 Å²	171.7	84%	0.837	82%	0.823	S	S	*	*			trans	-130.5	97.2	-177.8	-73.2	105.7	0	0	0	113.3
396	N	30.9	Very low	35.5	Very low	153 Å²	153	172.7 Å²	172.7	82%	0.818	82%	0.824	S	S	*	*			trans	-151.6	107.2	162.7	-139.9	-34.4	0	0	0	111
397	P	32.7	Very low	35.7	Very low	103 Å²	103	173.2 Å²	173.2	67%	0.669	83%	0.827	S	S	*	*			trans	-70.5	130.5	-179.5	-18.2	32.1	0	0	0	112.3	S399	P397-S399 PolarHBondContact O-N 2.86Å
398	R	36.1	Very low	35.5	Very low	257 Å²	257	173.4 Å²	173.4	97%	0.97	83%	0.828	S	S	*	*			trans	-73.4	106.6	171.9	-71.2	-172.5	-179.6	-166.7	1.7	111
399	S	38.7	Very low	35.6	Very low	108 Å²	108	177.4 Å²	177.4	76%	0.755	83%	0.831	S	S	*	*			trans	-142.4	17.5	169.8	53.5	0	0	0	0	115.4	P397 H401	P397-S399 PolarHBondContact O-N 2.86Å; S399-H401 PolarHBondContact O-N 3.31Å
400	E	37.6	Very low	35.5	Very low	191 Å²	191	183 Å²	183	89%	0.893	84%	0.843	S	S	*	*			trans	-98.7	53.5	172.6	-157.2	-174.6	-165.7	0	0	113.1
401	H	35.7	Very low	35.8	Very low	169 Å²	169	177.8 Å²	177.8	78%	0.782	84%	0.839	S	S	*	*			trans	-151.8	56.9	164.5	-133	71.6	0	0	0	115.2	S399	S399-H401 PolarHBondContact O-N 3.31Å
402	L	32.8	Very low	35.8	Very low	168 Å²	168	181.3 Å²	181.3	88%	0.88	84%	0.84	S	S	*	*			trans	-120.9	115.1	154.9	-75.3	175.1	0	0	0	108.8	R404	L402-R404 PolarHBondContact O-N 3.21Å; L402-R404 VanDerWaalsContact O-N 3.09Å
403	Q	31.8	Very low	36.3	Very low	177 Å²	177	179.9 Å²	179.9	83%	0.827	84%	0.843	S	S	*	*			trans	-60.8	113.7	171.5	-72.3	-178.7	-18.6	0	0	108.7	K405	Q403-K405 VanDerWaalsContact C-N 3.28Å; Q403-K405 PolarHBondContact O-N 3.02Å
404	R	35.2	Very low	36.6	Very low	233 Å²	233	172.3 Å²	172.3	88%	0.879	83%	0.833	S	S	*	*			trans	-68.5	85.9	175.5	-173.8	-174.8	-69.9	174.1	-2.2	109	L402 T406	L402-R404 PolarHBondContact O-N 3.21Å; L402-R404 VanDerWaalsContact O-N 3.09Å; R404-T406 PolarHBondContact O-N 3.3Å; R404-T406 VanDerWaalsContact O-N 3.09Å
405	K	36.9	Very low	37.3	Very low	195 Å²	195	165.4 Å²	165.4	85%	0.848	82%	0.818	S	S	*	*			trans	-51.2	117.6	170.1	-92.2	-173.7	174.7	179.3	0	108.3	Q403 L407	Q403-K405 VanDerWaalsContact C-N 3.28Å; Q403-K405 PolarHBondContact O-N 3.02Å; K405-L407 PolarHBondContact O-N 3.1Å
406	T	32.4	Very low	38	Very low	130 Å²	130	162 Å²	162	80%	0.798	82%	0.815	S	S	*	*			trans	-73.9	108.7	179.3	38.9	0	0	0	0	109.4	R404 S408	R404-T406 PolarHBondContact O-N 3.3Å; R404-T406 VanDerWaalsContact O-N 3.09Å; T406-S408 PolarHBondContact O-N 3.36Å
407	L	37.1	Very low	38.9	Very low	175 Å²	175	159.6 Å²	159.6	92%	0.916	80%	0.803	S	S	*	*			trans	-64.9	106.5	168.7	-71.4	175.4	0	0	0	108.5	K405	K405-L407 PolarHBondContact O-N 3.1Å
408	S	31.1	Very low	40.2	Very low	113 Å²	113	161 Å²	161	79%	0.79	80%	0.8	S	S	*	*			trans	-69.2	137.5	-179.6	-170.8	0	0	0	0	110.6	T406 R410	T406-S408 PolarHBondContact O-N 3.36Å; S408-R410 VanDerWaalsContact C-N 3.3Å; S408-R410 PolarHBondContact O-N 3.44Å
409	R	40.5	Very low	41.4	Very low	250 Å²	250	154.2 Å²	154.2	94%	0.943	78%	0.783	S	S	*	*	S	Bend	trans	-74.8	74	-174	-172.5	-171	175.4	-152.9	0.9	111.6
410	R	32.3	Very low	42.4	Very low	238 Å²	238	154 Å²	154	90%	0.898	77%	0.77	S	S	*	*			trans	-147.6	120.9	166.6	-145	175.5	-165.2	-162.9	3.3	110.9	S408	S408-R410 VanDerWaalsContact C-N 3.3Å; S408-R410 PolarHBondContact O-N 3.44Å
411	G	43.9	Very low	43	Very low	76 Å²	76	151.2 Å²	151.2	78%	0.784	76%	0.756	S	S	*	*			trans	-75.6	142	-172.7	0	0	0	0	0	114.1
412	R	39.3	Very low	44.3	Very low	246 Å²	246	149.3 Å²	149.3	93%	0.928	75%	0.746	S	S	*	*			trans	-155.1	160.7	154.8	-122.6	172.8	178.4	159.6	-1.2	109	G414	R412-G414 PolarHBondContact O-N 3.32Å
413	T	49	Very low	45.4	Very low	139 Å²	139	144.2 Å²	144.2	85%	0.853	73%	0.728	S	S	*	*	P	Polyproline II helix	trans	-67.5	117.8	179.7	45.1	0	0	0	0	111.1
414	G	40.2	Very low	46	Very low	57 Å²	57	142.2 Å²	142.2	59%	0.588	71%	0.713	S	S	*	*	P	Polyproline II helix	trans	-76.8	154.4	167.4	0	0	0	0	0	111.5	R412	R412-G414 PolarHBondContact O-N 3.32Å
415	S	52.8	Low	46.2	Very low	74 Å²	74	135.4 Å²	135.4	52%	0.517	70%	0.7	S	S	.	*	P	Polyproline II helix	trans	-81.8	152.9	177.7	-173.3	0	0	0	0	111.1	D417 E418	S415-D417 PolarHBondContact O-N 2.95Å; S415-D417 PolarHBondContact OG-N 3.41Å; S415-E418 PolarHBondContact N-OE2 3.42Å; S415-E418 PolarHBondContact O-N 2.97Å
416	L	50	Low	46.7	Very low	149 Å²	149	135 Å²	135	78%	0.78	69%	0.694	S	S	*	*	H	α-helix	trans	-60	-28.1	170.2	-78.4	169.4	0	0	0	112.2	E418 L419 E420	L416-E418 PolarHBondContact O-N 3.32Å; L416-L419 WeakPolarHBondContact O-CB 3.18Å; L416-L419 PolarHBondContact O-N 2.9Å; L416-L419 VanDerWaalsContact O-N 3.12Å; L416-E420 PolarHBondContact O-N 3.08Å
417	D	51.3	Low	47.1	Very low	104 Å²	104	131.4 Å²	131.4	56%	0.556	68%	0.684	S	S	*	*	H	α-helix	trans	-65.4	-37.4	-177.9	-155.7	20	0	0	0	112.3	S415 L419 E420 E421	S415-D417 PolarHBondContact O-N 2.95Å; S415-D417 PolarHBondContact OG-N 3.41Å; D417-L419 PolarHBondContact O-N 3.16Å; D417-E420 PolarHBondContact O-N 3.11Å; D417-E421 PolarHBondContact O-N 2.75Å
418	E	60.3	Low	47.2	Very low	133 Å²	133	127.9 Å²	127.9	62%	0.621	67%	0.674	S	S	*	*	H	α-helix	trans	-64.4	-30.4	174.1	-62.9	-178.5	125.6	0	0	111.9	S415 L416 F422	S415-E418 PolarHBondContact N-OE2 3.42Å; S415-E418 PolarHBondContact O-N 2.97Å; L416-E418 PolarHBondContact O-N 3.32Å; E418-F422 PolarHBondContact O-N 3.19Å
419	L	61.4	Low	47.6	Very low	114 Å²	114	134 Å²	134	60%	0.597	68%	0.68	S	S	*	*	H	α-helix	trans	-78.7	-35.1	177	-174.8	63.3	0	0	0	111.7	L416 D417 A423	L416-L419 WeakPolarHBondContact O-CB 3.18Å; L416-L419 PolarHBondContact O-N 2.9Å; L416-L419 VanDerWaalsContact O-N 3.12Å; D417-L419 PolarHBondContact O-N 3.16Å; L419-A423 PolarHBondContact O-N 3.45Å
