G4VK76_SCHMA Loading...

Rho GDP-dissociation inhibitor-related

AlphaFold DB , UniProt , Accession G4VK76, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 200 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	39.1	Very low	40.3	Very low	240 Å²	240	146.6 Å²	146.6	100%	1.182	83%	0.832	S	S	*	*				0	104.3	0	-81.2	166.5	159.6	0	0	105.9
2	A	39.1	Very low	40.5	Very low	104 Å²	104	148.1 Å²	148.1	86%	0.86	83%	0.827	S	S	*	*			trans	-89.5	106.6	177.2	0	0	0	0	0	106.6
3	E	35.9	Very low	40.8	Very low	183 Å²	183	143.5 Å²	143.5	86%	0.855	81%	0.811	S	S	*	*			trans	-77.4	126.4	170.6	-69.6	-179.9	166.8	0	0	107.9	S5	E3-S5 PolarHBondContact O-N 3.47Å
4	P	42.6	Very low	41.4	Very low	119 Å²	119	143.5 Å²	143.5	77%	0.773	81%	0.808	S	S	*	*			trans	-73.4	121.8	-178.5	27.5	-30.4	0	0	0	110	V6	P4-V6 PolarHBondContact O-N 3.21Å
5	S	41.1	Very low	42	Very low	108 Å²	108	140.2 Å²	140.2	76%	0.755	79%	0.792	S	S	*	*			trans	-62.4	111.4	167.7	48.5	0	0	0	0	109.3	E3 E7	E3-S5 PolarHBondContact O-N 3.47Å; S5-E7 PolarHBondContact O-N 3.19Å
6	V	44	Very low	42.8	Very low	130 Å²	130	142.6 Å²	142.6	79%	0.788	79%	0.791	S	S	*	*			trans	-71.2	106.6	165.7	-179.5	0	0	0	0	106	P4 E8	P4-V6 PolarHBondContact O-N 3.21Å; V6-E8 PolarHBondContact O-N 3.01Å
7	E	40.4	Very low	43.8	Very low	181 Å²	181	142.9 Å²	142.9	85%	0.846	79%	0.791	S	S	*	*			trans	-63.2	104.5	167.1	-76.4	179.2	156.4	0	0	107.8	S5 G9	S5-E7 PolarHBondContact O-N 3.19Å; E7-G9 PolarHBondContact O-N 3.37Å
8	E	40.5	Very low	45.6	Very low	187 Å²	187	144 Å²	144	87%	0.874	79%	0.789	S	S	*	*			trans	-68.1	79.9	165.3	-71.4	-178.8	159.6	0	0	108.1	V6 D10	V6-E8 PolarHBondContact O-N 3.01Å; E8-D10 PolarHBondContact O-N 3.34Å
9	G	38.1	Very low	47.6	Very low	63 Å²	63	143.1 Å²	143.1	65%	0.649	77%	0.774	S	S	*	*			trans	-71.7	102.7	171.4	0	0	0	0	0	110.2	E7 L11	E7-G9 PolarHBondContact O-N 3.37Å; G9-L11 PolarHBondContact O-N 2.92Å
10	D	39.5	Very low	49.4	Very low	130 Å²	130	144.8 Å²	144.8	70%	0.695	77%	0.774	S	S	*	*			trans	0.3	97.8	157.3	-82	-33.8	0	0	0	115.4	E8 E12	E8-D10 PolarHBondContact O-N 3.34Å; D10-E12 HydrophobicContact CB-CB 4.42Å; D10-E12 PolarHBondContact O-N 2.7Å
11	L	42.7	Very low	51.3	Low	168 Å²	168	140.3 Å²	140.3	88%	0.88	75%	0.753	S	S	*	*			trans	-80.5	30.8	156	-73	171.6	0	0	0	111.1	G9 S13	G9-L11 PolarHBondContact O-N 2.92Å; L11-S13 PolarHBondContact O-N 3.1Å
12	E	42.5	Very low	53.5	Low	164 Å²	164	132.7 Å²	132.7	77%	0.766	72%	0.721	S	S	*	*			trans	-75.7	60	168	-67.9	-162.5	167.1	0	0	110.3	D10 D14	D10-E12 HydrophobicContact CB-CB 4.42Å; D10-E12 PolarHBondContact O-N 2.7Å; E12-D14 VanDerWaalsContact C-N 3.27Å; E12-D14 PolarHBondContact O-N 2.78Å
13	S	45.2	Very low	55.8	Low	89 Å²	89	134.6 Å²	134.6	62%	0.622	71%	0.712	S	S	*	*			trans	-95.5	70.8	155.8	64.6	0	0	0	0	107.3	L11 V15	L11-S13 PolarHBondContact O-N 3.1Å; S13-V15 PolarHBondContact O-N 3.35Å
14	D	48.6	Very low	58.3	Low	143 Å²	143	131.6 Å²	131.6	77%	0.765	70%	0.696	S	S	*	*			trans	-70.8	51.5	165.9	-149.6	6.6	0	0	0	108.7	E12 K16	E12-D14 VanDerWaalsContact C-N 3.27Å; E12-D14 PolarHBondContact O-N 2.78Å; D14-K16 PolarHBondContact O-N 2.84Å
15	V	51.3	Low	60.4	Low	94 Å²	94	130.8 Å²	130.8	57%	0.57	68%	0.678	S	S	*	*			trans	-64.2	91.6	164	-179.9	0	0	0	0	102.8	S13 N17	S13-V15 PolarHBondContact O-N 3.35Å; V15-N17 PolarHBondContact O-N 2.8Å
16	K	53.8	Low	62.8	Low	178 Å²	178	127.6 Å²	127.6	77%	0.774	65%	0.654	S	S	*	*			trans	-50	89.9	157.7	-72.3	-179.6	179.9	176.8	0	105.4	D14 E18	D14-K16 PolarHBondContact O-N 2.84Å; K16-E18 PolarHBondContact O-N 3.1Å
17	N	60.2	Low	64.8	Low	148 Å²	148	121.8 Å²	121.8	79%	0.791	62%	0.618	S	S	*	*			trans	-66.9	77.8	171.8	-95.5	-49.7	0	0	0	104.8	V15 Y19	V15-N17 PolarHBondContact O-N 2.8Å; N17-Y19 PolarHBondContact O-N 2.84Å
18	E	77.2	Confident	67	Low	163 Å²	163	119.7 Å²	119.7	76%	0.762	61%	0.608	S	S	*	*			trans	-66.7	93.5	174.6	-171.2	174.1	-163.2	0	0	105.6	K16 K20	K16-E18 PolarHBondContact O-N 3.1Å; E18-K20 PolarHBondContact O-N 2.76Å; E18-K20 VanDerWaalsContact O-N 3.14Å
19	Y	82.1	Confident	69.3	Low	127 Å²	127	115.2 Å²	115.2	50%	0.498	59%	0.588	S	S	.	*	P	Polyproline II helix	trans	-53.2	119.7	179.9	172.1	-98.5	0	0	0	109.2	N17 P21 M140 D179	N17-Y19 PolarHBondContact O-N 2.84Å; Y19-P21 HydrophobicContact CD1-CG 4.37Å; Y19-P21 HydrophobicContact CE1-CB 4.39Å; Y19-P21 HydrophobicContact CE1-CG 4Å; Y19-M140 HydrophobicContact CE1-CE 4.22Å; Y19-D179 WeakPolarHBondContact CE1-OD2 3.33Å; Y19-D179 PolarHBondContact OH-OD2 3.35Å
20	K	85.2	Confident	71.6	Confident	176 Å²	176	114.2 Å²	114.2	77%	0.765	57%	0.567	S	S	*	*	P	Polyproline II helix	trans	-99.1	116.5	174.2	-67.9	-176.4	-177.3	178.5	0	108.3	E18	E18-K20 PolarHBondContact O-N 2.76Å; E18-K20 VanDerWaalsContact O-N 3.14Å
21	P	87.4	Confident	73.7	Confident	52 Å²	52	110 Å²	110	34%	0.338	54%	0.543	S	S	.	.	P	Polyproline II helix	trans	-56.5	147.6	174.1	-28.8	37	0	0	0	112.9	Y19 D179	Y19-P21 HydrophobicContact CD1-CG 4.37Å; Y19-P21 HydrophobicContact CE1-CB 4.39Å; Y19-P21 HydrophobicContact CE1-CG 4Å; P21-D179 HydrophobicContact CB-CB 3.76Å; P21-D179 HydrophobicContact CG-CB 3.89Å
22	P	85.4	Confident	75.8	Confident	79 Å²	79	106.1 Å²	106.1	51%	0.513	52%	0.524	S	S	.	.	P	Polyproline II helix	trans	-65.3	164	170.9	30.7	-35.2	0	0	0	111.1	K24	P22-K24 PolarHBondContact O-N 2.65Å
23	E	87.2	Confident	77.8	Confident	145 Å²	145	101.3 Å²	101.3	68%	0.678	50%	0.503	S	S	*	.	P	Polyproline II helix	trans	-60.5	131.8	169.8	-173.6	-175.1	-156.6	0	0	110	R25	E23-R25 PolarHBondContact O-N 2.92Å; E23-R25 IonicContact OE2-CZ 2.82Å; E23-R25 IonicContact OE2-NE 2.69Å; E23-R25 IonicContact OE2-NH2 3.58Å; E23-R25 PolarHBondContact OE2-NH2 2.95Å
24	K	88.4	Confident	79.7	Confident	120 Å²	120	100.8 Å²	100.8	52%	0.522	49%	0.493	S	S	.	.	P	Polyproline II helix	trans	-57.2	127.9	174.5	-174.7	-178.5	-175.2	120.6	0	110.1	P22 D180	P22-K24 PolarHBondContact O-N 2.65Å; K24-D180 WeakPolarHBondContact CB-OD1 3.29Å; K24-D180 WeakPolarHBondContact CD-OD2 3.23Å; K24-D180 WeakPolarHBondContact CE-OD2 3.34Å; K24-D180 VanDerWaalsContact CG-OD2 3.3Å; K24-D180 WeakPolarHBondContact CG-OD2 3.43Å; K24-D180 IonicContact NZ-OD2 3.05Å; K24-D180 PolarHBondContact NZ-OD2 3.4Å
25	R	88.7	Confident	81.3	Confident	101 Å²	101	99.5 Å²	99.5	38%	0.381	48%	0.481	S	S	.	.			trans	-138.3	141.8	169.1	-63.2	-161.8	-177.5	-127.4	-3.5	110.4	E23 E29 I30	E23-R25 PolarHBondContact O-N 2.92Å; E23-R25 IonicContact OE2-CZ 2.82Å; E23-R25 IonicContact OE2-NE 2.69Å; E23-R25 IonicContact OE2-NH2 3.58Å; E23-R25 PolarHBondContact OE2-NH2 2.95Å; R25-E29 WeakPolarHBondContact CA-OE2 3.39Å; R25-E29 HydrophobicContact CB-CB 4.49Å; R25-I30 HydrophobicContact CB-CD1 4.17Å; R25-I30 HydrophobicContact CB-CG1 3.87Å
26	T	90.2	Very high	83	Confident	42 Å²	42	104.1 Å²	104.1	26%	0.258	50%	0.496	S	S	.	.			trans	-75.7	158.3	175.4	63.7	0	0	0	0	111.1	E28 E29 I30 D116	T26-E28 PolarHBondContact O-N 2.83Å; T26-E29 PolarHBondContact N-OE2 3.3Å; T26-E29 PolarHBondContact O-N 2.87Å; T26-E29 WeakPolarHBondContact OG1-CB 3.21Å; T26-E29 VanDerWaalsContact OG1-CD 3.26Å; T26-E29 WeakPolarHBondContact OG1-CG 3.39Å; T26-E29 PolarHBondContact OG1-N 3.03Å; T26-E29 VanDerWaalsContact OG1-N 3.13Å; T26-E29 PolarHBondContact OG1-OE2 2.61Å; T26-I30 VanDerWaalsContact O-CG1 3.31Å; T26-I30 WeakPolarHBondContact O-CG1 3.33Å; T26-I30 PolarHBondContact O-N 3.33Å; T26-D116 WeakPolarHBondContact CA-OD2 3.23Å; T26-D116 VanDerWaalsContact CB-OD2 3.27Å; T26-D116 WeakPolarHBondContact CB-OD2 3.48Å; T26-D116 WeakPolarHBondContact CG2-OD2 3.27Å
27	L	86.7	Confident	84.8	Confident	7 Å²	7	98.7 Å²	98.7	4%	0.037	48%	0.475	C	S	.	.	H	α-helix	trans	-53.2	-41.2	173	-179.7	68	0	0	0	111.7	I30 M31 L48 A51 L52 D116 I117 P146	L27-I30 PolarHBondContact O-N 3.05Å; L27-M31 WeakPolarHBondContact O-CB 3.48Å; L27-M31 PolarHBondContact O-N 3.34Å; L27-L48 HydrophobicContact CD1-CB 3.85Å; L27-L48 HydrophobicContact CD1-CD1 4.01Å; L27-L48 HydrophobicContact CD1-CD2 4Å; L27-L48 HydrophobicContact CD1-CG 4.17Å; L27-A51 HydrophobicContact CD1-CB 4.21Å; L27-A51 HydrophobicContact CD2-CB 3.72Å; L27-L52 HydrophobicContact CD2-CD2 3.74Å; L27-L52 HydrophobicContact CD2-CG 4.02Å; L27-L52 HydrophobicContact CG-CD2 3.74Å; L27-L52 HydrophobicContact CG-CG 4.18Å; L27-D116 VanDerWaalsContact CB-OD1 3.24Å; L27-D116 WeakPolarHBondContact CB-OD1 3.4Å; L27-D116 PolarHBondContact N-OD1 2.71Å; L27-I117 HydrophobicContact CB-CD1 4.17Å; L27-I117 HydrophobicContact CB-CG1 4.25Å; L27-I117 HydrophobicContact CD1-CD1 3.55Å; L27-I117 HydrophobicContact CD1-CG1 3.9Å; L27-I117 HydrophobicContact CG-CD1 4.48Å; L27-P146 HydrophobicContact CD2-CG 4.41Å
28	E	86.8	Confident	86.2	Confident	137 Å²	137	97.1 Å²	97.1	64%	0.64	46%	0.464	S	S	*	.	H	α-helix	trans	-67.2	-44.4	178.1	-65.7	-175.9	178	0	0	112	T26 M31 N32	T26-E28 PolarHBondContact O-N 2.83Å; E28-M31 PolarHBondContact O-N 3.29Å; E28-N32 WeakPolarHBondContact O-CB 3.16Å; E28-N32 VanDerWaalsContact O-CG 3.27Å; E28-N32 PolarHBondContact O-N 3.21Å; E28-N32 PolarHBondContact O-ND2 3.21Å
29	E	88.7	Confident	86.9	Confident	94 Å²	94	93.1 Å²	93.1	44%	0.439	45%	0.454	S	S	.	.	H	α-helix	trans	-62.1	-43.9	175.5	-73.6	164.5	152.6	0	0	111.3	R25 T26 M31 N32 L33	R25-E29 WeakPolarHBondContact CA-OE2 3.39Å; R25-E29 HydrophobicContact CB-CB 4.49Å; T26-E29 PolarHBondContact N-OE2 3.3Å; T26-E29 PolarHBondContact O-N 2.87Å; T26-E29 WeakPolarHBondContact OG1-CB 3.21Å; T26-E29 VanDerWaalsContact OG1-CD 3.26Å; T26-E29 WeakPolarHBondContact OG1-CG 3.39Å; T26-E29 PolarHBondContact OG1-N 3.03Å; T26-E29 VanDerWaalsContact OG1-N 3.13Å; T26-E29 PolarHBondContact OG1-OE2 2.61Å; E29-M31 VanDerWaalsContact C-N 3.3Å; E29-M31 PolarHBondContact O-N 2.97Å; E29-N32 PolarHBondContact O-N 3.41Å; E29-N32 VanDerWaalsContact O-N 3.13Å; E29-L33 WeakPolarHBondContact O-CG 3.47Å; E29-L33 PolarHBondContact O-N 3.48Å
30	I	85.9	Confident	87.3	Confident	41 Å²	41	90.2 Å²	90.2	21%	0.21	45%	0.446	C	S	.	.	H	α-helix	trans	-60.8	-42.7	178.5	-67.5	163.6	0	0	0	110.6	R25 T26 L27 N32 L33 K44 L48 I117	R25-I30 HydrophobicContact CB-CD1 4.17Å; R25-I30 HydrophobicContact CB-CG1 3.87Å; T26-I30 VanDerWaalsContact O-CG1 3.31Å; T26-I30 WeakPolarHBondContact O-CG1 3.33Å; T26-I30 PolarHBondContact O-N 3.33Å; L27-I30 PolarHBondContact O-N 3.05Å; I30-N32 VanDerWaalsContact C-N 3.32Å; I30-N32 PolarHBondContact O-N 2.88Å; I30-L33 PolarHBondContact O-N 3.16Å; I30-K44 HydrophobicContact CG2-CD 4.41Å; I30-K44 VanDerWaalsContact O-CD 3.28Å; I30-K44 WeakPolarHBondContact O-CD 3.48Å; I30-K44 WeakPolarHBondContact O-CE 3.3Å; I30-K44 PolarHBondContact O-NZ 3.13Å; I30-L48 HydrophobicContact CB-CD1 4.46Å; I30-L48 HydrophobicContact CG2-CD1 3.63Å; I30-I117 HydrophobicContact CD1-CD1 3.69Å
31	M	82.7	Confident	87.4	Confident	41 Å²	41	87.4 Å²	87.4	20%	0.202	43%	0.431	C	S	.	.	H	α-helix	trans	-68.8	-30.8	177.4	-164.8	66.1	167.8	0	0	112.8	L27 E28 E29 K44 E45 L52	L27-M31 WeakPolarHBondContact O-CB 3.48Å; L27-M31 PolarHBondContact O-N 3.34Å; E28-M31 PolarHBondContact O-N 3.29Å; E29-M31 VanDerWaalsContact C-N 3.3Å; E29-M31 PolarHBondContact O-N 2.97Å; M31-K44 HydrophobicContact SD-CB 4.03Å; M31-E45 HydrophobicContact CE-CB 3.91Å; M31-E45 HydrophobicContact CE-CG 4.18Å; M31-L52 HydrophobicContact CB-CD1 4.29Å; M31-L52 HydrophobicContact CE-CD1 3.81Å; M31-L52 HydrophobicContact CG-CD1 3.72Å; M31-L52 HydrophobicContact SD-CD1 3.9Å
32	N	86.9	Confident	87.4	Confident	87 Å²	87	90.3 Å²	90.3	47%	0.465	44%	0.438	S	S	.	.	H	α-helix	trans	-82.7	-15.1	178.8	-74.5	-46.8	0	0	0	113.8	E28 E29 I30 K35	E28-N32 WeakPolarHBondContact O-CB 3.16Å; E28-N32 VanDerWaalsContact O-CG 3.27Å; E28-N32 PolarHBondContact O-N 3.21Å; E28-N32 PolarHBondContact O-ND2 3.21Å; E29-N32 PolarHBondContact O-N 3.41Å; E29-N32 VanDerWaalsContact O-N 3.13Å; I30-N32 VanDerWaalsContact C-N 3.32Å; I30-N32 PolarHBondContact O-N 2.88Å; N32-K35 WeakPolarHBondContact O-CG 3.37Å; N32-K35 WeakPolarHBondContact OD1-CE 3.34Å; N32-K35 PolarHBondContact OD1-NZ 2.89Å
33	L	85.9	Confident	87.5	Confident	63 Å²	63	93.6 Å²	93.6	33%	0.33	44%	0.441	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.7	145.4	170.5	-75.8	168.9	0	0	0	110.7	E29 I30 K35 K44	E29-L33 WeakPolarHBondContact O-CG 3.47Å; E29-L33 PolarHBondContact O-N 3.48Å; I30-L33 PolarHBondContact O-N 3.16Å; L33-K35 VanDerWaalsContact C-N 3.3Å; L33-K35 PolarHBondContact O-N 2.85Å; L33-K44 VanDerWaalsContact C-NZ 3.3Å; L33-K44 VanDerWaalsContact CB-NZ 3.29Å; L33-K44 PolarHBondContact O-NZ 3.34Å
34	D	85.1	Confident	87.5	Confident	78 Å²	78	87.7 Å²	87.7	42%	0.417	41%	0.413	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.2	31.3	172.6	-40.7	-55.4	0	0	0	114.5	E36 D37 L40 K44	D34-E36 PolarHBondContact O-N 2.89Å; D34-E36 VanDerWaalsContact O-N 3.16Å; D34-D37 HydrophobicContact CB-CB 4.35Å; D34-D37 PolarHBondContact O-N 2.93Å; D34-L40 HydrophobicContact CB-CB 4.03Å; D34-L40 HydrophobicContact CB-CD1 3.75Å; D34-K44 IonicContact OD2-NZ 2.71Å; D34-K44 PolarHBondContact OD2-NZ 3.41Å
35	K	81.8	Confident	87.4	Confident	117 Å²	117	87 Å²	87	51%	0.509	41%	0.412	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.9	-31.2	178.2	-79.1	-176.7	-175	-174.9	0	114	N32 L33 D37	N32-K35 WeakPolarHBondContact O-CG 3.37Å; N32-K35 WeakPolarHBondContact OD1-CE 3.34Å; N32-K35 PolarHBondContact OD1-NZ 2.89Å; L33-K35 VanDerWaalsContact C-N 3.3Å; L33-K35 PolarHBondContact O-N 2.85Å; K35-D37 VanDerWaalsContact C-N 3.27Å
36	E	86	Confident	87.2	Confident	190 Å²	190	86 Å²	86	89%	0.888	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.7	-13.7	179.5	-53.9	-53.5	135.3	0	0	112.6	D34	D34-E36 PolarHBondContact O-N 2.89Å; D34-E36 VanDerWaalsContact O-N 3.16Å
37	D	92.1	Very high	87	Confident	64 Å²	64	88 Å²	88	34%	0.342	43%	0.434	S	S	.	.			trans	-98	103.1	175.3	-171.7	-37.5	0	0	0	109.8	D34 K35 S39 L40 R41	D34-D37 HydrophobicContact CB-CB 4.35Å; D34-D37 PolarHBondContact O-N 2.93Å; K35-D37 VanDerWaalsContact C-N 3.27Å; D37-S39 PolarHBondContact O-N 2.8Å; D37-S39 WeakPolarHBondContact OD1-CA 3.48Å; D37-S39 WeakPolarHBondContact OD1-CB 3.19Å; D37-S39 PolarHBondContact OD1-N 3.46Å; D37-S39 PolarHBondContact OD1-OG 2.84Å; D37-L40 HydrophobicContact CB-CB 4.01Å; D37-L40 HydrophobicContact CB-CD1 4.02Å; D37-L40 HydrophobicContact CB-CG 4.17Å; D37-L40 PolarHBondContact O-N 2.9Å; D37-L40 PolarHBondContact OD1-N 3.21Å; D37-L40 WeakPolarHBondContact OD2-CD1 3.43Å; D37-R41 WeakPolarHBondContact O-CB 3.39Å; D37-R41 PolarHBondContact O-N 2.85Å
38	E	90.1	Very high	86.9	Confident	116 Å²	116	88.3 Å²	88.3	54%	0.542	44%	0.435	S	S	.	.	H	α-helix	trans	-57.7	-36.7	-179.7	-169.6	-173.1	165.9	0	0	112.4	K42	E38-K42 HydrophobicContact CG-CD 4.45Å; E38-K42 WeakPolarHBondContact O-CB 3.41Å; E38-K42 WeakPolarHBondContact O-CG 3.23Å; E38-K42 PolarHBondContact O-N 3.09Å; E38-K42 WeakPolarHBondContact OE1-CE 3.47Å; E38-K42 IonicContact OE1-NZ 2.64Å; E38-K42 PolarHBondContact OE1-NZ 3.43Å
39	S	92.3	Very high	86.4	Confident	79 Å²	79	82.8 Å²	82.8	55%	0.552	42%	0.416	S	S	*	.	H	α-helix	trans	-71.4	-44.2	-177.2	75.5	0	0	0	0	111.5	D37 K42 Y43	D37-S39 PolarHBondContact O-N 2.8Å; D37-S39 WeakPolarHBondContact OD1-CA 3.48Å; D37-S39 WeakPolarHBondContact OD1-CB 3.19Å; D37-S39 PolarHBondContact OD1-N 3.46Å; D37-S39 PolarHBondContact OD1-OG 2.84Å; S39-K42 PolarHBondContact O-N 2.91Å; S39-Y43 WeakPolarHBondContact O-CB 3.22Å; S39-Y43 PolarHBondContact O-N 3.49Å
