A0A087Y2I0_POEFO Loading...

Zinc finger, AN1-type domain 2A

AlphaFold DB , UniProt , Accession A0A087Y2I0, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 279 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	50.7	Low	71.2	Confident	230 Å²	230	112.2 Å²	112.2	100%	1.133	58%	0.579	S	S	*	*				0	111.2	0	-157.3	67.5	-178.4	0	0	106.1
2	E	54.7	Low	72.5	Confident	179 Å²	179	105.9 Å²	105.9	84%	0.836	55%	0.545	S	S	*	.			trans	-95.7	127.9	-171.1	-49.8	-174.2	159.7	0	0	106.8	P4	E2-P4 WeakPolarHBondContact O-CD 3.36Å
3	F	60.1	Low	73.4	Confident	179 Å²	179	112.8 Å²	112.8	79%	0.785	57%	0.569	S	S	*	*			trans	-80.7	106.7	178	-81.2	-86	0	0	0	108.7	L6	F3-L6 HydrophobicContact CB-CD1 4.23Å; F3-L6 HydrophobicContact CD1-CD1 3.72Å; F3-L6 HydrophobicContact CE1-CD1 4.46Å; F3-L6 HydrophobicContact CG-CD1 4.27Å
4	P	64.4	Low	74.3	Confident	113 Å²	113	113.3 Å²	113.3	73%	0.734	58%	0.581	S	S	*	*			trans	-81.7	128.3	-176.9	-6.4	27.5	0	0	0	109.3	E2 L6	E2-P4 WeakPolarHBondContact O-CD 3.36Å; P4-L6 PolarHBondContact O-N 3.2Å
5	D	63	Low	74.9	Confident	148 Å²	148	107.1 Å²	107.1	79%	0.791	55%	0.551	S	S	*	*			trans	53.9	45.9	161	-119.2	-121	0	0	0	117	G7	D5-G7 PolarHBondContact O-N 3.04Å
6	L	69.5	Low	75.3	Confident	113 Å²	113	111.3 Å²	111.3	59%	0.592	56%	0.564	S	S	*	*			trans	-82.9	93.7	168.1	-68.2	-179.8	0	0	0	110.8	F3 P4 F20	F3-L6 HydrophobicContact CB-CD1 4.23Å; F3-L6 HydrophobicContact CD1-CD1 3.72Å; F3-L6 HydrophobicContact CE1-CD1 4.46Å; F3-L6 HydrophobicContact CG-CD1 4.27Å; P4-L6 PolarHBondContact O-N 3.2Å; L6-F20 WeakPolarHBondContact O-CD1 3.44Å; L6-F20 WeakPolarHBondContact O-CE1 3.17Å
7	G	73.1	Confident	75.7	Confident	16 Å²	16	114.4 Å²	114.4	17%	0.165	57%	0.567	C	S	.	*	S	Bend	trans	138.1	151.2	171.5	0	0	0	0	0	112.5	D5 L18 D19	D5-G7 PolarHBondContact O-N 3.04Å; G7-L18 WeakPolarHBondContact O-CD2 3.49Å; G7-D19 WeakPolarHBondContact CA-O 3.19Å
8	E	83.6	Confident	76.1	Confident	98 Å²	98	112.6 Å²	112.6	46%	0.458	56%	0.56	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-105.9	151.2	-179.6	-70.3	-79.5	-178.3	0	0	110.7	D19 P22 I31	E8-D19 PolarHBondContact N-O 3.16Å; E8-D19 VanDerWaalsContact N-O 3.16Å; E8-D19 PolarHBondContact O-N 3.06Å; E8-P22 HydrophobicContact CB-CB 3.94Å; E8-P22 HydrophobicContact CG-CB 3.84Å; E8-P22 HydrophobicContact CG-CG 4.38Å; E8-I31 HydrophobicContact CB-CD1 4.03Å; E8-I31 HydrophobicContact CB-CG2 3.98Å; E8-I31 HydrophobicContact CG-CD1 3.82Å
9	H	87.9	Confident	76.3	Confident	96 Å²	96	108.7 Å²	108.7	44%	0.444	54%	0.541	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	140.8	173.2	-66.6	83.7	0	0	0	110.1	S11 L18	H9-S11 PolarHBondContact O-N 2.78Å; H9-L18 WeakPolarHBondContact CE1-CD2 3.32Å
10	C	89.5	Confident	76.3	Confident	6 Å²	6	111.7 Å²	111.7	4%	0.041	55%	0.551	C	S	.	*			trans	-63.7	129.6	169.6	176.8	0	0	0	0	110.9	E12 C15 R17 C33	C10-E12 PolarHBondContact O-N 3.21Å; C10-E12 VanDerWaalsContact O-N 3.16Å; C10-C15 VanDerWaalsContact CB-O 3.29Å; C10-C15 WeakPolarHBondContact CB-O 3.4Å; C10-R17 PolarHBondContact N-O 3Å; C10-R17 VanDerWaalsContact N-O 3.11Å; C10-C33 HydrophobicContact CB-CB 4.09Å
11	S	87.3	Confident	76.6	Confident	56 Å²	56	112.3 Å²	112.3	39%	0.392	56%	0.556	S	S	.	*			trans	-68.7	-5.8	-179.8	-66.2	0	0	0	0	114	H9 E30 I31	H9-S11 PolarHBondContact O-N 2.78Å; S11-E30 WeakPolarHBondContact CB-OE2 3.21Å; S11-E30 PolarHBondContact OG-OE2 3.21Å; S11-I31 WeakPolarHBondContact CB-O 3.31Å; S11-I31 PolarHBondContact N-O 3.16Å; S11-I31 PolarHBondContact OG-O 2.95Å
12	E	86.2	Confident	77.9	Confident	37 Å²	37	104.4 Å²	104.4	17%	0.173	52%	0.522	C	S	.	.			trans	-70.9	133.2	177.6	-105.6	-51.4	144.5	0	0	112.6	C10 T14 C15 F32 H36 H42	C10-E12 PolarHBondContact O-N 3.21Å; C10-E12 VanDerWaalsContact O-N 3.16Å; E12-T14 PolarHBondContact O-N 2.97Å; E12-C15 HydrophobicContact CB-CB 4.22Å; E12-C15 CarbonylContact O-C 3.53Å; E12-C15 PolarHBondContact O-N 3.34Å; E12-F32 HydrophobicContact CB-CD1 4.42Å; E12-F32 HydrophobicContact CB-CE1 4.44Å; E12-F32 HydrophobicContact CG-CD1 4.15Å; E12-F32 HydrophobicContact CG-CE1 4Å; E12-H36 HydrophobicContact CG-CB 4.26Å; E12-H42 HydrophobicContact CG-CB 3.75Å; E12-H42 WeakPolarHBondContact OE1-CA 3.36Å; E12-H42 WeakPolarHBondContact OE1-CB 3.41Å
13	K	84.1	Confident	79.3	Confident	195 Å²	195	98.6 Å²	98.6	85%	0.848	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67	-26.6	-174.1	-61.3	-171.6	-177.7	-177.1	0	112.5
14	T	86.1	Confident	80.7	Confident	120 Å²	120	98.6 Å²	98.6	74%	0.736	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.5	-16.9	177	54.1	0	0	0	0	113.3	E12	E12-T14 PolarHBondContact O-N 2.97Å
15	C	84	Confident	81.9	Confident	21 Å²	21	93.2 Å²	93.2	14%	0.142	46%	0.455	C	S	.	.			trans	-135.6	94.8	-171.4	-174.5	0	0	0	0	111.4	C10 E12 R17 H36	C10-C15 VanDerWaalsContact CB-O 3.29Å; C10-C15 WeakPolarHBondContact CB-O 3.4Å; E12-C15 HydrophobicContact CB-CB 4.22Å; E12-C15 CarbonylContact O-C 3.53Å; E12-C15 PolarHBondContact O-N 3.34Å; C15-R17 VanDerWaalsContact C-N 3.25Å; C15-R17 PolarHBondContact O-N 3.11Å; C15-H36 WeakPolarHBondContact CB-CE1 3.29Å; C15-H36 VanDerWaalsContact SG-CE1 3.53Å
16	K	80.7	Confident	83	Confident	174 Å²	174	90.4 Å²	90.4	76%	0.757	44%	0.44	S	S	*	.			trans	-92.1	38	172.2	-61	-174.1	178.9	-175.3	0	112.3
17	R	82.4	Confident	83.8	Confident	163 Å²	163	85.8 Å²	85.8	62%	0.615	42%	0.418	S	S	*	.			trans	-75.6	129.9	178.7	-171.7	170	-176.1	153.4	3.5	109.3	C10 C15	C10-R17 PolarHBondContact N-O 3Å; C10-R17 VanDerWaalsContact N-O 3.11Å; C15-R17 VanDerWaalsContact C-N 3.25Å; C15-R17 PolarHBondContact O-N 3.11Å
18	L	83	Confident	84.4	Confident	83 Å²	83	86.7 Å²	86.7	44%	0.435	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	124.4	164.4	-81.8	163.5	0	0	0	109.1	G7 H9	G7-L18 WeakPolarHBondContact O-CD2 3.49Å; H9-L18 WeakPolarHBondContact CE1-CD2 3.32Å
19	D	80.3	Confident	84.6	Confident	39 Å²	39	89.3 Å²	89.3	21%	0.209	43%	0.434	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	127.8	172.3	-149.9	-36.3	0	0	0	109.2	G7 E8 L21 C33 K34	G7-D19 WeakPolarHBondContact CA-O 3.19Å; E8-D19 PolarHBondContact N-O 3.16Å; E8-D19 VanDerWaalsContact N-O 3.16Å; E8-D19 PolarHBondContact O-N 3.06Å; D19-L21 PolarHBondContact O-N 3.16Å; D19-L21 PolarHBondContact OD1-N 3.28Å; D19-C33 HydrophobicContact CB-CB 3.99Å; D19-C33 VanDerWaalsContact OD2-CA 3.27Å; D19-C33 WeakPolarHBondContact OD2-CA 3.44Å; D19-C33 WeakPolarHBondContact OD2-CB 3.46Å; D19-K34 PolarHBondContact OD2-N 3.36Å
20	F	76.4	Confident	84.7	Confident	167 Å²	167	89.5 Å²	89.5	73%	0.732	44%	0.435	S	S	*	.	S	Bend	trans	-73	-14.1	-178.1	-62.4	-81.7	0	0	0	112.1	L6 P22	L6-F20 WeakPolarHBondContact O-CD1 3.44Å; L6-F20 WeakPolarHBondContact O-CE1 3.17Å; F20-P22 WeakPolarHBondContact O-CD 3.04Å
21	L	81.8	Confident	84.7	Confident	126 Å²	126	90.3 Å²	90.3	66%	0.66	44%	0.439	S	S	*	.	S	Bend	trans	-114.4	86.5	174.4	-163.1	72.2	0	0	0	109.7	D19 M23	D19-L21 PolarHBondContact O-N 3.16Å; D19-L21 PolarHBondContact OD1-N 3.28Å; L21-M23 WeakPolarHBondContact O-CG 3.27Å; L21-M23 PolarHBondContact O-N 3.05Å
22	P	77.8	Confident	84.8	Confident	63 Å²	63	88 Å²	88	41%	0.409	42%	0.421	S	S	.	.			trans	-64.6	102	-178.1	24.4	-34.2	0	0	0	111.6	E8 F20 I31	E8-P22 HydrophobicContact CB-CB 3.94Å; E8-P22 HydrophobicContact CG-CB 3.84Å; E8-P22 HydrophobicContact CG-CG 4.38Å; F20-P22 WeakPolarHBondContact O-CD 3.04Å; P22-I31 HydrophobicContact CB-CD1 4.35Å; P22-I31 HydrophobicContact CB-CG2 3.93Å
23	M	85.3	Confident	84.9	Confident	58 Å²	58	86.2 Å²	86.2	29%	0.286	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	120.5	177.7	-56.6	-165.3	-66.8	0	0	110.5	L21 F32 K34 I37	L21-M23 WeakPolarHBondContact O-CG 3.27Å; L21-M23 PolarHBondContact O-N 3.05Å; M23-F32 PolarHBondContact O-N 3.26Å; M23-K34 HydrophobicContact CE-CB 4.28Å; M23-I37 HydrophobicContact CB-CD1 3.39Å; M23-I37 HydrophobicContact CE-CB 4.27Å; M23-I37 HydrophobicContact CE-CD1 3.99Å; M23-I37 HydrophobicContact CE-CG2 3.9Å; M23-I37 HydrophobicContact CG-CD1 4.37Å; M23-I37 HydrophobicContact SD-CD1 4.18Å
24	R	89.2	Confident	85.1	Confident	178 Å²	178	84.4 Å²	84.4	67%	0.672	41%	0.405	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.2	129.7	179.4	-66.2	176.5	-172.1	-163.2	-1	110.2	D26 E30 I31	R24-D26 PolarHBondContact O-N 3.2Å; R24-E30 CarbonylContact C-O 3.51Å; R24-E30 WeakPolarHBondContact CA-O 3.48Å; R24-I31 HydrophobicContact CG-CG1 3.92Å
25	C	88.7	Confident	85.2	Confident	1 Å²	1	83.1 Å²	83.1	1%	0.007	39%	0.394	C	S	.	.	P	Polyproline II helix	trans	-61.7	125.5	168.4	174.4	0	0	0	0	108.9	A27 C28 Q29 E30 F32 H42	C25-A27 PolarHBondContact O-N 2.96Å; C25-C28 VanDerWaalsContact CB-SG 3.51Å; C25-C28 PolarHBondContact SG-SG 3.42Å; C25-Q29 WeakPolarHBondContact O-CA 3.21Å; C25-Q29 PolarHBondContact O-N 3.42Å; C25-E30 PolarHBondContact N-O 3.39Å; C25-F32 HydrophobicContact CB-CD2 3.77Å; C25-F32 HydrophobicContact CB-CE2 3.62Å; C25-H42 VanDerWaalsContact SG-CE1 3.51Å; C25-H42 PolarHBondContact SG-NE2 2.9Å
26	D	86.4	Confident	85.5	Confident	89 Å²	89	84 Å²	84	48%	0.476	40%	0.396	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.2	-13.4	-174.5	69.4	-38.8	0	0	0	113	R24 Y39 K50	R24-D26 PolarHBondContact O-N 3.2Å; D26-Y39 WeakPolarHBondContact OD1-CE1 3.12Å; D26-Y39 PolarHBondContact OD1-OH 3.37Å; D26-Y39 PolarHBondContact OD2-OH 2.82Å; D26-K50 VanDerWaalsContact C-NZ 3.29Å; D26-K50 VanDerWaalsContact CB-NZ 3.3Å; D26-K50 WeakPolarHBondContact O-CE 3.11Å; D26-K50 PolarHBondContact O-NZ 3.33Å; D26-K50 WeakPolarHBondContact OD2-CD 3.5Å; D26-K50 WeakPolarHBondContact OD2-CE 3.5Å; D26-K50 IonicContact OD2-NZ 2.8Å; D26-K50 PolarHBondContact OD2-NZ 3.15Å
27	A	85.9	Confident	85.8	Confident	16 Å²	16	78 Å²	78	13%	0.132	37%	0.372	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.8	-44.4	175.5	0	0	0	0	0	114.3	C25 Y39 S46 K50	C25-A27 PolarHBondContact O-N 2.96Å; A27-Y39 HydrophobicContact CB-CD1 4.29Å; A27-Y39 HydrophobicContact CB-CE1 3.61Å; A27-S46 PolarHBondContact O-OG 2.98Å; A27-K50 HydrophobicContact CB-CD 4.17Å; A27-K50 HydrophobicContact CB-CG 4.29Å
28	C	86.9	Confident	86.1	Confident	34 Å²	34	73.7 Å²	73.7	23%	0.23	36%	0.363	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.9	-7.3	-179	62.5	0	0	0	0	114.6	C25 E30 C44 S46	C25-C28 VanDerWaalsContact CB-SG 3.51Å; C25-C28 PolarHBondContact SG-SG 3.42Å; C28-E30 PolarHBondContact O-N 3.32Å; C28-C44 VanDerWaalsContact SG-SG 3.64Å; C28-S46 WeakPolarHBondContact CA-OG 3.45Å; C28-S46 WeakPolarHBondContact CB-OG 3.1Å; C28-S46 PolarHBondContact N-OG 2.98Å
29	Q	87.6	Confident	86.4	Confident	154 Å²	154	73.3 Å²	73.3	72%	0.72	36%	0.357	S	S	*	.			trans	66.6	-4.8	177.9	-53.8	-177.3	11.7	0	0	116.2	C25	C25-Q29 WeakPolarHBondContact O-CA 3.21Å; C25-Q29 PolarHBondContact O-N 3.42Å
30	E	88.6	Confident	86.6	Confident	99 Å²	99	75.2 Å²	75.2	46%	0.463	38%	0.378	S	S	.	.			trans	-62	152.8	169.1	-67.7	-60.7	143.5	0	0	113	S11 R24 C25 C28 F32	S11-E30 WeakPolarHBondContact CB-OE2 3.21Å; S11-E30 PolarHBondContact OG-OE2 3.21Å; R24-E30 CarbonylContact C-O 3.51Å; R24-E30 WeakPolarHBondContact CA-O 3.48Å; C25-E30 PolarHBondContact N-O 3.39Å; C28-E30 PolarHBondContact O-N 3.32Å; E30-F32 HydrophobicContact CB-CD2 4.43Å; E30-F32 HydrophobicContact CB-CE2 3.5Å; E30-F32 HydrophobicContact CB-CZ 3.56Å; E30-F32 HydrophobicContact CG-CZ 4.45Å
31	I	89.9	Confident	87.2	Confident	23 Å²	23	71.5 Å²	71.5	12%	0.118	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	132.6	-178.6	-60.1	175.7	0	0	0	109.8	E8 S11 P22 R24	E8-I31 HydrophobicContact CB-CD1 4.03Å; E8-I31 HydrophobicContact CB-CG2 3.98Å; E8-I31 HydrophobicContact CG-CD1 3.82Å; S11-I31 WeakPolarHBondContact CB-O 3.31Å; S11-I31 PolarHBondContact N-O 3.16Å; S11-I31 PolarHBondContact OG-O 2.95Å; P22-I31 HydrophobicContact CB-CD1 4.35Å; P22-I31 HydrophobicContact CB-CG2 3.93Å; R24-I31 HydrophobicContact CG-CG1 3.92Å
32	F	89.7	Confident	87.4	Confident	7 Å²	7	66 Å²	66	3%	0.031	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	149	176.4	-59.1	-77.6	0	0	0	111.4	E12 M23 C25 E30 H36 I37 H42	E12-F32 HydrophobicContact CB-CD1 4.42Å; E12-F32 HydrophobicContact CB-CE1 4.44Å; E12-F32 HydrophobicContact CG-CD1 4.15Å; E12-F32 HydrophobicContact CG-CE1 4Å; M23-F32 PolarHBondContact O-N 3.26Å; C25-F32 HydrophobicContact CB-CD2 3.77Å; C25-F32 HydrophobicContact CB-CE2 3.62Å; E30-F32 HydrophobicContact CB-CD2 4.43Å; E30-F32 HydrophobicContact CB-CE2 3.5Å; E30-F32 HydrophobicContact CB-CZ 3.56Å; E30-F32 HydrophobicContact CG-CZ 4.45Å; F32-H36 HydrophobicContact CB-CB 4.18Å; F32-H36 HydrophobicContact CD1-CB 4.22Å; F32-I37 HydrophobicContact CB-CB 4.24Å; F32-H42 HydrophobicContact CD1-CB 3.83Å; F32-H42 AromaticContact CD2-ND1 3.95Å; F32-H42 HydrophobicContact CE1-CB 3.44Å; F32-H42 VanDerWaalsContact CE1-CB 3.44Å; F32-H42 AromaticContact CE1-CG 3.76Å; F32-H42 HydrophobicContact CE2-CB 4.3Å; F32-H42 AromaticContact CE2-CD2 3.44Å; F32-H42 VanDerWaalsContact CE2-CD2 3.44Å; F32-H42 WeakPolarHBondContact CE2-CD2 3.48Å; F32-H42 AromaticContact CE2-CE1 3.79Å; F32-H42 AromaticContact CE2-CG 3.67Å; F32-H42 AromaticContact CE2-ND1 3.88Å; F32-H42 AromaticContact CE2-NE2 3.55Å; F32-H42 HydrophobicContact CG-CB 4.43Å; F32-H42 HydrophobicContact CZ-CB 3.7Å; F32-H42 AromaticContact CZ-CD2 3.31Å; F32-H42 WeakPolarHBondContact CZ-CD2 3.41Å; F32-H42 AromaticContact CZ-CG 3.49Å; F32-H42 VanDerWaalsContact CZ-CG 3.49Å; F32-H42 AromaticContact CZ-NE2 3.93Å
