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Cleavage and polyadenylation specificity factor subunit 5

Component of the cleavage factor Im (CFIm) complex that functions as an activator of the pre-mRNA 3'-end cleavage and polyadenylation processing required for the maturation of pre-mRNA into functional mRNAs. CFIm contributes to the recruitment of multiprotein complexes on specific sequences on the pre-mRNA 3'-end, so called cleavage and polyadenylation signals (pA signals). Most pre-mRNAs contain multiple pA signals, resulting in alternative cleavage and polyadenylation (APA) producing mRNAs with variable 3'-end formation. The CFIm complex acts as a key regulator of cleavage and polyadenylation site choice during APA through its binding to 5'-UGUA-3' elements localized in the 3'-untranslated region (UTR) for a huge number of pre-mRNAs.

AlphaFold DB (A0A2K6D3J5), UniProt , Accession A0A096NIH1, Species PAPAN (Papio anubis, Olive baboon), Gene NUDT21, Length 227 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	42.9	Very low	48.6	Very low	244 Å²	244	152.4 Å²	152.4	100%	1.202	84%	0.843	S	S	*	*				0	106.9	0	-70.6	179.2	-173	0	0	107.5
2	S	41.3	Very low	49.7	Very low	115 Å²	115	145.1 Å²	145.1	80%	0.804	83%	0.828	S	S	*	*			trans	-84.1	121.6	-176.4	45	0	0	0	0	110.3
3	V	46.8	Very low	50.6	Low	146 Å²	146	152.4 Å²	152.4	89%	0.885	83%	0.834	S	S	*	*			trans	-86.9	114.1	178.3	-153.1	0	0	0	0	108.2
4	V	47.6	Very low	51.4	Low	124 Å²	124	150.4 Å²	150.4	75%	0.752	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-82.2	129.2	175.8	-177.2	0	0	0	0	108.3
5	P	48.7	Very low	51.9	Low	105 Å²	105	156.1 Å²	156.1	68%	0.682	84%	0.836	S	S	*	*	P	Polyproline II helix	trans	-76.2	148.5	176.5	25.5	-22.8	0	0	0	111
6	P	48.8	Very low	51.8	Low	124 Å²	124	150.6 Å²	150.6	81%	0.805	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-70.6	136.3	-176	27.6	-32	0	0	0	111.5	R8	P6-R8 PolarHBondContact O-N 3.33Å
7	N	46.7	Very low	51.7	Low	162 Å²	162	149.3 Å²	149.3	87%	0.866	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-62.8	117.6	178.8	-157.1	7.3	0	0	0	109.9	S9	N7-S9 PolarHBondContact O-N 3.22Å
8	R	50.2	Low	51.5	Low	232 Å²	232	147.4 Å²	147.4	88%	0.875	82%	0.819	S	S	*	*			trans	-68.4	114.7	172.5	-86.4	-177	179.2	177.3	-0.4	108.6	P6 Q10	P6-R8 PolarHBondContact O-N 3.33Å; R8-Q10 PolarHBondContact O-N 3.04Å; R8-Q10 VanDerWaalsContact O-N 3.16Å
9	S	51	Low	51.3	Low	97 Å²	97	149.2 Å²	149.2	68%	0.678	82%	0.82	S	S	*	*			trans	-56.5	115.1	168.7	52.3	0	0	0	0	110.1	N7 T11	N7-S9 PolarHBondContact O-N 3.22Å; S9-T11 VanDerWaalsContact C-N 3.34Å; S9-T11 PolarHBondContact O-N 3.16Å
10	Q	58.3	Low	51	Low	196 Å²	196	150.1 Å²	150.1	92%	0.916	82%	0.816	S	S	*	*			trans	-72.2	90.7	166.2	-73.7	-172.1	6.3	0	0	108.9	R8	R8-Q10 PolarHBondContact O-N 3.04Å; R8-Q10 VanDerWaalsContact O-N 3.16Å
11	T	52.3	Low	51	Low	131 Å²	131	146.8 Å²	146.8	80%	0.804	82%	0.816	S	S	*	*			trans	-94.7	104	164.1	51.8	0	0	0	0	108.5	S9	S9-T11 VanDerWaalsContact C-N 3.34Å; S9-T11 PolarHBondContact O-N 3.16Å
12	G	62.4	Low	50.9	Low	65 Å²	65	139.6 Å²	139.6	67%	0.67	78%	0.783	S	S	*	*	S	Bend	trans	-177.7	153.7	174.7	0	0	0	0	0	111.2
13	W	60.9	Low	51.4	Low	240 Å²	240	144.4 Å²	144.4	91%	0.909	79%	0.789	S	S	*	*			trans	-52.6	139.6	173.1	-72.9	80.6	0	0	0	110.6	R15	W13-R15 PolarHBondContact O-N 3.27Å; W13-R15 VanDerWaalsContact O-N 3.1Å
14	P	61.7	Low	51.7	Low	125 Å²	125	146.1 Å²	146.1	81%	0.812	78%	0.781	S	S	*	*			trans	-59.8	117.5	-175.8	19.5	-28.8	0	0	0	110.6	G16	P14-G16 PolarHBondContact O-N 3.21Å
15	R	58.5	Low	52.1	Low	235 Å²	235	147.7 Å²	147.7	89%	0.887	78%	0.784	S	S	*	*			trans	-83.2	93.8	176.2	-67.1	-172.5	-175.2	-168.7	1.4	108.9	W13 V17	W13-R15 PolarHBondContact O-N 3.27Å; W13-R15 VanDerWaalsContact O-N 3.1Å; R15-V17 PolarHBondContact O-N 3.18Å
16	G	50.7	Low	52.2	Low	68 Å²	68	152 Å²	152	70%	0.701	80%	0.795	S	S	*	*			trans	-63.2	116.3	161.2	0	0	0	0	0	108.9	P14 T18	P14-G16 PolarHBondContact O-N 3.21Å; G16-T18 PolarHBondContact O-N 3.1Å
17	V	50.9	Low	52.8	Low	129 Å²	129	154.3 Å²	154.3	78%	0.782	80%	0.795	S	S	*	*			trans	-80.7	94.6	173.3	-177.2	0	0	0	0	107.6	R15	R15-V17 PolarHBondContact O-N 3.18Å
18	T	46.9	Very low	54.1	Low	115 Å²	115	153.1 Å²	153.1	71%	0.706	79%	0.794	S	S	*	*			trans	-101.4	96.5	165.1	14.7	0	0	0	0	108.8	G16 F20	G16-T18 PolarHBondContact O-N 3.1Å; T18-F20 HydrophobicContact CG2-CD2 4.14Å; T18-F20 HydrophobicContact CG2-CE2 4.01Å; T18-F20 PolarHBondContact O-N 3.2Å
19	Q	48.8	Very low	55.5	Low	182 Å²	182	148.6 Å²	148.6	85%	0.85	78%	0.78	S	S	*	*			trans	-72.6	97.4	162.4	-84.3	-177	-21.9	0	0	108.4
20	F	44.6	Very low	57.2	Low	167 Å²	167	147.4 Å²	147.4	73%	0.732	77%	0.77	S	S	*	*			trans	-115.4	102.2	158.1	-82.3	-82.4	0	0	0	107.9	T18 N22	T18-F20 HydrophobicContact CG2-CD2 4.14Å; T18-F20 HydrophobicContact CG2-CE2 4.01Å; T18-F20 PolarHBondContact O-N 3.2Å; F20-N22 PolarHBondContact O-N 3.33Å
21	G	50.6	Low	58.6	Low	80 Å²	80	143.8 Å²	143.8	83%	0.825	76%	0.756	S	S	*	*			trans	-69.4	115.2	168.8	0	0	0	0	0	108.8
22	N	41.4	Very low	60.2	Low	93 Å²	93	144 Å²	144	50%	0.497	76%	0.758	S	S	.	*			trans	-120.5	116.3	172.5	-77.4	-28.6	0	0	0	110.5	F20 Y24	F20-N22 PolarHBondContact O-N 3.33Å; N22-Y24 HydrophobicContact CB-CD2 3.44Å; N22-Y24 VanDerWaalsContact CB-CD2 3.44Å; N22-Y24 HydrophobicContact CB-CE1 4.2Å; N22-Y24 HydrophobicContact CB-CE2 3.02Å; N22-Y24 HydrophobicContact CB-CG 4.22Å; N22-Y24 VanDerWaalsContact CB-CZ 3.45Å; N22-Y24 WeakPolarHBondContact ND2-CE2 3.49Å; N22-Y24 VanDerWaalsContact ND2-CZ 3.32Å; N22-Y24 PolarHBondContact ND2-OH 3.2Å; N22-Y24 PolarHBondContact O-N 2.77Å
23	K	52	Low	61.3	Low	217 Å²	217	147.5 Å²	147.5	94%	0.943	76%	0.76	S	S	*	*			trans	-67.5	100.4	158.5	-70.5	178.1	175.3	179.1	0	107.2
24	Y	53.1	Low	62.7	Low	182 Å²	182	139.2 Å²	139.2	71%	0.714	73%	0.732	S	S	*	*			trans	-105.7	121.8	171	-70.3	-65	0	0	0	110	N22	N22-Y24 HydrophobicContact CB-CD2 3.44Å; N22-Y24 VanDerWaalsContact CB-CD2 3.44Å; N22-Y24 HydrophobicContact CB-CE1 4.2Å; N22-Y24 HydrophobicContact CB-CE2 3.02Å; N22-Y24 HydrophobicContact CB-CG 4.22Å; N22-Y24 VanDerWaalsContact CB-CZ 3.45Å; N22-Y24 WeakPolarHBondContact ND2-CE2 3.49Å; N22-Y24 VanDerWaalsContact ND2-CZ 3.32Å; N22-Y24 PolarHBondContact ND2-OH 3.2Å; N22-Y24 PolarHBondContact O-N 2.77Å
25	I	55.3	Low	64.3	Low	156 Å²	156	135 Å²	135	80%	0.8	70%	0.7	S	S	*	*			trans	-46.6	134.4	158.4	-66.9	164.6	0	0	0	107.7	Q27	I25-Q27 PolarHBondContact O-N 3.31Å
26	Q	50.7	Low	66.2	Low	197 Å²	197	126.5 Å²	126.5	92%	0.921	67%	0.674	S	S	*	*			trans	-67	75.1	173.8	-81.9	177.7	-23.2	0	0	110
27	Q	62.4	Low	68.5	Low	171 Å²	171	123.4 Å²	123.4	80%	0.799	64%	0.642	S	S	*	*	P	Polyproline II helix	trans	-70.3	132	155.6	-87.7	176.9	-23.4	0	0	107.3	I25 K29	I25-Q27 PolarHBondContact O-N 3.31Å; Q27-K29 PolarHBondContact O-N 2.92Å
28	T	73.1	Confident	70.7	Confident	138 Å²	138	120.5 Å²	120.5	85%	0.847	62%	0.621	S	S	*	*	P	Polyproline II helix	trans	-53.1	132.5	168.7	42.1	0	0	0	0	108.4
29	K	80.6	Confident	73.2	Confident	137 Å²	137	115.1 Å²	115.1	60%	0.596	59%	0.588	S	S	*	*	P	Polyproline II helix	trans	-57.3	143.5	-178.6	-64.8	177.6	-168.7	167.4	0	109.6	Q27 L31 E34	Q27-K29 PolarHBondContact O-N 2.92Å; K29-L31 PolarHBondContact O-N 3.14Å; K29-E34 HydrophobicContact CD-CB 4.49Å; K29-E34 VanDerWaalsContact CD-OE2 3.25Å; K29-E34 WeakPolarHBondContact CD-OE2 3.27Å; K29-E34 IonicContact NZ-OE2 3.88Å; K29-E34 PolarHBondContact NZ-OE2 3.1Å
30	P	86.3	Confident	75.6	Confident	72 Å²	72	108.2 Å²	108.2	47%	0.468	56%	0.555	S	S	.	*	P	Polyproline II helix	trans	-51.5	138.2	174.8	-26.7	31.3	0	0	0	112.7	T32 L33 E34	P30-T32 PolarHBondContact O-N 2.75Å; P30-T32 VanDerWaalsContact O-N 3.09Å; P30-L33 HydrophobicContact CB-CD1 4.41Å; P30-L33 HydrophobicContact CB-CG 4.33Å; P30-L33 HydrophobicContact CG-CD1 4.06Å; P30-L33 PolarHBondContact O-N 2.75Å; P30-E34 PolarHBondContact O-N 2.88Å; P30-E34 VanDerWaalsContact O-N 3.12Å
31	L	86.5	Confident	78.1	Confident	119 Å²	119	101.7 Å²	101.7	62%	0.623	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-20.5	176.5	-64.4	178.5	0	0	0	113.2	K29 L33	K29-L31 PolarHBondContact O-N 3.14Å; L31-L33 VanDerWaalsContact C-N 3.33Å
32	T	86.3	Confident	80.4	Confident	135 Å²	135	99.7 Å²	99.7	83%	0.828	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.1	-23.4	173.5	52.6	0	0	0	0	113.4	P30	P30-T32 PolarHBondContact O-N 2.75Å; P30-T32 VanDerWaalsContact O-N 3.09Å
33	L	85.6	Confident	83.1	Confident	139 Å²	139	101.2 Å²	101.2	73%	0.728	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.1	-37.3	178.8	-67.3	179.4	0	0	0	112	P30 L31	P30-L33 HydrophobicContact CB-CD1 4.41Å; P30-L33 HydrophobicContact CB-CG 4.33Å; P30-L33 HydrophobicContact CG-CD1 4.06Å; P30-L33 PolarHBondContact O-N 2.75Å; L31-L33 VanDerWaalsContact C-N 3.33Å
34	E	90.1	Very high	85.3	Confident	67 Å²	67	92.8 Å²	92.8	31%	0.313	48%	0.478	S	S	.	.			trans	-144.5	107.1	179.1	-168.1	171.6	176.9	0	0	109.6	K29 P30 N223	K29-E34 HydrophobicContact CD-CB 4.49Å; K29-E34 VanDerWaalsContact CD-OE2 3.25Å; K29-E34 WeakPolarHBondContact CD-OE2 3.27Å; K29-E34 IonicContact NZ-OE2 3.88Å; K29-E34 PolarHBondContact NZ-OE2 3.1Å; P30-E34 PolarHBondContact O-N 2.88Å; P30-E34 VanDerWaalsContact O-N 3.12Å; E34-N223 HydrophobicContact CG-CB 4.25Å; E34-N223 PolarHBondContact OE1-ND2 2.92Å
35	R	96.7	Very high	87.4	Confident	35 Å²	35	84.5 Å²	84.5	13%	0.132	45%	0.445	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	103.7	179.1	-171.7	64	177.3	104	-2.4	109.8	I37 D142 D143 F222 N223	R35-I37 HydrophobicContact CG-CD1 4.28Å; R35-D142 IonicContact NH2-OD2 2.75Å; R35-D143 IonicContact CZ-OD2 2.73Å; R35-D143 VanDerWaalsContact CZ-OD2 3.25Å; R35-D143 IonicContact NE-OD1 3.14Å; R35-D143 PolarHBondContact NE-OD1 3.48Å; R35-D143 IonicContact NE-OD2 3.43Å; R35-D143 PolarHBondContact NE-OD2 3.22Å; R35-D143 IonicContact NH2-OD2 3.42Å; R35-D143 PolarHBondContact NH2-OD2 3.37Å; R35-F222 HydrophobicContact CB-CD1 3.86Å; R35-F222 HydrophobicContact CB-CE1 4.16Å; R35-F222 HydrophobicContact CG-CD1 3.69Å; R35-F222 HydrophobicContact CG-CE1 3.68Å; R35-N223 PolarHBondContact O-N 3.42Å
36	T	97.4	Very high	89.2	Confident	58 Å²	58	81.1 Å²	81.1	36%	0.356	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	133.5	177	-55.9	0	0	0	0	111	N223 I225	T36-N223 VanDerWaalsContact CA-O 3.3Å; T36-N223 WeakPolarHBondContact CA-O 3.39Å; T36-I225 HydrophobicContact CG2-CD1 3.86Å; T36-I225 HydrophobicContact CG2-CG1 3.4Å; T36-I225 VanDerWaalsContact CG2-CG1 3.4Å
37	I	98.3	Very high	91.3	Very high	3 Å²	3	76 Å²	76	2%	0.015	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	128.9	178.2	-59.5	-64.5	0	0	0	109	R35 L39 L176 Q178 F222 N223 F224 I225	R35-I37 HydrophobicContact CG-CD1 4.28Å; I37-L39 HydrophobicContact CG2-CD2 4.14Å; I37-L176 HydrophobicContact CD1-CD2 3.96Å; I37-L176 HydrophobicContact CG1-CD1 4.35Å; I37-L176 HydrophobicContact CG1-CD2 4.37Å; I37-L176 HydrophobicContact CG2-CD2 4.15Å; I37-Q178 HydrophobicContact CD1-CG 4Å; I37-Q178 HydrophobicContact CG2-CG 4.42Å; I37-F222 HydrophobicContact CD1-CD1 4.22Å; I37-F222 HydrophobicContact CD1-CE1 4.35Å; I37-F222 HydrophobicContact CG1-CB 4.29Å; I37-F222 HydrophobicContact CG1-CD1 3.51Å; I37-F222 HydrophobicContact CG1-CE1 4.07Å; I37-F222 HydrophobicContact CG1-CG 4.12Å; I37-N223 PolarHBondContact N-O 3.07Å; I37-F224 HydrophobicContact CB-CD1 3.97Å; I37-F224 HydrophobicContact CB-CE1 4.11Å; I37-F224 HydrophobicContact CG2-CD1 4.21Å; I37-F224 HydrophobicContact CG2-CE1 4.17Å; I37-F224 WeakPolarHBondContact O-CA 3.33Å; I37-I225 PolarHBondContact O-N 3.12Å
38	N	98.5	Very high	92.7	Very high	67 Å²	67	69.1 Å²	69.1	36%	0.358	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	126.5	174.8	-71.2	-44.6	0	0	0	110.2	Y40 I225 N227	N38-Y40 HydrophobicContact CB-CE2 4.01Å; N38-I225 WeakPolarHBondContact OD1-CB 3.45Å; N38-N227 WeakPolarHBondContact CB-ND2 3.25Å; N38-N227 PolarHBondContact OD1-ND2 2.69Å
39	L	98.7	Very high	93.7	Very high	2 Å²	2	67.5 Å²	67.5	1%	0.01	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	146.6	168.1	-54.8	-173	0	0	0	108.6	I37 I85 H87 P92 F224 I225 Y226 N227	I37-L39 HydrophobicContact CG2-CD2 4.14Å; L39-I85 HydrophobicContact CD1-CG2 3.77Å; L39-I85 HydrophobicContact CD2-CB 3.67Å; L39-I85 HydrophobicContact CD2-CG2 3.57Å; L39-I85 HydrophobicContact CG-CG2 4.33Å; L39-H87 HydrophobicContact CB-CB 4.36Å; L39-H87 HydrophobicContact CD1-CB 4.46Å; L39-P92 HydrophobicContact CD1-CB 4.11Å; L39-P92 HydrophobicContact CD1-CG 4.36Å; L39-F224 HydrophobicContact CD1-CB 3.84Å; L39-F224 HydrophobicContact CD1-CD1 3.64Å; L39-F224 HydrophobicContact CD1-CD2 4.3Å; L39-F224 HydrophobicContact CD1-CE1 4.28Å; L39-F224 HydrophobicContact CD1-CG 3.67Å; L39-F224 HydrophobicContact CD2-CD1 3.82Å; L39-F224 HydrophobicContact CD2-CE1 4.08Å; L39-F224 HydrophobicContact CG-CB 4.18Å; L39-F224 HydrophobicContact CG-CD1 3.7Å; L39-F224 HydrophobicContact CG-CE1 4.42Å; L39-F224 HydrophobicContact CG-CG 4.13Å; L39-I225 PolarHBondContact N-O 3.49Å; L39-Y226 HydrophobicContact CD1-CD1 4.33Å; L39-Y226 HydrophobicContact CD1-CE1 3.98Å; L39-N227 WeakPolarHBondContact O-CB 3.37Å; L39-N227 PolarHBondContact O-N 2.86Å; L39-N227 PolarHBondContact O-ND2 3.1Å
40	Y	98.8	Very high	94.4	Very high	37 Å²	37	61.9 Å²	61.9	15%	0.145	35%	0.348	C	S	.	.			trans	-122.8	158.5	176.3	-57	-83.7	0	0	0	110.9	N38 Y45 H87 L179 E181 N227	N38-Y40 HydrophobicContact CB-CE2 4.01Å; Y40-Y45 WeakPolarHBondContact CB-OH 3.42Å; Y40-Y45 WeakPolarHBondContact CD2-OH 3.48Å; Y40-H87 PolarHBondContact O-CD2 3.11Å; Y40-H87 PolarHBondContact O-N 2.97Å; Y40-L179 WeakPolarHBondContact CE2-O 3.44Å; Y40-E181 HydrophobicContact CD1-CB 3.99Å; Y40-E181 HydrophobicContact CD1-CG 3.65Å; Y40-E181 HydrophobicContact CE1-CB 3.73Å; Y40-E181 HydrophobicContact CE1-CG 3.68Å; Y40-E181 HydrophobicContact CE2-CB 4.38Å; Y40-E181 HydrophobicContact CG-CB 4.41Å; Y40-E181 HydrophobicContact CG-CG 4.35Å; Y40-N227 HydrophobicContact CD1-CB 3.62Å; Y40-N227 HydrophobicContact CE1-CB 3.72Å
41	P	98.7	Very high	94.8	Very high	31 Å²	31	64 Å²	64	20%	0.201	35%	0.351	C	S	.	.	B	Isolated β-bridge	trans	-58.4	142.1	-178.7	-25.4	35.8	0	0	0	112	T43 N44 Y45 H87 N227	P41-T43 PolarHBondContact O-N 3.18Å; P41-T43 VanDerWaalsContact O-N 3.11Å; P41-N44 VanDerWaalsContact O-CB 3.31Å; P41-N44 WeakPolarHBondContact O-CB 3.23Å; P41-N44 PolarHBondContact O-N 3.26Å; P41-Y45 WeakPolarHBondContact O-CD2 3.47Å; P41-H87 CarbonylContact C-O 3.44Å; P41-H87 VanDerWaalsContact CA-O 3.25Å; P41-H87 WeakPolarHBondContact CA-O 3.45Å; P41-N227 WeakPolarHBondContact CD-O 3.44Å
42	L	98.2	Very high	95.2	Very high	37 Å²	37	60.3 Å²	60.3	19%	0.194	33%	0.334	C	S	.	.	G	3₁₀ helix	trans	-51.9	-36.4	175.3	174.9	61.3	0	0	0	112	N44 Y45 F47 V86 H87 A195	L42-N44 PolarHBondContact O-N 3.37Å; L42-N44 VanDerWaalsContact O-N 3.16Å; L42-Y45 PolarHBondContact O-N 3.02Å; L42-Y45 VanDerWaalsContact O-N 3.1Å; L42-F47 HydrophobicContact CD1-CE2 4.1Å; L42-F47 HydrophobicContact CD1-CZ 3.82Å; L42-V86 HydrophobicContact CB-CG2 4.17Å; L42-V86 HydrophobicContact CD1-CG2 3.97Å; L42-H87 PolarHBondContact N-O 2.93Å; L42-A195 HydrophobicContact CD1-CB 4.03Å; L42-A195 HydrophobicContact CD2-CB 4.02Å
43	T	97.9	Very high	95.5	Very high	125 Å²	125	56.2 Å²	56.2	77%	0.767	31%	0.307	S	S	*	.	G	3₁₀ helix	trans	-64.3	-14.4	178.5	53	0	0	0	0	114.5	P41 Y45	P41-T43 PolarHBondContact O-N 3.18Å; P41-T43 VanDerWaalsContact O-N 3.11Å; T43-Y45 PolarHBondContact O-N 3.11Å
44	N	97.9	Very high	95.7	Very high	40 Å²	40	58.3 Å²	58.3	21%	0.214	31%	0.307	C	S	.	.	G	3₁₀ helix	trans	-76.1	-13	174.6	-75.2	18.1	0	0	0	113.2	P41 L42 E181 K182	P41-N44 VanDerWaalsContact O-CB 3.31Å; P41-N44 WeakPolarHBondContact O-CB 3.23Å; P41-N44 PolarHBondContact O-N 3.26Å; L42-N44 PolarHBondContact O-N 3.37Å; L42-N44 VanDerWaalsContact O-N 3.16Å; N44-E181 WeakPolarHBondContact CB-O 3.4Å; N44-E181 PolarHBondContact ND2-O 2.91Å; N44-K182 HydrophobicContact CB-CG 4.24Å
45	Y	97	Very high	95.6	Very high	8 Å²	8	59.9 Å²	59.9	3%	0.031	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	128.9	-175.5	-57.4	-75.1	0	0	0	110.5	Y40 P41 L42 T43 V86 L179 Q180 A183 F185	Y40-Y45 WeakPolarHBondContact CB-OH 3.42Å; Y40-Y45 WeakPolarHBondContact CD2-OH 3.48Å; P41-Y45 WeakPolarHBondContact O-CD2 3.47Å; L42-Y45 PolarHBondContact O-N 3.02Å; L42-Y45 VanDerWaalsContact O-N 3.1Å; T43-Y45 PolarHBondContact O-N 3.11Å; Y45-V86 HydrophobicContact CD2-CB 4.39Å; Y45-V86 HydrophobicContact CD2-CG1 3.57Å; Y45-V86 HydrophobicContact CE2-CB 4.1Å; Y45-V86 HydrophobicContact CE2-CG1 3.33Å; Y45-V86 HydrophobicContact CG-CG1 4.48Å; Y45-L179 HydrophobicContact CD1-CD1 4.45Å; Y45-L179 HydrophobicContact CE1-CB 4.03Å; Y45-L179 HydrophobicContact CE1-CD1 3.81Å; Y45-L179 HydrophobicContact CE1-CG 4.38Å; Y45-L179 HydrophobicContact CE2-CD1 4.27Å; Y45-L179 VanDerWaalsContact OH-CB 3.29Å; Y45-L179 WeakPolarHBondContact OH-CB 3.49Å; Y45-Q180 WeakPolarHBondContact CE1-O 3.44Å; Y45-Q180 PolarHBondContact OH-O 3.15Å; Y45-A183 WeakPolarHBondContact CA-O 3.16Å; Y45-A183 HydrophobicContact CD1-CB 3.91Å; Y45-A183 HydrophobicContact CE1-CB 4.11Å; Y45-F185 AromaticContact CD1-CE2 3.72Å; Y45-F185 HydrophobicContact CD1-CE2 3.72Å; Y45-F185 HydrophobicContact CD1-CZ 4.09Å; Y45-F185 HydrophobicContact CG-CE2 4.02Å