40	L	89.6	Confident	85.8	Confident	65 Å²	65	81.2 Å²	81.2	34%	0.34	41%	0.414	S	S	.	.	H	α-helix	trans	-68.3	-38.5	176.1	-69.5	178.1	0	0	0	111.6	D34 D37 Y43 K44	D34-L40 HydrophobicContact CB-CB 4.03Å; D34-L40 HydrophobicContact CB-CD1 3.75Å; D37-L40 HydrophobicContact CB-CB 4.01Å; D37-L40 HydrophobicContact CB-CD1 4.02Å; D37-L40 HydrophobicContact CB-CG 4.17Å; D37-L40 PolarHBondContact O-N 2.9Å; D37-L40 PolarHBondContact OD1-N 3.21Å; D37-L40 WeakPolarHBondContact OD2-CD1 3.43Å; L40-Y43 PolarHBondContact O-N 3.03Å; L40-K44 WeakPolarHBondContact O-CB 3.48Å; L40-K44 WeakPolarHBondContact O-CG 3.47Å; L40-K44 PolarHBondContact O-N 2.87Å
41	R	87.4	Confident	85.6	Confident	117 Å²	117	79.6 Å²	79.6	44%	0.442	41%	0.406	S	S	.	.	H	α-helix	trans	-61	-47.6	175.6	-168.6	-177.9	65.7	138.5	0.6	111.5	D37 Y43 K44 E45	D37-R41 WeakPolarHBondContact O-CB 3.39Å; D37-R41 PolarHBondContact O-N 2.85Å; R41-Y43 VanDerWaalsContact C-N 3.34Å; R41-Y43 PolarHBondContact O-N 2.99Å; R41-K44 PolarHBondContact O-N 3.38Å; R41-E45 WeakPolarHBondContact O-CB 3.33Å; R41-E45 PolarHBondContact O-N 3.03Å
42	K	88.1	Confident	85.1	Confident	113 Å²	113	81.2 Å²	81.2	49%	0.491	42%	0.415	S	S	.	.	H	α-helix	trans	-62.7	-39.7	175.5	-75.9	179.3	-176.4	169.8	0	112.1	E38 S39 E45 A46	E38-K42 HydrophobicContact CG-CD 4.45Å; E38-K42 WeakPolarHBondContact O-CB 3.41Å; E38-K42 WeakPolarHBondContact O-CG 3.23Å; E38-K42 PolarHBondContact O-N 3.09Å; E38-K42 WeakPolarHBondContact OE1-CE 3.47Å; E38-K42 IonicContact OE1-NZ 2.64Å; E38-K42 PolarHBondContact OE1-NZ 3.43Å; S39-K42 PolarHBondContact O-N 2.91Å; K42-E45 PolarHBondContact O-N 3.28Å; K42-A46 WeakPolarHBondContact O-CB 3.44Å; K42-A46 PolarHBondContact O-N 2.61Å
43	Y	86.7	Confident	84	Confident	148 Å²	148	80 Å²	80	58%	0.58	42%	0.423	S	S	*	.	H	α-helix	trans	-62.2	-48.6	176.6	176	-99.1	0	0	0	111.9	S39 L40 R41 A46 L47	S39-Y43 WeakPolarHBondContact O-CB 3.22Å; S39-Y43 PolarHBondContact O-N 3.49Å; L40-Y43 PolarHBondContact O-N 3.03Å; R41-Y43 VanDerWaalsContact C-N 3.34Å; R41-Y43 PolarHBondContact O-N 2.99Å; Y43-A46 PolarHBondContact O-N 3Å; Y43-L47 HydrophobicContact CE1-CD2 4.01Å; Y43-L47 VanDerWaalsContact O-CB 3.32Å; Y43-L47 WeakPolarHBondContact O-CB 3.34Å; Y43-L47 PolarHBondContact O-N 2.82Å
44	K	88	Confident	83.4	Confident	21 Å²	21	82.4 Å²	82.4	9%	0.091	44%	0.441	C	S	.	.	H	α-helix	trans	-64	-41.9	176.9	-70.7	174.2	-176.7	179.4	0	111.8	I30 M31 L33 D34 L40 R41 A46 L47 L48	I30-K44 HydrophobicContact CG2-CD 4.41Å; I30-K44 VanDerWaalsContact O-CD 3.28Å; I30-K44 WeakPolarHBondContact O-CD 3.48Å; I30-K44 WeakPolarHBondContact O-CE 3.3Å; I30-K44 PolarHBondContact O-NZ 3.13Å; M31-K44 HydrophobicContact SD-CB 4.03Å; L33-K44 VanDerWaalsContact C-NZ 3.3Å; L33-K44 VanDerWaalsContact CB-NZ 3.29Å; L33-K44 PolarHBondContact O-NZ 3.34Å; D34-K44 IonicContact OD2-NZ 2.71Å; D34-K44 PolarHBondContact OD2-NZ 3.41Å; L40-K44 WeakPolarHBondContact O-CB 3.48Å; L40-K44 WeakPolarHBondContact O-CG 3.47Å; L40-K44 PolarHBondContact O-N 2.87Å; R41-K44 PolarHBondContact O-N 3.38Å; K44-A46 PolarHBondContact O-N 2.88Å; K44-L47 PolarHBondContact O-N 2.96Å; K44-L48 WeakPolarHBondContact O-CA 3.28Å; K44-L48 VanDerWaalsContact O-CB 3.23Å; K44-L48 WeakPolarHBondContact O-CB 3.25Å; K44-L48 PolarHBondContact O-N 2.94Å
45	E	85.2	Confident	83.3	Confident	107 Å²	107	80.6 Å²	80.6	50%	0.5	43%	0.429	S	S	.	.	H	α-helix	trans	-61.6	-43.4	175.8	-170.8	174.7	-171.5	0	0	111.8	M31 R41 K42 L47 G49	M31-E45 HydrophobicContact CE-CB 3.91Å; M31-E45 HydrophobicContact CE-CG 4.18Å; R41-E45 WeakPolarHBondContact O-CB 3.33Å; R41-E45 PolarHBondContact O-N 3.03Å; K42-E45 PolarHBondContact O-N 3.28Å; E45-L47 VanDerWaalsContact C-N 3.33Å; E45-L47 PolarHBondContact O-N 2.85Å; E45-G49 WeakPolarHBondContact O-CA 3.49Å; E45-G49 PolarHBondContact O-N 2.95Å
46	A	85.6	Confident	83.6	Confident	79 Å²	79	83.9 Å²	83.9	65%	0.653	44%	0.443	S	S	*	.	H	α-helix	trans	-64	-38.2	175	0	0	0	0	0	112.4	K42 Y43 K44	K42-A46 WeakPolarHBondContact O-CB 3.44Å; K42-A46 PolarHBondContact O-N 2.61Å; Y43-A46 PolarHBondContact O-N 3Å; K44-A46 PolarHBondContact O-N 2.88Å
47	L	84.6	Confident	83.8	Confident	83 Å²	83	76.8 Å²	76.8	44%	0.435	41%	0.413	S	S	.	.	H	α-helix	trans	-81.9	-34.7	-176.8	-173.4	64.6	0	0	0	113.7	Y43 K44 E45 R145	Y43-L47 HydrophobicContact CE1-CD2 4.01Å; Y43-L47 VanDerWaalsContact O-CB 3.32Å; Y43-L47 WeakPolarHBondContact O-CB 3.34Å; Y43-L47 PolarHBondContact O-N 2.82Å; K44-L47 PolarHBondContact O-N 2.96Å; E45-L47 VanDerWaalsContact C-N 3.33Å; E45-L47 PolarHBondContact O-N 2.85Å; L47-R145 PolarHBondContact O-NH1 2.66Å
48	L	85	Confident	83.9	Confident	14 Å²	14	75.7 Å²	75.7	7%	0.073	41%	0.409	C	S	.	.	H	α-helix	trans	-125.2	-14.3	-166.5	-61.7	177.6	0	0	0	113.3	L27 I30 K44 P50 A51 I117 R145	L27-L48 HydrophobicContact CD1-CB 3.85Å; L27-L48 HydrophobicContact CD1-CD1 4.01Å; L27-L48 HydrophobicContact CD1-CD2 4Å; L27-L48 HydrophobicContact CD1-CG 4.17Å; I30-L48 HydrophobicContact CB-CD1 4.46Å; I30-L48 HydrophobicContact CG2-CD1 3.63Å; K44-L48 WeakPolarHBondContact O-CA 3.28Å; K44-L48 VanDerWaalsContact O-CB 3.23Å; K44-L48 WeakPolarHBondContact O-CB 3.25Å; K44-L48 PolarHBondContact O-N 2.94Å; L48-P50 VanDerWaalsContact C-CD 3.49Å; L48-P50 VanDerWaalsContact C-N 3.32Å; L48-A51 WeakPolarHBondContact O-CA 3.38Å; L48-A51 VanDerWaalsContact O-CB 3.29Å; L48-A51 WeakPolarHBondContact O-CB 3.46Å; L48-A51 PolarHBondContact O-N 2.86Å; L48-I117 HydrophobicContact CD1-CD1 4.27Å; L48-I117 HydrophobicContact CD2-CD1 3.93Å; L48-R145 HydrophobicContact CD2-CB 4.48Å
49	G	76.3	Confident	84.2	Confident	22 Å²	22	71.6 Å²	71.6	23%	0.227	39%	0.39	C	S	.	.	G	3₁₀ helix	trans	-50.3	-43.8	178.6	0	0	0	0	0	114	E45 A51 L52	E45-G49 WeakPolarHBondContact O-CA 3.49Å; E45-G49 PolarHBondContact O-N 2.95Å; G49-A51 PolarHBondContact O-N 2.73Å; G49-A51 VanDerWaalsContact O-N 3.13Å; G49-L52 PolarHBondContact O-N 2.94Å
50	P	77.3	Confident	84.3	Confident	61 Å²	61	71.6 Å²	71.6	40%	0.396	39%	0.388	S	S	.	.	G	3₁₀ helix	trans	-61.5	-19	174.4	-25.3	35.5	0	0	0	114.9	L48 T54	L48-P50 VanDerWaalsContact C-CD 3.49Å; L48-P50 VanDerWaalsContact C-N 3.32Å; P50-T54 PolarHBondContact O-OG1 3.28Å
51	A	80.5	Confident	84.5	Confident	6 Å²	6	74.7 Å²	74.7	5%	0.05	40%	0.401	C	S	.	.	G	3₁₀ helix	trans	-87.2	-20.1	179.2	0	0	0	0	0	113.5	L27 L48 G49 G53 R145 P146	L27-A51 HydrophobicContact CD1-CB 4.21Å; L27-A51 HydrophobicContact CD2-CB 3.72Å; L48-A51 WeakPolarHBondContact O-CA 3.38Å; L48-A51 VanDerWaalsContact O-CB 3.29Å; L48-A51 WeakPolarHBondContact O-CB 3.46Å; L48-A51 PolarHBondContact O-N 2.86Å; G49-A51 PolarHBondContact O-N 2.73Å; G49-A51 VanDerWaalsContact O-N 3.13Å; A51-G53 PolarHBondContact O-N 2.67Å; A51-R145 HydrophobicContact CB-CB 4.21Å; A51-P146 HydrophobicContact CB-CB 4.26Å; A51-P146 HydrophobicContact CB-CG 4.37Å; A51-P146 WeakPolarHBondContact CB-O 3.4Å
52	L	72.5	Confident	84.8	Confident	76 Å²	76	73.9 Å²	73.9	40%	0.398	40%	0.398	S	S	.	.	S	Bend	trans	-79.3	31.5	-174	-75.4	166.1	0	0	0	114.6	L27 M31 G49	L27-L52 HydrophobicContact CD2-CD2 3.74Å; L27-L52 HydrophobicContact CD2-CG 4.02Å; L27-L52 HydrophobicContact CG-CD2 3.74Å; L27-L52 HydrophobicContact CG-CG 4.18Å; M31-L52 HydrophobicContact CB-CD1 4.29Å; M31-L52 HydrophobicContact CE-CD1 3.81Å; M31-L52 HydrophobicContact CG-CD1 3.72Å; M31-L52 HydrophobicContact SD-CD1 3.9Å; G49-L52 PolarHBondContact O-N 2.94Å
53	G	64.9	Low	85.1	Confident	61 Å²	61	73.9 Å²	73.9	63%	0.629	41%	0.412	S	S	*	.	S	Bend	trans	104.1	19	170.4	0	0	0	0	0	116.3	A51 F55	A51-G53 PolarHBondContact O-N 2.67Å; G53-F55 PolarHBondContact O-N 3.44Å
54	T	72.1	Confident	85.5	Confident	114 Å²	114	68.7 Å²	68.7	70%	0.699	40%	0.399	S	S	*	.	S	Bend	trans	-76.6	-9.5	169.1	57.5	0	0	0	0	113.1	P50	P50-T54 PolarHBondContact O-OG1 3.28Å
55	F	82.5	Confident	85.9	Confident	40 Å²	40	69.4 Å²	69.4	18%	0.175	40%	0.404	C	S	.	.	S	Bend	trans	-121.1	147.8	-179.5	74.1	-84.5	0	0	0	112.3	G53 P146 Q147 G148	G53-F55 PolarHBondContact O-N 3.44Å; F55-P146 HydrophobicContact CE1-CB 3.78Å; F55-P146 WeakPolarHBondContact CE1-O 3.48Å; F55-P146 HydrophobicContact CZ-CB 3.43Å; F55-P146 VanDerWaalsContact CZ-CB 3.43Å; F55-Q147 VanDerWaalsContact CD2-C 3.43Å; F55-Q147 VanDerWaalsContact CE2-C 3.45Å; F55-Q147 WeakPolarHBondContact CE2-O 3.34Å; F55-G148 VanDerWaalsContact CD2-CA 3.45Å; F55-G148 VanDerWaalsContact CD2-N 3.3Å
56	K	88.2	Confident	86.5	Confident	186 Å²	186	64.5 Å²	64.5	81%	0.809	38%	0.381	S	S	*	.			trans	-72.2	126.6	170.9	-177.9	-177.7	177	-174.8	0	108.9	P58	K56-P58 WeakPolarHBondContact O-CD 3.32Å; K56-P58 VanDerWaalsContact O-N 3.16Å
57	V	92	Very high	87.1	Confident	41 Å²	41	61 Å²	61	25%	0.248	35%	0.352	C	S	.	.			trans	-51.6	119.6	172.8	177.2	0	0	0	0	109.1	F59 P60 Q114	V57-F59 PolarHBondContact O-N 3.23Å; V57-P60 HydrophobicContact CG1-CB 4.44Å; V57-P60 WeakPolarHBondContact O-CD 3.4Å; V57-Q114 HydrophobicContact CG1-CB 4.2Å; V57-Q114 HydrophobicContact CG1-CG 4.46Å; V57-Q114 VanDerWaalsContact CG1-OE1 3.28Å
58	P	93.1	Very high	87.8	Confident	41 Å²	41	57.5 Å²	57.5	27%	0.266	33%	0.333	S	S	.	.	S	Bend	trans	-64.2	-40	-173.5	-26	35.6	0	0	0	113.6	K56 P60 Y112	K56-P58 WeakPolarHBondContact O-CD 3.32Å; K56-P58 VanDerWaalsContact O-N 3.16Å; P58-P60 WeakPolarHBondContact O-CD 3.02Å; P58-Y112 HydrophobicContact CB-CD1 3.86Å; P58-Y112 HydrophobicContact CB-CE1 4.21Å; P58-Y112 HydrophobicContact CB-CG 4.44Å; P58-Y112 HydrophobicContact CG-CD1 3.78Å; P58-Y112 HydrophobicContact CG-CE1 4.37Å
59	F	96.2	Very high	88.4	Confident	29 Å²	29	59.6 Å²	59.6	13%	0.127	34%	0.343	C	S	.	.			trans	-122.8	72.9	-180	-60.3	-86	0	0	0	110.2	V57 E61 R62 V67 L86 Y112 Q114	V57-F59 PolarHBondContact O-N 3.23Å; F59-E61 VanDerWaalsContact C-OE2 3.29Å; F59-E61 WeakPolarHBondContact CA-OE2 3.48Å; F59-E61 PolarHBondContact O-N 3.46Å; F59-R62 HydrophobicContact CB-CB 3.98Å; F59-R62 HydrophobicContact CB-CG 3.78Å; F59-R62 PolarHBondContact O-N 3.01Å; F59-V67 HydrophobicContact CB-CB 4.49Å; F59-V67 HydrophobicContact CB-CG1 4.27Å; F59-V67 HydrophobicContact CB-CG2 4.09Å; F59-V67 HydrophobicContact CD1-CG1 4.21Å; F59-V67 HydrophobicContact CD2-CB 3.89Å; F59-V67 HydrophobicContact CD2-CG1 3.73Å; F59-V67 HydrophobicContact CD2-CG2 4.33Å; F59-V67 HydrophobicContact CE2-CB 4.49Å; F59-V67 HydrophobicContact CE2-CG1 4.14Å; F59-V67 HydrophobicContact CG-CB 4.27Å; F59-V67 HydrophobicContact CG-CG1 3.79Å; F59-V67 HydrophobicContact CG-CG2 4.4Å; F59-L86 HydrophobicContact CD1-CD2 4.25Å; F59-L86 HydrophobicContact CE1-CD1 3.68Å; F59-L86 HydrophobicContact CE1-CD2 3.79Å; F59-L86 HydrophobicContact CE1-CG 4.41Å; F59-L86 HydrophobicContact CZ-CD1 4.04Å; F59-L86 HydrophobicContact CZ-CD2 4.18Å; F59-Y112 HydrophobicContact CD2-CD2 4.31Å; F59-Y112 HydrophobicContact CD2-CG 4.29Å; F59-Y112 HydrophobicContact CE2-CD1 4.22Å; F59-Y112 AromaticContact CE2-CD2 3.41Å; F59-Y112 HydrophobicContact CE2-CD2 3.41Å; F59-Y112 VanDerWaalsContact CE2-CD2 3.41Å; F59-Y112 HydrophobicContact CE2-CE1 4.4Å; F59-Y112 AromaticContact CE2-CE2 3.65Å; F59-Y112 HydrophobicContact CE2-CE2 3.65Å; F59-Y112 AromaticContact CE2-CG 3.71Å; F59-Y112 HydrophobicContact CE2-CG 3.71Å; F59-Y112 HydrophobicContact CZ-CD2 4.18Å; F59-Y112 HydrophobicContact CZ-CE2 4.04Å; F59-Q114 VanDerWaalsContact N-OE1 3.09Å; F59-Q114 PolarHBondContact O-NE2 3.21Å; F59-Q114 VanDerWaalsContact O-NE2 3.11Å; F59-Q114 PolarHBondContact O-OE1 2.94Å
60	P	94.2	Very high	89.4	Confident	80 Å²	80	61.4 Å²	61.4	52%	0.519	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-23.6	-175.2	27.7	-35.2	0	0	0	113.3	V57 P58 R62 R115	V57-P60 HydrophobicContact CG1-CB 4.44Å; V57-P60 WeakPolarHBondContact O-CD 3.4Å; P58-P60 WeakPolarHBondContact O-CD 3.02Å; P60-R62 VanDerWaalsContact C-N 3.35Å; P60-R115 PolarHBondContact O-NH2 2.91Å
61	E	95.3	Very high	90.4	Very high	129 Å²	129	58.5 Å²	58.5	60%	0.603	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.7	-18.6	175.4	77.9	-66.4	163.4	0	0	113.6	F59	F59-E61 VanDerWaalsContact C-OE2 3.29Å; F59-E61 WeakPolarHBondContact CA-OE2 3.48Å; F59-E61 PolarHBondContact O-N 3.46Å
62	R	93.9	Very high	91.2	Very high	101 Å²	101	58.4 Å²	58.4	38%	0.381	33%	0.325	S	S	.	.			trans	-92.5	123.6	174.7	-58.1	-77.4	178.3	151.5	0.9	108.7	F59 P60 V67 L86 Q114 R115	F59-R62 HydrophobicContact CB-CB 3.98Å; F59-R62 HydrophobicContact CB-CG 3.78Å; F59-R62 PolarHBondContact O-N 3.01Å; P60-R62 VanDerWaalsContact C-N 3.35Å; R62-V67 HydrophobicContact CB-CG2 3.65Å; R62-V67 HydrophobicContact CG-CG1 4.24Å; R62-V67 HydrophobicContact CG-CG2 4.06Å; R62-L86 PolarHBondContact NH2-O 2.84Å; R62-Q114 PolarHBondContact O-NE2 3.04Å; R62-Q114 VanDerWaalsContact O-NE2 3.08Å; R62-R115 PolarHBondContact O-NE 3.24Å; R62-R115 PolarHBondContact O-NH2 3.41Å
63	S	93.8	Very high	92.3	Very high	113 Å²	113	54.8 Å²	54.8	79%	0.79	31%	0.306	S	S	*	.			trans	-77.4	-22.3	179.5	53.9	0	0	0	0	113.6
64	A	95.6	Very high	93.9	Very high	38 Å²	38	53.7 Å²	53.7	31%	0.314	29%	0.285	S	S	.	.	S	Bend	trans	-64.6	146.3	-179.6	0	0	0	0	0	112.5	V66 Q114 Y184	A64-V66 VanDerWaalsContact C-N 3.33Å; A64-V66 WeakPolarHBondContact CB-O 3.36Å; A64-Q114 PolarHBondContact O-NE2 3.33Å; A64-Y184 HydrophobicContact CB-CD1 4.3Å
65	N	96	Very high	95	Very high	37 Å²	37	48.5 Å²	48.5	20%	0.198	25%	0.253	C	S	.	.	S	Bend	trans	-70.7	-29.4	174.2	-69	-12.2	0	0	0	112.1	V113 Q114 V118 Y184	N65-V113 CarbonylContact O-C 3.51Å; N65-V113 WeakPolarHBondContact O-CA 3.28Å; N65-Q114 WeakPolarHBondContact CA-O 3.27Å; N65-Q114 WeakPolarHBondContact O-CG 3.44Å; N65-Q114 PolarHBondContact O-N 2.8Å; N65-Q114 VanDerWaalsContact O-O 3.12Å; N65-V118 HydrophobicContact CB-CG2 3.81Å; N65-Y184 HydrophobicContact CB-CE1 4.26Å
66	V	98.3	Very high	95.5	Very high	3 Å²	3	53 Å²	53	2%	0.018	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	128.9	172.9	-165.6	0	0	0	0	109.8	A64 F68 Y111 Y112 V113 V118 L121 Y184	A64-V66 VanDerWaalsContact C-N 3.33Å; A64-V66 WeakPolarHBondContact CB-O 3.36Å; V66-F68 HydrophobicContact CB-CE2 3.91Å; V66-F68 HydrophobicContact CB-CZ 4.37Å; V66-F68 HydrophobicContact CG1-CD2 4.09Å; V66-F68 HydrophobicContact CG1-CE1 4.29Å; V66-F68 HydrophobicContact CG1-CE2 3.38Å; V66-F68 HydrophobicContact CG1-CZ 3.51Å; V66-Y111 HydrophobicContact CG1-CD2 3.74Å; V66-Y111 HydrophobicContact CG1-CG 4.32Å; V66-Y112 CarbonylContact C-O 3.6Å; V66-Y112 VanDerWaalsContact CA-O 3.27Å; V66-Y112 WeakPolarHBondContact CA-O 3.11Å; V66-V113 HydrophobicContact CG1-CG2 4.46Å; V66-V113 HydrophobicContact CG2-CG2 4.22Å; V66-V118 HydrophobicContact CG2-CB 4.23Å; V66-V118 HydrophobicContact CG2-CG1 3.94Å; V66-V118 HydrophobicContact CG2-CG2 3.6Å; V66-L121 HydrophobicContact CG2-CD1 4.44Å; V66-Y184 HydrophobicContact CB-CD1 3.54Å; V66-Y184 HydrophobicContact CB-CD2 4.4Å; V66-Y184 HydrophobicContact CB-CE1 3.74Å; V66-Y184 HydrophobicContact CB-CG 3.89Å; V66-Y184 HydrophobicContact CG2-CD1 3.88Å; V66-Y184 HydrophobicContact CG2-CD2 4.27Å; V66-Y184 HydrophobicContact CG2-CE1 3.57Å; V66-Y184 HydrophobicContact CG2-CE2 4.01Å; V66-Y184 HydrophobicContact CG2-CG 4.21Å
67	V	98.2	Very high	95.6	Very high	7 Å²	7	48.2 Å²	48.2	4%	0.042	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	123	174.3	-179.4	0	0	0	0	108.7	F59 R62 L86 Y111 Y112	F59-V67 HydrophobicContact CB-CB 4.49Å; F59-V67 HydrophobicContact CB-CG1 4.27Å; F59-V67 HydrophobicContact CB-CG2 4.09Å; F59-V67 HydrophobicContact CD1-CG1 4.21Å; F59-V67 HydrophobicContact CD2-CB 3.89Å; F59-V67 HydrophobicContact CD2-CG1 3.73Å; F59-V67 HydrophobicContact CD2-CG2 4.33Å; F59-V67 HydrophobicContact CE2-CB 4.49Å; F59-V67 HydrophobicContact CE2-CG1 4.14Å; F59-V67 HydrophobicContact CG-CB 4.27Å; F59-V67 HydrophobicContact CG-CG1 3.79Å; F59-V67 HydrophobicContact CG-CG2 4.4Å; R62-V67 HydrophobicContact CB-CG2 3.65Å; R62-V67 HydrophobicContact CG-CG1 4.24Å; R62-V67 HydrophobicContact CG-CG2 4.06Å; V67-L86 HydrophobicContact CG1-CD2 3.62Å; V67-Y111 CarbonylContact O-C 3.59Å; V67-Y111 VanDerWaalsContact O-CA 3.27Å; V67-Y111 WeakPolarHBondContact O-CA 3.34Å; V67-Y112 PolarHBondContact N-O 2.76Å; V67-Y112 PolarHBondContact O-N 3.5Å