33	C	89.2	Confident	87.8	Confident	0 Å²	0	71.6 Å²	71.6	0%	0	36%	0.355	C	S	.	.			trans	-69.7	167.7	169.7	68.6	0	0	0	0	111.2	C10 D19 D35 H36 I37	C10-C33 HydrophobicContact CB-CB 4.09Å; D19-C33 HydrophobicContact CB-CB 3.99Å; D19-C33 VanDerWaalsContact OD2-CA 3.27Å; D19-C33 WeakPolarHBondContact OD2-CA 3.44Å; D19-C33 WeakPolarHBondContact OD2-CB 3.46Å; C33-D35 PolarHBondContact O-N 3.17Å; C33-H36 PolarHBondContact O-N 3.3Å; C33-H36 PolarHBondContact SG-ND1 3.01Å; C33-I37 PolarHBondContact O-N 3.06Å; C33-I37 VanDerWaalsContact O-N 3.15Å
34	K	87.9	Confident	87.9	Confident	158 Å²	158	69.4 Å²	69.4	69%	0.687	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-45.9	-37.5	-179.4	-172.3	-170.1	172.3	-162	0	114.8	D19 M23	D19-K34 PolarHBondContact OD2-N 3.36Å; M23-K34 HydrophobicContact CE-CB 4.28Å
35	D	88.4	Confident	87.7	Confident	92 Å²	92	67 Å²	67	49%	0.492	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.7	-21.9	-175.3	-53.5	-47.1	0	0	0	113.3	C33 N41	C33-D35 PolarHBondContact O-N 3.17Å; D35-N41 PolarHBondContact O-ND2 3.21Å
36	H	88.8	Confident	87.3	Confident	39 Å²	39	67.5 Å²	67.5	18%	0.181	35%	0.353	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.7	-8	-175	-65.6	93.1	0	0	0	114.6	E12 C15 F32 C33 T38 H42	E12-H36 HydrophobicContact CG-CB 4.26Å; C15-H36 WeakPolarHBondContact CB-CE1 3.29Å; C15-H36 VanDerWaalsContact SG-CE1 3.53Å; F32-H36 HydrophobicContact CB-CB 4.18Å; F32-H36 HydrophobicContact CD1-CB 4.22Å; C33-H36 PolarHBondContact O-N 3.3Å; C33-H36 PolarHBondContact SG-ND1 3.01Å; H36-T38 PolarHBondContact O-N 3.45Å; H36-H42 WeakPolarHBondContact O-CB 3.33Å; H36-H42 PolarHBondContact O-ND1 3.43Å
37	I	88.3	Confident	87.1	Confident	50 Å²	50	65 Å²	65	26%	0.256	34%	0.343	S	S	.	.			trans	-60.7	-25.7	-179.2	-175.2	154.8	0	0	0	114.8	M23 F32 C33 H42	M23-I37 HydrophobicContact CB-CD1 3.39Å; M23-I37 HydrophobicContact CE-CB 4.27Å; M23-I37 HydrophobicContact CE-CD1 3.99Å; M23-I37 HydrophobicContact CE-CG2 3.9Å; M23-I37 HydrophobicContact CG-CD1 4.37Å; M23-I37 HydrophobicContact SD-CD1 4.18Å; F32-I37 HydrophobicContact CB-CB 4.24Å; C33-I37 PolarHBondContact O-N 3.06Å; C33-I37 VanDerWaalsContact O-N 3.15Å; I37-H42 PolarHBondContact O-CE1 2.94Å; I37-H42 PolarHBondContact O-ND1 2.85Å
38	T	88.3	Confident	86.6	Confident	71 Å²	71	72.2 Å²	72.2	44%	0.436	37%	0.368	S	S	.	.	S	Bend	trans	-67.4	138.5	177.8	65.1	0	0	0	0	110.7	H36 A40 N41 H42	H36-T38 PolarHBondContact O-N 3.45Å; T38-A40 PolarHBondContact O-N 2.66Å; T38-N41 PolarHBondContact O-N 3.05Å; T38-N41 WeakPolarHBondContact OG1-CB 3.22Å; T38-N41 PolarHBondContact OG1-ND2 3Å; T38-H42 PolarHBondContact O-N 2.98Å; T38-H42 PolarHBondContact O-ND1 3.39Å
39	Y	88.6	Confident	86	Confident	76 Å²	76	76.4 Å²	76.4	30%	0.298	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.3	-30.1	-175.5	-50.9	-67.2	0	0	0	114	D26 A27 K43 C44 S47 K50	D26-Y39 WeakPolarHBondContact OD1-CE1 3.12Å; D26-Y39 PolarHBondContact OD1-OH 3.37Å; D26-Y39 PolarHBondContact OD2-OH 2.82Å; A27-Y39 HydrophobicContact CB-CD1 4.29Å; A27-Y39 HydrophobicContact CB-CE1 3.61Å; Y39-K43 VanDerWaalsContact O-CA 3.32Å; Y39-K43 WeakPolarHBondContact O-CA 3.38Å; Y39-K43 PolarHBondContact O-N 3.46Å; Y39-C44 HydrophobicContact CD1-CB 3.8Å; Y39-C44 HydrophobicContact CG-CB 4.32Å; Y39-C44 PolarHBondContact O-N 3.31Å; Y39-S47 WeakPolarHBondContact CB-OG 3.24Å; Y39-K50 WeakPolarHBondContact OH-CD 3.35Å
40	A	85.6	Confident	85.3	Confident	79 Å²	79	72.3 Å²	72.3	65%	0.653	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69	-38.3	177.5	0	0	0	0	0	112.4	T38	T38-A40 PolarHBondContact O-N 2.66Å
41	N	87.9	Confident	84.3	Confident	89 Å²	89	72.4 Å²	72.4	48%	0.476	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.6	-34.5	-173.5	-69	-0.9	0	0	0	112.1	D35 T38	D35-N41 PolarHBondContact O-ND2 3.21Å; T38-N41 PolarHBondContact O-N 3.05Å; T38-N41 WeakPolarHBondContact OG1-CB 3.22Å; T38-N41 PolarHBondContact OG1-ND2 3Å
42	H	87.1	Confident	83.5	Confident	11 Å²	11	74.2 Å²	74.2	5%	0.051	38%	0.377	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.3	13.7	173.2	73	-94	0	0	0	114.7	E12 C25 F32 H36 I37 T38 C44	E12-H42 HydrophobicContact CG-CB 3.75Å; E12-H42 WeakPolarHBondContact OE1-CA 3.36Å; E12-H42 WeakPolarHBondContact OE1-CB 3.41Å; C25-H42 VanDerWaalsContact SG-CE1 3.51Å; C25-H42 PolarHBondContact SG-NE2 2.9Å; F32-H42 HydrophobicContact CD1-CB 3.83Å; F32-H42 AromaticContact CD2-ND1 3.95Å; F32-H42 HydrophobicContact CE1-CB 3.44Å; F32-H42 VanDerWaalsContact CE1-CB 3.44Å; F32-H42 AromaticContact CE1-CG 3.76Å; F32-H42 HydrophobicContact CE2-CB 4.3Å; F32-H42 AromaticContact CE2-CD2 3.44Å; F32-H42 VanDerWaalsContact CE2-CD2 3.44Å; F32-H42 WeakPolarHBondContact CE2-CD2 3.48Å; F32-H42 AromaticContact CE2-CE1 3.79Å; F32-H42 AromaticContact CE2-CG 3.67Å; F32-H42 AromaticContact CE2-ND1 3.88Å; F32-H42 AromaticContact CE2-NE2 3.55Å; F32-H42 HydrophobicContact CG-CB 4.43Å; F32-H42 HydrophobicContact CZ-CB 3.7Å; F32-H42 AromaticContact CZ-CD2 3.31Å; F32-H42 WeakPolarHBondContact CZ-CD2 3.41Å; F32-H42 AromaticContact CZ-CG 3.49Å; F32-H42 VanDerWaalsContact CZ-CG 3.49Å; F32-H42 AromaticContact CZ-NE2 3.93Å; H36-H42 WeakPolarHBondContact O-CB 3.33Å; H36-H42 PolarHBondContact O-ND1 3.43Å; I37-H42 PolarHBondContact O-CE1 2.94Å; I37-H42 PolarHBondContact O-ND1 2.85Å; T38-H42 PolarHBondContact O-N 2.98Å; T38-H42 PolarHBondContact O-ND1 3.39Å; H42-C44 VanDerWaalsContact C-N 3.3Å; H42-C44 WeakPolarHBondContact NE2-CB 3.43Å; H42-C44 PolarHBondContact NE2-SG 3.3Å; H42-C44 VanDerWaalsContact NE2-SG 3.39Å; H42-C44 PolarHBondContact O-N 3.12Å; H42-C44 VanDerWaalsContact O-N 3.16Å
43	K	85.8	Confident	82.8	Confident	180 Å²	180	80.6 Å²	80.6	78%	0.783	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	44.4	52.6	177.1	-64.7	168.4	-177.1	169.3	0	112.8	Y39 T45	Y39-K43 VanDerWaalsContact O-CA 3.32Å; Y39-K43 WeakPolarHBondContact O-CA 3.38Å; Y39-K43 PolarHBondContact O-N 3.46Å; K43-T45 PolarHBondContact O-N 3.21Å; K43-T45 VanDerWaalsContact O-N 3.12Å
44	C	86.8	Confident	82.6	Confident	12 Å²	12	84.2 Å²	84.2	8%	0.081	43%	0.43	C	S	.	.			trans	-54	115.1	-165.5	-169.3	0	0	0	0	113.2	C28 Y39 H42 S46 S47	C28-C44 VanDerWaalsContact SG-SG 3.64Å; Y39-C44 HydrophobicContact CD1-CB 3.8Å; Y39-C44 HydrophobicContact CG-CB 4.32Å; Y39-C44 PolarHBondContact O-N 3.31Å; H42-C44 VanDerWaalsContact C-N 3.3Å; H42-C44 WeakPolarHBondContact NE2-CB 3.43Å; H42-C44 PolarHBondContact NE2-SG 3.3Å; H42-C44 VanDerWaalsContact NE2-SG 3.39Å; H42-C44 PolarHBondContact O-N 3.12Å; H42-C44 VanDerWaalsContact O-N 3.16Å; C44-S46 PolarHBondContact O-N 3.19Å; C44-S47 WeakPolarHBondContact O-CB 3.41Å; C44-S47 PolarHBondContact O-N 2.91Å
45	T	85.4	Confident	82.6	Confident	126 Å²	126	78 Å²	78	77%	0.773	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.6	-28.8	179.5	-43.2	0	0	0	0	113	K43 Y48	K43-T45 PolarHBondContact O-N 3.21Å; K43-T45 VanDerWaalsContact O-N 3.12Å; T45-Y48 WeakPolarHBondContact O-CD1 3.39Å; T45-Y48 WeakPolarHBondContact O-CE1 3.38Å
46	S	81.4	Confident	82.7	Confident	12 Å²	12	77.5 Å²	77.5	8%	0.084	41%	0.405	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.5	16.5	-177.4	48.4	0	0	0	0	114.5	A27 C28 C44 Y48 K49	A27-S46 PolarHBondContact O-OG 2.98Å; C28-S46 WeakPolarHBondContact CA-OG 3.45Å; C28-S46 WeakPolarHBondContact CB-OG 3.1Å; C28-S46 PolarHBondContact N-OG 2.98Å; C44-S46 PolarHBondContact O-N 3.19Å; S46-Y48 PolarHBondContact O-N 3.29Å; S46-Y48 VanDerWaalsContact O-N 3.11Å; S46-K49 WeakPolarHBondContact O-CB 3.28Å; S46-K49 PolarHBondContact O-N 3.46Å
47	S	81.4	Confident	82.7	Confident	36 Å²	36	75.6 Å²	75.6	25%	0.252	40%	0.397	S	S	.	.	G	3₁₀ helix	trans	-50.7	-37.4	176.3	-160.9	0	0	0	0	112.6	Y39 C44 K49 K50 D51	Y39-S47 WeakPolarHBondContact CB-OG 3.24Å; C44-S47 WeakPolarHBondContact O-CB 3.41Å; C44-S47 PolarHBondContact O-N 2.91Å; S47-K49 PolarHBondContact O-N 3.12Å; S47-K50 PolarHBondContact O-N 2.87Å; S47-D51 PolarHBondContact O-N 3.49Å
48	Y	74.3	Confident	82.7	Confident	169 Å²	169	77.7 Å²	77.7	66%	0.663	41%	0.413	S	S	*	.	G	3₁₀ helix	trans	-57.1	-22.5	177.8	67.8	-100.3	0	0	0	114	T45 S46 K50	T45-Y48 WeakPolarHBondContact O-CD1 3.39Å; T45-Y48 WeakPolarHBondContact O-CE1 3.38Å; S46-Y48 PolarHBondContact O-N 3.29Å; S46-Y48 VanDerWaalsContact O-N 3.11Å; Y48-K50 PolarHBondContact O-N 2.95Å
49	K	74.1	Confident	82.6	Confident	121 Å²	121	78.2 Å²	78.2	53%	0.526	41%	0.413	S	S	.	.	G	3₁₀ helix	trans	-75.4	-12.4	178	-61.5	-171	-179.7	179.8	0	112.8	S46 S47 R68	S46-K49 WeakPolarHBondContact O-CB 3.28Å; S46-K49 PolarHBondContact O-N 3.46Å; S47-K49 PolarHBondContact O-N 3.12Å; K49-R68 PolarHBondContact O-NH1 2.86Å
50	K	73.6	Confident	82.5	Confident	69 Å²	69	76 Å²	76	30%	0.3	41%	0.408	S	S	.	.	T	Hydrogen-bonded Turn	trans	-125.7	-14.6	-173.5	-61.2	-154.9	175.2	-161.8	0	115	D26 A27 Y39 S47 Y48 V52	D26-K50 VanDerWaalsContact C-NZ 3.29Å; D26-K50 VanDerWaalsContact CB-NZ 3.3Å; D26-K50 WeakPolarHBondContact O-CE 3.11Å; D26-K50 PolarHBondContact O-NZ 3.33Å; D26-K50 WeakPolarHBondContact OD2-CD 3.5Å; D26-K50 WeakPolarHBondContact OD2-CE 3.5Å; D26-K50 IonicContact OD2-NZ 2.8Å; D26-K50 PolarHBondContact OD2-NZ 3.15Å; A27-K50 HydrophobicContact CB-CD 4.17Å; A27-K50 HydrophobicContact CB-CG 4.29Å; Y39-K50 WeakPolarHBondContact OH-CD 3.35Å; S47-K50 PolarHBondContact O-N 2.87Å; Y48-K50 PolarHBondContact O-N 2.95Å; K50-V52 VanDerWaalsContact C-N 3.25Å; K50-V52 PolarHBondContact O-N 2.83Å
51	D	68.6	Low	82.5	Confident	100 Å²	100	78.2 Å²	78.2	54%	0.535	41%	0.409	S	S	.	.			trans	-72.9	76.6	170.9	-147.5	-108.3	0	0	0	110.9	S47 Q53	S47-D51 PolarHBondContact O-N 3.49Å; D51-Q53 PolarHBondContact O-N 3.3Å; D51-Q53 VanDerWaalsContact O-N 3.14Å; D51-Q53 VanDerWaalsContact OD1-CG 3.28Å; D51-Q53 WeakPolarHBondContact OD1-CG 3.37Å; D51-Q53 PolarHBondContact OD1-NE2 2.83Å
52	V	72.3	Confident	82.5	Confident	61 Å²	61	76.9 Å²	76.9	37%	0.37	40%	0.404	S	S	.	.			trans	-83.8	84.4	177.2	-174.9	0	0	0	0	108.7	K50 I66 R68	K50-V52 VanDerWaalsContact C-N 3.25Å; K50-V52 PolarHBondContact O-N 2.83Å; V52-I66 HydrophobicContact CG1-CD1 4.42Å; V52-I66 HydrophobicContact CG1-CG1 4.05Å; V52-R68 HydrophobicContact CG2-CG 4.28Å
53	Q	75.7	Confident	82.6	Confident	141 Å²	141	80 Å²	80	66%	0.659	43%	0.426	S	S	*	.			trans	-69.7	130.8	176.3	-59.4	-169.4	3.8	0	0	110.4	D51 P55 I66	D51-Q53 PolarHBondContact O-N 3.3Å; D51-Q53 VanDerWaalsContact O-N 3.14Å; D51-Q53 VanDerWaalsContact OD1-CG 3.28Å; D51-Q53 WeakPolarHBondContact OD1-CG 3.37Å; D51-Q53 PolarHBondContact OD1-NE2 2.83Å; Q53-P55 VanDerWaalsContact O-CD 3.32Å; Q53-P55 WeakPolarHBondContact O-CD 3.47Å; Q53-I66 WeakPolarHBondContact O-CD1 3.43Å
54	V	85.1	Confident	82.7	Confident	77 Å²	77	72 Å²	72	47%	0.467	39%	0.391	S	S	.	.			trans	-95.6	106.8	-176.8	-177.4	0	0	0	0	108.7	P63 I64	V54-P63 HydrophobicContact CG1-CB 3.75Å; V54-I64 WeakPolarHBondContact CG1-O 3.38Å
55	P	86.8	Confident	82.6	Confident	26 Å²	26	76.5 Å²	76.5	17%	0.169	42%	0.42	C	S	.	.	P	Polyproline II helix	trans	-66.3	145.8	179.4	29	-36	0	0	0	110.9	Q53 I64 I66 P72 V76	Q53-P55 VanDerWaalsContact O-CD 3.32Å; Q53-P55 WeakPolarHBondContact O-CD 3.47Å; P55-I64 HydrophobicContact CG-CB 4.49Å; P55-I64 PolarHBondContact O-N 3.11Å; P55-I66 HydrophobicContact CG-CG2 3.72Å; P55-P72 HydrophobicContact CB-CB 4.23Å; P55-P72 HydrophobicContact CG-CB 4.07Å; P55-V76 HydrophobicContact CB-CG2 3.72Å; P55-V76 HydrophobicContact CG-CG2 3.89Å
56	V	90.2	Very high	82.5	Confident	82 Å²	82	72 Å²	72	50%	0.497	39%	0.391	S	S	.	.	B	Isolated β-bridge	trans	-102.7	134.1	177.7	179.6	0	0	0	0	109.2
57	C	89.9	Confident	82.5	Confident	0 Å²	0	78.9 Å²	78.9	0%	0	42%	0.419	C	S	.	.	P	Polyproline II helix	trans	-66.7	127.4	175.7	-176.2	0	0	0	0	111.2	L59 C60 N61 T62 I64 H79	C57-L59 PolarHBondContact O-N 2.78Å; C57-L59 PolarHBondContact SG-N 3.07Å; C57-C60 WeakPolarHBondContact CB-SG 3.27Å; C57-C60 VanDerWaalsContact SG-SG 3.64Å; C57-N61 VanDerWaalsContact O-CA 3.29Å; C57-N61 WeakPolarHBondContact O-CA 3.33Å; C57-N61 PolarHBondContact O-N 3Å; C57-T62 PolarHBondContact N-O 3.24Å; C57-I64 HydrophobicContact CB-CD1 3.84Å; C57-I64 HydrophobicContact CB-CG1 4.35Å; C57-H79 VanDerWaalsContact SG-CD2 3.56Å
58	P	87.7	Confident	82.3	Confident	93 Å²	93	85.5 Å²	85.5	60%	0.604	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.6	-16	179.1	28.7	-36	0	0	0	113.9
59	L	86.8	Confident	82.4	Confident	83 Å²	83	81.8 Å²	81.8	44%	0.435	45%	0.452	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.2	-33.2	-178.3	-59.4	-177.4	0	0	0	113.3	C57 I80 S86	C57-L59 PolarHBondContact O-N 2.78Å; C57-L59 PolarHBondContact SG-N 3.07Å; L59-I80 HydrophobicContact CD1-CG1 4.14Å; L59-I80 HydrophobicContact CD1-CG2 3.94Å; L59-S86 WeakPolarHBondContact O-CB 3.13Å; L59-S86 PolarHBondContact O-OG 2.89Å