46	T	94.6	Very high	95.3	Very high	86 Å²	86	65.5 Å²	65.5	53%	0.528	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	141.1	177.2	-55.6	0	0	0	0	109.5	A183 L184 F185	T46-A183 PolarHBondContact N-O 3.38Å; T46-A183 VanDerWaalsContact N-O 3.11Å; T46-L184 HydrophobicContact CG2-CD1 3.53Å; T46-F185 PolarHBondContact O-N 3.44Å
47	F	93.8	Very high	95.1	Very high	88 Å²	88	64 Å²	64	39%	0.386	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	102.2	-179	-51.1	-70.1	0	0	0	109.7	L42 F185 L193	L42-F47 HydrophobicContact CD1-CE2 4.1Å; L42-F47 HydrophobicContact CD1-CZ 3.82Å; F47-F185 HydrophobicContact CD1-CB 4.22Å; F47-F185 AromaticContact CD1-CD2 3.83Å; F47-F185 HydrophobicContact CD1-CD2 3.83Å; F47-F185 AromaticContact CE1-CD2 3.57Å; F47-F185 HydrophobicContact CE1-CD2 3.57Å; F47-F185 HydrophobicContact CE1-CE2 4.16Å; F47-L193 HydrophobicContact CD1-CD2 3.64Å; F47-L193 HydrophobicContact CD1-CG 4.47Å; F47-L193 HydrophobicContact CE1-CD2 3.55Å; F47-L193 HydrophobicContact CE1-CG 4.28Å
48	G	92.8	Very high	94.7	Very high	27 Å²	27	69.6 Å²	69.6	28%	0.278	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	167.6	167.9	0	0	0	0	0	111.5	F185 V187	G48-F185 PolarHBondContact N-O 2.96Å; G48-V187 PolarHBondContact O-N 3.42Å
49	T	93.4	Very high	94.3	Very high	105 Å²	105	69.1 Å²	69.1	64%	0.644	37%	0.371	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.9	142.9	176.4	58.7	0	0	0	0	111.3	V187	T49-V187 CarbonylContact C-O 3.59Å; T49-V187 VanDerWaalsContact CA-O 3.3Å; T49-V187 WeakPolarHBondContact CA-O 3.44Å
50	K	94.7	Very high	93.9	Very high	19 Å²	19	73.8 Å²	73.8	8%	0.083	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	179.2	170.6	69.8	-178.8	-176.6	-166.7	0	111.9	E127 I128 G130 Q132 A186 V187 P188 K189	K50-E127 PolarHBondContact NZ-O 2.88Å; K50-I128 WeakPolarHBondContact CE-O 3.44Å; K50-I128 PolarHBondContact NZ-O 2.94Å; K50-G130 PolarHBondContact NZ-O 3.29Å; K50-Q132 HydrophobicContact CB-CG 4.46Å; K50-Q132 HydrophobicContact CD-CG 4.42Å; K50-A186 HydrophobicContact CB-CB 4.3Å; K50-A186 HydrophobicContact CD-CB 3.98Å; K50-A186 VanDerWaalsContact CD-O 3.29Å; K50-A186 WeakPolarHBondContact CD-O 3.23Å; K50-A186 WeakPolarHBondContact CE-O 3.21Å; K50-A186 HydrophobicContact CG-CB 4.36Å; K50-A186 PolarHBondContact NZ-O 2.73Å; K50-V187 PolarHBondContact N-O 3.14Å; K50-P188 HydrophobicContact CG-CG 4.48Å; K50-K189 WeakPolarHBondContact O-CG 3.26Å; K50-K189 PolarHBondContact O-N 3.08Å
51	E	94.9	Very high	93.7	Very high	116 Å²	116	75.6 Å²	75.6	54%	0.542	42%	0.421	S	S	.	.	S	Bend	trans	-56.7	148.3	-179.5	-68.7	-51.9	114.8	0	0	113	P188 K189	E51-P188 WeakPolarHBondContact O-CB 3.43Å; E51-K189 IonicContact OE1-NZ 3.69Å; E51-K189 PolarHBondContact OE1-NZ 2.9Å
52	P	94.4	Very high	93.6	Very high	41 Å²	41	75.6 Å²	75.6	27%	0.266	42%	0.424	S	S	.	.			trans	-56.7	143.4	-177.8	-24.2	33.6	0	0	0	112.9	Y54 K189 N190	P52-Y54 HydrophobicContact CB-CE2 3.91Å; P52-K189 HydrophobicContact CG-CB 4.37Å; P52-N190 VanDerWaalsContact CA-OD1 3.23Å; P52-N190 WeakPolarHBondContact CA-OD1 3.37Å; P52-N190 HydrophobicContact CB-CB 4.2Å
53	L	92.6	Very high	93.5	Very high	49 Å²	49	77.4 Å²	77.4	26%	0.257	43%	0.429	S	S	.	.			trans	-110.1	109.6	174.2	-175.1	66.5	0	0	0	108.7	I128 P188 N190	L53-I128 HydrophobicContact CD2-CG1 3.89Å; L53-P188 HydrophobicContact CB-CB 3.76Å; L53-P188 HydrophobicContact CB-CG 3.71Å; L53-P188 HydrophobicContact CD2-CG 4.39Å; L53-N190 PolarHBondContact N-OD1 2.82Å; L53-N190 PolarHBondContact O-ND2 3.14Å
54	Y	90.4	Very high	93.5	Very high	184 Å²	184	72.3 Å²	72.3	72%	0.722	40%	0.396	S	S	*	.			trans	-88.2	141.7	-178.7	-64.4	-75.1	0	0	0	111.5	P52	P52-Y54 HydrophobicContact CB-CE2 3.91Å
55	E	88.4	Confident	93.4	Very high	99 Å²	99	75 Å²	75	46%	0.463	41%	0.407	S	S	.	.			trans	-65.5	145.2	173	-68.3	-72.5	137.1	0	0	110.9	D57 K105 Y191	E55-D57 PolarHBondContact O-N 2.73Å; E55-K105 IonicContact OE1-NZ 2.81Å; E55-K105 PolarHBondContact OE1-NZ 3.39Å; E55-K105 IonicContact OE2-NZ 2.92Å; E55-K105 PolarHBondContact OE2-NZ 2.95Å; E55-Y191 PolarHBondContact OE1-OH 3.26Å
56	K	90	Very high	93.5	Very high	154 Å²	154	76.5 Å²	76.5	67%	0.67	41%	0.412	S	S	*	.	S	Bend	trans	-61.5	-35.8	175.9	-64.1	-177	-174.5	174.9	0	112.3	E110	K56-E110 IonicContact NZ-OE2 3.61Å; K56-E110 PolarHBondContact NZ-OE2 3.11Å
57	D	92.2	Very high	93.6	Very high	27 Å²	27	72.4 Å²	72.4	14%	0.144	39%	0.388	C	S	.	.			trans	-104.9	121.5	-173.3	-56.2	-53.7	0	0	0	110.4	E55 S59 A62 R63 R66	E55-D57 PolarHBondContact O-N 2.73Å; D57-S59 PolarHBondContact O-N 3.35Å; D57-A62 HydrophobicContact CB-CB 4.48Å; D57-R63 HydrophobicContact CB-CB 3.79Å; D57-R63 VanDerWaalsContact CG-CA 3.42Å; D57-R63 WeakPolarHBondContact OD2-CA 3.46Å; D57-R63 WeakPolarHBondContact OD2-CB 3.14Å; D57-R63 WeakPolarHBondContact OD2-CG 3.2Å; D57-R66 IonicContact OD1-CZ 2.76Å; D57-R66 IonicContact OD1-NE 3.12Å; D57-R66 PolarHBondContact OD1-NE 2.84Å; D57-R66 IonicContact OD1-NH2 2.69Å; D57-R66 IonicContact OD2-CZ 2.8Å; D57-R66 IonicContact OD2-NE 3.85Å; D57-R66 PolarHBondContact OD2-NE 3.39Å; D57-R66 IonicContact OD2-NH2 2.75Å; D57-R66 PolarHBondContact OD2-NH2 3.4Å
58	S	89.9	Confident	93.9	Very high	120 Å²	120	73 Å²	73	84%	0.839	39%	0.387	S	S	*	.	S	Bend	trans	-72.3	-16	179.5	59.2	0	0	0	0	113.9
59	S	91.7	Very high	94.1	Very high	57 Å²	57	75.9 Å²	75.9	40%	0.399	39%	0.393	S	S	.	.	S	Bend	trans	-155.4	164	-178.7	67.4	0	0	0	0	111.9	D57 A61 A62 R63	D57-S59 PolarHBondContact O-N 3.35Å; S59-A61 PolarHBondContact O-N 3.28Å; S59-A62 PolarHBondContact O-N 2.82Å; S59-A62 WeakPolarHBondContact OG-CB 3.43Å; S59-A62 PolarHBondContact OG-N 3.09Å; S59-A62 VanDerWaalsContact OG-N 3.12Å; S59-R63 PolarHBondContact O-N 3.11Å
60	V	89.8	Confident	94.3	Very high	99 Å²	99	73.3 Å²	73.3	60%	0.6	37%	0.374	S	S	*	.	H	α-helix	trans	-59.4	-37.6	173.6	178.6	0	0	0	0	111.5	R63 F64	V60-R63 PolarHBondContact O-N 3.01Å; V60-F64 HydrophobicContact CG1-CD2 3.83Å; V60-F64 HydrophobicContact CG1-CE2 3.47Å; V60-F64 VanDerWaalsContact CG1-CE2 3.47Å; V60-F64 VanDerWaalsContact O-CD2 3.24Å; V60-F64 WeakPolarHBondContact O-CD2 3.44Å; V60-F64 PolarHBondContact O-N 3.28Å
61	A	94.4	Very high	94.5	Very high	75 Å²	75	74.3 Å²	74.3	62%	0.62	38%	0.379	S	S	*	.	H	α-helix	trans	-64.4	-47.3	177	0	0	0	0	0	111.5	S59 R63 F64 Q65	S59-A61 PolarHBondContact O-N 3.28Å; A61-R63 VanDerWaalsContact C-N 3.3Å; A61-R63 PolarHBondContact O-N 3.27Å; A61-F64 PolarHBondContact O-N 3.49Å; A61-Q65 WeakPolarHBondContact O-CB 3.37Å; A61-Q65 PolarHBondContact O-N 3.27Å
62	A	96.6	Very high	94.6	Very high	32 Å²	32	75.2 Å²	75.2	26%	0.264	39%	0.387	S	S	.	.	H	α-helix	trans	-59.5	-41.1	176.2	0	0	0	0	0	111.8	D57 S59 F64 Q65 R66	D57-A62 HydrophobicContact CB-CB 4.48Å; S59-A62 PolarHBondContact O-N 2.82Å; S59-A62 WeakPolarHBondContact OG-CB 3.43Å; S59-A62 PolarHBondContact OG-N 3.09Å; S59-A62 VanDerWaalsContact OG-N 3.12Å; A62-F64 PolarHBondContact O-N 3.1Å; A62-Q65 PolarHBondContact O-N 2.97Å; A62-R66 PolarHBondContact O-N 3.48Å
63	R	96.1	Very high	94.8	Very high	75 Å²	75	81.3 Å²	81.3	28%	0.283	41%	0.409	S	S	.	.	H	α-helix	trans	-57.9	-48	176.7	179.3	174.5	175.1	-117	-4.8	112.8	D57 S59 V60 A61 M67 R150 E170	D57-R63 HydrophobicContact CB-CB 3.79Å; D57-R63 VanDerWaalsContact CG-CA 3.42Å; D57-R63 WeakPolarHBondContact OD2-CA 3.46Å; D57-R63 WeakPolarHBondContact OD2-CB 3.14Å; D57-R63 WeakPolarHBondContact OD2-CG 3.2Å; S59-R63 PolarHBondContact O-N 3.11Å; V60-R63 PolarHBondContact O-N 3.01Å; A61-R63 VanDerWaalsContact C-N 3.3Å; A61-R63 PolarHBondContact O-N 3.27Å; R63-M67 WeakPolarHBondContact O-CB 3.28Å; R63-M67 PolarHBondContact O-N 2.96Å; R63-R150 VanDerWaalsContact NH2-NH2 3.16Å; R63-E170 IonicContact NH2-OE2 2.78Å
64	F	96.7	Very high	95	Very high	17 Å²	17	83.7 Å²	83.7	8%	0.075	42%	0.421	C	S	.	.	H	α-helix	trans	-73.7	-29.7	179.3	-70	-57.4	0	0	0	112.9	V60 A61 A62 M67 R68 F153 E154 P155	V60-F64 HydrophobicContact CG1-CD2 3.83Å; V60-F64 HydrophobicContact CG1-CE2 3.47Å; V60-F64 VanDerWaalsContact CG1-CE2 3.47Å; V60-F64 VanDerWaalsContact O-CD2 3.24Å; V60-F64 WeakPolarHBondContact O-CD2 3.44Å; V60-F64 PolarHBondContact O-N 3.28Å; A61-F64 PolarHBondContact O-N 3.49Å; A62-F64 PolarHBondContact O-N 3.1Å; F64-M67 HydrophobicContact CD1-SD 4.34Å; F64-M67 PolarHBondContact O-N 3.39Å; F64-R68 WeakPolarHBondContact O-CG 3.46Å; F64-R68 PolarHBondContact O-N 2.84Å; F64-R68 VanDerWaalsContact O-N 3.12Å; F64-F153 VanDerWaalsContact CD1-C 3.43Å; F64-F153 HydrophobicContact CD1-CB 4.43Å; F64-F153 WeakPolarHBondContact CD1-O 3.19Å; F64-E154 VanDerWaalsContact CE1-C 3.49Å; F64-P155 HydrophobicContact CE2-CG 4.06Å; F64-P155 HydrophobicContact CZ-CG 3.92Å
65	Q	97.8	Very high	95.3	Very high	96 Å²	96	76.2 Å²	76.2	45%	0.449	40%	0.401	S	S	.	.	H	α-helix	trans	-64.5	-51.6	173.3	-178.3	56.7	28.2	0	0	111.1	A61 A62 M67 R68 E69	A61-Q65 WeakPolarHBondContact O-CB 3.37Å; A61-Q65 PolarHBondContact O-N 3.27Å; A62-Q65 PolarHBondContact O-N 2.97Å; Q65-M67 VanDerWaalsContact C-N 3.25Å; Q65-M67 PolarHBondContact O-N 3.15Å; Q65-R68 WeakPolarHBondContact O-CB 3.47Å; Q65-R68 PolarHBondContact O-N 2.97Å; Q65-R68 VanDerWaalsContact O-N 3.07Å; Q65-E69 WeakPolarHBondContact CG-OE1 3.25Å; Q65-E69 PolarHBondContact NE2-OE1 2.79Å; Q65-E69 PolarHBondContact O-N 3.17Å; Q65-E69 VanDerWaalsContact O-N 3.12Å
66	R	97.8	Very high	95.8	Very high	40 Å²	40	74.7 Å²	74.7	15%	0.151	39%	0.394	C	S	.	.	H	α-helix	trans	-58.8	-38.5	175	-176.9	175.9	62.6	91.2	-3.6	112	D57 A62 R68 E69 E70 R77 E110	D57-R66 IonicContact OD1-CZ 2.76Å; D57-R66 IonicContact OD1-NE 3.12Å; D57-R66 PolarHBondContact OD1-NE 2.84Å; D57-R66 IonicContact OD1-NH2 2.69Å; D57-R66 IonicContact OD2-CZ 2.8Å; D57-R66 IonicContact OD2-NE 3.85Å; D57-R66 PolarHBondContact OD2-NE 3.39Å; D57-R66 IonicContact OD2-NH2 2.75Å; D57-R66 PolarHBondContact OD2-NH2 3.4Å; A62-R66 PolarHBondContact O-N 3.48Å; R66-R68 VanDerWaalsContact C-N 3.31Å; R66-R68 PolarHBondContact O-N 3.34Å; R66-E69 PolarHBondContact O-N 3.09Å; R66-E70 WeakPolarHBondContact CD-OE1 3.3Å; R66-E70 HydrophobicContact CG-CG 4.29Å; R66-E70 WeakPolarHBondContact CG-OE1 3.5Å; R66-E70 IonicContact CZ-OE1 3.57Å; R66-E70 IonicContact NE-OE1 2.79Å; R66-E70 IonicContact NH1-OE1 3.63Å; R66-E70 PolarHBondContact NH1-OE1 3.17Å; R66-E70 IonicContact NH1-OE2 3.96Å; R66-E70 PolarHBondContact NH1-OE2 3.16Å; R66-E70 WeakPolarHBondContact O-CB 3.25Å; R66-E70 WeakPolarHBondContact O-CG 3.46Å; R66-E70 PolarHBondContact O-N 3.48Å; R66-R77 VanDerWaalsContact NH1-NH2 3.15Å; R66-E110 IonicContact CZ-OE1 2.82Å; R66-E110 IonicContact CZ-OE2 3.52Å; R66-E110 IonicContact NH1-OE1 3.59Å; R66-E110 PolarHBondContact NH1-OE1 3.15Å; R66-E110 VanDerWaalsContact NH1-OE1 3.14Å; R66-E110 IonicContact NH1-OE2 3.46Å; R66-E110 PolarHBondContact NH1-OE2 2.84Å; R66-E110 IonicContact NH2-OE1 2.74Å; R66-E110 PolarHBondContact NH2-OE1 2.86Å; R66-E110 IonicContact NH2-OE2 3.76Å
67	M	98.1	Very high	96.2	Very high	1 Å²	1	68 Å²	68	1%	0.005	36%	0.364	C	S	.	.	H	α-helix	trans	-61.7	-37.7	176.7	-170	-178.1	-76	0	0	112.4	R63 F64 Q65 F71 R77 F153 K169	R63-M67 WeakPolarHBondContact O-CB 3.28Å; R63-M67 PolarHBondContact O-N 2.96Å; F64-M67 HydrophobicContact CD1-SD 4.34Å; F64-M67 PolarHBondContact O-N 3.39Å; Q65-M67 VanDerWaalsContact C-N 3.25Å; Q65-M67 PolarHBondContact O-N 3.15Å; M67-F71 WeakPolarHBondContact O-CB 3.46Å; M67-F71 PolarHBondContact O-N 3.12Å; M67-R77 VanDerWaalsContact CA-NH2 3.33Å; M67-F153 HydrophobicContact CB-CD1 4.1Å; M67-F153 HydrophobicContact CB-CE1 4.41Å; M67-F153 HydrophobicContact CG-CD1 3.77Å; M67-F153 HydrophobicContact CG-CE1 3.93Å; M67-F153 WeakPolarHBondContact O-CE1 3.47Å; M67-F153 HydrophobicContact SD-CD1 3.96Å; M67-K169 HydrophobicContact SD-CB 4.21Å
68	R	98.2	Very high	96.5	Very high	100 Å²	100	70.1 Å²	70.1	38%	0.377	37%	0.371	S	S	.	.	H	α-helix	trans	-64.4	-50.1	173.2	-68.6	171	-138.9	-84.4	-5.6	111.1	F64 Q65 R66 E70 F71 D72 F153	F64-R68 WeakPolarHBondContact O-CG 3.46Å; F64-R68 PolarHBondContact O-N 2.84Å; F64-R68 VanDerWaalsContact O-N 3.12Å; Q65-R68 WeakPolarHBondContact O-CB 3.47Å; Q65-R68 PolarHBondContact O-N 2.97Å; Q65-R68 VanDerWaalsContact O-N 3.07Å; R66-R68 VanDerWaalsContact C-N 3.31Å; R66-R68 PolarHBondContact O-N 3.34Å; R68-E70 VanDerWaalsContact C-N 3.33Å; R68-E70 PolarHBondContact O-N 3.33Å; R68-F71 WeakPolarHBondContact O-CB 3.49Å; R68-F71 PolarHBondContact O-N 3.32Å; R68-F71 VanDerWaalsContact O-N 3.1Å; R68-D72 PolarHBondContact O-N 3.34Å; R68-D72 VanDerWaalsContact O-N 3.1Å; R68-F153 HydrophobicContact CB-CD1 4.48Å; R68-F153 HydrophobicContact CB-CE1 4.21Å; R68-F153 HydrophobicContact CB-CZ 4.25Å; R68-F153 HydrophobicContact CG-CB 4.25Å; R68-F153 HydrophobicContact CG-CD1 3.64Å; R68-F153 HydrophobicContact CG-CD2 3.69Å; R68-F153 HydrophobicContact CG-CE1 3.77Å; R68-F153 HydrophobicContact CG-CE2 3.8Å; R68-F153 HydrophobicContact CG-CG 3.59Å; R68-F153 HydrophobicContact CG-CZ 3.82Å; R68-F153 VanDerWaalsContact CZ-CB 3.46Å; R68-F153 VanDerWaalsContact NH1-CB 3.3Å
69	E	97.9	Very high	97	Very high	88 Å²	88	64.9 Å²	64.9	41%	0.411	33%	0.333	S	S	.	.	H	α-helix	trans	-61.5	-39.5	-177.5	-68	169.8	-166.3	0	0	113.1	Q65 R66 K73	Q65-E69 WeakPolarHBondContact CG-OE1 3.25Å; Q65-E69 PolarHBondContact NE2-OE1 2.79Å; Q65-E69 PolarHBondContact O-N 3.17Å; Q65-E69 VanDerWaalsContact O-N 3.12Å; R66-E69 PolarHBondContact O-N 3.09Å; E69-K73 WeakPolarHBondContact O-CD 3.43Å; E69-K73 WeakPolarHBondContact O-CG 3.48Å
70	E	97.9	Very high	97.3	Very high	50 Å²	50	62.2 Å²	62.2	23%	0.234	32%	0.315	C	S	.	.	H	α-helix	trans	-70.9	-39.2	174.1	-74.2	174	-170.1	0	0	111.5	R66 R68 D72 K73 I74 R77	R66-E70 WeakPolarHBondContact CD-OE1 3.3Å; R66-E70 HydrophobicContact CG-CG 4.29Å; R66-E70 WeakPolarHBondContact CG-OE1 3.5Å; R66-E70 IonicContact CZ-OE1 3.57Å; R66-E70 IonicContact NE-OE1 2.79Å; R66-E70 IonicContact NH1-OE1 3.63Å; R66-E70 PolarHBondContact NH1-OE1 3.17Å; R66-E70 IonicContact NH1-OE2 3.96Å; R66-E70 PolarHBondContact NH1-OE2 3.16Å; R66-E70 WeakPolarHBondContact O-CB 3.25Å; R66-E70 WeakPolarHBondContact O-CG 3.46Å; R66-E70 PolarHBondContact O-N 3.48Å; R68-E70 VanDerWaalsContact C-N 3.33Å; R68-E70 PolarHBondContact O-N 3.33Å; E70-D72 VanDerWaalsContact C-N 3.27Å; E70-D72 PolarHBondContact O-N 3.12Å; E70-K73 PolarHBondContact O-N 2.9Å; E70-I74 HydrophobicContact CB-CD1 4.49Å; E70-I74 HydrophobicContact CB-CG1 4.35Å; E70-I74 WeakPolarHBondContact O-CG1 3.36Å; E70-I74 PolarHBondContact O-N 3.09Å; E70-R77 IonicContact OE1-NH2 2.62Å; E70-R77 IonicContact OE2-CZ 3.11Å; E70-R77 VanDerWaalsContact OE2-CZ 3.22Å; E70-R77 IonicContact OE2-NE 2.85Å; E70-R77 PolarHBondContact OE2-NE 3.09Å; E70-R77 VanDerWaalsContact OE2-NE 3.08Å; E70-R77 IonicContact OE2-NH2 3.11Å; E70-R77 PolarHBondContact OE2-NH2 3.11Å
71	F	98.2	Very high	97.7	Very high	41 Å²	41	58.7 Å²	58.7	18%	0.18	29%	0.292	C	S	.	.	H	α-helix	trans	-60.2	-39	-180	-173.1	-93.3	0	0	0	112.4	M67 R68 K73 G75 M76 F153 K167 P168 K169	M67-F71 WeakPolarHBondContact O-CB 3.46Å; M67-F71 PolarHBondContact O-N 3.12Å; R68-F71 WeakPolarHBondContact O-CB 3.49Å; R68-F71 PolarHBondContact O-N 3.32Å; R68-F71 VanDerWaalsContact O-N 3.1Å; F71-K73 VanDerWaalsContact C-N 3.26Å; F71-K73 PolarHBondContact O-N 2.85Å; F71-G75 WeakPolarHBondContact CA-O 3.33Å; F71-G75 WeakPolarHBondContact CD2-O 3.19Å; F71-G75 WeakPolarHBondContact O-CA 3.3Å; F71-G75 PolarHBondContact O-N 3.34Å; F71-M76 HydrophobicContact CE2-CB 4.49Å; F71-F153 HydrophobicContact CB-CE1 3.89Å; F71-F153 HydrophobicContact CB-CZ 3.82Å; F71-F153 AromaticContact CD1-CZ 3.97Å; F71-F153 HydrophobicContact CD1-CZ 3.97Å; F71-F153 HydrophobicContact CG-CE1 4.24Å; F71-F153 AromaticContact CG-CZ 3.88Å; F71-F153 HydrophobicContact CG-CZ 3.88Å; F71-K167 HydrophobicContact CZ-CB 4.29Å; F71-P168 WeakPolarHBondContact CE2-O 3.31Å; F71-K169 HydrophobicContact CD1-CD 4.36Å; F71-K169 HydrophobicContact CD2-CD 3.9Å; F71-K169 HydrophobicContact CE1-CD 4.19Å; F71-K169 HydrophobicContact CE2-CD 3.73Å; F71-K169 HydrophobicContact CG-CD 4.21Å; F71-K169 HydrophobicContact CZ-CD 3.88Å
