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Proteasome subunit beta

Component of the proteasome, a multicatalytic proteinase complex which is characterized by its ability to cleave peptides with Arg, Phe, Tyr, Leu, and Glu adjacent to the leaving group at neutral or slightly basic pH. The proteasome has an ATP-dependent proteolytic activity. The proteasome is a multicatalytic proteinase complex which is characterized by its ability to cleave peptides with Arg, Phe, Tyr, Leu, and Glu adjacent to the leaving group at neutral or slightly basic pH. The proteasome has an ATP-dependent proteolytic activity. This subunit is involved in antigen processing to generate class I binding peptides.

AlphaFold DB , UniProt , Accession A0A060VRG6, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene n/a, Length 278 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	39.4	Very low	44.1	Very low	247 Å²	247	159.6 Å²	159.6	100%	1.217	84%	0.842	S	S	*	*				0	96.9	0	-64.6	-171.8	-169.5	0	0	107.3
2	L	35.4	Very low	44.6	Very low	178 Å²	178	156.7 Å²	156.7	93%	0.932	85%	0.845	S	S	*	*			trans	-81.8	119.7	-179.1	-79.2	154.9	0	0	0	108.4	N4	L2-N4 PolarHBondContact O-N 3.34Å
3	N	45	Very low	45.5	Very low	161 Å²	161	147.8 Å²	147.8	86%	0.861	81%	0.806	S	S	*	*			trans	-58.4	100.4	173.5	-96.8	-11.5	0	0	0	109.6	S5	N3-S5 PolarHBondContact O-N 2.77Å
4	N	41	Very low	47.3	Very low	155 Å²	155	142.1 Å²	142.1	83%	0.829	80%	0.799	S	S	*	*			trans	-79.1	72	166.1	-120.8	1.6	0	0	0	108.1	L2 R6	L2-N4 PolarHBondContact O-N 3.34Å; N4-R6 PolarHBondContact O-N 3.12Å
5	S	45	Very low	49.3	Very low	102 Å²	102	134.2 Å²	134.2	71%	0.713	75%	0.752	S	S	*	*			trans	-67.5	89.4	163.4	55	0	0	0	0	107.2	N3	N3-S5 PolarHBondContact O-N 2.77Å
6	R	41.3	Very low	51.2	Low	222 Å²	222	130.9 Å²	130.9	84%	0.838	74%	0.741	S	S	*	*			trans	-52.6	124.8	163.4	-73.8	-177.5	-177.8	-178.3	1.3	106	N4 C8	N4-R6 PolarHBondContact O-N 3.12Å; R6-C8 PolarHBondContact O-N 3.33Å; R6-C8 VanDerWaalsContact O-N 3.1Å
7	P	43.3	Very low	53.1	Low	116 Å²	116	126.9 Å²	126.9	75%	0.753	71%	0.713	S	S	*	*			trans	-54.5	126.7	168.5	22.4	-29	0	0	0	105.8	Q9	P7-Q9 VanDerWaalsContact C-N 3.34Å; P7-Q9 PolarHBondContact O-N 3.39Å
8	C	43	Very low	54.7	Low	120 Å²	120	128.4 Å²	128.4	81%	0.811	71%	0.714	S	S	*	*			trans	-50	104.3	175.3	-173.7	0	0	0	0	106.4	R6	R6-C8 PolarHBondContact O-N 3.33Å; R6-C8 VanDerWaalsContact O-N 3.1Å
9	Q	49.3	Very low	56.3	Low	172 Å²	172	126.2 Å²	126.2	80%	0.804	70%	0.701	S	S	*	*	P	Polyproline II helix	trans	-57.1	127.7	172.3	-80	-172.3	-18.8	0	0	104.8	P7 Q11	P7-Q9 VanDerWaalsContact C-N 3.34Å; P7-Q9 PolarHBondContact O-N 3.39Å; Q9-Q11 PolarHBondContact O-N 2.74Å
10	P	50.9	Low	57.7	Low	103 Å²	103	121.7 Å²	121.7	67%	0.669	68%	0.676	S	S	*	*	P	Polyproline II helix	trans	-52.4	120.8	175.6	21.1	-29.3	0	0	0	105.9	S12	P10-S12 PolarHBondContact O-N 3.12Å
11	Q	51.6	Low	58.9	Low	180 Å²	180	126.1 Å²	126.1	84%	0.841	68%	0.683	S	S	*	*	P	Polyproline II helix	trans	-49	123.2	174.5	-81.3	178.1	-24.3	0	0	106.1	Q9 A13	Q9-Q11 PolarHBondContact O-N 2.74Å; Q11-A13 PolarHBondContact O-N 3.38Å
12	S	50.2	Low	61.2	Low	124 Å²	124	120.2 Å²	120.2	87%	0.867	65%	0.647	S	S	*	*			trans	-65.2	81.1	170.1	-178.5	0	0	0	0	106.6	P10	P10-S12 PolarHBondContact O-N 3.12Å
13	A	56.3	Low	63.7	Low	41 Å²	41	115.1 Å²	115.1	34%	0.339	62%	0.621	S	S	.	*			trans	-64.8	146.8	168.5	0	0	0	0	0	107.3	Q11 F15	Q11-A13 PolarHBondContact O-N 3.38Å; A13-F15 CarbonylContact O-C 3.12Å; A13-F15 PolarHBondContact O-N 2.95Å
14	G	70	Confident	65.6	Low	69 Å²	69	110.1 Å²	110.1	71%	0.711	60%	0.602	S	S	*	*	S	Bend	trans	-54.7	-27.9	-173	0	0	0	0	0	114.5
15	F	77.3	Confident	67.8	Low	23 Å²	23	106.9 Å²	106.9	10%	0.101	59%	0.587	C	S	.	*			trans	-93.5	113.1	171.4	-69.8	-75.8	0	0	0	111.4	A13 F17 V98 M102 M130 Y134 I138	A13-F15 CarbonylContact O-C 3.12Å; A13-F15 PolarHBondContact O-N 2.95Å; F15-F17 HydrophobicContact CB-CD2 4.31Å; F15-F17 HydrophobicContact CB-CE2 3.74Å; F15-F17 HydrophobicContact CD1-CE2 4.05Å; F15-F17 HydrophobicContact CD1-CZ 4.09Å; F15-F17 HydrophobicContact CG-CE2 4.26Å; F15-V98 HydrophobicContact CE2-CB 4.37Å; F15-V98 HydrophobicContact CE2-CG1 3.71Å; F15-V98 HydrophobicContact CZ-CB 3.93Å; F15-V98 HydrophobicContact CZ-CG1 3.7Å; F15-M102 HydrophobicContact CD2-CE 4.01Å; F15-M102 HydrophobicContact CD2-SD 4.11Å; F15-M102 HydrophobicContact CE2-CE 3.98Å; F15-M102 HydrophobicContact CE2-SD 3.95Å; F15-M130 HydrophobicContact CD2-CE 3.48Å; F15-M130 VanDerWaalsContact CD2-CE 3.48Å; F15-M130 HydrophobicContact CE2-CE 3.37Å; F15-M130 HydrophobicContact CZ-CE 4.5Å; F15-Y134 HydrophobicContact CB-CE1 3.81Å; F15-Y134 HydrophobicContact CB-CE2 4.05Å; F15-Y134 HydrophobicContact CD2-CE2 4.46Å; F15-Y134 WeakPolarHBondContact O-CE1 3.36Å; F15-Y134 PolarHBondContact O-OH 2.7Å; F15-I138 HydrophobicContact CB-CD1 4.29Å; F15-I138 HydrophobicContact CD1-CD1 3.77Å; F15-I138 HydrophobicContact CD1-CG1 3.88Å; F15-I138 HydrophobicContact CD2-CD1 3.66Å; F15-I138 HydrophobicContact CE1-CD1 3.91Å; F15-I138 HydrophobicContact CE1-CG1 3.99Å; F15-I138 HydrophobicContact CE1-CG2 4.41Å; F15-I138 HydrophobicContact CE2-CD1 3.81Å; F15-I138 HydrophobicContact CG-CD1 3.64Å; F15-I138 HydrophobicContact CG-CG1 4.22Å; F15-I138 HydrophobicContact CZ-CD1 3.92Å; F15-I138 HydrophobicContact CZ-CG1 4.42Å; F15-I138 HydrophobicContact CZ-CG2 4.39Å
16	S	80.4	Confident	69.8	Low	81 Å²	81	105.4 Å²	105.4	57%	0.566	57%	0.571	S	S	*	*			trans	-115.1	120.7	174.2	179.4	0	0	0	0	111.4
17	F	82.5	Confident	71.9	Confident	63 Å²	63	99.6 Å²	99.6	28%	0.276	55%	0.554	S	S	.	*			trans	-124.1	20.5	-178.6	-65.3	-76.7	0	0	0	112.7	F15 N19 T20 Y134 H137 I138	F15-F17 HydrophobicContact CB-CD2 4.31Å; F15-F17 HydrophobicContact CB-CE2 3.74Å; F15-F17 HydrophobicContact CD1-CE2 4.05Å; F15-F17 HydrophobicContact CD1-CZ 4.09Å; F15-F17 HydrophobicContact CG-CE2 4.26Å; F17-N19 PolarHBondContact O-N 3.18Å; F17-T20 WeakPolarHBondContact CA-OG1 3.49Å; F17-T20 WeakPolarHBondContact CB-OG1 3.37Å; F17-T20 VanDerWaalsContact O-CB 3.29Å; F17-T20 WeakPolarHBondContact O-CB 3.49Å; F17-T20 PolarHBondContact O-N 3.47Å; F17-T20 VanDerWaalsContact O-N 3.1Å; F17-T20 PolarHBondContact O-OG1 3.29Å; F17-Y134 AromaticContact CD2-CD1 3.26Å; F17-Y134 HydrophobicContact CD2-CD1 3.26Å; F17-Y134 AromaticContact CD2-CE1 3.71Å; F17-Y134 HydrophobicContact CD2-CE1 3.71Å; F17-Y134 HydrophobicContact CD2-CG 4.04Å; F17-Y134 AromaticContact CE2-CD1 3.53Å; F17-Y134 HydrophobicContact CE2-CD1 3.53Å; F17-Y134 HydrophobicContact CE2-CE1 4.02Å; F17-Y134 AromaticContact CE2-CG 3.88Å; F17-Y134 HydrophobicContact CE2-CG 3.88Å; F17-Y134 HydrophobicContact CG-CD1 4.44Å; F17-H137 HydrophobicContact CD1-CB 3.51Å; F17-H137 HydrophobicContact CD2-CB 4.28Å; F17-H137 HydrophobicContact CE1-CB 3.38Å; F17-H137 HydrophobicContact CE2-CB 4.1Å; F17-H137 HydrophobicContact CG-CB 3.97Å; F17-H137 HydrophobicContact CZ-CB 3.67Å; F17-I138 HydrophobicContact CE2-CD1 4.34Å; F17-I138 HydrophobicContact CE2-CG1 3.7Å; F17-I138 HydrophobicContact CZ-CG1 3.75Å
18	E	83.3	Confident	73.9	Confident	154 Å²	154	95.5 Å²	95.5	72%	0.72	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-35.2	-177.7	-63.8	-178.6	162.6	0	0	112.6	T20	E18-T20 VanDerWaalsContact C-N 3.27Å; E18-T20 PolarHBondContact O-N 2.63Å
19	N	85.1	Confident	76	Confident	87 Å²	87	93.8 Å²	93.8	47%	0.465	52%	0.515	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81	-1.2	-179.7	-80.5	-54.8	0	0	0	114	F17 R21 R22 N23	F17-N19 PolarHBondContact O-N 3.18Å; N19-R21 VanDerWaalsContact C-N 3.35Å; N19-R21 PolarHBondContact O-N 3.27Å; N19-R22 WeakPolarHBondContact O-CB 3.14Å; N19-R22 PolarHBondContact O-N 2.89Å; N19-R22 PolarHBondContact OD1-NE 3.19Å; N19-R22 VanDerWaalsContact OD1-NE 3.15Å; N19-N23 WeakPolarHBondContact O-CB 3.47Å; N19-N23 VanDerWaalsContact O-CG 3.27Å; N19-N23 PolarHBondContact O-N 3.12Å; N19-N23 PolarHBondContact O-OD1 3Å
20	T	83.9	Confident	77.7	Confident	35 Å²	35	88.8 Å²	88.8	22%	0.215	49%	0.494	C	S	.	.	H	α-helix	trans	-64.4	-38.8	-170.7	-52.1	0	0	0	0	112.6	F17 E18 R22 N23 A24 H137	F17-T20 WeakPolarHBondContact CA-OG1 3.49Å; F17-T20 WeakPolarHBondContact CB-OG1 3.37Å; F17-T20 VanDerWaalsContact O-CB 3.29Å; F17-T20 WeakPolarHBondContact O-CB 3.49Å; F17-T20 PolarHBondContact O-N 3.47Å; F17-T20 VanDerWaalsContact O-N 3.1Å; F17-T20 PolarHBondContact O-OG1 3.29Å; E18-T20 VanDerWaalsContact C-N 3.27Å; E18-T20 PolarHBondContact O-N 2.63Å; T20-R22 PolarHBondContact O-N 3.29Å; T20-N23 PolarHBondContact O-N 3.42Å; T20-A24 WeakPolarHBondContact O-CB 3.39Å; T20-A24 PolarHBondContact O-N 3.41Å; T20-H137 WeakPolarHBondContact CG2-CE1 3.32Å
21	R	83.6	Confident	79.3	Confident	215 Å²	215	87.4 Å²	87.4	81%	0.811	49%	0.486	S	S	*	.	H	α-helix	trans	-63.8	-41.9	176	-171.1	177.7	-178	-177.1	1.1	112.1	N19 A24 V25	N19-R21 VanDerWaalsContact C-N 3.35Å; N19-R21 PolarHBondContact O-N 3.27Å; R21-A24 PolarHBondContact O-N 2.97Å; R21-V25 WeakPolarHBondContact O-CG2 3.44Å; R21-V25 PolarHBondContact O-N 3.27Å
22	R	87.7	Confident	81	Confident	123 Å²	123	86.6 Å²	86.6	46%	0.464	48%	0.483	S	S	.	.	H	α-helix	trans	-62.9	-45.8	174.6	-179.9	-173	61.9	71	4.3	110.6	N19 T20 A24 V25 L26	N19-R22 WeakPolarHBondContact O-CB 3.14Å; N19-R22 PolarHBondContact O-N 2.89Å; N19-R22 PolarHBondContact OD1-NE 3.19Å; N19-R22 VanDerWaalsContact OD1-NE 3.15Å; T20-R22 PolarHBondContact O-N 3.29Å; R22-A24 VanDerWaalsContact C-N 3.34Å; R22-A24 PolarHBondContact O-N 3.41Å; R22-V25 PolarHBondContact O-N 2.94Å; R22-L26 HydrophobicContact CG-CD1 4.24Å; R22-L26 WeakPolarHBondContact O-CG 3.2Å; R22-L26 PolarHBondContact O-N 2.87Å
23	N	86.4	Confident	82.7	Confident	71 Å²	71	86.7 Å²	86.7	38%	0.38	47%	0.473	S	S	.	.	H	α-helix	trans	-62	-40.1	179.4	-69.9	-9.5	0	0	0	111.8	N19 T20 V25 L26 E27	N19-N23 WeakPolarHBondContact O-CB 3.47Å; N19-N23 VanDerWaalsContact O-CG 3.27Å; N19-N23 PolarHBondContact O-N 3.12Å; N19-N23 PolarHBondContact O-OD1 3Å; T20-N23 PolarHBondContact O-N 3.42Å; N23-V25 PolarHBondContact O-N 2.86Å; N23-L26 PolarHBondContact O-N 3.35Å; N23-E27 WeakPolarHBondContact O-CB 3.36Å; N23-E27 PolarHBondContact O-N 3.08Å
24	A	85.3	Confident	84.1	Confident	56 Å²	56	88 Å²	88	46%	0.463	49%	0.49	S	S	.	.	H	α-helix	trans	-62.5	-40.1	176.8	0	0	0	0	0	112.7	T20 R21 R22 E27 G28	T20-A24 WeakPolarHBondContact O-CB 3.39Å; T20-A24 PolarHBondContact O-N 3.41Å; R21-A24 PolarHBondContact O-N 2.97Å; R22-A24 VanDerWaalsContact C-N 3.34Å; R22-A24 PolarHBondContact O-N 3.41Å; A24-E27 PolarHBondContact O-N 2.78Å; A24-G28 PolarHBondContact O-N 2.9Å; A24-G28 VanDerWaalsContact O-N 3.12Å
25	V	88.1	Confident	84.8	Confident	87 Å²	87	92.3 Å²	92.3	53%	0.527	49%	0.486	S	S	.	.	H	α-helix	trans	-66.1	-42.7	174.6	174.8	0	0	0	0	111	R21 R22 N23 E27 G28 N29	R21-V25 WeakPolarHBondContact O-CG2 3.44Å; R21-V25 PolarHBondContact O-N 3.27Å; R22-V25 PolarHBondContact O-N 2.94Å; N23-V25 PolarHBondContact O-N 2.86Å; V25-E27 VanDerWaalsContact C-N 3.34Å; V25-G28 PolarHBondContact O-N 3.35Å; V25-N29 PolarHBondContact O-N 3.42Å; V25-N29 VanDerWaalsContact O-N 3.11Å; V25-N29 PolarHBondContact O-OD1 3.48Å
26	L	86.9	Confident	84.8	Confident	72 Å²	72	96.7 Å²	96.7	38%	0.377	52%	0.52	S	S	.	.	H	α-helix	trans	-64.5	-39.5	176.7	-70.9	174.2	0	0	0	112	R22 N23 N29 L30	R22-L26 HydrophobicContact CG-CD1 4.24Å; R22-L26 WeakPolarHBondContact O-CG 3.2Å; R22-L26 PolarHBondContact O-N 2.87Å; N23-L26 PolarHBondContact O-N 3.35Å; L26-N29 PolarHBondContact O-N 2.96Å; L26-L30 HydrophobicContact CB-CD1 4.47Å; L26-L30 WeakPolarHBondContact O-CB 3.27Å; L26-L30 WeakPolarHBondContact O-CG 3.4Å; L26-L30 PolarHBondContact O-N 3.31Å
27	E	85.7	Confident	84.7	Confident	100 Å²	100	94.5 Å²	94.5	47%	0.467	50%	0.504	S	S	.	.	H	α-helix	trans	-57.7	-46.9	173.8	-101	176.9	-176.6	0	0	111.9	N23 A24 V25 L30 S31 S37	N23-E27 WeakPolarHBondContact O-CB 3.36Å; N23-E27 PolarHBondContact O-N 3.08Å; A24-E27 PolarHBondContact O-N 2.78Å; V25-E27 VanDerWaalsContact C-N 3.34Å; E27-L30 PolarHBondContact O-N 3.39Å; E27-S31 WeakPolarHBondContact O-CB 3.41Å; E27-S31 PolarHBondContact O-N 3.01Å; E27-S31 PolarHBondContact O-OG 2.72Å; E27-S37 WeakPolarHBondContact CG-OG 3.48Å; E27-S37 WeakPolarHBondContact OE1-CB 3.4Å; E27-S37 PolarHBondContact OE1-OG 3.19Å
28	G	84.9	Confident	84.5	Confident	30 Å²	30	97.5 Å²	97.5	31%	0.309	53%	0.53	S	S	.	.	H	α-helix	trans	-55.7	-56.3	175.1	0	0	0	0	0	111.5	A24 V25 L30 S31 E32	A24-G28 PolarHBondContact O-N 2.9Å; A24-G28 VanDerWaalsContact O-N 3.12Å; V25-G28 PolarHBondContact O-N 3.35Å; G28-L30 PolarHBondContact O-N 3.41Å; G28-S31 PolarHBondContact O-N 3.23Å; G28-S31 PolarHBondContact O-OG 2.97Å; G28-E32 PolarHBondContact O-N 2.93Å
29	N	87.1	Confident	84.1	Confident	83 Å²	83	99.3 Å²	99.3	44%	0.444	54%	0.536	S	S	.	.	H	α-helix	trans	-62.9	-39.4	-177.5	-63	-7.7	0	0	0	113	V25 L26 L33	V25-N29 PolarHBondContact O-N 3.42Å; V25-N29 VanDerWaalsContact O-N 3.11Å; V25-N29 PolarHBondContact O-OD1 3.48Å; L26-N29 PolarHBondContact O-N 2.96Å; N29-L33 PolarHBondContact O-N 3.48Å
30	L	85.1	Confident	83.7	Confident	67 Å²	67	98.2 Å²	98.2	35%	0.351	54%	0.539	S	S	.	.	H	α-helix	trans	-73	-33.5	180	-74.3	171.2	0	0	0	111.8	L26 E27 G28 E32 L33 G34 Y35	L26-L30 HydrophobicContact CB-CD1 4.47Å; L26-L30 WeakPolarHBondContact O-CB 3.27Å; L26-L30 WeakPolarHBondContact O-CG 3.4Å; L26-L30 PolarHBondContact O-N 3.31Å; E27-L30 PolarHBondContact O-N 3.39Å; G28-L30 PolarHBondContact O-N 3.41Å; L30-E32 VanDerWaalsContact C-N 3.33Å; L30-L33 CarbonylContact O-C 3.45Å; L30-L33 WeakPolarHBondContact O-CA 3.46Å; L30-L33 PolarHBondContact O-N 2.84Å; L30-L33 VanDerWaalsContact O-N 3.13Å; L30-G34 PolarHBondContact O-N 3.31Å; L30-Y35 HydrophobicContact CD2-CD2 4.3Å; L30-Y35 PolarHBondContact O-N 3.27Å
31	S	84.6	Confident	83.3	Confident	74 Å²	74	104 Å²	104	52%	0.517	56%	0.557	S	S	.	*	H	α-helix	trans	-65.5	-36.6	175.5	72.9	0	0	0	0	112.2	E27 G28 L33 G34	E27-S31 WeakPolarHBondContact O-CB 3.41Å; E27-S31 PolarHBondContact O-N 3.01Å; E27-S31 PolarHBondContact O-OG 2.72Å; G28-S31 PolarHBondContact O-N 3.23Å; G28-S31 PolarHBondContact O-OG 2.97Å; S31-L33 PolarHBondContact O-N 2.9Å; S31-G34 PolarHBondContact O-N 3.23Å
32	E	86.6	Confident	82.8	Confident	163 Å²	163	100.6 Å²	100.6	76%	0.762	55%	0.548	S	S	*	.	H	α-helix	trans	-62.3	-31.4	172	-68.4	178.7	179.9	0	0	112.2	G28 L30 G34	G28-E32 PolarHBondContact O-N 2.93Å; L30-E32 VanDerWaalsContact C-N 3.33Å; E32-G34 VanDerWaalsContact C-N 3.31Å
33	L	86.3	Confident	82.3	Confident	126 Å²	126	96 Å²	96	66%	0.66	53%	0.534	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87	4.3	176.5	-68.7	164.1	0	0	0	113.3	N29 L30 S31 Y35	N29-L33 PolarHBondContact O-N 3.48Å; L30-L33 CarbonylContact O-C 3.45Å; L30-L33 WeakPolarHBondContact O-CA 3.46Å; L30-L33 PolarHBondContact O-N 2.84Å; L30-L33 VanDerWaalsContact O-N 3.13Å; S31-L33 PolarHBondContact O-N 2.9Å; L33-Y35 HydrophobicContact CB-CD2 3.77Å; L33-Y35 HydrophobicContact CB-CE2 4.05Å
34	G	86.2	Confident	82.2	Confident	69 Å²	69	93 Å²	93	71%	0.711	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.2	9.5	178.2	0	0	0	0	0	115.5	L30 S31 E32	L30-G34 PolarHBondContact O-N 3.31Å; S31-G34 PolarHBondContact O-N 3.23Å; E32-G34 VanDerWaalsContact C-N 3.31Å
35	Y	83.3	Confident	82.6	Confident	159 Å²	159	90.4 Å²	90.4	62%	0.624	50%	0.498	S	S	*	.			trans	-90.6	142.5	176.4	-64.8	-83.6	0	0	0	111.2	L30 L33	L30-Y35 HydrophobicContact CD2-CD2 4.3Å; L30-Y35 PolarHBondContact O-N 3.27Å; L33-Y35 HydrophobicContact CB-CD2 3.77Å; L33-Y35 HydrophobicContact CB-CE2 4.05Å
36	S	78.3	Confident	83.1	Confident	115 Å²	115	86.2 Å²	86.2	80%	0.804	47%	0.473	S	S	*	.			trans	-108	135.4	176.1	53.3	0	0	0	0	111
37	S	77.3	Confident	83.6	Confident	35 Å²	35	82.8 Å²	82.8	25%	0.245	46%	0.455	C	S	.	.	P	Polyproline II helix	trans	-74.2	149.9	176.6	-74.4	0	0	0	0	112.4	E27 K39	E27-S37 WeakPolarHBondContact CG-OG 3.48Å; E27-S37 WeakPolarHBondContact OE1-CB 3.4Å; E27-S37 PolarHBondContact OE1-OG 3.19Å; S37-K39 PolarHBondContact O-N 3.39Å
38	P	79.5	Confident	84.2	Confident	127 Å²	127	78 Å²	78	83%	0.825	43%	0.433	S	S	*	.	P	Polyproline II helix	trans	-59.5	127.6	172.5	-19	30.9	0	0	0	110.5
39	K	75.3	Confident	84.8	Confident	191 Å²	191	76.6 Å²	76.6	83%	0.83	42%	0.418	S	S	*	.	P	Polyproline II helix	trans	-89.8	144.8	176.3	-65.6	-179.8	-177.6	175.4	0	110.2	S37 R41	S37-K39 PolarHBondContact O-N 3.39Å; K39-R41 PolarHBondContact O-N 2.98Å
40	A	76.3	Confident	85.4	Confident	65 Å²	65	72.7 Å²	72.7	54%	0.537	40%	0.397	S	S	.	.	P	Polyproline II helix	trans	-60.9	134.2	168.4	0	0	0	0	0	109.6	K42 V92	A40-K42 PolarHBondContact O-N 3.47Å; A40-V92 HydrophobicContact CB-CG1 4.46Å; A40-V92 HydrophobicContact CB-CG2 4.1Å
41	R	74.8	Confident	86	Confident	156 Å²	156	71.1 Å²	71.1	59%	0.589	39%	0.39	S	S	*	.	P	Polyproline II helix	trans	-66.5	116.4	179.6	-66.2	-173.2	-169.4	-73.2	10	109.3	K39 D66	K39-R41 PolarHBondContact O-N 2.98Å; R41-D66 WeakPolarHBondContact CD-OD1 3.46Å; R41-D66 IonicContact CZ-OD1 3.49Å; R41-D66 IonicContact CZ-OD2 3.4Å; R41-D66 IonicContact NE-OD1 3.3Å; R41-D66 IonicContact NE-OD2 3.64Å; R41-D66 IonicContact NH1-OD1 2.62Å; R41-D66 PolarHBondContact NH1-OD1 2.85Å; R41-D66 IonicContact NH1-OD2 3.72Å; R41-D66 PolarHBondContact NH1-OD2 2.8Å; R41-D66 IonicContact NH2-OD2 3.18Å
42	K	74.4	Confident	86.6	Confident	143 Å²	143	67.9 Å²	67.9	62%	0.622	37%	0.366	S	S	*	.	B	Isolated β-bridge	trans	-100	137.1	172.6	-68.6	-177.3	-180	-177.1	0	108.4	A40 V92	A40-K42 PolarHBondContact O-N 3.47Å; K42-V92 HydrophobicContact CG-CG2 4.17Å
43	T	76.9	Confident	87.1	Confident	27 Å²	27	65.3 Å²	65.3	17%	0.166	35%	0.353	C	S	.	.	P	Polyproline II helix	trans	-94.4	136.4	173.2	59.9	0	0	0	0	109	T45 A64 G91 A93	T43-T45 PolarHBondContact O-N 3.35Å; T43-T45 PolarHBondContact OG1-OG1 3.13Å; T43-A64 HydrophobicContact CG2-CB 4.01Å; T43-G91 PolarHBondContact N-O 3.49Å; T43-A93 HydrophobicContact CG2-CB 3.82Å