60	C	86.9	Confident	82.7	Confident	28 Å²	28	78.7 Å²	78.7	19%	0.189	44%	0.44	C	S	.	.	T	Hydrogen-bonded Turn	trans	-122.6	-1.8	-172.7	75.3	0	0	0	0	114	C57 T62 H79 S86	C57-C60 WeakPolarHBondContact CB-SG 3.27Å; C57-C60 VanDerWaalsContact SG-SG 3.64Å; C60-T62 PolarHBondContact O-N 3.25Å; C60-T62 PolarHBondContact O-OG1 3.25Å; C60-T62 WeakPolarHBondContact SG-CB 3.36Å; C60-T62 PolarHBondContact SG-N 3.46Å; C60-T62 PolarHBondContact SG-OG1 3.07Å; C60-T62 VanDerWaalsContact SG-OG1 3.35Å; C60-H79 PolarHBondContact SG-NE2 2.78Å; C60-S86 VanDerWaalsContact CA-OG 3.24Å; C60-S86 WeakPolarHBondContact CA-OG 3.42Å; C60-S86 WeakPolarHBondContact CB-OG 3.34Å; C60-S86 PolarHBondContact N-OG 3.4Å
61	N	85.9	Confident	83	Confident	127 Å²	127	81 Å²	81	68%	0.679	45%	0.452	S	S	*	.			trans	49.4	22.5	-176.1	-62.3	-22.8	0	0	0	114.4	C57	C57-N61 VanDerWaalsContact O-CA 3.29Å; C57-N61 WeakPolarHBondContact O-CA 3.33Å; C57-N61 PolarHBondContact O-N 3Å
62	T	86.4	Confident	83.7	Confident	61 Å²	61	78.9 Å²	78.9	37%	0.374	45%	0.445	S	S	.	.			trans	-90.1	132.3	176.8	-54.8	0	0	0	0	108.6	C57 C60	C57-T62 PolarHBondContact N-O 3.24Å; C60-T62 PolarHBondContact O-N 3.25Å; C60-T62 PolarHBondContact O-OG1 3.25Å; C60-T62 WeakPolarHBondContact SG-CB 3.36Å; C60-T62 PolarHBondContact SG-N 3.46Å; C60-T62 PolarHBondContact SG-OG1 3.07Å; C60-T62 VanDerWaalsContact SG-OG1 3.35Å
63	P	88.7	Confident	84.4	Confident	77 Å²	77	82.1 Å²	82.1	50%	0.5	46%	0.46	S	S	.	.	B	Isolated β-bridge	trans	-67	134.1	173.4	27.4	-33.8	0	0	0	110.4	V54	V54-P63 HydrophobicContact CG1-CB 3.75Å
64	I	88.1	Confident	85	Confident	10 Å²	10	80 Å²	80	5%	0.051	45%	0.452	C	S	.	.			trans	-104.9	112	-175.9	-60.8	173	0	0	0	109.3	V54 P55 C57 I66 K75 V76 H79	V54-I64 WeakPolarHBondContact CG1-O 3.38Å; P55-I64 HydrophobicContact CG-CB 4.49Å; P55-I64 PolarHBondContact O-N 3.11Å; C57-I64 HydrophobicContact CB-CD1 3.84Å; C57-I64 HydrophobicContact CB-CG1 4.35Å; I64-I66 PolarHBondContact O-N 2.93Å; I64-K75 HydrophobicContact CG2-CB 4.22Å; I64-K75 HydrophobicContact CG2-CG 3.74Å; I64-V76 HydrophobicContact CD1-CB 4.24Å; I64-V76 HydrophobicContact CD1-CG1 4.38Å; I64-V76 HydrophobicContact CD1-CG2 3.98Å; I64-H79 HydrophobicContact CD1-CB 3.52Å; I64-H79 HydrophobicContact CG1-CB 4.18Å; I64-H79 HydrophobicContact CG2-CB 4.45Å
65	P	84.6	Confident	85.1	Confident	107 Å²	107	78.1 Å²	78.1	70%	0.695	44%	0.438	S	S	*	.			trans	-65.6	115.7	177.6	-19.9	32.9	0	0	0	111.6
66	I	84.6	Confident	85.2	Confident	33 Å²	33	78 Å²	78	17%	0.169	44%	0.436	C	S	.	.	P	Polyproline II helix	trans	-94.2	145.7	173.4	60.1	169.8	0	0	0	111.2	V52 Q53 P55 I64 P72 K75	V52-I66 HydrophobicContact CG1-CD1 4.42Å; V52-I66 HydrophobicContact CG1-CG1 4.05Å; Q53-I66 WeakPolarHBondContact O-CD1 3.43Å; P55-I66 HydrophobicContact CG-CG2 3.72Å; I64-I66 PolarHBondContact O-N 2.93Å; I66-P72 HydrophobicContact CD1-CG 4.33Å; I66-K75 HydrophobicContact CG2-CB 3.73Å; I66-K75 HydrophobicContact CG2-CG 3.99Å
67	K	80	Confident	85.1	Confident	155 Å²	155	75.4 Å²	75.4	67%	0.674	43%	0.426	S	S	*	.	P	Polyproline II helix	trans	-85	152	170.7	-69.2	179.9	-179.8	175	0	110.2	G69 E70	K67-G69 PolarHBondContact O-N 2.71Å; K67-G69 VanDerWaalsContact O-N 3.16Å; K67-E70 HydrophobicContact CB-CB 4.47Å; K67-E70 PolarHBondContact O-N 2.91Å; K67-E70 VanDerWaalsContact O-N 3.11Å
68	R	78.1	Confident	85.1	Confident	175 Å²	175	79.1 Å²	79.1	66%	0.66	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	117.9	176.2	-68.5	172.5	175.3	-88.6	-5.6	109.7	K49 V52	K49-R68 PolarHBondContact O-NH1 2.86Å; V52-R68 HydrophobicContact CG2-CG 4.28Å
69	G	77.1	Confident	85.3	Confident	91 Å²	91	76 Å²	76	94%	0.938	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	97	-1.8	-179.5	0	0	0	0	0	115.6	K67	K67-G69 PolarHBondContact O-N 2.71Å; K67-G69 VanDerWaalsContact O-N 3.16Å
70	E	79.6	Confident	85.3	Confident	57 Å²	57	74.1 Å²	74.1	27%	0.266	41%	0.411	S	S	.	.	S	Bend	trans	-99.4	131.6	175.6	-163.2	172	-174.1	0	0	109.5	K67 K75	K67-E70 HydrophobicContact CB-CB 4.47Å; K67-E70 PolarHBondContact O-N 2.91Å; K67-E70 VanDerWaalsContact O-N 3.11Å; E70-K75 HydrophobicContact CG-CD 4.21Å; E70-K75 WeakPolarHBondContact OE1-CD 3.39Å; E70-K75 WeakPolarHBondContact OE1-CE 3.5Å; E70-K75 IonicContact OE1-NZ 2.68Å; E70-K75 PolarHBondContact OE1-NZ 3.25Å; E70-K75 WeakPolarHBondContact OE2-CD 3.4Å; E70-K75 IonicContact OE2-NZ 2.72Å; E70-K75 PolarHBondContact OE2-NZ 3.02Å
71	M	79.9	Confident	85.2	Confident	116 Å²	116	78 Å²	78	57%	0.571	43%	0.43	S	S	*	.			trans	-71.6	139.9	-175.2	-63.9	-157.3	-60.8	0	0	111.9	D73 I74 K75	M71-D73 VanDerWaalsContact C-N 3.35Å; M71-D73 PolarHBondContact O-N 3.33Å; M71-I74 HydrophobicContact CB-CD1 4.15Å; M71-I74 HydrophobicContact CB-CG1 4.27Å; M71-I74 HydrophobicContact CE-CD1 3.87Å; M71-I74 HydrophobicContact CE-CG1 4.36Å; M71-I74 PolarHBondContact O-N 3.15Å; M71-K75 PolarHBondContact O-N 3.18Å
72	P	83.9	Confident	85	Confident	57 Å²	57	80.2 Å²	80.2	37%	0.37	43%	0.428	S	S	.	.	H	α-helix	trans	-51	-48.9	179.7	-29.7	36.6	0	0	0	113.6	P55 I66 I74 K75 V76	P55-P72 HydrophobicContact CB-CB 4.23Å; P55-P72 HydrophobicContact CG-CB 4.07Å; I66-P72 HydrophobicContact CD1-CG 4.33Å; P72-I74 VanDerWaalsContact C-N 3.33Å; P72-I74 PolarHBondContact O-N 3.07Å; P72-K75 PolarHBondContact O-N 2.6Å; P72-K75 VanDerWaalsContact O-N 3.11Å; P72-V76 VanDerWaalsContact O-CG2 3.22Å; P72-V76 WeakPolarHBondContact O-CG2 3.29Å; P72-V76 PolarHBondContact O-N 3.08Å
73	D	86.4	Confident	84.7	Confident	128 Å²	128	82.3 Å²	82.3	68%	0.684	44%	0.437	S	S	*	.	H	α-helix	trans	-60.2	-39.1	-175.8	-58.1	-91	0	0	0	113.2	M71 V76 G77	M71-D73 VanDerWaalsContact C-N 3.35Å; M71-D73 PolarHBondContact O-N 3.33Å; D73-V76 PolarHBondContact O-N 3.23Å; D73-G77 PolarHBondContact O-N 3.02Å
74	I	87.4	Confident	84.5	Confident	96 Å²	96	78.7 Å²	78.7	49%	0.492	41%	0.414	S	S	.	.	H	α-helix	trans	-64.8	-43.2	177.7	-59.3	176.5	0	0	0	109.9	M71 P72 G77 E78	M71-I74 HydrophobicContact CB-CD1 4.15Å; M71-I74 HydrophobicContact CB-CG1 4.27Å; M71-I74 HydrophobicContact CE-CD1 3.87Å; M71-I74 HydrophobicContact CE-CG1 4.36Å; M71-I74 PolarHBondContact O-N 3.15Å; P72-I74 VanDerWaalsContact C-N 3.33Å; P72-I74 PolarHBondContact O-N 3.07Å; I74-G77 PolarHBondContact O-N 3.3Å; I74-E78 PolarHBondContact O-N 3.46Å
75	K	88.2	Confident	84.1	Confident	39 Å²	39	87.1 Å²	87.1	17%	0.17	45%	0.45	C	S	.	.	H	α-helix	trans	-70.4	-37.5	178.7	-145.7	78.7	-160.8	153.5	0	112.8	I64 I66 E70 M71 P72 E78 H79	I64-K75 HydrophobicContact CG2-CB 4.22Å; I64-K75 HydrophobicContact CG2-CG 3.74Å; I66-K75 HydrophobicContact CG2-CB 3.73Å; I66-K75 HydrophobicContact CG2-CG 3.99Å; E70-K75 HydrophobicContact CG-CD 4.21Å; E70-K75 WeakPolarHBondContact OE1-CD 3.39Å; E70-K75 WeakPolarHBondContact OE1-CE 3.5Å; E70-K75 IonicContact OE1-NZ 2.68Å; E70-K75 PolarHBondContact OE1-NZ 3.25Å; E70-K75 WeakPolarHBondContact OE2-CD 3.4Å; E70-K75 IonicContact OE2-NZ 2.72Å; E70-K75 PolarHBondContact OE2-NZ 3.02Å; M71-K75 PolarHBondContact O-N 3.18Å; P72-K75 PolarHBondContact O-N 2.6Å; P72-K75 VanDerWaalsContact O-N 3.11Å; K75-E78 WeakPolarHBondContact CE-OE2 3.39Å; K75-E78 IonicContact NZ-OE2 3.16Å; K75-E78 PolarHBondContact NZ-OE2 3.17Å; K75-H79 WeakPolarHBondContact O-CB 3.07Å; K75-H79 PolarHBondContact O-N 2.84Å
76	V	89.6	Confident	83.3	Confident	24 Å²	24	85 Å²	85	15%	0.145	44%	0.437	C	S	.	.	H	α-helix	trans	-64.3	-43.5	175	175.9	0	0	0	0	110	P55 I64 P72 D73 H79 I80	P55-V76 HydrophobicContact CB-CG2 3.72Å; P55-V76 HydrophobicContact CG-CG2 3.89Å; I64-V76 HydrophobicContact CD1-CB 4.24Å; I64-V76 HydrophobicContact CD1-CG1 4.38Å; I64-V76 HydrophobicContact CD1-CG2 3.98Å; P72-V76 VanDerWaalsContact O-CG2 3.22Å; P72-V76 WeakPolarHBondContact O-CG2 3.29Å; P72-V76 PolarHBondContact O-N 3.08Å; D73-V76 PolarHBondContact O-N 3.23Å; V76-H79 PolarHBondContact O-N 3Å; V76-I80 HydrophobicContact CG1-CD1 3.87Å; V76-I80 WeakPolarHBondContact O-CD1 3.03Å; V76-I80 VanDerWaalsContact O-CG1 3.22Å; V76-I80 WeakPolarHBondContact O-CG1 3.2Å; V76-I80 PolarHBondContact O-N 2.89Å
77	G	88.4	Confident	82.5	Confident	27 Å²	27	84.1 Å²	84.1	28%	0.278	43%	0.433	S	S	.	.	H	α-helix	trans	-60	-52.9	172.8	0	0	0	0	0	113	D73 I74 H79 I80 D81	D73-G77 PolarHBondContact O-N 3.02Å; I74-G77 PolarHBondContact O-N 3.3Å; G77-H79 VanDerWaalsContact C-N 3.27Å; G77-H79 PolarHBondContact O-N 2.87Å; G77-I80 WeakPolarHBondContact O-CA 3.45Å; G77-I80 WeakPolarHBondContact O-CB 3.32Å; G77-I80 PolarHBondContact O-N 2.99Å; G77-D81 PolarHBondContact O-N 2.92Å
78	E	89.4	Confident	81.8	Confident	77 Å²	77	80.8 Å²	80.8	36%	0.36	43%	0.427	S	S	.	.	H	α-helix	trans	-56.1	-42.5	178.2	-174.1	-175.7	-166.1	0	0	112	I74 K75 D81 R82	I74-E78 PolarHBondContact O-N 3.46Å; K75-E78 WeakPolarHBondContact CE-OE2 3.39Å; K75-E78 IonicContact NZ-OE2 3.16Å; K75-E78 PolarHBondContact NZ-OE2 3.17Å; E78-D81 PolarHBondContact O-N 3.23Å; E78-R82 HydrophobicContact CG-CG 4.45Å; E78-R82 WeakPolarHBondContact O-CB 3.45Å; E78-R82 WeakPolarHBondContact O-CG 3.39Å; E78-R82 PolarHBondContact O-N 3.32Å
79	H	90.6	Very high	80.9	Confident	27 Å²	27	73.9 Å²	73.9	13%	0.125	41%	0.408	C	S	.	.	I	π-helix	trans	-61.6	-47	174.2	175.4	76.1	0	0	0	111.9	C57 C60 I64 K75 V76 G77 D81 R82 D83 C84	C57-H79 VanDerWaalsContact SG-CD2 3.56Å; C60-H79 PolarHBondContact SG-NE2 2.78Å; I64-H79 HydrophobicContact CD1-CB 3.52Å; I64-H79 HydrophobicContact CG1-CB 4.18Å; I64-H79 HydrophobicContact CG2-CB 4.45Å; K75-H79 WeakPolarHBondContact O-CB 3.07Å; K75-H79 PolarHBondContact O-N 2.84Å; V76-H79 PolarHBondContact O-N 3Å; G77-H79 VanDerWaalsContact C-N 3.27Å; G77-H79 PolarHBondContact O-N 2.87Å; H79-D81 VanDerWaalsContact C-N 3.29Å; H79-D81 PolarHBondContact O-N 3.34Å; H79-R82 PolarHBondContact O-N 2.91Å; H79-D83 CarbonylContact O-C 3.52Å; H79-D83 PolarHBondContact O-N 3.43Å; H79-C84 WeakPolarHBondContact NE2-CA 3.36Å; H79-C84 VanDerWaalsContact O-CB 3.3Å; H79-C84 WeakPolarHBondContact O-CB 3.26Å; H79-C84 PolarHBondContact O-N 2.68Å
80	I	87.8	Confident	80.1	Confident	45 Å²	45	73.5 Å²	73.5	23%	0.231	38%	0.381	C	S	.	.	I	π-helix	trans	-56.5	-44.3	177.6	-72	164.6	0	0	0	110.8	L59 V76 G77	L59-I80 HydrophobicContact CD1-CG1 4.14Å; L59-I80 HydrophobicContact CD1-CG2 3.94Å; V76-I80 HydrophobicContact CG1-CD1 3.87Å; V76-I80 WeakPolarHBondContact O-CD1 3.03Å; V76-I80 VanDerWaalsContact O-CG1 3.22Å; V76-I80 WeakPolarHBondContact O-CG1 3.2Å; V76-I80 PolarHBondContact O-N 2.89Å; G77-I80 WeakPolarHBondContact O-CA 3.45Å; G77-I80 WeakPolarHBondContact O-CB 3.32Å; G77-I80 PolarHBondContact O-N 2.99Å
81	D	84.5	Confident	79.1	Confident	110 Å²	110	81.2 Å²	81.2	59%	0.588	41%	0.408	S	S	*	.	I	π-helix	trans	-75.9	-30.6	-175.6	-75	-36.1	0	0	0	114.7	G77 E78 H79 R93	G77-D81 PolarHBondContact O-N 2.92Å; E78-D81 PolarHBondContact O-N 3.23Å; H79-D81 VanDerWaalsContact C-N 3.29Å; H79-D81 PolarHBondContact O-N 3.34Å; D81-R93 VanDerWaalsContact O-CZ 3.3Å; D81-R93 PolarHBondContact O-NH2 3.42Å
82	R	82.7	Confident	78.1	Confident	172 Å²	172	83.3 Å²	83.3	65%	0.649	41%	0.414	S	S	*	.	I	π-helix	trans	-115.2	-49.4	-170.5	-53.2	-174.3	84.8	110.5	0.2	113.9	E78 H79	E78-R82 HydrophobicContact CG-CG 4.45Å; E78-R82 WeakPolarHBondContact O-CB 3.45Å; E78-R82 WeakPolarHBondContact O-CG 3.39Å; E78-R82 PolarHBondContact O-N 3.32Å; H79-R82 PolarHBondContact O-N 2.91Å
83	D	78.4	Confident	76.9	Confident	105 Å²	105	85.2 Å²	85.2	56%	0.561	41%	0.414	S	S	*	.	I	π-helix	trans	-114	-5	-162.4	-64	-61	0	0	0	114.4	H79 K85	H79-D83 CarbonylContact O-C 3.52Å; H79-D83 PolarHBondContact O-N 3.43Å; D83-K85 PolarHBondContact O-N 3.14Å
84	C	86.1	Confident	75.8	Confident	1 Å²	1	86.1 Å²	86.1	1%	0.007	41%	0.412	C	S	.	.			trans	-70.9	122.9	-178.2	-170.9	0	0	0	0	111.4	H79 D87	H79-C84 WeakPolarHBondContact NE2-CA 3.36Å; H79-C84 VanDerWaalsContact O-CB 3.3Å; H79-C84 WeakPolarHBondContact O-CB 3.26Å; H79-C84 PolarHBondContact O-N 2.68Å; C84-D87 HydrophobicContact CB-CB 3.89Å; C84-D87 WeakPolarHBondContact O-CB 3.35Å
85	K	79.3	Confident	74.7	Confident	188 Å²	188	85.2 Å²	85.2	82%	0.817	41%	0.407	S	S	*	.	S	Bend	trans	-80.7	-30.3	-174	-64.3	173.4	-176.5	169.6	0	113.4	D83	D83-K85 PolarHBondContact O-N 3.14Å
86	S	68.2	Low	73.5	Confident	61 Å²	61	89.2 Å²	89.2	43%	0.427	43%	0.425	S	S	.	.	S	Bend	trans	-93.2	-0.2	178.2	45.5	0	0	0	0	113.2	L59 C60 P88	L59-S86 WeakPolarHBondContact O-CB 3.13Å; L59-S86 PolarHBondContact O-OG 2.89Å; C60-S86 VanDerWaalsContact CA-OG 3.24Å; C60-S86 WeakPolarHBondContact CA-OG 3.42Å; C60-S86 WeakPolarHBondContact CB-OG 3.34Å; C60-S86 PolarHBondContact N-OG 3.4Å; S86-P88 WeakPolarHBondContact O-CD 3.24Å
87	D	67.3	Low	72.9	Confident	16 Å²	16	91.6 Å²	91.6	9%	0.086	44%	0.44	C	S	.	.			trans	-56	117.2	174.8	166.8	31.1	0	0	0	111	C84 A89 Q90 R93	C84-D87 HydrophobicContact CB-CB 3.89Å; C84-D87 WeakPolarHBondContact O-CB 3.35Å; D87-A89 PolarHBondContact O-N 3.02Å; D87-A89 VanDerWaalsContact O-N 3.14Å; D87-A89 WeakPolarHBondContact OD1-CA 3.34Å; D87-A89 WeakPolarHBondContact OD1-CB 3.46Å; D87-A89 PolarHBondContact OD1-N 3.15Å; D87-A89 WeakPolarHBondContact OD2-CB 3.22Å; D87-Q90 HydrophobicContact CB-CG 4.41Å; D87-Q90 WeakPolarHBondContact O-CB 3.44Å; D87-Q90 PolarHBondContact O-N 2.72Å; D87-Q90 PolarHBondContact OD2-N 2.75Å; D87-Q90 VanDerWaalsContact OD2-N 3.17Å; D87-R93 IonicContact OD2-CZ 2.7Å; D87-R93 IonicContact OD2-NH1 2.64Å; D87-R93 PolarHBondContact OD2-NH1 3Å; D87-R93 IonicContact OD2-NH2 3.46Å; D87-R93 PolarHBondContact OD2-NH2 3.5Å
