A0A096N499_PAPAN Loading...

RCAN family member 3

Inhibits calcineurin-dependent transcriptional responses by binding to the catalytic domain of calcineurin A. Could play a role during central nervous system development.

AlphaFold DB (A0A1D5QCL3), UniProt , Accession A0A096N499, Species PAPAN (Papio anubis, Olive baboon), Gene RCAN3, Length 241 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	34.9	Very low	37.7	Very low	230 Å²	230	171.3 Å²	171.3	100%	1.133	84%	0.84	S	S	*	*				0	129.6	0	-81.6	-174.7	173.5	0	0	107.9
2	L	36.3	Very low	37.9	Very low	146 Å²	146	165.7 Å²	165.7	76%	0.764	83%	0.83	S	S	*	*			trans	66	100.1	153.2	-57.4	156.5	0	0	0	115.5
3	R	43.2	Very low	38.2	Very low	223 Å²	223	166.1 Å²	166.1	84%	0.842	83%	0.828	S	S	*	*				74.6	152.2	87.5	-80.4	-168.6	-176.3	-165.2	1.5	112.6
4	D	38.5	Very low	38.4	Very low	149 Å²	149	160.1 Å²	160.1	80%	0.797	81%	0.81	S	S	*	*			trans	100.5	138.1	168.5	-57.1	-28.1	0	0	0	114.5
5	T	37.9	Very low	38.4	Very low	113 Å²	113	160.3 Å²	160.3	69%	0.693	81%	0.814	S	S	*	*			cis	-169.7	137.5	-1.6	-100.1	0	0	0	0	108.8
6	M	38.8	Very low	38.7	Very low	177 Å²	177	160.4 Å²	160.4	87%	0.872	82%	0.816	S	S	*	*			trans	-17	128.5	148.9	-129.5	154	161.7	0	0	116.8
7	K	44	Very low	38.4	Very low	209 Å²	209	158.2 Å²	158.2	91%	0.909	82%	0.817	S	S	*	*			trans	177.6	137.4	148.6	-106.2	166.2	173.3	-178.1	0	106.9
8	S	37.7	Very low	38.3	Very low	108 Å²	108	155 Å²	155	76%	0.755	81%	0.811	S	S	*	*			cis	-164	151.4	14.7	176.2	0	0	0	0	106.9
9	W	30	Very low	38.7	Very low	229 Å²	229	153.7 Å²	153.7	87%	0.867	81%	0.81	S	S	*	*			trans	-47.7	144.7	170.8	-56.3	-22.8	0	0	0	113.6
10	N	36.7	Very low	38.8	Very low	156 Å²	156	153.6 Å²	153.6	83%	0.834	81%	0.81	S	S	*	*				-164	122	97.2	-108.8	-5.5	0	0	0	113.1
11	D	36.3	Very low	39.3	Very low	144 Å²	144	154 Å²	154	77%	0.77	81%	0.808	S	S	*	*			trans	-71.1	133.2	164.5	-168.8	-4.2	0	0	0	108.3
12	S	40.7	Very low	39.5	Very low	104 Å²	104	152.1 Å²	152.1	73%	0.727	80%	0.796	S	S	*	*			trans	179.4	125	133.5	-81	0	0	0	0	112.7
13	Q	41.2	Very low	39.9	Very low	171 Å²	171	152.1 Å²	152.1	80%	0.799	79%	0.792	S	S	*	*			trans	89.7	85.9	148.6	-75.6	-174.4	-78.3	0	0	119.2
14	S	41.2	Very low	40.2	Very low	83 Å²	83	150.4 Å²	150.4	58%	0.58	79%	0.794	S	S	*	*				51.9	111	107.1	66.9	0	0	0	0	117.5
15	D	39.2	Very low	40.4	Very low	162 Å²	162	150.6 Å²	150.6	87%	0.866	79%	0.79	S	S	*	*				-151.2	151.3	106.9	-87	-34.7	0	0	0	110.9
16	L	42	Very low	40.8	Very low	162 Å²	162	153.8 Å²	153.8	85%	0.848	80%	0.797	S	S	*	*			trans	-85.4	168.1	-163.9	-69.6	148.3	0	0	0	113.8
17	C	34.9	Very low	41	Very low	124 Å²	124	152.9 Å²	152.9	84%	0.838	79%	0.792	S	S	*	*			trans	87.3	124.3	169.8	-70.2	0	0	0	0	115.8
18	S	35.6	Very low	41.3	Very low	100 Å²	100	150.2 Å²	150.2	70%	0.699	79%	0.787	S	S	*	*			cis	-157.6	147.9	3.7	-82.4	0	0	0	0	108	D20	S18-D20 PolarHBondContact O-N 3.27Å
19	T	47	Very low	41.7	Very low	130 Å²	130	154.1 Å²	154.1	80%	0.798	79%	0.79	S	S	*	*			trans	-55.8	125.3	158.9	-69.9	0	0	0	0	108.5
20	D	40.3	Very low	42.6	Very low	152 Å²	152	146 Å²	146	81%	0.813	78%	0.778	S	S	*	*			trans	-145.5	121.2	143.9	-83.5	-44.5	0	0	0	109.5	S18	S18-D20 PolarHBondContact O-N 3.27Å
21	Q	48.4	Very low	43.3	Very low	163 Å²	163	147.1 Å²	147.1	76%	0.762	78%	0.778	S	S	*	*			trans	-39.2	120.4	178.2	-164.2	161.1	1.7	0	0	114.3	E23	Q21-E23 PolarHBondContact O-N 3.18Å
22	E	40.5	Very low	44.2	Very low	190 Å²	190	145.4 Å²	145.4	89%	0.888	77%	0.769	S	S	*	*			trans	-75.3	102.9	166	-69.6	179.3	173.4	0	0	108.4
23	E	43.5	Very low	45	Very low	146 Å²	146	148 Å²	148	68%	0.682	77%	0.77	S	S	*	*			trans	-83.2	109.2	162	-69.7	-172.8	164.8	0	0	107.8	Q21 E25	Q21-E23 PolarHBondContact O-N 3.18Å; E23-E25 PolarHBondContact O-N 3.01Å
24	E	50	Low	45.7	Very low	186 Å²	186	146.4 Å²	146.4	87%	0.869	77%	0.767	S	S	*	*			trans	-69.3	93.6	165.3	-70.4	-171.5	161.6	0	0	108.2	E26	E24-E26 PolarHBondContact O-N 3.14Å; E24-E26 VanDerWaalsContact O-N 3.15Å
25	E	42.5	Very low	46.3	Very low	154 Å²	154	147.3 Å²	147.3	72%	0.72	77%	0.765	S	S	*	*			trans	-72.8	101.2	169.1	-69.1	-170.9	161.5	0	0	109.4	E23 M27	E23-E25 PolarHBondContact O-N 3.01Å; E25-M27 PolarHBondContact O-N 2.84Å; E25-M27 VanDerWaalsContact O-N 3.1Å
26	E	46.1	Very low	47.1	Very low	180 Å²	180	145.5 Å²	145.5	84%	0.841	76%	0.755	S	S	*	*			trans	-55.8	109.9	160.7	-88	-176.2	145.3	0	0	109	E24 I28	E24-E26 PolarHBondContact O-N 3.14Å; E24-E26 VanDerWaalsContact O-N 3.15Å; E26-I28 VanDerWaalsContact C-N 3.3Å; E26-I28 PolarHBondContact O-N 3.1Å
27	M	43.6	Very low	47.7	Very low	157 Å²	157	144 Å²	144	77%	0.773	75%	0.748	S	S	*	*			trans	-67.9	85.6	175.5	-62.6	-73.7	-85.2	0	0	110	E25 F29	E25-M27 PolarHBondContact O-N 2.84Å; E25-M27 VanDerWaalsContact O-N 3.1Å; M27-F29 PolarHBondContact O-N 3.15Å; M27-F29 VanDerWaalsContact O-N 3.14Å
28	I	50.8	Low	48.8	Very low	154 Å²	154	146 Å²	146	79%	0.79	74%	0.744	S	S	*	*			trans	-64.4	107.8	164.2	-88.6	171.2	0	0	0	107.5	E26 G30	E26-I28 VanDerWaalsContact C-N 3.3Å; E26-I28 PolarHBondContact O-N 3.1Å; I28-G30 PolarHBondContact O-N 3.24Å
29	F	45.2	Very low	50	Low	189 Å²	189	148.9 Å²	148.9	83%	0.829	75%	0.749	S	S	*	*			trans	-66.5	98.2	166.6	-83.8	-96.7	0	0	0	107.8	M27 E31	M27-F29 PolarHBondContact O-N 3.15Å; M27-F29 VanDerWaalsContact O-N 3.14Å; F29-E31 PolarHBondContact O-N 3.43Å
30	G	48.8	Very low	50.8	Low	59 Å²	59	148.7 Å²	148.7	61%	0.608	74%	0.74	S	S	*	*			trans	-65.3	108.9	162.3	0	0	0	0	0	108.2	I28 N32	I28-G30 PolarHBondContact O-N 3.24Å; G30-N32 PolarHBondContact O-N 3.34Å
31	E	52	Low	52.1	Low	180 Å²	180	146.4 Å²	146.4	84%	0.841	73%	0.728	S	S	*	*			trans	-66.3	83.6	166.1	-67	174.3	138.9	0	0	107.8	F29 E33	F29-E31 PolarHBondContact O-N 3.43Å; E31-E33 PolarHBondContact O-N 2.9Å
32	N	55.5	Low	53	Low	107 Å²	107	141.5 Å²	141.5	57%	0.572	71%	0.707	S	S	*	*			trans	-78.9	98.4	163.4	-80.5	-17.8	0	0	0	107.3	G30 D34 D35	G30-N32 PolarHBondContact O-N 3.34Å; N32-D34 PolarHBondContact O-N 3.05Å; N32-D35 HydrophobicContact CB-CB 4.34Å; N32-D35 VanDerWaalsContact CB-OD2 3.31Å; N32-D35 WeakPolarHBondContact CB-OD2 3.42Å; N32-D35 PolarHBondContact ND2-OD2 3.39Å; N32-D35 PolarHBondContact O-N 3.25Å
33	E	56.9	Low	54.2	Low	160 Å²	160	136.5 Å²	136.5	75%	0.748	69%	0.693	S	S	*	*	H	α-helix	trans	-57.4	-31	179	-47	176.6	-149.5	0	0	111.4	E31	E31-E33 PolarHBondContact O-N 2.9Å
34	D	54.9	Low	55.9	Low	137 Å²	137	135.9 Å²	135.9	73%	0.733	69%	0.694	S	S	*	*	H	α-helix	trans	-74.5	-30.2	-177.1	-65.2	-43	0	0	0	114.2	N32 L36	N32-D34 PolarHBondContact O-N 3.05Å; D34-L36 VanDerWaalsContact C-N 3.27Å; D34-L36 PolarHBondContact O-N 2.87Å
35	D	54.5	Low	57.5	Low	102 Å²	102	129.6 Å²	129.6	55%	0.545	67%	0.666	S	S	.	*	H	α-helix	trans	-73.1	-22	178.5	-75.3	-46.7	0	0	0	111.8	N32 M39	N32-D35 HydrophobicContact CB-CB 4.34Å; N32-D35 VanDerWaalsContact CB-OD2 3.31Å; N32-D35 WeakPolarHBondContact CB-OD2 3.42Å; N32-D35 PolarHBondContact ND2-OD2 3.39Å; N32-D35 PolarHBondContact O-N 3.25Å; D35-M39 PolarHBondContact O-N 3.45Å
36	L	55.6	Low	59.8	Low	124 Å²	124	123.4 Å²	123.4	65%	0.649	64%	0.64	S	S	*	*	H	α-helix	trans	-78.6	-36	-178.1	-136.9	100.9	0	0	0	112.4	D34 M39	D34-L36 VanDerWaalsContact C-N 3.27Å; D34-L36 PolarHBondContact O-N 2.87Å; L36-M39 PolarHBondContact O-N 2.91Å
37	D	56	Low	62	Low	131 Å²	131	117.4 Å²	117.4	70%	0.701	62%	0.615	S	S	*	*	H	α-helix	trans	-73.5	-35.7	180	-90.5	-28.8	0	0	0	111.8	M39 M40	D37-M39 VanDerWaalsContact C-N 3.3Å; D37-M39 PolarHBondContact O-N 3.44Å; D37-M40 PolarHBondContact O-N 3.39Å
38	E	57.3	Low	64.4	Low	165 Å²	165	110.2 Å²	110.2	77%	0.771	58%	0.58	S	S	*	*	H	α-helix	trans	-71.2	-25.9	175.8	-154.3	171.7	-154.8	0	0	112	M40	E38-M40 VanDerWaalsContact C-N 3.27Å; E38-M40 PolarHBondContact O-N 2.97Å
39	M	59.8	Low	66.5	Low	160 Å²	160	102.9 Å²	102.9	79%	0.788	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.9	-7.3	176.2	-155.8	-175.5	76.9	0	0	113.8	D35 L36 D37	D35-M39 PolarHBondContact O-N 3.45Å; L36-M39 PolarHBondContact O-N 2.91Å; D37-M39 VanDerWaalsContact C-N 3.3Å; D37-M39 PolarHBondContact O-N 3.44Å
40	M	64.6	Low	68.9	Low	126 Å²	126	96.9 Å²	96.9	62%	0.621	52%	0.516	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.5	22.6	-175.3	-111	-176.5	63.4	0	0	114.5	D37 E38 L42	D37-M40 PolarHBondContact O-N 3.39Å; E38-M40 VanDerWaalsContact C-N 3.27Å; E38-M40 PolarHBondContact O-N 2.97Å; M40-L42 PolarHBondContact O-N 3.24Å
41	D	67.1	Low	71.1	Confident	105 Å²	105	94.1 Å²	94.1	56%	0.561	49%	0.488	S	S	*	.			trans	-70.1	96.8	174.5	-168.3	4.4	0	0	0	112	S43	D41-S43 VanDerWaalsContact C-N 3.31Å; D41-S43 VanDerWaalsContact CG-OG 3.26Å; D41-S43 WeakPolarHBondContact OD1-CB 3.31Å; D41-S43 PolarHBondContact OD1-N 3.3Å; D41-S43 PolarHBondContact OD1-OG 3.06Å; D41-S43 PolarHBondContact OD2-OG 3.34Å
42	L	67.2	Low	73.1	Confident	60 Å²	60	86.4 Å²	86.4	31%	0.314	45%	0.454	S	S	.	.			trans	-89.3	4.9	175.6	-56.3	175.7	0	0	0	112.4	M40 D44 L45 E98	M40-L42 PolarHBondContact O-N 3.24Å; L42-D44 VanDerWaalsContact C-N 3.26Å; L42-D44 PolarHBondContact O-N 3.05Å; L42-L45 HydrophobicContact CB-CD1 4.16Å; L42-L45 HydrophobicContact CD2-CD1 3.5Å; L42-L45 VanDerWaalsContact CD2-CD1 3.5Å; L42-L45 HydrophobicContact CG-CD1 4.39Å; L42-L45 WeakPolarHBondContact O-CB 3.36Å; L42-L45 PolarHBondContact O-N 3.45Å; L42-L45 VanDerWaalsContact O-N 3.15Å; L42-E98 HydrophobicContact CD1-CG 4.05Å
43	S	67.5	Low	74.6	Confident	85 Å²	85	84 Å²	84	59%	0.594	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67	-26.7	-175.7	69.9	0	0	0	0	113.4	D41 L45	D41-S43 VanDerWaalsContact C-N 3.31Å; D41-S43 VanDerWaalsContact CG-OG 3.26Å; D41-S43 WeakPolarHBondContact OD1-CB 3.31Å; D41-S43 PolarHBondContact OD1-N 3.3Å; D41-S43 PolarHBondContact OD1-OG 3.06Å; D41-S43 PolarHBondContact OD2-OG 3.34Å; S43-L45 VanDerWaalsContact C-N 3.31Å
44	D	77.4	Confident	76.2	Confident	133 Å²	133	76.4 Å²	76.4	71%	0.711	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.3	-11	175.8	-78.7	-8	0	0	0	113.6	L42	L42-D44 VanDerWaalsContact C-N 3.26Å; L42-D44 PolarHBondContact O-N 3.05Å
45	L	84.8	Confident	78	Confident	53 Å²	53	72.9 Å²	72.9	28%	0.277	39%	0.388	S	S	.	.	S	Bend	trans	-77.8	138.5	-177.1	-68.7	177.9	0	0	0	111.8	L42 S43 P97 A101 F121	L42-L45 HydrophobicContact CB-CD1 4.16Å; L42-L45 HydrophobicContact CD2-CD1 3.5Å; L42-L45 VanDerWaalsContact CD2-CD1 3.5Å; L42-L45 HydrophobicContact CG-CD1 4.39Å; L42-L45 WeakPolarHBondContact O-CB 3.36Å; L42-L45 PolarHBondContact O-N 3.45Å; L42-L45 VanDerWaalsContact O-N 3.15Å; S43-L45 VanDerWaalsContact C-N 3.31Å; L45-P97 HydrophobicContact CB-CB 4.34Å; L45-P97 VanDerWaalsContact O-CB 3.3Å; L45-P97 WeakPolarHBondContact O-CB 3.45Å; L45-A101 HydrophobicContact CD1-CB 3.89Å; L45-F121 HydrophobicContact CD1-CE2 4.5Å; L45-F121 HydrophobicContact CD1-CZ 4.11Å; L45-F121 HydrophobicContact CD2-CD2 4.3Å; L45-F121 HydrophobicContact CD2-CE2 3.78Å; L45-F121 HydrophobicContact CD2-CZ 4.02Å; L45-F121 HydrophobicContact CG-CZ 4.47Å
46	P	90.3	Very high	79.7	Confident	25 Å²	25	71.7 Å²	71.7	16%	0.162	38%	0.38	C	S	.	.			trans	-75.7	147.7	177.8	31.4	-33.2	0	0	0	111.1	S48 F121 A122 V124	P46-S48 PolarHBondContact O-N 2.94Å; P46-F121 HydrophobicContact CG-CB 3.59Å; P46-F121 HydrophobicContact CG-CD1 3.6Å; P46-F121 HydrophobicContact CG-CE1 4.49Å; P46-F121 HydrophobicContact CG-CG 3.81Å; P46-A122 VanDerWaalsContact CB-O 3.31Å; P46-A122 WeakPolarHBondContact CB-O 3.42Å; P46-A122 WeakPolarHBondContact CG-O 3.36Å; P46-V124 HydrophobicContact CB-CG2 3.49Å; P46-V124 VanDerWaalsContact CB-CG2 3.49Å
47	T	92.4	Very high	81.4	Confident	53 Å²	53	67 Å²	67	33%	0.325	36%	0.359	S	S	.	.	S	Bend	trans	-76.3	-2.9	179.4	60.1	0	0	0	0	113.9	F94 P97	T47-F94 WeakPolarHBondContact CB-O 3.44Å; T47-F94 WeakPolarHBondContact O-CB 3.37Å; T47-F94 WeakPolarHBondContact O-CD2 3.43Å; T47-F94 PolarHBondContact O-N 3.4Å; T47-P97 HydrophobicContact CG2-CB 4.15Å; T47-P97 HydrophobicContact CG2-CG 4.49Å