44	G	83.6	Confident	87.6	Confident	8 Å²	8	63.5 Å²	63.5	8%	0.082	34%	0.344	C	S	.	.	P	Polyproline II helix	trans	-61.9	129.7	159.5	0	0	0	0	0	109.6	T65 K77 S173 G212	G44-T65 PolarHBondContact N-OG1 2.86Å; G44-K77 PolarHBondContact O-NZ 2.91Å; G44-S173 WeakPolarHBondContact CA-OG 3.15Å; G44-G212 CarbonylContact C-O 3.5Å; G44-G212 VanDerWaalsContact C-O 3.22Å; G44-G212 WeakPolarHBondContact CA-O 3.15Å; G44-G212 VanDerWaalsContact O-O 3.05Å
45	T	93.5	Very high	88.2	Confident	1 Å²	1	60.2 Å²	60.2	1%	0.006	31%	0.31	C	S	.	.			trans	-156.4	141.1	-170.7	-69.9	0	0	0	0	110.4	T43 I47 K77 A90 G172 S173 G174	T43-T45 PolarHBondContact O-N 3.35Å; T43-T45 PolarHBondContact OG1-OG1 3.13Å; T45-I47 HydrophobicContact CG2-CG2 3.63Å; T45-K77 HydrophobicContact CG2-CD 3.56Å; T45-K77 PolarHBondContact OG1-NZ 2.95Å; T45-A90 HydrophobicContact CG2-CB 4.06Å; T45-G172 CarbonylContact O-C 3.53Å; T45-G172 VanDerWaalsContact O-C 3.27Å; T45-G172 WeakPolarHBondContact O-CA 3.28Å; T45-S173 PolarHBondContact N-OG 2.78Å; T45-S173 PolarHBondContact O-N 3.06Å; T45-S173 PolarHBondContact O-OG 2.77Å; T45-G174 PolarHBondContact O-N 2.92Å
46	T	97.8	Very high	88.9	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	118.1	163.6	-58.1	0	0	0	0	108.5	A60 D61 G174 A178 I203 S213	T46-A60 WeakPolarHBondContact O-CA 3.42Å; T46-D61 PolarHBondContact N-OD1 3.49Å; T46-D61 PolarHBondContact O-N 3.27Å; T46-G174 WeakPolarHBondContact OG1-CA 2.95Å; T46-A178 HydrophobicContact CG2-CB 3.88Å; T46-I203 HydrophobicContact CG2-CD1 3.9Å; T46-S213 PolarHBondContact N-OG 2.68Å; T46-S213 WeakPolarHBondContact OG1-CB 3.21Å; T46-S213 PolarHBondContact OG1-OG 3.01Å
47	I	98.1	Very high	89.8	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	146.5	169.7	61.1	172.4	0	0	0	109.8	T45 G59 A60 K77 C88 A90 I143 T170 M171	T45-I47 HydrophobicContact CG2-CG2 3.63Å; I47-G59 WeakPolarHBondContact CA-O 3.41Å; I47-A60 HydrophobicContact CG2-CB 3.72Å; I47-K77 HydrophobicContact CG2-CB 4.49Å; I47-C88 HydrophobicContact CB-CB 3.93Å; I47-C88 HydrophobicContact CD1-CB 3.58Å; I47-C88 HydrophobicContact CG1-CB 4.31Å; I47-C88 HydrophobicContact CG2-CB 4.02Å; I47-A90 HydrophobicContact CD1-CB 3.67Å; I47-A90 HydrophobicContact CG1-CB 4.06Å; I47-I143 HydrophobicContact CB-CD1 4.45Å; I47-I143 HydrophobicContact CD1-CB 4.42Å; I47-I143 HydrophobicContact CD1-CD1 3.93Å; I47-I143 HydrophobicContact CD1-CG1 3.92Å; I47-I143 HydrophobicContact CG1-CD1 3.83Å; I47-I143 HydrophobicContact CG1-CG1 4.39Å; I47-T170 CarbonylContact O-C 3.53Å; I47-T170 WeakPolarHBondContact O-CA 3.47Å; I47-M171 HydrophobicContact CD1-CB 3.89Å; I47-M171 HydrophobicContact CG1-CB 3.7Å; I47-M171 WeakPolarHBondContact CG1-O 3.42Å; I47-M171 PolarHBondContact N-O 2.87Å; I47-M171 PolarHBondContact O-N 3.13Å
48	A	98.4	Very high	90.9	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	158.1	-177.3	0	0	0	0	0	110.5	G59 L169 T170 F182 I203	A48-G59 PolarHBondContact N-O 3.27Å; A48-G59 PolarHBondContact O-N 3.38Å; A48-L169 CarbonylContact C-O 3.6Å; A48-L169 VanDerWaalsContact CA-O 3.25Å; A48-L169 WeakPolarHBondContact CA-O 3.22Å; A48-T170 HydrophobicContact CB-CG2 4.22Å; A48-F182 HydrophobicContact CB-CE2 3.75Å; A48-F182 HydrophobicContact CB-CZ 3.76Å; A48-I203 HydrophobicContact CB-CD1 3.57Å; A48-I203 HydrophobicContact CB-CG1 4.4Å
49	G	98.3	Very high	91.8	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154	151.2	170.9	0	0	0	0	0	111.8	I57 L154 F168 L169	G49-I57 CarbonylContact C-O 3.51Å; G49-I57 WeakPolarHBondContact CA-O 3.15Å; G49-L154 VanDerWaalsContact C-CD2 3.45Å; G49-L154 WeakPolarHBondContact O-CD2 3.46Å; G49-F168 CarbonylContact O-C 3.59Å; G49-F168 WeakPolarHBondContact O-CA 3.26Å; G49-L169 PolarHBondContact N-O 3.17Å; G49-L169 PolarHBondContact O-N 2.89Å
50	I	98.4	Very high	92.9	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	149.5	175.1	69.4	176.7	0	0	0	110.9	V56 I57 P167 F168 F182 A195 V199	I50-V56 CarbonylContact O-C 3.51Å; I50-V56 WeakPolarHBondContact O-CA 3.45Å; I50-I57 HydrophobicContact CG1-CB 4.23Å; I50-I57 PolarHBondContact N-O 2.91Å; I50-I57 PolarHBondContact O-N 2.94Å; I50-P167 CarbonylContact C-O 3.27Å; I50-P167 WeakPolarHBondContact CA-O 3.41Å; I50-F168 HydrophobicContact CB-CB 4.39Å; I50-F168 HydrophobicContact CG2-CB 3.76Å; I50-F182 HydrophobicContact CG2-CD1 4Å; I50-F182 HydrophobicContact CG2-CE1 3.37Å; I50-F182 HydrophobicContact CG2-CE2 4Å; I50-F182 HydrophobicContact CG2-CZ 3.36Å; I50-A195 HydrophobicContact CD1-CB 3.59Å; I50-A195 WeakPolarHBondContact CD1-O 3.38Å; I50-V199 HydrophobicContact CB-CG2 4.36Å; I50-V199 HydrophobicContact CD1-CG2 3.52Å; I50-V199 HydrophobicContact CG1-CG2 3.55Å; I50-V199 HydrophobicContact CG2-CG2 3.99Å
51	V	98.4	Very high	93.9	Very high	35 Å²	35	27.2 Å²	27.2	21%	0.212	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	127.8	164.6	-175.2	0	0	0	0	107.6	V56 A152 L154 P167	V51-V56 HydrophobicContact CG2-CG1 4.06Å; V51-A152 HydrophobicContact CG1-CB 3.87Å; V51-L154 HydrophobicContact CG2-CB 3.6Å; V51-L154 HydrophobicContact CG2-CD2 4.36Å; V51-P167 PolarHBondContact N-O 3.38Å
52	F	98	Very high	95	Very high	5 Å²	5	19.8 Å²	19.8	2%	0.022	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	178.9	173.6	76.5	-80.9	0	0	0	109.2	D54 G55 I57 M190 L192 A195 V221 T223	F52-D54 VanDerWaalsContact C-N 3.3Å; F52-D54 HydrophobicContact CD2-CB 4.47Å; F52-D54 HydrophobicContact CE2-CB 3.76Å; F52-D54 HydrophobicContact CZ-CB 4.32Å; F52-D54 PolarHBondContact O-N 2.89Å; F52-G55 WeakPolarHBondContact CD1-O 3.49Å; F52-G55 PolarHBondContact N-O 3.13Å; F52-G55 PolarHBondContact O-N 2.79Å; F52-G55 VanDerWaalsContact O-O 3.07Å; F52-I57 HydrophobicContact CD1-CD1 4.13Å; F52-I57 HydrophobicContact CD1-CG1 3.71Å; F52-I57 HydrophobicContact CE1-CD1 4.26Å; F52-I57 HydrophobicContact CE1-CG1 3.68Å; F52-M190 WeakPolarHBondContact CB-O 3.49Å; F52-L192 HydrophobicContact CD2-CB 4.41Å; F52-L192 HydrophobicContact CD2-CD1 4.47Å; F52-L192 HydrophobicContact CE1-CD1 4.17Å; F52-L192 HydrophobicContact CE2-CB 3.93Å; F52-L192 HydrophobicContact CE2-CD1 3.73Å; F52-L192 HydrophobicContact CE2-CG 4.41Å; F52-L192 HydrophobicContact CZ-CD1 3.55Å; F52-A195 HydrophobicContact CB-CB 3.72Å; F52-A195 HydrophobicContact CG-CB 4.13Å; F52-V221 HydrophobicContact CE1-CG1 4.43Å; F52-V221 HydrophobicContact CZ-CG1 4.3Å; F52-T223 HydrophobicContact CZ-CG2 3.87Å
53	K	96.7	Very high	96	Very high	109 Å²	109	16 Å²	16	47%	0.474	8%	0.08	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.6	-44	-171.4	-177.2	-172.9	175.3	-170.8	0	114.4	N189 M190 E191	K53-N189 HydrophobicContact CB-CB 4.49Å; K53-M190 WeakPolarHBondContact CB-O 3.47Å; K53-M190 PolarHBondContact N-O 2.88Å; K53-M190 VanDerWaalsContact N-O 3.12Å; K53-E191 WeakPolarHBondContact CD-OE1 3.37Å; K53-E191 IonicContact NZ-OE1 3.44Å; K53-E191 PolarHBondContact NZ-OE1 2.93Å; K53-E191 IonicContact NZ-OE2 3.02Å
54	D	96.5	Very high	96.9	Very high	88 Å²	88	15.3 Å²	15.3	47%	0.471	8%	0.077	S	C	.	.	T	Hydrogen-bonded Turn	trans	-107.6	5.3	-171.8	-50.9	-49.7	0	0	0	113.7	F52	F52-D54 VanDerWaalsContact C-N 3.3Å; F52-D54 HydrophobicContact CD2-CB 4.47Å; F52-D54 HydrophobicContact CE2-CB 3.76Å; F52-D54 HydrophobicContact CZ-CB 4.32Å; F52-D54 PolarHBondContact O-N 2.89Å
55	G	97.7	Very high	97.4	Very high	0 Å²	0	15.6 Å²	15.6	0%	0	8%	0.077	C	C	.	.	E	Extended strand (participates in β ladder)	trans	168.3	-154.6	-174.5	0	0	0	0	0	116.1	F52 I222	F52-G55 WeakPolarHBondContact CD1-O 3.49Å; F52-G55 PolarHBondContact N-O 3.13Å; F52-G55 PolarHBondContact O-N 2.79Å; F52-G55 VanDerWaalsContact O-O 3.07Å; G55-I222 CarbonylContact C-O 3.6Å; G55-I222 VanDerWaalsContact CA-O 3.27Å; G55-I222 WeakPolarHBondContact CA-O 3.26Å
56	V	98.4	Very high	97.3	Very high	0 Å²	0	17.9 Å²	17.9	0%	0	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	149.1	174.6	-56.8	0	0	0	0	111.4	I50 V51 A152 I222	I50-V56 CarbonylContact O-C 3.51Å; I50-V56 WeakPolarHBondContact O-CA 3.45Å; V51-V56 HydrophobicContact CG2-CG1 4.06Å; V56-A152 HydrophobicContact CG1-CB 3.81Å; V56-I222 HydrophobicContact CG2-CB 3.72Å; V56-I222 HydrophobicContact CG2-CD1 3.82Å; V56-I222 HydrophobicContact CG2-CG1 4.11Å; V56-I222 HydrophobicContact CG2-CG2 4.37Å; V56-I222 PolarHBondContact N-O 3.28Å; V56-I222 PolarHBondContact O-N 2.89Å
57	I	98.6	Very high	96.8	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	129.4	170.7	-55.7	179	0	0	0	108	G49 I50 F52 L192 A195 K196 V199 L219 C220 V221	G49-I57 CarbonylContact C-O 3.51Å; G49-I57 WeakPolarHBondContact CA-O 3.15Å; I50-I57 HydrophobicContact CG1-CB 4.23Å; I50-I57 PolarHBondContact N-O 2.91Å; I50-I57 PolarHBondContact O-N 2.94Å; F52-I57 HydrophobicContact CD1-CD1 4.13Å; F52-I57 HydrophobicContact CD1-CG1 3.71Å; F52-I57 HydrophobicContact CE1-CD1 4.26Å; F52-I57 HydrophobicContact CE1-CG1 3.68Å; I57-L192 HydrophobicContact CD1-CD1 4.04Å; I57-A195 HydrophobicContact CD1-CB 3.64Å; I57-K196 HydrophobicContact CD1-CB 4.45Å; I57-K196 HydrophobicContact CD1-CG 3.82Å; I57-V199 HydrophobicContact CB-CG2 4.17Å; I57-V199 HydrophobicContact CG2-CB 4.28Å; I57-V199 HydrophobicContact CG2-CG1 4.33Å; I57-V199 HydrophobicContact CG2-CG2 3.95Å; I57-L219 HydrophobicContact CG2-CD2 4.28Å; I57-C220 CarbonylContact C-O 3.6Å; I57-C220 WeakPolarHBondContact CA-O 3.5Å; I57-V221 HydrophobicContact CD1-CG2 4.44Å; I57-V221 HydrophobicContact CG1-CG1 4.48Å; I57-V221 HydrophobicContact CG1-CG2 4.24Å; I57-V221 HydrophobicContact CG2-CG2 4.49Å
58	L	98.7	Very high	96.4	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	141.3	169.6	-60.6	179.6	0	0	0	109.3	I78 I143 L154 L219 C220 I222	L58-I78 HydrophobicContact CB-CD1 4.4Å; L58-I78 HydrophobicContact CD1-CG2 4.44Å; L58-I143 HydrophobicContact CD2-CG2 3.87Å; L58-L154 HydrophobicContact CD2-CD1 3.61Å; L58-L219 CarbonylContact O-C 3.5Å; L58-L219 WeakPolarHBondContact O-CA 3.4Å; L58-C220 HydrophobicContact CB-CB 4.26Å; L58-C220 PolarHBondContact N-O 3.31Å; L58-C220 PolarHBondContact O-N 3.28Å; L58-I222 HydrophobicContact CD1-CD1 4.38Å
59	G	98.4	Very high	96.2	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	145.7	177.8	0	0	0	0	0	111.7	I47 A48 D218	I47-G59 WeakPolarHBondContact CA-O 3.41Å; A48-G59 PolarHBondContact N-O 3.27Å; A48-G59 PolarHBondContact O-N 3.38Å; G59-D218 VanDerWaalsContact CA-O 3.3Å; G59-D218 WeakPolarHBondContact CA-O 3.42Å
60	A	98.4	Very high	96	Very high	0 Å²	0	39 Å²	39	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	153.8	176.1	0	0	0	0	0	111.4	T46 I47 K77 I78 D218	T46-A60 WeakPolarHBondContact O-CA 3.42Å; I47-A60 HydrophobicContact CG2-CB 3.72Å; A60-K77 HydrophobicContact CB-CB 3.95Å; A60-I78 HydrophobicContact CB-CD1 4.16Å; A60-I78 HydrophobicContact CB-CG1 3.85Å; A60-D218 PolarHBondContact N-O 3.1Å; A60-D218 VanDerWaalsContact N-O 3.13Å; A60-D218 PolarHBondContact O-N 3.38Å
61	D	97.9	Very high	95.9	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	162.8	166.8	79	-53.4	0	0	0	111.7	T46 K77 I203 I207 S213 G214 N216	T46-D61 PolarHBondContact N-OD1 3.49Å; T46-D61 PolarHBondContact O-N 3.27Å; D61-K77 VanDerWaalsContact CG-NZ 3.31Å; D61-K77 VanDerWaalsContact O-CD 3.27Å; D61-K77 WeakPolarHBondContact O-CD 3.44Å; D61-K77 WeakPolarHBondContact O-CE 3.14Å; D61-K77 IonicContact OD1-NZ 2.72Å; D61-K77 PolarHBondContact OD1-NZ 3.44Å; D61-K77 IonicContact OD2-NZ 3.43Å; D61-K77 PolarHBondContact OD2-NZ 2.89Å; D61-I203 HydrophobicContact CB-CG2 4.03Å; D61-I207 HydrophobicContact CB-CD1 4.27Å; D61-I207 HydrophobicContact CB-CG1 4.1Å; D61-S213 WeakPolarHBondContact OD2-CA 3.49Å; D61-G214 PolarHBondContact OD2-N 3.32Å; D61-N216 WeakPolarHBondContact CA-O 3.39Å
62	T	97.3	Very high	95.8	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	24%	0.241	C	C	.	.			trans	-105.1	4	-174.5	69.1	0	0	0	0	115.1	K73 N74 C75 G214 S215 N216 D218 R231	T62-K73 CarbonylContact C-O 3.59Å; T62-K73 CarbonylContact O-C 3.58Å; T62-K73 VanDerWaalsContact O-O 3.07Å; T62-K73 PolarHBondContact OG1-O 3.3Å; T62-N74 CarbonylContact O-C 3.22Å; T62-N74 PolarHBondContact O-N 3.24Å; T62-C75 WeakPolarHBondContact CA-O 3.35Å; T62-C75 PolarHBondContact O-N 2.77Å; T62-G214 PolarHBondContact N-O 3.1Å; T62-S215 WeakPolarHBondContact OG1-CB 3.36Å; T62-N216 HydrophobicContact CG2-CB 3.86Å; T62-N216 PolarHBondContact N-O 2.72Å; T62-N216 VanDerWaalsContact N-O 3.13Å; T62-N216 PolarHBondContact OG1-N 3.02Å; T62-D218 WeakPolarHBondContact CG2-OD2 3.42Å; T62-R231 VanDerWaalsContact CG2-NH2 3.28Å
63	R	96.4	Very high	95.6	Very high	64 Å²	64	50.1 Å²	50.1	24%	0.242	27%	0.266	C	S	.	.			trans	-81.2	136.1	177.8	178.7	174	-68.2	175.6	4.9	111.2	T65 V70 D72 K77 L211 G212 S213 G214	R63-T65 HydrophobicContact CG-CG2 4.02Å; R63-V70 HydrophobicContact CG-CG1 4.01Å; R63-V70 HydrophobicContact CG-CG2 4.3Å; R63-D72 WeakPolarHBondContact CA-O 3.36Å; R63-K77 WeakPolarHBondContact O-CE 3.42Å; R63-K77 PolarHBondContact O-NZ 3.3Å; R63-L211 PolarHBondContact NH1-O 3.44Å; R63-G212 WeakPolarHBondContact CD-O 3.3Å; R63-S213 PolarHBondContact NH1-O 2.99Å; R63-S213 VanDerWaalsContact NH1-O 3.08Å; R63-G214 WeakPolarHBondContact CB-O 3.35Å; R63-G214 PolarHBondContact N-O 2.78Å; R63-G214 VanDerWaalsContact N-O 3.14Å
64	A	95.6	Very high	95.6	Very high	12 Å²	12	49.1 Å²	49.1	10%	0.099	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	123.7	162.6	0	0	0	0	0	108.9	T43 A71 D72 C75	T43-A64 HydrophobicContact CG2-CB 4.01Å; A64-A71 PolarHBondContact O-N 3.42Å; A64-D72 HydrophobicContact CB-CB 4.17Å; A64-D72 PolarHBondContact N-O 3.4Å; A64-D72 PolarHBondContact O-N 3.31Å; A64-C75 HydrophobicContact CB-CB 3.9Å
65	T	94.3	Very high	95.5	Very high	14 Å²	14	46.6 Å²	46.6	9%	0.086	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	147.4	176	60.9	0	0	0	0	111.2	G44 R63 V69 V70	G44-T65 PolarHBondContact N-OG1 2.86Å; R63-T65 HydrophobicContact CG-CG2 4.02Å; T65-V69 CarbonylContact C-O 3.56Å; T65-V69 VanDerWaalsContact CA-O 3.31Å; T65-V69 WeakPolarHBondContact CA-O 3.33Å; T65-V70 HydrophobicContact CG2-CG2 4.45Å
66	D	91	Very high	95.4	Very high	48 Å²	48	52.3 Å²	52.3	26%	0.257	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	98.6	160.1	-173.1	18	0	0	0	107.4	R41 M68 V69 A71	R41-D66 WeakPolarHBondContact CD-OD1 3.46Å; R41-D66 IonicContact CZ-OD1 3.49Å; R41-D66 IonicContact CZ-OD2 3.4Å; R41-D66 IonicContact NE-OD1 3.3Å; R41-D66 IonicContact NE-OD2 3.64Å; R41-D66 IonicContact NH1-OD1 2.62Å; R41-D66 PolarHBondContact NH1-OD1 2.85Å; R41-D66 IonicContact NH1-OD2 3.72Å; R41-D66 PolarHBondContact NH1-OD2 2.8Å; R41-D66 IonicContact NH2-OD2 3.18Å; D66-M68 PolarHBondContact O-N 2.59Å; D66-V69 PolarHBondContact N-O 3.33Å; D66-V69 PolarHBondContact O-N 3.35Å; D66-A71 HydrophobicContact CB-CB 4.03Å
67	D	86.6	Confident	95.3	Very high	117 Å²	117	52.8 Å²	52.8	63%	0.626	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.7	-109.7	-165.9	-62.8	-32.3	0	0	0	111.7
68	M	90.8	Very high	95.3	Very high	170 Å²	170	53.2 Å²	53.2	84%	0.837	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.4	-1.5	-176.4	-59.1	-59.4	-72.9	0	0	113.5	D66	D66-M68 PolarHBondContact O-N 2.59Å
69	V	93.6	Very high	95.2	Very high	103 Å²	103	54.4 Å²	54.4	62%	0.624	29%	0.293	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.8	135	-178.2	-179.5	0	0	0	0	109.6	T65 D66 A71	T65-V69 CarbonylContact C-O 3.56Å; T65-V69 VanDerWaalsContact CA-O 3.31Å; T65-V69 WeakPolarHBondContact CA-O 3.33Å; D66-V69 PolarHBondContact N-O 3.33Å; D66-V69 PolarHBondContact O-N 3.35Å; V69-A71 PolarHBondContact O-N 2.86Å; V69-A71 VanDerWaalsContact O-N 3.16Å
70	V	95.5	Very high	95.2	Very high	55 Å²	55	59.8 Å²	59.8	33%	0.333	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	108	172.5	179.7	0	0	0	0	109	R63 T65 D72 K73	R63-V70 HydrophobicContact CG-CG1 4.01Å; R63-V70 HydrophobicContact CG-CG2 4.3Å; T65-V70 HydrophobicContact CG2-CG2 4.45Å; V70-D72 WeakPolarHBondContact CG1-O 3.34Å; V70-K73 HydrophobicContact CG1-CG 3.84Å
71	A	95	Very high	95.2	Very high	72 Å²	72	59.9 Å²	59.9	60%	0.595	31%	0.314	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.7	-42.6	178.8	0	0	0	0	0	111.5	A64 D66 V69	A64-A71 PolarHBondContact O-N 3.42Å; D66-A71 HydrophobicContact CB-CB 4.03Å; V69-A71 PolarHBondContact O-N 2.86Å; V69-A71 VanDerWaalsContact O-N 3.16Å
72	D	95.6	Very high	95.2	Very high	74 Å²	74	60.1 Å²	60.1	40%	0.396	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	140.9	175.6	-169.2	0.9	0	0	0	110.9	R63 A64 V70 N74 C75	R63-D72 WeakPolarHBondContact CA-O 3.36Å; A64-D72 HydrophobicContact CB-CB 4.17Å; A64-D72 PolarHBondContact N-O 3.4Å; A64-D72 PolarHBondContact O-N 3.31Å; V70-D72 WeakPolarHBondContact CG1-O 3.34Å; D72-N74 PolarHBondContact OD1-N 2.91Å; D72-C75 HydrophobicContact CB-CB 4.25Å; D72-C75 WeakPolarHBondContact OD2-CA 3.26Å; D72-C75 PolarHBondContact OD2-N 2.79Å
73	K	95.6	Very high	95.2	Very high	127 Å²	127	64.4 Å²	64.4	55%	0.552	34%	0.344	S	S	*	.	S	Bend	trans	-97.7	-17.4	176.6	-66.6	-177.8	180	-175.2	0	112.8	T62 V70 S215	T62-K73 CarbonylContact C-O 3.59Å; T62-K73 CarbonylContact O-C 3.58Å; T62-K73 VanDerWaalsContact O-O 3.07Å; T62-K73 PolarHBondContact OG1-O 3.3Å; V70-K73 HydrophobicContact CG1-CG 3.84Å; K73-S215 WeakPolarHBondContact O-CB 3.44Å; K73-S215 PolarHBondContact O-OG 2.99Å
74	N	95.9	Very high	95.2	Very high	88 Å²	88	62.7 Å²	62.7	47%	0.471	34%	0.34	S	S	.	.	S	Bend	trans	-132.7	45.2	-174.4	-165.3	25.5	0	0	0	112.3	T62 D72 R231	T62-N74 CarbonylContact O-C 3.22Å; T62-N74 PolarHBondContact O-N 3.24Å; D72-N74 PolarHBondContact OD1-N 2.91Å; N74-R231 VanDerWaalsContact C-NH2 3.33Å; N74-R231 PolarHBondContact O-NH2 2.89Å; N74-R231 VanDerWaalsContact O-NH2 3.1Å; N74-R231 PolarHBondContact OD1-NE 3.46Å; N74-R231 PolarHBondContact OD1-NH2 3.03Å
75	C	95.3	Very high	95.3	Very high	34 Å²	34	62.1 Å²	62.1	23%	0.23	34%	0.335	C	S	.	.			trans	-75.4	142.3	177.1	-178.6	0	0	0	0	111.4	T62 A64 D72 R231	T62-C75 WeakPolarHBondContact CA-O 3.35Å; T62-C75 PolarHBondContact O-N 2.77Å; A64-C75 HydrophobicContact CB-CB 3.9Å; D72-C75 HydrophobicContact CB-CB 4.25Å; D72-C75 WeakPolarHBondContact OD2-CA 3.26Å; D72-C75 PolarHBondContact OD2-N 2.79Å; C75-R231 VanDerWaalsContact C-NH2 3.28Å; C75-R231 PolarHBondContact O-NH1 3.39Å; C75-R231 PolarHBondContact O-NH2 3.47Å
76	M	94.6	Very high	95.5	Very high	121 Å²	121	63.3 Å²	63.3	60%	0.596	34%	0.338	S	S	*	.			trans	-90.6	127.8	174.7	-61.8	-171.9	-71.1	0	0	110.3	R231	M76-R231 VanDerWaalsContact CG-NH1 3.35Å