420	E	59.1	Low	47.5	Very low	104 Å²	104	126.5 Å²	126.5	49%	0.486	67%	0.671	S	S	.	*	H	α-helix	trans	-70.2	-41.4	175.6	-154.4	-167.4	127.9	0	0	111.6	L416 D417 F422 A423 R424	L416-E420 PolarHBondContact O-N 3.08Å; D417-E420 PolarHBondContact O-N 3.11Å; E420-F422 VanDerWaalsContact C-N 3.32Å; E420-F422 PolarHBondContact O-N 2.81Å; E420-A423 WeakPolarHBondContact O-CB 3.42Å; E420-A423 PolarHBondContact O-N 2.87Å; E420-A423 VanDerWaalsContact O-N 3.09Å; E420-R424 WeakPolarHBondContact O-CG 3.31Å; E420-R424 PolarHBondContact O-N 2.9Å; E420-R424 IonicContact OE1-CZ 3.97Å; E420-R424 IonicContact OE1-NE 3.19Å; E420-R424 PolarHBondContact OE1-NE 3.12Å; E420-R424 IonicContact OE1-NH2 2.94Å; E420-R424 PolarHBondContact OE1-NH2 3.25Å; E420-R424 IonicContact OE2-NH2 2.68Å
421	E	50.4	Low	47.7	Very low	131 Å²	131	126.5 Å²	126.5	61%	0.612	67%	0.671	S	S	*	*	H	α-helix	trans	-60.6	-41.7	174.9	-171.7	167.3	-134.9	0	0	111.7	D417 A423 R424 C425	D417-E421 PolarHBondContact O-N 2.75Å; E421-A423 VanDerWaalsContact C-N 3.32Å; E421-A423 PolarHBondContact O-N 3.35Å; E421-R424 PolarHBondContact O-N 2.99Å; E421-C425 PolarHBondContact O-N 2.91Å; E421-C425 PolarHBondContact O-SG 3.33Å
422	F	62.2	Low	47.1	Very low	130 Å²	130	134.5 Å²	134.5	57%	0.57	68%	0.677	S	S	*	*	H	α-helix	trans	-60.5	-38.8	172.7	-176.4	-98.1	0	0	0	112.8	E418 E420 Y426	E418-F422 PolarHBondContact O-N 3.19Å; E420-F422 VanDerWaalsContact C-N 3.32Å; E420-F422 PolarHBondContact O-N 2.81Å; F422-Y426 HydrophobicContact CE1-CE2 4.28Å; F422-Y426 HydrophobicContact CZ-CE2 4.16Å
423	A	55.8	Low	46.9	Very low	60 Å²	60	128.3 Å²	128.3	50%	0.496	67%	0.669	S	S	.	*	H	α-helix	trans	-67.5	-41.7	176.5	0	0	0	0	0	112.5	L419 E420 E421 C425 Y426	L419-A423 PolarHBondContact O-N 3.45Å; E420-A423 WeakPolarHBondContact O-CB 3.42Å; E420-A423 PolarHBondContact O-N 2.87Å; E420-A423 VanDerWaalsContact O-N 3.09Å; E421-A423 VanDerWaalsContact C-N 3.32Å; E421-A423 PolarHBondContact O-N 3.35Å; A423-C425 PolarHBondContact O-N 3.34Å; A423-Y426 PolarHBondContact O-N 3.35Å; A423-Y426 VanDerWaalsContact O-N 3.16Å
424	R	44.8	Very low	46.2	Very low	135 Å²	135	130.5 Å²	130.5	51%	0.509	67%	0.67	S	S	.	*	H	α-helix	trans	-59	-31.4	178.6	-68.2	175	-159.3	146	-0.5	112.2	E420 E421 Y426 G427	E420-R424 WeakPolarHBondContact O-CG 3.31Å; E420-R424 PolarHBondContact O-N 2.9Å; E420-R424 IonicContact OE1-CZ 3.97Å; E420-R424 IonicContact OE1-NE 3.19Å; E420-R424 PolarHBondContact OE1-NE 3.12Å; E420-R424 IonicContact OE1-NH2 2.94Å; E420-R424 PolarHBondContact OE1-NH2 3.25Å; E420-R424 IonicContact OE2-NH2 2.68Å; E421-R424 PolarHBondContact O-N 2.99Å; R424-Y426 PolarHBondContact O-N 3.27Å; R424-Y426 VanDerWaalsContact O-N 3.14Å; R424-G427 PolarHBondContact O-N 3.37Å
425	C	40.3	Very low	46.2	Very low	91 Å²	91	133.4 Å²	133.4	62%	0.615	68%	0.678	S	S	*	*	H	α-helix	trans	-60.2	-20.2	177.3	-68.8	0	0	0	0	115.3	E421 A423	E421-C425 PolarHBondContact O-N 2.91Å; E421-C425 PolarHBondContact O-SG 3.33Å; A423-C425 PolarHBondContact O-N 3.34Å
426	Y	46.8	Very low	45.6	Very low	185 Å²	185	135.6 Å²	135.6	73%	0.725	69%	0.691	S	S	*	*	H	α-helix	trans	-91.7	-23	178.7	-80.4	-92.9	0	0	0	114.2	F422 A423 R424	F422-Y426 HydrophobicContact CE1-CE2 4.28Å; F422-Y426 HydrophobicContact CZ-CE2 4.16Å; A423-Y426 PolarHBondContact O-N 3.35Å; A423-Y426 VanDerWaalsContact O-N 3.16Å; R424-Y426 PolarHBondContact O-N 3.27Å; R424-Y426 VanDerWaalsContact O-N 3.14Å
427	G	40.7	Very low	44.8	Very low	56 Å²	56	136 Å²	136	58%	0.577	69%	0.694	S	S	*	*	H	α-helix	trans	-74.4	-26.4	-173	0	0	0	0	0	115.3	R424 R429	R424-G427 PolarHBondContact O-N 3.37Å; G427-R429 VanDerWaalsContact C-N 3.33Å; G427-R429 PolarHBondContact O-N 2.96Å
428	S	38.2	Very low	43.9	Very low	101 Å²	101	142.9 Å²	142.9	71%	0.706	71%	0.712	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.5	-0.1	-166	53.1	0	0	0	0	116.1
429	R	39.9	Very low	42.6	Very low	241 Å²	241	143.4 Å²	143.4	91%	0.909	72%	0.718	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92	-0	177.8	-79.1	-175.8	172.3	164.6	0.3	115.4	G427	G427-R429 VanDerWaalsContact C-N 3.33Å; G427-R429 PolarHBondContact O-N 2.96Å
430	A	38.3	Very low	41.3	Very low	92 Å²	92	146.9 Å²	146.9	76%	0.76	73%	0.731	S	S	*	*	S	Bend	trans	-92.7	9.8	-170.6	0	0	0	0	0	116.3
431	R	37.8	Very low	39.9	Very low	239 Å²	239	145.5 Å²	145.5	90%	0.902	75%	0.745	S	S	*	*			trans	-128.1	120.7	169.5	-72.9	-171.9	-178.5	175	2.2	111.1
432	R	30.5	Very low	39.1	Very low	243 Å²	243	150 Å²	150	92%	0.917	76%	0.757	S	S	*	*			trans	-105.3	126.4	171	-173.3	178.5	-170.5	159.2	3.2	108.2
433	P	35.7	Very low	37.7	Very low	116 Å²	116	149.2 Å²	149.2	75%	0.753	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-64.8	147.7	173	-21	33.2	0	0	0	112
434	E	34.8	Very low	36.5	Very low	185 Å²	185	157.1 Å²	157.1	86%	0.864	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-71.3	147.2	167.4	-72.1	-179.3	117.2	0	0	111.2
435	P	38.6	Very low	35.7	Very low	118 Å²	118	155.7 Å²	155.7	77%	0.766	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-79.2	142.7	167	33.7	-32.3	0	0	0	110.7
436	P	40	Very low	35.8	Very low	120 Å²	120	157.1 Å²	157.1	78%	0.779	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-79.6	150.1	-178.3	32.2	-35.8	0	0	0	113.3
437	D	34.9	Very low	35.7	Very low	159 Å²	159	153.8 Å²	153.8	85%	0.85	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-56.3	148.6	175.5	-77.3	-57.5	0	0	0	114.3
438	R	32	Very low	35.4	Very low	247 Å²	247	162.9 Å²	162.9	93%	0.932	81%	0.814	S	S	*	*			trans	-137.7	139.7	160.4	-72.9	-167.9	172.3	-173.1	-2.3	110.8
439	L	32.7	Very low	35.1	Very low	145 Å²	145	169.6 Å²	169.6	76%	0.759	82%	0.823	S	S	*	*			trans	-106.1	146.9	-163.3	-83.4	157.8	0	0	0	113.9
440	H	34.1	Very low	34.6	Very low	186 Å²	186	163 Å²	163	86%	0.861	82%	0.815	S	S	*	*			trans	67.9	147.3	168.9	-54.9	110	0	0	0	117.8