72	D	97.9	Very high	97.9	Very high	135 Å²	135	55.1 Å²	55.1	72%	0.722	26%	0.262	S	S	*	.	H	α-helix	trans	-68.3	-25.2	177.2	-66	-23.7	0	0	0	113	R68 E70	R68-D72 PolarHBondContact O-N 3.34Å; R68-D72 VanDerWaalsContact O-N 3.1Å; E70-D72 VanDerWaalsContact C-N 3.27Å; E70-D72 PolarHBondContact O-N 3.12Å
73	K	97.7	Very high	98	Very high	169 Å²	169	53.6 Å²	53.6	74%	0.735	25%	0.25	S	C	*	.	H	α-helix	trans	-95	-44.6	-176.1	-67.7	172.5	-174.5	171.2	0	113.5	E69 E70 F71	E69-K73 WeakPolarHBondContact O-CD 3.43Å; E69-K73 WeakPolarHBondContact O-CG 3.48Å; E70-K73 PolarHBondContact O-N 2.9Å; F71-K73 VanDerWaalsContact C-N 3.26Å; F71-K73 PolarHBondContact O-N 2.85Å
74	I	96.9	Very high	98.2	Very high	98 Å²	98	50 Å²	50	50%	0.503	24%	0.236	S	C	.	.	H	α-helix	trans	-126	0.1	-169.9	61.6	166.3	0	0	0	113.2	E70 P113	E70-I74 HydrophobicContact CB-CD1 4.49Å; E70-I74 HydrophobicContact CB-CG1 4.35Å; E70-I74 WeakPolarHBondContact O-CG1 3.36Å; E70-I74 PolarHBondContact O-N 3.09Å; I74-P113 HydrophobicContact CD1-CG 4.14Å; I74-P113 HydrophobicContact CG2-CG 4.23Å
75	G	98.1	Very high	98.3	Very high	28 Å²	28	49.5 Å²	49.5	29%	0.289	23%	0.234	S	C	.	.			trans	79.5	-148.8	179.5	0	0	0	0	0	113.5	F71 R77	F71-G75 WeakPolarHBondContact CA-O 3.33Å; F71-G75 WeakPolarHBondContact CD2-O 3.19Å; F71-G75 WeakPolarHBondContact O-CA 3.3Å; F71-G75 PolarHBondContact O-N 3.34Å; G75-R77 PolarHBondContact O-N 2.72Å
76	M	98.4	Very high	98.3	Very high	67 Å²	67	44.9 Å²	44.9	33%	0.33	21%	0.213	S	C	.	.	S	Bend	trans	-58.9	126.5	-174.4	-178.6	179	68	0	0	112	F71 R78 P168 H171	F71-M76 HydrophobicContact CE2-CB 4.49Å; M76-R78 PolarHBondContact O-N 3.16Å; M76-P168 WeakPolarHBondContact CG-O 3.16Å; M76-P168 HydrophobicContact SD-CB 4.29Å; M76-P168 HydrophobicContact SD-CG 3.68Å; M76-H171 HydrophobicContact CE-CB 3.5Å; M76-H171 HydrophobicContact CG-CB 4.36Å; M76-H171 HydrophobicContact SD-CB 3.55Å; M76-H171 VanDerWaalsContact SD-CB 3.55Å
77	R	98.6	Very high	98.3	Very high	12 Å²	12	43.7 Å²	43.7	5%	0.045	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.9	134.4	172.9	-179.5	174.7	-71.2	178.4	9.2	109.9	R66 M67 E70 G75 E110 K169 E170 H171	R66-R77 VanDerWaalsContact NH1-NH2 3.15Å; M67-R77 VanDerWaalsContact CA-NH2 3.33Å; E70-R77 IonicContact OE1-NH2 2.62Å; E70-R77 IonicContact OE2-CZ 3.11Å; E70-R77 VanDerWaalsContact OE2-CZ 3.22Å; E70-R77 IonicContact OE2-NE 2.85Å; E70-R77 PolarHBondContact OE2-NE 3.09Å; E70-R77 VanDerWaalsContact OE2-NE 3.08Å; E70-R77 IonicContact OE2-NH2 3.11Å; E70-R77 PolarHBondContact OE2-NH2 3.11Å; G75-R77 PolarHBondContact O-N 2.72Å; R77-E110 HydrophobicContact CG-CG 4.45Å; R77-E110 IonicContact CZ-OE1 3.69Å; R77-E110 IonicContact NE-OE1 3.65Å; R77-E110 PolarHBondContact NE-OE1 2.84Å; R77-E110 IonicContact NH1-OE1 2.9Å; R77-E110 PolarHBondContact NH1-OE1 2.9Å; R77-E110 IonicContact NH2-OE1 3.08Å; R77-K169 PolarHBondContact N-O 3.42Å; R77-E170 HydrophobicContact CB-CB 4.34Å; R77-E170 HydrophobicContact CB-CG 4.21Å; R77-E170 HydrophobicContact CG-CG 4.27Å; R77-E170 CarbonylContact O-C 3.57Å; R77-E170 VanDerWaalsContact O-CA 3.31Å; R77-E170 WeakPolarHBondContact O-CA 3.1Å; R77-H171 PolarHBondContact O-N 2.79Å
78	R	98.7	Very high	98.4	Very high	72 Å²	72	47.5 Å²	47.5	27%	0.272	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	123.7	175.1	-59.1	-173.5	-60	152.6	6.4	109.7	M76 L111 N112 E115	M76-R78 PolarHBondContact O-N 3.16Å; R78-L111 HydrophobicContact CB-CB 4.22Å; R78-L111 HydrophobicContact CB-CD1 4.02Å; R78-L111 HydrophobicContact CB-CG 4.41Å; R78-L111 PolarHBondContact O-N 2.97Å; R78-N112 PolarHBondContact NH2-O 2.65Å; R78-E115 PolarHBondContact NH1-O 3.04Å; R78-E115 VanDerWaalsContact NH1-O 3.07Å; R78-E115 VanDerWaalsContact NH2-N 3.2Å; R78-E115 PolarHBondContact NH2-O 3.27Å
79	T	98.8	Very high	98.3	Very high	10 Å²	10	50.3 Å²	50.3	6%	0.061	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	138.6	-178.8	-55.1	0	0	0	0	109.2	G109 E170 H171 K172 K173	T79-G109 WeakPolarHBondContact CA-O 3.29Å; T79-G109 WeakPolarHBondContact CG2-O 3.47Å; T79-E170 PolarHBondContact OG1-OE1 2.94Å; T79-H171 PolarHBondContact N-O 2.86Å; T79-K172 HydrophobicContact CG2-CG 4.28Å; T79-K172 CarbonylContact O-C 3.54Å; T79-K172 VanDerWaalsContact O-CA 3.28Å; T79-K172 WeakPolarHBondContact O-CA 3.2Å; T79-K173 PolarHBondContact O-N 2.76Å
80	V	98.9	Very high	98.3	Very high	2 Å²	2	54 Å²	54	1%	0.012	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	137.9	175.3	-64.9	0	0	0	0	110.3	G108 G109 L111 E117 L121 L124 K173 F175	V80-G108 CarbonylContact O-C 3.49Å; V80-G108 WeakPolarHBondContact O-CA 3.44Å; V80-G109 PolarHBondContact N-O 3.2Å; V80-G109 PolarHBondContact O-N 2.85Å; V80-L111 HydrophobicContact CG1-CD1 3.82Å; V80-L111 HydrophobicContact CG1-CD2 4.09Å; V80-L111 HydrophobicContact CG1-CG 4.01Å; V80-L111 HydrophobicContact CG2-CD2 3.61Å; V80-L111 HydrophobicContact CG2-CG 4.15Å; V80-E117 HydrophobicContact CG1-CB 4.14Å; V80-L121 HydrophobicContact CB-CB 4.19Å; V80-L121 HydrophobicContact CB-CD1 4.35Å; V80-L121 HydrophobicContact CG2-CB 3.75Å; V80-L121 HydrophobicContact CG2-CD1 4.01Å; V80-L121 HydrophobicContact CG2-CG 4.41Å; V80-L124 HydrophobicContact CG2-CD1 3.66Å; V80-K173 CarbonylContact C-O 3.58Å; V80-K173 WeakPolarHBondContact CA-O 3.41Å; V80-K173 HydrophobicContact CG1-CB 4.46Å; V80-F175 HydrophobicContact CB-CE2 4.33Å; V80-F175 HydrophobicContact CG1-CE2 3.97Å
81	E	98.8	Very high	98.4	Very high	24 Å²	24	55.6 Å²	55.6	11%	0.112	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	136.2	179.2	-70.4	-178	168.9	0	0	110.7	L106 K172 K173 L174 F175	E81-L106 HydrophobicContact CB-CB 3.94Å; E81-L106 HydrophobicContact CB-CD1 4.12Å; E81-L106 HydrophobicContact CG-CB 4.25Å; E81-K172 VanDerWaalsContact CD-NZ 3.31Å; E81-K172 HydrophobicContact CG-CD 4.47Å; E81-K172 WeakPolarHBondContact OE1-CE 3.45Å; E81-K172 IonicContact OE1-NZ 2.77Å; E81-K172 PolarHBondContact OE1-NZ 2.92Å; E81-K172 WeakPolarHBondContact OE2-CD 3.42Å; E81-K172 IonicContact OE2-NZ 3.25Å; E81-K172 PolarHBondContact OE2-NZ 2.94Å; E81-K173 PolarHBondContact N-O 2.95Å; E81-L174 HydrophobicContact CB-CG 4.28Å; E81-L174 WeakPolarHBondContact O-CA 3.13Å; E81-F175 PolarHBondContact O-N 2.95Å
82	G	98.7	Very high	98.4	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	130.6	178.9	0	0	0	0	0	111.7	P107 F175	G82-P107 PolarHBondContact N-O 3.46Å; G82-P107 WeakPolarHBondContact O-CD 3.29Å; G82-F175 CarbonylContact C-O 3.51Å
83	V	98.8	Very high	98.5	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	108.7	171.7	178.7	0	0	0	0	108.3	I85 V94 L106 I145 L174 F175 V177 L215 L219	V83-I85 HydrophobicContact CG1-CD1 4.4Å; V83-I85 HydrophobicContact CG1-CG1 4.04Å; V83-V94 HydrophobicContact CG1-CG1 4.06Å; V83-V94 HydrophobicContact CG1-CG2 4.3Å; V83-L106 HydrophobicContact CG2-CD1 3.88Å; V83-L106 HydrophobicContact CG2-CD2 3.97Å; V83-I145 HydrophobicContact CB-CD1 3.93Å; V83-I145 HydrophobicContact CG1-CD1 4.43Å; V83-I145 HydrophobicContact CG2-CD1 3.53Å; V83-L174 HydrophobicContact CG2-CD2 4.3Å; V83-F175 PolarHBondContact N-O 3.02Å; V83-V177 PolarHBondContact O-N 2.85Å; V83-L215 HydrophobicContact CG2-CD1 4.34Å; V83-L215 HydrophobicContact CG2-CD2 3.85Å; V83-L219 HydrophobicContact CG1-CD1 4.36Å; V83-L219 HydrophobicContact CG1-CD2 4.46Å
84	L	98.7	Very high	98.5	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	137.2	173.2	-45.7	97.2	0	0	0	109.3	V94 L95 P107 M125 L129 W139 V177 L179 F185	L84-V94 WeakPolarHBondContact O-CA 3.49Å; L84-L95 HydrophobicContact CB-CB 4.25Å; L84-L95 HydrophobicContact CB-CD1 4.03Å; L84-L95 HydrophobicContact CB-CG 4.26Å; L84-L95 HydrophobicContact CD1-CB 4.49Å; L84-L95 PolarHBondContact O-N 3.1Å; L84-P107 HydrophobicContact CD1-CG 3.39Å; L84-M125 HydrophobicContact CD1-CE 3.66Å; L84-M125 HydrophobicContact CD2-CE 3.57Å; L84-M125 HydrophobicContact CG-CE 3.85Å; L84-L129 HydrophobicContact CD1-CD1 4.4Å; L84-W139 HydrophobicContact CD2-CZ3 3.82Å; L84-V177 HydrophobicContact CD2-CG1 4.41Å; L84-V177 HydrophobicContact CG-CB 4.25Å; L84-L179 HydrophobicContact CB-CD1 4.15Å; L84-L179 HydrophobicContact CB-CG 4.35Å; L84-L179 HydrophobicContact CD2-CD1 4.39Å; L84-L179 HydrophobicContact CD2-CD2 3.49Å; L84-L179 VanDerWaalsContact CD2-CD2 3.49Å; L84-L179 HydrophobicContact CD2-CG 4.15Å; L84-F185 HydrophobicContact CD2-CE1 4.37Å; L84-F185 HydrophobicContact CD2-CZ 4.41Å
85	I	98.8	Very high	98.6	Very high	6 Å²	6	36 Å²	36	3%	0.031	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	131.5	-174.4	-48.4	172.2	0	0	0	108.7	L39 V83 P92 H93 L176 L219 F224	L39-I85 HydrophobicContact CD1-CG2 3.77Å; L39-I85 HydrophobicContact CD2-CB 3.67Å; L39-I85 HydrophobicContact CD2-CG2 3.57Å; L39-I85 HydrophobicContact CG-CG2 4.33Å; V83-I85 HydrophobicContact CG1-CD1 4.4Å; V83-I85 HydrophobicContact CG1-CG1 4.04Å; I85-P92 HydrophobicContact CG2-CB 3.94Å; I85-H93 WeakPolarHBondContact CA-O 3.47Å; I85-L176 HydrophobicContact CD1-CD1 3.81Å; I85-L176 HydrophobicContact CD1-CG 4.35Å; I85-L219 HydrophobicContact CD1-CD1 3.77Å; I85-L219 HydrophobicContact CD1-CD2 3.58Å; I85-L219 HydrophobicContact CD1-CG 4.26Å; I85-L219 HydrophobicContact CG1-CD1 4.42Å; I85-F224 HydrophobicContact CD1-CE1 3.83Å; I85-F224 HydrophobicContact CD1-CZ 3.74Å
86	V	98.8	Very high	98.6	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	176.6	169.6	-57.5	0	0	0	0	108.4	L42 Y45 P92 H93 L95 L179 A195	L42-V86 HydrophobicContact CB-CG2 4.17Å; L42-V86 HydrophobicContact CD1-CG2 3.97Å; Y45-V86 HydrophobicContact CD2-CB 4.39Å; Y45-V86 HydrophobicContact CD2-CG1 3.57Å; Y45-V86 HydrophobicContact CE2-CB 4.1Å; Y45-V86 HydrophobicContact CE2-CG1 3.33Å; Y45-V86 HydrophobicContact CG-CG1 4.48Å; V86-P92 WeakPolarHBondContact O-CA 3.31Å; V86-H93 HydrophobicContact CG2-CB 4Å; V86-H93 PolarHBondContact N-O 2.85Å; V86-H93 PolarHBondContact O-N 2.58Å; V86-L95 HydrophobicContact CG1-CD1 4.17Å; V86-L95 HydrophobicContact CG1-CD2 4.26Å; V86-L95 HydrophobicContact CG1-CG 4.3Å; V86-L95 HydrophobicContact CG2-CD2 3.96Å; V86-L179 HydrophobicContact CG1-CD1 3.8Å; V86-A195 HydrophobicContact CG2-CB 4.37Å
87	H	98.8	Very high	98.6	Very high	14 Å²	14	31.9 Å²	31.9	7%	0.065	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	152.9	167.7	78.9	92.6	0	0	0	112.8	L39 Y40 P41 L42 L91 Y226 N227	L39-H87 HydrophobicContact CB-CB 4.36Å; L39-H87 HydrophobicContact CD1-CB 4.46Å; Y40-H87 PolarHBondContact O-CD2 3.11Å; Y40-H87 PolarHBondContact O-N 2.97Å; P41-H87 CarbonylContact C-O 3.44Å; P41-H87 VanDerWaalsContact CA-O 3.25Å; P41-H87 WeakPolarHBondContact CA-O 3.45Å; L42-H87 PolarHBondContact N-O 2.93Å; H87-L91 VanDerWaalsContact CA-O 3.25Å; H87-L91 WeakPolarHBondContact CA-O 3.46Å; H87-L91 WeakPolarHBondContact CB-O 3.34Å; H87-Y226 HydrophobicContact CB-CD1 3.59Å; H87-Y226 HydrophobicContact CB-CE1 3.98Å; H87-Y226 AromaticContact CG-CD1 3.66Å; H87-N227 PolarHBondContact CE1-O 2.91Å; H87-N227 PolarHBondContact NE2-O 2.79Å
88	E	98.2	Very high	98.5	Very high	82 Å²	82	33 Å²	33	38%	0.383	15%	0.149	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	131.8	166.1	-168.8	179.7	178.9	0	0	106.6	R90 L91	E88-R90 PolarHBondContact O-N 2.9Å; E88-R90 VanDerWaalsContact O-N 3.14Å; E88-L91 PolarHBondContact N-O 3.43Å; E88-L91 VanDerWaalsContact N-O 3.15Å; E88-L91 WeakPolarHBondContact O-CB 3.31Å; E88-L91 PolarHBondContact O-N 2.85Å
89	H	98.1	Very high	98.1	Very high	159 Å²	159	32 Å²	32	74%	0.736	15%	0.148	S	C	*	.	T	Hydrogen-bonded Turn	trans	52	34.8	-174.1	-53.2	116.8	0	0	0	114.1	L91	H89-L91 PolarHBondContact O-N 2.96Å
90	R	97.9	Very high	97.7	Very high	165 Å²	165	34.5 Å²	34.5	62%	0.623	18%	0.176	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.5	29	-174.9	-57.3	176.5	19.1	101.5	8	114.3	E88 Y226	E88-R90 PolarHBondContact O-N 2.9Å; E88-R90 VanDerWaalsContact O-N 3.14Å; R90-Y226 VanDerWaalsContact C-CE1 3.5Å; R90-Y226 HydrophobicContact CB-CD1 4.05Å; R90-Y226 HydrophobicContact CB-CD2 4.45Å; R90-Y226 HydrophobicContact CB-CE1 4.45Å; R90-Y226 HydrophobicContact CB-CG 4.03Å; R90-Y226 HydrophobicContact CG-CG 4.22Å; R90-Y226 VanDerWaalsContact O-CE1 3.27Å; R90-Y226 WeakPolarHBondContact O-CE1 3.46Å
91	L	98.4	Very high	97.2	Very high	84 Å²	84	39.8 Å²	39.8	44%	0.44	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	126.4	170.4	-61.8	173.3	0	0	0	108.6	H87 E88 H89 H93 F199	H87-L91 VanDerWaalsContact CA-O 3.25Å; H87-L91 WeakPolarHBondContact CA-O 3.46Å; H87-L91 WeakPolarHBondContact CB-O 3.34Å; E88-L91 PolarHBondContact N-O 3.43Å; E88-L91 VanDerWaalsContact N-O 3.15Å; E88-L91 WeakPolarHBondContact O-CB 3.31Å; E88-L91 PolarHBondContact O-N 2.85Å; H89-L91 PolarHBondContact O-N 2.96Å; L91-H93 PolarHBondContact O-CE1 3.24Å; L91-H93 PolarHBondContact O-N 2.87Å; L91-H93 PolarHBondContact O-ND1 3.48Å; L91-F199 HydrophobicContact CD1-CE1 4.39Å
92	P	98.8	Very high	96.7	Very high	14 Å²	14	44 Å²	44	9%	0.091	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	134.8	176.3	-14.2	26.8	0	0	0	110.7	L39 I85 V86 L198 F224 Y226	L39-P92 HydrophobicContact CD1-CB 4.11Å; L39-P92 HydrophobicContact CD1-CG 4.36Å; I85-P92 HydrophobicContact CG2-CB 3.94Å; V86-P92 WeakPolarHBondContact O-CA 3.31Å; P92-L198 HydrophobicContact CB-CD1 3.86Å; P92-L198 HydrophobicContact CB-CG 4.06Å; P92-L198 HydrophobicContact CG-CD1 3.94Å; P92-L198 PolarHBondContact O-N 3.47Å; P92-F224 HydrophobicContact CG-CD2 4.07Å; P92-F224 HydrophobicContact CG-CE2 4.31Å; P92-Y226 WeakPolarHBondContact CD-OH 3.47Å; P92-Y226 HydrophobicContact CG-CE1 4.04Å; P92-Y226 VanDerWaalsContact CG-OH 3.26Å; P92-Y226 WeakPolarHBondContact CG-OH 3.46Å
93	H	98.9	Very high	96.4	Very high	17 Å²	17	48.9 Å²	48.9	8%	0.079	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	134.1	173.3	-65.9	65.8	0	0	0	109.3	I85 V86 L91 A195 A196 P197	I85-H93 WeakPolarHBondContact CA-O 3.47Å; V86-H93 HydrophobicContact CG2-CB 4Å; V86-H93 PolarHBondContact N-O 2.85Å; V86-H93 PolarHBondContact O-N 2.58Å; L91-H93 PolarHBondContact O-CE1 3.24Å; L91-H93 PolarHBondContact O-N 2.87Å; L91-H93 PolarHBondContact O-ND1 3.48Å; H93-A195 HydrophobicContact CB-CB 3.9Å; H93-A196 CarbonylContact C-O 3.53Å; H93-A196 VanDerWaalsContact CA-O 3.28Å; H93-A196 WeakPolarHBondContact CA-O 3.2Å; H93-P197 VanDerWaalsContact CD2-N 3.33Å; H93-P197 WeakPolarHBondContact NE2-CB 3.26Å
94	V	98.8	Very high	96.3	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	132.6	173.7	177.2	0	0	0	0	108.9	V83 L84 L96 L106 A196 L198 L201 L215 L219	V83-V94 HydrophobicContact CG1-CG1 4.06Å; V83-V94 HydrophobicContact CG1-CG2 4.3Å; L84-V94 WeakPolarHBondContact O-CA 3.49Å; V94-L96 HydrophobicContact CG1-CD2 3.87Å; V94-L96 HydrophobicContact CG1-CG 4.31Å; V94-L106 HydrophobicContact CG1-CD2 4.14Å; V94-A196 PolarHBondContact N-O 3.26Å; V94-A196 PolarHBondContact O-N 3.28Å; V94-L198 HydrophobicContact CG2-CD2 3.88Å; V94-L201 HydrophobicContact CB-CD1 4.08Å; V94-L201 HydrophobicContact CG2-CD1 4.07Å; V94-L215 HydrophobicContact CG1-CD1 3.97Å; V94-L215 HydrophobicContact CG2-CD1 4.27Å; V94-L219 HydrophobicContact CG2-CD1 3.96Å
95	L	98.6	Very high	96.3	Very high	1 Å²	1	53 Å²	53	1%	0.005	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	122.7	173.8	-58.2	-175.6	0	0	0	110.5	L84 V86 L179 F185 L193 V194 A195	L84-L95 HydrophobicContact CB-CB 4.25Å; L84-L95 HydrophobicContact CB-CD1 4.03Å; L84-L95 HydrophobicContact CB-CG 4.26Å; L84-L95 HydrophobicContact CD1-CB 4.49Å; L84-L95 PolarHBondContact O-N 3.1Å; V86-L95 HydrophobicContact CG1-CD1 4.17Å; V86-L95 HydrophobicContact CG1-CD2 4.26Å; V86-L95 HydrophobicContact CG1-CG 4.3Å; V86-L95 HydrophobicContact CG2-CD2 3.96Å; L95-L179 HydrophobicContact CD1-CD1 4.32Å; L95-F185 HydrophobicContact CD1-CE2 4.1Å; L95-F185 HydrophobicContact CD1-CZ 4.39Å; L95-L193 HydrophobicContact CB-CD1 4.12Å; L95-V194 CarbonylContact C-O 3.57Å; L95-V194 WeakPolarHBondContact CA-O 3.38Å; L95-A195 HydrophobicContact CD2-CB 3.87Å
96	L	98.6	Very high	96.3	Very high	0 Å²	0	53 Å²	53	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	143	-178.8	-60.7	178.5	0	0	0	111.4	V94 F104 L106 L193 V194 A196 L201 Y208 I212	V94-L96 HydrophobicContact CG1-CD2 3.87Å; V94-L96 HydrophobicContact CG1-CG 4.31Å; L96-F104 HydrophobicContact CB-CD1 4.37Å; L96-F104 HydrophobicContact CD1-CB 4.35Å; L96-F104 HydrophobicContact CD1-CD1 4.37Å; L96-L106 HydrophobicContact CD2-CD2 3.67Å; L96-L106 HydrophobicContact CD2-CG 4.33Å; L96-L193 WeakPolarHBondContact O-CA 3.16Å; L96-V194 HydrophobicContact CB-CG2 3.96Å; L96-V194 PolarHBondContact N-O 2.8Å; L96-V194 PolarHBondContact O-N 3.16Å; L96-A196 HydrophobicContact CD1-CB 3.83Å; L96-A196 HydrophobicContact CG-CB 4.45Å; L96-L201 HydrophobicContact CD1-CD2 4.05Å; L96-Y208 HydrophobicContact CD1-CD1 3.91Å; L96-Y208 HydrophobicContact CD1-CE1 3.72Å; L96-I212 HydrophobicContact CD1-CG2 3.92Å; L96-I212 HydrophobicContact CD2-CD1 4.13Å; L96-I212 HydrophobicContact CD2-CG1 4.48Å; L96-I212 HydrophobicContact CD2-CG2 4.09Å