77	K	96.4	Very high	95.8	Very high	9 Å²	9	61 Å²	61	4%	0.039	33%	0.326	C	S	.	.			trans	-119.3	-7.3	178.8	-52.8	-173.9	-170.1	178.7	0	113.8	G44 T45 I47 A60 D61 R63 H79 C88 G89	G44-K77 PolarHBondContact O-NZ 2.91Å; T45-K77 HydrophobicContact CG2-CD 3.56Å; T45-K77 PolarHBondContact OG1-NZ 2.95Å; I47-K77 HydrophobicContact CG2-CB 4.49Å; A60-K77 HydrophobicContact CB-CB 3.95Å; D61-K77 VanDerWaalsContact CG-NZ 3.31Å; D61-K77 VanDerWaalsContact O-CD 3.27Å; D61-K77 WeakPolarHBondContact O-CD 3.44Å; D61-K77 WeakPolarHBondContact O-CE 3.14Å; D61-K77 IonicContact OD1-NZ 2.72Å; D61-K77 PolarHBondContact OD1-NZ 3.44Å; D61-K77 IonicContact OD2-NZ 3.43Å; D61-K77 PolarHBondContact OD2-NZ 2.89Å; R63-K77 WeakPolarHBondContact O-CE 3.42Å; R63-K77 PolarHBondContact O-NZ 3.3Å; K77-H79 PolarHBondContact O-CD2 3.29Å; K77-H79 VanDerWaalsContact O-CD2 3.24Å; K77-H79 PolarHBondContact O-NE2 3.16Å; K77-C88 CarbonylContact O-C 3.53Å; K77-C88 VanDerWaalsContact O-CA 3.24Å; K77-C88 WeakPolarHBondContact O-CA 3.42Å; K77-G89 PolarHBondContact O-N 3.02Å
78	I	98	Very high	96.4	Very high	10 Å²	10	55.4 Å²	55.4	5%	0.051	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	105.3	175.7	-48.8	-171.9	0	0	0	106.6	L58 A60 Y86 D218 C220 Y229	L58-I78 HydrophobicContact CB-CD1 4.4Å; L58-I78 HydrophobicContact CD1-CG2 4.44Å; A60-I78 HydrophobicContact CB-CD1 4.16Å; A60-I78 HydrophobicContact CB-CG1 3.85Å; I78-Y86 HydrophobicContact CG2-CD1 4.03Å; I78-D218 HydrophobicContact CD1-CB 4.31Å; I78-C220 HydrophobicContact CD1-CB 4.06Å; I78-C220 HydrophobicContact CG2-CB 3.88Å; I78-Y229 HydrophobicContact CB-CE2 3.9Å; I78-Y229 HydrophobicContact CD1-CE2 4.07Å; I78-Y229 HydrophobicContact CG1-CE2 4.34Å; I78-Y229 HydrophobicContact CG2-CE2 4.28Å
79	H	97.9	Very high	96.6	Very high	24 Å²	24	47.6 Å²	47.6	11%	0.111	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	143.5	-175	-51.3	-85.1	0	0	0	110.6	K77 Y86 C87 E97 T100	K77-H79 PolarHBondContact O-CD2 3.29Å; K77-H79 VanDerWaalsContact O-CD2 3.24Å; K77-H79 PolarHBondContact O-NE2 3.16Å; H79-Y86 WeakPolarHBondContact O-CA 3.38Å; H79-Y86 WeakPolarHBondContact O-CD1 3.24Å; H79-C87 PolarHBondContact N-O 3.11Å; H79-C87 PolarHBondContact O-N 3.31Å; H79-E97 IonicContact CE1-OE2 2.82Å; H79-E97 PolarHBondContact CE1-OE2 3.13Å; H79-E97 IonicContact ND1-OE2 3.23Å; H79-E97 PolarHBondContact ND1-OE2 3.32Å; H79-E97 VanDerWaalsContact ND1-OE2 3.13Å; H79-T100 HydrophobicContact CB-CG2 4.21Å
80	Y	98.1	Very high	96.6	Very high	113 Å²	113	42.8 Å²	42.8	44%	0.443	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	138.6	172	174.1	-92.6	0	0	0	110.5	A82 P83 Y86	Y80-A82 WeakPolarHBondContact CE2-O 3.45Å; Y80-P83 VanDerWaalsContact OH-CD 3.24Å; Y80-P83 WeakPolarHBondContact OH-CD 3.42Å; Y80-Y86 HydrophobicContact CD2-CE1 4.21Å; Y80-Y86 HydrophobicContact CD2-CE2 4.1Å; Y80-Y86 AromaticContact CD2-CZ 3.74Å
81	I	97.9	Very high	96.5	Very high	3 Å²	3	41.1 Å²	41.1	2%	0.015	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	-47.4	170.9	-59	-65.5	0	0	0	110.6	I85 C87 T100 M103 S104 V107 V123	I81-I85 HydrophobicContact CB-CB 4.45Å; I81-I85 HydrophobicContact CB-CG2 4.31Å; I81-I85 HydrophobicContact CG2-CG2 4.49Å; I81-I85 PolarHBondContact N-O 2.87Å; I81-C87 HydrophobicContact CD1-CB 4.13Å; I81-C87 HydrophobicContact CG1-CB 3.77Å; I81-T100 HydrophobicContact CD1-CG2 4.31Å; I81-T100 WeakPolarHBondContact CD1-O 3.45Å; I81-M103 HydrophobicContact CD1-CB 4.2Å; I81-S104 PolarHBondContact O-OG 3.47Å; I81-V107 HydrophobicContact CG2-CB 4.36Å; I81-V107 HydrophobicContact CG2-CG1 4.43Å; I81-V107 HydrophobicContact CG2-CG2 4.16Å; I81-V123 HydrophobicContact CG2-CG1 3.96Å; I81-V123 HydrophobicContact CG2-CG2 4.07Å
82	A	97.4	Very high	96.4	Very high	4 Å²	4	38.4 Å²	38.4	3%	0.033	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	167.2	178.9	0	0	0	0	0	109.6	Y80 N84 I85 V107 P118	Y80-A82 WeakPolarHBondContact CE2-O 3.45Å; A82-N84 PolarHBondContact O-N 3.47Å; A82-I85 HydrophobicContact CB-CB 4.17Å; A82-I85 HydrophobicContact CB-CD1 4.39Å; A82-I85 HydrophobicContact CB-CG1 4.33Å; A82-I85 PolarHBondContact N-O 3.28Å; A82-I85 PolarHBondContact O-N 3.29Å; A82-V107 HydrophobicContact CB-CG1 4.08Å; A82-P118 HydrophobicContact CB-CG 3.49Å; A82-P118 VanDerWaalsContact CB-CG 3.49Å
83	P	96.8	Very high	96.2	Very high	91 Å²	91	37.1 Å²	37.1	59%	0.591	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.7	-26.9	-177.2	-28	37	0	0	0	114.4	Y80 V227	Y80-P83 VanDerWaalsContact OH-CD 3.24Å; Y80-P83 WeakPolarHBondContact OH-CD 3.42Å; P83-V227 VanDerWaalsContact O-CG2 3.22Å; P83-V227 WeakPolarHBondContact O-CG2 3.21Å
84	N	97.2	Very high	96.1	Very high	27 Å²	27	34.2 Å²	34.2	14%	0.144	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-112.9	6.5	-179.3	66.2	-44.4	0	0	0	114.3	A82 P118 G146 V147	A82-N84 PolarHBondContact O-N 3.47Å; N84-P118 PolarHBondContact ND2-O 3.34Å; N84-P118 VanDerWaalsContact ND2-O 3.13Å; N84-G146 WeakPolarHBondContact O-CA 3.39Å; N84-V147 WeakPolarHBondContact CB-O 3.38Å; N84-V147 PolarHBondContact ND2-O 3.45Å; N84-V147 PolarHBondContact O-N 3.48Å; N84-V147 VanDerWaalsContact O-N 3.13Å
85	I	98.3	Very high	96	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	127.3	-174	-49.9	174.5	0	0	0	110.5	I81 A82 P118 V120 V123 V144	I81-I85 HydrophobicContact CB-CB 4.45Å; I81-I85 HydrophobicContact CB-CG2 4.31Å; I81-I85 HydrophobicContact CG2-CG2 4.49Å; I81-I85 PolarHBondContact N-O 2.87Å; A82-I85 HydrophobicContact CB-CB 4.17Å; A82-I85 HydrophobicContact CB-CD1 4.39Å; A82-I85 HydrophobicContact CB-CG1 4.33Å; A82-I85 PolarHBondContact N-O 3.28Å; A82-I85 PolarHBondContact O-N 3.29Å; I85-P118 HydrophobicContact CD1-CB 4.27Å; I85-P118 HydrophobicContact CD1-CG 4.11Å; I85-V120 HydrophobicContact CD1-CG2 4.32Å; I85-V120 HydrophobicContact CG1-CG2 4.25Å; I85-V123 HydrophobicContact CD1-CG2 3.64Å; I85-V123 HydrophobicContact CG2-CG2 4.31Å; I85-V144 HydrophobicContact CG2-CG1 3.89Å
86	Y	98.6	Very high	95.9	Very high	39 Å²	39	29.9 Å²	29.9	15%	0.153	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	160.5	172.5	-76.9	-110.9	0	0	0	110.6	I78 H79 Y80 G145 I222 V227	I78-Y86 HydrophobicContact CG2-CD1 4.03Å; H79-Y86 WeakPolarHBondContact O-CA 3.38Å; H79-Y86 WeakPolarHBondContact O-CD1 3.24Å; Y80-Y86 HydrophobicContact CD2-CE1 4.21Å; Y80-Y86 HydrophobicContact CD2-CE2 4.1Å; Y80-Y86 AromaticContact CD2-CZ 3.74Å; Y86-G145 PolarHBondContact N-O 2.83Å; Y86-G145 PolarHBondContact O-N 3.4Å; Y86-I222 HydrophobicContact CD2-CD1 3.99Å; Y86-I222 HydrophobicContact CD2-CG1 4.43Å; Y86-I222 HydrophobicContact CG-CD1 4.31Å; Y86-V227 HydrophobicContact CD2-CG1 4.07Å; Y86-V227 HydrophobicContact CD2-CG2 4.31Å; Y86-V227 HydrophobicContact CE2-CB 4.01Å; Y86-V227 HydrophobicContact CE2-CG1 3.51Å; Y86-V227 HydrophobicContact CE2-CG2 3.86Å
87	C	97.5	Very high	95.9	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	129.9	-177.4	-173.7	0	0	0	0	110.8	H79 I81 T100 I143	H79-C87 PolarHBondContact N-O 3.11Å; H79-C87 PolarHBondContact O-N 3.31Å; I81-C87 HydrophobicContact CD1-CB 4.13Å; I81-C87 HydrophobicContact CG1-CB 3.77Å; C87-T100 HydrophobicContact CB-CG2 4.12Å; C87-I143 CarbonylContact C-O 3.51Å; C87-I143 VanDerWaalsContact CA-O 3.29Å; C87-I143 WeakPolarHBondContact CA-O 3.19Å
88	C	97.4	Very high	95.8	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	131.8	170.4	-66.2	0	0	0	0	110.9	I47 K77 L142 I143	I47-C88 HydrophobicContact CB-CB 3.93Å; I47-C88 HydrophobicContact CD1-CB 3.58Å; I47-C88 HydrophobicContact CG1-CB 4.31Å; I47-C88 HydrophobicContact CG2-CB 4.02Å; K77-C88 CarbonylContact O-C 3.53Å; K77-C88 VanDerWaalsContact O-CA 3.24Å; K77-C88 WeakPolarHBondContact O-CA 3.42Å; C88-L142 VanDerWaalsContact O-CA 3.32Å; C88-L142 WeakPolarHBondContact O-CA 3.44Å; C88-I143 HydrophobicContact CB-CB 4.22Å; C88-I143 PolarHBondContact N-O 3.15Å; C88-I143 PolarHBondContact O-N 2.97Å
89	G	95.6	Very high	95.7	Very high	6 Å²	6	29.2 Å²	29.2	6%	0.062	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	135.5	176.4	0	0	0	0	0	113.5	K77	K77-G89 PolarHBondContact O-N 3.02Å
90	A	94.6	Very high	95.6	Very high	2 Å²	2	28.2 Å²	28.2	2%	0.017	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	164.5	168.7	0	0	0	0	0	111	T45 I47 S141	T45-A90 HydrophobicContact CG2-CB 4.06Å; I47-A90 HydrophobicContact CD1-CB 3.67Å; I47-A90 HydrophobicContact CG1-CB 4.06Å; A90-S141 PolarHBondContact N-O 3.04Å; A90-S141 PolarHBondContact O-N 2.77Å
91	G	92.3	Very high	95.5	Very high	19 Å²	19	28 Å²	28	20%	0.196	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	93	-129.7	-178.5	0	0	0	0	0	112.4	T43 A93	T43-G91 PolarHBondContact N-O 3.49Å; G91-A93 PolarHBondContact O-N 2.79Å
92	V	93.6	Very high	95.3	Very high	15 Å²	15	30.7 Å²	30.7	9%	0.091	19%	0.185	C	C	.	.	B	Isolated β-bridge	trans	-74.5	113.4	176.4	179.7	0	0	0	0	108.5	A40 K42 A94 D95 A96 G139	A40-V92 HydrophobicContact CB-CG1 4.46Å; A40-V92 HydrophobicContact CB-CG2 4.1Å; K42-V92 HydrophobicContact CG-CG2 4.17Å; V92-A94 PolarHBondContact O-N 3.37Å; V92-D95 HydrophobicContact CB-CB 3.97Å; V92-D95 WeakPolarHBondContact CB-OD2 3.2Å; V92-D95 HydrophobicContact CG1-CB 4.03Å; V92-D95 PolarHBondContact O-N 3Å; V92-A96 PolarHBondContact O-N 3.49Å; V92-A96 VanDerWaalsContact O-N 3.1Å; V92-G139 PolarHBondContact N-O 2.81Å
93	A	91.4	Very high	95.2	Very high	48 Å²	48	30.7 Å²	30.7	40%	0.397	18%	0.184	S	C	.	.	H	α-helix	trans	-61.1	-44.3	-170.6	0	0	0	0	0	113	T43 G91 D95 A96 E97	T43-A93 HydrophobicContact CG2-CB 3.82Å; G91-A93 PolarHBondContact O-N 2.79Å; A93-D95 VanDerWaalsContact C-N 3.32Å; A93-D95 PolarHBondContact O-N 3.02Å; A93-A96 PolarHBondContact O-N 2.8Å; A93-E97 PolarHBondContact O-N 2.94Å
94	A	92.6	Very high	95.2	Very high	65 Å²	65	27.2 Å²	27.2	54%	0.537	16%	0.162	S	C	.	.	H	α-helix	trans	-63	-39.3	178.8	0	0	0	0	0	112.3	V92 E97 V98	V92-A94 PolarHBondContact O-N 3.37Å; A94-E97 PolarHBondContact O-N 3.28Å; A94-V98 WeakPolarHBondContact O-CB 3.14Å; A94-V98 WeakPolarHBondContact O-CG2 3.43Å; A94-V98 PolarHBondContact O-N 2.76Å
95	D	94.3	Very high	95.2	Very high	28 Å²	28	28.8 Å²	28.8	15%	0.15	18%	0.175	C	C	.	.	H	α-helix	trans	-64.5	-43.4	178.1	-73.4	-10	0	0	0	111	V92 A93 T99 I138 G139	V92-D95 HydrophobicContact CB-CB 3.97Å; V92-D95 WeakPolarHBondContact CB-OD2 3.2Å; V92-D95 HydrophobicContact CG1-CB 4.03Å; V92-D95 PolarHBondContact O-N 3Å; A93-D95 VanDerWaalsContact C-N 3.32Å; A93-D95 PolarHBondContact O-N 3.02Å; D95-T99 WeakPolarHBondContact O-CB 3.38Å; D95-T99 PolarHBondContact O-N 2.9Å; D95-T99 PolarHBondContact O-OG1 3.19Å; D95-I138 HydrophobicContact CB-CG2 3.76Å; D95-G139 PolarHBondContact OD2-N 2.54Å
96	A	93.6	Very high	95.1	Very high	3 Å²	3	32.1 Å²	32.1	3%	0.025	19%	0.193	C	C	.	.	H	α-helix	trans	-63.9	-45.6	177.4	0	0	0	0	0	111.9	V92 A93 T100 S140 L142	V92-A96 PolarHBondContact O-N 3.49Å; V92-A96 VanDerWaalsContact O-N 3.1Å; A93-A96 PolarHBondContact O-N 2.8Å; A96-T100 WeakPolarHBondContact O-CB 3.35Å; A96-T100 VanDerWaalsContact O-CG2 3.26Å; A96-T100 WeakPolarHBondContact O-CG2 3.48Å; A96-T100 PolarHBondContact O-N 2.78Å; A96-T100 PolarHBondContact O-OG1 3.07Å; A96-S140 VanDerWaalsContact CA-OG 3.32Å; A96-S140 WeakPolarHBondContact CA-OG 3.28Å; A96-S140 WeakPolarHBondContact CB-OG 3.41Å; A96-L142 HydrophobicContact CB-CD2 4.28Å
97	E	94	Very high	95.1	Very high	73 Å²	73	30.3 Å²	30.3	34%	0.341	19%	0.186	S	C	.	.	H	α-helix	trans	-60.1	-53.6	178.1	-174.5	65.3	-148.8	0	0	111.2	H79 A93 A94 T99 T100 Q101	H79-E97 IonicContact CE1-OE2 2.82Å; H79-E97 PolarHBondContact CE1-OE2 3.13Å; H79-E97 IonicContact ND1-OE2 3.23Å; H79-E97 PolarHBondContact ND1-OE2 3.32Å; H79-E97 VanDerWaalsContact ND1-OE2 3.13Å; A93-E97 PolarHBondContact O-N 2.94Å; A94-E97 PolarHBondContact O-N 3.28Å; E97-T99 PolarHBondContact O-N 3.06Å; E97-T100 PolarHBondContact O-N 2.97Å; E97-T100 PolarHBondContact O-OG1 3.4Å; E97-Q101 WeakPolarHBondContact O-CB 3.45Å; E97-Q101 VanDerWaalsContact O-CG 3.26Å; E97-Q101 WeakPolarHBondContact O-CG 3.4Å; E97-Q101 PolarHBondContact O-N 2.86Å; E97-Q101 PolarHBondContact OE1-NE2 2.87Å
98	V	94.7	Very high	95.1	Very high	54 Å²	54	35.8 Å²	35.8	33%	0.327	21%	0.212	S	C	.	.	H	α-helix	trans	-67	-39.2	-177.4	175.8	0	0	0	0	111.2	F15 A94 Q101 M102	F15-V98 HydrophobicContact CE2-CB 4.37Å; F15-V98 HydrophobicContact CE2-CG1 3.71Å; F15-V98 HydrophobicContact CZ-CB 3.93Å; F15-V98 HydrophobicContact CZ-CG1 3.7Å; A94-V98 WeakPolarHBondContact O-CB 3.14Å; A94-V98 WeakPolarHBondContact O-CG2 3.43Å; A94-V98 PolarHBondContact O-N 2.76Å; V98-Q101 PolarHBondContact O-N 3.06Å; V98-M102 HydrophobicContact CG1-CE 3.52Å; V98-M102 HydrophobicContact CG1-SD 4.33Å; V98-M102 WeakPolarHBondContact O-CG 3.39Å; V98-M102 PolarHBondContact O-N 2.88Å
99	T	95.3	Very high	95.1	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-63.3	-45.3	177.4	-60.4	0	0	0	0	111.1	D95 E97 M102 M103 L127 M130 L142	D95-T99 WeakPolarHBondContact O-CB 3.38Å; D95-T99 PolarHBondContact O-N 2.9Å; D95-T99 PolarHBondContact O-OG1 3.19Å; E97-T99 PolarHBondContact O-N 3.06Å; T99-M102 PolarHBondContact O-N 2.85Å; T99-M103 VanDerWaalsContact O-CG 3.32Å; T99-M103 WeakPolarHBondContact O-CG 3.25Å; T99-M103 PolarHBondContact O-N 3.42Å; T99-L127 HydrophobicContact CG2-CD2 3.5Å; T99-L127 VanDerWaalsContact CG2-CD2 3.5Å; T99-M130 HydrophobicContact CG2-CE 4.38Å; T99-M130 HydrophobicContact CG2-SD 4.33Å; T99-L142 HydrophobicContact CG2-CD1 4.2Å
100	T	95.5	Very high	95.1	Very high	2 Å²	2	44.3 Å²	44.3	1%	0.012	25%	0.252	C	S	.	.	H	α-helix	trans	-67.9	-39.9	179.4	52.8	0	0	0	0	112.1	H79 I81 C87 A96 E97 M103 S104 L142	H79-T100 HydrophobicContact CB-CG2 4.21Å; I81-T100 HydrophobicContact CD1-CG2 4.31Å; I81-T100 WeakPolarHBondContact CD1-O 3.45Å; C87-T100 HydrophobicContact CB-CG2 4.12Å; A96-T100 WeakPolarHBondContact O-CB 3.35Å; A96-T100 VanDerWaalsContact O-CG2 3.26Å; A96-T100 WeakPolarHBondContact O-CG2 3.48Å; A96-T100 PolarHBondContact O-N 2.78Å; A96-T100 PolarHBondContact O-OG1 3.07Å; E97-T100 PolarHBondContact O-N 2.97Å; E97-T100 PolarHBondContact O-OG1 3.4Å; T100-M103 PolarHBondContact O-N 3.02Å; T100-S104 WeakPolarHBondContact O-CB 3.25Å; T100-S104 PolarHBondContact O-N 3.16Å; T100-L142 HydrophobicContact CG2-CD2 4.14Å
101	Q	96.1	Very high	95.2	Very high	108 Å²	108	45.8 Å²	45.8	51%	0.505	26%	0.263	S	S	.	.	H	α-helix	trans	-60.3	-46.5	173.9	-73	177.3	4.8	0	0	112.3	E97 V98 M103 S104 S105	E97-Q101 WeakPolarHBondContact O-CB 3.45Å; E97-Q101 VanDerWaalsContact O-CG 3.26Å; E97-Q101 WeakPolarHBondContact O-CG 3.4Å; E97-Q101 PolarHBondContact O-N 2.86Å; E97-Q101 PolarHBondContact OE1-NE2 2.87Å; V98-Q101 PolarHBondContact O-N 3.06Å; Q101-M103 VanDerWaalsContact C-N 3.31Å; Q101-M103 PolarHBondContact O-N 3.4Å; Q101-S104 PolarHBondContact O-N 3.48Å; Q101-S105 PolarHBondContact O-N 3.4Å
102	M	94.6	Very high	95.5	Very high	60 Å²	60	51 Å²	51	30%	0.296	29%	0.285	S	S	.	.	H	α-helix	trans	-60.3	-41.5	175.6	-73.7	-178.3	-173.1	0	0	111.7	F15 V98 T99 N106 M130	F15-M102 HydrophobicContact CD2-CE 4.01Å; F15-M102 HydrophobicContact CD2-SD 4.11Å; F15-M102 HydrophobicContact CE2-CE 3.98Å; F15-M102 HydrophobicContact CE2-SD 3.95Å; V98-M102 HydrophobicContact CG1-CE 3.52Å; V98-M102 HydrophobicContact CG1-SD 4.33Å; V98-M102 WeakPolarHBondContact O-CG 3.39Å; V98-M102 PolarHBondContact O-N 2.88Å; T99-M102 PolarHBondContact O-N 2.85Å; M102-N106 VanDerWaalsContact O-CG 3.31Å; M102-N106 PolarHBondContact O-N 3.46Å; M102-N106 VanDerWaalsContact O-N 3.08Å; M102-N106 PolarHBondContact O-ND2 3.38Å; M102-M130 HydrophobicContact SD-CE 3.76Å
103	M	95.5	Very high	95.7	Very high	4 Å²	4	55.2 Å²	55.2	2%	0.02	32%	0.316	C	S	.	.	H	α-helix	trans	-66.1	-44.8	176.8	-71.4	-56.5	116.9	0	0	112.4	I81 T99 T100 Q101 S105 N106 V107 Q126 L127 M130	I81-M103 HydrophobicContact CD1-CB 4.2Å; T99-M103 VanDerWaalsContact O-CG 3.32Å; T99-M103 WeakPolarHBondContact O-CG 3.25Å; T99-M103 PolarHBondContact O-N 3.42Å; T100-M103 PolarHBondContact O-N 3.02Å; Q101-M103 VanDerWaalsContact C-N 3.31Å; Q101-M103 PolarHBondContact O-N 3.4Å; M103-S105 VanDerWaalsContact C-N 3.29Å; M103-S105 PolarHBondContact O-N 2.88Å; M103-N106 PolarHBondContact O-N 3.44Å; M103-V107 VanDerWaalsContact O-CB 3.31Å; M103-V107 WeakPolarHBondContact O-CB 3.5Å; M103-V107 WeakPolarHBondContact O-CG2 3.36Å; M103-V107 PolarHBondContact O-N 2.87Å; M103-Q126 HydrophobicContact SD-CB 3.68Å; M103-L127 HydrophobicContact CG-CD2 3.32Å; M103-L127 HydrophobicContact CG-CG 3.66Å; M103-L127 HydrophobicContact SD-CD2 3.97Å; M103-L127 HydrophobicContact SD-CG 3.94Å; M103-M130 HydrophobicContact CE-CB 4.3Å; M103-M130 HydrophobicContact CE-CG 4.49Å; M103-M130 HydrophobicContact CE-SD 3.32Å; M103-M130 WeakPolarHBondContact CE-SD 3.35Å
104	S	97.1	Very high	96	Very high	18 Å²	18	55.8 Å²	55.8	13%	0.126	31%	0.314	C	S	.	.	H	α-helix	trans	-55.2	-47.1	177.1	-170.8	0	0	0	0	110.6	I81 T100 Q101 V107 E108	I81-S104 PolarHBondContact O-OG 3.47Å; T100-S104 WeakPolarHBondContact O-CB 3.25Å; T100-S104 PolarHBondContact O-N 3.16Å; Q101-S104 PolarHBondContact O-N 3.48Å; S104-V107 PolarHBondContact O-N 3.19Å; S104-E108 WeakPolarHBondContact O-CB 3.43Å; S104-E108 PolarHBondContact O-N 3Å
105	S	97.1	Very high	96.2	Very high	60 Å²	60	56 Å²	56	42%	0.42	32%	0.322	S	S	.	.	H	α-helix	trans	-63.4	-46.1	178.5	179.7	0	0	0	0	112.7	Q101 M103 V107 E108 L109	Q101-S105 PolarHBondContact O-N 3.4Å; M103-S105 VanDerWaalsContact C-N 3.29Å; M103-S105 PolarHBondContact O-N 2.88Å; S105-V107 VanDerWaalsContact C-N 3.33Å; S105-V107 PolarHBondContact O-N 3.21Å; S105-E108 PolarHBondContact O-N 3.13Å; S105-L109 WeakPolarHBondContact O-CG 3.24Å; S105-L109 PolarHBondContact O-N 3.4Å
106	N	96.2	Very high	96.2	Very high	71 Å²	71	63.5 Å²	63.5	38%	0.38	35%	0.349	S	S	.	.	H	α-helix	trans	-64.1	-38.7	178.6	-71.1	-21.6	0	0	0	112.5	M102 M103 H110	M102-N106 VanDerWaalsContact O-CG 3.31Å; M102-N106 PolarHBondContact O-N 3.46Å; M102-N106 VanDerWaalsContact O-N 3.08Å; M102-N106 PolarHBondContact O-ND2 3.38Å; M103-N106 PolarHBondContact O-N 3.44Å; N106-H110 WeakPolarHBondContact O-CB 3.49Å; N106-H110 PolarHBondContact O-N 3.1Å