441	G	29.6	Very low	34.3	Very low	76 Å²	76	169.3 Å²	169.3	78%	0.784	82%	0.82	S	S	*	*			trans	-167.2	-52.1	-177.4	0	0	0	0	0	117.7
442	R	33	Very low	33.9	Very low	226 Å²	226	169.3 Å²	169.3	85%	0.853	82%	0.82	S	S	*	*			trans	76.5	130	172.6	-161.2	172.4	-165.2	171	12.3	119.7
443	D	32.4	Very low	33.9	Very low	113 Å²	113	165.8 Å²	165.8	60%	0.604	81%	0.814	S	S	*	*			trans	23.7	122.6	152.6	-40.7	-22.3	0	0	0	121.8
444	Y	30.8	Very low	33.9	Very low	225 Å²	225	168.8 Å²	168.8	88%	0.882	82%	0.818	S	S	*	*				-174.6	160.6	109.9	-111.6	-85.3	0	0	0	112.1
445	S	29.2	Very low	33.9	Very low	106 Å²	106	167.5 Å²	167.5	74%	0.741	82%	0.817	S	S	*	*			trans	-149.5	174.7	174.1	-68.2	0	0	0	0	108
446	P	42.4	Very low	33.7	Very low	121 Å²	121	168.9 Å²	168.9	79%	0.786	82%	0.818	S	S	*	*			cis	-127.4	-138.9	0.8	44.4	-25.3	0	0	0	109.3
447	P	43.1	Very low	33.3	Very low	114 Å²	114	168.1 Å²	168.1	74%	0.74	81%	0.811	S	S	*	*			cis	-126.9	178.5	-25.3	38.8	-22.2	0	0	0	114.7
448	R	35.7	Very low	33.3	Very low	248 Å²	248	172.1 Å²	172.1	94%	0.936	82%	0.815	S	S	*	*			trans	-70.8	151.1	164.9	-65.4	172.5	173.5	152.4	-3.7	111.3
449	R	31	Very low	33.3	Very low	241 Å²	241	164 Å²	164	91%	0.909	81%	0.808	S	S	*	*			trans	-137.3	132.4	157.9	-158.1	172.5	-167.4	163.5	3.7	110.4
450	S	30.8	Very low	33.2	Very low	104 Å²	104	168.6 Å²	168.6	73%	0.727	82%	0.816	S	S	*	*			trans	-94	154.2	178.6	49.5	0	0	0	0	111.6
451	Y	30.5	Very low	33	Very low	224 Å²	224	170.8 Å²	170.8	88%	0.878	82%	0.816	S	S	*	*			trans	-119.5	137.1	150.2	-100.3	-92.3	0	0	0	109.3
452	R	29.6	Very low	33	Very low	239 Å²	239	172 Å²	172	90%	0.902	81%	0.813	S	S	*	*			trans	-146.4	136.7	168.2	174.7	179.1	175.5	171.7	1.1	104.9
453	E	31.3	Very low	32.7	Very low	169 Å²	169	172.9 Å²	172.9	79%	0.79	82%	0.816	S	S	*	*			trans	-111.8	-178.7	-169.8	-157.9	155	-149.5	0	0	110.7
454	E	34.9	Very low	32.7	Very low	179 Å²	179	172.7 Å²	172.7	84%	0.836	82%	0.824	S	S	*	*			trans	75.6	71.1	175	-54.8	-173.7	129.9	0	0	116.9
455	D	34.4	Very low	33	Very low	157 Å²	157	168 Å²	168	84%	0.84	82%	0.82	S	S	*	*				51.8	134.3	114.6	-66.6	19.5	0	0	0	123.7
456	D	34.8	Very low	33.1	Very low	148 Å²	148	167.7 Å²	167.7	79%	0.791	82%	0.819	S	S	*	*			trans	-48.1	173.9	166.8	-60.3	-57.1	0	0	0	115.4
457	T	32.6	Very low	33.2	Very low	103 Å²	103	167.5 Å²	167.5	63%	0.632	82%	0.817	S	S	*	*			cis	-169.9	169.1	38.9	-30.1	0	0	0	0	113.8
458	W	33.8	Very low	32.8	Very low	243 Å²	243	168.9 Å²	168.9	92%	0.92	82%	0.818	S	S	*	*			trans	88	130.6	154.2	-58.7	116.9	0	0	0	122.5
459	G	32	Very low	32.5	Very low	78 Å²	78	163.6 Å²	163.6	80%	0.804	81%	0.805	S	S	*	*				118.6	99.9	129.4	0	0	0	0	0	119.5
460	R	31.5	Very low	32.5	Very low	241 Å²	241	160.6 Å²	160.6	91%	0.909	80%	0.801	S	S	*	*			trans	-96.2	127	165.4	-67.5	-174.5	-174	-103.3	12.5	112.6
461	R	28.7	Very low	32.5	Very low	231 Å²	231	163 Å²	163	87%	0.872	80%	0.799	S	S	*	*				171.4	121.3	112	-99.8	178.8	-89.8	-158.5	-5.4	115.9
462	S	30.2	Very low	32.5	Very low	102 Å²	102	163.7 Å²	163.7	71%	0.713	80%	0.8	S	S	*	*			trans	42.5	101	130.9	-46.4	0	0	0	0	121.5
463	R	27.3	Very low	32.7	Very low	245 Å²	245	160.9 Å²	160.9	93%	0.925	79%	0.789	S	S	*	*				-167.6	129.9	126.2	-121.4	169.3	-88.1	-141.9	-1.5	114
464	S	31.7	Very low	32.8	Very low	109 Å²	109	157.8 Å²	157.8	76%	0.762	78%	0.778	S	S	*	*			trans	-102.8	154.7	149.5	-50.5	0	0	0	0	107.5
465	P	37.6	Very low	32.7	Very low	125 Å²	125	155.1 Å²	155.1	81%	0.812	77%	0.774	S	S	*	*				-147.2	163.5	95	37.6	-21.6	0	0	0	115.2
466	S	32.2	Very low	32.7	Very low	101 Å²	101	157.6 Å²	157.6	71%	0.706	77%	0.772	S	S	*	*			trans	-112.1	151.5	173.4	-40.5	0	0	0	0	111.7
467	P	44.3	Very low	32.4	Very low	117 Å²	117	157 Å²	157	76%	0.76	77%	0.769	S	S	*	*			trans	-93.4	138.9	146.1	-0	20.7	0	0	0	109.1
468	L	33.3	Very low	32.5	Very low	142 Å²	142	156.7 Å²	156.7	74%	0.743	77%	0.77	S	S	*	*			cis	69.2	132.7	43.6	-53.6	174.3	0	0	0	112
469	M	31	Very low	32.3	Very low	138 Å²	138	151.6 Å²	151.6	68%	0.68	76%	0.761	S	S	*	*			cis	-163.9	147.7	6	-122.6	-72.2	150.5	0	0	112	K471	M469-K471 HydrophobicContact SD-CB 4.35Å
470	H	31	Very low	32.4	Very low	178 Å²	178	158.4 Å²	158.4	82%	0.824	76%	0.763	S	S	*	*			trans	168.5	156.5	136.2	-107.9	-95	0	0	0	112
471	K	30.8	Very low	32.5	Very low	154 Å²	154	152.6 Å²	152.6	67%	0.67	76%	0.756	S	S	*	*				172.6	99.5	-61.6	174.5	-172	174.1	-175.2	0	110.1	M469	M469-K471 HydrophobicContact SD-CB 4.35Å
472	R	30.7	Very low	32.6	Very low	239 Å²	239	147.8 Å²	147.8	90%	0.902	76%	0.757	S	S	*	*			trans	-162.6	128.2	153.6	-112.6	-175.5	174.8	-136.1	0.8	106
473	R	32.5	Very low	32.8	Very low	180 Å²	180	154.2 Å²	154.2	68%	0.679	77%	0.765	S	S	*	*			cis	66	124	34.4	-68.4	-158.1	161.3	-95.2	-0.2	113.8
474	D	34.4	Very low	33.3	Very low	103 Å²	103	148.1 Å²	148.1	55%	0.551	76%	0.757	S	S	*	*			cis	-143	178.4	-8.8	-80.8	-47.5	0	0	0	106.7
475	T	31.1	Very low	33.6	Very low	124 Å²	124	149.1 Å²	149.1	76%	0.761	76%	0.761	S	S	*	*			cis	-170.1	150.3	48.1	-54.7	0	0	0	0	111.5
476	W	35.1	Very low	33.5	Very low	208 Å²	208	151 Å²	151	79%	0.788	76%	0.763	S	S	*	*			trans	-25.3	166	165.8	-52.4	83.8	0	0	0	119.9
477	D	29.8	Very low	33.7	Very low	137 Å²	137	151 Å²	151	73%	0.733	76%	0.764	S	S	*	*			cis	-148	-161.5	16.3	-147.6	-27	0	0	0	114.3
478	S	33.1	Very low	33.5	Very low	95 Å²	95	155.2 Å²	155.2	66%	0.664	77%	0.77	S	S	*	*			trans	-113	155.3	-151.2	-47.2	0	0	0	0	115.8
479	D	31.2	Very low	33.7	Very low	136 Å²	136	153.4 Å²	153.4	73%	0.727	77%	0.77	S	S	*	*				-173.8	143.5	114.8	-135.8	-18.1	0	0	0	116.4
480	R	32.1	Very low	34.7	Very low	222 Å²	222	156.5 Å²	156.5	84%	0.838	78%	0.775	S	S	*	*			trans	64.9	169.2	150.5	-89.1	169.8	-156.4	-113.2	-1	122.1