48	S	94.3	Very high	83.1	Confident	6 Å²	6	60.9 Å²	60.9	4%	0.042	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	139.9	-172.4	-62.9	0	0	0	0	111.7	P46 I92 N93 A122	P46-S48 PolarHBondContact O-N 2.94Å; S48-I92 CarbonylContact C-O 3.56Å; S48-I92 VanDerWaalsContact CA-O 3.27Å; S48-I92 WeakPolarHBondContact CA-O 3.33Å; S48-N93 WeakPolarHBondContact CB-OD1 3.4Å; S48-N93 PolarHBondContact OG-OD1 3.05Å; S48-A122 WeakPolarHBondContact O-CB 3.26Å; S48-A122 PolarHBondContact O-N 3.16Å
49	L	95.3	Very high	84.8	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	151.9	172.4	-64.3	179.6	0	0	0	111.6	R91 I92 F94 A100 A103 R104 L119 Y120 F121	L49-R91 CarbonylContact O-C 3.6Å; L49-R91 WeakPolarHBondContact O-CA 2.85Å; L49-I92 HydrophobicContact CB-CB 4.48Å; L49-I92 PolarHBondContact N-O 3.35Å; L49-I92 PolarHBondContact O-N 3.08Å; L49-F94 HydrophobicContact CB-CE2 4.29Å; L49-F94 HydrophobicContact CD1-CE2 3.76Å; L49-F94 HydrophobicContact CD1-CZ 4.23Å; L49-F94 HydrophobicContact CG-CE2 3.91Å; L49-A100 HydrophobicContact CG-CB 4.24Å; L49-A103 HydrophobicContact CD1-CB 4.46Å; L49-R104 HydrophobicContact CD1-CB 4.08Å; L49-R104 HydrophobicContact CD2-CB 4.22Å; L49-L119 HydrophobicContact CD1-CD1 4.43Å; L49-Y120 CarbonylContact C-O 3.59Å; L49-Y120 VanDerWaalsContact CA-O 3.29Å; L49-Y120 WeakPolarHBondContact CA-O 3.41Å; L49-F121 HydrophobicContact CD2-CD1 3.33Å; L49-F121 HydrophobicContact CD2-CE1 3.6Å; L49-F121 HydrophobicContact CD2-CG 3.97Å; L49-F121 HydrophobicContact CD2-CZ 4.42Å
50	F	95.5	Very high	86.3	Confident	64 Å²	64	52.9 Å²	52.9	28%	0.281	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	118.6	162.5	-78.6	-73.9	0	0	0	109.7	F84 V90 R91 L119 Y120 A122	F50-F84 HydrophobicContact CE1-CE2 4.25Å; F50-V90 WeakPolarHBondContact CA-O 3.09Å; F50-R91 HydrophobicContact CD1-CB 3.94Å; F50-R91 HydrophobicContact CE1-CB 3.66Å; F50-R91 HydrophobicContact CE1-CG 4.15Å; F50-R91 HydrophobicContact CZ-CB 4.36Å; F50-R91 HydrophobicContact CZ-CG 4.38Å; F50-L119 CarbonylContact O-C 3.59Å; F50-L119 WeakPolarHBondContact O-CA 3.24Å; F50-Y120 PolarHBondContact N-O 3.25Å; F50-Y120 PolarHBondContact O-N 2.7Å; F50-A122 HydrophobicContact CD2-CB 3.57Å; F50-A122 HydrophobicContact CE2-CB 3.42Å; F50-A122 VanDerWaalsContact CE2-CB 3.42Å; F50-A122 HydrophobicContact CZ-CB 4.42Å
51	A	95.3	Very high	87.7	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	114.8	162.7	0	0	0	0	0	109.7	V54 F68 R89 V90 I92 L117 L119	A51-V54 HydrophobicContact CB-CG2 3.81Å; A51-F68 HydrophobicContact CB-CZ 3.9Å; A51-R89 CarbonylContact O-C 3.24Å; A51-R89 WeakPolarHBondContact O-CA 3.48Å; A51-V90 HydrophobicContact CB-CB 4.33Å; A51-V90 PolarHBondContact N-O 2.85Å; A51-V90 PolarHBondContact O-N 2.94Å; A51-I92 HydrophobicContact CB-CD1 4.05Å; A51-L117 HydrophobicContact CB-CD1 4.02Å; A51-L119 HydrophobicContact CB-CD2 3.64Å
52	C	92.3	Very high	88.9	Confident	19 Å²	19	49 Å²	49	13%	0.128	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	154.8	175.2	-71.5	0	0	0	0	110.3	V54 K118 Y120	C52-V54 VanDerWaalsContact C-N 3.33Å; C52-K118 HydrophobicContact CB-CB 4.05Å; C52-K118 PolarHBondContact N-O 2.72Å; C52-K118 PolarHBondContact O-N 3.42Å; C52-K118 VanDerWaalsContact O-N 3.17Å; C52-Y120 HydrophobicContact CB-CD2 4.16Å; C52-Y120 HydrophobicContact CB-CE2 3.85Å
53	S	87.2	Confident	90.2	Very high	56 Å²	56	51.6 Å²	51.6	39%	0.392	28%	0.281	S	S	.	.	S	Bend	trans	61.4	41	-179	-164.6	0	0	0	0	112.8	R88 Q115	S53-R88 PolarHBondContact N-O 3.15Å; S53-Q115 PolarHBondContact O-OE1 3.01Å
54	V	91.8	Very high	91.4	Very high	1 Å²	1	49.7 Å²	49.7	1%	0.006	26%	0.263	C	S	.	.			trans	-77.3	134.2	176.7	-177.1	0	0	0	0	109.4	A51 C52 V58 F59 F68 R88 V90 L117	A51-V54 HydrophobicContact CB-CG2 3.81Å; C52-V54 VanDerWaalsContact C-N 3.33Å; V54-V58 HydrophobicContact CG1-CB 3.7Å; V54-V58 HydrophobicContact CG1-CG1 3.83Å; V54-V58 HydrophobicContact CG1-CG2 3.71Å; V54-F59 HydrophobicContact CB-CE2 3.87Å; V54-F59 HydrophobicContact CB-CZ 4.03Å; V54-F59 HydrophobicContact CG1-CE2 3.84Å; V54-F59 HydrophobicContact CG1-CZ 4.14Å; V54-F68 HydrophobicContact CG1-CD2 4.42Å; V54-F68 HydrophobicContact CG1-CE2 4.15Å; V54-F68 HydrophobicContact CG1-CZ 4.48Å; V54-F68 HydrophobicContact CG2-CE2 4.29Å; V54-F68 HydrophobicContact CG2-CZ 4.23Å; V54-R88 PolarHBondContact N-O 3.36Å; V54-V90 HydrophobicContact CG1-CG2 4.41Å; V54-V90 HydrophobicContact CG2-CG2 4.14Å; V54-L117 HydrophobicContact CG2-CD1 4.04Å
55	H	92.2	Very high	92.1	Very high	62 Å²	62	46.1 Å²	46.1	29%	0.287	24%	0.241	S	C	.	.			trans	-60	141.7	-179.8	-168.4	-85.9	0	0	0	111.4	A57 V58 N113	H55-A57 VanDerWaalsContact ND1-CB 3.33Å; H55-A57 WeakPolarHBondContact ND1-CB 3.15Å; H55-A57 PolarHBondContact ND1-N 2.97Å; H55-A57 PolarHBondContact O-N 3.44Å; H55-V58 WeakPolarHBondContact O-CB 3.42Å; H55-V58 PolarHBondContact O-N 3.25Å; H55-V58 VanDerWaalsContact O-N 3.08Å; H55-N113 HydrophobicContact CB-CB 3.89Å; H55-N113 PolarHBondContact CD2-O 3.16Å
56	E	91.1	Very high	92.6	Very high	77 Å²	77	48.5 Å²	48.5	36%	0.36	25%	0.251	S	S	.	.	G	3₁₀ helix	trans	-59.6	-33.5	-173.5	-175.1	157	-168.6	0	0	113.1	V58 F59 E60 R88	E56-V58 PolarHBondContact O-N 2.6Å; E56-V58 VanDerWaalsContact O-N 3.13Å; E56-F59 WeakPolarHBondContact O-CB 3.37Å; E56-F59 PolarHBondContact O-N 3.37Å; E56-E60 HydrophobicContact CG-CG 4.29Å; E56-E60 PolarHBondContact O-N 3.16Å; E56-R88 IonicContact OE2-CZ 3.71Å; E56-R88 IonicContact OE2-NH2 2.77Å; E56-R88 PolarHBondContact OE2-NH2 3.22Å
57	A	90.4	Very high	92.8	Very high	27 Å²	27	54.1 Å²	54.1	22%	0.223	27%	0.269	C	S	.	.	G	3₁₀ helix	trans	-55.1	-31.2	177.3	0	0	0	0	0	113.6	H55 F59 E60 A61 E64	H55-A57 VanDerWaalsContact ND1-CB 3.33Å; H55-A57 WeakPolarHBondContact ND1-CB 3.15Å; H55-A57 PolarHBondContact ND1-N 2.97Å; H55-A57 PolarHBondContact O-N 3.44Å; A57-F59 PolarHBondContact O-N 2.93Å; A57-E60 PolarHBondContact O-N 3.37Å; A57-E60 VanDerWaalsContact O-N 3.15Å; A57-A61 PolarHBondContact O-N 3.3Å; A57-E64 HydrophobicContact CB-CB 4.29Å; A57-E64 HydrophobicContact CB-CG 3.99Å
58	V	91.9	Very high	92.9	Very high	1 Å²	1	51.7 Å²	51.7	1%	0.006	25%	0.253	C	S	.	.	G	3₁₀ helix	trans	-63	-24.6	176.2	-179.9	0	0	0	0	112	V54 H55 E56 K65 F68 F112	V54-V58 HydrophobicContact CG1-CB 3.7Å; V54-V58 HydrophobicContact CG1-CG1 3.83Å; V54-V58 HydrophobicContact CG1-CG2 3.71Å; H55-V58 WeakPolarHBondContact O-CB 3.42Å; H55-V58 PolarHBondContact O-N 3.25Å; H55-V58 VanDerWaalsContact O-N 3.08Å; E56-V58 PolarHBondContact O-N 2.6Å; E56-V58 VanDerWaalsContact O-N 3.13Å; V58-K65 WeakPolarHBondContact O-CB 3.24Å; V58-F68 HydrophobicContact CG1-CB 3.81Å; V58-F68 HydrophobicContact CG1-CD1 4.02Å; V58-F68 HydrophobicContact CG1-CD2 4.39Å; V58-F68 HydrophobicContact CG1-CG 3.81Å; V58-F68 HydrophobicContact CG2-CB 4.19Å; V58-F68 HydrophobicContact CG2-CD2 4.41Å; V58-F68 HydrophobicContact CG2-CG 4.41Å; V58-F112 HydrophobicContact CG2-CD1 4.42Å; V58-F112 HydrophobicContact CG2-CE1 3.54Å; V58-F112 HydrophobicContact CG2-CZ 4.34Å
59	F	91.9	Very high	93	Very high	31 Å²	31	53.4 Å²	53.4	14%	0.136	26%	0.261	C	S	.	.	G	3₁₀ helix	trans	-96.5	-8.6	179.7	-56.6	-86.6	0	0	0	113.5	V54 E56 A57 L83 K85 R88 V90	V54-F59 HydrophobicContact CB-CE2 3.87Å; V54-F59 HydrophobicContact CB-CZ 4.03Å; V54-F59 HydrophobicContact CG1-CE2 3.84Å; V54-F59 HydrophobicContact CG1-CZ 4.14Å; E56-F59 WeakPolarHBondContact O-CB 3.37Å; E56-F59 PolarHBondContact O-N 3.37Å; A57-F59 PolarHBondContact O-N 2.93Å; F59-L83 HydrophobicContact CD1-CB 4.03Å; F59-L83 HydrophobicContact CD1-CD2 3.91Å; F59-L83 HydrophobicContact CE1-CB 3.93Å; F59-L83 HydrophobicContact CE1-CD2 4.15Å; F59-L83 HydrophobicContact CE1-CG 4.43Å; F59-K85 HydrophobicContact CB-CB 4.3Å; F59-K85 HydrophobicContact CB-CD 4.05Å; F59-K85 HydrophobicContact CB-CG 3.93Å; F59-K85 HydrophobicContact CD1-CB 3.92Å; F59-K85 HydrophobicContact CD1-CG 4.38Å; F59-K85 HydrophobicContact CG-CB 4.24Å; F59-K85 HydrophobicContact CG-CG 4.19Å; F59-R88 HydrophobicContact CE2-CB 4.48Å; F59-V90 HydrophobicContact CE1-CG2 3.94Å; F59-V90 HydrophobicContact CZ-CG2 3.87Å
60	E	91.8	Very high	92.9	Very high	127 Å²	127	55.7 Å²	55.7	59%	0.593	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.2	-42.3	-174.5	-55	-152.1	142.5	0	0	112.8	E56 A57 K85	E56-E60 HydrophobicContact CG-CG 4.29Å; E56-E60 PolarHBondContact O-N 3.16Å; A57-E60 PolarHBondContact O-N 3.37Å; A57-E60 VanDerWaalsContact O-N 3.15Å; E60-K85 IonicContact OE1-NZ 2.72Å; E60-K85 PolarHBondContact OE1-NZ 2.93Å
61	A	93.3	Very high	92.9	Very high	41 Å²	41	54.9 Å²	54.9	34%	0.339	28%	0.278	S	S	.	.			trans	-100.3	124.7	-177.9	0	0	0	0	0	110.4	A57 E63 E64 K65	A57-A61 PolarHBondContact O-N 3.3Å; A61-E63 VanDerWaalsContact C-N 3.31Å; A61-E63 PolarHBondContact O-N 3.39Å; A61-E64 HydrophobicContact CB-CB 4.14Å; A61-E64 HydrophobicContact CB-CG 4.01Å; A61-E64 PolarHBondContact O-N 3.46Å; A61-K65 PolarHBondContact O-N 3.32Å
62	Q	93.3	Very high	92.9	Very high	109 Å²	109	54.9 Å²	54.9	51%	0.509	28%	0.278	S	S	.	.	H	α-helix	trans	-62.4	-37.1	179.3	-178.3	61.2	22.9	0	0	112.2	K65 E66	Q62-K65 WeakPolarHBondContact O-CB 3.48Å; Q62-K65 PolarHBondContact O-N 3.02Å; Q62-E66 WeakPolarHBondContact CG-OE1 3.3Å; Q62-E66 PolarHBondContact NE2-OE1 3.33Å; Q62-E66 WeakPolarHBondContact O-CG 3.37Å; Q62-E66 PolarHBondContact O-N 3.18Å
63	E	94.1	Very high	93	Very high	114 Å²	114	56.9 Å²	56.9	53%	0.533	29%	0.29	S	S	.	.	H	α-helix	trans	-64.3	-43.1	178	-170.4	-174.7	163.6	0	0	112	A61 K65 E66 R67	A61-E63 VanDerWaalsContact C-N 3.31Å; A61-E63 PolarHBondContact O-N 3.39Å; E63-K65 VanDerWaalsContact C-N 3.31Å; E63-K65 PolarHBondContact O-N 3.4Å; E63-E66 PolarHBondContact O-N 3.39Å; E63-R67 WeakPolarHBondContact O-CG 3.45Å; E63-R67 PolarHBondContact O-N 2.95Å; E63-R67 IonicContact OE1-CZ 3.59Å; E63-R67 IonicContact OE1-NE 3.39Å; E63-R67 PolarHBondContact OE1-NE 3.35Å; E63-R67 IonicContact OE1-NH2 2.87Å; E63-R67 PolarHBondContact OE1-NH2 3.49Å
64	E	92.6	Very high	93.4	Very high	44 Å²	44	60.7 Å²	60.7	21%	0.206	30%	0.304	C	S	.	.	H	α-helix	trans	-68.4	-34.7	178.2	-67.9	-61.2	155.2	0	0	111.9	A57 A61 F68 N113	A57-E64 HydrophobicContact CB-CB 4.29Å; A57-E64 HydrophobicContact CB-CG 3.99Å; A61-E64 HydrophobicContact CB-CB 4.14Å; A61-E64 HydrophobicContact CB-CG 4.01Å; A61-E64 PolarHBondContact O-N 3.46Å; E64-F68 WeakPolarHBondContact O-CB 3.43Å; E64-F68 PolarHBondContact O-N 3.06Å; E64-N113 PolarHBondContact OE2-ND2 2.73Å
65	K	93.6	Very high	93.5	Very high	58 Å²	58	62.2 Å²	62.2	25%	0.252	31%	0.31	S	S	.	.	H	α-helix	trans	-61.6	-49.6	171.6	-175.7	-174.3	165	-170.2	0	111.3	V58 A61 Q62 E63 R67 F68 E69 L83	V58-K65 WeakPolarHBondContact O-CB 3.24Å; A61-K65 PolarHBondContact O-N 3.32Å; Q62-K65 WeakPolarHBondContact O-CB 3.48Å; Q62-K65 PolarHBondContact O-N 3.02Å; E63-K65 VanDerWaalsContact C-N 3.31Å; E63-K65 PolarHBondContact O-N 3.4Å; K65-R67 VanDerWaalsContact C-N 3.34Å; K65-R67 PolarHBondContact O-N 3.49Å; K65-F68 WeakPolarHBondContact O-CB 3.38Å; K65-F68 PolarHBondContact O-N 3.49Å; K65-E69 WeakPolarHBondContact CE-OE1 3.42Å; K65-E69 HydrophobicContact CG-CG 4.48Å; K65-E69 IonicContact NZ-OE1 3.76Å; K65-E69 WeakPolarHBondContact O-CG 3.39Å; K65-E69 PolarHBondContact O-N 3.33Å; K65-L83 HydrophobicContact CD-CD2 4.44Å; K65-L83 HydrophobicContact CG-CD2 4.48Å
66	E	94.6	Very high	93.5	Very high	103 Å²	103	60.4 Å²	60.4	48%	0.481	30%	0.303	S	S	.	.	H	α-helix	trans	-62.7	-41.2	179.4	-74	170.1	-169.3	0	0	111.7	Q62 E63 F68 E69 A70	Q62-E66 WeakPolarHBondContact CG-OE1 3.3Å; Q62-E66 PolarHBondContact NE2-OE1 3.33Å; Q62-E66 WeakPolarHBondContact O-CG 3.37Å; Q62-E66 PolarHBondContact O-N 3.18Å; E63-E66 PolarHBondContact O-N 3.39Å; E66-F68 VanDerWaalsContact C-N 3.32Å; E66-F68 PolarHBondContact O-N 2.81Å; E66-E69 PolarHBondContact O-N 2.95Å; E66-A70 VanDerWaalsContact O-CB 3.26Å; E66-A70 WeakPolarHBondContact O-CB 3.41Å; E66-A70 PolarHBondContact O-N 2.95Å
67	R	94.4	Very high	93.6	Very high	143 Å²	143	63.4 Å²	63.4	54%	0.54	32%	0.321	S	S	.	.	H	α-helix	trans	-60.2	-41.7	173	-74.8	178	-173.7	-113.1	4	112.3	E63 K65	E63-R67 WeakPolarHBondContact O-CG 3.45Å; E63-R67 PolarHBondContact O-N 2.95Å; E63-R67 IonicContact OE1-CZ 3.59Å; E63-R67 IonicContact OE1-NE 3.39Å; E63-R67 PolarHBondContact OE1-NE 3.35Å; E63-R67 IonicContact OE1-NH2 2.87Å; E63-R67 PolarHBondContact OE1-NH2 3.49Å; K65-R67 VanDerWaalsContact C-N 3.34Å; K65-R67 PolarHBondContact O-N 3.49Å