68	F	98.4	Very high	95.6	Very high	8 Å²	8	49.3 Å²	49.3	4%	0.035	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	119.2	-179.4	-67.5	-91.6	0	0	0	109.5	V66 L85 L86 V109 Y111 F176 Y184 I185	V66-F68 HydrophobicContact CB-CE2 3.91Å; V66-F68 HydrophobicContact CB-CZ 4.37Å; V66-F68 HydrophobicContact CG1-CD2 4.09Å; V66-F68 HydrophobicContact CG1-CE1 4.29Å; V66-F68 HydrophobicContact CG1-CE2 3.38Å; V66-F68 HydrophobicContact CG1-CZ 3.51Å; F68-L85 HydrophobicContact CB-CB 4.12Å; F68-L85 HydrophobicContact CB-CD1 3.75Å; F68-L85 CarbonylContact O-C 3.58Å; F68-L85 WeakPolarHBondContact O-CB 3.26Å; F68-L86 WeakPolarHBondContact O-CD2 3.29Å; F68-V109 HydrophobicContact CD1-CG1 3.56Å; F68-V109 HydrophobicContact CE1-CG1 4.01Å; F68-Y111 HydrophobicContact CD1-CG 4.27Å; F68-Y111 HydrophobicContact CE1-CD1 4.22Å; F68-Y111 AromaticContact CE1-CG 3.95Å; F68-Y111 HydrophobicContact CE1-CG 3.95Å; F68-F176 AromaticContact CD1-CD2 3.76Å; F68-F176 HydrophobicContact CD1-CD2 3.76Å; F68-F176 AromaticContact CD1-CE2 3.9Å; F68-F176 HydrophobicContact CD1-CE2 3.9Å; F68-F176 HydrophobicContact CD1-CG 4.36Å; F68-F176 HydrophobicContact CE1-CB 3.96Å; F68-F176 AromaticContact CE1-CD1 3.79Å; F68-F176 HydrophobicContact CE1-CD1 3.79Å; F68-F176 AromaticContact CE1-CD2 3.13Å; F68-F176 HydrophobicContact CE1-CD2 3.13Å; F68-F176 HydrophobicContact CE1-CE1 4.02Å; F68-F176 AromaticContact CE1-CE2 3.39Å; F68-F176 HydrophobicContact CE1-CE2 3.39Å; F68-F176 AromaticContact CE1-CG 3.34Å; F68-F176 HydrophobicContact CE1-CG 3.34Å; F68-F176 AromaticContact CE1-CZ 3.84Å; F68-F176 HydrophobicContact CE1-CZ 3.84Å; F68-F176 HydrophobicContact CE2-CB 3.85Å; F68-F176 HydrophobicContact CE2-CD2 4.34Å; F68-F176 HydrophobicContact CE2-CG 4.18Å; F68-F176 HydrophobicContact CZ-CB 3.31Å; F68-F176 AromaticContact CZ-CD1 3.75Å; F68-F176 HydrophobicContact CZ-CD1 3.75Å; F68-F176 AromaticContact CZ-CD2 3.49Å; F68-F176 HydrophobicContact CZ-CD2 3.49Å; F68-F176 VanDerWaalsContact CZ-CD2 3.49Å; F68-F176 HydrophobicContact CZ-CE1 4.42Å; F68-F176 HydrophobicContact CZ-CE2 4.18Å; F68-F176 AromaticContact CZ-CG 3.22Å; F68-F176 HydrophobicContact CZ-CG 3.22Å; F68-Y184 HydrophobicContact CE2-CG 4.23Å; F68-I185 HydrophobicContact CB-CD1 4.22Å; F68-I185 HydrophobicContact CB-CG2 4.29Å; F68-I185 HydrophobicContact CD1-CG2 4.26Å; F68-I185 HydrophobicContact CD2-CB 4.1Å; F68-I185 HydrophobicContact CD2-CG2 3.4Å; F68-I185 VanDerWaalsContact CD2-CG2 3.4Å; F68-I185 HydrophobicContact CE2-CG2 3.78Å; F68-I185 HydrophobicContact CG-CG2 3.69Å; F68-I185 HydrophobicContact CZ-CG2 4.35Å
69	E	98	Very high	95.7	Very high	58 Å²	58	52.8 Å²	52.8	27%	0.271	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	-54	-177.4	177.4	175	-151	0	0	110.9	N84 L85 L86 V110 Y112	E69-N84 PolarHBondContact O-OD1 2.98Å; E69-L85 PolarHBondContact O-N 3.23Å; E69-L86 HydrophobicContact CG-CD1 4.07Å; E69-V110 HydrophobicContact CB-CG1 4.46Å; E69-V110 PolarHBondContact N-O 2.9Å; E69-Y112 HydrophobicContact CB-CD2 4.39Å; E69-Y112 HydrophobicContact CB-CE2 3.92Å; E69-Y112 HydrophobicContact CG-CE2 4.49Å; E69-Y112 VanDerWaalsContact OE2-CE2 3.29Å; E69-Y112 WeakPolarHBondContact OE2-CE2 3.44Å; E69-Y112 PolarHBondContact OE2-OH 3.28Å
70	K	97.6	Very high	95.6	Very high	60 Å²	60	56.2 Å²	56.2	26%	0.261	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.1	160.3	-176.2	59.4	172.6	-179.8	179.9	0	112.9	E82 F83 V110	K70-E82 HydrophobicContact CB-CG 4.28Å; K70-E82 HydrophobicContact CD-CG 3.93Å; K70-E82 WeakPolarHBondContact CD-OE2 3.36Å; K70-E82 WeakPolarHBondContact CE-OE2 3.4Å; K70-E82 IonicContact NZ-OE1 3.05Å; K70-E82 IonicContact NZ-OE2 3.52Å; K70-E82 PolarHBondContact NZ-OE2 2.88Å; K70-F83 VanDerWaalsContact CA-O 3.26Å; K70-F83 WeakPolarHBondContact CA-O 3.37Å; K70-F83 WeakPolarHBondContact CB-O 3.41Å; K70-V110 HydrophobicContact CD-CG2 4.3Å; K70-V110 HydrophobicContact CG-CB 3.73Å; K70-V110 HydrophobicContact CG-CG2 3.76Å; K70-V110 PolarHBondContact N-O 3.42Å; K70-V110 PolarHBondContact O-N 3.48Å
71	F	96.7	Very high	95.7	Very high	0 Å²	0	54.9 Å²	54.9	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	136.5	174.9	153	-96.4	0	0	0	109.3	I73 F83 L85 I107 Q108 V109 W187 W189	F71-I73 HydrophobicContact CE1-CD1 3.76Å; F71-I73 HydrophobicContact CE1-CG1 4.11Å; F71-I73 HydrophobicContact CE2-CD1 3.77Å; F71-I73 HydrophobicContact CZ-CD1 3.22Å; F71-I73 HydrophobicContact CZ-CG1 4.07Å; F71-F83 HydrophobicContact CD1-CB 4.13Å; F71-F83 AromaticContact CD1-CD2 3.6Å; F71-F83 HydrophobicContact CD1-CD2 3.6Å; F71-F83 HydrophobicContact CD1-CE2 4.38Å; F71-F83 HydrophobicContact CD1-CG 4.16Å; F71-F83 AromaticContact CE1-CD2 3.79Å; F71-F83 HydrophobicContact CE1-CD2 3.79Å; F71-F83 HydrophobicContact CE1-CE2 4.11Å; F71-F83 PolarHBondContact N-O 3.4Å; F71-F83 PolarHBondContact O-N 3.03Å; F71-L85 HydrophobicContact CB-CD1 3.74Å; F71-L85 HydrophobicContact CB-CG 4.24Å; F71-I107 HydrophobicContact CD2-CG2 3.7Å; F71-I107 HydrophobicContact CE2-CB 4.1Å; F71-I107 HydrophobicContact CE2-CD1 4.21Å; F71-I107 HydrophobicContact CE2-CG1 3.86Å; F71-I107 HydrophobicContact CE2-CG2 3.36Å; F71-I107 HydrophobicContact CZ-CG1 4.38Å; F71-Q108 CarbonylContact C-O 3.57Å; F71-Q108 VanDerWaalsContact CA-O 3.29Å; F71-Q108 WeakPolarHBondContact CA-O 3.26Å; F71-V109 HydrophobicContact CB-CG2 4.41Å; F71-V109 HydrophobicContact CD2-CG2 3.86Å; F71-W187 HydrophobicContact CB-CZ2 4.19Å; F71-W187 HydrophobicContact CD1-CZ2 4.36Å; F71-W187 AromaticContact CD1-NE1 3.83Å; F71-W187 AromaticContact CD2-CZ2 3.74Å; F71-W187 HydrophobicContact CD2-CZ2 3.74Å; F71-W187 AromaticContact CE1-NE1 3.81Å; F71-W187 HydrophobicContact CE2-CZ2 4Å; F71-W187 AromaticContact CG-CZ2 3.87Å; F71-W187 HydrophobicContact CG-CZ2 3.87Å; F71-W187 HydrophobicContact CZ-CZ2 4.42Å; F71-W189 AromaticContact CE1-CD2 3.97Å; F71-W189 HydrophobicContact CE1-CD2 3.97Å; F71-W189 HydrophobicContact CE1-CE3 4.24Å; F71-W189 HydrophobicContact CE1-CG 4.25Å; F71-W189 HydrophobicContact CE2-CZ2 4.47Å; F71-W189 AromaticContact CZ-CD2 3.82Å; F71-W189 HydrophobicContact CZ-CD2 3.82Å; F71-W189 AromaticContact CZ-CE2 3.53Å; F71-W189 HydrophobicContact CZ-CE3 4.15Å; F71-W189 HydrophobicContact CZ-CG 4.38Å; F71-W189 HydrophobicContact CZ-CH2 4.06Å; F71-W189 AromaticContact CZ-CZ2 3.7Å; F71-W189 HydrophobicContact CZ-CZ2 3.7Å; F71-W189 HydrophobicContact CZ-CZ3 4.24Å; F71-W189 AromaticContact CZ-NE1 3.86Å
72	C	97.1	Very high	95.7	Very high	5 Å²	5	54.1 Å²	54.1	3%	0.034	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	144.4	-176.3	-54.4	0	0	0	0	111.1	L74 I81 Q108	C72-L74 HydrophobicContact CB-CD1 4.24Å; C72-I81 CarbonylContact C-O 3.48Å; C72-I81 WeakPolarHBondContact CA-O 3.23Å; C72-Q108 HydrophobicContact CB-CB 4.37Å; C72-Q108 PolarHBondContact N-O 2.86Å; C72-Q108 PolarHBondContact O-N 2.96Å
73	I	96.9	Very high	95.8	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	118.8	166.2	-53.8	-56.7	0	0	0	108.5	F71 V75 I81 F83 V97 I99 I107 W189	F71-I73 HydrophobicContact CE1-CD1 3.76Å; F71-I73 HydrophobicContact CE1-CG1 4.11Å; F71-I73 HydrophobicContact CE2-CD1 3.77Å; F71-I73 HydrophobicContact CZ-CD1 3.22Å; F71-I73 HydrophobicContact CZ-CG1 4.07Å; I73-V75 HydrophobicContact CG2-CG2 3.73Å; I73-I81 PolarHBondContact N-O 2.87Å; I73-I81 PolarHBondContact O-N 2.94Å; I73-F83 HydrophobicContact CG1-CE2 4.36Å; I73-V97 HydrophobicContact CB-CG1 4.29Å; I73-V97 HydrophobicContact CG1-CG2 4.21Å; I73-V97 HydrophobicContact CG2-CG1 3.95Å; I73-I99 HydrophobicContact CG2-CD1 4.4Å; I73-I107 HydrophobicContact CD1-CG1 3.79Å; I73-W189 HydrophobicContact CD1-CE3 4.19Å; I73-W189 HydrophobicContact CD1-CH2 3.43Å; I73-W189 VanDerWaalsContact CD1-CH2 3.43Å; I73-W189 HydrophobicContact CD1-CZ2 4.17Å; I73-W189 HydrophobicContact CD1-CZ3 3.4Å; I73-W189 VanDerWaalsContact CD1-CZ3 3.4Å; I73-W189 HydrophobicContact CG1-CE3 4.29Å; I73-W189 HydrophobicContact CG1-CH2 4.24Å; I73-W189 HydrophobicContact CG1-CZ3 3.7Å
74	L	97.3	Very high	95.9	Very high	38 Å²	38	48.6 Å²	48.6	20%	0.199	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	95.8	-178	-55.6	87.3	0	0	0	107	C72 Y105 R106 Q108	C72-L74 HydrophobicContact CB-CD1 4.24Å; L74-Y105 CarbonylContact O-C 3.6Å; L74-Y105 WeakPolarHBondContact O-CA 3.37Å; L74-Y105 WeakPolarHBondContact O-CB 3.43Å; L74-R106 HydrophobicContact CB-CB 4.38Å; L74-R106 HydrophobicContact CD1-CB 4.36Å; L74-R106 WeakPolarHBondContact CD1-O 3.44Å; L74-R106 PolarHBondContact N-O 2.79Å; L74-R106 PolarHBondContact O-N 2.86Å; L74-Q108 HydrophobicContact CD1-CB 3.42Å; L74-Q108 VanDerWaalsContact CD1-CB 3.42Å
75	V	95.7	Very high	95.9	Very high	4 Å²	4	47.2 Å²	47.2	2%	0.024	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	129.3	178.4	-173.3	0	0	0	0	108.5	I73 G77 Q78 V97 I99	I73-V75 HydrophobicContact CG2-CG2 3.73Å; V75-G77 PolarHBondContact O-N 2.78Å; V75-Q78 HydrophobicContact CB-CB 4.13Å; V75-Q78 HydrophobicContact CB-CG 4.21Å; V75-Q78 HydrophobicContact CG1-CG 4.09Å; V75-Q78 PolarHBondContact O-N 2.9Å; V75-V97 HydrophobicContact CG2-CG1 4.36Å; V75-I99 HydrophobicContact CG1-CG2 4.04Å; V75-I99 HydrophobicContact CG2-CD1 4.27Å; V75-I99 HydrophobicContact CG2-CG1 3.99Å
76	E	94	Very high	95.9	Very high	134 Å²	134	47.4 Å²	47.4	63%	0.626	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.4	127.4	179.4	-175.3	179.3	-155.6	0	0	111.3	Q78 C103 S104	E76-Q78 VanDerWaalsContact C-N 3.3Å; E76-Q78 PolarHBondContact O-N 2.89Å; E76-C103 PolarHBondContact O-SG 2.89Å; E76-C103 VanDerWaalsContact O-SG 3.33Å; E76-S104 WeakPolarHBondContact CB-O 3.41Å; E76-S104 PolarHBondContact N-O 2.8Å
77	G	90.4	Very high	95.7	Very high	86 Å²	86	49.4 Å²	49.4	89%	0.887	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.2	8.2	179.9	0	0	0	0	0	115.4	V75	V75-G77 PolarHBondContact O-N 2.78Å
78	Q	91.6	Very high	95.3	Very high	65 Å²	65	54.7 Å²	54.7	30%	0.304	31%	0.313	S	S	.	.	S	Bend	trans	-122.7	157	174.5	-52.8	-174	15.4	0	0	111.1	V75 E76 S98	V75-Q78 HydrophobicContact CB-CB 4.13Å; V75-Q78 HydrophobicContact CB-CG 4.21Å; V75-Q78 HydrophobicContact CG1-CG 4.09Å; V75-Q78 PolarHBondContact O-N 2.9Å; E76-Q78 VanDerWaalsContact C-N 3.3Å; E76-Q78 PolarHBondContact O-N 2.89Å; Q78-S98 PolarHBondContact OE1-O 3.04Å
79	P	94.2	Very high	95.1	Very high	113 Å²	113	56.5 Å²	56.5	73%	0.734	32%	0.323	S	S	*	.	P	Polyproline II helix	trans	-60.6	142.9	168.2	-21.2	33.3	0	0	0	111.6	I81	P79-I81 PolarHBondContact O-N 2.96Å
80	D	95.3	Very high	94.6	Very high	101 Å²	101	56.5 Å²	56.5	54%	0.54	33%	0.329	S	S	.	.	P	Polyproline II helix	trans	-59.9	135.1	176.3	-65.6	-17.6	0	0	0	111
81	I	95	Very high	93.9	Very high	53 Å²	53	58.1 Å²	58.1	27%	0.272	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	117	178.4	-61.8	159.2	0	0	0	108.5	C72 I73 P79 F83 V97	C72-I81 CarbonylContact C-O 3.48Å; C72-I81 WeakPolarHBondContact CA-O 3.23Å; I73-I81 PolarHBondContact N-O 2.87Å; I73-I81 PolarHBondContact O-N 2.94Å; P79-I81 PolarHBondContact O-N 2.96Å; I81-F83 HydrophobicContact CG2-CE2 3.76Å; I81-F83 HydrophobicContact CG2-CZ 4.03Å; I81-V97 HydrophobicContact CB-CG2 4.45Å; I81-V97 HydrophobicContact CD1-CB 4.14Å; I81-V97 HydrophobicContact CD1-CG1 3.35Å; I81-V97 HydrophobicContact CD1-CG2 4.03Å; I81-V97 HydrophobicContact CG2-CG2 3.97Å
82	E	95.4	Very high	93.6	Very high	113 Å²	113	58.8 Å²	58.8	53%	0.528	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	140.7	-174	-175.6	175.4	116.2	0	0	112.5	K70	K70-E82 HydrophobicContact CB-CG 4.28Å; K70-E82 HydrophobicContact CD-CG 3.93Å; K70-E82 WeakPolarHBondContact CD-OE2 3.36Å; K70-E82 WeakPolarHBondContact CE-OE2 3.4Å; K70-E82 IonicContact NZ-OE1 3.05Å; K70-E82 IonicContact NZ-OE2 3.52Å; K70-E82 PolarHBondContact NZ-OE2 2.88Å
83	F	95.9	Very high	92.9	Very high	10 Å²	10	64.8 Å²	64.8	4%	0.044	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	127.4	173.3	-60.2	-93.2	0	0	0	110.2	K70 F71 I73 I81 L85 F92 K95 V97	K70-F83 VanDerWaalsContact CA-O 3.26Å; K70-F83 WeakPolarHBondContact CA-O 3.37Å; K70-F83 WeakPolarHBondContact CB-O 3.41Å; F71-F83 HydrophobicContact CD1-CB 4.13Å; F71-F83 AromaticContact CD1-CD2 3.6Å; F71-F83 HydrophobicContact CD1-CD2 3.6Å; F71-F83 HydrophobicContact CD1-CE2 4.38Å; F71-F83 HydrophobicContact CD1-CG 4.16Å; F71-F83 AromaticContact CE1-CD2 3.79Å; F71-F83 HydrophobicContact CE1-CD2 3.79Å; F71-F83 HydrophobicContact CE1-CE2 4.11Å; F71-F83 PolarHBondContact N-O 3.4Å; F71-F83 PolarHBondContact O-N 3.03Å; I73-F83 HydrophobicContact CG1-CE2 4.36Å; I81-F83 HydrophobicContact CG2-CE2 3.76Å; I81-F83 HydrophobicContact CG2-CZ 4.03Å; F83-L85 PolarHBondContact O-N 3.24Å; F83-F92 HydrophobicContact CB-CD2 4Å; F83-F92 HydrophobicContact CB-CE1 4.19Å; F83-F92 HydrophobicContact CB-CE2 3.55Å; F83-F92 HydrophobicContact CB-CZ 3.66Å; F83-F92 HydrophobicContact CD1-CB 4.09Å; F83-F92 AromaticContact CD1-CD1 3.8Å; F83-F92 HydrophobicContact CD1-CD1 3.8Å; F83-F92 AromaticContact CD1-CD2 3.86Å; F83-F92 HydrophobicContact CD1-CD2 3.86Å; F83-F92 HydrophobicContact CD1-CE1 4.18Å; F83-F92 HydrophobicContact CD1-CE2 4.22Å; F83-F92 AromaticContact CD1-CG 3.64Å; F83-F92 HydrophobicContact CD1-CG 3.64Å; F83-F92 HydrophobicContact CD1-CZ 4.37Å; F83-F92 HydrophobicContact CE1-CB 4.22Å; F83-F92 HydrophobicContact CE1-CG 4.27Å; F83-F92 HydrophobicContact CG-CD2 4.16Å; F83-F92 HydrophobicContact CG-CE2 4.21Å; F83-F92 HydrophobicContact CG-CG 4.39Å; F83-F92 HydrophobicContact CG-CZ 4.49Å; F83-K95 HydrophobicContact CE1-CB 4.23Å; F83-V97 HydrophobicContact CE2-CG2 3.98Å; F83-V97 HydrophobicContact CZ-CG2 3.81Å
84	N	96.3	Very high	92.3	Very high	88 Å²	88	68.5 Å²	68.5	47%	0.471	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	111.6	179.6	178.5	-4.8	0	0	0	111.3	E69 L86 G87 F92	E69-N84 PolarHBondContact O-OD1 2.98Å; N84-L86 WeakPolarHBondContact OD1-CB 3.19Å; N84-L86 PolarHBondContact OD1-N 3.05Å; N84-G87 PolarHBondContact OD1-N 2.83Å; N84-F92 WeakPolarHBondContact O-CZ 3.36Å
85	L	97.1	Very high	91.8	Very high	8 Å²	8	73.2 Å²	73.2	4%	0.042	41%	0.414	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.4	-8.8	-177.8	-67	174	0	0	0	114	F68 E69 F71 F83 I89 F92 I185 W187	F68-L85 HydrophobicContact CB-CB 4.12Å; F68-L85 HydrophobicContact CB-CD1 3.75Å; F68-L85 CarbonylContact O-C 3.58Å; F68-L85 WeakPolarHBondContact O-CB 3.26Å; E69-L85 PolarHBondContact O-N 3.23Å; F71-L85 HydrophobicContact CB-CD1 3.74Å; F71-L85 HydrophobicContact CB-CG 4.24Å; F83-L85 PolarHBondContact O-N 3.24Å; L85-I89 HydrophobicContact CD2-CG2 4.15Å; L85-F92 HydrophobicContact CD2-CE2 3.64Å; L85-F92 HydrophobicContact CD2-CZ 4.25Å; L85-I185 HydrophobicContact CB-CD1 4.03Å; L85-I185 HydrophobicContact CD1-CD1 4.46Å; L85-I185 HydrophobicContact CD2-CD1 3.9Å; L85-I185 HydrophobicContact CG-CD1 4.36Å; L85-W187 HydrophobicContact CD2-CD2 3.99Å; L85-W187 HydrophobicContact CD2-CE3 4.26Å; L85-W187 HydrophobicContact CD2-CG 4.19Å
86	L	95.8	Very high	91.5	Very high	42 Å²	42	76.4 Å²	76.4	22%	0.22	44%	0.435	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-23.8	173.5	-60.4	172.8	0	0	0	112.5	F59 R62 V67 F68 E69 N84	F59-L86 HydrophobicContact CD1-CD2 4.25Å; F59-L86 HydrophobicContact CE1-CD1 3.68Å; F59-L86 HydrophobicContact CE1-CD2 3.79Å; F59-L86 HydrophobicContact CE1-CG 4.41Å; F59-L86 HydrophobicContact CZ-CD1 4.04Å; F59-L86 HydrophobicContact CZ-CD2 4.18Å; R62-L86 PolarHBondContact NH2-O 2.84Å; V67-L86 HydrophobicContact CG1-CD2 3.62Å; F68-L86 WeakPolarHBondContact O-CD2 3.29Å; E69-L86 HydrophobicContact CG-CD1 4.07Å; N84-L86 WeakPolarHBondContact OD1-CB 3.19Å; N84-L86 PolarHBondContact OD1-N 3.05Å