481	P	35.5	Very low	35.9	Very low	118 Å²	118	153.8 Å²	153.8	77%	0.766	77%	0.767	S	S	*	*				-104.8	162.7	-126.4	40.7	-40.3	0	0	0	117.2
482	C	29.6	Very low	36.9	Very low	131 Å²	131	151.8 Å²	151.8	89%	0.885	76%	0.763	S	S	*	*			trans	-69.1	140.1	175.8	-66	0	0	0	0	114.1
483	R	35.2	Very low	38.5	Very low	236 Å²	236	142.6 Å²	142.6	89%	0.891	74%	0.743	S	S	*	*			trans	-127.4	149.5	154.4	-79.6	-174.1	173.4	-173	-1.4	108.6
484	P	36.8	Very low	40.1	Very low	117 Å²	117	140.8 Å²	140.8	76%	0.76	74%	0.74	S	S	*	*	P	Polyproline II helix	trans	-70.1	147	-178.5	29.3	-35.2	0	0	0	111.9
485	P	37.9	Very low	41.5	Very low	131 Å²	131	140.2 Å²	140.2	85%	0.851	74%	0.737	S	S	*	*	P	Polyproline II helix	trans	-71.1	131.3	175.9	29.1	-33.6	0	0	0	111.2
486	L	35.4	Very low	42.8	Very low	163 Å²	163	138.5 Å²	138.5	85%	0.853	73%	0.726	S	S	*	*	P	Polyproline II helix	trans	-76.3	130.4	-180	-179	64.3	0	0	0	111.5	K488	L486-K488 PolarHBondContact O-N 3.3Å
487	S	36.4	Very low	44.1	Very low	103 Å²	103	131.1 Å²	131.1	72%	0.72	71%	0.706	S	S	*	*	P	Polyproline II helix	trans	-66.2	117.8	171.2	52.3	0	0	0	0	110.8	S489	S487-S489 PolarHBondContact O-N 3.42Å; S487-S489 VanDerWaalsContact O-N 3.11Å
488	K	40.5	Very low	46	Very low	204 Å²	204	127.9 Å²	127.9	89%	0.887	69%	0.692	S	S	*	*			trans	-81	92	-177.7	-148.7	175.4	-171	-178.9	0	109.9	L486	L486-K488 PolarHBondContact O-N 3.3Å
489	S	38.2	Very low	47.8	Very low	105 Å²	105	129 Å²	129	73%	0.734	69%	0.689	S	S	*	*			trans	-63	144.4	167.4	50	0	0	0	0	110	S487	S487-S489 PolarHBondContact O-N 3.42Å; S487-S489 VanDerWaalsContact O-N 3.11Å
490	Y	52.5	Low	49.2	Very low	203 Å²	203	126.9 Å²	126.9	80%	0.796	68%	0.675	S	S	*	*			trans	-69.8	151.1	164.5	-93.7	-105.7	0	0	0	109.7
491	D	55.6	Low	50.6	Low	120 Å²	120	126 Å²	126	64%	0.642	67%	0.672	S	S	*	*			trans	-112	96.1	-178.1	-168.9	-16.9	0	0	0	109.3	G493 F494	D491-G493 PolarHBondContact O-N 3.47Å; D491-G493 VanDerWaalsContact O-N 3.16Å; D491-G493 PolarHBondContact OD1-N 3.39Å; D491-F494 WeakPolarHBondContact O-CB 3.4Å; D491-F494 PolarHBondContact O-N 3.02Å; D491-F494 VanDerWaalsContact O-N 3.08Å
492	D	51.7	Low	52	Low	113 Å²	113	128.4 Å²	128.4	60%	0.604	67%	0.67	S	S	*	*	H	α-helix	trans	-63.7	-19.9	-174.2	-62.9	-47.7	0	0	0	112.9	F494 L495 T496	D492-F494 VanDerWaalsContact C-N 3.28Å; D492-F494 PolarHBondContact O-N 2.94Å; D492-L495 PolarHBondContact O-N 3.43Å; D492-T496 WeakPolarHBondContact O-CB 3.41Å; D492-T496 PolarHBondContact O-N 3.29Å; D492-T496 PolarHBondContact O-OG1 2.97Å
493	G	63.5	Low	53.3	Low	46 Å²	46	125.7 Å²	125.7	47%	0.474	66%	0.657	S	S	.	*	H	α-helix	trans	-61.2	-37	172.9	0	0	0	0	0	112.3	D491 S497	D491-G493 PolarHBondContact O-N 3.47Å; D491-G493 VanDerWaalsContact O-N 3.16Å; D491-G493 PolarHBondContact OD1-N 3.39Å; G493-S497 WeakPolarHBondContact O-CB 3.4Å; G493-S497 PolarHBondContact O-N 3.33Å
494	F	66.8	Low	54.2	Low	141 Å²	141	123 Å²	123	62%	0.618	65%	0.647	S	S	*	*	H	α-helix	trans	-65.7	-49.9	177.1	-177.3	-103	0	0	0	111.4	D491 D492 T496 S497 V498	D491-F494 WeakPolarHBondContact O-CB 3.4Å; D491-F494 PolarHBondContact O-N 3.02Å; D491-F494 VanDerWaalsContact O-N 3.08Å; D492-F494 VanDerWaalsContact C-N 3.28Å; D492-F494 PolarHBondContact O-N 2.94Å; F494-T496 VanDerWaalsContact C-N 3.31Å; F494-T496 PolarHBondContact O-N 3.09Å; F494-S497 PolarHBondContact O-N 3.2Å; F494-S497 PolarHBondContact O-OG 3.27Å; F494-V498 HydrophobicContact CD1-CG2 4.34Å; F494-V498 HydrophobicContact CE1-CG2 3.95Å; F494-V498 HydrophobicContact CE2-CG2 4.24Å; F494-V498 HydrophobicContact CZ-CG2 3.89Å; F494-V498 WeakPolarHBondContact O-CG2 3.42Å; F494-V498 PolarHBondContact O-N 3.32Å
495	L	64	Low	54.7	Low	92 Å²	92	120.6 Å²	120.6	48%	0.482	64%	0.643	S	S	.	*	H	α-helix	trans	-59.6	-42.7	177.7	-71.4	173.8	0	0	0	111.6	D492 V498 L499	D492-L495 PolarHBondContact O-N 3.43Å; L495-V498 PolarHBondContact O-N 3.07Å; L495-L499 WeakPolarHBondContact O-CB 3.44Å; L495-L499 WeakPolarHBondContact O-CG 3.4Å; L495-L499 PolarHBondContact O-N 2.92Å
496	T	58.8	Low	55.2	Low	88 Å²	88	126.1 Å²	126.1	54%	0.54	65%	0.647	S	S	.	*	H	α-helix	trans	-60.3	-46.6	176.1	-52.7	0	0	0	0	111.1	D492 F494 V498 L499 E500	D492-T496 WeakPolarHBondContact O-CB 3.41Å; D492-T496 PolarHBondContact O-N 3.29Å; D492-T496 PolarHBondContact O-OG1 2.97Å; F494-T496 VanDerWaalsContact C-N 3.31Å; F494-T496 PolarHBondContact O-N 3.09Å; T496-V498 VanDerWaalsContact C-N 3.33Å; T496-V498 PolarHBondContact O-N 3.02Å; T496-L499 PolarHBondContact O-N 3.38Å; T496-E500 WeakPolarHBondContact O-CB 3.48Å; T496-E500 PolarHBondContact O-N 2.77Å
497	S	61.1	Low	55.3	Low	53 Å²	53	121.1 Å²	121.1	37%	0.371	64%	0.635	S	S	.	*	H	α-helix	trans	-64	-33.7	178.6	78.6	0	0	0	0	113.9	G493 F494 R501	G493-S497 WeakPolarHBondContact O-CB 3.4Å; G493-S497 PolarHBondContact O-N 3.33Å; F494-S497 PolarHBondContact O-N 3.2Å; F494-S497 PolarHBondContact O-OG 3.27Å; S497-R501 VanDerWaalsContact O-CB 3.26Å; S497-R501 WeakPolarHBondContact O-CB 3.46Å; S497-R501 PolarHBondContact O-N 2.93Å
498	V	71.1	Confident	55.3	Low	69 Å²	69	120.2 Å²	120.2	42%	0.418	64%	0.642	S	S	.	*	H	α-helix	trans	-73.9	-41.4	177	171.4	0	0	0	0	111	F494 L495 T496 K502	F494-V498 HydrophobicContact CD1-CG2 4.34Å; F494-V498 HydrophobicContact CE1-CG2 3.95Å; F494-V498 HydrophobicContact CE2-CG2 4.24Å; F494-V498 HydrophobicContact CZ-CG2 3.89Å; F494-V498 WeakPolarHBondContact O-CG2 3.42Å; F494-V498 PolarHBondContact O-N 3.32Å; L495-V498 PolarHBondContact O-N 3.07Å; T496-V498 VanDerWaalsContact C-N 3.33Å; T496-V498 PolarHBondContact O-N 3.02Å; V498-K502 VanDerWaalsContact O-CB 3.31Å; V498-K502 WeakPolarHBondContact O-CB 3.39Å; V498-K502 PolarHBondContact O-N 3.15Å
