A0A087YC39_POEFO Loading...

Family with sequence similarity 83 member D

AlphaFold DB , UniProt , Accession A0A087YC39, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 540 aa.

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(Predicted Aligned Error values between residue pairs)

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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	29.4	Very low	35.2	Very low	247 Å²	247	128.5 Å²	128.5	100%	1.217	73%	0.73	S	S	*	*				0	94.6	0	-66.3	-165.9	-128.8	0	0	106.9
2	A	26.3	Very low	35.6	Very low	98 Å²	98	130.1 Å²	130.1	81%	0.81	73%	0.734	S	S	*	*			trans	-86.9	123	-179.7	0	0	0	0	0	108.3	S4	A2-S4 PolarHBondContact O-N 3.38Å
3	L	30.3	Very low	36.3	Very low	180 Å²	180	133.5 Å²	133.5	94%	0.942	73%	0.728	S	S	*	*			trans	-63.9	112.4	170.7	-71.2	162.6	0	0	0	107.5
4	S	39.2	Very low	36.6	Very low	82 Å²	82	137.2 Å²	137.2	57%	0.573	75%	0.745	S	S	*	*			trans	-70.3	134	170.8	-167.4	0	0	0	0	107.9	A2 T6	A2-S4 PolarHBondContact O-N 3.38Å; S4-T6 PolarHBondContact O-N 3.23Å
5	Q	36.2	Very low	36.7	Very low	144 Å²	144	132.7 Å²	132.7	67%	0.673	74%	0.744	S	S	*	*			trans	-42.6	120.5	-173.9	-70.3	172.1	-14.6	0	0	113.1
6	T	37.9	Very low	36.6	Very low	104 Å²	104	136.3 Å²	136.3	64%	0.638	75%	0.753	S	S	*	*			trans	-82.1	133.6	157.3	44	0	0	0	0	107.9	S4 D8	S4-T6 PolarHBondContact O-N 3.23Å; T6-D8 PolarHBondContact O-N 3.13Å
7	L	42.4	Very low	36.3	Very low	122 Å²	122	142.4 Å²	142.4	64%	0.639	76%	0.762	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.1	27.7	-179.6	-99.8	165.3	0	0	0	113.8	D9	L7-D9 VanDerWaalsContact C-N 3.31Å; L7-D9 PolarHBondContact O-N 3.08Å
8	D	37.1	Very low	36.2	Very low	129 Å²	129	137.1 Å²	137.1	69%	0.69	74%	0.736	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81	-7.8	-179.6	-81.9	-37.2	0	0	0	113.5	T6	T6-D8 PolarHBondContact O-N 3.13Å
9	D	37.9	Very low	36.3	Very low	156 Å²	156	134.5 Å²	134.5	83%	0.834	73%	0.73	S	S	*	*			trans	-109.1	36.6	-175.4	-73.6	-34.6	0	0	0	114.2	L7	L7-D9 VanDerWaalsContact C-N 3.31Å; L7-D9 PolarHBondContact O-N 3.08Å
10	S	34.2	Very low	36.6	Very low	67 Å²	67	133.2 Å²	133.2	47%	0.469	74%	0.738	S	S	.	*			trans	-94.4	123.2	170.9	-77.6	0	0	0	0	112	L12	S10-L12 VanDerWaalsContact C-N 3.26Å; S10-L12 PolarHBondContact O-N 2.97Å; S10-L12 VanDerWaalsContact O-N 3.09Å
11	P	36.1	Very low	36.9	Very low	84 Å²	84	130.8 Å²	130.8	55%	0.545	74%	0.736	S	S	.	*			trans	-83	23.6	-171.5	34.1	-35.4	0	0	0	115.1	R13	P11-R13 PolarHBondContact O-N 3.02Å
12	L	40.7	Very low	37.6	Very low	148 Å²	148	124.5 Å²	124.5	78%	0.775	71%	0.707	S	S	*	*			trans	-73.4	43.5	179.9	-68.7	177.7	0	0	0	114.4	S10	S10-L12 VanDerWaalsContact C-N 3.26Å; S10-L12 PolarHBondContact O-N 2.97Å; S10-L12 VanDerWaalsContact O-N 3.09Å
13	R	43.9	Very low	38.6	Very low	175 Å²	175	123.4 Å²	123.4	66%	0.66	70%	0.698	S	S	*	*			trans	-129.1	75.6	168.9	-80.5	-158.7	171.8	-176.4	0.2	111.9	P11	P11-R13 PolarHBondContact O-N 3.02Å
14	L	41.2	Very low	39.7	Very low	185 Å²	185	120 Å²	120	97%	0.969	68%	0.684	S	S	*	*			trans	-129.4	81	151.6	-140	81.4	0	0	0	110.6
15	G	38.2	Very low	40.5	Very low	70 Å²	70	120 Å²	120	72%	0.722	68%	0.678	S	S	*	*	S	Bend	trans	172.3	89.2	174	0	0	0	0	0	112
16	Q	34.2	Very low	41.2	Very low	190 Å²	190	119 Å²	119	89%	0.888	68%	0.677	S	S	*	*			trans	57.7	112.3	177	-68	-177.3	-10.4	0	0	116.1	P18	Q16-P18 WeakPolarHBondContact O-CD 3.31Å; Q16-P18 VanDerWaalsContact O-N 3.1Å
17	R	32.6	Very low	41.8	Very low	240 Å²	240	121.6 Å²	121.6	91%	0.906	68%	0.682	S	S	*	*			trans	-53.4	113.3	169.7	-160.2	179.6	-161	163.3	4.3	108.5	S19	R17-S19 PolarHBondContact O-N 3.05Å
18	P	34.6	Very low	42.6	Very low	47 Å²	47	123.1 Å²	123.1	31%	0.305	69%	0.685	S	S	.	*			trans	-65.2	140.4	171.9	-12	27	0	0	0	107.4	Q16 D22	Q16-P18 WeakPolarHBondContact O-CD 3.31Å; Q16-P18 VanDerWaalsContact O-N 3.1Å; P18-D22 HydrophobicContact CB-CB 3.93Å
19	S	36.8	Very low	43.9	Very low	87 Å²	87	122.4 Å²	122.4	61%	0.608	69%	0.685	S	S	*	*			trans	-46.3	146.1	160.6	174	0	0	0	0	108.8	R17 A21 D22	R17-S19 PolarHBondContact O-N 3.05Å; S19-A21 PolarHBondContact O-N 3.13Å; S19-D22 PolarHBondContact O-N 2.78Å
20	A	43	Very low	45.8	Very low	109 Å²	109	119.9 Å²	119.9	90%	0.901	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.8	0.9	-177.5	0	0	0	0	0	114.9
21	A	43.2	Very low	48.2	Very low	83 Å²	83	120.1 Å²	120.1	69%	0.686	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87	-15.3	174.4	0	0	0	0	0	115	S19	S19-A21 PolarHBondContact O-N 3.13Å
22	D	44.5	Very low	50.7	Low	114 Å²	114	119.4 Å²	119.4	61%	0.61	65%	0.65	S	S	*	*			trans	-113.7	26.5	-174.6	-67.2	-36.9	0	0	0	113.8	P18 S19 V24	P18-D22 HydrophobicContact CB-CB 3.93Å; S19-D22 PolarHBondContact O-N 2.78Å; D22-V24 PolarHBondContact O-N 2.98Å
23	A	46.3	Very low	53.1	Low	75 Å²	75	118.8 Å²	118.8	62%	0.62	64%	0.637	S	S	*	*			trans	-72.7	86.7	162.9	0	0	0	0	0	107.6	N25	A23-N25 PolarHBondContact O-N 2.8Å
24	V	53.9	Low	55.4	Low	109 Å²	109	113.2 Å²	113.2	66%	0.661	62%	0.619	S	S	*	*			trans	-45.4	118.7	166.2	-176.4	0	0	0	0	106.5	D22 L26 V29	D22-V24 PolarHBondContact O-N 2.98Å; V24-L26 VanDerWaalsContact C-N 3.33Å; V24-L26 PolarHBondContact O-N 3.15Å; V24-V29 HydrophobicContact CG1-CG2 4.44Å
25	N	54.5	Low	57.8	Low	81 Å²	81	105.7 Å²	105.7	43%	0.433	58%	0.578	S	S	.	*			trans	-61.8	95.3	-176.9	-172.6	-7.7	0	0	0	107.9	A23 Q27 E28	A23-N25 PolarHBondContact O-N 2.8Å; N25-Q27 PolarHBondContact O-N 2.93Å; N25-Q27 WeakPolarHBondContact OD1-CB 3.34Å; N25-Q27 PolarHBondContact OD1-N 2.85Å; N25-E28 HydrophobicContact CB-CB 4.4Å; N25-E28 HydrophobicContact CB-CG 3.93Å; N25-E28 PolarHBondContact ND2-OE1 2.68Å; N25-E28 WeakPolarHBondContact O-CB 3.39Å; N25-E28 PolarHBondContact O-N 3.08Å
26	L	51.2	Low	60.4	Low	124 Å²	124	105.2 Å²	105.2	65%	0.649	56%	0.558	S	S	*	*	H	α-helix	trans	-59.3	-22.9	-176.1	-70.3	169.9	0	0	0	111.7	V24 E28 V29 Y30	V24-L26 VanDerWaalsContact C-N 3.33Å; V24-L26 PolarHBondContact O-N 3.15Å; L26-E28 PolarHBondContact O-N 2.99Å; L26-V29 PolarHBondContact O-N 2.95Å; L26-Y30 PolarHBondContact O-N 2.84Å
27	Q	51.6	Low	63.3	Low	159 Å²	159	96.1 Å²	96.1	74%	0.743	52%	0.516	S	S	*	.	H	α-helix	trans	-63.4	-23.9	171.3	-155.5	75.9	22.8	0	0	113.3	N25	N25-Q27 PolarHBondContact O-N 2.93Å; N25-Q27 WeakPolarHBondContact OD1-CB 3.34Å; N25-Q27 PolarHBondContact OD1-N 2.85Å
28	E	58.2	Low	66.1	Low	154 Å²	154	85.7 Å²	85.7	72%	0.72	48%	0.478	S	S	*	.	H	α-helix	trans	-81.6	-23.3	176	-70.3	170.7	-161.2	0	0	112.4	N25 L26	N25-E28 HydrophobicContact CB-CB 4.4Å; N25-E28 HydrophobicContact CB-CG 3.93Å; N25-E28 PolarHBondContact ND2-OE1 2.68Å; N25-E28 WeakPolarHBondContact O-CB 3.39Å; N25-E28 PolarHBondContact O-N 3.08Å; L26-E28 PolarHBondContact O-N 2.99Å
29	V	64.5	Low	68.9	Low	114 Å²	114	84.9 Å²	84.9	69%	0.691	47%	0.47	S	S	*	.	H	α-helix	trans	-87.9	-29.9	-177.9	-174.9	0	0	0	0	111.7	V24 L26	V24-V29 HydrophobicContact CG1-CG2 4.44Å; L26-V29 PolarHBondContact O-N 2.95Å
30	Y	77.6	Confident	71.6	Confident	103 Å²	103	83.8 Å²	83.8	40%	0.404	46%	0.455	S	S	.	.			trans	-123.9	123.8	-179.3	-176.1	-98.9	0	0	0	112.6	L26 E32 R35	L26-Y30 PolarHBondContact O-N 2.84Å; Y30-E32 HydrophobicContact CE1-CB 3.97Å; Y30-E32 PolarHBondContact OH-OE2 2.8Å; Y30-R35 VanDerWaalsContact OH-CD 3.31Å; Y30-R35 WeakPolarHBondContact OH-CD 3.27Å
31	N	85.6	Confident	74	Confident	72 Å²	72	78.7 Å²	78.7	39%	0.385	41%	0.413	S	S	.	.			trans	-122.4	104.3	176	-173	-32.2	0	0	0	110.7	R33 H34 R35	N31-R33 PolarHBondContact O-N 2.93Å; N31-R33 WeakPolarHBondContact OD1-CA 3.35Å; N31-R33 WeakPolarHBondContact OD1-CB 3.19Å; N31-R33 PolarHBondContact OD1-N 2.93Å; N31-H34 HydrophobicContact CB-CB 4.21Å; N31-H34 WeakPolarHBondContact CB-ND1 3.34Å; N31-H34 PolarHBondContact ND2-CE1 2.9Å; N31-H34 VanDerWaalsContact ND2-CE1 3.34Å; N31-H34 PolarHBondContact ND2-ND1 2.72Å; N31-H34 WeakPolarHBondContact O-CB 3.35Å; N31-H34 PolarHBondContact O-N 3.36Å; N31-H34 VanDerWaalsContact O-N 3.12Å; N31-H34 PolarHBondContact OD1-N 3.43Å; N31-R35 PolarHBondContact O-N 3.32Å
32	E	88.5	Confident	76.3	Confident	68 Å²	68	77 Å²	77	32%	0.318	39%	0.392	S	S	.	.	H	α-helix	trans	-58.8	-32.8	-179.8	178.6	58.9	-169.5	0	0	112.7	Y30 R35 L36	Y30-E32 HydrophobicContact CE1-CB 3.97Å; Y30-E32 PolarHBondContact OH-OE2 2.8Å; E32-R35 WeakPolarHBondContact O-CB 3.43Å; E32-R35 PolarHBondContact O-N 3.45Å; E32-R35 IonicContact OE1-CZ 3.71Å; E32-R35 VanDerWaalsContact OE1-CZ 3.3Å; E32-R35 IonicContact OE1-NE 3.03Å; E32-R35 PolarHBondContact OE1-NE 2.82Å; E32-R35 VanDerWaalsContact OE1-NE 3.13Å; E32-R35 IonicContact OE1-NH2 2.97Å; E32-R35 PolarHBondContact OE1-NH2 3.47Å; E32-R35 IonicContact OE2-CZ 4Å; E32-R35 IonicContact OE2-NE 3.69Å; E32-R35 PolarHBondContact OE2-NE 3.43Å; E32-R35 IonicContact OE2-NH2 3.62Å; E32-L36 HydrophobicContact CG-CD1 4.31Å; E32-L36 WeakPolarHBondContact O-CG 3.47Å; E32-L36 PolarHBondContact O-N 2.85Å
33	R	91.6	Very high	78.4	Confident	135 Å²	135	76 Å²	76	51%	0.509	39%	0.394	S	S	.	.	H	α-helix	trans	-70.4	-35.2	179.4	-55.3	-171.6	-179.1	169.5	1.8	112	N31 R35 L36 A37 I58	N31-R33 PolarHBondContact O-N 2.93Å; N31-R33 WeakPolarHBondContact OD1-CA 3.35Å; N31-R33 WeakPolarHBondContact OD1-CB 3.19Å; N31-R33 PolarHBondContact OD1-N 2.93Å; R33-R35 VanDerWaalsContact C-N 3.34Å; R33-L36 PolarHBondContact O-N 3.47Å; R33-A37 WeakPolarHBondContact O-CB 3.26Å; R33-A37 PolarHBondContact O-N 3.48Å; R33-I58 HydrophobicContact CB-CD1 3.49Å; R33-I58 VanDerWaalsContact CB-CD1 3.49Å; R33-I58 HydrophobicContact CB-CG1 4.45Å; R33-I58 HydrophobicContact CG-CD1 4.42Å
34	H	91.9	Very high	80.4	Confident	59 Å²	59	73.9 Å²	73.9	27%	0.273	38%	0.38	S	S	.	.	H	α-helix	trans	-65	-39.8	172.3	-67.1	157.6	0	0	0	111.5	N31 A37 L38 F61	N31-H34 HydrophobicContact CB-CB 4.21Å; N31-H34 WeakPolarHBondContact CB-ND1 3.34Å; N31-H34 PolarHBondContact ND2-CE1 2.9Å; N31-H34 VanDerWaalsContact ND2-CE1 3.34Å; N31-H34 PolarHBondContact ND2-ND1 2.72Å; N31-H34 WeakPolarHBondContact O-CB 3.35Å; N31-H34 PolarHBondContact O-N 3.36Å; N31-H34 VanDerWaalsContact O-N 3.12Å; N31-H34 PolarHBondContact OD1-N 3.43Å; H34-A37 PolarHBondContact O-N 2.69Å; H34-L38 PolarHBondContact O-N 2.92Å; H34-F61 HydrophobicContact CB-CE1 4.12Å; H34-F61 HydrophobicContact CB-CE2 4.25Å; H34-F61 HydrophobicContact CB-CZ 3.84Å; H34-F61 AromaticContact CD2-CD1 3.38Å; H34-F61 WeakPolarHBondContact CD2-CD1 3.32Å; H34-F61 AromaticContact CD2-CE1 3.42Å; H34-F61 VanDerWaalsContact CD2-CE1 3.42Å; H34-F61 WeakPolarHBondContact CD2-CE1 3.37Å; H34-F61 AromaticContact CD2-CG 3.95Å; H34-F61 AromaticContact CD2-CZ 3.99Å; H34-F61 AromaticContact CG-CE1 3.96Å; H34-F61 AromaticContact NE2-CD1 3.75Å
35	R	91.1	Very high	82.3	Confident	27 Å²	27	69.3 Å²	69.3	10%	0.102	36%	0.355	C	S	.	.	H	α-helix	trans	-59.4	-49.6	174.1	-180	-173.5	83.6	66	13.6	111.4	Y30 N31 E32 R33 A37 L38 E39 Y229	Y30-R35 VanDerWaalsContact OH-CD 3.31Å; Y30-R35 WeakPolarHBondContact OH-CD 3.27Å; N31-R35 PolarHBondContact O-N 3.32Å; E32-R35 WeakPolarHBondContact O-CB 3.43Å; E32-R35 PolarHBondContact O-N 3.45Å; E32-R35 IonicContact OE1-CZ 3.71Å; E32-R35 VanDerWaalsContact OE1-CZ 3.3Å; E32-R35 IonicContact OE1-NE 3.03Å; E32-R35 PolarHBondContact OE1-NE 2.82Å; E32-R35 VanDerWaalsContact OE1-NE 3.13Å; E32-R35 IonicContact OE1-NH2 2.97Å; E32-R35 PolarHBondContact OE1-NH2 3.47Å; E32-R35 IonicContact OE2-CZ 4Å; E32-R35 IonicContact OE2-NE 3.69Å; E32-R35 PolarHBondContact OE2-NE 3.43Å; E32-R35 IonicContact OE2-NH2 3.62Å; R33-R35 VanDerWaalsContact C-N 3.34Å; R35-A37 VanDerWaalsContact C-N 3.35Å; R35-A37 PolarHBondContact O-N 3.17Å; R35-L38 WeakPolarHBondContact O-CB 3.12Å; R35-L38 PolarHBondContact O-N 3.2Å; R35-L38 VanDerWaalsContact O-N 3.12Å; R35-E39 IonicContact CZ-OE1 3.65Å; R35-E39 IonicContact CZ-OE2 3.34Å; R35-E39 IonicContact NH1-OE1 2.65Å; R35-E39 PolarHBondContact NH1-OE1 3.15Å; R35-E39 IonicContact NH1-OE2 3.82Å; R35-E39 PolarHBondContact NH1-OE2 3.34Å; R35-E39 IonicContact NH2-OE2 2.74Å; R35-E39 PolarHBondContact O-N 3.38Å; R35-Y229 VanDerWaalsContact CB-OH 3.24Å; R35-Y229 WeakPolarHBondContact CB-OH 3.41Å; R35-Y229 HydrophobicContact CG-CE1 4.32Å; R35-Y229 WeakPolarHBondContact CG-OH 3.49Å
36	L	92.6	Very high	84.2	Confident	59 Å²	59	67.3 Å²	67.3	31%	0.309	35%	0.345	S	S	.	.	H	α-helix	trans	-62.5	-41.2	179.5	-71.3	170.9	0	0	0	112.2	E32 R33 L38 E39 E40 F52	E32-L36 HydrophobicContact CG-CD1 4.31Å; E32-L36 WeakPolarHBondContact O-CG 3.47Å; E32-L36 PolarHBondContact O-N 2.85Å; R33-L36 PolarHBondContact O-N 3.47Å; L36-L38 PolarHBondContact O-N 3.11Å; L36-E39 WeakPolarHBondContact O-CB 3.43Å; L36-E39 PolarHBondContact O-N 2.86Å; L36-E39 VanDerWaalsContact O-N 3.1Å; L36-E40 PolarHBondContact O-N 3.28Å; L36-F52 HydrophobicContact CB-CE1 4.11Å; L36-F52 HydrophobicContact CB-CE2 4.09Å; L36-F52 HydrophobicContact CB-CZ 3.46Å; L36-F52 VanDerWaalsContact CB-CZ 3.46Å; L36-F52 HydrophobicContact CD1-CZ 4.31Å
37	A	94.3	Very high	86.4	Confident	0 Å²	0	67.5 Å²	67.5	0%	0	34%	0.343	C	S	.	.	H	α-helix	trans	-58.3	-40.7	173.7	0	0	0	0	0	111.2	R33 H34 R35 E39 E40 L41 F49 F52 L53 F61	R33-A37 WeakPolarHBondContact O-CB 3.26Å; R33-A37 PolarHBondContact O-N 3.48Å; H34-A37 PolarHBondContact O-N 2.69Å; R35-A37 VanDerWaalsContact C-N 3.35Å; R35-A37 PolarHBondContact O-N 3.17Å; A37-E39 VanDerWaalsContact C-N 3.31Å; A37-E39 PolarHBondContact O-N 2.89Å; A37-E40 PolarHBondContact O-N 2.94Å; A37-L41 PolarHBondContact O-N 2.88Å; A37-F49 HydrophobicContact CB-CD2 3.94Å; A37-F49 HydrophobicContact CB-CE2 3.84Å; A37-F49 WeakPolarHBondContact O-CD2 3.25Å; A37-F52 HydrophobicContact CB-CD1 3.6Å; A37-F52 HydrophobicContact CB-CE1 3.77Å; A37-L53 HydrophobicContact CB-CD2 4.15Å; A37-F61 HydrophobicContact CB-CE1 4.14Å; A37-F61 HydrophobicContact CB-CZ 4.48Å
38	L	93.2	Very high	88.5	Confident	20 Å²	20	63.3 Å²	63.3	11%	0.105	33%	0.325	C	S	.	.	H	α-helix	trans	-65.9	-33	177.2	-160.9	65.6	0	0	0	112.7	H34 R35 L36 L41 L42 L62 I70 Y229 M231 I237	H34-L38 PolarHBondContact O-N 2.92Å; R35-L38 WeakPolarHBondContact O-CB 3.12Å; R35-L38 PolarHBondContact O-N 3.2Å; R35-L38 VanDerWaalsContact O-N 3.12Å; L36-L38 PolarHBondContact O-N 3.11Å; L38-L41 HydrophobicContact CD1-CD2 4.1Å; L38-L41 WeakPolarHBondContact O-CB 3.46Å; L38-L41 PolarHBondContact O-N 2.85Å; L38-L42 PolarHBondContact O-N 3.18Å; L38-L42 VanDerWaalsContact O-N 3.15Å; L38-L62 HydrophobicContact CD1-CD1 4.12Å; L38-I70 HydrophobicContact CD1-CD1 4.26Å; L38-I70 HydrophobicContact CD1-CG2 3.97Å; L38-Y229 HydrophobicContact CD2-CD1 3.95Å; L38-Y229 HydrophobicContact CD2-CE1 3.82Å; L38-M231 HydrophobicContact CB-CE 4.35Å; L38-M231 HydrophobicContact CD2-CE 3.66Å; L38-M231 HydrophobicContact CG-CE 3.59Å; L38-I237 HydrophobicContact CD2-CD1 3.91Å; L38-I237 HydrophobicContact CG-CD1 4.31Å
39	E	91.7	Very high	90.3	Very high	30 Å²	30	56 Å²	56	14%	0.14	29%	0.291	C	S	.	.	H	α-helix	trans	-67.9	-43.1	173.5	-68.9	-169.3	147.9	0	0	112.3	R35 L36 A37 L41 L42 S43 M231 R232	R35-E39 IonicContact CZ-OE1 3.65Å; R35-E39 IonicContact CZ-OE2 3.34Å; R35-E39 IonicContact NH1-OE1 2.65Å; R35-E39 PolarHBondContact NH1-OE1 3.15Å; R35-E39 IonicContact NH1-OE2 3.82Å; R35-E39 PolarHBondContact NH1-OE2 3.34Å; R35-E39 IonicContact NH2-OE2 2.74Å; R35-E39 PolarHBondContact O-N 3.38Å; L36-E39 WeakPolarHBondContact O-CB 3.43Å; L36-E39 PolarHBondContact O-N 2.86Å; L36-E39 VanDerWaalsContact O-N 3.1Å; A37-E39 VanDerWaalsContact C-N 3.31Å; A37-E39 PolarHBondContact O-N 2.89Å; E39-L41 VanDerWaalsContact C-N 3.28Å; E39-L41 PolarHBondContact O-N 2.9Å; E39-L42 PolarHBondContact O-N 3.18Å; E39-S43 WeakPolarHBondContact O-CB 3.47Å; E39-S43 PolarHBondContact O-N 3.28Å; E39-S43 PolarHBondContact O-OG 2.82Å; E39-M231 HydrophobicContact CG-CB 4.29Å; E39-M231 HydrophobicContact CG-CG 4.34Å; E39-M231 HydrophobicContact CG-SD 3.99Å; E39-R232 WeakPolarHBondContact OE1-CB 3.4Å; E39-R232 PolarHBondContact OE1-N 2.94Å
40	E	93.9	Very high	91.8	Very high	65 Å²	65	53.2 Å²	53.2	30%	0.304	27%	0.272	S	S	.	.	H	α-helix	trans	-60.6	-38.9	172	-70.2	-62.9	153.7	0	0	111.5	L36 A37 L42 G44 G45 F52	L36-E40 PolarHBondContact O-N 3.28Å; A37-E40 PolarHBondContact O-N 2.94Å; E40-L42 PolarHBondContact O-N 3.45Å; E40-G44 CarbonylContact O-C 3.55Å; E40-G44 WeakPolarHBondContact O-CA 3.33Å; E40-G44 PolarHBondContact O-N 2.76Å; E40-G45 PolarHBondContact O-N 2.97Å; E40-F52 HydrophobicContact CB-CB 4.35Å; E40-F52 HydrophobicContact CG-CB 4.09Å; E40-F52 HydrophobicContact CG-CD2 3.75Å; E40-F52 HydrophobicContact CG-CE2 4.46Å; E40-F52 HydrophobicContact CG-CG 4.04Å
41	L	94.2	Very high	92.7	Very high	1 Å²	1	51.9 Å²	51.9	1%	0.005	27%	0.272	C	S	.	.	H	α-helix	trans	-60.9	-43	176.7	-177.8	63	0	0	0	112.6	A37 L38 E39 G45 V46 F49 L62 I67 I70 R71	A37-L41 PolarHBondContact O-N 2.88Å; L38-L41 HydrophobicContact CD1-CD2 4.1Å; L38-L41 WeakPolarHBondContact O-CB 3.46Å; L38-L41 PolarHBondContact O-N 2.85Å; E39-L41 VanDerWaalsContact C-N 3.28Å; E39-L41 PolarHBondContact O-N 2.9Å; L41-G45 WeakPolarHBondContact O-CA 3.46Å; L41-G45 PolarHBondContact O-N 3.5Å; L41-G45 VanDerWaalsContact O-N 3.17Å; L41-V46 HydrophobicContact CD1-CG2 4.1Å; L41-F49 HydrophobicContact CB-CB 3.9Å; L41-F49 HydrophobicContact CB-CD2 4.03Å; L41-F49 HydrophobicContact CB-CG 4.14Å; L41-F49 HydrophobicContact CD1-CB 3.72Å; L41-F49 HydrophobicContact CD1-CD1 4.3Å; L41-F49 HydrophobicContact CD1-CG 3.98Å; L41-F49 HydrophobicContact CG-CB 4.42Å; L41-L62 HydrophobicContact CD2-CD1 4.17Å; L41-I67 HydrophobicContact CD1-CG2 3.91Å; L41-I67 HydrophobicContact CD2-CG1 4.38Å; L41-I67 HydrophobicContact CD2-CG2 4.31Å; L41-I70 HydrophobicContact CD2-CG2 4.4Å; L41-R71 HydrophobicContact CD1-CG 4.37Å; L41-R71 HydrophobicContact CD2-CG 4.44Å; L41-R71 HydrophobicContact CG-CG 4.16Å
42	L	91.7	Very high	93.3	Very high	47 Å²	47	49.2 Å²	49.2	25%	0.246	26%	0.257	C	S	.	.	H	α-helix	trans	-81.1	-32.6	-177.9	-69.5	-156.1	0	0	0	113.5	L38 E39 E40 I70 R71 A74 M231 A235 I237	L38-L42 PolarHBondContact O-N 3.18Å; L38-L42 VanDerWaalsContact O-N 3.15Å; E39-L42 PolarHBondContact O-N 3.18Å; E40-L42 PolarHBondContact O-N 3.45Å; L42-I70 HydrophobicContact CD2-CG2 4Å; L42-R71 HydrophobicContact CD2-CG 4.32Å; L42-A74 HydrophobicContact CD1-CB 3.51Å; L42-A74 HydrophobicContact CD2-CB 3.72Å; L42-A74 HydrophobicContact CG-CB 4.3Å; L42-M231 HydrophobicContact CB-SD 4.24Å; L42-M231 HydrophobicContact CD1-CE 3.18Å; L42-M231 HydrophobicContact CD1-SD 3.43Å; L42-M231 WeakPolarHBondContact CD1-SD 3.41Å; L42-M231 HydrophobicContact CG-CE 3.65Å; L42-M231 HydrophobicContact CG-SD 3.95Å; L42-A235 HydrophobicContact CD1-CB 4.34Å; L42-I237 HydrophobicContact CD1-CD1 4.03Å; L42-I237 HydrophobicContact CD1-CG1 4.1Å
43	S	89.1	Confident	93.7	Very high	93 Å²	93	46.4 Å²	46.4	65%	0.65	24%	0.244	S	C	*	.	H	α-helix	trans	-85.5	-46.1	-178.4	57.9	0	0	0	0	112.5	E39	E39-S43 WeakPolarHBondContact O-CB 3.47Å; E39-S43 PolarHBondContact O-N 3.28Å; E39-S43 PolarHBondContact O-OG 2.82Å
44	G	87.8	Confident	93.9	Very high	32 Å²	32	46.7 Å²	46.7	33%	0.33	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-108.2	-10.1	-172.6	0	0	0	0	0	114.9	E40 N48	E40-G44 CarbonylContact O-C 3.55Å; E40-G44 WeakPolarHBondContact O-CA 3.33Å; E40-G44 PolarHBondContact O-N 2.76Å; G44-N48 WeakPolarHBondContact CA-ND2 3.23Å
45	G	92.6	Very high	94.1	Very high	13 Å²	13	52.4 Å²	52.4	13%	0.134	27%	0.268	C	S	.	.	H	α-helix	trans	85.8	-168.9	179.5	0	0	0	0	0	113.6	E40 L41 E47 N48 F49	E40-G45 PolarHBondContact O-N 2.97Å; L41-G45 WeakPolarHBondContact O-CA 3.46Å; L41-G45 PolarHBondContact O-N 3.5Å; L41-G45 VanDerWaalsContact O-N 3.17Å; G45-E47 PolarHBondContact O-N 3.03Å; G45-N48 PolarHBondContact O-N 2.88Å; G45-F49 PolarHBondContact O-N 3.34Å; G45-F49 VanDerWaalsContact O-N 3.11Å
46	V	95.6	Very high	94.4	Very high	39 Å²	39	54.4 Å²	54.4	24%	0.236	28%	0.279	C	S	.	.	H	α-helix	trans	-67.1	-38.6	-169.9	-175.7	0	0	0	0	112	L41 F49 L50 I67	L41-V46 HydrophobicContact CD1-CG2 4.1Å; V46-F49 WeakPolarHBondContact O-CB 3.48Å; V46-F49 PolarHBondContact O-N 2.97Å; V46-L50 HydrophobicContact CG1-CD1 4.1Å; V46-L50 HydrophobicContact CG1-CG 4.29Å; V46-L50 WeakPolarHBondContact O-CG 3.21Å; V46-L50 PolarHBondContact O-N 3.32Å; V46-I67 HydrophobicContact CG2-CG2 3.73Å
47	E	96.3	Very high	94.5	Very high	128 Å²	128	60.7 Å²	60.7	60%	0.598	30%	0.304	S	S	*	.	H	α-helix	trans	-63	-47.4	179.6	-57	-53.7	148.4	0	0	111.4	G45 F49 L50 D51	G45-E47 PolarHBondContact O-N 3.03Å; E47-F49 VanDerWaalsContact C-N 3.3Å; E47-F49 PolarHBondContact O-N 3.07Å; E47-L50 PolarHBondContact O-N 3.43Å; E47-D51 WeakPolarHBondContact O-CB 3.38Å; E47-D51 PolarHBondContact O-N 3.1Å
48	N	95.6	Very high	94.5	Very high	70 Å²	70	61.6 Å²	61.6	37%	0.374	31%	0.308	S	S	.	.	H	α-helix	trans	-62.3	-38.6	176.8	-73.7	25.3	0	0	0	112.1	G44 G45 D51 F52	G44-N48 WeakPolarHBondContact CA-ND2 3.23Å; G45-N48 PolarHBondContact O-N 2.88Å; N48-D51 PolarHBondContact O-N 3.15Å; N48-F52 VanDerWaalsContact O-CB 3.26Å; N48-F52 WeakPolarHBondContact O-CB 3.37Å; N48-F52 PolarHBondContact O-N 3.4Å
49	F	96.4	Very high	94.6	Very high	0 Å²	0	65.6 Å²	65.6	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-59.1	-50.8	172.5	167.8	-106.3	0	0	0	111.7	A37 L41 G45 V46 E47 D51 F52 L53 N60 F61 L62 I67	A37-F49 HydrophobicContact CB-CD2 3.94Å; A37-F49 HydrophobicContact CB-CE2 3.84Å; A37-F49 WeakPolarHBondContact O-CD2 3.25Å; L41-F49 HydrophobicContact CB-CB 3.9Å; L41-F49 HydrophobicContact CB-CD2 4.03Å; L41-F49 HydrophobicContact CB-CG 4.14Å; L41-F49 HydrophobicContact CD1-CB 3.72Å; L41-F49 HydrophobicContact CD1-CD1 4.3Å; L41-F49 HydrophobicContact CD1-CG 3.98Å; L41-F49 HydrophobicContact CG-CB 4.42Å; G45-F49 PolarHBondContact O-N 3.34Å; G45-F49 VanDerWaalsContact O-N 3.11Å; V46-F49 WeakPolarHBondContact O-CB 3.48Å; V46-F49 PolarHBondContact O-N 2.97Å; E47-F49 VanDerWaalsContact C-N 3.3Å; E47-F49 PolarHBondContact O-N 3.07Å; F49-D51 VanDerWaalsContact C-N 3.33Å; F49-D51 PolarHBondContact O-N 2.92Å; F49-F52 WeakPolarHBondContact O-CB 3.44Å; F49-F52 PolarHBondContact O-N 3.34Å; F49-L53 HydrophobicContact CD1-CD1 4.16Å; F49-L53 HydrophobicContact CD2-CG 4.46Å; F49-L53 HydrophobicContact CE1-CD1 3.58Å; F49-L53 HydrophobicContact CE1-CG 4.43Å; F49-L53 HydrophobicContact CE2-CD1 4.06Å; F49-L53 HydrophobicContact CE2-CD2 4.23Å; F49-L53 HydrophobicContact CE2-CG 4.18Å; F49-L53 HydrophobicContact CZ-CD1 3.54Å; F49-L53 HydrophobicContact CZ-CD2 4.4Å; F49-L53 HydrophobicContact CZ-CG 4.17Å; F49-L53 WeakPolarHBondContact O-CG 3.46Å; F49-L53 PolarHBondContact O-N 3.25Å; F49-N60 WeakPolarHBondContact CE1-OD1 3.34Å; F49-F61 HydrophobicContact CE2-CE1 4.01Å; F49-F61 HydrophobicContact CE2-CZ 4.26Å; F49-F61 HydrophobicContact CZ-CE1 4.27Å; F49-L62 HydrophobicContact CE2-CD1 4.31Å; F49-L62 HydrophobicContact CZ-CB 4.46Å; F49-L62 HydrophobicContact CZ-CD1 4.08Å; F49-L62 HydrophobicContact CZ-CG 4.42Å; F49-I67 HydrophobicContact CD1-CD1 4.33Å; F49-I67 HydrophobicContact CE1-CD1 3.88Å; F49-I67 HydrophobicContact CE1-CG1 4.5Å
50	L	96.4	Very high	94.7	Very high	57 Å²	57	68 Å²	68	30%	0.298	35%	0.349	S	S	.	.	H	α-helix	trans	-64.3	-38.6	179.8	-67.8	176.3	0	0	0	112.1	V46 E47 L53 K54	V46-L50 HydrophobicContact CG1-CD1 4.1Å; V46-L50 HydrophobicContact CG1-CG 4.29Å; V46-L50 WeakPolarHBondContact O-CG 3.21Å; V46-L50 PolarHBondContact O-N 3.32Å; E47-L50 PolarHBondContact O-N 3.43Å; L50-L53 HydrophobicContact CD2-CD1 4.41Å; L50-L53 PolarHBondContact O-N 2.98Å; L50-K54 WeakPolarHBondContact O-CG 3.4Å; L50-K54 PolarHBondContact O-N 2.9Å
51	D	97.1	Very high	94.7	Very high	74 Å²	74	68.3 Å²	68.3	40%	0.396	35%	0.35	S	S	.	.	H	α-helix	trans	-69.6	-36.8	176.8	-75.6	-11.6	0	0	0	112.1	E47 N48 F49 K54 R55	E47-D51 WeakPolarHBondContact O-CB 3.38Å; E47-D51 PolarHBondContact O-N 3.1Å; N48-D51 PolarHBondContact O-N 3.15Å; F49-D51 VanDerWaalsContact C-N 3.33Å; F49-D51 PolarHBondContact O-N 2.92Å; D51-K54 PolarHBondContact O-N 3.21Å; D51-K54 IonicContact OD1-NZ 3.58Å; D51-K54 PolarHBondContact OD1-NZ 3.36Å; D51-R55 WeakPolarHBondContact O-CB 3.39Å; D51-R55 VanDerWaalsContact O-CG 3.25Å; D51-R55 WeakPolarHBondContact O-CG 3.33Å; D51-R55 PolarHBondContact O-N 2.82Å
52	F	96.9	Very high	94.8	Very high	16 Å²	16	69.2 Å²	69.2	7%	0.07	35%	0.354	C	S	.	.	H	α-helix	trans	-61	-46.4	170.7	-176.7	-87.3	0	0	0	111.4	L36 A37 E40 N48 F49 K54 R55 E56 I58	L36-F52 HydrophobicContact CB-CE1 4.11Å; L36-F52 HydrophobicContact CB-CE2 4.09Å; L36-F52 HydrophobicContact CB-CZ 3.46Å; L36-F52 VanDerWaalsContact CB-CZ 3.46Å; L36-F52 HydrophobicContact CD1-CZ 4.31Å; A37-F52 HydrophobicContact CB-CD1 3.6Å; A37-F52 HydrophobicContact CB-CE1 3.77Å; E40-F52 HydrophobicContact CB-CB 4.35Å; E40-F52 HydrophobicContact CG-CB 4.09Å; E40-F52 HydrophobicContact CG-CD2 3.75Å; E40-F52 HydrophobicContact CG-CE2 4.46Å; E40-F52 HydrophobicContact CG-CG 4.04Å; N48-F52 VanDerWaalsContact O-CB 3.26Å; N48-F52 WeakPolarHBondContact O-CB 3.37Å; N48-F52 PolarHBondContact O-N 3.4Å; F49-F52 WeakPolarHBondContact O-CB 3.44Å; F49-F52 PolarHBondContact O-N 3.34Å; F52-K54 VanDerWaalsContact C-N 3.33Å; F52-K54 PolarHBondContact O-N 3.36Å; F52-R55 PolarHBondContact O-N 3.02Å; F52-E56 HydrophobicContact CD1-CG 4.17Å; F52-E56 HydrophobicContact CD2-CG 4.39Å; F52-E56 HydrophobicContact CE1-CB 4.27Å; F52-E56 HydrophobicContact CE1-CG 3.71Å; F52-E56 HydrophobicContact CE2-CG 3.96Å; F52-E56 HydrophobicContact CG-CG 4.49Å; F52-E56 HydrophobicContact CZ-CG 3.59Å; F52-E56 WeakPolarHBondContact O-CB 3.41Å; F52-E56 PolarHBondContact O-N 3.03Å; F52-I58 HydrophobicContact CD1-CD1 4.5Å; F52-I58 HydrophobicContact CE1-CD1 4Å
53	L	96.8	Very high	95	Very high	9 Å²	9	69.5 Å²	69.5	5%	0.047	36%	0.361	C	S	.	.	H	α-helix	trans	-58.8	-42.9	176.6	-69.1	-179.3	0	0	0	112	A37 F49 L50 K57 I58 N60 F61	A37-L53 HydrophobicContact CB-CD2 4.15Å; F49-L53 HydrophobicContact CD1-CD1 4.16Å; F49-L53 HydrophobicContact CD2-CG 4.46Å; F49-L53 HydrophobicContact CE1-CD1 3.58Å; F49-L53 HydrophobicContact CE1-CG 4.43Å; F49-L53 HydrophobicContact CE2-CD1 4.06Å; F49-L53 HydrophobicContact CE2-CD2 4.23Å; F49-L53 HydrophobicContact CE2-CG 4.18Å; F49-L53 HydrophobicContact CZ-CD1 3.54Å; F49-L53 HydrophobicContact CZ-CD2 4.4Å; F49-L53 HydrophobicContact CZ-CG 4.17Å; F49-L53 WeakPolarHBondContact O-CG 3.46Å; F49-L53 PolarHBondContact O-N 3.25Å; L50-L53 HydrophobicContact CD2-CD1 4.41Å; L50-L53 PolarHBondContact O-N 2.98Å; L53-K57 WeakPolarHBondContact O-CA 3.47Å; L53-K57 PolarHBondContact O-N 2.92Å; L53-I58 HydrophobicContact CD2-CB 3.73Å; L53-I58 HydrophobicContact CD2-CD1 4.33Å; L53-I58 HydrophobicContact CD2-CG2 3.86Å; L53-I58 PolarHBondContact O-N 3.17Å; L53-N60 HydrophobicContact CD1-CB 3.89Å; L53-F61 HydrophobicContact CD2-CD1 4.35Å; L53-F61 HydrophobicContact CD2-CE1 4.2Å
54	K	96.8	Very high	95.3	Very high	141 Å²	141	71.2 Å²	71.2	61%	0.613	36%	0.362	S	S	*	.	H	α-helix	trans	-63.2	-45.9	175.6	-69.3	169.9	-157.7	155.5	0	111.7	L50 D51 F52 K57	L50-K54 WeakPolarHBondContact O-CG 3.4Å; L50-K54 PolarHBondContact O-N 2.9Å; D51-K54 PolarHBondContact O-N 3.21Å; D51-K54 IonicContact OD1-NZ 3.58Å; D51-K54 PolarHBondContact OD1-NZ 3.36Å; F52-K54 VanDerWaalsContact C-N 3.33Å; F52-K54 PolarHBondContact O-N 3.36Å; K54-K57 PolarHBondContact O-N 3.39Å
55	R	96.8	Very high	95.6	Very high	180 Å²	180	74.5 Å²	74.5	68%	0.679	37%	0.372	S	S	*	.	H	α-helix	trans	-62.5	-46	-179.4	-77.2	174.7	54.2	-159.6	-10.7	112.2	D51 F52 K57	D51-R55 WeakPolarHBondContact O-CB 3.39Å; D51-R55 VanDerWaalsContact O-CG 3.25Å; D51-R55 WeakPolarHBondContact O-CG 3.33Å; D51-R55 PolarHBondContact O-N 2.82Å; F52-R55 PolarHBondContact O-N 3.02Å; R55-K57 VanDerWaalsContact C-N 3.3Å
56	E	95.8	Very high	95.7	Very high	68 Å²	68	77.5 Å²	77.5	32%	0.318	38%	0.383	S	S	.	.	H	α-helix	trans	-86.3	-0.6	-178.5	-66.4	-60.6	137.8	0	0	113.5	F52 I58	F52-E56 HydrophobicContact CD1-CG 4.17Å; F52-E56 HydrophobicContact CD2-CG 4.39Å; F52-E56 HydrophobicContact CE1-CB 4.27Å; F52-E56 HydrophobicContact CE1-CG 3.71Å; F52-E56 HydrophobicContact CE2-CG 3.96Å; F52-E56 HydrophobicContact CG-CG 4.49Å; F52-E56 HydrophobicContact CZ-CG 3.59Å; F52-E56 WeakPolarHBondContact O-CB 3.41Å; F52-E56 PolarHBondContact O-N 3.03Å; E56-I58 VanDerWaalsContact C-N 3.33Å; E56-I58 HydrophobicContact CB-CD1 3.56Å; E56-I58 HydrophobicContact CB-CG1 3.74Å; E56-I58 HydrophobicContact CG-CD1 4.43Å; E56-I58 PolarHBondContact O-N 2.97Å