87	G	92.6	Very high	91.5	Very high	44 Å²	44	70.1 Å²	70.1	45%	0.454	41%	0.406	S	S	.	.	S	Bend	trans	-92	-155.7	-177.1	0	0	0	0	0	113.9	N84	N84-G87 PolarHBondContact OD1-N 2.83Å
88	D	91.4	Very high	91.7	Very high	119 Å²	119	68.8 Å²	68.8	64%	0.636	38%	0.383	S	S	*	.			trans	-75.6	123.6	171.9	-170.1	0.4	0	0	0	110.7	S90	D88-S90 WeakPolarHBondContact OD1-CB 3.45Å; D88-S90 PolarHBondContact OD1-N 2.86Å; D88-S90 PolarHBondContact OD1-OG 3.33Å; D88-S90 VanDerWaalsContact OD1-OG 3.13Å; D88-S90 PolarHBondContact OD2-OG 2.87Å
89	I	92.5	Very high	91.9	Very high	45 Å²	45	65.7 Å²	65.7	23%	0.231	37%	0.368	C	S	.	.			trans	-102.7	-1.1	-177	64.8	176.4	0	0	0	112.6	L85 D91 F92 I185 W187	L85-I89 HydrophobicContact CD2-CG2 4.15Å; I89-D91 PolarHBondContact O-N 3.14Å; I89-F92 HydrophobicContact CB-CD2 4.46Å; I89-F92 HydrophobicContact CB-CE1 4.39Å; I89-F92 HydrophobicContact CB-CE2 4.1Å; I89-F92 HydrophobicContact CB-CZ 4.05Å; I89-F92 HydrophobicContact CG2-CE1 4.35Å; I89-F92 HydrophobicContact CG2-CE2 3.94Å; I89-F92 HydrophobicContact CG2-CZ 3.69Å; I89-I185 HydrophobicContact CD1-CD1 4.48Å; I89-I185 HydrophobicContact CD1-CG1 4.38Å; I89-W187 HydrophobicContact CB-CB 4.48Å; I89-W187 HydrophobicContact CD1-CB 4.04Å
90	S	87.5	Confident	91.9	Very high	58 Å²	58	62.3 Å²	62.3	41%	0.406	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-27.8	-176.6	66.5	0	0	0	0	113.7	D88 K93	D88-S90 WeakPolarHBondContact OD1-CB 3.45Å; D88-S90 PolarHBondContact OD1-N 2.86Å; D88-S90 PolarHBondContact OD1-OG 3.33Å; D88-S90 VanDerWaalsContact OD1-OG 3.13Å; D88-S90 PolarHBondContact OD2-OG 2.87Å; S90-K93 WeakPolarHBondContact O-CE 3.35Å
91	D	84.3	Confident	91.9	Very high	94 Å²	94	58.4 Å²	58.4	50%	0.503	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.7	-0.2	-166.9	-71.3	-2.6	0	0	0	113.6	I89 K93 S94	I89-D91 PolarHBondContact O-N 3.14Å; D91-K93 PolarHBondContact O-N 3.2Å; D91-S94 WeakPolarHBondContact O-CB 3.28Å; D91-S94 PolarHBondContact O-N 3.23Å; D91-S94 PolarHBondContact O-OG 3.47Å
92	F	89.8	Confident	91.9	Very high	14 Å²	14	57 Å²	57	6%	0.061	32%	0.322	C	S	.	.	G	3₁₀ helix	trans	-60.6	-35	-178.7	-70.3	7.1	0	0	0	112.2	F83 N84 L85 I89 S94 K95 W187 K188 W189	F83-F92 HydrophobicContact CB-CD2 4Å; F83-F92 HydrophobicContact CB-CE1 4.19Å; F83-F92 HydrophobicContact CB-CE2 3.55Å; F83-F92 HydrophobicContact CB-CZ 3.66Å; F83-F92 HydrophobicContact CD1-CB 4.09Å; F83-F92 AromaticContact CD1-CD1 3.8Å; F83-F92 HydrophobicContact CD1-CD1 3.8Å; F83-F92 AromaticContact CD1-CD2 3.86Å; F83-F92 HydrophobicContact CD1-CD2 3.86Å; F83-F92 HydrophobicContact CD1-CE1 4.18Å; F83-F92 HydrophobicContact CD1-CE2 4.22Å; F83-F92 AromaticContact CD1-CG 3.64Å; F83-F92 HydrophobicContact CD1-CG 3.64Å; F83-F92 HydrophobicContact CD1-CZ 4.37Å; F83-F92 HydrophobicContact CE1-CB 4.22Å; F83-F92 HydrophobicContact CE1-CG 4.27Å; F83-F92 HydrophobicContact CG-CD2 4.16Å; F83-F92 HydrophobicContact CG-CE2 4.21Å; F83-F92 HydrophobicContact CG-CG 4.39Å; F83-F92 HydrophobicContact CG-CZ 4.49Å; N84-F92 WeakPolarHBondContact O-CZ 3.36Å; L85-F92 HydrophobicContact CD2-CE2 3.64Å; L85-F92 HydrophobicContact CD2-CZ 4.25Å; I89-F92 HydrophobicContact CB-CD2 4.46Å; I89-F92 HydrophobicContact CB-CE1 4.39Å; I89-F92 HydrophobicContact CB-CE2 4.1Å; I89-F92 HydrophobicContact CB-CZ 4.05Å; I89-F92 HydrophobicContact CG2-CE1 4.35Å; I89-F92 HydrophobicContact CG2-CE2 3.94Å; I89-F92 HydrophobicContact CG2-CZ 3.69Å; F92-S94 PolarHBondContact O-N 2.77Å; F92-S94 VanDerWaalsContact O-N 3.16Å; F92-K95 PolarHBondContact O-N 2.72Å; F92-W187 AromaticContact CD2-CD1 3.78Å; F92-W187 HydrophobicContact CD2-CG 4.38Å; F92-K188 WeakPolarHBondContact CB-O 3.13Å; F92-W189 HydrophobicContact CB-CB 4.32Å
93	K	82.2	Confident	91.8	Very high	131 Å²	131	52.5 Å²	52.5	57%	0.57	30%	0.303	S	S	*	.	G	3₁₀ helix	trans	-60	-20.9	172.9	68.3	-174	177.7	-172.5	0	114.3	S90 D91 K95 K188	S90-K93 WeakPolarHBondContact O-CE 3.35Å; D91-K93 PolarHBondContact O-N 3.2Å; K93-K95 VanDerWaalsContact C-N 3.31Å; K93-K188 PolarHBondContact N-O 2.81Å
94	S	83.3	Confident	91.9	Very high	78 Å²	78	53.9 Å²	53.9	55%	0.545	31%	0.314	S	S	.	.	G	3₁₀ helix	trans	-82.8	-10.4	177.5	74.9	0	0	0	0	113	D91 F92 P96	D91-S94 WeakPolarHBondContact O-CB 3.28Å; D91-S94 PolarHBondContact O-N 3.23Å; D91-S94 PolarHBondContact O-OG 3.47Å; F92-S94 PolarHBondContact O-N 2.77Å; F92-S94 VanDerWaalsContact O-N 3.16Å; S94-P96 VanDerWaalsContact C-CD 3.46Å; S94-P96 WeakPolarHBondContact O-CD 3.46Å
95	K	87.7	Confident	91.9	Very high	138 Å²	138	50.2 Å²	50.2	60%	0.6	29%	0.294	S	S	*	.	S	Bend	trans	-115.3	74.3	-179.9	-64.1	178.9	-178	177.5	0	110	F83 F92 K93 V97	F83-K95 HydrophobicContact CE1-CB 4.23Å; F92-K95 PolarHBondContact O-N 2.72Å; K93-K95 VanDerWaalsContact C-N 3.31Å; K95-V97 PolarHBondContact O-N 3.35Å
96	P	90.1	Very high	91.9	Very high	70 Å²	70	54.5 Å²	54.5	46%	0.455	31%	0.309	S	S	.	.	P	Polyproline II helix	trans	-65.2	135.3	179.5	28	-34.3	0	0	0	111.1	S94 C190	S94-P96 VanDerWaalsContact C-CD 3.46Å; S94-P96 WeakPolarHBondContact O-CD 3.46Å; P96-C190 CarbonylContact C-O 3.55Å; P96-C190 WeakPolarHBondContact CA-O 3.34Å; P96-C190 HydrophobicContact CB-CB 4.18Å
97	V	93.5	Very high	92	Very high	3 Å²	3	52.5 Å²	52.5	2%	0.018	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	116.4	175.1	174.6	0	0	0	0	109.4	I73 V75 I81 F83 K95 I99 C190 I191 N192	I73-V97 HydrophobicContact CB-CG1 4.29Å; I73-V97 HydrophobicContact CG1-CG2 4.21Å; I73-V97 HydrophobicContact CG2-CG1 3.95Å; V75-V97 HydrophobicContact CG2-CG1 4.36Å; I81-V97 HydrophobicContact CB-CG2 4.45Å; I81-V97 HydrophobicContact CD1-CB 4.14Å; I81-V97 HydrophobicContact CD1-CG1 3.35Å; I81-V97 HydrophobicContact CD1-CG2 4.03Å; I81-V97 HydrophobicContact CG2-CG2 3.97Å; F83-V97 HydrophobicContact CE2-CG2 3.98Å; F83-V97 HydrophobicContact CZ-CG2 3.81Å; K95-V97 PolarHBondContact O-N 3.35Å; V97-I99 HydrophobicContact CG1-CD1 4.3Å; V97-I99 HydrophobicContact CG1-CG1 3.92Å; V97-I99 PolarHBondContact O-N 2.87Å; V97-C190 PolarHBondContact N-O 2.69Å; V97-I191 HydrophobicContact CB-CG2 4.28Å; V97-I191 CarbonylContact O-C 3.56Å; V97-I191 VanDerWaalsContact O-CA 3.23Å; V97-I191 WeakPolarHBondContact O-CA 3.49Å; V97-N192 PolarHBondContact O-N 2.94Å
98	S	95	Very high	92.3	Very high	58 Å²	58	52.6 Å²	52.6	41%	0.406	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	117.7	178.3	-68.5	0	0	0	0	110.7	Q78 N192	Q78-S98 PolarHBondContact OE1-O 3.04Å; S98-N192 WeakPolarHBondContact CA-O 3.44Å
99	I	95.5	Very high	92.6	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	126.6	179.2	-52	-176.2	0	0	0	108.2	I73 V75 V97 C103 Y105 A160 I191 N192 I193 V194	I73-I99 HydrophobicContact CG2-CD1 4.4Å; V75-I99 HydrophobicContact CG1-CG2 4.04Å; V75-I99 HydrophobicContact CG2-CD1 4.27Å; V75-I99 HydrophobicContact CG2-CG1 3.99Å; V97-I99 HydrophobicContact CG1-CD1 4.3Å; V97-I99 HydrophobicContact CG1-CG1 3.92Å; V97-I99 PolarHBondContact O-N 2.87Å; I99-C103 HydrophobicContact CG2-CB 4.38Å; I99-Y105 HydrophobicContact CD1-CD1 3.83Å; I99-Y105 HydrophobicContact CD1-CD2 4.09Å; I99-Y105 HydrophobicContact CD1-CE1 4.11Å; I99-Y105 HydrophobicContact CD1-CE2 4.39Å; I99-Y105 HydrophobicContact CD1-CG 3.82Å; I99-Y105 HydrophobicContact CG2-CD1 3.96Å; I99-A160 HydrophobicContact CG2-CB 3.72Å; I99-I191 HydrophobicContact CD1-CB 4.09Å; I99-I191 HydrophobicContact CD1-CD1 4.39Å; I99-I191 HydrophobicContact CD1-CG2 3.81Å; I99-I191 HydrophobicContact CG1-CB 4.46Å; I99-N192 PolarHBondContact N-O 3.47Å; I99-I193 HydrophobicContact CB-CD1 3.95Å; I99-I193 CarbonylContact O-C 3.5Å; I99-I193 WeakPolarHBondContact O-CA 3.35Å; I99-V194 PolarHBondContact O-N 3.35Å
100	V	94.6	Very high	92.9	Very high	41 Å²	41	45.1 Å²	45.1	25%	0.248	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	134.2	176.3	177	0	0	0	0	108.8	G102 C103 A160 V194 K196	V100-G102 PolarHBondContact O-N 2.79Å; V100-C103 HydrophobicContact CB-CB 4.17Å; V100-C103 WeakPolarHBondContact O-CB 3.33Å; V100-C103 PolarHBondContact O-N 2.89Å; V100-A160 WeakPolarHBondContact O-CB 3.37Å; V100-V194 HydrophobicContact CG2-CG2 4.1Å; V100-K196 HydrophobicContact CG1-CB 3.7Å; V100-K196 HydrophobicContact CG1-CG 3.9Å
101	E	95	Very high	93.4	Very high	20 Å²	20	42.5 Å²	42.5	9%	0.093	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.9	136.7	178	75	-172.2	155.2	0	0	111.4	C103 G163 R167 I193 V194 K196	E101-C103 PolarHBondContact O-N 2.96Å; E101-G163 PolarHBondContact OE2-N 2.83Å; E101-R167 VanDerWaalsContact CD-NE 3.35Å; E101-R167 VanDerWaalsContact CD-NH2 3.32Å; E101-R167 IonicContact OE1-CZ 3.38Å; E101-R167 IonicContact OE1-NE 3.35Å; E101-R167 PolarHBondContact OE1-NE 3.29Å; E101-R167 IonicContact OE1-NH2 2.7Å; E101-R167 PolarHBondContact OE1-NH2 2.79Å; E101-R167 IonicContact OE2-CZ 3.36Å; E101-R167 IonicContact OE2-NE 2.78Å; E101-R167 PolarHBondContact OE2-NE 3.19Å; E101-R167 IonicContact OE2-NH2 3.1Å; E101-R167 PolarHBondContact OE2-NH2 3.46Å; E101-R167 VanDerWaalsContact OE2-NH2 3.1Å; E101-I193 HydrophobicContact CB-CG2 3.87Å; E101-V194 WeakPolarHBondContact CB-O 3.38Å; E101-V194 PolarHBondContact N-O 2.96Å; E101-K196 HydrophobicContact CG-CB 4.24Å; E101-K196 PolarHBondContact OE1-N 3.16Å
102	G	93.8	Very high	94	Very high	23 Å²	23	39.5 Å²	39.5	24%	0.237	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	72.4	2.2	-176.4	0	0	0	0	0	116.2	V100 A160	V100-G102 PolarHBondContact O-N 2.79Å; G102-A160 VanDerWaalsContact CA-O 3.28Å; G102-A160 WeakPolarHBondContact CA-O 3.47Å; G102-A160 PolarHBondContact N-O 3.5Å
103	C	94.9	Very high	94.4	Very high	19 Å²	19	38.8 Å²	38.8	13%	0.128	21%	0.208	C	C	.	.			trans	-78.9	143.4	172.6	-170.2	0	0	0	0	109.9	E76 I99 V100 E101 A160	E76-C103 PolarHBondContact O-SG 2.89Å; E76-C103 VanDerWaalsContact O-SG 3.33Å; I99-C103 HydrophobicContact CG2-CB 4.38Å; V100-C103 HydrophobicContact CB-CB 4.17Å; V100-C103 WeakPolarHBondContact O-CB 3.33Å; V100-C103 PolarHBondContact O-N 2.89Å; E101-C103 PolarHBondContact O-N 2.96Å; C103-A160 PolarHBondContact O-N 3.37Å
104	S	96.5	Very high	94.9	Very high	38 Å²	38	32.6 Å²	32.6	27%	0.266	18%	0.181	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	139.8	172.5	-170.9	0	0	0	0	110.4	E76 P157 E158	E76-S104 WeakPolarHBondContact CB-O 3.41Å; E76-S104 PolarHBondContact N-O 2.8Å; S104-P157 WeakPolarHBondContact OG-CB 3.48Å; S104-E158 CarbonylContact C-O 3.6Å; S104-E158 VanDerWaalsContact CA-O 3.28Å; S104-E158 WeakPolarHBondContact CA-O 3.38Å
105	Y	96.8	Very high	95.3	Very high	12 Å²	12	33.9 Å²	33.9	5%	0.047	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	160.6	171.1	67.5	-85.7	0	0	0	111.6	L74 I99 E158 A160	L74-Y105 CarbonylContact O-C 3.6Å; L74-Y105 WeakPolarHBondContact O-CA 3.37Å; L74-Y105 WeakPolarHBondContact O-CB 3.43Å; I99-Y105 HydrophobicContact CD1-CD1 3.83Å; I99-Y105 HydrophobicContact CD1-CD2 4.09Å; I99-Y105 HydrophobicContact CD1-CE1 4.11Å; I99-Y105 HydrophobicContact CD1-CE2 4.39Å; I99-Y105 HydrophobicContact CD1-CG 3.82Å; I99-Y105 HydrophobicContact CG2-CD1 3.96Å; Y105-E158 HydrophobicContact CD1-CB 4.42Å; Y105-E158 HydrophobicContact CD2-CB 4.42Å; Y105-E158 HydrophobicContact CE1-CB 3.91Å; Y105-E158 HydrophobicContact CE2-CB 3.87Å; Y105-E158 HydrophobicContact CE2-CG 4.49Å; Y105-E158 WeakPolarHBondContact CE2-OE2 3.35Å; Y105-E158 VanDerWaalsContact CZ-OE2 3.24Å; Y105-E158 PolarHBondContact N-O 3.22Å; Y105-E158 PolarHBondContact O-N 2.88Å; Y105-E158 PolarHBondContact OH-OE2 2.86Å; Y105-A160 HydrophobicContact CD1-CB 4.43Å; Y105-A160 HydrophobicContact CE1-CB 4.23Å
106	R	97.7	Very high	95.6	Very high	98 Å²	98	28.8 Å²	28.8	37%	0.37	15%	0.153	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	155	174.7	-66.7	173.2	-175.9	-102	5.5	110.6	L74 T154 S155 P157	L74-R106 HydrophobicContact CB-CB 4.38Å; L74-R106 HydrophobicContact CD1-CB 4.36Å; L74-R106 WeakPolarHBondContact CD1-O 3.44Å; L74-R106 PolarHBondContact N-O 2.79Å; L74-R106 PolarHBondContact O-N 2.86Å; R106-T154 HydrophobicContact CB-CG2 3.97Å; R106-T154 HydrophobicContact CG-CG2 4.4Å; R106-S155 PolarHBondContact NH1-O 3.35Å; R106-P157 HydrophobicContact CG-CB 4.32Å
107	I	97.1	Very high	95.7	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	134	166.1	-73.5	170.7	0	0	0	107.9	F71 I73 V109 Q125 W153 T154 S155 W189	F71-I107 HydrophobicContact CD2-CG2 3.7Å; F71-I107 HydrophobicContact CE2-CB 4.1Å; F71-I107 HydrophobicContact CE2-CD1 4.21Å; F71-I107 HydrophobicContact CE2-CG1 3.86Å; F71-I107 HydrophobicContact CE2-CG2 3.36Å; F71-I107 HydrophobicContact CZ-CG1 4.38Å; I73-I107 HydrophobicContact CD1-CG1 3.79Å; I107-V109 HydrophobicContact CG2-CG2 4.05Å; I107-Q125 VanDerWaalsContact CD1-OE1 3.27Å; I107-W153 HydrophobicContact CG2-CH2 4.37Å; I107-W153 HydrophobicContact CG2-CZ3 3.79Å; I107-T154 CarbonylContact O-C 3.58Å; I107-T154 VanDerWaalsContact O-CA 3.27Å; I107-T154 WeakPolarHBondContact O-CA 3.14Å; I107-S155 PolarHBondContact N-OG 3.08Å; I107-S155 PolarHBondContact O-N 3Å; I107-W189 HydrophobicContact CD1-CH2 4.24Å; I107-W189 HydrophobicContact CD1-CZ2 3.87Å; I107-W189 HydrophobicContact CG1-CH2 4.47Å; I107-W189 HydrophobicContact CG1-CZ2 4.46Å
108	Q	98.2	Very high	95.8	Very high	45 Å²	45	26.6 Å²	26.6	21%	0.21	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	140.5	167.1	-175.6	176.3	95	0	0	110.2	F71 C72 L74 I152 W153 T154	F71-Q108 CarbonylContact C-O 3.57Å; F71-Q108 VanDerWaalsContact CA-O 3.29Å; F71-Q108 WeakPolarHBondContact CA-O 3.26Å; C72-Q108 HydrophobicContact CB-CB 4.37Å; C72-Q108 PolarHBondContact N-O 2.86Å; C72-Q108 PolarHBondContact O-N 2.96Å; L74-Q108 HydrophobicContact CD1-CB 3.42Å; L74-Q108 VanDerWaalsContact CD1-CB 3.42Å; Q108-I152 VanDerWaalsContact CD-CG2 3.49Å; Q108-I152 HydrophobicContact CG-CG2 3.52Å; Q108-W153 CarbonylContact C-O 3.58Å; Q108-W153 VanDerWaalsContact CA-O 3.23Å; Q108-W153 WeakPolarHBondContact CA-O 3.39Å; Q108-W153 WeakPolarHBondContact CG-O 3.27Å; Q108-T154 HydrophobicContact CB-CG2 4.49Å; Q108-T154 PolarHBondContact NE2-OG1 2.91Å
109	V	98.4	Very high	95.9	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	130.8	178	-175.9	0	0	0	0	108.9	F68 F71 I107 Y111 I152 W153 F176	F68-V109 HydrophobicContact CD1-CG1 3.56Å; F68-V109 HydrophobicContact CE1-CG1 4.01Å; F71-V109 HydrophobicContact CB-CG2 4.41Å; F71-V109 HydrophobicContact CD2-CG2 3.86Å; I107-V109 HydrophobicContact CG2-CG2 4.05Å; V109-Y111 HydrophobicContact CG1-CD1 4.21Å; V109-I152 WeakPolarHBondContact O-CA 3.4Å; V109-W153 HydrophobicContact CB-CE3 4.18Å; V109-W153 HydrophobicContact CG2-CE3 3.88Å; V109-W153 HydrophobicContact CG2-CZ3 4.07Å; V109-W153 PolarHBondContact N-O 3.41Å; V109-W153 PolarHBondContact O-N 2.57Å; V109-F176 HydrophobicContact CB-CE2 4.21Å; V109-F176 HydrophobicContact CB-CZ 4.09Å; V109-F176 HydrophobicContact CG1-CE2 3.76Å; V109-F176 HydrophobicContact CG1-CZ 4Å; V109-F176 HydrophobicContact CG2-CE2 3.87Å; V109-F176 HydrophobicContact CG2-CZ 3.91Å
110	V	98.5	Very high	95.9	Very high	7 Å²	7	25.6 Å²	25.6	4%	0.042	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	123.2	174	-173.4	0	0	0	0	108.4	E69 K70 P150 H151 I152	E69-V110 HydrophobicContact CB-CG1 4.46Å; E69-V110 PolarHBondContact N-O 2.9Å; K70-V110 HydrophobicContact CD-CG2 4.3Å; K70-V110 HydrophobicContact CG-CB 3.73Å; K70-V110 HydrophobicContact CG-CG2 3.76Å; K70-V110 PolarHBondContact N-O 3.42Å; K70-V110 PolarHBondContact O-N 3.48Å; V110-P150 HydrophobicContact CG1-CB 3.62Å; V110-P150 HydrophobicContact CG1-CG 4.21Å; V110-H151 WeakPolarHBondContact CA-O 3.33Å; V110-I152 HydrophobicContact CG1-CG1 4.47Å; V110-I152 HydrophobicContact CG2-CG1 4.26Å