68	F	94.9	Very high	93.7	Very high	2 Å²	2	68.9 Å²	68.9	1%	0.009	34%	0.342	C	S	.	.	H	α-helix	trans	-66.6	-46.6	177.3	178.8	-92.9	0	0	0	111.9	A51 V54 V58 E64 K65 E66 A70 L71 F72 V90 I92 F112 L117	A51-F68 HydrophobicContact CB-CZ 3.9Å; V54-F68 HydrophobicContact CG1-CD2 4.42Å; V54-F68 HydrophobicContact CG1-CE2 4.15Å; V54-F68 HydrophobicContact CG1-CZ 4.48Å; V54-F68 HydrophobicContact CG2-CE2 4.29Å; V54-F68 HydrophobicContact CG2-CZ 4.23Å; V58-F68 HydrophobicContact CG1-CB 3.81Å; V58-F68 HydrophobicContact CG1-CD1 4.02Å; V58-F68 HydrophobicContact CG1-CD2 4.39Å; V58-F68 HydrophobicContact CG1-CG 3.81Å; V58-F68 HydrophobicContact CG2-CB 4.19Å; V58-F68 HydrophobicContact CG2-CD2 4.41Å; V58-F68 HydrophobicContact CG2-CG 4.41Å; E64-F68 WeakPolarHBondContact O-CB 3.43Å; E64-F68 PolarHBondContact O-N 3.06Å; K65-F68 WeakPolarHBondContact O-CB 3.38Å; K65-F68 PolarHBondContact O-N 3.49Å; E66-F68 VanDerWaalsContact C-N 3.32Å; E66-F68 PolarHBondContact O-N 2.81Å; F68-A70 VanDerWaalsContact C-N 3.31Å; F68-A70 PolarHBondContact O-N 3.4Å; F68-L71 WeakPolarHBondContact O-CB 3.47Å; F68-L71 PolarHBondContact O-N 2.87Å; F68-F72 HydrophobicContact CD1-CE2 4.34Å; F68-F72 HydrophobicContact CD2-CE2 4.41Å; F68-F72 HydrophobicContact CE1-CD2 4.2Å; F68-F72 AromaticContact CE1-CE2 3.75Å; F68-F72 HydrophobicContact CE1-CE2 3.75Å; F68-F72 AromaticContact CE2-CE2 3.85Å; F68-F72 HydrophobicContact CE2-CE2 3.85Å; F68-F72 HydrophobicContact CZ-CD2 4.37Å; F68-F72 AromaticContact CZ-CE2 3.48Å; F68-F72 HydrophobicContact CZ-CE2 3.48Å; F68-F72 VanDerWaalsContact CZ-CE2 3.48Å; F68-F72 HydrophobicContact CZ-CZ 4.19Å; F68-F72 WeakPolarHBondContact O-CD2 3.39Å; F68-V90 HydrophobicContact CE1-CB 4.17Å; F68-V90 HydrophobicContact CE1-CG1 4.09Å; F68-V90 HydrophobicContact CE1-CG2 4.19Å; F68-V90 HydrophobicContact CZ-CB 4.42Å; F68-V90 HydrophobicContact CZ-CG2 4.47Å; F68-I92 HydrophobicContact CZ-CD1 4.46Å; F68-F112 HydrophobicContact CB-CE1 4.21Å; F68-F112 HydrophobicContact CB-CZ 3.82Å; F68-F112 HydrophobicContact CD2-CD1 4.23Å; F68-F112 AromaticContact CD2-CE1 3.95Å; F68-F112 HydrophobicContact CD2-CE1 3.95Å; F68-F112 HydrophobicContact CD2-CZ 4.15Å; F68-L117 HydrophobicContact CE2-CD1 3.96Å; F68-L117 HydrophobicContact CE2-CD2 4.27Å
69	E	94.8	Very high	93.8	Very high	42 Å²	42	69.8 Å²	69.8	20%	0.196	35%	0.348	C	S	.	.	H	α-helix	trans	-62.3	-40.2	178.7	-70.8	-179.1	173.4	0	0	111.1	K65 E66 L71 F72 T73 F81	K65-E69 WeakPolarHBondContact CE-OE1 3.42Å; K65-E69 HydrophobicContact CG-CG 4.48Å; K65-E69 IonicContact NZ-OE1 3.76Å; K65-E69 WeakPolarHBondContact O-CG 3.39Å; K65-E69 PolarHBondContact O-N 3.33Å; E66-E69 PolarHBondContact O-N 2.95Å; E69-L71 PolarHBondContact O-N 3.17Å; E69-L71 VanDerWaalsContact O-N 3.16Å; E69-F72 PolarHBondContact O-N 3.47Å; E69-T73 PolarHBondContact O-N 2.74Å; E69-T73 PolarHBondContact O-OG1 3.47Å; E69-T73 VanDerWaalsContact O-OG1 3.05Å; E69-F81 HydrophobicContact CB-CD2 4.32Å; E69-F81 HydrophobicContact CB-CE1 4.31Å; E69-F81 HydrophobicContact CB-CE2 3.81Å; E69-F81 HydrophobicContact CB-CZ 3.8Å; E69-F81 HydrophobicContact CG-CD1 4.06Å; E69-F81 HydrophobicContact CG-CD2 3.75Å; E69-F81 HydrophobicContact CG-CE1 4.06Å; E69-F81 HydrophobicContact CG-CE2 3.76Å; E69-F81 HydrophobicContact CG-CG 3.9Å; E69-F81 HydrophobicContact CG-CZ 3.91Å
70	A	94.8	Very high	94	Very high	49 Å²	49	71.9 Å²	71.9	41%	0.405	36%	0.363	S	S	.	.	H	α-helix	trans	-57.8	-29.7	177.6	0	0	0	0	0	113.6	E66 F68 F72 I74	E66-A70 VanDerWaalsContact O-CB 3.26Å; E66-A70 WeakPolarHBondContact O-CB 3.41Å; E66-A70 PolarHBondContact O-N 2.95Å; F68-A70 VanDerWaalsContact C-N 3.31Å; F68-A70 PolarHBondContact O-N 3.4Å; A70-F72 PolarHBondContact O-N 2.97Å; A70-I74 WeakPolarHBondContact O-CD1 3.37Å; A70-I74 WeakPolarHBondContact O-CG1 3.47Å
71	L	93.9	Very high	94.2	Very high	47 Å²	47	67.8 Å²	67.8	25%	0.246	34%	0.344	C	S	.	.	H	α-helix	trans	-59.7	-37.5	174.5	-66.6	172.8	0	0	0	111.7	F68 E69 Y75 L107 F112	F68-L71 WeakPolarHBondContact O-CB 3.47Å; F68-L71 PolarHBondContact O-N 2.87Å; E69-L71 PolarHBondContact O-N 3.17Å; E69-L71 VanDerWaalsContact O-N 3.16Å; L71-Y75 WeakPolarHBondContact O-CD2 3.36Å; L71-Y75 WeakPolarHBondContact O-CE2 3.39Å; L71-L107 HydrophobicContact CB-CD1 4.1Å; L71-F112 HydrophobicContact CD1-CD2 3.63Å; L71-F112 HydrophobicContact CD1-CE2 3.77Å; L71-F112 HydrophobicContact CD1-CG 4.5Å
72	F	95.4	Very high	94.2	Very high	0 Å²	0	70 Å²	70	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-93.1	-28.4	-174.9	-62.2	-78.2	0	0	0	112.8	F68 E69 A70 I74 Y75 V79 F81 I92 F94 A103 L107 L117 L119	F68-F72 HydrophobicContact CD1-CE2 4.34Å; F68-F72 HydrophobicContact CD2-CE2 4.41Å; F68-F72 HydrophobicContact CE1-CD2 4.2Å; F68-F72 AromaticContact CE1-CE2 3.75Å; F68-F72 HydrophobicContact CE1-CE2 3.75Å; F68-F72 AromaticContact CE2-CE2 3.85Å; F68-F72 HydrophobicContact CE2-CE2 3.85Å; F68-F72 HydrophobicContact CZ-CD2 4.37Å; F68-F72 AromaticContact CZ-CE2 3.48Å; F68-F72 HydrophobicContact CZ-CE2 3.48Å; F68-F72 VanDerWaalsContact CZ-CE2 3.48Å; F68-F72 HydrophobicContact CZ-CZ 4.19Å; F68-F72 WeakPolarHBondContact O-CD2 3.39Å; E69-F72 PolarHBondContact O-N 3.47Å; A70-F72 PolarHBondContact O-N 2.97Å; F72-I74 PolarHBondContact O-N 2.9Å; F72-Y75 PolarHBondContact O-N 3.46Å; F72-Y75 VanDerWaalsContact O-N 3.16Å; F72-V79 HydrophobicContact CB-CG1 4.46Å; F72-F81 HydrophobicContact CB-CE1 3.91Å; F72-F81 HydrophobicContact CB-CZ 3.91Å; F72-F81 AromaticContact CD2-CE1 3.97Å; F72-F81 HydrophobicContact CD2-CE1 3.97Å; F72-F81 HydrophobicContact CG-CE1 4.21Å; F72-I92 HydrophobicContact CB-CG2 4.32Å; F72-I92 HydrophobicContact CD1-CD1 3.85Å; F72-I92 HydrophobicContact CD1-CG2 4.42Å; F72-I92 HydrophobicContact CD2-CD1 3.85Å; F72-I92 HydrophobicContact CE1-CD1 3.57Å; F72-I92 HydrophobicContact CE2-CD1 3.61Å; F72-I92 HydrophobicContact CG-CD1 3.96Å; F72-I92 HydrophobicContact CG-CG2 4.29Å; F72-I92 HydrophobicContact CZ-CD1 3.44Å; F72-I92 VanDerWaalsContact CZ-CD1 3.44Å; F72-F94 HydrophobicContact CB-CE1 4.4Å; F72-F94 HydrophobicContact CB-CZ 4.36Å; F72-F94 AromaticContact CD1-CZ 3.86Å; F72-F94 HydrophobicContact CD1-CZ 3.86Å; F72-A103 HydrophobicContact CD1-CB 4.28Å; F72-L107 HydrophobicContact CD1-CD1 3.8Å; F72-L107 HydrophobicContact CE1-CD1 3.49Å; F72-L107 VanDerWaalsContact CE1-CD1 3.49Å; F72-L107 HydrophobicContact CG-CD1 4.5Å; F72-L107 HydrophobicContact CZ-CD1 3.91Å; F72-L117 HydrophobicContact CZ-CD2 3.96Å; F72-L119 HydrophobicContact CE1-CD1 4Å; F72-L119 HydrophobicContact CE1-CD2 4.22Å; F72-L119 HydrophobicContact CZ-CD1 4.34Å; F72-L119 HydrophobicContact CZ-CD2 4.02Å
73	T	95.1	Very high	94.3	Very high	60 Å²	60	67.6 Å²	67.6	37%	0.368	34%	0.337	S	S	.	.	H	α-helix	trans	-63.7	-22.1	177.3	-51	0	0	0	0	112.9	E69 Y75 D76	E69-T73 PolarHBondContact O-N 2.74Å; E69-T73 PolarHBondContact O-OG1 3.47Å; E69-T73 VanDerWaalsContact O-OG1 3.05Å; T73-Y75 PolarHBondContact O-N 2.96Å; T73-D76 CarbonylContact C-O 3.48Å; T73-D76 WeakPolarHBondContact CA-O 3.44Å; T73-D76 CarbonylContact O-C 3.58Å; T73-D76 PolarHBondContact O-N 2.87Å; T73-D76 VanDerWaalsContact O-O 3.05Å
74	I	94.7	Very high	94.2	Very high	136 Å²	136	66 Å²	66	70%	0.697	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-28.7	175.8	-63.2	158.9	0	0	0	112	A70 F72	A70-I74 WeakPolarHBondContact O-CD1 3.37Å; A70-I74 WeakPolarHBondContact O-CG1 3.47Å; F72-I74 PolarHBondContact O-N 2.9Å
75	Y	93.8	Very high	94.2	Very high	34 Å²	34	68.6 Å²	68.6	13%	0.133	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.6	-25.5	-176.8	-58.4	-80.6	0	0	0	113.3	L71 F72 T73 R102 A103 E106 L107	L71-Y75 WeakPolarHBondContact O-CD2 3.36Å; L71-Y75 WeakPolarHBondContact O-CE2 3.39Å; F72-Y75 PolarHBondContact O-N 3.46Å; F72-Y75 VanDerWaalsContact O-N 3.16Å; T73-Y75 PolarHBondContact O-N 2.96Å; Y75-R102 HydrophobicContact CD1-CB 4.27Å; Y75-A103 HydrophobicContact CD1-CB 4.4Å; Y75-A103 HydrophobicContact CD2-CB 3.71Å; Y75-A103 HydrophobicContact CE2-CB 3.98Å; Y75-A103 HydrophobicContact CG-CB 3.94Å; Y75-E106 VanDerWaalsContact CE1-OE2 3.24Å; Y75-E106 WeakPolarHBondContact CE1-OE2 3.35Å; Y75-E106 WeakPolarHBondContact OH-CG 3.31Å; Y75-E106 PolarHBondContact OH-OE2 2.69Å; Y75-L107 HydrophobicContact CE2-CD1 3.78Å; Y75-L107 HydrophobicContact CE2-CG 4.26Å
76	D	94.2	Very high	94.1	Very high	24 Å²	24	71.4 Å²	71.4	13%	0.128	37%	0.366	C	S	.	.			trans	-159.3	134	-176.8	-173.4	-6.1	0	0	0	110.2	T73 Q78 V79 F94 S95 A99	T73-D76 CarbonylContact C-O 3.48Å; T73-D76 WeakPolarHBondContact CA-O 3.44Å; T73-D76 CarbonylContact O-C 3.58Å; T73-D76 PolarHBondContact O-N 2.87Å; T73-D76 VanDerWaalsContact O-O 3.05Å; D76-Q78 VanDerWaalsContact C-N 3.33Å; D76-Q78 PolarHBondContact OD1-N 2.87Å; D76-V79 HydrophobicContact CB-CG2 3.66Å; D76-V79 VanDerWaalsContact O-CG2 3.24Å; D76-V79 WeakPolarHBondContact O-CG2 3.48Å; D76-F94 HydrophobicContact CB-CD1 3.95Å; D76-S95 WeakPolarHBondContact OD2-CA 3.22Å; D76-S95 VanDerWaalsContact OD2-CB 3.3Å; D76-S95 WeakPolarHBondContact OD2-CB 3.31Å; D76-S95 PolarHBondContact OD2-N 3.33Å; D76-A99 HydrophobicContact CB-CB 4.1Å
77	D	91.9	Very high	93.8	Very high	140 Å²	140	73.5 Å²	73.5	75%	0.749	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.7	-20.4	179.9	-64.3	-36.2	0	0	0	112.4
78	Q	92.1	Very high	93.7	Very high	141 Å²	141	72 Å²	72	66%	0.659	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.3	34.8	-174.8	-63	-62.4	-50.2	0	0	112.5	D76	D76-Q78 VanDerWaalsContact C-N 3.33Å; D76-Q78 PolarHBondContact OD1-N 2.87Å
79	V	95.4	Very high	93.7	Very high	21 Å²	21	77.7 Å²	77.7	13%	0.127	39%	0.39	C	S	.	.			trans	-76	135.8	179.1	-177.5	0	0	0	0	111.1	F72 D76 F81 I92 N93 F94	F72-V79 HydrophobicContact CB-CG1 4.46Å; D76-V79 HydrophobicContact CB-CG2 3.66Å; D76-V79 VanDerWaalsContact O-CG2 3.24Å; D76-V79 WeakPolarHBondContact O-CG2 3.48Å; V79-F81 HydrophobicContact CB-CE2 4.06Å; V79-F81 HydrophobicContact CB-CZ 4.06Å; V79-F81 HydrophobicContact CG1-CD1 4.36Å; V79-F81 HydrophobicContact CG1-CD2 4.25Å; V79-F81 HydrophobicContact CG1-CE1 3.76Å; V79-F81 HydrophobicContact CG1-CE2 3.62Å; V79-F81 HydrophobicContact CG1-CZ 3.35Å; V79-I92 HydrophobicContact CG1-CG2 3.4Å; V79-N93 WeakPolarHBondContact CA-O 3.38Å; V79-F94 HydrophobicContact CG2-CD1 3.66Å; V79-F94 HydrophobicContact CG2-CE1 3.85Å; V79-F94 HydrophobicContact CG2-CG 4.48Å
80	T	95.1	Very high	93.7	Very high	74 Å²	74	75.8 Å²	75.8	45%	0.454	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	138.9	172.4	62.5	0	0	0	0	111.3	I92 N93	T80-I92 WeakPolarHBondContact O-CA 3.28Å; T80-N93 PolarHBondContact N-O 3.21Å; T80-N93 PolarHBondContact O-N 3.43Å; T80-N93 WeakPolarHBondContact OG1-CB 3.34Å; T80-N93 PolarHBondContact OG1-ND2 3.34Å
81	F	95.4	Very high	93.8	Very high	42 Å²	42	77.5 Å²	77.5	18%	0.184	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	130.1	-176.9	-56.9	-89	0	0	0	110.9	E69 F72 V79 L83 V90 R91 I92	E69-F81 HydrophobicContact CB-CD2 4.32Å; E69-F81 HydrophobicContact CB-CE1 4.31Å; E69-F81 HydrophobicContact CB-CE2 3.81Å; E69-F81 HydrophobicContact CB-CZ 3.8Å; E69-F81 HydrophobicContact CG-CD1 4.06Å; E69-F81 HydrophobicContact CG-CD2 3.75Å; E69-F81 HydrophobicContact CG-CE1 4.06Å; E69-F81 HydrophobicContact CG-CE2 3.76Å; E69-F81 HydrophobicContact CG-CG 3.9Å; E69-F81 HydrophobicContact CG-CZ 3.91Å; F72-F81 HydrophobicContact CB-CE1 3.91Å; F72-F81 HydrophobicContact CB-CZ 3.91Å; F72-F81 AromaticContact CD2-CE1 3.97Å; F72-F81 HydrophobicContact CD2-CE1 3.97Å; F72-F81 HydrophobicContact CG-CE1 4.21Å; V79-F81 HydrophobicContact CB-CE2 4.06Å; V79-F81 HydrophobicContact CB-CZ 4.06Å; V79-F81 HydrophobicContact CG1-CD1 4.36Å; V79-F81 HydrophobicContact CG1-CD2 4.25Å; V79-F81 HydrophobicContact CG1-CE1 3.76Å; V79-F81 HydrophobicContact CG1-CE2 3.62Å; V79-F81 HydrophobicContact CG1-CZ 3.35Å; F81-L83 HydrophobicContact CB-CD1 4.26Å; F81-V90 HydrophobicContact CB-CG1 4.39Å; F81-V90 HydrophobicContact CD1-CG1 4.29Å; F81-R91 CarbonylContact C-O 3.54Å; F81-R91 WeakPolarHBondContact CA-O 3.45Å; F81-I92 HydrophobicContact CD1-CG1 4.03Å; F81-I92 HydrophobicContact CD1-CG2 4.19Å; F81-I92 HydrophobicContact CE1-CG1 4.22Å; F81-I92 HydrophobicContact CE1-CG2 3.88Å