57	K	95.4	Very high	95.6	Very high	191 Å²	191	76 Å²	76	83%	0.83	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	55	44.8	-178.8	-56.3	179.8	-178.9	179	0	112.9	L53 K54 R55	L53-K57 WeakPolarHBondContact O-CA 3.47Å; L53-K57 PolarHBondContact O-N 2.92Å; K54-K57 PolarHBondContact O-N 3.39Å; R55-K57 VanDerWaalsContact C-N 3.3Å
58	I	95.1	Very high	95.5	Very high	20 Å²	20	76.5 Å²	76.5	10%	0.103	38%	0.376	C	S	.	.	P	Polyproline II helix	trans	-102.3	132.5	179.7	-51.6	165.9	0	0	0	108.2	R33 F52 L53 E56	R33-I58 HydrophobicContact CB-CD1 3.49Å; R33-I58 VanDerWaalsContact CB-CD1 3.49Å; R33-I58 HydrophobicContact CB-CG1 4.45Å; R33-I58 HydrophobicContact CG-CD1 4.42Å; F52-I58 HydrophobicContact CD1-CD1 4.5Å; F52-I58 HydrophobicContact CE1-CD1 4Å; L53-I58 HydrophobicContact CD2-CB 3.73Å; L53-I58 HydrophobicContact CD2-CD1 4.33Å; L53-I58 HydrophobicContact CD2-CG2 3.86Å; L53-I58 PolarHBondContact O-N 3.17Å; E56-I58 VanDerWaalsContact C-N 3.33Å; E56-I58 HydrophobicContact CB-CD1 3.56Å; E56-I58 HydrophobicContact CB-CG1 3.74Å; E56-I58 HydrophobicContact CG-CD1 4.43Å; E56-I58 PolarHBondContact O-N 2.97Å
59	P	94.2	Very high	95.4	Very high	103 Å²	103	79 Å²	79	67%	0.669	38%	0.38	S	S	*	.	P	Polyproline II helix	trans	-64.6	147.1	171.5	28.2	-34	0	0	0	110.4	F61	P59-F61 PolarHBondContact O-N 2.92Å; P59-F61 VanDerWaalsContact O-N 3.14Å
60	N	94.7	Very high	95.2	Very high	80 Å²	80	80.4 Å²	80.4	43%	0.428	39%	0.387	S	S	.	.	P	Polyproline II helix	trans	-63.5	120.7	173.8	-174.3	12.9	0	0	0	109.7	F49 L53 L62	F49-N60 WeakPolarHBondContact CE1-OD1 3.34Å; L53-N60 HydrophobicContact CD1-CB 3.89Å; N60-L62 PolarHBondContact ND2-O 3.29Å; N60-L62 VanDerWaalsContact ND2-O 3.1Å; N60-L62 PolarHBondContact OD1-N 3.37Å; N60-L62 VanDerWaalsContact OD1-N 3.12Å; N60-L62 PolarHBondContact OD1-O 2.97Å; N60-L62 VanDerWaalsContact OD1-O 3.13Å
61	F	94.5	Very high	94.9	Very high	73 Å²	73	84 Å²	84	32%	0.32	40%	0.397	S	S	.	.			trans	-106.2	-2.6	-176.2	66.8	-87.9	0	0	0	113	H34 A37 F49 L53 P59	H34-F61 HydrophobicContact CB-CE1 4.12Å; H34-F61 HydrophobicContact CB-CE2 4.25Å; H34-F61 HydrophobicContact CB-CZ 3.84Å; H34-F61 AromaticContact CD2-CD1 3.38Å; H34-F61 WeakPolarHBondContact CD2-CD1 3.32Å; H34-F61 AromaticContact CD2-CE1 3.42Å; H34-F61 VanDerWaalsContact CD2-CE1 3.42Å; H34-F61 WeakPolarHBondContact CD2-CE1 3.37Å; H34-F61 AromaticContact CD2-CG 3.95Å; H34-F61 AromaticContact CD2-CZ 3.99Å; H34-F61 AromaticContact CG-CE1 3.96Å; H34-F61 AromaticContact NE2-CD1 3.75Å; A37-F61 HydrophobicContact CB-CE1 4.14Å; A37-F61 HydrophobicContact CB-CZ 4.48Å; F49-F61 HydrophobicContact CE2-CE1 4.01Å; F49-F61 HydrophobicContact CE2-CZ 4.26Å; F49-F61 HydrophobicContact CZ-CE1 4.27Å; L53-F61 HydrophobicContact CD2-CD1 4.35Å; L53-F61 HydrophobicContact CD2-CE1 4.2Å; P59-F61 PolarHBondContact O-N 2.92Å; P59-F61 VanDerWaalsContact O-N 3.14Å
62	L	95	Very high	94.6	Very high	19 Å²	19	85 Å²	85	10%	0.099	41%	0.41	C	S	.	.	S	Bend	trans	-115.9	134.5	177.5	-61.5	176.2	0	0	0	110.3	L38 L41 F49 N60 E66 I67 I70	L38-L62 HydrophobicContact CD1-CD1 4.12Å; L41-L62 HydrophobicContact CD2-CD1 4.17Å; F49-L62 HydrophobicContact CE2-CD1 4.31Å; F49-L62 HydrophobicContact CZ-CB 4.46Å; F49-L62 HydrophobicContact CZ-CD1 4.08Å; F49-L62 HydrophobicContact CZ-CG 4.42Å; N60-L62 PolarHBondContact ND2-O 3.29Å; N60-L62 VanDerWaalsContact ND2-O 3.1Å; N60-L62 PolarHBondContact OD1-N 3.37Å; N60-L62 VanDerWaalsContact OD1-N 3.12Å; N60-L62 PolarHBondContact OD1-O 2.97Å; N60-L62 VanDerWaalsContact OD1-O 3.13Å; L62-E66 HydrophobicContact CB-CB 4.44Å; L62-E66 HydrophobicContact CD2-CB 4.41Å; L62-I67 HydrophobicContact CB-CD1 4.27Å; L62-I67 HydrophobicContact CB-CG1 3.77Å; L62-I67 HydrophobicContact CD1-CG1 4.26Å; L62-I70 HydrophobicContact CD1-CD1 3.9Å; L62-I70 HydrophobicContact CD2-CD1 4.01Å
63	S	95.9	Very high	94.2	Very high	54 Å²	54	86.4 Å²	86.4	38%	0.378	42%	0.424	S	S	.	.			trans	-70.1	157.3	167.4	60.9	0	0	0	0	111.6	D65 E66 I67	S63-D65 PolarHBondContact O-N 3.44Å; S63-E66 WeakPolarHBondContact CB-OE2 3.37Å; S63-E66 PolarHBondContact N-OE2 2.93Å; S63-E66 WeakPolarHBondContact O-CB 3.31Å; S63-E66 PolarHBondContact O-N 2.95Å; S63-E66 WeakPolarHBondContact OG-CB 3.09Å; S63-E66 WeakPolarHBondContact OG-CG 3.46Å; S63-E66 PolarHBondContact OG-N 3.28Å; S63-E66 PolarHBondContact OG-OE2 3.37Å; S63-I67 WeakPolarHBondContact O-CG1 3.33Å; S63-I67 PolarHBondContact O-N 3.02Å
64	D	95.3	Very high	93.8	Very high	129 Å²	129	87.4 Å²	87.4	69%	0.69	43%	0.434	S	S	*	.	H	α-helix	trans	-56.2	-38.6	177.7	-62.6	-32.2	0	0	0	112.1	I67 Q68	D64-I67 WeakPolarHBondContact O-CB 3.24Å; D64-I67 PolarHBondContact O-N 3.38Å; D64-Q68 PolarHBondContact O-N 3.37Å
65	D	94.5	Very high	93.4	Very high	100 Å²	100	84.1 Å²	84.1	54%	0.535	43%	0.426	S	S	.	.	H	α-helix	trans	-61.7	-43	174.4	-91.2	5.5	0	0	0	112.7	S63 R69	S63-D65 PolarHBondContact O-N 3.44Å; D65-R69 WeakPolarHBondContact O-CB 3.44Å; D65-R69 VanDerWaalsContact O-CG 3.31Å; D65-R69 WeakPolarHBondContact O-CG 3.44Å; D65-R69 PolarHBondContact O-N 2.94Å; D65-R69 IonicContact OD2-NH1 3.85Å
66	E	94.3	Very high	92.7	Very high	77 Å²	77	80 Å²	80	36%	0.36	42%	0.422	S	S	.	.	H	α-helix	trans	-68.2	-42.2	175.7	-74.5	169.8	119.8	0	0	111.5	L62 S63 Q68 R69 I70	L62-E66 HydrophobicContact CB-CB 4.44Å; L62-E66 HydrophobicContact CD2-CB 4.41Å; S63-E66 WeakPolarHBondContact CB-OE2 3.37Å; S63-E66 PolarHBondContact N-OE2 2.93Å; S63-E66 WeakPolarHBondContact O-CB 3.31Å; S63-E66 PolarHBondContact O-N 2.95Å; S63-E66 WeakPolarHBondContact OG-CB 3.09Å; S63-E66 WeakPolarHBondContact OG-CG 3.46Å; S63-E66 PolarHBondContact OG-N 3.28Å; S63-E66 PolarHBondContact OG-OE2 3.37Å; E66-Q68 VanDerWaalsContact C-N 3.28Å; E66-Q68 PolarHBondContact O-N 2.83Å; E66-R69 VanDerWaalsContact CG-NH2 3.29Å; E66-R69 PolarHBondContact O-N 3.03Å; E66-I70 HydrophobicContact CB-CD1 4.43Å; E66-I70 WeakPolarHBondContact O-CB 3.43Å; E66-I70 WeakPolarHBondContact O-CD1 3.36Å; E66-I70 VanDerWaalsContact O-CG1 3.24Å; E66-I70 WeakPolarHBondContact O-CG1 3.5Å; E66-I70 PolarHBondContact O-N 3.25Å
67	I	94.9	Very high	91.9	Very high	8 Å²	8	79.1 Å²	79.1	4%	0.041	42%	0.422	C	S	.	.	H	α-helix	trans	-55.3	-47.8	175.1	-71.9	169.4	0	0	0	109.9	L41 V46 F49 L62 S63 D64 R71	L41-I67 HydrophobicContact CD1-CG2 3.91Å; L41-I67 HydrophobicContact CD2-CG1 4.38Å; L41-I67 HydrophobicContact CD2-CG2 4.31Å; V46-I67 HydrophobicContact CG2-CG2 3.73Å; F49-I67 HydrophobicContact CD1-CD1 4.33Å; F49-I67 HydrophobicContact CE1-CD1 3.88Å; F49-I67 HydrophobicContact CE1-CG1 4.5Å; L62-I67 HydrophobicContact CB-CD1 4.27Å; L62-I67 HydrophobicContact CB-CG1 3.77Å; L62-I67 HydrophobicContact CD1-CG1 4.26Å; S63-I67 WeakPolarHBondContact O-CG1 3.33Å; S63-I67 PolarHBondContact O-N 3.02Å; D64-I67 WeakPolarHBondContact O-CB 3.24Å; D64-I67 PolarHBondContact O-N 3.38Å; I67-R71 WeakPolarHBondContact O-CB 3.34Å; I67-R71 WeakPolarHBondContact O-CG 3.5Å; I67-R71 PolarHBondContact O-N 3.08Å
68	Q	94.1	Very high	90.7	Very high	137 Å²	137	75 Å²	75	64%	0.64	42%	0.415	S	S	*	.	H	α-helix	trans	-65.4	-42.5	178	-172.2	177.4	-7.6	0	0	112.3	D64 E66 S72	D64-Q68 PolarHBondContact O-N 3.37Å; E66-Q68 VanDerWaalsContact C-N 3.28Å; E66-Q68 PolarHBondContact O-N 2.83Å; Q68-S72 WeakPolarHBondContact O-CB 3.42Å; Q68-S72 PolarHBondContact O-N 3.35Å; Q68-S72 PolarHBondContact O-OG 3.41Å
69	R	91.5	Very high	88.9	Confident	122 Å²	122	85.1 Å²	85.1	46%	0.46	45%	0.452	S	S	.	.	H	α-helix	trans	-63.6	-45.2	177.6	-78.7	-170.9	-66.4	-94.8	4.1	112.3	D65 E66 S72 A73	D65-R69 WeakPolarHBondContact O-CB 3.44Å; D65-R69 VanDerWaalsContact O-CG 3.31Å; D65-R69 WeakPolarHBondContact O-CG 3.44Å; D65-R69 PolarHBondContact O-N 2.94Å; D65-R69 IonicContact OD2-NH1 3.85Å; E66-R69 VanDerWaalsContact CG-NH2 3.29Å; E66-R69 PolarHBondContact O-N 3.03Å; R69-S72 WeakPolarHBondContact CA-OG 3.48Å; R69-S72 PolarHBondContact O-N 3.23Å; R69-S72 PolarHBondContact O-OG 2.9Å; R69-A73 VanDerWaalsContact O-CB 3.23Å; R69-A73 WeakPolarHBondContact O-CB 3.21Å; R69-A73 PolarHBondContact O-N 3.03Å
70	I	92.9	Very high	86.5	Confident	31 Å²	31	86.3 Å²	86.3	16%	0.159	46%	0.461	C	S	.	.	H	α-helix	trans	-63.4	-47.4	179.7	-71.8	163.2	0	0	0	110.1	L38 L41 L42 L62 E66 S72 A73 A74 I237	L38-I70 HydrophobicContact CD1-CD1 4.26Å; L38-I70 HydrophobicContact CD1-CG2 3.97Å; L41-I70 HydrophobicContact CD2-CG2 4.4Å; L42-I70 HydrophobicContact CD2-CG2 4Å; L62-I70 HydrophobicContact CD1-CD1 3.9Å; L62-I70 HydrophobicContact CD2-CD1 4.01Å; E66-I70 HydrophobicContact CB-CD1 4.43Å; E66-I70 WeakPolarHBondContact O-CB 3.43Å; E66-I70 WeakPolarHBondContact O-CD1 3.36Å; E66-I70 VanDerWaalsContact O-CG1 3.24Å; E66-I70 WeakPolarHBondContact O-CG1 3.5Å; E66-I70 PolarHBondContact O-N 3.25Å; I70-S72 VanDerWaalsContact C-N 3.3Å; I70-S72 PolarHBondContact O-N 3.47Å; I70-A73 PolarHBondContact O-N 2.76Å; I70-A74 WeakPolarHBondContact O-CB 3.47Å; I70-A74 PolarHBondContact O-N 2.91Å; I70-I237 HydrophobicContact CG2-CD1 3.41Å; I70-I237 VanDerWaalsContact CG2-CD1 3.41Å; I70-I237 HydrophobicContact CG2-CG1 4.24Å
71	R	91.5	Very high	83.8	Confident	131 Å²	131	88.6 Å²	88.6	49%	0.494	48%	0.478	S	S	.	.	H	α-helix	trans	-61.8	-37.5	178.5	-71.6	178.5	71.8	-157.9	2.1	112.8	L41 L42 I67	L41-R71 HydrophobicContact CD1-CG 4.37Å; L41-R71 HydrophobicContact CD2-CG 4.44Å; L41-R71 HydrophobicContact CG-CG 4.16Å; L42-R71 HydrophobicContact CD2-CG 4.32Å; I67-R71 WeakPolarHBondContact O-CB 3.34Å; I67-R71 WeakPolarHBondContact O-CG 3.5Å; I67-R71 PolarHBondContact O-N 3.08Å
72	S	89.3	Confident	81	Confident	97 Å²	97	89.8 Å²	89.8	68%	0.678	50%	0.495	S	S	*	.	H	α-helix	trans	-77.5	-27.1	178.1	54.5	0	0	0	0	113.8	Q68 R69 I70	Q68-S72 WeakPolarHBondContact O-CB 3.42Å; Q68-S72 PolarHBondContact O-N 3.35Å; Q68-S72 PolarHBondContact O-OG 3.41Å; R69-S72 WeakPolarHBondContact CA-OG 3.48Å; R69-S72 PolarHBondContact O-N 3.23Å; R69-S72 PolarHBondContact O-OG 2.9Å; I70-S72 VanDerWaalsContact C-N 3.3Å; I70-S72 PolarHBondContact O-N 3.47Å
73	A	88.2	Confident	78.1	Confident	45 Å²	45	95 Å²	95	37%	0.372	53%	0.527	S	S	.	.	H	α-helix	trans	-86.7	-16.4	178.2	0	0	0	0	0	113.7	R69 I70 V75 I237	R69-A73 VanDerWaalsContact O-CB 3.23Å; R69-A73 WeakPolarHBondContact O-CB 3.21Å; R69-A73 PolarHBondContact O-N 3.03Å; I70-A73 PolarHBondContact O-N 2.76Å; A73-V75 PolarHBondContact O-N 2.68Å; A73-I237 HydrophobicContact CB-CG2 4.35Å
74	A	89.6	Confident	75.1	Confident	29 Å²	29	101.1 Å²	101.1	24%	0.24	55%	0.549	C	S	.	.			trans	-63.7	124.1	-179.5	0	0	0	0	0	112	L42 I70 I237	L42-A74 HydrophobicContact CD1-CB 3.51Å; L42-A74 HydrophobicContact CD2-CB 3.72Å; L42-A74 HydrophobicContact CG-CB 4.3Å; I70-A74 WeakPolarHBondContact O-CB 3.47Å; I70-A74 PolarHBondContact O-N 2.91Å; A74-I237 HydrophobicContact CB-CG1 4.22Å
75	V	87.1	Confident	72	Confident	73 Å²	73	98.2 Å²	98.2	44%	0.442	55%	0.55	S	S	.	.	B	Isolated β-bridge	trans	-105.7	120.1	174.3	-177.4	0	0	0	0	108.2	A73 A235 R236	A73-V75 PolarHBondContact O-N 2.68Å; V75-A235 CarbonylContact O-C 3.6Å; V75-A235 VanDerWaalsContact O-CA 3.31Å; V75-A235 WeakPolarHBondContact O-CA 3.48Å; V75-R236 HydrophobicContact CB-CG 4.14Å; V75-R236 PolarHBondContact N-O 2.91Å; V75-R236 PolarHBondContact O-N 2.93Å
76	P	82.2	Confident	69.1	Low	92 Å²	92	102.3 Å²	102.3	60%	0.597	57%	0.566	S	S	*	*			trans	-63.7	159	176	28.1	-34.1	0	0	0	110.4
77	P	79.2	Confident	66.3	Low	51 Å²	51	107.7 Å²	107.7	33%	0.331	59%	0.591	S	S	.	*			trans	-55.6	141.8	173.8	26.9	-36	0	0	0	109.3	R79 S233	P77-R79 PolarHBondContact O-N 3.13Å; P77-S233 WeakPolarHBondContact CG-O 3.4Å
78	P	70.3	Confident	63.3	Low	103 Å²	103	114.8 Å²	114.8	67%	0.669	63%	0.628	S	S	*	*			trans	-55.6	115.6	170.7	22	-29.1	0	0	0	107.5	C80	P78-C80 PolarHBondContact O-N 2.54Å
79	R	58.4	Low	60.4	Low	234 Å²	234	116.1 Å²	116.1	88%	0.883	64%	0.635	S	S	*	*			trans	-59.2	113.6	174	-69.5	-177.6	177.2	165.5	-1	105.9	P77 V81	P77-R79 PolarHBondContact O-N 3.13Å; R79-V81 PolarHBondContact O-N 3.48Å
80	C	43.5	Very low	58.1	Low	127 Å²	127	119.5 Å²	119.5	86%	0.858	66%	0.655	S	S	*	*			trans	-52.2	116.2	160.7	-90.3	0	0	0	0	105.5	P78 S82	P78-C80 PolarHBondContact O-N 2.54Å; C80-S82 PolarHBondContact O-N 3.12Å
81	V	36.7	Very low	55.5	Low	129 Å²	129	123.4 Å²	123.4	78%	0.782	69%	0.685	S	S	*	*			trans	-66.8	92.5	175.2	-170	0	0	0	0	105	R79 V83	R79-V81 PolarHBondContact O-N 3.48Å; V81-V83 VanDerWaalsContact C-N 3.29Å; V81-V83 PolarHBondContact O-N 3.48Å
82	S	37.5	Very low	52.9	Low	98 Å²	98	125.7 Å²	125.7	69%	0.685	71%	0.707	S	S	*	*			trans	-59	103.9	159.4	169.7	0	0	0	0	104.9	C80 H84	C80-S82 PolarHBondContact O-N 3.12Å; S82-H84 PolarHBondContact O-N 3.02Å
83	V	33	Very low	50	Low	128 Å²	128	123.9 Å²	123.9	78%	0.776	70%	0.703	S	S	*	*			trans	-57.9	111.1	167.4	176.8	0	0	0	0	105.2	V81 G85	V81-V83 VanDerWaalsContact C-N 3.29Å; V81-V83 PolarHBondContact O-N 3.48Å; V83-G85 PolarHBondContact O-N 3.42Å; V83-G85 VanDerWaalsContact O-N 3.13Å
84	H	33.1	Very low	47.8	Very low	182 Å²	182	127.7 Å²	127.7	84%	0.843	73%	0.727	S	S	*	*			trans	-52.4	116.2	174.4	-118.1	42.4	0	0	0	109.7	S82	S82-H84 PolarHBondContact O-N 3.02Å
85	G	29.3	Very low	45.4	Very low	68 Å²	68	130.1 Å²	130.1	70%	0.701	74%	0.742	S	S	*	*			trans	-137.7	127.9	154.6	0	0	0	0	0	105.6	V83	V83-G85 PolarHBondContact O-N 3.42Å; V83-G85 VanDerWaalsContact O-N 3.13Å
86	E	33.9	Very low	43.1	Very low	186 Å²	186	134.2 Å²	134.2	87%	0.869	76%	0.761	S	S	*	*			trans	-63.2	141.8	-156	-62.7	167.1	156	0	0	115.1
87	E	36.7	Very low	41	Very low	190 Å²	190	136 Å²	136	89%	0.888	77%	0.765	S	S	*	*			trans	40.1	92.7	140.9	-145.3	167.2	-146.4	0	0	118.7
88	L	32.3	Very low	39.1	Very low	157 Å²	157	138.2 Å²	138.2	82%	0.822	78%	0.781	S	S	*	*			trans	-153.3	110.9	141.5	-157.1	69.9	0	0	0	112
89	E	32.8	Very low	37.9	Very low	166 Å²	166	137.7 Å²	137.7	78%	0.776	78%	0.78	S	S	*	*			trans	36.2	123.8	145.7	-56.7	-165.9	157.8	0	0	121.8	S91	E89-S91 PolarHBondContact O-N 2.97Å
90	Q	43.3	Very low	37.3	Very low	192 Å²	192	130.8 Å²	130.8	90%	0.897	77%	0.767	S	S	*	*	S	Bend	trans	-2.7	102.2	137.5	-72.4	151.2	-3.2	0	0	116
91	S	37.3	Very low	37.3	Very low	113 Å²	113	131 Å²	131	79%	0.79	76%	0.764	S	S	*	*			trans	156.8	63.8	140.1	-176.7	0	0	0	0	112.5	E89	E89-S91 PolarHBondContact O-N 2.97Å
92	L	36.4	Very low	38	Very low	180 Å²	180	128 Å²	128	94%	0.942	75%	0.747	S	S	*	*			trans	-138.3	84.7	151.9	-81.3	160.9	0	0	0	104.3
93	G	29.5	Very low	38.6	Very low	59 Å²	59	131 Å²	131	61%	0.608	74%	0.744	S	S	*	*				79.1	81	63.5	0	0	0	0	0	108.1	S95	G93-S95 PolarHBondContact O-N 3.44Å; G93-S95 VanDerWaalsContact O-N 3.15Å
94	S	41.8	Very low	39.7	Very low	125 Å²	125	131.5 Å²	131.5	87%	0.874	74%	0.736	S	S	*	*	S	Bend	trans	8.5	92.6	143.3	60	0	0	0	0	116.5
95	S	38.8	Very low	40.6	Very low	79 Å²	79	125.3 Å²	125.3	55%	0.552	71%	0.712	S	S	*	*			trans	161.6	79.8	147.7	174.7	0	0	0	0	106.6	G93 D97	G93-S95 PolarHBondContact O-N 3.44Å; G93-S95 VanDerWaalsContact O-N 3.15Å; S95-D97 VanDerWaalsContact C-N 3.32Å; S95-D97 PolarHBondContact OG-OD2 3.28Å
96	L	39.9	Very low	41.9	Very low	159 Å²	159	129 Å²	129	83%	0.832	71%	0.711	S	S	*	*			trans	-101.2	86	134.2	-154.6	76.6	0	0	0	103.2	C98	L96-C98 PolarHBondContact O-N 3.22Å
97	D	37.4	Very low	43	Very low	129 Å²	129	125.4 Å²	125.4	69%	0.69	70%	0.702	S	S	*	*			trans	-58.4	78.4	159.8	-73.4	-49.3	0	0	0	107.2	S95 S99	S95-D97 VanDerWaalsContact C-N 3.32Å; S95-D97 PolarHBondContact OG-OD2 3.28Å; D97-S99 PolarHBondContact O-N 2.99Å
98	C	39.8	Very low	44.2	Very low	98 Å²	98	120.5 Å²	120.5	66%	0.662	69%	0.688	S	S	*	*			trans	-70.7	51.2	148.4	-65.7	0	0	0	0	107.9	L96 S100	L96-C98 PolarHBondContact O-N 3.22Å; C98-S100 PolarHBondContact O-N 3.3Å
99	S	43.7	Very low	45.8	Very low	93 Å²	93	118.2 Å²	118.2	65%	0.65	68%	0.677	S	S	*	*			trans	-66.1	71.6	146.7	172.5	0	0	0	0	105.1	D97 V101	D97-S99 PolarHBondContact O-N 2.99Å; S99-V101 PolarHBondContact O-N 2.94Å
100	S	46.2	Very low	47.5	Very low	88 Å²	88	115.6 Å²	115.6	62%	0.615	67%	0.672	S	S	*	*			trans	-65.4	101.2	164.6	61.7	0	0	0	0	104.4	C98 T102	C98-S100 PolarHBondContact O-N 3.3Å; S100-T102 PolarHBondContact O-N 3.07Å
101	V	42.9	Very low	48.9	Very low	131 Å²	131	113.8 Å²	113.8	79%	0.794	66%	0.663	S	S	*	*			trans	-41.1	113.4	162.6	-179.5	0	0	0	0	105.7	S99 Y103	S99-V101 PolarHBondContact O-N 2.94Å; V101-Y103 PolarHBondContact O-N 3.34Å
102	T	53.4	Low	50.7	Low	67 Å²	67	112.1 Å²	112.1	41%	0.411	65%	0.65	S	S	.	*			trans	-66.6	96.1	-166.2	20.3	0	0	0	0	109.2	S100 F104	S100-T102 PolarHBondContact O-N 3.07Å; T102-F104 VanDerWaalsContact C-N 3.3Å; T102-F104 HydrophobicContact CG2-CD2 3.99Å; T102-F104 HydrophobicContact CG2-CE2 3.29Å; T102-F104 HydrophobicContact CG2-CZ 4Å; T102-F104 PolarHBondContact O-N 3.42Å
103	Y	50	Low	52.7	Low	161 Å²	161	105.8 Å²	105.8	63%	0.631	62%	0.62	S	S	*	*			trans	-71.4	89.4	171.7	-169.9	-109.5	0	0	0	108.2	V101 P105 D109	V101-Y103 PolarHBondContact O-N 3.34Å; Y103-P105 HydrophobicContact CD1-CG 3.98Å; Y103-P105 HydrophobicContact CE1-CB 4.11Å; Y103-P105 HydrophobicContact CE1-CG 3.49Å; Y103-P105 VanDerWaalsContact CE1-CG 3.49Å; Y103-P105 HydrophobicContact CE2-CB 4.45Å; Y103-P105 VanDerWaalsContact O-CD 3.31Å; Y103-P105 WeakPolarHBondContact O-CD 3.24Å; Y103-D109 WeakPolarHBondContact CE1-OD2 3.42Å; Y103-D109 PolarHBondContact OH-OD1 3.09Å; Y103-D109 VanDerWaalsContact OH-OD1 3.07Å; Y103-D109 PolarHBondContact OH-OD2 3.32Å
104	F	55.3	Low	55.1	Low	138 Å²	138	108.9 Å²	108.9	61%	0.605	62%	0.621	S	S	*	*			trans	-111.6	75.2	170.2	-69.8	-69.2	0	0	0	108.5	T102 E106	T102-F104 VanDerWaalsContact C-N 3.3Å; T102-F104 HydrophobicContact CG2-CD2 3.99Å; T102-F104 HydrophobicContact CG2-CE2 3.29Å; T102-F104 HydrophobicContact CG2-CZ 4Å; T102-F104 PolarHBondContact O-N 3.42Å; F104-E106 PolarHBondContact O-N 3.29Å
105	P	52.7	Low	57.2	Low	53 Å²	53	104.2 Å²	104.2	34%	0.344	59%	0.587	S	S	.	*			trans	-66.1	134.7	177.3	33.4	-37.8	0	0	0	108.3	Y103 V107	Y103-P105 HydrophobicContact CD1-CG 3.98Å; Y103-P105 HydrophobicContact CE1-CB 4.11Å; Y103-P105 HydrophobicContact CE1-CG 3.49Å; Y103-P105 VanDerWaalsContact CE1-CG 3.49Å; Y103-P105 HydrophobicContact CE2-CB 4.45Å; Y103-P105 VanDerWaalsContact O-CD 3.31Å; Y103-P105 WeakPolarHBondContact O-CD 3.24Å; P105-V107 VanDerWaalsContact CB-O 3.29Å; P105-V107 WeakPolarHBondContact CB-O 3.34Å; P105-V107 PolarHBondContact O-N 2.97Å; P105-V107 VanDerWaalsContact O-N 3.12Å
106	E	56.2	Low	59.1	Low	146 Å²	146	107 Å²	107	68%	0.682	59%	0.591	S	S	*	*	S	Bend	trans	-63.3	-15.4	176	-64.3	179.6	173.9	0	0	112	F104	F104-E106 PolarHBondContact O-N 3.29Å
107	V	55.9	Low	61.3	Low	110 Å²	110	100.6 Å²	100.6	67%	0.667	56%	0.557	S	S	*	*	S	Bend	trans	-131.4	134.8	179.5	-172.9	0	0	0	0	108.3	P105 D109	P105-V107 VanDerWaalsContact CB-O 3.29Å; P105-V107 WeakPolarHBondContact CB-O 3.34Å; P105-V107 PolarHBondContact O-N 2.97Å; P105-V107 VanDerWaalsContact O-N 3.12Å; V107-D109 PolarHBondContact O-N 3.33Å
108	S	62.8	Low	63.3	Low	86 Å²	86	96.2 Å²	96.2	60%	0.601	54%	0.542	S	S	*	.			trans	-60	124.3	169.5	169.4	0	0	0	0	109.8	V110	S108-V110 PolarHBondContact O-N 3.09Å; S108-V110 PolarHBondContact OG-N 3.39Å; S108-V110 PolarHBondContact OG-O 3.06Å; S108-V110 VanDerWaalsContact OG-O 3.11Å
109	D	66.5	Low	65.6	Low	110 Å²	110	93.3 Å²	93.3	59%	0.588	52%	0.518	S	S	*	.	S	Bend	trans	-70.6	-11.3	174	-48	-63.2	0	0	0	113	Y103 V107	Y103-D109 WeakPolarHBondContact CE1-OD2 3.42Å; Y103-D109 PolarHBondContact OH-OD1 3.09Å; Y103-D109 VanDerWaalsContact OH-OD1 3.07Å; Y103-D109 PolarHBondContact OH-OD2 3.32Å; V107-D109 PolarHBondContact O-N 3.33Å
110	V	68.4	Low	67.4	Low	110 Å²	110	90 Å²	90	67%	0.667	49%	0.494	S	S	*	.	S	Bend	trans	-88.2	118.6	176.2	-175.5	0	0	0	0	108.6	S108	S108-V110 PolarHBondContact O-N 3.09Å; S108-V110 PolarHBondContact OG-N 3.39Å; S108-V110 PolarHBondContact OG-O 3.06Å; S108-V110 VanDerWaalsContact OG-O 3.11Å
111	E	72.1	Confident	68.4	Low	155 Å²	155	90.6 Å²	90.6	72%	0.724	50%	0.504	S	S	*	.	P	Polyproline II helix	trans	-63.1	129.8	172.5	-171	175.4	-178.8	0	0	110
112	P	74.5	Confident	69.6	Low	78 Å²	78	86.8 Å²	86.8	51%	0.506	48%	0.477	S	S	.	.	P	Polyproline II helix	trans	-55.5	137.5	175.8	-28.7	36.8	0	0	0	112.1	L114 A292	P112-L114 PolarHBondContact O-N 2.96Å; P112-A292 HydrophobicContact CB-CB 3.8Å; P112-A292 HydrophobicContact CG-CB 4.28Å
113	P	79.3	Confident	70	Confident	47 Å²	47	88.7 Å²	88.7	31%	0.305	49%	0.488	S	S	.	.	P	Polyproline II helix	trans	-57	136.1	173	-17.8	32.6	0	0	0	110.5	Y291	P113-Y291 HydrophobicContact CB-CD1 4.37Å; P113-Y291 HydrophobicContact CB-CE1 4.09Å
114	L	79.7	Confident	70.6	Confident	123 Å²	123	85.3 Å²	85.3	64%	0.644	49%	0.494	S	S	*	.	P	Polyproline II helix	trans	-69.8	149.4	178.5	-60.9	176.4	0	0	0	110.6	P112 E116	P112-L114 PolarHBondContact O-N 2.96Å; L114-E116 WeakPolarHBondContact O-CG 3.49Å; L114-E116 PolarHBondContact O-N 3.35Å
115	L	86.4	Confident	71.2	Confident	28 Å²	28	81.5 Å²	81.5	15%	0.147	49%	0.494	C	S	.	.			trans	-81	78.9	172.7	-68.8	156.3	0	0	0	108.7	I117 G118 W119 Y191 F287 R288 Y291	L115-I117 PolarHBondContact O-N 3.16Å; L115-G118 PolarHBondContact O-N 3.36Å; L115-W119 HydrophobicContact CB-CB 3.69Å; L115-W119 HydrophobicContact CB-CE3 4.4Å; L115-W119 HydrophobicContact CB-CG 4.28Å; L115-W119 HydrophobicContact CD1-CB 3.9Å; L115-W119 HydrophobicContact CD1-CD2 3.51Å; L115-W119 HydrophobicContact CD1-CE3 3.8Å; L115-W119 HydrophobicContact CD1-CG 3.57Å; L115-W119 HydrophobicContact CD1-CZ3 4.44Å; L115-W119 HydrophobicContact CD2-CE3 3.99Å; L115-W119 HydrophobicContact CD2-CZ3 4.25Å; L115-W119 HydrophobicContact CG-CB 4.4Å; L115-W119 HydrophobicContact CG-CD2 4.4Å; L115-W119 HydrophobicContact CG-CE3 4.27Å; L115-W119 HydrophobicContact CG-CG 4.48Å; L115-Y191 HydrophobicContact CB-CE1 4.22Å; L115-Y191 HydrophobicContact CD2-CD1 3.94Å; L115-Y191 HydrophobicContact CD2-CE1 3.72Å; L115-Y191 HydrophobicContact CD2-CG 4.38Å; L115-Y191 PolarHBondContact O-OH 3.03Å; L115-Y191 VanDerWaalsContact O-OH 3.08Å; L115-F287 HydrophobicContact CD2-CE1 3.95Å; L115-R288 HydrophobicContact CD1-CG 4.12Å; L115-Y291 HydrophobicContact CD2-CD1 3.78Å; L115-Y291 HydrophobicContact CD2-CD2 3.8Å; L115-Y291 HydrophobicContact CD2-CE1 3.84Å; L115-Y291 HydrophobicContact CD2-CE2 3.88Å; L115-Y291 HydrophobicContact CD2-CG 3.77Å; L115-Y291 HydrophobicContact CG-CD1 4.34Å; L115-Y291 HydrophobicContact CG-CE1 4.4Å
116	E	77.4	Confident	72.5	Confident	136 Å²	136	80.9 Å²	80.9	64%	0.636	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-28.2	-162.6	-70.1	168.4	-168.5	0	0	116.1	L114 G118	L114-E116 WeakPolarHBondContact O-CG 3.49Å; L114-E116 PolarHBondContact O-N 3.35Å; E116-G118 VanDerWaalsContact C-N 3.32Å
117	I	86.4	Confident	73.8	Confident	25 Å²	25	82 Å²	82	13%	0.128	49%	0.49	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.1	12.5	-173.6	59.1	165.2	0	0	0	113	L115 P189 Y191 Q218 R220	L115-I117 PolarHBondContact O-N 3.16Å; I117-P189 HydrophobicContact CD1-CB 3.94Å; I117-P189 HydrophobicContact CG1-CB 4.01Å; I117-P189 WeakPolarHBondContact O-CB 3.43Å; I117-P189 WeakPolarHBondContact O-CG 3.31Å; I117-Y191 HydrophobicContact CD1-CD1 4.36Å; I117-Y191 HydrophobicContact CD1-CE1 4.06Å; I117-Y191 HydrophobicContact CD1-CE2 4.19Å; I117-Y191 HydrophobicContact CG1-CD1 4.24Å; I117-Y191 HydrophobicContact CG1-CE1 3.45Å; I117-Y191 VanDerWaalsContact CG1-CE1 3.45Å; I117-Y191 HydrophobicContact CG1-CE2 3.76Å; I117-Y191 WeakPolarHBondContact CG1-OH 3.41Å; I117-Y191 PolarHBondContact N-OH 3.05Å; I117-Q218 WeakPolarHBondContact CD1-O 3.4Å; I117-R220 HydrophobicContact CD1-CB 4.27Å; I117-R220 HydrophobicContact CD1-CG 3.79Å; I117-R220 HydrophobicContact CG1-CG 4.09Å; I117-R220 HydrophobicContact CG2-CG 4Å
118	G	80.6	Confident	75.4	Confident	37 Å²	37	78.7 Å²	78.7	38%	0.381	47%	0.466	S	S	.	.			trans	104.6	111.3	-179.8	0	0	0	0	0	110.9	L115 E116 Y191	L115-G118 PolarHBondContact O-N 3.36Å; E116-G118 VanDerWaalsContact C-N 3.32Å; G118-Y191 PolarHBondContact N-OH 3.37Å; G118-Y191 VanDerWaalsContact N-OH 3.15Å; G118-Y191 WeakPolarHBondContact O-CE2 3.43Å; G118-Y191 PolarHBondContact O-OH 3.47Å
119	W	87.6	Confident	76.6	Confident	38 Å²	38	75.6 Å²	75.6	14%	0.144	45%	0.447	C	S	.	.			trans	-113.5	132.6	164.7	-163.9	-103.2	0	0	0	107.5	L115 A121 V162 A164 Y191 L247 D284 F287	L115-W119 HydrophobicContact CB-CB 3.69Å; L115-W119 HydrophobicContact CB-CE3 4.4Å; L115-W119 HydrophobicContact CB-CG 4.28Å; L115-W119 HydrophobicContact CD1-CB 3.9Å; L115-W119 HydrophobicContact CD1-CD2 3.51Å; L115-W119 HydrophobicContact CD1-CE3 3.8Å; L115-W119 HydrophobicContact CD1-CG 3.57Å; L115-W119 HydrophobicContact CD1-CZ3 4.44Å; L115-W119 HydrophobicContact CD2-CE3 3.99Å; L115-W119 HydrophobicContact CD2-CZ3 4.25Å; L115-W119 HydrophobicContact CG-CB 4.4Å; L115-W119 HydrophobicContact CG-CD2 4.4Å; L115-W119 HydrophobicContact CG-CE3 4.27Å; L115-W119 HydrophobicContact CG-CG 4.48Å; W119-A121 PolarHBondContact O-N 3.4Å; W119-V162 HydrophobicContact CE3-CG2 3.84Å; W119-V162 HydrophobicContact CZ3-CG2 3.92Å; W119-A164 HydrophobicContact CH2-CB 3.42Å; W119-A164 VanDerWaalsContact CH2-CB 3.42Å; W119-A164 HydrophobicContact CZ3-CB 3.65Å; W119-Y191 AromaticContact CE3-CD2 3.91Å; W119-Y191 HydrophobicContact CE3-CD2 3.91Å; W119-Y191 AromaticContact CE3-CE2 3.7Å; W119-Y191 HydrophobicContact CE3-CE2 3.7Å; W119-Y191 AromaticContact CZ3-CD2 3.76Å; W119-Y191 HydrophobicContact CZ3-CD2 3.76Å; W119-Y191 HydrophobicContact CZ3-CE2 4.06Å; W119-Y191 HydrophobicContact CZ3-CG 4.42Å; W119-L247 HydrophobicContact CH2-CD2 4.06Å; W119-L247 HydrophobicContact CZ2-CD2 3.85Å; W119-D284 WeakPolarHBondContact CZ2-OD1 3.19Å; W119-D284 PolarHBondContact NE1-OD1 3.01Å; W119-F287 AromaticContact CH2-CD1 3.21Å; W119-F287 HydrophobicContact CH2-CD1 3.21Å; W119-F287 AromaticContact CH2-CE1 3.53Å; W119-F287 HydrophobicContact CH2-CE1 3.53Å; W119-F287 AromaticContact CH2-CG 3.9Å; W119-F287 HydrophobicContact CH2-CG 3.9Å; W119-F287 HydrophobicContact CH2-CZ 4.43Å; W119-F287 AromaticContact CZ2-CD1 3.9Å; W119-F287 HydrophobicContact CZ2-CD1 3.9Å; W119-F287 AromaticContact CZ3-CD1 3.77Å; W119-F287 HydrophobicContact CZ3-CD1 3.77Å; W119-F287 AromaticContact CZ3-CE1 3.56Å; W119-F287 HydrophobicContact CZ3-CE1 3.56Å; W119-F287 HydrophobicContact CZ3-CZ 4.39Å
120	P	80.8	Confident	77.9	Confident	24 Å²	24	75 Å²	75	16%	0.156	45%	0.448	C	S	.	.			trans	-64.1	133.7	178.6	-10	23.2	0	0	0	108.9	F122 E161 V162	P120-F122 HydrophobicContact CB-CD2 4.08Å; P120-F122 HydrophobicContact CB-CE1 4.12Å; P120-F122 HydrophobicContact CB-CE2 3.38Å; P120-F122 HydrophobicContact CB-CZ 3.38Å; P120-F122 HydrophobicContact CG-CE2 3.5Å; P120-F122 VanDerWaalsContact CG-CE2 3.5Å; P120-F122 HydrophobicContact CG-CZ 3.58Å; P120-F122 WeakPolarHBondContact O-CD2 3.42Å; P120-F122 PolarHBondContact O-N 2.93Å; P120-E161 HydrophobicContact CG-CB 4.23Å; P120-V162 HydrophobicContact CG-CB 4.08Å; P120-V162 HydrophobicContact CG-CG1 3.56Å
121	A	67.4	Low	79.2	Confident	100 Å²	100	73.3 Å²	73.3	83%	0.826	44%	0.437	S	S	*	.			trans	-75.2	74.3	176.1	0	0	0	0	0	108.9	W119 T123	W119-A121 PolarHBondContact O-N 3.4Å; A121-T123 PolarHBondContact O-N 2.52Å; A121-T123 VanDerWaalsContact O-N 3.14Å
122	F	68.6	Low	80.4	Confident	51 Å²	51	74.5 Å²	74.5	22%	0.224	44%	0.435	C	S	.	.			trans	-67.2	112.8	165.3	-56.7	-71.1	0	0	0	106.6	P120 A124 R128 D249 G250	P120-F122 HydrophobicContact CB-CD2 4.08Å; P120-F122 HydrophobicContact CB-CE1 4.12Å; P120-F122 HydrophobicContact CB-CE2 3.38Å; P120-F122 HydrophobicContact CB-CZ 3.38Å; P120-F122 HydrophobicContact CG-CE2 3.5Å; P120-F122 VanDerWaalsContact CG-CE2 3.5Å; P120-F122 HydrophobicContact CG-CZ 3.58Å; P120-F122 WeakPolarHBondContact O-CD2 3.42Å; P120-F122 PolarHBondContact O-N 2.93Å; F122-A124 PolarHBondContact O-N 3.06Å; F122-R128 VanDerWaalsContact CB-NH2 3.28Å; F122-D249 WeakPolarHBondContact CZ-O 3.3Å; F122-G250 VanDerWaalsContact CE2-CA 3.44Å