499	L	70.4	Confident	54.9	Low	118 Å²	118	118.3 Å²	118.3	62%	0.618	64%	0.641	S	S	*	*	H	α-helix	trans	-64.3	-42.2	173.8	-72	171.1	0	0	0	111.5	L495 T496 K502 A503	L495-L499 WeakPolarHBondContact O-CB 3.44Å; L495-L499 WeakPolarHBondContact O-CG 3.4Å; L495-L499 PolarHBondContact O-N 2.92Å; T496-L499 PolarHBondContact O-N 3.38Å; L499-K502 PolarHBondContact O-N 2.85Å; L499-A503 WeakPolarHBondContact O-CB 3.12Å; L499-A503 PolarHBondContact O-N 2.87Å
500	E	59.5	Low	54.7	Low	92 Å²	92	124.5 Å²	124.5	43%	0.43	65%	0.648	S	S	.	*	H	α-helix	trans	-66.5	-43.8	177.1	-166.8	-175.7	177.8	0	0	112	T496 K502 A503 R504	T496-E500 WeakPolarHBondContact O-CB 3.48Å; T496-E500 PolarHBondContact O-N 2.77Å; E500-K502 PolarHBondContact O-N 2.96Å; E500-A503 PolarHBondContact O-N 2.95Å; E500-A503 VanDerWaalsContact O-N 3.15Å; E500-R504 WeakPolarHBondContact O-CG 3.26Å; E500-R504 PolarHBondContact O-N 3.02Å; E500-R504 IonicContact OE1-CZ 3.24Å; E500-R504 VanDerWaalsContact OE1-CZ 3.24Å; E500-R504 IonicContact OE1-NE 3.02Å; E500-R504 PolarHBondContact OE1-NE 3.2Å; E500-R504 IonicContact OE1-NH2 2.65Å; E500-R504 PolarHBondContact OE1-NH2 3.4Å
501	R	62.5	Low	53.7	Low	202 Å²	202	120.6 Å²	120.6	76%	0.762	65%	0.651	S	S	*	*	H	α-helix	trans	-59.1	-37.5	173.4	-169.8	180	-63.6	-150.2	0	111.6	S497 G505	S497-R501 VanDerWaalsContact O-CB 3.26Å; S497-R501 WeakPolarHBondContact O-CB 3.46Å; S497-R501 PolarHBondContact O-N 2.93Å; R501-G505 PolarHBondContact O-N 3.38Å
502	K	63.9	Low	52.6	Low	169 Å²	169	120.1 Å²	120.1	74%	0.735	66%	0.664	S	S	*	*	H	α-helix	trans	-72.2	-33.3	175.9	-168.7	173.4	-176.8	177.6	0	113	V498 L499 E500	V498-K502 VanDerWaalsContact O-CB 3.31Å; V498-K502 WeakPolarHBondContact O-CB 3.39Å; V498-K502 PolarHBondContact O-N 3.15Å; L499-K502 PolarHBondContact O-N 2.85Å; E500-K502 PolarHBondContact O-N 2.96Å
503	A	58	Low	51.4	Low	74 Å²	74	118 Å²	118	61%	0.612	67%	0.668	S	S	*	*	H	α-helix	trans	-70.9	-40.8	175.4	0	0	0	0	0	112.3	L499 E500 G505	L499-A503 WeakPolarHBondContact O-CB 3.12Å; L499-A503 PolarHBondContact O-N 2.87Å; E500-A503 PolarHBondContact O-N 2.95Å; E500-A503 VanDerWaalsContact O-N 3.15Å; A503-G505 VanDerWaalsContact C-N 3.27Å; A503-G505 PolarHBondContact O-N 2.65Å
504	R	53.8	Low	49.9	Very low	181 Å²	181	127.6 Å²	127.6	68%	0.683	69%	0.69	S	S	*	*	H	α-helix	trans	-66.2	-26.3	177.2	-69	175	-179.5	-125.8	7.4	112.7	E500 R506 G507	E500-R504 WeakPolarHBondContact O-CG 3.26Å; E500-R504 PolarHBondContact O-N 3.02Å; E500-R504 IonicContact OE1-CZ 3.24Å; E500-R504 VanDerWaalsContact OE1-CZ 3.24Å; E500-R504 IonicContact OE1-NE 3.02Å; E500-R504 PolarHBondContact OE1-NE 3.2Å; E500-R504 IonicContact OE1-NH2 2.65Å; E500-R504 PolarHBondContact OE1-NH2 3.4Å; R504-R506 PolarHBondContact O-N 2.92Å; R504-G507 PolarHBondContact O-N 3.41Å
505	G	46.8	Very low	48.3	Very low	65 Å²	65	124.5 Å²	124.5	67%	0.67	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.7	20.8	179	0	0	0	0	0	117.6	R501 A503	R501-G505 PolarHBondContact O-N 3.38Å; A503-G505 VanDerWaalsContact C-N 3.27Å; A503-G505 PolarHBondContact O-N 2.65Å
506	R	48.3	Very low	46.9	Very low	247 Å²	247	126.5 Å²	126.5	93%	0.932	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-120.8	1.9	173.9	-95.6	-171.9	-177.7	-114.2	3.9	114.7	R504	R504-R506 PolarHBondContact O-N 2.92Å
507	G	38.2	Very low	45.9	Very low	59 Å²	59	130.9 Å²	130.9	61%	0.608	72%	0.716	S	S	*	*	S	Bend	trans	-112.2	143.5	167.3	0	0	0	0	0	110.4	R504	R504-G507 PolarHBondContact O-N 3.41Å
508	G	35.4	Very low	44.5	Very low	83 Å²	83	135.4 Å²	135.4	86%	0.856	74%	0.736	S	S	*	*			trans	-80.4	143.6	-173.6	0	0	0	0	0	114.4
509	D	33.2	Very low	42.8	Very low	164 Å²	164	136.6 Å²	136.6	88%	0.877	75%	0.748	S	S	*	*			trans	-71.9	136.4	178.3	-78.8	-53	0	0	0	113.9
510	R	34.2	Very low	41.1	Very low	236 Å²	236	138.2 Å²	138.2	89%	0.891	76%	0.757	S	S	*	*			trans	-142.7	126.9	147.1	-81.2	-164.1	173.2	-179.3	-1.2	112.1
511	S	31.5	Very low	39.8	Very low	120 Å²	120	140 Å²	140	84%	0.839	77%	0.774	S	S	*	*			trans	81.3	128.1	153.6	68.1	0	0	0	0	121.9
512	A	31.2	Very low	38.9	Very low	111 Å²	111	135.5 Å²	135.5	92%	0.917	77%	0.771	S	S	*	*			trans	69.1	133.2	157.2	0	0	0	0	0	120.2
513	G	28	Very low	37.4	Very low	68 Å²	68	132.7 Å²	132.7	70%	0.701	77%	0.773	S	S	*	*			cis	161.5	147.1	-12.7	0	0	0	0	0	115.6
514	R	31.2	Very low	36.2	Very low	247 Å²	247	139.6 Å²	139.6	93%	0.932	79%	0.789	S	S	*	*			trans	67.1	151.5	179.7	-63.8	-176.6	173	121.8	-2.1	115.3
515	A	33.3	Very low	35	Very low	77 Å²	77	134 Å²	134	64%	0.636	79%	0.788	S	S	*	*			cis	-137	145.2	5.2	0	0	0	0	0	111.6
516	D	35.3	Very low	34.3	Very low	133 Å²	133	136.9 Å²	136.9	71%	0.711	80%	0.798	S	S	*	*				36.4	140.7	116.9	-37.3	-41.8	0	0	0	118.7
517	E	37.3	Very low	33.8	Very low	180 Å²	180	129.2 Å²	129.2	84%	0.841	78%	0.782	S	S	*	*			cis	-159.5	179.8	16	-137.3	163.7	160.5	0	0	111.9
518	D	31.8	Very low	33.6	Very low	149 Å²	149	138.3 Å²	138.3	80%	0.797	80%	0.798	S	S	*	*			trans	63.8	137.8	174.1	-86.3	-21	0	0	0	120.5
519	S	35.6	Very low	33.3	Very low	93 Å²	93	138 Å²	138	65%	0.65	79%	0.794	S	S	*	*			cis	-161.7	170.4	-19.5	-127.7	0	0	0	0	113.7
520	D	33.9	Very low	33.2	Very low	153 Å²	153	140.4 Å²	140.4	82%	0.818	80%	0.797	S	S	*	*			trans	68.6	144.7	167.1	-75.7	-38.2	0	0	0	122.5
521	T	33	Very low	32.9	Very low	129 Å²	129	132.7 Å²	132.7	79%	0.791	79%	0.791	S	S	*	*			trans	-139.2	-162.1	-171.4	68.2	0	0	0	0	107.4
522	P	43.4	Very low	32.8	Very low	108 Å²	108	132.1 Å²	132.1	70%	0.701	79%	0.787	S	S	*	*			cis	-137.8	144	10.7	39.3	-18	0	0	0	119.3
523	S	32.7	Very low	32.7	Very low	110 Å²	110	133.9 Å²	133.9	77%	0.769	78%	0.781	S	S	*	*			trans	17.4	136.7	141.7	67	0	0	0	0	123.8
524	K	32.4	Very low	32.7	Very low	219 Å²	219	134.9 Å²	134.9	95%	0.952	78%	0.777	S	S	*	*				-153.7	131.6	124	-112.2	178.3	-177.2	177.1	0	110.3