97	L	97.9	Very high	96.2	Very high	7 Å²	7	53 Å²	53	4%	0.037	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	112.9	169.5	-64.9	167.5	0	0	0	109.1	F104 K105 P107 I128 L129 Y191 L193	L97-F104 CarbonylContact O-C 3.6Å; L97-F104 WeakPolarHBondContact O-CA 3.45Å; L97-K105 HydrophobicContact CB-CB 4.36Å; L97-K105 PolarHBondContact N-O 3.05Å; L97-K105 PolarHBondContact O-N 2.88Å; L97-P107 HydrophobicContact CD1-CB 4.09Å; L97-I128 HydrophobicContact CD1-CG2 3.65Å; L97-I128 HydrophobicContact CD2-CG2 4.42Å; L97-L129 HydrophobicContact CD2-CD2 4.23Å; L97-Y191 HydrophobicContact CB-CD1 3.8Å; L97-Y191 HydrophobicContact CB-CE1 4.2Å; L97-Y191 HydrophobicContact CD2-CG 4.48Å; L97-L193 HydrophobicContact CD2-CD1 3.96Å; L97-L193 HydrophobicContact CG-CD1 4.45Å
98	Q	96.4	Very high	96.2	Very high	37 Å²	37	53.2 Å²	53.2	17%	0.173	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	128.3	174.3	-174.1	-178.8	21	0	0	110	G100 T101 F103 F104 Y191 K192 V194	Q98-G100 WeakPolarHBondContact CG-O 3.38Å; Q98-G100 PolarHBondContact NE2-O 2.77Å; Q98-T101 PolarHBondContact NE2-O 3Å; Q98-F103 WeakPolarHBondContact CA-O 3.37Å; Q98-F104 HydrophobicContact CB-CD1 3.92Å; Q98-F104 HydrophobicContact CB-CE1 3.78Å; Q98-F104 HydrophobicContact CG-CD1 4.06Å; Q98-F104 HydrophobicContact CG-CE1 3.58Å; Q98-F104 HydrophobicContact CG-CZ 4.08Å; Q98-Y191 WeakPolarHBondContact O-CA 3.36Å; Q98-K192 HydrophobicContact CB-CB 4.32Å; Q98-K192 PolarHBondContact N-O 3.49Å; Q98-K192 PolarHBondContact O-N 3.1Å; Q98-V194 HydrophobicContact CB-CG1 4.31Å; Q98-V194 HydrophobicContact CB-CG2 4.45Å
99	L	91.8	Very high	96.2	Very high	50 Å²	50	50.1 Å²	50.1	26%	0.262	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	116.7	173.2	-158.1	71.4	0	0	0	108.6	F103 N190 Y191	L99-F103 HydrophobicContact CB-CB 4.48Å; L99-F103 HydrophobicContact CB-CD1 3.88Å; L99-F103 HydrophobicContact CD2-CD1 4.29Å; L99-F103 PolarHBondContact N-O 3.25Å; L99-F103 WeakPolarHBondContact O-CB 3.42Å; L99-N190 WeakPolarHBondContact CD1-O 3.46Å; L99-Y191 HydrophobicContact CB-CD1 4.1Å; L99-Y191 HydrophobicContact CB-CE1 3.79Å; L99-Y191 HydrophobicContact CD1-CD1 3.58Å; L99-Y191 HydrophobicContact CD1-CD2 4.17Å; L99-Y191 HydrophobicContact CD1-CE1 3.39Å; L99-Y191 HydrophobicContact CD1-CE2 4.01Å; L99-Y191 HydrophobicContact CD1-CG 3.98Å; L99-Y191 HydrophobicContact CD2-CE1 4.19Å; L99-Y191 HydrophobicContact CG-CD1 4.4Å; L99-Y191 HydrophobicContact CG-CE1 3.98Å
100	G	89.7	Confident	96.2	Very high	62 Å²	62	44.4 Å²	44.4	64%	0.639	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	65	-141.2	-170.5	0	0	0	0	0	111.9	Q98	Q98-G100 WeakPolarHBondContact CG-O 3.38Å; Q98-G100 PolarHBondContact NE2-O 2.77Å
101	T	87.4	Confident	96.2	Very high	114 Å²	114	37.4 Å²	37.4	70%	0.699	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-96.3	-43.6	-173.9	49.2	0	0	0	0	113.6	Q98	Q98-T101 PolarHBondContact NE2-O 3Å
102	T	88.9	Confident	96.2	Very high	113 Å²	113	37.6 Å²	37.6	69%	0.693	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-118.9	9.9	-167.5	61	0	0	0	0	114.4
103	F	92.8	Very high	96.1	Very high	101 Å²	101	41.5 Å²	41.5	44%	0.443	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	118.6	-176.7	-168.4	-101.1	0	0	0	110.7	Q98 L99 K105	Q98-F103 WeakPolarHBondContact CA-O 3.37Å; L99-F103 HydrophobicContact CB-CB 4.48Å; L99-F103 HydrophobicContact CB-CD1 3.88Å; L99-F103 HydrophobicContact CD2-CD1 4.29Å; L99-F103 PolarHBondContact N-O 3.25Å; L99-F103 WeakPolarHBondContact O-CB 3.42Å; F103-K105 HydrophobicContact CD1-CD 4.44Å; F103-K105 HydrophobicContact CD1-CG 4.39Å; F103-K105 HydrophobicContact CE1-CD 3.61Å; F103-K105 HydrophobicContact CE1-CG 3.79Å; F103-K105 HydrophobicContact CZ-CD 4.29Å; F103-K105 HydrophobicContact CZ-CG 4.31Å
104	F	97.3	Very high	96	Very high	36 Å²	36	44.5 Å²	44.5	16%	0.158	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	140.8	-177	-61.2	-86.3	0	0	0	110.6	L96 L97 Q98 V194 Y208 I212	L96-F104 HydrophobicContact CB-CD1 4.37Å; L96-F104 HydrophobicContact CD1-CB 4.35Å; L96-F104 HydrophobicContact CD1-CD1 4.37Å; L97-F104 CarbonylContact O-C 3.6Å; L97-F104 WeakPolarHBondContact O-CA 3.45Å; Q98-F104 HydrophobicContact CB-CD1 3.92Å; Q98-F104 HydrophobicContact CB-CE1 3.78Å; Q98-F104 HydrophobicContact CG-CD1 4.06Å; Q98-F104 HydrophobicContact CG-CE1 3.58Å; Q98-F104 HydrophobicContact CG-CZ 4.08Å; F104-V194 HydrophobicContact CD1-CG2 4.27Å; F104-V194 HydrophobicContact CE1-CG2 4.06Å; F104-Y208 HydrophobicContact CB-CD1 4.07Å; F104-Y208 HydrophobicContact CB-CE1 4.3Å; F104-Y208 AromaticContact CD1-CE1 3.99Å; F104-Y208 HydrophobicContact CD1-CE1 3.99Å; F104-Y208 AromaticContact CD2-CD1 3.81Å; F104-Y208 HydrophobicContact CD2-CD1 3.81Å; F104-Y208 AromaticContact CD2-CE1 3.64Å; F104-Y208 HydrophobicContact CD2-CE1 3.64Å; F104-Y208 HydrophobicContact CE1-CE1 4.19Å; F104-Y208 HydrophobicContact CE2-CD1 4.41Å; F104-Y208 AromaticContact CE2-CE1 3.86Å; F104-Y208 HydrophobicContact CE2-CE1 3.86Å; F104-Y208 AromaticContact CG-CD1 3.91Å; F104-Y208 HydrophobicContact CG-CD1 3.91Å; F104-Y208 AromaticContact CG-CE1 3.7Å; F104-Y208 HydrophobicContact CG-CE1 3.7Å; F104-Y208 HydrophobicContact CZ-CE1 4.13Å; F104-I212 HydrophobicContact CB-CD1 4.22Å
105	K	97.2	Very high	96	Very high	50 Å²	50	46.1 Å²	46.1	22%	0.217	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	149.8	178.6	-78.9	175.9	157.6	166.9	0	111.2	E55 L97 F103	E55-K105 IonicContact OE1-NZ 2.81Å; E55-K105 PolarHBondContact OE1-NZ 3.39Å; E55-K105 IonicContact OE2-NZ 2.92Å; E55-K105 PolarHBondContact OE2-NZ 2.95Å; L97-K105 HydrophobicContact CB-CB 4.36Å; L97-K105 PolarHBondContact N-O 3.05Å; L97-K105 PolarHBondContact O-N 2.88Å; F103-K105 HydrophobicContact CD1-CD 4.44Å; F103-K105 HydrophobicContact CD1-CG 4.39Å; F103-K105 HydrophobicContact CE1-CD 3.61Å; F103-K105 HydrophobicContact CE1-CG 3.79Å; F103-K105 HydrophobicContact CZ-CD 4.29Å; F103-K105 HydrophobicContact CZ-CG 4.31Å
106	L	98.5	Very high	96	Very high	8 Å²	8	50.4 Å²	50.4	4%	0.042	31%	0.312	C	S	.	.			trans	-79.5	145.3	160.4	-69.9	169.8	0	0	0	109.3	E81 V83 V94 L96 G108 L174 I212 L215	E81-L106 HydrophobicContact CB-CB 3.94Å; E81-L106 HydrophobicContact CB-CD1 4.12Å; E81-L106 HydrophobicContact CG-CB 4.25Å; V83-L106 HydrophobicContact CG2-CD1 3.88Å; V83-L106 HydrophobicContact CG2-CD2 3.97Å; V94-L106 HydrophobicContact CG1-CD2 4.14Å; L96-L106 HydrophobicContact CD2-CD2 3.67Å; L96-L106 HydrophobicContact CD2-CG 4.33Å; L106-G108 PolarHBondContact O-N 2.98Å; L106-L174 HydrophobicContact CD1-CD2 3.85Å; L106-L174 HydrophobicContact CD1-CG 4.31Å; L106-I212 HydrophobicContact CG-CG1 4.32Å; L106-L215 HydrophobicContact CD1-CD1 4.49Å; L106-L215 HydrophobicContact CD2-CD1 4.29Å
107	P	98	Very high	96	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	32%	0.322	C	S	.	.	S	Bend	trans	-64.8	132.1	169.8	27.8	-32.8	0	0	0	109.7	G82 L84 L97 M125 I128 L129	G82-P107 PolarHBondContact N-O 3.46Å; G82-P107 WeakPolarHBondContact O-CD 3.29Å; L84-P107 HydrophobicContact CD1-CG 3.39Å; L97-P107 HydrophobicContact CD1-CB 4.09Å; P107-M125 HydrophobicContact CB-SD 3.67Å; P107-M125 HydrophobicContact CG-CE 4.21Å; P107-M125 HydrophobicContact CG-SD 3.72Å; P107-I128 HydrophobicContact CB-CD1 4.34Å; P107-I128 HydrophobicContact CB-CG2 4.32Å; P107-L129 HydrophobicContact CB-CD1 4.2Å; P107-L129 HydrophobicContact CG-CD1 4.25Å
108	G	98.2	Very high	96	Very high	17 Å²	17	54 Å²	54	18%	0.175	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	158.2	-167.4	-171.6	0	0	0	0	0	111.3	V80 L106 I128	V80-G108 CarbonylContact O-C 3.49Å; V80-G108 WeakPolarHBondContact O-CA 3.44Å; L106-G108 PolarHBondContact O-N 2.98Å; G108-I128 VanDerWaalsContact N-CD1 3.31Å; G108-I128 VanDerWaalsContact O-CD1 3.31Å; G108-I128 WeakPolarHBondContact O-CD1 3.47Å
109	G	98.1	Very high	96.1	Very high	18 Å²	18	57.1 Å²	57.1	19%	0.186	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	164	-163.5	-176	0	0	0	0	0	114	T79 V80	T79-G109 WeakPolarHBondContact CA-O 3.29Å; T79-G109 WeakPolarHBondContact CG2-O 3.47Å; V80-G109 PolarHBondContact N-O 3.2Å; V80-G109 PolarHBondContact O-N 2.85Å
110	E	98.3	Very high	96.4	Very high	39 Å²	39	54.8 Å²	54.8	18%	0.182	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	135.1	-174.3	-62.3	169.3	173.1	0	0	110.7	K56 R66 R77	K56-E110 IonicContact NZ-OE2 3.61Å; K56-E110 PolarHBondContact NZ-OE2 3.11Å; R66-E110 IonicContact CZ-OE1 2.82Å; R66-E110 IonicContact CZ-OE2 3.52Å; R66-E110 IonicContact NH1-OE1 3.59Å; R66-E110 PolarHBondContact NH1-OE1 3.15Å; R66-E110 VanDerWaalsContact NH1-OE1 3.14Å; R66-E110 IonicContact NH1-OE2 3.46Å; R66-E110 PolarHBondContact NH1-OE2 2.84Å; R66-E110 IonicContact NH2-OE1 2.74Å; R66-E110 PolarHBondContact NH2-OE1 2.86Å; R66-E110 IonicContact NH2-OE2 3.76Å; R77-E110 HydrophobicContact CG-CG 4.45Å; R77-E110 IonicContact CZ-OE1 3.69Å; R77-E110 IonicContact NE-OE1 3.65Å; R77-E110 PolarHBondContact NE-OE1 2.84Å; R77-E110 IonicContact NH1-OE1 2.9Å; R77-E110 PolarHBondContact NH1-OE1 2.9Å; R77-E110 IonicContact NH2-OE1 3.08Å
111	L	98.6	Very high	96.8	Very high	17 Å²	17	51.8 Å²	51.8	9%	0.089	30%	0.303	C	S	.	.	P	Polyproline II helix	trans	-79.8	146.9	172.5	-64.4	-178.5	0	0	0	110.9	R78 V80 E115 E117	R78-L111 HydrophobicContact CB-CB 4.22Å; R78-L111 HydrophobicContact CB-CD1 4.02Å; R78-L111 HydrophobicContact CB-CG 4.41Å; R78-L111 PolarHBondContact O-N 2.97Å; V80-L111 HydrophobicContact CG1-CD1 3.82Å; V80-L111 HydrophobicContact CG1-CD2 4.09Å; V80-L111 HydrophobicContact CG1-CG 4.01Å; V80-L111 HydrophobicContact CG2-CD2 3.61Å; V80-L111 HydrophobicContact CG2-CG 4.15Å; L111-E115 WeakPolarHBondContact CA-OE2 3.46Å; L111-E115 HydrophobicContact CB-CB 4.46Å; L111-E117 HydrophobicContact CD1-CB 4.27Å; L111-E117 HydrophobicContact CD1-CG 3.86Å
112	N	97.7	Very high	97.3	Very high	88 Å²	88	49.1 Å²	49.1	47%	0.471	28%	0.282	S	S	.	.	P	Polyproline II helix	trans	-68.6	157	167.3	-63.2	-50.8	0	0	0	110.7	R78 G114 E115	R78-N112 PolarHBondContact NH2-O 2.65Å; N112-G114 PolarHBondContact O-N 2.78Å; N112-E115 HydrophobicContact CB-CB 4Å; N112-E115 PolarHBondContact N-OE2 2.81Å; N112-E115 PolarHBondContact ND2-OE1 3.06Å; N112-E115 VanDerWaalsContact O-CB 3.29Å; N112-E115 WeakPolarHBondContact O-CB 3.37Å; N112-E115 PolarHBondContact O-N 3.48Å; N112-E115 VanDerWaalsContact O-N 3.09Å
113	P	97.1	Very high	97.7	Very high	96 Å²	96	47.5 Å²	47.5	62%	0.623	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	127.5	173.3	-25.3	35.1	0	0	0	111.3	I74 E115	I74-P113 HydrophobicContact CD1-CG 4.14Å; I74-P113 HydrophobicContact CG2-CG 4.23Å; P113-E115 PolarHBondContact O-N 3.14Å
114	G	96.3	Very high	98	Very high	80 Å²	80	43.3 Å²	43.3	83%	0.825	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	73.5	-3	-179	0	0	0	0	0	115.8	N112	N112-G114 PolarHBondContact O-N 2.78Å
115	E	98.3	Very high	98	Very high	35 Å²	35	41.6 Å²	41.6	16%	0.164	24%	0.238	C	C	.	.			trans	-65.8	140.8	177	-169.2	174.5	-135.7	0	0	111.2	R78 L111 N112 P113 R123	R78-E115 PolarHBondContact NH1-O 3.04Å; R78-E115 VanDerWaalsContact NH1-O 3.07Å; R78-E115 VanDerWaalsContact NH2-N 3.2Å; R78-E115 PolarHBondContact NH2-O 3.27Å; L111-E115 WeakPolarHBondContact CA-OE2 3.46Å; L111-E115 HydrophobicContact CB-CB 4.46Å; N112-E115 HydrophobicContact CB-CB 4Å; N112-E115 PolarHBondContact N-OE2 2.81Å; N112-E115 PolarHBondContact ND2-OE1 3.06Å; N112-E115 VanDerWaalsContact O-CB 3.29Å; N112-E115 WeakPolarHBondContact O-CB 3.37Å; N112-E115 PolarHBondContact O-N 3.48Å; N112-E115 VanDerWaalsContact O-N 3.09Å; P113-E115 PolarHBondContact O-N 3.14Å; E115-R123 IonicContact OE1-CZ 3.49Å; E115-R123 IonicContact OE1-NE 2.73Å; E115-R123 PolarHBondContact OE1-NE 3.07Å; E115-R123 IonicContact OE1-NH2 3.7Å; E115-R123 PolarHBondContact OE1-NH2 3.05Å; E115-R123 IonicContact OE2-CZ 3.42Å; E115-R123 IonicContact OE2-NE 2.75Å; E115-R123 IonicContact OE2-NH2 3.23Å; E115-R123 PolarHBondContact OE2-NH2 2.84Å
116	D	98.4	Very high	97.9	Very high	90 Å²	90	41.5 Å²	41.5	48%	0.481	24%	0.241	S	C	.	.			trans	-67.2	144.5	171.3	175.1	-100.5	0	0	0	110.8	V118 E119 G120	D116-V118 WeakPolarHBondContact OD1-CA 3.33Å; D116-V118 WeakPolarHBondContact OD1-CB 3.44Å; D116-V118 PolarHBondContact OD1-N 2.85Å; D116-E119 HydrophobicContact CB-CB 4.2Å; D116-E119 HydrophobicContact CB-CG 4.39Å; D116-E119 PolarHBondContact OD1-N 2.88Å; D116-G120 WeakPolarHBondContact O-CA 3.42Å; D116-G120 PolarHBondContact O-N 2.83Å
117	E	98.5	Very high	97.8	Very high	45 Å²	45	45.9 Å²	45.9	21%	0.21	26%	0.262	C	S	.	.	H	α-helix	trans	-71	-39.8	-172.6	-60.7	174.4	159.7	0	0	112.4	V80 L111 L121 K173 F175	V80-E117 HydrophobicContact CG1-CB 4.14Å; L111-E117 HydrophobicContact CD1-CB 4.27Å; L111-E117 HydrophobicContact CD1-CG 3.86Å; E117-L121 WeakPolarHBondContact O-CB 3.32Å; E117-L121 PolarHBondContact O-N 2.94Å; E117-K173 VanDerWaalsContact CD-CD 3.5Å; E117-K173 WeakPolarHBondContact OE1-CD 3.24Å; E117-K173 WeakPolarHBondContact OE1-CE 3.14Å; E117-K173 IonicContact OE1-NZ 3Å; E117-K173 PolarHBondContact OE1-NZ 3.47Å; E117-K173 WeakPolarHBondContact OE2-CD 3.35Å; E117-K173 WeakPolarHBondContact OE2-CE 3.46Å; E117-K173 IonicContact OE2-NZ 3.25Å; E117-K173 PolarHBondContact OE2-NZ 3.3Å; E117-F175 HydrophobicContact CB-CE2 4.42Å; E117-F175 HydrophobicContact CB-CZ 4.09Å
118	V	98.3	Very high	97.7	Very high	37 Å²	37	46.6 Å²	46.6	22%	0.224	27%	0.265	C	S	.	.	H	α-helix	trans	-74	-49.1	-179.2	171.9	0	0	0	0	109.4	D116 G120 L121 K122 I141 F175	D116-V118 WeakPolarHBondContact OD1-CA 3.33Å; D116-V118 WeakPolarHBondContact OD1-CB 3.44Å; D116-V118 PolarHBondContact OD1-N 2.85Å; V118-G120 VanDerWaalsContact C-N 3.33Å; V118-G120 PolarHBondContact O-N 2.81Å; V118-L121 PolarHBondContact O-N 2.92Å; V118-L121 VanDerWaalsContact O-N 3.15Å; V118-K122 WeakPolarHBondContact O-CG 3.45Å; V118-K122 PolarHBondContact O-N 2.83Å; V118-I141 HydrophobicContact CG1-CB 4.08Å; V118-I141 HydrophobicContact CG1-CG2 4.48Å; V118-F175 HydrophobicContact CG2-CE1 4.35Å
119	E	98.3	Very high	97.6	Very high	104 Å²	104	45.8 Å²	45.8	49%	0.486	26%	0.257	S	S	.	.	H	α-helix	trans	-64.5	-38.5	178.7	-64.3	-55	124.3	0	0	112.1	D116 L121 K122 R123	D116-E119 HydrophobicContact CB-CB 4.2Å; D116-E119 HydrophobicContact CB-CG 4.39Å; D116-E119 PolarHBondContact OD1-N 2.88Å; E119-L121 PolarHBondContact O-N 2.75Å; E119-K122 PolarHBondContact O-N 2.9Å; E119-K122 IonicContact OE1-NZ 3.91Å; E119-K122 PolarHBondContact OE1-NZ 2.83Å; E119-R123 PolarHBondContact O-N 2.9Å
120	G	98.4	Very high	97.3	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-62.9	-40.1	172.6	0	0	0	0	0	112.5	D116 V118 R123 L124	D116-G120 WeakPolarHBondContact O-CA 3.42Å; D116-G120 PolarHBondContact O-N 2.83Å; V118-G120 VanDerWaalsContact C-N 3.33Å; V118-G120 PolarHBondContact O-N 2.81Å; G120-R123 PolarHBondContact O-N 2.91Å; G120-L124 WeakPolarHBondContact O-CB 3.49Å; G120-L124 WeakPolarHBondContact O-CD1 3.38Å; G120-L124 VanDerWaalsContact O-CG 3.26Å; G120-L124 WeakPolarHBondContact O-CG 3.35Å; G120-L124 PolarHBondContact O-N 2.79Å
121	L	98.6	Very high	96.9	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-65	-43.1	173.7	-176.4	56	0	0	0	111.5	V80 E117 V118 E119 R123 L124 M125 I141 F175 V177	V80-L121 HydrophobicContact CB-CB 4.19Å; V80-L121 HydrophobicContact CB-CD1 4.35Å; V80-L121 HydrophobicContact CG2-CB 3.75Å; V80-L121 HydrophobicContact CG2-CD1 4.01Å; V80-L121 HydrophobicContact CG2-CG 4.41Å; E117-L121 WeakPolarHBondContact O-CB 3.32Å; E117-L121 PolarHBondContact O-N 2.94Å; V118-L121 PolarHBondContact O-N 2.92Å; V118-L121 VanDerWaalsContact O-N 3.15Å; E119-L121 PolarHBondContact O-N 2.75Å; L121-R123 VanDerWaalsContact C-N 3.31Å; L121-R123 PolarHBondContact O-N 3.36Å; L121-L124 PolarHBondContact O-N 2.68Å; L121-M125 HydrophobicContact CD1-CG 3.83Å; L121-M125 HydrophobicContact CD1-SD 4.26Å; L121-M125 HydrophobicContact CG-CG 4.04Å; L121-M125 WeakPolarHBondContact O-CB 3.35Å; L121-M125 WeakPolarHBondContact O-CG 3.43Å; L121-M125 PolarHBondContact O-N 3.43Å; L121-I141 HydrophobicContact CB-CD1 4.12Å; L121-I141 HydrophobicContact CD2-CD1 3.85Å; L121-I141 HydrophobicContact CD2-CG2 4.2Å; L121-I141 HydrophobicContact CG-CD1 3.82Å; L121-F175 HydrophobicContact CD2-CB 3.73Å; L121-F175 HydrophobicContact CD2-CD2 3.71Å; L121-F175 HydrophobicContact CD2-CG 4Å; L121-V177 HydrophobicContact CD2-CG2 4.43Å