88	P	65.7	Low	72.6	Confident	84 Å²	84	91.8 Å²	91.8	55%	0.545	43%	0.434	S	S	.	.	H	α-helix	trans	-62.4	-19.4	175.6	26.6	-34	0	0	0	112.2	S86 R91 K92	S86-P88 WeakPolarHBondContact O-CD 3.24Å; P88-R91 WeakPolarHBondContact O-CB 3.22Å; P88-R91 PolarHBondContact O-N 3.48Å; P88-R91 VanDerWaalsContact O-N 3.14Å; P88-K92 PolarHBondContact O-N 3.45Å
89	A	57.7	Low	72.6	Confident	30 Å²	30	94.7 Å²	94.7	25%	0.248	45%	0.446	C	S	.	.	H	α-helix	trans	-71.3	-19.9	171.7	0	0	0	0	0	113.6	D87 R91 K92 R93	D87-A89 PolarHBondContact O-N 3.02Å; D87-A89 VanDerWaalsContact O-N 3.14Å; D87-A89 WeakPolarHBondContact OD1-CA 3.34Å; D87-A89 WeakPolarHBondContact OD1-CB 3.46Å; D87-A89 PolarHBondContact OD1-N 3.15Å; D87-A89 WeakPolarHBondContact OD2-CB 3.22Å; A89-R91 PolarHBondContact O-N 3.09Å; A89-K92 CarbonylContact O-C 3.6Å; A89-K92 PolarHBondContact O-N 3.36Å; A89-R93 WeakPolarHBondContact O-CB 3.49Å; A89-R93 VanDerWaalsContact O-CG 3.27Å; A89-R93 WeakPolarHBondContact O-CG 3.47Å; A89-R93 PolarHBondContact O-N 2.96Å
90	Q	60.5	Low	72.6	Confident	83 Å²	83	94 Å²	94	39%	0.388	44%	0.444	S	S	.	.	H	α-helix	trans	-57.1	-35.9	164.1	-76.5	-71.6	-2.6	0	0	111.6	D87 R93	D87-Q90 HydrophobicContact CB-CG 4.41Å; D87-Q90 WeakPolarHBondContact O-CB 3.44Å; D87-Q90 PolarHBondContact O-N 2.72Å; D87-Q90 PolarHBondContact OD2-N 2.75Å; D87-Q90 VanDerWaalsContact OD2-N 3.17Å; Q90-R93 VanDerWaalsContact CD-NH1 3.32Å
91	R	59.8	Low	72.6	Confident	219 Å²	219	94.8 Å²	94.8	83%	0.826	45%	0.453	S	S	*	.	H	α-helix	trans	-74	-33.2	175.5	-146	-178.4	-62.2	-175.8	2.9	111.7	P88 A89	P88-R91 WeakPolarHBondContact O-CB 3.22Å; P88-R91 PolarHBondContact O-N 3.48Å; P88-R91 VanDerWaalsContact O-N 3.14Å; A89-R91 PolarHBondContact O-N 3.09Å
92	K	57.6	Low	72.8	Confident	160 Å²	160	92.4 Å²	92.4	70%	0.696	44%	0.438	S	S	*	.	H	α-helix	trans	-79.8	-30.5	176.5	-60.6	-179.2	175.7	-177.9	0	114.3	P88 A89 K94 I95	P88-K92 PolarHBondContact O-N 3.45Å; A89-K92 CarbonylContact O-C 3.6Å; A89-K92 PolarHBondContact O-N 3.36Å; K92-K94 PolarHBondContact O-N 3.23Å; K92-K94 VanDerWaalsContact O-N 3.11Å; K92-I95 VanDerWaalsContact O-CG1 3.28Å; K92-I95 WeakPolarHBondContact O-CG1 3.45Å; K92-I95 PolarHBondContact O-N 3.49Å
93	R	60.2	Low	73.1	Confident	98 Å²	98	87.5 Å²	87.5	37%	0.37	44%	0.44	S	S	.	.	S	Bend	trans	-61.6	-17.5	178.8	-81	-178.2	-161.3	100.6	19	112.6	D81 D87 A89 Q90 I95	D81-R93 VanDerWaalsContact O-CZ 3.3Å; D81-R93 PolarHBondContact O-NH2 3.42Å; D87-R93 IonicContact OD2-CZ 2.7Å; D87-R93 IonicContact OD2-NH1 2.64Å; D87-R93 PolarHBondContact OD2-NH1 3Å; D87-R93 IonicContact OD2-NH2 3.46Å; D87-R93 PolarHBondContact OD2-NH2 3.5Å; A89-R93 WeakPolarHBondContact O-CB 3.49Å; A89-R93 VanDerWaalsContact O-CG 3.27Å; A89-R93 WeakPolarHBondContact O-CG 3.47Å; A89-R93 PolarHBondContact O-N 2.96Å; Q90-R93 VanDerWaalsContact CD-NH1 3.32Å; R93-I95 PolarHBondContact O-N 2.62Å
94	K	62.1	Low	73.5	Confident	146 Å²	146	86.4 Å²	86.4	64%	0.635	45%	0.454	S	S	*	.			trans	-76.3	54.6	166.7	-52	-170.5	-179.1	179.9	0	111.3	K92 F96 T97	K92-K94 PolarHBondContact O-N 3.23Å; K92-K94 VanDerWaalsContact O-N 3.11Å; K94-F96 PolarHBondContact O-N 3.35Å; K94-F96 VanDerWaalsContact O-N 3.08Å; K94-T97 HydrophobicContact CB-CG2 3.49Å; K94-T97 VanDerWaalsContact CB-CG2 3.49Å; K94-T97 HydrophobicContact CD-CG2 4.27Å; K94-T97 HydrophobicContact CG-CG2 4.49Å; K94-T97 WeakPolarHBondContact O-CG2 3.46Å; K94-T97 PolarHBondContact O-OG1 3.26Å
95	I	64.4	Low	73.6	Confident	78 Å²	78	87.6 Å²	87.6	40%	0.4	46%	0.462	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-20.4	-170.5	-61	155.6	0	0	0	112.4	K92 R93 M110	K92-I95 VanDerWaalsContact O-CG1 3.28Å; K92-I95 WeakPolarHBondContact O-CG1 3.45Å; K92-I95 PolarHBondContact O-N 3.49Å; R93-I95 PolarHBondContact O-N 2.62Å; I95-M110 HydrophobicContact CG2-CE 4.34Å; I95-M110 HydrophobicContact CG2-CG 4.15Å; I95-M110 HydrophobicContact CG2-SD 4.07Å; I95-M110 WeakPolarHBondContact O-CA 3.45Å; I95-M110 WeakPolarHBondContact O-CB 3.43Å; I95-M110 WeakPolarHBondContact O-CG 3.49Å
96	F	63.8	Low	73.9	Confident	123 Å²	123	88.1 Å²	88.1	54%	0.539	46%	0.464	S	S	.	.	T	Hydrogen-bonded Turn	trans	-132.7	68.6	179.5	-70.9	-72.9	0	0	0	111.9	K94 K108	K94-F96 PolarHBondContact O-N 3.35Å; K94-F96 VanDerWaalsContact O-N 3.08Å; F96-K108 HydrophobicContact CB-CB 3.97Å; F96-K108 HydrophobicContact CB-CD 4.22Å; F96-K108 HydrophobicContact CD1-CB 4.25Å; F96-K108 WeakPolarHBondContact CD1-O 3.38Å; F96-K108 WeakPolarHBondContact O-CD 3.43Å
97	T	76.5	Confident	74.7	Confident	74 Å²	74	88.3 Å²	88.3	45%	0.454	46%	0.459	S	S	.	.			trans	-92.1	-37.5	176.9	39.3	0	0	0	0	113.8	K94 K99	K94-T97 HydrophobicContact CB-CG2 3.49Å; K94-T97 VanDerWaalsContact CB-CG2 3.49Å; K94-T97 HydrophobicContact CD-CG2 4.27Å; K94-T97 HydrophobicContact CG-CG2 4.49Å; K94-T97 WeakPolarHBondContact O-CG2 3.46Å; K94-T97 PolarHBondContact O-OG1 3.26Å; T97-K99 PolarHBondContact O-N 3.48Å; T97-K99 VanDerWaalsContact O-N 3.09Å
98	N	83.1	Confident	75.7	Confident	31 Å²	31	92.2 Å²	92.2	17%	0.166	48%	0.475	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	98.1	-169	-57.7	-69.2	0	0	0	110.1	K108 E109 M110 R112 N121	N98-K108 CarbonylContact O-C 3.57Å; N98-K108 WeakPolarHBondContact O-CA 3.37Å; N98-E109 WeakPolarHBondContact CB-O 3.33Å; N98-E109 PolarHBondContact ND2-O 3.05Å; N98-E109 PolarHBondContact O-N 2.94Å; N98-M110 PolarHBondContact ND2-O 2.83Å; N98-R112 WeakPolarHBondContact OD1-CB 3.21Å; N98-N121 WeakPolarHBondContact CA-OD1 3.34Å; N98-N121 VanDerWaalsContact CB-OD1 3.31Å; N98-N121 WeakPolarHBondContact CB-OD1 3.27Å
99	K	87.8	Confident	76.6	Confident	138 Å²	138	89.4 Å²	89.4	60%	0.6	45%	0.454	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.8	132.6	-179	-69	148.5	171.1	-90	0	110.2	T97 S101 K108 N121	T97-K99 PolarHBondContact O-N 3.48Å; T97-K99 VanDerWaalsContact O-N 3.09Å; K99-S101 PolarHBondContact O-N 2.86Å; K99-K108 HydrophobicContact CG-CD 4.32Å; K99-K108 HydrophobicContact CG-CG 4.08Å; K99-N121 PolarHBondContact N-OD1 3.03Å; K99-N121 PolarHBondContact O-OD1 3.35Å
100	C	90.9	Very high	77.7	Confident	12 Å²	12	94.1 Å²	94.1	8%	0.081	47%	0.473	C	S	.	.			trans	-60.1	133.4	171.3	-171	0	0	0	0	111.9	C105 Q107 N121 C123	C100-C105 HydrophobicContact CB-CB 3.88Å; C100-C105 VanDerWaalsContact CB-SG 3.56Å; C100-Q107 WeakPolarHBondContact CB-O 3.18Å; C100-Q107 PolarHBondContact N-O 3.31Å; C100-Q107 VanDerWaalsContact N-O 3.09Å; C100-N121 CarbonylContact C-O 3.49Å; C100-C123 HydrophobicContact CB-CB 4.04Å; C100-C123 PolarHBondContact SG-N 3.18Å
101	S	89.2	Confident	78.7	Confident	62 Å²	62	96 Å²	96	43%	0.434	48%	0.484	S	S	.	.			trans	-88.4	-3.2	-179.4	-51.1	0	0	0	0	113.5	K99 N121	K99-S101 PolarHBondContact O-N 2.86Å; S101-N121 VanDerWaalsContact CB-O 3.27Å; S101-N121 WeakPolarHBondContact CB-O 3.4Å; S101-N121 PolarHBondContact N-O 3.31Å; S101-N121 PolarHBondContact OG-O 3.44Å
102	K	88.4	Confident	80	Confident	60 Å²	60	93.5 Å²	93.5	26%	0.261	48%	0.475	S	S	.	.	S	Bend	trans	-72.7	134.3	176.9	-173.8	-172.3	-177.5	171.8	0	110.6	G104 C105 Y122 H126 D131 H132	K102-G104 PolarHBondContact O-N 3.48Å; K102-C105 HydrophobicContact CB-CB 4.16Å; K102-C105 WeakPolarHBondContact O-CB 3.41Å; K102-C105 PolarHBondContact O-N 2.87Å; K102-Y122 HydrophobicContact CB-CD1 4.19Å; K102-Y122 HydrophobicContact CB-CE1 4.24Å; K102-H126 HydrophobicContact CD-CB 4.39Å; K102-H126 VanDerWaalsContact CD-CD2 3.44Å; K102-H126 WeakPolarHBondContact CD-CD2 3.39Å; K102-H126 WeakPolarHBondContact CD-NE2 3.3Å; K102-H126 PolarHBondContact NZ-CD2 2.98Å; K102-H126 VanDerWaalsContact NZ-CD2 3.26Å; K102-H126 PolarHBondContact NZ-NE2 3.42Å; K102-D131 VanDerWaalsContact CD-O 3.25Å; K102-D131 WeakPolarHBondContact CD-O 3.5Å; K102-D131 WeakPolarHBondContact CE-O 3.5Å; K102-D131 PolarHBondContact NZ-O 2.93Å; K102-H132 HydrophobicContact CB-CB 4.44Å; K102-H132 HydrophobicContact CG-CB 4.47Å
103	G	87.7	Confident	81.5	Confident	68 Å²	68	86.6 Å²	86.6	70%	0.701	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.6	130	173.5	0	0	0	0	0	112.2	C105	G103-C105 VanDerWaalsContact C-N 3.27Å; G103-C105 PolarHBondContact O-N 3.11Å
104	G	87.3	Confident	83	Confident	83 Å²	83	84.4 Å²	84.4	86%	0.856	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.1	-10.5	-178.4	0	0	0	0	0	116.2	K102 K106	K102-G104 PolarHBondContact O-N 3.48Å; G104-K106 PolarHBondContact O-N 3.37Å
105	C	88.2	Confident	84.3	Confident	26 Å²	26	77.6 Å²	77.6	18%	0.176	41%	0.414	C	S	.	.			trans	-86.3	111.2	-179.5	-168	0	0	0	0	112.4	C100 K102 G103 C123 H126	C100-C105 HydrophobicContact CB-CB 3.88Å; C100-C105 VanDerWaalsContact CB-SG 3.56Å; K102-C105 HydrophobicContact CB-CB 4.16Å; K102-C105 WeakPolarHBondContact O-CB 3.41Å; K102-C105 PolarHBondContact O-N 2.87Å; G103-C105 VanDerWaalsContact C-N 3.27Å; G103-C105 PolarHBondContact O-N 3.11Å; C105-C123 VanDerWaalsContact SG-SG 3.65Å; C105-H126 PolarHBondContact SG-CE1 3.01Å; C105-H126 PolarHBondContact SG-ND1 2.79Å
106	K	86.6	Confident	85.4	Confident	199 Å²	199	79.5 Å²	79.5	87%	0.865	43%	0.425	S	S	*	.			trans	-89.1	-0.6	176.4	-61.2	179.9	-176.8	176.1	0	114.1	G104	G104-K106 PolarHBondContact O-N 3.37Å
107	Q	84.8	Confident	86.4	Confident	65 Å²	65	78.9 Å²	78.9	30%	0.304	42%	0.424	S	S	.	.			trans	-69.5	133.7	-174.7	-169.1	162.6	-28.2	0	0	110.7	C100 E109 C123	C100-Q107 WeakPolarHBondContact CB-O 3.18Å; C100-Q107 PolarHBondContact N-O 3.31Å; C100-Q107 VanDerWaalsContact N-O 3.09Å; Q107-E109 PolarHBondContact NE2-OE1 3.33Å; Q107-C123 HydrophobicContact CB-CB 3.94Å; Q107-C123 HydrophobicContact CG-CB 3.81Å
108	K	88.4	Confident	86.9	Confident	97 Å²	97	75.6 Å²	75.6	42%	0.422	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	141.3	172.7	-54	-177.8	-161.3	165	0	108.2	F96 N98 K99	F96-K108 HydrophobicContact CB-CB 3.97Å; F96-K108 HydrophobicContact CB-CD 4.22Å; F96-K108 HydrophobicContact CD1-CB 4.25Å; F96-K108 WeakPolarHBondContact CD1-O 3.38Å; F96-K108 WeakPolarHBondContact O-CD 3.43Å; N98-K108 CarbonylContact O-C 3.57Å; N98-K108 WeakPolarHBondContact O-CA 3.37Å; K99-K108 HydrophobicContact CG-CD 4.32Å; K99-K108 HydrophobicContact CG-CG 4.08Å
109	E	84.8	Confident	87.1	Confident	25 Å²	25	80.4 Å²	80.4	12%	0.117	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	153.9	177.4	-63	-62.1	168.3	0	0	111.5	N98 Q107 I111 C123 L124	N98-E109 WeakPolarHBondContact CB-O 3.33Å; N98-E109 PolarHBondContact ND2-O 3.05Å; N98-E109 PolarHBondContact O-N 2.94Å; Q107-E109 PolarHBondContact NE2-OE1 3.33Å; E109-I111 WeakPolarHBondContact CB-O 3.34Å; E109-C123 HydrophobicContact CG-CB 3.77Å; E109-C123 WeakPolarHBondContact OE1-CB 3.32Å; E109-L124 PolarHBondContact OE1-N 2.72Å
110	M	80	Confident	87.2	Confident	129 Å²	129	77.7 Å²	77.7	64%	0.635	42%	0.417	S	S	*	.	S	Bend	trans	-72.5	-33.7	171.4	-172	178.4	-176.7	0	0	111.9	I95 N98	I95-M110 HydrophobicContact CG2-CE 4.34Å; I95-M110 HydrophobicContact CG2-CG 4.15Å; I95-M110 HydrophobicContact CG2-SD 4.07Å; I95-M110 WeakPolarHBondContact O-CA 3.45Å; I95-M110 WeakPolarHBondContact O-CB 3.43Å; I95-M110 WeakPolarHBondContact O-CG 3.49Å; N98-M110 PolarHBondContact ND2-O 2.83Å
111	I	82.3	Confident	87.3	Confident	123 Å²	123	78.1 Å²	78.1	63%	0.631	42%	0.418	S	S	*	.	S	Bend	trans	-98.6	136.9	178.2	-60.9	172.2	0	0	0	109.5	E109 V113	E109-I111 WeakPolarHBondContact CB-O 3.34Å; I111-V113 HydrophobicContact CG2-CG2 4.45Å; I111-V113 PolarHBondContact O-N 3.27Å; I111-V113 VanDerWaalsContact O-N 3.15Å
112	R	85.8	Confident	87.5	Confident	167 Å²	167	75.5 Å²	75.5	63%	0.63	40%	0.399	S	S	*	.			trans	-75.1	101.7	171.7	-173.4	-176.1	172	-178.8	-2.8	109.6	N98 T114	N98-R112 WeakPolarHBondContact OD1-CB 3.21Å; R112-T114 HydrophobicContact CG-CG2 4.2Å
113	V	89.1	Confident	87.6	Confident	14 Å²	14	72.6 Å²	72.6	9%	0.085	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	105.4	172.3	-179.8	0	0	0	0	109.1	I111 N121 Y122 L124 R127	I111-V113 HydrophobicContact CG2-CG2 4.45Å; I111-V113 PolarHBondContact O-N 3.27Å; I111-V113 VanDerWaalsContact O-N 3.15Å; V113-N121 PolarHBondContact N-ND2 3.11Å; V113-N121 WeakPolarHBondContact O-CA 3.45Å; V113-N121 PolarHBondContact O-ND2 2.94Å; V113-Y122 PolarHBondContact O-N 2.76Å; V113-L124 HydrophobicContact CG2-CD2 3.93Å; V113-R127 HydrophobicContact CG1-CB 3.77Å; V113-R127 HydrophobicContact CG1-CG 3.45Å; V113-R127 VanDerWaalsContact CG1-CG 3.45Å
114	T	91.4	Very high	87.7	Confident	52 Å²	52	74.7 Å²	74.7	32%	0.319	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	145.2	172.9	43.9	0	0	0	0	110.9	R112 L120	R112-T114 HydrophobicContact CG-CG2 4.2Å; T114-L120 WeakPolarHBondContact CA-O 3.42Å
115	C	90	Very high	87.8	Confident	3 Å²	3	77.5 Å²	77.5	2%	0.02	37%	0.369	C	S	.	.			trans	-78.6	139.5	165.6	-178.2	0	0	0	0	110.5	Q117 C118 H119 L120 Y122	C115-Q117 PolarHBondContact O-N 3.16Å; C115-Q117 PolarHBondContact SG-N 3.46Å; C115-Q117 VanDerWaalsContact SG-N 3.45Å; C115-C118 VanDerWaalsContact CB-SG 3.54Å; C115-H119 WeakPolarHBondContact O-CA 3.49Å; C115-H119 PolarHBondContact O-N 3.01Å; C115-H119 PolarHBondContact O-ND1 3.45Å; C115-L120 PolarHBondContact N-O 2.9Å; C115-Y122 HydrophobicContact CB-CD2 4.05Å; C115-Y122 HydrophobicContact CB-CE2 3.87Å
116	D	88.3	Confident	87.9	Confident	119 Å²	119	77.7 Å²	77.7	64%	0.636	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.9	-14.4	179.4	-53.3	-59	0	0	0	113.5	H119	D116-H119 PolarHBondContact O-CE1 3.05Å