82	Q	94.8	Very high	93.9	Very high	86 Å²	86	75.2 Å²	75.2	40%	0.402	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	111.8	170.8	-64.4	172.7	8.4	0	0	108.7	F84 V90 R91	Q82-F84 HydrophobicContact CB-CE2 4.2Å; Q82-F84 HydrophobicContact CB-CZ 4.21Å; Q82-V90 CarbonylContact O-C 3.58Å; Q82-V90 WeakPolarHBondContact O-CA 3.44Å; Q82-R91 HydrophobicContact CB-CB 4.18Å; Q82-R91 PolarHBondContact N-O 3.21Å; Q82-R91 PolarHBondContact O-N 3.15Å
83	L	93.7	Very high	93.9	Very high	60 Å²	60	76.3 Å²	76.3	31%	0.314	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	126.5	-175	-65.5	89.5	0	0	0	110.7	F59 K65 F81 V90	F59-L83 HydrophobicContact CD1-CB 4.03Å; F59-L83 HydrophobicContact CD1-CD2 3.91Å; F59-L83 HydrophobicContact CE1-CB 3.93Å; F59-L83 HydrophobicContact CE1-CD2 4.15Å; F59-L83 HydrophobicContact CE1-CG 4.43Å; K65-L83 HydrophobicContact CD-CD2 4.44Å; K65-L83 HydrophobicContact CG-CD2 4.48Å; F81-L83 HydrophobicContact CB-CD1 4.26Å; L83-V90 HydrophobicContact CD2-CG2 4.48Å; L83-V90 HydrophobicContact CG-CG1 4.27Å; L83-V90 HydrophobicContact CG-CG2 4.15Å
84	F	93.6	Very high	93.9	Very high	80 Å²	80	73.9 Å²	73.9	35%	0.351	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	81.2	175.8	-57.2	-75.9	0	0	0	109.7	F50 Q82 S86 F87 R88 R89 R91	F50-F84 HydrophobicContact CE1-CE2 4.25Å; Q82-F84 HydrophobicContact CB-CE2 4.2Å; Q82-F84 HydrophobicContact CB-CZ 4.21Å; F84-S86 PolarHBondContact O-N 3.07Å; F84-F87 HydrophobicContact CB-CB 4.25Å; F84-F87 HydrophobicContact CB-CD2 4.23Å; F84-F87 CarbonylContact O-C 3.5Å; F84-F87 PolarHBondContact O-N 2.91Å; F84-R88 PolarHBondContact O-N 2.94Å; F84-R89 WeakPolarHBondContact CA-O 2.96Å; F84-R89 HydrophobicContact CB-CB 4.36Å; F84-R89 WeakPolarHBondContact CB-O 3.31Å; F84-R89 PolarHBondContact N-O 3.4Å; F84-R89 PolarHBondContact O-N 3.2Å; F84-R91 HydrophobicContact CE2-CB 3.85Å
85	K	91.2	Very high	93.8	Very high	98 Å²	98	71.1 Å²	71.1	43%	0.426	35%	0.348	S	S	.	.	G	3₁₀ helix	trans	-51.4	-50.7	-174.1	-179.5	169.6	-179.7	155.9	0	113	F59 E60 F87 R88	F59-K85 HydrophobicContact CB-CB 4.3Å; F59-K85 HydrophobicContact CB-CD 4.05Å; F59-K85 HydrophobicContact CB-CG 3.93Å; F59-K85 HydrophobicContact CD1-CB 3.92Å; F59-K85 HydrophobicContact CD1-CG 4.38Å; F59-K85 HydrophobicContact CG-CB 4.24Å; F59-K85 HydrophobicContact CG-CG 4.19Å; E60-K85 IonicContact OE1-NZ 2.72Å; E60-K85 PolarHBondContact OE1-NZ 2.93Å; K85-F87 PolarHBondContact O-N 2.93Å; K85-R88 PolarHBondContact O-N 3.26Å
86	S	91.4	Very high	93.7	Very high	117 Å²	117	75.5 Å²	75.5	82%	0.818	37%	0.368	S	S	*	.	G	3₁₀ helix	trans	-60.5	-29.9	-178.5	-54.3	0	0	0	0	113.6	F84	F84-S86 PolarHBondContact O-N 3.07Å
87	F	89.6	Confident	93.6	Very high	147 Å²	147	76 Å²	76	65%	0.645	37%	0.372	S	S	*	.	G	3₁₀ helix	trans	-95.2	-3.7	-179.5	-64.6	-76.9	0	0	0	113	F84 K85 R89	F84-F87 HydrophobicContact CB-CB 4.25Å; F84-F87 HydrophobicContact CB-CD2 4.23Å; F84-F87 CarbonylContact O-C 3.5Å; F84-F87 PolarHBondContact O-N 2.91Å; K85-F87 PolarHBondContact O-N 2.93Å; F87-R89 HydrophobicContact CB-CB 4.22Å; F87-R89 HydrophobicContact CB-CG 4.24Å; F87-R89 WeakPolarHBondContact O-CG 3.3Å; F87-R89 PolarHBondContact O-N 2.6Å
88	R	92.1	Very high	93.6	Very high	111 Å²	111	74.5 Å²	74.5	42%	0.419	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	48	44.2	-171.1	-62.3	-175.3	175.4	-177.8	-4.4	111.8	S53 V54 E56 F59 F84 K85	S53-R88 PolarHBondContact N-O 3.15Å; V54-R88 PolarHBondContact N-O 3.36Å; E56-R88 IonicContact OE2-CZ 3.71Å; E56-R88 IonicContact OE2-NH2 2.77Å; E56-R88 PolarHBondContact OE2-NH2 3.22Å; F59-R88 HydrophobicContact CE2-CB 4.48Å; F84-R88 PolarHBondContact O-N 2.94Å; K85-R88 PolarHBondContact O-N 3.26Å
89	R	94.8	Very high	93.7	Very high	123 Å²	123	68 Å²	68	46%	0.464	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	145.2	-177.2	-75.2	173.6	-165.6	-172.4	0.5	110.9	A51 F84 F87	A51-R89 CarbonylContact O-C 3.24Å; A51-R89 WeakPolarHBondContact O-CA 3.48Å; F84-R89 WeakPolarHBondContact CA-O 2.96Å; F84-R89 HydrophobicContact CB-CB 4.36Å; F84-R89 WeakPolarHBondContact CB-O 3.31Å; F84-R89 PolarHBondContact N-O 3.4Å; F84-R89 PolarHBondContact O-N 3.2Å; F87-R89 HydrophobicContact CB-CB 4.22Å; F87-R89 HydrophobicContact CB-CG 4.24Å; F87-R89 WeakPolarHBondContact O-CG 3.3Å; F87-R89 PolarHBondContact O-N 2.6Å
90	V	95.7	Very high	93.6	Very high	1 Å²	1	67 Å²	67	1%	0.006	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	126.1	171.9	-176.3	0	0	0	0	108.2	F50 A51 V54 F59 F68 F81 Q82 L83 I92	F50-V90 WeakPolarHBondContact CA-O 3.09Å; A51-V90 HydrophobicContact CB-CB 4.33Å; A51-V90 PolarHBondContact N-O 2.85Å; A51-V90 PolarHBondContact O-N 2.94Å; V54-V90 HydrophobicContact CG1-CG2 4.41Å; V54-V90 HydrophobicContact CG2-CG2 4.14Å; F59-V90 HydrophobicContact CE1-CG2 3.94Å; F59-V90 HydrophobicContact CZ-CG2 3.87Å; F68-V90 HydrophobicContact CE1-CB 4.17Å; F68-V90 HydrophobicContact CE1-CG1 4.09Å; F68-V90 HydrophobicContact CE1-CG2 4.19Å; F68-V90 HydrophobicContact CZ-CB 4.42Å; F68-V90 HydrophobicContact CZ-CG2 4.47Å; F81-V90 HydrophobicContact CB-CG1 4.39Å; F81-V90 HydrophobicContact CD1-CG1 4.29Å; Q82-V90 CarbonylContact O-C 3.58Å; Q82-V90 WeakPolarHBondContact O-CA 3.44Å; L83-V90 HydrophobicContact CD2-CG2 4.48Å; L83-V90 HydrophobicContact CG-CG1 4.27Å; L83-V90 HydrophobicContact CG-CG2 4.15Å; V90-I92 HydrophobicContact CG1-CG1 4.14Å
91	R	95.6	Very high	93.5	Very high	85 Å²	85	63.9 Å²	63.9	32%	0.321	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	129.9	168.1	175.5	179.2	179	169.1	7.1	108.6	L49 F50 F81 Q82 F84 N93	L49-R91 CarbonylContact O-C 3.6Å; L49-R91 WeakPolarHBondContact O-CA 2.85Å; F50-R91 HydrophobicContact CD1-CB 3.94Å; F50-R91 HydrophobicContact CE1-CB 3.66Å; F50-R91 HydrophobicContact CE1-CG 4.15Å; F50-R91 HydrophobicContact CZ-CB 4.36Å; F50-R91 HydrophobicContact CZ-CG 4.38Å; F81-R91 CarbonylContact C-O 3.54Å; F81-R91 WeakPolarHBondContact CA-O 3.45Å; Q82-R91 HydrophobicContact CB-CB 4.18Å; Q82-R91 PolarHBondContact N-O 3.21Å; Q82-R91 PolarHBondContact O-N 3.15Å; F84-R91 HydrophobicContact CE2-CB 3.85Å; R91-N93 PolarHBondContact NE-OD1 2.82Å; R91-N93 PolarHBondContact NH2-OD1 2.89Å
92	I	96.1	Very high	93.4	Very high	0 Å²	0	68.7 Å²	68.7	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	116.9	-176.3	-51.7	167.7	0	0	0	105.5	S48 L49 A51 F68 F72 V79 T80 F81 V90 F94	S48-I92 CarbonylContact C-O 3.56Å; S48-I92 VanDerWaalsContact CA-O 3.27Å; S48-I92 WeakPolarHBondContact CA-O 3.33Å; L49-I92 HydrophobicContact CB-CB 4.48Å; L49-I92 PolarHBondContact N-O 3.35Å; L49-I92 PolarHBondContact O-N 3.08Å; A51-I92 HydrophobicContact CB-CD1 4.05Å; F68-I92 HydrophobicContact CZ-CD1 4.46Å; F72-I92 HydrophobicContact CB-CG2 4.32Å; F72-I92 HydrophobicContact CD1-CD1 3.85Å; F72-I92 HydrophobicContact CD1-CG2 4.42Å; F72-I92 HydrophobicContact CD2-CD1 3.85Å; F72-I92 HydrophobicContact CE1-CD1 3.57Å; F72-I92 HydrophobicContact CE2-CD1 3.61Å; F72-I92 HydrophobicContact CG-CD1 3.96Å; F72-I92 HydrophobicContact CG-CG2 4.29Å; F72-I92 HydrophobicContact CZ-CD1 3.44Å; F72-I92 VanDerWaalsContact CZ-CD1 3.44Å; V79-I92 HydrophobicContact CG1-CG2 3.4Å; T80-I92 WeakPolarHBondContact O-CA 3.28Å; F81-I92 HydrophobicContact CD1-CG1 4.03Å; F81-I92 HydrophobicContact CD1-CG2 4.19Å; F81-I92 HydrophobicContact CE1-CG1 4.22Å; F81-I92 HydrophobicContact CE1-CG2 3.88Å; V90-I92 HydrophobicContact CG1-CG1 4.14Å; I92-F94 HydrophobicContact CB-CE2 4.08Å; I92-F94 HydrophobicContact CG2-CD2 4.19Å; I92-F94 HydrophobicContact CG2-CE1 4.31Å; I92-F94 HydrophobicContact CG2-CE2 3.46Å; I92-F94 VanDerWaalsContact CG2-CE2 3.46Å; I92-F94 HydrophobicContact CG2-CZ 3.53Å
93	N	95.6	Very high	93.4	Very high	22 Å²	22	64.6 Å²	64.6	12%	0.118	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	125.6	175	-41.9	-79.8	0	0	0	109	S48 V79 T80 R91	S48-N93 WeakPolarHBondContact CB-OD1 3.4Å; S48-N93 PolarHBondContact OG-OD1 3.05Å; V79-N93 WeakPolarHBondContact CA-O 3.38Å; T80-N93 PolarHBondContact N-O 3.21Å; T80-N93 PolarHBondContact O-N 3.43Å; T80-N93 WeakPolarHBondContact OG1-CB 3.34Å; T80-N93 PolarHBondContact OG1-ND2 3.34Å; R91-N93 PolarHBondContact NE-OD1 2.82Å; R91-N93 PolarHBondContact NH2-OD1 2.89Å
94	F	94.9	Very high	93.5	Very high	9 Å²	9	66.1 Å²	66.1	4%	0.039	31%	0.306	C	S	.	.			trans	-96.8	159.2	174.7	-59.4	-95.5	0	0	0	109.5	T47 L49 F72 D76 V79 I92 A99 A100 A103	T47-F94 WeakPolarHBondContact CB-O 3.44Å; T47-F94 WeakPolarHBondContact O-CB 3.37Å; T47-F94 WeakPolarHBondContact O-CD2 3.43Å; T47-F94 PolarHBondContact O-N 3.4Å; L49-F94 HydrophobicContact CB-CE2 4.29Å; L49-F94 HydrophobicContact CD1-CE2 3.76Å; L49-F94 HydrophobicContact CD1-CZ 4.23Å; L49-F94 HydrophobicContact CG-CE2 3.91Å; F72-F94 HydrophobicContact CB-CE1 4.4Å; F72-F94 HydrophobicContact CB-CZ 4.36Å; F72-F94 AromaticContact CD1-CZ 3.86Å; F72-F94 HydrophobicContact CD1-CZ 3.86Å; D76-F94 HydrophobicContact CB-CD1 3.95Å; V79-F94 HydrophobicContact CG2-CD1 3.66Å; V79-F94 HydrophobicContact CG2-CE1 3.85Å; V79-F94 HydrophobicContact CG2-CG 4.48Å; I92-F94 HydrophobicContact CB-CE2 4.08Å; I92-F94 HydrophobicContact CG2-CD2 4.19Å; I92-F94 HydrophobicContact CG2-CE1 4.31Å; I92-F94 HydrophobicContact CG2-CE2 3.46Å; I92-F94 VanDerWaalsContact CG2-CE2 3.46Å; I92-F94 HydrophobicContact CG2-CZ 3.53Å; F94-A99 HydrophobicContact CB-CB 4.46Å; F94-A99 HydrophobicContact CD1-CB 4.07Å; F94-A100 HydrophobicContact CB-CB 4.33Å; F94-A100 HydrophobicContact CD2-CB 3.51Å; F94-A100 HydrophobicContact CE2-CB 4Å; F94-A100 HydrophobicContact CG-CB 3.99Å; F94-A103 HydrophobicContact CE1-CB 4.17Å; F94-A103 HydrophobicContact CZ-CB 3.89Å
95	S	93.7	Very high	93.5	Very high	79 Å²	79	69.2 Å²	69.2	55%	0.552	33%	0.325	S	S	*	.	S	Bend	trans	-74.2	-31.7	170.4	-175.5	0	0	0	0	112	D76	D76-S95 WeakPolarHBondContact OD2-CA 3.22Å; D76-S95 VanDerWaalsContact OD2-CB 3.3Å; D76-S95 WeakPolarHBondContact OD2-CB 3.31Å; D76-S95 PolarHBondContact OD2-N 3.33Å
96	K	91.8	Very high	93.6	Very high	125 Å²	125	70.4 Å²	70.4	54%	0.543	33%	0.332	S	S	.	.	S	Bend	trans	-123.4	139	-176.9	-63.2	-178.3	-178.1	-179.3	0	111.8	E98 A99 A100	K96-E98 VanDerWaalsContact C-N 3.3Å; K96-E98 PolarHBondContact O-N 3Å; K96-A99 HydrophobicContact CB-CB 4.4Å; K96-A99 PolarHBondContact O-N 3.49Å; K96-A100 PolarHBondContact O-N 3.2Å
97	P	92	Very high	93.7	Very high	35 Å²	35	65.6 Å²	65.6	23%	0.227	30%	0.297	C	S	.	.	H	α-helix	trans	-66.1	-33.6	178.1	27.6	-33.4	0	0	0	112.2	L45 T47 A99 A100 A101	L45-P97 HydrophobicContact CB-CB 4.34Å; L45-P97 VanDerWaalsContact O-CB 3.3Å; L45-P97 WeakPolarHBondContact O-CB 3.45Å; T47-P97 HydrophobicContact CG2-CB 4.15Å; T47-P97 HydrophobicContact CG2-CG 4.49Å; P97-A99 VanDerWaalsContact C-N 3.31Å; P97-A99 PolarHBondContact O-N 2.87Å; P97-A100 WeakPolarHBondContact O-CB 3.29Å; P97-A100 PolarHBondContact O-N 2.81Å; P97-A101 PolarHBondContact O-N 2.8Å
98	E	91.7	Very high	94	Very high	109 Å²	109	61.3 Å²	61.3	51%	0.509	28%	0.279	S	S	.	.	H	α-helix	trans	-57	-41.7	173.6	-63.8	165.5	-166.4	0	0	112.6	L42 K96 A101 R102	L42-E98 HydrophobicContact CD1-CG 4.05Å; K96-E98 VanDerWaalsContact C-N 3.3Å; K96-E98 PolarHBondContact O-N 3Å; E98-A101 PolarHBondContact O-N 2.65Å; E98-R102 WeakPolarHBondContact O-CG 3.27Å; E98-R102 PolarHBondContact O-N 3.24Å
99	A	93.9	Very high	94	Very high	4 Å²	4	61.6 Å²	61.6	3%	0.033	29%	0.285	C	S	.	.	H	α-helix	trans	-66.4	-41.6	178.5	0	0	0	0	0	111.1	D76 F94 K96 P97 R102 A103	D76-A99 HydrophobicContact CB-CB 4.1Å; F94-A99 HydrophobicContact CB-CB 4.46Å; F94-A99 HydrophobicContact CD1-CB 4.07Å; K96-A99 HydrophobicContact CB-CB 4.4Å; K96-A99 PolarHBondContact O-N 3.49Å; P97-A99 VanDerWaalsContact C-N 3.31Å; P97-A99 PolarHBondContact O-N 2.87Å; A99-R102 PolarHBondContact O-N 2.85Å; A99-A103 VanDerWaalsContact O-CB 3.31Å; A99-A103 WeakPolarHBondContact O-CB 3.45Å; A99-A103 PolarHBondContact O-N 2.8Å