111	Y	98.5	Very high	96.1	Very high	4 Å²	4	23.7 Å²	23.7	2%	0.016	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	159.1	-175.9	63.9	-85.2	0	0	0	111.7	V66 V67 F68 V109 V113 L121 L141 F144 P150 H151 W153	V66-Y111 HydrophobicContact CG1-CD2 3.74Å; V66-Y111 HydrophobicContact CG1-CG 4.32Å; V67-Y111 CarbonylContact O-C 3.59Å; V67-Y111 VanDerWaalsContact O-CA 3.27Å; V67-Y111 WeakPolarHBondContact O-CA 3.34Å; F68-Y111 HydrophobicContact CD1-CG 4.27Å; F68-Y111 HydrophobicContact CE1-CD1 4.22Å; F68-Y111 AromaticContact CE1-CG 3.95Å; F68-Y111 HydrophobicContact CE1-CG 3.95Å; V109-Y111 HydrophobicContact CG1-CD1 4.21Å; Y111-V113 HydrophobicContact CD2-CG2 4.14Å; Y111-V113 HydrophobicContact CE2-CG2 4.02Å; Y111-L121 HydrophobicContact CD2-CD2 4.19Å; Y111-L121 HydrophobicContact CE2-CD2 3.57Å; Y111-L141 HydrophobicContact CE1-CD2 4.27Å; Y111-F144 VanDerWaalsContact OH-CE1 3.27Å; Y111-F144 WeakPolarHBondContact OH-CE1 3.19Å; Y111-F144 WeakPolarHBondContact OH-CZ 3.45Å; Y111-P150 CarbonylContact O-C 3.5Å; Y111-P150 WeakPolarHBondContact O-CA 3.48Å; Y111-H151 HydrophobicContact CD1-CB 4.35Å; Y111-H151 HydrophobicContact CD2-CB 4.1Å; Y111-H151 HydrophobicContact CE1-CB 3.88Å; Y111-H151 HydrophobicContact CE2-CB 3.61Å; Y111-H151 HydrophobicContact CG-CB 4.45Å; Y111-H151 VanDerWaalsContact CZ-CB 3.48Å; Y111-H151 PolarHBondContact N-O 2.78Å; Y111-H151 PolarHBondContact O-N 2.77Å; Y111-W153 HydrophobicContact CE1-CB 3.94Å
112	Y	97.7	Very high	96.2	Very high	30 Å²	30	24.5 Å²	24.5	12%	0.118	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	132.1	-179.7	-65.6	-104.6	0	0	0	108.7	P58 F59 V66 V67 E69 P150	P58-Y112 HydrophobicContact CB-CD1 3.86Å; P58-Y112 HydrophobicContact CB-CE1 4.21Å; P58-Y112 HydrophobicContact CB-CG 4.44Å; P58-Y112 HydrophobicContact CG-CD1 3.78Å; P58-Y112 HydrophobicContact CG-CE1 4.37Å; F59-Y112 HydrophobicContact CD2-CD2 4.31Å; F59-Y112 HydrophobicContact CD2-CG 4.29Å; F59-Y112 HydrophobicContact CE2-CD1 4.22Å; F59-Y112 AromaticContact CE2-CD2 3.41Å; F59-Y112 HydrophobicContact CE2-CD2 3.41Å; F59-Y112 VanDerWaalsContact CE2-CD2 3.41Å; F59-Y112 HydrophobicContact CE2-CE1 4.4Å; F59-Y112 AromaticContact CE2-CE2 3.65Å; F59-Y112 HydrophobicContact CE2-CE2 3.65Å; F59-Y112 AromaticContact CE2-CG 3.71Å; F59-Y112 HydrophobicContact CE2-CG 3.71Å; F59-Y112 HydrophobicContact CZ-CD2 4.18Å; F59-Y112 HydrophobicContact CZ-CE2 4.04Å; V66-Y112 CarbonylContact C-O 3.6Å; V66-Y112 VanDerWaalsContact CA-O 3.27Å; V66-Y112 WeakPolarHBondContact CA-O 3.11Å; V67-Y112 PolarHBondContact N-O 2.76Å; V67-Y112 PolarHBondContact O-N 3.5Å; E69-Y112 HydrophobicContact CB-CD2 4.39Å; E69-Y112 HydrophobicContact CB-CE2 3.92Å; E69-Y112 HydrophobicContact CG-CE2 4.49Å; E69-Y112 VanDerWaalsContact OE2-CE2 3.29Å; E69-Y112 WeakPolarHBondContact OE2-CE2 3.44Å; E69-Y112 PolarHBondContact OE2-OH 3.28Å; Y112-P150 HydrophobicContact CD1-CB 4.19Å; Y112-P150 HydrophobicContact CD2-CB 4.2Å; Y112-P150 HydrophobicContact CE1-CB 3.79Å; Y112-P150 VanDerWaalsContact CE1-CD 3.48Å; Y112-P150 HydrophobicContact CE1-CG 4.06Å; Y112-P150 HydrophobicContact CE2-CB 3.78Å; Y112-P150 HydrophobicContact CE2-CG 4.47Å; Y112-P150 HydrophobicContact CG-CB 4.4Å
113	V	96.7	Very high	96.4	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	123.5	165.6	-178	0	0	0	0	107.6	N65 V66 Y111 V118 F144 P146 Q147	N65-V113 CarbonylContact O-C 3.51Å; N65-V113 WeakPolarHBondContact O-CA 3.28Å; V66-V113 HydrophobicContact CG1-CG2 4.46Å; V66-V113 HydrophobicContact CG2-CG2 4.22Å; Y111-V113 HydrophobicContact CD2-CG2 4.14Å; Y111-V113 HydrophobicContact CE2-CG2 4.02Å; V113-V118 HydrophobicContact CG1-CB 4.29Å; V113-V118 HydrophobicContact CG1-CG2 3.77Å; V113-F144 HydrophobicContact CB-CB 4.18Å; V113-F144 HydrophobicContact CG1-CB 4.19Å; V113-F144 HydrophobicContact CG2-CB 3.6Å; V113-F144 HydrophobicContact CG2-CG 4.24Å; V113-P146 WeakPolarHBondContact O-CA 3.29Å; V113-Q147 PolarHBondContact O-N 3.48Å
114	Q	94.4	Very high	96.6	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	12%	0.115	C	C	.	.			trans	-134.5	158.9	-174.7	60.9	174.5	26.4	0	0	110.3	V57 F59 R62 A64 N65 D116	V57-Q114 HydrophobicContact CG1-CB 4.2Å; V57-Q114 HydrophobicContact CG1-CG 4.46Å; V57-Q114 VanDerWaalsContact CG1-OE1 3.28Å; F59-Q114 VanDerWaalsContact N-OE1 3.09Å; F59-Q114 PolarHBondContact O-NE2 3.21Å; F59-Q114 VanDerWaalsContact O-NE2 3.11Å; F59-Q114 PolarHBondContact O-OE1 2.94Å; R62-Q114 PolarHBondContact O-NE2 3.04Å; R62-Q114 VanDerWaalsContact O-NE2 3.08Å; A64-Q114 PolarHBondContact O-NE2 3.33Å; N65-Q114 WeakPolarHBondContact CA-O 3.27Å; N65-Q114 WeakPolarHBondContact O-CG 3.44Å; N65-Q114 PolarHBondContact O-N 2.8Å; N65-Q114 VanDerWaalsContact O-O 3.12Å; Q114-D116 PolarHBondContact O-N 3.41Å
115	R	91.5	Very high	96.6	Very high	106 Å²	106	23.5 Å²	23.5	40%	0.4	10%	0.103	S	C	.	.	S	Bend	trans	69	-60.2	175.7	-51	173	-174.8	-83.9	1.8	115.1	P60 R62 P146	P60-R115 PolarHBondContact O-NH2 2.91Å; R62-R115 PolarHBondContact O-NE 3.24Å; R62-R115 PolarHBondContact O-NH2 3.41Å; R115-P146 VanDerWaalsContact C-CG 3.48Å
116	D	93.2	Very high	96.7	Very high	30 Å²	30	25.9 Å²	25.9	16%	0.16	11%	0.112	C	C	.	.	S	Bend	trans	-139.3	163.6	-175.9	-150.8	-10.2	0	0	0	113.5	T26 L27 Q114 P146	T26-D116 WeakPolarHBondContact CA-OD2 3.23Å; T26-D116 VanDerWaalsContact CB-OD2 3.27Å; T26-D116 WeakPolarHBondContact CB-OD2 3.48Å; T26-D116 WeakPolarHBondContact CG2-OD2 3.27Å; L27-D116 VanDerWaalsContact CB-OD1 3.24Å; L27-D116 WeakPolarHBondContact CB-OD1 3.4Å; L27-D116 PolarHBondContact N-OD1 2.71Å; Q114-D116 PolarHBondContact O-N 3.41Å; D116-P146 VanDerWaalsContact CA-CG 3.46Å; D116-P146 VanDerWaalsContact N-CG 3.31Å; D116-P146 VanDerWaalsContact O-CG 3.3Å; D116-P146 WeakPolarHBondContact O-CG 3.43Å
117	I	93	Very high	96.7	Very high	27 Å²	27	22.1 Å²	22.1	14%	0.138	10%	0.099	C	C	.	.			trans	-61	139.1	174.9	-66.4	164.9	0	0	0	109.3	L27 I30 L48 F144	L27-I117 HydrophobicContact CB-CD1 4.17Å; L27-I117 HydrophobicContact CB-CG1 4.25Å; L27-I117 HydrophobicContact CD1-CD1 3.55Å; L27-I117 HydrophobicContact CD1-CG1 3.9Å; L27-I117 HydrophobicContact CG-CD1 4.48Å; I30-I117 HydrophobicContact CD1-CD1 3.69Å; L48-I117 HydrophobicContact CD1-CD1 4.27Å; L48-I117 HydrophobicContact CD2-CD1 3.93Å; I117-F144 CarbonylContact C-O 3.47Å; I117-F144 WeakPolarHBondContact CA-O 3.49Å
118	V	95.9	Very high	96.7	Very high	1 Å²	1	27.9 Å²	27.9	1%	0.006	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	115	174.2	176.9	0	0	0	0	107.8	N65 V66 V113 L121 N143 F144 D178 Y184	N65-V118 HydrophobicContact CB-CG2 3.81Å; V66-V118 HydrophobicContact CG2-CB 4.23Å; V66-V118 HydrophobicContact CG2-CG1 3.94Å; V66-V118 HydrophobicContact CG2-CG2 3.6Å; V113-V118 HydrophobicContact CG1-CB 4.29Å; V113-V118 HydrophobicContact CG1-CG2 3.77Å; V118-L121 HydrophobicContact CG1-CB 4.06Å; V118-L121 HydrophobicContact CG1-CD1 4.3Å; V118-N143 CarbonylContact O-C 3.56Å; V118-N143 WeakPolarHBondContact O-CA 3.47Å; V118-F144 PolarHBondContact N-O 3.06Å; V118-F144 PolarHBondContact O-N 3.43Å; V118-D178 HydrophobicContact CG1-CB 4Å; V118-Y184 HydrophobicContact CG1-CE2 4.35Å
119	C	95.5	Very high	96.5	Very high	36 Å²	36	28.4 Å²	28.4	24%	0.243	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	130.3	-177.9	-67.8	0	0	0	0	110.7	L121 N143 D178 D179	C119-L121 PolarHBondContact O-N 3.1Å; C119-N143 WeakPolarHBondContact CA-OD1 3.35Å; C119-D178 WeakPolarHBondContact O-CB 3.44Å; C119-D179 WeakPolarHBondContact O-CB 3.27Å; C119-D179 PolarHBondContact O-N 3.49Å; C119-D179 VanDerWaalsContact O-N 3.1Å
120	G	96.5	Very high	96.2	Very high	1 Å²	1	30.7 Å²	30.7	1%	0.01	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	63.3	41.6	174.6	0	0	0	0	0	114.1	R122 M140 G142 N143 D178 D179	G120-R122 PolarHBondContact O-N 3.49Å; G120-M140 WeakPolarHBondContact CA-SD 3.45Å; G120-G142 WeakPolarHBondContact CA-O 3.39Å; G120-G142 PolarHBondContact N-O 2.85Å; G120-N143 PolarHBondContact N-OD1 3.11Å; G120-D178 WeakPolarHBondContact O-CA 3.31Å; G120-D179 WeakPolarHBondContact CA-OD2 3.32Å
121	L	98.3	Very high	96	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58	128.9	172.6	-175.8	64.9	0	0	0	108.9	V66 Y111 V118 C119 L141 G142 F144 F176 Y184	V66-L121 HydrophobicContact CG2-CD1 4.44Å; Y111-L121 HydrophobicContact CD2-CD2 4.19Å; Y111-L121 HydrophobicContact CE2-CD2 3.57Å; V118-L121 HydrophobicContact CG1-CB 4.06Å; V118-L121 HydrophobicContact CG1-CD1 4.3Å; C119-L121 PolarHBondContact O-N 3.1Å; L121-L141 HydrophobicContact CD2-CD2 4.4Å; L121-L141 WeakPolarHBondContact O-CA 3.42Å; L121-L141 WeakPolarHBondContact O-CB 3.48Å; L121-L141 PolarHBondContact O-N 3.22Å; L121-G142 PolarHBondContact N-O 3.05Å; L121-G142 PolarHBondContact O-N 2.9Å; L121-F144 HydrophobicContact CB-CD2 3.84Å; L121-F144 HydrophobicContact CB-CE2 3.84Å; L121-F144 HydrophobicContact CD2-CD2 3.96Å; L121-F144 HydrophobicContact CD2-CE2 3.96Å; L121-F144 HydrophobicContact CG-CE2 4.47Å; L121-F176 HydrophobicContact CD1-CB 4.39Å; L121-F176 HydrophobicContact CD1-CD1 4.12Å; L121-F176 HydrophobicContact CG-CD1 4.2Å; L121-Y184 HydrophobicContact CD1-CD2 4.14Å; L121-Y184 HydrophobicContact CD1-CE2 4.22Å
122	R	97.9	Very high	95.8	Very high	37 Å²	37	40.8 Å²	40.8	14%	0.14	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	131.2	-169.6	-176.2	-175.7	-74.3	108.7	-6.8	110	G120 K124 S138 V139 M140 F176 I177 D179	G120-R122 PolarHBondContact O-N 3.49Å; R122-K124 HydrophobicContact CG-CG 4.39Å; R122-S138 WeakPolarHBondContact CD-OG 3.44Å; R122-V139 CarbonylContact C-O 3.56Å; R122-V139 VanDerWaalsContact CA-O 3.3Å; R122-V139 WeakPolarHBondContact CA-O 3.45Å; R122-V139 WeakPolarHBondContact CG-O 3.42Å; R122-M140 HydrophobicContact CB-SD 4.37Å; R122-F176 WeakPolarHBondContact O-CA 3.17Å; R122-I177 WeakPolarHBondContact CA-O 3.38Å; R122-I177 HydrophobicContact CB-CG2 4.29Å; R122-I177 WeakPolarHBondContact CB-O 3.24Å; R122-I177 PolarHBondContact N-O 2.93Å; R122-I177 PolarHBondContact O-N 3.49Å; R122-D179 IonicContact CZ-OD1 2.72Å; R122-D179 IonicContact NH1-OD1 3.95Å; R122-D179 PolarHBondContact NH1-OD1 3.2Å; R122-D179 IonicContact NH2-OD1 3.58Å; R122-D179 PolarHBondContact NH2-OD1 3.13Å
123	Y	98.2	Very high	95.8	Very high	0 Å²	0	43 Å²	43	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	133.3	168.6	178.7	-107.1	0	0	0	109.3	Q125 M137 S138 V139 W153 S174 Q175 F176 W187	Y123-Q125 HydrophobicContact CE1-CB 3.59Å; Y123-Q125 PolarHBondContact OH-OE1 2.64Å; Y123-M137 HydrophobicContact CD1-CE 4.35Å; Y123-M137 HydrophobicContact CE1-CE 4.23Å; Y123-M137 HydrophobicContact CE1-SD 4.07Å; Y123-S138 CarbonylContact O-C 3.57Å; Y123-S138 WeakPolarHBondContact O-CA 3.25Å; Y123-V139 PolarHBondContact N-O 3.05Å; Y123-V139 PolarHBondContact O-N 3.14Å; Y123-W153 AromaticContact CD1-CH2 3.38Å; Y123-W153 HydrophobicContact CD1-CH2 3.38Å; Y123-W153 HydrophobicContact CD1-CZ2 4.29Å; Y123-W153 AromaticContact CD1-CZ3 3.93Å; Y123-W153 HydrophobicContact CD1-CZ3 3.93Å; Y123-W153 HydrophobicContact CD2-CH2 4.21Å; Y123-W153 AromaticContact CD2-CZ3 3.9Å; Y123-W153 HydrophobicContact CD2-CZ3 3.9Å; Y123-W153 AromaticContact CE1-CH2 3.88Å; Y123-W153 HydrophobicContact CE1-CH2 3.88Å; Y123-W153 HydrophobicContact CE1-CZ3 4.3Å; Y123-W153 HydrophobicContact CE2-CZ3 4.26Å; Y123-W153 AromaticContact CG-CH2 3.56Å; Y123-W153 HydrophobicContact CG-CH2 3.56Å; Y123-W153 HydrophobicContact CG-CZ2 4.45Å; Y123-W153 AromaticContact CG-CZ3 3.7Å; Y123-W153 HydrophobicContact CG-CZ3 3.7Å; Y123-S174 WeakPolarHBondContact OH-CB 3.33Å; Y123-S174 PolarHBondContact OH-OG 3.2Å; Y123-Q175 WeakPolarHBondContact CA-O 3.38Å; Y123-F176 HydrophobicContact CD2-CD2 4.19Å; Y123-F176 HydrophobicContact CD2-CE1 4Å; Y123-F176 AromaticContact CD2-CE2 3.66Å; Y123-F176 HydrophobicContact CD2-CE2 3.66Å; Y123-F176 AromaticContact CD2-CZ 3.56Å; Y123-F176 HydrophobicContact CD2-CZ 3.56Å; Y123-F176 HydrophobicContact CE2-CE2 4.22Å; Y123-F176 HydrophobicContact CE2-CZ 4.41Å; Y123-F176 HydrophobicContact CG-CE1 4.36Å; Y123-F176 HydrophobicContact CG-CZ 4.23Å; Y123-W187 HydrophobicContact CE2-CH2 4.1Å; Y123-W187 HydrophobicContact CE2-CZ2 4.5Å
124	K	98.2	Very high	95.7	Very high	56 Å²	56	46.3 Å²	46.3	24%	0.243	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	144.8	171.1	-65.2	-175.5	178.5	-178.8	0	110	R122 W126 M137 S174 Q175 I177	R122-K124 HydrophobicContact CG-CG 4.39Å; K124-W126 HydrophobicContact CB-CH2 3.7Å; K124-W126 HydrophobicContact CB-CZ2 4.2Å; K124-W126 HydrophobicContact CB-CZ3 4.02Å; K124-W126 HydrophobicContact CD-CH2 3.94Å; K124-W126 HydrophobicContact CD-CZ2 4.12Å; K124-M137 WeakPolarHBondContact CA-O 3.3Å; K124-S174 CarbonylContact O-C 3.5Å; K124-S174 WeakPolarHBondContact O-CA 3.44Å; K124-Q175 HydrophobicContact CB-CB 4.44Å; K124-Q175 PolarHBondContact N-O 2.82Å; K124-Q175 PolarHBondContact O-N 3.13Å; K124-I177 HydrophobicContact CD-CG2 4.16Å; K124-I177 HydrophobicContact CG-CG2 4.47Å
125	Q	97.4	Very high	95.7	Very high	3 Å²	3	49.9 Å²	49.9	1%	0.014	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	141.7	175.8	155	174.7	-51.4	0	0	111.7	I107 Y123 E136 M137 I172 V173	I107-Q125 VanDerWaalsContact CD1-OE1 3.27Å; Y123-Q125 HydrophobicContact CE1-CB 3.59Å; Y123-Q125 PolarHBondContact OH-OE1 2.64Å; Q125-E136 WeakPolarHBondContact O-CA 3.18Å; Q125-M137 HydrophobicContact CB-CG 3.55Å; Q125-M137 HydrophobicContact CB-SD 3.85Å; Q125-M137 HydrophobicContact CG-CG 3.97Å; Q125-M137 HydrophobicContact CG-SD 3.94Å; Q125-M137 PolarHBondContact N-O 2.83Å; Q125-M137 PolarHBondContact NE2-SD 2.71Å; Q125-M137 VanDerWaalsContact NE2-SD 3.44Å; Q125-M137 PolarHBondContact O-N 3.06Å; Q125-I172 HydrophobicContact CG-CG2 3.55Å; Q125-V173 CarbonylContact C-O 3.53Å; Q125-V173 VanDerWaalsContact CA-O 3.23Å; Q125-V173 WeakPolarHBondContact CA-O 3.32Å
126	W	98	Very high	96	Very high	62 Å²	62	50.3 Å²	50.3	24%	0.235	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	124.4	173.9	-59.1	-88.9	0	0	0	109.8	K124 L133 E136 I172 V173 Q175	K124-W126 HydrophobicContact CB-CH2 3.7Å; K124-W126 HydrophobicContact CB-CZ2 4.2Å; K124-W126 HydrophobicContact CB-CZ3 4.02Å; K124-W126 HydrophobicContact CD-CH2 3.94Å; K124-W126 HydrophobicContact CD-CZ2 4.12Å; W126-L133 HydrophobicContact CB-CD1 3.94Å; W126-E136 VanDerWaalsContact CD1-CD 3.48Å; W126-E136 PolarHBondContact NE1-OE1 2.88Å; W126-I172 WeakPolarHBondContact O-CA 3.33Å; W126-V173 HydrophobicContact CE3-CB 4.04Å; W126-V173 HydrophobicContact CE3-CG1 4.1Å; W126-V173 HydrophobicContact CZ3-CG1 4.39Å; W126-V173 PolarHBondContact N-O 2.85Å; W126-V173 PolarHBondContact O-N 2.98Å; W126-Q175 HydrophobicContact CH2-CB 4.34Å; W126-Q175 HydrophobicContact CZ3-CB 3.91Å
127	L	96.8	Very high	96.1	Very high	20 Å²	20	50.7 Å²	50.7	11%	0.105	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	124.1	-178.6	-174.6	65	0	0	0	110	L133 V134 D135 Y170 I172	L127-L133 WeakPolarHBondContact O-CD1 3.39Å; L127-V134 HydrophobicContact CB-CG2 4Å; L127-V134 HydrophobicContact CD2-CG2 3.78Å; L127-V134 HydrophobicContact CG-CG2 3.58Å; L127-V134 WeakPolarHBondContact O-CG2 3.5Å; L127-V134 PolarHBondContact O-N 3.19Å; L127-D135 HydrophobicContact CB-CB 3.93Å; L127-D135 HydrophobicContact CD2-CB 4.07Å; L127-D135 PolarHBondContact N-O 3.18Å; L127-D135 PolarHBondContact O-N 3.24Å; L127-Y170 HydrophobicContact CD1-CD1 3.89Å; L127-Y170 HydrophobicContact CD1-CG 4.13Å; L127-Y170 HydrophobicContact CD2-CD1 4.07Å; L127-Y170 HydrophobicContact CD2-CE1 4.47Å; L127-Y170 HydrophobicContact CG-CD1 3.87Å; L127-I172 HydrophobicContact CD1-CD1 3.94Å; L127-I172 HydrophobicContact CD1-CG1 3.47Å; L127-I172 VanDerWaalsContact CD1-CG1 3.47Å