117	Q	84	Confident	88.1	Confident	110 Å²	110	75.4 Å²	75.4	51%	0.514	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.7	-28.9	-172.4	-61	-65.7	-23.4	0	0	114.4	C115 T136 D137	C115-Q117 PolarHBondContact O-N 3.16Å; C115-Q117 PolarHBondContact SG-N 3.46Å; C115-Q117 VanDerWaalsContact SG-N 3.45Å; Q117-T136 HydrophobicContact CB-CG2 4.18Å; Q117-D137 PolarHBondContact O-N 2.95Å
118	C	86.9	Confident	88.3	Confident	5 Å²	5	77.2 Å²	77.2	3%	0.034	36%	0.362	C	S	.	.	T	Hydrogen-bonded Turn	trans	-125.1	-4.6	178.7	69.8	0	0	0	0	113.5	C115 L120 Y122 K135	C115-C118 VanDerWaalsContact CB-SG 3.54Å; C118-L120 PolarHBondContact O-N 3.36Å; C118-Y122 PolarHBondContact SG-OH 3.45Å; C118-K135 WeakPolarHBondContact CB-O 3.4Å
119	H	88.4	Confident	88.2	Confident	132 Å²	132	75.1 Å²	75.1	61%	0.611	36%	0.358	S	S	*	.			trans	56.9	1.4	178.5	-54.4	-43.6	0	0	0	117.2	C115 D116	C115-H119 WeakPolarHBondContact O-CA 3.49Å; C115-H119 PolarHBondContact O-N 3.01Å; C115-H119 PolarHBondContact O-ND1 3.45Å; D116-H119 PolarHBondContact O-CE1 3.05Å
120	L	89.9	Confident	88.2	Confident	81 Å²	81	81.1 Å²	81.1	42%	0.424	39%	0.39	S	S	.	.			trans	-68.6	153.1	171.2	-64.4	176.2	0	0	0	111.3	T114 C115 C118 Y122	T114-L120 WeakPolarHBondContact CA-O 3.42Å; C115-L120 PolarHBondContact N-O 2.9Å; C118-L120 PolarHBondContact O-N 3.36Å; L120-Y122 HydrophobicContact CB-CE2 3.69Å; L120-Y122 WeakPolarHBondContact CD1-OH 3.49Å; L120-Y122 WeakPolarHBondContact O-CD2 3.47Å
121	N	92.2	Very high	88.5	Confident	20 Å²	20	78.5 Å²	78.5	11%	0.107	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	131.3	178.2	172	-127.9	0	0	0	110.9	N98 K99 C100 S101 V113	N98-N121 WeakPolarHBondContact CA-OD1 3.34Å; N98-N121 VanDerWaalsContact CB-OD1 3.31Å; N98-N121 WeakPolarHBondContact CB-OD1 3.27Å; K99-N121 PolarHBondContact N-OD1 3.03Å; K99-N121 PolarHBondContact O-OD1 3.35Å; C100-N121 CarbonylContact C-O 3.49Å; S101-N121 VanDerWaalsContact CB-O 3.27Å; S101-N121 WeakPolarHBondContact CB-O 3.4Å; S101-N121 PolarHBondContact N-O 3.31Å; S101-N121 PolarHBondContact OG-O 3.44Å; V113-N121 PolarHBondContact N-ND2 3.11Å; V113-N121 WeakPolarHBondContact O-CA 3.45Å; V113-N121 PolarHBondContact O-ND2 2.94Å
122	Y	92.1	Very high	88.7	Confident	7 Å²	7	73 Å²	73	3%	0.027	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	166.4	176.2	-61	-77.8	0	0	0	110.6	K102 V113 C115 C118 L120 H126 H132	K102-Y122 HydrophobicContact CB-CD1 4.19Å; K102-Y122 HydrophobicContact CB-CE1 4.24Å; V113-Y122 PolarHBondContact O-N 2.76Å; C115-Y122 HydrophobicContact CB-CD2 4.05Å; C115-Y122 HydrophobicContact CB-CE2 3.87Å; C118-Y122 PolarHBondContact SG-OH 3.45Å; L120-Y122 HydrophobicContact CB-CE2 3.69Å; L120-Y122 WeakPolarHBondContact CD1-OH 3.49Å; L120-Y122 WeakPolarHBondContact O-CD2 3.47Å; Y122-H126 VanDerWaalsContact CB-O 3.23Å; Y122-H126 WeakPolarHBondContact CB-O 3.42Å; Y122-H126 HydrophobicContact CD1-CB 4.33Å; Y122-H126 HydrophobicContact CG-CB 4.5Å; Y122-H132 HydrophobicContact CD1-CB 3.74Å; Y122-H132 AromaticContact CD1-CG 3.92Å; Y122-H132 AromaticContact CD2-CE1 3.78Å; Y122-H132 AromaticContact CD2-ND1 3.74Å; Y122-H132 HydrophobicContact CE1-CB 3.41Å; Y122-H132 VanDerWaalsContact CE1-CB 3.41Å; Y122-H132 AromaticContact CE1-CD2 3.87Å; Y122-H132 AromaticContact CE1-CG 3.57Å; Y122-H132 HydrophobicContact CE2-CB 4.46Å; Y122-H132 AromaticContact CE2-CD2 3.5Å; Y122-H132 AromaticContact CE2-CE1 3.62Å; Y122-H132 AromaticContact CE2-CG 3.7Å; Y122-H132 AromaticContact CE2-ND1 3.76Å; Y122-H132 AromaticContact CE2-NE2 3.46Å; Y122-H132 WeakPolarHBondContact CE2-NE2 3.37Å; Y122-H132 HydrophobicContact CG-CB 4.4Å; Y122-H132 AromaticContact CG-ND1 3.93Å; Y122-H132 AromaticContact CZ-CD2 3.26Å; Y122-H132 AromaticContact CZ-CG 3.43Å; Y122-H132 VanDerWaalsContact CZ-CG 3.43Å; Y122-H132 AromaticContact CZ-ND1 3.98Å; Y122-H132 AromaticContact CZ-NE2 3.76Å; Y122-H132 PolarHBondContact OH-CD2 3.14Å; Y122-H132 VanDerWaalsContact OH-CD2 3.24Å
123	C	91.5	Very high	88.7	Confident	0 Å²	0	71.4 Å²	71.4	0%	0	36%	0.355	C	S	.	.			trans	-79.3	170.3	168.3	63.8	0	0	0	0	111.1	C100 C105 Q107 E109 K125 H126 R127	C100-C123 HydrophobicContact CB-CB 4.04Å; C100-C123 PolarHBondContact SG-N 3.18Å; C105-C123 VanDerWaalsContact SG-SG 3.65Å; Q107-C123 HydrophobicContact CB-CB 3.94Å; Q107-C123 HydrophobicContact CG-CB 3.81Å; E109-C123 HydrophobicContact CG-CB 3.77Å; E109-C123 WeakPolarHBondContact OE1-CB 3.32Å; C123-K125 PolarHBondContact O-N 3.24Å; C123-K125 VanDerWaalsContact O-N 3.17Å; C123-H126 CarbonylContact O-C 3.43Å; C123-H126 PolarHBondContact O-N 3.17Å; C123-H126 PolarHBondContact SG-ND1 3.14Å; C123-R127 PolarHBondContact O-N 2.98Å; C123-R127 VanDerWaalsContact O-N 3.09Å
124	L	89.9	Confident	88.5	Confident	112 Å²	112	72.2 Å²	72.2	59%	0.586	36%	0.361	S	S	*	.	G	3₁₀ helix	trans	-57.5	-34.3	-179.6	-73.3	167.3	0	0	0	112.4	E109 V113 H126	E109-L124 PolarHBondContact OE1-N 2.72Å; V113-L124 HydrophobicContact CG2-CD2 3.93Å; L124-H126 VanDerWaalsContact C-N 3.28Å; L124-H126 PolarHBondContact O-N 2.8Å
125	K	90.1	Very high	87.8	Confident	141 Å²	141	77.2 Å²	77.2	61%	0.613	38%	0.378	S	S	*	.	G	3₁₀ helix	trans	-69.4	-19	175.4	-58	-175.2	-179.4	178.4	0	114.6	C123	C123-K125 PolarHBondContact O-N 3.24Å; C123-K125 VanDerWaalsContact O-N 3.17Å
126	H	89.9	Confident	87.2	Confident	31 Å²	31	80.9 Å²	80.9	14%	0.144	40%	0.4	C	S	.	.	G	3₁₀ helix	trans	-121	18.3	-176.9	-61	131.8	0	0	0	112.3	K102 C105 Y122 C123 L124 H128 D131 H132	K102-H126 HydrophobicContact CD-CB 4.39Å; K102-H126 VanDerWaalsContact CD-CD2 3.44Å; K102-H126 WeakPolarHBondContact CD-CD2 3.39Å; K102-H126 WeakPolarHBondContact CD-NE2 3.3Å; K102-H126 PolarHBondContact NZ-CD2 2.98Å; K102-H126 VanDerWaalsContact NZ-CD2 3.26Å; K102-H126 PolarHBondContact NZ-NE2 3.42Å; C105-H126 PolarHBondContact SG-CE1 3.01Å; C105-H126 PolarHBondContact SG-ND1 2.79Å; Y122-H126 VanDerWaalsContact CB-O 3.23Å; Y122-H126 WeakPolarHBondContact CB-O 3.42Å; Y122-H126 HydrophobicContact CD1-CB 4.33Å; Y122-H126 HydrophobicContact CG-CB 4.5Å; C123-H126 CarbonylContact O-C 3.43Å; C123-H126 PolarHBondContact O-N 3.17Å; C123-H126 PolarHBondContact SG-ND1 3.14Å; L124-H126 VanDerWaalsContact C-N 3.28Å; L124-H126 PolarHBondContact O-N 2.8Å; H126-H128 VanDerWaalsContact C-N 3.33Å; H126-H128 PolarHBondContact O-N 2.94Å; H126-D131 PolarHBondContact CD2-O 3.39Å; H126-H132 PolarHBondContact O-ND1 3.27Å
127	R	91.3	Very high	86.2	Confident	150 Å²	150	81 Å²	81	57%	0.566	40%	0.401	S	S	*	.			trans	-62.1	-38.7	-180	178.3	171.7	-178.4	-112.3	-7.6	112.7	V113 C123	V113-R127 HydrophobicContact CG1-CB 3.77Å; V113-R127 HydrophobicContact CG1-CG 3.45Å; V113-R127 VanDerWaalsContact CG1-CG 3.45Å; C123-R127 PolarHBondContact O-N 2.98Å; C123-R127 VanDerWaalsContact O-N 3.09Å
128	H	88.9	Confident	85.3	Confident	103 Å²	103	78 Å²	78	48%	0.477	40%	0.399	S	S	.	.	S	Bend	trans	-79	144.1	-172.1	-163.9	-106.1	0	0	0	111.5	H126 L130 D131 H132	H126-H128 VanDerWaalsContact C-N 3.33Å; H126-H128 PolarHBondContact O-N 2.94Å; H128-L130 PolarHBondContact O-N 3.39Å; H128-D131 WeakPolarHBondContact CB-OD2 3.49Å; H128-D131 PolarHBondContact O-N 3.46Å; H128-H132 PolarHBondContact O-CE1 3Å; H128-H132 PolarHBondContact O-ND1 3Å
129	P	85	Confident	83.9	Confident	54 Å²	54	87 Å²	87	35%	0.351	44%	0.438	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60	-11.5	179.6	-27.3	36.5	0	0	0	116.6	H132 C134	P129-H132 VanDerWaalsContact O-O 3.06Å; P129-C134 HydrophobicContact CB-CB 4.01Å
130	L	84.6	Confident	82.3	Confident	150 Å²	150	85.7 Å²	85.7	79%	0.785	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.4	-24.5	173.3	-60	176.4	0	0	0	112.5	H128	H128-L130 PolarHBondContact O-N 3.39Å
131	D	86.3	Confident	81	Confident	74 Å²	74	86.9 Å²	86.9	40%	0.396	45%	0.45	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.4	-4.4	-176.5	-72.4	-67.7	0	0	0	112.7	K102 H126 H128	K102-D131 VanDerWaalsContact CD-O 3.25Å; K102-D131 WeakPolarHBondContact CD-O 3.5Å; K102-D131 WeakPolarHBondContact CE-O 3.5Å; K102-D131 PolarHBondContact NZ-O 2.93Å; H126-D131 PolarHBondContact CD2-O 3.39Å; H128-D131 WeakPolarHBondContact CB-OD2 3.49Å; H128-D131 PolarHBondContact O-N 3.46Å
132	H	87.8	Confident	79.8	Confident	7 Å²	7	90 Å²	90	3%	0.032	47%	0.473	C	S	.	.	T	Hydrogen-bonded Turn	trans	-137.8	156.4	169.5	62.2	-96.5	0	0	0	109.9	K102 Y122 H126 H128 P129 C134	K102-H132 HydrophobicContact CB-CB 4.44Å; K102-H132 HydrophobicContact CG-CB 4.47Å; Y122-H132 HydrophobicContact CD1-CB 3.74Å; Y122-H132 AromaticContact CD1-CG 3.92Å; Y122-H132 AromaticContact CD2-CE1 3.78Å; Y122-H132 AromaticContact CD2-ND1 3.74Å; Y122-H132 HydrophobicContact CE1-CB 3.41Å; Y122-H132 VanDerWaalsContact CE1-CB 3.41Å; Y122-H132 AromaticContact CE1-CD2 3.87Å; Y122-H132 AromaticContact CE1-CG 3.57Å; Y122-H132 HydrophobicContact CE2-CB 4.46Å; Y122-H132 AromaticContact CE2-CD2 3.5Å; Y122-H132 AromaticContact CE2-CE1 3.62Å; Y122-H132 AromaticContact CE2-CG 3.7Å; Y122-H132 AromaticContact CE2-ND1 3.76Å; Y122-H132 AromaticContact CE2-NE2 3.46Å; Y122-H132 WeakPolarHBondContact CE2-NE2 3.37Å; Y122-H132 HydrophobicContact CG-CB 4.4Å; Y122-H132 AromaticContact CG-ND1 3.93Å; Y122-H132 AromaticContact CZ-CD2 3.26Å; Y122-H132 AromaticContact CZ-CG 3.43Å; Y122-H132 VanDerWaalsContact CZ-CG 3.43Å; Y122-H132 AromaticContact CZ-ND1 3.98Å; Y122-H132 AromaticContact CZ-NE2 3.76Å; Y122-H132 PolarHBondContact OH-CD2 3.14Å; Y122-H132 VanDerWaalsContact OH-CD2 3.24Å; H126-H132 PolarHBondContact O-ND1 3.27Å; H128-H132 PolarHBondContact O-CE1 3Å; H128-H132 PolarHBondContact O-ND1 3Å; P129-H132 VanDerWaalsContact O-O 3.06Å; H132-C134 WeakPolarHBondContact NE2-CB 3.38Å; H132-C134 PolarHBondContact NE2-SG 2.7Å; H132-C134 PolarHBondContact O-N 2.92Å
133	D	84.1	Confident	78.7	Confident	135 Å²	135	98.9 Å²	98.9	72%	0.722	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.7	77.5	175.1	-53.8	-92.9	0	0	0	110.6	K135	D133-K135 PolarHBondContact O-N 2.64Å
134	C	85.3	Confident	77.4	Confident	31 Å²	31	103.5 Å²	103.5	21%	0.209	54%	0.542	C	S	.	.			trans	-69.2	93.6	-171.5	-161.7	0	0	0	0	111.2	P129 H132 T136	P129-C134 HydrophobicContact CB-CB 4.01Å; H132-C134 WeakPolarHBondContact NE2-CB 3.38Å; H132-C134 PolarHBondContact NE2-SG 2.7Å; H132-C134 PolarHBondContact O-N 2.92Å; C134-T136 PolarHBondContact O-N 3.46Å; C134-T136 VanDerWaalsContact O-N 3.13Å
135	K	78.3	Confident	76.7	Confident	157 Å²	157	99.5 Å²	99.5	68%	0.683	53%	0.527	S	S	*	.			trans	-72.3	99.2	168.2	-133.1	74.5	169	-171.1	0	107.8	C118 D133 D137	C118-K135 WeakPolarHBondContact CB-O 3.4Å; D133-K135 PolarHBondContact O-N 2.64Å; K135-D137 PolarHBondContact O-N 3.27Å
136	T	75.6	Confident	76.1	Confident	79 Å²	79	98.3 Å²	98.3	49%	0.485	52%	0.524	S	S	.	.			trans	-68.3	96.4	175.9	54.4	0	0	0	0	109.3	Q117 C134 G138	Q117-T136 HydrophobicContact CB-CG2 4.18Å; C134-T136 PolarHBondContact O-N 3.46Å; C134-T136 VanDerWaalsContact O-N 3.13Å; T136-G138 PolarHBondContact O-N 3.48Å
137	D	67.3	Low	75.3	Confident	121 Å²	121	98.3 Å²	98.3	65%	0.647	53%	0.529	S	S	*	.			trans	-77.5	54.2	-178.4	-69.8	-52.2	0	0	0	111.1	Q117 K135	Q117-D137 PolarHBondContact O-N 2.95Å; K135-D137 PolarHBondContact O-N 3.27Å
138	G	65.2	Low	74.6	Confident	47 Å²	47	93.9 Å²	93.9	49%	0.485	53%	0.525	S	S	.	.	S	Bend	trans	175.9	87.4	-173.6	0	0	0	0	0	114	T136	T136-G138 PolarHBondContact O-N 3.48Å
139	K	58.7	Low	74	Confident	196 Å²	196	92 Å²	92	85%	0.852	52%	0.52	S	S	*	.			trans	54.8	96.1	162.6	-53.6	124.4	-177.3	178.3	0	114.5	L141	K139-L141 PolarHBondContact O-N 2.99Å
140	S	55.2	Low	73.6	Confident	104 Å²	104	95.3 Å²	95.3	73%	0.727	53%	0.532	S	S	*	.			trans	-43.3	126.8	150.6	176	0	0	0	0	108.8	S142	S140-S142 PolarHBondContact O-N 3.24Å
141	L	61.4	Low	73.1	Confident	105 Å²	105	96.9 Å²	96.9	55%	0.55	53%	0.528	S	S	.	.			trans	-51.1	112.2	176	-71.4	173.5	0	0	0	107.6	K139	K139-L141 PolarHBondContact O-N 2.99Å
142	S	68.1	Low	72.4	Confident	85 Å²	85	97.3 Å²	97.3	59%	0.594	54%	0.537	S	S	*	.			trans	-48.4	146.4	-178.2	-55	0	0	0	0	109.8	S140 P144 G145 H146	S140-S142 PolarHBondContact O-N 3.24Å; S142-P144 CarbonylContact O-C 3.5Å; S142-P144 WeakPolarHBondContact O-CD 3.49Å; S142-G145 WeakPolarHBondContact O-CA 3.17Å; S142-G145 PolarHBondContact O-N 3.01Å; S142-H146 PolarHBondContact O-N 3.36Å
143	K	68.5	Low	71.3	Confident	195 Å²	195	102.9 Å²	102.9	85%	0.848	56%	0.563	S	S	*	*	H	α-helix	trans	-34.8	-43.7	178.5	-86.5	162.2	172.4	169.4	0	115.7	A147	K143-A147 WeakPolarHBondContact O-CB 3.38Å; K143-A147 PolarHBondContact O-N 3.04Å; K143-A147 VanDerWaalsContact O-N 3.13Å
144	P	65	Low	70.1	Confident	97 Å²	97	98.9 Å²	98.9	63%	0.63	55%	0.553	S	S	*	*	H	α-helix	trans	-61.4	-38	171.7	22.3	-35.2	0	0	0	116	S142 A147 A148	S142-P144 CarbonylContact O-C 3.5Å; S142-P144 WeakPolarHBondContact O-CD 3.49Å; P144-A147 CarbonylContact O-C 3.4Å; P144-A147 PolarHBondContact O-N 3.49Å; P144-A148 PolarHBondContact O-N 3.02Å
145	G	74.4	Confident	68.5	Low	27 Å²	27	101.6 Å²	101.6	28%	0.278	58%	0.578	S	S	.	*	H	α-helix	trans	-67.5	-41.8	178.3	0	0	0	0	0	113.3	S142 A147 A148 V149	S142-G145 WeakPolarHBondContact O-CA 3.17Å; S142-G145 PolarHBondContact O-N 3.01Å; G145-A147 VanDerWaalsContact C-N 3.32Å; G145-A147 PolarHBondContact O-N 3.42Å; G145-A148 PolarHBondContact O-N 3.08Å; G145-V149 PolarHBondContact O-N 2.69Å