525	G	28	Very low	32.5	Very low	63 Å²	63	131.4 Å²	131.4	65%	0.649	77%	0.769	S	S	*	*			cis	159.1	88.7	-13.3	0	0	0	0	0	115.4
526	S	32.3	Very low	32.2	Very low	126 Å²	126	137.7 Å²	137.7	88%	0.881	78%	0.778	S	S	*	*			trans	71.1	165	162.5	-126.2	0	0	0	0	116.6
527	S	37.3	Very low	31.8	Very low	86 Å²	86	136.7 Å²	136.7	60%	0.601	78%	0.781	S	S	*	*			cis	-153.5	142.1	6.6	69.4	0	0	0	0	115.3
528	R	34.9	Very low	31.3	Very low	249 Å²	249	139.6 Å²	139.6	94%	0.94	78%	0.784	S	S	*	*			trans	60.3	148.9	145.6	-62.2	165	177.2	-179.9	-2.5	117.4
529	G	29.2	Very low	31.5	Very low	76 Å²	76	137.9 Å²	137.9	78%	0.784	78%	0.784	S	S	*	*			cis	138.9	163.7	10.5	0	0	0	0	0	109
530	K	31.3	Very low	31.5	Very low	215 Å²	215	138.9 Å²	138.9	94%	0.935	79%	0.789	S	S	*	*			cis	-174.9	128.5	-3.8	174.6	-175.8	177.3	-174.2	0	109.2
531	G	26.6	Very low	31.5	Very low	74 Å²	74	136.8 Å²	136.8	76%	0.763	79%	0.786	S	S	*	*			trans	81	165.6	175.8	0	0	0	0	0	115.1
532	S	30.5	Very low	31.2	Very low	108 Å²	108	139.9 Å²	139.9	76%	0.755	79%	0.791	S	S	*	*			cis	-164.9	162.5	-8.2	50.8	0	0	0	0	111.5
533	D	28.2	Very low	30.9	Very low	148 Å²	148	143.9 Å²	143.9	79%	0.791	79%	0.792	S	S	*	*			trans	6	149.3	142.3	-49.6	-27.4	0	0	0	119.6
534	S	27.9	Very low	31.1	Very low	89 Å²	89	143.9 Å²	143.9	62%	0.622	79%	0.79	S	S	*	*			cis	180	-177.1	-6.9	49.6	0	0	0	0	110.1
535	F	28.1	Very low	31.2	Very low	175 Å²	175	138.9 Å²	138.9	77%	0.768	77%	0.773	S	S	*	*			trans	67.7	113.9	171.3	-65.9	-78.9	0	0	0	117.8
536	Y	26.3	Very low	31.6	Very low	209 Å²	209	144.8 Å²	144.8	82%	0.82	78%	0.784	S	S	*	*				89.4	112.6	71.8	-107.6	-93.1	0	0	0	114.6
537	S	27.1	Very low	31.8	Very low	111 Å²	111	146.8 Å²	146.8	78%	0.776	79%	0.785	S	S	*	*				176.3	127	126.6	-83	0	0	0	0	116
538	R	25.8	Very low	31.8	Very low	241 Å²	241	150 Å²	150	91%	0.909	80%	0.795	S	S	*	*			trans	37.6	129.3	142.4	-71.5	-179.7	167.5	159.2	-4	123
539	S	36.8	Very low	32.1	Very low	113 Å²	113	143.7 Å²	143.7	79%	0.79	79%	0.787	S	S	*	*			trans	-68.2	163.9	154.4	-22.1	0	0	0	0	113.4
540	P	36.6	Very low	32.6	Very low	115 Å²	115	147.8 Å²	147.8	75%	0.747	79%	0.79	S	S	*	*				-129.4	138.3	117.4	35.5	-27.5	0	0	0	110.7
541	S	33.1	Very low	32.9	Very low	108 Å²	108	142.4 Å²	142.4	76%	0.755	78%	0.777	S	S	*	*			cis	73.9	104.3	47.6	81.9	0	0	0	0	114.9
542	H	26	Very low	33.6	Very low	195 Å²	195	145.1 Å²	145.1	90%	0.903	78%	0.781	S	S	*	*			trans	-134.4	152.9	142.6	-151.8	-81.4	0	0	0	109.5
543	R	37.8	Very low	33.9	Very low	191 Å²	191	149.5 Å²	149.5	72%	0.721	78%	0.782	S	S	*	*			trans	-120.8	-174.6	-172.9	-131.3	-179	176.3	128	1.1	108.7	D545	R543-D545 IonicContact CZ-OD2 3.14Å; R543-D545 IonicContact NE-OD2 2.69Å; R543-D545 PolarHBondContact NE-OD2 3.34Å; R543-D545 IonicContact NH2-OD2 2.73Å; R543-D545 PolarHBondContact NH2-OD2 3.46Å
544	P	36.4	Very low	34.6	Very low	111 Å²	111	147.2 Å²	147.2	72%	0.721	78%	0.778	S	S	*	*			cis	-125.8	163.7	37.4	39.3	-24.1	0	0	0	116.1
545	D	35	Very low	35.2	Very low	114 Å²	114	151 Å²	151	61%	0.61	79%	0.785	S	S	*	*			trans	-93.7	140.7	149.5	-47.4	-78	0	0	0	106.5	R543	R543-D545 IonicContact CZ-OD2 3.14Å; R543-D545 IonicContact NE-OD2 2.69Å; R543-D545 PolarHBondContact NE-OD2 3.34Å; R543-D545 IonicContact NH2-OD2 2.73Å; R543-D545 PolarHBondContact NH2-OD2 3.46Å
546	E	36.7	Very low	36.1	Very low	186 Å²	186	148.4 Å²	148.4	87%	0.869	78%	0.779	S	S	*	*			trans	-138.7	145.5	158.6	-77.7	-156.3	124.1	0	0	109.1
547	D	36.3	Very low	36.9	Very low	169 Å²	169	144.4 Å²	144.4	90%	0.904	77%	0.768	S	S	*	*			trans	-83.7	141.8	-170.8	-56.7	-92.1	0	0	0	113.5
548	D	37	Very low	37.7	Very low	152 Å²	152	142 Å²	142	81%	0.813	75%	0.754	S	S	*	*			trans	-126	124.8	167.8	-162.1	27.4	0	0	0	108.4
549	P	42.3	Very low	38.4	Very low	118 Å²	118	134.6 Å²	134.6	77%	0.766	73%	0.73	S	S	*	*	P	Polyproline II helix	trans	-81.6	127	-158.3	29.6	-34.9	0	0	0	114.3
550	L	39.2	Very low	38.9	Very low	161 Å²	161	136.5 Å²	136.5	84%	0.843	72%	0.72	S	S	*	*	P	Polyproline II helix	trans	-72.4	149.1	172.9	-67.6	176.4	0	0	0	112.4
551	P	37.5	Very low	39	Very low	103 Å²	103	139.7 Å²	139.7	67%	0.669	72%	0.719	S	S	*	*	P	Polyproline II helix	trans	-70.7	152.6	-171.5	27.2	-35.4	0	0	0	114.3	Y553	P551-Y553 PolarHBondContact O-N 3.48Å
552	P	41.7	Very low	39.5	Very low	130 Å²	130	142.3 Å²	142.3	84%	0.844	71%	0.712	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.5	87.2	-164.9	32.6	-37.3	0	0	0	113.5
553	Y	35.4	Very low	40.3	Very low	201 Å²	201	141.2 Å²	141.2	79%	0.788	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-146.5	-7.2	167.6	-145	-101.4	0	0	0	116.4	P551	P551-Y553 PolarHBondContact O-N 3.48Å
554	S	43.1	Very low	40.5	Very low	100 Å²	100	134.7 Å²	134.7	70%	0.699	69%	0.687	S	S	*	*	S	Bend	trans	-81.8	-15.3	-173.6	45.4	0	0	0	0	115.6
555	E	41.8	Very low	40.6	Very low	167 Å²	167	136.3 Å²	136.3	78%	0.78	69%	0.689	S	S	*	*	H	α-helix	trans	-80.7	-25.7	-172.8	-61.3	-167.4	131.4	0	0	114.6	E557	E555-E557 PolarHBondContact O-N 3.34Å
556	L	45.3	Very low	40.9	Very low	121 Å²	121	138.3 Å²	138.3	63%	0.634	70%	0.699	S	S	*	*	H	α-helix	trans	-71.6	-13	-171.7	-161	70.4	0	0	0	114
557	E	43.7	Very low	41.2	Very low	126 Å²	126	134.8 Å²	134.8	59%	0.589	69%	0.691	S	S	*	*	H	α-helix	trans	-98	-40.6	-175.9	-161.6	138.4	-109.4	0	0	112.4	E555 E559 R560	E555-E557 PolarHBondContact O-N 3.34Å; E557-E559 VanDerWaalsContact C-N 3.29Å; E557-E559 PolarHBondContact O-N 3.37Å; E557-R560 WeakPolarHBondContact O-CB 3.33Å; E557-R560 PolarHBondContact O-N 2.88Å; E557-R560 VanDerWaalsContact O-N 3.11Å
558	A	43.6	Very low	41.4	Very low	59 Å²	59	132.7 Å²	132.7	49%	0.488	68%	0.684	S	S	.	*	H	α-helix	trans	-58.9	-40.2	174	0	0	0	0	0	112.1	R560 Y561	A558-R560 PolarHBondContact O-N 3.36Å; A558-Y561 PolarHBondContact O-N 2.93Å