122	K	98.3	Very high	96.2	Very high	57 Å²	57	53.4 Å²	53.4	25%	0.248	29%	0.285	C	S	.	.	H	α-helix	trans	-57.9	-42.6	174.9	-66.5	-177.9	-178	162.5	0	112	V118 E119 T126 W139 I141	V118-K122 WeakPolarHBondContact O-CG 3.45Å; V118-K122 PolarHBondContact O-N 2.83Å; E119-K122 PolarHBondContact O-N 2.9Å; E119-K122 IonicContact OE1-NZ 3.91Å; E119-K122 PolarHBondContact OE1-NZ 2.83Å; K122-T126 WeakPolarHBondContact O-CB 3.38Å; K122-T126 PolarHBondContact O-N 2.62Å; K122-T126 PolarHBondContact O-OG1 2.81Å; K122-W139 VanDerWaalsContact CE-O 3.31Å; K122-W139 WeakPolarHBondContact CE-O 3.31Å; K122-W139 HydrophobicContact CG-CB 4.04Å; K122-I141 HydrophobicContact CG-CD1 3.77Å
123	R	97.5	Very high	95.4	Very high	80 Å²	80	53.4 Å²	53.4	30%	0.302	29%	0.285	S	S	.	.	H	α-helix	trans	-59.3	-51.7	174.6	178.5	-176.9	57.7	68.1	0.4	111.1	E115 E119 G120 L121 M125 T126 E127	E115-R123 IonicContact OE1-CZ 3.49Å; E115-R123 IonicContact OE1-NE 2.73Å; E115-R123 PolarHBondContact OE1-NE 3.07Å; E115-R123 IonicContact OE1-NH2 3.7Å; E115-R123 PolarHBondContact OE1-NH2 3.05Å; E115-R123 IonicContact OE2-CZ 3.42Å; E115-R123 IonicContact OE2-NE 2.75Å; E115-R123 IonicContact OE2-NH2 3.23Å; E115-R123 PolarHBondContact OE2-NH2 2.84Å; E119-R123 PolarHBondContact O-N 2.9Å; G120-R123 PolarHBondContact O-N 2.91Å; L121-R123 VanDerWaalsContact C-N 3.31Å; L121-R123 PolarHBondContact O-N 3.36Å; R123-M125 PolarHBondContact O-N 3.29Å; R123-T126 PolarHBondContact O-N 3.43Å; R123-E127 IonicContact NH1-OE2 2.79Å; R123-E127 WeakPolarHBondContact O-CB 3.39Å; R123-E127 PolarHBondContact O-N 2.78Å
124	L	98	Very high	94.4	Very high	12 Å²	12	52.1 Å²	52.1	6%	0.063	29%	0.289	C	S	.	.	H	α-helix	trans	-63.8	-40.6	-179	-70.6	161.4	0	0	0	112.2	V80 G120 L121 T126 E127 I128	V80-L124 HydrophobicContact CG2-CD1 3.66Å; G120-L124 WeakPolarHBondContact O-CB 3.49Å; G120-L124 WeakPolarHBondContact O-CD1 3.38Å; G120-L124 VanDerWaalsContact O-CG 3.26Å; G120-L124 WeakPolarHBondContact O-CG 3.35Å; G120-L124 PolarHBondContact O-N 2.79Å; L121-L124 PolarHBondContact O-N 2.68Å; L124-T126 VanDerWaalsContact C-N 3.34Å; L124-T126 PolarHBondContact O-N 2.85Å; L124-E127 PolarHBondContact O-N 3Å; L124-I128 WeakPolarHBondContact O-CB 3.43Å; L124-I128 WeakPolarHBondContact O-CD1 3.24Å; L124-I128 WeakPolarHBondContact O-CG1 3.27Å; L124-I128 PolarHBondContact O-N 2.87Å
125	M	97.3	Very high	93.8	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-62.5	-41.8	175.4	-69.5	-70.1	-68.2	0	0	111.5	L84 P107 L121 R123 I128 L129 G130 W139 V177	L84-M125 HydrophobicContact CD1-CE 3.66Å; L84-M125 HydrophobicContact CD2-CE 3.57Å; L84-M125 HydrophobicContact CG-CE 3.85Å; P107-M125 HydrophobicContact CB-SD 3.67Å; P107-M125 HydrophobicContact CG-CE 4.21Å; P107-M125 HydrophobicContact CG-SD 3.72Å; L121-M125 HydrophobicContact CD1-CG 3.83Å; L121-M125 HydrophobicContact CD1-SD 4.26Å; L121-M125 HydrophobicContact CG-CG 4.04Å; L121-M125 WeakPolarHBondContact O-CB 3.35Å; L121-M125 WeakPolarHBondContact O-CG 3.43Å; L121-M125 PolarHBondContact O-N 3.43Å; R123-M125 PolarHBondContact O-N 3.29Å; M125-I128 PolarHBondContact O-N 3.5Å; M125-L129 HydrophobicContact CE-CD1 4.43Å; M125-L129 PolarHBondContact O-N 2.88Å; M125-G130 PolarHBondContact O-N 2.7Å; M125-W139 HydrophobicContact CB-CD2 3.97Å; M125-W139 HydrophobicContact CB-CG 4.32Å; M125-W139 HydrophobicContact CB-CH2 4.47Å; M125-W139 HydrophobicContact CB-CZ2 3.92Å; M125-W139 HydrophobicContact CE-CD2 4.46Å; M125-W139 HydrophobicContact CE-CE3 3.92Å; M125-W139 HydrophobicContact CE-CH2 3.98Å; M125-W139 HydrophobicContact CE-CZ3 3.66Å; M125-V177 HydrophobicContact CE-CG1 4.25Å; M125-V177 HydrophobicContact CE-CG2 4.28Å
126	T	96.1	Very high	93	Very high	49 Å²	49	57.4 Å²	57.4	30%	0.301	30%	0.301	S	S	.	.	H	α-helix	trans	-66.7	-42.5	175.2	-55.4	0	0	0	0	111.4	K122 R123 L124 I128 G130 W139	K122-T126 WeakPolarHBondContact O-CB 3.38Å; K122-T126 PolarHBondContact O-N 2.62Å; K122-T126 PolarHBondContact O-OG1 2.81Å; R123-T126 PolarHBondContact O-N 3.43Å; L124-T126 VanDerWaalsContact C-N 3.34Å; L124-T126 PolarHBondContact O-N 2.85Å; T126-I128 VanDerWaalsContact C-N 3.31Å; T126-I128 PolarHBondContact O-N 2.76Å; T126-G130 WeakPolarHBondContact O-CA 3.46Å; T126-G130 PolarHBondContact O-N 2.94Å; T126-W139 PolarHBondContact OG1-NE1 2.81Å
127	E	95	Very high	92.4	Very high	100 Å²	100	54.7 Å²	54.7	47%	0.467	29%	0.286	S	S	.	.	H	α-helix	trans	-59.5	-42.1	175.9	-174.1	-179.6	162.8	0	0	111.6	K50 R123 L124	K50-E127 PolarHBondContact NZ-O 2.88Å; R123-E127 IonicContact NH1-OE2 2.79Å; R123-E127 WeakPolarHBondContact O-CB 3.39Å; R123-E127 PolarHBondContact O-N 2.78Å; L124-E127 PolarHBondContact O-N 3Å
128	I	96	Very high	92.1	Very high	14 Å²	14	57.5 Å²	57.5	7%	0.072	30%	0.302	C	S	.	.	H	α-helix	trans	-84	-47.2	-175.2	-62.9	165.6	0	0	0	112.2	K50 L53 L97 P107 G108 L124 M125 T126 P188	K50-I128 WeakPolarHBondContact CE-O 3.44Å; K50-I128 PolarHBondContact NZ-O 2.94Å; L53-I128 HydrophobicContact CD2-CG1 3.89Å; L97-I128 HydrophobicContact CD1-CG2 3.65Å; L97-I128 HydrophobicContact CD2-CG2 4.42Å; P107-I128 HydrophobicContact CB-CD1 4.34Å; P107-I128 HydrophobicContact CB-CG2 4.32Å; G108-I128 VanDerWaalsContact N-CD1 3.31Å; G108-I128 VanDerWaalsContact O-CD1 3.31Å; G108-I128 WeakPolarHBondContact O-CD1 3.47Å; L124-I128 WeakPolarHBondContact O-CB 3.43Å; L124-I128 WeakPolarHBondContact O-CD1 3.24Å; L124-I128 WeakPolarHBondContact O-CG1 3.27Å; L124-I128 PolarHBondContact O-N 2.87Å; M125-I128 PolarHBondContact O-N 3.5Å; T126-I128 VanDerWaalsContact C-N 3.31Å; T126-I128 PolarHBondContact O-N 2.76Å; I128-P188 WeakPolarHBondContact O-CD 3.41Å
129	L	96	Very high	92	Very high	1 Å²	1	56.1 Å²	56.1	1%	0.005	29%	0.293	C	S	.	.	H	α-helix	trans	-118.7	-8.3	-170.4	-63.2	179.3	0	0	0	114.4	L84 L97 P107 M125 W139 F185 A186 V187 L193	L84-L129 HydrophobicContact CD1-CD1 4.4Å; L97-L129 HydrophobicContact CD2-CD2 4.23Å; P107-L129 HydrophobicContact CB-CD1 4.2Å; P107-L129 HydrophobicContact CG-CD1 4.25Å; M125-L129 HydrophobicContact CE-CD1 4.43Å; M125-L129 PolarHBondContact O-N 2.88Å; L129-W139 HydrophobicContact CB-CH2 4.24Å; L129-W139 HydrophobicContact CB-CZ2 4.48Å; L129-F185 HydrophobicContact CB-CD1 4.07Å; L129-F185 HydrophobicContact CD1-CD1 4.33Å; L129-A186 PolarHBondContact O-N 2.87Å; L129-V187 HydrophobicContact CD2-CG2 4.26Å; L129-L193 HydrophobicContact CD2-CD2 4.15Å
130	G	93.4	Very high	92	Very high	5 Å²	5	53 Å²	53	5%	0.052	28%	0.281	C	S	.	.			trans	-67.7	147.4	-178.5	0	0	0	0	0	113.3	K50 M125 T126 A186	K50-G130 PolarHBondContact NZ-O 3.29Å; M125-G130 PolarHBondContact O-N 2.7Å; T126-G130 WeakPolarHBondContact O-CA 3.46Å; T126-G130 PolarHBondContact O-N 2.94Å; G130-A186 WeakPolarHBondContact O-CB 3.43Å
131	R	89.8	Confident	92	Very high	83 Å²	83	53.5 Å²	53.5	31%	0.313	28%	0.283	S	S	.	.			trans	-68.4	152.3	179.6	-57.8	166.1	65.4	148.9	5.3	111.2	D133 L184	R131-D133 WeakPolarHBondContact CB-OD1 3.41Å; R131-D133 IonicContact CZ-OD1 3.22Å; R131-D133 IonicContact CZ-OD2 2.7Å; R131-D133 IonicContact NE-OD1 2.66Å; R131-D133 PolarHBondContact NE-OD1 2.7Å; R131-D133 VanDerWaalsContact NE-OD1 3.11Å; R131-D133 IonicContact NE-OD2 3.31Å; R131-D133 PolarHBondContact NE-OD2 2.9Å; R131-D133 IonicContact NH2-OD2 2.62Å; R131-D133 PolarHBondContact NH2-OD2 3.48Å; R131-L184 HydrophobicContact CG-CB 4.36Å; R131-L184 HydrophobicContact CG-CD2 4.14Å; R131-L184 HydrophobicContact CG-CG 4.29Å; R131-L184 WeakPolarHBondContact CG-O 3.29Å
132	Q	82.3	Confident	91.8	Very high	146 Å²	146	58.6 Å²	58.6	68%	0.682	31%	0.311	S	S	*	.	S	Bend	trans	-97.2	0.9	177.6	-67.4	-172.7	-43	0	0	113.7	K50 G134	K50-Q132 HydrophobicContact CB-CG 4.46Å; K50-Q132 HydrophobicContact CD-CG 4.42Å; Q132-G134 VanDerWaalsContact C-N 3.27Å; Q132-G134 PolarHBondContact O-N 2.92Å
133	D	82.5	Confident	91.8	Very high	88 Å²	88	56.6 Å²	56.6	47%	0.471	30%	0.303	S	S	.	.	S	Bend	trans	-88.5	11.8	-178.3	57.4	7.8	0	0	0	113.7	R131 V135	R131-D133 WeakPolarHBondContact CB-OD1 3.41Å; R131-D133 IonicContact CZ-OD1 3.22Å; R131-D133 IonicContact CZ-OD2 2.7Å; R131-D133 IonicContact NE-OD1 2.66Å; R131-D133 PolarHBondContact NE-OD1 2.7Å; R131-D133 VanDerWaalsContact NE-OD1 3.11Å; R131-D133 IonicContact NE-OD2 3.31Å; R131-D133 PolarHBondContact NE-OD2 2.9Å; R131-D133 IonicContact NH2-OD2 2.62Å; R131-D133 PolarHBondContact NH2-OD2 3.48Å; D133-V135 VanDerWaalsContact C-N 3.26Å; D133-V135 PolarHBondContact O-N 2.81Å; D133-V135 PolarHBondContact OD1-N 2.88Å
134	G	76.3	Confident	91.8	Very high	68 Å²	68	55.5 Å²	55.5	70%	0.701	31%	0.307	S	S	*	.	S	Bend	trans	81	-3.2	178.5	0	0	0	0	0	114.7	Q132 L136	Q132-G134 VanDerWaalsContact C-N 3.27Å; Q132-G134 PolarHBondContact O-N 2.92Å; G134-L136 PolarHBondContact O-N 2.75Å
135	V	82.7	Confident	91.7	Very high	76 Å²	76	55.6 Å²	55.6	46%	0.461	31%	0.307	S	S	.	.			trans	-77.6	110.7	173.2	-177.5	0	0	0	0	109.1	D133 Q137	D133-V135 VanDerWaalsContact C-N 3.26Å; D133-V135 PolarHBondContact O-N 2.81Å; D133-V135 PolarHBondContact OD1-N 2.88Å; V135-Q137 PolarHBondContact O-N 2.89Å
136	L	81.2	Confident	91.7	Very high	151 Å²	151	56.1 Å²	56.1	79%	0.791	31%	0.313	S	S	*	.	P	Polyproline II helix	trans	-70.2	126.6	174.3	-66.2	174.6	0	0	0	109.9	G134	G134-L136 PolarHBondContact O-N 2.75Å
137	Q	86.8	Confident	91.9	Very high	32 Å²	32	56 Å²	56	15%	0.15	31%	0.31	C	S	.	.	P	Polyproline II helix	trans	-81.8	122.8	171.7	-171.9	69.6	48.8	0	0	108.3	V135 W139	V135-Q137 PolarHBondContact O-N 2.89Å; Q137-W139 HydrophobicContact CB-CZ2 4.06Å; Q137-W139 HydrophobicContact CG-CD2 4.13Å; Q137-W139 HydrophobicContact CG-CE3 4.27Å; Q137-W139 HydrophobicContact CG-CH2 4Å; Q137-W139 HydrophobicContact CG-CZ2 3.81Å; Q137-W139 HydrophobicContact CG-CZ3 4.21Å; Q137-W139 PolarHBondContact O-N 3.45Å
138	D	91	Very high	92.1	Very high	104 Å²	104	52.2 Å²	52.2	56%	0.556	29%	0.292	S	S	*	.	P	Polyproline II helix	trans	-79.2	119.2	172.5	-173.1	26.3	0	0	0	109.9
139	W	96.6	Very high	92.2	Very high	8 Å²	8	53.5 Å²	53.5	3%	0.03	30%	0.296	C	S	.	.			trans	-104	113	-177.8	-60.5	109.8	0	0	0	109.5	L84 K122 M125 T126 L129 Q137 I141 V177 L179 F185	L84-W139 HydrophobicContact CD2-CZ3 3.82Å; K122-W139 VanDerWaalsContact CE-O 3.31Å; K122-W139 WeakPolarHBondContact CE-O 3.31Å; K122-W139 HydrophobicContact CG-CB 4.04Å; M125-W139 HydrophobicContact CB-CD2 3.97Å; M125-W139 HydrophobicContact CB-CG 4.32Å; M125-W139 HydrophobicContact CB-CH2 4.47Å; M125-W139 HydrophobicContact CB-CZ2 3.92Å; M125-W139 HydrophobicContact CE-CD2 4.46Å; M125-W139 HydrophobicContact CE-CE3 3.92Å; M125-W139 HydrophobicContact CE-CH2 3.98Å; M125-W139 HydrophobicContact CE-CZ3 3.66Å; T126-W139 PolarHBondContact OG1-NE1 2.81Å; L129-W139 HydrophobicContact CB-CH2 4.24Å; L129-W139 HydrophobicContact CB-CZ2 4.48Å; Q137-W139 HydrophobicContact CB-CZ2 4.06Å; Q137-W139 HydrophobicContact CG-CD2 4.13Å; Q137-W139 HydrophobicContact CG-CE3 4.27Å; Q137-W139 HydrophobicContact CG-CH2 4Å; Q137-W139 HydrophobicContact CG-CZ2 3.81Å; Q137-W139 HydrophobicContact CG-CZ3 4.21Å; Q137-W139 PolarHBondContact O-N 3.45Å; W139-I141 HydrophobicContact CB-CD1 4.3Å; W139-I141 HydrophobicContact CB-CG1 4.31Å; W139-V177 HydrophobicContact CE3-CG1 3.8Å; W139-V177 HydrophobicContact CZ3-CG1 4.49Å; W139-L179 HydrophobicContact CZ3-CD2 4.35Å; W139-F185 HydrophobicContact CH2-CD1 4.15Å; W139-F185 AromaticContact CH2-CE1 3.81Å; W139-F185 HydrophobicContact CH2-CE1 3.81Å; W139-F185 HydrophobicContact CZ3-CE1 4.01Å
140	V	98	Very high	92.3	Very high	38 Å²	38	53.5 Å²	53.5	23%	0.23	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	113.3	178.8	-178.9	0	0	0	0	109.4	D142 Q178	V140-D142 WeakPolarHBondContact CG1-OD2 3.16Å; V140-Q178 HydrophobicContact CB-CB 4.09Å; V140-Q178 HydrophobicContact CG1-CB 4.16Å; V140-Q178 PolarHBondContact O-N 3.49Å
141	I	97.9	Very high	92.6	Very high	11 Å²	11	53.8 Å²	53.8	6%	0.056	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	88.9	-171.7	-47.4	-176.9	0	0	0	109.4	V118 L121 K122 W139 F175 V177	V118-I141 HydrophobicContact CG1-CB 4.08Å; V118-I141 HydrophobicContact CG1-CG2 4.48Å; L121-I141 HydrophobicContact CB-CD1 4.12Å; L121-I141 HydrophobicContact CD2-CD1 3.85Å; L121-I141 HydrophobicContact CD2-CG2 4.2Å; L121-I141 HydrophobicContact CG-CD1 3.82Å; K122-I141 HydrophobicContact CG-CD1 3.77Å; W139-I141 HydrophobicContact CB-CD1 4.3Å; W139-I141 HydrophobicContact CB-CG1 4.31Å; I141-F175 HydrophobicContact CG2-CB 3.58Å; I141-F175 HydrophobicContact CG2-CD1 4Å; I141-F175 HydrophobicContact CG2-CG 3.96Å; I141-V177 HydrophobicContact CD1-CG2 4.24Å; I141-V177 HydrophobicContact CG1-CG1 4.24Å; I141-V177 HydrophobicContact CG1-CG2 4.13Å
142	D	95.4	Very high	93	Very high	107 Å²	107	53.1 Å²	53.1	57%	0.572	30%	0.299	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111.9	-11.5	-173.7	-57.1	-35.7	0	0	0	113.2	R35 V140 Q178	R35-D142 IonicContact NH2-OD2 2.75Å; V140-D142 WeakPolarHBondContact CG1-OD2 3.16Å; D142-Q178 PolarHBondContact OD2-NE2 3.31Å
143	D	97.6	Very high	93.7	Very high	15 Å²	15	47.8 Å²	47.8	8%	0.08	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	111.2	-164.7	-75.2	-88.8	0	0	0	111.5	R35 F175 L176 F222	R35-D143 IonicContact CZ-OD2 2.73Å; R35-D143 VanDerWaalsContact CZ-OD2 3.25Å; R35-D143 IonicContact NE-OD1 3.14Å; R35-D143 PolarHBondContact NE-OD1 3.48Å; R35-D143 IonicContact NE-OD2 3.43Å; R35-D143 PolarHBondContact NE-OD2 3.22Å; R35-D143 IonicContact NH2-OD2 3.42Å; R35-D143 PolarHBondContact NH2-OD2 3.37Å; D143-F175 CarbonylContact O-C 3.53Å; D143-F175 VanDerWaalsContact O-CA 3.24Å; D143-F175 WeakPolarHBondContact O-CA 3.13Å; D143-L176 HydrophobicContact CB-CB 4.07Å; D143-L176 PolarHBondContact O-N 2.91Å; D143-F222 HydrophobicContact CB-CE1 4.29Å; D143-F222 HydrophobicContact CB-CZ 4.23Å
144	C	97.4	Very high	94.4	Very high	58 Å²	58	48.6 Å²	48.6	39%	0.392	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	128.8	164.1	-178.8	0	0	0	0	109.3	F175 R221	C144-F175 HydrophobicContact CB-CD1 4.16Å; C144-F175 HydrophobicContact CB-CE1 4.07Å; C144-R221 PolarHBondContact O-NH2 2.9Å; C144-R221 VanDerWaalsContact O-NH2 3.1Å
145	I	96.6	Very high	95.4	Very high	14 Å²	14	49.4 Å²	49.4	7%	0.072	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	-17.8	-176.8	63.6	170.6	0	0	0	113.6	V83 L174 L176 L215 L219 F222	V83-I145 HydrophobicContact CB-CD1 3.93Å; V83-I145 HydrophobicContact CG1-CD1 4.43Å; V83-I145 HydrophobicContact CG2-CD1 3.53Å; I145-L174 HydrophobicContact CD1-CB 4.06Å; I145-L174 HydrophobicContact CD1-CD2 4.41Å; I145-L174 HydrophobicContact CG1-CB 3.59Å; I145-L174 WeakPolarHBondContact CG1-O 3.3Å; I145-L174 PolarHBondContact N-O 2.95Å; I145-L176 HydrophobicContact CG2-CB 3.79Å; I145-L215 HydrophobicContact CD1-CD2 4.17Å; I145-L219 HydrophobicContact CD1-CD2 4.45Å; I145-F222 HydrophobicContact CG2-CE2 3.78Å; I145-F222 HydrophobicContact CG2-CZ 3.68Å
146	G	98.1	Very high	96.1	Very high	11 Å²	11	48.6 Å²	48.6	11%	0.113	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-175.9	161.5	-179.1	0	0	0	0	0	114.3	L174	G146-L174 PolarHBondContact O-N 3Å
147	N	98.8	Very high	96.9	Very high	47 Å²	47	43.1 Å²	43.1	25%	0.251	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	139.2	177.2	-67.8	-97.9	0	0	0	109.1	W149 P159 H171 K172 K173	N147-W149 HydrophobicContact CB-CE3 4.33Å; N147-W149 HydrophobicContact CB-CH2 3.25Å; N147-W149 HydrophobicContact CB-CZ2 3.81Å; N147-W149 HydrophobicContact CB-CZ3 3.53Å; N147-P159 WeakPolarHBondContact O-CA 3.34Å; N147-H171 PolarHBondContact OD1-NE2 3.26Å; N147-K172 CarbonylContact C-O 3.52Å; N147-K172 WeakPolarHBondContact CA-O 3.29Å; N147-K173 WeakPolarHBondContact OD1-CE 3.4Å; N147-K173 VanDerWaalsContact OD1-CG 3.27Å; N147-K173 WeakPolarHBondContact OD1-CG 3.5Å
148	W	98.8	Very high	97.5	Very high	19 Å²	19	45.6 Å²	45.6	7%	0.072	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	141	176.3	-73.4	75.8	0	0	0	110.5	Q157 Y158 P159 K172 P210 I211	W148-Q157 HydrophobicContact CE3-CB 3.81Å; W148-Q157 HydrophobicContact CZ3-CB 4.45Å; W148-Q157 WeakPolarHBondContact CZ3-O 3.31Å; W148-Y158 CarbonylContact C-O 3.56Å; W148-Y158 VanDerWaalsContact CA-O 3.31Å; W148-Y158 WeakPolarHBondContact CA-O 3.28Å; W148-P159 HydrophobicContact CD2-CB 4.36Å; W148-P159 HydrophobicContact CZ2-CB 4.3Å; W148-K172 HydrophobicContact CB-CB 4.3Å; W148-K172 PolarHBondContact N-O 3.44Å; W148-K172 PolarHBondContact O-N 2.8Å; W148-P210 HydrophobicContact CH2-CB 3.81Å; W148-P210 HydrophobicContact CH2-CG 4.43Å; W148-P210 WeakPolarHBondContact CH2-O 3.44Å; W148-P210 WeakPolarHBondContact CZ2-O 3.45Å; W148-P210 HydrophobicContact CZ3-CB 4.05Å; W148-P210 HydrophobicContact CZ3-CG 4.25Å; W148-I211 HydrophobicContact CD2-CD1 4.22Å; W148-I211 HydrophobicContact CD2-CG1 3.63Å; W148-I211 HydrophobicContact CE3-CG1 3.9Å; W148-I211 HydrophobicContact CG-CD1 4.22Å; W148-I211 HydrophobicContact CG-CG1 4.05Å; W148-I211 HydrophobicContact CH2-CG1 4.25Å; W148-I211 HydrophobicContact CZ2-CB 4.41Å; W148-I211 HydrophobicContact CZ2-CG1 3.99Å; W148-I211 HydrophobicContact CZ3-CG1 4.2Å