146	H	76.6	Confident	67.4	Low	116 Å²	116	99.4 Å²	99.4	54%	0.537	58%	0.583	S	S	.	*	H	α-helix	trans	-61	-41.9	169.4	-108.8	48.3	0	0	0	111.5	S142 A148 V149 M150	S142-H146 PolarHBondContact O-N 3.36Å; H146-A148 VanDerWaalsContact C-N 3.26Å; H146-A148 PolarHBondContact O-N 3.25Å; H146-V149 PolarHBondContact O-N 3.46Å; H146-M150 WeakPolarHBondContact O-CG 3.4Å; H146-M150 PolarHBondContact O-N 2.89Å
147	A	73.9	Confident	66.4	Low	31 Å²	31	99.9 Å²	99.9	26%	0.256	59%	0.589	S	S	.	*	H	α-helix	trans	-69.8	-17.7	177.1	0	0	0	0	0	114.1	K143 P144 G145 R151	K143-A147 WeakPolarHBondContact O-CB 3.38Å; K143-A147 PolarHBondContact O-N 3.04Å; K143-A147 VanDerWaalsContact O-N 3.13Å; P144-A147 CarbonylContact O-C 3.4Å; P144-A147 PolarHBondContact O-N 3.49Å; G145-A147 VanDerWaalsContact C-N 3.32Å; G145-A147 PolarHBondContact O-N 3.42Å; A147-R151 WeakPolarHBondContact O-CB 3.48Å; A147-R151 WeakPolarHBondContact O-CG 3.38Å; A147-R151 PolarHBondContact O-N 3.42Å; A147-R151 PolarHBondContact O-NE 3.34Å
148	A	75.8	Confident	65.4	Low	57 Å²	57	100 Å²	100	47%	0.471	60%	0.599	S	S	.	*	H	α-helix	trans	-78.2	-45	172	0	0	0	0	0	111.1	P144 G145 H146 R151 S152	P144-A148 PolarHBondContact O-N 3.02Å; G145-A148 PolarHBondContact O-N 3.08Å; H146-A148 VanDerWaalsContact C-N 3.26Å; H146-A148 PolarHBondContact O-N 3.25Å; A148-R151 PolarHBondContact O-N 2.77Å; A148-R151 VanDerWaalsContact O-N 3.15Å; A148-S152 PolarHBondContact O-N 3.43Å; A148-S152 PolarHBondContact O-OG 2.93Å
149	V	77.8	Confident	64.4	Low	64 Å²	64	103.3 Å²	103.3	39%	0.388	62%	0.615	S	S	.	*	H	α-helix	trans	-64.7	-40.4	177.3	177.7	0	0	0	0	111.8	G145 H146 R151 S152 Q153	G145-V149 PolarHBondContact O-N 2.69Å; H146-V149 PolarHBondContact O-N 3.46Å; V149-R151 VanDerWaalsContact C-N 3.28Å; V149-R151 PolarHBondContact O-N 2.95Å; V149-S152 WeakPolarHBondContact CA-OG 3.28Å; V149-S152 PolarHBondContact O-N 3.23Å; V149-S152 PolarHBondContact O-OG 3.15Å; V149-Q153 WeakPolarHBondContact O-CG 3.47Å; V149-Q153 PolarHBondContact O-N 3.37Å
150	M	76.3	Confident	63.5	Low	123 Å²	123	98.3 Å²	98.3	61%	0.606	61%	0.61	S	S	*	*	H	α-helix	trans	-63.1	-34.6	173.5	-69.4	-79.3	98.7	0	0	112.4	H146 G154	H146-M150 WeakPolarHBondContact O-CG 3.4Å; H146-M150 PolarHBondContact O-N 2.89Å; M150-G154 PolarHBondContact O-N 3.38Å
151	R	74.8	Confident	62.9	Low	183 Å²	183	99.1 Å²	99.1	69%	0.691	62%	0.616	S	S	*	*	H	α-helix	trans	-73.5	-35.1	176.7	-83.2	-178.9	-100.9	-141.3	-0.2	113.2	A147 A148 V149 Q153 G154	A147-R151 WeakPolarHBondContact O-CB 3.48Å; A147-R151 WeakPolarHBondContact O-CG 3.38Å; A147-R151 PolarHBondContact O-N 3.42Å; A147-R151 PolarHBondContact O-NE 3.34Å; A148-R151 PolarHBondContact O-N 2.77Å; A148-R151 VanDerWaalsContact O-N 3.15Å; V149-R151 VanDerWaalsContact C-N 3.28Å; V149-R151 PolarHBondContact O-N 2.95Å; R151-Q153 VanDerWaalsContact C-N 3.3Å; R151-Q153 PolarHBondContact O-N 2.9Å; R151-G154 PolarHBondContact O-N 3.18Å
152	S	69.9	Low	61.8	Low	83 Å²	83	97.7 Å²	97.7	58%	0.58	63%	0.627	S	S	*	*	H	α-helix	trans	-71.8	-22.5	175.5	56.2	0	0	0	0	113.4	A148 V149	A148-S152 PolarHBondContact O-N 3.43Å; A148-S152 PolarHBondContact O-OG 2.93Å; V149-S152 WeakPolarHBondContact CA-OG 3.28Å; V149-S152 PolarHBondContact O-N 3.23Å; V149-S152 PolarHBondContact O-OG 3.15Å
153	Q	65.9	Low	60.5	Low	125 Å²	125	98.4 Å²	98.4	58%	0.584	63%	0.631	S	S	*	*	H	α-helix	trans	-85.7	-27.6	174.5	-67	179.4	10.1	0	0	113.3	V149 R151 A155	V149-Q153 WeakPolarHBondContact O-CG 3.47Å; V149-Q153 PolarHBondContact O-N 3.37Å; R151-Q153 VanDerWaalsContact C-N 3.3Å; R151-Q153 PolarHBondContact O-N 2.9Å; Q153-A155 VanDerWaalsContact C-N 3.31Å; Q153-A155 PolarHBondContact O-N 3.08Å
154	G	57.6	Low	59.4	Low	50 Å²	50	100 Å²	100	52%	0.515	63%	0.632	S	S	.	*	G	3₁₀ helix	trans	-75.7	-9.5	177.7	0	0	0	0	0	115.8	M150 R151 S156	M150-G154 PolarHBondContact O-N 3.38Å; R151-G154 PolarHBondContact O-N 3.18Å; G154-S156 VanDerWaalsContact C-N 3.3Å; G154-S156 PolarHBondContact O-N 3.48Å
155	A	53.1	Low	58.4	Low	88 Å²	88	101.3 Å²	101.3	73%	0.727	64%	0.644	S	S	*	*	G	3₁₀ helix	trans	-78.9	-8.3	-176.9	0	0	0	0	0	114.5	Q153	Q153-A155 VanDerWaalsContact C-N 3.31Å; Q153-A155 PolarHBondContact O-N 3.08Å
156	S	55.3	Low	56.9	Low	112 Å²	112	105.9 Å²	105.9	78%	0.783	67%	0.671	S	S	*	*	G	3₁₀ helix	trans	-98.6	0.3	-172.3	-54.8	0	0	0	0	114.6	G154	G154-S156 VanDerWaalsContact C-N 3.3Å; G154-S156 PolarHBondContact O-N 3.48Å
157	S	53.8	Low	55.2	Low	89 Å²	89	104.3 Å²	104.3	62%	0.622	68%	0.679	S	S	*	*			trans	-151.6	84.8	-172.8	59	0	0	0	0	114.3
158	S	46.5	Very low	53.6	Low	122 Å²	122	109 Å²	109	85%	0.853	71%	0.709	S	S	*	*			trans	-178.1	111.6	135.6	31.7	0	0	0	0	111.9
159	S	44.9	Very low	51.6	Low	118 Å²	118	110.3 Å²	110.3	83%	0.825	73%	0.728	S	S	*	*			trans	-81	147.4	154.5	44.1	0	0	0	0	110.2
160	A	39.8	Very low	49.8	Very low	90 Å²	90	114.5 Å²	114.5	74%	0.744	75%	0.748	S	S	*	*			trans	86.7	137	158.9	0	0	0	0	0	121.2
161	S	42.6	Very low	48.8	Very low	122 Å²	122	114 Å²	114	85%	0.853	76%	0.755	S	S	*	*			trans	81.2	95.4	147.4	-57.2	0	0	0	0	119.3
162	G	37.9	Very low	47.3	Very low	75 Å²	75	114.6 Å²	114.6	77%	0.773	76%	0.757	S	S	*	*			trans	-91.5	-170.8	-178.8	0	0	0	0	0	117.7
163	S	39.2	Very low	46.2	Very low	99 Å²	99	116.8 Å²	116.8	69%	0.692	77%	0.769	S	S	*	*			trans	-169.9	109.6	147.2	-88.9	0	0	0	0	113.2
164	R	46.1	Very low	45	Very low	229 Å²	229	115.8 Å²	115.8	86%	0.864	77%	0.771	S	S	*	*			trans	18.8	118.4	137.8	46	166.7	171.3	-179.9	-3.1	120.2
165	S	43.7	Very low	44.2	Very low	125 Å²	125	118.2 Å²	118.2	87%	0.874	78%	0.781	S	S	*	*				-164.1	151.7	120.9	35.5	0	0	0	0	113.2
166	S	43.8	Very low	43.6	Very low	122 Å²	122	121.9 Å²	121.9	85%	0.853	79%	0.788	S	S	*	*			trans	-79.2	173.2	-177.7	-39.2	0	0	0	0	111.8
167	A	41.1	Very low	42.6	Very low	84 Å²	84	120 Å²	120	69%	0.694	79%	0.787	S	S	*	*			cis	-161.8	162.4	18.5	0	0	0	0	0	114.2
168	S	39.5	Very low	42	Very low	129 Å²	129	122 Å²	122	90%	0.902	80%	0.795	S	S	*	*			trans	76.1	125.9	137.8	-63.5	0	0	0	0	122.5
169	G	33.2	Very low	41.5	Very low	84 Å²	84	122.7 Å²	122.7	87%	0.866	79%	0.794	S	S	*	*			trans	140.5	86.3	162.3	0	0	0	0	0	115.2
170	N	41.5	Very low	41.1	Very low	152 Å²	152	123 Å²	123	81%	0.813	79%	0.79	S	S	*	*			trans	-94.4	173.7	171.4	-135.8	22.7	0	0	0	109.3
171	P	53.7	Low	41.1	Very low	113 Å²	113	126.1 Å²	126.1	73%	0.734	80%	0.795	S	S	*	*			cis	-136.9	-169	9.1	40.9	-19.8	0	0	0	116.5
172	R	43.7	Very low	40.8	Very low	195 Å²	195	126.7 Å²	126.7	74%	0.736	79%	0.788	S	S	*	*			trans	-69.7	-179.3	-179.5	-54	174.2	171	-154.2	-3.5	113.7
173	P	47.1	Very low	40.9	Very low	129 Å²	129	134.3 Å²	134.3	84%	0.838	79%	0.793	S	S	*	*				-132.7	156.7	94.1	38.4	-30.5	0	0	0	116
174	V	40.2	Very low	40.8	Very low	104 Å²	104	133.7 Å²	133.7	63%	0.63	79%	0.794	S	S	*	*			trans	-87.3	154.4	156	-70.8	0	0	0	0	107.5
175	S	40.5	Very low	40.3	Very low	102 Å²	102	133.4 Å²	133.4	71%	0.713	80%	0.795	S	S	*	*				-176.3	141.9	68.2	-77.1	0	0	0	0	108.2
176	N	41.1	Very low	39.8	Very low	164 Å²	164	130.8 Å²	130.8	88%	0.877	79%	0.788	S	S	*	*				54.2	118.4	94.7	-146.7	35.8	0	0	0	115.3
177	G	33.9	Very low	39.6	Very low	74 Å²	74	131 Å²	131	76%	0.763	79%	0.789	S	S	*	*			trans	-172.9	80.6	-178.7	0	0	0	0	0	113.7
178	V	41.4	Very low	39.2	Very low	130 Å²	130	130.2 Å²	130.2	79%	0.788	79%	0.79	S	S	*	*			trans	-80.1	127.2	162.9	163.2	0	0	0	0	108.6
179	T	35.6	Very low	39	Very low	136 Å²	136	130.1 Å²	130.1	83%	0.834	79%	0.789	S	S	*	*			trans	-144.6	118.4	154.4	-63.4	0	0	0	0	110.4
180	V	37.7	Very low	39.2	Very low	124 Å²	124	130.4 Å²	130.4	75%	0.752	78%	0.783	S	S	*	*			trans	-90.8	129.9	159.6	165.1	0	0	0	0	107.5
181	N	39.5	Very low	39.4	Very low	157 Å²	157	129.5 Å²	129.5	84%	0.84	79%	0.785	S	S	*	*			trans	-162.6	176	130.3	-127.7	-14.7	0	0	0	114.9
182	N	37.1	Very low	38.6	Very low	134 Å²	134	134.5 Å²	134.5	72%	0.717	79%	0.789	S	S	*	*			trans	-127.5	171.4	-144.4	-144.6	-9.9	0	0	0	113.2
183	R	40.3	Very low	38.2	Very low	234 Å²	234	131 Å²	131	88%	0.883	78%	0.784	S	S	*	*			trans	72.5	152.4	161.7	-77.3	175.9	163.3	148.5	-3.7	119
184	A	35.4	Very low	38	Very low	86 Å²	86	131.1 Å²	131.1	71%	0.711	79%	0.785	S	S	*	*			cis	-133.7	-166.6	0.2	0	0	0	0	0	110
185	Y	36.6	Very low	37.8	Very low	223 Å²	223	132 Å²	132	88%	0.875	79%	0.791	S	S	*	*			cis	-147.7	168.4	4	38.1	-107.5	0	0	0	108.4
186	G	33.7	Very low	37.8	Very low	71 Å²	71	132.6 Å²	132.6	73%	0.732	80%	0.795	S	S	*	*				90.9	129.5	66.5	0	0	0	0	0	111
187	S	37.9	Very low	37.4	Very low	126 Å²	126	131.5 Å²	131.5	88%	0.881	79%	0.794	S	S	*	*			cis	-164	151.5	8.4	-176.1	0	0	0	0	112.8
188	G	33.1	Very low	37.8	Very low	68 Å²	68	132.9 Å²	132.9	70%	0.701	79%	0.792	S	S	*	*			trans	71.2	151.5	140.2	0	0	0	0	0	121
189	S	35.5	Very low	37.4	Very low	127 Å²	127	131.6 Å²	131.6	89%	0.888	80%	0.795	S	S	*	*			cis	-160.6	162.7	-3.9	-76.8	0	0	0	0	110.9
190	A	37.1	Very low	37.5	Very low	89 Å²	89	132.6 Å²	132.6	74%	0.736	79%	0.79	S	S	*	*			trans	-85.4	176.2	174.2	0	0	0	0	0	113.1
191	P	46.5	Very low	37.5	Very low	133 Å²	133	133.9 Å²	133.9	86%	0.864	79%	0.793	S	S	*	*				-146	-166.5	98.3	39	-21.9	0	0	0	115.4
192	R	35.9	Very low	37.4	Very low	218 Å²	218	131.7 Å²	131.7	82%	0.823	79%	0.785	S	S	*	*			trans	-133.5	143.1	-168.4	-91.7	-164.1	177.6	-112.7	2.9	114.2
193	I	36.5	Very low	37.5	Very low	123 Å²	123	132.9 Å²	132.9	63%	0.631	79%	0.789	S	S	*	*			trans	57.3	134.2	146.6	-44.2	158.2	0	0	0	118.4	T195	I193-T195 HydrophobicContact CG2-CG2 4.18Å
194	P	42.1	Very low	37.5	Very low	131 Å²	131	126.6 Å²	126.6	85%	0.851	78%	0.779	S	S	*	*				-132	177.6	102.2	34.3	-21.4	0	0	0	114.7
195	T	35.8	Very low	38	Very low	122 Å²	122	128.6 Å²	128.6	75%	0.748	79%	0.785	S	S	*	*			trans	-104.5	176.2	-163	45.8	0	0	0	0	115.8	I193	I193-T195 HydrophobicContact CG2-CG2 4.18Å
196	S	40.7	Very low	38.2	Very low	114 Å²	114	123.9 Å²	123.9	80%	0.797	78%	0.784	S	S	*	*			trans	81.3	144	177.3	76.8	0	0	0	0	115.3
197	V	34	Very low	38.9	Very low	142 Å²	142	124.8 Å²	124.8	86%	0.861	79%	0.785	S	S	*	*			cis	-139.8	171.7	23.2	-148.8	0	0	0	0	112.2
198	S	40.5	Very low	39.8	Very low	103 Å²	103	123.9 Å²	123.9	72%	0.72	78%	0.779	S	S	*	*			trans	-68.7	154.1	-168.2	-47.4	0	0	0	0	119
199	A	33.7	Very low	40.3	Very low	103 Å²	103	129.9 Å²	129.9	85%	0.851	79%	0.786	S	S	*	*			trans	-150.6	143.3	142.6	0	0	0	0	0	110.5
200	Q	38.1	Very low	40.9	Very low	156 Å²	156	132.5 Å²	132.5	73%	0.729	78%	0.784	S	S	*	*			trans	-96.8	163.4	-169.7	-99.5	79.3	-12.3	0	0	114.7
201	N	38.5	Very low	41.8	Very low	151 Å²	151	133.4 Å²	133.4	81%	0.807	79%	0.792	S	S	*	*			trans	72.1	142.7	150.5	-89.7	14.6	0	0	0	119.4
202	V	37.4	Very low	42.3	Very low	111 Å²	111	130.9 Å²	130.9	67%	0.673	79%	0.789	S	S	*	*			cis	-143.7	143.5	-20.1	177.9	0	0	0	0	106.7
203	I	38.4	Very low	43	Very low	159 Å²	159	126.5 Å²	126.5	82%	0.815	78%	0.78	S	S	*	*			trans	-125.1	125.7	162.2	-58.3	172.1	0	0	0	107.6
204	P	40.5	Very low	45	Very low	103 Å²	103	125 Å²	125	67%	0.669	78%	0.777	S	S	*	*			trans	-74.9	139.4	179.5	29.7	-33.4	0	0	0	111.8
205	P	44.8	Very low	46.9	Very low	127 Å²	127	127.3 Å²	127.3	83%	0.825	78%	0.776	S	S	*	*			trans	-95.4	108.9	-177.1	34.8	-31	0	0	0	112.3
206	S	41.3	Very low	49	Very low	124 Å²	124	128.4 Å²	128.4	87%	0.867	77%	0.772	S	S	*	*			trans	-132.8	52.6	172.5	-61.2	0	0	0	0	112.2
207	A	49.6	Very low	51.1	Low	91 Å²	91	128.6 Å²	128.6	75%	0.752	76%	0.761	S	S	*	*			trans	-154.3	82.8	170.7	0	0	0	0	0	112
208	S	55	Low	53.3	Low	106 Å²	106	124.3 Å²	124.3	74%	0.741	74%	0.741	S	S	*	*			trans	177	141.7	146.3	-80.3	0	0	0	0	111.7
209	F	45.4	Very low	55.5	Low	195 Å²	195	124.8 Å²	124.8	86%	0.855	73%	0.734	S	S	*	*			trans	68.6	127.2	175.9	-61.3	-78.8	0	0	0	115.8
210	Q	46.7	Very low	58	Low	182 Å²	182	125.5 Å²	125.5	85%	0.85	72%	0.72	S	S	*	*			cis	-140.4	146.3	6.8	-102.1	159.6	-23.9	0	0	111.5
211	A	56.7	Low	60	Low	108 Å²	108	125.1 Å²	125.1	89%	0.893	71%	0.712	S	S	*	*			trans	-82.9	141.5	165.5	0	0	0	0	0	110.2
212	G	56.9	Low	62.1	Low	79 Å²	79	120.2 Å²	120.2	81%	0.814	69%	0.692	S	S	*	*			trans	157.3	-5	174.7	0	0	0	0	0	118
213	M	51.2	Low	64.1	Low	127 Å²	127	119.9 Å²	119.9	63%	0.626	69%	0.686	S	S	*	*			trans	-95.1	139.4	176.7	-64.4	-179	-173.9	0	0	110.9	Q217	M213-Q217 HydrophobicContact CB-CB 4.27Å
214	T	78.7	Confident	66	Low	92 Å²	92	118.1 Å²	118.1	56%	0.564	67%	0.674	S	S	*	*			trans	-71.1	157.8	171.4	55.5	0	0	0	0	110.6	E216 Q217 A218	T214-E216 PolarHBondContact O-N 3.44Å; T214-Q217 PolarHBondContact O-N 3.11Å; T214-A218 PolarHBondContact O-N 2.87Å
215	E	80.2	Confident	67.6	Low	178 Å²	178	118.9 Å²	118.9	83%	0.832	67%	0.671	S	S	*	*	H	α-helix	trans	-54.9	-38.5	-179.2	-172	175.2	170.3	0	0	112.3	A218 L219	E215-A218 PolarHBondContact O-N 2.93Å; E215-L219 WeakPolarHBondContact O-CB 3.4Å; E215-L219 PolarHBondContact O-N 3.46Å
216	E	80.9	Confident	69.2	Low	145 Å²	145	116.5 Å²	116.5	68%	0.678	66%	0.657	S	S	*	*	H	α-helix	trans	-64.9	-42	175.1	-170.7	176.4	124.4	0	0	112.8	T214 A218 L219 Q220	T214-E216 PolarHBondContact O-N 3.44Å; E216-A218 VanDerWaalsContact C-N 3.32Å; E216-A218 PolarHBondContact O-N 3.22Å; E216-L219 PolarHBondContact O-N 3.48Å; E216-Q220 WeakPolarHBondContact O-CB 3.16Å; E216-Q220 PolarHBondContact O-N 3.22Å