107	V	97.1	Very high	96.3	Very high	1 Å²	1	67.4 Å²	67.4	1%	0.006	37%	0.374	C	S	.	.	H	α-helix	trans	-69.8	-39.5	179	172.3	0	0	0	0	110.8	I81 A82 M103 S104 S105 H110 S111 P118 V123	I81-V107 HydrophobicContact CG2-CB 4.36Å; I81-V107 HydrophobicContact CG2-CG1 4.43Å; I81-V107 HydrophobicContact CG2-CG2 4.16Å; A82-V107 HydrophobicContact CB-CG1 4.08Å; M103-V107 VanDerWaalsContact O-CB 3.31Å; M103-V107 WeakPolarHBondContact O-CB 3.5Å; M103-V107 WeakPolarHBondContact O-CG2 3.36Å; M103-V107 PolarHBondContact O-N 2.87Å; S104-V107 PolarHBondContact O-N 3.19Å; S105-V107 VanDerWaalsContact C-N 3.33Å; S105-V107 PolarHBondContact O-N 3.21Å; V107-H110 PolarHBondContact O-N 3.15Å; V107-S111 WeakPolarHBondContact O-CB 3.45Å; V107-S111 PolarHBondContact O-N 2.99Å; V107-P118 HydrophobicContact CG1-CB 3.55Å; V107-P118 HydrophobicContact CG1-CG 3.68Å; V107-V123 HydrophobicContact CG1-CG2 4.4Å; V107-V123 HydrophobicContact CG2-CG2 3.78Å
108	E	97.4	Very high	96.4	Very high	115 Å²	115	64.3 Å²	64.3	54%	0.537	36%	0.36	S	S	.	.	H	α-helix	trans	-62.1	-48.8	174.2	-176.8	173.2	-169	0	0	111.3	S104 S105 H110 S111 L112	S104-E108 WeakPolarHBondContact O-CB 3.43Å; S104-E108 PolarHBondContact O-N 3Å; S105-E108 PolarHBondContact O-N 3.13Å; E108-H110 VanDerWaalsContact C-N 3.28Å; E108-H110 PolarHBondContact O-N 3.32Å; E108-S111 PolarHBondContact O-N 2.88Å; E108-S111 VanDerWaalsContact O-N 3.13Å; E108-L112 HydrophobicContact CG-CD1 4.18Å; E108-L112 WeakPolarHBondContact O-CG 3.48Å; E108-L112 PolarHBondContact O-N 3.01Å
109	L	97.6	Very high	96.5	Very high	107 Å²	107	64.7 Å²	64.7	56%	0.56	36%	0.36	S	S	*	.	H	α-helix	trans	-57.2	-42.1	174.5	-72.5	174.6	0	0	0	112	S105 S113	S105-L109 WeakPolarHBondContact O-CG 3.24Å; S105-L109 PolarHBondContact O-N 3.4Å; L109-S113 WeakPolarHBondContact O-CB 3.16Å; L109-S113 PolarHBondContact O-N 2.85Å
110	H	97	Very high	96.6	Very high	78 Å²	78	64.7 Å²	64.7	36%	0.361	36%	0.36	S	S	.	.	H	α-helix	trans	-65.3	-41.6	176.7	-176.9	65.1	0	0	0	112.4	N106 V107 E108 S113 T114	N106-H110 WeakPolarHBondContact O-CB 3.49Å; N106-H110 PolarHBondContact O-N 3.1Å; V107-H110 PolarHBondContact O-N 3.15Å; E108-H110 VanDerWaalsContact C-N 3.28Å; E108-H110 PolarHBondContact O-N 3.32Å; H110-S113 PolarHBondContact O-N 3.32Å; H110-T114 WeakPolarHBondContact O-CB 3.41Å; H110-T114 WeakPolarHBondContact O-CG2 3.49Å; H110-T114 PolarHBondContact O-N 3.43Å; H110-T114 PolarHBondContact O-OG1 3Å
111	S	96.6	Very high	96.7	Very high	33 Å²	33	67.7 Å²	67.7	23%	0.231	38%	0.378	C	S	.	.	H	α-helix	trans	-66.5	-42.7	178.5	-172.8	0	0	0	0	111.6	V107 E108 S113 T114 G115 R116	V107-S111 WeakPolarHBondContact O-CB 3.45Å; V107-S111 PolarHBondContact O-N 2.99Å; E108-S111 PolarHBondContact O-N 2.88Å; E108-S111 VanDerWaalsContact O-N 3.13Å; S111-S113 VanDerWaalsContact C-N 3.35Å; S111-S113 PolarHBondContact O-N 3.21Å; S111-T114 PolarHBondContact O-N 3.14Å; S111-T114 PolarHBondContact O-OG1 2.91Å; S111-G115 WeakPolarHBondContact O-CA 3.41Å; S111-G115 PolarHBondContact O-N 3.4Å; S111-R116 PolarHBondContact O-N 3.36Å; S111-R116 PolarHBondContact OG-O 2.79Å
112	L	97.5	Very high	96.7	Very high	127 Å²	127	64.2 Å²	64.2	67%	0.665	36%	0.364	S	S	*	.	H	α-helix	trans	-62.2	-40.9	174.7	-70.1	173.2	0	0	0	112.1	E108	E108-L112 HydrophobicContact CG-CD1 4.18Å; E108-L112 WeakPolarHBondContact O-CG 3.48Å; E108-L112 PolarHBondContact O-N 3.01Å
113	S	97.8	Very high	96.8	Very high	105 Å²	105	61.4 Å²	61.4	73%	0.734	35%	0.35	S	S	*	.	H	α-helix	trans	-69.4	-39.1	178.6	177.1	0	0	0	0	112.9	L109 H110 S111	L109-S113 WeakPolarHBondContact O-CB 3.16Å; L109-S113 PolarHBondContact O-N 2.85Å; H110-S113 PolarHBondContact O-N 3.32Å; S111-S113 VanDerWaalsContact C-N 3.35Å; S111-S113 PolarHBondContact O-N 3.21Å
114	T	97.3	Very high	96.9	Very high	59 Å²	59	61.4 Å²	61.4	36%	0.362	35%	0.351	S	S	.	.	H	α-helix	trans	-85.4	-18.3	-178.3	56.2	0	0	0	0	113.3	H110 S111 R116	H110-T114 WeakPolarHBondContact O-CB 3.41Å; H110-T114 WeakPolarHBondContact O-CG2 3.49Å; H110-T114 PolarHBondContact O-N 3.43Å; H110-T114 PolarHBondContact O-OG1 3Å; S111-T114 PolarHBondContact O-N 3.14Å; S111-T114 PolarHBondContact O-OG1 2.91Å; T114-R116 PolarHBondContact O-N 2.89Å; T114-R116 PolarHBondContact OG1-N 3.15Å
115	G	96.8	Very high	96.9	Very high	69 Å²	69	67.7 Å²	67.7	71%	0.711	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.5	22.6	-171.8	0	0	0	0	0	113.1	S111	S111-G115 WeakPolarHBondContact O-CA 3.41Å; S111-G115 PolarHBondContact O-N 3.4Å
116	R	95.4	Very high	96.9	Very high	186 Å²	186	67.2 Å²	67.2	70%	0.702	36%	0.363	S	S	*	.	S	Bend	trans	-130.7	151.4	-173.8	-69.9	-178.4	-177	-173.5	0.6	111.5	S111 T114	S111-R116 PolarHBondContact O-N 3.36Å; S111-R116 PolarHBondContact OG-O 2.79Å; T114-R116 PolarHBondContact O-N 2.89Å; T114-R116 PolarHBondContact OG1-N 3.15Å
117	P	94.6	Very high	96.9	Very high	86 Å²	86	63.9 Å²	63.9	56%	0.558	35%	0.345	S	S	*	.	P	Polyproline II helix	trans	-63	139.8	173.6	26.5	-33.7	0	0	0	110.3
118	P	96.3	Very high	96.8	Very high	7 Å²	7	66.3 Å²	66.3	5%	0.045	36%	0.356	C	S	.	.	P	Polyproline II helix	trans	-71	147.4	-178.5	29.3	-33.8	0	0	0	111.7	A82 N84 I85 V107	A82-P118 HydrophobicContact CB-CG 3.49Å; A82-P118 VanDerWaalsContact CB-CG 3.49Å; N84-P118 PolarHBondContact ND2-O 3.34Å; N84-P118 VanDerWaalsContact ND2-O 3.13Å; I85-P118 HydrophobicContact CD1-CB 4.27Å; I85-P118 HydrophobicContact CD1-CG 4.11Å; V107-P118 HydrophobicContact CG1-CB 3.55Å; V107-P118 HydrophobicContact CG1-CG 3.68Å
119	L	97.2	Very high	96.8	Very high	63 Å²	63	65.7 Å²	65.7	33%	0.33	35%	0.353	S	S	.	.	P	Polyproline II helix	trans	-87.9	145.8	174	-56.3	178.1	0	0	0	110.6	V121 T122 D148 V149	L119-V121 HydrophobicContact CB-CG2 3.78Å; L119-V121 HydrophobicContact CD1-CG2 4.23Å; L119-V121 PolarHBondContact O-N 3.37Å; L119-T122 WeakPolarHBondContact O-CB 3.46Å; L119-T122 PolarHBondContact O-N 3.29Å; L119-D148 HydrophobicContact CD2-CB 3.94Å; L119-V149 HydrophobicContact CD2-CG2 3.93Å
120	V	97.4	Very high	96.6	Very high	0 Å²	0	61.4 Å²	61.4	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-61.3	-37.9	179.8	-171.8	0	0	0	0	110.9	I85 T122 V123 T124 V144 D148 H153 Y155	I85-V120 HydrophobicContact CD1-CG2 4.32Å; I85-V120 HydrophobicContact CG1-CG2 4.25Å; V120-T122 PolarHBondContact O-N 2.88Å; V120-V123 PolarHBondContact O-N 3.24Å; V120-T124 PolarHBondContact O-N 2.74Å; V120-T124 VanDerWaalsContact O-N 3.1Å; V120-T124 PolarHBondContact O-OG1 2.91Å; V120-V144 HydrophobicContact CG1-CG1 4.06Å; V120-D148 HydrophobicContact CG2-CB 4.32Å; V120-D148 PolarHBondContact N-OD2 3.47Å; V120-H153 HydrophobicContact CB-CB 4.17Å; V120-H153 HydrophobicContact CG1-CB 4.16Å; V120-H153 HydrophobicContact CG2-CB 4.34Å; V120-Y155 HydrophobicContact CB-CE2 4.37Å; V120-Y155 HydrophobicContact CG1-CD2 3.74Å; V120-Y155 HydrophobicContact CG1-CE2 3.82Å
121	V	97.4	Very high	96.5	Very high	65 Å²	65	57.7 Å²	57.7	39%	0.394	31%	0.313	S	S	.	.	H	α-helix	trans	-59.8	-30.9	177.5	-63.9	0	0	0	0	113.5	L119 R125 Y155	L119-V121 HydrophobicContact CB-CG2 3.78Å; L119-V121 HydrophobicContact CD1-CG2 4.23Å; L119-V121 PolarHBondContact O-N 3.37Å; V121-R125 WeakPolarHBondContact O-CB 3.36Å; V121-R125 PolarHBondContact O-N 3.14Å; V121-Y155 WeakPolarHBondContact CG1-OH 3.21Å
122	T	97.1	Very high	96.5	Very high	35 Å²	35	62.3 Å²	62.3	22%	0.215	33%	0.329	C	S	.	.	H	α-helix	trans	-68.3	-43.8	179.1	-61.5	0	0	0	0	110.2	L119 V120 R125 Q126	L119-T122 WeakPolarHBondContact O-CB 3.46Å; L119-T122 PolarHBondContact O-N 3.29Å; V120-T122 PolarHBondContact O-N 2.88Å; T122-R125 PolarHBondContact O-N 3.37Å; T122-Q126 WeakPolarHBondContact O-CG 3.07Å; T122-Q126 PolarHBondContact O-N 3.13Å; T122-Q126 VanDerWaalsContact O-N 3.08Å
123	V	97.3	Very high	96.2	Very high	0 Å²	0	63.8 Å²	63.8	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-62.9	-52	177.2	-175.1	0	0	0	0	110.4	I81 I85 V107 V120 R125 Q126 L127 V144	I81-V123 HydrophobicContact CG2-CG1 3.96Å; I81-V123 HydrophobicContact CG2-CG2 4.07Å; I85-V123 HydrophobicContact CD1-CG2 3.64Å; I85-V123 HydrophobicContact CG2-CG2 4.31Å; V107-V123 HydrophobicContact CG1-CG2 4.4Å; V107-V123 HydrophobicContact CG2-CG2 3.78Å; V120-V123 PolarHBondContact O-N 3.24Å; V123-R125 VanDerWaalsContact C-N 3.28Å; V123-R125 PolarHBondContact O-N 2.86Å; V123-Q126 PolarHBondContact O-N 2.7Å; V123-L127 HydrophobicContact CG1-CD1 4.02Å; V123-L127 WeakPolarHBondContact O-CB 3.46Å; V123-L127 PolarHBondContact O-N 2.89Å; V123-V144 HydrophobicContact CB-CG1 4.45Å; V123-V144 HydrophobicContact CG1-CG1 4.14Å
124	T	97.1	Very high	95.9	Very high	4 Å²	4	60.1 Å²	60.1	3%	0.025	30%	0.296	C	S	.	.	H	α-helix	trans	-59.6	-39.1	179.5	-55.4	0	0	0	0	111.8	V120 K128 Y155 V157 Y163	V120-T124 PolarHBondContact O-N 2.74Å; V120-T124 VanDerWaalsContact O-N 3.1Å; V120-T124 PolarHBondContact O-OG1 2.91Å; T124-K128 WeakPolarHBondContact O-CG 3.33Å; T124-K128 PolarHBondContact O-N 2.8Å; T124-Y155 HydrophobicContact CG2-CD1 4.02Å; T124-Y155 HydrophobicContact CG2-CG 3.94Å; T124-Y155 WeakPolarHBondContact OG1-CD2 3.37Å; T124-V157 HydrophobicContact CG2-CG2 3.92Å; T124-Y163 HydrophobicContact CG2-CD2 4.1Å; T124-Y163 HydrophobicContact CG2-CG 4.32Å
125	R	97.6	Very high	95.5	Very high	151 Å²	151	63 Å²	63	57%	0.57	31%	0.305	S	S	*	.	H	α-helix	trans	-65	-44.6	177.6	-178.5	177.5	178.7	120.1	-1.8	112.3	V121 T122 V123 K128 Q129	V121-R125 WeakPolarHBondContact O-CB 3.36Å; V121-R125 PolarHBondContact O-N 3.14Å; T122-R125 PolarHBondContact O-N 3.37Å; V123-R125 VanDerWaalsContact C-N 3.28Å; V123-R125 PolarHBondContact O-N 2.86Å; R125-K128 VanDerWaalsContact O-CG 3.3Å; R125-K128 WeakPolarHBondContact O-CG 3.49Å; R125-Q129 WeakPolarHBondContact O-CB 3.31Å; R125-Q129 VanDerWaalsContact O-CG 3.3Å; R125-Q129 WeakPolarHBondContact O-CG 3.33Å; R125-Q129 PolarHBondContact O-N 2.69Å
126	Q	96.4	Very high	95.1	Very high	50 Å²	50	60.5 Å²	60.5	23%	0.234	28%	0.28	C	S	.	.	H	α-helix	trans	-66.4	-43.7	178.7	-71.7	-173.6	55.4	0	0	111.1	M103 T122 V123 Q129 M130	M103-Q126 HydrophobicContact SD-CB 3.68Å; T122-Q126 WeakPolarHBondContact O-CG 3.07Å; T122-Q126 PolarHBondContact O-N 3.13Å; T122-Q126 VanDerWaalsContact O-N 3.08Å; V123-Q126 PolarHBondContact O-N 2.7Å; Q126-Q129 PolarHBondContact O-N 3.45Å; Q126-M130 WeakPolarHBondContact O-CB 3.39Å; Q126-M130 PolarHBondContact O-N 3.37Å
127	L	96.3	Very high	94.9	Very high	1 Å²	1	55.9 Å²	55.9	1%	0.005	27%	0.266	C	S	.	.	H	α-helix	trans	-57.3	-53.1	176.2	-82.9	172	0	0	0	112.3	T99 M103 V123 Q129 M130 L131 L142 V144 V157	T99-L127 HydrophobicContact CG2-CD2 3.5Å; T99-L127 VanDerWaalsContact CG2-CD2 3.5Å; M103-L127 HydrophobicContact CG-CD2 3.32Å; M103-L127 HydrophobicContact CG-CG 3.66Å; M103-L127 HydrophobicContact SD-CD2 3.97Å; M103-L127 HydrophobicContact SD-CG 3.94Å; V123-L127 HydrophobicContact CG1-CD1 4.02Å; V123-L127 WeakPolarHBondContact O-CB 3.46Å; V123-L127 PolarHBondContact O-N 2.89Å; L127-Q129 VanDerWaalsContact C-N 3.29Å; L127-Q129 PolarHBondContact O-N 3.44Å; L127-M130 PolarHBondContact O-N 2.95Å; L127-L131 WeakPolarHBondContact O-CB 3.5Å; L127-L131 WeakPolarHBondContact O-CG 3.12Å; L127-L131 PolarHBondContact O-N 3.18Å; L127-L142 HydrophobicContact CD1-CD1 3.88Å; L127-L142 HydrophobicContact CD2-CD1 3.49Å; L127-L142 VanDerWaalsContact CD2-CD1 3.49Å; L127-L142 HydrophobicContact CG-CD1 4.29Å; L127-V144 HydrophobicContact CD1-CG2 3.55Å; L127-V157 HydrophobicContact CB-CG1 4.46Å
128	K	95.8	Very high	94.8	Very high	52 Å²	52	51.8 Å²	51.8	23%	0.226	24%	0.239	C	C	.	.	H	α-helix	trans	-61.9	-38.5	-177.9	74.5	173.9	-174	166.8	0	112.3	T124 R125 F132 V157 G161 Y163	T124-K128 WeakPolarHBondContact O-CG 3.33Å; T124-K128 PolarHBondContact O-N 2.8Å; R125-K128 VanDerWaalsContact O-CG 3.3Å; R125-K128 WeakPolarHBondContact O-CG 3.49Å; K128-F132 WeakPolarHBondContact O-CB 3.1Å; K128-F132 PolarHBondContact O-N 3.23Å; K128-V157 HydrophobicContact CB-CG1 4.34Å; K128-G161 WeakPolarHBondContact CB-O 3.42Å; K128-Y163 HydrophobicContact CB-CD1 4.46Å; K128-Y163 HydrophobicContact CD-CD1 3.39Å; K128-Y163 HydrophobicContact CD-CE1 3.43Å; K128-Y163 VanDerWaalsContact CD-CE1 3.43Å; K128-Y163 HydrophobicContact CD-CG 4.23Å; K128-Y163 PolarHBondContact NZ-OH 2.98Å
129	Q	95.9	Very high	94.5	Very high	102 Å²	102	52.4 Å²	52.4	48%	0.477	25%	0.247	S	C	.	.	H	α-helix	trans	-68.2	-41.1	179.2	-75	-179.1	-24.8	0	0	111.3	R125 Q126 L127 R133	R125-Q129 WeakPolarHBondContact O-CB 3.31Å; R125-Q129 VanDerWaalsContact O-CG 3.3Å; R125-Q129 WeakPolarHBondContact O-CG 3.33Å; R125-Q129 PolarHBondContact O-N 2.69Å; Q126-Q129 PolarHBondContact O-N 3.45Å; L127-Q129 VanDerWaalsContact C-N 3.29Å; L127-Q129 PolarHBondContact O-N 3.44Å; Q129-R133 WeakPolarHBondContact O-CB 3.33Å; Q129-R133 PolarHBondContact O-N 3.3Å
130	M	94.3	Very high	94.3	Very high	17 Å²	17	49.4 Å²	49.4	8%	0.084	23%	0.231	C	C	.	.	H	α-helix	trans	-63.7	-51.4	175.6	178.4	177.3	168.6	0	0	111.4	F15 T99 M102 M103 Q126 L127 F132 R133 Y134 I138	F15-M130 HydrophobicContact CD2-CE 3.48Å; F15-M130 VanDerWaalsContact CD2-CE 3.48Å; F15-M130 HydrophobicContact CE2-CE 3.37Å; F15-M130 HydrophobicContact CZ-CE 4.5Å; T99-M130 HydrophobicContact CG2-CE 4.38Å; T99-M130 HydrophobicContact CG2-SD 4.33Å; M102-M130 HydrophobicContact SD-CE 3.76Å; M103-M130 HydrophobicContact CE-CB 4.3Å; M103-M130 HydrophobicContact CE-CG 4.49Å; M103-M130 HydrophobicContact CE-SD 3.32Å; M103-M130 WeakPolarHBondContact CE-SD 3.35Å; Q126-M130 WeakPolarHBondContact O-CB 3.39Å; Q126-M130 PolarHBondContact O-N 3.37Å; L127-M130 PolarHBondContact O-N 2.95Å; M130-F132 PolarHBondContact O-N 3.31Å; M130-R133 WeakPolarHBondContact O-CB 3.27Å; M130-R133 PolarHBondContact O-N 3.1Å; M130-Y134 HydrophobicContact CE-CE2 4.23Å; M130-Y134 HydrophobicContact CG-CD2 4.17Å; M130-Y134 HydrophobicContact CG-CE2 4Å; M130-Y134 WeakPolarHBondContact O-CD2 3.29Å; M130-Y134 PolarHBondContact O-N 3.08Å; M130-I138 HydrophobicContact CE-CD1 3.96Å
131	L	95.1	Very high	94.2	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-63.2	-42.1	-178.8	-69	176.5	0	0	0	111.7	L127 R133 Y134 Q135 I138 V157	L127-L131 WeakPolarHBondContact O-CB 3.5Å; L127-L131 WeakPolarHBondContact O-CG 3.12Å; L127-L131 PolarHBondContact O-N 3.18Å; L131-R133 VanDerWaalsContact C-N 3.35Å; L131-R133 PolarHBondContact O-N 3.08Å; L131-Y134 CarbonylContact O-C 3.53Å; L131-Y134 PolarHBondContact O-N 3.27Å; L131-Q135 PolarHBondContact O-N 3.18Å; L131-I138 HydrophobicContact CD2-CB 3.83Å; L131-I138 HydrophobicContact CD2-CD1 4.47Å; L131-I138 HydrophobicContact CD2-CG2 3.61Å; L131-V157 HydrophobicContact CD1-CG1 3.69Å
132	F	95.2	Very high	94.2	Very high	129 Å²	129	47.4 Å²	47.4	57%	0.566	22%	0.22	S	C	*	.	H	α-helix	trans	-63	-38.9	174.4	-174.3	-104.8	0	0	0	112.2	K128 M130 Y134 Q135 H160	K128-F132 WeakPolarHBondContact O-CB 3.1Å; K128-F132 PolarHBondContact O-N 3.23Å; M130-F132 PolarHBondContact O-N 3.31Å; F132-Y134 PolarHBondContact O-N 2.85Å; F132-Q135 PolarHBondContact O-N 2.92Å; F132-Q135 PolarHBondContact O-NE2 3.01Å; F132-H160 WeakPolarHBondContact CD2-O 3.13Å
133	R	92.4	Very high	94.3	Very high	158 Å²	158	45.7 Å²	45.7	60%	0.596	21%	0.21	S	C	*	.	H	α-helix	trans	-56.6	-34.6	175.7	-177.3	176.3	71.5	-174.7	4.6	112.3	Q129 M130 L131 Q135	Q129-R133 WeakPolarHBondContact O-CB 3.33Å; Q129-R133 PolarHBondContact O-N 3.3Å; M130-R133 WeakPolarHBondContact O-CB 3.27Å; M130-R133 PolarHBondContact O-N 3.1Å; L131-R133 VanDerWaalsContact C-N 3.35Å; L131-R133 PolarHBondContact O-N 3.08Å; R133-Q135 VanDerWaalsContact C-N 3.35Å
134	Y	90.7	Very high	94.3	Very high	28 Å²	28	45.7 Å²	45.7	11%	0.11	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.3	9.3	178.2	-65.5	-66.7	0	0	0	114	F15 F17 M130 L131 F132 G136 H137 I138	F15-Y134 HydrophobicContact CB-CE1 3.81Å; F15-Y134 HydrophobicContact CB-CE2 4.05Å; F15-Y134 HydrophobicContact CD2-CE2 4.46Å; F15-Y134 WeakPolarHBondContact O-CE1 3.36Å; F15-Y134 PolarHBondContact O-OH 2.7Å; F17-Y134 AromaticContact CD2-CD1 3.26Å; F17-Y134 HydrophobicContact CD2-CD1 3.26Å; F17-Y134 AromaticContact CD2-CE1 3.71Å; F17-Y134 HydrophobicContact CD2-CE1 3.71Å; F17-Y134 HydrophobicContact CD2-CG 4.04Å; F17-Y134 AromaticContact CE2-CD1 3.53Å; F17-Y134 HydrophobicContact CE2-CD1 3.53Å; F17-Y134 HydrophobicContact CE2-CE1 4.02Å; F17-Y134 AromaticContact CE2-CG 3.88Å; F17-Y134 HydrophobicContact CE2-CG 3.88Å; F17-Y134 HydrophobicContact CG-CD1 4.44Å; M130-Y134 HydrophobicContact CE-CE2 4.23Å; M130-Y134 HydrophobicContact CG-CD2 4.17Å; M130-Y134 HydrophobicContact CG-CE2 4Å; M130-Y134 WeakPolarHBondContact O-CD2 3.29Å; M130-Y134 PolarHBondContact O-N 3.08Å; L131-Y134 CarbonylContact O-C 3.53Å; L131-Y134 PolarHBondContact O-N 3.27Å; F132-Y134 PolarHBondContact O-N 2.85Å; Y134-G136 PolarHBondContact O-N 2.8Å; Y134-H137 WeakPolarHBondContact O-CB 3.24Å; Y134-H137 PolarHBondContact O-CD2 2.63Å; Y134-H137 PolarHBondContact O-N 3.42Å; Y134-I138 HydrophobicContact CD2-CD1 3.25Å; Y134-I138 HydrophobicContact CD2-CG1 4.09Å; Y134-I138 HydrophobicContact CE2-CD1 3.78Å; Y134-I138 HydrophobicContact CG-CD1 3.78Å; Y134-I138 HydrophobicContact CG-CG1 4.11Å
135	Q	89.9	Confident	94.4	Very high	120 Å²	120	45.5 Å²	45.5	56%	0.561	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.6	30.6	171.1	-58.4	-69.1	-64.1	0	0	113.9	L131 F132 R133	L131-Q135 PolarHBondContact O-N 3.18Å; F132-Q135 PolarHBondContact O-N 2.92Å; F132-Q135 PolarHBondContact O-NE2 3.01Å; R133-Q135 VanDerWaalsContact C-N 3.35Å
136	G	88.6	Confident	94.4	Very high	17 Å²	17	38.3 Å²	38.3	18%	0.175	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	82.2	7.4	-178.9	0	0	0	0	0	116.2	Y134 I138 P159	Y134-G136 PolarHBondContact O-N 2.8Å; G136-I138 VanDerWaalsContact C-N 3.27Å; G136-I138 PolarHBondContact O-N 3.27Å; G136-P159 WeakPolarHBondContact CA-O 3.45Å