123	T	60.5	Low	81.5	Confident	106 Å²	106	74.1 Å²	74.1	65%	0.65	44%	0.439	S	S	*	.			trans	-54.3	115.4	171.9	-45.9	0	0	0	0	107	A121 G125 S126	A121-T123 PolarHBondContact O-N 2.52Å; A121-T123 VanDerWaalsContact O-N 3.14Å; T123-G125 PolarHBondContact O-N 2.78Å; T123-S126 VanDerWaalsContact O-CB 3.24Å; T123-S126 WeakPolarHBondContact O-CB 3.49Å; T123-S126 PolarHBondContact O-N 3.44Å; T123-S126 PolarHBondContact O-OG 3.04Å
124	A	64.2	Low	82.3	Confident	90 Å²	90	75.6 Å²	75.6	74%	0.744	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.6	131.1	176.1	0	0	0	0	0	108.6	F122	F122-A124 PolarHBondContact O-N 3.06Å
125	G	67.4	Low	83.1	Confident	59 Å²	59	72.2 Å²	72.2	61%	0.608	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.8	6.2	-174.2	0	0	0	0	0	116.4	T123 E281	T123-G125 PolarHBondContact O-N 2.78Å; G125-E281 WeakPolarHBondContact CA-OE1 3.4Å; G125-E281 PolarHBondContact N-OE1 2.94Å
126	S	79.3	Confident	83.5	Confident	40 Å²	40	72.5 Å²	72.5	28%	0.28	44%	0.437	S	S	.	.			trans	-70	140.8	169.8	56.6	0	0	0	0	111.5	T123 R128 Q278	T123-S126 VanDerWaalsContact O-CB 3.24Å; T123-S126 WeakPolarHBondContact O-CB 3.49Å; T123-S126 PolarHBondContact O-N 3.44Å; T123-S126 PolarHBondContact O-OG 3.04Å; S126-R128 PolarHBondContact O-N 3.39Å; S126-Q278 PolarHBondContact O-NE2 3.19Å; S126-Q278 PolarHBondContact O-OE1 3.05Å
127	Y	85.1	Confident	84.3	Confident	170 Å²	170	72 Å²	72	67%	0.667	43%	0.433	S	S	*	.			trans	-72.6	117	178.8	179.8	-114.4	0	0	0	110.9	G129 V130	Y127-G129 VanDerWaalsContact CZ-CA 3.45Å; Y127-V130 WeakPolarHBondContact OH-CG2 3.47Å; Y127-V130 PolarHBondContact OH-N 3.07Å
128	R	87.6	Confident	84.4	Confident	40 Å²	40	71.1 Å²	71.1	15%	0.151	43%	0.428	C	S	.	.			trans	-97.1	8.9	-178.5	-59.4	-175.7	-173.2	172.9	5	113.7	F122 S126 G250 G277 T280 E281 D284	F122-R128 VanDerWaalsContact CB-NH2 3.28Å; S126-R128 PolarHBondContact O-N 3.39Å; R128-G250 PolarHBondContact NH1-O 3.37Å; R128-G250 VanDerWaalsContact NH1-O 3.08Å; R128-G277 WeakPolarHBondContact O-CA 3.5Å; R128-T280 VanDerWaalsContact CD-OG1 3.27Å; R128-T280 WeakPolarHBondContact CD-OG1 3.38Å; R128-T280 VanDerWaalsContact NH1-C 3.35Å; R128-T280 PolarHBondContact NH1-O 2.8Å; R128-T280 PolarHBondContact NH1-OG1 3Å; R128-E281 VanDerWaalsContact NH1-CA 3.31Å; R128-D284 IonicContact CZ-OD2 3.79Å; R128-D284 IonicContact NH1-OD2 2.76Å; R128-D284 IonicContact NH2-OD2 3.82Å; R128-D284 PolarHBondContact NH2-OD2 3.2Å
129	G	89.2	Confident	84.7	Confident	21 Å²	21	73.5 Å²	73.5	22%	0.216	44%	0.437	C	S	.	.			trans	97.3	172.4	-177.5	0	0	0	0	0	113.9	Y127 G277 Q278	Y127-G129 VanDerWaalsContact CZ-CA 3.45Å; G129-G277 CarbonylContact O-C 3.57Å; G129-G277 WeakPolarHBondContact O-CA 3.47Å; G129-Q278 PolarHBondContact O-N 2.95Å
130	V	93	Very high	84.5	Confident	98 Å²	98	73 Å²	73	59%	0.594	44%	0.44	S	S	*	.	S	Bend	trans	-65.3	136.2	179.2	-179.5	0	0	0	0	109.8	Y127 R132	Y127-V130 WeakPolarHBondContact OH-CG2 3.47Å; Y127-V130 PolarHBondContact OH-N 3.07Å; V130-R132 PolarHBondContact O-N 3.27Å
131	T	95.9	Very high	84.1	Confident	74 Å²	74	83 Å²	83	45%	0.454	48%	0.476	S	S	.	.			trans	-62	123.3	176.2	-60.4	0	0	0	0	111.1	S276 I279	T131-S276 CarbonylContact C-O 3.55Å; T131-S276 VanDerWaalsContact CA-O 3.23Å; T131-S276 WeakPolarHBondContact CA-O 3.47Å; T131-I279 HydrophobicContact CG2-CB 3.93Å; T131-I279 HydrophobicContact CG2-CG2 3.68Å
132	R	96.8	Very high	84.5	Confident	180 Å²	180	81.2 Å²	81.2	68%	0.679	47%	0.467	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-125.2	145.9	173.4	-57.2	176	178.8	-128.1	-1.2	109.7	V130 L275 S276	V130-R132 PolarHBondContact O-N 3.27Å; R132-L275 CarbonylContact O-C 3.5Å; R132-L275 WeakPolarHBondContact O-CA 3.34Å; R132-S276 PolarHBondContact N-O 3.45Å; R132-S276 PolarHBondContact O-N 2.88Å
133	A	97.6	Very high	84.8	Confident	70 Å²	70	88.5 Å²	88.5	58%	0.579	50%	0.502	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-130.2	135.3	178.5	0	0	0	0	0	110.4	I273 E274 L275	A133-I273 HydrophobicContact CB-CG2 4.33Å; A133-E274 CarbonylContact C-O 3.58Å; A133-E274 VanDerWaalsContact CA-O 3.31Å; A133-E274 WeakPolarHBondContact CA-O 3.45Å; A133-L275 HydrophobicContact CB-CD2 3.56Å
134	V	97	Very high	85.8	Confident	77 Å²	77	86.7 Å²	86.7	47%	0.467	49%	0.491	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	122.9	171.9	-179.4	0	0	0	0	107.6	I273 E274	V134-I273 CarbonylContact O-C 3.6Å; V134-I273 WeakPolarHBondContact O-CA 3.12Å; V134-E274 HydrophobicContact CB-CB 4.38Å; V134-E274 PolarHBondContact N-O 3.36Å; V134-E274 PolarHBondContact O-N 3.18Å
135	A	96.5	Very high	86.8	Confident	53 Å²	53	86.9 Å²	86.9	44%	0.438	48%	0.478	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	130.6	-179.5	0	0	0	0	0	111.1	F137	A135-F137 HydrophobicContact CB-CD2 4.4Å; A135-F137 HydrophobicContact CB-CE2 3.53Å; A135-F137 HydrophobicContact CB-CZ 3.88Å
136	H	95.1	Very high	88	Confident	34 Å²	34	87.3 Å²	87.3	16%	0.157	46%	0.462	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	135.2	170.2	-59.5	-73	0	0	0	108.9	A147 C148 A151 N271 L272	H136-A147 HydrophobicContact CB-CB 4.35Å; H136-C148 PolarHBondContact O-SG 2.92Å; H136-A151 VanDerWaalsContact CD2-CB 3.4Å; H136-A151 WeakPolarHBondContact CD2-CB 3.33Å; H136-N271 CarbonylContact O-C 3.55Å; H136-N271 VanDerWaalsContact O-CA 3.24Å; H136-N271 WeakPolarHBondContact O-CA 3.24Å; H136-L272 WeakPolarHBondContact CA-O 3.43Å; H136-L272 HydrophobicContact CB-CB 4.44Å; H136-L272 WeakPolarHBondContact CB-O 3.2Å; H136-L272 PolarHBondContact N-O 2.97Å; H136-L272 PolarHBondContact O-N 3.42Å
137	F	93.9	Very high	88.6	Confident	125 Å²	125	86 Å²	86	55%	0.548	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	141.7	177.6	-62.3	-85.6	0	0	0	108.8	A135 S140 N271	A135-F137 HydrophobicContact CB-CD2 4.4Å; A135-F137 HydrophobicContact CB-CE2 3.53Å; A135-F137 HydrophobicContact CB-CZ 3.88Å; F137-S140 VanDerWaalsContact O-CB 3.27Å; F137-S140 WeakPolarHBondContact O-CB 3.37Å; F137-N271 HydrophobicContact CD1-CB 3.68Å; F137-N271 HydrophobicContact CE1-CB 3.83Å
138	Q	89.3	Confident	89.1	Confident	7 Å²	7	78 Å²	78	3%	0.033	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	136.5	173.7	-171.7	-178.5	-63.4	0	0	108.6	C148 D264 N268 S269 S270	Q138-C148 HydrophobicContact CB-CB 4.32Å; Q138-D264 PolarHBondContact NE2-O 3.47Å; Q138-N268 PolarHBondContact NE2-O 3.05Å; Q138-S269 CarbonylContact O-C 3.6Å; Q138-S269 WeakPolarHBondContact O-CA 3.47Å; Q138-S269 PolarHBondContact O-OG 3.36Å; Q138-S270 PolarHBondContact N-O 3.02Å; Q138-S270 PolarHBondContact O-N 2.89Å
139	P	87.1	Confident	89.5	Confident	86 Å²	86	76.3 Å²	76.3	56%	0.558	42%	0.416	S	S	*	.	S	Bend	cis	-66.1	140	-7.5	28.6	-33.7	0	0	0	111.5
140	S	82.4	Confident	89.8	Confident	29 Å²	29	78.4 Å²	78.4	20%	0.203	42%	0.42	C	S	.	.	P	Polyproline II helix	trans	-99.8	144.1	173.8	34.6	0	0	0	0	110.5	F137 T144 A147	F137-S140 VanDerWaalsContact O-CB 3.27Å; F137-S140 WeakPolarHBondContact O-CB 3.37Å; S140-T144 PolarHBondContact OG-O 3Å; S140-A147 VanDerWaalsContact OG-CB 3.25Å; S140-A147 WeakPolarHBondContact OG-CB 3.16Å
141	Y	72.8	Confident	89.9	Confident	233 Å²	233	73.7 Å²	73.7	91%	0.914	39%	0.392	S	S	*	.	S	Bend	trans	-88.3	123.4	171	-59.5	-81.9	0	0	0	108.8
142	G	74.5	Confident	90	Very high	62 Å²	62	70.2 Å²	70.2	64%	0.639	37%	0.37	S	S	*	.	S	Bend	trans	137.2	-158.3	-179.3	0	0	0	0	0	113.4	T144	G142-T144 PolarHBondContact O-N 3.3Å
143	E	76.6	Confident	90	Very high	205 Å²	205	63.8 Å²	63.8	96%	0.958	35%	0.346	S	S	*	.	S	Bend	trans	-68	-31.5	-174.6	-63.4	-177.9	165	0	0	113.7
144	T	81.7	Confident	90	Very high	68 Å²	68	66.5 Å²	66.5	42%	0.417	34%	0.341	S	S	.	.			trans	-108.1	110.8	178.9	-55.2	0	0	0	0	109.5	S140 G142 E150	S140-T144 PolarHBondContact OG-O 3Å; G142-T144 PolarHBondContact O-N 3.3Å; T144-E150 HydrophobicContact CG2-CB 4.17Å; T144-E150 HydrophobicContact CG2-CG 4.1Å
145	I	85.3	Confident	90.1	Very high	93 Å²	93	63 Å²	63	48%	0.477	32%	0.32	S	S	.	.	S	Bend	trans	-81.4	-20	177.7	56.7	172.5	0	0	0	113.5
146	Y	90.9	Very high	90.1	Very high	69 Å²	69	60.5 Å²	60.5	27%	0.271	30%	0.299	S	S	.	.			trans	-113.4	50.8	-179.6	-50.2	-59.8	0	0	0	111.2	C148 K149 E150 G265 K266	Y146-C148 VanDerWaalsContact C-N 3.29Å; Y146-C148 PolarHBondContact O-N 3.12Å; Y146-K149 PolarHBondContact O-N 3.23Å; Y146-E150 PolarHBondContact O-N 3.07Å; Y146-G265 WeakPolarHBondContact CD1-O 3.3Å; Y146-K266 HydrophobicContact CD1-CD 4.12Å; Y146-K266 HydrophobicContact CE1-CD 3.44Å; Y146-K266 VanDerWaalsContact CE1-CD 3.44Å; Y146-K266 HydrophobicContact CE2-CD 4.16Å; Y146-K266 VanDerWaalsContact CZ-CD 3.46Å; Y146-K266 WeakPolarHBondContact OH-CD 3.3Å; Y146-K266 PolarHBondContact OH-NZ 3.31Å
147	A	93.3	Very high	90.3	Very high	13 Å²	13	63.6 Å²	63.6	11%	0.107	31%	0.312	C	S	.	.	H	α-helix	trans	-56.2	-40.2	-170.3	0	0	0	0	0	113.3	H136 S140 A151	H136-A147 HydrophobicContact CB-CB 4.35Å; S140-A147 VanDerWaalsContact OG-CB 3.25Å; S140-A147 WeakPolarHBondContact OG-CB 3.16Å; A147-A151 WeakPolarHBondContact O-CB 3.19Å; A147-A151 PolarHBondContact O-N 2.48Å
148	C	95.6	Very high	90.4	Very high	0 Å²	0	59.6 Å²	59.6	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-63.9	-48.9	178.1	-65.7	0	0	0	0	112	H136 Q138 Y146 A151 A152 Y258 S270 L272	H136-C148 PolarHBondContact O-SG 2.92Å; Q138-C148 HydrophobicContact CB-CB 4.32Å; Y146-C148 VanDerWaalsContact C-N 3.29Å; Y146-C148 PolarHBondContact O-N 3.12Å; C148-A151 PolarHBondContact O-N 3.13Å; C148-A152 PolarHBondContact O-N 2.97Å; C148-Y258 HydrophobicContact CB-CD1 4.34Å; C148-Y258 HydrophobicContact CB-CD2 3.68Å; C148-Y258 HydrophobicContact CB-CE2 4.15Å; C148-Y258 HydrophobicContact CB-CG 3.81Å; C148-S270 PolarHBondContact SG-O 2.95Å; C148-S270 VanDerWaalsContact SG-O 3.41Å; C148-L272 HydrophobicContact CB-CB 4.09Å; C148-L272 WeakPolarHBondContact O-CD2 3.36Å
149	K	95.6	Very high	90.8	Very high	5 Å²	5	59.4 Å²	59.4	2%	0.022	30%	0.299	C	S	.	.	H	α-helix	trans	-60.2	-49.6	178.4	-179.4	163.9	173.3	158.3	0	111.4	Y146 A151 A152 R153 D172 D174 Y258	Y146-K149 PolarHBondContact O-N 3.23Å; K149-A151 VanDerWaalsContact C-N 3.31Å; K149-A151 PolarHBondContact O-N 3.1Å; K149-A152 PolarHBondContact O-N 2.91Å; K149-R153 HydrophobicContact CG-CG 4.5Å; K149-R153 VanDerWaalsContact O-CG 3.3Å; K149-R153 WeakPolarHBondContact O-CG 3.38Å; K149-R153 PolarHBondContact O-N 2.73Å; K149-D172 VanDerWaalsContact NZ-CG 3.31Å; K149-D172 IonicContact NZ-OD1 3.74Å; K149-D172 PolarHBondContact NZ-OD1 3.23Å; K149-D172 IonicContact NZ-OD2 2.88Å; K149-D172 PolarHBondContact NZ-OD2 3.25Å; K149-D174 WeakPolarHBondContact CE-OD2 3.45Å; K149-D174 IonicContact NZ-OD2 2.93Å; K149-D174 PolarHBondContact NZ-OD2 3.39Å; K149-Y258 HydrophobicContact CB-CE2 4.42Å; K149-Y258 VanDerWaalsContact CB-OH 3.3Å; K149-Y258 WeakPolarHBondContact CB-OH 3.25Å; K149-Y258 WeakPolarHBondContact CG-OH 3.31Å
150	E	95.2	Very high	91.1	Very high	65 Å²	65	63.6 Å²	63.6	30%	0.304	31%	0.308	S	S	.	.	H	α-helix	trans	-68.5	-30.9	-178	-69.5	-56.6	125.3	0	0	112.4	T144 Y146 R153 R154	T144-E150 HydrophobicContact CG2-CB 4.17Å; T144-E150 HydrophobicContact CG2-CG 4.1Å; Y146-E150 PolarHBondContact O-N 3.07Å; E150-R153 IonicContact OE1-NH1 3.94Å; E150-R153 PolarHBondContact OE1-NH1 3.11Å; E150-R153 VanDerWaalsContact OE1-NH1 3.17Å; E150-R153 IonicContact OE2-NH1 3.89Å; E150-R154 VanDerWaalsContact O-CB 3.28Å; E150-R154 WeakPolarHBondContact O-CB 3.27Å; E150-R154 PolarHBondContact O-N 3.25Å
151	A	95.9	Very high	91.6	Very high	0 Å²	0	67.3 Å²	67.3	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-63.7	-50	171	0	0	0	0	0	112.4	H136 A147 C148 K149 R153 R154 M155 L272	H136-A151 VanDerWaalsContact CD2-CB 3.4Å; H136-A151 WeakPolarHBondContact CD2-CB 3.33Å; A147-A151 WeakPolarHBondContact O-CB 3.19Å; A147-A151 PolarHBondContact O-N 2.48Å; C148-A151 PolarHBondContact O-N 3.13Å; K149-A151 VanDerWaalsContact C-N 3.31Å; K149-A151 PolarHBondContact O-N 3.1Å; A151-R153 VanDerWaalsContact C-N 3.34Å; A151-R153 PolarHBondContact O-N 2.77Å; A151-R154 PolarHBondContact O-N 3.07Å; A151-M155 WeakPolarHBondContact O-CG 3.35Å; A151-M155 PolarHBondContact O-N 2.75Å; A151-L272 HydrophobicContact CB-CD2 4.04Å
152	A	97.3	Very high	92.7	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-57.4	-46.2	176.3	0	0	0	0	0	112	C148 K149 R154 M155 I156 I175 Y258 F260 L272	C148-A152 PolarHBondContact O-N 2.97Å; K149-A152 PolarHBondContact O-N 2.91Å; A152-R154 PolarHBondContact O-N 2.83Å; A152-M155 PolarHBondContact O-N 3.27Å; A152-I156 WeakPolarHBondContact O-CG1 3.47Å; A152-I156 PolarHBondContact O-N 2.84Å; A152-I175 HydrophobicContact CB-CD1 4.02Å; A152-Y258 HydrophobicContact CB-CE1 4.4Å; A152-F260 HydrophobicContact CB-CE1 3.94Å; A152-L272 HydrophobicContact CB-CD2 4.09Å
153	R	97.6	Very high	93.8	Very high	46 Å²	46	53.3 Å²	53.3	17%	0.174	25%	0.249	C	C	.	.	H	α-helix	trans	-61.1	-44	177.6	-69	-177.6	73.6	-161.6	6.6	112.7	K149 E150 A151 M155 I156 K157 I175 D178	K149-R153 HydrophobicContact CG-CG 4.5Å; K149-R153 VanDerWaalsContact O-CG 3.3Å; K149-R153 WeakPolarHBondContact O-CG 3.38Å; K149-R153 PolarHBondContact O-N 2.73Å; E150-R153 IonicContact OE1-NH1 3.94Å; E150-R153 PolarHBondContact OE1-NH1 3.11Å; E150-R153 VanDerWaalsContact OE1-NH1 3.17Å; E150-R153 IonicContact OE2-NH1 3.89Å; A151-R153 VanDerWaalsContact C-N 3.34Å; A151-R153 PolarHBondContact O-N 2.77Å; R153-M155 VanDerWaalsContact C-N 3.32Å; R153-M155 PolarHBondContact O-N 3.14Å; R153-I156 PolarHBondContact O-N 3.46Å; R153-K157 WeakPolarHBondContact O-CB 3.18Å; R153-K157 VanDerWaalsContact O-CG 3.3Å; R153-K157 WeakPolarHBondContact O-CG 3.5Å; R153-K157 PolarHBondContact O-N 3.12Å; R153-I175 HydrophobicContact CG-CD1 3.47Å; R153-I175 VanDerWaalsContact CG-CD1 3.47Å; R153-D178 WeakPolarHBondContact CB-OD2 3.43Å; R153-D178 WeakPolarHBondContact CG-OD2 3.21Å; R153-D178 IonicContact CZ-OD2 3.77Å; R153-D178 IonicContact NE-OD2 2.72Å; R153-D178 PolarHBondContact NE-OD2 2.7Å; R153-D178 IonicContact NH2-OD1 2.72Å; R153-D178 IonicContact NH2-OD2 3.59Å; R153-D178 PolarHBondContact NH2-OD2 3.28Å
154	R	97.2	Very high	94.8	Very high	127 Å²	127	43.5 Å²	43.5	48%	0.479	20%	0.203	S	C	.	.	H	α-helix	trans	-61	-43.1	177.9	-168.3	-170.6	-43.1	100.5	10.4	111.3	E150 A151 A152 K157 S158	E150-R154 VanDerWaalsContact O-CB 3.28Å; E150-R154 WeakPolarHBondContact O-CB 3.27Å; E150-R154 PolarHBondContact O-N 3.25Å; A151-R154 PolarHBondContact O-N 3.07Å; A152-R154 PolarHBondContact O-N 2.83Å; R154-K157 PolarHBondContact O-N 3.39Å; R154-S158 WeakPolarHBondContact O-CB 3.49Å; R154-S158 PolarHBondContact O-N 2.9Å; R154-S158 PolarHBondContact O-OG 2.86Å
155	M	97.8	Very high	95.6	Very high	3 Å²	3	40.3 Å²	40.3	2%	0.015	18%	0.183	C	C	.	.	H	α-helix	trans	-61.2	-48.8	177.2	-70.6	-178.7	75	0	0	111.4	A151 A152 R153 K157 S158 A159 M246 I248 R252 A254 E274	A151-M155 WeakPolarHBondContact O-CG 3.35Å; A151-M155 PolarHBondContact O-N 2.75Å; A152-M155 PolarHBondContact O-N 3.27Å; R153-M155 VanDerWaalsContact C-N 3.32Å; R153-M155 PolarHBondContact O-N 3.14Å; M155-K157 PolarHBondContact O-N 2.92Å; M155-S158 PolarHBondContact O-N 2.94Å; M155-S158 VanDerWaalsContact O-N 3.11Å; M155-S158 PolarHBondContact O-OG 3.25Å; M155-A159 PolarHBondContact O-N 2.96Å; M155-M246 HydrophobicContact CB-CE 3.61Å; M155-M246 HydrophobicContact CE-CE 4.36Å; M155-M246 HydrophobicContact CG-CE 4.49Å; M155-M246 HydrophobicContact SD-CE 4.15Å; M155-I248 HydrophobicContact CB-CG1 4.26Å; M155-I248 HydrophobicContact CE-CG1 4.22Å; M155-R252 HydrophobicContact CE-CB 4.08Å; M155-A254 HydrophobicContact CE-CB 3.84Å; M155-A254 HydrophobicContact SD-CB 3.62Å; M155-E274 HydrophobicContact CE-CG 3.92Å; M155-E274 HydrophobicContact SD-CB 4.28Å; M155-E274 HydrophobicContact SD-CG 3.92Å
156	I	98.3	Very high	96.2	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-58.7	-45.1	177.1	-67.6	164.3	0	0	0	111.9	A152 R153 S158 A159 I163 I175 D178 L179 R186 M246	A152-I156 WeakPolarHBondContact O-CG1 3.47Å; A152-I156 PolarHBondContact O-N 2.84Å; R153-I156 PolarHBondContact O-N 3.46Å; I156-S158 VanDerWaalsContact C-N 3.26Å; I156-S158 PolarHBondContact O-N 2.83Å; I156-A159 WeakPolarHBondContact O-CB 3.46Å; I156-A159 PolarHBondContact O-N 2.89Å; I156-I163 HydrophobicContact CG2-CD1 4.17Å; I156-I175 HydrophobicContact CD1-CD1 4.3Å; I156-I175 HydrophobicContact CD1-CG2 3.81Å; I156-D178 HydrophobicContact CG2-CB 3.8Å; I156-L179 HydrophobicContact CD1-CD2 4.08Å; I156-L179 HydrophobicContact CD1-CG 4.28Å; I156-L179 HydrophobicContact CG1-CD2 4.13Å; I156-L179 HydrophobicContact CG2-CD2 3.83Å; I156-L179 HydrophobicContact CG2-CG 4.31Å; I156-R186 PolarHBondContact O-NH1 3.42Å; I156-R186 PolarHBondContact O-NH2 2.86Å; I156-R186 VanDerWaalsContact O-NH2 3.12Å; I156-M246 HydrophobicContact CD1-SD 3.99Å; I156-M246 HydrophobicContact CG1-CE 4.09Å; I156-M246 HydrophobicContact CG1-SD 3.52Å; I156-M246 VanDerWaalsContact CG1-SD 3.52Å
157	K	97.8	Very high	96.5	Very high	100 Å²	100	32.7 Å²	32.7	44%	0.435	15%	0.148	S	C	.	.	H	α-helix	trans	-65.8	-29.7	178	-72	175.6	-175.1	179.1	0	112.7	R153 R154 M155 D178 R186	R153-K157 WeakPolarHBondContact O-CB 3.18Å; R153-K157 VanDerWaalsContact O-CG 3.3Å; R153-K157 WeakPolarHBondContact O-CG 3.5Å; R153-K157 PolarHBondContact O-N 3.12Å; R154-K157 PolarHBondContact O-N 3.39Å; M155-K157 PolarHBondContact O-N 2.92Å; K157-D178 WeakPolarHBondContact CE-OD1 3.32Å; K157-D178 VanDerWaalsContact CE-OD2 3.25Å; K157-D178 WeakPolarHBondContact CE-OD2 3.29Å; K157-D178 IonicContact NZ-OD1 3.24Å; K157-D178 IonicContact NZ-OD2 2.78Å; K157-R186 PolarHBondContact O-NH1 3.02Å
158	S	96.9	Very high	96.6	Very high	41 Å²	41	33 Å²	33	29%	0.287	15%	0.148	S	C	.	.	H	α-helix	trans	-82.4	-10.7	179.8	76.2	0	0	0	0	114.7	R154 M155 I156 R252	R154-S158 WeakPolarHBondContact O-CB 3.49Å; R154-S158 PolarHBondContact O-N 2.9Å; R154-S158 PolarHBondContact O-OG 2.86Å; M155-S158 PolarHBondContact O-N 2.94Å; M155-S158 VanDerWaalsContact O-N 3.11Å; M155-S158 PolarHBondContact O-OG 3.25Å; I156-S158 VanDerWaalsContact C-N 3.26Å; I156-S158 PolarHBondContact O-N 2.83Å; S158-R252 PolarHBondContact OG-NH1 3.12Å; S158-R252 VanDerWaalsContact OG-NH1 3.1Å; S158-R252 PolarHBondContact OG-NH2 2.95Å
159	A	96.7	Very high	96.6	Very high	2 Å²	2	33.9 Å²	33.9	2%	0.017	15%	0.154	C	C	.	.			trans	-64	145.8	-177.7	0	0	0	0	0	112.5	M155 I156 I163 R186 V188 I248	M155-A159 PolarHBondContact O-N 2.96Å; I156-A159 WeakPolarHBondContact O-CB 3.46Å; I156-A159 PolarHBondContact O-N 2.89Å; A159-I163 HydrophobicContact CB-CD1 3.69Å; A159-I163 HydrophobicContact CB-CG1 3.52Å; A159-R186 PolarHBondContact O-NH1 3.45Å; A159-V188 HydrophobicContact CB-CG1 4.45Å; A159-I248 HydrophobicContact CB-CD1 4.38Å; A159-I248 HydrophobicContact CB-CG2 3.71Å
160	K	94.4	Very high	96.6	Very high	174 Å²	174	33.7 Å²	33.7	76%	0.757	15%	0.153	S	C	*	.	S	Bend	trans	-131.8	-30.8	-177.7	-63.8	-177.9	-176.9	177.6	0	113.6	D249	K160-D249 PolarHBondContact N-OD1 3.23Å; K160-D249 PolarHBondContact N-OD2 3.34Å
161	E	92.9	Very high	96.7	Very high	108 Å²	108	32.9 Å²	32.9	51%	0.505	15%	0.153	S	C	.	.	S	Bend	trans	-116.4	-45.2	-169.7	-62.1	-171.6	132.4	0	0	112.7	P120 P189 D249	P120-E161 HydrophobicContact CG-CB 4.23Å; E161-P189 VanDerWaalsContact O-CD 3.25Å; E161-P189 WeakPolarHBondContact O-CD 3.24Å; E161-D249 HydrophobicContact CB-CB 4.45Å; E161-D249 PolarHBondContact N-OD1 3.46Å
162	V	95.6	Very high	96.8	Very high	0 Å²	0	33 Å²	33	0%	0	15%	0.154	C	C	.	.			trans	-159.5	147.9	179.5	69.6	0	0	0	0	111.2	W119 P120 P189 Y191 D249	W119-V162 HydrophobicContact CE3-CG2 3.84Å; W119-V162 HydrophobicContact CZ3-CG2 3.92Å; P120-V162 HydrophobicContact CG-CB 4.08Å; P120-V162 HydrophobicContact CG-CG1 3.56Å; V162-P189 HydrophobicContact CG2-CB 4.45Å; V162-Y191 HydrophobicContact CG2-CD2 3.89Å; V162-Y191 HydrophobicContact CG2-CE2 3.87Å; V162-D249 PolarHBondContact N-OD1 3.08Å; V162-D249 PolarHBondContact O-N 3.32Å
163	I	97.8	Very high	96.7	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	124.4	167.6	-57.8	172.9	0	0	0	107.7	I156 A159 I165 L179 A182 V188 P189 V190 Y191 M246 I248	I156-I163 HydrophobicContact CG2-CD1 4.17Å; A159-I163 HydrophobicContact CB-CD1 3.69Å; A159-I163 HydrophobicContact CB-CG1 3.52Å; I163-I165 HydrophobicContact CG2-CD1 3.87Å; I163-I165 HydrophobicContact CG2-CG1 3.93Å; I163-L179 HydrophobicContact CD1-CD2 4.16Å; I163-L179 HydrophobicContact CG2-CD2 4Å; I163-A182 HydrophobicContact CD1-CB 3.88Å; I163-V188 HydrophobicContact CD1-CG1 4.27Å; I163-V188 HydrophobicContact CG1-CG1 4Å; I163-P189 PolarHBondContact N-O 2.74Å; I163-V190 HydrophobicContact CB-CG1 4.31Å; I163-V190 HydrophobicContact CB-CG2 4.08Å; I163-V190 HydrophobicContact CD1-CG2 4.07Å; I163-V190 HydrophobicContact CG1-CG2 4.45Å; I163-V190 HydrophobicContact CG2-CG1 4.29Å; I163-V190 CarbonylContact O-C 3.44Å; I163-V190 VanDerWaalsContact O-CA 3.31Å; I163-V190 WeakPolarHBondContact O-CA 3.46Å; I163-Y191 PolarHBondContact O-N 2.86Å; I163-M246 HydrophobicContact CG2-CG 4.46Å; I163-I248 HydrophobicContact CB-CD1 4.23Å; I163-I248 HydrophobicContact CG1-CD1 3.86Å; I163-I248 HydrophobicContact CG2-CD1 3.86Å
164	A	97.7	Very high	96.7	Very high	0 Å²	0	37 Å²	37	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	124.5	174.7	0	0	0	0	0	109.1	W119 Y191 M246 L247 F287	W119-A164 HydrophobicContact CH2-CB 3.42Å; W119-A164 VanDerWaalsContact CH2-CB 3.42Å; W119-A164 HydrophobicContact CZ3-CB 3.65Å; A164-Y191 CarbonylContact C-O 3.56Å; A164-Y191 WeakPolarHBondContact CA-O 3.41Å; A164-M246 CarbonylContact O-C 3.58Å; A164-M246 VanDerWaalsContact O-CA 3.27Å; A164-M246 WeakPolarHBondContact O-CA 3.39Å; A164-L247 HydrophobicContact CB-CB 4.08Å; A164-L247 PolarHBondContact N-O 3.41Å; A164-L247 PolarHBondContact O-N 2.95Å; A164-F287 HydrophobicContact CB-CD1 4.16Å; A164-F287 HydrophobicContact CB-CD2 3.71Å; A164-F287 HydrophobicContact CB-CE1 3.97Å; A164-F287 HydrophobicContact CB-CE2 3.52Å; A164-F287 HydrophobicContact CB-CG 4.05Å; A164-F287 HydrophobicContact CB-CZ 3.68Å
165	I	98.1	Very high	96.7	Very high	0 Å²	0	31 Å²	31	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	129.6	-175.7	-66.6	166.7	0	0	0	109	I163 T167 L179 Y191 I192 L193 M246 F260	I163-I165 HydrophobicContact CG2-CD1 3.87Å; I163-I165 HydrophobicContact CG2-CG1 3.93Å; I165-T167 HydrophobicContact CG2-CG2 3.88Å; I165-L179 HydrophobicContact CD1-CD1 3.75Å; I165-L179 HydrophobicContact CD1-CD2 3.66Å; I165-L179 HydrophobicContact CD1-CG 4.35Å; I165-Y191 PolarHBondContact N-O 3.05Å; I165-I192 HydrophobicContact CB-CG2 4.41Å; I165-I192 HydrophobicContact CG2-CG2 4.37Å; I165-I192 CarbonylContact O-C 3.56Å; I165-I192 WeakPolarHBondContact O-CA 3.46Å; I165-L193 PolarHBondContact O-N 2.87Å; I165-M246 HydrophobicContact CD1-SD 4.35Å; I165-M246 HydrophobicContact CG1-CB 4.18Å; I165-M246 HydrophobicContact CG1-CG 3.77Å; I165-M246 HydrophobicContact CG1-SD 4.2Å; I165-F260 HydrophobicContact CG2-CD2 4.39Å; I165-F260 HydrophobicContact CG2-CE2 3.86Å
166	V	97.9	Very high	96.7	Very high	1 Å²	1	30.9 Å²	30.9	1%	0.006	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	121.8	165.2	-173.1	0	0	0	0	107.4	L193 E243 R244 F245 F287 L290	V166-L193 WeakPolarHBondContact CA-O 3.38Å; V166-L193 HydrophobicContact CG1-CB 4.46Å; V166-L193 HydrophobicContact CG2-CB 4.22Å; V166-L193 HydrophobicContact CG2-CD1 4.17Å; V166-E243 HydrophobicContact CG1-CB 4.08Å; V166-R244 WeakPolarHBondContact O-CA 3.5Å; V166-F245 HydrophobicContact CB-CD1 4.04Å; V166-F245 HydrophobicContact CB-CE1 3.84Å; V166-F245 HydrophobicContact CB-CZ 4.16Å; V166-F245 HydrophobicContact CG1-CE1 4.36Å; V166-F245 HydrophobicContact CG2-CD1 4.24Å; V166-F245 HydrophobicContact CG2-CE1 3.61Å; V166-F245 HydrophobicContact CG2-CE2 3.93Å; V166-F245 HydrophobicContact CG2-CZ 3.44Å; V166-F245 VanDerWaalsContact CG2-CZ 3.44Å; V166-F245 PolarHBondContact N-O 2.76Å; V166-F245 PolarHBondContact O-N 3.46Å; V166-F245 VanDerWaalsContact O-O 3.09Å; V166-F287 HydrophobicContact CG2-CD2 3.59Å; V166-F287 HydrophobicContact CG2-CE2 3.92Å; V166-L290 HydrophobicContact CB-CD1 4.48Å; V166-L290 HydrophobicContact CG1-CD1 3.79Å; V166-L290 HydrophobicContact CG2-CD1 3.98Å
167	T	96.6	Very high	96.6	Very high	2 Å²	2	37.3 Å²	37.3	1%	0.012	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.9	155.2	-179.4	-169.3	0	0	0	0	112.9	I165 S169 L170 L193 L194 D195 F260	I165-T167 HydrophobicContact CG2-CG2 3.88Å; T167-S169 PolarHBondContact OG1-N 2.68Å; T167-S169 PolarHBondContact OG1-O 3.33Å; T167-L170 HydrophobicContact CG2-CB 4.07Å; T167-L193 PolarHBondContact N-O 2.77Å; T167-L194 HydrophobicContact CG2-CD2 3.46Å; T167-L194 VanDerWaalsContact CG2-CD2 3.46Å; T167-L194 WeakPolarHBondContact O-CA 3.15Å; T167-D195 PolarHBondContact O-N 3.37Å; T167-D195 VanDerWaalsContact O-N 3.12Å; T167-F260 HydrophobicContact CG2-CD2 4.14Å
168	D	94.9	Very high	96.7	Very high	20 Å²	20	33.3 Å²	33.3	11%	0.107	16%	0.162	C	C	.	.	S	Bend	trans	-93.8	-2.6	174.4	73.5	-31	0	0	0	113.2	D195 C198 V241 H242 R244 R259	D168-D195 HydrophobicContact CB-CB 4.17Å; D168-C198 WeakPolarHBondContact O-CB 3.45Å; D168-C198 PolarHBondContact O-SG 3.11Å; D168-V241 WeakPolarHBondContact CB-O 3.44Å; D168-H242 IonicContact OD2-ND1 3.58Å; D168-R244 VanDerWaalsContact CG-NH2 3.34Å; D168-R244 IonicContact OD1-CZ 3.87Å; D168-R244 IonicContact OD1-NE 2.93Å; D168-R244 PolarHBondContact OD1-NE 3.39Å; D168-R244 IonicContact OD1-NH2 3.98Å; D168-R244 IonicContact OD2-CZ 2.9Å; D168-R244 IonicContact OD2-NE 2.68Å; D168-R244 PolarHBondContact OD2-NE 3.42Å; D168-R244 IonicContact OD2-NH2 3.3Å; D168-R244 PolarHBondContact OD2-NH2 2.73Å; D168-R259 WeakPolarHBondContact OD1-CD 3.27Å; D168-R259 WeakPolarHBondContact OD1-CG 3.4Å
169	S	95.4	Very high	96.7	Very high	17 Å²	17	31.3 Å²	31.3	12%	0.119	15%	0.149	C	C	.	.			trans	-159.2	121.5	176	-173.9	0	0	0	0	111.4	T167 F260 N261	T167-S169 PolarHBondContact OG1-N 2.68Å; T167-S169 PolarHBondContact OG1-O 3.33Å; S169-F260 WeakPolarHBondContact O-CB 3.35Å; S169-F260 PolarHBondContact O-N 3.12Å; S169-N261 PolarHBondContact OG-ND2 2.94Å
170	L	96.7	Very high	96.7	Very high	1 Å²	1	33.9 Å²	33.9	1%	0.005	16%	0.16	C	C	.	.	B	Isolated β-bridge	trans	-132.3	87.9	173.2	-175.8	63.4	0	0	0	109	T167 I175 L179 I192 L194 F202 F260	T167-L170 HydrophobicContact CG2-CB 4.07Å; L170-I175 HydrophobicContact CD1-CG2 4.06Å; L170-L179 HydrophobicContact CD1-CD1 4.44Å; L170-L179 HydrophobicContact CD2-CD1 4.44Å; L170-I192 HydrophobicContact CD2-CD1 3.82Å; L170-I192 HydrophobicContact CD2-CG2 3.87Å; L170-L194 HydrophobicContact CB-CD2 3.81Å; L170-L194 HydrophobicContact CD2-CD2 4.37Å; L170-F202 HydrophobicContact CB-CD2 4.16Å; L170-F202 HydrophobicContact CD2-CD2 3.98Å; L170-F202 HydrophobicContact CD2-CE2 3.67Å; L170-F202 HydrophobicContact CG-CD2 4.04Å; L170-F202 HydrophobicContact CG-CE2 4.13Å; L170-F202 VanDerWaalsContact O-CD2 3.31Å; L170-F202 WeakPolarHBondContact O-CD2 3.02Å; L170-F260 CarbonylContact C-O 3.45Å; L170-F260 WeakPolarHBondContact CA-O 3.41Å; L170-F260 HydrophobicContact CD1-CB 3.59Å; L170-F260 HydrophobicContact CD1-CD2 3.87Å; L170-F260 HydrophobicContact CD1-CG 4.08Å
171	T	97.4	Very high	96.7	Very high	48 Å²	48	28.6 Å²	28.6	29%	0.294	14%	0.138	S	C	.	.			trans	-134.3	4.3	178.9	66.2	0	0	0	0	113.4	A201 M205 F260 N261	T171-A201 HydrophobicContact CG2-CB 4.04Å; T171-M205 WeakPolarHBondContact CA-SD 3.33Å; T171-F260 PolarHBondContact N-O 3.14Å; T171-N261 VanDerWaalsContact OG1-CB 3.32Å; T171-N261 WeakPolarHBondContact OG1-CB 3.35Å
172	D	97	Very high	96.9	Very high	3 Å²	3	23.4 Å²	23.4	2%	0.016	11%	0.114	C	C	.	.			trans	-76.9	121.1	174.7	-169.8	-60.5	0	0	0	110.6	K149 D174 I175 F176 F260	K149-D172 VanDerWaalsContact NZ-CG 3.31Å; K149-D172 IonicContact NZ-OD1 3.74Å; K149-D172 PolarHBondContact NZ-OD1 3.23Å; K149-D172 IonicContact NZ-OD2 2.88Å; K149-D172 PolarHBondContact NZ-OD2 3.25Å; D172-D174 VanDerWaalsContact C-N 3.35Å; D172-D174 PolarHBondContact O-N 3.11Å; D172-D174 WeakPolarHBondContact OD1-CB 3.5Å; D172-D174 PolarHBondContact OD1-N 3.27Å; D172-I175 HydrophobicContact CB-CB 4.19Å; D172-I175 HydrophobicContact CB-CG1 4Å; D172-I175 PolarHBondContact OD1-N 3.12Å; D172-F176 WeakPolarHBondContact O-CB 3.31Å; D172-F176 PolarHBondContact O-N 2.96Å; D172-F260 WeakPolarHBondContact CB-O 3.08Å; D172-F260 PolarHBondContact N-O 3.43Å