217	Q	84.2	Confident	70.5	Confident	118 Å²	118	116.7 Å²	116.7	55%	0.551	65%	0.648	S	S	*	*	H	α-helix	trans	-65.6	-35.7	174.9	-108.7	-177.7	-22.4	0	0	112.1	M213 T214 R221	M213-Q217 HydrophobicContact CB-CB 4.27Å; T214-Q217 PolarHBondContact O-N 3.11Å; Q217-R221 WeakPolarHBondContact O-CB 3.48Å; Q217-R221 PolarHBondContact O-N 3.48Å; Q217-R221 VanDerWaalsContact O-N 3.12Å
218	A	81.2	Confident	70.9	Confident	53 Å²	53	115.3 Å²	115.3	44%	0.438	64%	0.636	S	S	.	*	H	α-helix	trans	-68.3	-42.2	173.7	0	0	0	0	0	111.8	T214 E215 E216 A222	T214-A218 PolarHBondContact O-N 2.87Å; E215-A218 PolarHBondContact O-N 2.93Å; E216-A218 VanDerWaalsContact C-N 3.32Å; E216-A218 PolarHBondContact O-N 3.22Å; A218-A222 WeakPolarHBondContact O-CB 3.5Å; A218-A222 PolarHBondContact O-N 3.47Å
219	L	86.5	Confident	70.6	Confident	112 Å²	112	117.4 Å²	117.4	59%	0.586	64%	0.639	S	S	*	*	H	α-helix	trans	-67	-46.1	178.6	-171.6	71.9	0	0	0	111.8	E215 E216 R221 A222 L223	E215-L219 WeakPolarHBondContact O-CB 3.4Å; E215-L219 PolarHBondContact O-N 3.46Å; E216-L219 PolarHBondContact O-N 3.48Å; L219-R221 VanDerWaalsContact C-N 3.31Å; L219-R221 PolarHBondContact O-N 3.04Å; L219-A222 WeakPolarHBondContact O-CB 3.43Å; L219-A222 PolarHBondContact O-N 3.04Å; L219-A222 VanDerWaalsContact O-N 3.15Å; L219-L223 HydrophobicContact CG-CD1 4.41Å; L219-L223 WeakPolarHBondContact O-CG 3.38Å; L219-L223 PolarHBondContact O-N 2.93Å
220	Q	85.4	Confident	71	Confident	118 Å²	118	112.5 Å²	112.5	55%	0.551	63%	0.629	S	S	*	*	H	α-helix	trans	-63.5	-39.5	178.2	-171.8	143.5	-32.6	0	0	111.2	E216 L223 E224	E216-Q220 WeakPolarHBondContact O-CB 3.16Å; E216-Q220 PolarHBondContact O-N 3.22Å; Q220-L223 PolarHBondContact O-N 3.17Å; Q220-E224 WeakPolarHBondContact O-CG 3.41Å; Q220-E224 PolarHBondContact O-N 2.86Å
221	R	81.6	Confident	71.2	Confident	148 Å²	148	114 Å²	114	56%	0.558	63%	0.627	S	S	*	*	H	α-helix	trans	-67.1	-35.1	173.5	-164.6	171.5	-152.1	-122.8	-0.3	112.9	Q217 L219 M225	Q217-R221 WeakPolarHBondContact O-CB 3.48Å; Q217-R221 PolarHBondContact O-N 3.48Å; Q217-R221 VanDerWaalsContact O-N 3.12Å; L219-R221 VanDerWaalsContact C-N 3.31Å; L219-R221 PolarHBondContact O-N 3.04Å; R221-M225 HydrophobicContact CG-SD 4.44Å; R221-M225 WeakPolarHBondContact O-CB 3.2Å; R221-M225 VanDerWaalsContact O-CG 3.24Å; R221-M225 WeakPolarHBondContact O-CG 3.44Å; R221-M225 PolarHBondContact O-N 3.19Å
222	A	81.3	Confident	70.6	Confident	48 Å²	48	113.5 Å²	113.5	40%	0.397	61%	0.614	S	S	.	*	H	α-helix	trans	-66.3	-40.9	174	0	0	0	0	0	111.6	A218 L219 M225 S226	A218-A222 WeakPolarHBondContact O-CB 3.5Å; A218-A222 PolarHBondContact O-N 3.47Å; L219-A222 WeakPolarHBondContact O-CB 3.43Å; L219-A222 PolarHBondContact O-N 3.04Å; L219-A222 VanDerWaalsContact O-N 3.15Å; A222-M225 PolarHBondContact O-N 3.33Å; A222-S226 PolarHBondContact O-N 2.8Å; A222-S226 PolarHBondContact O-OG 2.98Å; A222-S226 VanDerWaalsContact O-OG 3.07Å
223	L	80.1	Confident	70.1	Confident	104 Å²	104	114.3 Å²	114.3	55%	0.545	61%	0.614	S	S	.	*	H	α-helix	trans	-65.2	-43.6	174.1	-69.5	168.2	0	0	0	111.9	L219 Q220 M225 S226 L227	L219-L223 HydrophobicContact CG-CD1 4.41Å; L219-L223 WeakPolarHBondContact O-CG 3.38Å; L219-L223 PolarHBondContact O-N 2.93Å; Q220-L223 PolarHBondContact O-N 3.17Å; L223-M225 VanDerWaalsContact C-N 3.34Å; L223-M225 PolarHBondContact O-N 3.21Å; L223-S226 PolarHBondContact O-N 3.15Å; L223-L227 WeakPolarHBondContact O-CG 3.31Å; L223-L227 PolarHBondContact O-N 2.8Å
224	E	78.6	Confident	69.8	Low	122 Å²	122	114.7 Å²	114.7	57%	0.57	62%	0.623	S	S	*	*	H	α-helix	trans	-62.1	-39.4	172.5	-76.7	-174.6	136.1	0	0	112.3	Q220 L227 A228	Q220-E224 WeakPolarHBondContact O-CG 3.41Å; Q220-E224 PolarHBondContact O-N 2.86Å; E224-L227 PolarHBondContact O-N 3.48Å; E224-A228 WeakPolarHBondContact O-CB 3.33Å; E224-A228 PolarHBondContact O-N 3.21Å
225	M	72.5	Confident	68.4	Low	120 Å²	120	119.5 Å²	119.5	59%	0.591	64%	0.639	S	S	*	*	H	α-helix	trans	-65.8	-39.5	174.9	-76.5	177.8	62.9	0	0	112	R221 A222 L223 L227 A228 D229	R221-M225 HydrophobicContact CG-SD 4.44Å; R221-M225 WeakPolarHBondContact O-CB 3.2Å; R221-M225 VanDerWaalsContact O-CG 3.24Å; R221-M225 WeakPolarHBondContact O-CG 3.44Å; R221-M225 PolarHBondContact O-N 3.19Å; A222-M225 PolarHBondContact O-N 3.33Å; L223-M225 VanDerWaalsContact C-N 3.34Å; L223-M225 PolarHBondContact O-N 3.21Å; M225-L227 VanDerWaalsContact C-N 3.32Å; M225-L227 PolarHBondContact O-N 3.29Å; M225-A228 PolarHBondContact O-N 2.92Å; M225-D229 PolarHBondContact O-N 2.97Å
226	S	78.8	Confident	66.7	Low	77 Å²	77	114.8 Å²	114.8	54%	0.538	63%	0.63	S	S	.	*	H	α-helix	trans	-64.4	-33.6	172.8	-60.2	0	0	0	0	113.1	A222 L223 S230	A222-S226 PolarHBondContact O-N 2.8Å; A222-S226 PolarHBondContact O-OG 2.98Å; A222-S226 VanDerWaalsContact O-OG 3.07Å; L223-S226 PolarHBondContact O-N 3.15Å; S226-S230 PolarHBondContact O-OG 3.45Å
227	L	68.1	Low	65.4	Low	128 Å²	128	114 Å²	114	67%	0.67	64%	0.635	S	S	*	*	H	α-helix	trans	-74.8	-29.2	172.8	-70.8	168	0	0	0	112.5	L223 E224 M225 S230	L223-L227 WeakPolarHBondContact O-CG 3.31Å; L223-L227 PolarHBondContact O-N 2.8Å; E224-L227 PolarHBondContact O-N 3.48Å; M225-L227 VanDerWaalsContact C-N 3.32Å; M225-L227 PolarHBondContact O-N 3.29Å; L227-S230 WeakPolarHBondContact O-CB 3.22Å
228	A	58.6	Low	64.1	Low	61 Å²	61	111.4 Å²	111.4	50%	0.504	63%	0.629	S	S	.	*	H	α-helix	trans	-77.5	-33.7	176.3	0	0	0	0	0	113.1	E224 M225 S230 R231	E224-A228 WeakPolarHBondContact O-CB 3.33Å; E224-A228 PolarHBondContact O-N 3.21Å; M225-A228 PolarHBondContact O-N 2.92Å; A228-S230 PolarHBondContact O-N 3.44Å; A228-R231 PolarHBondContact O-N 3.35Å
229	D	50.1	Low	63.9	Low	150 Å²	150	111.1 Å²	111.1	80%	0.802	62%	0.624	S	S	*	*	H	α-helix	trans	-64.8	-22.5	173.7	-146.2	-118.2	0	0	0	111.7	M225 R231	M225-D229 PolarHBondContact O-N 2.97Å; D229-R231 PolarHBondContact O-N 3.33Å
230	S	52.8	Low	63.7	Low	92 Å²	92	110.6 Å²	110.6	64%	0.643	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.2	10.1	171.3	-55.9	0	0	0	0	114	S226 L227 A228	S226-S230 PolarHBondContact O-OG 3.45Å; L227-S230 WeakPolarHBondContact O-CB 3.22Å; A228-S230 PolarHBondContact O-N 3.44Å
231	R	51	Low	63.4	Low	213 Å²	213	112.2 Å²	112.2	80%	0.804	64%	0.635	S	S	*	*			trans	-117.7	96.4	173.3	-80	-176.9	138.1	-171.8	-3.5	111.9	A228 D229 A233	A228-R231 PolarHBondContact O-N 3.35Å; D229-R231 PolarHBondContact O-N 3.33Å; R231-A233 PolarHBondContact O-N 3.33Å
232	P	43.7	Very low	63.6	Low	98 Å²	98	110.7 Å²	110.7	64%	0.636	63%	0.634	S	S	*	*			trans	-59.1	131.3	152.7	-14.9	29.4	0	0	0	109
233	A	47.1	Very low	64	Low	97 Å²	97	114.4 Å²	114.4	80%	0.802	64%	0.643	S	S	*	*	S	Bend	trans	-64.3	148.1	149.1	0	0	0	0	0	107.9	R231	R231-A233 PolarHBondContact O-N 3.33Å
234	V	45.1	Very low	64.5	Low	134 Å²	134	116 Å²	116	81%	0.812	65%	0.648	S	S	*	*	S	Bend	trans	80.5	126.7	-163.6	-168.7	0	0	0	0	112.9	A236	V234-A236 PolarHBondContact O-N 3.07Å
235	Q	48	Very low	65.3	Low	194 Å²	194	115.5 Å²	115.5	91%	0.907	65%	0.649	S	S	*	*			trans	-66.2	93.3	179.4	-67.4	165.8	-35.5	0	0	110.7	T237	Q235-T237 PolarHBondContact O-N 2.95Å
236	A	44.3	Very low	66.3	Low	79 Å²	79	114.8 Å²	114.8	65%	0.653	65%	0.647	S	S	*	*			trans	-78.5	111.5	165.3	0	0	0	0	0	108.9	V234	V234-A236 PolarHBondContact O-N 3.07Å
237	T	54.5	Low	67	Low	128 Å²	128	113.7 Å²	113.7	79%	0.785	64%	0.642	S	S	*	*	P	Polyproline II helix	trans	-58.1	126.2	155.4	47.5	0	0	0	0	107	Q235 S239	Q235-T237 PolarHBondContact O-N 2.95Å; T237-S239 PolarHBondContact O-N 3Å
238	P	56.8	Low	68.3	Low	64 Å²	64	112.3 Å²	112.3	42%	0.416	64%	0.635	S	S	.	*	P	Polyproline II helix	trans	-55.7	142.5	-179.5	24.6	-34.2	0	0	0	109.2	E242 Q243	P238-E242 HydrophobicContact CB-CB 4.4Å; P238-Q243 HydrophobicContact CG-CG 4.38Å
239	S	77	Confident	70.1	Confident	47 Å²	47	112.1 Å²	112.1	33%	0.329	63%	0.633	S	S	.	*	P	Polyproline II helix	trans	-59.3	148.8	175.7	65.2	0	0	0	0	109.5	T237 Q241 E242 Q243	T237-S239 PolarHBondContact O-N 3Å; S239-Q241 PolarHBondContact O-N 2.82Å; S239-Q241 VanDerWaalsContact O-N 3.08Å; S239-E242 VanDerWaalsContact CB-OE2 3.27Å; S239-E242 WeakPolarHBondContact CB-OE2 3.47Å; S239-E242 PolarHBondContact N-OE2 3.32Å; S239-E242 PolarHBondContact O-N 2.99Å; S239-E242 WeakPolarHBondContact OG-CG 3.32Å; S239-E242 PolarHBondContact OG-N 3.09Å; S239-E242 PolarHBondContact OG-OE2 3.13Å; S239-Q243 PolarHBondContact O-N 3.09Å; S239-Q243 VanDerWaalsContact O-N 3.17Å
240	P	81.9	Confident	72.3	Confident	100 Å²	100	111.1 Å²	111.1	65%	0.649	62%	0.624	S	S	*	*	H	α-helix	trans	-52	-37.3	178.3	-27.8	35.3	0	0	0	112	Q243 E244	P240-Q243 WeakPolarHBondContact O-CB 3.37Å; P240-Q243 PolarHBondContact O-N 2.88Å; P240-Q243 VanDerWaalsContact O-N 3.15Å; P240-E244 PolarHBondContact O-N 3.36Å
241	Q	79.4	Confident	74.3	Confident	153 Å²	153	109.5 Å²	109.5	72%	0.715	62%	0.616	S	S	*	*	H	α-helix	trans	-66.3	-38.9	178.5	-167.8	171.4	-18.1	0	0	113.5	S239 Q243 E244 D245	S239-Q241 PolarHBondContact O-N 2.82Å; S239-Q241 VanDerWaalsContact O-N 3.08Å; Q241-Q243 VanDerWaalsContact C-N 3.29Å; Q241-Q243 PolarHBondContact O-N 3.5Å; Q241-E244 PolarHBondContact O-N 3.48Å; Q241-D245 WeakPolarHBondContact O-CB 3.4Å; Q241-D245 PolarHBondContact O-N 2.94Å
242	E	86.1	Confident	76.4	Confident	116 Å²	116	104.7 Å²	104.7	54%	0.542	61%	0.606	S	S	.	*	H	α-helix	trans	-65.6	-32.7	171	-78.7	162.9	96.8	0	0	112.2	P238 S239 D245 L246	P238-E242 HydrophobicContact CB-CB 4.4Å; S239-E242 VanDerWaalsContact CB-OE2 3.27Å; S239-E242 WeakPolarHBondContact CB-OE2 3.47Å; S239-E242 PolarHBondContact N-OE2 3.32Å; S239-E242 PolarHBondContact O-N 2.99Å; S239-E242 WeakPolarHBondContact OG-CG 3.32Å; S239-E242 PolarHBondContact OG-N 3.09Å; S239-E242 PolarHBondContact OG-OE2 3.13Å; E242-D245 PolarHBondContact O-N 3.46Å; E242-L246 VanDerWaalsContact O-CB 3.26Å; E242-L246 WeakPolarHBondContact O-CB 3.42Å; E242-L246 PolarHBondContact O-N 2.99Å
243	Q	89.4	Confident	78.9	Confident	125 Å²	125	103 Å²	103	58%	0.584	60%	0.601	S	S	*	*	H	α-helix	trans	-69.8	-39.1	177.8	-121.6	171	25.9	0	0	111.8	P238 S239 P240 Q241 A247	P238-Q243 HydrophobicContact CG-CG 4.38Å; S239-Q243 PolarHBondContact O-N 3.09Å; S239-Q243 VanDerWaalsContact O-N 3.17Å; P240-Q243 WeakPolarHBondContact O-CB 3.37Å; P240-Q243 PolarHBondContact O-N 2.88Å; P240-Q243 VanDerWaalsContact O-N 3.15Å; Q241-Q243 VanDerWaalsContact C-N 3.29Å; Q241-Q243 PolarHBondContact O-N 3.5Å; Q243-A247 WeakPolarHBondContact O-CB 3.41Å; Q243-A247 PolarHBondContact O-N 3.38Å; Q243-A247 VanDerWaalsContact O-N 3.09Å
244	E	91.6	Very high	81.2	Confident	138 Å²	138	101.3 Å²	101.3	65%	0.645	59%	0.586	S	S	*	*	H	α-helix	trans	-65.2	-44	171.9	-69.3	175.6	98.4	0	0	111.8	P240 Q241 A247 L248	P240-E244 PolarHBondContact O-N 3.36Å; Q241-E244 PolarHBondContact O-N 3.48Å; E244-A247 PolarHBondContact O-N 3.18Å; E244-L248 WeakPolarHBondContact O-CB 2.95Å; E244-L248 PolarHBondContact O-N 3.38Å
245	D	94	Very high	83.7	Confident	111 Å²	111	98.6 Å²	98.6	59%	0.594	57%	0.573	S	S	*	*	H	α-helix	trans	-66	-41.4	-179.7	-150.3	-104.1	0	0	0	112	Q241 E242 L248 A249	Q241-D245 WeakPolarHBondContact O-CB 3.4Å; Q241-D245 PolarHBondContact O-N 2.94Å; E242-D245 PolarHBondContact O-N 3.46Å; D245-L248 PolarHBondContact O-N 2.69Å; D245-A249 WeakPolarHBondContact O-CB 3.46Å; D245-A249 PolarHBondContact O-N 3.42Å
246	L	93.4	Very high	86	Confident	105 Å²	105	95.7 Å²	95.7	55%	0.55	56%	0.56	S	S	.	*	H	α-helix	trans	-66	-40.7	175.5	-165.8	158	0	0	0	111.7	E242 L248 A249 Q250	E242-L246 VanDerWaalsContact O-CB 3.26Å; E242-L246 WeakPolarHBondContact O-CB 3.42Å; E242-L246 PolarHBondContact O-N 2.99Å; L246-L248 VanDerWaalsContact C-N 3.35Å; L246-A249 PolarHBondContact O-N 3.13Å; L246-Q250 HydrophobicContact CD2-CG 4.18Å; L246-Q250 WeakPolarHBondContact O-CG 3.44Å; L246-Q250 PolarHBondContact O-N 3.45Å
247	A	93.9	Very high	88.3	Confident	54 Å²	54	98 Å²	98	45%	0.446	56%	0.557	S	S	.	*	H	α-helix	trans	-63.6	-39.8	174.4	0	0	0	0	0	112	Q243 E244 Q250 A251	Q243-A247 WeakPolarHBondContact O-CB 3.41Å; Q243-A247 PolarHBondContact O-N 3.38Å; Q243-A247 VanDerWaalsContact O-N 3.09Å; E244-A247 PolarHBondContact O-N 3.18Å; A247-Q250 PolarHBondContact O-N 3.24Å; A247-A251 PolarHBondContact O-N 2.94Å
248	L	96.3	Very high	90.2	Very high	100 Å²	100	97.8 Å²	97.8	52%	0.524	55%	0.547	S	S	.	.	H	α-helix	trans	-64.4	-43.7	174.7	-179	61.1	0	0	0	111.7	E244 D245 L246 Q250 A251 L252	E244-L248 WeakPolarHBondContact O-CB 2.95Å; E244-L248 PolarHBondContact O-N 3.38Å; D245-L248 PolarHBondContact O-N 2.69Å; L246-L248 VanDerWaalsContact C-N 3.35Å; L248-Q250 PolarHBondContact O-N 2.72Å; L248-A251 PolarHBondContact O-N 2.93Å; L248-L252 HydrophobicContact CG-CD1 4.37Å; L248-L252 WeakPolarHBondContact O-CG 3.37Å; L248-L252 PolarHBondContact O-N 3.45Å
249	A	95.1	Very high	92	Very high	56 Å²	56	101.4 Å²	101.4	46%	0.463	55%	0.553	S	S	.	*	H	α-helix	trans	-60.6	-42.4	176.5	0	0	0	0	0	112.2	D245 L246 L252 A253	D245-A249 WeakPolarHBondContact O-CB 3.46Å; D245-A249 PolarHBondContact O-N 3.42Å; L246-A249 PolarHBondContact O-N 3.13Å; A249-L252 PolarHBondContact O-N 3.13Å; A249-A253 WeakPolarHBondContact O-CB 3.27Å; A249-A253 PolarHBondContact O-N 2.9Å