137	H	89.8	Confident	94.5	Very high	89 Å²	89	36.6 Å²	36.6	41%	0.412	17%	0.174	S	C	.	.			trans	-69	-27.3	173	-64.9	-52.4	0	0	0	113.1	F17 T20 Y134 G139	F17-H137 HydrophobicContact CD1-CB 3.51Å; F17-H137 HydrophobicContact CD2-CB 4.28Å; F17-H137 HydrophobicContact CE1-CB 3.38Å; F17-H137 HydrophobicContact CE2-CB 4.1Å; F17-H137 HydrophobicContact CG-CB 3.97Å; F17-H137 HydrophobicContact CZ-CB 3.67Å; T20-H137 WeakPolarHBondContact CG2-CE1 3.32Å; Y134-H137 WeakPolarHBondContact O-CB 3.24Å; Y134-H137 PolarHBondContact O-CD2 2.63Å; Y134-H137 PolarHBondContact O-N 3.42Å; H137-G139 PolarHBondContact O-N 2.91Å
138	I	92.5	Very high	94.5	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	18%	0.178	C	C	.	.	S	Bend	trans	-79.5	107.1	167.8	-59.6	-176.8	0	0	0	107.4	F15 F17 D95 M130 L131 Y134 G136 S140 P159	F15-I138 HydrophobicContact CB-CD1 4.29Å; F15-I138 HydrophobicContact CD1-CD1 3.77Å; F15-I138 HydrophobicContact CD1-CG1 3.88Å; F15-I138 HydrophobicContact CD2-CD1 3.66Å; F15-I138 HydrophobicContact CE1-CD1 3.91Å; F15-I138 HydrophobicContact CE1-CG1 3.99Å; F15-I138 HydrophobicContact CE1-CG2 4.41Å; F15-I138 HydrophobicContact CE2-CD1 3.81Å; F15-I138 HydrophobicContact CG-CD1 3.64Å; F15-I138 HydrophobicContact CG-CG1 4.22Å; F15-I138 HydrophobicContact CZ-CD1 3.92Å; F15-I138 HydrophobicContact CZ-CG1 4.42Å; F15-I138 HydrophobicContact CZ-CG2 4.39Å; F17-I138 HydrophobicContact CE2-CD1 4.34Å; F17-I138 HydrophobicContact CE2-CG1 3.7Å; F17-I138 HydrophobicContact CZ-CG1 3.75Å; D95-I138 HydrophobicContact CB-CG2 3.76Å; M130-I138 HydrophobicContact CE-CD1 3.96Å; L131-I138 HydrophobicContact CD2-CB 3.83Å; L131-I138 HydrophobicContact CD2-CD1 4.47Å; L131-I138 HydrophobicContact CD2-CG2 3.61Å; Y134-I138 HydrophobicContact CD2-CD1 3.25Å; Y134-I138 HydrophobicContact CD2-CG1 4.09Å; Y134-I138 HydrophobicContact CE2-CD1 3.78Å; Y134-I138 HydrophobicContact CG-CD1 3.78Å; Y134-I138 HydrophobicContact CG-CG1 4.11Å; G136-I138 VanDerWaalsContact C-N 3.27Å; G136-I138 PolarHBondContact O-N 3.27Å; I138-S140 PolarHBondContact O-N 2.8Å; I138-P159 WeakPolarHBondContact O-CB 3.26Å
139	G	91.3	Very high	94.5	Very high	20 Å²	20	40.6 Å²	40.6	21%	0.206	20%	0.202	C	C	.	.			trans	-81.5	35.2	-173.8	0	0	0	0	0	114.3	V92 D95 H137	V92-G139 PolarHBondContact N-O 2.81Å; D95-G139 PolarHBondContact OD2-N 2.54Å; H137-G139 PolarHBondContact O-N 2.91Å
140	S	92.1	Very high	94.4	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	122	-175.9	179.7	0	0	0	0	111.5	A96 I138 L142	A96-S140 VanDerWaalsContact CA-OG 3.32Å; A96-S140 WeakPolarHBondContact CA-OG 3.28Å; A96-S140 WeakPolarHBondContact CB-OG 3.41Å; I138-S140 PolarHBondContact O-N 2.8Å; S140-L142 WeakPolarHBondContact OG-CD2 3.39Å; S140-L142 WeakPolarHBondContact OG-CG 3.4Å
141	S	95.8	Very high	94.5	Very high	22 Å²	22	41.2 Å²	41.2	15%	0.154	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	121.4	171.8	-79.2	0	0	0	0	108.4	A90 P159	A90-S141 PolarHBondContact N-O 3.04Å; A90-S141 PolarHBondContact O-N 2.77Å; S141-P159 WeakPolarHBondContact OG-CD 3.42Å
142	L	97.7	Very high	94.7	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	141.6	-169.8	-60.5	176.7	0	0	0	111.8	C88 A96 T99 T100 L127 S140 S156 V157	C88-L142 VanDerWaalsContact O-CA 3.32Å; C88-L142 WeakPolarHBondContact O-CA 3.44Å; A96-L142 HydrophobicContact CB-CD2 4.28Å; T99-L142 HydrophobicContact CG2-CD1 4.2Å; T100-L142 HydrophobicContact CG2-CD2 4.14Å; L127-L142 HydrophobicContact CD1-CD1 3.88Å; L127-L142 HydrophobicContact CD2-CD1 3.49Å; L127-L142 VanDerWaalsContact CD2-CD1 3.49Å; L127-L142 HydrophobicContact CG-CD1 4.29Å; S140-L142 WeakPolarHBondContact OG-CD2 3.39Å; S140-L142 WeakPolarHBondContact OG-CG 3.4Å; L142-S156 CarbonylContact O-C 3.55Å; L142-S156 WeakPolarHBondContact O-CA 3.22Å; L142-V157 HydrophobicContact CB-CB 4.42Å; L142-V157 PolarHBondContact N-O 3.42Å; L142-V157 PolarHBondContact O-N 2.82Å
143	I	98.4	Very high	94.8	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	116.5	163.3	-61.1	176.2	0	0	0	107.5	I47 L58 C87 C88 L154 Y155 L169 M171	I47-I143 HydrophobicContact CB-CD1 4.45Å; I47-I143 HydrophobicContact CD1-CB 4.42Å; I47-I143 HydrophobicContact CD1-CD1 3.93Å; I47-I143 HydrophobicContact CD1-CG1 3.92Å; I47-I143 HydrophobicContact CG1-CD1 3.83Å; I47-I143 HydrophobicContact CG1-CG1 4.39Å; L58-I143 HydrophobicContact CD2-CG2 3.87Å; C87-I143 CarbonylContact C-O 3.51Å; C87-I143 VanDerWaalsContact CA-O 3.29Å; C87-I143 WeakPolarHBondContact CA-O 3.19Å; C88-I143 HydrophobicContact CB-CB 4.22Å; C88-I143 PolarHBondContact N-O 3.15Å; C88-I143 PolarHBondContact O-N 2.97Å; I143-L154 HydrophobicContact CG2-CD1 3.73Å; I143-L154 HydrophobicContact CG2-CG 4.4Å; I143-Y155 CarbonylContact C-O 3.57Å; I143-Y155 WeakPolarHBondContact CA-O 3.21Å; I143-L169 HydrophobicContact CD1-CB 4.07Å; I143-L169 HydrophobicContact CG1-CB 4.47Å; I143-L169 HydrophobicContact CG2-CB 4.5Å; I143-L169 HydrophobicContact CG2-CD1 4.2Å; I143-M171 HydrophobicContact CD1-CB 4.08Å; I143-M171 HydrophobicContact CD1-CG 3.83Å; I143-M171 HydrophobicContact CG1-CB 4.25Å; I143-M171 HydrophobicContact CG1-CG 3.7Å
144	V	98.4	Very high	95.1	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	121.1	178.3	-175.3	0	0	0	0	108.6	I85 V120 V123 L127 L154 Y155 V157	I85-V144 HydrophobicContact CG2-CG1 3.89Å; V120-V144 HydrophobicContact CG1-CG1 4.06Å; V123-V144 HydrophobicContact CB-CG1 4.45Å; V123-V144 HydrophobicContact CG1-CG1 4.14Å; L127-V144 HydrophobicContact CD1-CG2 3.55Å; V144-L154 WeakPolarHBondContact O-CA 3.35Å; V144-Y155 PolarHBondContact N-O 3.01Å; V144-Y155 PolarHBondContact O-N 3.08Å; V144-V157 HydrophobicContact CG2-CG2 4.5Å
145	G	98.3	Very high	95.5	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	136.5	177.1	0	0	0	0	0	110.8	Y86 I222	Y86-G145 PolarHBondContact N-O 2.83Å; Y86-G145 PolarHBondContact O-N 3.4Å; G145-I222 WeakPolarHBondContact O-CD1 2.95Å
146	G	98.1	Very high	95.8	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-163.9	168.4	174.1	0	0	0	0	0	113	N84 H153	N84-G146 WeakPolarHBondContact O-CA 3.39Å; G146-H153 PolarHBondContact N-O 2.93Å; G146-H153 VanDerWaalsContact N-O 3.07Å; G146-H153 PolarHBondContact O-N 3.46Å
147	V	98	Very high	96.3	Very high	14 Å²	14	22.8 Å²	22.8	9%	0.085	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	122.8	172.4	-178.6	0	0	0	0	107.9	N84 A152 I222 Q224	N84-V147 WeakPolarHBondContact CB-O 3.38Å; N84-V147 PolarHBondContact ND2-O 3.45Å; N84-V147 PolarHBondContact O-N 3.48Å; N84-V147 VanDerWaalsContact O-N 3.13Å; V147-A152 HydrophobicContact CG2-CB 4.3Å; V147-I222 HydrophobicContact CB-CG2 4.33Å; V147-I222 HydrophobicContact CG2-CG2 3.93Å; V147-I222 WeakPolarHBondContact CG2-O 3.29Å; V147-Q224 HydrophobicContact CG1-CB 4.32Å
148	D	96.1	Very high	96.6	Very high	17 Å²	17	22.4 Å²	22.4	9%	0.091	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	-175.9	175.7	67.6	31.5	0	0	0	111.4	L119 V120 T150 G151 H153	L119-D148 HydrophobicContact CD2-CB 3.94Å; V120-D148 HydrophobicContact CG2-CB 4.32Å; V120-D148 PolarHBondContact N-OD2 3.47Å; D148-T150 PolarHBondContact O-N 3.4Å; D148-T150 VanDerWaalsContact O-N 3.08Å; D148-T150 WeakPolarHBondContact OD1-CA 3.42Å; D148-T150 WeakPolarHBondContact OD1-CB 3.21Å; D148-T150 PolarHBondContact OD1-N 3.1Å; D148-T150 PolarHBondContact OD1-OG1 3.23Å; D148-G151 PolarHBondContact N-O 3.06Å; D148-G151 PolarHBondContact O-N 3.5Å; D148-G151 PolarHBondContact OD1-N 2.96Å; D148-H153 IonicContact OD1-CD2 3.74Å; D148-H153 PolarHBondContact OD1-CD2 3.14Å; D148-H153 IonicContact OD1-NE2 2.91Å; D148-H153 PolarHBondContact OD1-NE2 3.32Å; D148-H153 IonicContact OD2-CD2 3.37Å; D148-H153 PolarHBondContact OD2-CD2 3.46Å; D148-H153 VanDerWaalsContact OD2-CD2 3.3Å; D148-H153 IonicContact OD2-NE2 2.69Å; D148-H153 PolarHBondContact OD2-NE2 3.35Å
149	V	95.6	Very high	96.8	Very high	120 Å²	120	23.4 Å²	23.4	73%	0.727	15%	0.145	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-18.5	-178.7	-60.6	0	0	0	0	113.7	L119	L119-V149 HydrophobicContact CD2-CG2 3.93Å
150	T	95.3	Very high	96.9	Very high	103 Å²	103	28.4 Å²	28.4	63%	0.632	16%	0.163	S	C	*	.	T	Hydrogen-bonded Turn	trans	-96.5	-7.1	177.2	66.3	0	0	0	0	112.9	D148 H153	D148-T150 PolarHBondContact O-N 3.4Å; D148-T150 VanDerWaalsContact O-N 3.08Å; D148-T150 WeakPolarHBondContact OD1-CA 3.42Å; D148-T150 WeakPolarHBondContact OD1-CB 3.21Å; D148-T150 PolarHBondContact OD1-N 3.1Å; D148-T150 PolarHBondContact OD1-OG1 3.23Å; T150-H153 PolarHBondContact OG1-CE1 3.29Å; T150-H153 PolarHBondContact OG1-NE2 2.76Å
151	G	96.3	Very high	97	Very high	29 Å²	29	29 Å²	29	30%	0.299	17%	0.169	S	C	.	.	E	Extended strand (participates in β ladder)	trans	124.8	-161.3	175.5	0	0	0	0	0	113.5	D148 H153	D148-G151 PolarHBondContact N-O 3.06Å; D148-G151 PolarHBondContact O-N 3.5Å; D148-G151 PolarHBondContact OD1-N 2.96Å; G151-H153 PolarHBondContact O-CD2 3.37Å; G151-H153 VanDerWaalsContact O-CD2 3.27Å; G151-H153 PolarHBondContact O-NE2 3.32Å
152	A	97.6	Very high	97	Very high	30 Å²	30	30.9 Å²	30.9	25%	0.248	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	130.4	178.7	0	0	0	0	0	111.1	V51 V56 V147	V51-A152 HydrophobicContact CG1-CB 3.87Å; V56-A152 HydrophobicContact CG1-CB 3.81Å; V147-A152 HydrophobicContact CG2-CB 4.3Å
153	H	98.1	Very high	97	Very high	15 Å²	15	35.8 Å²	35.8	7%	0.069	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	141.1	176	-50.8	-78.5	0	0	0	111.5	V120 G146 D148 T150 G151 Y155 K165	V120-H153 HydrophobicContact CB-CB 4.17Å; V120-H153 HydrophobicContact CG1-CB 4.16Å; V120-H153 HydrophobicContact CG2-CB 4.34Å; G146-H153 PolarHBondContact N-O 2.93Å; G146-H153 VanDerWaalsContact N-O 3.07Å; G146-H153 PolarHBondContact O-N 3.46Å; D148-H153 IonicContact OD1-CD2 3.74Å; D148-H153 PolarHBondContact OD1-CD2 3.14Å; D148-H153 IonicContact OD1-NE2 2.91Å; D148-H153 PolarHBondContact OD1-NE2 3.32Å; D148-H153 IonicContact OD2-CD2 3.37Å; D148-H153 PolarHBondContact OD2-CD2 3.46Å; D148-H153 VanDerWaalsContact OD2-CD2 3.3Å; D148-H153 IonicContact OD2-NE2 2.69Å; D148-H153 PolarHBondContact OD2-NE2 3.35Å; T150-H153 PolarHBondContact OG1-CE1 3.29Å; T150-H153 PolarHBondContact OG1-NE2 2.76Å; G151-H153 PolarHBondContact O-CD2 3.37Å; G151-H153 VanDerWaalsContact O-CD2 3.27Å; G151-H153 PolarHBondContact O-NE2 3.32Å; H153-Y155 HydrophobicContact CB-CD2 4.23Å; H153-Y155 HydrophobicContact CB-CE2 3.57Å; H153-K165 WeakPolarHBondContact ND1-CE 3.36Å; H153-K165 PolarHBondContact ND1-NZ 2.83Å
154	L	98.4	Very high	97	Very high	1 Å²	1	39.2 Å²	39.2	1%	0.005	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	126.7	178.5	-172	72.8	0	0	0	109	G49 V51 L58 I143 V144 L166 L169	G49-L154 VanDerWaalsContact C-CD2 3.45Å; G49-L154 WeakPolarHBondContact O-CD2 3.46Å; V51-L154 HydrophobicContact CG2-CB 3.6Å; V51-L154 HydrophobicContact CG2-CD2 4.36Å; L58-L154 HydrophobicContact CD2-CD1 3.61Å; I143-L154 HydrophobicContact CG2-CD1 3.73Å; I143-L154 HydrophobicContact CG2-CG 4.4Å; V144-L154 WeakPolarHBondContact O-CA 3.35Å; L154-L166 PolarHBondContact O-N 3.37Å; L154-L169 HydrophobicContact CD2-CB 4.26Å; L154-L169 HydrophobicContact CD2-CD1 4.08Å; L154-L169 HydrophobicContact CD2-CG 4.1Å; L154-L169 HydrophobicContact CG-CD1 3.83Å; L154-L169 HydrophobicContact CG-CG 4.4Å
155	Y	98.6	Very high	97	Very high	18 Å²	18	44.7 Å²	44.7	7%	0.071	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	141.4	-176.7	-66.6	-84.4	0	0	0	111.5	V120 V121 T124 I143 V144 H153 Y163 D164 K165	V120-Y155 HydrophobicContact CB-CE2 4.37Å; V120-Y155 HydrophobicContact CG1-CD2 3.74Å; V120-Y155 HydrophobicContact CG1-CE2 3.82Å; V121-Y155 WeakPolarHBondContact CG1-OH 3.21Å; T124-Y155 HydrophobicContact CG2-CD1 4.02Å; T124-Y155 HydrophobicContact CG2-CG 3.94Å; T124-Y155 WeakPolarHBondContact OG1-CD2 3.37Å; I143-Y155 CarbonylContact C-O 3.57Å; I143-Y155 WeakPolarHBondContact CA-O 3.21Å; V144-Y155 PolarHBondContact N-O 3.01Å; V144-Y155 PolarHBondContact O-N 3.08Å; H153-Y155 HydrophobicContact CB-CD2 4.23Å; H153-Y155 HydrophobicContact CB-CE2 3.57Å; Y155-Y163 HydrophobicContact CD1-CD2 4.29Å; Y155-D164 VanDerWaalsContact CA-O 3.25Å; Y155-D164 WeakPolarHBondContact CA-O 3.07Å; Y155-K165 HydrophobicContact CD1-CB 3.81Å; Y155-K165 HydrophobicContact CD1-CG 4.13Å; Y155-K165 HydrophobicContact CE1-CB 3.57Å; Y155-K165 HydrophobicContact CE1-CD 3.88Å; Y155-K165 HydrophobicContact CE1-CG 3.7Å
156	S	97.8	Very high	97	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	142.6	162.6	50	0	0	0	0	108.6	L142 Y163 D164	L142-S156 CarbonylContact O-C 3.55Å; L142-S156 WeakPolarHBondContact O-CA 3.22Å; S156-Y163 WeakPolarHBondContact O-CA 3.28Å; S156-Y163 WeakPolarHBondContact O-CB 3.26Å; S156-D164 PolarHBondContact N-O 3.47Å; S156-D164 PolarHBondContact O-N 3.01Å; S156-D164 VanDerWaalsContact O-N 3.15Å; S156-D164 WeakPolarHBondContact OG-CB 3.47Å; S156-D164 PolarHBondContact OG-N 3.46Å
157	V	97.9	Very high	96.9	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	118.1	170.1	-168.7	0	0	0	0	108.1	T124 L127 K128 L131 L142 V144 S162	T124-V157 HydrophobicContact CG2-CG2 3.92Å; L127-V157 HydrophobicContact CB-CG1 4.46Å; K128-V157 HydrophobicContact CB-CG1 4.34Å; L131-V157 HydrophobicContact CD1-CG1 3.69Å; L142-V157 HydrophobicContact CB-CB 4.42Å; L142-V157 PolarHBondContact N-O 3.42Å; L142-V157 PolarHBondContact O-N 2.82Å; V144-V157 HydrophobicContact CG2-CG2 4.5Å; V157-S162 WeakPolarHBondContact CA-O 3.47Å
158	Y	96.9	Very high	96.9	Very high	81 Å²	81	52.1 Å²	52.1	32%	0.318	28%	0.284	S	S	.	.			trans	-88.6	160.9	-180	-63.5	-91	0	0	0	111.1	H160 G161 S162 D164 M171	Y158-H160 PolarHBondContact O-N 2.84Å; Y158-G161 PolarHBondContact O-N 3.03Å; Y158-S162 WeakPolarHBondContact CB-OG 3.46Å; Y158-S162 WeakPolarHBondContact CD2-OG 3.4Å; Y158-S162 PolarHBondContact N-O 3.27Å; Y158-D164 WeakPolarHBondContact CE2-OD2 3.39Å; Y158-M171 HydrophobicContact CD1-CE 3.3Å; Y158-M171 HydrophobicContact CD1-SD 4.21Å; Y158-M171 HydrophobicContact CE1-CE 3.21Å; Y158-M171 HydrophobicContact CE1-SD 3.47Å; Y158-M171 WeakPolarHBondContact CE1-SD 3.32Å; Y158-M171 HydrophobicContact CG-CE 4.05Å
159	P	95.3	Very high	97	Very high	22 Å²	22	51.8 Å²	51.8	14%	0.143	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.4	-31.3	-177.7	-31.4	36.9	0	0	0	114.9	G136 I138 S141 G161	G136-P159 WeakPolarHBondContact CA-O 3.45Å; I138-P159 WeakPolarHBondContact O-CB 3.26Å; S141-P159 WeakPolarHBondContact OG-CD 3.42Å; P159-G161 VanDerWaalsContact C-N 3.28Å; P159-G161 PolarHBondContact O-N 2.91Å
160	H	94.6	Very high	97.1	Very high	124 Å²	124	47 Å²	47	57%	0.574	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.8	-0.7	-179.9	-56.8	-62.5	0	0	0	114	F132 Y158	F132-H160 WeakPolarHBondContact CD2-O 3.13Å; Y158-H160 PolarHBondContact O-N 2.84Å
161	G	93.6	Very high	97.2	Very high	12 Å²	12	42.8 Å²	42.8	12%	0.124	23%	0.226	C	C	.	.	S	Bend	trans	85.3	6.8	-178.8	0	0	0	0	0	115	K128 Y158 P159	K128-G161 WeakPolarHBondContact CB-O 3.42Å; Y158-G161 PolarHBondContact O-N 3.03Å; P159-G161 VanDerWaalsContact C-N 3.28Å; P159-G161 PolarHBondContact O-N 2.91Å
162	S	97.1	Very high	97.2	Very high	62 Å²	62	43 Å²	43	43%	0.434	23%	0.229	S	C	.	.			trans	-68.1	148.4	163.4	56	0	0	0	0	109.9	V157 Y158	V157-S162 WeakPolarHBondContact CA-O 3.47Å; Y158-S162 WeakPolarHBondContact CB-OG 3.46Å; Y158-S162 WeakPolarHBondContact CD2-OG 3.4Å; Y158-S162 PolarHBondContact N-O 3.27Å
163	Y	97.8	Very high	97	Very high	104 Å²	104	44.7 Å²	44.7	41%	0.408	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	145.4	-179.9	73.3	-78.4	0	0	0	110.6	T124 K128 Y155 S156	T124-Y163 HydrophobicContact CG2-CD2 4.1Å; T124-Y163 HydrophobicContact CG2-CG 4.32Å; K128-Y163 HydrophobicContact CB-CD1 4.46Å; K128-Y163 HydrophobicContact CD-CD1 3.39Å; K128-Y163 HydrophobicContact CD-CE1 3.43Å; K128-Y163 VanDerWaalsContact CD-CE1 3.43Å; K128-Y163 HydrophobicContact CD-CG 4.23Å; K128-Y163 PolarHBondContact NZ-OH 2.98Å; Y155-Y163 HydrophobicContact CD1-CD2 4.29Å; S156-Y163 WeakPolarHBondContact O-CA 3.28Å; S156-Y163 WeakPolarHBondContact O-CB 3.26Å
164	D	97.8	Very high	97	Very high	72 Å²	72	44.1 Å²	44.1	39%	0.385	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	151.1	176.2	-55.9	-59.2	0	0	0	110.3	Y155 S156 Y158 L166	Y155-D164 VanDerWaalsContact CA-O 3.25Å; Y155-D164 WeakPolarHBondContact CA-O 3.07Å; S156-D164 PolarHBondContact N-O 3.47Å; S156-D164 PolarHBondContact O-N 3.01Å; S156-D164 VanDerWaalsContact O-N 3.15Å; S156-D164 WeakPolarHBondContact OG-CB 3.47Å; S156-D164 PolarHBondContact OG-N 3.46Å; Y158-D164 WeakPolarHBondContact CE2-OD2 3.39Å; D164-L166 HydrophobicContact CB-CD1 4.25Å; D164-L166 HydrophobicContact CB-CG 4.28Å
165	K	97.9	Very high	96.9	Very high	115 Å²	115	44.8 Å²	44.8	50%	0.5	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	113.5	170.9	-173.1	-177.2	-179.3	171.7	0	108.2	H153 Y155	H153-K165 WeakPolarHBondContact ND1-CE 3.36Å; H153-K165 PolarHBondContact ND1-NZ 2.83Å; Y155-K165 HydrophobicContact CD1-CB 3.81Å; Y155-K165 HydrophobicContact CD1-CG 4.13Å; Y155-K165 HydrophobicContact CE1-CB 3.57Å; Y155-K165 HydrophobicContact CE1-CD 3.88Å; Y155-K165 HydrophobicContact CE1-CG 3.7Å
166	L	97.6	Very high	96.8	Very high	84 Å²	84	46.7 Å²	46.7	44%	0.44	27%	0.267	S	S	.	.			trans	-137.8	154.1	-174.4	-67.3	175.2	0	0	0	111	L154 D164 F168 L169	L154-L166 PolarHBondContact O-N 3.37Å; D164-L166 HydrophobicContact CB-CD1 4.25Å; D164-L166 HydrophobicContact CB-CG 4.28Å; L166-F168 VanDerWaalsContact C-N 3.26Å; L166-F168 WeakPolarHBondContact CB-O 3.39Å; L166-F168 PolarHBondContact O-N 3Å; L166-L169 HydrophobicContact CB-CD2 3.7Å; L166-L169 HydrophobicContact CB-CG 4.1Å; L166-L169 HydrophobicContact CD1-CD2 3.54Å; L166-L169 HydrophobicContact CG-CD2 4.05Å
167	P	97.4	Very high	96.8	Very high	56 Å²	56	47.6 Å²	47.6	36%	0.364	28%	0.275	S	S	.	.	S	Bend	trans	-67.5	-27	177.6	25.4	-33.2	0	0	0	113.1	I50 V51 Y186	I50-P167 CarbonylContact C-O 3.27Å; I50-P167 WeakPolarHBondContact CA-O 3.41Å; V51-P167 PolarHBondContact N-O 3.38Å; P167-Y186 HydrophobicContact CB-CE1 4.29Å; P167-Y186 VanDerWaalsContact CB-OH 3.28Å; P167-Y186 WeakPolarHBondContact CB-OH 3.3Å; P167-Y186 HydrophobicContact CG-CE1 4.46Å