173	L	96.7	Very high	96.9	Very high	76 Å²	76	23.7 Å²	23.7	40%	0.398	12%	0.116	S	C	.	.	H	α-helix	trans	-66.5	-33.6	-176.5	-63.4	177.4	0	0	0	113.1	R177 M205 V209	L173-R177 WeakPolarHBondContact O-CB 2.98Å; L173-R177 WeakPolarHBondContact O-CD 3.47Å; L173-R177 WeakPolarHBondContact O-CG 3.38Å; L173-R177 PolarHBondContact O-N 3.5Å; L173-M205 HydrophobicContact CD2-CG 3.69Å; L173-M205 HydrophobicContact CD2-SD 4.07Å; L173-V209 HydrophobicContact CD2-CG2 3.57Å
174	D	96.8	Very high	96.7	Very high	54 Å²	54	26.5 Å²	26.5	29%	0.289	14%	0.135	S	C	.	.	H	α-helix	trans	-74	-41.4	-177.3	-59	-44.1	0	0	0	110.5	K149 D172 R177 D178	K149-D174 WeakPolarHBondContact CE-OD2 3.45Å; K149-D174 IonicContact NZ-OD2 2.93Å; K149-D174 PolarHBondContact NZ-OD2 3.39Å; D172-D174 VanDerWaalsContact C-N 3.35Å; D172-D174 PolarHBondContact O-N 3.11Å; D172-D174 WeakPolarHBondContact OD1-CB 3.5Å; D172-D174 PolarHBondContact OD1-N 3.27Å; D174-R177 PolarHBondContact O-N 3.09Å; D174-R177 IonicContact OD1-NH1 3.13Å; D174-D178 VanDerWaalsContact O-CG 3.3Å; D174-D178 PolarHBondContact O-N 3.43Å
175	I	97.8	Very high	96.5	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-62.8	-46.7	173.7	-61	-72.7	0	0	0	110	A152 R153 I156 L170 D172 R177 D178 L179 F260	A152-I175 HydrophobicContact CB-CD1 4.02Å; R153-I175 HydrophobicContact CG-CD1 3.47Å; R153-I175 VanDerWaalsContact CG-CD1 3.47Å; I156-I175 HydrophobicContact CD1-CD1 4.3Å; I156-I175 HydrophobicContact CD1-CG2 3.81Å; L170-I175 HydrophobicContact CD1-CG2 4.06Å; D172-I175 HydrophobicContact CB-CB 4.19Å; D172-I175 HydrophobicContact CB-CG1 4Å; D172-I175 PolarHBondContact OD1-N 3.12Å; I175-R177 VanDerWaalsContact C-N 3.34Å; I175-R177 PolarHBondContact O-N 2.98Å; I175-D178 PolarHBondContact O-N 3.14Å; I175-L179 HydrophobicContact CG2-CD1 4.24Å; I175-L179 WeakPolarHBondContact O-CG 3.5Å; I175-L179 PolarHBondContact O-N 3.42Å; I175-F260 HydrophobicContact CG1-CD1 4.45Å; I175-F260 HydrophobicContact CG2-CB 4.42Å; I175-F260 HydrophobicContact CG2-CD1 4.4Å; I175-F260 HydrophobicContact CG2-CG 4.28Å
176	F	97.6	Very high	96.4	Very high	1 Å²	1	37.2 Å²	37.2	0%	0.004	18%	0.182	C	C	.	.	H	α-helix	trans	-62.9	-39	179.2	-176.8	-105.4	0	0	0	112.6	D172 L179 Q180 F202 M205 V211	D172-F176 WeakPolarHBondContact O-CB 3.31Å; D172-F176 PolarHBondContact O-N 2.96Å; F176-L179 PolarHBondContact O-N 3.4Å; F176-Q180 WeakPolarHBondContact O-CB 3.32Å; F176-Q180 PolarHBondContact O-N 3.24Å; F176-F202 HydrophobicContact CD2-CE2 4.02Å; F176-F202 AromaticContact CE2-CE2 3.89Å; F176-F202 HydrophobicContact CE2-CE2 3.89Å; F176-F202 HydrophobicContact CE2-CZ 4.09Å; F176-M205 HydrophobicContact CB-CE 3.83Å; F176-M205 HydrophobicContact CB-SD 4.15Å; F176-M205 HydrophobicContact CD1-CE 4.1Å; F176-M205 HydrophobicContact CD2-CE 3.59Å; F176-M205 HydrophobicContact CE2-CE 4.17Å; F176-M205 HydrophobicContact CG-CE 3.55Å; F176-M205 HydrophobicContact CG-SD 4.37Å; F176-V211 HydrophobicContact CE1-CB 4.31Å; F176-V211 HydrophobicContact CE1-CG1 4.42Å; F176-V211 HydrophobicContact CE1-CG2 4.28Å; F176-V211 HydrophobicContact CZ-CB 4.44Å; F176-V211 HydrophobicContact CZ-CG1 4.17Å
177	R	96.8	Very high	96.2	Very high	135 Å²	135	46.4 Å²	46.4	51%	0.509	22%	0.216	S	C	.	.	H	α-helix	trans	-62.1	-43.7	174.2	-77.7	166.5	178.7	173.9	-3	112.1	L173 D174 I175 L179 Q180 E181	L173-R177 WeakPolarHBondContact O-CB 2.98Å; L173-R177 WeakPolarHBondContact O-CD 3.47Å; L173-R177 WeakPolarHBondContact O-CG 3.38Å; L173-R177 PolarHBondContact O-N 3.5Å; D174-R177 PolarHBondContact O-N 3.09Å; D174-R177 IonicContact OD1-NH1 3.13Å; I175-R177 VanDerWaalsContact C-N 3.34Å; I175-R177 PolarHBondContact O-N 2.98Å; R177-L179 VanDerWaalsContact C-N 3.29Å; R177-L179 PolarHBondContact O-N 2.93Å; R177-Q180 PolarHBondContact O-N 3.39Å; R177-E181 WeakPolarHBondContact O-CB 3.48Å; R177-E181 PolarHBondContact O-N 3.13Å
178	D	98.1	Very high	96.2	Very high	16 Å²	16	46.4 Å²	46.4	9%	0.086	22%	0.217	C	C	.	.	H	α-helix	trans	-64.2	-35.7	177.5	-67.4	-23.3	0	0	0	111.1	R153 I156 K157 D174 I175 A182	R153-D178 WeakPolarHBondContact CB-OD2 3.43Å; R153-D178 WeakPolarHBondContact CG-OD2 3.21Å; R153-D178 IonicContact CZ-OD2 3.77Å; R153-D178 IonicContact NE-OD2 2.72Å; R153-D178 PolarHBondContact NE-OD2 2.7Å; R153-D178 IonicContact NH2-OD1 2.72Å; R153-D178 IonicContact NH2-OD2 3.59Å; R153-D178 PolarHBondContact NH2-OD2 3.28Å; I156-D178 HydrophobicContact CG2-CB 3.8Å; K157-D178 WeakPolarHBondContact CE-OD1 3.32Å; K157-D178 VanDerWaalsContact CE-OD2 3.25Å; K157-D178 WeakPolarHBondContact CE-OD2 3.29Å; K157-D178 IonicContact NZ-OD1 3.24Å; K157-D178 IonicContact NZ-OD2 2.78Å; D174-D178 VanDerWaalsContact O-CG 3.3Å; D174-D178 PolarHBondContact O-N 3.43Å; I175-D178 PolarHBondContact O-N 3.14Å; D178-A182 PolarHBondContact O-N 3.02Å; D178-A182 VanDerWaalsContact O-N 3.08Å
179	L	97.6	Very high	96.3	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-69.4	-41.2	173.1	-67	170.8	0	0	0	112.8	I156 I163 I165 L170 I175 F176 R177 E181 A182 C183 V190 I192 M219	I156-L179 HydrophobicContact CD1-CD2 4.08Å; I156-L179 HydrophobicContact CD1-CG 4.28Å; I156-L179 HydrophobicContact CG1-CD2 4.13Å; I156-L179 HydrophobicContact CG2-CD2 3.83Å; I156-L179 HydrophobicContact CG2-CG 4.31Å; I163-L179 HydrophobicContact CD1-CD2 4.16Å; I163-L179 HydrophobicContact CG2-CD2 4Å; I165-L179 HydrophobicContact CD1-CD1 3.75Å; I165-L179 HydrophobicContact CD1-CD2 3.66Å; I165-L179 HydrophobicContact CD1-CG 4.35Å; L170-L179 HydrophobicContact CD1-CD1 4.44Å; L170-L179 HydrophobicContact CD2-CD1 4.44Å; I175-L179 HydrophobicContact CG2-CD1 4.24Å; I175-L179 WeakPolarHBondContact O-CG 3.5Å; I175-L179 PolarHBondContact O-N 3.42Å; F176-L179 PolarHBondContact O-N 3.4Å; R177-L179 VanDerWaalsContact C-N 3.29Å; R177-L179 PolarHBondContact O-N 2.93Å; L179-E181 VanDerWaalsContact C-N 3.32Å; L179-A182 WeakPolarHBondContact O-CB 3.34Å; L179-A182 PolarHBondContact O-N 3.17Å; L179-C183 PolarHBondContact O-N 2.86Å; L179-C183 PolarHBondContact O-SG 3.27Å; L179-V190 HydrophobicContact CD2-CG1 4.16Å; L179-I192 HydrophobicContact CD1-CD1 4.36Å; L179-M219 HydrophobicContact CB-CE 4.16Å
180	Q	95.9	Very high	96.4	Very high	55 Å²	55	45.5 Å²	45.5	26%	0.257	21%	0.211	S	C	.	.	H	α-helix	trans	-63.3	-41	176.9	-177	-178.2	3.8	0	0	111.2	F176 R177 C183 S184 L216	F176-Q180 WeakPolarHBondContact O-CB 3.32Å; F176-Q180 PolarHBondContact O-N 3.24Å; R177-Q180 PolarHBondContact O-N 3.39Å; Q180-C183 PolarHBondContact O-N 2.92Å; Q180-S184 VanDerWaalsContact O-CB 3.24Å; Q180-S184 WeakPolarHBondContact O-CB 3.33Å; Q180-S184 PolarHBondContact O-N 3.3Å; Q180-S184 PolarHBondContact O-OG 3.3Å; Q180-L216 HydrophobicContact CG-CD2 4.28Å
181	E	96.1	Very high	96.4	Very high	63 Å²	63	45.4 Å²	45.4	29%	0.294	21%	0.211	S	C	.	.	H	α-helix	trans	-61.1	-45.5	173.7	-179.6	-79.5	153.5	0	0	110.9	R177 L179 C183 S184 H185 R186	R177-E181 WeakPolarHBondContact O-CB 3.48Å; R177-E181 PolarHBondContact O-N 3.13Å; L179-E181 VanDerWaalsContact C-N 3.32Å; E181-C183 VanDerWaalsContact C-N 3.32Å; E181-C183 PolarHBondContact O-N 2.85Å; E181-S184 PolarHBondContact O-N 3.37Å; E181-H185 WeakPolarHBondContact O-CB 3.47Å; E181-H185 PolarHBondContact O-N 2.96Å; E181-R186 PolarHBondContact O-N 2.84Å; E181-R186 IonicContact OE1-NE 2.92Å; E181-R186 PolarHBondContact OE1-NE 2.83Å; E181-R186 IonicContact OE2-CZ 3.17Å; E181-R186 VanDerWaalsContact OE2-CZ 3.24Å; E181-R186 IonicContact OE2-NE 3.17Å; E181-R186 PolarHBondContact OE2-NE 3.29Å; E181-R186 IonicContact OE2-NH2 3.87Å; E181-R186 PolarHBondContact OE2-NH2 2.79Å
182	A	96.8	Very high	96.4	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-56.6	-45.7	176	0	0	0	0	0	111.9	I163 D178 L179 R186 R187 V188	I163-A182 HydrophobicContact CD1-CB 3.88Å; D178-A182 PolarHBondContact O-N 3.02Å; D178-A182 VanDerWaalsContact O-N 3.08Å; L179-A182 WeakPolarHBondContact O-CB 3.34Å; L179-A182 PolarHBondContact O-N 3.17Å; A182-R186 VanDerWaalsContact CB-NH2 3.26Å; A182-R186 CarbonylContact O-C 3.57Å; A182-R186 PolarHBondContact O-N 2.76Å; A182-R187 PolarHBondContact O-N 3.21Å; A182-V188 HydrophobicContact CB-CB 4.34Å; A182-V188 PolarHBondContact O-N 2.65Å
183	C	94.4	Very high	96.4	Very high	6 Å²	6	43 Å²	43	4%	0.041	20%	0.196	C	C	.	.	H	α-helix	trans	-68.9	-46.2	-180	-65.8	0	0	0	0	112.8	L179 Q180 E181 R187 V190 Q218 M219	L179-C183 PolarHBondContact O-N 2.86Å; L179-C183 PolarHBondContact O-SG 3.27Å; Q180-C183 PolarHBondContact O-N 2.92Å; E181-C183 VanDerWaalsContact C-N 3.32Å; E181-C183 PolarHBondContact O-N 2.85Å; C183-R187 WeakPolarHBondContact O-CA 3.29Å; C183-V190 WeakPolarHBondContact SG-CG2 3.47Å; C183-Q218 HydrophobicContact CB-CB 4.17Å; C183-M219 WeakPolarHBondContact SG-CE 3.25Å
184	S	93.6	Very high	96.4	Very high	58 Å²	58	39.4 Å²	39.4	41%	0.406	18%	0.177	S	C	.	.	H	α-helix	trans	-87.8	-40.2	-165.4	-50.2	0	0	0	0	111.9	Q180 E181	Q180-S184 VanDerWaalsContact O-CB 3.24Å; Q180-S184 WeakPolarHBondContact O-CB 3.33Å; Q180-S184 PolarHBondContact O-N 3.3Å; Q180-S184 PolarHBondContact O-OG 3.3Å; E181-S184 PolarHBondContact O-N 3.37Å
185	H	94.1	Very high	96.4	Very high	149 Å²	149	37 Å²	37	69%	0.69	16%	0.164	S	C	*	.	T	Hydrogen-bonded Turn	trans	-97.5	-50.6	-174.4	-61.5	177.4	0	0	0	111.4	E181	E181-H185 WeakPolarHBondContact O-CB 3.47Å; E181-H185 PolarHBondContact O-N 2.96Å
186	R	95.4	Very high	96.1	Very high	76 Å²	76	41.3 Å²	41.3	29%	0.287	19%	0.185	S	C	.	.	S	Bend	trans	-84.1	-12	-178.8	-65.4	-177.1	-79.6	139	-5.7	113.6	I156 K157 A159 E181 A182 V188	I156-R186 PolarHBondContact O-NH1 3.42Å; I156-R186 PolarHBondContact O-NH2 2.86Å; I156-R186 VanDerWaalsContact O-NH2 3.12Å; K157-R186 PolarHBondContact O-NH1 3.02Å; A159-R186 PolarHBondContact O-NH1 3.45Å; E181-R186 PolarHBondContact O-N 2.84Å; E181-R186 IonicContact OE1-NE 2.92Å; E181-R186 PolarHBondContact OE1-NE 2.83Å; E181-R186 IonicContact OE2-CZ 3.17Å; E181-R186 VanDerWaalsContact OE2-CZ 3.24Å; E181-R186 IonicContact OE2-NE 3.17Å; E181-R186 PolarHBondContact OE2-NE 3.29Å; E181-R186 IonicContact OE2-NH2 3.87Å; E181-R186 PolarHBondContact OE2-NH2 2.79Å; A182-R186 VanDerWaalsContact CB-NH2 3.26Å; A182-R186 CarbonylContact O-C 3.57Å; A182-R186 PolarHBondContact O-N 2.76Å; R186-V188 HydrophobicContact CB-CG2 3.82Å; R186-V188 PolarHBondContact O-N 3.44Å
187	R	95.1	Very high	95.8	Very high	194 Å²	194	44.4 Å²	44.4	73%	0.732	21%	0.206	S	C	*	.			trans	54.7	32.2	-175.4	-58.8	-173.7	176.2	-179.4	0.6	113.4	A182 C183 P189	A182-R187 PolarHBondContact O-N 3.21Å; C183-R187 WeakPolarHBondContact O-CA 3.29Å; R187-P189 WeakPolarHBondContact O-CD 3.49Å
188	V	96.3	Very high	95.6	Very high	3 Å²	3	38.6 Å²	38.6	2%	0.018	19%	0.186	C	C	.	.			trans	-75.5	125.6	174	-179	0	0	0	0	108.4	A159 I163 A182 R186 V190	A159-V188 HydrophobicContact CB-CG1 4.45Å; I163-V188 HydrophobicContact CD1-CG1 4.27Å; I163-V188 HydrophobicContact CG1-CG1 4Å; A182-V188 HydrophobicContact CB-CB 4.34Å; A182-V188 PolarHBondContact O-N 2.65Å; R186-V188 HydrophobicContact CB-CG2 3.82Å; R186-V188 PolarHBondContact O-N 3.44Å; V188-V190 PolarHBondContact O-N 3.34Å
189	P	96.5	Very high	95.4	Very high	17 Å²	17	38.3 Å²	38.3	11%	0.11	19%	0.186	C	C	.	.			trans	-59.3	129.8	170.9	-23.7	33.2	0	0	0	112.2	I117 E161 V162 I163 R187 Y191	I117-P189 HydrophobicContact CD1-CB 3.94Å; I117-P189 HydrophobicContact CG1-CB 4.01Å; I117-P189 WeakPolarHBondContact O-CB 3.43Å; I117-P189 WeakPolarHBondContact O-CG 3.31Å; E161-P189 VanDerWaalsContact O-CD 3.25Å; E161-P189 WeakPolarHBondContact O-CD 3.24Å; V162-P189 HydrophobicContact CG2-CB 4.45Å; I163-P189 PolarHBondContact N-O 2.74Å; R187-P189 WeakPolarHBondContact O-CD 3.49Å; P189-Y191 HydrophobicContact CB-CE2 4.24Å
190	V	97.3	Very high	95.3	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	117.8	179.7	-176.1	0	0	0	0	110.4	I163 L179 C183 V188 I192 Q218 M219 R220	I163-V190 HydrophobicContact CB-CG1 4.31Å; I163-V190 HydrophobicContact CB-CG2 4.08Å; I163-V190 HydrophobicContact CD1-CG2 4.07Å; I163-V190 HydrophobicContact CG1-CG2 4.45Å; I163-V190 HydrophobicContact CG2-CG1 4.29Å; I163-V190 CarbonylContact O-C 3.44Å; I163-V190 VanDerWaalsContact O-CA 3.31Å; I163-V190 WeakPolarHBondContact O-CA 3.46Å; L179-V190 HydrophobicContact CD2-CG1 4.16Å; C183-V190 WeakPolarHBondContact SG-CG2 3.47Å; V188-V190 PolarHBondContact O-N 3.34Å; V190-I192 HydrophobicContact CG1-CD1 4.14Å; V190-I192 HydrophobicContact CG1-CG1 3.86Å; V190-Q218 PolarHBondContact N-O 3.37Å; V190-M219 HydrophobicContact CB-CG 4.39Å; V190-M219 HydrophobicContact CG1-CE 4.37Å; V190-M219 HydrophobicContact CG1-CG 4.48Å; V190-M219 CarbonylContact O-C 3.43Å; V190-M219 WeakPolarHBondContact O-CA 3.12Å; V190-R220 PolarHBondContact O-N 3.19Å
191	Y	97.4	Very high	95.3	Very high	0 Å²	0	41 Å²	41	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	129.3	172.7	-58.3	-92.4	0	0	0	109.8	L115 I117 G118 W119 V162 I163 A164 I165 P189 R220 F287 Y291	L115-Y191 HydrophobicContact CB-CE1 4.22Å; L115-Y191 HydrophobicContact CD2-CD1 3.94Å; L115-Y191 HydrophobicContact CD2-CE1 3.72Å; L115-Y191 HydrophobicContact CD2-CG 4.38Å; L115-Y191 PolarHBondContact O-OH 3.03Å; L115-Y191 VanDerWaalsContact O-OH 3.08Å; I117-Y191 HydrophobicContact CD1-CD1 4.36Å; I117-Y191 HydrophobicContact CD1-CE1 4.06Å; I117-Y191 HydrophobicContact CD1-CE2 4.19Å; I117-Y191 HydrophobicContact CG1-CD1 4.24Å; I117-Y191 HydrophobicContact CG1-CE1 3.45Å; I117-Y191 VanDerWaalsContact CG1-CE1 3.45Å; I117-Y191 HydrophobicContact CG1-CE2 3.76Å; I117-Y191 WeakPolarHBondContact CG1-OH 3.41Å; I117-Y191 PolarHBondContact N-OH 3.05Å; G118-Y191 PolarHBondContact N-OH 3.37Å; G118-Y191 VanDerWaalsContact N-OH 3.15Å; G118-Y191 WeakPolarHBondContact O-CE2 3.43Å; G118-Y191 PolarHBondContact O-OH 3.47Å; W119-Y191 AromaticContact CE3-CD2 3.91Å; W119-Y191 HydrophobicContact CE3-CD2 3.91Å; W119-Y191 AromaticContact CE3-CE2 3.7Å; W119-Y191 HydrophobicContact CE3-CE2 3.7Å; W119-Y191 AromaticContact CZ3-CD2 3.76Å; W119-Y191 HydrophobicContact CZ3-CD2 3.76Å; W119-Y191 HydrophobicContact CZ3-CE2 4.06Å; W119-Y191 HydrophobicContact CZ3-CG 4.42Å; V162-Y191 HydrophobicContact CG2-CD2 3.89Å; V162-Y191 HydrophobicContact CG2-CE2 3.87Å; I163-Y191 PolarHBondContact O-N 2.86Å; A164-Y191 CarbonylContact C-O 3.56Å; A164-Y191 WeakPolarHBondContact CA-O 3.41Å; I165-Y191 PolarHBondContact N-O 3.05Å; P189-Y191 HydrophobicContact CB-CE2 4.24Å; Y191-R220 WeakPolarHBondContact CA-O 3.4Å; Y191-R220 HydrophobicContact CD1-CB 4.03Å; Y191-R220 HydrophobicContact CE1-CB 4.5Å; Y191-F287 HydrophobicContact CG-CZ 4.42Å; Y191-Y291 AromaticContact CD1-CE2 3.65Å; Y191-Y291 HydrophobicContact CD1-CE2 3.65Å; Y191-Y291 HydrophobicContact CE1-CE2 4.28Å
192	I	97.4	Very high	95.3	Very high	0 Å²	0	38 Å²	38	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	117.4	-179.8	-47.4	-176.6	0	0	0	108.5	I165 L170 L179 V190 L194 M219 R220 V221 R222	I165-I192 HydrophobicContact CB-CG2 4.41Å; I165-I192 HydrophobicContact CG2-CG2 4.37Å; I165-I192 CarbonylContact O-C 3.56Å; I165-I192 WeakPolarHBondContact O-CA 3.46Å; L170-I192 HydrophobicContact CD2-CD1 3.82Å; L170-I192 HydrophobicContact CD2-CG2 3.87Å; L179-I192 HydrophobicContact CD1-CD1 4.36Å; V190-I192 HydrophobicContact CG1-CD1 4.14Å; V190-I192 HydrophobicContact CG1-CG1 3.86Å; I192-L194 HydrophobicContact CG2-CD1 4.37Å; I192-L194 HydrophobicContact CG2-CD2 3.71Å; I192-L194 HydrophobicContact CG2-CG 3.74Å; I192-M219 HydrophobicContact CD1-CE 4.35Å; I192-M219 HydrophobicContact CD1-CG 4.29Å; I192-M219 HydrophobicContact CD1-SD 3.94Å; I192-R220 PolarHBondContact N-O 3.01Å; I192-V221 HydrophobicContact CB-CG1 4.36Å; I192-V221 HydrophobicContact CB-CG2 4.24Å; I192-V221 HydrophobicContact CD1-CG2 4.19Å; I192-V221 HydrophobicContact CG1-CG2 4.44Å; I192-V221 CarbonylContact O-C 3.52Å; I192-V221 WeakPolarHBondContact O-CA 3.4Å; I192-R222 PolarHBondContact O-N 3.28Å
193	L	97.4	Very high	95.2	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	113.6	169	-57.3	-173.1	0	0	0	108.2	I165 V166 T167 R222 V224 F287 L290 Y291	I165-L193 PolarHBondContact O-N 2.87Å; V166-L193 WeakPolarHBondContact CA-O 3.38Å; V166-L193 HydrophobicContact CG1-CB 4.46Å; V166-L193 HydrophobicContact CG2-CB 4.22Å; V166-L193 HydrophobicContact CG2-CD1 4.17Å; T167-L193 PolarHBondContact N-O 2.77Å; L193-R222 WeakPolarHBondContact CA-O 3.31Å; L193-R222 HydrophobicContact CD2-CB 3.75Å; L193-R222 HydrophobicContact CD2-CG 4.43Å; L193-V224 HydrophobicContact CB-CG1 4.46Å; L193-F287 HydrophobicContact CD1-CD2 4.19Å; L193-F287 HydrophobicContact CD1-CE2 3.79Å; L193-F287 HydrophobicContact CD1-CZ 4.05Å; L193-F287 HydrophobicContact CG-CE2 3.82Å; L193-F287 HydrophobicContact CG-CZ 4Å; L193-L290 HydrophobicContact CD1-CB 3.56Å; L193-Y291 HydrophobicContact CD1-CD2 4.49Å; L193-Y291 HydrophobicContact CD2-CD2 3.77Å; L193-Y291 HydrophobicContact CD2-CE2 4.34Å; L193-Y291 HydrophobicContact CG-CD2 4.47Å
194	L	96.8	Very high	95.2	Very high	0 Å²	0	46 Å²	46	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	140.5	-179.5	-68.1	-179.6	0	0	0	110.6	T167 L170 I192 Q196 F202 V221 R222 T223 V224	T167-L194 HydrophobicContact CG2-CD2 3.46Å; T167-L194 VanDerWaalsContact CG2-CD2 3.46Å; T167-L194 WeakPolarHBondContact O-CA 3.15Å; L170-L194 HydrophobicContact CB-CD2 3.81Å; L170-L194 HydrophobicContact CD2-CD2 4.37Å; I192-L194 HydrophobicContact CG2-CD1 4.37Å; I192-L194 HydrophobicContact CG2-CD2 3.71Å; I192-L194 HydrophobicContact CG2-CG 3.74Å; L194-Q196 PolarHBondContact O-N 2.88Å; L194-F202 HydrophobicContact CD1-CB 3.82Å; L194-F202 HydrophobicContact CD1-CD1 3.57Å; L194-F202 HydrophobicContact CD1-CD2 4.11Å; L194-F202 HydrophobicContact CD1-CE1 4.13Å; L194-F202 HydrophobicContact CD1-CG 3.55Å; L194-V221 HydrophobicContact CD1-CG1 3.84Å; L194-V221 HydrophobicContact CG-CG1 4.32Å; L194-R222 PolarHBondContact N-O 2.81Å; L194-T223 CarbonylContact O-C 3.6Å; L194-T223 WeakPolarHBondContact O-CA 3.44Å; L194-V224 PolarHBondContact O-N 3.08Å
195	D	95.3	Very high	95.4	Very high	3 Å²	3	43.9 Å²	43.9	2%	0.016	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-55	136.4	165.8	176.6	70.1	0	0	0	110.7	T167 D168 S197 C198 A199 V224 V241	T167-D195 PolarHBondContact O-N 3.37Å; T167-D195 VanDerWaalsContact O-N 3.12Å; D168-D195 HydrophobicContact CB-CB 4.17Å; D195-S197 PolarHBondContact O-N 2.99Å; D195-S197 WeakPolarHBondContact OD2-CA 3.36Å; D195-S197 WeakPolarHBondContact OD2-CB 3.43Å; D195-S197 PolarHBondContact OD2-N 2.77Å; D195-S197 PolarHBondContact OD2-OG 2.79Å; D195-C198 PolarHBondContact O-N 3.34Å; D195-C198 PolarHBondContact O-SG 2.76Å; D195-A199 PolarHBondContact O-N 2.95Å; D195-V224 WeakPolarHBondContact CA-O 3.14Å; D195-V241 HydrophobicContact CB-CB 4.42Å; D195-V241 PolarHBondContact OD1-N 3.5Å
196	Q	93.2	Very high	95.4	Very high	92 Å²	92	36.9 Å²	36.9	43%	0.43	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.3	-32.5	-177.6	64.6	173.7	21	0	0	113.3	L194 C198 V224 A225	L194-Q196 PolarHBondContact O-N 2.88Å; Q196-C198 VanDerWaalsContact C-N 3.32Å; Q196-C198 PolarHBondContact O-N 2.68Å; Q196-V224 PolarHBondContact N-O 2.9Å; Q196-A225 HydrophobicContact CG-CB 4.25Å
197	S	91.3	Very high	95.3	Very high	65 Å²	65	41.1 Å²	41.1	46%	0.455	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.7	-20	-177.1	77.5	0	0	0	0	113	D195	D195-S197 PolarHBondContact O-N 2.99Å; D195-S197 WeakPolarHBondContact OD2-CA 3.36Å; D195-S197 WeakPolarHBondContact OD2-CB 3.43Å; D195-S197 PolarHBondContact OD2-N 2.77Å; D195-S197 PolarHBondContact OD2-OG 2.79Å
198	C	92.3	Very high	95.3	Very high	14 Å²	14	38.1 Å²	38.1	10%	0.095	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.5	-16	-179.6	81.4	0	0	0	0	113.7	D168 D195 Q196 P200 A201 F202	D168-C198 WeakPolarHBondContact O-CB 3.45Å; D168-C198 PolarHBondContact O-SG 3.11Å; D195-C198 PolarHBondContact O-N 3.34Å; D195-C198 PolarHBondContact O-SG 2.76Å; Q196-C198 VanDerWaalsContact C-N 3.32Å; Q196-C198 PolarHBondContact O-N 2.68Å; C198-P200 VanDerWaalsContact C-CD 3.46Å; C198-A201 WeakPolarHBondContact O-CB 3.44Å; C198-A201 PolarHBondContact O-N 3.32Å; C198-F202 PolarHBondContact O-N 2.76Å; C198-F202 VanDerWaalsContact O-N 3.16Å
199	A	94	Very high	95.1	Very high	9 Å²	9	40.6 Å²	40.6	7%	0.074	21%	0.21	C	C	.	.	H	α-helix	trans	-50.8	-43.1	179.7	0	0	0	0	0	114.5	D195 A201 F202 L203 T223 I297	D195-A199 PolarHBondContact O-N 2.95Å; A199-A201 VanDerWaalsContact C-N 3.32Å; A199-A201 PolarHBondContact O-N 3.34Å; A199-F202 PolarHBondContact O-N 3.08Å; A199-L203 WeakPolarHBondContact O-CG 3.46Å; A199-L203 PolarHBondContact O-N 3.09Å; A199-T223 HydrophobicContact CB-CG2 3.64Å; A199-I297 HydrophobicContact CB-CD1 3.86Å
200	P	94.7	Very high	94.9	Very high	73 Å²	73	42.8 Å²	42.8	47%	0.474	24%	0.236	S	C	.	.	H	α-helix	trans	-63.4	-34.9	177.9	-23	34.9	0	0	0	113.7	C198 R204	C198-P200 VanDerWaalsContact C-CD 3.46Å; P200-R204 WeakPolarHBondContact O-CB 3.41Å; P200-R204 PolarHBondContact O-N 3.15Å; P200-R204 VanDerWaalsContact O-N 3.09Å
201	A	95.4	Very high	94.6	Very high	39 Å²	39	43.7 Å²	43.7	32%	0.322	24%	0.242	S	C	.	.	H	α-helix	trans	-70.5	-43	178.4	0	0	0	0	0	111.2	T171 C198 A199 R204 M205	T171-A201 HydrophobicContact CG2-CB 4.04Å; C198-A201 WeakPolarHBondContact O-CB 3.44Å; C198-A201 PolarHBondContact O-N 3.32Å; A199-A201 VanDerWaalsContact C-N 3.32Å; A199-A201 PolarHBondContact O-N 3.34Å; A201-R204 PolarHBondContact O-N 3.02Å; A201-M205 PolarHBondContact O-N 3.09Å
202	F	96.3	Very high	94.2	Very high	1 Å²	1	50.1 Å²	50.1	0%	0.004	27%	0.266	C	S	.	.	H	α-helix	trans	-59.7	-49.5	173.4	170.6	-105	0	0	0	111.9	L170 F176 L194 C198 A199 R204 M205 C206 L213 V221 I297	L170-F202 HydrophobicContact CB-CD2 4.16Å; L170-F202 HydrophobicContact CD2-CD2 3.98Å; L170-F202 HydrophobicContact CD2-CE2 3.67Å; L170-F202 HydrophobicContact CG-CD2 4.04Å; L170-F202 HydrophobicContact CG-CE2 4.13Å; L170-F202 VanDerWaalsContact O-CD2 3.31Å; L170-F202 WeakPolarHBondContact O-CD2 3.02Å; F176-F202 HydrophobicContact CD2-CE2 4.02Å; F176-F202 AromaticContact CE2-CE2 3.89Å; F176-F202 HydrophobicContact CE2-CE2 3.89Å; F176-F202 HydrophobicContact CE2-CZ 4.09Å; L194-F202 HydrophobicContact CD1-CB 3.82Å; L194-F202 HydrophobicContact CD1-CD1 3.57Å; L194-F202 HydrophobicContact CD1-CD2 4.11Å; L194-F202 HydrophobicContact CD1-CE1 4.13Å; L194-F202 HydrophobicContact CD1-CG 3.55Å; C198-F202 PolarHBondContact O-N 2.76Å; C198-F202 VanDerWaalsContact O-N 3.16Å; A199-F202 PolarHBondContact O-N 3.08Å; F202-R204 VanDerWaalsContact C-N 3.27Å; F202-R204 PolarHBondContact O-N 3.21Å; F202-M205 HydrophobicContact CD2-CE 3.61Å; F202-M205 HydrophobicContact CE2-CE 3.74Å; F202-M205 WeakPolarHBondContact O-CA 3.21Å; F202-M205 WeakPolarHBondContact O-CB 3.47Å; F202-M205 PolarHBondContact O-N 3.42Å; F202-C206 VanDerWaalsContact CZ-SG 3.55Å; F202-C206 PolarHBondContact O-N 3.16Å; F202-C206 PolarHBondContact O-SG 3.3Å; F202-C206 VanDerWaalsContact O-SG 3.39Å; F202-L213 HydrophobicContact CE1-CD1 3.91Å; F202-L213 HydrophobicContact CE1-CD2 4.02Å; F202-L213 HydrophobicContact CZ-CD2 3.99Å; F202-V221 HydrophobicContact CD1-CG1 4.34Å; F202-V221 HydrophobicContact CE1-CB 4.39Å; F202-V221 HydrophobicContact CE1-CG1 3.79Å; F202-V221 HydrophobicContact CE1-CG2 4.03Å; F202-V221 HydrophobicContact CZ-CG1 4.42Å; F202-V221 HydrophobicContact CZ-CG2 4.07Å; F202-I297 HydrophobicContact CD1-CD1 4.43Å
203	L	95.1	Very high	93.8	Very high	26 Å²	26	51.2 Å²	51.2	14%	0.136	27%	0.272	C	S	.	.	H	α-helix	trans	-60.7	-36.6	178.3	-70.9	175	0	0	0	112.4	A199 C206 R207 L213 I297	A199-L203 WeakPolarHBondContact O-CG 3.46Å; A199-L203 PolarHBondContact O-N 3.09Å; L203-C206 PolarHBondContact O-N 3.29Å; L203-R207 WeakPolarHBondContact O-CG 3.48Å; L203-R207 PolarHBondContact O-N 3.43Å; L203-R207 VanDerWaalsContact O-N 3.07Å; L203-L213 HydrophobicContact CD2-CD1 3.7Å; L203-I297 HydrophobicContact CD1-CD1 3.89Å; L203-I297 HydrophobicContact CD1-CG1 4.22Å; L203-I297 HydrophobicContact CD2-CD1 3.85Å; L203-I297 HydrophobicContact CD2-CG1 4.48Å; L203-I297 HydrophobicContact CG-CD1 3.79Å
204	R	95.1	Very high	93.3	Very high	147 Å²	147	55.5 Å²	55.5	56%	0.555	30%	0.295	S	S	*	.	H	α-helix	trans	-64.8	-42.4	174.4	-170.1	179.7	-62.3	113.7	0.1	111.4	P200 A201 F202 R207 N208	P200-R204 WeakPolarHBondContact O-CB 3.41Å; P200-R204 PolarHBondContact O-N 3.15Å; P200-R204 VanDerWaalsContact O-N 3.09Å; A201-R204 PolarHBondContact O-N 3.02Å; F202-R204 VanDerWaalsContact C-N 3.27Å; F202-R204 PolarHBondContact O-N 3.21Å; R204-R207 PolarHBondContact O-N 3.02Å; R204-N208 PolarHBondContact O-N 3.49Å; R204-N208 PolarHBondContact O-OD1 2.89Å
205	M	96.5	Very high	92.9	Very high	13 Å²	13	60.3 Å²	60.3	6%	0.064	32%	0.32	C	S	.	.	H	α-helix	trans	-58.3	-49.7	173.3	178.5	-163.1	63.9	0	0	111.1	T171 L173 F176 A201 F202 R207 N208 V209	T171-M205 WeakPolarHBondContact CA-SD 3.33Å; L173-M205 HydrophobicContact CD2-CG 3.69Å; L173-M205 HydrophobicContact CD2-SD 4.07Å; F176-M205 HydrophobicContact CB-CE 3.83Å; F176-M205 HydrophobicContact CB-SD 4.15Å; F176-M205 HydrophobicContact CD1-CE 4.1Å; F176-M205 HydrophobicContact CD2-CE 3.59Å; F176-M205 HydrophobicContact CE2-CE 4.17Å; F176-M205 HydrophobicContact CG-CE 3.55Å; F176-M205 HydrophobicContact CG-SD 4.37Å; A201-M205 PolarHBondContact O-N 3.09Å; F202-M205 HydrophobicContact CD2-CE 3.61Å; F202-M205 HydrophobicContact CE2-CE 3.74Å; F202-M205 WeakPolarHBondContact O-CA 3.21Å; F202-M205 WeakPolarHBondContact O-CB 3.47Å; F202-M205 PolarHBondContact O-N 3.42Å; M205-R207 VanDerWaalsContact C-N 3.28Å; M205-R207 PolarHBondContact O-N 2.79Å; M205-N208 WeakPolarHBondContact O-CB 3.43Å; M205-N208 PolarHBondContact O-N 2.83Å; M205-N208 VanDerWaalsContact O-N 3.07Å; M205-V209 WeakPolarHBondContact O-CG2 3.44Å; M205-V209 PolarHBondContact O-N 3.46Å
206	C	94.8	Very high	92.7	Very high	3 Å²	3	60.7 Å²	60.7	2%	0.02	32%	0.322	C	S	.	.	H	α-helix	trans	-57.2	-42.1	179.1	-61.9	0	0	0	0	112.1	F202 L203 V209 G210 V211	F202-C206 VanDerWaalsContact CZ-SG 3.55Å; F202-C206 PolarHBondContact O-N 3.16Å; F202-C206 PolarHBondContact O-SG 3.3Å; F202-C206 VanDerWaalsContact O-SG 3.39Å; L203-C206 PolarHBondContact O-N 3.29Å; C206-V209 PolarHBondContact O-N 3.07Å; C206-G210 PolarHBondContact O-N 3.15Å; C206-G210 VanDerWaalsContact O-N 3.09Å; C206-V211 PolarHBondContact O-N 3.46Å
207	R	93.9	Very high	92.6	Very high	164 Å²	164	66.1 Å²	66.1	62%	0.619	34%	0.339	S	S	*	.	H	α-helix	trans	-62.1	-42.8	174.9	-70.5	173.8	-167.6	172.3	4.9	112.4	L203 R204 M205 V209 G210	L203-R207 WeakPolarHBondContact O-CG 3.48Å; L203-R207 PolarHBondContact O-N 3.43Å; L203-R207 VanDerWaalsContact O-N 3.07Å; R204-R207 PolarHBondContact O-N 3.02Å; M205-R207 VanDerWaalsContact C-N 3.28Å; M205-R207 PolarHBondContact O-N 2.79Å; R207-V209 VanDerWaalsContact C-N 3.27Å; R207-V209 PolarHBondContact O-N 2.93Å; R207-G210 PolarHBondContact O-N 3.05Å
208	N	94.4	Very high	92.7	Very high	131 Å²	131	65.8 Å²	65.8	70%	0.701	33%	0.33	S	S	*	.	H	α-helix	trans	-65	-31.6	179.1	-67.5	-6.4	0	0	0	112.5	R204 M205 G210	R204-N208 PolarHBondContact O-N 3.49Å; R204-N208 PolarHBondContact O-OD1 2.89Å; M205-N208 WeakPolarHBondContact O-CB 3.43Å; M205-N208 PolarHBondContact O-N 2.83Å; M205-N208 VanDerWaalsContact O-N 3.07Å; N208-G210 VanDerWaalsContact C-N 3.3Å
209	V	93.2	Very high	92.8	Very high	55 Å²	55	65.5 Å²	65.5	33%	0.333	33%	0.327	S	S	.	.	H	α-helix	trans	-83.2	-9.4	175.3	-174.4	0	0	0	0	111.8	L173 M205 C206 R207 V211	L173-V209 HydrophobicContact CD2-CG2 3.57Å; M205-V209 WeakPolarHBondContact O-CG2 3.44Å; M205-V209 PolarHBondContact O-N 3.46Å; C206-V209 PolarHBondContact O-N 3.07Å; R207-V209 VanDerWaalsContact C-N 3.27Å; R207-V209 PolarHBondContact O-N 2.93Å; V209-V211 HydrophobicContact CB-CG2 4.37Å; V209-V211 HydrophobicContact CG1-CG2 3.92Å