149	W	98.9	Very high	97.9	Very high	42 Å²	42	44.2 Å²	44.2	16%	0.159	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	136.1	-179.2	-67.5	-89.4	0	0	0	111.2	N147 Q157 Y158 Y160 I161 P168 E170 H171	N147-W149 HydrophobicContact CB-CE3 4.33Å; N147-W149 HydrophobicContact CB-CH2 3.25Å; N147-W149 HydrophobicContact CB-CZ2 3.81Å; N147-W149 HydrophobicContact CB-CZ3 3.53Å; W149-Q157 CarbonylContact O-C 3.54Å; W149-Q157 WeakPolarHBondContact O-CA 3.31Å; W149-Y158 PolarHBondContact N-O 2.62Å; W149-Y158 PolarHBondContact O-N 3.27Å; W149-Y160 VanDerWaalsContact CE3-C 3.42Å; W149-I161 HydrophobicContact CD2-CG1 3.68Å; W149-I161 HydrophobicContact CE3-CG1 4.31Å; W149-I161 HydrophobicContact CG-CG1 3.77Å; W149-I161 HydrophobicContact CZ2-CD1 4.47Å; W149-I161 HydrophobicContact CZ2-CG1 4.24Å; W149-P168 HydrophobicContact CB-CB 4.5Å; W149-E170 WeakPolarHBondContact CA-O 3.34Å; W149-H171 AromaticContact CD1-CD2 3.98Å; W149-H171 AromaticContact CE2-CD2 3.69Å; W149-H171 AromaticContact CE2-NE2 3.86Å; W149-H171 AromaticContact CZ2-NE2 3.77Å; W149-H171 AromaticContact NE1-CD2 3.43Å; W149-H171 PolarHBondContact NE1-CD2 2.88Å; W149-H171 AromaticContact NE1-CG 3.57Å; W149-H171 AromaticContact NE1-NE2 3.87Å
150	R	98.8	Very high	98	Very high	1 Å²	1	50.1 Å²	50.1	0%	0.004	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	114	170.6	-170.4	-172.1	-61.1	-64.1	-11.7	109.1	R63 N152 E154 P155 Q157 P168 K169 E170	R63-R150 VanDerWaalsContact NH2-NH2 3.16Å; R150-N152 WeakPolarHBondContact CD-O 3.41Å; R150-N152 WeakPolarHBondContact CG-O 3.46Å; R150-E154 WeakPolarHBondContact CD-O 3.49Å; R150-E154 PolarHBondContact NH1-O 2.9Å; R150-P155 PolarHBondContact NH1-O 3.11Å; R150-Q157 HydrophobicContact CB-CG 4.15Å; R150-Q157 HydrophobicContact CG-CG 4.45Å; R150-P168 CarbonylContact O-C 3.59Å; R150-P168 WeakPolarHBondContact O-CA 3.12Å; R150-P168 WeakPolarHBondContact O-CB 3.39Å; R150-K169 PolarHBondContact O-N 2.91Å; R150-E170 HydrophobicContact CB-CB 3.74Å; R150-E170 IonicContact CZ-OE2 3.83Å; R150-E170 VanDerWaalsContact CZ-OE2 3.31Å; R150-E170 PolarHBondContact N-O 2.92Å; R150-E170 IonicContact NE-OE2 2.68Å; R150-E170 PolarHBondContact NE-OE2 3.4Å; R150-E170 IonicContact NH2-OE2 3.36Å; R150-E170 PolarHBondContact NH2-OE2 3.43Å; R150-E170 PolarHBondContact O-N 3.44Å
151	P	98.6	Very high	98	Very high	10 Å²	10	52.4 Å²	52.4	7%	0.065	27%	0.273	C	S	.	.			trans	-75.3	-34.2	-177	28.3	-34.2	0	0	0	113.3	Y158 P162 I165 K169	P151-Y158 HydrophobicContact CG-CD2 4.06Å; P151-Y158 HydrophobicContact CG-CE2 3.78Å; P151-P162 HydrophobicContact CB-CG 4.34Å; P151-P162 HydrophobicContact CG-CG 4.37Å; P151-I165 HydrophobicContact CB-CD1 3.91Å; P151-I165 HydrophobicContact CB-CG1 3.88Å; P151-I165 HydrophobicContact CB-CG2 4.05Å; P151-K169 PolarHBondContact O-NZ 3.36Å
152	N	98.4	Very high	98	Very high	69 Å²	69	53 Å²	53	37%	0.369	28%	0.277	S	S	.	.	S	Bend	trans	-127.4	171.5	-171.9	-61.7	-34.3	0	0	0	111.7	R150 E154	R150-N152 WeakPolarHBondContact CD-O 3.41Å; R150-N152 WeakPolarHBondContact CG-O 3.46Å; N152-E154 HydrophobicContact CB-CB 4.25Å; N152-E154 HydrophobicContact CB-CG 4.18Å; N152-E154 PolarHBondContact O-N 2.85Å
153	F	98.1	Very high	98.2	Very high	35 Å²	35	51.7 Å²	51.7	15%	0.154	28%	0.281	C	S	.	.	S	Bend	trans	-79.6	55.2	172.3	-58.6	-73.2	0	0	0	111.3	F64 M67 R68 F71 K169	F64-F153 VanDerWaalsContact CD1-C 3.43Å; F64-F153 HydrophobicContact CD1-CB 4.43Å; F64-F153 WeakPolarHBondContact CD1-O 3.19Å; M67-F153 HydrophobicContact CB-CD1 4.1Å; M67-F153 HydrophobicContact CB-CE1 4.41Å; M67-F153 HydrophobicContact CG-CD1 3.77Å; M67-F153 HydrophobicContact CG-CE1 3.93Å; M67-F153 WeakPolarHBondContact O-CE1 3.47Å; M67-F153 HydrophobicContact SD-CD1 3.96Å; R68-F153 HydrophobicContact CB-CD1 4.48Å; R68-F153 HydrophobicContact CB-CE1 4.21Å; R68-F153 HydrophobicContact CB-CZ 4.25Å; R68-F153 HydrophobicContact CG-CB 4.25Å; R68-F153 HydrophobicContact CG-CD1 3.64Å; R68-F153 HydrophobicContact CG-CD2 3.69Å; R68-F153 HydrophobicContact CG-CE1 3.77Å; R68-F153 HydrophobicContact CG-CE2 3.8Å; R68-F153 HydrophobicContact CG-CG 3.59Å; R68-F153 HydrophobicContact CG-CZ 3.82Å; R68-F153 VanDerWaalsContact CZ-CB 3.46Å; R68-F153 VanDerWaalsContact NH1-CB 3.3Å; F71-F153 HydrophobicContact CB-CE1 3.89Å; F71-F153 HydrophobicContact CB-CZ 3.82Å; F71-F153 AromaticContact CD1-CZ 3.97Å; F71-F153 HydrophobicContact CD1-CZ 3.97Å; F71-F153 HydrophobicContact CG-CE1 4.24Å; F71-F153 AromaticContact CG-CZ 3.88Å; F71-F153 HydrophobicContact CG-CZ 3.88Å; F153-K169 HydrophobicContact CD1-CB 4.16Å; F153-K169 HydrophobicContact CD1-CD 4.37Å; F153-K169 HydrophobicContact CD1-CG 3.97Å; F153-K169 HydrophobicContact CD2-CD 4.33Å; F153-K169 HydrophobicContact CD2-CG 4.32Å; F153-K169 HydrophobicContact CE1-CB 4.03Å; F153-K169 HydrophobicContact CE1-CD 3.79Å; F153-K169 HydrophobicContact CE1-CG 3.86Å; F153-K169 HydrophobicContact CE2-CD 3.78Å; F153-K169 HydrophobicContact CE2-CG 4.24Å; F153-K169 HydrophobicContact CG-CG 4.21Å; F153-K169 HydrophobicContact CZ-CD 3.49Å; F153-K169 VanDerWaalsContact CZ-CD 3.49Å; F153-K169 HydrophobicContact CZ-CG 4.02Å
154	E	97.3	Very high	98.2	Very high	104 Å²	104	60 Å²	60	49%	0.486	32%	0.319	S	S	.	.	S	Bend	trans	-143.9	162.1	-171.9	-68.1	175.2	177.1	0	0	110.1	F64 R150 N152 P156	F64-E154 VanDerWaalsContact CE1-C 3.49Å; R150-E154 WeakPolarHBondContact CD-O 3.49Å; R150-E154 PolarHBondContact NH1-O 2.9Å; N152-E154 HydrophobicContact CB-CB 4.25Å; N152-E154 HydrophobicContact CB-CG 4.18Å; N152-E154 PolarHBondContact O-N 2.85Å; E154-P156 VanDerWaalsContact C-CD 3.41Å
155	P	96.8	Very high	98.2	Very high	86 Å²	86	59.6 Å²	59.6	56%	0.558	31%	0.313	S	S	*	.	S	Bend	trans	-58.3	-35.4	-176.6	-26.7	35.6	0	0	0	118.4	F64 R150	F64-P155 HydrophobicContact CE2-CG 4.06Å; F64-P155 HydrophobicContact CZ-CG 3.92Å; R150-P155 PolarHBondContact NH1-O 3.11Å
156	P	97.6	Very high	98.3	Very high	59 Å²	59	65 Å²	65	38%	0.383	35%	0.346	S	S	.	.			trans	-59.6	139.1	-174.3	-27.2	36.1	0	0	0	114.2	E154 Y158	E154-P156 VanDerWaalsContact C-CD 3.41Å; P156-Y158 HydrophobicContact CB-CE2 3.99Å
157	Q	98.3	Very high	98.3	Very high	35 Å²	35	71.5 Å²	71.5	16%	0.164	37%	0.372	C	S	.	.			trans	-134.7	149.2	174.9	-70.2	167.3	88.9	0	0	108.8	W148 W149 R150	W148-Q157 HydrophobicContact CE3-CB 3.81Å; W148-Q157 HydrophobicContact CZ3-CB 4.45Å; W148-Q157 WeakPolarHBondContact CZ3-O 3.31Å; W149-Q157 CarbonylContact O-C 3.54Å; W149-Q157 WeakPolarHBondContact O-CA 3.31Å; R150-Q157 HydrophobicContact CB-CG 4.15Å; R150-Q157 HydrophobicContact CG-CG 4.45Å
158	Y	98.6	Very high	98.3	Very high	84 Å²	84	70 Å²	70	33%	0.329	36%	0.364	S	S	.	.	B	Isolated β-bridge	trans	-131.7	144.9	-175.4	-58.1	-85	0	0	0	111.1	W148 W149 P151 P156 Y160 P162	W148-Y158 CarbonylContact C-O 3.56Å; W148-Y158 VanDerWaalsContact CA-O 3.31Å; W148-Y158 WeakPolarHBondContact CA-O 3.28Å; W149-Y158 PolarHBondContact N-O 2.62Å; W149-Y158 PolarHBondContact O-N 3.27Å; P151-Y158 HydrophobicContact CG-CD2 4.06Å; P151-Y158 HydrophobicContact CG-CE2 3.78Å; P156-Y158 HydrophobicContact CB-CE2 3.99Å; Y158-Y160 WeakPolarHBondContact CB-O 3.37Å; Y158-Y160 PolarHBondContact O-N 2.85Å; Y158-P162 HydrophobicContact CD2-CG 3.69Å; Y158-P162 HydrophobicContact CE2-CG 4.26Å; Y158-P162 HydrophobicContact CG-CG 4.04Å
159	P	98.6	Very high	98.3	Very high	76 Å²	76	70.6 Å²	70.6	49%	0.494	37%	0.367	S	S	.	.	S	Bend	trans	-78.3	20.4	177.3	33.7	-35.3	0	0	0	113.2	N147 W148	N147-P159 WeakPolarHBondContact O-CA 3.34Å; W148-P159 HydrophobicContact CD2-CB 4.36Å; W148-P159 HydrophobicContact CZ2-CB 4.3Å
160	Y	98.7	Very high	98.3	Very high	132 Å²	132	68.9 Å²	68.9	52%	0.518	36%	0.361	S	S	.	.	S	Bend	trans	-154.8	163	176.4	56.7	-90.5	0	0	0	108.5	W149 Y158 P162	W149-Y160 VanDerWaalsContact CE3-C 3.42Å; Y158-Y160 WeakPolarHBondContact CB-O 3.37Å; Y158-Y160 PolarHBondContact O-N 2.85Å; Y160-P162 HydrophobicContact CE2-CB 4.34Å; Y160-P162 HydrophobicContact CE2-CG 4.37Å; Y160-P162 VanDerWaalsContact O-CD 3.32Å; Y160-P162 WeakPolarHBondContact O-CD 3.37Å
161	I	98.7	Very high	98.3	Very high	86 Å²	86	70.1 Å²	70.1	44%	0.441	37%	0.367	S	S	.	.	P	Polyproline II helix	trans	-79.2	117.1	170.5	-58.4	174.8	0	0	0	107.7	W149 I165	W149-I161 HydrophobicContact CD2-CG1 3.68Å; W149-I161 HydrophobicContact CE3-CG1 4.31Å; W149-I161 HydrophobicContact CG-CG1 3.77Å; W149-I161 HydrophobicContact CZ2-CD1 4.47Å; W149-I161 HydrophobicContact CZ2-CG1 4.24Å; I161-I165 HydrophobicContact CG2-CB 4.27Å; I161-I165 HydrophobicContact CG2-CG2 4.43Å; I161-I165 VanDerWaalsContact CG2-O 3.29Å; I161-I165 WeakPolarHBondContact CG2-O 3.14Å
162	P	98.5	Very high	98.3	Very high	23 Å²	23	70.5 Å²	70.5	15%	0.149	37%	0.368	C	S	.	.	P	Polyproline II helix	trans	-62.5	155.2	-178.3	-22.1	34	0	0	0	112.8	P151 Y158 Y160 H164 I165	P151-P162 HydrophobicContact CB-CG 4.34Å; P151-P162 HydrophobicContact CG-CG 4.37Å; Y158-P162 HydrophobicContact CD2-CG 3.69Å; Y158-P162 HydrophobicContact CE2-CG 4.26Å; Y158-P162 HydrophobicContact CG-CG 4.04Å; Y160-P162 HydrophobicContact CE2-CB 4.34Å; Y160-P162 HydrophobicContact CE2-CG 4.37Å; Y160-P162 VanDerWaalsContact O-CD 3.32Å; Y160-P162 WeakPolarHBondContact O-CD 3.37Å; P162-H164 PolarHBondContact O-N 3.41Å; P162-I165 HydrophobicContact CB-CG1 3.87Å; P162-I165 HydrophobicContact CG-CG1 4.33Å; P162-I165 WeakPolarHBondContact O-CB 3.39Å; P162-I165 PolarHBondContact O-N 2.75Å; P162-I165 VanDerWaalsContact O-N 3.14Å
163	A	98.3	Very high	98.3	Very high	79 Å²	79	69.3 Å²	69.3	65%	0.653	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.6	140.4	179.8	0	0	0	0	0	111.7	I165	A163-I165 PolarHBondContact O-N 2.69Å
164	H	98.1	Very high	98.4	Very high	190 Å²	190	67.7 Å²	67.7	88%	0.88	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.4	0.3	-178.6	-44.9	-70.9	0	0	0	116	P162 T166	P162-H164 PolarHBondContact O-N 3.41Å; H164-T166 PolarHBondContact O-N 2.8Å
165	I	98.6	Very high	98.4	Very high	49 Å²	49	63.3 Å²	63.3	25%	0.251	33%	0.332	S	S	.	.			trans	-83.4	102.1	173.4	-58.1	-61.6	0	0	0	109.5	P151 I161 P162 A163 P168	P151-I165 HydrophobicContact CB-CD1 3.91Å; P151-I165 HydrophobicContact CB-CG1 3.88Å; P151-I165 HydrophobicContact CB-CG2 4.05Å; I161-I165 HydrophobicContact CG2-CB 4.27Å; I161-I165 HydrophobicContact CG2-CG2 4.43Å; I161-I165 VanDerWaalsContact CG2-O 3.29Å; I161-I165 WeakPolarHBondContact CG2-O 3.14Å; P162-I165 HydrophobicContact CB-CG1 3.87Å; P162-I165 HydrophobicContact CG-CG1 4.33Å; P162-I165 WeakPolarHBondContact O-CB 3.39Å; P162-I165 PolarHBondContact O-N 2.75Å; P162-I165 VanDerWaalsContact O-N 3.14Å; A163-I165 PolarHBondContact O-N 2.69Å; I165-P168 HydrophobicContact CG2-CB 4.27Å
166	T	98	Very high	98.5	Very high	127 Å²	127	59.3 Å²	59.3	78%	0.779	31%	0.305	S	S	*	.	S	Bend	trans	-91.7	-19.1	176.6	56.8	0	0	0	0	113.4	H164	H164-T166 PolarHBondContact O-N 2.8Å
167	K	98.3	Very high	98.6	Very high	149 Å²	149	56.6 Å²	56.6	65%	0.648	29%	0.288	S	S	*	.	S	Bend	trans	-135.7	74.4	-175.5	-65.5	-174.4	-179.1	-177.7	0	111.6	F71 K169	F71-K167 HydrophobicContact CZ-CB 4.29Å; K167-K169 PolarHBondContact O-NZ 2.81Å
168	P	98.6	Very high	98.6	Very high	15 Å²	15	56.6 Å²	56.6	10%	0.097	29%	0.288	C	S	.	.			trans	-61.2	151	172.2	24.5	-30.2	0	0	0	111.1	F71 M76 W149 R150 I165	F71-P168 WeakPolarHBondContact CE2-O 3.31Å; M76-P168 WeakPolarHBondContact CG-O 3.16Å; M76-P168 HydrophobicContact SD-CB 4.29Å; M76-P168 HydrophobicContact SD-CG 3.68Å; W149-P168 HydrophobicContact CB-CB 4.5Å; R150-P168 CarbonylContact O-C 3.59Å; R150-P168 WeakPolarHBondContact O-CA 3.12Å; R150-P168 WeakPolarHBondContact O-CB 3.39Å; I165-P168 HydrophobicContact CG2-CB 4.27Å
169	K	98.8	Very high	98.5	Very high	31 Å²	31	53.3 Å²	53.3	14%	0.135	28%	0.276	C	S	.	.	S	Bend	trans	-87.1	-28.9	-175.6	-52	-50.4	177.5	-74.9	0	112.9	M67 F71 R77 R150 P151 F153 K167	M67-K169 HydrophobicContact SD-CB 4.21Å; F71-K169 HydrophobicContact CD1-CD 4.36Å; F71-K169 HydrophobicContact CD2-CD 3.9Å; F71-K169 HydrophobicContact CE1-CD 4.19Å; F71-K169 HydrophobicContact CE2-CD 3.73Å; F71-K169 HydrophobicContact CG-CD 4.21Å; F71-K169 HydrophobicContact CZ-CD 3.88Å; R77-K169 PolarHBondContact N-O 3.42Å; R150-K169 PolarHBondContact O-N 2.91Å; P151-K169 PolarHBondContact O-NZ 3.36Å; F153-K169 HydrophobicContact CD1-CB 4.16Å; F153-K169 HydrophobicContact CD1-CD 4.37Å; F153-K169 HydrophobicContact CD1-CG 3.97Å; F153-K169 HydrophobicContact CD2-CD 4.33Å; F153-K169 HydrophobicContact CD2-CG 4.32Å; F153-K169 HydrophobicContact CE1-CB 4.03Å; F153-K169 HydrophobicContact CE1-CD 3.79Å; F153-K169 HydrophobicContact CE1-CG 3.86Å; F153-K169 HydrophobicContact CE2-CD 3.78Å; F153-K169 HydrophobicContact CE2-CG 4.24Å; F153-K169 HydrophobicContact CG-CG 4.21Å; F153-K169 HydrophobicContact CZ-CD 3.49Å; F153-K169 VanDerWaalsContact CZ-CD 3.49Å; F153-K169 HydrophobicContact CZ-CG 4.02Å; K167-K169 PolarHBondContact O-NZ 2.81Å
170	E	98.8	Very high	98.5	Very high	6 Å²	6	53.7 Å²	53.7	3%	0.028	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	137	177.8	-172	-177.9	-175.4	0	0	109.6	R63 R77 T79 W149 R150	R63-E170 IonicContact NH2-OE2 2.78Å; R77-E170 HydrophobicContact CB-CB 4.34Å; R77-E170 HydrophobicContact CB-CG 4.21Å; R77-E170 HydrophobicContact CG-CG 4.27Å; R77-E170 CarbonylContact O-C 3.57Å; R77-E170 VanDerWaalsContact O-CA 3.31Å; R77-E170 WeakPolarHBondContact O-CA 3.1Å; T79-E170 PolarHBondContact OG1-OE1 2.94Å; W149-E170 WeakPolarHBondContact CA-O 3.34Å; R150-E170 HydrophobicContact CB-CB 3.74Å; R150-E170 IonicContact CZ-OE2 3.83Å; R150-E170 VanDerWaalsContact CZ-OE2 3.31Å; R150-E170 PolarHBondContact N-O 2.92Å; R150-E170 IonicContact NE-OE2 2.68Å; R150-E170 PolarHBondContact NE-OE2 3.4Å; R150-E170 IonicContact NH2-OE2 3.36Å; R150-E170 PolarHBondContact NH2-OE2 3.43Å; R150-E170 PolarHBondContact O-N 3.44Å
171	H	98.8	Very high	98.4	Very high	27 Å²	27	52.4 Å²	52.4	13%	0.125	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	120.7	164.7	174.6	-159.7	0	0	0	108.5	M76 R77 T79 N147 W149 K173	M76-H171 HydrophobicContact CE-CB 3.5Å; M76-H171 HydrophobicContact CG-CB 4.36Å; M76-H171 HydrophobicContact SD-CB 3.55Å; M76-H171 VanDerWaalsContact SD-CB 3.55Å; R77-H171 PolarHBondContact O-N 2.79Å; T79-H171 PolarHBondContact N-O 2.86Å; N147-H171 PolarHBondContact OD1-NE2 3.26Å; W149-H171 AromaticContact CD1-CD2 3.98Å; W149-H171 AromaticContact CE2-CD2 3.69Å; W149-H171 AromaticContact CE2-NE2 3.86Å; W149-H171 AromaticContact CZ2-NE2 3.77Å; W149-H171 AromaticContact NE1-CD2 3.43Å; W149-H171 PolarHBondContact NE1-CD2 2.88Å; W149-H171 AromaticContact NE1-CG 3.57Å; W149-H171 AromaticContact NE1-NE2 3.87Å; H171-K173 WeakPolarHBondContact CE1-CE 3.35Å
172	K	98.8	Very high	98.2	Very high	19 Å²	19	55.2 Å²	55.2	8%	0.083	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	127.2	178.6	177.9	-176.7	-73.3	-152.6	0	110	T79 E81 N147 W148 L174 I211	T79-K172 HydrophobicContact CG2-CG 4.28Å; T79-K172 CarbonylContact O-C 3.54Å; T79-K172 VanDerWaalsContact O-CA 3.28Å; T79-K172 WeakPolarHBondContact O-CA 3.2Å; E81-K172 VanDerWaalsContact CD-NZ 3.31Å; E81-K172 HydrophobicContact CG-CD 4.47Å; E81-K172 WeakPolarHBondContact OE1-CE 3.45Å; E81-K172 IonicContact OE1-NZ 2.77Å; E81-K172 PolarHBondContact OE1-NZ 2.92Å; E81-K172 WeakPolarHBondContact OE2-CD 3.42Å; E81-K172 IonicContact OE2-NZ 3.25Å; E81-K172 PolarHBondContact OE2-NZ 2.94Å; N147-K172 CarbonylContact C-O 3.52Å; N147-K172 WeakPolarHBondContact CA-O 3.29Å; W148-K172 HydrophobicContact CB-CB 4.3Å; W148-K172 PolarHBondContact N-O 3.44Å; W148-K172 PolarHBondContact O-N 2.8Å; K172-L174 HydrophobicContact CD-CD1 4.05Å; K172-L174 HydrophobicContact CG-CD1 3.97Å; K172-I211 HydrophobicContact CD-CD1 3.71Å