100	A	93.8	Very high	94	Very high	0 Å²	0	58 Å²	58	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-62.3	-42.8	174.4	0	0	0	0	0	111.8	L49 F94 K96 P97 R104 F121	L49-A100 HydrophobicContact CG-CB 4.24Å; F94-A100 HydrophobicContact CB-CB 4.33Å; F94-A100 HydrophobicContact CD2-CB 3.51Å; F94-A100 HydrophobicContact CE2-CB 4Å; F94-A100 HydrophobicContact CG-CB 3.99Å; K96-A100 PolarHBondContact O-N 3.2Å; P97-A100 WeakPolarHBondContact O-CB 3.29Å; P97-A100 PolarHBondContact O-N 2.81Å; A100-R104 WeakPolarHBondContact O-CB 3.37Å; A100-R104 PolarHBondContact O-N 3.17Å; A100-F121 HydrophobicContact CB-CE1 4.14Å
101	A	93	Very high	93.8	Very high	9 Å²	9	63.5 Å²	63.5	7%	0.074	31%	0.306	C	S	.	.	H	α-helix	trans	-62.5	-47.8	177.2	0	0	0	0	0	112	L45 P97 E98 R104 I105 F121	L45-A101 HydrophobicContact CD1-CB 3.89Å; P97-A101 PolarHBondContact O-N 2.8Å; E98-A101 PolarHBondContact O-N 2.65Å; A101-R104 PolarHBondContact O-N 2.89Å; A101-I105 VanDerWaalsContact O-CG1 3.31Å; A101-I105 WeakPolarHBondContact O-CG1 3.48Å; A101-I105 PolarHBondContact O-N 3.13Å; A101-F121 HydrophobicContact CB-CZ 4.22Å
102	R	93.5	Very high	93.6	Very high	143 Å²	143	60.9 Å²	60.9	54%	0.54	30%	0.297	S	S	.	.	H	α-helix	trans	-61.2	-48.9	177.1	-71.2	-170.6	-59.3	172.5	5.5	112.1	Y75 E98 A99 R104 I105 E106	Y75-R102 HydrophobicContact CD1-CB 4.27Å; E98-R102 WeakPolarHBondContact O-CG 3.27Å; E98-R102 PolarHBondContact O-N 3.24Å; A99-R102 PolarHBondContact O-N 2.85Å; R102-R104 VanDerWaalsContact C-N 3.25Å; R102-R104 PolarHBondContact O-N 3.19Å; R102-I105 PolarHBondContact O-N 2.94Å; R102-I105 VanDerWaalsContact O-N 3.16Å; R102-E106 PolarHBondContact O-N 2.97Å
103	A	94.8	Very high	93.2	Very high	0 Å²	0	64 Å²	64	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-58.4	-39.4	177.1	0	0	0	0	0	111.5	L49 F72 Y75 F94 A99 L107	L49-A103 HydrophobicContact CD1-CB 4.46Å; F72-A103 HydrophobicContact CD1-CB 4.28Å; Y75-A103 HydrophobicContact CD1-CB 4.4Å; Y75-A103 HydrophobicContact CD2-CB 3.71Å; Y75-A103 HydrophobicContact CE2-CB 3.98Å; Y75-A103 HydrophobicContact CG-CB 3.94Å; F94-A103 HydrophobicContact CE1-CB 4.17Å; F94-A103 HydrophobicContact CZ-CB 3.89Å; A99-A103 VanDerWaalsContact O-CB 3.31Å; A99-A103 WeakPolarHBondContact O-CB 3.45Å; A99-A103 PolarHBondContact O-N 2.8Å; A103-L107 WeakPolarHBondContact O-CB 3.4Å; A103-L107 PolarHBondContact O-N 3.46Å
104	R	94.6	Very high	92.8	Very high	92 Å²	92	66.5 Å²	66.5	35%	0.347	35%	0.345	S	S	.	.	H	α-helix	trans	-64.8	-48	175.2	-177.7	-178.7	175.1	-132.4	-5.5	111.7	L49 A100 A101 R102 E106 H108 L119	L49-R104 HydrophobicContact CD1-CB 4.08Å; L49-R104 HydrophobicContact CD2-CB 4.22Å; A100-R104 WeakPolarHBondContact O-CB 3.37Å; A100-R104 PolarHBondContact O-N 3.17Å; A101-R104 PolarHBondContact O-N 2.89Å; R102-R104 VanDerWaalsContact C-N 3.25Å; R102-R104 PolarHBondContact O-N 3.19Å; R104-E106 VanDerWaalsContact C-N 3.28Å; R104-E106 PolarHBondContact O-N 3.2Å; R104-H108 WeakPolarHBondContact O-CB 3.2Å; R104-H108 PolarHBondContact O-N 2.84Å; R104-L119 HydrophobicContact CG-CB 4.23Å
105	I	93.5	Very high	92.6	Very high	144 Å²	144	68.6 Å²	68.6	74%	0.738	36%	0.355	S	S	*	.	H	α-helix	trans	-61	-40.7	-177.8	-69.2	163.7	0	0	0	110.9	A101 R102	A101-I105 VanDerWaalsContact O-CG1 3.31Å; A101-I105 WeakPolarHBondContact O-CG1 3.48Å; A101-I105 PolarHBondContact O-N 3.13Å; R102-I105 PolarHBondContact O-N 2.94Å; R102-I105 VanDerWaalsContact O-N 3.16Å
106	E	93.9	Very high	92.6	Very high	124 Å²	124	70.2 Å²	70.2	58%	0.579	35%	0.352	S	S	*	.	H	α-helix	trans	-83.5	-39.2	-175	-168.8	171.7	173.8	0	0	113.5	Y75 R102 R104 T110	Y75-E106 VanDerWaalsContact CE1-OE2 3.24Å; Y75-E106 WeakPolarHBondContact CE1-OE2 3.35Å; Y75-E106 WeakPolarHBondContact OH-CG 3.31Å; Y75-E106 PolarHBondContact OH-OE2 2.69Å; R102-E106 PolarHBondContact O-N 2.97Å; R104-E106 VanDerWaalsContact C-N 3.28Å; R104-E106 PolarHBondContact O-N 3.2Å; E106-T110 VanDerWaalsContact O-CG2 3.31Å; E106-T110 WeakPolarHBondContact O-CG2 3.38Å
107	L	94.1	Very high	92.7	Very high	15 Å²	15	64.4 Å²	64.4	8%	0.079	33%	0.327	C	S	.	.	H	α-helix	trans	-98.6	-11.1	-171.8	-60.1	176.3	0	0	0	114.1	L71 F72 Y75 A103 E109 T110 L119	L71-L107 HydrophobicContact CB-CD1 4.1Å; F72-L107 HydrophobicContact CD1-CD1 3.8Å; F72-L107 HydrophobicContact CE1-CD1 3.49Å; F72-L107 VanDerWaalsContact CE1-CD1 3.49Å; F72-L107 HydrophobicContact CG-CD1 4.5Å; F72-L107 HydrophobicContact CZ-CD1 3.91Å; Y75-L107 HydrophobicContact CE2-CD1 3.78Å; Y75-L107 HydrophobicContact CE2-CG 4.26Å; A103-L107 WeakPolarHBondContact O-CB 3.4Å; A103-L107 PolarHBondContact O-N 3.46Å; L107-E109 PolarHBondContact O-N 3.17Å; L107-T110 WeakPolarHBondContact O-CB 3.39Å; L107-T110 WeakPolarHBondContact O-CG2 3.41Å; L107-T110 PolarHBondContact O-N 2.79Å; L107-T110 PolarHBondContact O-OG1 3.13Å; L107-L119 HydrophobicContact CB-CD1 3.68Å
108	H	95.2	Very high	92.8	Very high	58 Å²	58	67.2 Å²	67.2	27%	0.269	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.6	133.5	178.3	-169.7	82.2	0	0	0	111.2	R104 T110 L119	R104-H108 WeakPolarHBondContact O-CB 3.2Å; R104-H108 PolarHBondContact O-N 2.84Å; H108-T110 PolarHBondContact O-N 2.92Å; H108-L119 HydrophobicContact CB-CB 4.38Å; H108-L119 PolarHBondContact CE1-O 3.31Å; H108-L119 PolarHBondContact ND1-N 3.46Å; H108-L119 PolarHBondContact ND1-O 3.5Å
109	E	93	Very high	93	Very high	117 Å²	117	62 Å²	62	55%	0.547	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.4	8.3	-174.9	-52.5	-167.5	159	0	0	116.7	L107 L117	L107-E109 PolarHBondContact O-N 3.17Å; E109-L117 WeakPolarHBondContact CA-O 3.31Å; E109-L117 PolarHBondContact N-O 3.35Å
110	T	93.3	Very high	93	Very high	48 Å²	48	67 Å²	67	29%	0.294	33%	0.33	S	S	.	.			trans	-66.9	146.3	171.3	61.2	0	0	0	0	111.8	E106 L107 H108 F112 K116 L117	E106-T110 VanDerWaalsContact O-CG2 3.31Å; E106-T110 WeakPolarHBondContact O-CG2 3.38Å; L107-T110 WeakPolarHBondContact O-CB 3.39Å; L107-T110 WeakPolarHBondContact O-CG2 3.41Å; L107-T110 PolarHBondContact O-N 2.79Å; L107-T110 PolarHBondContact O-OG1 3.13Å; H108-T110 PolarHBondContact O-N 2.92Å; T110-F112 PolarHBondContact O-N 3.23Å; T110-K116 WeakPolarHBondContact O-CA 3.47Å; T110-L117 PolarHBondContact O-N 3.26Å
111	D	92.5	Very high	93	Very high	116 Å²	116	69.3 Å²	69.3	62%	0.62	34%	0.34	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.2	115	176.4	-74	-62.6	0	0	0	110.5	K116	D111-K116 VanDerWaalsContact OD1-CG 3.28Å; D111-K116 WeakPolarHBondContact OD1-CG 3.41Å
112	F	90.8	Very high	92.9	Very high	29 Å²	29	69 Å²	69	13%	0.127	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	120	173.8	-176	-93.4	0	0	0	109.5	V58 F68 L71 T110 G114 Q115	V58-F112 HydrophobicContact CG2-CD1 4.42Å; V58-F112 HydrophobicContact CG2-CE1 3.54Å; V58-F112 HydrophobicContact CG2-CZ 4.34Å; F68-F112 HydrophobicContact CB-CE1 4.21Å; F68-F112 HydrophobicContact CB-CZ 3.82Å; F68-F112 HydrophobicContact CD2-CD1 4.23Å; F68-F112 AromaticContact CD2-CE1 3.95Å; F68-F112 HydrophobicContact CD2-CE1 3.95Å; F68-F112 HydrophobicContact CD2-CZ 4.15Å; L71-F112 HydrophobicContact CD1-CD2 3.63Å; L71-F112 HydrophobicContact CD1-CE2 3.77Å; L71-F112 HydrophobicContact CD1-CG 4.5Å; T110-F112 PolarHBondContact O-N 3.23Å; F112-G114 PolarHBondContact O-N 3.14Å; F112-Q115 PolarHBondContact N-O 3.36Å; F112-Q115 PolarHBondContact O-N 2.81Å; F112-Q115 VanDerWaalsContact O-O 3.05Å
113	N	87.6	Confident	92.2	Very high	66 Å²	66	70.3 Å²	70.3	35%	0.353	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.8	39.4	-176	-70.9	-19.7	0	0	0	113.8	H55 E64 Q115	H55-N113 HydrophobicContact CB-CB 3.89Å; H55-N113 PolarHBondContact CD2-O 3.16Å; E64-N113 PolarHBondContact OE2-ND2 2.73Å; N113-Q115 PolarHBondContact O-N 2.89Å
114	G	88.4	Confident	90.9	Very high	75 Å²	75	74 Å²	74	77%	0.773	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.5	9.7	179.9	0	0	0	0	0	114.9	F112	F112-G114 PolarHBondContact O-N 3.14Å
115	Q	90.4	Very high	89.2	Confident	53 Å²	53	78.3 Å²	78.3	25%	0.248	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	137.6	172.7	-68.6	-175.3	2.8	0	0	110.8	S53 F112 N113 L117	S53-Q115 PolarHBondContact O-OE1 3.01Å; F112-Q115 PolarHBondContact N-O 3.36Å; F112-Q115 PolarHBondContact O-N 2.81Å; F112-Q115 VanDerWaalsContact O-O 3.05Å; N113-Q115 PolarHBondContact O-N 2.89Å; Q115-L117 PolarHBondContact O-N 2.77Å
116	K	93.6	Very high	87.3	Confident	113 Å²	113	78.7 Å²	78.7	49%	0.491	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	120.9	174.5	-68.5	-168.3	173.6	-159.3	0	111	T110 D111	T110-K116 WeakPolarHBondContact O-CA 3.47Å; D111-K116 VanDerWaalsContact OD1-CG 3.28Å; D111-K116 WeakPolarHBondContact OD1-CG 3.41Å
117	L	93.8	Very high	85.1	Confident	3 Å²	3	78.5 Å²	78.5	2%	0.016	41%	0.409	C	S	.	.			trans	-74.1	126.2	-179.3	-168.9	63.1	0	0	0	110.9	A51 V54 F68 F72 E109 T110 Q115 L119	A51-L117 HydrophobicContact CB-CD1 4.02Å; V54-L117 HydrophobicContact CG2-CD1 4.04Å; F68-L117 HydrophobicContact CE2-CD1 3.96Å; F68-L117 HydrophobicContact CE2-CD2 4.27Å; F72-L117 HydrophobicContact CZ-CD2 3.96Å; E109-L117 WeakPolarHBondContact CA-O 3.31Å; E109-L117 PolarHBondContact N-O 3.35Å; T110-L117 PolarHBondContact O-N 3.26Å; Q115-L117 PolarHBondContact O-N 2.77Å; L117-L119 HydrophobicContact CD2-CD1 4.47Å; L117-L119 HydrophobicContact CD2-CD2 4Å; L117-L119 HydrophobicContact CD2-CG 4.28Å; L117-L119 HydrophobicContact CG-CD2 4Å; L117-L119 HydrophobicContact CG-CG 4.25Å
118	K	94.5	Very high	83.2	Confident	94 Å²	94	81 Å²	81	41%	0.409	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	107.2	178.1	-66.6	-176.3	177.9	-174.5	0	110.6	C52 Y120	C52-K118 HydrophobicContact CB-CB 4.05Å; C52-K118 PolarHBondContact N-O 2.72Å; C52-K118 PolarHBondContact O-N 3.42Å; C52-K118 VanDerWaalsContact O-N 3.17Å; K118-Y120 HydrophobicContact CB-CE2 3.68Å
119	L	95.3	Very high	81.1	Confident	0 Å²	0	85.5 Å²	85.5	0%	0	46%	0.46	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	123.7	179.3	-59.6	-179.3	0	0	0	112.2	L49 F50 A51 F72 R104 L107 H108 L117	L49-L119 HydrophobicContact CD1-CD1 4.43Å; F50-L119 CarbonylContact O-C 3.59Å; F50-L119 WeakPolarHBondContact O-CA 3.24Å; A51-L119 HydrophobicContact CB-CD2 3.64Å; F72-L119 HydrophobicContact CE1-CD1 4Å; F72-L119 HydrophobicContact CE1-CD2 4.22Å; F72-L119 HydrophobicContact CZ-CD1 4.34Å; F72-L119 HydrophobicContact CZ-CD2 4.02Å; R104-L119 HydrophobicContact CG-CB 4.23Å; L107-L119 HydrophobicContact CB-CD1 3.68Å; H108-L119 HydrophobicContact CB-CB 4.38Å; H108-L119 PolarHBondContact CE1-O 3.31Å; H108-L119 PolarHBondContact ND1-N 3.46Å; H108-L119 PolarHBondContact ND1-O 3.5Å; L117-L119 HydrophobicContact CD2-CD1 4.47Å; L117-L119 HydrophobicContact CD2-CD2 4Å; L117-L119 HydrophobicContact CD2-CG 4.28Å; L117-L119 HydrophobicContact CG-CD2 4Å; L117-L119 HydrophobicContact CG-CG 4.25Å
120	Y	94.6	Very high	79.1	Confident	107 Å²	107	86.1 Å²	86.1	42%	0.42	47%	0.471	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	142.5	177.1	-58.8	-79.4	0	0	0	110.5	L49 F50 C52 K118 A122	L49-Y120 CarbonylContact C-O 3.59Å; L49-Y120 VanDerWaalsContact CA-O 3.29Å; L49-Y120 WeakPolarHBondContact CA-O 3.41Å; F50-Y120 PolarHBondContact N-O 3.25Å; F50-Y120 PolarHBondContact O-N 2.7Å; C52-Y120 HydrophobicContact CB-CD2 4.16Å; C52-Y120 HydrophobicContact CB-CE2 3.85Å; K118-Y120 HydrophobicContact CB-CE2 3.68Å; Y120-A122 PolarHBondContact O-N 3.07Å
121	F	93.4	Very high	77.2	Confident	49 Å²	49	93.6 Å²	93.6	22%	0.215	49%	0.494	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.8	131.9	169.9	-80.6	-61	0	0	0	110.6	L45 P46 L49 A100 A101 Q123	L45-F121 HydrophobicContact CD1-CE2 4.5Å; L45-F121 HydrophobicContact CD1-CZ 4.11Å; L45-F121 HydrophobicContact CD2-CD2 4.3Å; L45-F121 HydrophobicContact CD2-CE2 3.78Å; L45-F121 HydrophobicContact CD2-CZ 4.02Å; L45-F121 HydrophobicContact CG-CZ 4.47Å; P46-F121 HydrophobicContact CG-CB 3.59Å; P46-F121 HydrophobicContact CG-CD1 3.6Å; P46-F121 HydrophobicContact CG-CE1 4.49Å; P46-F121 HydrophobicContact CG-CG 3.81Å; L49-F121 HydrophobicContact CD2-CD1 3.33Å; L49-F121 HydrophobicContact CD2-CE1 3.6Å; L49-F121 HydrophobicContact CD2-CG 3.97Å; L49-F121 HydrophobicContact CD2-CZ 4.42Å; A100-F121 HydrophobicContact CB-CE1 4.14Å; A101-F121 HydrophobicContact CB-CZ 4.22Å; F121-Q123 PolarHBondContact O-N 3.05Å