210	G	91.9	Very high	92.8	Very high	64 Å²	64	69.3 Å²	69.3	66%	0.66	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.2	22.6	-178.2	0	0	0	0	0	113.9	C206 R207 N208	C206-G210 PolarHBondContact O-N 3.15Å; C206-G210 VanDerWaalsContact O-N 3.09Å; R207-G210 PolarHBondContact O-N 3.05Å; N208-G210 VanDerWaalsContact C-N 3.3Å
211	V	90.4	Very high	92.9	Very high	19 Å²	19	66.5 Å²	66.5	12%	0.115	32%	0.321	C	S	.	.			trans	-102.5	127.4	-178.4	177.7	0	0	0	0	110.1	F176 C206 V209 L216	F176-V211 HydrophobicContact CE1-CB 4.31Å; F176-V211 HydrophobicContact CE1-CG1 4.42Å; F176-V211 HydrophobicContact CE1-CG2 4.28Å; F176-V211 HydrophobicContact CZ-CB 4.44Å; F176-V211 HydrophobicContact CZ-CG1 4.17Å; C206-V211 PolarHBondContact O-N 3.46Å; V209-V211 HydrophobicContact CB-CG2 4.37Å; V209-V211 HydrophobicContact CG1-CG2 3.92Å; V211-L216 HydrophobicContact CG1-CD1 3.8Å; V211-L216 HydrophobicContact CG1-CD2 4.44Å; V211-L216 HydrophobicContact CG1-CG 4.15Å
212	R	88.8	Confident	92.9	Very high	134 Å²	134	66.2 Å²	66.2	51%	0.506	31%	0.312	S	S	.	.			trans	-97.3	129	170.2	-62.8	174.5	55.2	-128.9	-8.8	109.3	D214 D215	R212-D214 IonicContact CZ-OD2 2.86Å; R212-D214 IonicContact NH2-OD2 3.76Å; R212-D214 PolarHBondContact NH2-OD2 3.34Å; R212-D214 PolarHBondContact O-N 3.2Å; R212-D215 WeakPolarHBondContact CB-OD2 3.15Å; R212-D215 IonicContact CZ-OD1 3.05Å; R212-D215 IonicContact NH1-OD1 2.77Å; R212-D215 PolarHBondContact NH1-OD1 3.38Å; R212-D215 IonicContact NH1-OD2 2.76Å; R212-D215 WeakPolarHBondContact O-CB 3.4Å; R212-D215 PolarHBondContact O-N 2.8Å; R212-D215 VanDerWaalsContact O-N 3.07Å
213	L	89.1	Confident	92.9	Very high	24 Å²	24	67.5 Å²	67.5	13%	0.126	32%	0.32	C	S	.	.	G	3₁₀ helix	trans	-60.8	-31.3	179.4	-61.5	177.4	0	0	0	112.3	F202 L203 D215 L216 M219 V221 I297	F202-L213 HydrophobicContact CE1-CD1 3.91Å; F202-L213 HydrophobicContact CE1-CD2 4.02Å; F202-L213 HydrophobicContact CZ-CD2 3.99Å; L203-L213 HydrophobicContact CD2-CD1 3.7Å; L213-D215 PolarHBondContact O-N 2.81Å; L213-L216 HydrophobicContact CD2-CD1 4.44Å; L213-L216 PolarHBondContact O-N 2.88Å; L213-L216 VanDerWaalsContact O-N 3.11Å; L213-M219 HydrophobicContact CD2-SD 4.42Å; L213-V221 HydrophobicContact CD1-CB 4.49Å; L213-V221 HydrophobicContact CD1-CG2 4.37Å; L213-V221 HydrophobicContact CD2-CG2 4.25Å; L213-I297 HydrophobicContact CD1-CG2 4Å
214	D	87.4	Confident	92.9	Very high	90 Å²	90	66.4 Å²	66.4	48%	0.481	31%	0.314	S	S	.	.	G	3₁₀ helix	trans	-60	-29.8	176.6	-54.8	-34.4	0	0	0	112.9	R212 L216	R212-D214 IonicContact CZ-OD2 2.86Å; R212-D214 IonicContact NH2-OD2 3.76Å; R212-D214 PolarHBondContact NH2-OD2 3.34Å; R212-D214 PolarHBondContact O-N 3.2Å; D214-L216 VanDerWaalsContact C-N 3.31Å
215	D	88.7	Confident	92.8	Very high	100 Å²	100	61.1 Å²	61.1	54%	0.535	30%	0.302	S	S	.	.	G	3₁₀ helix	trans	-79.5	-21.1	-177.8	-58.4	-21	0	0	0	110.8	R212 L213 R217	R212-D215 WeakPolarHBondContact CB-OD2 3.15Å; R212-D215 IonicContact CZ-OD1 3.05Å; R212-D215 IonicContact NH1-OD1 2.77Å; R212-D215 PolarHBondContact NH1-OD1 3.38Å; R212-D215 IonicContact NH1-OD2 2.76Å; R212-D215 WeakPolarHBondContact O-CB 3.4Å; R212-D215 PolarHBondContact O-N 2.8Å; R212-D215 VanDerWaalsContact O-N 3.07Å; L213-D215 PolarHBondContact O-N 2.81Å; D215-R217 PolarHBondContact O-N 2.91Å; D215-R217 VanDerWaalsContact O-N 3.14Å
216	L	90.6	Very high	92.5	Very high	12 Å²	12	61.3 Å²	61.3	6%	0.063	31%	0.308	C	S	.	.			trans	-86.3	78.2	179.1	-59.2	178.7	0	0	0	110.9	Q180 V211 L213 D214 Q218 M219	Q180-L216 HydrophobicContact CG-CD2 4.28Å; V211-L216 HydrophobicContact CG1-CD1 3.8Å; V211-L216 HydrophobicContact CG1-CD2 4.44Å; V211-L216 HydrophobicContact CG1-CG 4.15Å; L213-L216 HydrophobicContact CD2-CD1 4.44Å; L213-L216 PolarHBondContact O-N 2.88Å; L213-L216 VanDerWaalsContact O-N 3.11Å; D214-L216 VanDerWaalsContact C-N 3.31Å; L216-Q218 PolarHBondContact O-N 3.41Å; L216-Q218 VanDerWaalsContact O-N 3.13Å; L216-M219 HydrophobicContact CB-CB 3.71Å; L216-M219 HydrophobicContact CD1-CB 4.28Å; L216-M219 HydrophobicContact CD1-CE 3.96Å; L216-M219 HydrophobicContact CD1-SD 3.65Å; L216-M219 PolarHBondContact O-N 3.37Å
217	R	89.9	Confident	92.2	Very high	206 Å²	206	67.4 Å²	67.4	78%	0.777	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.5	-34.2	-177.8	-64.9	-172.4	-179.9	-164.3	0.2	114	D215 M219 R220	D215-R217 PolarHBondContact O-N 2.91Å; D215-R217 VanDerWaalsContact O-N 3.14Å; R217-M219 VanDerWaalsContact C-N 3.32Å; R217-R220 PolarHBondContact O-NH1 3.47Å; R217-R220 VanDerWaalsContact O-NH1 3.09Å
218	Q	94.1	Very high	92	Very high	58 Å²	58	61.6 Å²	61.6	27%	0.271	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.8	11.2	178.7	-65	-61.6	-16.1	0	0	113.7	I117 C183 V190 L216	I117-Q218 WeakPolarHBondContact CD1-O 3.4Å; C183-Q218 HydrophobicContact CB-CB 4.17Å; V190-Q218 PolarHBondContact N-O 3.37Å; L216-Q218 PolarHBondContact O-N 3.41Å; L216-Q218 VanDerWaalsContact O-N 3.13Å
219	M	95.1	Very high	91.7	Very high	7 Å²	7	59.6 Å²	59.6	3%	0.034	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	133.6	175	-167	175.9	-75.4	0	0	110.3	L179 C183 V190 I192 L213 L216 R217 V221	L179-M219 HydrophobicContact CB-CE 4.16Å; C183-M219 WeakPolarHBondContact SG-CE 3.25Å; V190-M219 HydrophobicContact CB-CG 4.39Å; V190-M219 HydrophobicContact CG1-CE 4.37Å; V190-M219 HydrophobicContact CG1-CG 4.48Å; V190-M219 CarbonylContact O-C 3.43Å; V190-M219 WeakPolarHBondContact O-CA 3.12Å; I192-M219 HydrophobicContact CD1-CE 4.35Å; I192-M219 HydrophobicContact CD1-CG 4.29Å; I192-M219 HydrophobicContact CD1-SD 3.94Å; L213-M219 HydrophobicContact CD2-SD 4.42Å; L216-M219 HydrophobicContact CB-CB 3.71Å; L216-M219 HydrophobicContact CD1-CB 4.28Å; L216-M219 HydrophobicContact CD1-CE 3.96Å; L216-M219 HydrophobicContact CD1-SD 3.65Å; L216-M219 PolarHBondContact O-N 3.37Å; R217-M219 VanDerWaalsContact C-N 3.32Å; M219-V221 HydrophobicContact CG-CG2 4.02Å; M219-V221 HydrophobicContact SD-CG2 4.11Å
220	R	94.4	Very high	91.4	Very high	89 Å²	89	64.4 Å²	64.4	34%	0.336	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	114	172.3	-70.7	-67.3	-178.1	-89.7	-2.1	109	I117 V190 Y191 I192 R217	I117-R220 HydrophobicContact CD1-CB 4.27Å; I117-R220 HydrophobicContact CD1-CG 3.79Å; I117-R220 HydrophobicContact CG1-CG 4.09Å; I117-R220 HydrophobicContact CG2-CG 4Å; V190-R220 PolarHBondContact O-N 3.19Å; Y191-R220 WeakPolarHBondContact CA-O 3.4Å; Y191-R220 HydrophobicContact CD1-CB 4.03Å; Y191-R220 HydrophobicContact CE1-CB 4.5Å; I192-R220 PolarHBondContact N-O 3.01Å; R217-R220 PolarHBondContact O-NH1 3.47Å; R217-R220 VanDerWaalsContact O-NH1 3.09Å
221	V	95.8	Very high	91	Very high	15 Å²	15	62 Å²	62	9%	0.091	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	126.2	177.7	-172.7	0	0	0	0	108.9	I192 L194 F202 L213 M219 I297	I192-V221 HydrophobicContact CB-CG1 4.36Å; I192-V221 HydrophobicContact CB-CG2 4.24Å; I192-V221 HydrophobicContact CD1-CG2 4.19Å; I192-V221 HydrophobicContact CG1-CG2 4.44Å; I192-V221 CarbonylContact O-C 3.52Å; I192-V221 WeakPolarHBondContact O-CA 3.4Å; L194-V221 HydrophobicContact CD1-CG1 3.84Å; L194-V221 HydrophobicContact CG-CG1 4.32Å; F202-V221 HydrophobicContact CD1-CG1 4.34Å; F202-V221 HydrophobicContact CE1-CB 4.39Å; F202-V221 HydrophobicContact CE1-CG1 3.79Å; F202-V221 HydrophobicContact CE1-CG2 4.03Å; F202-V221 HydrophobicContact CZ-CG1 4.42Å; F202-V221 HydrophobicContact CZ-CG2 4.07Å; L213-V221 HydrophobicContact CD1-CB 4.49Å; L213-V221 HydrophobicContact CD1-CG2 4.37Å; L213-V221 HydrophobicContact CD2-CG2 4.25Å; M219-V221 HydrophobicContact CG-CG2 4.02Å; M219-V221 HydrophobicContact SD-CG2 4.11Å; V221-I297 HydrophobicContact CB-CG2 3.87Å; V221-I297 HydrophobicContact CG1-CB 4.47Å; V221-I297 HydrophobicContact CG1-CD1 4.28Å; V221-I297 HydrophobicContact CG1-CG2 4.06Å; V221-I297 WeakPolarHBondContact O-CG2 3.35Å; V221-I297 PolarHBondContact O-N 2.72Å
222	R	95.8	Very high	90.7	Very high	32 Å²	32	70.2 Å²	70.2	12%	0.121	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	155.2	178.5	-55.7	-178.6	67.2	97.4	-5.2	109	I192 L193 L194 Y291 S294 Q295	I192-R222 PolarHBondContact O-N 3.28Å; L193-R222 WeakPolarHBondContact CA-O 3.31Å; L193-R222 HydrophobicContact CD2-CB 3.75Å; L193-R222 HydrophobicContact CD2-CG 4.43Å; L194-R222 PolarHBondContact N-O 2.81Å; R222-Y291 VanDerWaalsContact CD-CZ 3.46Å; R222-Y291 HydrophobicContact CG-CE2 4.37Å; R222-S294 VanDerWaalsContact CD-OG 3.32Å; R222-S294 WeakPolarHBondContact CD-OG 3.5Å; R222-S294 PolarHBondContact NE-OG 2.84Å; R222-S294 PolarHBondContact NH2-O 2.92Å; R222-Q295 CarbonylContact C-O 3.54Å; R222-Q295 WeakPolarHBondContact CA-O 3.34Å; R222-Q295 VanDerWaalsContact CB-O 3.27Å; R222-Q295 WeakPolarHBondContact CB-O 3.34Å
223	T	96.1	Very high	90.3	Very high	28 Å²	28	67.3 Å²	67.3	17%	0.172	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	136.4	175.9	54.4	0	0	0	0	110.3	L194 A199 S294 Q295 I297	L194-T223 CarbonylContact O-C 3.6Å; L194-T223 WeakPolarHBondContact O-CA 3.44Å; A199-T223 HydrophobicContact CB-CG2 3.64Å; T223-S294 CarbonylContact O-C 3.55Å; T223-S294 WeakPolarHBondContact O-CA 3.31Å; T223-S294 WeakPolarHBondContact O-CB 3.33Å; T223-Q295 PolarHBondContact N-O 3.45Å; T223-Q295 PolarHBondContact O-N 2.56Å; T223-Q295 PolarHBondContact OG1-O 2.88Å; T223-I297 HydrophobicContact CG2-CB 4.38Å; T223-I297 HydrophobicContact CG2-CD1 4.25Å; T223-I297 HydrophobicContact CG2-CG1 4.13Å
224	V	95	Very high	90.1	Very high	3 Å²	3	67.8 Å²	67.8	2%	0.018	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	148.9	174.2	63.3	0	0	0	0	109.1	L193 L194 D195 Q196 V241 L290	L193-V224 HydrophobicContact CB-CG1 4.46Å; L194-V224 PolarHBondContact O-N 3.08Å; D195-V224 WeakPolarHBondContact CA-O 3.14Å; Q196-V224 PolarHBondContact N-O 2.9Å; V224-V241 HydrophobicContact CB-CG2 4.34Å; V224-V241 HydrophobicContact CG1-CB 4.06Å; V224-V241 HydrophobicContact CG1-CG1 4.09Å; V224-V241 HydrophobicContact CG1-CG2 3.77Å; V224-V241 HydrophobicContact CG2-CG2 4.02Å; V224-L290 HydrophobicContact CG2-CD2 4.17Å
225	A	92.6	Very high	90.1	Very high	36 Å²	36	64 Å²	64	30%	0.298	32%	0.316	S	S	.	.			trans	-122.8	151.4	178.8	0	0	0	0	0	109.1	Q196 T238 V241	Q196-A225 HydrophobicContact CG-CB 4.25Å; A225-T238 HydrophobicContact CB-CG2 3.74Å; A225-V241 VanDerWaalsContact C-CG2 3.41Å
226	G	90.1	Very high	90.2	Very high	18 Å²	18	63.4 Å²	63.4	19%	0.186	31%	0.307	C	S	.	.			trans	-72.5	-176.9	174.7	0	0	0	0	0	111.9	T228 T238 G239	G226-T228 PolarHBondContact O-N 3.44Å; G226-T238 WeakPolarHBondContact O-CG2 3.4Å; G226-G239 WeakPolarHBondContact CA-O 3.07Å; G226-G239 PolarHBondContact N-O 3.24Å
227	T	89.4	Confident	90.2	Very high	130 Å²	130	63.8 Å²	63.8	80%	0.798	31%	0.309	S	S	*	.	P	Polyproline II helix	trans	-56.5	137.5	179.1	-51.6	0	0	0	0	111.7	G239	T227-G239 PolarHBondContact O-N 2.72Å
228	T	89.2	Confident	90.2	Very high	43 Å²	43	55.6 Å²	55.6	26%	0.264	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	122.4	174.9	-62.1	0	0	0	0	110.3	G226 Y230 R236 I237 T238	G226-T228 PolarHBondContact O-N 3.44Å; T228-Y230 HydrophobicContact CG2-CD1 4.47Å; T228-Y230 HydrophobicContact CG2-CD2 4.17Å; T228-Y230 HydrophobicContact CG2-CE1 4.01Å; T228-Y230 HydrophobicContact CG2-CE2 3.67Å; T228-R236 HydrophobicContact CG2-CB 3.84Å; T228-R236 HydrophobicContact CG2-CG 4.29Å; T228-I237 CarbonylContact C-O 3.48Å; T228-I237 WeakPolarHBondContact CA-O 3.24Å; T228-T238 PolarHBondContact OG1-OG1 3.28Å
229	Y	87.8	Confident	90	Very high	89 Å²	89	54.3 Å²	54.3	35%	0.349	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	121	173.8	-164.8	-95	0	0	0	110	R35 L38 M231 R236 I237	R35-Y229 VanDerWaalsContact CB-OH 3.24Å; R35-Y229 WeakPolarHBondContact CB-OH 3.41Å; R35-Y229 HydrophobicContact CG-CE1 4.32Å; R35-Y229 WeakPolarHBondContact CG-OH 3.49Å; L38-Y229 HydrophobicContact CD2-CD1 3.95Å; L38-Y229 HydrophobicContact CD2-CE1 3.82Å; Y229-M231 HydrophobicContact CD1-CE 4.39Å; Y229-M231 HydrophobicContact CD1-CG 4.38Å; Y229-M231 HydrophobicContact CE1-CG 4.47Å; Y229-R236 CarbonylContact O-C 3.58Å; Y229-R236 VanDerWaalsContact O-CA 3.27Å; Y229-R236 WeakPolarHBondContact O-CA 3.48Å; Y229-I237 PolarHBondContact N-O 3.02Å; Y229-I237 PolarHBondContact O-N 2.97Å
230	Y	86.4	Confident	89.8	Confident	156 Å²	156	59.3 Å²	59.3	61%	0.612	31%	0.305	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.3	134.6	-180	-66.7	-86.1	0	0	0	110.9	T228 R236	T228-Y230 HydrophobicContact CG2-CD1 4.47Å; T228-Y230 HydrophobicContact CG2-CD2 4.17Å; T228-Y230 HydrophobicContact CG2-CE1 4.01Å; T228-Y230 HydrophobicContact CG2-CE2 3.67Å; Y230-R236 HydrophobicContact CD1-CB 3.95Å; Y230-R236 HydrophobicContact CE1-CB 4.1Å
231	M	84.9	Confident	89.7	Confident	12 Å²	12	55.5 Å²	55.5	6%	0.059	29%	0.292	C	S	.	.	P	Polyproline II helix	trans	-101.6	161.2	175.6	-60.3	-167.9	-174.1	0	0	111.6	L38 E39 L42 Y229 S233 G234 A235 I237	L38-M231 HydrophobicContact CB-CE 4.35Å; L38-M231 HydrophobicContact CD2-CE 3.66Å; L38-M231 HydrophobicContact CG-CE 3.59Å; E39-M231 HydrophobicContact CG-CB 4.29Å; E39-M231 HydrophobicContact CG-CG 4.34Å; E39-M231 HydrophobicContact CG-SD 3.99Å; L42-M231 HydrophobicContact CB-SD 4.24Å; L42-M231 HydrophobicContact CD1-CE 3.18Å; L42-M231 HydrophobicContact CD1-SD 3.43Å; L42-M231 WeakPolarHBondContact CD1-SD 3.41Å; L42-M231 HydrophobicContact CG-CE 3.65Å; L42-M231 HydrophobicContact CG-SD 3.95Å; Y229-M231 HydrophobicContact CD1-CE 4.39Å; Y229-M231 HydrophobicContact CD1-CG 4.38Å; Y229-M231 HydrophobicContact CE1-CG 4.47Å; M231-S233 PolarHBondContact O-N 3.5Å; M231-G234 WeakPolarHBondContact O-CA 3.25Å; M231-G234 PolarHBondContact O-N 3.24Å; M231-A235 HydrophobicContact CB-CB 4.47Å; M231-A235 WeakPolarHBondContact CB-O 3.35Å; M231-A235 PolarHBondContact N-O 3.27Å; M231-I237 HydrophobicContact CE-CD1 3.29Å; M231-I237 HydrophobicContact CE-CG1 4.08Å
232	R	83.1	Confident	89.4	Confident	193 Å²	193	60.1 Å²	60.1	73%	0.728	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-30.3	176.5	-173.1	177.5	-175	149.9	5.4	112.4	E39 G234	E39-R232 WeakPolarHBondContact OE1-CB 3.4Å; E39-R232 PolarHBondContact OE1-N 2.94Å; R232-G234 PolarHBondContact O-N 3.46Å; R232-G234 VanDerWaalsContact O-N 3.15Å
233	S	81.8	Confident	89.3	Confident	73 Å²	73	62.2 Å²	62.2	51%	0.51	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-7.6	173.6	62.5	0	0	0	0	113.5	P77 M231 A235	P77-S233 WeakPolarHBondContact CG-O 3.4Å; M231-S233 PolarHBondContact O-N 3.5Å; S233-A235 PolarHBondContact O-N 2.78Å; S233-A235 WeakPolarHBondContact OG-CB 3.33Å; S233-A235 PolarHBondContact OG-N 3.07Å
234	G	84.4	Confident	89.3	Confident	33 Å²	33	63.8 Å²	63.8	34%	0.34	33%	0.326	S	S	.	.	S	Bend	trans	79.3	-0.9	-171.6	0	0	0	0	0	113.5	M231 R232	M231-G234 WeakPolarHBondContact O-CA 3.25Å; M231-G234 PolarHBondContact O-N 3.24Å; R232-G234 PolarHBondContact O-N 3.46Å; R232-G234 VanDerWaalsContact O-N 3.15Å
235	A	86.8	Confident	89.4	Confident	10 Å²	10	64 Å²	64	8%	0.083	33%	0.327	C	S	.	.			trans	-67.4	147.8	169.3	0	0	0	0	0	109.9	L42 V75 M231 S233	L42-A235 HydrophobicContact CD1-CB 4.34Å; V75-A235 CarbonylContact O-C 3.6Å; V75-A235 VanDerWaalsContact O-CA 3.31Å; V75-A235 WeakPolarHBondContact O-CA 3.48Å; M231-A235 HydrophobicContact CB-CB 4.47Å; M231-A235 WeakPolarHBondContact CB-O 3.35Å; M231-A235 PolarHBondContact N-O 3.27Å; S233-A235 PolarHBondContact O-N 2.78Å; S233-A235 WeakPolarHBondContact OG-CB 3.33Å; S233-A235 PolarHBondContact OG-N 3.07Å
236	R	89.9	Confident	89.7	Confident	89 Å²	89	62.4 Å²	62.4	34%	0.336	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	146.1	177.8	72.5	-179.7	90.2	126.3	-1.7	111.5	V75 T228 Y229 Y230	V75-R236 HydrophobicContact CB-CG 4.14Å; V75-R236 PolarHBondContact N-O 2.91Å; V75-R236 PolarHBondContact O-N 2.93Å; T228-R236 HydrophobicContact CG2-CB 3.84Å; T228-R236 HydrophobicContact CG2-CG 4.29Å; Y229-R236 CarbonylContact O-C 3.58Å; Y229-R236 VanDerWaalsContact O-CA 3.27Å; Y229-R236 WeakPolarHBondContact O-CA 3.48Å; Y230-R236 HydrophobicContact CD1-CB 3.95Å; Y230-R236 HydrophobicContact CE1-CB 4.1Å
237	I	90.9	Very high	90	Very high	20 Å²	20	61.5 Å²	61.5	10%	0.103	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	126.5	171.9	-57.7	158.8	0	0	0	107.3	L38 L42 I70 A73 A74 T228 Y229 M231	L38-I237 HydrophobicContact CD2-CD1 3.91Å; L38-I237 HydrophobicContact CG-CD1 4.31Å; L42-I237 HydrophobicContact CD1-CD1 4.03Å; L42-I237 HydrophobicContact CD1-CG1 4.1Å; I70-I237 HydrophobicContact CG2-CD1 3.41Å; I70-I237 VanDerWaalsContact CG2-CD1 3.41Å; I70-I237 HydrophobicContact CG2-CG1 4.24Å; A73-I237 HydrophobicContact CB-CG2 4.35Å; A74-I237 HydrophobicContact CB-CG1 4.22Å; T228-I237 CarbonylContact C-O 3.48Å; T228-I237 WeakPolarHBondContact CA-O 3.24Å; Y229-I237 PolarHBondContact N-O 3.02Å; Y229-I237 PolarHBondContact O-N 2.97Å; M231-I237 HydrophobicContact CE-CD1 3.29Å; M231-I237 HydrophobicContact CE-CG1 4.08Å
238	T	90.6	Very high	90.3	Very high	34 Å²	34	55.3 Å²	55.3	21%	0.209	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	124.9	177.2	-57.8	0	0	0	0	109.8	A225 G226 T228	A225-T238 HydrophobicContact CB-CG2 3.74Å; G226-T238 WeakPolarHBondContact O-CG2 3.4Å; T228-T238 PolarHBondContact OG1-OG1 3.28Å
239	G	90.6	Very high	90.5	Very high	30 Å²	30	53.8 Å²	53.8	31%	0.309	26%	0.256	S	S	.	.	P	Polyproline II helix	trans	-67.1	171.8	175.8	0	0	0	0	0	112.9	G226 T227	G226-G239 WeakPolarHBondContact CA-O 3.07Å; G226-G239 PolarHBondContact N-O 3.24Å; T227-G239 PolarHBondContact O-N 2.72Å
240	K	90.9	Very high	90.6	Very high	112 Å²	112	49.5 Å²	49.5	49%	0.487	24%	0.24	S	C	.	.	P	Polyproline II helix	trans	-102.4	151.8	174.9	-62.6	-172.6	-179.2	-170.1	0	110.6
241	V	90.9	Very high	90.7	Very high	10 Å²	10	45.3 Å²	45.3	6%	0.061	23%	0.228	C	C	.	.	P	Polyproline II helix	trans	-89.2	121.5	171.5	-177.8	0	0	0	0	109	D168 D195 V224 A225 E243	D168-V241 WeakPolarHBondContact CB-O 3.44Å; D195-V241 HydrophobicContact CB-CB 4.42Å; D195-V241 PolarHBondContact OD1-N 3.5Å; V224-V241 HydrophobicContact CB-CG2 4.34Å; V224-V241 HydrophobicContact CG1-CB 4.06Å; V224-V241 HydrophobicContact CG1-CG1 4.09Å; V224-V241 HydrophobicContact CG1-CG2 3.77Å; V224-V241 HydrophobicContact CG2-CG2 4.02Å; A225-V241 VanDerWaalsContact C-CG2 3.41Å; V241-E243 HydrophobicContact CG1-CB 4.05Å; V241-E243 HydrophobicContact CG1-CG 4.46Å
242	H	90.3	Very high	91.2	Very high	112 Å²	112	47.6 Å²	47.6	52%	0.519	24%	0.236	S	C	.	.			trans	-109.8	4.8	177.2	-70.7	-52.7	0	0	0	113.2	D168 R244	D168-H242 IonicContact OD2-ND1 3.58Å; H242-R244 PolarHBondContact O-N 3.21Å; H242-R244 PolarHBondContact O-NH1 3.18Å
243	E	93.5	Very high	91.9	Very high	76 Å²	76	38.4 Å²	38.4	36%	0.355	20%	0.201	S	C	.	.			trans	-65.7	132.9	174.9	-68.9	-179.2	-130.2	0	0	110.9	V166 V241 L290	V166-E243 HydrophobicContact CG1-CB 4.08Å; V241-E243 HydrophobicContact CG1-CB 4.05Å; V241-E243 HydrophobicContact CG1-CG 4.46Å; E243-L290 WeakPolarHBondContact OE2-CD1 3.33Å
244	R	95.8	Very high	92.7	Very high	60 Å²	60	35 Å²	35	23%	0.226	18%	0.177	C	C	.	.			trans	-136.3	100.1	-177.1	-64.3	175.8	-162.7	91.3	-1	108.6	V166 D168 H242 T255	V166-R244 WeakPolarHBondContact O-CA 3.5Å; D168-R244 VanDerWaalsContact CG-NH2 3.34Å; D168-R244 IonicContact OD1-CZ 3.87Å; D168-R244 IonicContact OD1-NE 2.93Å; D168-R244 PolarHBondContact OD1-NE 3.39Å; D168-R244 IonicContact OD1-NH2 3.98Å; D168-R244 IonicContact OD2-CZ 2.9Å; D168-R244 IonicContact OD2-NE 2.68Å; D168-R244 PolarHBondContact OD2-NE 3.42Å; D168-R244 IonicContact OD2-NH2 3.3Å; D168-R244 PolarHBondContact OD2-NH2 2.73Å; H242-R244 PolarHBondContact O-N 3.21Å; H242-R244 PolarHBondContact O-NH1 3.18Å; R244-T255 WeakPolarHBondContact O-CA 3.28Å; R244-T255 WeakPolarHBondContact O-CB 3.5Å; R244-T255 PolarHBondContact O-OG1 2.91Å
245	F	98.1	Very high	93.4	Very high	9 Å²	9	35.2 Å²	35.2	4%	0.039	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	158	169.7	69	-91.1	0	0	0	112.5	V166 V253 A254 F283 E286 F287 L290	V166-F245 HydrophobicContact CB-CD1 4.04Å; V166-F245 HydrophobicContact CB-CE1 3.84Å; V166-F245 HydrophobicContact CB-CZ 4.16Å; V166-F245 HydrophobicContact CG1-CE1 4.36Å; V166-F245 HydrophobicContact CG2-CD1 4.24Å; V166-F245 HydrophobicContact CG2-CE1 3.61Å; V166-F245 HydrophobicContact CG2-CE2 3.93Å; V166-F245 HydrophobicContact CG2-CZ 3.44Å; V166-F245 VanDerWaalsContact CG2-CZ 3.44Å; V166-F245 PolarHBondContact N-O 2.76Å; V166-F245 PolarHBondContact O-N 3.46Å; V166-F245 VanDerWaalsContact O-O 3.09Å; F245-V253 HydrophobicContact CB-CG1 4.17Å; F245-A254 CarbonylContact C-O 3.43Å; F245-A254 WeakPolarHBondContact CA-O 3.2Å; F245-A254 WeakPolarHBondContact CB-O 3.46Å; F245-F283 HydrophobicContact CB-CD1 4.09Å; F245-F283 HydrophobicContact CB-CE1 4.15Å; F245-F283 HydrophobicContact CD1-CD1 4.06Å; F245-F283 HydrophobicContact CD1-CE1 4.43Å; F245-F283 HydrophobicContact CD2-CB 4.32Å; F245-F283 AromaticContact CD2-CD1 3.81Å; F245-F283 HydrophobicContact CD2-CD1 3.81Å; F245-F283 HydrophobicContact CD2-CG 4.5Å; F245-F283 HydrophobicContact CE1-CD1 4.42Å; F245-F283 HydrophobicContact CE2-CB 4.19Å; F245-F283 HydrophobicContact CE2-CD1 4.19Å; F245-F283 AromaticContact CG-CD1 3.73Å; F245-F283 HydrophobicContact CG-CD1 3.73Å; F245-F283 HydrophobicContact CG-CE1 4.2Å; F245-F283 HydrophobicContact CZ-CD1 4.48Å; F245-E286 HydrophobicContact CE1-CG 4.29Å; F245-E286 HydrophobicContact CZ-CB 4.44Å; F245-E286 HydrophobicContact CZ-CG 4.42Å; F245-F287 HydrophobicContact CE2-CB 4.12Å; F245-F287 HydrophobicContact CE2-CD2 4.27Å; F245-F287 HydrophobicContact CZ-CB 4.09Å; F245-F287 HydrophobicContact CZ-CD2 4.39Å; F245-L290 HydrophobicContact CE1-CD1 4.31Å
246	M	98	Very high	93.8	Very high	1 Å²	1	35.8 Å²	35.8	1%	0.005	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	118.5	175.7	174.8	178	71.2	0	0	108.9	M155 I156 I163 A164 I165 I248 V253 A254	M155-M246 HydrophobicContact CB-CE 3.61Å; M155-M246 HydrophobicContact CE-CE 4.36Å; M155-M246 HydrophobicContact CG-CE 4.49Å; M155-M246 HydrophobicContact SD-CE 4.15Å; I156-M246 HydrophobicContact CD1-SD 3.99Å; I156-M246 HydrophobicContact CG1-CE 4.09Å; I156-M246 HydrophobicContact CG1-SD 3.52Å; I156-M246 VanDerWaalsContact CG1-SD 3.52Å; I163-M246 HydrophobicContact CG2-CG 4.46Å; A164-M246 CarbonylContact O-C 3.58Å; A164-M246 VanDerWaalsContact O-CA 3.27Å; A164-M246 WeakPolarHBondContact O-CA 3.39Å; I165-M246 HydrophobicContact CD1-SD 4.35Å; I165-M246 HydrophobicContact CG1-CB 4.18Å; I165-M246 HydrophobicContact CG1-CG 3.77Å; I165-M246 HydrophobicContact CG1-SD 4.2Å; M246-I248 HydrophobicContact CE-CD1 4.1Å; M246-I248 HydrophobicContact CE-CG1 4.12Å; M246-I248 HydrophobicContact CG-CD1 3.76Å; M246-I248 HydrophobicContact CG-CG1 4.13Å; M246-I248 HydrophobicContact SD-CD1 3.85Å; M246-I248 HydrophobicContact SD-CG1 4.44Å; M246-V253 CarbonylContact O-C 3.47Å; M246-V253 WeakPolarHBondContact O-CA 3.41Å; M246-A254 HydrophobicContact CB-CB 4.35Å; M246-A254 HydrophobicContact CE-CB 4.06Å; M246-A254 PolarHBondContact N-O 2.71Å; M246-A254 PolarHBondContact O-N 3.31Å
247	L	97.2	Very high	94.1	Very high	0 Å²	0	34 Å²	34	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	126.3	174.5	-178	69.5	0	0	0	109.4	W119 A164 R252 V253 D284	W119-L247 HydrophobicContact CH2-CD2 4.06Å; W119-L247 HydrophobicContact CZ2-CD2 3.85Å; A164-L247 HydrophobicContact CB-CB 4.08Å; A164-L247 PolarHBondContact N-O 3.41Å; A164-L247 PolarHBondContact O-N 2.95Å; L247-R252 CarbonylContact C-O 3.55Å; L247-R252 WeakPolarHBondContact CA-O 3.49Å; L247-V253 HydrophobicContact CD1-CG2 3.37Å; L247-D284 HydrophobicContact CD2-CB 4.02Å
248	I	96	Very high	94.4	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	125.6	180	-57.5	-64.1	0	0	0	108.8	M155 A159 I163 M246 G250 N251 R252	M155-I248 HydrophobicContact CB-CG1 4.26Å; M155-I248 HydrophobicContact CE-CG1 4.22Å; A159-I248 HydrophobicContact CB-CD1 4.38Å; A159-I248 HydrophobicContact CB-CG2 3.71Å; I163-I248 HydrophobicContact CB-CD1 4.23Å; I163-I248 HydrophobicContact CG1-CD1 3.86Å; I163-I248 HydrophobicContact CG2-CD1 3.86Å; M246-I248 HydrophobicContact CE-CD1 4.1Å; M246-I248 HydrophobicContact CE-CG1 4.12Å; M246-I248 HydrophobicContact CG-CD1 3.76Å; M246-I248 HydrophobicContact CG-CG1 4.13Å; M246-I248 HydrophobicContact SD-CD1 3.85Å; M246-I248 HydrophobicContact SD-CG1 4.44Å; I248-G250 PolarHBondContact O-N 2.92Å; I248-N251 PolarHBondContact O-N 3.01Å; I248-N251 VanDerWaalsContact O-N 3.13Å; I248-N251 PolarHBondContact O-OD1 3.28Å; I248-R252 HydrophobicContact CB-CB 4.41Å; I248-R252 PolarHBondContact N-O 2.98Å; I248-R252 PolarHBondContact O-N 2.9Å
249	D	93.2	Very high	94.6	Very high	10 Å²	10	35.3 Å²	35.3	5%	0.053	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	50	24.9	176.5	-50.8	-35.6	0	0	0	113.2	F122 K160 E161 V162 N251 R252	F122-D249 WeakPolarHBondContact CZ-O 3.3Å; K160-D249 PolarHBondContact N-OD1 3.23Å; K160-D249 PolarHBondContact N-OD2 3.34Å; E161-D249 HydrophobicContact CB-CB 4.45Å; E161-D249 PolarHBondContact N-OD1 3.46Å; V162-D249 PolarHBondContact N-OD1 3.08Å; V162-D249 PolarHBondContact O-N 3.32Å; D249-N251 PolarHBondContact O-N 3.37Å; D249-R252 IonicContact OD2-NH2 3.87Å
250	G	88.7	Confident	94.9	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.4	7.8	-174.6	0	0	0	0	0	117.9	F122 R128 I248 T280	F122-G250 VanDerWaalsContact CE2-CA 3.44Å; R128-G250 PolarHBondContact NH1-O 3.37Å; R128-G250 VanDerWaalsContact NH1-O 3.08Å; I248-G250 PolarHBondContact O-N 2.92Å; G250-T280 PolarHBondContact O-OG1 3.4Å
251	N	90.1	Very high	95.2	Very high	68 Å²	68	29.4 Å²	29.4	36%	0.364	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	-123.5	-9.4	-174.9	64.9	26.4	0	0	0	114.3	I248 D249 S276 T280	I248-N251 PolarHBondContact O-N 3.01Å; I248-N251 VanDerWaalsContact O-N 3.13Å; I248-N251 PolarHBondContact O-OD1 3.28Å; D249-N251 PolarHBondContact O-N 3.37Å; N251-S276 WeakPolarHBondContact O-CA 3.39Å; N251-T280 WeakPolarHBondContact O-CG2 3.43Å
252	R	95.1	Very high	95.3	Very high	59 Å²	59	36.2 Å²	36.2	22%	0.223	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	140.1	175	-72.8	178.2	-68.4	167.1	3.7	110.5	M155 S158 L247 I248 D249 L275	M155-R252 HydrophobicContact CE-CB 4.08Å; S158-R252 PolarHBondContact OG-NH1 3.12Å; S158-R252 VanDerWaalsContact OG-NH1 3.1Å; S158-R252 PolarHBondContact OG-NH2 2.95Å; L247-R252 CarbonylContact C-O 3.55Å; L247-R252 WeakPolarHBondContact CA-O 3.49Å; I248-R252 HydrophobicContact CB-CB 4.41Å; I248-R252 PolarHBondContact N-O 2.98Å; I248-R252 PolarHBondContact O-N 2.9Å; D249-R252 IonicContact OD2-NH2 3.87Å; R252-L275 CarbonylContact C-O 3.58Å; R252-L275 WeakPolarHBondContact CA-O 3.39Å
253	V	97.9	Very high	95.5	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	136.4	178.5	174.1	0	0	0	0	109.1	F245 M246 L247 E274 L275 T280 F283	F245-V253 HydrophobicContact CB-CG1 4.17Å; M246-V253 CarbonylContact O-C 3.47Å; M246-V253 WeakPolarHBondContact O-CA 3.41Å; L247-V253 HydrophobicContact CD1-CG2 3.37Å; V253-E274 CarbonylContact O-C 3.55Å; V253-E274 WeakPolarHBondContact O-CA 3.46Å; V253-L275 HydrophobicContact CB-CB 4.31Å; V253-L275 PolarHBondContact N-O 3.03Å; V253-L275 PolarHBondContact O-N 3.23Å; V253-T280 HydrophobicContact CB-CG2 4.46Å; V253-T280 HydrophobicContact CG2-CG2 3.74Å; V253-F283 HydrophobicContact CB-CD2 4.2Å; V253-F283 HydrophobicContact CB-CG 4.34Å; V253-F283 HydrophobicContact CG1-CB 4.32Å; V253-F283 HydrophobicContact CG1-CD1 3.78Å; V253-F283 HydrophobicContact CG1-CD2 3.88Å; V253-F283 HydrophobicContact CG1-CE1 3.96Å; V253-F283 HydrophobicContact CG1-CE2 4.05Å; V253-F283 HydrophobicContact CG1-CG 3.73Å; V253-F283 HydrophobicContact CG1-CZ 4.09Å; V253-F283 HydrophobicContact CG2-CB 3.71Å; V253-F283 HydrophobicContact CG2-CD2 3.85Å; V253-F283 HydrophobicContact CG2-CG 3.84Å