168	F	98	Very high	96.8	Very high	30 Å²	30	47.6 Å²	47.6	13%	0.132	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	151.7	172.3	58.3	-93.4	0	0	0	109.9	G49 I50 L166 I179 F182 E183 Y186	G49-F168 CarbonylContact O-C 3.59Å; G49-F168 WeakPolarHBondContact O-CA 3.26Å; I50-F168 HydrophobicContact CB-CB 4.39Å; I50-F168 HydrophobicContact CG2-CB 3.76Å; L166-F168 VanDerWaalsContact C-N 3.26Å; L166-F168 WeakPolarHBondContact CB-O 3.39Å; L166-F168 PolarHBondContact O-N 3Å; F168-I179 HydrophobicContact CD2-CD1 3.9Å; F168-I179 HydrophobicContact CE2-CD1 3.66Å; F168-F182 HydrophobicContact CB-CD2 4.08Å; F168-F182 HydrophobicContact CB-CE2 4.37Å; F168-F182 HydrophobicContact CB-CG 4.37Å; F168-F182 HydrophobicContact CD2-CB 3.71Å; F168-F182 AromaticContact CD2-CD2 3.86Å; F168-F182 HydrophobicContact CD2-CD2 3.86Å; F168-F182 HydrophobicContact CD2-CG 4.1Å; F168-F182 HydrophobicContact CE2-CB 3.97Å; F168-F182 HydrophobicContact CG-CB 4.19Å; F168-F182 HydrophobicContact CG-CD2 4.3Å; F168-F182 HydrophobicContact CG-CG 4.38Å; F168-E183 WeakPolarHBondContact CZ-OE1 3.32Å; F168-Y186 AromaticContact CD1-CD1 3.66Å; F168-Y186 HydrophobicContact CD1-CD1 3.66Å; F168-Y186 AromaticContact CD1-CD2 3.8Å; F168-Y186 HydrophobicContact CD1-CD2 3.8Å; F168-Y186 AromaticContact CD1-CE1 3.91Å; F168-Y186 HydrophobicContact CD1-CE1 3.91Å; F168-Y186 HydrophobicContact CD1-CE2 4.04Å; F168-Y186 AromaticContact CD1-CG 3.61Å; F168-Y186 HydrophobicContact CD1-CG 3.61Å; F168-Y186 AromaticContact CE1-CD1 3.57Å; F168-Y186 HydrophobicContact CE1-CD1 3.57Å; F168-Y186 HydrophobicContact CE1-CD2 4.49Å; F168-Y186 HydrophobicContact CE1-CE1 4.02Å; F168-Y186 AromaticContact CE1-CG 3.85Å; F168-Y186 HydrophobicContact CE1-CG 3.85Å
169	L	97.8	Very high	96.9	Very high	9 Å²	9	46.3 Å²	46.3	5%	0.047	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	148.3	-176.1	-69.8	172.2	0	0	0	110.4	A48 G49 I143 L154 L166	A48-L169 CarbonylContact C-O 3.6Å; A48-L169 VanDerWaalsContact CA-O 3.25Å; A48-L169 WeakPolarHBondContact CA-O 3.22Å; G49-L169 PolarHBondContact N-O 3.17Å; G49-L169 PolarHBondContact O-N 2.89Å; I143-L169 HydrophobicContact CD1-CB 4.07Å; I143-L169 HydrophobicContact CG1-CB 4.47Å; I143-L169 HydrophobicContact CG2-CB 4.5Å; I143-L169 HydrophobicContact CG2-CD1 4.2Å; L154-L169 HydrophobicContact CD2-CB 4.26Å; L154-L169 HydrophobicContact CD2-CD1 4.08Å; L154-L169 HydrophobicContact CD2-CG 4.1Å; L154-L169 HydrophobicContact CG-CD1 3.83Å; L154-L169 HydrophobicContact CG-CG 4.4Å; L166-L169 HydrophobicContact CB-CD2 3.7Å; L166-L169 HydrophobicContact CB-CG 4.1Å; L166-L169 HydrophobicContact CD1-CD2 3.54Å; L166-L169 HydrophobicContact CG-CD2 4.05Å
170	T	97.9	Very high	97	Very high	21 Å²	21	48.3 Å²	48.3	13%	0.129	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	139.1	171.9	59.5	0	0	0	0	109.8	I47 A48 A175 A178 I179 F182	I47-T170 CarbonylContact O-C 3.53Å; I47-T170 WeakPolarHBondContact O-CA 3.47Å; A48-T170 HydrophobicContact CB-CG2 4.22Å; T170-A175 PolarHBondContact OG1-O 3.34Å; T170-A178 HydrophobicContact CG2-CB 3.64Å; T170-I179 HydrophobicContact CG2-CB 4.27Å; T170-I179 HydrophobicContact CG2-CD1 4.13Å; T170-F182 HydrophobicContact CG2-CD2 3.54Å; T170-F182 HydrophobicContact CG2-CE2 3.5Å
171	M	97.1	Very high	97.2	Very high	13 Å²	13	44 Å²	44	6%	0.064	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	161.3	178.8	-63.9	-72.6	-88.3	0	0	110.6	I47 I143 Y158	I47-M171 HydrophobicContact CD1-CB 3.89Å; I47-M171 HydrophobicContact CG1-CB 3.7Å; I47-M171 WeakPolarHBondContact CG1-O 3.42Å; I47-M171 PolarHBondContact N-O 2.87Å; I47-M171 PolarHBondContact O-N 3.13Å; I143-M171 HydrophobicContact CD1-CB 4.08Å; I143-M171 HydrophobicContact CD1-CG 3.83Å; I143-M171 HydrophobicContact CG1-CB 4.25Å; I143-M171 HydrophobicContact CG1-CG 3.7Å; Y158-M171 HydrophobicContact CD1-CE 3.3Å; Y158-M171 HydrophobicContact CD1-SD 4.21Å; Y158-M171 HydrophobicContact CE1-CE 3.21Å; Y158-M171 HydrophobicContact CE1-SD 3.47Å; Y158-M171 WeakPolarHBondContact CE1-SD 3.32Å; Y158-M171 HydrophobicContact CG-CE 4.05Å
172	G	95.4	Very high	97.4	Very high	34 Å²	34	43.5 Å²	43.5	35%	0.351	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	98.2	-172.9	-178	0	0	0	0	0	113.7	T45 A175	T45-G172 CarbonylContact O-C 3.53Å; T45-G172 VanDerWaalsContact O-C 3.27Å; T45-G172 WeakPolarHBondContact O-CA 3.28Å; G172-A175 VanDerWaalsContact O-CB 3.26Å; G172-A175 WeakPolarHBondContact O-CB 3.35Å; G172-A175 PolarHBondContact O-N 3.43Å
173	S	95.2	Very high	97.4	Very high	65 Å²	65	46.8 Å²	46.8	46%	0.455	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-39.7	-175.6	48.3	0	0	0	0	113	G44 T45 A175 D210	G44-S173 WeakPolarHBondContact CA-OG 3.15Å; T45-S173 PolarHBondContact N-OG 2.78Å; T45-S173 PolarHBondContact O-N 3.06Å; T45-S173 PolarHBondContact O-OG 2.77Å; S173-A175 VanDerWaalsContact C-N 3.29Å; S173-A175 PolarHBondContact O-N 3.24Å; S173-D210 WeakPolarHBondContact CB-OD2 3.39Å; S173-D210 PolarHBondContact OG-OD2 3.27Å
174	G	96.3	Very high	97.4	Very high	3 Å²	3	48.1 Å²	48.1	3%	0.031	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88	11.5	177.6	0	0	0	0	0	114.5	T45 T46 G176 A177 A178 D210	T45-G174 PolarHBondContact O-N 2.92Å; T46-G174 WeakPolarHBondContact OG1-CA 2.95Å; G174-G176 PolarHBondContact O-N 2.81Å; G174-A177 PolarHBondContact O-N 3.35Å; G174-A177 VanDerWaalsContact O-N 3.1Å; G174-A178 PolarHBondContact O-N 2.93Å; G174-A178 VanDerWaalsContact O-N 3.14Å; G174-D210 PolarHBondContact N-OD2 2.94Å
175	A	96.4	Very high	97.4	Very high	16 Å²	16	49 Å²	49	13%	0.132	28%	0.284	C	S	.	.	H	α-helix	trans	-56.2	-37.1	179.9	0	0	0	0	0	112.9	T170 G172 S173 A177 A178 I179	T170-A175 PolarHBondContact OG1-O 3.34Å; G172-A175 VanDerWaalsContact O-CB 3.26Å; G172-A175 WeakPolarHBondContact O-CB 3.35Å; G172-A175 PolarHBondContact O-N 3.43Å; S173-A175 VanDerWaalsContact C-N 3.29Å; S173-A175 PolarHBondContact O-N 3.24Å; A175-A177 VanDerWaalsContact C-N 3.29Å; A175-A177 PolarHBondContact O-N 3.04Å; A175-A178 PolarHBondContact O-N 3.16Å; A175-I179 WeakPolarHBondContact O-CB 3.5Å; A175-I179 WeakPolarHBondContact O-CG2 3.15Å; A175-I179 PolarHBondContact O-N 2.81Å
176	G	97.1	Very high	97.4	Very high	57 Å²	57	46.1 Å²	46.1	59%	0.588	27%	0.27	S	S	*	.	H	α-helix	trans	-63.2	-31	178.6	0	0	0	0	0	114.1	G174 I179	G174-G176 PolarHBondContact O-N 2.81Å; G176-I179 WeakPolarHBondContact O-CG2 3.37Å
177	A	97.6	Very high	97.4	Very high	19 Å²	19	49 Å²	49	16%	0.157	28%	0.275	C	S	.	.	H	α-helix	trans	-82.7	-33	174.6	0	0	0	0	0	112	G174 A175 S180 A205 C209	G174-A177 PolarHBondContact O-N 3.35Å; G174-A177 VanDerWaalsContact O-N 3.1Å; A175-A177 VanDerWaalsContact C-N 3.29Å; A175-A177 PolarHBondContact O-N 3.04Å; A177-S180 PolarHBondContact O-OG 2.96Å; A177-A205 HydrophobicContact CB-CB 4.43Å; A177-C209 HydrophobicContact CB-CB 3.77Å
178	A	98.1	Very high	97.3	Very high	0 Å²	0	51 Å²	51	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-70.1	-39.5	176.8	0	0	0	0	0	112.1	T46 T170 G174 A175 S180 I181 F182 A202	T46-A178 HydrophobicContact CG2-CB 3.88Å; T170-A178 HydrophobicContact CG2-CB 3.64Å; G174-A178 PolarHBondContact O-N 2.93Å; G174-A178 VanDerWaalsContact O-N 3.14Å; A175-A178 PolarHBondContact O-N 3.16Å; A178-S180 VanDerWaalsContact C-N 3.34Å; A178-S180 PolarHBondContact O-N 3Å; A178-I181 PolarHBondContact O-N 3.37Å; A178-F182 PolarHBondContact O-N 3.22Å; A178-A202 WeakPolarHBondContact CA-O 3.32Å; A178-A202 HydrophobicContact CB-CB 4.29Å; A178-A202 WeakPolarHBondContact CB-O 3.47Å
179	I	98.2	Very high	97.2	Very high	55 Å²	55	55.4 Å²	55.4	28%	0.282	31%	0.312	S	S	.	.	H	α-helix	trans	-67.1	-35.4	-176.8	-163.2	65.9	0	0	0	111.8	F168 T170 A175 G176 I181 F182 E183	F168-I179 HydrophobicContact CD2-CD1 3.9Å; F168-I179 HydrophobicContact CE2-CD1 3.66Å; T170-I179 HydrophobicContact CG2-CB 4.27Å; T170-I179 HydrophobicContact CG2-CD1 4.13Å; A175-I179 WeakPolarHBondContact O-CB 3.5Å; A175-I179 WeakPolarHBondContact O-CG2 3.15Å; A175-I179 PolarHBondContact O-N 2.81Å; G176-I179 WeakPolarHBondContact O-CG2 3.37Å; I179-I181 VanDerWaalsContact C-N 3.25Å; I179-I181 PolarHBondContact O-N 3.22Å; I179-F182 PolarHBondContact O-N 3.44Å; I179-F182 VanDerWaalsContact O-N 3.11Å; I179-E183 HydrophobicContact CG1-CG 4.3Å; I179-E183 WeakPolarHBondContact O-CG 3.32Å; I179-E183 PolarHBondContact O-N 3.08Å
180	S	98.2	Very high	97.2	Very high	63 Å²	63	55.3 Å²	55.3	44%	0.441	31%	0.312	S	S	.	.	H	α-helix	trans	-62.7	-34.7	178.3	61.9	0	0	0	0	112.2	A177 A178 D184	A177-S180 PolarHBondContact O-OG 2.96Å; A178-S180 VanDerWaalsContact C-N 3.34Å; A178-S180 PolarHBondContact O-N 3Å; S180-D184 WeakPolarHBondContact O-CB 3.49Å; S180-D184 PolarHBondContact O-N 2.96Å; S180-D184 VanDerWaalsContact O-N 3.16Å
181	I	98.3	Very high	97.2	Very high	35 Å²	35	59 Å²	59	18%	0.179	33%	0.327	C	S	.	.	H	α-helix	trans	-68	-40.3	174.2	-65.6	-54.1	0	0	0	111.9	A178 I179 R185 L198 D201 A202 A205	A178-I181 PolarHBondContact O-N 3.37Å; I179-I181 VanDerWaalsContact C-N 3.25Å; I179-I181 PolarHBondContact O-N 3.22Å; I181-R185 PolarHBondContact O-N 3.47Å; I181-L198 HydrophobicContact CG2-CD1 3.83Å; I181-D201 HydrophobicContact CG2-CB 4.36Å; I181-A202 HydrophobicContact CB-CB 4.12Å; I181-A202 HydrophobicContact CG2-CB 3.91Å; I181-A205 HydrophobicContact CD1-CB 4.3Å; I181-A205 HydrophobicContact CG1-CB 3.63Å
182	F	98.1	Very high	97.2	Very high	0 Å²	0	60.6 Å²	60.6	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-67.4	-46.9	175.9	-72.3	-30.5	0	0	0	111.8	A48 I50 F168 T170 A178 I179 D184 R185 Y186 L198 V199 A202	A48-F182 HydrophobicContact CB-CE2 3.75Å; A48-F182 HydrophobicContact CB-CZ 3.76Å; I50-F182 HydrophobicContact CG2-CD1 4Å; I50-F182 HydrophobicContact CG2-CE1 3.37Å; I50-F182 HydrophobicContact CG2-CE2 4Å; I50-F182 HydrophobicContact CG2-CZ 3.36Å; F168-F182 HydrophobicContact CB-CD2 4.08Å; F168-F182 HydrophobicContact CB-CE2 4.37Å; F168-F182 HydrophobicContact CB-CG 4.37Å; F168-F182 HydrophobicContact CD2-CB 3.71Å; F168-F182 AromaticContact CD2-CD2 3.86Å; F168-F182 HydrophobicContact CD2-CD2 3.86Å; F168-F182 HydrophobicContact CD2-CG 4.1Å; F168-F182 HydrophobicContact CE2-CB 3.97Å; F168-F182 HydrophobicContact CG-CB 4.19Å; F168-F182 HydrophobicContact CG-CD2 4.3Å; F168-F182 HydrophobicContact CG-CG 4.38Å; T170-F182 HydrophobicContact CG2-CD2 3.54Å; T170-F182 HydrophobicContact CG2-CE2 3.5Å; A178-F182 PolarHBondContact O-N 3.22Å; I179-F182 PolarHBondContact O-N 3.44Å; I179-F182 VanDerWaalsContact O-N 3.11Å; F182-D184 VanDerWaalsContact C-N 3.27Å; F182-D184 PolarHBondContact O-N 3.23Å; F182-R185 PolarHBondContact O-N 2.93Å; F182-Y186 WeakPolarHBondContact O-CA 3.42Å; F182-Y186 WeakPolarHBondContact O-CB 3.3Å; F182-Y186 PolarHBondContact O-N 3.47Å; F182-L198 HydrophobicContact CD1-CD1 4.23Å; F182-L198 HydrophobicContact CD1-CD2 4.02Å; F182-L198 HydrophobicContact CD1-CG 3.84Å; F182-L198 HydrophobicContact CE1-CD2 4.39Å; F182-L198 HydrophobicContact CE1-CG 3.97Å; F182-V199 HydrophobicContact CE1-CG2 4.36Å; F182-V199 HydrophobicContact CZ-CG2 4.37Å; F182-A202 HydrophobicContact CD1-CB 4.1Å; F182-A202 HydrophobicContact CE1-CB 3.67Å; F182-A202 HydrophobicContact CE2-CB 4.39Å; F182-A202 HydrophobicContact CZ-CB 3.84Å
183	E	98.1	Very high	97.3	Very high	132 Å²	132	64.3 Å²	64.3	62%	0.617	35%	0.345	S	S	*	.	H	α-helix	trans	-60.1	-35.4	179.5	-70.3	-65.3	162.4	0	0	112.9	F168 I179	F168-E183 WeakPolarHBondContact CZ-OE1 3.32Å; I179-E183 HydrophobicContact CG1-CG 4.3Å; I179-E183 WeakPolarHBondContact O-CG 3.32Å; I179-E183 PolarHBondContact O-N 3.08Å
184	D	97.9	Very high	97.4	Very high	131 Å²	131	64.5 Å²	64.5	70%	0.701	34%	0.338	S	S	*	.	H	α-helix	trans	-74	-38.6	179.4	-177.9	59.1	0	0	0	113.4	S180 F182	S180-D184 WeakPolarHBondContact O-CB 3.49Å; S180-D184 PolarHBondContact O-N 2.96Å; S180-D184 VanDerWaalsContact O-N 3.16Å; F182-D184 VanDerWaalsContact C-N 3.27Å; F182-D184 PolarHBondContact O-N 3.23Å
185	R	97.8	Very high	97.5	Very high	92 Å²	92	64.4 Å²	64.4	35%	0.347	34%	0.337	S	S	.	.	H	α-helix	trans	-122.2	-8.9	-164	-62	-171.1	-75.5	164.2	-8.8	115.6	I181 F182 L198 D201	I181-R185 PolarHBondContact O-N 3.47Å; F182-R185 PolarHBondContact O-N 2.93Å; R185-L198 HydrophobicContact CB-CD1 3.69Å; R185-D201 IonicContact CZ-OD2 3.13Å; R185-D201 IonicContact NH1-OD2 3.75Å; R185-D201 PolarHBondContact NH1-OD2 2.93Å; R185-D201 IonicContact NH2-OD2 2.54Å; R185-D201 PolarHBondContact NH2-OD2 3.41Å
186	Y	97.8	Very high	97.6	Very high	54 Å²	54	64.3 Å²	64.3	21%	0.212	33%	0.334	C	S	.	.			trans	-64.6	137.3	-179.4	173.8	-98.2	0	0	0	111.3	P167 F168 F182 M190 L198	P167-Y186 HydrophobicContact CB-CE1 4.29Å; P167-Y186 VanDerWaalsContact CB-OH 3.28Å; P167-Y186 WeakPolarHBondContact CB-OH 3.3Å; P167-Y186 HydrophobicContact CG-CE1 4.46Å; F168-Y186 AromaticContact CD1-CD1 3.66Å; F168-Y186 HydrophobicContact CD1-CD1 3.66Å; F168-Y186 AromaticContact CD1-CD2 3.8Å; F168-Y186 HydrophobicContact CD1-CD2 3.8Å; F168-Y186 AromaticContact CD1-CE1 3.91Å; F168-Y186 HydrophobicContact CD1-CE1 3.91Å; F168-Y186 HydrophobicContact CD1-CE2 4.04Å; F168-Y186 AromaticContact CD1-CG 3.61Å; F168-Y186 HydrophobicContact CD1-CG 3.61Å; F168-Y186 AromaticContact CE1-CD1 3.57Å; F168-Y186 HydrophobicContact CE1-CD1 3.57Å; F168-Y186 HydrophobicContact CE1-CD2 4.49Å; F168-Y186 HydrophobicContact CE1-CE1 4.02Å; F168-Y186 AromaticContact CE1-CG 3.85Å; F168-Y186 HydrophobicContact CE1-CG 3.85Å; F182-Y186 WeakPolarHBondContact O-CA 3.42Å; F182-Y186 WeakPolarHBondContact O-CB 3.3Å; F182-Y186 PolarHBondContact O-N 3.47Å; Y186-M190 HydrophobicContact CD2-SD 4.3Å; Y186-L198 HydrophobicContact CD2-CD2 4.48Å
187	R	96.9	Very high	97.7	Very high	145 Å²	145	67.3 Å²	67.3	55%	0.547	33%	0.33	S	S	.	.			trans	-131.4	143.9	171.5	-64.5	-173	-73.2	-149.3	5.3	109.3	M190 E194	R187-M190 HydrophobicContact CB-CG 3.92Å; R187-M190 HydrophobicContact CB-SD 4.31Å; R187-M190 PolarHBondContact N-SD 2.88Å; R187-M190 WeakPolarHBondContact O-CG 3.4Å; R187-E194 IonicContact CZ-OE1 3.54Å; R187-E194 IonicContact NE-OE1 3.69Å; R187-E194 PolarHBondContact NE-OE1 3.14Å; R187-E194 VanDerWaalsContact NH2-CD 3.3Å; R187-E194 IonicContact NH2-OE1 3.08Å; R187-E194 PolarHBondContact NH2-OE1 3.16Å; R187-E194 IonicContact NH2-OE2 3.7Å; R187-E194 PolarHBondContact NH2-OE2 2.88Å
188	P	95.9	Very high	97.7	Very high	96 Å²	96	66.7 Å²	66.7	62%	0.623	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	144.3	172.2	27.8	-33.6	0	0	0	110.2	M190	P188-M190 PolarHBondContact O-N 2.96Å
189	N	95.5	Very high	97.7	Very high	123 Å²	123	66.7 Å²	66.7	66%	0.658	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.5	39.3	175.3	-52.3	-40.8	0	0	0	114.9	K53	K53-N189 HydrophobicContact CB-CB 4.49Å
190	M	97.1	Very high	97.7	Very high	8 Å²	8	67.3 Å²	67.3	4%	0.039	32%	0.323	C	S	.	.			trans	-60	149	172.6	-71.6	165.4	82.6	0	0	112.2	F52 K53 Y186 R187 P188 E194 A195 L198	F52-M190 WeakPolarHBondContact CB-O 3.49Å; K53-M190 WeakPolarHBondContact CB-O 3.47Å; K53-M190 PolarHBondContact N-O 2.88Å; K53-M190 VanDerWaalsContact N-O 3.12Å; Y186-M190 HydrophobicContact CD2-SD 4.3Å; R187-M190 HydrophobicContact CB-CG 3.92Å; R187-M190 HydrophobicContact CB-SD 4.31Å; R187-M190 PolarHBondContact N-SD 2.88Å; R187-M190 WeakPolarHBondContact O-CG 3.4Å; P188-M190 PolarHBondContact O-N 2.96Å; M190-E194 HydrophobicContact CE-CB 4.16Å; M190-E194 HydrophobicContact CE-CG 3.52Å; M190-E194 WeakPolarHBondContact CE-OE1 3.46Å; M190-A195 HydrophobicContact CB-CB 4.32Å; M190-L198 HydrophobicContact CE-CB 4.03Å; M190-L198 HydrophobicContact CE-CD2 3.62Å; M190-L198 HydrophobicContact CE-CG 4.43Å; M190-L198 HydrophobicContact SD-CD2 3.79Å
191	E	98.1	Very high	97.7	Very high	97 Å²	97	65.5 Å²	65.5	45%	0.453	31%	0.309	S	S	.	.			trans	-74.5	155.2	171.4	-65.4	-65.2	149.9	0	0	110.8	K53 E193 E194 A195	K53-E191 WeakPolarHBondContact CD-OE1 3.37Å; K53-E191 IonicContact NZ-OE1 3.44Å; K53-E191 PolarHBondContact NZ-OE1 2.93Å; K53-E191 IonicContact NZ-OE2 3.02Å; E191-E193 PolarHBondContact O-N 2.6Å; E191-E194 PolarHBondContact O-N 3.48Å; E191-A195 WeakPolarHBondContact O-CB 3.43Å; E191-A195 PolarHBondContact O-N 3.43Å
192	L	97.3	Very high	97.7	Very high	48 Å²	48	63.9 Å²	63.9	25%	0.251	30%	0.3	S	S	.	.	H	α-helix	trans	-53.3	-48.3	-169.8	175.4	62.6	0	0	0	114.3	F52 I57 A195 K196 V221	F52-L192 HydrophobicContact CD2-CB 4.41Å; F52-L192 HydrophobicContact CD2-CD1 4.47Å; F52-L192 HydrophobicContact CE1-CD1 4.17Å; F52-L192 HydrophobicContact CE2-CB 3.93Å; F52-L192 HydrophobicContact CE2-CD1 3.73Å; F52-L192 HydrophobicContact CE2-CG 4.41Å; F52-L192 HydrophobicContact CZ-CD1 3.55Å; I57-L192 HydrophobicContact CD1-CD1 4.04Å; L192-A195 WeakPolarHBondContact O-CB 3.48Å; L192-A195 PolarHBondContact O-N 3.21Å; L192-K196 HydrophobicContact CD1-CD 4.48Å; L192-K196 HydrophobicContact CD1-CG 4.32Å; L192-K196 HydrophobicContact CG-CD 4.4Å; L192-K196 WeakPolarHBondContact O-CG 3.44Å; L192-K196 PolarHBondContact O-N 3.42Å; L192-V221 HydrophobicContact CD1-CG1 3.52Å; L192-V221 HydrophobicContact CD1-CG2 4.32Å
193	E	97.7	Very high	97.7	Very high	112 Å²	112	63.9 Å²	63.9	52%	0.523	30%	0.3	S	S	.	.	H	α-helix	trans	-71.4	-33.1	-176	-66.9	-55.4	130.7	0	0	112.4	E191 K196 K197	E191-E193 PolarHBondContact O-N 2.6Å; E193-K196 IonicContact OE1-NZ 3.82Å; E193-K196 PolarHBondContact OE1-NZ 2.78Å; E193-K196 IonicContact OE2-NZ 3.66Å; E193-K197 PolarHBondContact O-N 3.23Å; E193-K197 VanDerWaalsContact O-N 3.12Å
194	E	97.8	Very high	97.7	Very high	69 Å²	69	58.2 Å²	58.2	32%	0.322	28%	0.276	S	S	.	.	H	α-helix	trans	-66.9	-44.1	173.7	-163.8	-167.8	148.3	0	0	110.7	R187 M190 E191 K197 L198	R187-E194 IonicContact CZ-OE1 3.54Å; R187-E194 IonicContact NE-OE1 3.69Å; R187-E194 PolarHBondContact NE-OE1 3.14Å; R187-E194 VanDerWaalsContact NH2-CD 3.3Å; R187-E194 IonicContact NH2-OE1 3.08Å; R187-E194 PolarHBondContact NH2-OE1 3.16Å; R187-E194 IonicContact NH2-OE2 3.7Å; R187-E194 PolarHBondContact NH2-OE2 2.88Å; M190-E194 HydrophobicContact CE-CB 4.16Å; M190-E194 HydrophobicContact CE-CG 3.52Å; M190-E194 WeakPolarHBondContact CE-OE1 3.46Å; E191-E194 PolarHBondContact O-N 3.48Å; E194-K197 PolarHBondContact O-N 3Å; E194-L198 PolarHBondContact O-N 3.1Å