559	E	41.7	Very low	41.4	Very low	86 Å²	86	133.2 Å²	133.2	40%	0.402	69%	0.687	S	S	.	*	H	α-helix	trans	-74.1	-8.9	-179	-141	52	-128.3	0	0	113.5	E557 R562 R563	E557-E559 VanDerWaalsContact C-N 3.29Å; E557-E559 PolarHBondContact O-N 3.37Å; E559-R562 IonicContact OE1-NH1 2.7Å; E559-R562 PolarHBondContact OE1-NH1 2.64Å; E559-R562 IonicContact OE2-CZ 2.74Å; E559-R562 IonicContact OE2-NH1 2.99Å; E559-R562 PolarHBondContact OE2-NH1 3.22Å; E559-R563 PolarHBondContact O-NH1 3.27Å
560	R	46	Very low	41.1	Very low	154 Å²	154	137.7 Å²	137.7	58%	0.581	69%	0.688	S	S	*	*	H	α-helix	trans	-83.1	-39	174.6	-158.5	178	-59.6	163	9.3	111.7	E557 A558 R563	E557-R560 WeakPolarHBondContact O-CB 3.33Å; E557-R560 PolarHBondContact O-N 2.88Å; E557-R560 VanDerWaalsContact O-N 3.11Å; A558-R560 PolarHBondContact O-N 3.36Å; R560-R563 PolarHBondContact O-N 3.43Å
561	Y	40.4	Very low	40.7	Very low	182 Å²	182	140 Å²	140	71%	0.714	69%	0.687	S	S	*	*	H	α-helix	trans	-65.5	-44.1	-179.2	-90.2	-87	0	0	0	113	A558 R563 A564	A558-Y561 PolarHBondContact O-N 2.93Å; Y561-R563 PolarHBondContact O-N 3.12Å; Y561-A564 PolarHBondContact O-N 2.68Å; Y561-A564 VanDerWaalsContact O-N 3.09Å
562	R	42.4	Very low	40.4	Very low	163 Å²	163	146.2 Å²	146.2	62%	0.615	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.8	-19.2	-179.9	-70	-160	-165.8	101.5	3.9	115.2	E559	E559-R562 IonicContact OE1-NH1 2.7Å; E559-R562 PolarHBondContact OE1-NH1 2.64Å; E559-R562 IonicContact OE2-CZ 2.74Å; E559-R562 IonicContact OE2-NH1 2.99Å; E559-R562 PolarHBondContact OE2-NH1 3.22Å
563	R	42.6	Very low	40	Very low	171 Å²	171	146.7 Å²	146.7	65%	0.645	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88	-16.3	179.8	-72.9	-175.1	178	82	-1.8	114	E559 R560 Y561	E559-R563 PolarHBondContact O-NH1 3.27Å; R560-R563 PolarHBondContact O-N 3.43Å; Y561-R563 PolarHBondContact O-N 3.12Å
564	A	43.5	Very low	39.8	Very low	54 Å²	54	142 Å²	142	45%	0.446	70%	0.701	S	S	.	*	T	Hydrogen-bonded Turn	trans	-76.2	-38.8	-174.3	0	0	0	0	0	113.2	Y561 L566 T567	Y561-A564 PolarHBondContact O-N 2.68Å; Y561-A564 VanDerWaalsContact O-N 3.09Å; A564-L566 VanDerWaalsContact C-N 3.29Å; A564-L566 PolarHBondContact O-N 3.15Å; A564-T567 PolarHBondContact O-OG1 3.09Å
565	D	38.2	Very low	39.3	Very low	146 Å²	146	144.9 Å²	144.9	78%	0.781	71%	0.709	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.9	-8.2	-171.3	-67.2	-36.8	0	0	0	114.6
566	L	40.7	Very low	39.5	Very low	156 Å²	156	142.1 Å²	142.1	82%	0.817	71%	0.705	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95	-4	-175.8	-84.1	165.6	0	0	0	115.1	A564	A564-L566 VanDerWaalsContact C-N 3.29Å; A564-L566 PolarHBondContact O-N 3.15Å
567	T	42	Very low	39.2	Very low	112 Å²	112	142.5 Å²	142.5	69%	0.687	72%	0.715	S	S	*	*	S	Bend	trans	-103.3	-5.1	-171.3	43.8	0	0	0	0	116	A564	A564-T567 PolarHBondContact O-OG1 3.09Å
568	T	41.3	Very low	38.6	Very low	125 Å²	125	148 Å²	148	77%	0.767	73%	0.73	S	S	*	*	S	Bend	trans	-91.8	-10.9	-163	-43	0	0	0	0	115
569	D	37.5	Very low	38	Very low	163 Å²	163	150.6 Å²	150.6	87%	0.872	75%	0.745	S	S	*	*	S	Bend	trans	-118.9	47.8	-170.4	-156.6	19.1	0	0	0	113.9
570	R	36.6	Very low	37.4	Very low	211 Å²	211	152.7 Å²	152.7	80%	0.796	76%	0.758	S	S	*	*			trans	-140.1	136.6	173.5	-112.9	177.5	-176.4	171.4	2.3	113.1
571	Y	30.3	Very low	36.8	Very low	210 Å²	210	154.8 Å²	154.8	82%	0.824	77%	0.766	S	S	*	*			trans	71.9	77.3	175.3	-59.5	-72.6	0	0	0	117.9
572	R	29.8	Very low	36.4	Very low	234 Å²	234	155.9 Å²	155.9	88%	0.883	77%	0.771	S	S	*	*			trans	-76.6	162.7	138.7	-134.3	178.2	-172.7	123	-1.7	109.5
573	T	33.3	Very low	35.8	Very low	140 Å²	140	159.7 Å²	159.7	86%	0.859	79%	0.785	S	S	*	*			trans	80.1	103	166.4	-14.2	0	0	0	0	118.1
574	A	32.9	Very low	35.3	Very low	101 Å²	101	157.1 Å²	157.1	84%	0.835	79%	0.789	S	S	*	*			trans	178.6	142.1	131	0	0	0	0	0	110.6
575	D	31.1	Very low	34.7	Very low	162 Å²	162	161.4 Å²	161.4	87%	0.866	81%	0.809	S	S	*	*			trans	-107.9	163.6	174.9	-98.9	-53	0	0	0	111.9
576	P	47.4	Very low	34.3	Very low	109 Å²	109	162.9 Å²	162.9	71%	0.708	81%	0.811	S	S	*	*			trans	-106.8	165.6	-156.3	40.1	-38.1	0	0	0	117
577	P	39.2	Very low	34.9	Very low	129 Å²	129	161 Å²	161	84%	0.838	81%	0.808	S	S	*	*			trans	-100.9	176.3	161.6	37.1	-30.8	0	0	0	114.1
578	R	30.1	Very low	34.2	Very low	242 Å²	242	159.5 Å²	159.5	91%	0.913	82%	0.815	S	S	*	*			trans	-118.1	-179.6	-169.3	-74.6	173.8	160.7	164.5	-6.6	113.7
579	S	31.7	Very low	33.8	Very low	113 Å²	113	159 Å²	159	79%	0.79	82%	0.816	S	S	*	*			trans	92.6	151.4	159.9	85.4	0	0	0	0	116.8
580	D	29.1	Very low	33.4	Very low	129 Å²	129	162.5 Å²	162.5	69%	0.69	82%	0.818	S	S	*	*			cis	-152.9	164.7	-4.1	-143.4	-1.3	0	0	0	116.7
581	R	33.1	Very low	34.1	Very low	199 Å²	199	156.7 Å²	156.7	75%	0.751	81%	0.807	S	S	*	*			trans	8.9	136.4	156.7	-77.8	162.5	164.1	175.1	-6.2	126
582	Y	31.7	Very low	34.3	Very low	205 Å²	205	155.9 Å²	155.9	80%	0.804	81%	0.808	S	S	*	*			trans	68.2	152.9	134.8	-80.4	-117.1	0	0	0	119.3
583	R	30.4	Very low	34.4	Very low	242 Å²	242	149.3 Å²	149.3	91%	0.913	80%	0.798	S	S	*	*			cis	-160.9	168	48.3	-147.3	173.8	-163.2	163.2	3.5	114.8
584	T	31.7	Very low	34.4	Very low	118 Å²	118	152.6 Å²	152.6	72%	0.724	80%	0.796	S	S	*	*			trans	-99.9	168.4	-177.9	-11.5	0	0	0	0	114.2
585	V	29.9	Very low	34.4	Very low	144 Å²	144	153.3 Å²	153.3	87%	0.873	79%	0.791	S	S	*	*			trans	-167.2	154.9	142.5	132.8	0	0	0	0	112.1
586	E	30.5	Very low	34.4	Very low	176 Å²	176	157.3 Å²	157.3	82%	0.822	79%	0.793	S	S	*	*			trans	-135.7	-159.4	-179.6	-134.3	-155.4	164.3	0	0	107.8
587	P	52.6	Low	34.9	Very low	116 Å²	116	156.7 Å²	156.7	75%	0.753	79%	0.789	S	S	*	*			cis	-133	-165.3	-18	37.6	-16.7	0	0	0	113.9
588	G	28.2	Very low	34.6	Very low	81 Å²	81	158.1 Å²	158.1	84%	0.835	79%	0.785	S	S	*	*			trans	-177.8	132.2	165.9	0	0	0	0	0	117.7