128	R	97.1	Very high	96.2	Very high	121 Å²	121	52.9 Å²	52.9	46%	0.457	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	138.1	177.8	-72.5	-177.4	173.5	-118.1	3.5	112.3	P131 I132 L133 Y170 K171	R128-P131 PolarHBondContact NH1-O 3.07Å; R128-I132 CarbonylContact C-O 3.55Å; R128-I132 WeakPolarHBondContact CA-O 3.3Å; R128-I132 WeakPolarHBondContact CB-O 3.4Å; R128-L133 HydrophobicContact CG-CB 4.46Å; R128-L133 HydrophobicContact CG-CD1 4.09Å; R128-Y170 CarbonylContact O-C 3.54Å; R128-Y170 VanDerWaalsContact O-CA 3.3Å; R128-Y170 WeakPolarHBondContact O-CA 3.5Å; R128-K171 PolarHBondContact N-O 3.22Å; R128-K171 PolarHBondContact O-N 2.92Å
129	K	95.3	Very high	96.3	Very high	55 Å²	55	55.2 Å²	55.2	24%	0.239	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	106.9	166.1	-171.5	171.2	-171.8	156.7	0	109.2	I132 V134 L165 S166 R167 Y170	K129-I132 PolarHBondContact N-O 3.17Å; K129-I132 PolarHBondContact O-N 2.89Å; K129-V134 HydrophobicContact CB-CG1 3.92Å; K129-L165 PolarHBondContact NZ-O 3.04Å; K129-S166 PolarHBondContact NZ-O 3.13Å; K129-R167 PolarHBondContact NZ-O 2.93Å; K129-Y170 HydrophobicContact CB-CD1 3.98Å; K129-Y170 HydrophobicContact CB-CE1 3.88Å; K129-Y170 HydrophobicContact CD-CE1 3.97Å; K129-Y170 HydrophobicContact CD-CE2 4.38Å; K129-Y170 HydrophobicContact CG-CE1 4.28Å
130	G	92.6	Very high	96.3	Very high	49 Å²	49	57.2 Å²	57.2	51%	0.505	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.7	-128.5	-169.2	0	0	0	0	0	111.1
131	P	93	Very high	96.4	Very high	112 Å²	112	58.7 Å²	58.7	73%	0.727	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.4	-15.1	177.5	31.8	-32.8	0	0	0	113.8	R128	R128-P131 PolarHBondContact NH1-O 3.07Å
132	I	95.2	Very high	96.2	Very high	111 Å²	111	59.7 Å²	59.7	57%	0.569	32%	0.322	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87	129.5	-170	-55.8	175.1	0	0	0	110.2	R128 K129 V134	R128-I132 CarbonylContact C-O 3.55Å; R128-I132 WeakPolarHBondContact CA-O 3.3Å; R128-I132 WeakPolarHBondContact CB-O 3.4Å; K129-I132 PolarHBondContact N-O 3.17Å; K129-I132 PolarHBondContact O-N 2.89Å; I132-V134 HydrophobicContact CG2-CG1 4.14Å
133	L	96.5	Very high	96.1	Very high	76 Å²	76	63.2 Å²	63.2	40%	0.398	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	119.5	165.1	-178.4	71.4	0	0	0	108	W126 L127 R128 D135	W126-L133 HydrophobicContact CB-CD1 3.94Å; L127-L133 WeakPolarHBondContact O-CD1 3.39Å; R128-L133 HydrophobicContact CG-CB 4.46Å; R128-L133 HydrophobicContact CG-CD1 4.09Å; L133-D135 WeakPolarHBondContact CD1-O 3.22Å
134	V	95.5	Very high	95.9	Very high	69 Å²	69	64.6 Å²	64.6	42%	0.418	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	-23.3	-175.5	-65.7	0	0	0	0	112.7	L127 K129 I132 Y170	L127-V134 HydrophobicContact CB-CG2 4Å; L127-V134 HydrophobicContact CD2-CG2 3.78Å; L127-V134 HydrophobicContact CG-CG2 3.58Å; L127-V134 WeakPolarHBondContact O-CG2 3.5Å; L127-V134 PolarHBondContact O-N 3.19Å; K129-V134 HydrophobicContact CB-CG1 3.92Å; I132-V134 HydrophobicContact CG2-CG1 4.14Å; V134-Y170 HydrophobicContact CG2-CD1 4.06Å; V134-Y170 HydrophobicContact CG2-CE1 4Å
135	D	95.1	Very high	95.6	Very high	76 Å²	76	66.3 Å²	66.3	41%	0.406	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.6	150	177.5	-173.3	44.3	0	0	0	111.1	L127 L133	L127-D135 HydrophobicContact CB-CB 3.93Å; L127-D135 HydrophobicContact CD2-CB 4.07Å; L127-D135 PolarHBondContact N-O 3.18Å; L127-D135 PolarHBondContact O-N 3.24Å; L133-D135 WeakPolarHBondContact CD1-O 3.22Å
136	E	96.7	Very high	95.5	Very high	115 Å²	115	66.2 Å²	66.2	54%	0.537	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	127.8	174.1	174.3	169.8	-172.8	0	0	108.8	Q125 W126	Q125-E136 WeakPolarHBondContact O-CA 3.18Å; W126-E136 VanDerWaalsContact CD1-CD 3.48Å; W126-E136 PolarHBondContact NE1-OE1 2.88Å
137	M	95.4	Very high	95.2	Very high	38 Å²	38	64.3 Å²	64.3	19%	0.187	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	148.1	-179.3	68.6	-178.7	-62.6	0	0	111.4	Y123 K124 Q125 V139	Y123-M137 HydrophobicContact CD1-CE 4.35Å; Y123-M137 HydrophobicContact CE1-CE 4.23Å; Y123-M137 HydrophobicContact CE1-SD 4.07Å; K124-M137 WeakPolarHBondContact CA-O 3.3Å; Q125-M137 HydrophobicContact CB-CG 3.55Å; Q125-M137 HydrophobicContact CB-SD 3.85Å; Q125-M137 HydrophobicContact CG-CG 3.97Å; Q125-M137 HydrophobicContact CG-SD 3.94Å; Q125-M137 PolarHBondContact N-O 2.83Å; Q125-M137 PolarHBondContact NE2-SD 2.71Å; Q125-M137 VanDerWaalsContact NE2-SD 3.44Å; Q125-M137 PolarHBondContact O-N 3.06Å; M137-V139 HydrophobicContact CE-CG2 3.81Å
138	S	96.3	Very high	94.9	Very high	72 Å²	72	65.2 Å²	65.2	50%	0.503	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	115.4	176	167	0	0	0	0	109.8	R122 Y123	R122-S138 WeakPolarHBondContact CD-OG 3.44Å; Y123-S138 CarbonylContact O-C 3.57Å; Y123-S138 WeakPolarHBondContact O-CA 3.25Å
139	V	96.8	Very high	94.7	Very high	50 Å²	50	65 Å²	65	30%	0.303	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	122.7	-176.3	-177.2	0	0	0	0	109.5	R122 Y123 M137 L141 W153	R122-V139 CarbonylContact C-O 3.56Å; R122-V139 VanDerWaalsContact CA-O 3.3Å; R122-V139 WeakPolarHBondContact CA-O 3.45Å; R122-V139 WeakPolarHBondContact CG-O 3.42Å; Y123-V139 PolarHBondContact N-O 3.05Å; Y123-V139 PolarHBondContact O-N 3.14Å; M137-V139 HydrophobicContact CE-CG2 3.81Å; V139-L141 HydrophobicContact CG1-CD1 4.36Å; V139-L141 VanDerWaalsContact O-CD1 3.25Å; V139-L141 WeakPolarHBondContact O-CD1 3.39Å; V139-W153 HydrophobicContact CB-CZ2 4.44Å; V139-W153 HydrophobicContact CG1-CZ2 4.3Å
140	M	96.3	Very high	94.8	Very high	78 Å²	78	64.4 Å²	64.4	38%	0.384	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	118.7	171.7	-177.1	64.9	99.7	0	0	109.3	Y19 G120 R122	Y19-M140 HydrophobicContact CE1-CE 4.22Å; G120-M140 WeakPolarHBondContact CA-SD 3.45Å; R122-M140 HydrophobicContact CB-SD 4.37Å
141	L	97.1	Very high	95	Very high	32 Å²	32	63.8 Å²	63.8	17%	0.168	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	-31.3	178.3	-78.6	66.2	0	0	0	111.4	Y111 L121 V139 F144 W153 F176	Y111-L141 HydrophobicContact CE1-CD2 4.27Å; L121-L141 HydrophobicContact CD2-CD2 4.4Å; L121-L141 WeakPolarHBondContact O-CA 3.42Å; L121-L141 WeakPolarHBondContact O-CB 3.48Å; L121-L141 PolarHBondContact O-N 3.22Å; V139-L141 HydrophobicContact CG1-CD1 4.36Å; V139-L141 VanDerWaalsContact O-CD1 3.25Å; V139-L141 WeakPolarHBondContact O-CD1 3.39Å; L141-F144 HydrophobicContact CB-CE2 3.85Å; L141-F144 HydrophobicContact CB-CZ 3.93Å; L141-W153 HydrophobicContact CD1-CD2 4.32Å; L141-W153 HydrophobicContact CD1-CZ2 4.47Å; L141-W153 HydrophobicContact CD2-CB 3.71Å; L141-W153 HydrophobicContact CD2-CD2 3.85Å; L141-W153 HydrophobicContact CD2-CE3 4.39Å; L141-W153 HydrophobicContact CD2-CG 3.51Å; L141-W153 HydrophobicContact CG-CB 4.47Å; L141-W153 HydrophobicContact CG-CD2 4.13Å; L141-W153 HydrophobicContact CG-CG 3.85Å; L141-F176 HydrophobicContact CD1-CE1 4.29Å; L141-F176 HydrophobicContact CD2-CE1 3.64Å; L141-F176 HydrophobicContact CD2-CZ 4.4Å
142	G	95.9	Very high	95.3	Very high	21 Å²	21	63.4 Å²	63.4	22%	0.216	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	122.8	-155.5	173.9	0	0	0	0	0	114	G120 L121 F144	G120-G142 WeakPolarHBondContact CA-O 3.39Å; G120-G142 PolarHBondContact N-O 2.85Å; L121-G142 PolarHBondContact N-O 3.05Å; L121-G142 PolarHBondContact O-N 2.9Å; G142-F144 WeakPolarHBondContact O-CD2 3.46Å; G142-F144 WeakPolarHBondContact O-CE2 3.38Å
143	N	94.7	Very high	95.4	Very high	111 Å²	111	59.8 Å²	59.8	59%	0.594	32%	0.322	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107	136.5	-178.4	-56.5	-33.7	0	0	0	109.5	V118 C119 G120	V118-N143 CarbonylContact O-C 3.56Å; V118-N143 WeakPolarHBondContact O-CA 3.47Å; C119-N143 WeakPolarHBondContact CA-OD1 3.35Å; G120-N143 PolarHBondContact N-OD1 3.11Å
144	F	94.7	Very high	95.5	Very high	30 Å²	30	58.8 Å²	58.8	13%	0.132	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	135.1	-172.8	-62.2	-83.3	0	0	0	110.5	Y111 V113 I117 V118 L121 L141 G142 H151	Y111-F144 VanDerWaalsContact OH-CE1 3.27Å; Y111-F144 WeakPolarHBondContact OH-CE1 3.19Å; Y111-F144 WeakPolarHBondContact OH-CZ 3.45Å; V113-F144 HydrophobicContact CB-CB 4.18Å; V113-F144 HydrophobicContact CG1-CB 4.19Å; V113-F144 HydrophobicContact CG2-CB 3.6Å; V113-F144 HydrophobicContact CG2-CG 4.24Å; I117-F144 CarbonylContact C-O 3.47Å; I117-F144 WeakPolarHBondContact CA-O 3.49Å; V118-F144 PolarHBondContact N-O 3.06Å; V118-F144 PolarHBondContact O-N 3.43Å; L121-F144 HydrophobicContact CB-CD2 3.84Å; L121-F144 HydrophobicContact CB-CE2 3.84Å; L121-F144 HydrophobicContact CD2-CD2 3.96Å; L121-F144 HydrophobicContact CD2-CE2 3.96Å; L121-F144 HydrophobicContact CG-CE2 4.47Å; L141-F144 HydrophobicContact CB-CE2 3.85Å; L141-F144 HydrophobicContact CB-CZ 3.93Å; G142-F144 WeakPolarHBondContact O-CD2 3.46Å; G142-F144 WeakPolarHBondContact O-CE2 3.38Å; F144-H151 AromaticContact CD1-CE1 3.58Å; F144-H151 AromaticContact CD1-ND1 3.71Å; F144-H151 AromaticContact CD1-NE2 3.88Å; F144-H151 AromaticContact CE1-ND1 3.96Å
145	R	92.3	Very high	95.5	Very high	91 Å²	91	55.7 Å²	55.7	34%	0.343	30%	0.3	S	S	.	.			trans	-94	154.9	173.2	66.9	-178.1	179.8	-176.5	-0.3	110.2	L47 L48 A51 Q147	L47-R145 PolarHBondContact O-NH1 2.66Å; L48-R145 HydrophobicContact CD2-CB 4.48Å; A51-R145 HydrophobicContact CB-CB 4.21Å; R145-Q147 PolarHBondContact O-N 3.02Å
146	P	93.7	Very high	95.6	Very high	1 Å²	1	58.5 Å²	58.5	1%	0.006	32%	0.316	C	S	.	.			trans	-58.8	135.9	170.9	-23.3	32	0	0	0	112.5	L27 A51 F55 V113 R115 D116	L27-P146 HydrophobicContact CD2-CG 4.41Å; A51-P146 HydrophobicContact CB-CB 4.26Å; A51-P146 HydrophobicContact CB-CG 4.37Å; A51-P146 WeakPolarHBondContact CB-O 3.4Å; F55-P146 HydrophobicContact CE1-CB 3.78Å; F55-P146 WeakPolarHBondContact CE1-O 3.48Å; F55-P146 HydrophobicContact CZ-CB 3.43Å; F55-P146 VanDerWaalsContact CZ-CB 3.43Å; V113-P146 WeakPolarHBondContact O-CA 3.29Å; R115-P146 VanDerWaalsContact C-CG 3.48Å; D116-P146 VanDerWaalsContact CA-CG 3.46Å; D116-P146 VanDerWaalsContact N-CG 3.31Å; D116-P146 VanDerWaalsContact O-CG 3.3Å; D116-P146 WeakPolarHBondContact O-CG 3.43Å
147	Q	92.1	Very high	95.5	Very high	22 Å²	22	56.2 Å²	56.2	10%	0.103	31%	0.311	C	S	.	.			trans	-156.3	162.3	174.7	59.9	-177.6	31.8	0	0	111.9	F55 V113 R145 H149 H151	F55-Q147 VanDerWaalsContact CD2-C 3.43Å; F55-Q147 VanDerWaalsContact CE2-C 3.45Å; F55-Q147 WeakPolarHBondContact CE2-O 3.34Å; V113-Q147 PolarHBondContact O-N 3.48Å; R145-Q147 PolarHBondContact O-N 3.02Å; Q147-H149 VanDerWaalsContact CD-CE1 3.44Å; Q147-H149 PolarHBondContact NE2-CE1 2.85Å; Q147-H149 PolarHBondContact NE2-ND1 2.77Å; Q147-H149 VanDerWaalsContact NE2-ND1 3.17Å; Q147-H149 PolarHBondContact NE2-O 2.86Å; Q147-H149 PolarHBondContact O-N 2.76Å; Q147-H151 PolarHBondContact NE2-CE1 3.27Å; Q147-H151 PolarHBondContact NE2-NE2 3.32Å
148	G	90.5	Very high	95.5	Very high	40 Å²	40	56.2 Å²	56.2	41%	0.412	31%	0.31	S	S	.	.	S	Bend	trans	-79.7	-12.3	-174.7	0	0	0	0	0	115.9	F55	F55-G148 VanDerWaalsContact CD2-CA 3.45Å; F55-G148 VanDerWaalsContact CD2-N 3.3Å
149	H	93.6	Very high	95.4	Very high	115 Å²	115	58.5 Å²	58.5	53%	0.532	31%	0.313	S	S	.	.	S	Bend	trans	-114.8	155.1	-178.5	66.3	78.1	0	0	0	111.2	Q147	Q147-H149 VanDerWaalsContact CD-CE1 3.44Å; Q147-H149 PolarHBondContact NE2-CE1 2.85Å; Q147-H149 PolarHBondContact NE2-ND1 2.77Å; Q147-H149 VanDerWaalsContact NE2-ND1 3.17Å; Q147-H149 PolarHBondContact NE2-O 2.86Å; Q147-H149 PolarHBondContact O-N 2.76Å
150	P	97.1	Very high	95.3	Very high	44 Å²	44	56.1 Å²	56.1	29%	0.286	30%	0.298	S	S	.	.			trans	-68.8	156.7	-177.5	25.8	-31.2	0	0	0	112.2	V110 Y111 Y112	V110-P150 HydrophobicContact CG1-CB 3.62Å; V110-P150 HydrophobicContact CG1-CG 4.21Å; Y111-P150 CarbonylContact O-C 3.5Å; Y111-P150 WeakPolarHBondContact O-CA 3.48Å; Y112-P150 HydrophobicContact CD1-CB 4.19Å; Y112-P150 HydrophobicContact CD2-CB 4.2Å; Y112-P150 HydrophobicContact CE1-CB 3.79Å; Y112-P150 VanDerWaalsContact CE1-CD 3.48Å; Y112-P150 HydrophobicContact CE1-CG 4.06Å; Y112-P150 HydrophobicContact CE2-CB 3.78Å; Y112-P150 HydrophobicContact CE2-CG 4.47Å; Y112-P150 HydrophobicContact CG-CB 4.4Å
151	H	97.6	Very high	95.1	Very high	35 Å²	35	54.8 Å²	54.8	16%	0.162	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	147.8	156.9	-64	-84.3	0	0	0	109.5	V110 Y111 F144 Q147	V110-H151 WeakPolarHBondContact CA-O 3.33Å; Y111-H151 HydrophobicContact CD1-CB 4.35Å; Y111-H151 HydrophobicContact CD2-CB 4.1Å; Y111-H151 HydrophobicContact CE1-CB 3.88Å; Y111-H151 HydrophobicContact CE2-CB 3.61Å; Y111-H151 HydrophobicContact CG-CB 4.45Å; Y111-H151 VanDerWaalsContact CZ-CB 3.48Å; Y111-H151 PolarHBondContact N-O 2.78Å; Y111-H151 PolarHBondContact O-N 2.77Å; F144-H151 AromaticContact CD1-CE1 3.58Å; F144-H151 AromaticContact CD1-ND1 3.71Å; F144-H151 AromaticContact CD1-NE2 3.88Å; F144-H151 AromaticContact CE1-ND1 3.96Å; Q147-H151 PolarHBondContact NE2-CE1 3.27Å; Q147-H151 PolarHBondContact NE2-NE2 3.32Å
152	I	98	Very high	95	Very high	105 Å²	105	59.2 Å²	59.2	54%	0.538	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	116.6	173.8	-55.2	179.7	0	0	0	106.9	Q108 V109 V110	Q108-I152 VanDerWaalsContact CD-CG2 3.49Å; Q108-I152 HydrophobicContact CG-CG2 3.52Å; V109-I152 WeakPolarHBondContact O-CA 3.4Å; V110-I152 HydrophobicContact CG1-CG1 4.47Å; V110-I152 HydrophobicContact CG2-CG1 4.26Å
153	W	98.1	Very high	94.7	Very high	34 Å²	34	59.7 Å²	59.7	13%	0.129	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	136.1	169.5	170.5	69.6	0	0	0	109.2	I107 Q108 V109 Y111 Y123 V139 L141 F176	I107-W153 HydrophobicContact CG2-CH2 4.37Å; I107-W153 HydrophobicContact CG2-CZ3 3.79Å; Q108-W153 CarbonylContact C-O 3.58Å; Q108-W153 VanDerWaalsContact CA-O 3.23Å; Q108-W153 WeakPolarHBondContact CA-O 3.39Å; Q108-W153 WeakPolarHBondContact CG-O 3.27Å; V109-W153 HydrophobicContact CB-CE3 4.18Å; V109-W153 HydrophobicContact CG2-CE3 3.88Å; V109-W153 HydrophobicContact CG2-CZ3 4.07Å; V109-W153 PolarHBondContact N-O 3.41Å; V109-W153 PolarHBondContact O-N 2.57Å; Y111-W153 HydrophobicContact CE1-CB 3.94Å; Y123-W153 AromaticContact CD1-CH2 3.38Å; Y123-W153 HydrophobicContact CD1-CH2 3.38Å; Y123-W153 HydrophobicContact CD1-CZ2 4.29Å; Y123-W153 AromaticContact CD1-CZ3 3.93Å; Y123-W153 HydrophobicContact CD1-CZ3 3.93Å; Y123-W153 HydrophobicContact CD2-CH2 4.21Å; Y123-W153 AromaticContact CD2-CZ3 3.9Å; Y123-W153 HydrophobicContact CD2-CZ3 3.9Å; Y123-W153 AromaticContact CE1-CH2 3.88Å; Y123-W153 HydrophobicContact CE1-CH2 3.88Å; Y123-W153 HydrophobicContact CE1-CZ3 4.3Å; Y123-W153 HydrophobicContact CE2-CZ3 4.26Å; Y123-W153 AromaticContact CG-CH2 3.56Å; Y123-W153 HydrophobicContact CG-CH2 3.56Å; Y123-W153 HydrophobicContact CG-CZ2 4.45Å; Y123-W153 AromaticContact CG-CZ3 3.7Å; Y123-W153 HydrophobicContact CG-CZ3 3.7Å; V139-W153 HydrophobicContact CB-CZ2 4.44Å; V139-W153 HydrophobicContact CG1-CZ2 4.3Å; L141-W153 HydrophobicContact CD1-CD2 4.32Å; L141-W153 HydrophobicContact CD1-CZ2 4.47Å; L141-W153 HydrophobicContact CD2-CB 3.71Å; L141-W153 HydrophobicContact CD2-CD2 3.85Å; L141-W153 HydrophobicContact CD2-CE3 4.39Å; L141-W153 HydrophobicContact CD2-CG 3.51Å; L141-W153 HydrophobicContact CG-CB 4.47Å; L141-W153 HydrophobicContact CG-CD2 4.13Å; L141-W153 HydrophobicContact CG-CG 3.85Å; W153-F176 AromaticContact CE3-CZ 4Å; W153-F176 HydrophobicContact CE3-CZ 4Å; W153-F176 HydrophobicContact CZ3-CZ 4.19Å