250	Q	96	Very high	92.8	Very high	129 Å²	129	106.9 Å²	106.9	60%	0.603	57%	0.567	S	S	*	*	H	α-helix	trans	-64.4	-40.4	174.9	-73.2	-178.4	-8.9	0	0	112.5	L246 A247 L248 A253 A254	L246-Q250 HydrophobicContact CD2-CG 4.18Å; L246-Q250 WeakPolarHBondContact O-CG 3.44Å; L246-Q250 PolarHBondContact O-N 3.45Å; A247-Q250 PolarHBondContact O-N 3.24Å; L248-Q250 PolarHBondContact O-N 2.72Å; Q250-A253 PolarHBondContact O-N 3.36Å; Q250-A254 WeakPolarHBondContact O-CB 3.44Å; Q250-A254 PolarHBondContact O-N 3.44Å
251	A	96.4	Very high	93.3	Very high	59 Å²	59	109.5 Å²	109.5	49%	0.488	56%	0.564	S	S	.	*	H	α-helix	trans	-64.9	-40.5	177.4	0	0	0	0	0	112.5	A247 L248 S255	A247-A251 PolarHBondContact O-N 2.94Å; L248-A251 PolarHBondContact O-N 2.93Å; A251-S255 WeakPolarHBondContact O-CB 3.34Å; A251-S255 PolarHBondContact O-N 2.89Å; A251-S255 VanDerWaalsContact O-N 3.08Å
252	L	95.1	Very high	93.8	Very high	112 Å²	112	106.8 Å²	106.8	59%	0.586	55%	0.551	S	S	*	*	H	α-helix	trans	-64.8	-44.8	175	-70.5	172.3	0	0	0	111.8	L248 A249 A254 S255 E256	L248-L252 HydrophobicContact CG-CD1 4.37Å; L248-L252 WeakPolarHBondContact O-CG 3.37Å; L248-L252 PolarHBondContact O-N 3.45Å; A249-L252 PolarHBondContact O-N 3.13Å; L252-A254 PolarHBondContact O-N 3.4Å; L252-S255 PolarHBondContact O-N 3.05Å; L252-E256 PolarHBondContact O-N 3.31Å
253	A	96	Very high	94	Very high	63 Å²	63	104.9 Å²	104.9	52%	0.521	54%	0.542	S	S	.	.	H	α-helix	trans	-61.1	-43.4	177.4	0	0	0	0	0	112.5	A249 Q250 S255 E256 E257	A249-A253 WeakPolarHBondContact O-CB 3.27Å; A249-A253 PolarHBondContact O-N 2.9Å; Q250-A253 PolarHBondContact O-N 3.36Å; A253-S255 PolarHBondContact O-N 2.82Å; A253-E256 PolarHBondContact O-N 3.01Å; A253-E257 PolarHBondContact O-N 2.8Å
254	A	95.3	Very high	93.9	Very high	61 Å²	61	105.3 Å²	105.3	50%	0.504	54%	0.544	S	S	.	.	H	α-helix	trans	-62.9	-40.8	176.3	0	0	0	0	0	112.3	Q250 L252 E257 E258	Q250-A254 WeakPolarHBondContact O-CB 3.44Å; Q250-A254 PolarHBondContact O-N 3.44Å; L252-A254 PolarHBondContact O-N 3.4Å; A254-E257 PolarHBondContact O-N 2.92Å; A254-E258 WeakPolarHBondContact O-CB 3.46Å; A254-E258 PolarHBondContact O-N 3.46Å
255	S	96.8	Very high	93.7	Very high	77 Å²	77	108 Å²	108	54%	0.538	55%	0.549	S	S	.	.	H	α-helix	trans	-65.7	-40.5	176.7	-169.8	0	0	0	0	112.3	A251 L252 A253 E258 Y259	A251-S255 WeakPolarHBondContact O-CB 3.34Å; A251-S255 PolarHBondContact O-N 2.89Å; A251-S255 VanDerWaalsContact O-N 3.08Å; L252-S255 PolarHBondContact O-N 3.05Å; A253-S255 PolarHBondContact O-N 2.82Å; S255-E258 PolarHBondContact O-N 3.09Å; S255-Y259 VanDerWaalsContact O-CB 3.32Å; S255-Y259 WeakPolarHBondContact O-CB 3.23Å; S255-Y259 PolarHBondContact O-N 3.22Å
256	E	96	Very high	92.9	Very high	133 Å²	133	108.5 Å²	108.5	62%	0.621	55%	0.547	S	S	*	.	H	α-helix	trans	-66.2	-39.9	176	-167	-178.6	109.8	0	0	112	L252 A253 Y259 R260	L252-E256 PolarHBondContact O-N 3.31Å; A253-E256 PolarHBondContact O-N 3.01Å; E256-Y259 PolarHBondContact O-N 3.22Å; E256-R260 WeakPolarHBondContact O-CB 3.47Å; E256-R260 PolarHBondContact O-N 3.01Å
257	E	93.2	Very high	92	Very high	127 Å²	127	109 Å²	109	59%	0.593	55%	0.546	S	S	*	.	H	α-helix	trans	-65.3	-44.4	174.5	-166.3	-176.1	135.5	0	0	111.5	A253 A254 Y259 R260 R261	A253-E257 PolarHBondContact O-N 2.8Å; A254-E257 PolarHBondContact O-N 2.92Å; E257-Y259 VanDerWaalsContact C-N 3.34Å; E257-Y259 PolarHBondContact O-N 3.09Å; E257-R260 WeakPolarHBondContact O-CB 3.48Å; E257-R260 PolarHBondContact O-N 3.17Å; E257-R261 WeakPolarHBondContact O-CG 3.35Å; E257-R261 PolarHBondContact O-N 3.45Å
258	E	94.1	Very high	90.9	Very high	124 Å²	124	107.8 Å²	107.8	58%	0.579	54%	0.539	S	S	*	.	H	α-helix	trans	-62.8	-41.5	176.9	-174.6	162.7	-152.2	0	0	111.7	A254 S255 R260 R261 Q262	A254-E258 WeakPolarHBondContact O-CB 3.46Å; A254-E258 PolarHBondContact O-N 3.46Å; S255-E258 PolarHBondContact O-N 3.09Å; E258-R260 PolarHBondContact O-N 2.73Å; E258-R261 PolarHBondContact O-N 2.97Å; E258-Q262 WeakPolarHBondContact O-CG 3.48Å; E258-Q262 PolarHBondContact O-N 3.32Å
259	Y	94.5	Very high	89.5	Confident	139 Å²	139	112.5 Å²	112.5	55%	0.545	55%	0.55	S	S	.	*	H	α-helix	trans	-60.1	-43.6	173.2	-178.3	-105.4	0	0	0	112.2	S255 E256 E257 R261 Q262 Q263	S255-Y259 VanDerWaalsContact O-CB 3.32Å; S255-Y259 WeakPolarHBondContact O-CB 3.23Å; S255-Y259 PolarHBondContact O-N 3.22Å; E256-Y259 PolarHBondContact O-N 3.22Å; E257-Y259 VanDerWaalsContact C-N 3.34Å; E257-Y259 PolarHBondContact O-N 3.09Å; Y259-R261 PolarHBondContact O-N 3.39Å; Y259-Q262 PolarHBondContact O-N 2.9Å; Y259-Q263 HydrophobicContact CE1-CG 4.19Å; Y259-Q263 PolarHBondContact O-N 3.19Å; Y259-Q263 PolarHBondContact OH-NE2 3.2Å; Y259-Q263 VanDerWaalsContact OH-NE2 3.09Å
260	R	93.6	Very high	88	Confident	162 Å²	162	116.1 Å²	116.1	61%	0.611	56%	0.558	S	S	*	*	H	α-helix	trans	-58.9	-43.9	172.1	-97.2	177.6	144.6	-174.2	-4.3	112.5	E256 E257 E258 Q262 Q263 Q264	E256-R260 WeakPolarHBondContact O-CB 3.47Å; E256-R260 PolarHBondContact O-N 3.01Å; E257-R260 WeakPolarHBondContact O-CB 3.48Å; E257-R260 PolarHBondContact O-N 3.17Å; E258-R260 PolarHBondContact O-N 2.73Å; R260-Q262 VanDerWaalsContact C-N 3.32Å; R260-Q262 PolarHBondContact O-N 2.75Å; R260-Q263 PolarHBondContact O-N 3.43Å; R260-Q264 WeakPolarHBondContact O-CG 3.42Å; R260-Q264 PolarHBondContact O-N 3.42Å
261	R	93.5	Very high	86.5	Confident	155 Å²	155	113.9 Å²	113.9	59%	0.585	55%	0.553	S	S	*	*	H	α-helix	trans	-66.6	-33.8	177	-66.7	-178.6	87.6	-160.2	11	111.8	E257 E258 Y259 R265	E257-R261 WeakPolarHBondContact O-CG 3.35Å; E257-R261 PolarHBondContact O-N 3.45Å; E258-R261 PolarHBondContact O-N 2.97Å; Y259-R261 PolarHBondContact O-N 3.39Å; R261-R265 WeakPolarHBondContact O-CB 3.41Å; R261-R265 WeakPolarHBondContact O-CG 3.33Å; R261-R265 PolarHBondContact O-N 2.9Å
262	Q	90.1	Very high	84.9	Confident	96 Å²	96	118.5 Å²	118.5	45%	0.449	56%	0.562	S	S	.	*	H	α-helix	trans	-66.8	-44.5	172.4	-71.5	-174.6	30.1	0	0	112	E258 Y259 R260 Q264 R265 Q266	E258-Q262 WeakPolarHBondContact O-CG 3.48Å; E258-Q262 PolarHBondContact O-N 3.32Å; Y259-Q262 PolarHBondContact O-N 2.9Å; R260-Q262 VanDerWaalsContact C-N 3.32Å; R260-Q262 PolarHBondContact O-N 2.75Å; Q262-Q264 PolarHBondContact O-N 2.75Å; Q262-R265 PolarHBondContact O-N 3.11Å; Q262-Q266 WeakPolarHBondContact O-CG 3.41Å; Q262-Q266 PolarHBondContact O-N 3.29Å
263	Q	89.6	Confident	83.2	Confident	77 Å²	77	120 Å²	120	36%	0.36	57%	0.566	S	S	.	*	H	α-helix	trans	-58.4	-46.4	174.4	-74.4	-165.7	-3.1	0	0	112.1	Y259 R260 R265 Q266 Q267	Y259-Q263 HydrophobicContact CE1-CG 4.19Å; Y259-Q263 PolarHBondContact O-N 3.19Å; Y259-Q263 PolarHBondContact OH-NE2 3.2Å; Y259-Q263 VanDerWaalsContact OH-NE2 3.09Å; R260-Q263 PolarHBondContact O-N 3.43Å; Q263-R265 VanDerWaalsContact C-N 3.3Å; Q263-R265 PolarHBondContact O-N 3.38Å; Q263-Q266 PolarHBondContact O-N 3.35Å; Q263-Q266 VanDerWaalsContact O-N 3.13Å; Q263-Q267 WeakPolarHBondContact O-CG 3.4Å; Q263-Q267 PolarHBondContact O-N 3.15Å
264	Q	88	Confident	81.4	Confident	133 Å²	133	120.5 Å²	120.5	62%	0.621	57%	0.566	S	S	*	*	H	α-helix	trans	-61	-38.1	176.3	-71.4	178.7	1.6	0	0	112.3	R260 Q262 G268	R260-Q264 WeakPolarHBondContact O-CG 3.42Å; R260-Q264 PolarHBondContact O-N 3.42Å; Q262-Q264 PolarHBondContact O-N 2.75Å; Q264-G268 PolarHBondContact O-N 3.02Å
265	R	86.1	Confident	79.7	Confident	196 Å²	196	122.4 Å²	122.4	74%	0.74	57%	0.571	S	S	*	*	H	α-helix	trans	-67.8	-31.9	174.5	-79.7	-178.9	168.4	-150.1	-1.9	113.4	R261 Q262 Q263 R269	R261-R265 WeakPolarHBondContact O-CB 3.41Å; R261-R265 WeakPolarHBondContact O-CG 3.33Å; R261-R265 PolarHBondContact O-N 2.9Å; Q262-R265 PolarHBondContact O-N 3.11Å; Q263-R265 VanDerWaalsContact C-N 3.3Å; Q263-R265 PolarHBondContact O-N 3.38Å; R265-R269 PolarHBondContact O-N 3.47Å; R265-R269 VanDerWaalsContact O-N 3.15Å
266	Q	78.8	Confident	77.9	Confident	121 Å²	121	123.7 Å²	123.7	57%	0.565	58%	0.579	S	S	*	*	H	α-helix	trans	-71.7	-49.8	175.7	-71.1	176.5	22.7	0	0	110.9	Q262 Q263 G268 R269 E270	Q262-Q266 WeakPolarHBondContact O-CG 3.41Å; Q262-Q266 PolarHBondContact O-N 3.29Å; Q263-Q266 PolarHBondContact O-N 3.35Å; Q263-Q266 VanDerWaalsContact O-N 3.13Å; Q266-G268 VanDerWaalsContact C-N 3.28Å; Q266-G268 PolarHBondContact O-N 3.43Å; Q266-R269 WeakPolarHBondContact O-CA 3.3Å; Q266-R269 WeakPolarHBondContact O-CB 3.2Å; Q266-R269 PolarHBondContact O-N 3.08Å; Q266-E270 PolarHBondContact O-N 2.72Å
267	Q	74.6	Confident	75.9	Confident	114 Å²	114	122.6 Å²	122.6	53%	0.533	59%	0.585	S	S	.	*	H	α-helix	trans	-59.5	-39	175.2	-65.6	174.1	21.9	0	0	112	Q263 R269 T271	Q263-Q267 WeakPolarHBondContact O-CG 3.4Å; Q263-Q267 PolarHBondContact O-N 3.15Å; Q267-R269 VanDerWaalsContact C-N 3.25Å; Q267-R269 PolarHBondContact O-N 3.26Å; Q267-T271 WeakPolarHBondContact O-CG2 3.4Å; Q267-T271 PolarHBondContact O-N 3.09Å; Q267-T271 VanDerWaalsContact O-N 3.11Å; Q267-T271 PolarHBondContact O-OG1 2.99Å
268	G	70.4	Confident	74	Confident	29 Å²	29	123.5 Å²	123.5	30%	0.299	59%	0.593	S	S	.	*	H	α-helix	trans	-70.1	-14	173.1	0	0	0	0	0	115.1	Q264 Q266 T271 K272	Q264-G268 PolarHBondContact O-N 3.02Å; Q266-G268 VanDerWaalsContact C-N 3.28Å; Q266-G268 PolarHBondContact O-N 3.43Å; G268-T271 WeakPolarHBondContact CA-OG1 3.41Å; G268-K272 WeakPolarHBondContact O-CD 3.44Å; G268-K272 VanDerWaalsContact O-CG 3.3Å; G268-K272 WeakPolarHBondContact O-CG 3.25Å
269	R	67.1	Low	71.5	Confident	200 Å²	200	126.6 Å²	126.6	76%	0.755	63%	0.628	S	S	*	*	H	α-helix	trans	-88.6	-46.7	171.1	-100.1	-177.3	162.9	-175.2	-5.4	111.3	R265 Q266 Q267 T271 K272 Q273	R265-R269 PolarHBondContact O-N 3.47Å; R265-R269 VanDerWaalsContact O-N 3.15Å; Q266-R269 WeakPolarHBondContact O-CA 3.3Å; Q266-R269 WeakPolarHBondContact O-CB 3.2Å; Q266-R269 PolarHBondContact O-N 3.08Å; Q267-R269 VanDerWaalsContact C-N 3.25Å; Q267-R269 PolarHBondContact O-N 3.26Å; R269-T271 VanDerWaalsContact C-N 3.35Å; R269-T271 PolarHBondContact O-N 3.34Å; R269-K272 PolarHBondContact O-N 3.21Å; R269-Q273 WeakPolarHBondContact O-CB 3.41Å; R269-Q273 PolarHBondContact O-N 3.22Å
270	E	61.8	Low	70.4	Confident	131 Å²	131	126 Å²	126	61%	0.612	63%	0.632	S	S	*	*	H	α-helix	trans	-57	-47.4	176.3	-73.5	179.2	101.4	0	0	111.6	Q266 K272 Q273 S274	Q266-E270 PolarHBondContact O-N 2.72Å; E270-K272 VanDerWaalsContact C-N 3.35Å; E270-K272 PolarHBondContact O-N 2.93Å; E270-Q273 PolarHBondContact O-N 3.28Å; E270-S274 PolarHBondContact O-N 3.28Å; E270-S274 PolarHBondContact O-OG 3.44Å
271	T	65.3	Low	69.1	Low	83 Å²	83	124.1 Å²	124.1	51%	0.509	63%	0.633	S	S	.	*	H	α-helix	trans	-62	-36.9	177.3	44.7	0	0	0	0	113.5	Q267 G268 R269 S274 T275	Q267-T271 WeakPolarHBondContact O-CG2 3.4Å; Q267-T271 PolarHBondContact O-N 3.09Å; Q267-T271 VanDerWaalsContact O-N 3.11Å; Q267-T271 PolarHBondContact O-OG1 2.99Å; G268-T271 WeakPolarHBondContact CA-OG1 3.41Å; R269-T271 VanDerWaalsContact C-N 3.35Å; R269-T271 PolarHBondContact O-N 3.34Å; T271-S274 PolarHBondContact O-OG 2.84Å; T271-T275 PolarHBondContact O-N 2.98Å; T271-T275 PolarHBondContact O-OG1 3.24Å
272	K	63.8	Low	67.8	Low	155 Å²	155	122.3 Å²	122.3	67%	0.674	64%	0.636	S	S	*	*	H	α-helix	trans	-72.9	-34.2	175.7	-74.9	-178.9	-179.1	-174.5	0	112.6	G268 R269 E270 T275 C276	G268-K272 WeakPolarHBondContact O-CD 3.44Å; G268-K272 VanDerWaalsContact O-CG 3.3Å; G268-K272 WeakPolarHBondContact O-CG 3.25Å; R269-K272 PolarHBondContact O-N 3.21Å; E270-K272 VanDerWaalsContact C-N 3.35Å; E270-K272 PolarHBondContact O-N 2.93Å; K272-T275 WeakPolarHBondContact CA-OG1 3.39Å; K272-T275 PolarHBondContact O-N 3.44Å; K272-T275 PolarHBondContact O-OG1 3.43Å; K272-C276 PolarHBondContact O-N 3.4Å
273	Q	59.6	Low	66.5	Low	145 Å²	145	123.9 Å²	123.9	68%	0.678	65%	0.647	S	S	*	*	H	α-helix	trans	-69.3	-38.8	178.1	-162.8	165.3	8.9	0	0	111	R269 E270 C276	R269-Q273 WeakPolarHBondContact O-CB 3.41Å; R269-Q273 PolarHBondContact O-N 3.22Å; E270-Q273 PolarHBondContact O-N 3.28Å; Q273-C276 PolarHBondContact O-N 3.47Å
274	S	58.3	Low	65	Low	73 Å²	73	126.8 Å²	126.8	51%	0.51	67%	0.665	S	S	.	*	H	α-helix	trans	-69	-29.6	174.1	56.3	0	0	0	0	114	E270 T271 C276	E270-S274 PolarHBondContact O-N 3.28Å; E270-S274 PolarHBondContact O-OG 3.44Å; T271-S274 PolarHBondContact O-OG 2.84Å; S274-C276 VanDerWaalsContact C-N 3.32Å; S274-C276 PolarHBondContact O-N 3.36Å
275	T	58.9	Low	63.5	Low	100 Å²	100	126.4 Å²	126.4	61%	0.613	67%	0.668	S	S	*	*	H	α-helix	trans	-73.9	-16.8	174.5	48.9	0	0	0	0	114.9	T271 K272	T271-T275 PolarHBondContact O-N 2.98Å; T271-T275 PolarHBondContact O-OG1 3.24Å; K272-T275 WeakPolarHBondContact CA-OG1 3.39Å; K272-T275 PolarHBondContact O-N 3.44Å; K272-T275 PolarHBondContact O-OG1 3.43Å
276	C	57.7	Low	61.9	Low	105 Å²	105	121.4 Å²	121.4	71%	0.709	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87	-6.6	-177.2	-158.4	0	0	0	0	114	K272 Q273 S274	K272-C276 PolarHBondContact O-N 3.4Å; Q273-C276 PolarHBondContact O-N 3.47Å; S274-C276 VanDerWaalsContact C-N 3.32Å; S274-C276 PolarHBondContact O-N 3.36Å
277	C	54.2	Low	60.6	Low	109 Å²	109	121.5 Å²	121.5	74%	0.736	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102	17.3	-177.4	-60.9	0	0	0	0	113.6
278	L	53.7	Low	59.4	Low	147 Å²	147	122.1 Å²	122.1	77%	0.77	68%	0.682	S	S	*	*			trans	-129.8	31.3	-172.1	-84.2	161.7	0	0	0	113
279	S	42.2	Very low	58.4	Low	188 Å²	188	130.5 Å²	130.5	100%	1.315	72%	0.717	S	S	*	*			trans	-142.8	0	169.9	-67.1	0	0	0	0	110.5

Retrieved 279 of 279 residues in 569.8 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).