254	A	98.1	Very high	95.6	Very high	2 Å²	2	30.1 Å²	30.1	2%	0.017	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	130.7	165.3	0	0	0	0	0	108.8	M155 F245 M246 L272 I273	M155-A254 HydrophobicContact CE-CB 3.84Å; M155-A254 HydrophobicContact SD-CB 3.62Å; F245-A254 CarbonylContact C-O 3.43Å; F245-A254 WeakPolarHBondContact CA-O 3.2Å; F245-A254 WeakPolarHBondContact CB-O 3.46Å; M246-A254 HydrophobicContact CB-CB 4.35Å; M246-A254 HydrophobicContact CE-CB 4.06Å; M246-A254 PolarHBondContact N-O 2.71Å; M246-A254 PolarHBondContact O-N 3.31Å; A254-L272 HydrophobicContact CB-CD1 3.91Å; A254-L272 HydrophobicContact CB-CD2 4.27Å; A254-L272 HydrophobicContact CB-CG 4.2Å; A254-I273 CarbonylContact C-O 3.53Å; A254-I273 WeakPolarHBondContact CA-O 3.08Å
255	T	98.1	Very high	95.3	Very high	37 Å²	37	27.3 Å²	27.3	23%	0.227	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	151.9	175.4	-174	0	0	0	0	111.7	R244 I273 L275 F283	R244-T255 WeakPolarHBondContact O-CA 3.28Å; R244-T255 WeakPolarHBondContact O-CB 3.5Å; R244-T255 PolarHBondContact O-OG1 2.91Å; T255-I273 PolarHBondContact N-O 3.25Å; T255-I273 PolarHBondContact O-N 3.25Å; T255-L275 HydrophobicContact CG2-CD1 4.04Å; T255-F283 HydrophobicContact CG2-CE1 4.48Å; T255-F283 HydrophobicContact CG2-CZ 4.17Å
256	G	96.6	Very high	94.9	Very high	22 Å²	22	30.5 Å²	30.5	23%	0.227	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	162.5	-162.4	178.7	0	0	0	0	0	113.8	N271	G256-N271 CarbonylContact C-O 3.51Å; G256-N271 WeakPolarHBondContact CA-O 3.2Å
257	S	95.8	Very high	94.6	Very high	51 Å²	51	36 Å²	36	36%	0.357	18%	0.179	S	C	.	.	S	Bend	trans	-83.6	-14.9	176.7	58.5	0	0	0	0	113.5	R259 S270 N271	S257-R259 PolarHBondContact O-N 2.93Å; S257-S270 WeakPolarHBondContact OG-CA 3.45Å; S257-N271 WeakPolarHBondContact CB-OD1 3.46Å; S257-N271 PolarHBondContact N-O 2.86Å; S257-N271 PolarHBondContact N-OD1 2.76Å; S257-N271 PolarHBondContact OG-N 2.74Å; S257-N271 PolarHBondContact OG-OD1 3.17Å
258	Y	96.5	Very high	94.4	Very high	5 Å²	5	39 Å²	39	2%	0.02	20%	0.195	C	C	.	.			trans	-64.3	119.3	179.9	-178	-108.2	0	0	0	111.9	C148 K149 A152 F260 D264 N271	C148-Y258 HydrophobicContact CB-CD1 4.34Å; C148-Y258 HydrophobicContact CB-CD2 3.68Å; C148-Y258 HydrophobicContact CB-CE2 4.15Å; C148-Y258 HydrophobicContact CB-CG 3.81Å; K149-Y258 HydrophobicContact CB-CE2 4.42Å; K149-Y258 VanDerWaalsContact CB-OH 3.3Å; K149-Y258 WeakPolarHBondContact CB-OH 3.25Å; K149-Y258 WeakPolarHBondContact CG-OH 3.31Å; A152-Y258 HydrophobicContact CB-CE1 4.4Å; Y258-F260 HydrophobicContact CD1-CD1 4.03Å; Y258-F260 AromaticContact CD1-CE1 3.98Å; Y258-F260 HydrophobicContact CD1-CE1 3.98Å; Y258-F260 AromaticContact CE1-CD1 3.66Å; Y258-F260 HydrophobicContact CE1-CD1 3.66Å; Y258-F260 AromaticContact CE1-CE1 3.92Å; Y258-F260 HydrophobicContact CE1-CE1 3.92Å; Y258-D264 HydrophobicContact CD2-CB 4.04Å; Y258-D264 HydrophobicContact CE2-CB 4.03Å; Y258-D264 WeakPolarHBondContact CE2-O 3.42Å; Y258-N271 PolarHBondContact N-O 2.72Å
259	R	95.9	Very high	94.2	Very high	77 Å²	77	43.8 Å²	43.8	29%	0.291	23%	0.228	S	C	.	.			trans	-97.5	151.9	171.1	-54.7	174.7	-68.7	171.5	-0.2	111.2	D168 S257 N261 D264	D168-R259 WeakPolarHBondContact OD1-CD 3.27Å; D168-R259 WeakPolarHBondContact OD1-CG 3.4Å; S257-R259 PolarHBondContact O-N 2.93Å; R259-N261 PolarHBondContact O-N 3.43Å; R259-D264 WeakPolarHBondContact CA-OD2 3.25Å; R259-D264 HydrophobicContact CB-CB 4.49Å; R259-D264 WeakPolarHBondContact CB-OD2 3.41Å; R259-D264 WeakPolarHBondContact CG-OD2 3.46Å; R259-D264 IonicContact CZ-OD1 3.91Å; R259-D264 IonicContact CZ-OD2 3.73Å; R259-D264 PolarHBondContact N-OD2 3.17Å; R259-D264 IonicContact NE-OD1 3.46Å; R259-D264 IonicContact NE-OD2 3.58Å; R259-D264 PolarHBondContact NE-OD2 3Å; R259-D264 IonicContact NH2-OD1 3.57Å; R259-D264 PolarHBondContact NH2-OD1 2.96Å; R259-D264 IonicContact NH2-OD2 2.99Å; R259-D264 WeakPolarHBondContact O-CB 3.44Å
260	F	96.6	Very high	94.3	Very high	11 Å²	11	43.8 Å²	43.8	5%	0.048	23%	0.229	C	C	.	.	B	Isolated β-bridge	trans	-82.2	59.6	-179.8	-54.7	-45.7	0	0	0	111.7	A152 I165 T167 S169 L170 T171 D172 I175 Y258	A152-F260 HydrophobicContact CB-CE1 3.94Å; I165-F260 HydrophobicContact CG2-CD2 4.39Å; I165-F260 HydrophobicContact CG2-CE2 3.86Å; T167-F260 HydrophobicContact CG2-CD2 4.14Å; S169-F260 WeakPolarHBondContact O-CB 3.35Å; S169-F260 PolarHBondContact O-N 3.12Å; L170-F260 CarbonylContact C-O 3.45Å; L170-F260 WeakPolarHBondContact CA-O 3.41Å; L170-F260 HydrophobicContact CD1-CB 3.59Å; L170-F260 HydrophobicContact CD1-CD2 3.87Å; L170-F260 HydrophobicContact CD1-CG 4.08Å; T171-F260 PolarHBondContact N-O 3.14Å; D172-F260 WeakPolarHBondContact CB-O 3.08Å; D172-F260 PolarHBondContact N-O 3.43Å; I175-F260 HydrophobicContact CG1-CD1 4.45Å; I175-F260 HydrophobicContact CG2-CB 4.42Å; I175-F260 HydrophobicContact CG2-CD1 4.4Å; I175-F260 HydrophobicContact CG2-CG 4.28Å; Y258-F260 HydrophobicContact CD1-CD1 4.03Å; Y258-F260 AromaticContact CD1-CE1 3.98Å; Y258-F260 HydrophobicContact CD1-CE1 3.98Å; Y258-F260 AromaticContact CE1-CD1 3.66Å; Y258-F260 HydrophobicContact CE1-CD1 3.66Å; Y258-F260 AromaticContact CE1-CE1 3.92Å; Y258-F260 HydrophobicContact CE1-CE1 3.92Å
261	N	96.1	Very high	94.6	Very high	8 Å²	8	46 Å²	46	4%	0.043	24%	0.241	C	C	.	.	S	Bend	trans	-129.8	164.3	172.7	62.7	46.4	0	0	0	111.1	S169 T171 R259 T263 D264 G265	S169-N261 PolarHBondContact OG-ND2 2.94Å; T171-N261 VanDerWaalsContact OG1-CB 3.32Å; T171-N261 WeakPolarHBondContact OG1-CB 3.35Å; R259-N261 PolarHBondContact O-N 3.43Å; N261-T263 VanDerWaalsContact C-N 3.3Å; N261-T263 PolarHBondContact O-N 2.95Å; N261-T263 PolarHBondContact OD1-N 3.36Å; N261-T263 PolarHBondContact OD1-OG1 2.82Å; N261-D264 PolarHBondContact O-N 3.34Å; N261-D264 WeakPolarHBondContact OD1-CB 3.34Å; N261-D264 PolarHBondContact OD1-N 3.06Å; N261-D264 PolarHBondContact OD1-OD1 3.25Å; N261-G265 PolarHBondContact O-N 3.39Å
262	W	94.8	Very high	95	Very high	153 Å²	153	43 Å²	43	58%	0.58	23%	0.225	S	C	*	.	H	α-helix	trans	-64.3	-35	-176.6	-177.2	91.8	0	0	0	112.7	G265 K266 L267	W262-G265 PolarHBondContact O-N 3.39Å; W262-K266 HydrophobicContact CD2-CG 4.24Å; W262-K266 HydrophobicContact CH2-CB 4.46Å; W262-K266 HydrophobicContact CZ2-CB 4.32Å; W262-K266 HydrophobicContact CZ2-CG 4.04Å; W262-K266 WeakPolarHBondContact O-CB 3.45Å; W262-K266 PolarHBondContact O-N 2.92Å; W262-K266 VanDerWaalsContact O-N 3.11Å; W262-L267 HydrophobicContact CH2-CD1 4.46Å; W262-L267 HydrophobicContact CZ3-CD1 3.78Å; W262-L267 HydrophobicContact CZ3-CG 4.1Å
263	T	94.6	Very high	95.1	Very high	56 Å²	56	42.6 Å²	42.6	34%	0.344	23%	0.227	S	C	.	.	H	α-helix	trans	-66.2	-43.8	-179.3	46.4	0	0	0	0	112	N261 G265 K266 L267 N268	N261-T263 VanDerWaalsContact C-N 3.3Å; N261-T263 PolarHBondContact O-N 2.95Å; N261-T263 PolarHBondContact OD1-N 3.36Å; N261-T263 PolarHBondContact OD1-OG1 2.82Å; T263-G265 VanDerWaalsContact C-N 3.29Å; T263-G265 PolarHBondContact O-N 3.3Å; T263-K266 PolarHBondContact O-N 2.84Å; T263-L267 HydrophobicContact CG2-CD1 4.44Å; T263-L267 WeakPolarHBondContact O-CA 3.22Å; T263-L267 WeakPolarHBondContact O-CB 3.47Å; T263-L267 PolarHBondContact O-N 3.3Å; T263-N268 PolarHBondContact O-N 2.81Å
264	D	93.7	Very high	95.1	Very high	4 Å²	4	44.4 Å²	44.4	2%	0.021	24%	0.235	C	C	.	.	H	α-helix	trans	-71.6	-29.1	175.1	-70.6	18	0	0	0	110.6	Q138 Y258 R259 N261 K266 N268	Q138-D264 PolarHBondContact NE2-O 3.47Å; Y258-D264 HydrophobicContact CD2-CB 4.04Å; Y258-D264 HydrophobicContact CE2-CB 4.03Å; Y258-D264 WeakPolarHBondContact CE2-O 3.42Å; R259-D264 WeakPolarHBondContact CA-OD2 3.25Å; R259-D264 HydrophobicContact CB-CB 4.49Å; R259-D264 WeakPolarHBondContact CB-OD2 3.41Å; R259-D264 WeakPolarHBondContact CG-OD2 3.46Å; R259-D264 IonicContact CZ-OD1 3.91Å; R259-D264 IonicContact CZ-OD2 3.73Å; R259-D264 PolarHBondContact N-OD2 3.17Å; R259-D264 IonicContact NE-OD1 3.46Å; R259-D264 IonicContact NE-OD2 3.58Å; R259-D264 PolarHBondContact NE-OD2 3Å; R259-D264 IonicContact NH2-OD1 3.57Å; R259-D264 PolarHBondContact NH2-OD1 2.96Å; R259-D264 IonicContact NH2-OD2 2.99Å; R259-D264 WeakPolarHBondContact O-CB 3.44Å; N261-D264 PolarHBondContact O-N 3.34Å; N261-D264 WeakPolarHBondContact OD1-CB 3.34Å; N261-D264 PolarHBondContact OD1-N 3.06Å; N261-D264 PolarHBondContact OD1-OD1 3.25Å; D264-K266 VanDerWaalsContact C-N 3.29Å; D264-K266 PolarHBondContact O-N 3.04Å; D264-N268 PolarHBondContact OD1-ND2 3.46Å
265	G	89.8	Confident	95.1	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-69.9	-16.7	173.3	0	0	0	0	0	115.7	Y146 N261 W262 T263	Y146-G265 WeakPolarHBondContact CD1-O 3.3Å; N261-G265 PolarHBondContact O-N 3.39Å; W262-G265 PolarHBondContact O-N 3.39Å; T263-G265 VanDerWaalsContact C-N 3.29Å; T263-G265 PolarHBondContact O-N 3.3Å
266	K	90.2	Very high	95	Very high	76 Å²	76	45.3 Å²	45.3	33%	0.33	24%	0.241	S	C	.	.	H	α-helix	trans	-136.3	-36.4	-170.3	-65.9	-62.4	-175.3	-176.5	0	115.8	Y146 W262 T263 D264	Y146-K266 HydrophobicContact CD1-CD 4.12Å; Y146-K266 HydrophobicContact CE1-CD 3.44Å; Y146-K266 VanDerWaalsContact CE1-CD 3.44Å; Y146-K266 HydrophobicContact CE2-CD 4.16Å; Y146-K266 VanDerWaalsContact CZ-CD 3.46Å; Y146-K266 WeakPolarHBondContact OH-CD 3.3Å; Y146-K266 PolarHBondContact OH-NZ 3.31Å; W262-K266 HydrophobicContact CD2-CG 4.24Å; W262-K266 HydrophobicContact CH2-CB 4.46Å; W262-K266 HydrophobicContact CZ2-CB 4.32Å; W262-K266 HydrophobicContact CZ2-CG 4.04Å; W262-K266 WeakPolarHBondContact O-CB 3.45Å; W262-K266 PolarHBondContact O-N 2.92Å; W262-K266 VanDerWaalsContact O-N 3.11Å; T263-K266 PolarHBondContact O-N 2.84Å; D264-K266 VanDerWaalsContact C-N 3.29Å; D264-K266 PolarHBondContact O-N 3.04Å
267	L	91.3	Very high	94.8	Very high	118 Å²	118	44.5 Å²	44.5	62%	0.618	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-113.8	-42.4	-167	-58.1	-177.4	0	0	0	112.5	W262 T263	W262-L267 HydrophobicContact CH2-CD1 4.46Å; W262-L267 HydrophobicContact CZ3-CD1 3.78Å; W262-L267 HydrophobicContact CZ3-CG 4.1Å; T263-L267 HydrophobicContact CG2-CD1 4.44Å; T263-L267 WeakPolarHBondContact O-CA 3.22Å; T263-L267 WeakPolarHBondContact O-CB 3.47Å; T263-L267 PolarHBondContact O-N 3.3Å
268	N	92.8	Very high	94.7	Very high	63 Å²	63	44.7 Å²	44.7	34%	0.337	23%	0.227	S	C	.	.	S	Bend	trans	-83.5	146.7	-172.5	-58.2	-27.2	0	0	0	111.6	Q138 T263 D264	Q138-N268 PolarHBondContact NE2-O 3.05Å; T263-N268 PolarHBondContact O-N 2.81Å; D264-N268 PolarHBondContact OD1-ND2 3.46Å
269	S	93.4	Very high	94.6	Very high	100 Å²	100	47.1 Å²	47.1	70%	0.699	24%	0.24	S	C	*	.			trans	-76.5	126.2	166.7	-175.2	0	0	0	0	108.5	Q138	Q138-S269 CarbonylContact O-C 3.6Å; Q138-S269 WeakPolarHBondContact O-CA 3.47Å; Q138-S269 PolarHBondContact O-OG 3.36Å
270	S	94.4	Very high	94.5	Very high	9 Å²	9	43.5 Å²	43.5	6%	0.063	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	160.1	-175.1	-61	0	0	0	0	110.7	Q138 C148 S257	Q138-S270 PolarHBondContact N-O 3.02Å; Q138-S270 PolarHBondContact O-N 2.89Å; C148-S270 PolarHBondContact SG-O 2.95Å; C148-S270 VanDerWaalsContact SG-O 3.41Å; S257-S270 WeakPolarHBondContact OG-CA 3.45Å
271	N	95.6	Very high	94.3	Very high	46 Å²	46	45.1 Å²	45.1	25%	0.246	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	151.6	175.4	71.6	-45.1	0	0	0	111.2	H136 F137 G256 S257 Y258	H136-N271 CarbonylContact O-C 3.55Å; H136-N271 VanDerWaalsContact O-CA 3.24Å; H136-N271 WeakPolarHBondContact O-CA 3.24Å; F137-N271 HydrophobicContact CD1-CB 3.68Å; F137-N271 HydrophobicContact CE1-CB 3.83Å; G256-N271 CarbonylContact C-O 3.51Å; G256-N271 WeakPolarHBondContact CA-O 3.2Å; S257-N271 WeakPolarHBondContact CB-OD1 3.46Å; S257-N271 PolarHBondContact N-O 2.86Å; S257-N271 PolarHBondContact N-OD1 2.76Å; S257-N271 PolarHBondContact OG-N 2.74Å; S257-N271 PolarHBondContact OG-OD1 3.17Å; Y258-N271 PolarHBondContact N-O 2.72Å
272	L	97.3	Very high	94.1	Very high	5 Å²	5	50.5 Å²	50.5	3%	0.026	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	124.5	173.9	-173.1	73.7	0	0	0	108.8	H136 C148 A151 A152 A254	H136-L272 WeakPolarHBondContact CA-O 3.43Å; H136-L272 HydrophobicContact CB-CB 4.44Å; H136-L272 WeakPolarHBondContact CB-O 3.2Å; H136-L272 PolarHBondContact N-O 2.97Å; H136-L272 PolarHBondContact O-N 3.42Å; C148-L272 HydrophobicContact CB-CB 4.09Å; C148-L272 WeakPolarHBondContact O-CD2 3.36Å; A151-L272 HydrophobicContact CB-CD2 4.04Å; A152-L272 HydrophobicContact CB-CD2 4.09Å; A254-L272 HydrophobicContact CB-CD1 3.91Å; A254-L272 HydrophobicContact CB-CD2 4.27Å; A254-L272 HydrophobicContact CB-CG 4.2Å
273	I	97.9	Very high	94.1	Very high	52 Å²	52	45.1 Å²	45.1	27%	0.267	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	116.8	-179.8	-53.7	174.2	0	0	0	107.7	A133 V134 A254 T255 L275	A133-I273 HydrophobicContact CB-CG2 4.33Å; V134-I273 CarbonylContact O-C 3.6Å; V134-I273 WeakPolarHBondContact O-CA 3.12Å; A254-I273 CarbonylContact C-O 3.53Å; A254-I273 WeakPolarHBondContact CA-O 3.08Å; T255-I273 PolarHBondContact N-O 3.25Å; T255-I273 PolarHBondContact O-N 3.25Å; I273-L275 HydrophobicContact CG2-CD2 3.66Å; I273-L275 HydrophobicContact CG2-CG 4.02Å
274	E	97.9	Very high	94.1	Very high	38 Å²	38	43.1 Å²	43.1	18%	0.178	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	117.5	169.3	-179.2	176.5	170.4	0	0	109	A133 V134 M155 V253	A133-E274 CarbonylContact C-O 3.58Å; A133-E274 VanDerWaalsContact CA-O 3.31Å; A133-E274 WeakPolarHBondContact CA-O 3.45Å; V134-E274 HydrophobicContact CB-CB 4.38Å; V134-E274 PolarHBondContact N-O 3.36Å; V134-E274 PolarHBondContact O-N 3.18Å; M155-E274 HydrophobicContact CE-CG 3.92Å; M155-E274 HydrophobicContact SD-CB 4.28Å; M155-E274 HydrophobicContact SD-CG 3.92Å; V253-E274 CarbonylContact O-C 3.55Å; V253-E274 WeakPolarHBondContact O-CA 3.46Å
275	L	97.9	Very high	94	Very high	24 Å²	24	47.5 Å²	47.5	13%	0.126	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	143.2	178.9	-60	174.8	0	0	0	109.7	R132 A133 R252 V253 T255 I273 I279 F283	R132-L275 CarbonylContact O-C 3.5Å; R132-L275 WeakPolarHBondContact O-CA 3.34Å; A133-L275 HydrophobicContact CB-CD2 3.56Å; R252-L275 CarbonylContact C-O 3.58Å; R252-L275 WeakPolarHBondContact CA-O 3.39Å; V253-L275 HydrophobicContact CB-CB 4.31Å; V253-L275 PolarHBondContact N-O 3.03Å; V253-L275 PolarHBondContact O-N 3.23Å; T255-L275 HydrophobicContact CG2-CD1 4.04Å; I273-L275 HydrophobicContact CG2-CD2 3.66Å; I273-L275 HydrophobicContact CG2-CG 4.02Å; L275-I279 HydrophobicContact CB-CG2 3.97Å; L275-F283 HydrophobicContact CD1-CE2 3.74Å; L275-F283 HydrophobicContact CD1-CZ 3.97Å
276	S	95.9	Very high	94.2	Very high	34 Å²	34	50.5 Å²	50.5	24%	0.238	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	166.1	173	63.2	0	0	0	0	110.2	T131 R132 N251	T131-S276 CarbonylContact C-O 3.55Å; T131-S276 VanDerWaalsContact CA-O 3.23Å; T131-S276 WeakPolarHBondContact CA-O 3.47Å; R132-S276 PolarHBondContact N-O 3.45Å; R132-S276 PolarHBondContact O-N 2.88Å; N251-S276 WeakPolarHBondContact O-CA 3.39Å
277	G	92.9	Very high	94.5	Very high	5 Å²	5	46.9 Å²	46.9	5%	0.052	24%	0.244	C	C	.	.	S	Bend	trans	92.4	-157.1	-179.2	0	0	0	0	0	113.5	R128 G129 I279 T280	R128-G277 WeakPolarHBondContact O-CA 3.5Å; G129-G277 CarbonylContact O-C 3.57Å; G129-G277 WeakPolarHBondContact O-CA 3.47Å; G277-I279 PolarHBondContact O-N 3.41Å; G277-I279 VanDerWaalsContact O-N 3.13Å; G277-T280 WeakPolarHBondContact O-CB 3.36Å; G277-T280 WeakPolarHBondContact O-CG2 3.36Å; G277-T280 PolarHBondContact O-N 2.59Å; G277-T280 VanDerWaalsContact O-N 3.13Å; G277-T280 PolarHBondContact O-OG1 2.83Å
278	Q	93.1	Very high	94.5	Very high	54 Å²	54	48 Å²	48	25%	0.252	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58	-30.4	-172.4	-161.7	64.5	25.4	0	0	114.2	S126 G129 T280 E281	S126-Q278 PolarHBondContact O-NE2 3.19Å; S126-Q278 PolarHBondContact O-OE1 3.05Å; G129-Q278 PolarHBondContact O-N 2.95Å; Q278-T280 PolarHBondContact O-N 2.94Å; Q278-E281 PolarHBondContact NE2-OE2 2.8Å; Q278-E281 WeakPolarHBondContact O-CB 3.28Å; Q278-E281 PolarHBondContact O-N 2.92Å
279	I	94.3	Very high	94.5	Very high	57 Å²	57	48.3 Å²	48.3	29%	0.292	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-25.8	179.4	-168.5	59.9	0	0	0	113.3	T131 L275 G277 E281 K282 F283	T131-I279 HydrophobicContact CG2-CB 3.93Å; T131-I279 HydrophobicContact CG2-CG2 3.68Å; L275-I279 HydrophobicContact CB-CG2 3.97Å; G277-I279 PolarHBondContact O-N 3.41Å; G277-I279 VanDerWaalsContact O-N 3.13Å; I279-E281 PolarHBondContact O-N 2.76Å; I279-K282 PolarHBondContact O-N 3Å; I279-K282 VanDerWaalsContact O-N 3.13Å; I279-F283 HydrophobicContact CG1-CD2 4.48Å; I279-F283 HydrophobicContact CG1-CE2 4.02Å; I279-F283 WeakPolarHBondContact O-CD2 3.43Å
280	T	93.6	Very high	94.5	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-63.7	-21.4	179	61.2	0	0	0	0	113.7	R128 G250 N251 V253 G277 Q278 K282 F283 D284	R128-T280 VanDerWaalsContact CD-OG1 3.27Å; R128-T280 WeakPolarHBondContact CD-OG1 3.38Å; R128-T280 VanDerWaalsContact NH1-C 3.35Å; R128-T280 PolarHBondContact NH1-O 2.8Å; R128-T280 PolarHBondContact NH1-OG1 3Å; G250-T280 PolarHBondContact O-OG1 3.4Å; N251-T280 WeakPolarHBondContact O-CG2 3.43Å; V253-T280 HydrophobicContact CB-CG2 4.46Å; V253-T280 HydrophobicContact CG2-CG2 3.74Å; G277-T280 WeakPolarHBondContact O-CB 3.36Å; G277-T280 WeakPolarHBondContact O-CG2 3.36Å; G277-T280 PolarHBondContact O-N 2.59Å; G277-T280 VanDerWaalsContact O-N 3.13Å; G277-T280 PolarHBondContact O-OG1 2.83Å; Q278-T280 PolarHBondContact O-N 2.94Å; T280-K282 VanDerWaalsContact C-N 3.3Å; T280-K282 PolarHBondContact O-N 3.14Å; T280-F283 PolarHBondContact O-N 2.97Å; T280-D284 WeakPolarHBondContact O-CB 3.49Å; T280-D284 PolarHBondContact O-N 3.08Å
281	E	91.9	Very high	94.5	Very high	45 Å²	45	43.6 Å²	43.6	21%	0.21	21%	0.207	C	C	.	.	H	α-helix	trans	-62	-38	173.8	-175.6	173.7	-150.6	0	0	111.9	G125 R128 Q278 I279 F283 D284 E285	G125-E281 WeakPolarHBondContact CA-OE1 3.4Å; G125-E281 PolarHBondContact N-OE1 2.94Å; R128-E281 VanDerWaalsContact NH1-CA 3.31Å; Q278-E281 PolarHBondContact NE2-OE2 2.8Å; Q278-E281 WeakPolarHBondContact O-CB 3.28Å; Q278-E281 PolarHBondContact O-N 2.92Å; I279-E281 PolarHBondContact O-N 2.76Å; E281-F283 PolarHBondContact O-N 3.13Å; E281-D284 PolarHBondContact O-N 2.9Å; E281-E285 WeakPolarHBondContact O-CB 3.4Å; E281-E285 PolarHBondContact O-N 3.36Å
282	K	93.5	Very high	94.3	Very high	122 Å²	122	43.3 Å²	43.3	53%	0.53	21%	0.211	S	C	.	.	H	α-helix	trans	-68.9	-35.4	179.2	-69.4	-73.1	151.4	-157.1	0	112.5	I279 T280 E285 E286	I279-K282 PolarHBondContact O-N 3Å; I279-K282 VanDerWaalsContact O-N 3.13Å; T280-K282 VanDerWaalsContact C-N 3.3Å; T280-K282 PolarHBondContact O-N 3.14Å; K282-E285 IonicContact NZ-OE2 3.65Å; K282-E285 PolarHBondContact NZ-OE2 3.45Å; K282-E286 WeakPolarHBondContact O-CB 3.25Å; K282-E286 PolarHBondContact O-N 3.43Å
283	F	95.3	Very high	94	Very high	40 Å²	40	48.9 Å²	48.9	18%	0.175	24%	0.237	C	C	.	.	H	α-helix	trans	-75.3	-32.1	175.8	-70.9	-83.9	0	0	0	112.8	F245 V253 T255 L275 I279 T280 E281 F287	F245-F283 HydrophobicContact CB-CD1 4.09Å; F245-F283 HydrophobicContact CB-CE1 4.15Å; F245-F283 HydrophobicContact CD1-CD1 4.06Å; F245-F283 HydrophobicContact CD1-CE1 4.43Å; F245-F283 HydrophobicContact CD2-CB 4.32Å; F245-F283 AromaticContact CD2-CD1 3.81Å; F245-F283 HydrophobicContact CD2-CD1 3.81Å; F245-F283 HydrophobicContact CD2-CG 4.5Å; F245-F283 HydrophobicContact CE1-CD1 4.42Å; F245-F283 HydrophobicContact CE2-CB 4.19Å; F245-F283 HydrophobicContact CE2-CD1 4.19Å; F245-F283 AromaticContact CG-CD1 3.73Å; F245-F283 HydrophobicContact CG-CD1 3.73Å; F245-F283 HydrophobicContact CG-CE1 4.2Å; F245-F283 HydrophobicContact CZ-CD1 4.48Å; V253-F283 HydrophobicContact CB-CD2 4.2Å; V253-F283 HydrophobicContact CB-CG 4.34Å; V253-F283 HydrophobicContact CG1-CB 4.32Å; V253-F283 HydrophobicContact CG1-CD1 3.78Å; V253-F283 HydrophobicContact CG1-CD2 3.88Å; V253-F283 HydrophobicContact CG1-CE1 3.96Å; V253-F283 HydrophobicContact CG1-CE2 4.05Å; V253-F283 HydrophobicContact CG1-CG 3.73Å; V253-F283 HydrophobicContact CG1-CZ 4.09Å; V253-F283 HydrophobicContact CG2-CB 3.71Å; V253-F283 HydrophobicContact CG2-CD2 3.85Å; V253-F283 HydrophobicContact CG2-CG 3.84Å; T255-F283 HydrophobicContact CG2-CE1 4.48Å; T255-F283 HydrophobicContact CG2-CZ 4.17Å; L275-F283 HydrophobicContact CD1-CE2 3.74Å; L275-F283 HydrophobicContact CD1-CZ 3.97Å; I279-F283 HydrophobicContact CG1-CD2 4.48Å; I279-F283 HydrophobicContact CG1-CE2 4.02Å; I279-F283 WeakPolarHBondContact O-CD2 3.43Å; T280-F283 PolarHBondContact O-N 2.97Å; E281-F283 PolarHBondContact O-N 3.13Å; F283-F287 VanDerWaalsContact O-CB 3.25Å; F283-F287 WeakPolarHBondContact O-CB 3.27Å; F283-F287 PolarHBondContact O-N 3.3Å
284	D	93.3	Very high	93.8	Very high	14 Å²	14	46.5 Å²	46.5	8%	0.075	22%	0.224	C	C	.	.	H	α-helix	trans	-64.6	-46.2	171.2	176.1	33.7	0	0	0	110.7	W119 R128 L247 T280 E281 F287 R288	W119-D284 WeakPolarHBondContact CZ2-OD1 3.19Å; W119-D284 PolarHBondContact NE1-OD1 3.01Å; R128-D284 IonicContact CZ-OD2 3.79Å; R128-D284 IonicContact NH1-OD2 2.76Å; R128-D284 IonicContact NH2-OD2 3.82Å; R128-D284 PolarHBondContact NH2-OD2 3.2Å; L247-D284 HydrophobicContact CD2-CB 4.02Å; T280-D284 WeakPolarHBondContact O-CB 3.49Å; T280-D284 PolarHBondContact O-N 3.08Å; E281-D284 PolarHBondContact O-N 2.9Å; D284-F287 PolarHBondContact O-N 3.06Å; D284-R288 VanDerWaalsContact O-CG 3.28Å; D284-R288 WeakPolarHBondContact O-CG 3.44Å; D284-R288 PolarHBondContact O-N 3.13Å; D284-R288 VanDerWaalsContact O-N 3.09Å
285	E	91.8	Very high	93.6	Very high	95 Å²	95	50.5 Å²	50.5	44%	0.444	24%	0.243	S	C	.	.	H	α-helix	trans	-57.1	-52.5	172.8	-176	174.3	-160	0	0	111.7	E281 K282 F287 R288 I289	E281-E285 WeakPolarHBondContact O-CB 3.4Å; E281-E285 PolarHBondContact O-N 3.36Å; K282-E285 IonicContact NZ-OE2 3.65Å; K282-E285 PolarHBondContact NZ-OE2 3.45Å; E285-F287 PolarHBondContact O-N 3.35Å; E285-R288 WeakPolarHBondContact O-CB 3.24Å; E285-R288 PolarHBondContact O-N 3.35Å; E285-R288 VanDerWaalsContact O-N 3.16Å; E285-I289 HydrophobicContact CG-CD1 4.19Å; E285-I289 WeakPolarHBondContact O-CG1 3.27Å; E285-I289 PolarHBondContact O-N 3.19Å; E285-I289 VanDerWaalsContact O-N 3.07Å
286	E	94.6	Very high	93.3	Very high	63 Å²	63	53.2 Å²	53.2	29%	0.294	26%	0.262	S	S	.	.	H	α-helix	trans	-60.3	-43.6	178.9	-171.3	55.7	-132.1	0	0	112.1	F245 K282 R288 I289 L290	F245-E286 HydrophobicContact CE1-CG 4.29Å; F245-E286 HydrophobicContact CZ-CB 4.44Å; F245-E286 HydrophobicContact CZ-CG 4.42Å; K282-E286 WeakPolarHBondContact O-CB 3.25Å; K282-E286 PolarHBondContact O-N 3.43Å; E286-R288 VanDerWaalsContact C-N 3.27Å; E286-R288 PolarHBondContact O-N 2.82Å; E286-I289 PolarHBondContact O-N 3.39Å; E286-I289 VanDerWaalsContact O-N 3.15Å; E286-L290 HydrophobicContact CG-CD1 4.19Å; E286-L290 HydrophobicContact CG-CG 4.48Å; E286-L290 WeakPolarHBondContact O-CG 3.34Å; E286-L290 PolarHBondContact O-N 3.26Å
287	F	95	Very high	93	Very high	0 Å²	0	53 Å²	53	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-57.5	-42.5	177.2	-175.1	-90.4	0	0	0	111.7	L115 W119 A164 V166 Y191 L193 F245 F283 D284 E285 L290 Y291	L115-F287 HydrophobicContact CD2-CE1 3.95Å; W119-F287 AromaticContact CH2-CD1 3.21Å; W119-F287 HydrophobicContact CH2-CD1 3.21Å; W119-F287 AromaticContact CH2-CE1 3.53Å; W119-F287 HydrophobicContact CH2-CE1 3.53Å; W119-F287 AromaticContact CH2-CG 3.9Å; W119-F287 HydrophobicContact CH2-CG 3.9Å; W119-F287 HydrophobicContact CH2-CZ 4.43Å; W119-F287 AromaticContact CZ2-CD1 3.9Å; W119-F287 HydrophobicContact CZ2-CD1 3.9Å; W119-F287 AromaticContact CZ3-CD1 3.77Å; W119-F287 HydrophobicContact CZ3-CD1 3.77Å; W119-F287 AromaticContact CZ3-CE1 3.56Å; W119-F287 HydrophobicContact CZ3-CE1 3.56Å; W119-F287 HydrophobicContact CZ3-CZ 4.39Å; A164-F287 HydrophobicContact CB-CD1 4.16Å; A164-F287 HydrophobicContact CB-CD2 3.71Å; A164-F287 HydrophobicContact CB-CE1 3.97Å; A164-F287 HydrophobicContact CB-CE2 3.52Å; A164-F287 HydrophobicContact CB-CG 4.05Å; A164-F287 HydrophobicContact CB-CZ 3.68Å; V166-F287 HydrophobicContact CG2-CD2 3.59Å; V166-F287 HydrophobicContact CG2-CE2 3.92Å; Y191-F287 HydrophobicContact CG-CZ 4.42Å; L193-F287 HydrophobicContact CD1-CD2 4.19Å; L193-F287 HydrophobicContact CD1-CE2 3.79Å; L193-F287 HydrophobicContact CD1-CZ 4.05Å; L193-F287 HydrophobicContact CG-CE2 3.82Å; L193-F287 HydrophobicContact CG-CZ 4Å; F245-F287 HydrophobicContact CE2-CB 4.12Å; F245-F287 HydrophobicContact CE2-CD2 4.27Å; F245-F287 HydrophobicContact CZ-CB 4.09Å; F245-F287 HydrophobicContact CZ-CD2 4.39Å; F283-F287 VanDerWaalsContact O-CB 3.25Å; F283-F287 WeakPolarHBondContact O-CB 3.27Å; F283-F287 PolarHBondContact O-N 3.3Å; D284-F287 PolarHBondContact O-N 3.06Å; E285-F287 PolarHBondContact O-N 3.35Å; F287-L290 PolarHBondContact O-N 3.5Å; F287-Y291 AromaticContact CE1-CD2 3.93Å; F287-Y291 HydrophobicContact CE1-CD2 3.93Å; F287-Y291 HydrophobicContact CE1-CG 4.42Å; F287-Y291 HydrophobicContact CZ-CD2 4.09Å; F287-Y291 VanDerWaalsContact O-CB 3.25Å; F287-Y291 WeakPolarHBondContact O-CB 3.48Å; F287-Y291 PolarHBondContact O-N 2.99Å
288	R	92.6	Very high	92.2	Very high	141 Å²	141	58.3 Å²	58.3	53%	0.532	29%	0.286	S	S	.	.	H	α-helix	trans	-66.3	-38.7	178.9	-69.2	175.5	68	132.9	5.1	111.9	L115 D284 E285 E286 Y291 A292	L115-R288 HydrophobicContact CD1-CG 4.12Å; D284-R288 VanDerWaalsContact O-CG 3.28Å; D284-R288 WeakPolarHBondContact O-CG 3.44Å; D284-R288 PolarHBondContact O-N 3.13Å; D284-R288 VanDerWaalsContact O-N 3.09Å; E285-R288 WeakPolarHBondContact O-CB 3.24Å; E285-R288 PolarHBondContact O-N 3.35Å; E285-R288 VanDerWaalsContact O-N 3.16Å; E286-R288 VanDerWaalsContact C-N 3.27Å; E286-R288 PolarHBondContact O-N 2.82Å; R288-Y291 PolarHBondContact O-N 2.8Å; R288-A292 WeakPolarHBondContact O-CB 3.43Å; R288-A292 PolarHBondContact O-N 3.1Å
289	I	91.9	Very high	90.8	Very high	70 Å²	70	57.3 Å²	57.3	36%	0.359	29%	0.286	S	S	.	.	H	α-helix	trans	-62.3	-51.2	175.4	-66	166.1	0	0	0	110	E285 E286 Y291 A292 Q293	E285-I289 HydrophobicContact CG-CD1 4.19Å; E285-I289 WeakPolarHBondContact O-CG1 3.27Å; E285-I289 PolarHBondContact O-N 3.19Å; E285-I289 VanDerWaalsContact O-N 3.07Å; E286-I289 PolarHBondContact O-N 3.39Å; E286-I289 VanDerWaalsContact O-N 3.15Å; I289-Y291 VanDerWaalsContact C-N 3.31Å; I289-Y291 PolarHBondContact O-N 2.8Å; I289-A292 WeakPolarHBondContact O-CB 3.23Å; I289-A292 PolarHBondContact O-N 3.38Å; I289-A292 VanDerWaalsContact O-N 3.14Å; I289-Q293 WeakPolarHBondContact O-CG 3.34Å; I289-Q293 PolarHBondContact O-N 3.02Å; I289-Q293 VanDerWaalsContact O-N 3.17Å
290	L	94.3	Very high	89.1	Confident	7 Å²	7	62.3 Å²	62.3	4%	0.037	30%	0.301	C	S	.	.	H	α-helix	trans	-63.2	-37.9	177.9	-66.3	172.8	0	0	0	112.1	V166 L193 V224 E243 F245 E286 F287 A292 Q293 S294	V166-L290 HydrophobicContact CB-CD1 4.48Å; V166-L290 HydrophobicContact CG1-CD1 3.79Å; V166-L290 HydrophobicContact CG2-CD1 3.98Å; L193-L290 HydrophobicContact CD1-CB 3.56Å; V224-L290 HydrophobicContact CG2-CD2 4.17Å; E243-L290 WeakPolarHBondContact OE2-CD1 3.33Å; F245-L290 HydrophobicContact CE1-CD1 4.31Å; E286-L290 HydrophobicContact CG-CD1 4.19Å; E286-L290 HydrophobicContact CG-CG 4.48Å; E286-L290 WeakPolarHBondContact O-CG 3.34Å; E286-L290 PolarHBondContact O-N 3.26Å; F287-L290 PolarHBondContact O-N 3.5Å; L290-A292 VanDerWaalsContact C-N 3.28Å; L290-A292 PolarHBondContact O-N 2.72Å; L290-Q293 PolarHBondContact O-N 2.79Å; L290-S294 VanDerWaalsContact O-CB 3.29Å; L290-S294 WeakPolarHBondContact O-CB 3.42Å; L290-S294 PolarHBondContact O-N 2.76Å
291	Y	93.9	Very high	87	Confident	4 Å²	4	64 Å²	64	2%	0.016	32%	0.319	C	S	.	.	H	α-helix	trans	-61.8	-40.6	175.9	-163.4	-92.8	0	0	0	110.9	P113 L115 Y191 L193 R222 F287 R288 I289 Q293 S294	P113-Y291 HydrophobicContact CB-CD1 4.37Å; P113-Y291 HydrophobicContact CB-CE1 4.09Å; L115-Y291 HydrophobicContact CD2-CD1 3.78Å; L115-Y291 HydrophobicContact CD2-CD2 3.8Å; L115-Y291 HydrophobicContact CD2-CE1 3.84Å; L115-Y291 HydrophobicContact CD2-CE2 3.88Å; L115-Y291 HydrophobicContact CD2-CG 3.77Å; L115-Y291 HydrophobicContact CG-CD1 4.34Å; L115-Y291 HydrophobicContact CG-CE1 4.4Å; Y191-Y291 AromaticContact CD1-CE2 3.65Å; Y191-Y291 HydrophobicContact CD1-CE2 3.65Å; Y191-Y291 HydrophobicContact CE1-CE2 4.28Å; L193-Y291 HydrophobicContact CD1-CD2 4.49Å; L193-Y291 HydrophobicContact CD2-CD2 3.77Å; L193-Y291 HydrophobicContact CD2-CE2 4.34Å; L193-Y291 HydrophobicContact CG-CD2 4.47Å; R222-Y291 VanDerWaalsContact CD-CZ 3.46Å; R222-Y291 HydrophobicContact CG-CE2 4.37Å; F287-Y291 AromaticContact CE1-CD2 3.93Å; F287-Y291 HydrophobicContact CE1-CD2 3.93Å; F287-Y291 HydrophobicContact CE1-CG 4.42Å; F287-Y291 HydrophobicContact CZ-CD2 4.09Å; F287-Y291 VanDerWaalsContact O-CB 3.25Å; F287-Y291 WeakPolarHBondContact O-CB 3.48Å; F287-Y291 PolarHBondContact O-N 2.99Å; R288-Y291 PolarHBondContact O-N 2.8Å; I289-Y291 VanDerWaalsContact C-N 3.31Å; I289-Y291 PolarHBondContact O-N 2.8Å; Y291-Q293 VanDerWaalsContact C-N 3.31Å; Y291-Q293 PolarHBondContact O-N 3.11Å; Y291-S294 PolarHBondContact O-N 2.93Å; Y291-S294 PolarHBondContact O-OG 2.79Å