154	T	97.9	Very high	94.5	Very high	55 Å²	55	59.7 Å²	59.7	34%	0.337	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	133.5	172.1	-53.6	0	0	0	0	108.1	R106 I107 Q108	R106-T154 HydrophobicContact CB-CG2 3.97Å; R106-T154 HydrophobicContact CG-CG2 4.4Å; I107-T154 CarbonylContact O-C 3.58Å; I107-T154 VanDerWaalsContact O-CA 3.27Å; I107-T154 WeakPolarHBondContact O-CA 3.14Å; Q108-T154 HydrophobicContact CB-CG2 4.49Å; Q108-T154 PolarHBondContact NE2-OG1 2.91Å
155	S	96.7	Very high	94.4	Very high	4 Å²	4	66 Å²	66	3%	0.028	36%	0.356	C	S	.	.	P	Polyproline II helix	trans	-66.9	163.9	176.7	72.8	0	0	0	0	111.8	R106 I107	R106-S155 PolarHBondContact NH1-O 3.35Å; I107-S155 PolarHBondContact N-OG 3.08Å; I107-S155 PolarHBondContact O-N 3Å
156	D	95.9	Very high	94.4	Very high	136 Å²	136	63.2 Å²	63.2	73%	0.727	35%	0.35	S	S	*	.	P	Polyproline II helix	trans	-57.6	153.6	159.3	-72.6	-34.1	0	0	0	110.5	E158	D156-E158 PolarHBondContact O-N 2.82Å
157	P	95.4	Very high	94.5	Very high	66 Å²	66	66.5 Å²	66.5	43%	0.429	36%	0.363	S	S	.	.	P	Polyproline II helix	trans	-67.7	129.1	178.7	28.2	-29.2	0	0	0	110	S104 R106	S104-P157 WeakPolarHBondContact OG-CB 3.48Å; R106-P157 HydrophobicContact CG-CB 4.32Å
158	E	94	Very high	94.6	Very high	38 Å²	38	66.6 Å²	66.6	18%	0.178	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	143.8	171.2	-69	176.7	-150.3	0	0	109.2	S104 Y105 D156	S104-E158 CarbonylContact C-O 3.6Å; S104-E158 VanDerWaalsContact CA-O 3.28Å; S104-E158 WeakPolarHBondContact CA-O 3.38Å; Y105-E158 HydrophobicContact CD1-CB 4.42Å; Y105-E158 HydrophobicContact CD2-CB 4.42Å; Y105-E158 HydrophobicContact CE1-CB 3.91Å; Y105-E158 HydrophobicContact CE2-CB 3.87Å; Y105-E158 HydrophobicContact CE2-CG 4.49Å; Y105-E158 WeakPolarHBondContact CE2-OE2 3.35Å; Y105-E158 VanDerWaalsContact CZ-OE2 3.24Å; Y105-E158 PolarHBondContact N-O 3.22Å; Y105-E158 PolarHBondContact O-N 2.88Å; Y105-E158 PolarHBondContact OH-OE2 2.86Å; D156-E158 PolarHBondContact O-N 2.82Å
159	E	95.1	Very high	94.8	Very high	120 Å²	120	67.6 Å²	67.6	56%	0.561	37%	0.37	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.2	124.5	172.8	-172.1	179.4	131.7	0	0	109.8	K162	E159-K162 WeakPolarHBondContact OE1-CE 3.38Å; E159-K162 IonicContact OE1-NZ 2.66Å; E159-K162 PolarHBondContact OE1-NZ 3.5Å
160	A	94.1	Very high	95	Very high	0 Å²	0	62.8 Å²	62.8	0%	0	35%	0.348	C	S	.	.	P	Polyproline II helix	trans	-60.2	132.9	175.9	0	0	0	0	0	111.2	I99 V100 G102 C103 Y105 K162 I193	I99-A160 HydrophobicContact CG2-CB 3.72Å; V100-A160 WeakPolarHBondContact O-CB 3.37Å; G102-A160 VanDerWaalsContact CA-O 3.28Å; G102-A160 WeakPolarHBondContact CA-O 3.47Å; G102-A160 PolarHBondContact N-O 3.5Å; C103-A160 PolarHBondContact O-N 3.37Å; Y105-A160 HydrophobicContact CD1-CB 4.43Å; Y105-A160 HydrophobicContact CE1-CB 4.23Å; A160-K162 PolarHBondContact O-N 3.17Å; A160-I193 HydrophobicContact CB-CD1 3.98Å
161	P	93.7	Very high	94.9	Very high	50 Å²	50	66.8 Å²	66.8	33%	0.325	36%	0.361	S	S	.	.	P	Polyproline II helix	trans	-66.5	139.4	-173.3	29.3	-37.1	0	0	0	111.4	I193	P161-I193 HydrophobicContact CG-CG1 4.29Å; P161-I193 WeakPolarHBondContact O-CG2 3.37Å
162	K	92.9	Very high	94.9	Very high	126 Å²	126	65.2 Å²	65.2	55%	0.548	35%	0.353	S	S	.	.	P	Polyproline II helix	trans	-91.7	152.7	-177.2	-67.3	168.1	178.7	150.5	0	112.2	E159 A160 S166	E159-K162 WeakPolarHBondContact OE1-CE 3.38Å; E159-K162 IonicContact OE1-NZ 2.66Å; E159-K162 PolarHBondContact OE1-NZ 3.5Å; A160-K162 PolarHBondContact O-N 3.17Å; K162-S166 WeakPolarHBondContact O-CB 3.34Å; K162-S166 PolarHBondContact O-OG 3.29Å
163	G	91.6	Very high	94.8	Very high	30 Å²	30	62.1 Å²	62.1	31%	0.309	34%	0.339	S	S	.	.	S	Bend	trans	102.8	158.3	166.6	0	0	0	0	0	114.4	E101 L165 S166 R167	E101-G163 PolarHBondContact OE2-N 2.83Å; G163-L165 VanDerWaalsContact C-N 3.27Å; G163-L165 PolarHBondContact O-N 3.07Å; G163-S166 WeakPolarHBondContact O-CB 3.27Å; G163-S166 PolarHBondContact O-N 2.85Å; G163-R167 WeakPolarHBondContact O-CG 3.34Å; G163-R167 PolarHBondContact O-N 2.74Å; G163-R167 VanDerWaalsContact O-N 3.1Å
164	V	90	Very high	94.8	Very high	112 Å²	112	60.5 Å²	60.5	68%	0.679	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-40.3	-171.4	-179.2	0	0	0	0	112.3	S166	V164-S166 VanDerWaalsContact C-N 3.3Å; V164-S166 PolarHBondContact O-N 3.04Å
165	L	91.9	Very high	94.8	Very high	163 Å²	163	58.6 Å²	58.6	85%	0.853	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.6	-22.3	179.4	-63.8	179.2	0	0	0	113.3	K129 G163	K129-L165 PolarHBondContact NZ-O 3.04Å; G163-L165 VanDerWaalsContact C-N 3.27Å; G163-L165 PolarHBondContact O-N 3.07Å
166	S	92.7	Very high	94.9	Very high	31 Å²	31	58.4 Å²	58.4	22%	0.217	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.6	-27.7	178.5	-56.5	0	0	0	0	111.9	K129 K162 G163 V164 Y170	K129-S166 PolarHBondContact NZ-O 3.13Å; K162-S166 WeakPolarHBondContact O-CB 3.34Å; K162-S166 PolarHBondContact O-OG 3.29Å; G163-S166 WeakPolarHBondContact O-CB 3.27Å; G163-S166 PolarHBondContact O-N 2.85Å; V164-S166 VanDerWaalsContact C-N 3.3Å; V164-S166 PolarHBondContact O-N 3.04Å; S166-Y170 WeakPolarHBondContact O-CE2 3.47Å; S166-Y170 PolarHBondContact O-OH 2.97Å
167	R	94.7	Very high	95	Very high	70 Å²	70	52.5 Å²	52.5	26%	0.264	29%	0.287	S	S	.	.			trans	-58.5	154.7	176.9	-67.2	172	-163.7	156.5	3.5	113.1	E101 K129 G163 I193	E101-R167 VanDerWaalsContact CD-NE 3.35Å; E101-R167 VanDerWaalsContact CD-NH2 3.32Å; E101-R167 IonicContact OE1-CZ 3.38Å; E101-R167 IonicContact OE1-NE 3.35Å; E101-R167 PolarHBondContact OE1-NE 3.29Å; E101-R167 IonicContact OE1-NH2 2.7Å; E101-R167 PolarHBondContact OE1-NH2 2.79Å; E101-R167 IonicContact OE2-CZ 3.36Å; E101-R167 IonicContact OE2-NE 2.78Å; E101-R167 PolarHBondContact OE2-NE 3.19Å; E101-R167 IonicContact OE2-NH2 3.1Å; E101-R167 PolarHBondContact OE2-NH2 3.46Å; E101-R167 VanDerWaalsContact OE2-NH2 3.1Å; K129-R167 PolarHBondContact NZ-O 2.93Å; G163-R167 WeakPolarHBondContact O-CG 3.34Å; G163-R167 PolarHBondContact O-N 2.74Å; G163-R167 VanDerWaalsContact O-N 3.1Å; R167-I193 WeakPolarHBondContact CA-O 3.38Å; R167-I193 WeakPolarHBondContact CB-O 3.42Å
168	G	94.9	Very high	95.1	Very high	24 Å²	24	49.5 Å²	49.5	25%	0.247	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	114.4	-168.8	177	0	0	0	0	0	114.1	Y170 N192 I193	G168-Y170 WeakPolarHBondContact O-CD2 3.39Å; G168-N192 WeakPolarHBondContact CA-OD1 3.49Å; G168-N192 WeakPolarHBondContact O-CA 3.36Å; G168-N192 PolarHBondContact O-OD1 3.47Å; G168-I193 PolarHBondContact N-O 2.99Å; G168-I193 PolarHBondContact O-N 2.92Å
169	S	95.7	Very high	95.2	Very high	61 Å²	61	48 Å²	48	43%	0.427	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	131.9	-173	-178.9	0	0	0	0	112.3	I191 N192	S169-I191 WeakPolarHBondContact CA-O 3.35Å; S169-N192 PolarHBondContact N-OD1 3.04Å
170	Y	96.1	Very high	95.1	Very high	15 Å²	15	45 Å²	45	6%	0.059	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	139.5	169	-65.8	-107.1	0	0	0	109.4	L127 R128 K129 V134 S166 G168 C190 I191 I193	L127-Y170 HydrophobicContact CD1-CD1 3.89Å; L127-Y170 HydrophobicContact CD1-CG 4.13Å; L127-Y170 HydrophobicContact CD2-CD1 4.07Å; L127-Y170 HydrophobicContact CD2-CE1 4.47Å; L127-Y170 HydrophobicContact CG-CD1 3.87Å; R128-Y170 CarbonylContact O-C 3.54Å; R128-Y170 VanDerWaalsContact O-CA 3.3Å; R128-Y170 WeakPolarHBondContact O-CA 3.5Å; K129-Y170 HydrophobicContact CB-CD1 3.98Å; K129-Y170 HydrophobicContact CB-CE1 3.88Å; K129-Y170 HydrophobicContact CD-CE1 3.97Å; K129-Y170 HydrophobicContact CD-CE2 4.38Å; K129-Y170 HydrophobicContact CG-CE1 4.28Å; V134-Y170 HydrophobicContact CG2-CD1 4.06Å; V134-Y170 HydrophobicContact CG2-CE1 4Å; S166-Y170 WeakPolarHBondContact O-CE2 3.47Å; S166-Y170 PolarHBondContact O-OH 2.97Å; G168-Y170 WeakPolarHBondContact O-CD2 3.39Å; Y170-C190 VanDerWaalsContact O-CA 3.25Å; Y170-C190 WeakPolarHBondContact O-CA 3.46Å; Y170-I191 HydrophobicContact CD2-CG1 4.36Å; Y170-I191 HydrophobicContact CG-CG1 4.38Å; Y170-I191 PolarHBondContact N-O 3.29Å; Y170-I191 PolarHBondContact O-N 3.33Å; Y170-I191 VanDerWaalsContact O-N 3.09Å; Y170-I193 HydrophobicContact CD2-CG1 3.8Å; Y170-I193 HydrophobicContact CE2-CB 4.24Å; Y170-I193 HydrophobicContact CE2-CG1 3.57Å
171	K	96.5	Very high	95	Very high	128 Å²	128	51.5 Å²	51.5	56%	0.557	28%	0.277	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.6	128.1	175.7	-62.8	-178.3	-178.7	176.2	0	108.4	R128	R128-K171 PolarHBondContact N-O 3.22Å; R128-K171 PolarHBondContact O-N 2.92Å
172	I	96.5	Very high	95.1	Very high	2 Å²	2	50.8 Å²	50.8	1%	0.01	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	136	-179.4	-56.8	89.4	0	0	0	108.9	Q125 W126 L127 K188 W189 I191	Q125-I172 HydrophobicContact CG-CG2 3.55Å; W126-I172 WeakPolarHBondContact O-CA 3.33Å; L127-I172 HydrophobicContact CD1-CD1 3.94Å; L127-I172 HydrophobicContact CD1-CG1 3.47Å; L127-I172 VanDerWaalsContact CD1-CG1 3.47Å; I172-K188 VanDerWaalsContact O-CA 3.28Å; I172-K188 WeakPolarHBondContact O-CA 2.94Å; I172-W189 HydrophobicContact CB-CD2 4.03Å; I172-W189 HydrophobicContact CB-CG 4.21Å; I172-W189 HydrophobicContact CB-CZ2 3.9Å; I172-W189 HydrophobicContact CD1-CD2 4.17Å; I172-W189 HydrophobicContact CD1-CE3 4.2Å; I172-W189 HydrophobicContact CD1-CH2 4.21Å; I172-W189 HydrophobicContact CD1-CZ2 4.2Å; I172-W189 HydrophobicContact CD1-CZ3 4.24Å; I172-W189 HydrophobicContact CG1-CD2 4.41Å; I172-W189 HydrophobicContact CG1-CH2 4.31Å; I172-W189 HydrophobicContact CG1-CZ2 3.88Å; I172-W189 HydrophobicContact CG2-CZ2 3.72Å; I172-W189 PolarHBondContact N-O 2.77Å; I172-W189 PolarHBondContact O-N 3.34Å; I172-I191 HydrophobicContact CD1-CB 4.32Å; I172-I191 HydrophobicContact CD1-CD1 4.36Å; I172-I191 HydrophobicContact CD1-CG1 3.94Å; I172-I191 HydrophobicContact CD1-CG2 3.96Å
173	V	97.1	Very high	95.3	Very high	39 Å²	39	50.9 Å²	50.9	24%	0.236	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	124.9	162.7	-174.4	0	0	0	0	107	Q125 W126 T186 K188	Q125-V173 CarbonylContact C-O 3.53Å; Q125-V173 VanDerWaalsContact CA-O 3.23Å; Q125-V173 WeakPolarHBondContact CA-O 3.32Å; W126-V173 HydrophobicContact CE3-CB 4.04Å; W126-V173 HydrophobicContact CE3-CG1 4.1Å; W126-V173 HydrophobicContact CZ3-CG1 4.39Å; W126-V173 PolarHBondContact N-O 2.85Å; W126-V173 PolarHBondContact O-N 2.98Å; V173-T186 HydrophobicContact CG1-CG2 3.71Å; V173-K188 HydrophobicContact CG1-CG 4.48Å; V173-K188 HydrophobicContact CG2-CD 4.36Å; V173-K188 HydrophobicContact CG2-CG 4.11Å
174	S	97.5	Very high	95.6	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	139.8	178.3	-66.6	0	0	0	0	109.3	Y123 K124 T186 W187 W189	Y123-S174 WeakPolarHBondContact OH-CB 3.33Å; Y123-S174 PolarHBondContact OH-OG 3.2Å; K124-S174 CarbonylContact O-C 3.5Å; K124-S174 WeakPolarHBondContact O-CA 3.44Å; S174-T186 CarbonylContact O-C 3.5Å; S174-T186 VanDerWaalsContact O-CA 3.26Å; S174-T186 WeakPolarHBondContact O-CA 3.48Å; S174-W187 VanDerWaalsContact CB-CE2 3.46Å; S174-W187 PolarHBondContact N-O 2.87Å; S174-W187 PolarHBondContact O-N 3.4Å; S174-W189 PolarHBondContact OG-NE1 2.77Å
175	Q	98.3	Very high	96	Very high	15 Å²	15	47.4 Å²	47.4	7%	0.07	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	143	-176.5	176	-179.4	72.2	0	0	111	Y123 K124 W126 E183 I185 T186	Y123-Q175 WeakPolarHBondContact CA-O 3.38Å; K124-Q175 HydrophobicContact CB-CB 4.44Å; K124-Q175 PolarHBondContact N-O 2.82Å; K124-Q175 PolarHBondContact O-N 3.13Å; W126-Q175 HydrophobicContact CH2-CB 4.34Å; W126-Q175 HydrophobicContact CZ3-CB 3.91Å; Q175-E183 PolarHBondContact NE2-OE1 3.03Å; Q175-E183 PolarHBondContact NE2-OE2 3.22Å; Q175-I185 WeakPolarHBondContact CA-O 3.3Å; Q175-T186 HydrophobicContact CB-CG2 4.42Å; Q175-T186 WeakPolarHBondContact CG-OG1 3.32Å; Q175-T186 PolarHBondContact NE2-OG1 3.48Å
176	F	98.5	Very high	96.2	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	130	162.5	-79.4	-83.9	0	0	0	111	F68 V109 L121 R122 Y123 L141 W153 Y184 I185 W187	F68-F176 AromaticContact CD1-CD2 3.76Å; F68-F176 HydrophobicContact CD1-CD2 3.76Å; F68-F176 AromaticContact CD1-CE2 3.9Å; F68-F176 HydrophobicContact CD1-CE2 3.9Å; F68-F176 HydrophobicContact CD1-CG 4.36Å; F68-F176 HydrophobicContact CE1-CB 3.96Å; F68-F176 AromaticContact CE1-CD1 3.79Å; F68-F176 HydrophobicContact CE1-CD1 3.79Å; F68-F176 AromaticContact CE1-CD2 3.13Å; F68-F176 HydrophobicContact CE1-CD2 3.13Å; F68-F176 HydrophobicContact CE1-CE1 4.02Å; F68-F176 AromaticContact CE1-CE2 3.39Å; F68-F176 HydrophobicContact CE1-CE2 3.39Å; F68-F176 AromaticContact CE1-CG 3.34Å; F68-F176 HydrophobicContact CE1-CG 3.34Å; F68-F176 AromaticContact CE1-CZ 3.84Å; F68-F176 HydrophobicContact CE1-CZ 3.84Å; F68-F176 HydrophobicContact CE2-CB 3.85Å; F68-F176 HydrophobicContact CE2-CD2 4.34Å; F68-F176 HydrophobicContact CE2-CG 4.18Å; F68-F176 HydrophobicContact CZ-CB 3.31Å; F68-F176 AromaticContact CZ-CD1 3.75Å; F68-F176 HydrophobicContact CZ-CD1 3.75Å; F68-F176 AromaticContact CZ-CD2 3.49Å; F68-F176 HydrophobicContact CZ-CD2 3.49Å; F68-F176 VanDerWaalsContact CZ-CD2 3.49Å; F68-F176 HydrophobicContact CZ-CE1 4.42Å; F68-F176 HydrophobicContact CZ-CE2 4.18Å; F68-F176 AromaticContact CZ-CG 3.22Å; F68-F176 HydrophobicContact CZ-CG 3.22Å; V109-F176 HydrophobicContact CB-CE2 4.21Å; V109-F176 HydrophobicContact CB-CZ 4.09Å; V109-F176 HydrophobicContact CG1-CE2 3.76Å; V109-F176 HydrophobicContact CG1-CZ 4Å; V109-F176 HydrophobicContact CG2-CE2 3.87Å; V109-F176 HydrophobicContact CG2-CZ 3.91Å; L121-F176 HydrophobicContact CD1-CB 4.39Å; L121-F176 HydrophobicContact CD1-CD1 4.12Å; L121-F176 HydrophobicContact CG-CD1 4.2Å; R122-F176 WeakPolarHBondContact O-CA 3.17Å; Y123-F176 HydrophobicContact CD2-CD2 4.19Å; Y123-F176 HydrophobicContact CD2-CE1 4Å; Y123-F176 AromaticContact CD2-CE2 3.66Å; Y123-F176 HydrophobicContact CD2-CE2 3.66Å; Y123-F176 AromaticContact CD2-CZ 3.56Å; Y123-F176 HydrophobicContact CD2-CZ 3.56Å; Y123-F176 HydrophobicContact CE2-CE2 4.22Å; Y123-F176 HydrophobicContact CE2-CZ 4.41Å; Y123-F176 HydrophobicContact CG-CE1 4.36Å; Y123-F176 HydrophobicContact CG-CZ 4.23Å; L141-F176 HydrophobicContact CD1-CE1 4.29Å; L141-F176 HydrophobicContact CD2-CE1 3.64Å; L141-F176 HydrophobicContact CD2-CZ 4.4Å; W153-F176 AromaticContact CE3-CZ 4Å; W153-F176 HydrophobicContact CE3-CZ 4Å; W153-F176 HydrophobicContact CZ3-CZ 4.19Å; F176-Y184 PolarHBondContact O-N 2.94Å; F176-I185 HydrophobicContact CB-CG2 4.22Å; F176-I185 HydrophobicContact CD2-CG2 4.11Å; F176-I185 PolarHBondContact N-O 2.9Å; F176-W187 AromaticContact CD2-CH2 3.96Å; F176-W187 HydrophobicContact CD2-CH2 3.96Å; F176-W187 AromaticContact CD2-CZ3 3.87Å; F176-W187 HydrophobicContact CD2-CZ3 3.87Å; F176-W187 AromaticContact CE2-CH2 3.75Å; F176-W187 HydrophobicContact CE2-CH2 3.75Å; F176-W187 HydrophobicContact CE2-CZ3 4.15Å
177	I	98.3	Very high	96.4	Very high	13 Å²	13	41 Å²	41	7%	0.067	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	152.2	179.5	-169.5	173.2	0	0	0	109	R122 K124 A182 E183	R122-I177 WeakPolarHBondContact CA-O 3.38Å; R122-I177 HydrophobicContact CB-CG2 4.29Å; R122-I177 WeakPolarHBondContact CB-O 3.24Å; R122-I177 PolarHBondContact N-O 2.93Å; R122-I177 PolarHBondContact O-N 3.49Å; K124-I177 HydrophobicContact CD-CG2 4.16Å; K124-I177 HydrophobicContact CG-CG2 4.47Å; I177-A182 WeakPolarHBondContact CA-O 3.28Å; I177-E183 HydrophobicContact CD1-CG 3.95Å; I177-E183 HydrophobicContact CG1-CG 4.15Å
178	D	97.4	Very high	96.5	Very high	2 Å²	2	44 Å²	44	1%	0.011	23%	0.226	C	C	.	.			trans	-108.6	-174.4	172.6	67	15.5	0	0	0	112.9	V118 C119 G120 D180 K181 A182 Y184	V118-D178 HydrophobicContact CG1-CB 4Å; C119-D178 WeakPolarHBondContact O-CB 3.44Å; G120-D178 WeakPolarHBondContact O-CA 3.31Å; D178-D180 VanDerWaalsContact C-N 3.31Å; D178-D180 WeakPolarHBondContact OD1-CA 3.47Å; D178-D180 WeakPolarHBondContact OD1-CB 3.44Å; D178-D180 PolarHBondContact OD1-N 2.94Å; D178-K181 PolarHBondContact O-N 2.96Å; D178-K181 PolarHBondContact OD1-N 3.4Å; D178-K181 VanDerWaalsContact OD1-N 3.14Å; D178-A182 PolarHBondContact N-O 2.67Å; D178-A182 WeakPolarHBondContact OD1-CB 3.39Å; D178-A182 PolarHBondContact OD1-N 2.8Å; D178-Y184 HydrophobicContact CB-CE2 3.85Å; D178-Y184 WeakPolarHBondContact OD2-CE2 3.41Å; D178-Y184 VanDerWaalsContact OD2-CZ 3.31Å; D178-Y184 PolarHBondContact OD2-OH 3.48Å