195	A	98.1	Very high	97.7	Very high	0 Å²	0	53 Å²	53	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-61	-46.7	175.9	0	0	0	0	0	111.7	I50 F52 I57 M190 E191 L192 K197 L198 V199	I50-A195 HydrophobicContact CD1-CB 3.59Å; I50-A195 WeakPolarHBondContact CD1-O 3.38Å; F52-A195 HydrophobicContact CB-CB 3.72Å; F52-A195 HydrophobicContact CG-CB 4.13Å; I57-A195 HydrophobicContact CD1-CB 3.64Å; M190-A195 HydrophobicContact CB-CB 4.32Å; E191-A195 WeakPolarHBondContact O-CB 3.43Å; E191-A195 PolarHBondContact O-N 3.43Å; L192-A195 WeakPolarHBondContact O-CB 3.48Å; L192-A195 PolarHBondContact O-N 3.21Å; A195-K197 VanDerWaalsContact C-N 3.35Å; A195-K197 PolarHBondContact O-N 3.06Å; A195-L198 PolarHBondContact O-N 2.99Å; A195-V199 WeakPolarHBondContact O-CG2 3.42Å; A195-V199 PolarHBondContact O-N 3.39Å
196	K	98.3	Very high	97.7	Very high	15 Å²	15	48.6 Å²	48.6	7%	0.065	23%	0.234	C	C	.	.	H	α-helix	trans	-56	-48	174.9	-78.2	175.4	179.6	167.9	0	111.8	I57 L192 E193 L198 V199 R200 L219 V221	I57-K196 HydrophobicContact CD1-CB 4.45Å; I57-K196 HydrophobicContact CD1-CG 3.82Å; L192-K196 HydrophobicContact CD1-CD 4.48Å; L192-K196 HydrophobicContact CD1-CG 4.32Å; L192-K196 HydrophobicContact CG-CD 4.4Å; L192-K196 WeakPolarHBondContact O-CG 3.44Å; L192-K196 PolarHBondContact O-N 3.42Å; E193-K196 IonicContact OE1-NZ 3.82Å; E193-K196 PolarHBondContact OE1-NZ 2.78Å; E193-K196 IonicContact OE2-NZ 3.66Å; K196-L198 VanDerWaalsContact C-N 3.34Å; K196-L198 PolarHBondContact O-N 3.31Å; K196-V199 PolarHBondContact O-N 2.64Å; K196-R200 WeakPolarHBondContact O-CB 3.41Å; K196-R200 PolarHBondContact O-N 2.92Å; K196-L219 HydrophobicContact CB-CD1 4.19Å; K196-L219 HydrophobicContact CG-CD1 4.33Å; K196-V221 HydrophobicContact CG-CG2 4.3Å
197	K	98.1	Very high	97.7	Very high	120 Å²	120	46.9 Å²	46.9	52%	0.522	23%	0.229	S	C	.	.	H	α-helix	trans	-62.6	-41.8	179.5	-173	179.1	178.8	-176.7	0	111.5	E193 E194 A195 R200 D201	E193-K197 PolarHBondContact O-N 3.23Å; E193-K197 VanDerWaalsContact O-N 3.12Å; E194-K197 PolarHBondContact O-N 3Å; A195-K197 VanDerWaalsContact C-N 3.35Å; A195-K197 PolarHBondContact O-N 3.06Å; K197-R200 PolarHBondContact O-N 3.32Å; K197-D201 WeakPolarHBondContact O-CB 3.29Å; K197-D201 PolarHBondContact O-N 3.34Å
198	L	98.3	Very high	97.7	Very high	6 Å²	6	46.9 Å²	46.9	3%	0.031	23%	0.233	C	C	.	.	H	α-helix	trans	-62.7	-47	178.2	-178.7	60.3	0	0	0	111.9	I181 F182 R185 Y186 M190 E194 A195 K196 D201 A202	I181-L198 HydrophobicContact CG2-CD1 3.83Å; F182-L198 HydrophobicContact CD1-CD1 4.23Å; F182-L198 HydrophobicContact CD1-CD2 4.02Å; F182-L198 HydrophobicContact CD1-CG 3.84Å; F182-L198 HydrophobicContact CE1-CD2 4.39Å; F182-L198 HydrophobicContact CE1-CG 3.97Å; R185-L198 HydrophobicContact CB-CD1 3.69Å; Y186-L198 HydrophobicContact CD2-CD2 4.48Å; M190-L198 HydrophobicContact CE-CB 4.03Å; M190-L198 HydrophobicContact CE-CD2 3.62Å; M190-L198 HydrophobicContact CE-CG 4.43Å; M190-L198 HydrophobicContact SD-CD2 3.79Å; E194-L198 PolarHBondContact O-N 3.1Å; A195-L198 PolarHBondContact O-N 2.99Å; K196-L198 VanDerWaalsContact C-N 3.34Å; K196-L198 PolarHBondContact O-N 3.31Å; L198-D201 PolarHBondContact O-N 3.43Å; L198-A202 WeakPolarHBondContact O-CB 3.33Å; L198-A202 PolarHBondContact O-N 3.43Å
199	V	98.4	Very high	97.7	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-62.8	-44.2	176.4	179.5	0	0	0	0	110.9	I50 I57 F182 A195 K196 D201 A202 I203 L219	I50-V199 HydrophobicContact CB-CG2 4.36Å; I50-V199 HydrophobicContact CD1-CG2 3.52Å; I50-V199 HydrophobicContact CG1-CG2 3.55Å; I50-V199 HydrophobicContact CG2-CG2 3.99Å; I57-V199 HydrophobicContact CB-CG2 4.17Å; I57-V199 HydrophobicContact CG2-CB 4.28Å; I57-V199 HydrophobicContact CG2-CG1 4.33Å; I57-V199 HydrophobicContact CG2-CG2 3.95Å; F182-V199 HydrophobicContact CE1-CG2 4.36Å; F182-V199 HydrophobicContact CZ-CG2 4.37Å; A195-V199 WeakPolarHBondContact O-CG2 3.42Å; A195-V199 PolarHBondContact O-N 3.39Å; K196-V199 PolarHBondContact O-N 2.64Å; V199-D201 VanDerWaalsContact C-N 3.33Å; V199-D201 PolarHBondContact O-N 2.87Å; V199-A202 PolarHBondContact O-N 2.97Å; V199-I203 HydrophobicContact CG1-CG1 4.43Å; V199-I203 WeakPolarHBondContact O-CG1 3.44Å; V199-I203 PolarHBondContact O-N 2.9Å; V199-L219 HydrophobicContact CB-CD2 3.95Å; V199-L219 HydrophobicContact CG1-CD2 3.46Å; V199-L219 VanDerWaalsContact CG1-CD2 3.46Å
200	R	97.9	Very high	97.8	Very high	67 Å²	67	42.9 Å²	42.9	25%	0.253	21%	0.213	S	C	.	.	H	α-helix	trans	-55.3	-51.7	175.8	-177.2	-78.6	-63.5	-123.4	10.8	110.5	K196 K197 A202 I203 A204 V217 Y233 D234	K196-R200 WeakPolarHBondContact O-CB 3.41Å; K196-R200 PolarHBondContact O-N 2.92Å; K197-R200 PolarHBondContact O-N 3.32Å; R200-A202 VanDerWaalsContact C-N 3.29Å; R200-A202 PolarHBondContact O-N 3.23Å; R200-I203 PolarHBondContact O-N 2.96Å; R200-A204 WeakPolarHBondContact O-CB 3.31Å; R200-A204 PolarHBondContact O-N 3.32Å; R200-V217 HydrophobicContact CG-CG1 4.42Å; R200-Y233 HydrophobicContact CB-CD1 4.25Å; R200-Y233 HydrophobicContact CB-CE1 3.92Å; R200-Y233 HydrophobicContact CG-CD1 3.98Å; R200-Y233 HydrophobicContact CG-CE1 3.86Å; R200-D234 VanDerWaalsContact CD-OD2 3.26Å; R200-D234 WeakPolarHBondContact CD-OD2 3.43Å; R200-D234 HydrophobicContact CG-CB 3.92Å; R200-D234 IonicContact CZ-OD2 2.77Å; R200-D234 IonicContact NE-OD2 2.74Å; R200-D234 IonicContact NH1-OD2 3.99Å; R200-D234 PolarHBondContact NH1-OD2 3.01Å
201	D	98.2	Very high	97.7	Very high	26 Å²	26	49.4 Å²	49.4	14%	0.139	25%	0.247	C	C	.	.	H	α-helix	trans	-64.5	-35	-177.1	-65.8	-7.7	0	0	0	111.6	I181 R185 K197 L198 V199 A204 A205	I181-D201 HydrophobicContact CG2-CB 4.36Å; R185-D201 IonicContact CZ-OD2 3.13Å; R185-D201 IonicContact NH1-OD2 3.75Å; R185-D201 PolarHBondContact NH1-OD2 2.93Å; R185-D201 IonicContact NH2-OD2 2.54Å; R185-D201 PolarHBondContact NH2-OD2 3.41Å; K197-D201 WeakPolarHBondContact O-CB 3.29Å; K197-D201 PolarHBondContact O-N 3.34Å; L198-D201 PolarHBondContact O-N 3.43Å; V199-D201 VanDerWaalsContact C-N 3.33Å; V199-D201 PolarHBondContact O-N 2.87Å; D201-A204 PolarHBondContact O-N 3.17Å; D201-A205 PolarHBondContact O-N 3.02Å
202	A	98.4	Very high	97.5	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-64.8	-45.4	175.5	0	0	0	0	0	112	A178 I181 F182 L198 V199 R200 A205 G206	A178-A202 WeakPolarHBondContact CA-O 3.32Å; A178-A202 HydrophobicContact CB-CB 4.29Å; A178-A202 WeakPolarHBondContact CB-O 3.47Å; I181-A202 HydrophobicContact CB-CB 4.12Å; I181-A202 HydrophobicContact CG2-CB 3.91Å; F182-A202 HydrophobicContact CD1-CB 4.1Å; F182-A202 HydrophobicContact CE1-CB 3.67Å; F182-A202 HydrophobicContact CE2-CB 4.39Å; F182-A202 HydrophobicContact CZ-CB 3.84Å; L198-A202 WeakPolarHBondContact O-CB 3.33Å; L198-A202 PolarHBondContact O-N 3.43Å; V199-A202 PolarHBondContact O-N 2.97Å; R200-A202 VanDerWaalsContact C-N 3.29Å; R200-A202 PolarHBondContact O-N 3.23Å; A202-A205 PolarHBondContact O-N 3.45Å; A202-G206 PolarHBondContact O-N 3.5Å
203	I	98.4	Very high	97.5	Very high	0 Å²	0	43 Å²	43	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-65.7	-41.1	174.4	-59.9	-58.9	0	0	0	110.6	T46 A48 D61 V199 R200 A205 G206 I207 V217	T46-I203 HydrophobicContact CG2-CD1 3.9Å; A48-I203 HydrophobicContact CB-CD1 3.57Å; A48-I203 HydrophobicContact CB-CG1 4.4Å; D61-I203 HydrophobicContact CB-CG2 4.03Å; V199-I203 HydrophobicContact CG1-CG1 4.43Å; V199-I203 WeakPolarHBondContact O-CG1 3.44Å; V199-I203 PolarHBondContact O-N 2.9Å; R200-I203 PolarHBondContact O-N 2.96Å; I203-A205 VanDerWaalsContact C-N 3.31Å; I203-A205 PolarHBondContact O-N 2.82Å; I203-G206 CarbonylContact O-C 3.51Å; I203-G206 WeakPolarHBondContact O-CA 3.09Å; I203-G206 PolarHBondContact O-N 3.26Å; I203-I207 HydrophobicContact CG2-CD1 4.09Å; I203-I207 HydrophobicContact CG2-CG1 4.34Å; I203-I207 WeakPolarHBondContact O-CG1 3.34Å; I203-I207 PolarHBondContact O-N 2.62Å; I203-V217 HydrophobicContact CB-CG1 3.96Å; I203-V217 HydrophobicContact CB-CG2 4.32Å; I203-V217 HydrophobicContact CG1-CG1 4.33Å; I203-V217 HydrophobicContact CG2-CB 4.4Å; I203-V217 HydrophobicContact CG2-CG1 3.96Å; I203-V217 HydrophobicContact CG2-CG2 3.88Å
204	A	97.9	Very high	97.4	Very high	13 Å²	13	37.7 Å²	37.7	11%	0.107	20%	0.195	C	C	.	.	H	α-helix	trans	-61	-39.1	177.4	0	0	0	0	0	112.1	R200 D201 G206 I207 F208	R200-A204 WeakPolarHBondContact O-CB 3.31Å; R200-A204 PolarHBondContact O-N 3.32Å; D201-A204 PolarHBondContact O-N 3.17Å; A204-G206 VanDerWaalsContact C-N 3.33Å; A204-G206 PolarHBondContact O-N 3.17Å; A204-I207 WeakPolarHBondContact O-CB 3.38Å; A204-I207 PolarHBondContact O-N 3.2Å; A204-I207 VanDerWaalsContact O-N 3.16Å; A204-F208 WeakPolarHBondContact O-CD2 3.48Å; A204-F208 PolarHBondContact O-N 3.31Å
205	A	98	Very high	97.3	Very high	21 Å²	21	35.3 Å²	35.3	17%	0.174	19%	0.185	C	C	.	.	H	α-helix	trans	-60.4	-42.7	172	0	0	0	0	0	111.5	A177 I181 D201 A202 I203 F208 C209	A177-A205 HydrophobicContact CB-CB 4.43Å; I181-A205 HydrophobicContact CD1-CB 4.3Å; I181-A205 HydrophobicContact CG1-CB 3.63Å; D201-A205 PolarHBondContact O-N 3.02Å; A202-A205 PolarHBondContact O-N 3.45Å; I203-A205 VanDerWaalsContact C-N 3.31Å; I203-A205 PolarHBondContact O-N 2.82Å; A205-F208 PolarHBondContact O-N 3.18Å; A205-C209 VanDerWaalsContact O-CB 3.24Å; A205-C209 WeakPolarHBondContact O-CB 3.49Å; A205-C209 PolarHBondContact O-N 2.81Å; A205-C209 PolarHBondContact O-SG 3.37Å
206	G	97.6	Very high	97.2	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-57.8	-45.7	170.2	0	0	0	0	0	112.9	A202 I203 A204 F208 C209 D210	A202-G206 PolarHBondContact O-N 3.5Å; I203-G206 CarbonylContact O-C 3.51Å; I203-G206 WeakPolarHBondContact O-CA 3.09Å; I203-G206 PolarHBondContact O-N 3.26Å; A204-G206 VanDerWaalsContact C-N 3.33Å; A204-G206 PolarHBondContact O-N 3.17Å; G206-F208 VanDerWaalsContact C-N 3.35Å; G206-F208 PolarHBondContact O-N 3.46Å; G206-C209 PolarHBondContact O-N 2.93Å; G206-D210 VanDerWaalsContact O-CB 3.28Å; G206-D210 WeakPolarHBondContact O-CB 3.46Å; G206-D210 PolarHBondContact O-N 3.01Å
207	I	97.4	Very high	97.2	Very high	19 Å²	19	36 Å²	36	10%	0.097	19%	0.19	C	C	.	.	H	α-helix	trans	-59.6	-40.9	179.2	-71.2	174.3	0	0	0	112.6	D61 I203 A204 V217 P236	D61-I207 HydrophobicContact CB-CD1 4.27Å; D61-I207 HydrophobicContact CB-CG1 4.1Å; I203-I207 HydrophobicContact CG2-CD1 4.09Å; I203-I207 HydrophobicContact CG2-CG1 4.34Å; I203-I207 WeakPolarHBondContact O-CG1 3.34Å; I203-I207 PolarHBondContact O-N 2.62Å; A204-I207 WeakPolarHBondContact O-CB 3.38Å; A204-I207 PolarHBondContact O-N 3.2Å; A204-I207 VanDerWaalsContact O-N 3.16Å; I207-V217 HydrophobicContact CD1-CG2 3.63Å; I207-P236 HydrophobicContact CD1-CG 4.15Å
208	F	97.3	Very high	97.3	Very high	144 Å²	144	30.3 Å²	30.3	63%	0.632	17%	0.165	S	C	*	.	H	α-helix	trans	-87.1	-23.3	-176.4	-71.4	-65.1	0	0	0	113.8	A204 A205 G206 P236	A204-F208 WeakPolarHBondContact O-CD2 3.48Å; A204-F208 PolarHBondContact O-N 3.31Å; A205-F208 PolarHBondContact O-N 3.18Å; G206-F208 VanDerWaalsContact C-N 3.35Å; G206-F208 PolarHBondContact O-N 3.46Å; F208-P236 HydrophobicContact CE2-CB 3.9Å; F208-P236 HydrophobicContact CZ-CB 3.62Å
209	C	96.8	Very high	97.3	Very high	102 Å²	102	30 Å²	30	69%	0.689	16%	0.164	S	C	*	.	H	α-helix	trans	-105.7	-11.2	-175.9	-63.1	0	0	0	0	114.3	A177 A205 G206	A177-C209 HydrophobicContact CB-CB 3.77Å; A205-C209 VanDerWaalsContact O-CB 3.24Å; A205-C209 WeakPolarHBondContact O-CB 3.49Å; A205-C209 PolarHBondContact O-N 2.81Å; A205-C209 PolarHBondContact O-SG 3.37Å; G206-C209 PolarHBondContact O-N 2.93Å
210	D	96.7	Very high	97.3	Very high	33 Å²	33	30 Å²	30	18%	0.176	16%	0.164	C	C	.	.			trans	-119.1	131	176.6	173.6	40.5	0	0	0	111.4	S173 G174 G206 G212 S213	S173-D210 WeakPolarHBondContact CB-OD2 3.39Å; S173-D210 PolarHBondContact OG-OD2 3.27Å; G174-D210 PolarHBondContact N-OD2 2.94Å; G206-D210 VanDerWaalsContact O-CB 3.28Å; G206-D210 WeakPolarHBondContact O-CB 3.46Å; G206-D210 PolarHBondContact O-N 3.01Å; D210-G212 VanDerWaalsContact C-N 3.29Å; D210-G212 PolarHBondContact O-N 2.95Å; D210-G212 PolarHBondContact OD1-N 3.09Å; D210-S213 PolarHBondContact O-N 3.45Å; D210-S213 WeakPolarHBondContact OD2-CB 3.16Å; D210-S213 PolarHBondContact OD2-N 2.75Å; D210-S213 VanDerWaalsContact OD2-N 3.08Å; D210-S213 PolarHBondContact OD2-OG 2.94Å
211	L	95.3	Very high	97.3	Very high	145 Å²	145	27.1 Å²	27.1	76%	0.759	15%	0.153	S	C	*	.	S	Bend	trans	-67.3	-34.1	179.3	-64.7	175.3	0	0	0	112.2	R63 S213	R63-L211 PolarHBondContact NH1-O 3.44Å; L211-S213 VanDerWaalsContact C-N 3.31Å
212	G	94.1	Very high	97.3	Very high	12 Å²	12	25.9 Å²	25.9	12%	0.124	15%	0.147	C	C	.	.	S	Bend	trans	-71.2	-27.9	-177.4	0	0	0	0	0	113.5	G44 R63 D210	G44-G212 CarbonylContact C-O 3.5Å; G44-G212 VanDerWaalsContact C-O 3.22Å; G44-G212 WeakPolarHBondContact CA-O 3.15Å; G44-G212 VanDerWaalsContact O-O 3.05Å; R63-G212 WeakPolarHBondContact CD-O 3.3Å; D210-G212 VanDerWaalsContact C-N 3.29Å; D210-G212 PolarHBondContact O-N 2.95Å; D210-G212 PolarHBondContact OD1-N 3.09Å
213	S	96.3	Very high	97.3	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	16%	0.157	C	C	.	.			trans	-95.5	153.4	-177.2	-57	0	0	0	0	111.5	T46 D61 R63 D210 L211	T46-S213 PolarHBondContact N-OG 2.68Å; T46-S213 WeakPolarHBondContact OG1-CB 3.21Å; T46-S213 PolarHBondContact OG1-OG 3.01Å; D61-S213 WeakPolarHBondContact OD2-CA 3.49Å; R63-S213 PolarHBondContact NH1-O 2.99Å; R63-S213 VanDerWaalsContact NH1-O 3.08Å; D210-S213 PolarHBondContact O-N 3.45Å; D210-S213 WeakPolarHBondContact OD2-CB 3.16Å; D210-S213 PolarHBondContact OD2-N 2.75Å; D210-S213 VanDerWaalsContact OD2-N 3.08Å; D210-S213 PolarHBondContact OD2-OG 2.94Å; L211-S213 VanDerWaalsContact C-N 3.31Å
214	G	95.4	Very high	97.1	Very high	0 Å²	0	36 Å²	36	0%	0	20%	0.197	C	C	.	.			trans	164.1	-167.3	174.6	0	0	0	0	0	116.7	D61 T62 R63	D61-G214 PolarHBondContact OD2-N 3.32Å; T62-G214 PolarHBondContact N-O 3.1Å; R63-G214 WeakPolarHBondContact CB-O 3.35Å; R63-G214 PolarHBondContact N-O 2.78Å; R63-G214 VanDerWaalsContact N-O 3.14Å
215	S	96.1	Very high	96.9	Very high	18 Å²	18	40.4 Å²	40.4	13%	0.126	23%	0.233	C	C	.	.	S	Bend	trans	71.5	-122.7	-177.6	-52.5	0	0	0	0	112	T62 K73 P236	T62-S215 WeakPolarHBondContact OG1-CB 3.36Å; K73-S215 WeakPolarHBondContact O-CB 3.44Å; K73-S215 PolarHBondContact O-OG 2.99Å; S215-P236 WeakPolarHBondContact O-CD 3.49Å
216	N	97.4	Very high	96.7	Very high	31 Å²	31	41 Å²	41	17%	0.166	24%	0.242	C	C	.	.			trans	-96.4	165.7	-174.3	-55.4	-25.1	0	0	0	110.9	D61 T62 D234	D61-N216 WeakPolarHBondContact CA-O 3.39Å; T62-N216 HydrophobicContact CG2-CB 3.86Å; T62-N216 PolarHBondContact N-O 2.72Å; T62-N216 VanDerWaalsContact N-O 3.13Å; T62-N216 PolarHBondContact OG1-N 3.02Å; N216-D234 WeakPolarHBondContact CA-O 3.45Å
217	V	98.1	Very high	96.7	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	127.7	169.2	-177.3	0	0	0	0	108.9	R200 I203 I207 L219 G232 Y233 D234 P236	R200-V217 HydrophobicContact CG-CG1 4.42Å; I203-V217 HydrophobicContact CB-CG1 3.96Å; I203-V217 HydrophobicContact CB-CG2 4.32Å; I203-V217 HydrophobicContact CG1-CG1 4.33Å; I203-V217 HydrophobicContact CG2-CB 4.4Å; I203-V217 HydrophobicContact CG2-CG1 3.96Å; I203-V217 HydrophobicContact CG2-CG2 3.88Å; I207-V217 HydrophobicContact CD1-CG2 3.63Å; V217-L219 HydrophobicContact CG1-CD2 4.36Å; V217-G232 CarbonylContact O-C 3.54Å; V217-Y233 PolarHBondContact O-N 3.46Å; V217-D234 HydrophobicContact CB-CB 4.18Å; V217-D234 HydrophobicContact CG2-CB 4.31Å; V217-D234 PolarHBondContact N-O 3.06Å; V217-D234 PolarHBondContact O-N 2.9Å; V217-P236 HydrophobicContact CG2-CG 4.36Å
218	D	98.4	Very high	96.7	Very high	0 Å²	0	47 Å²	47	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	146.9	168	-54.7	-46.7	0	0	0	110.8	G59 A60 T62 I78 L230 R231 G232	G59-D218 VanDerWaalsContact CA-O 3.3Å; G59-D218 WeakPolarHBondContact CA-O 3.42Å; A60-D218 PolarHBondContact N-O 3.1Å; A60-D218 VanDerWaalsContact N-O 3.13Å; A60-D218 PolarHBondContact O-N 3.38Å; T62-D218 WeakPolarHBondContact CG2-OD2 3.42Å; I78-D218 HydrophobicContact CD1-CB 4.31Å; D218-L230 WeakPolarHBondContact CA-O 3.48Å; D218-R231 WeakPolarHBondContact OD1-CA 3.18Å; D218-R231 VanDerWaalsContact OD1-CD 3.28Å; D218-R231 WeakPolarHBondContact OD1-CD 3.2Å; D218-R231 IonicContact OD1-CZ 3.71Å; D218-R231 IonicContact OD1-NE 2.63Å; D218-R231 IonicContact OD1-NH1 3.88Å; D218-R231 IonicContact OD2-CZ 3.29Å; D218-R231 IonicContact OD2-NE 3.34Å; D218-R231 IonicContact OD2-NH1 2.78Å; D218-R231 PolarHBondContact OD2-NH1 2.84Å; D218-R231 IonicContact OD2-NH2 3.47Å; D218-G232 PolarHBondContact OD1-N 3.3Å
219	L	98.4	Very high	96.8	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	143.5	171.8	-61.5	-180	0	0	0	110.1	I57 L58 K196 V199 V217 L230 Y233	I57-L219 HydrophobicContact CG2-CD2 4.28Å; L58-L219 CarbonylContact O-C 3.5Å; L58-L219 WeakPolarHBondContact O-CA 3.4Å; K196-L219 HydrophobicContact CB-CD1 4.19Å; K196-L219 HydrophobicContact CG-CD1 4.33Å; V199-L219 HydrophobicContact CB-CD2 3.95Å; V199-L219 HydrophobicContact CG1-CD2 3.46Å; V199-L219 VanDerWaalsContact CG1-CD2 3.46Å; V217-L219 HydrophobicContact CG1-CD2 4.36Å; L219-L230 HydrophobicContact CB-CB 4.29Å; L219-L230 HydrophobicContact CB-CD1 4.44Å; L219-L230 PolarHBondContact N-O 2.81Å; L219-L230 WeakPolarHBondContact O-CA 3.49Å; L219-L230 WeakPolarHBondContact O-CB 3.49Å; L219-L230 PolarHBondContact O-N 3.35Å; L219-Y233 HydrophobicContact CD1-CD1 3.4Å; L219-Y233 HydrophobicContact CD1-CD2 4.1Å; L219-Y233 HydrophobicContact CD1-CE1 3.56Å; L219-Y233 HydrophobicContact CD1-CE2 4.24Å; L219-Y233 HydrophobicContact CD1-CG 3.68Å; L219-Y233 HydrophobicContact CG-CD1 3.99Å; L219-Y233 HydrophobicContact CG-CG 4.09Å
220	C	98.5	Very high	96.8	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	113.4	169.3	-172.3	0	0	0	0	108.3	I57 L58 I78 V227 Y229	I57-C220 CarbonylContact C-O 3.6Å; I57-C220 WeakPolarHBondContact CA-O 3.5Å; L58-C220 HydrophobicContact CB-CB 4.26Å; L58-C220 PolarHBondContact N-O 3.31Å; L58-C220 PolarHBondContact O-N 3.28Å; I78-C220 HydrophobicContact CD1-CB 4.06Å; I78-C220 HydrophobicContact CG2-CB 3.88Å; C220-V227 VanDerWaalsContact SG-CG1 3.55Å; C220-Y229 HydrophobicContact CB-CD2 3.87Å; C220-Y229 HydrophobicContact CB-CE2 4.39Å