122	A	89.6	Confident	75.4	Confident	4 Å²	4	92.3 Å²	92.3	3%	0.033	49%	0.487	C	S	.	.			trans	-74.6	118.8	173.7	0	0	0	0	0	108.1	P46 S48 F50 Y120 V124	P46-A122 VanDerWaalsContact CB-O 3.31Å; P46-A122 WeakPolarHBondContact CB-O 3.42Å; P46-A122 WeakPolarHBondContact CG-O 3.36Å; S48-A122 WeakPolarHBondContact O-CB 3.26Å; S48-A122 PolarHBondContact O-N 3.16Å; F50-A122 HydrophobicContact CD2-CB 3.57Å; F50-A122 HydrophobicContact CE2-CB 3.42Å; F50-A122 VanDerWaalsContact CE2-CB 3.42Å; F50-A122 HydrophobicContact CZ-CB 4.42Å; Y120-A122 PolarHBondContact O-N 3.07Å; A122-V124 PolarHBondContact O-N 3.29Å
123	Q	79.7	Confident	73.8	Confident	169 Å²	169	100.8 Å²	100.8	79%	0.79	52%	0.524	S	S	*	.			trans	-62.6	113.3	173.9	-170.9	176	-7	0	0	108.3	F121 Q125	F121-Q123 PolarHBondContact O-N 3.05Å; Q123-Q125 PolarHBondContact O-N 3.05Å; Q123-Q125 VanDerWaalsContact O-N 3.11Å
124	V	66.9	Low	72.8	Confident	77 Å²	77	102.1 Å²	102.1	47%	0.467	54%	0.538	S	S	.	.			trans	-69.9	111.4	174.3	-177.7	0	0	0	0	105.7	P46 A122 M126	P46-V124 HydrophobicContact CB-CG2 3.49Å; P46-V124 VanDerWaalsContact CB-CG2 3.49Å; A122-V124 PolarHBondContact O-N 3.29Å; V124-M126 HydrophobicContact CG1-CB 3.95Å; V124-M126 HydrophobicContact CG1-CG 3.36Å; V124-M126 PolarHBondContact O-N 2.77Å
125	Q	59.3	Low	72.1	Confident	184 Å²	184	106.6 Å²	106.6	86%	0.86	53%	0.533	S	S	*	.			trans	-73.8	53.4	168.4	-68.2	-179.4	-20.8	0	0	109.7	Q123 S127	Q123-Q125 PolarHBondContact O-N 3.05Å; Q123-Q125 VanDerWaalsContact O-N 3.11Å; Q125-S127 PolarHBondContact O-N 3.19Å
126	M	52.9	Low	71.7	Confident	152 Å²	152	112.2 Å²	112.2	75%	0.749	56%	0.564	S	S	*	*			trans	-84.7	97.7	158.6	-70.4	-62.7	-101.1	0	0	104	V124 G128	V124-M126 HydrophobicContact CG1-CB 3.95Å; V124-M126 HydrophobicContact CG1-CG 3.36Å; V124-M126 PolarHBondContact O-N 2.77Å; M126-G128 PolarHBondContact O-N 3.29Å
127	S	49.1	Very low	71	Confident	120 Å²	120	114.3 Å²	114.3	84%	0.839	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.2	31.3	164.6	59.5	0	0	0	0	111.9	Q125	Q125-S127 PolarHBondContact O-N 3.19Å
128	G	53	Low	70.3	Confident	67 Å²	67	119.4 Å²	119.4	69%	0.691	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.7	-19.8	-176	0	0	0	0	0	113.1	M126 V130	M126-G128 PolarHBondContact O-N 3.29Å; G128-V130 PolarHBondContact O-N 3.35Å
129	E	51.3	Low	69.5	Low	153 Å²	153	120.6 Å²	120.6	72%	0.715	63%	0.63	S	S	*	*	S	Bend	trans	-86.8	92.4	172.2	-76.7	179.1	-176.8	0	0	110.2	R131	E129-R131 PolarHBondContact O-N 2.97Å
130	V	52.5	Low	68.6	Low	129 Å²	129	128.2 Å²	128.2	78%	0.782	67%	0.666	S	S	*	*	S	Bend	trans	38.9	41.3	140.7	-158.1	0	0	0	0	115.4	G128	G128-V130 PolarHBondContact O-N 3.35Å
131	R	51.7	Low	67.6	Low	205 Å²	205	127.4 Å²	127.4	77%	0.774	67%	0.674	S	S	*	*	S	Bend	trans	-119.3	111.6	162.4	-66.1	-156.1	-61.8	-173.3	-0.1	105.8	E129	E129-R131 PolarHBondContact O-N 2.97Å
132	D	55.8	Low	66.7	Low	89 Å²	89	129.8 Å²	129.8	48%	0.476	69%	0.692	S	S	.	*			trans	74.5	85.3	178.5	-63.9	-40.9	0	0	0	116	S134 Y135	D132-S134 WeakPolarHBondContact CB-OG 3.4Å; D132-S134 PolarHBondContact O-N 3.11Å; D132-S134 PolarHBondContact OD1-OG 2.78Å; D132-Y135 HydrophobicContact CB-CD2 3.8Å; D132-Y135 HydrophobicContact CB-CE2 3.44Å; D132-Y135 VanDerWaalsContact CB-CE2 3.44Å; D132-Y135 VanDerWaalsContact O-CD2 3.31Å; D132-Y135 WeakPolarHBondContact O-CD2 3.49Å
133	K	57.1	Low	65.7	Low	208 Å²	208	136 Å²	136	90%	0.904	72%	0.718	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.3	25.6	143	-55.5	-179	-176.9	-177.3	0	112.4
134	S	66	Low	65	Low	94 Å²	94	134 Å²	134	66%	0.657	71%	0.709	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.1	-7.9	-173.3	-35	0	0	0	0	111	D132	D132-S134 WeakPolarHBondContact CB-OG 3.4Å; D132-S134 PolarHBondContact O-N 3.11Å; D132-S134 PolarHBondContact OD1-OG 2.78Å
135	Y	74.8	Confident	64.7	Low	168 Å²	168	136.3 Å²	136.3	66%	0.659	71%	0.713	S	S	*	*	S	Bend	trans	-85	139.7	173.5	-58.6	-63	0	0	0	110.9	D132 L137	D132-Y135 HydrophobicContact CB-CD2 3.8Å; D132-Y135 HydrophobicContact CB-CE2 3.44Å; D132-Y135 VanDerWaalsContact CB-CE2 3.44Å; D132-Y135 VanDerWaalsContact O-CD2 3.31Å; D132-Y135 WeakPolarHBondContact O-CD2 3.49Å; Y135-L137 PolarHBondContact O-N 2.84Å
136	L	81.4	Confident	64.9	Low	172 Å²	172	133.4 Å²	133.4	90%	0.901	70%	0.703	S	S	*	*	P	Polyproline II helix	trans	-59	136	170.3	-67.2	174.4	0	0	0	109.5
137	L	78.3	Confident	65.5	Low	156 Å²	156	131.8 Å²	131.8	82%	0.817	70%	0.696	S	S	*	*	P	Polyproline II helix	trans	-61.5	142.5	174.1	-64.3	175.2	0	0	0	109.6	Y135	Y135-L137 PolarHBondContact O-N 2.84Å
138	P	79.4	Confident	65.7	Low	111 Å²	111	131.3 Å²	131.3	72%	0.721	69%	0.692	S	S	*	*	P	Polyproline II helix	trans	-49.5	135.3	168.4	-26.3	34.4	0	0	0	109.8	Q140	P138-Q140 PolarHBondContact O-N 3.21Å
139	P	77	Confident	66.2	Low	118 Å²	118	134.1 Å²	134.1	77%	0.766	70%	0.698	S	S	*	*	P	Polyproline II helix	trans	-59.2	141.3	-177.2	24.7	-33.8	0	0	0	109.9
140	Q	77.3	Confident	66.4	Low	161 Å²	161	130.4 Å²	130.4	75%	0.752	69%	0.688	S	S	*	*	P	Polyproline II helix	trans	-57.6	129.9	176.8	-68.6	-177.8	-5.3	0	0	109.3	P138 V142	P138-Q140 PolarHBondContact O-N 3.21Å; Q140-V142 HydrophobicContact CB-CG1 3.98Å; Q140-V142 PolarHBondContact O-N 3.26Å
141	P	73.4	Confident	66.8	Low	89 Å²	89	128.5 Å²	128.5	58%	0.578	69%	0.686	S	S	*	*			trans	-75.8	57.9	-176	30	-35	0	0	0	112.2	K143 Q144	P141-K143 VanDerWaalsContact C-N 3.28Å; P141-K143 PolarHBondContact O-N 2.69Å; P141-Q144 HydrophobicContact CB-CG 3.7Å
142	V	73.4	Confident	67.3	Low	100 Å²	100	123.9 Å²	123.9	61%	0.606	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.3	-14.9	-173.5	-68.6	0	0	0	0	114	Q140 F145	Q140-V142 HydrophobicContact CB-CG1 3.98Å; Q140-V142 PolarHBondContact O-N 3.26Å; V142-F145 WeakPolarHBondContact O-CE1 3.31Å
143	K	68.8	Low	67.9	Low	134 Å²	134	123.7 Å²	123.7	58%	0.583	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-139.6	27.5	-172.4	-68.6	179.2	-176.1	-179.8	0	114	P141 F145 L146	P141-K143 VanDerWaalsContact C-N 3.28Å; P141-K143 PolarHBondContact O-N 2.69Å; K143-F145 HydrophobicContact CB-CE1 4.5Å; K143-F145 HydrophobicContact CG-CE1 4.43Å; K143-F145 HydrophobicContact CG-CZ 4.34Å; K143-F145 PolarHBondContact O-N 3.33Å; K143-F145 VanDerWaalsContact O-N 3.16Å; K143-L146 HydrophobicContact CB-CD1 4.11Å; K143-L146 HydrophobicContact CB-CG 4.44Å; K143-L146 HydrophobicContact CD-CD1 4.07Å; K143-L146 HydrophobicContact CG-CD1 4.27Å; K143-L146 PolarHBondContact O-N 3.33Å
144	Q	65.1	Low	68.6	Low	127 Å²	127	118.2 Å²	118.2	59%	0.593	67%	0.674	S	S	*	*	G	3₁₀ helix	trans	-62.4	-19.8	177.3	-74.3	-175.7	-27.5	0	0	113.3	P141 L146 I147	P141-Q144 HydrophobicContact CB-CG 3.7Å; Q144-L146 PolarHBondContact O-N 3.16Å; Q144-I147 PolarHBondContact O-N 3.29Å
145	F	61.3	Low	69	Low	125 Å²	125	121.4 Å²	121.4	55%	0.548	69%	0.689	S	S	.	*	G	3₁₀ helix	trans	-71.1	-9.7	172.7	63.5	-95.4	0	0	0	114.5	V142 K143 P150	V142-F145 WeakPolarHBondContact O-CE1 3.31Å; K143-F145 HydrophobicContact CB-CE1 4.5Å; K143-F145 HydrophobicContact CG-CE1 4.43Å; K143-F145 HydrophobicContact CG-CZ 4.34Å; K143-F145 PolarHBondContact O-N 3.33Å; K143-F145 VanDerWaalsContact O-N 3.16Å; F145-P150 WeakPolarHBondContact O-CB 3.33Å
146	L	64.5	Low	69	Low	123 Å²	123	117.1 Å²	117.1	64%	0.644	70%	0.696	S	S	*	*	G	3₁₀ helix	trans	-92	-6.7	174.1	-63.5	-179.4	0	0	0	112.8	K143 Q144	K143-L146 HydrophobicContact CB-CD1 4.11Å; K143-L146 HydrophobicContact CB-CG 4.44Å; K143-L146 HydrophobicContact CD-CD1 4.07Å; K143-L146 HydrophobicContact CG-CD1 4.27Å; K143-L146 PolarHBondContact O-N 3.33Å; Q144-L146 PolarHBondContact O-N 3.16Å
147	I	63.9	Low	68.8	Low	119 Å²	119	117 Å²	117	61%	0.61	68%	0.684	S	S	*	*	S	Bend	trans	-97.9	116.9	-179.5	-36.9	175.2	0	0	0	106.8	Q144 P149	Q144-I147 PolarHBondContact O-N 3.29Å; I147-P149 CarbonylContact O-C 3.55Å; I147-P149 VanDerWaalsContact O-C 3.24Å
148	S	54.1	Low	68.8	Low	109 Å²	109	117.4 Å²	117.4	76%	0.762	68%	0.679	S	S	*	*	S	Bend	trans	-80.2	137.2	-174.6	54.8	0	0	0	0	112.1
149	P	62.4	Low	68.6	Low	126 Å²	126	118 Å²	118	82%	0.818	67%	0.672	S	S	*	*	S	Bend	cis	-78.5	136.2	-6.3	29.3	-30.9	0	0	0	112	I147 A151	I147-P149 CarbonylContact O-C 3.55Å; I147-P149 VanDerWaalsContact O-C 3.24Å; P149-A151 PolarHBondContact O-N 2.83Å
150	P	57.1	Low	68.6	Low	76 Å²	76	117 Å²	117	49%	0.494	67%	0.668	S	S	.	*	P	Polyproline II helix	trans	-67.4	138.1	178.1	28.3	-33.2	0	0	0	110.1	F145 S152	F145-P150 WeakPolarHBondContact O-CB 3.33Å; P150-S152 PolarHBondContact O-N 2.99Å
151	A	60.4	Low	68.6	Low	89 Å²	89	117.3 Å²	117.3	74%	0.736	67%	0.669	S	S	*	*	P	Polyproline II helix	trans	-54.3	138.9	155.6	0	0	0	0	0	107.8	P149	P149-A151 PolarHBondContact O-N 2.83Å
152	S	61	Low	68.7	Low	107 Å²	107	119.3 Å²	119.3	75%	0.748	68%	0.675	S	S	*	*			trans	-35.8	140.8	-172.4	-50.4	0	0	0	0	113.9	P150	P150-S152 PolarHBondContact O-N 2.99Å
153	P	69.4	Low	68.7	Low	85 Å²	85	119.2 Å²	119.2	55%	0.552	69%	0.685	S	S	*	*	P	Polyproline II helix	trans	-54.8	145.6	177.5	22	-31.3	0	0	0	110.6	W157	P153-W157 HydrophobicContact CB-CB 4.12Å; P153-W157 HydrophobicContact CB-CD2 4.27Å; P153-W157 HydrophobicContact CB-CE3 4.18Å; P153-W157 HydrophobicContact CB-CG 4.26Å
154	P	72.4	Confident	68.7	Low	94 Å²	94	120.8 Å²	120.8	61%	0.61	70%	0.696	S	S	*	*	P	Polyproline II helix	trans	-54.9	149.1	-178.2	-24.9	32.9	0	0	0	112.6	G156 W157	P154-G156 PolarHBondContact O-N 3.31Å; P154-G156 VanDerWaalsContact O-N 3.13Å; P154-W157 WeakPolarHBondContact O-CB 3.47Å; P154-W157 PolarHBondContact O-N 3.2Å
155	V	73.6	Confident	68.9	Low	160 Å²	160	120.6 Å²	120.6	97%	0.97	71%	0.706	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.1	119.5	175.1	179.9	0	0	0	0	109.2
156	G	75.6	Confident	69.5	Low	78 Å²	78	121 Å²	121	80%	0.804	72%	0.719	S	S	*	*	T	Hydrogen-bonded Turn	trans	98.2	-2.4	-177.7	0	0	0	0	0	115.5	P154 K158	P154-G156 PolarHBondContact O-N 3.31Å; P154-G156 VanDerWaalsContact O-N 3.13Å; G156-K158 PolarHBondContact O-N 3.04Å
157	W	76.9	Confident	70.2	Confident	170 Å²	170	120.6 Å²	120.6	64%	0.644	72%	0.716	S	S	*	*			trans	-67.1	120.8	171	-170.8	89	0	0	0	110.3	P153 P154 Q159	P153-W157 HydrophobicContact CB-CB 4.12Å; P153-W157 HydrophobicContact CB-CD2 4.27Å; P153-W157 HydrophobicContact CB-CE3 4.18Å; P153-W157 HydrophobicContact CB-CG 4.26Å; P154-W157 WeakPolarHBondContact O-CB 3.47Å; P154-W157 PolarHBondContact O-N 3.2Å; W157-Q159 HydrophobicContact CH2-CB 3.93Å; W157-Q159 HydrophobicContact CH2-CG 4.37Å; W157-Q159 HydrophobicContact CZ3-CB 4.05Å
158	K	77.2	Confident	71.1	Confident	165 Å²	165	118.3 Å²	118.3	72%	0.717	71%	0.705	S	S	*	*			trans	-118.9	132.5	171.6	-170.8	-175	175.2	-167	0	107.6	G156 S160	G156-K158 PolarHBondContact O-N 3.04Å; K158-S160 PolarHBondContact O-N 2.76Å
159	Q	75.4	Confident	72.6	Confident	124 Å²	124	121.6 Å²	121.6	58%	0.579	70%	0.702	S	S	*	*	P	Polyproline II helix	trans	-57	126.4	170.7	-173.2	175	-0.2	0	0	108.6	W157	W157-Q159 HydrophobicContact CH2-CB 3.93Å; W157-Q159 HydrophobicContact CH2-CG 4.37Å; W157-Q159 HydrophobicContact CZ3-CB 4.05Å
160	S	78	Confident	73.6	Confident	97 Å²	97	121.8 Å²	121.8	68%	0.678	70%	0.696	S	S	*	*	P	Polyproline II helix	trans	-57.3	138.6	171.4	42.3	0	0	0	0	109.2	K158 D162	K158-S160 PolarHBondContact O-N 2.76Å; S160-D162 PolarHBondContact O-N 3.44Å
161	E	77.1	Confident	74.7	Confident	166 Å²	166	123.3 Å²	123.3	78%	0.776	70%	0.699	S	S	*	*	P	Polyproline II helix	trans	-61	122.8	176.5	-68.9	178.3	-173.5	0	0	108.7	A163	E161-A163 PolarHBondContact O-N 3.45Å
162	D	75.3	Confident	75.8	Confident	131 Å²	131	123.7 Å²	123.7	70%	0.701	69%	0.689	S	S	*	*	P	Polyproline II helix	trans	-55.8	131.8	175.4	-80.7	-21.1	0	0	0	108.4	S160 M164	S160-D162 PolarHBondContact O-N 3.44Å; D162-M164 PolarHBondContact O-N 2.99Å