292	A	91.5	Very high	84.6	Confident	39 Å²	39	68.4 Å²	68.4	32%	0.322	35%	0.351	S	S	.	.	H	α-helix	trans	-60.6	-38.4	175.8	0	0	0	0	0	113.6	P112 R288 I289 L290	P112-A292 HydrophobicContact CB-CB 3.8Å; P112-A292 HydrophobicContact CG-CB 4.28Å; R288-A292 WeakPolarHBondContact O-CB 3.43Å; R288-A292 PolarHBondContact O-N 3.1Å; I289-A292 WeakPolarHBondContact O-CB 3.23Å; I289-A292 PolarHBondContact O-N 3.38Å; I289-A292 VanDerWaalsContact O-N 3.14Å; L290-A292 VanDerWaalsContact C-N 3.28Å; L290-A292 PolarHBondContact O-N 2.72Å
293	Q	91.1	Very high	81.9	Confident	123 Å²	123	69.2 Å²	69.2	58%	0.575	36%	0.357	S	S	*	.	H	α-helix	trans	-84	-18	-179.6	-63.8	172.8	-1.8	0	0	113.3	I289 L290 Y291	I289-Q293 WeakPolarHBondContact O-CG 3.34Å; I289-Q293 PolarHBondContact O-N 3.02Å; I289-Q293 VanDerWaalsContact O-N 3.17Å; L290-Q293 PolarHBondContact O-N 2.79Å; Y291-Q293 VanDerWaalsContact C-N 3.31Å; Y291-Q293 PolarHBondContact O-N 3.11Å
294	S	94.1	Very high	79.1	Confident	1 Å²	1	72.4 Å²	72.4	1%	0.007	38%	0.384	C	S	.	.			trans	-74.7	159.2	-174.8	71.4	0	0	0	0	113.6	R222 T223 L290 Y291	R222-S294 VanDerWaalsContact CD-OG 3.32Å; R222-S294 WeakPolarHBondContact CD-OG 3.5Å; R222-S294 PolarHBondContact NE-OG 2.84Å; R222-S294 PolarHBondContact NH2-O 2.92Å; T223-S294 CarbonylContact O-C 3.55Å; T223-S294 WeakPolarHBondContact O-CA 3.31Å; T223-S294 WeakPolarHBondContact O-CB 3.33Å; L290-S294 VanDerWaalsContact O-CB 3.29Å; L290-S294 WeakPolarHBondContact O-CB 3.42Å; L290-S294 PolarHBondContact O-N 2.76Å; Y291-S294 PolarHBondContact O-N 2.93Å; Y291-S294 PolarHBondContact O-OG 2.79Å
295	Q	93.1	Very high	76.5	Confident	123 Å²	123	78 Å²	78	58%	0.575	42%	0.418	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.1	142.5	177	-65.8	-63.2	-30.2	0	0	110.9	R222 T223 I297	R222-Q295 CarbonylContact C-O 3.54Å; R222-Q295 WeakPolarHBondContact CA-O 3.34Å; R222-Q295 VanDerWaalsContact CB-O 3.27Å; R222-Q295 WeakPolarHBondContact CB-O 3.34Å; T223-Q295 PolarHBondContact N-O 3.45Å; T223-Q295 PolarHBondContact O-N 2.56Å; T223-Q295 PolarHBondContact OG1-O 2.88Å; Q295-I297 PolarHBondContact O-N 2.89Å
296	P	91.9	Very high	73.9	Confident	81 Å²	81	84.5 Å²	84.5	53%	0.526	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.1	137.8	177.6	27.7	-33.4	0	0	0	110.9	N298	P296-N298 PolarHBondContact O-N 3.29Å
297	I	89.4	Confident	71.1	Confident	29 Å²	29	84.6 Å²	84.6	15%	0.149	46%	0.457	C	S	.	.			trans	-70.2	125.9	178.3	-161.1	169.1	0	0	0	109.7	A199 F202 L203 L213 V221 T223 Q295 A299	A199-I297 HydrophobicContact CB-CD1 3.86Å; F202-I297 HydrophobicContact CD1-CD1 4.43Å; L203-I297 HydrophobicContact CD1-CD1 3.89Å; L203-I297 HydrophobicContact CD1-CG1 4.22Å; L203-I297 HydrophobicContact CD2-CD1 3.85Å; L203-I297 HydrophobicContact CD2-CG1 4.48Å; L203-I297 HydrophobicContact CG-CD1 3.79Å; L213-I297 HydrophobicContact CD1-CG2 4Å; V221-I297 HydrophobicContact CB-CG2 3.87Å; V221-I297 HydrophobicContact CG1-CB 4.47Å; V221-I297 HydrophobicContact CG1-CD1 4.28Å; V221-I297 HydrophobicContact CG1-CG2 4.06Å; V221-I297 WeakPolarHBondContact O-CG2 3.35Å; V221-I297 PolarHBondContact O-N 2.72Å; T223-I297 HydrophobicContact CG2-CB 4.38Å; T223-I297 HydrophobicContact CG2-CD1 4.25Å; T223-I297 HydrophobicContact CG2-CG1 4.13Å; Q295-I297 PolarHBondContact O-N 2.89Å; I297-A299 PolarHBondContact O-N 3.49Å; I297-A299 VanDerWaalsContact O-N 3.08Å
298	N	75.8	Confident	68.2	Low	117 Å²	117	89.7 Å²	89.7	63%	0.626	49%	0.492	S	S	*	.			trans	-79.6	95.5	173	-163.9	-5.8	0	0	0	109.4	P296 R300	P296-N298 PolarHBondContact O-N 3.29Å; N298-R300 PolarHBondContact ND2-O 3.33Å; N298-R300 PolarHBondContact O-N 2.76Å; N298-R300 PolarHBondContact OD1-N 2.88Å; N298-R300 PolarHBondContact OD1-O 3.06Å
299	A	64.4	Low	65.5	Low	32 Å²	32	86.2 Å²	86.2	26%	0.264	50%	0.501	S	S	.	.			trans	-67	-21.9	178.7	0	0	0	0	0	112.7	I297 G301	I297-A299 PolarHBondContact O-N 3.49Å; I297-A299 VanDerWaalsContact O-N 3.08Å; A299-G301 PolarHBondContact O-N 2.73Å
300	R	57.1	Low	63	Low	163 Å²	163	89.1 Å²	89.1	62%	0.615	52%	0.521	S	S	*	.	S	Bend	trans	-82.5	114.2	166.9	-60.6	-170.6	-166.3	-157	6.4	106.4	N298	N298-R300 PolarHBondContact ND2-O 3.33Å; N298-R300 PolarHBondContact O-N 2.76Å; N298-R300 PolarHBondContact OD1-N 2.88Å; N298-R300 PolarHBondContact OD1-O 3.06Å
301	G	50.9	Low	60.1	Low	35 Å²	35	96.5 Å²	96.5	36%	0.361	56%	0.56	S	S	.	*			trans	-52.5	170.5	171.2	0	0	0	0	0	111.3	A299 Q303	A299-G301 PolarHBondContact O-N 2.73Å; G301-Q303 PolarHBondContact O-N 2.73Å
302	P	40.8	Very low	57.2	Low	137 Å²	137	103.7 Å²	103.7	89%	0.89	59%	0.594	S	S	*	*			trans	-49.5	112.5	175.7	20.7	-30.9	0	0	0	107.7	S304	P302-S304 VanDerWaalsContact C-N 3.3Å; P302-S304 PolarHBondContact O-N 3.05Å
303	Q	36.7	Very low	54.2	Low	140 Å²	140	109 Å²	109	65%	0.654	61%	0.611	S	S	*	*			trans	-63.2	105.7	175	-68.4	-174.2	7.8	0	0	103.8	G301 V305	G301-Q303 PolarHBondContact O-N 2.73Å; Q303-V305 PolarHBondContact O-N 2.96Å
304	S	36	Very low	51.8	Low	106 Å²	106	110.5 Å²	110.5	74%	0.741	62%	0.622	S	S	*	*			trans	-46.6	116.1	159	166.7	0	0	0	0	104.7	P302 R306	P302-S304 VanDerWaalsContact C-N 3.3Å; P302-S304 PolarHBondContact O-N 3.05Å; S304-R306 PolarHBondContact O-N 3.13Å
305	V	40.1	Very low	48.8	Very low	132 Å²	132	116.5 Å²	116.5	80%	0.8	66%	0.664	S	S	*	*			trans	-59.2	84.9	174.2	179.3	0	0	0	0	106	Q303 G307	Q303-V305 PolarHBondContact O-N 2.96Å; V305-G307 PolarHBondContact O-N 3.13Å; V305-G307 VanDerWaalsContact O-N 3.08Å
306	R	36.3	Very low	45.9	Very low	232 Å²	232	118.7 Å²	118.7	88%	0.875	68%	0.679	S	S	*	*			trans	-69.6	95	146.1	-86.2	-166.5	-164	-152.2	3.8	103.4	S304 S308	S304-R306 PolarHBondContact O-N 3.13Å; R306-S308 PolarHBondContact O-N 2.99Å
307	G	36.6	Very low	42.8	Very low	65 Å²	65	124 Å²	124	67%	0.67	69%	0.694	S	S	*	*			trans	-53.3	97.8	162.8	0	0	0	0	0	107.5	V305 G309	V305-G307 PolarHBondContact O-N 3.13Å; V305-G307 VanDerWaalsContact O-N 3.08Å; G307-G309 PolarHBondContact O-N 2.91Å; G307-G309 VanDerWaalsContact O-N 3.13Å
308	S	34.4	Very low	39.9	Very low	106 Å²	106	131.9 Å²	131.9	74%	0.741	73%	0.729	S	S	*	*			trans	-81.5	71.2	156.9	-174.6	0	0	0	0	105.8	R306 V310	R306-S308 PolarHBondContact O-N 2.99Å; S308-V310 VanDerWaalsContact C-N 3.28Å; S308-V310 PolarHBondContact O-N 2.81Å
309	G	34.2	Very low	37.5	Very low	69 Å²	69	133.7 Å²	133.7	71%	0.711	74%	0.738	S	S	*	*			trans	-67.1	96.7	160.3	0	0	0	0	0	106.7	G307 L311	G307-G309 PolarHBondContact O-N 2.91Å; G307-G309 VanDerWaalsContact O-N 3.13Å; G309-L311 PolarHBondContact O-N 3.31Å; G309-L311 VanDerWaalsContact O-N 3.08Å
310	V	39.9	Very low	35.9	Very low	131 Å²	131	136.1 Å²	136.1	79%	0.794	76%	0.758	S	S	*	*			trans	-70.1	95.7	156.7	177.8	0	0	0	0	105.1	S308	S308-V310 VanDerWaalsContact C-N 3.28Å; S308-V310 PolarHBondContact O-N 2.81Å
311	L	34.1	Very low	34.4	Very low	161 Å²	161	134.3 Å²	134.3	84%	0.843	77%	0.765	S	S	*	*			trans	-127.1	103.8	159.1	-166.5	80.7	0	0	0	106.5	G309 H313	G309-L311 PolarHBondContact O-N 3.31Å; G309-L311 VanDerWaalsContact O-N 3.08Å; L311-H313 PolarHBondContact O-N 3.46Å
312	E	31.7	Very low	33.1	Very low	156 Å²	156	138.1 Å²	138.1	73%	0.729	79%	0.785	S	S	*	*			trans	-53.7	125.2	157.2	-81	178.5	125.6	0	0	108.6
313	H	29.4	Very low	32.5	Very low	150 Å²	150	136.8 Å²	136.8	69%	0.694	78%	0.779	S	S	*	*				170.2	126.2	115.1	-91.4	-73.3	0	0	0	110.7	L311	L311-H313 PolarHBondContact O-N 3.46Å
314	L	41.6	Very low	32.8	Very low	154 Å²	154	135.2 Å²	135.2	81%	0.806	78%	0.781	S	S	*	*			trans	55.5	102.7	144	-58.4	167.2	0	0	0	117.2
315	S	29.8	Very low	32.5	Very low	127 Å²	127	141.1 Å²	141.1	89%	0.888	79%	0.787	S	S	*	*			trans	-141.9	131.1	150.9	-76.2	0	0	0	0	112.4
316	I	32	Very low	31.9	Very low	170 Å²	170	143 Å²	143	87%	0.872	79%	0.789	S	S	*	*			trans	-66.4	145.4	-172.9	-73.8	150.8	0	0	0	111.2
317	K	27.3	Very low	31.5	Very low	193 Å²	193	138 Å²	138	84%	0.839	79%	0.789	S	S	*	*			trans	-61.6	135.4	171.4	-64.4	172.9	176.9	176.4	0	110.8
318	H	28.1	Very low	31.1	Very low	194 Å²	194	146.4 Å²	146.4	90%	0.898	80%	0.801	S	S	*	*			trans	-151.5	142.9	133.8	-129.4	-90	0	0	0	112.5
319	L	27	Very low	30.8	Very low	155 Å²	155	150.7 Å²	150.7	81%	0.812	81%	0.809	S	S	*	*			trans	-95.5	170.4	-166.9	-135.5	89.6	0	0	0	111.9
320	A	29.7	Very low	30.6	Very low	83 Å²	83	156.7 Å²	156.7	69%	0.686	82%	0.815	S	S	*	*			trans	81.9	141.5	147.7	0	0	0	0	0	117.8
321	T	25.4	Very low	30.3	Very low	125 Å²	125	156 Å²	156	77%	0.767	81%	0.814	S	S	*	*			cis	-167.4	149.3	9.8	-81	0	0	0	0	111.8
322	C	24.5	Very low	30.1	Very low	114 Å²	114	154.8 Å²	154.8	77%	0.77	81%	0.813	S	S	*	*			trans	8.3	134	158.1	-66.2	0	0	0	0	125.8
323	S	27.4	Very low	30.1	Very low	109 Å²	109	155.6 Å²	155.6	76%	0.762	82%	0.817	S	S	*	*				47.8	154.1	102.9	-146.9	0	0	0	0	119.8
324	P	43.6	Very low	30.5	Very low	107 Å²	107	154.6 Å²	154.6	70%	0.695	82%	0.824	S	S	*	*			cis	-155.1	-176.2	33.2	42	-17.8	0	0	0	121.4
325	R	28.8	Very low	29.9	Very low	231 Å²	231	153 Å²	153	87%	0.872	82%	0.821	S	S	*	*			trans	89.2	144.7	161.7	-70.1	-176.4	169.4	174.1	-2.4	117.6
326	M	29.3	Very low	29.8	Very low	172 Å²	172	155.3 Å²	155.3	85%	0.847	82%	0.817	S	S	*	*			cis	162.7	118.6	-23.6	-102.7	-85.6	103.4	0	0	104.2
327	S	27	Very low	29.8	Very low	125 Å²	125	155.4 Å²	155.4	87%	0.874	82%	0.818	S	S	*	*			trans	-177.3	125	143.4	51.7	0	0	0	0	110.6
328	R	29	Very low	29.9	Very low	242 Å²	242	153.1 Å²	153.1	91%	0.913	82%	0.82	S	S	*	*			trans	-96.6	132.6	-174.5	150.8	-174.4	148.7	179.1	-4.6	108.2
329	E	27.8	Very low	29.9	Very low	196 Å²	196	149.6 Å²	149.6	92%	0.916	82%	0.818	S	S	*	*			trans	-155.8	132.3	156.3	-109.8	165.9	-152.7	0	0	110.9
330	K	30.6	Very low	30	Very low	195 Å²	195	148.9 Å²	148.9	85%	0.848	82%	0.82	S	S	*	*			trans	-84.8	153.2	172.3	-100.3	179.1	174.4	-177.9	0	108.2
331	P	33.4	Very low	30.2	Very low	117 Å²	117	151.3 Å²	151.3	76%	0.76	83%	0.829	S	S	*	*				-150.5	145.1	96.8	26.8	-3.9	0	0	0	117.5
332	T	29	Very low	30.3	Very low	135 Å²	135	151.5 Å²	151.5	83%	0.828	84%	0.835	S	S	*	*			trans	41	132.4	131.2	-6.9	0	0	0	0	123.3
333	E	32.8	Very low	30.5	Very low	173 Å²	173	157.5 Å²	157.5	81%	0.808	84%	0.841	S	S	*	*			trans	-55.7	158.6	168.6	-61.6	175.8	145.9	0	0	114.8
334	P	36.3	Very low	30.5	Very low	129 Å²	129	161.5 Å²	161.5	84%	0.838	85%	0.845	S	S	*	*			trans	-113.5	127.6	152.8	31.5	-18.5	0	0	0	113.1
335	V	29.1	Very low	30.1	Very low	122 Å²	122	162.1 Å²	162.1	74%	0.739	85%	0.849	S	S	*	*			trans	-76.3	147.6	171.4	168.5	0	0	0	0	111.1
336	H	28.7	Very low	30.1	Very low	175 Å²	175	160.3 Å²	160.3	81%	0.81	85%	0.851	S	S	*	*			trans	-49.5	138.9	170.7	-65.9	-91.5	0	0	0	114.7
337	L	32.3	Very low	29.8	Very low	172 Å²	172	158.3 Å²	158.3	90%	0.901	85%	0.848	S	S	*	*			trans	-141.8	121.9	154.9	-73.9	177.4	0	0	0	111.7
338	T	27.4	Very low	29.7	Very low	144 Å²	144	156.6 Å²	156.6	88%	0.883	84%	0.837	S	S	*	*			trans	-85.7	140.4	162.8	45.1	0	0	0	0	109.6
339	S	29.7	Very low	29.6	Very low	120 Å²	120	153.9 Å²	153.9	84%	0.839	83%	0.834	S	S	*	*			trans	-137.5	122.7	175.3	54.9	0	0	0	0	112.3
340	T	29	Very low	29.5	Very low	140 Å²	140	151.7 Å²	151.7	86%	0.859	82%	0.824	S	S	*	*			trans	-100.1	149.9	157.9	39.8	0	0	0	0	109.4
341	P	33.9	Very low	29.9	Very low	134 Å²	134	147.8 Å²	147.8	87%	0.87	82%	0.818	S	S	*	*			trans	-100.9	138.9	-179.1	35.3	-27.7	0	0	0	112.8
342	S	27.1	Very low	29.4	Very low	129 Å²	129	147.2 Å²	147.2	90%	0.902	82%	0.817	S	S	*	*			trans	-125.1	148.6	159.8	-171.2	0	0	0	0	110.4
343	R	28.5	Very low	29.3	Very low	240 Å²	240	149.7 Å²	149.7	91%	0.906	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-91.5	145.1	-160.8	-175.5	178.1	178.1	-177	-0.5	112.1
344	K	28.3	Very low	29.7	Very low	193 Å²	193	147.1 Å²	147.1	84%	0.839	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-70.9	159.9	178.1	-71.3	178.9	176	178.9	0	114.3
345	P	35.1	Very low	29.3	Very low	120 Å²	120	145.9 Å²	145.9	78%	0.779	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-100.9	161.9	170	38.2	-30.3	0	0	0	113.8
346	Q	27.4	Very low	30.1	Very low	193 Å²	193	144.7 Å²	144.7	90%	0.902	80%	0.804	S	S	*	*			trans	-141.6	144.5	161.7	-91	-173.5	-35.9	0	0	111.9
347	T	24.5	Very low	30.2	Very low	131 Å²	131	146.5 Å²	146.5	80%	0.804	80%	0.803	S	S	*	*			trans	-56.5	167.1	176.9	43.7	0	0	0	0	115.2
348	S	24.9	Very low	30.2	Very low	89 Å²	89	145.4 Å²	145.4	62%	0.622	79%	0.794	S	S	*	*			cis	-171.7	167.6	16	31.3	0	0	0	0	111.4
349	H	26.5	Very low	30.3	Very low	184 Å²	184	144.3 Å²	144.3	85%	0.852	79%	0.787	S	S	*	*			trans	108.9	121.5	154.9	-62	-72.9	0	0	0	120.3
350	E	25.7	Very low	30.3	Very low	151 Å²	151	143.7 Å²	143.7	71%	0.706	78%	0.783	S	S	*	*			trans	-94	167	171	-143.8	-157.4	136.7	0	0	110.1	S352	E350-S352 PolarHBondContact OE1-N 3.29Å
351	P	37.9	Very low	31.5	Very low	113 Å²	113	142 Å²	142	73%	0.734	77%	0.774	S	S	*	*				-152.3	162.4	78.8	37.5	-17.1	0	0	0	118.2
352	S	22.9	Very low	31.5	Very low	104 Å²	104	141 Å²	141	73%	0.727	77%	0.766	S	S	*	*			trans	107.9	126.8	136.9	72.7	0	0	0	0	121.6	E350	E350-S352 PolarHBondContact OE1-N 3.29Å
353	F	27.5	Very low	31.8	Very low	187 Å²	187	139.6 Å²	139.6	82%	0.82	76%	0.755	S	S	*	*			trans	-71	175.4	178.5	-76.5	-79.3	0	0	0	114.7
354	P	41.7	Very low	32	Very low	120 Å²	120	135 Å²	135	78%	0.779	75%	0.749	S	S	*	*			cis	-143.5	172.6	27.3	36.8	-12.6	0	0	0	120
355	S	28.1	Very low	32.1	Very low	103 Å²	103	130.6 Å²	130.6	72%	0.72	74%	0.742	S	S	*	*			trans	-58.6	-171.8	175.9	68.6	0	0	0	0	116.6
356	P	44.1	Very low	32	Very low	96 Å²	96	129.7 Å²	129.7	62%	0.623	74%	0.739	S	S	*	*			cis	-151.8	-172.6	8.8	44.9	-23.9	0	0	0	118.7
357	R	32	Very low	32.4	Very low	213 Å²	213	126.8 Å²	126.8	80%	0.804	74%	0.735	S	S	*	*			trans	78.5	146.3	153.3	-68.7	173.6	-166	-154.3	2.7	117
358	Q	33.1	Very low	32.9	Very low	149 Å²	149	128 Å²	128	70%	0.696	74%	0.735	S	S	*	*			cis	-167.9	159.1	9.6	-128.9	172	5	0	0	110.5
359	T	29.4	Very low	33.2	Very low	122 Å²	122	131.7 Å²	131.7	75%	0.748	75%	0.747	S	S	*	*			trans	68.6	120.4	146.5	58.7	0	0	0	0	123
360	S	29.3	Very low	33.4	Very low	106 Å²	106	125.9 Å²	125.9	74%	0.741	74%	0.737	S	S	*	*			trans	-69.8	-162.1	160.8	57.7	0	0	0	0	113.8
361	P	53.2	Low	33.5	Very low	106 Å²	106	122.3 Å²	122.3	69%	0.688	74%	0.741	S	S	*	*			cis	-140.7	-168.1	-18.9	23	3.9	0	0	0	115
362	V	33.8	Very low	33.1	Very low	113 Å²	113	124.2 Å²	124.2	69%	0.685	75%	0.75	S	S	*	*			trans	96.2	104.3	145.9	-164.8	0	0	0	0	117.2
363	S	34.8	Very low	33.5	Very low	98 Å²	98	127.6 Å²	127.6	69%	0.685	76%	0.757	S	S	*	*				77.5	145.8	87.6	-41.2	0	0	0	0	113.5
364	D	32.5	Very low	33.7	Very low	143 Å²	143	127 Å²	127	77%	0.765	76%	0.757	S	S	*	*			cis	-168.3	162.2	36.1	-105.3	-40.5	0	0	0	113.8
365	S	30.5	Very low	33.2	Very low	101 Å²	101	129.8 Å²	129.8	71%	0.706	76%	0.759	S	S	*	*			trans	63.8	121.1	147.6	69.6	0	0	0	0	120.8
366	S	32.6	Very low	33.1	Very low	101 Å²	101	133.9 Å²	133.9	71%	0.706	76%	0.764	S	S	*	*				74.9	98.7	59.3	83.8	0	0	0	0	115.3
367	T	35.8	Very low	32.4	Very low	133 Å²	133	135.7 Å²	135.7	82%	0.816	77%	0.768	S	S	*	*				89.1	136.1	96.3	-35.3	0	0	0	0	115.8
368	I	35.3	Very low	32.3	Very low	157 Å²	157	133 Å²	133	81%	0.805	77%	0.768	S	S	*	*			trans	115.5	136.4	149.2	-105.2	164.4	0	0	0	120
369	D	31.1	Very low	32	Very low	166 Å²	166	132 Å²	132	89%	0.888	76%	0.763	S	S	*	*			trans	60.6	151.9	165	-106.5	0.8	0	0	0	119.9
370	G	29.9	Very low	32	Very low	61 Å²	61	135.1 Å²	135.1	63%	0.629	77%	0.769	S	S	*	*			cis	156.3	138.3	17	0	0	0	0	0	105.8
371	G	28.4	Very low	32.1	Very low	77 Å²	77	136.8 Å²	136.8	79%	0.794	77%	0.765	S	S	*	*			trans	-75.9	177.7	-161.2	0	0	0	0	0	118.6
372	T	29.3	Very low	30.9	Very low	152 Å²	152	136.4 Å²	136.4	93%	0.933	76%	0.761	S	S	*	*			trans	164.6	152.9	137.1	-63.6	0	0	0	0	111.2
373	M	32.1	Very low	30.8	Very low	176 Å²	176	138.4 Å²	138.4	87%	0.867	77%	0.767	S	S	*	*			trans	-88.3	150	-168	-160.7	177.4	-175.8	0	0	113.3
374	E	31.3	Very low	30.4	Very low	175 Å²	175	137.6 Å²	137.6	82%	0.818	77%	0.766	S	S	*	*			trans	163.3	115	148.1	-95.4	-178.2	164.6	0	0	110.2
375	Q	29.6	Very low	30.2	Very low	177 Å²	177	135 Å²	135	83%	0.827	76%	0.764	S	S	*	*				70.6	109.8	86.2	-87	-172.5	-2.6	0	0	118.5
376	K	27.7	Very low	30	Very low	190 Å²	190	135.6 Å²	135.6	83%	0.826	77%	0.768	S	S	*	*			trans	162.9	117.3	132.4	-97.1	179.7	172.1	176.2	0	111
377	L	28.4	Very low	29.7	Very low	134 Å²	134	138.6 Å²	138.6	70%	0.702	78%	0.775	S	S	*	*				62.7	112.2	95.9	-89	149.2	0	0	0	113
378	I	29.1	Very low	29.4	Very low	157 Å²	157	139.1 Å²	139.1	81%	0.805	77%	0.773	S	S	*	*				-174	129.2	88.2	-79.3	153.3	0	0	0	105.2
379	Q	26.9	Very low	29.1	Very low	128 Å²	128	142 Å²	142	60%	0.598	78%	0.775	S	S	*	*				75.5	106.7	54.8	-168.5	163.2	9.5	0	0	115.8	E381	Q379-E381 PolarHBondContact NE2-OE2 3.23Å
380	E	29.5	Very low	28.9	Very low	186 Å²	186	139.8 Å²	139.8	87%	0.869	77%	0.771	S	S	*	*			trans	-168.9	113.8	133.9	-108.5	-176	167	0	0	106.4
381	E	31.3	Very low	28.8	Very low	141 Å²	141	144.7 Å²	144.7	66%	0.659	78%	0.782	S	S	*	*			cis	73.4	125.7	46.5	-140.4	176.7	174.5	0	0	109.5	Q379	Q379-E381 PolarHBondContact NE2-OE2 3.23Å
382	V	29.5	Very low	29	Very low	99 Å²	99	146.4 Å²	146.4	60%	0.6	78%	0.779	S	S	*	*			cis	-179.8	155.7	13.6	111.4	0	0	0	0	113.5
383	L	30.2	Very low	28.9	Very low	155 Å²	155	144.8 Å²	144.8	81%	0.812	77%	0.769	S	S	*	*			trans	37.4	161.6	133.3	-58.5	160.1	0	0	0	121.1
384	A	27.3	Very low	28.6	Very low	81 Å²	81	144.1 Å²	144.1	67%	0.669	76%	0.764	S	S	*	*			cis	-162.9	146	23	0	0	0	0	0	110.3
385	A	27.8	Very low	28.4	Very low	87 Å²	87	145.7 Å²	145.7	72%	0.719	76%	0.763	S	S	*	*				67.9	106.8	102.6	0	0	0	0	0	115.8
386	S	25.9	Very low	28.3	Very low	114 Å²	114	145.6 Å²	145.6	80%	0.797	76%	0.762	S	S	*	*				76.9	123.1	88.5	-60.3	0	0	0	0	115.5
387	I	27.7	Very low	28.4	Very low	165 Å²	165	140.3 Å²	140.3	85%	0.846	75%	0.753	S	S	*	*				168.1	140.1	122.4	-81.8	157.1	0	0	0	111
388	N	28.8	Very low	28.4	Very low	143 Å²	143	142.1 Å²	142.1	77%	0.765	76%	0.758	S	S	*	*			trans	-67.6	156.2	178.3	-69.4	-39	0	0	0	114.7
389	Y	28.6	Very low	28.4	Very low	218 Å²	218	142.6 Å²	142.6	86%	0.855	76%	0.755	S	S	*	*				-177	136.2	122.7	-95.3	-70.4	0	0	0	112.3
390	C	26.7	Very low	28.4	Very low	119 Å²	119	142.9 Å²	142.9	80%	0.804	76%	0.76	S	S	*	*			trans	26.7	133.7	151.2	-71.8	0	0	0	0	125.4
391	L	27.7	Very low	28.4	Very low	165 Å²	165	138.5 Å²	138.5	86%	0.864	76%	0.756	S	S	*	*			trans	-48.5	157.1	152.6	-88.5	150.8	0	0	0	114.4
392	P	34.7	Very low	28.3	Very low	113 Å²	113	136.9 Å²	136.9	73%	0.734	77%	0.766	S	S	*	*				-155.5	155.5	90	38.6	-17.3	0	0	0	119.5
393	T	25.3	Very low	28.4	Very low	118 Å²	118	137.3 Å²	137.3	72%	0.724	77%	0.774	S	S	*	*			trans	76.2	121.3	135.8	-52.2	0	0	0	0	124.6
394	E	26.9	Very low	28.8	Very low	162 Å²	162	135.5 Å²	135.5	76%	0.757	77%	0.771	S	S	*	*			trans	3.7	142.7	146	-51.1	-166.7	153.7	0	0	123.6
395	R	26.7	Very low	28.7	Very low	207 Å²	207	138.2 Å²	138.2	78%	0.781	78%	0.78	S	S	*	*				162.2	139	100.9	-85.5	-159.5	-149.2	176.6	12	113.7
396	H	28	Very low	28.7	Very low	175 Å²	175	138.8 Å²	138.8	81%	0.81	78%	0.784	S	S	*	*			trans	39.6	153.7	143.3	-65.9	-91.4	0	0	0	121.6
397	A	29.9	Very low	28.8	Very low	79 Å²	79	138.1 Å²	138.1	65%	0.653	79%	0.786	S	S	*	*			cis	-178.2	156.4	-15.8	0	0	0	0	0	107.4
398	E	28.1	Very low	28.8	Very low	172 Å²	172	135.5 Å²	135.5	80%	0.804	78%	0.783	S	S	*	*			trans	76.8	125.6	153.3	-74.4	-171.1	133	0	0	125.5
399	K	28	Very low	28.7	Very low	167 Å²	167	140.1 Å²	140.1	73%	0.726	79%	0.789	S	S	*	*			trans	56.7	142.1	137.7	-80.6	179.4	166.7	171	0	120.2
400	D	28.3	Very low	28.7	Very low	135 Å²	135	138.1 Å²	138.1	72%	0.722	79%	0.787	S	S	*	*			cis	-160.9	154.6	17.5	-108	-35.9	0	0	0	111.1
401	A	28.4	Very low	28.8	Very low	94 Å²	94	140 Å²	140	78%	0.777	79%	0.788	S	S	*	*			trans	29.3	122.4	150.8	0	0	0	0	0	123.7
402	A	30.2	Very low	28.9	Very low	106 Å²	106	137.6 Å²	137.6	88%	0.876	78%	0.784	S	S	*	*				168.5	127.8	108.8	0	0	0	0	0	112.3
403	S	30.7	Very low	28.7	Very low	108 Å²	108	139 Å²	139	76%	0.755	79%	0.792	S	S	*	*			trans	-83.2	158.5	172.2	61	0	0	0	0	111.8
404	P	38.1	Very low	28.9	Very low	117 Å²	117	141.6 Å²	141.6	76%	0.76	80%	0.795	S	S	*	*				-146.6	144.3	77.7	30.3	-8.2	0	0	0	117.9
405	T	25.8	Very low	29	Very low	139 Å²	139	140 Å²	140	85%	0.853	80%	0.797	S	S	*	*			trans	45.2	112.3	134.9	-25	0	0	0	0	122.4
406	A	28.4	Very low	29	Very low	98 Å²	98	135.1 Å²	135.1	81%	0.81	79%	0.794	S	S	*	*				-170.1	116.2	127.4	0	0	0	0	0	113.8
407	A	28.2	Very low	29.1	Very low	101 Å²	101	135.6 Å²	135.6	84%	0.835	80%	0.796	S	S	*	*			trans	43.9	106.6	147	0	0	0	0	0	121.8
408	S	27.7	Very low	29	Very low	110 Å²	110	137.3 Å²	137.3	77%	0.769	80%	0.804	S	S	*	*			trans	-120.6	124.6	149.8	174.1	0	0	0	0	109
409	R	27	Very low	29	Very low	240 Å²	240	135.2 Å²	135.2	91%	0.906	80%	0.802	S	S	*	*			trans	-92.2	117.6	178.1	-78.8	-179	168.4	120.1	-3.8	109.3
410	H	28	Very low	29.2	Very low	175 Å²	175	133.5 Å²	133.5	81%	0.81	81%	0.806	S	S	*	*			trans	-91.9	135.5	161.9	-95.1	-91.5	0	0	0	109.5
411	I	28.6	Very low	29.3	Very low	159 Å²	159	134.6 Å²	134.6	82%	0.815	81%	0.812	S	S	*	*			trans	-106.7	116.6	168.2	-70.1	171.6	0	0	0	107.4
412	S	29.2	Very low	29.4	Very low	114 Å²	114	133.8 Å²	133.8	80%	0.797	81%	0.813	S	S	*	*			trans	-91.1	141.7	170.1	-64.7	0	0	0	0	109.8
413	T	31.6	Very low	29.3	Very low	144 Å²	144	136.4 Å²	136.4	88%	0.883	81%	0.812	S	S	*	*			trans	-101.5	115.8	173.7	-36.1	0	0	0	0	109
414	Q	28.4	Very low	29.4	Very low	171 Å²	171	138.3 Å²	138.3	80%	0.799	82%	0.819	S	S	*	*			trans	-100.5	127.6	177.5	-172.2	178.5	18.3	0	0	108.9
415	T	30.3	Very low	29	Very low	130 Å²	130	141.2 Å²	141.2	80%	0.798	82%	0.823	S	S	*	*			trans	-91.7	118.9	168.5	37.7	0	0	0	0	109.5
416	S	26.3	Very low	29.3	Very low	103 Å²	103	141.5 Å²	141.5	72%	0.72	83%	0.825	S	S	*	*			trans	-107.1	129.5	173.3	-66.2	0	0	0	0	109.9
417	H	29.6	Very low	29.2	Very low	185 Å²	185	142.9 Å²	142.9	86%	0.856	82%	0.818	S	S	*	*			trans	-96.7	128.5	166.6	-75.1	-90.4	0	0	0	109.1
418	S	27.6	Very low	29.5	Very low	116 Å²	116	142.8 Å²	142.8	81%	0.811	82%	0.818	S	S	*	*			trans	-108.3	121.6	168.8	56.7	0	0	0	0	109.3
419	V	29.4	Very low	29.5	Very low	127 Å²	127	146.1 Å²	146.1	77%	0.77	82%	0.821	S	S	*	*			trans	-90.4	132.9	170.1	179.3	0	0	0	0	107.5
420	T	32.1	Very low	29.5	Very low	132 Å²	132	138 Å²	138	81%	0.81	81%	0.812	S	S	*	*			trans	-127.3	116.2	163.6	45.4	0	0	0	0	108.7
421	D	29.4	Very low	29.7	Very low	158 Å²	158	138.4 Å²	138.4	85%	0.845	82%	0.819	S	S	*	*			trans	-69.7	149.5	168.2	-76.8	-39.2	0	0	0	111.3
422	G	30.8	Very low	29.5	Very low	77 Å²	77	134.1 Å²	134.1	79%	0.794	81%	0.814	S	S	*	*			trans	-153.8	107.8	168.3	0	0	0	0	0	109.5
423	D	28.6	Very low	30.2	Very low	161 Å²	161	134.1 Å²	134.1	86%	0.861	81%	0.811	S	S	*	*			trans	-63.3	143	176.8	-72.8	-50.4	0	0	0	112.7
424	T	32.2	Very low	29.9	Very low	147 Å²	147	133.3 Å²	133.3	90%	0.902	81%	0.806	S	S	*	*			trans	-152.6	132.9	138.6	-25.9	0	0	0	0	112
425	Q	29.6	Very low	29.9	Very low	179 Å²	179	130.1 Å²	130.1	84%	0.836	80%	0.803	S	S	*	*			trans	-76.9	143.8	-176.7	-174.6	179.7	10.3	0	0	112.5
426	T	32.4	Very low	29.9	Very low	145 Å²	145	130 Å²	130	89%	0.89	80%	0.802	S	S	*	*			trans	-150.6	138.8	145.9	-43.9	0	0	0	0	111.2
427	D	26.6	Very low	29.9	Very low	127 Å²	127	129.4 Å²	129.4	68%	0.679	80%	0.803	S	S	*	*			trans	-76	147	-168	-163.8	7.3	0	0	0	114
428	A	33.3	Very low	30	Very low	99 Å²	99	130.6 Å²	130.6	82%	0.818	81%	0.806	S	S	*	*			trans	-156.8	109.2	156.2	0	0	0	0	0	110.1
429	Q	29.2	Very low	30	Very low	180 Å²	180	131.1 Å²	131.1	84%	0.841	81%	0.805	S	S	*	*			trans	-64.8	152.3	176.2	-62.3	169.9	-21.9	0	0	112.9
430	G	27.3	Very low	30.3	Very low	70 Å²	70	131 Å²	131	72%	0.722	81%	0.807	S	S	*	*			trans	153.2	95.6	147.9	0	0	0	0	0	118.3
431	L	30.3	Very low	30.1	Very low	183 Å²	183	132.7 Å²	132.7	96%	0.958	81%	0.805	S	S	*	*			trans	77.7	114.4	146.3	-59	163	0	0	0	119.5
432	G	25.8	Very low	30.1	Very low	68 Å²	68	134.8 Å²	134.8	70%	0.701	81%	0.81	S	S	*	*			trans	-78.3	-159.9	157	0	0	0	0	0	112.3
433	P	42.7	Very low	29.9	Very low	115 Å²	115	137.7 Å²	137.7	75%	0.747	81%	0.807	S	S	*	*			cis	-147.1	172.6	13.2	43	-22.2	0	0	0	117.5
434	T	27.1	Very low	29.9	Very low	126 Å²	126	141.6 Å²	141.6	77%	0.773	81%	0.81	S	S	*	*			trans	65.7	134.4	143.1	19	0	0	0	0	125.1
435	S	28	Very low	29.9	Very low	104 Å²	104	139.9 Å²	139.9	73%	0.727	80%	0.804	S	S	*	*			trans	75.6	134.5	139.8	-116.7	0	0	0	0	117.1
436	T	28.8	Very low	30.3	Very low	128 Å²	128	136.7 Å²	136.7	79%	0.785	80%	0.799	S	S	*	*			cis	-166.4	153.2	37.5	17.9	0	0	0	0	109.1
437	A	27.6	Very low	30.2	Very low	90 Å²	90	139.3 Å²	139.3	74%	0.744	80%	0.798	S	S	*	*			trans	-59.7	150.8	169.5	0	0	0	0	0	113.7
438	K	30.6	Very low	30.5	Very low	210 Å²	210	142.7 Å²	142.7	91%	0.913	81%	0.81	S	S	*	*				179.3	107.9	128.2	-96.9	166.3	-172.1	-175.5	0	111.2
439	T	29.2	Very low	30.5	Very low	128 Å²	128	146 Å²	146	79%	0.785	81%	0.812	S	S	*	*			trans	-80	158.9	152.9	-12.4	0	0	0	0	108.8
440	P	34.7	Very low	30.9	Very low	125 Å²	125	143.1 Å²	143.1	81%	0.812	81%	0.809	S	S	*	*				-135.4	152.3	109.5	20.5	-0.9	0	0	0	114.4
441	Q	27.7	Very low	31.3	Very low	167 Å²	167	143.9 Å²	143.9	78%	0.78	81%	0.808	S	S	*	*			trans	-55.8	148.8	-179.8	-63.6	166.1	-76.2	0	0	114.4
442	Q	29.5	Very low	31.9	Very low	201 Å²	201	140.9 Å²	140.9	94%	0.939	80%	0.8	S	S	*	*			trans	-135.6	119.4	136.4	-99.4	-171.3	-8.4	0	0	110
443	D	27.8	Very low	32.8	Very low	138 Å²	138	147 Å²	147	74%	0.738	81%	0.81	S	S	*	*			trans	-59	139.5	167.2	-92.3	-40.4	0	0	0	111.9
444	R	28.1	Very low	32.9	Very low	243 Å²	243	145.8 Å²	145.8	92%	0.917	81%	0.809	S	S	*	*			trans	-170.7	103.7	140.5	-104.4	171.8	-164.5	-149.7	5.4	110.1
445	S	32.3	Very low	34	Very low	112 Å²	112	145.5 Å²	145.5	78%	0.783	80%	0.803	S	S	*	*			trans	-65.9	150.8	159.3	-37	0	0	0	0	109.7
446	P	36.9	Very low	35.4	Very low	112 Å²	112	145.2 Å²	145.2	73%	0.727	80%	0.799	S	S	*	*				-148.7	143.8	108.2	33.6	-15.4	0	0	0	116.4
447	K	30.6	Very low	36.6	Very low	200 Å²	200	144.1 Å²	144.1	87%	0.87	79%	0.788	S	S	*	*			trans	48.8	113	134.8	-67	178.1	174.3	178.9	0	120.3
448	Q	33.7	Very low	38	Very low	198 Å²	198	144.9 Å²	144.9	93%	0.925	78%	0.779	S	S	*	*			trans	-61.4	135	154.9	-77.4	169.8	-47.9	0	0	112.9
449	I	32	Very low	40.1	Very low	168 Å²	168	138.8 Å²	138.8	86%	0.862	76%	0.762	S	S	*	*			trans	-151.2	145.8	149.8	-68.4	-165.2	0	0	0	106.8
450	P	38.4	Very low	42.3	Very low	119 Å²	119	137.4 Å²	137.4	77%	0.773	75%	0.75	S	S	*	*	P	Polyproline II helix	trans	-93.4	158.1	-143.4	35.8	-33.5	0	0	0	115.8
451	A	35.8	Very low	44.4	Very low	86 Å²	86	138 Å²	138	71%	0.711	74%	0.739	S	S	*	*	P	Polyproline II helix	trans	-73.5	139.4	174.3	0	0	0	0	0	111.9
452	P	42.3	Very low	46.9	Very low	120 Å²	120	134.5 Å²	134.5	78%	0.779	73%	0.726	S	S	*	*	P	Polyproline II helix	trans	-81.5	121.5	169.5	31.4	-27.2	0	0	0	109.3	A454	P452-A454 PolarHBondContact O-N 3.5Å
453	H	45.7	Very low	49.2	Very low	197 Å²	197	127.1 Å²	127.1	91%	0.912	70%	0.7	S	S	*	*			trans	-66.9	110.5	162.5	-75.1	-85.5	0	0	0	108.4
454	A	44.7	Very low	51.9	Low	90 Å²	90	127.1 Å²	127.1	74%	0.744	69%	0.693	S	S	*	*			trans	-111.1	121.2	165.9	0	0	0	0	0	108.2	P452	P452-A454 PolarHBondContact O-N 3.5Å
455	D	50.4	Low	54.6	Low	119 Å²	119	122.2 Å²	122.2	64%	0.636	68%	0.681	S	S	*	*			trans	-58.1	122.8	176	-101.4	-41.5	0	0	0	110.5	D457 I458	D455-D457 PolarHBondContact O-N 3.26Å; D455-D457 VanDerWaalsContact O-N 3.12Å; D455-I458 HydrophobicContact CB-CD1 4.15Å; D455-I458 HydrophobicContact CB-CG1 4.29Å; D455-I458 PolarHBondContact O-N 3.38Å