179	D	95.7	Very high	96.5	Very high	7 Å²	7	43 Å²	43	4%	0.037	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-23.9	179.9	-82.6	-15.8	0	0	0	114	Y19 P21 C119 G120 R122 K181	Y19-D179 WeakPolarHBondContact CE1-OD2 3.33Å; Y19-D179 PolarHBondContact OH-OD2 3.35Å; P21-D179 HydrophobicContact CB-CB 3.76Å; P21-D179 HydrophobicContact CG-CB 3.89Å; C119-D179 WeakPolarHBondContact O-CB 3.27Å; C119-D179 PolarHBondContact O-N 3.49Å; C119-D179 VanDerWaalsContact O-N 3.1Å; G120-D179 WeakPolarHBondContact CA-OD2 3.32Å; R122-D179 IonicContact CZ-OD1 2.72Å; R122-D179 IonicContact NH1-OD1 3.95Å; R122-D179 PolarHBondContact NH1-OD1 3.2Å; R122-D179 IonicContact NH2-OD1 3.58Å; R122-D179 PolarHBondContact NH2-OD1 3.13Å; D179-K181 PolarHBondContact O-N 2.86Å
180	D	93	Very high	96.5	Very high	56 Å²	56	40.6 Å²	40.6	30%	0.299	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.2	2	171.2	-65.3	-29.2	0	0	0	112.6	K24 D178 A182	K24-D180 WeakPolarHBondContact CB-OD1 3.29Å; K24-D180 WeakPolarHBondContact CD-OD2 3.23Å; K24-D180 WeakPolarHBondContact CE-OD2 3.34Å; K24-D180 VanDerWaalsContact CG-OD2 3.3Å; K24-D180 WeakPolarHBondContact CG-OD2 3.43Å; K24-D180 IonicContact NZ-OD2 3.05Å; K24-D180 PolarHBondContact NZ-OD2 3.4Å; D178-D180 VanDerWaalsContact C-N 3.31Å; D178-D180 WeakPolarHBondContact OD1-CA 3.47Å; D178-D180 WeakPolarHBondContact OD1-CB 3.44Å; D178-D180 PolarHBondContact OD1-N 2.94Å; D180-A182 PolarHBondContact O-N 2.72Å
181	K	92.9	Very high	96.5	Very high	137 Å²	137	40 Å²	40	60%	0.596	20%	0.196	S	C	*	.			trans	64.2	20.5	-175.3	-44.4	-56.6	176.6	-167.6	0	113.3	D178 D179 E183	D178-K181 PolarHBondContact O-N 2.96Å; D178-K181 PolarHBondContact OD1-N 3.4Å; D178-K181 VanDerWaalsContact OD1-N 3.14Å; D179-K181 PolarHBondContact O-N 2.86Å; K181-E183 PolarHBondContact O-N 3.45Å
182	A	95.4	Very high	96.4	Very high	36 Å²	36	36.3 Å²	36.3	30%	0.298	18%	0.182	S	C	.	.			trans	-71.8	113.6	170.8	0	0	0	0	0	109	I177 D178 D180 Y184	I177-A182 WeakPolarHBondContact CA-O 3.28Å; D178-A182 PolarHBondContact N-O 2.67Å; D178-A182 WeakPolarHBondContact OD1-CB 3.39Å; D178-A182 PolarHBondContact OD1-N 2.8Å; D180-A182 PolarHBondContact O-N 2.72Å; A182-Y184 HydrophobicContact CB-CE2 4.13Å; A182-Y184 WeakPolarHBondContact O-CD2 3.35Å; A182-Y184 WeakPolarHBondContact O-CE2 3.15Å
183	E	97	Very high	96.4	Very high	127 Å²	127	36.3 Å²	36.3	59%	0.593	18%	0.182	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-82.6	116.5	171.1	-64.8	-171.7	179.3	0	0	109.3	Q175 I177 K181	Q175-E183 PolarHBondContact NE2-OE1 3.03Å; Q175-E183 PolarHBondContact NE2-OE2 3.22Å; I177-E183 HydrophobicContact CD1-CG 3.95Å; I177-E183 HydrophobicContact CG1-CG 4.15Å; K181-E183 PolarHBondContact O-N 3.45Å
184	Y	97.5	Very high	96.3	Very high	44 Å²	44	36.7 Å²	36.7	17%	0.173	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	-42.2	-176.2	-68.1	-81.7	0	0	0	112.6	A64 N65 V66 F68 V118 L121 F176 D178 A182	A64-Y184 HydrophobicContact CB-CD1 4.3Å; N65-Y184 HydrophobicContact CB-CE1 4.26Å; V66-Y184 HydrophobicContact CB-CD1 3.54Å; V66-Y184 HydrophobicContact CB-CD2 4.4Å; V66-Y184 HydrophobicContact CB-CE1 3.74Å; V66-Y184 HydrophobicContact CB-CG 3.89Å; V66-Y184 HydrophobicContact CG2-CD1 3.88Å; V66-Y184 HydrophobicContact CG2-CD2 4.27Å; V66-Y184 HydrophobicContact CG2-CE1 3.57Å; V66-Y184 HydrophobicContact CG2-CE2 4.01Å; V66-Y184 HydrophobicContact CG2-CG 4.21Å; F68-Y184 HydrophobicContact CE2-CG 4.23Å; V118-Y184 HydrophobicContact CG1-CE2 4.35Å; L121-Y184 HydrophobicContact CD1-CD2 4.14Å; L121-Y184 HydrophobicContact CD1-CE2 4.22Å; F176-Y184 PolarHBondContact O-N 2.94Å; D178-Y184 HydrophobicContact CB-CE2 3.85Å; D178-Y184 WeakPolarHBondContact OD2-CE2 3.41Å; D178-Y184 VanDerWaalsContact OD2-CZ 3.31Å; D178-Y184 PolarHBondContact OD2-OH 3.48Å; A182-Y184 HydrophobicContact CB-CE2 4.13Å; A182-Y184 WeakPolarHBondContact O-CD2 3.35Å; A182-Y184 WeakPolarHBondContact O-CE2 3.15Å
185	I	97.6	Very high	96.2	Very high	26 Å²	26	42.8 Å²	42.8	13%	0.133	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.8	145.7	179.8	-167.8	166.2	0	0	0	109.8	F68 L85 I89 Q175 F176 W187	F68-I185 HydrophobicContact CB-CD1 4.22Å; F68-I185 HydrophobicContact CB-CG2 4.29Å; F68-I185 HydrophobicContact CD1-CG2 4.26Å; F68-I185 HydrophobicContact CD2-CB 4.1Å; F68-I185 HydrophobicContact CD2-CG2 3.4Å; F68-I185 VanDerWaalsContact CD2-CG2 3.4Å; F68-I185 HydrophobicContact CE2-CG2 3.78Å; F68-I185 HydrophobicContact CG-CG2 3.69Å; F68-I185 HydrophobicContact CZ-CG2 4.35Å; L85-I185 HydrophobicContact CB-CD1 4.03Å; L85-I185 HydrophobicContact CD1-CD1 4.46Å; L85-I185 HydrophobicContact CD2-CD1 3.9Å; L85-I185 HydrophobicContact CG-CD1 4.36Å; I89-I185 HydrophobicContact CD1-CD1 4.48Å; I89-I185 HydrophobicContact CD1-CG1 4.38Å; Q175-I185 WeakPolarHBondContact CA-O 3.3Å; F176-I185 HydrophobicContact CB-CG2 4.22Å; F176-I185 HydrophobicContact CD2-CG2 4.11Å; F176-I185 PolarHBondContact N-O 2.9Å; I185-W187 HydrophobicContact CD1-CE3 4.44Å; I185-W187 HydrophobicContact CG1-CE3 4.11Å; I185-W187 HydrophobicContact CG2-CE3 4.03Å; I185-W187 HydrophobicContact CG2-CZ3 3.73Å
186	T	97.2	Very high	95.6	Very high	56 Å²	56	48.5 Å²	48.5	34%	0.344	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	128.1	168.6	-63.4	0	0	0	0	108.4	V173 S174 Q175	V173-T186 HydrophobicContact CG1-CG2 3.71Å; S174-T186 CarbonylContact O-C 3.5Å; S174-T186 VanDerWaalsContact O-CA 3.26Å; S174-T186 WeakPolarHBondContact O-CA 3.48Å; Q175-T186 HydrophobicContact CB-CG2 4.42Å; Q175-T186 WeakPolarHBondContact CG-OG1 3.32Å; Q175-T186 PolarHBondContact NE2-OG1 3.48Å
187	W	96.3	Very high	94.7	Very high	4 Å²	4	53 Å²	53	2%	0.015	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	160.1	177.8	71.9	97.6	0	0	0	111.4	F71 L85 I89 F92 Y123 S174 F176 I185 W189	F71-W187 HydrophobicContact CB-CZ2 4.19Å; F71-W187 HydrophobicContact CD1-CZ2 4.36Å; F71-W187 AromaticContact CD1-NE1 3.83Å; F71-W187 AromaticContact CD2-CZ2 3.74Å; F71-W187 HydrophobicContact CD2-CZ2 3.74Å; F71-W187 AromaticContact CE1-NE1 3.81Å; F71-W187 HydrophobicContact CE2-CZ2 4Å; F71-W187 AromaticContact CG-CZ2 3.87Å; F71-W187 HydrophobicContact CG-CZ2 3.87Å; F71-W187 HydrophobicContact CZ-CZ2 4.42Å; L85-W187 HydrophobicContact CD2-CD2 3.99Å; L85-W187 HydrophobicContact CD2-CE3 4.26Å; L85-W187 HydrophobicContact CD2-CG 4.19Å; I89-W187 HydrophobicContact CB-CB 4.48Å; I89-W187 HydrophobicContact CD1-CB 4.04Å; F92-W187 AromaticContact CD2-CD1 3.78Å; F92-W187 HydrophobicContact CD2-CG 4.38Å; Y123-W187 HydrophobicContact CE2-CH2 4.1Å; Y123-W187 HydrophobicContact CE2-CZ2 4.5Å; S174-W187 VanDerWaalsContact CB-CE2 3.46Å; S174-W187 PolarHBondContact N-O 2.87Å; S174-W187 PolarHBondContact O-N 3.4Å; F176-W187 AromaticContact CD2-CH2 3.96Å; F176-W187 HydrophobicContact CD2-CH2 3.96Å; F176-W187 AromaticContact CD2-CZ3 3.87Å; F176-W187 HydrophobicContact CD2-CZ3 3.87Å; F176-W187 AromaticContact CE2-CH2 3.75Å; F176-W187 HydrophobicContact CE2-CH2 3.75Å; F176-W187 HydrophobicContact CE2-CZ3 4.15Å; I185-W187 HydrophobicContact CD1-CE3 4.44Å; I185-W187 HydrophobicContact CG1-CE3 4.11Å; I185-W187 HydrophobicContact CG2-CE3 4.03Å; I185-W187 HydrophobicContact CG2-CZ3 3.73Å; W187-W189 AromaticContact CD1-CD1 3.61Å; W187-W189 AromaticContact NE1-CD1 3.41Å; W187-W189 AromaticContact NE1-NE1 3.89Å
188	K	96.2	Very high	93.4	Very high	133 Å²	133	57.3 Å²	57.3	58%	0.578	29%	0.294	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.6	130.5	179.9	-55.7	-174.2	-179.5	171.2	0	109.4	F92 K93 I172 V173	F92-K188 WeakPolarHBondContact CB-O 3.13Å; K93-K188 PolarHBondContact N-O 2.81Å; I172-K188 VanDerWaalsContact O-CA 3.28Å; I172-K188 WeakPolarHBondContact O-CA 2.94Å; V173-K188 HydrophobicContact CG1-CG 4.48Å; V173-K188 HydrophobicContact CG2-CD 4.36Å; V173-K188 HydrophobicContact CG2-CG 4.11Å
189	W	96.3	Very high	91.8	Very high	2 Å²	2	64.6 Å²	64.6	1%	0.008	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	174.4	179.8	62.1	-73.2	0	0	0	109.6	F71 I73 F92 I107 I172 S174 W187 I191	F71-W189 AromaticContact CE1-CD2 3.97Å; F71-W189 HydrophobicContact CE1-CD2 3.97Å; F71-W189 HydrophobicContact CE1-CE3 4.24Å; F71-W189 HydrophobicContact CE1-CG 4.25Å; F71-W189 HydrophobicContact CE2-CZ2 4.47Å; F71-W189 AromaticContact CZ-CD2 3.82Å; F71-W189 HydrophobicContact CZ-CD2 3.82Å; F71-W189 AromaticContact CZ-CE2 3.53Å; F71-W189 HydrophobicContact CZ-CE3 4.15Å; F71-W189 HydrophobicContact CZ-CG 4.38Å; F71-W189 HydrophobicContact CZ-CH2 4.06Å; F71-W189 AromaticContact CZ-CZ2 3.7Å; F71-W189 HydrophobicContact CZ-CZ2 3.7Å; F71-W189 HydrophobicContact CZ-CZ3 4.24Å; F71-W189 AromaticContact CZ-NE1 3.86Å; I73-W189 HydrophobicContact CD1-CE3 4.19Å; I73-W189 HydrophobicContact CD1-CH2 3.43Å; I73-W189 VanDerWaalsContact CD1-CH2 3.43Å; I73-W189 HydrophobicContact CD1-CZ2 4.17Å; I73-W189 HydrophobicContact CD1-CZ3 3.4Å; I73-W189 VanDerWaalsContact CD1-CZ3 3.4Å; I73-W189 HydrophobicContact CG1-CE3 4.29Å; I73-W189 HydrophobicContact CG1-CH2 4.24Å; I73-W189 HydrophobicContact CG1-CZ3 3.7Å; F92-W189 HydrophobicContact CB-CB 4.32Å; I107-W189 HydrophobicContact CD1-CH2 4.24Å; I107-W189 HydrophobicContact CD1-CZ2 3.87Å; I107-W189 HydrophobicContact CG1-CH2 4.47Å; I107-W189 HydrophobicContact CG1-CZ2 4.46Å; I172-W189 HydrophobicContact CB-CD2 4.03Å; I172-W189 HydrophobicContact CB-CG 4.21Å; I172-W189 HydrophobicContact CB-CZ2 3.9Å; I172-W189 HydrophobicContact CD1-CD2 4.17Å; I172-W189 HydrophobicContact CD1-CE3 4.2Å; I172-W189 HydrophobicContact CD1-CH2 4.21Å; I172-W189 HydrophobicContact CD1-CZ2 4.2Å; I172-W189 HydrophobicContact CD1-CZ3 4.24Å; I172-W189 HydrophobicContact CG1-CD2 4.41Å; I172-W189 HydrophobicContact CG1-CH2 4.31Å; I172-W189 HydrophobicContact CG1-CZ2 3.88Å; I172-W189 HydrophobicContact CG2-CZ2 3.72Å; I172-W189 PolarHBondContact N-O 2.77Å; I172-W189 PolarHBondContact O-N 3.34Å; S174-W189 PolarHBondContact OG-NE1 2.77Å; W187-W189 AromaticContact CD1-CD1 3.61Å; W187-W189 AromaticContact NE1-CD1 3.41Å; W187-W189 AromaticContact NE1-NE1 3.89Å; W189-I191 HydrophobicContact CE3-CG2 3.93Å; W189-I191 HydrophobicContact CH2-CG2 3.8Å; W189-I191 HydrophobicContact CZ3-CG2 3.18Å
190	C	95.4	Very high	89.2	Confident	10 Å²	10	72.8 Å²	72.8	7%	0.068	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	140.1	-173.5	-66.5	0	0	0	0	110.4	P96 V97 Y170	P96-C190 CarbonylContact C-O 3.55Å; P96-C190 WeakPolarHBondContact CA-O 3.34Å; P96-C190 HydrophobicContact CB-CB 4.18Å; V97-C190 PolarHBondContact N-O 2.69Å; Y170-C190 VanDerWaalsContact O-CA 3.25Å; Y170-C190 WeakPolarHBondContact O-CA 3.46Å
191	I	95.3	Very high	89	Confident	3 Å²	3	73.7 Å²	73.7	2%	0.015	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	153.2	163.1	67.5	-173.1	0	0	0	109.1	V97 I99 S169 Y170 I172 W189 I193	V97-I191 HydrophobicContact CB-CG2 4.28Å; V97-I191 CarbonylContact O-C 3.56Å; V97-I191 VanDerWaalsContact O-CA 3.23Å; V97-I191 WeakPolarHBondContact O-CA 3.49Å; I99-I191 HydrophobicContact CD1-CB 4.09Å; I99-I191 HydrophobicContact CD1-CD1 4.39Å; I99-I191 HydrophobicContact CD1-CG2 3.81Å; I99-I191 HydrophobicContact CG1-CB 4.46Å; S169-I191 WeakPolarHBondContact CA-O 3.35Å; Y170-I191 HydrophobicContact CD2-CG1 4.36Å; Y170-I191 HydrophobicContact CG-CG1 4.38Å; Y170-I191 PolarHBondContact N-O 3.29Å; Y170-I191 PolarHBondContact O-N 3.33Å; Y170-I191 VanDerWaalsContact O-N 3.09Å; I172-I191 HydrophobicContact CD1-CB 4.32Å; I172-I191 HydrophobicContact CD1-CD1 4.36Å; I172-I191 HydrophobicContact CD1-CG1 3.94Å; I172-I191 HydrophobicContact CD1-CG2 3.96Å; W189-I191 HydrophobicContact CE3-CG2 3.93Å; W189-I191 HydrophobicContact CH2-CG2 3.8Å; W189-I191 HydrophobicContact CZ3-CG2 3.18Å; I191-I193 HydrophobicContact CD1-CD1 3.82Å; I191-I193 HydrophobicContact CG1-CD1 4.12Å
192	N	95.8	Very high	88.8	Confident	50 Å²	50	70.3 Å²	70.3	27%	0.267	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	111.8	171.8	-173.9	47.6	0	0	0	108.7	V97 S98 I99 G168 S169 V194	V97-N192 PolarHBondContact O-N 2.94Å; S98-N192 WeakPolarHBondContact CA-O 3.44Å; I99-N192 PolarHBondContact N-O 3.47Å; G168-N192 WeakPolarHBondContact CA-OD1 3.49Å; G168-N192 WeakPolarHBondContact O-CA 3.36Å; G168-N192 PolarHBondContact O-OD1 3.47Å; S169-N192 PolarHBondContact N-OD1 3.04Å; N192-V194 WeakPolarHBondContact ND2-CG1 3.17Å; N192-V194 PolarHBondContact O-N 2.96Å
193	I	96.1	Very high	88.4	Confident	2 Å²	2	72.2 Å²	72.2	1%	0.01	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	116.2	179.6	-54.6	-51.7	0	0	0	108.9	I99 E101 A160 P161 R167 G168 Y170 I191	I99-I193 HydrophobicContact CB-CD1 3.95Å; I99-I193 CarbonylContact O-C 3.5Å; I99-I193 WeakPolarHBondContact O-CA 3.35Å; E101-I193 HydrophobicContact CB-CG2 3.87Å; A160-I193 HydrophobicContact CB-CD1 3.98Å; P161-I193 HydrophobicContact CG-CG1 4.29Å; P161-I193 WeakPolarHBondContact O-CG2 3.37Å; R167-I193 WeakPolarHBondContact CA-O 3.38Å; R167-I193 WeakPolarHBondContact CB-O 3.42Å; G168-I193 PolarHBondContact N-O 2.99Å; G168-I193 PolarHBondContact O-N 2.92Å; Y170-I193 HydrophobicContact CD2-CG1 3.8Å; Y170-I193 HydrophobicContact CE2-CB 4.24Å; Y170-I193 HydrophobicContact CE2-CG1 3.57Å; I191-I193 HydrophobicContact CD1-CD1 3.82Å; I191-I193 HydrophobicContact CG1-CD1 4.12Å
194	V	94.7	Very high	87.9	Confident	47 Å²	47	69 Å²	69	29%	0.285	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	155.6	-174.8	-61.3	0	0	0	0	112.1	I99 V100 E101 N192	I99-V194 PolarHBondContact O-N 3.35Å; V100-V194 HydrophobicContact CG2-CG2 4.1Å; E101-V194 WeakPolarHBondContact CB-O 3.38Å; E101-V194 PolarHBondContact N-O 2.96Å; N192-V194 WeakPolarHBondContact ND2-CG1 3.17Å; N192-V194 PolarHBondContact O-N 2.96Å
195	K	94.6	Very high	87.3	Confident	128 Å²	128	70.6 Å²	70.6	56%	0.557	39%	0.39	S	S	*	.	P	Polyproline II helix	trans	-62.3	138.5	178.8	179.8	177.5	178.7	-170.2	0	110.4	S197	K195-S197 PolarHBondContact O-N 2.64Å
196	K	86.7	Confident	86.6	Confident	136 Å²	136	73.5 Å²	73.5	59%	0.591	41%	0.408	S	S	*	.	P	Polyproline II helix	trans	-66.2	122.8	168.2	-170.6	170.6	-176	174.8	0	109.5	V100 E101 T198	V100-K196 HydrophobicContact CG1-CB 3.7Å; V100-K196 HydrophobicContact CG1-CG 3.9Å; E101-K196 HydrophobicContact CG-CB 4.24Å; E101-K196 PolarHBondContact OE1-N 3.16Å; K196-T198 PolarHBondContact O-N 2.61Å
197	S	79.3	Confident	85.9	Confident	93 Å²	93	74.8 Å²	74.8	65%	0.65	41%	0.412	S	S	*	.	P	Polyproline II helix	trans	-59.7	127.2	171.3	49	0	0	0	0	108.4	K195 D199	K195-S197 PolarHBondContact O-N 2.64Å; S197-D199 PolarHBondContact O-N 3.25Å
198	T	72	Confident	85.1	Confident	104 Å²	104	80.2 Å²	80.2	64%	0.638	44%	0.443	S	S	*	.			trans	-82.6	102.1	170.4	-45.2	0	0	0	0	105.6	K196 S200	K196-T198 PolarHBondContact O-N 2.61Å; T198-S200 PolarHBondContact O-N 2.88Å
199	D	63.2	Low	84.2	Confident	155 Å²	155	75.8 Å²	75.8	83%	0.829	43%	0.431	S	S	*	.			trans	-61.9	108.8	159.5	-70	-19.2	0	0	0	105.3	S197	S197-D199 PolarHBondContact O-N 3.25Å
200	S	40.6	Very low	83.1	Confident	180 Å²	180	82.5 Å²	82.5	100%	1.259	47%	0.47	S	S	*	.			trans	-88.8	0	174.9	-55.2	0	0	0	0	109.6	T198	T198-S200 PolarHBondContact O-N 2.88Å

Retrieved 200 of 200 residues in 75.6 ms (Link to these results)

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