173	K	98.8	Very high	98.1	Very high	44 Å²	44	54.7 Å²	54.7	19%	0.191	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	138.2	173.4	-80.1	-175.7	175.5	176.3	0	111.1	T79 V80 E81 E117 N147 H171 F175	T79-K173 PolarHBondContact O-N 2.76Å; V80-K173 CarbonylContact C-O 3.58Å; V80-K173 WeakPolarHBondContact CA-O 3.41Å; V80-K173 HydrophobicContact CG1-CB 4.46Å; E81-K173 PolarHBondContact N-O 2.95Å; E117-K173 VanDerWaalsContact CD-CD 3.5Å; E117-K173 WeakPolarHBondContact OE1-CD 3.24Å; E117-K173 WeakPolarHBondContact OE1-CE 3.14Å; E117-K173 IonicContact OE1-NZ 3Å; E117-K173 PolarHBondContact OE1-NZ 3.47Å; E117-K173 WeakPolarHBondContact OE2-CD 3.35Å; E117-K173 WeakPolarHBondContact OE2-CE 3.46Å; E117-K173 IonicContact OE2-NZ 3.25Å; E117-K173 PolarHBondContact OE2-NZ 3.3Å; N147-K173 WeakPolarHBondContact OD1-CE 3.4Å; N147-K173 VanDerWaalsContact OD1-CG 3.27Å; N147-K173 WeakPolarHBondContact OD1-CG 3.5Å; H171-K173 WeakPolarHBondContact CE1-CE 3.35Å; K173-F175 HydrophobicContact CB-CD2 4.35Å; K173-F175 HydrophobicContact CB-CE2 3.6Å; K173-F175 HydrophobicContact CB-CZ 4.12Å; K173-F175 HydrophobicContact CD-CE2 4.34Å; K173-F175 HydrophobicContact CD-CZ 4.06Å
174	L	98.8	Very high	97.9	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	134.1	174.9	-85.7	75.9	0	0	0	109.5	E81 V83 L106 I145 G146 K172 I211 L215	E81-L174 HydrophobicContact CB-CG 4.28Å; E81-L174 WeakPolarHBondContact O-CA 3.13Å; V83-L174 HydrophobicContact CG2-CD2 4.3Å; L106-L174 HydrophobicContact CD1-CD2 3.85Å; L106-L174 HydrophobicContact CD1-CG 4.31Å; I145-L174 HydrophobicContact CD1-CB 4.06Å; I145-L174 HydrophobicContact CD1-CD2 4.41Å; I145-L174 HydrophobicContact CG1-CB 3.59Å; I145-L174 WeakPolarHBondContact CG1-O 3.3Å; I145-L174 PolarHBondContact N-O 2.95Å; G146-L174 PolarHBondContact O-N 3Å; K172-L174 HydrophobicContact CD-CD1 4.05Å; K172-L174 HydrophobicContact CG-CD1 3.97Å; L174-I211 HydrophobicContact CD1-CG2 4.02Å; L174-I211 HydrophobicContact CD2-CG2 3.7Å; L174-I211 HydrophobicContact CG-CG2 4.5Å; L174-L215 HydrophobicContact CD2-CD2 3.81Å
175	F	98.9	Very high	97.8	Very high	13 Å²	13	44.3 Å²	44.3	6%	0.057	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	143	177.3	-62.2	-93.3	0	0	0	110.9	V80 E81 G82 V83 E117 V118 L121 I141 D143 C144 K173	V80-F175 HydrophobicContact CB-CE2 4.33Å; V80-F175 HydrophobicContact CG1-CE2 3.97Å; E81-F175 PolarHBondContact O-N 2.95Å; G82-F175 CarbonylContact C-O 3.51Å; V83-F175 PolarHBondContact N-O 3.02Å; E117-F175 HydrophobicContact CB-CE2 4.42Å; E117-F175 HydrophobicContact CB-CZ 4.09Å; V118-F175 HydrophobicContact CG2-CE1 4.35Å; L121-F175 HydrophobicContact CD2-CB 3.73Å; L121-F175 HydrophobicContact CD2-CD2 3.71Å; L121-F175 HydrophobicContact CD2-CG 4Å; I141-F175 HydrophobicContact CG2-CB 3.58Å; I141-F175 HydrophobicContact CG2-CD1 4Å; I141-F175 HydrophobicContact CG2-CG 3.96Å; D143-F175 CarbonylContact O-C 3.53Å; D143-F175 VanDerWaalsContact O-CA 3.24Å; D143-F175 WeakPolarHBondContact O-CA 3.13Å; C144-F175 HydrophobicContact CB-CD1 4.16Å; C144-F175 HydrophobicContact CB-CE1 4.07Å; K173-F175 HydrophobicContact CB-CD2 4.35Å; K173-F175 HydrophobicContact CB-CE2 3.6Å; K173-F175 HydrophobicContact CB-CZ 4.12Å; K173-F175 HydrophobicContact CD-CE2 4.34Å; K173-F175 HydrophobicContact CD-CZ 4.06Å
176	L	98.8	Very high	97.6	Very high	1 Å²	1	42.5 Å²	42.5	1%	0.005	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	124.6	168.1	-176.4	154.6	0	0	0	108.5	I37 I85 D143 I145 Q178 L219 F222	I37-L176 HydrophobicContact CD1-CD2 3.96Å; I37-L176 HydrophobicContact CG1-CD1 4.35Å; I37-L176 HydrophobicContact CG1-CD2 4.37Å; I37-L176 HydrophobicContact CG2-CD2 4.15Å; I85-L176 HydrophobicContact CD1-CD1 3.81Å; I85-L176 HydrophobicContact CD1-CG 4.35Å; D143-L176 HydrophobicContact CB-CB 4.07Å; D143-L176 PolarHBondContact O-N 2.91Å; I145-L176 HydrophobicContact CG2-CB 3.79Å; L176-Q178 HydrophobicContact CD2-CG 3.66Å; L176-L219 HydrophobicContact CD1-CD2 4.02Å; L176-F222 HydrophobicContact CB-CZ 4.42Å; L176-F222 HydrophobicContact CD1-CD1 4.33Å; L176-F222 HydrophobicContact CD1-CD2 3.98Å; L176-F222 HydrophobicContact CD1-CE1 4Å; L176-F222 HydrophobicContact CD1-CE2 3.65Å; L176-F222 HydrophobicContact CD1-CG 4.31Å; L176-F222 HydrophobicContact CD1-CZ 3.63Å
177	V	98.6	Very high	97.6	Very high	2 Å²	2	36.9 Å²	36.9	1%	0.012	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	112	178.8	-176.2	0	0	0	0	108	V83 L84 L121 M125 W139 I141 L179	V83-V177 PolarHBondContact O-N 2.85Å; L84-V177 HydrophobicContact CD2-CG1 4.41Å; L84-V177 HydrophobicContact CG-CB 4.25Å; L121-V177 HydrophobicContact CD2-CG2 4.43Å; M125-V177 HydrophobicContact CE-CG1 4.25Å; M125-V177 HydrophobicContact CE-CG2 4.28Å; W139-V177 HydrophobicContact CE3-CG1 3.8Å; W139-V177 HydrophobicContact CZ3-CG1 4.49Å; I141-V177 HydrophobicContact CD1-CG2 4.24Å; I141-V177 HydrophobicContact CG1-CG1 4.24Å; I141-V177 HydrophobicContact CG1-CG2 4.13Å; V177-L179 PolarHBondContact O-N 3.49Å
178	Q	98.4	Very high	97.5	Very high	36 Å²	36	29.8 Å²	29.8	17%	0.168	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	123.7	179.5	-67.4	176.8	83.4	0	0	109.2	I37 V140 D142 L176	I37-Q178 HydrophobicContact CD1-CG 4Å; I37-Q178 HydrophobicContact CG2-CG 4.42Å; V140-Q178 HydrophobicContact CB-CB 4.09Å; V140-Q178 HydrophobicContact CG1-CB 4.16Å; V140-Q178 PolarHBondContact O-N 3.49Å; D142-Q178 PolarHBondContact OD2-NE2 3.31Å; L176-Q178 HydrophobicContact CD2-CG 3.66Å
179	L	97.7	Very high	97.3	Very high	15 Å²	15	34.6 Å²	34.6	8%	0.079	16%	0.162	C	C	.	.	P	Polyproline II helix	trans	-85.4	145.2	177.9	-71.2	179	0	0	0	111	Y40 Y45 L84 V86 L95 W139 V177 F185	Y40-L179 WeakPolarHBondContact CE2-O 3.44Å; Y45-L179 HydrophobicContact CD1-CD1 4.45Å; Y45-L179 HydrophobicContact CE1-CB 4.03Å; Y45-L179 HydrophobicContact CE1-CD1 3.81Å; Y45-L179 HydrophobicContact CE1-CG 4.38Å; Y45-L179 HydrophobicContact CE2-CD1 4.27Å; Y45-L179 VanDerWaalsContact OH-CB 3.29Å; Y45-L179 WeakPolarHBondContact OH-CB 3.49Å; L84-L179 HydrophobicContact CB-CD1 4.15Å; L84-L179 HydrophobicContact CB-CG 4.35Å; L84-L179 HydrophobicContact CD2-CD1 4.39Å; L84-L179 HydrophobicContact CD2-CD2 3.49Å; L84-L179 VanDerWaalsContact CD2-CD2 3.49Å; L84-L179 HydrophobicContact CD2-CG 4.15Å; V86-L179 HydrophobicContact CG1-CD1 3.8Å; L95-L179 HydrophobicContact CD1-CD1 4.32Å; W139-L179 HydrophobicContact CZ3-CD2 4.35Å; V177-L179 PolarHBondContact O-N 3.49Å; L179-F185 HydrophobicContact CD1-CZ 4.19Å; L179-F185 HydrophobicContact CD2-CE1 4.17Å; L179-F185 HydrophobicContact CD2-CZ 3.7Å
180	Q	96.9	Very high	97.1	Very high	84 Å²	84	35.7 Å²	35.7	39%	0.393	17%	0.17	S	C	.	.	P	Polyproline II helix	trans	-66.4	163.8	164.9	-58.7	-59.7	-31.5	0	0	110.2	Y45 K182	Y45-Q180 WeakPolarHBondContact CE1-O 3.44Å; Y45-Q180 PolarHBondContact OH-O 3.15Å; Q180-K182 PolarHBondContact O-N 2.98Å; Q180-K182 VanDerWaalsContact O-N 3.15Å
181	E	97	Very high	97	Very high	105 Å²	105	36.4 Å²	36.4	49%	0.491	17%	0.172	S	C	.	.	S	Bend	trans	-54.2	-36.7	-180	-175.3	-173.7	156.1	0	0	112.5	Y40 N44	Y40-E181 HydrophobicContact CD1-CB 3.99Å; Y40-E181 HydrophobicContact CD1-CG 3.65Å; Y40-E181 HydrophobicContact CE1-CB 3.73Å; Y40-E181 HydrophobicContact CE1-CG 3.68Å; Y40-E181 HydrophobicContact CE2-CB 4.38Å; Y40-E181 HydrophobicContact CG-CB 4.41Å; Y40-E181 HydrophobicContact CG-CG 4.35Å; N44-E181 WeakPolarHBondContact CB-O 3.4Å; N44-E181 PolarHBondContact ND2-O 2.91Å
182	K	95.9	Very high	96.8	Very high	144 Å²	144	41.5 Å²	41.5	63%	0.626	19%	0.194	S	C	*	.	S	Bend	trans	-136.7	140.9	176.6	-62.5	178.8	-176.1	175.1	0	109.5	N44 Q180	N44-K182 HydrophobicContact CB-CG 4.24Å; Q180-K182 PolarHBondContact O-N 2.98Å; Q180-K182 VanDerWaalsContact O-N 3.15Å
183	A	94.5	Very high	96.7	Very high	12 Å²	12	41.6 Å²	41.6	10%	0.099	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	156.1	171.8	0	0	0	0	0	111.1	Y45 T46 F185	Y45-A183 WeakPolarHBondContact CA-O 3.16Å; Y45-A183 HydrophobicContact CD1-CB 3.91Å; Y45-A183 HydrophobicContact CE1-CB 4.11Å; T46-A183 PolarHBondContact N-O 3.38Å; T46-A183 VanDerWaalsContact N-O 3.11Å; A183-F185 HydrophobicContact CB-CE1 4.37Å; A183-F185 HydrophobicContact CB-CZ 4.19Å
184	L	94.3	Very high	96.6	Very high	50 Å²	50	40.8 Å²	40.8	26%	0.262	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	120.5	170.2	175.7	71.8	0	0	0	107.9	T46 R131	T46-L184 HydrophobicContact CG2-CD1 3.53Å; R131-L184 HydrophobicContact CG-CB 4.36Å; R131-L184 HydrophobicContact CG-CD2 4.14Å; R131-L184 HydrophobicContact CG-CG 4.29Å; R131-L184 WeakPolarHBondContact CG-O 3.29Å
185	F	95.9	Very high	96.6	Very high	1 Å²	1	42.2 Å²	42.2	0%	0.004	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	134.3	173.2	-57.4	-64.5	0	0	0	110.1	Y45 T46 F47 G48 L84 L95 L129 W139 L179 A183 V187 L193	Y45-F185 AromaticContact CD1-CE2 3.72Å; Y45-F185 HydrophobicContact CD1-CE2 3.72Å; Y45-F185 HydrophobicContact CD1-CZ 4.09Å; Y45-F185 HydrophobicContact CG-CE2 4.02Å; T46-F185 PolarHBondContact O-N 3.44Å; F47-F185 HydrophobicContact CD1-CB 4.22Å; F47-F185 AromaticContact CD1-CD2 3.83Å; F47-F185 HydrophobicContact CD1-CD2 3.83Å; F47-F185 AromaticContact CE1-CD2 3.57Å; F47-F185 HydrophobicContact CE1-CD2 3.57Å; F47-F185 HydrophobicContact CE1-CE2 4.16Å; G48-F185 PolarHBondContact N-O 2.96Å; L84-F185 HydrophobicContact CD2-CE1 4.37Å; L84-F185 HydrophobicContact CD2-CZ 4.41Å; L95-F185 HydrophobicContact CD1-CE2 4.1Å; L95-F185 HydrophobicContact CD1-CZ 4.39Å; L129-F185 HydrophobicContact CB-CD1 4.07Å; L129-F185 HydrophobicContact CD1-CD1 4.33Å; W139-F185 HydrophobicContact CH2-CD1 4.15Å; W139-F185 AromaticContact CH2-CE1 3.81Å; W139-F185 HydrophobicContact CH2-CE1 3.81Å; W139-F185 HydrophobicContact CZ3-CE1 4.01Å; L179-F185 HydrophobicContact CD1-CZ 4.19Å; L179-F185 HydrophobicContact CD2-CE1 4.17Å; L179-F185 HydrophobicContact CD2-CZ 3.7Å; A183-F185 HydrophobicContact CB-CE1 4.37Å; A183-F185 HydrophobicContact CB-CZ 4.19Å; F185-V187 HydrophobicContact CB-CG2 4.43Å; F185-L193 HydrophobicContact CB-CD2 4.36Å; F185-L193 HydrophobicContact CD2-CD2 4.27Å; F185-L193 HydrophobicContact CG-CD2 4.41Å
186	A	96.1	Very high	96.6	Very high	11 Å²	11	41.7 Å²	41.7	9%	0.091	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	100.8	170.4	0	0	0	0	0	109.4	K50 L129 G130	K50-A186 HydrophobicContact CB-CB 4.3Å; K50-A186 HydrophobicContact CD-CB 3.98Å; K50-A186 VanDerWaalsContact CD-O 3.29Å; K50-A186 WeakPolarHBondContact CD-O 3.23Å; K50-A186 WeakPolarHBondContact CE-O 3.21Å; K50-A186 HydrophobicContact CG-CB 4.36Å; K50-A186 PolarHBondContact NZ-O 2.73Å; L129-A186 PolarHBondContact O-N 2.87Å; G130-A186 WeakPolarHBondContact O-CB 3.43Å
187	V	96.3	Very high	96.6	Very high	9 Å²	9	42.2 Å²	42.2	6%	0.055	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	131.7	-174	-173.1	0	0	0	0	109.7	G48 T49 K50 L129 F185 K189 L193	G48-V187 PolarHBondContact O-N 3.42Å; T49-V187 CarbonylContact C-O 3.59Å; T49-V187 VanDerWaalsContact CA-O 3.3Å; T49-V187 WeakPolarHBondContact CA-O 3.44Å; K50-V187 PolarHBondContact N-O 3.14Å; L129-V187 HydrophobicContact CD2-CG2 4.26Å; F185-V187 HydrophobicContact CB-CG2 4.43Å; V187-K189 PolarHBondContact O-N 2.78Å; V187-L193 HydrophobicContact CG1-CB 4.17Å; V187-L193 HydrophobicContact CG2-CB 3.79Å; V187-L193 HydrophobicContact CG2-CD2 3.9Å
188	P	96.4	Very high	96.6	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.5	134.7	175.7	-20.2	31.5	0	0	0	111	K50 E51 L53 I128 N190 Y191	K50-P188 HydrophobicContact CG-CG 4.48Å; E51-P188 WeakPolarHBondContact O-CB 3.43Å; L53-P188 HydrophobicContact CB-CB 3.76Å; L53-P188 HydrophobicContact CB-CG 3.71Å; L53-P188 HydrophobicContact CD2-CG 4.39Å; I128-P188 WeakPolarHBondContact O-CD 3.41Å; P188-N190 WeakPolarHBondContact CB-OD1 3.49Å; P188-N190 PolarHBondContact O-N 2.66Å; P188-Y191 HydrophobicContact CB-CD2 4.16Å; P188-Y191 HydrophobicContact CG-CD2 4.37Å; P188-Y191 PolarHBondContact O-N 2.86Å; P188-Y191 VanDerWaalsContact O-O 3.08Å
189	K	95.3	Very high	96.6	Very high	117 Å²	117	49 Å²	49	51%	0.509	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.2	-24.6	-173.4	-79.8	160.8	-175.5	169.6	0	115.6	K50 E51 P52 V187 Y191	K50-K189 WeakPolarHBondContact O-CG 3.26Å; K50-K189 PolarHBondContact O-N 3.08Å; E51-K189 IonicContact OE1-NZ 3.69Å; E51-K189 PolarHBondContact OE1-NZ 2.9Å; P52-K189 HydrophobicContact CG-CB 4.37Å; V187-K189 PolarHBondContact O-N 2.78Å; K189-Y191 VanDerWaalsContact C-N 3.31Å
190	N	94	Very high	96.6	Very high	53 Å²	53	52.3 Å²	52.3	28%	0.283	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83	-7.1	177.3	63	-47.6	0	0	0	113.6	P52 L53 L99 P188	P52-N190 VanDerWaalsContact CA-OD1 3.23Å; P52-N190 WeakPolarHBondContact CA-OD1 3.37Å; P52-N190 HydrophobicContact CB-CB 4.2Å; L53-N190 PolarHBondContact N-OD1 2.82Å; L53-N190 PolarHBondContact O-ND2 3.14Å; L99-N190 WeakPolarHBondContact CD1-O 3.46Å; P188-N190 WeakPolarHBondContact CB-OD1 3.49Å; P188-N190 PolarHBondContact O-N 2.66Å
191	Y	96.1	Very high	96.7	Very high	21 Å²	21	48.3 Å²	48.3	8%	0.082	23%	0.234	C	C	.	.			trans	-112.3	150.3	174.9	-76.3	-80.8	0	0	0	110.9	E55 L97 Q98 L99 P188 K189	E55-Y191 PolarHBondContact OE1-OH 3.26Å; L97-Y191 HydrophobicContact CB-CD1 3.8Å; L97-Y191 HydrophobicContact CB-CE1 4.2Å; L97-Y191 HydrophobicContact CD2-CG 4.48Å; Q98-Y191 WeakPolarHBondContact O-CA 3.36Å; L99-Y191 HydrophobicContact CB-CD1 4.1Å; L99-Y191 HydrophobicContact CB-CE1 3.79Å; L99-Y191 HydrophobicContact CD1-CD1 3.58Å; L99-Y191 HydrophobicContact CD1-CD2 4.17Å; L99-Y191 HydrophobicContact CD1-CE1 3.39Å; L99-Y191 HydrophobicContact CD1-CE2 4.01Å; L99-Y191 HydrophobicContact CD1-CG 3.98Å; L99-Y191 HydrophobicContact CD2-CE1 4.19Å; L99-Y191 HydrophobicContact CG-CD1 4.4Å; L99-Y191 HydrophobicContact CG-CE1 3.98Å; P188-Y191 HydrophobicContact CB-CD2 4.16Å; P188-Y191 HydrophobicContact CG-CD2 4.37Å; P188-Y191 PolarHBondContact O-N 2.86Å; P188-Y191 VanDerWaalsContact O-O 3.08Å; K189-Y191 VanDerWaalsContact C-N 3.31Å
192	K	95.7	Very high	96.8	Very high	134 Å²	134	49.8 Å²	49.8	58%	0.583	24%	0.236	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-112	128.4	165.3	-175.8	-177.3	178.4	-172.1	0	108.8	Q98 V194	Q98-K192 HydrophobicContact CB-CB 4.32Å; Q98-K192 PolarHBondContact N-O 3.49Å; Q98-K192 PolarHBondContact O-N 3.1Å; K192-V194 HydrophobicContact CD-CG1 3.94Å; K192-V194 HydrophobicContact CG-CG1 3.94Å
193	L	96.7	Very high	96.8	Very high	22 Å²	22	49.2 Å²	49.2	12%	0.115	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	120.7	171.6	-167.7	61.5	0	0	0	108.4	F47 L95 L96 L97 L129 F185 V187	F47-L193 HydrophobicContact CD1-CD2 3.64Å; F47-L193 HydrophobicContact CD1-CG 4.47Å; F47-L193 HydrophobicContact CE1-CD2 3.55Å; F47-L193 HydrophobicContact CE1-CG 4.28Å; L95-L193 HydrophobicContact CB-CD1 4.12Å; L96-L193 WeakPolarHBondContact O-CA 3.16Å; L97-L193 HydrophobicContact CD2-CD1 3.96Å; L97-L193 HydrophobicContact CG-CD1 4.45Å; L129-L193 HydrophobicContact CD2-CD2 4.15Å; F185-L193 HydrophobicContact CB-CD2 4.36Å; F185-L193 HydrophobicContact CD2-CD2 4.27Å; F185-L193 HydrophobicContact CG-CD2 4.41Å; V187-L193 HydrophobicContact CG1-CB 4.17Å; V187-L193 HydrophobicContact CG2-CB 3.79Å; V187-L193 HydrophobicContact CG2-CD2 3.9Å
194	V	97.4	Very high	97	Very high	27 Å²	27	51.3 Å²	51.3	16%	0.164	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	148	-179.4	-60	0	0	0	0	110	L95 L96 Q98 F104 K192	L95-V194 CarbonylContact C-O 3.57Å; L95-V194 WeakPolarHBondContact CA-O 3.38Å; L96-V194 HydrophobicContact CB-CG2 3.96Å; L96-V194 PolarHBondContact N-O 2.8Å; L96-V194 PolarHBondContact O-N 3.16Å; Q98-V194 HydrophobicContact CB-CG1 4.31Å; Q98-V194 HydrophobicContact CB-CG2 4.45Å; F104-V194 HydrophobicContact CD1-CG2 4.27Å; F104-V194 HydrophobicContact CE1-CG2 4.06Å; K192-V194 HydrophobicContact CD-CG1 3.94Å; K192-V194 HydrophobicContact CG-CG1 3.94Å
195	A	98.3	Very high	97.1	Very high	29 Å²	29	51 Å²	51	24%	0.24	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	107.8	172.9	0	0	0	0	0	108.1	L42 V86 H93 L95	L42-A195 HydrophobicContact CD1-CB 4.03Å; L42-A195 HydrophobicContact CD2-CB 4.02Å; V86-A195 HydrophobicContact CG2-CB 4.37Å; H93-A195 HydrophobicContact CB-CB 3.9Å; L95-A195 HydrophobicContact CD2-CB 3.87Å
196	A	98.4	Very high	97.1	Very high	3 Å²	3	57 Å²	57	3%	0.025	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	119.1	-177.7	0	0	0	0	0	110.4	H93 V94 L96 L201	H93-A196 CarbonylContact C-O 3.53Å; H93-A196 VanDerWaalsContact CA-O 3.28Å; H93-A196 WeakPolarHBondContact CA-O 3.2Å; V94-A196 PolarHBondContact N-O 3.26Å; V94-A196 PolarHBondContact O-N 3.28Å; L96-A196 HydrophobicContact CD1-CB 3.83Å; L96-A196 HydrophobicContact CG-CB 4.45Å; A196-L201 HydrophobicContact CB-CD1 4.44Å; A196-L201 HydrophobicContact CB-CD2 3.75Å; A196-L201 HydrophobicContact CB-CG 4.23Å