163	A	73.9	Confident	76.8	Confident	99 Å²	99	121.3 Å²	121.3	82%	0.818	67%	0.671	S	S	*	*			trans	-57.8	115.2	177.7	0	0	0	0	0	108.5	E161	E161-A163 PolarHBondContact O-N 3.45Å
164	M	67.6	Low	77.3	Confident	166 Å²	166	119 Å²	119	82%	0.818	66%	0.659	S	S	*	*			trans	-56.7	135.6	171.5	-70.2	-164.8	178.1	0	0	108.3	D162 V166	D162-M164 PolarHBondContact O-N 2.99Å; M164-V166 PolarHBondContact O-N 2.87Å
165	P	70.4	Confident	77.7	Confident	124 Å²	124	119.2 Å²	119.2	81%	0.805	66%	0.659	S	S	*	*			trans	-62.2	107.1	-176.7	24.6	-32.8	0	0	0	109.2	I167	P165-I167 PolarHBondContact O-N 3.08Å
166	V	73.4	Confident	78.1	Confident	134 Å²	134	116 Å²	116	81%	0.812	64%	0.643	S	S	*	*			trans	-72	113.8	173.3	178.7	0	0	0	0	106.9	M164 N168	M164-V166 PolarHBondContact O-N 2.87Å; V166-N168 PolarHBondContact O-N 3.25Å; V166-N168 VanDerWaalsContact O-N 3.08Å
167	I	79.6	Confident	78.4	Confident	113 Å²	113	118.6 Å²	118.6	58%	0.579	63%	0.633	S	S	*	*			trans	-68.6	107.7	176.3	-59.1	174.6	0	0	0	108	P165 L172	P165-I167 PolarHBondContact O-N 3.08Å; I167-L172 HydrophobicContact CG2-CD1 3.56Å
168	N	81.4	Confident	78.5	Confident	72 Å²	72	112.8 Å²	112.8	39%	0.385	61%	0.614	S	S	.	*			trans	-88.5	109.7	176.1	-173.9	-27.6	0	0	0	109.9	V166 D170 L171 L172	V166-N168 PolarHBondContact O-N 3.25Å; V166-N168 VanDerWaalsContact O-N 3.08Å; N168-D170 VanDerWaalsContact C-N 3.28Å; N168-D170 PolarHBondContact O-N 3.36Å; N168-D170 WeakPolarHBondContact OD1-CB 3.34Å; N168-D170 PolarHBondContact OD1-N 3.29Å; N168-L171 HydrophobicContact CB-CB 4.24Å; N168-L171 HydrophobicContact CB-CD1 3.87Å; N168-L171 HydrophobicContact CB-CG 3.92Å; N168-L171 PolarHBondContact O-N 2.93Å; N168-L171 PolarHBondContact OD1-N 3.4Å; N168-L172 PolarHBondContact O-N 2.99Å
169	Y	85.6	Confident	78.5	Confident	177 Å²	177	106 Å²	106	69%	0.694	59%	0.59	S	S	*	*	H	α-helix	trans	-66.2	-27.1	-179.5	-66.1	-81.7	0	0	0	113.6	L172 C173	Y169-L172 HydrophobicContact CD1-CD1 4.22Å; Y169-L172 PolarHBondContact O-N 3.49Å; Y169-C173 WeakPolarHBondContact O-CB 3.23Å; Y169-C173 PolarHBondContact O-N 3.24Å
170	D	83.5	Confident	78.5	Confident	130 Å²	130	104.6 Å²	104.6	70%	0.695	59%	0.592	S	S	*	*	H	α-helix	trans	-70	-38.3	176.6	-60.4	-30.1	0	0	0	110.8	N168 C173 A174	N168-D170 VanDerWaalsContact C-N 3.28Å; N168-D170 PolarHBondContact O-N 3.36Å; N168-D170 WeakPolarHBondContact OD1-CB 3.34Å; N168-D170 PolarHBondContact OD1-N 3.29Å; D170-C173 PolarHBondContact O-N 3.4Å; D170-A174 WeakPolarHBondContact O-CB 3.48Å; D170-A174 PolarHBondContact O-N 3.42Å
171	L	81.5	Confident	77.9	Confident	108 Å²	108	102 Å²	102	57%	0.565	58%	0.58	S	S	*	*	H	α-helix	trans	-65.2	-41.3	173.9	-64.6	-178.2	0	0	0	111.3	N168 C173 A174 V175	N168-L171 HydrophobicContact CB-CB 4.24Å; N168-L171 HydrophobicContact CB-CD1 3.87Å; N168-L171 HydrophobicContact CB-CG 3.92Å; N168-L171 PolarHBondContact O-N 2.93Å; N168-L171 PolarHBondContact OD1-N 3.4Å; L171-C173 VanDerWaalsContact C-N 3.35Å; L171-C173 PolarHBondContact O-N 2.86Å; L171-A174 PolarHBondContact O-N 3.41Å; L171-V175 WeakPolarHBondContact O-CB 3.36Å; L171-V175 VanDerWaalsContact O-CG2 3.23Å; L171-V175 WeakPolarHBondContact O-CG2 3.43Å; L171-V175 PolarHBondContact O-N 3.37Å
172	L	82.5	Confident	77.8	Confident	98 Å²	98	99.7 Å²	99.7	51%	0.513	57%	0.569	S	S	.	*	H	α-helix	trans	-59.6	-45.2	174.4	-78.5	157.9	0	0	0	111.7	I167 N168 Y169 V175 S176	I167-L172 HydrophobicContact CG2-CD1 3.56Å; N168-L172 PolarHBondContact O-N 2.99Å; Y169-L172 HydrophobicContact CD1-CD1 4.22Å; Y169-L172 PolarHBondContact O-N 3.49Å; L172-V175 PolarHBondContact O-N 2.95Å; L172-S176 WeakPolarHBondContact O-CB 3.4Å; L172-S176 PolarHBondContact O-N 3.48Å
173	C	81.8	Confident	77.7	Confident	56 Å²	56	100.4 Å²	100.4	38%	0.378	57%	0.566	S	S	.	*	H	α-helix	trans	-63.9	-44.3	176.1	-175.9	0	0	0	0	111.7	Y169 D170 L171 S176 K177	Y169-C173 WeakPolarHBondContact O-CB 3.23Å; Y169-C173 PolarHBondContact O-N 3.24Å; D170-C173 PolarHBondContact O-N 3.4Å; L171-C173 VanDerWaalsContact C-N 3.35Å; L171-C173 PolarHBondContact O-N 2.86Å; C173-S176 PolarHBondContact O-N 3.31Å; C173-S176 PolarHBondContact O-OG 3.22Å; C173-K177 WeakPolarHBondContact O-CG 3.42Å; C173-K177 PolarHBondContact O-N 2.76Å; C173-K177 VanDerWaalsContact SG-CE 3.55Å
174	A	80.1	Confident	77.9	Confident	36 Å²	36	100.2 Å²	100.2	30%	0.298	55%	0.545	S	S	.	.	H	α-helix	trans	-60.6	-47.3	176.8	0	0	0	0	0	111.4	D170 L171 S176 K177 L178	D170-A174 WeakPolarHBondContact O-CB 3.48Å; D170-A174 PolarHBondContact O-N 3.42Å; L171-A174 PolarHBondContact O-N 3.41Å; A174-S176 VanDerWaalsContact C-N 3.31Å; A174-S176 PolarHBondContact O-N 2.69Å; A174-K177 PolarHBondContact O-N 3.27Å; A174-K177 VanDerWaalsContact O-N 3.12Å; A174-L178 PolarHBondContact O-N 3.4Å
175	V	81.7	Confident	78.6	Confident	99 Å²	99	97.3 Å²	97.3	60%	0.6	53%	0.53	S	S	*	.	H	α-helix	trans	-61.9	-38.1	176.9	172.6	0	0	0	0	111.4	L171 L172 K177 L178	L171-V175 WeakPolarHBondContact O-CB 3.36Å; L171-V175 VanDerWaalsContact O-CG2 3.23Å; L171-V175 WeakPolarHBondContact O-CG2 3.43Å; L171-V175 PolarHBondContact O-N 3.37Å; L172-V175 PolarHBondContact O-N 2.95Å; V175-K177 PolarHBondContact O-N 3.18Å; V175-L178 WeakPolarHBondContact O-CB 3.45Å; V175-L178 PolarHBondContact O-N 3.29Å
176	S	81.2	Confident	78.9	Confident	93 Å²	93	96.2 Å²	96.2	65%	0.65	52%	0.516	S	S	*	.	H	α-helix	trans	-67	-20.9	177.1	74.1	0	0	0	0	114.5	L172 C173 A174	L172-S176 WeakPolarHBondContact O-CB 3.4Å; L172-S176 PolarHBondContact O-N 3.48Å; C173-S176 PolarHBondContact O-N 3.31Å; C173-S176 PolarHBondContact O-OG 3.22Å; A174-S176 VanDerWaalsContact C-N 3.31Å; A174-S176 PolarHBondContact O-N 2.69Å
177	K	81.3	Confident	79.2	Confident	133 Å²	133	95.1 Å²	95.1	58%	0.578	50%	0.502	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.7	-11.4	176.8	-69.3	169.4	-178.5	173.3	0	112.8	C173 A174 V175 G179	C173-K177 WeakPolarHBondContact O-CG 3.42Å; C173-K177 PolarHBondContact O-N 2.76Å; C173-K177 VanDerWaalsContact SG-CE 3.55Å; A174-K177 PolarHBondContact O-N 3.27Å; A174-K177 VanDerWaalsContact O-N 3.12Å; V175-K177 PolarHBondContact O-N 3.18Å; K177-G179 PolarHBondContact O-N 3.12Å
178	L	80.8	Confident	79.4	Confident	48 Å²	48	92.6 Å²	92.6	25%	0.251	50%	0.498	S	S	.	.			trans	-76.5	108.6	178.9	-64.8	-178.9	0	0	0	109.3	A174 V175 Y184 V198 V200	A174-L178 PolarHBondContact O-N 3.4Å; V175-L178 WeakPolarHBondContact O-CB 3.45Å; V175-L178 PolarHBondContact O-N 3.29Å; L178-Y184 HydrophobicContact CD2-CD1 4.03Å; L178-Y184 HydrophobicContact CD2-CD2 3.85Å; L178-Y184 HydrophobicContact CD2-CG 3.47Å; L178-Y184 VanDerWaalsContact CD2-CG 3.47Å; L178-V198 HydrophobicContact CD1-CG1 4.33Å; L178-V200 HydrophobicContact CB-CG2 3.82Å; L178-V200 HydrophobicContact CD1-CG2 4.45Å
179	G	76.6	Confident	79.5	Confident	21 Å²	21	91.1 Å²	91.1	22%	0.216	50%	0.5	C	S	.	.			trans	-80.6	145.5	171.6	0	0	0	0	0	111.9	K177 G181 E182 V200	K177-G179 PolarHBondContact O-N 3.12Å; G179-G181 PolarHBondContact O-N 3.4Å; G179-E182 PolarHBondContact O-N 3.47Å; G179-V200 WeakPolarHBondContact O-CB 3.29Å; G179-V200 WeakPolarHBondContact O-CG2 3.44Å
180	P	74.6	Confident	79.3	Confident	96 Å²	96	86.6 Å²	86.6	62%	0.623	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.7	135.1	168.5	-20.5	31.5	0	0	0	110.8	E182 E202	P180-E182 PolarHBondContact O-N 2.85Å; P180-E202 HydrophobicContact CB-CG 4.06Å
181	G	67.1	Low	79.3	Confident	41 Å²	41	90.6 Å²	90.6	42%	0.423	51%	0.505	S	S	.	.	T	Hydrogen-bonded Turn	trans	81	-10.6	179.2	0	0	0	0	0	115.4	G179 V200 E202	G179-G181 PolarHBondContact O-N 3.4Å; G181-V200 PolarHBondContact N-O 2.96Å; G181-V200 VanDerWaalsContact N-O 3.09Å; G181-E202 VanDerWaalsContact CA-OE1 3.29Å; G181-E202 WeakPolarHBondContact CA-OE1 3.32Å
182	E	73.2	Confident	79.2	Confident	118 Å²	118	90.7 Å²	90.7	55%	0.551	52%	0.515	S	S	*	.			trans	-86.9	137.1	-179.7	-158.7	169.7	-174.1	0	0	111.7	G179 P180	G179-E182 PolarHBondContact O-N 3.47Å; P180-E182 PolarHBondContact O-N 2.85Å
183	K	74.9	Confident	78.9	Confident	146 Å²	146	89 Å²	89	64%	0.635	51%	0.509	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.9	113.7	174.5	-61.4	-171.8	-177	-160.2	0	108.7	V197 H199	K183-V197 HydrophobicContact CB-CG1 3.94Å; K183-H199 VanDerWaalsContact CD-NE2 3.29Å; K183-H199 WeakPolarHBondContact CD-NE2 3.13Å; K183-H199 WeakPolarHBondContact CE-NE2 3.2Å; K183-H199 PolarHBondContact NZ-NE2 2.84Å
184	Y	77.9	Confident	79	Confident	96 Å²	96	91.8 Å²	91.8	38%	0.376	53%	0.526	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	109.2	178.7	-163.4	-90.7	0	0	0	110.2	L178 L186 V197 V198	L178-Y184 HydrophobicContact CD2-CD1 4.03Å; L178-Y184 HydrophobicContact CD2-CD2 3.85Å; L178-Y184 HydrophobicContact CD2-CG 3.47Å; L178-Y184 VanDerWaalsContact CD2-CG 3.47Å; Y184-L186 HydrophobicContact CD1-CD2 3.69Å; Y184-L186 HydrophobicContact CD1-CG 4.32Å; Y184-L186 HydrophobicContact CE1-CD2 3.84Å; Y184-L186 PolarHBondContact O-N 3.33Å; Y184-V197 WeakPolarHBondContact O-CA 3.45Å; Y184-V198 PolarHBondContact N-O 3.27Å; Y184-V198 PolarHBondContact O-N 3.01Å
185	E	81.1	Confident	79.2	Confident	105 Å²	105	92.4 Å²	92.4	49%	0.491	53%	0.529	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	106.9	174	-174.3	166.1	-146.4	0	0	109.3	A188 S195 V197	E185-A188 VanDerWaalsContact OE1-CA 3.32Å; E185-A188 WeakPolarHBondContact OE1-CA 3.39Å; E185-S195 WeakPolarHBondContact OE1-CB 3.46Å; E185-S195 PolarHBondContact OE1-OG 3.46Å; E185-V197 HydrophobicContact CB-CG2 4.27Å; E185-V197 HydrophobicContact CG-CG2 4.23Å
186	L	77.3	Confident	79.4	Confident	101 Å²	101	91.4 Å²	91.4	53%	0.529	52%	0.523	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	-37	176.3	-69.4	178	0	0	0	111.2	Y184 V196 V198	Y184-L186 HydrophobicContact CD1-CD2 3.69Å; Y184-L186 HydrophobicContact CD1-CG 4.32Å; Y184-L186 HydrophobicContact CE1-CD2 3.84Å; Y184-L186 PolarHBondContact O-N 3.33Å; L186-V196 HydrophobicContact CB-CG1 4.37Å; L186-V196 HydrophobicContact CD1-CG1 4.25Å; L186-V196 PolarHBondContact N-O 3.41Å; L186-V198 HydrophobicContact CD1-CG2 3.35Å; L186-V198 HydrophobicContact CD2-CG2 4.4Å; L186-V198 HydrophobicContact CG-CG2 3.72Å
187	H	79.3	Confident	79.5	Confident	111 Å²	111	89.7 Å²	89.7	51%	0.514	51%	0.508	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145	123.1	-179.2	-156.2	77.5	0	0	0	110.4	S195 V196	H187-S195 WeakPolarHBondContact O-CA 3.33Å; H187-S195 PolarHBondContact O-OG 3.24Å; H187-S195 VanDerWaalsContact O-OG 3.13Å; H187-V196 HydrophobicContact CB-CB 4.24Å; H187-V196 HydrophobicContact CB-CG2 4.46Å; H187-V196 PolarHBondContact N-O 3.26Å; H187-V196 PolarHBondContact O-N 3.08Å
188	A	83.6	Confident	79.5	Confident	60 Å²	60	85.7 Å²	85.7	50%	0.496	50%	0.495	S	S	.	.			trans	-64.1	138.1	173.9	0	0	0	0	0	110.7	E185	E185-A188 VanDerWaalsContact OE1-CA 3.32Å; E185-A188 WeakPolarHBondContact OE1-CA 3.39Å
189	G	83.6	Confident	79.5	Confident	41 Å²	41	88.7 Å²	88.7	42%	0.423	51%	0.507	S	S	.	.			trans	-65.5	138.5	174.4	0	0	0	0	0	110.6	T193	G189-T193 CarbonylContact C-O 3.47Å; G189-T193 VanDerWaalsContact CA-O 3.3Å; G189-T193 WeakPolarHBondContact CA-O 3.29Å
190	T	82.5	Confident	79.6	Confident	82 Å²	82	89.7 Å²	89.7	50%	0.503	51%	0.509	S	S	.	.	B	Isolated β-bridge	trans	-107.3	171.6	168.8	68.6	0	0	0	0	109.6	S192 T193	T190-S192 PolarHBondContact O-N 3.44Å; T190-T193 PolarHBondContact N-O 3.23Å; T190-T193 PolarHBondContact O-N 2.94Å; T190-T193 VanDerWaalsContact O-N 3.17Å; T190-T193 PolarHBondContact OG1-N 3.09Å; T190-T193 PolarHBondContact OG1-OG1 2.84Å
191	E	83.6	Confident	79.5	Confident	213 Å²	213	90.7 Å²	90.7	100%	0.995	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	-24.4	177.3	-64.2	-173.8	158	0	0	113.1
192	S	79.2	Confident	79.8	Confident	111 Å²	111	95.6 Å²	95.6	78%	0.776	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.1	-13.1	-179	-171.8	0	0	0	0	114.4	T190	T190-S192 PolarHBondContact O-N 3.44Å