456	P	56.2	Low	57.2	Low	99 Å²	99	121.9 Å²	121.9	64%	0.643	67%	0.667	S	S	*	*	H	α-helix	trans	-66	-15.3	-178.4	25.3	-32.5	0	0	0	113.4
457	D	54.9	Low	59.5	Low	105 Å²	105	121 Å²	121	56%	0.561	66%	0.655	S	S	*	*	H	α-helix	trans	-80.3	-20.6	-175	-135.9	25.9	0	0	0	113.3	D455	D455-D457 PolarHBondContact O-N 3.26Å; D455-D457 VanDerWaalsContact O-N 3.12Å
458	I	57.1	Low	62	Low	106 Å²	106	114.3 Å²	114.3	54%	0.544	63%	0.634	S	S	.	*	H	α-helix	trans	-77.1	-41.2	174.8	-59	173.7	0	0	0	109.7	D455 L460 K461 D462	D455-I458 HydrophobicContact CB-CD1 4.15Å; D455-I458 HydrophobicContact CB-CG1 4.29Å; D455-I458 PolarHBondContact O-N 3.38Å; I458-L460 PolarHBondContact O-N 3.33Å; I458-K461 PolarHBondContact O-N 3.17Å; I458-D462 PolarHBondContact O-N 2.82Å; I458-D462 VanDerWaalsContact O-N 3.14Å
459	S	74.6	Confident	64.7	Low	81 Å²	81	110.7 Å²	110.7	57%	0.566	62%	0.615	S	S	*	*	H	α-helix	trans	-64.7	-36.1	-178.5	176.5	0	0	0	0	113.6	A463	S459-A463 WeakPolarHBondContact O-CB 3.43Å; S459-A463 PolarHBondContact O-N 2.99Å
460	L	74.8	Confident	67.4	Low	100 Å²	100	109.1 Å²	109.1	52%	0.524	60%	0.604	S	S	.	*	H	α-helix	trans	-70.8	-41.1	177.6	-83.4	168.7	0	0	0	112.3	I458 D462 A463 F464	I458-L460 PolarHBondContact O-N 3.33Å; L460-D462 VanDerWaalsContact C-N 3.31Å; L460-D462 PolarHBondContact O-N 3.02Å; L460-A463 PolarHBondContact O-N 3.34Å; L460-F464 WeakPolarHBondContact O-CD2 3.47Å; L460-F464 PolarHBondContact O-N 3.47Å
461	K	79.4	Confident	69.9	Low	136 Å²	136	111.3 Å²	111.3	59%	0.591	60%	0.597	S	S	*	*	H	α-helix	trans	-62.5	-40.4	176.4	-76	178.6	179.7	168.6	0	111.6	I458 F464 H465	I458-K461 PolarHBondContact O-N 3.17Å; K461-F464 PolarHBondContact O-N 3.11Å; K461-H465 WeakPolarHBondContact O-CB 3.47Å; K461-H465 PolarHBondContact O-N 3.23Å
462	D	80.6	Confident	72.4	Confident	95 Å²	95	116.1 Å²	116.1	51%	0.508	60%	0.597	S	S	.	*	H	α-helix	trans	-65.8	-40.3	175.8	-68.1	-23.1	0	0	0	111.7	I458 L460 F464 H465 E466	I458-D462 PolarHBondContact O-N 2.82Å; I458-D462 VanDerWaalsContact O-N 3.14Å; L460-D462 VanDerWaalsContact C-N 3.31Å; L460-D462 PolarHBondContact O-N 3.02Å; D462-F464 PolarHBondContact O-N 3.07Å; D462-H465 PolarHBondContact O-N 3.46Å; D462-E466 PolarHBondContact O-N 3.09Å
463	A	77.6	Confident	74.7	Confident	46 Å²	46	114.3 Å²	114.3	38%	0.38	59%	0.587	S	S	.	*	H	α-helix	trans	-62.4	-42.7	174.6	0	0	0	0	0	112.5	S459 L460 H465 E466 L467	S459-A463 WeakPolarHBondContact O-CB 3.43Å; S459-A463 PolarHBondContact O-N 2.99Å; L460-A463 PolarHBondContact O-N 3.34Å; A463-H465 VanDerWaalsContact C-N 3.33Å; A463-H465 PolarHBondContact O-N 3.08Å; A463-E466 PolarHBondContact O-N 3.4Å; A463-L467 WeakPolarHBondContact O-CB 3.41Å; A463-L467 PolarHBondContact O-N 2.94Å
464	F	83	Confident	76.7	Confident	137 Å²	137	110.9 Å²	110.9	60%	0.601	57%	0.571	S	S	*	*	H	α-helix	trans	-65.7	-35.6	174.5	-79	-66.1	0	0	0	112.5	L460 K461 D462 S468	L460-F464 WeakPolarHBondContact O-CD2 3.47Å; L460-F464 PolarHBondContact O-N 3.47Å; K461-F464 PolarHBondContact O-N 3.11Å; D462-F464 PolarHBondContact O-N 3.07Å; F464-S468 VanDerWaalsContact O-CB 3.32Å; F464-S468 WeakPolarHBondContact O-CB 3.32Å; F464-S468 PolarHBondContact O-N 3.09Å; F464-S468 PolarHBondContact O-OG 3.34Å
465	H	85.7	Confident	78.7	Confident	141 Å²	141	113.1 Å²	113.1	65%	0.653	56%	0.561	S	S	*	*	H	α-helix	trans	-67.7	-43.3	176.2	-107.9	-49.7	0	0	0	112.3	K461 D462 A463 S468 K469	K461-H465 WeakPolarHBondContact O-CB 3.47Å; K461-H465 PolarHBondContact O-N 3.23Å; D462-H465 PolarHBondContact O-N 3.46Å; A463-H465 VanDerWaalsContact C-N 3.33Å; A463-H465 PolarHBondContact O-N 3.08Å; H465-S468 PolarHBondContact O-N 2.67Å; H465-K469 WeakPolarHBondContact O-CB 3.23Å; H465-K469 PolarHBondContact O-N 2.96Å
466	E	87.6	Confident	80.6	Confident	105 Å²	105	110.9 Å²	110.9	49%	0.491	56%	0.555	S	S	.	*	H	α-helix	trans	-67.2	-43	176.4	-80.8	-60.4	140.9	0	0	112	D462 A463 S468 K469 E470	D462-E466 PolarHBondContact O-N 3.09Å; A463-E466 PolarHBondContact O-N 3.4Å; E466-S468 VanDerWaalsContact C-N 3.27Å; E466-S468 PolarHBondContact O-N 3.19Å; E466-K469 WeakPolarHBondContact O-CB 3.39Å; E466-K469 PolarHBondContact O-N 3.3Å; E466-K469 VanDerWaalsContact O-N 3.12Å; E466-K469 IonicContact OE1-NZ 3.37Å; E466-K469 PolarHBondContact OE1-NZ 2.75Å; E466-K469 IonicContact OE2-NZ 2.98Å; E466-E470 WeakPolarHBondContact O-CB 3.42Å; E466-E470 PolarHBondContact O-N 3.43Å
467	L	84.2	Confident	82.2	Confident	92 Å²	92	108.7 Å²	108.7	48%	0.482	55%	0.545	S	S	.	.	H	α-helix	trans	-57.7	-39.7	171.8	-95.2	155.5	0	0	0	112.6	A463 K469 R471	A463-L467 WeakPolarHBondContact O-CB 3.41Å; A463-L467 PolarHBondContact O-N 2.94Å; L467-K469 VanDerWaalsContact C-N 3.35Å; L467-R471 WeakPolarHBondContact O-CB 3.24Å; L467-R471 VanDerWaalsContact O-CG 3.29Å; L467-R471 WeakPolarHBondContact O-CG 3.35Å; L467-R471 PolarHBondContact O-N 3.47Å
468	S	82.9	Confident	84	Confident	60 Å²	60	107.3 Å²	107.3	42%	0.42	54%	0.537	S	S	.	.	H	α-helix	trans	-68.7	-35.7	178.4	-62.9	0	0	0	0	112.2	F464 H465 E466 R472	F464-S468 VanDerWaalsContact O-CB 3.32Å; F464-S468 WeakPolarHBondContact O-CB 3.32Å; F464-S468 PolarHBondContact O-N 3.09Å; F464-S468 PolarHBondContact O-OG 3.34Å; H465-S468 PolarHBondContact O-N 2.67Å; E466-S468 VanDerWaalsContact C-N 3.27Å; E466-S468 PolarHBondContact O-N 3.19Å; S468-R472 WeakPolarHBondContact O-CB 3.38Å; S468-R472 PolarHBondContact O-N 3.16Å
469	K	90.3	Very high	85.5	Confident	123 Å²	123	110.6 Å²	110.6	54%	0.535	54%	0.542	S	S	.	.	H	α-helix	trans	-72.5	-42.8	177.4	-175.1	-179.4	169	-165.6	0	111.5	H465 E466 L467 R472 S473	H465-K469 WeakPolarHBondContact O-CB 3.23Å; H465-K469 PolarHBondContact O-N 2.96Å; E466-K469 WeakPolarHBondContact O-CB 3.39Å; E466-K469 PolarHBondContact O-N 3.3Å; E466-K469 VanDerWaalsContact O-N 3.12Å; E466-K469 IonicContact OE1-NZ 3.37Å; E466-K469 PolarHBondContact OE1-NZ 2.75Å; E466-K469 IonicContact OE2-NZ 2.98Å; L467-K469 VanDerWaalsContact C-N 3.35Å; K469-R472 PolarHBondContact O-N 3.36Å; K469-S473 PolarHBondContact O-N 2.99Å
470	E	89.9	Confident	86.4	Confident	134 Å²	134	110.6 Å²	110.6	63%	0.626	54%	0.542	S	S	*	.	H	α-helix	trans	-61.5	-48.3	174.5	-171	-177.3	-178.2	0	0	110.9	E466 R472 S473 H474	E466-E470 WeakPolarHBondContact O-CB 3.42Å; E466-E470 PolarHBondContact O-N 3.43Å; E470-R472 VanDerWaalsContact C-N 3.31Å; E470-R472 PolarHBondContact O-N 3.3Å; E470-S473 WeakPolarHBondContact O-CB 3.36Å; E470-S473 PolarHBondContact O-N 3.44Å; E470-S473 VanDerWaalsContact O-N 3.16Å; E470-H474 WeakPolarHBondContact O-CB 3.05Å; E470-H474 PolarHBondContact O-N 3.12Å
471	R	89.4	Confident	87.2	Confident	165 Å²	165	113.2 Å²	113.2	62%	0.623	55%	0.549	S	S	*	.	H	α-helix	trans	-56.5	-44.7	174.4	-80.3	176.7	142.2	-172	-4.7	112	L467 S473 H474 Y475	L467-R471 WeakPolarHBondContact O-CB 3.24Å; L467-R471 VanDerWaalsContact O-CG 3.29Å; L467-R471 WeakPolarHBondContact O-CG 3.35Å; L467-R471 PolarHBondContact O-N 3.47Å; R471-S473 VanDerWaalsContact C-N 3.35Å; R471-S473 PolarHBondContact O-N 2.92Å; R471-H474 PolarHBondContact O-N 3.16Å; R471-Y475 HydrophobicContact CB-CD2 4.47Å; R471-Y475 HydrophobicContact CB-CE2 4.38Å; R471-Y475 WeakPolarHBondContact O-CD2 3.47Å; R471-Y475 PolarHBondContact O-N 3.1Å
472	R	89.8	Confident	87.8	Confident	188 Å²	188	111.1 Å²	111.1	71%	0.709	54%	0.544	S	S	*	.	H	α-helix	trans	-62.6	-42.1	178.3	-170	-176.3	-59.3	164.4	2.1	111.8	S468 K469 E470 S476	S468-R472 WeakPolarHBondContact O-CB 3.38Å; S468-R472 PolarHBondContact O-N 3.16Å; K469-R472 PolarHBondContact O-N 3.36Å; E470-R472 VanDerWaalsContact C-N 3.31Å; E470-R472 PolarHBondContact O-N 3.3Å; R472-S476 WeakPolarHBondContact O-CB 3.33Å; R472-S476 PolarHBondContact O-N 3.34Å
473	S	89	Confident	88.3	Confident	82 Å²	82	112.5 Å²	112.5	57%	0.573	55%	0.548	S	S	*	.	H	α-helix	trans	-61.3	-46.3	174.8	-173.7	0	0	0	0	111.2	K469 E470 R471 Y475 S476 A477	K469-S473 PolarHBondContact O-N 2.99Å; E470-S473 WeakPolarHBondContact O-CB 3.36Å; E470-S473 PolarHBondContact O-N 3.44Å; E470-S473 VanDerWaalsContact O-N 3.16Å; R471-S473 VanDerWaalsContact C-N 3.35Å; R471-S473 PolarHBondContact O-N 2.92Å; S473-Y475 PolarHBondContact O-N 3.45Å; S473-S476 WeakPolarHBondContact O-CB 3.29Å; S473-S476 PolarHBondContact O-N 3.5Å; S473-A477 PolarHBondContact O-N 3.31Å
474	H	88.6	Confident	88.9	Confident	125 Å²	125	116.2 Å²	116.2	58%	0.579	56%	0.557	S	S	*	*	H	α-helix	trans	-61.8	-46.5	179.8	-157.7	86.4	0	0	0	112.2	E470 R471 S476 A477 I478	E470-H474 WeakPolarHBondContact O-CB 3.05Å; E470-H474 PolarHBondContact O-N 3.12Å; R471-H474 PolarHBondContact O-N 3.16Å; H474-S476 VanDerWaalsContact C-N 3.33Å; H474-S476 PolarHBondContact O-N 3Å; H474-A477 PolarHBondContact O-N 3.33Å; H474-I478 WeakPolarHBondContact O-CG1 3.45Å; H474-I478 PolarHBondContact O-N 3.01Å
475	Y	86.7	Confident	89.3	Confident	136 Å²	136	114.6 Å²	114.6	53%	0.533	55%	0.552	S	S	.	*	H	α-helix	trans	-66.3	-33.5	175.9	-73.8	-60.6	0	0	0	113.1	R471 S473 R479	R471-Y475 HydrophobicContact CB-CD2 4.47Å; R471-Y475 HydrophobicContact CB-CE2 4.38Å; R471-Y475 WeakPolarHBondContact O-CD2 3.47Å; R471-Y475 PolarHBondContact O-N 3.1Å; S473-Y475 PolarHBondContact O-N 3.45Å; Y475-R479 WeakPolarHBondContact O-CG 3.4Å; Y475-R479 PolarHBondContact O-N 3.32Å
476	S	91.1	Very high	89.6	Confident	72 Å²	72	111.7 Å²	111.7	50%	0.503	55%	0.545	S	S	.	.	H	α-helix	trans	-65	-44.1	174.2	-170.5	0	0	0	0	111.6	R472 S473 H474 I478 R479 S480	R472-S476 WeakPolarHBondContact O-CB 3.33Å; R472-S476 PolarHBondContact O-N 3.34Å; S473-S476 WeakPolarHBondContact O-CB 3.29Å; S473-S476 PolarHBondContact O-N 3.5Å; H474-S476 VanDerWaalsContact C-N 3.33Å; H474-S476 PolarHBondContact O-N 3Å; S476-I478 PolarHBondContact O-N 3.05Å; S476-R479 PolarHBondContact O-N 3.45Å; S476-S480 WeakPolarHBondContact O-CB 3.46Å; S476-S480 PolarHBondContact O-N 2.93Å
477	A	89.8	Confident	89.6	Confident	54 Å²	54	109.8 Å²	109.8	45%	0.446	54%	0.54	S	S	.	.	H	α-helix	trans	-63.2	-40.9	176.9	0	0	0	0	0	112.3	S473 H474 K481	S473-A477 PolarHBondContact O-N 3.31Å; H474-A477 PolarHBondContact O-N 3.33Å; A477-K481 PolarHBondContact O-N 3.29Å; A477-K481 VanDerWaalsContact O-N 3.1Å
478	I	91.3	Very high	89.7	Confident	75 Å²	75	106.9 Å²	106.9	39%	0.385	53%	0.528	S	S	.	.	H	α-helix	trans	-63.1	-47.3	175.2	-67.7	167.8	0	0	0	110.7	H474 S476 S480 K481 L482	H474-I478 WeakPolarHBondContact O-CG1 3.45Å; H474-I478 PolarHBondContact O-N 3.01Å; S476-I478 PolarHBondContact O-N 3.05Å; I478-S480 PolarHBondContact O-N 3.47Å; I478-K481 PolarHBondContact O-N 3.48Å; I478-L482 HydrophobicContact CG2-CD1 3.91Å; I478-L482 PolarHBondContact O-N 2.96Å
479	R	89.4	Confident	89.6	Confident	175 Å²	175	109.4 Å²	109.4	66%	0.66	54%	0.536	S	S	*	.	H	α-helix	trans	-61.6	-45.2	177.6	-76.5	-173	-158.1	142.5	3.4	112	Y475 S476 K481 L482 E483	Y475-R479 WeakPolarHBondContact O-CG 3.4Å; Y475-R479 PolarHBondContact O-N 3.32Å; S476-R479 PolarHBondContact O-N 3.45Å; R479-K481 VanDerWaalsContact C-N 3.29Å; R479-K481 PolarHBondContact O-N 2.98Å; R479-L482 PolarHBondContact O-N 3.33Å; R479-L482 VanDerWaalsContact O-N 3.12Å; R479-E483 WeakPolarHBondContact O-CG 3.39Å; R479-E483 PolarHBondContact O-N 2.99Å
480	S	93.3	Very high	89.1	Confident	81 Å²	81	106.8 Å²	106.8	57%	0.566	53%	0.53	S	S	*	.	H	α-helix	trans	-58.3	-41.1	178.2	179.8	0	0	0	0	112.2	S476 I478 H484	S476-S480 WeakPolarHBondContact O-CB 3.46Å; S476-S480 PolarHBondContact O-N 2.93Å; I478-S480 PolarHBondContact O-N 3.47Å; S480-H484 WeakPolarHBondContact O-CB 3.25Å; S480-H484 PolarHBondContact O-N 2.96Å
481	K	92.6	Very high	88.4	Confident	155 Å²	155	106.3 Å²	106.3	67%	0.674	53%	0.528	S	S	*	.	H	α-helix	trans	-66.5	-40.8	174.3	-77.1	-177.5	176.4	-177.5	0	112.9	A477 I478 R479 H484 M485	A477-K481 PolarHBondContact O-N 3.29Å; A477-K481 VanDerWaalsContact O-N 3.1Å; I478-K481 PolarHBondContact O-N 3.48Å; R479-K481 VanDerWaalsContact C-N 3.29Å; R479-K481 PolarHBondContact O-N 2.98Å; K481-H484 PolarHBondContact O-N 2.77Å; K481-M485 WeakPolarHBondContact O-CG 3.29Å; K481-M485 PolarHBondContact O-N 3.37Å
482	L	90.1	Very high	87.5	Confident	93 Å²	93	107.1 Å²	107.1	49%	0.487	53%	0.531	S	S	.	.	H	α-helix	trans	-63.6	-47.1	176.7	-79.1	163.5	0	0	0	111.3	I478 R479 H484 M485 V486	I478-L482 HydrophobicContact CG2-CD1 3.91Å; I478-L482 PolarHBondContact O-N 2.96Å; R479-L482 PolarHBondContact O-N 3.33Å; R479-L482 VanDerWaalsContact O-N 3.12Å; L482-H484 VanDerWaalsContact C-N 3.34Å; L482-H484 PolarHBondContact O-N 3.46Å; L482-M485 HydrophobicContact CD2-CE 3.72Å; L482-M485 HydrophobicContact CG-CE 4.27Å; L482-M485 PolarHBondContact O-N 2.97Å; L482-M485 VanDerWaalsContact O-N 3.16Å; L482-V486 WeakPolarHBondContact O-CG2 3.41Å; L482-V486 PolarHBondContact O-N 3.21Å
483	E	91.1	Very high	86.4	Confident	124 Å²	124	106.9 Å²	106.9	58%	0.579	53%	0.53	S	S	*	.	H	α-helix	trans	-57.8	-46.4	175.4	-70.9	-62.1	152.4	0	0	111.1	R479 M485 V486 T487	R479-E483 WeakPolarHBondContact O-CG 3.39Å; R479-E483 PolarHBondContact O-N 2.99Å; E483-M485 VanDerWaalsContact C-N 3.32Å; E483-M485 PolarHBondContact O-N 2.86Å; E483-V486 PolarHBondContact O-N 3Å; E483-V486 VanDerWaalsContact O-N 3.16Å; E483-T487 WeakPolarHBondContact O-CG2 3.46Å; E483-T487 PolarHBondContact O-N 2.85Å; E483-T487 PolarHBondContact O-OG1 2.89Å
484	H	91.8	Very high	85.2	Confident	124 Å²	124	109.2 Å²	109.2	57%	0.574	53%	0.532	S	S	*	.	H	α-helix	trans	-61	-38.6	176.4	-177.5	-75.7	0	0	0	113	S480 K481 L482 T487 S488	S480-H484 WeakPolarHBondContact O-CB 3.25Å; S480-H484 PolarHBondContact O-N 2.96Å; K481-H484 PolarHBondContact O-N 2.77Å; L482-H484 VanDerWaalsContact C-N 3.34Å; L482-H484 PolarHBondContact O-N 3.46Å; H484-T487 WeakPolarHBondContact CA-OG1 3.43Å; H484-T487 PolarHBondContact O-OG1 2.93Å; H484-S488 PolarHBondContact CE1-OG 2.88Å; H484-S488 VanDerWaalsContact CE1-OG 3.3Å; H484-S488 PolarHBondContact ND1-OG 3.48Å; H484-S488 VanDerWaalsContact O-CB 3.24Å; H484-S488 WeakPolarHBondContact O-CB 3.37Å; H484-S488 PolarHBondContact O-N 2.98Å; H484-S488 PolarHBondContact O-OG 3.2Å
485	M	90.6	Very high	83.8	Confident	102 Å²	102	109.2 Å²	109.2	50%	0.502	54%	0.536	S	S	.	.	H	α-helix	trans	-67.2	-40.9	175.6	-74.1	-172.6	-61.1	0	0	111.4	K481 L482 E483 S488 L489	K481-M485 WeakPolarHBondContact O-CG 3.29Å; K481-M485 PolarHBondContact O-N 3.37Å; L482-M485 HydrophobicContact CD2-CE 3.72Å; L482-M485 HydrophobicContact CG-CE 4.27Å; L482-M485 PolarHBondContact O-N 2.97Å; L482-M485 VanDerWaalsContact O-N 3.16Å; E483-M485 VanDerWaalsContact C-N 3.32Å; E483-M485 PolarHBondContact O-N 2.86Å; M485-S488 PolarHBondContact O-N 2.97Å; M485-L489 WeakPolarHBondContact O-CB 3.41Å; M485-L489 VanDerWaalsContact O-CG 3.23Å; M485-L489 WeakPolarHBondContact O-CG 3.46Å; M485-L489 PolarHBondContact O-N 3.16Å
486	V	91.5	Very high	82.4	Confident	81 Å²	81	104.9 Å²	104.9	49%	0.491	53%	0.528	S	S	.	.	H	α-helix	trans	-64.5	-46.2	177.6	172	0	0	0	0	110.7	L482 E483 L489 T490	L482-V486 WeakPolarHBondContact O-CG2 3.41Å; L482-V486 PolarHBondContact O-N 3.21Å; E483-V486 PolarHBondContact O-N 3Å; E483-V486 VanDerWaalsContact O-N 3.16Å; V486-L489 PolarHBondContact O-N 2.86Å; V486-T490 WeakPolarHBondContact O-CB 3.44Å; V486-T490 PolarHBondContact O-N 3.35Å; V486-T490 PolarHBondContact O-OG1 3.01Å
487	T	88.9	Confident	80.7	Confident	64 Å²	64	105.8 Å²	105.8	39%	0.393	53%	0.527	S	S	.	.	H	α-helix	trans	-63	-45.5	176.4	55.5	0	0	0	0	111.4	E483 H484 L489 T490 E491	E483-T487 WeakPolarHBondContact O-CG2 3.46Å; E483-T487 PolarHBondContact O-N 2.85Å; E483-T487 PolarHBondContact O-OG1 2.89Å; H484-T487 WeakPolarHBondContact CA-OG1 3.43Å; H484-T487 PolarHBondContact O-OG1 2.93Å; T487-L489 VanDerWaalsContact C-N 3.29Å; T487-L489 PolarHBondContact O-N 2.94Å; T487-T490 PolarHBondContact O-N 3.28Å; T487-T490 VanDerWaalsContact O-N 3.09Å; T487-E491 WeakPolarHBondContact O-CG 3.35Å; T487-E491 PolarHBondContact O-N 3.06Å
488	S	85.3	Confident	79.2	Confident	32 Å²	32	107.9 Å²	107.9	22%	0.224	53%	0.534	C	S	.	.	H	α-helix	trans	-60.4	-37	177.9	-62.8	0	0	0	0	113	H484 M485 R492	H484-S488 PolarHBondContact CE1-OG 2.88Å; H484-S488 VanDerWaalsContact CE1-OG 3.3Å; H484-S488 PolarHBondContact ND1-OG 3.48Å; H484-S488 VanDerWaalsContact O-CB 3.24Å; H484-S488 WeakPolarHBondContact O-CB 3.37Å; H484-S488 PolarHBondContact O-N 2.98Å; H484-S488 PolarHBondContact O-OG 3.2Å; M485-S488 PolarHBondContact O-N 2.97Å; S488-R492 VanDerWaalsContact O-CG 3.32Å; S488-R492 WeakPolarHBondContact O-CG 3.44Å; S488-R492 PolarHBondContact O-N 2.83Å
489	L	80.7	Confident	77.5	Confident	112 Å²	112	108.3 Å²	108.3	59%	0.586	54%	0.54	S	S	*	.	H	α-helix	trans	-74.7	-32.9	176.6	-72.3	171.5	0	0	0	112	M485 V486 T487 R493	M485-L489 WeakPolarHBondContact O-CB 3.41Å; M485-L489 VanDerWaalsContact O-CG 3.23Å; M485-L489 WeakPolarHBondContact O-CG 3.46Å; M485-L489 PolarHBondContact O-N 3.16Å; V486-L489 PolarHBondContact O-N 2.86Å; T487-L489 VanDerWaalsContact C-N 3.29Å; T487-L489 PolarHBondContact O-N 2.94Å; L489-R493 PolarHBondContact O-N 3.12Å; L489-R493 VanDerWaalsContact O-N 3.09Å
490	T	81.3	Confident	75.6	Confident	69 Å²	69	105.1 Å²	105.1	42%	0.423	54%	0.537	S	S	.	.	H	α-helix	trans	-70.2	-45.3	176.8	-50.3	0	0	0	0	110.7	V486 T487 R492 R493 E494	V486-T490 WeakPolarHBondContact O-CB 3.44Å; V486-T490 PolarHBondContact O-N 3.35Å; V486-T490 PolarHBondContact O-OG1 3.01Å; T487-T490 PolarHBondContact O-N 3.28Å; T487-T490 VanDerWaalsContact O-N 3.09Å; T490-R492 VanDerWaalsContact C-N 3.33Å; T490-R492 PolarHBondContact O-N 2.99Å; T490-R493 WeakPolarHBondContact O-CB 3.42Å; T490-R493 PolarHBondContact O-N 3.3Å; T490-R493 VanDerWaalsContact O-N 3.08Å; T490-E494 PolarHBondContact O-N 3.31Å
491	E	74.6	Confident	73.8	Confident	123 Å²	123	106.7 Å²	106.7	58%	0.575	54%	0.543	S	S	*	.	H	α-helix	trans	-61	-39.3	174.4	-71.8	174.8	-177.6	0	0	112.2	T487 R493 E494 L495	T487-E491 WeakPolarHBondContact O-CG 3.35Å; T487-E491 PolarHBondContact O-N 3.06Å; E491-R493 VanDerWaalsContact C-N 3.32Å; E491-R493 PolarHBondContact O-N 2.75Å; E491-E494 PolarHBondContact O-N 3.02Å; E491-L495 VanDerWaalsContact O-CD1 3.29Å; E491-L495 WeakPolarHBondContact O-CD1 3.38Å; E491-L495 PolarHBondContact O-N 2.96Å
492	R	69.8	Low	71.6	Confident	183 Å²	183	104.8 Å²	104.8	69%	0.691	54%	0.544	S	S	*	.	H	α-helix	trans	-65.3	-34	173.9	-77.7	-178	-168.1	176.1	4.8	112.9	S488 T490 A496	S488-R492 VanDerWaalsContact O-CG 3.32Å; S488-R492 WeakPolarHBondContact O-CG 3.44Å; S488-R492 PolarHBondContact O-N 2.83Å; T490-R492 VanDerWaalsContact C-N 3.33Å; T490-R492 PolarHBondContact O-N 2.99Å; R492-A496 WeakPolarHBondContact O-CB 3.4Å; R492-A496 PolarHBondContact O-N 3.5Å; R492-A496 VanDerWaalsContact O-N 3.11Å
493	R	68.3	Low	69.5	Low	183 Å²	183	108.8 Å²	108.8	69%	0.691	56%	0.56	S	S	*	*	H	α-helix	trans	-69.5	-41.8	175.6	-170.5	175.8	-173.8	176.5	2.8	111.1	L489 T490 E491 A496 D497	L489-R493 PolarHBondContact O-N 3.12Å; L489-R493 VanDerWaalsContact O-N 3.09Å; T490-R493 WeakPolarHBondContact O-CB 3.42Å; T490-R493 PolarHBondContact O-N 3.3Å; T490-R493 VanDerWaalsContact O-N 3.08Å; E491-R493 VanDerWaalsContact C-N 3.32Å; E491-R493 PolarHBondContact O-N 2.75Å; R493-A496 PolarHBondContact O-N 3.22Å; R493-D497 PolarHBondContact O-N 3.46Å
494	E	62.1	Low	67.1	Low	130 Å²	130	105.9 Å²	105.9	61%	0.607	56%	0.563	S	S	*	*	H	α-helix	trans	-65.9	-38.1	175.8	-68	-167	171.6	0	0	112.3	T490 E491 A496 D497 V498	T490-E494 PolarHBondContact O-N 3.31Å; E491-E494 PolarHBondContact O-N 3.02Å; E494-A496 VanDerWaalsContact C-N 3.35Å; E494-A496 PolarHBondContact O-N 2.97Å; E494-D497 PolarHBondContact O-N 2.9Å; E494-V498 VanDerWaalsContact O-CG2 3.25Å; E494-V498 WeakPolarHBondContact O-CG2 3.47Å; E494-V498 PolarHBondContact O-N 3.5Å
495	L	59	Low	64.7	Low	125 Å²	125	106.8 Å²	106.8	65%	0.654	58%	0.577	S	S	*	*	H	α-helix	trans	-65.1	-35.1	172.2	-97.8	89.2	0	0	0	113.2	E491 T499	E491-L495 VanDerWaalsContact O-CD1 3.29Å; E491-L495 WeakPolarHBondContact O-CD1 3.38Å; E491-L495 PolarHBondContact O-N 2.96Å; L495-T499 WeakPolarHBondContact O-CG2 3.32Å; L495-T499 PolarHBondContact O-N 3.38Å; L495-T499 VanDerWaalsContact O-N 3.17Å; L495-T499 PolarHBondContact O-OG1 2.96Å
496	A	57.5	Low	61.9	Low	45 Å²	45	105.6 Å²	105.6	37%	0.372	59%	0.591	S	S	.	*	H	α-helix	trans	-69.9	-35.3	175.9	0	0	0	0	0	112	R492 R493 E494 T499 N500	R492-A496 WeakPolarHBondContact O-CB 3.4Å; R492-A496 PolarHBondContact O-N 3.5Å; R492-A496 VanDerWaalsContact O-N 3.11Å; R493-A496 PolarHBondContact O-N 3.22Å; E494-A496 VanDerWaalsContact C-N 3.35Å; E494-A496 PolarHBondContact O-N 2.97Å; A496-T499 WeakPolarHBondContact CA-OG1 3.1Å; A496-T499 PolarHBondContact O-OG1 3.26Å; A496-N500 PolarHBondContact O-N 3.05Å; A496-N500 PolarHBondContact O-ND2 3.14Å
497	D	56.3	Low	59.1	Low	91 Å²	91	107 Å²	107	49%	0.487	61%	0.611	S	S	.	*	H	α-helix	trans	-74.3	-35.5	176.5	-74.2	-25.1	0	0	0	112	R493 E494 N500 V501	R493-D497 PolarHBondContact O-N 3.46Å; E494-D497 PolarHBondContact O-N 2.9Å; D497-N500 PolarHBondContact O-N 3.46Å; D497-V501 WeakPolarHBondContact O-CG2 3.49Å; D497-V501 PolarHBondContact O-N 3.35Å
498	V	57.2	Low	56.4	Low	99 Å²	99	108.1 Å²	108.1	60%	0.6	63%	0.627	S	S	*	*	H	α-helix	trans	-69.8	-33.5	176.5	173.1	0	0	0	0	112.7	E494 V501 T502	E494-V498 VanDerWaalsContact O-CG2 3.25Å; E494-V498 WeakPolarHBondContact O-CG2 3.47Å; E494-V498 PolarHBondContact O-N 3.5Å; V498-V501 PolarHBondContact O-N 3.4Å; V498-T502 PolarHBondContact O-N 3.12Å; V498-T502 PolarHBondContact O-OG1 3.24Å
499	T	55.5	Low	53.9	Low	83 Å²	83	118.2 Å²	118.2	51%	0.509	66%	0.66	S	S	.	*	H	α-helix	trans	-71.9	-30.4	175.4	42	0	0	0	0	112.6	L495 A496 T502	L495-T499 WeakPolarHBondContact O-CG2 3.32Å; L495-T499 PolarHBondContact O-N 3.38Å; L495-T499 VanDerWaalsContact O-N 3.17Å; L495-T499 PolarHBondContact O-OG1 2.96Å; A496-T499 WeakPolarHBondContact CA-OG1 3.1Å; A496-T499 PolarHBondContact O-OG1 3.26Å; T499-T502 PolarHBondContact O-OG1 2.98Å
500	N	50.2	Low	51.5	Low	109 Å²	109	118.2 Å²	118.2	58%	0.583	67%	0.67	S	S	*	*	H	α-helix	trans	-75.1	-26.8	175.1	-72.5	-30.6	0	0	0	113.6	A496 D497	A496-N500 PolarHBondContact O-N 3.05Å; A496-N500 PolarHBondContact O-ND2 3.14Å; D497-N500 PolarHBondContact O-N 3.46Å
501	V	54.8	Low	49.1	Very low	114 Å²	114	119.5 Å²	119.5	69%	0.691	68%	0.681	S	S	*	*	H	α-helix	trans	-78.2	-27	177.9	174.1	0	0	0	0	112.4	D497 V498	D497-V501 WeakPolarHBondContact O-CG2 3.49Å; D497-V501 PolarHBondContact O-N 3.35Å; V498-V501 PolarHBondContact O-N 3.4Å
502	T	47.3	Very low	47	Very low	115 Å²	115	125.7 Å²	125.7	71%	0.706	70%	0.699	S	S	*	*	H	α-helix	trans	-82.5	-11.4	-178.8	29.4	0	0	0	0	114.5	V498 T499	V498-T502 PolarHBondContact O-N 3.12Å; V498-T502 PolarHBondContact O-OG1 3.24Å; T499-T502 PolarHBondContact O-OG1 2.98Å
503	Q	45	Very low	45.2	Very low	177 Å²	177	125 Å²	125	83%	0.827	70%	0.704	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.7	1.7	178.2	-114.8	170.6	0.4	0	0	114.6
504	G	41.8	Very low	43.4	Very low	62 Å²	62	126.5 Å²	126.5	64%	0.639	71%	0.71	S	S	*	*			trans	-106.3	31.7	-171.6	0	0	0	0	0	116.1
505	V	42	Very low	41.9	Very low	144 Å²	144	128.2 Å²	128.2	87%	0.873	72%	0.723	S	S	*	*			trans	-138.3	101.2	173.4	-174.1	0	0	0	0	110.7
506	G	31.2	Very low	40.6	Very low	77 Å²	77	131 Å²	131	79%	0.794	73%	0.732	S	S	*	*			trans	136.6	86.2	158.3	0	0	0	0	0	115.5
507	A	31.9	Very low	39.2	Very low	111 Å²	111	138.6 Å²	138.6	92%	0.917	76%	0.757	S	S	*	*				177.4	133.1	126.9	0	0	0	0	0	110.4
508	A	32.5	Very low	38	Very low	87 Å²	87	140.8 Å²	140.8	72%	0.719	77%	0.769	S	S	*	*			trans	-93.8	155.3	-167.4	0	0	0	0	0	113.6
509	R	32.8	Very low	36.7	Very low	244 Å²	244	142.9 Å²	142.9	92%	0.921	78%	0.782	S	S	*	*			trans	48.6	117.4	138	-71.4	176.7	163.6	-178	-4.2	119.1
510	S	30.2	Very low	35.7	Very low	112 Å²	112	146.1 Å²	146.1	78%	0.783	80%	0.796	S	S	*	*				-174.9	121.6	117.7	-166.7	0	0	0	0	114.5
511	S	30.4	Very low	35.4	Very low	96 Å²	96	147.1 Å²	147.1	67%	0.671	81%	0.808	S	S	*	*			trans	53.1	123.2	137	110.9	0	0	0	0	124.9
512	R	31.9	Very low	34.2	Very low	252 Å²	252	145 Å²	145	95%	0.951	81%	0.81	S	S	*	*				91.4	142.1	121	-83	-179.6	176.1	175.9	-0.4	121.9
513	Q	31.5	Very low	33.9	Very low	170 Å²	170	145.5 Å²	145.5	79%	0.794	82%	0.815	S	S	*	*			trans	-96.5	148.4	-163.6	-126.4	172.5	-25	0	0	112.4
514	R	31.1	Very low	33.6	Very low	214 Å²	214	142.6 Å²	142.6	81%	0.808	81%	0.812	S	S	*	*			trans	58	122.5	142	-88.2	-179.3	170.4	178.6	-3.4	121
515	N	29.2	Very low	32.9	Very low	165 Å²	165	144 Å²	144	88%	0.882	82%	0.817	S	S	*	*				-171.7	147	101.8	-97.9	-20.4	0	0	0	113.7
516	H	31.9	Very low	32.2	Very low	184 Å²	184	145.8 Å²	145.8	85%	0.852	82%	0.816	S	S	*	*			trans	-82.7	147	178.8	-96.6	-77.7	0	0	0	113.4
517	K	29.6	Very low	32.1	Very low	204 Å²	204	147.7 Å²	147.7	89%	0.887	82%	0.817	S	S	*	*			trans	-169	144	133.6	-135.4	173.1	178.5	179.9	0	113.2
518	D	30.7	Very low	32	Very low	138 Å²	138	146.3 Å²	146.3	74%	0.738	81%	0.813	S	S	*	*			trans	-74.4	153.8	-169.1	-55.7	-64.7	0	0	0	116.9
519	T	29.7	Very low	31.9	Very low	142 Å²	142	145.9 Å²	145.9	87%	0.871	82%	0.818	S	S	*	*				170.6	133.7	109	-48.4	0	0	0	0	111.7
520	N	34.3	Very low	31.8	Very low	152 Å²	152	143.7 Å²	143.7	81%	0.813	82%	0.82	S	S	*	*			trans	-65.7	176.1	-178.4	-99.1	-21.4	0	0	0	115.9
521	P	43.5	Very low	31.8	Very low	129 Å²	129	141.6 Å²	141.6	84%	0.838	82%	0.816	S	S	*	*			cis	-145.7	166.1	24.1	37.9	-15.6	0	0	0	119
522	G	29	Very low	31.9	Very low	70 Å²	70	143.4 Å²	143.4	72%	0.722	82%	0.823	S	S	*	*			trans	126.2	132.4	159	0	0	0	0	0	117
523	P	42.5	Very low	31.9	Very low	126 Å²	126	143.6 Å²	143.6	82%	0.818	82%	0.824	S	S	*	*			trans	-88.5	179.7	-172	40.4	-36	0	0	0	112
524	P	38.7	Very low	32.2	Very low	116 Å²	116	141.6 Å²	141.6	75%	0.753	83%	0.826	S	S	*	*			cis	-145.9	-170.3	23.1	39.5	-15.8	0	0	0	116.6
525	A	26.8	Very low	32.2	Very low	90 Å²	90	143.3 Å²	143.3	74%	0.744	83%	0.832	S	S	*	*			trans	70.4	147.1	162	0	0	0	0	0	116.5
526	E	27.9	Very low	32.4	Very low	183 Å²	183	139.9 Å²	139.9	86%	0.855	83%	0.827	S	S	*	*			cis	-169.1	163.1	12.5	-136.8	175.6	-160.6	0	0	108.7
527	S	29.2	Very low	32.4	Very low	116 Å²	116	142.1 Å²	142.1	81%	0.811	83%	0.828	S	S	*	*			trans	75.4	107.7	139.7	-167.1	0	0	0	0	122.2
528	G	29.4	Very low	32.3	Very low	82 Å²	82	138.9 Å²	138.9	85%	0.845	83%	0.829	S	S	*	*			trans	-168.9	91.6	144.4	0	0	0	0	0	105.9
529	G	29.5	Very low	32.5	Very low	79 Å²	79	137.5 Å²	137.5	81%	0.814	83%	0.826	S	S	*	*				123.2	58.4	62.3	0	0	0	0	0	107.1
530	M	31.1	Very low	32.8	Very low	198 Å²	198	143 Å²	143	98%	0.975	84%	0.841	S	S	*	*			trans	-74.7	139.5	169.4	-94	144.9	78.8	0	0	109.4
531	G	29.2	Very low	32.7	Very low	67 Å²	67	142.6 Å²	142.6	69%	0.691	84%	0.843	S	S	*	*			trans	-143.6	143.9	158.9	0	0	0	0	0	109.8
532	T	33.8	Very low	32.1	Very low	135 Å²	135	143.3 Å²	143.3	83%	0.828	84%	0.843	S	S	*	*			cis	-165.9	115.9	-12.5	33.3	0	0	0	0	104
533	W	31.9	Very low	32.3	Very low	256 Å²	256	147.4 Å²	147.4	97%	0.97	85%	0.85	S	S	*	*			trans	-104.3	134.9	164.5	-76.1	92.2	0	0	0	108.1	R535	W533-R535 PolarHBondContact O-N 3.41Å
534	P	36.8	Very low	31.7	Very low	127 Å²	127	148.6 Å²	148.6	83%	0.825	85%	0.851	S	S	*	*			trans	-81.3	120.6	-176.2	29.6	-29.9	0	0	0	111.4
535	R	32.1	Very low	31.3	Very low	251 Å²	251	150.7 Å²	150.7	95%	0.947	86%	0.858	S	S	*	*			trans	-95.4	125.9	159.8	-104.5	-177.2	170.5	167.8	-2.2	108.8	W533	W533-R535 PolarHBondContact O-N 3.41Å
536	A	33.7	Very low	31.6	Very low	93 Å²	93	154.7 Å²	154.7	77%	0.769	87%	0.865	S	S	*	*			trans	-111.2	104.9	159.3	0	0	0	0	0	107.3
537	R	32.1	Very low	31.9	Very low	231 Å²	231	152.7 Å²	152.7	87%	0.872	87%	0.866	S	S	*	*				68.6	100.3	109.9	-71.4	-166.4	-127.1	-153.1	2.3	115.5
538	C	26.2	Very low	32.1	Very low	136 Å²	136	155.5 Å²	155.5	92%	0.919	87%	0.87	S	S	*	*			trans	-83.7	134	142	-71.5	0	0	0	0	108.5
539	V	35	Very low	32.3	Very low	109 Å²	109	161.7 Å²	161.7	66%	0.661	87%	0.872	S	S	*	*			trans	-141.9	120.6	159.6	-177.3	0	0	0	0	107.5
540	H	36.1	Very low	32.5	Very low	258 Å²	258	169.2 Å²	169.2	100%	1.194	88%	0.877	S	S	*	*			trans	67.7	0	167.6	-68.6	-54.4	0	0	0	120.8

Retrieved 540 of 540 residues in 265.9 ms (Link to these results)

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