221	V	98.6	Very high	96.7	Very high	5 Å²	5	42.8 Å²	42.8	3%	0.03	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	121.6	178.5	-178.9	0	0	0	0	108.1	F52 I57 L192 K196 T223 V227 Q228 L230	F52-V221 HydrophobicContact CE1-CG1 4.43Å; F52-V221 HydrophobicContact CZ-CG1 4.3Å; I57-V221 HydrophobicContact CD1-CG2 4.44Å; I57-V221 HydrophobicContact CG1-CG1 4.48Å; I57-V221 HydrophobicContact CG1-CG2 4.24Å; I57-V221 HydrophobicContact CG2-CG2 4.49Å; L192-V221 HydrophobicContact CD1-CG1 3.52Å; L192-V221 HydrophobicContact CD1-CG2 4.32Å; K196-V221 HydrophobicContact CG-CG2 4.3Å; V221-T223 HydrophobicContact CG1-CG2 4.11Å; V221-V227 CarbonylContact O-C 3.59Å; V221-V227 WeakPolarHBondContact O-CA 3.09Å; V221-Q228 HydrophobicContact CB-CB 4.42Å; V221-Q228 PolarHBondContact N-O 3.17Å; V221-Q228 PolarHBondContact O-N 2.87Å; V221-L230 HydrophobicContact CG2-CD1 4.45Å
222	I	98.4	Very high	96.6	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	117.3	-178.9	-49.5	175.9	0	0	0	107.4	G55 V56 L58 Y86 G145 V147 V227	G55-I222 CarbonylContact C-O 3.6Å; G55-I222 VanDerWaalsContact CA-O 3.27Å; G55-I222 WeakPolarHBondContact CA-O 3.26Å; V56-I222 HydrophobicContact CG2-CB 3.72Å; V56-I222 HydrophobicContact CG2-CD1 3.82Å; V56-I222 HydrophobicContact CG2-CG1 4.11Å; V56-I222 HydrophobicContact CG2-CG2 4.37Å; V56-I222 PolarHBondContact N-O 3.28Å; V56-I222 PolarHBondContact O-N 2.89Å; L58-I222 HydrophobicContact CD1-CD1 4.38Å; Y86-I222 HydrophobicContact CD2-CD1 3.99Å; Y86-I222 HydrophobicContact CD2-CG1 4.43Å; Y86-I222 HydrophobicContact CG-CD1 4.31Å; G145-I222 WeakPolarHBondContact O-CD1 2.95Å; V147-I222 HydrophobicContact CB-CG2 4.33Å; V147-I222 HydrophobicContact CG2-CG2 3.93Å; V147-I222 WeakPolarHBondContact CG2-O 3.29Å; I222-V227 HydrophobicContact CB-CG2 4.24Å; I222-V227 HydrophobicContact CG1-CG1 4.25Å; I222-V227 HydrophobicContact CG1-CG2 4.12Å; I222-V227 HydrophobicContact CG2-CG2 3.84Å
223	T	97.8	Very high	96.8	Very high	36 Å²	36	40.7 Å²	40.7	22%	0.221	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	173	177.1	63	0	0	0	0	109.9	F52 V221 A225 G226	F52-T223 HydrophobicContact CZ-CG2 3.87Å; V221-T223 HydrophobicContact CG1-CG2 4.11Å; T223-A225 PolarHBondContact O-N 2.96Å; T223-A225 PolarHBondContact OG1-N 2.9Å; T223-G226 PolarHBondContact N-O 3.15Å; T223-G226 PolarHBondContact O-N 3.01Å; T223-G226 PolarHBondContact OG1-N 3.48Å; T223-G226 PolarHBondContact OG1-O 3.5Å
224	Q	94.8	Very high	96.8	Very high	177 Å²	177	42.7 Å²	42.7	83%	0.827	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-28.4	172.6	-169	174.7	8.2	0	0	113	V147 G226	V147-Q224 HydrophobicContact CG1-CB 4.32Å; Q224-G226 VanDerWaalsContact C-N 3.35Å
225	A	94.3	Very high	96.7	Very high	105 Å²	105	47.5 Å²	47.5	87%	0.868	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75	-25.3	178.9	0	0	0	0	0	112.9	T223	T223-A225 PolarHBondContact O-N 2.96Å; T223-A225 PolarHBondContact OG1-N 2.9Å
226	G	94.1	Very high	96.5	Very high	35 Å²	35	48.5 Å²	48.5	36%	0.361	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	153	-171.5	-179.1	0	0	0	0	0	113	T223 Q224	T223-G226 PolarHBondContact N-O 3.15Å; T223-G226 PolarHBondContact O-N 3.01Å; T223-G226 PolarHBondContact OG1-N 3.48Å; T223-G226 PolarHBondContact OG1-O 3.5Å; Q224-G226 VanDerWaalsContact C-N 3.35Å
227	V	97.4	Very high	96.2	Very high	45 Å²	45	50.2 Å²	50.2	27%	0.273	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	134.1	-178	-180	0	0	0	0	111	P83 Y86 C220 V221 I222	P83-V227 VanDerWaalsContact O-CG2 3.22Å; P83-V227 WeakPolarHBondContact O-CG2 3.21Å; Y86-V227 HydrophobicContact CD2-CG1 4.07Å; Y86-V227 HydrophobicContact CD2-CG2 4.31Å; Y86-V227 HydrophobicContact CE2-CB 4.01Å; Y86-V227 HydrophobicContact CE2-CG1 3.51Å; Y86-V227 HydrophobicContact CE2-CG2 3.86Å; C220-V227 VanDerWaalsContact SG-CG1 3.55Å; V221-V227 CarbonylContact O-C 3.59Å; V221-V227 WeakPolarHBondContact O-CA 3.09Å; I222-V227 HydrophobicContact CB-CG2 4.24Å; I222-V227 HydrophobicContact CG1-CG1 4.25Å; I222-V227 HydrophobicContact CG1-CG2 4.12Å; I222-V227 HydrophobicContact CG2-CG2 3.84Å
228	Q	97.6	Very high	95.8	Very high	99 Å²	99	58.3 Å²	58.3	46%	0.463	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	109.3	172	-170.1	-178.9	26.1	0	0	109.5	V221 L230	V221-Q228 HydrophobicContact CB-CB 4.42Å; V221-Q228 PolarHBondContact N-O 3.17Å; V221-Q228 PolarHBondContact O-N 2.87Å; Q228-L230 HydrophobicContact CG-CD2 3.76Å; Q228-L230 HydrophobicContact CG-CG 4.11Å
229	Y	97.4	Very high	95.5	Very high	77 Å²	77	66.5 Å²	66.5	30%	0.302	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	113.5	174.1	-171.8	-121.7	0	0	0	110.5	I78 C220 R231	I78-Y229 HydrophobicContact CB-CE2 3.9Å; I78-Y229 HydrophobicContact CD1-CE2 4.07Å; I78-Y229 HydrophobicContact CG1-CE2 4.34Å; I78-Y229 HydrophobicContact CG2-CE2 4.28Å; C220-Y229 HydrophobicContact CB-CD2 3.87Å; C220-Y229 HydrophobicContact CB-CE2 4.39Å; Y229-R231 HydrophobicContact CE1-CB 4.18Å; Y229-R231 PolarHBondContact OH-NH1 3.25Å
230	L	97	Very high	95.3	Very high	36 Å²	36	69.5 Å²	69.5	19%	0.188	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	86.9	-176.5	-59.6	174.5	0	0	0	109.3	D218 L219 V221 Q228 Y233	D218-L230 WeakPolarHBondContact CA-O 3.48Å; L219-L230 HydrophobicContact CB-CB 4.29Å; L219-L230 HydrophobicContact CB-CD1 4.44Å; L219-L230 PolarHBondContact N-O 2.81Å; L219-L230 WeakPolarHBondContact O-CA 3.49Å; L219-L230 WeakPolarHBondContact O-CB 3.49Å; L219-L230 PolarHBondContact O-N 3.35Å; V221-L230 HydrophobicContact CG2-CD1 4.45Å; Q228-L230 HydrophobicContact CG-CD2 3.76Å; Q228-L230 HydrophobicContact CG-CG 4.11Å; L230-Y233 HydrophobicContact CB-CD2 4.39Å; L230-Y233 HydrophobicContact CD1-CD2 4Å; L230-Y233 HydrophobicContact CD1-CE2 4.37Å
231	R	95.7	Very high	95.1	Very high	77 Å²	77	79.2 Å²	79.2	29%	0.291	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	131.2	176.3	-171	77.1	-170.5	165.9	9	110.6	T62 N74 C75 M76 D218 Y229 Y233	T62-R231 VanDerWaalsContact CG2-NH2 3.28Å; N74-R231 VanDerWaalsContact C-NH2 3.33Å; N74-R231 PolarHBondContact O-NH2 2.89Å; N74-R231 VanDerWaalsContact O-NH2 3.1Å; N74-R231 PolarHBondContact OD1-NE 3.46Å; N74-R231 PolarHBondContact OD1-NH2 3.03Å; C75-R231 VanDerWaalsContact C-NH2 3.28Å; C75-R231 PolarHBondContact O-NH1 3.39Å; C75-R231 PolarHBondContact O-NH2 3.47Å; M76-R231 VanDerWaalsContact CG-NH1 3.35Å; D218-R231 WeakPolarHBondContact OD1-CA 3.18Å; D218-R231 VanDerWaalsContact OD1-CD 3.28Å; D218-R231 WeakPolarHBondContact OD1-CD 3.2Å; D218-R231 IonicContact OD1-CZ 3.71Å; D218-R231 IonicContact OD1-NE 2.63Å; D218-R231 IonicContact OD1-NH1 3.88Å; D218-R231 IonicContact OD2-CZ 3.29Å; D218-R231 IonicContact OD2-NE 3.34Å; D218-R231 IonicContact OD2-NH1 2.78Å; D218-R231 PolarHBondContact OD2-NH1 2.84Å; D218-R231 IonicContact OD2-NH2 3.47Å; Y229-R231 HydrophobicContact CE1-CB 4.18Å; Y229-R231 PolarHBondContact OH-NH1 3.25Å; R231-Y233 VanDerWaalsContact C-N 3.31Å; R231-Y233 PolarHBondContact O-N 3.47Å
232	G	93.7	Very high	94.9	Very high	20 Å²	20	87.2 Å²	87.2	21%	0.206	46%	0.457	C	S	.	.	E	Extended strand (participates in β ladder)	trans	62	38.4	179.2	0	0	0	0	0	113.2	V217 D218 D234	V217-G232 CarbonylContact O-C 3.54Å; D218-G232 PolarHBondContact OD1-N 3.3Å; G232-D234 VanDerWaalsContact C-N 3.26Å; G232-D234 PolarHBondContact O-N 3.28Å
233	Y	96.8	Very high	94.8	Very high	94 Å²	94	97 Å²	97	37%	0.369	50%	0.503	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-54.7	-41.1	179.6	175.6	-101.3	0	0	0	112.4	R200 V217 L219 L230 R231	R200-Y233 HydrophobicContact CB-CD1 4.25Å; R200-Y233 HydrophobicContact CB-CE1 3.92Å; R200-Y233 HydrophobicContact CG-CD1 3.98Å; R200-Y233 HydrophobicContact CG-CE1 3.86Å; V217-Y233 PolarHBondContact O-N 3.46Å; L219-Y233 HydrophobicContact CD1-CD1 3.4Å; L219-Y233 HydrophobicContact CD1-CD2 4.1Å; L219-Y233 HydrophobicContact CD1-CE1 3.56Å; L219-Y233 HydrophobicContact CD1-CE2 4.24Å; L219-Y233 HydrophobicContact CD1-CG 3.68Å; L219-Y233 HydrophobicContact CG-CD1 3.99Å; L219-Y233 HydrophobicContact CG-CG 4.09Å; L230-Y233 HydrophobicContact CB-CD2 4.39Å; L230-Y233 HydrophobicContact CD1-CD2 4Å; L230-Y233 HydrophobicContact CD1-CE2 4.37Å; R231-Y233 VanDerWaalsContact C-N 3.31Å; R231-Y233 PolarHBondContact O-N 3.47Å
234	D	96.3	Very high	94.6	Very high	41 Å²	41	96.9 Å²	96.9	22%	0.219	51%	0.508	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	149	171	-163.9	10	0	0	0	111.1	R200 N216 V217 G232	R200-D234 VanDerWaalsContact CD-OD2 3.26Å; R200-D234 WeakPolarHBondContact CD-OD2 3.43Å; R200-D234 HydrophobicContact CG-CB 3.92Å; R200-D234 IonicContact CZ-OD2 2.77Å; R200-D234 IonicContact NE-OD2 2.74Å; R200-D234 IonicContact NH1-OD2 3.99Å; R200-D234 PolarHBondContact NH1-OD2 3.01Å; N216-D234 WeakPolarHBondContact CA-O 3.45Å; V217-D234 HydrophobicContact CB-CB 4.18Å; V217-D234 HydrophobicContact CG2-CB 4.31Å; V217-D234 PolarHBondContact N-O 3.06Å; V217-D234 PolarHBondContact O-N 2.9Å; G232-D234 VanDerWaalsContact C-N 3.26Å; G232-D234 PolarHBondContact O-N 3.28Å
235	Q	94.8	Very high	94.6	Very high	102 Å²	102	96 Å²	96	48%	0.477	50%	0.504	S	S	.	.			trans	-128.7	79.8	179.6	-59.6	-173.6	4.6	0	0	109.6	A237	Q235-A237 PolarHBondContact O-N 3.35Å
236	P	90.9	Very high	94.5	Very high	38 Å²	38	99.1 Å²	99.1	25%	0.247	50%	0.495	C	S	.	.	S	Bend	trans	-60.3	-28.4	-175	-24	32.4	0	0	0	114.4	I207 F208 S215 V217	I207-P236 HydrophobicContact CD1-CG 4.15Å; F208-P236 HydrophobicContact CE2-CB 3.9Å; F208-P236 HydrophobicContact CZ-CB 3.62Å; S215-P236 WeakPolarHBondContact O-CD 3.49Å; V217-P236 HydrophobicContact CG2-CG 4.36Å
237	A	90.3	Very high	94.6	Very high	67 Å²	67	105.7 Å²	105.7	55%	0.554	51%	0.513	S	S	*	.			trans	-128.6	131.5	-178.6	0	0	0	0	0	111.4	Q235	Q235-A237 PolarHBondContact O-N 3.35Å
238	Q	91.3	Very high	94.6	Very high	170 Å²	170	112.6 Å²	112.6	79%	0.794	54%	0.536	S	S	*	.			trans	-108.4	147.2	175.4	-63.9	-175.3	14.6	0	0	111.3
239	K	91.9	Very high	94.5	Very high	173 Å²	173	116.1 Å²	116.1	75%	0.752	55%	0.55	S	S	*	.	P	Polyproline II helix	trans	-76.8	128.8	175.7	-174.1	179.6	175.8	-178.5	0	109.8
240	G	93.3	Very high	94.4	Very high	62 Å²	62	119 Å²	119	64%	0.639	58%	0.578	S	S	*	*	P	Polyproline II helix	trans	-59.4	155	172.6	0	0	0	0	0	113.2
241	K	94.6	Very high	94.3	Very high	205 Å²	205	121 Å²	121	89%	0.891	61%	0.608	S	S	*	*	P	Polyproline II helix	trans	-72.8	141	174	-64.3	-177.2	-177.2	177.7	0	109.4
242	R	94.5	Very high	94.4	Very high	172 Å²	172	121.6 Å²	121.6	65%	0.649	62%	0.62	S	S	*	*	P	Polyproline II helix	trans	-77.5	125.2	173.4	-69.8	175.2	60.7	176.3	-0.6	108.8
243	E	95.8	Very high	94.5	Very high	206 Å²	206	126 Å²	126	96%	0.963	64%	0.642	S	S	*	*			trans	-80.1	-30.7	179.9	-63	-178.6	168.1	0	0	112.9
244	G	94.1	Very high	94.5	Very high	33 Å²	33	126.2 Å²	126.2	34%	0.34	66%	0.664	S	S	.	*	S	Bend	trans	-105.5	149.7	-178.9	0	0	0	0	0	114.7
245	Q	94.2	Very high	94.5	Very high	160 Å²	160	129.3 Å²	129.3	75%	0.748	68%	0.684	S	S	*	*			trans	-100.7	112.6	173	-176.1	173.5	1.8	0	0	111	K247	Q245-K247 HydrophobicContact CG-CB 4.11Å; Q245-K247 HydrophobicContact CG-CG 4.22Å
246	Y	93.8	Very high	94.6	Very high	170 Å²	170	132.8 Å²	132.8	67%	0.667	71%	0.705	S	S	*	*			trans	-102.5	35.6	177.7	-53.9	-48.7	0	0	0	112.6
247	K	96	Very high	94.9	Very high	173 Å²	173	136.8 Å²	136.8	75%	0.752	73%	0.729	S	S	*	*	P	Polyproline II helix	trans	-90.9	117.4	177.7	-70.3	-173	179.2	179.4	0	109.4	Q245	Q245-K247 HydrophobicContact CG-CB 4.11Å; Q245-K247 HydrophobicContact CG-CG 4.22Å
248	Y	95.8	Very high	95.1	Very high	189 Å²	189	141.7 Å²	141.7	74%	0.741	74%	0.738	S	S	*	*	P	Polyproline II helix	trans	-83.7	150.7	173.8	-59	-66	0	0	0	111.4	T252	Y248-T252 WeakPolarHBondContact CB-OG1 3.49Å
249	K	96.7	Very high	95.4	Very high	173 Å²	173	139.5 Å²	139.5	75%	0.752	74%	0.736	S	S	*	*	P	Polyproline II helix	trans	-71.5	150.3	175.2	-65.2	-177.5	-178.5	178.9	0	110	G251 T252	K249-G251 PolarHBondContact O-N 2.71Å; K249-T252 VanDerWaalsContact O-CG2 3.29Å; K249-T252 WeakPolarHBondContact O-CG2 3.21Å; K249-T252 PolarHBondContact O-N 3.21Å; K249-T252 PolarHBondContact O-OG1 3.25Å
250	P	95.6	Very high	95.5	Very high	138 Å²	138	136.5 Å²	136.5	90%	0.896	73%	0.732	S	S	*	*	T	Hydrogen-bonded Turn	trans	-53.8	140.1	171.5	-24.7	34.4	0	0	0	111.6
251	G	95.1	Very high	95.5	Very high	79 Å²	79	139 Å²	139	81%	0.814	74%	0.735	S	S	*	*	T	Hydrogen-bonded Turn	trans	95.2	-3.2	-178.2	0	0	0	0	0	115.5	K249 T253	K249-G251 PolarHBondContact O-N 2.71Å; G251-T253 VanDerWaalsContact C-N 3.34Å
252	T	96.8	Very high	95.4	Very high	89 Å²	89	134.5 Å²	134.5	55%	0.546	73%	0.727	S	S	.	*			trans	-74.3	-22.1	175.9	53.6	0	0	0	0	114.2	Y248 K249	Y248-T252 WeakPolarHBondContact CB-OG1 3.49Å; K249-T252 VanDerWaalsContact O-CG2 3.29Å; K249-T252 WeakPolarHBondContact O-CG2 3.21Å; K249-T252 PolarHBondContact O-N 3.21Å; K249-T252 PolarHBondContact O-OG1 3.25Å
253	T	96.6	Very high	95.2	Very high	111 Å²	111	132.9 Å²	132.9	68%	0.681	73%	0.73	S	S	*	*	S	Bend	trans	-98.9	123.5	-180	-51	0	0	0	0	109.4	G251 V255	G251-T253 VanDerWaalsContact C-N 3.34Å; T253-V255 PolarHBondContact O-N 2.89Å
254	A	96.5	Very high	94.6	Very high	99 Å²	99	129 Å²	129	82%	0.818	72%	0.723	S	S	*	*			trans	-66.6	126.4	175.5	0	0	0	0	0	110.6
255	V	96.6	Very high	94.1	Very high	107 Å²	107	134.3 Å²	134.3	65%	0.648	74%	0.743	S	S	*	*			trans	-113.2	121	177.7	-179.6	0	0	0	0	108.2	T253 K258	T253-V255 PolarHBondContact O-N 2.89Å; V255-K258 HydrophobicContact CG1-CB 4.41Å
256	L	97.2	Very high	93.4	Very high	174 Å²	174	134.1 Å²	134.1	91%	0.911	75%	0.747	S	S	*	*	S	Bend	trans	-77.4	-50.9	-178.6	-63.4	177.6	0	0	0	112.1
257	T	96.3	Very high	92.4	Very high	122 Å²	122	132 Å²	132	75%	0.748	75%	0.751	S	S	*	*			trans	-135.7	139.6	-177.9	-50.9	0	0	0	0	108.8
258	K	95.2	Very high	91.3	Very high	171 Å²	171	129 Å²	129	74%	0.743	75%	0.747	S	S	*	*			trans	-130.2	127.4	176.7	-177.2	-177.4	177.9	-175.3	0	108.8	V255 V260	V255-K258 HydrophobicContact CG1-CB 4.41Å; K258-V260 HydrophobicContact CD-CG2 4.43Å; K258-V260 HydrophobicContact CG-CG2 4.3Å
259	T	96.4	Very high	90.1	Very high	123 Å²	123	127.2 Å²	127.2	76%	0.755	75%	0.75	S	S	*	*			trans	-115	134.7	171.7	-55.7	0	0	0	0	108.3
260	V	95.5	Very high	88.8	Confident	110 Å²	110	127 Å²	127	67%	0.667	75%	0.752	S	S	*	*			trans	-121.5	119.2	177.5	-178.6	0	0	0	0	108	K258	K258-V260 HydrophobicContact CD-CG2 4.43Å; K258-V260 HydrophobicContact CG-CG2 4.3Å
261	T	93.2	Very high	87.6	Confident	115 Å²	115	125.5 Å²	125.5	71%	0.706	75%	0.745	S	S	*	*			trans	-107.6	106.1	177.9	-49.4	0	0	0	0	108.6
262	P	91.2	Very high	86.3	Confident	110 Å²	110	128.7 Å²	128.7	71%	0.714	74%	0.742	S	S	*	*			trans	-69	135.8	175.8	28.5	-31.9	0	0	0	109.9
263	L	90.4	Very high	84.9	Confident	139 Å²	139	132.8 Å²	132.8	73%	0.728	76%	0.755	S	S	*	*			trans	-91.4	117.4	172.7	-65.2	174	0	0	0	108.5	L265	L263-L265 PolarHBondContact O-N 3.21Å
264	P	84.3	Confident	83.2	Confident	125 Å²	125	135 Å²	135	81%	0.812	76%	0.762	S	S	*	*			trans	-73	109.3	169.7	29.1	-30.1	0	0	0	108.2
265	L	83.5	Confident	81.7	Confident	143 Å²	143	138.7 Å²	138.7	75%	0.749	76%	0.764	S	S	*	*			trans	-109.5	114.9	172.7	-67.4	168.6	0	0	0	107.2	L263 V267	L263-L265 PolarHBondContact O-N 3.21Å; L265-V267 PolarHBondContact O-N 3.37Å
266	D	78.3	Confident	80.1	Confident	157 Å²	157	141.2 Å²	141.2	84%	0.84	77%	0.774	S	S	*	*			trans	-74.4	110.3	167.4	-70.4	-29.8	0	0	0	107.5	V268	D266-V268 PolarHBondContact O-N 3.48Å; D266-V268 VanDerWaalsContact O-N 3.15Å
267	V	72.9	Confident	78.5	Confident	124 Å²	124	139.6 Å²	139.6	75%	0.752	77%	0.771	S	S	*	*			trans	-76.3	101.1	173.4	-178.5	0	0	0	0	107.1	L265	L265-V267 PolarHBondContact O-N 3.37Å
268	V	74.5	Confident	76.4	Confident	111 Å²	111	146.2 Å²	146.2	67%	0.673	79%	0.794	S	S	*	*			trans	-89.3	105.7	172.5	-172.6	0	0	0	0	107.6	D266 E270	D266-V268 PolarHBondContact O-N 3.48Å; D266-V268 VanDerWaalsContact O-N 3.15Å; V268-E270 HydrophobicContact CG1-CG 4.26Å; V268-E270 PolarHBondContact O-N 3.12Å
269	D	70.6	Confident	75.5	Confident	151 Å²	151	145 Å²	145	81%	0.807	80%	0.797	S	S	*	*			trans	-77.9	102.4	169.8	-83.7	-21.3	0	0	0	108.9
270	E	68.4	Low	74.4	Confident	169 Å²	169	146.2 Å²	146.2	79%	0.79	80%	0.799	S	S	*	*			trans	-87.9	109.4	168.9	-76	-171.6	164.6	0	0	110.1	V268 I272	V268-E270 HydrophobicContact CG1-CG 4.26Å; V268-E270 PolarHBondContact O-N 3.12Å; E270-I272 PolarHBondContact O-N 3.2Å
271	S	69.4	Low	73.2	Confident	107 Å²	107	148.2 Å²	148.2	75%	0.748	81%	0.806	S	S	*	*			trans	-82.4	103.8	168.3	61.2	0	0	0	0	109.9	Q273	S271-Q273 PolarHBondContact O-N 3.34Å
272	I	68.4	Low	72	Confident	145 Å²	145	150.1 Å²	150.1	74%	0.744	81%	0.812	S	S	*	*			trans	-74.2	105.5	172.1	-58.7	171.4	0	0	0	108.2	E270 L274	E270-I272 PolarHBondContact O-N 3.2Å; I272-L274 PolarHBondContact O-N 3.13Å
273	Q	67.8	Low	70.8	Confident	175 Å²	175	152.6 Å²	152.6	82%	0.818	82%	0.818	S	S	*	*			trans	-79.9	109.1	165.8	-71.2	-172.7	-11.5	0	0	108.6	S271 M275	S271-Q273 PolarHBondContact O-N 3.34Å; Q273-M275 PolarHBondContact O-N 3.44Å
274	L	61.3	Low	69.5	Low	159 Å²	159	153.5 Å²	153.5	83%	0.832	82%	0.824	S	S	*	*			trans	-69.3	115	167	-74.6	161.2	0	0	0	108	I272	I272-L274 PolarHBondContact O-N 3.13Å
275	M	65.5	Low	68.5	Low	176 Å²	176	155.6 Å²	155.6	87%	0.867	83%	0.825	S	S	*	*			trans	-75.4	122.1	165.8	-89.6	-168.3	-179.4	0	0	108.6	Q273 T277	Q273-M275 PolarHBondContact O-N 3.44Å; M275-T277 PolarHBondContact O-N 3.48Å; M275-T277 VanDerWaalsContact O-N 3.12Å
276	D	62.1	Low	67.3	Low	160 Å²	160	156.5 Å²	156.5	86%	0.856	83%	0.831	S	S	*	*			trans	-66.5	106.2	166.4	-81.3	-29.6	0	0	0	109	Q278	D276-Q278 PolarHBondContact O-N 3.11Å
277	T	63.1	Low	66.4	Low	139 Å²	139	156.5 Å²	156.5	85%	0.853	83%	0.83	S	S	*	*			trans	-78.7	103.7	163.8	47.7	0	0	0	0	108.2	M275	M275-T277 PolarHBondContact O-N 3.48Å; M275-T277 VanDerWaalsContact O-N 3.12Å
278	Q	52.7	Low	65.8	Low	262 Å²	262	159.5 Å²	159.5	100%	1.224	84%	0.837	S	S	*	*			trans	-67.7	0	164.4	-72.2	-173.4	-6	0	0	111.5	D276	D276-Q278 PolarHBondContact O-N 3.11Å

Retrieved 278 of 278 residues in 432.3 ms (Link to these results)

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