193	T	74.9	Confident	79	Confident	63 Å²	63	94.8 Å²	94.8	39%	0.387	54%	0.536	S	S	.	.	B	Isolated β-bridge	trans	-137	135.8	-175	57.7	0	0	0	0	112.3	G189 T190	G189-T193 CarbonylContact C-O 3.47Å; G189-T193 VanDerWaalsContact CA-O 3.3Å; G189-T193 WeakPolarHBondContact CA-O 3.29Å; T190-T193 PolarHBondContact N-O 3.23Å; T190-T193 PolarHBondContact O-N 2.94Å; T190-T193 VanDerWaalsContact O-N 3.17Å; T190-T193 PolarHBondContact OG1-N 3.09Å; T190-T193 PolarHBondContact OG1-OG1 2.84Å
194	P	83.9	Confident	78.3	Confident	113 Å²	113	96.7 Å²	96.7	73%	0.734	55%	0.547	S	S	*	.			trans	-67.1	151.8	177.2	29.7	-34.9	0	0	0	111.4
195	S	86.1	Confident	76.9	Confident	50 Å²	50	97.8 Å²	97.8	35%	0.35	56%	0.564	S	S	.	*			trans	-65.7	145.4	171.4	171.3	0	0	0	0	110.9	E185 H187 V197	E185-S195 WeakPolarHBondContact OE1-CB 3.46Å; E185-S195 PolarHBondContact OE1-OG 3.46Å; H187-S195 WeakPolarHBondContact O-CA 3.33Å; H187-S195 PolarHBondContact O-OG 3.24Å; H187-S195 VanDerWaalsContact O-OG 3.13Å; S195-V197 WeakPolarHBondContact OG-CG2 3.41Å
196	V	85.8	Confident	75.3	Confident	78 Å²	78	100.9 Å²	100.9	47%	0.473	58%	0.579	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-110.9	113.5	174.8	-177.9	0	0	0	0	108.7	L186 H187	L186-V196 HydrophobicContact CB-CG1 4.37Å; L186-V196 HydrophobicContact CD1-CG1 4.25Å; L186-V196 PolarHBondContact N-O 3.41Å; H187-V196 HydrophobicContact CB-CB 4.24Å; H187-V196 HydrophobicContact CB-CG2 4.46Å; H187-V196 PolarHBondContact N-O 3.26Å; H187-V196 PolarHBondContact O-N 3.08Å
197	V	81.9	Confident	73.7	Confident	57 Å²	57	104.9 Å²	104.9	35%	0.345	60%	0.595	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-122.8	128.7	-177.9	-174.7	0	0	0	0	110.3	K183 Y184 E185 S195	K183-V197 HydrophobicContact CB-CG1 3.94Å; Y184-V197 WeakPolarHBondContact O-CA 3.45Å; E185-V197 HydrophobicContact CB-CG2 4.27Å; E185-V197 HydrophobicContact CG-CG2 4.23Å; S195-V197 WeakPolarHBondContact OG-CG2 3.41Å
198	V	82.7	Confident	72.3	Confident	49 Å²	49	108.7 Å²	108.7	30%	0.297	61%	0.613	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-89.8	128	172.3	178.4	0	0	0	0	108.7	L178 Y184 L186	L178-V198 HydrophobicContact CD1-CG1 4.33Å; Y184-V198 PolarHBondContact N-O 3.27Å; Y184-V198 PolarHBondContact O-N 3.01Å; L186-V198 HydrophobicContact CD1-CG2 3.35Å; L186-V198 HydrophobicContact CD2-CG2 4.4Å; L186-V198 HydrophobicContact CG-CG2 3.72Å
199	H	80.2	Confident	70.5	Confident	111 Å²	111	114.1 Å²	114.1	51%	0.514	63%	0.628	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-106.5	118.2	171.6	-67.9	73.3	0	0	0	108	K183	K183-H199 VanDerWaalsContact CD-NE2 3.29Å; K183-H199 WeakPolarHBondContact CD-NE2 3.13Å; K183-H199 WeakPolarHBondContact CE-NE2 3.2Å; K183-H199 PolarHBondContact NZ-NE2 2.84Å
200	V	77.4	Confident	68.9	Low	41 Å²	41	119 Å²	119	25%	0.248	64%	0.64	C	S	.	*			trans	-85.3	112.7	175	-171.3	0	0	0	0	108	L178 G179 G181 E202	L178-V200 HydrophobicContact CB-CG2 3.82Å; L178-V200 HydrophobicContact CD1-CG2 4.45Å; G179-V200 WeakPolarHBondContact O-CB 3.29Å; G179-V200 WeakPolarHBondContact O-CG2 3.44Å; G181-V200 PolarHBondContact N-O 2.96Å; G181-V200 VanDerWaalsContact N-O 3.09Å; V200-E202 PolarHBondContact O-N 3.13Å
201	C	74.1	Confident	67.4	Low	118 Å²	118	121.1 Å²	121.1	80%	0.797	65%	0.652	S	S	*	*			trans	-64.5	130.4	174.5	-72.8	0	0	0	0	110.2	S203	C201-S203 PolarHBondContact O-N 3.09Å
202	E	73.6	Confident	65.8	Low	143 Å²	143	118 Å²	118	67%	0.668	64%	0.636	S	S	*	*			trans	-69	125.3	167.5	-63.4	177.3	-179.8	0	0	108.3	P180 G181 V200 E204	P180-E202 HydrophobicContact CB-CG 4.06Å; G181-E202 VanDerWaalsContact CA-OE1 3.29Å; G181-E202 WeakPolarHBondContact CA-OE1 3.32Å; V200-E202 PolarHBondContact O-N 3.13Å; E202-E204 PolarHBondContact O-N 3.1Å
203	S	55.9	Low	64.6	Low	101 Å²	101	119.5 Å²	119.5	71%	0.706	64%	0.635	S	S	*	*			trans	-72.1	97	176.3	51.1	0	0	0	0	109.6	C201 T205	C201-S203 PolarHBondContact O-N 3.09Å; S203-T205 PolarHBondContact O-N 2.78Å
204	E	59.8	Low	63.8	Low	186 Å²	186	121.9 Å²	121.9	87%	0.869	65%	0.651	S	S	*	*	S	Bend	trans	30.5	79.4	149.8	51.7	-166.5	134.4	0	0	117	E202	E202-E204 PolarHBondContact O-N 3.1Å
205	T	47.7	Very low	62.6	Low	120 Å²	120	126.3 Å²	126.3	74%	0.736	66%	0.659	S	S	*	*			trans	-144.5	99	144.6	-55.2	0	0	0	0	107.9	S203	S203-T205 PolarHBondContact O-N 2.78Å
206	E	49	Very low	61.5	Low	169 Å²	169	132.6 Å²	132.6	79%	0.79	68%	0.683	S	S	*	*	S	Bend	trans	66.4	96.9	155.5	-56.3	-179	-175.2	0	0	118.3
207	E	43	Very low	60.6	Low	185 Å²	185	138 Å²	138	86%	0.864	70%	0.7	S	S	*	*				163.9	136	104.2	-84.1	-170.3	169.6	0	0	110.7	E209	E207-E209 PolarHBondContact O-N 3.31Å; E207-E209 VanDerWaalsContact O-N 3.09Å
208	E	50.2	Low	60.2	Low	192 Å²	192	142.9 Å²	142.9	90%	0.897	72%	0.723	S	S	*	*			trans	-67	96.4	179.5	-64.4	173.7	143.1	0	0	111.3
209	E	45.9	Very low	59.9	Low	174 Å²	174	146.2 Å²	146.2	81%	0.813	74%	0.743	S	S	*	*			trans	-120.7	98.1	156.2	-81.8	-76.9	160.9	0	0	107.8	E207 T211	E207-E209 PolarHBondContact O-N 3.31Å; E207-E209 VanDerWaalsContact O-N 3.09Å; E209-T211 PolarHBondContact O-N 3.17Å
210	E	50.3	Low	59.6	Low	143 Å²	143	149.9 Å²	149.9	67%	0.668	76%	0.76	S	S	*	*			trans	-56.1	80.9	173.9	-73.9	-168.2	137.2	0	0	111.4	K212	E210-K212 HydrophobicContact CB-CG 4.4Å; E210-K212 PolarHBondContact O-N 2.8Å; E210-K212 WeakPolarHBondContact OE1-CE 3.45Å; E210-K212 IonicContact OE1-NZ 2.74Å; E210-K212 PolarHBondContact OE1-NZ 3.28Å; E210-K212 WeakPolarHBondContact OE2-CE 3.3Å; E210-K212 IonicContact OE2-NZ 2.67Å; E210-K212 PolarHBondContact OE2-NZ 3.09Å
211	T	49.8	Very low	59.7	Low	126 Å²	126	154 Å²	154	77%	0.773	79%	0.786	S	S	*	*			trans	-77.4	73.1	155.4	39	0	0	0	0	108.1	E209 N213	E209-T211 PolarHBondContact O-N 3.17Å; T211-N213 VanDerWaalsContact C-N 3.28Å; T211-N213 PolarHBondContact O-N 3.28Å
212	K	50.4	Low	60	Low	149 Å²	149	158.8 Å²	158.8	65%	0.648	79%	0.787	S	S	*	*			trans	-55.9	93.9	166.2	-82.7	170.4	174.4	143.9	0	108.1	E210 P214	E210-K212 HydrophobicContact CB-CG 4.4Å; E210-K212 PolarHBondContact O-N 2.8Å; E210-K212 WeakPolarHBondContact OE1-CE 3.45Å; E210-K212 IonicContact OE1-NZ 2.74Å; E210-K212 PolarHBondContact OE1-NZ 3.28Å; E210-K212 WeakPolarHBondContact OE2-CE 3.3Å; E210-K212 IonicContact OE2-NZ 2.67Å; E210-K212 PolarHBondContact OE2-NZ 3.09Å; K212-P214 WeakPolarHBondContact O-CD 3.49Å; K212-P214 VanDerWaalsContact O-N 3.12Å
213	N	53.5	Low	59.8	Low	141 Å²	141	162.3 Å²	162.3	75%	0.754	79%	0.794	S	S	*	*			trans	-52.4	120.9	167.9	-73.3	-48.7	0	0	0	107.6	T211 K215	T211-N213 VanDerWaalsContact C-N 3.28Å; T211-N213 PolarHBondContact O-N 3.28Å; N213-K215 PolarHBondContact O-N 2.89Å; N213-K215 VanDerWaalsContact O-N 3.09Å
214	P	58.8	Low	60.8	Low	113 Å²	113	162.8 Å²	162.8	73%	0.734	80%	0.795	S	S	*	*			trans	-61.4	121.8	-177.3	23.7	-31.6	0	0	0	107.8	K212 Q216	K212-P214 WeakPolarHBondContact O-CD 3.49Å; K212-P214 VanDerWaalsContact O-N 3.12Å; P214-Q216 PolarHBondContact O-N 3.01Å
215	K	57.8	Low	61.7	Low	206 Å²	206	159.9 Å²	159.9	90%	0.896	79%	0.785	S	S	*	*			trans	-51.2	109.1	174.9	-73	178.3	178.2	177.7	0	107.9	N213 K217	N213-K215 PolarHBondContact O-N 2.89Å; N213-K215 VanDerWaalsContact O-N 3.09Å; K215-K217 PolarHBondContact O-N 2.92Å
216	Q	64.1	Low	62.6	Low	182 Å²	182	158.9 Å²	158.9	85%	0.85	78%	0.781	S	S	*	*			trans	-62.3	111.1	177	-69.4	-178.6	-12.3	0	0	107.6	P214 I218	P214-Q216 PolarHBondContact O-N 3.01Å; Q216-I218 PolarHBondContact O-N 2.61Å; Q216-I218 VanDerWaalsContact O-N 3.08Å
217	K	67.2	Low	63.5	Low	192 Å²	192	156 Å²	156	84%	0.835	78%	0.777	S	S	*	*			trans	-74.7	100.3	178.1	-169.6	176.9	-178.2	-179.4	0	107.6	K215 V219	K215-K217 PolarHBondContact O-N 2.92Å; K217-V219 PolarHBondContact O-N 3.01Å; K217-V219 VanDerWaalsContact O-N 3.09Å
218	I	72.9	Confident	64.3	Low	160 Å²	160	152.7 Å²	152.7	82%	0.821	77%	0.769	S	S	*	*			trans	-61.2	113.3	175.1	-59.1	172.4	0	0	0	107.6	Q216	Q216-I218 PolarHBondContact O-N 2.61Å; Q216-I218 VanDerWaalsContact O-N 3.08Å
219	V	76.1	Confident	64.6	Low	119 Å²	119	148.5 Å²	148.5	72%	0.721	77%	0.767	S	S	*	*			trans	-76.6	127.4	175.1	-177.9	0	0	0	0	107.8	K217 T221	K217-V219 PolarHBondContact O-N 3.01Å; K217-V219 VanDerWaalsContact O-N 3.09Å; V219-T221 PolarHBondContact O-N 3.09Å; V219-T221 VanDerWaalsContact O-N 3.1Å
220	Q	75.4	Confident	65	Low	187 Å²	187	144.3 Å²	144.3	87%	0.874	76%	0.762	S	S	*	*			trans	-61.4	113.6	176.6	-177.1	175.9	-7.1	0	0	109.7
221	T	78.4	Confident	65	Low	128 Å²	128	144 Å²	144	79%	0.785	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-75.1	135.1	176.1	53.4	0	0	0	0	110.1	V219	V219-T221 PolarHBondContact O-N 3.09Å; V219-T221 VanDerWaalsContact O-N 3.1Å
222	R	79.8	Confident	65.1	Low	218 Å²	218	145.7 Å²	145.7	82%	0.823	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-61.9	143.2	172.1	-173.4	179	171.3	-177	-5	109.5
223	R	71	Confident	65	Low	218 Å²	218	147.7 Å²	147.7	82%	0.823	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-55.2	132.6	172.4	-178.4	-179.2	176	170.5	0	109.9
224	P	75.4	Confident	64.6	Low	110 Å²	110	146.5 Å²	146.5	71%	0.714	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-58.7	145.4	173.7	-22	32.1	0	0	0	111.7
225	D	78.9	Confident	63.9	Low	126 Å²	126	148.6 Å²	148.6	67%	0.674	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-64.1	143	177.3	-67.5	-44.9	0	0	0	110.7
226	P	66.4	Low	62.9	Low	99 Å²	99	144.5 Å²	144.5	64%	0.643	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-62.9	147.6	178.3	26.4	-33	0	0	0	110.6
227	P	67.7	Low	61.7	Low	108 Å²	108	144.4 Å²	144.4	70%	0.701	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-59.9	141.6	177.7	23.4	-31.6	0	0	0	111	A229	P227-A229 PolarHBondContact O-N 2.74Å
228	T	60.8	Low	60.4	Low	116 Å²	116	143 Å²	143	71%	0.712	78%	0.775	S	S	*	*	G	3₁₀ helix	trans	-60.7	10.5	-170.9	-23.2	0	0	0	0	116	A230 L231	T228-A230 PolarHBondContact O-N 2.67Å; T228-L231 HydrophobicContact CG2-CB 4.5Å; T228-L231 HydrophobicContact CG2-CD1 4.13Å
229	A	55.9	Low	58.7	Low	103 Å²	103	141.7 Å²	141.7	85%	0.851	78%	0.778	S	S	*	*	G	3₁₀ helix	trans	-75.8	-8.1	175	0	0	0	0	0	113.3	P227	P227-A229 PolarHBondContact O-N 2.74Å
230	A	54.5	Low	56.9	Low	86 Å²	86	140.7 Å²	140.7	71%	0.711	78%	0.782	S	S	*	*	G	3₁₀ helix	trans	-108.1	15.7	-178.9	0	0	0	0	0	114.3	T228	T228-A230 PolarHBondContact O-N 2.67Å
231	L	49.7	Very low	55.4	Low	138 Å²	138	143.6 Å²	143.6	72%	0.723	80%	0.803	S	S	*	*			trans	-113	27.2	-174.8	-84.3	177	0	0	0	114.8	T228	T228-L231 HydrophobicContact CG2-CB 4.5Å; T228-L231 HydrophobicContact CG2-CD1 4.13Å
232	N	51.8	Low	54.3	Low	160 Å²	160	144.4 Å²	144.4	86%	0.856	80%	0.803	S	S	*	*			trans	-130.3	82.3	167.1	-76.8	-24.9	0	0	0	109.4
233	E	48.8	Very low	53	Low	191 Å²	191	140.5 Å²	140.5	89%	0.893	80%	0.802	S	S	*	*			trans	-171	73.9	148.3	-105.9	171.6	-162.9	0	0	108.8	Q235	E233-Q235 PolarHBondContact O-N 2.74Å
234	S	44.5	Very low	52	Low	116 Å²	116	136.2 Å²	136.2	81%	0.811	80%	0.801	S	S	*	*			trans	-85.6	91.8	159.3	51.2	0	0	0	0	107.9
235	Q	44.5	Very low	50.6	Low	158 Å²	158	137.8 Å²	137.8	74%	0.738	81%	0.806	S	S	*	*			trans	-89.6	103.3	166.4	-150.3	171.2	24.9	0	0	107.8	E233 F237	E233-Q235 PolarHBondContact O-N 2.74Å; Q235-F237 PolarHBondContact O-N 2.91Å
236	T	37.6	Very low	48.8	Very low	120 Å²	120	138.5 Å²	138.5	74%	0.736	82%	0.815	S	S	*	*			trans	-68.5	116.6	173.3	43.8	0	0	0	0	109.4
237	F	38.8	Very low	47.6	Very low	180 Å²	180	141.1 Å²	141.1	79%	0.789	83%	0.826	S	S	*	*			trans	-89.6	102.6	164.7	-74	-84.2	0	0	0	108.4	Q235	Q235-F237 PolarHBondContact O-N 2.91Å
238	D	38.4	Very low	46.2	Very low	163 Å²	163	143.5 Å²	143.5	87%	0.872	84%	0.835	S	S	*	*			trans	-75.3	119.5	164.1	-86.6	-45.4	0	0	0	108.9
239	C	37.2	Very low	45.1	Very low	132 Å²	132	145.6 Å²	145.6	89%	0.892	85%	0.845	S	S	*	*			trans	-103.9	109.3	173.3	-162.9	0	0	0	0	107.3
240	A	39.8	Very low	44.2	Very low	98 Å²	98	149.2 Å²	149.2	81%	0.81	84%	0.844	S	S	*	*			trans	-107	128.4	168.3	0	0	0	0	0	109.2
241	L	44.3	Very low	43.2	Very low	248 Å²	248	154.9 Å²	154.9	100%	1.298	86%	0.856	S	S	*	*			trans	-70.7	0	171	-82.2	159.5	0	0	0	111.7

Retrieved 241 of 241 residues in 313.9 ms (Link to these results)

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