589	S	31.8	Very low	35	Very low	114 Å²	114	154.4 Å²	154.4	80%	0.797	78%	0.778	S	S	*	*			trans	-95.9	140.1	-176	36	0	0	0	0	114.7
590	R	30.2	Very low	34.9	Very low	237 Å²	237	152.2 Å²	152.2	89%	0.894	77%	0.773	S	S	*	*				63.1	159	86.1	-100.6	-172.1	-169.7	-167.7	5.3	115.3
591	P	51.9	Low	35.2	Very low	89 Å²	89	154 Å²	154	58%	0.578	78%	0.779	S	S	*	*			cis	-147.7	-178.8	-12.5	43.1	-23.9	0	0	0	118.5
592	F	33.8	Very low	35.3	Very low	194 Å²	194	149.1 Å²	149.1	85%	0.851	78%	0.775	S	S	*	*			trans	63	155.4	154.8	-60.6	-49	0	0	0	121.1
593	S	31.5	Very low	35.5	Very low	96 Å²	96	146.9 Å²	146.9	67%	0.671	77%	0.772	S	S	*	*			cis	-164.3	-163.6	-10.1	52.2	0	0	0	0	109.2
594	Y	33	Very low	35.7	Very low	209 Å²	209	140.9 Å²	140.9	82%	0.82	76%	0.762	S	S	*	*			cis	-167.2	-173.1	3.5	-135.3	-18.9	0	0	0	114.5
595	T	33.2	Very low	35.9	Very low	116 Å²	116	141.8 Å²	141.8	71%	0.712	76%	0.762	S	S	*	*			trans	51.6	106.4	154.4	51	0	0	0	0	127.7
596	R	30.8	Very low	36	Very low	245 Å²	245	143.7 Å²	143.7	93%	0.925	76%	0.761	S	S	*	*				67.3	166.9	113.7	-93.1	-150.4	166.1	179.3	-0.5	124.4
597	P	57.7	Low	36	Very low	96 Å²	96	139 Å²	139	62%	0.623	76%	0.76	S	S	*	*			trans	-136.3	-163.1	-137.2	48.3	-30.7	0	0	0	116.9
598	H	34.6	Very low	34.9	Very low	159 Å²	159	137.4 Å²	137.4	74%	0.736	77%	0.765	S	S	*	*				-172	175.3	127	-113.6	-103.9	0	0	0	117.2
599	Q	37	Very low	35.1	Very low	165 Å²	165	143.2 Å²	143.2	77%	0.771	76%	0.762	S	S	*	*			trans	-49.5	172.4	-172.4	-69	153.5	-46.6	0	0	120.1
600	G	30	Very low	35.3	Very low	66 Å²	66	144.6 Å²	144.6	68%	0.68	76%	0.756	S	S	*	*			cis	153.6	179	-8.4	0	0	0	0	0	116.1
601	M	36.2	Very low	35.5	Very low	168 Å²	168	140.2 Å²	140.2	83%	0.828	75%	0.745	S	S	*	*			trans	66.1	124.2	164.5	-69	179.5	71.5	0	0	119.1
602	S	34.2	Very low	34.7	Very low	95 Å²	95	144.1 Å²	144.1	66%	0.664	75%	0.748	S	S	*	*				84.3	144.6	73	-57.9	0	0	0	0	113.1
603	Q	36.7	Very low	34.8	Very low	159 Å²	159	140.5 Å²	140.5	74%	0.743	74%	0.738	S	S	*	*			cis	-170.3	140.6	7.9	-130.2	169.3	-1.5	0	0	113
604	T	34.7	Very low	35.1	Very low	115 Å²	115	147 Å²	147	71%	0.706	75%	0.748	S	S	*	*			trans	56.2	170.9	142.2	50	0	0	0	0	121.8
605	L	35.9	Very low	35.2	Very low	137 Å²	137	141.8 Å²	141.8	72%	0.717	74%	0.742	S	S	*	*			cis	-160.3	169.8	-3.8	-121.2	158	0	0	0	111.2
606	Q	32	Very low	35.6	Very low	184 Å²	184	147.3 Å²	147.3	86%	0.86	75%	0.749	S	S	*	*			trans	65.7	151.9	157.9	-81.9	157.5	-4.4	0	0	120.7
607	G	29.2	Very low	35.8	Very low	77 Å²	77	142 Å²	142	79%	0.794	74%	0.739	S	S	*	*			cis	157.4	128.3	-16.1	0	0	0	0	0	116.9
608	G	30.3	Very low	34.8	Very low	83 Å²	83	145.1 Å²	145.1	86%	0.856	75%	0.75	S	S	*	*			trans	90.8	167.8	165.6	0	0	0	0	0	117.6
609	R	33.1	Very low	34.7	Very low	204 Å²	204	143.1 Å²	143.1	77%	0.77	75%	0.754	S	S	*	*			cis	-174.5	127.3	-13.6	176.8	177.1	176.8	-149.9	-19.2	111.4
610	E	35.8	Very low	34.7	Very low	143 Å²	143	140.2 Å²	140.2	67%	0.668	76%	0.758	S	S	*	*			trans	54.8	175.6	164.9	-73.7	138.2	-122	0	0	116.2
611	E	33.9	Very low	35.1	Very low	145 Å²	145	142 Å²	142	68%	0.678	77%	0.766	S	S	*	*			cis	-156	177.6	-17.2	-129.7	-156.9	164.5	0	0	107.5
612	R	36	Very low	35.2	Very low	171 Å²	171	142.2 Å²	142.2	65%	0.645	77%	0.77	S	S	*	*			cis	-166.6	150.4	-4.8	-162.4	-173.3	165.8	86.9	9.9	111.5
613	D	36.1	Very low	35.2	Very low	117 Å²	117	143 Å²	143	63%	0.626	78%	0.776	S	S	*	*			trans	57.9	171.3	158.9	-81.7	-34.1	0	0	0	116.6
614	R	35.9	Very low	35.5	Very low	233 Å²	233	144.5 Å²	144.5	88%	0.879	77%	0.774	S	S	*	*			cis	-152	176.5	8.5	-143.8	167	-173.7	162.9	2.5	112
615	S	36.1	Very low	35.7	Very low	100 Å²	100	144.7 Å²	144.7	70%	0.699	77%	0.771	S	S	*	*			trans	-105.4	158	-173.9	55.3	0	0	0	0	116.5
616	R	41.7	Very low	35.9	Very low	231 Å²	231	142.7 Å²	142.7	87%	0.872	77%	0.769	S	S	*	*			trans	163.3	164.1	153.4	-94	158.8	-179.7	-169.4	-0.4	110.4
617	N	34.3	Very low	36.3	Very low	133 Å²	133	141.1 Å²	141.1	71%	0.711	77%	0.765	S	S	*	*			cis	-171.5	135.7	-41.3	-105.7	11.4	0	0	0	109
618	L	37.3	Very low	36.7	Very low	163 Å²	163	143.2 Å²	143.2	85%	0.853	76%	0.763	S	S	*	*			trans	31	113.7	146.6	-60.7	169.1	0	0	0	121.8
619	S	33.4	Very low	37.3	Very low	116 Å²	116	149.4 Å²	149.4	81%	0.811	78%	0.783	S	S	*	*				178.3	135.3	124.8	31.8	0	0	0	0	108.7
620	A	35.8	Very low	37.5	Very low	104 Å²	104	146.7 Å²	146.7	86%	0.86	78%	0.784	S	S	*	*			cis	86.6	100.8	35.3	0	0	0	0	0	113.7
621	A	38.1	Very low	37.6	Very low	103 Å²	103	146.9 Å²	146.9	85%	0.851	79%	0.79	S	S	*	*			trans	-142.1	134.2	168.3	0	0	0	0	0	109.8
622	L	39.5	Very low	37.8	Very low	173 Å²	173	147 Å²	147	91%	0.906	80%	0.796	S	S	*	*			trans	-129.5	127.8	-179.5	-81.1	166.7	0	0	0	110
623	S	33	Very low	37.9	Very low	112 Å²	112	145.6 Å²	145.6	78%	0.783	81%	0.805	S	S	*	*			trans	-161.4	122.7	148	-162.2	0	0	0	0	106.3
624	R	42.4	Very low	38.1	Very low	190 Å²	190	147.4 Å²	147.4	72%	0.717	82%	0.816	S	S	*	*			cis	76.2	126.1	47.4	-71.3	-160.9	66.5	113.4	10.1	114.5
625	D	40.7	Very low	38.2	Very low	119 Å²	119	141.7 Å²	141.7	64%	0.636	81%	0.812	S	S	*	*			trans	69.9	142.4	150.1	-55.1	-22	0	0	0	117.2
626	S	39.8	Very low	38.4	Very low	95 Å²	95	144.6 Å²	144.6	66%	0.664	82%	0.82	S	S	*	*			cis	-168.6	161.9	-8.2	48.2	0	0	0	0	114
627	L	40.8	Very low	38.1	Very low	152 Å²	152	138 Å²	138	80%	0.796	82%	0.816	S	S	*	*			trans	54.8	125.5	144.6	-69.3	164	0	0	0	123.2
628	V	35.8	Very low	38.4	Very low	121 Å²	121	138.4 Å²	138.4	73%	0.733	83%	0.825	S	S	*	*			trans	52.6	115.8	130.2	-179.2	0	0	0	0	120.3
629	V	44.4	Very low	38.5	Very low	213 Å²	213	136.2 Å²	136.2	100%	1.291	82%	0.823	S	S	*	*				-127	0	120.2	178.4	0	0	0	0	107.3

Retrieved 629 of 629 residues in 565.2 ms (Link to these results)

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