197	P	98.6	Very high	97.1	Very high	11 Å²	11	58 Å²	58	7%	0.071	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	148.8	177.6	24.9	-30.1	0	0	0	111.2	H93 F199 E200 L201	H93-P197 VanDerWaalsContact CD2-N 3.33Å; H93-P197 WeakPolarHBondContact NE2-CB 3.26Å; P197-F199 HydrophobicContact CB-CD1 3.75Å; P197-F199 HydrophobicContact CB-CE1 3.37Å; P197-F199 HydrophobicContact CB-CE2 4.36Å; P197-F199 HydrophobicContact CB-CG 4.39Å; P197-F199 HydrophobicContact CB-CZ 3.71Å; P197-F199 HydrophobicContact CG-CD1 4.24Å; P197-F199 HydrophobicContact CG-CD2 4.39Å; P197-F199 HydrophobicContact CG-CE1 3.64Å; P197-F199 HydrophobicContact CG-CE2 3.79Å; P197-F199 HydrophobicContact CG-CZ 3.37Å; P197-F199 PolarHBondContact O-N 3.3Å; P197-F199 VanDerWaalsContact O-N 3.1Å; P197-E200 WeakPolarHBondContact CD-OE2 3.46Å; P197-E200 HydrophobicContact CG-CB 3.99Å; P197-E200 WeakPolarHBondContact O-CB 3.49Å; P197-E200 PolarHBondContact O-N 2.97Å; P197-L201 PolarHBondContact O-N 3.18Å
198	L	98.7	Very high	97.2	Very high	33 Å²	33	58.6 Å²	58.6	17%	0.173	31%	0.306	C	S	.	.	H	α-helix	trans	-56.4	-33	-177	-64.2	-175.7	0	0	0	114.1	P92 V94 E200 L201 Y202 P216 L219	P92-L198 HydrophobicContact CB-CD1 3.86Å; P92-L198 HydrophobicContact CB-CG 4.06Å; P92-L198 HydrophobicContact CG-CD1 3.94Å; P92-L198 PolarHBondContact O-N 3.47Å; V94-L198 HydrophobicContact CG2-CD2 3.88Å; L198-E200 VanDerWaalsContact C-N 3.27Å; L198-E200 PolarHBondContact O-N 3.45Å; L198-L201 PolarHBondContact O-N 3.03Å; L198-Y202 WeakPolarHBondContact O-CB 3.41Å; L198-Y202 PolarHBondContact O-N 2.74Å; L198-P216 HydrophobicContact CB-CB 4.24Å; L198-P216 HydrophobicContact CB-CG 4.1Å; L198-P216 HydrophobicContact CD2-CG 4.23Å; L198-P216 VanDerWaalsContact O-CG 3.23Å; L198-P216 WeakPolarHBondContact O-CG 3.18Å; L198-L219 HydrophobicContact CD2-CD1 3.87Å
199	F	98.2	Very high	97.3	Very high	148 Å²	148	59.8 Å²	59.8	65%	0.649	32%	0.318	S	S	*	.	H	α-helix	trans	-69.5	-23.1	179.4	65.4	-105.2	0	0	0	113.3	L91 P197	L91-F199 HydrophobicContact CD1-CE1 4.39Å; P197-F199 HydrophobicContact CB-CD1 3.75Å; P197-F199 HydrophobicContact CB-CE1 3.37Å; P197-F199 HydrophobicContact CB-CE2 4.36Å; P197-F199 HydrophobicContact CB-CG 4.39Å; P197-F199 HydrophobicContact CB-CZ 3.71Å; P197-F199 HydrophobicContact CG-CD1 4.24Å; P197-F199 HydrophobicContact CG-CD2 4.39Å; P197-F199 HydrophobicContact CG-CE1 3.64Å; P197-F199 HydrophobicContact CG-CE2 3.79Å; P197-F199 HydrophobicContact CG-CZ 3.37Å; P197-F199 PolarHBondContact O-N 3.3Å; P197-F199 VanDerWaalsContact O-N 3.1Å
200	E	98.3	Very high	97.4	Very high	84 Å²	84	57.5 Å²	57.5	39%	0.393	32%	0.315	S	S	.	.	H	α-helix	trans	-78.8	-30.8	175.9	-172.2	-177.2	164	0	0	111.4	P197 L198 N204 Y208	P197-E200 WeakPolarHBondContact CD-OE2 3.46Å; P197-E200 HydrophobicContact CG-CB 3.99Å; P197-E200 WeakPolarHBondContact O-CB 3.49Å; P197-E200 PolarHBondContact O-N 2.97Å; L198-E200 VanDerWaalsContact C-N 3.27Å; L198-E200 PolarHBondContact O-N 3.45Å; E200-N204 WeakPolarHBondContact O-CB 3.44Å; E200-N204 PolarHBondContact O-ND2 3.43Å; E200-N204 VanDerWaalsContact O-ND2 3.09Å; E200-Y208 VanDerWaalsContact CD-OH 3.24Å; E200-Y208 HydrophobicContact CG-CE2 3.99Å; E200-Y208 PolarHBondContact OE1-OH 3.36Å
201	L	98.5	Very high	97.6	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-79.9	-38.4	178.5	-54.8	-174.2	0	0	0	112	V94 L96 A196 P197 L198 D203 N204 Y208 I212 S213 P216	V94-L201 HydrophobicContact CB-CD1 4.08Å; V94-L201 HydrophobicContact CG2-CD1 4.07Å; L96-L201 HydrophobicContact CD1-CD2 4.05Å; A196-L201 HydrophobicContact CB-CD1 4.44Å; A196-L201 HydrophobicContact CB-CD2 3.75Å; A196-L201 HydrophobicContact CB-CG 4.23Å; P197-L201 PolarHBondContact O-N 3.18Å; L198-L201 PolarHBondContact O-N 3.03Å; L201-D203 PolarHBondContact O-N 3.46Å; L201-N204 PolarHBondContact O-N 2.71Å; L201-N204 VanDerWaalsContact O-N 3.11Å; L201-Y208 HydrophobicContact CD2-CD1 3.62Å; L201-Y208 HydrophobicContact CD2-CD2 3.8Å; L201-Y208 HydrophobicContact CD2-CE1 3.61Å; L201-Y208 HydrophobicContact CD2-CE2 3.8Å; L201-Y208 HydrophobicContact CD2-CG 3.71Å; L201-I212 HydrophobicContact CD1-CG2 4.08Å; L201-I212 HydrophobicContact CD2-CG2 3.88Å; L201-I212 HydrophobicContact CG-CG2 4.48Å; L201-S213 WeakPolarHBondContact O-CA 3.36Å; L201-S213 WeakPolarHBondContact O-CB 3.43Å; L201-P216 HydrophobicContact CB-CG 4Å
202	Y	98.5	Very high	97.7	Very high	137 Å²	137	55 Å²	55	54%	0.537	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.2	125.2	-172.5	-179.7	-105.9	0	0	0	111.8	L198 N204 P216 Q217	L198-Y202 WeakPolarHBondContact O-CB 3.41Å; L198-Y202 PolarHBondContact O-N 2.74Å; Y202-N204 PolarHBondContact O-N 3.37Å; Y202-N204 VanDerWaalsContact O-N 3.09Å; Y202-P216 HydrophobicContact CD2-CB 4.09Å; Y202-Q217 HydrophobicContact CE2-CG 4.42Å
203	D	96.6	Very high	97.8	Very high	132 Å²	132	49 Å²	49	71%	0.706	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.3	21.9	178.8	-156.8	28	0	0	0	114.3	L201	L201-D203 PolarHBondContact O-N 3.46Å
204	N	97.9	Very high	97.9	Very high	55 Å²	55	49.1 Å²	49.1	29%	0.294	28%	0.28	S	S	.	.			trans	-110	50.6	-179.3	-168	3	0	0	0	112	E200 L201 Y202 P206 G207 Y208	E200-N204 WeakPolarHBondContact O-CB 3.44Å; E200-N204 PolarHBondContact O-ND2 3.43Å; E200-N204 VanDerWaalsContact O-ND2 3.09Å; L201-N204 PolarHBondContact O-N 2.71Å; L201-N204 VanDerWaalsContact O-N 3.11Å; Y202-N204 PolarHBondContact O-N 3.37Å; Y202-N204 VanDerWaalsContact O-N 3.09Å; N204-P206 VanDerWaalsContact C-N 3.3Å; N204-G207 PolarHBondContact O-N 2.99Å; N204-G207 PolarHBondContact OD1-N 3.39Å; N204-Y208 HydrophobicContact CB-CD2 4.16Å; N204-Y208 PolarHBondContact O-N 3.12Å
205	A	97.3	Very high	98	Very high	43 Å²	43	47.8 Å²	47.8	36%	0.355	27%	0.273	S	S	.	.	H	α-helix	trans	-58.5	-32.8	174.1	0	0	0	0	0	114.1	G207 G209 S213	A205-G207 VanDerWaalsContact C-N 3.32Å; A205-G207 PolarHBondContact O-N 3.26Å; A205-G209 WeakPolarHBondContact O-CA 3.47Å; A205-G209 PolarHBondContact O-N 3.34Å; A205-S213 WeakPolarHBondContact CA-OG 3.34Å
206	P	96.8	Very high	98	Very high	127 Å²	127	47.2 Å²	47.2	83%	0.825	27%	0.267	S	S	*	.	H	α-helix	trans	-61.1	-36.8	174.6	-26	36.5	0	0	0	113.8	N204	N204-P206 VanDerWaalsContact C-N 3.3Å
207	G	96.3	Very high	98	Very high	32 Å²	32	51.4 Å²	51.4	33%	0.33	29%	0.285	S	S	.	.	H	α-helix	trans	-86.6	-39.9	179.4	0	0	0	0	0	114.1	N204 A205	N204-G207 PolarHBondContact O-N 2.99Å; N204-G207 PolarHBondContact OD1-N 3.39Å; A205-G207 VanDerWaalsContact C-N 3.32Å; A205-G207 PolarHBondContact O-N 3.26Å
208	Y	97.8	Very high	98	Very high	22 Å²	22	53.1 Å²	53.1	9%	0.086	29%	0.294	C	S	.	.	H	α-helix	trans	-113.8	-4.3	-168.4	-72.2	-77.2	0	0	0	114.5	L96 F104 E200 L201 N204 I212	L96-Y208 HydrophobicContact CD1-CD1 3.91Å; L96-Y208 HydrophobicContact CD1-CE1 3.72Å; F104-Y208 HydrophobicContact CB-CD1 4.07Å; F104-Y208 HydrophobicContact CB-CE1 4.3Å; F104-Y208 AromaticContact CD1-CE1 3.99Å; F104-Y208 HydrophobicContact CD1-CE1 3.99Å; F104-Y208 AromaticContact CD2-CD1 3.81Å; F104-Y208 HydrophobicContact CD2-CD1 3.81Å; F104-Y208 AromaticContact CD2-CE1 3.64Å; F104-Y208 HydrophobicContact CD2-CE1 3.64Å; F104-Y208 HydrophobicContact CE1-CE1 4.19Å; F104-Y208 HydrophobicContact CE2-CD1 4.41Å; F104-Y208 AromaticContact CE2-CE1 3.86Å; F104-Y208 HydrophobicContact CE2-CE1 3.86Å; F104-Y208 AromaticContact CG-CD1 3.91Å; F104-Y208 HydrophobicContact CG-CD1 3.91Å; F104-Y208 AromaticContact CG-CE1 3.7Å; F104-Y208 HydrophobicContact CG-CE1 3.7Å; F104-Y208 HydrophobicContact CZ-CE1 4.13Å; E200-Y208 VanDerWaalsContact CD-OH 3.24Å; E200-Y208 HydrophobicContact CG-CE2 3.99Å; E200-Y208 PolarHBondContact OE1-OH 3.36Å; L201-Y208 HydrophobicContact CD2-CD1 3.62Å; L201-Y208 HydrophobicContact CD2-CD2 3.8Å; L201-Y208 HydrophobicContact CD2-CE1 3.61Å; L201-Y208 HydrophobicContact CD2-CE2 3.8Å; L201-Y208 HydrophobicContact CD2-CG 3.71Å; N204-Y208 HydrophobicContact CB-CD2 4.16Å; N204-Y208 PolarHBondContact O-N 3.12Å; Y208-I212 HydrophobicContact CD1-CG2 3.95Å; Y208-I212 HydrophobicContact CG-CG2 4.2Å; Y208-I212 WeakPolarHBondContact O-CB 3.46Å
209	G	97.3	Very high	98	Very high	25 Å²	25	51.6 Å²	51.6	26%	0.258	29%	0.286	S	S	.	.	H	α-helix	trans	73.4	168.1	-171.9	0	0	0	0	0	112.9	A205 I211 S213	A205-G209 WeakPolarHBondContact O-CA 3.47Å; A205-G209 PolarHBondContact O-N 3.34Å; G209-I211 VanDerWaalsContact C-N 3.29Å; G209-I211 PolarHBondContact O-N 3.36Å; G209-S213 VanDerWaalsContact O-CB 3.31Å; G209-S213 WeakPolarHBondContact O-CB 3.35Å; G209-S213 PolarHBondContact O-N 3.27Å; G209-S213 PolarHBondContact O-OG 2.81Å
210	P	97.5	Very high	98	Very high	69 Å²	69	49.2 Å²	49.2	45%	0.448	29%	0.288	S	S	.	.	H	α-helix	trans	-69.9	-23.2	-169	28.2	-36.6	0	0	0	114	W148 S214	W148-P210 HydrophobicContact CH2-CB 3.81Å; W148-P210 HydrophobicContact CH2-CG 4.43Å; W148-P210 WeakPolarHBondContact CH2-O 3.44Å; W148-P210 WeakPolarHBondContact CZ2-O 3.45Å; W148-P210 HydrophobicContact CZ3-CB 4.05Å; W148-P210 HydrophobicContact CZ3-CG 4.25Å; P210-S214 WeakPolarHBondContact O-CB 3.22Å; P210-S214 PolarHBondContact O-OG 3.09Å
211	I	98.3	Very high	98	Very high	12 Å²	12	51 Å²	51	6%	0.062	29%	0.291	C	S	.	.	H	α-helix	trans	-78.3	-59.8	-179.2	-59.2	173.8	0	0	0	110	W148 K172 L174 G209 S213 S214	W148-I211 HydrophobicContact CD2-CD1 4.22Å; W148-I211 HydrophobicContact CD2-CG1 3.63Å; W148-I211 HydrophobicContact CE3-CG1 3.9Å; W148-I211 HydrophobicContact CG-CD1 4.22Å; W148-I211 HydrophobicContact CG-CG1 4.05Å; W148-I211 HydrophobicContact CH2-CG1 4.25Å; W148-I211 HydrophobicContact CZ2-CB 4.41Å; W148-I211 HydrophobicContact CZ2-CG1 3.99Å; W148-I211 HydrophobicContact CZ3-CG1 4.2Å; K172-I211 HydrophobicContact CD-CD1 3.71Å; L174-I211 HydrophobicContact CD1-CG2 4.02Å; L174-I211 HydrophobicContact CD2-CG2 3.7Å; L174-I211 HydrophobicContact CG-CG2 4.5Å; G209-I211 VanDerWaalsContact C-N 3.29Å; G209-I211 PolarHBondContact O-N 3.36Å; I211-S213 VanDerWaalsContact C-N 3.32Å; I211-S213 PolarHBondContact O-N 2.95Å; I211-S214 PolarHBondContact O-N 3.07Å; I211-S214 VanDerWaalsContact O-N 3.11Å; I211-S214 PolarHBondContact O-OG 3Å
212	I	98.7	Very high	98	Very high	10 Å²	10	51.7 Å²	51.7	5%	0.051	29%	0.294	C	S	.	.	H	α-helix	trans	-63.9	-39.8	-175.1	-62.7	171.1	0	0	0	110.6	L96 F104 L106 L201 Y208 S214 L215	L96-I212 HydrophobicContact CD1-CG2 3.92Å; L96-I212 HydrophobicContact CD2-CD1 4.13Å; L96-I212 HydrophobicContact CD2-CG1 4.48Å; L96-I212 HydrophobicContact CD2-CG2 4.09Å; F104-I212 HydrophobicContact CB-CD1 4.22Å; L106-I212 HydrophobicContact CG-CG1 4.32Å; L201-I212 HydrophobicContact CD1-CG2 4.08Å; L201-I212 HydrophobicContact CD2-CG2 3.88Å; L201-I212 HydrophobicContact CG-CG2 4.48Å; Y208-I212 HydrophobicContact CD1-CG2 3.95Å; Y208-I212 HydrophobicContact CG-CG2 4.2Å; Y208-I212 WeakPolarHBondContact O-CB 3.46Å; I212-S214 PolarHBondContact O-N 3.2Å; I212-S214 VanDerWaalsContact O-N 3.16Å; I212-L215 HydrophobicContact CB-CD1 4.47Å; I212-L215 HydrophobicContact CG2-CD1 4.15Å; I212-L215 WeakPolarHBondContact O-CB 3.48Å; I212-L215 VanDerWaalsContact O-CG 3.3Å; I212-L215 WeakPolarHBondContact O-CG 3.19Å; I212-L215 PolarHBondContact O-N 3.38Å; I212-L215 VanDerWaalsContact O-N 3.09Å
213	S	98.6	Very high	98	Very high	9 Å²	9	48 Å²	48	6%	0.063	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-16.5	178.3	59.3	0	0	0	0	114.8	L201 A205 G209 I211	L201-S213 WeakPolarHBondContact O-CA 3.36Å; L201-S213 WeakPolarHBondContact O-CB 3.43Å; A205-S213 WeakPolarHBondContact CA-OG 3.34Å; G209-S213 VanDerWaalsContact O-CB 3.31Å; G209-S213 WeakPolarHBondContact O-CB 3.35Å; G209-S213 PolarHBondContact O-N 3.27Å; G209-S213 PolarHBondContact O-OG 2.81Å; I211-S213 VanDerWaalsContact C-N 3.32Å; I211-S213 PolarHBondContact O-N 2.95Å
214	S	98.6	Very high	98	Very high	23 Å²	23	43 Å²	43	16%	0.161	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.3	-6.2	176	74.2	0	0	0	0	114	P210 I211 I212 P216 Q217 L218	P210-S214 WeakPolarHBondContact O-CB 3.22Å; P210-S214 PolarHBondContact O-OG 3.09Å; I211-S214 PolarHBondContact O-N 3.07Å; I211-S214 VanDerWaalsContact O-N 3.11Å; I211-S214 PolarHBondContact O-OG 3Å; I212-S214 PolarHBondContact O-N 3.2Å; I212-S214 VanDerWaalsContact O-N 3.16Å; S214-P216 VanDerWaalsContact C-CD 3.41Å; S214-P216 VanDerWaalsContact C-N 3.34Å; S214-Q217 PolarHBondContact O-N 2.84Å; S214-Q217 VanDerWaalsContact O-N 3.14Å; S214-Q217 PolarHBondContact O-OE1 2.82Å; S214-Q217 VanDerWaalsContact O-OE1 3.11Å; S214-L218 PolarHBondContact O-N 2.8Å; S214-L218 VanDerWaalsContact O-N 3.16Å
215	L	98.8	Very high	98.1	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-56.8	-39	179.2	-67.6	177.6	0	0	0	113.4	V83 V94 L106 I145 L174 I212 Q217 L218 L219	V83-L215 HydrophobicContact CG2-CD1 4.34Å; V83-L215 HydrophobicContact CG2-CD2 3.85Å; V94-L215 HydrophobicContact CG1-CD1 3.97Å; V94-L215 HydrophobicContact CG2-CD1 4.27Å; L106-L215 HydrophobicContact CD1-CD1 4.49Å; L106-L215 HydrophobicContact CD2-CD1 4.29Å; I145-L215 HydrophobicContact CD1-CD2 4.17Å; L174-L215 HydrophobicContact CD2-CD2 3.81Å; I212-L215 HydrophobicContact CB-CD1 4.47Å; I212-L215 HydrophobicContact CG2-CD1 4.15Å; I212-L215 WeakPolarHBondContact O-CB 3.48Å; I212-L215 VanDerWaalsContact O-CG 3.3Å; I212-L215 WeakPolarHBondContact O-CG 3.19Å; I212-L215 PolarHBondContact O-N 3.38Å; I212-L215 VanDerWaalsContact O-N 3.09Å; L215-Q217 VanDerWaalsContact C-N 3.26Å; L215-Q217 PolarHBondContact O-N 3.03Å; L215-L218 HydrophobicContact CD2-CD1 4.33Å; L215-L218 PolarHBondContact O-N 3.23Å; L215-L218 VanDerWaalsContact O-N 3.12Å; L215-L219 HydrophobicContact CB-CD1 4.3Å; L215-L219 VanDerWaalsContact O-CB 3.29Å; L215-L219 WeakPolarHBondContact O-CB 3.29Å; L215-L219 WeakPolarHBondContact O-CG 3.43Å; L215-L219 PolarHBondContact O-N 3.46Å
216	P	98.8	Very high	98.1	Very high	17 Å²	17	44.4 Å²	44.4	11%	0.11	25%	0.252	C	S	.	.	H	α-helix	trans	-55.3	-40.5	176.1	-27.7	37.6	0	0	0	113.1	L198 L201 Y202 S214 S220	L198-P216 HydrophobicContact CB-CB 4.24Å; L198-P216 HydrophobicContact CB-CG 4.1Å; L198-P216 HydrophobicContact CD2-CG 4.23Å; L198-P216 VanDerWaalsContact O-CG 3.23Å; L198-P216 WeakPolarHBondContact O-CG 3.18Å; L201-P216 HydrophobicContact CB-CG 4Å; Y202-P216 HydrophobicContact CD2-CB 4.09Å; S214-P216 VanDerWaalsContact C-CD 3.41Å; S214-P216 VanDerWaalsContact C-N 3.34Å; P216-S220 PolarHBondContact O-N 2.75Å
217	Q	98.7	Very high	98.1	Very high	90 Å²	90	43.4 Å²	43.4	42%	0.421	24%	0.24	S	C	.	.	H	α-helix	trans	-67	-47.1	175.1	-65.1	88.4	-32.6	0	0	111.4	Y202 S214 L215 L219 S220	Y202-Q217 HydrophobicContact CE2-CG 4.42Å; S214-Q217 PolarHBondContact O-N 2.84Å; S214-Q217 VanDerWaalsContact O-N 3.14Å; S214-Q217 PolarHBondContact O-OE1 2.82Å; S214-Q217 VanDerWaalsContact O-OE1 3.11Å; L215-Q217 VanDerWaalsContact C-N 3.26Å; L215-Q217 PolarHBondContact O-N 3.03Å; Q217-L219 PolarHBondContact O-N 3.32Å; Q217-S220 WeakPolarHBondContact O-CB 3.45Å; Q217-S220 PolarHBondContact O-N 3.1Å; Q217-S220 PolarHBondContact O-OG 3.02Å
218	L	98.4	Very high	98.2	Very high	48 Å²	48	44 Å²	44	25%	0.251	24%	0.235	S	C	.	.	H	α-helix	trans	-64.4	-30.4	-178.9	-62.2	-178.9	0	0	0	112.8	S214 L215	S214-L218 PolarHBondContact O-N 2.8Å; S214-L218 VanDerWaalsContact O-N 3.16Å; L215-L218 HydrophobicContact CD2-CD1 4.33Å; L215-L218 PolarHBondContact O-N 3.23Å; L215-L218 VanDerWaalsContact O-N 3.12Å
219	L	98.6	Very high	98.2	Very high	1 Å²	1	45.2 Å²	45.2	1%	0.005	24%	0.243	C	C	.	.	H	α-helix	trans	-87.5	-14.1	-179.2	-65.1	175.8	0	0	0	113.4	V83 I85 V94 I145 L176 L198 L215 Q217 R221 F222 F224	V83-L219 HydrophobicContact CG1-CD1 4.36Å; V83-L219 HydrophobicContact CG1-CD2 4.46Å; I85-L219 HydrophobicContact CD1-CD1 3.77Å; I85-L219 HydrophobicContact CD1-CD2 3.58Å; I85-L219 HydrophobicContact CD1-CG 4.26Å; I85-L219 HydrophobicContact CG1-CD1 4.42Å; V94-L219 HydrophobicContact CG2-CD1 3.96Å; I145-L219 HydrophobicContact CD1-CD2 4.45Å; L176-L219 HydrophobicContact CD1-CD2 4.02Å; L198-L219 HydrophobicContact CD2-CD1 3.87Å; L215-L219 HydrophobicContact CB-CD1 4.3Å; L215-L219 VanDerWaalsContact O-CB 3.29Å; L215-L219 WeakPolarHBondContact O-CB 3.29Å; L215-L219 WeakPolarHBondContact O-CG 3.43Å; L215-L219 PolarHBondContact O-N 3.46Å; Q217-L219 PolarHBondContact O-N 3.32Å; L219-R221 PolarHBondContact O-N 3.38Å; L219-R221 VanDerWaalsContact O-N 3.1Å; L219-F222 HydrophobicContact CD2-CD2 4.09Å; L219-F222 HydrophobicContact CD2-CE2 3.99Å; L219-F222 WeakPolarHBondContact O-CD2 3.41Å; L219-F222 PolarHBondContact O-N 3.29Å; L219-F222 VanDerWaalsContact O-N 3.17Å; L219-F224 HydrophobicContact CB-CE2 4.42Å; L219-F224 HydrophobicContact CB-CZ 4.2Å
220	S	98.3	Very high	98.3	Very high	98 Å²	98	46.3 Å²	46.3	69%	0.685	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-21.7	-176.2	68.2	0	0	0	0	114.8	P216 Q217	P216-S220 PolarHBondContact O-N 2.75Å; Q217-S220 WeakPolarHBondContact O-CB 3.45Å; Q217-S220 PolarHBondContact O-N 3.1Å; Q217-S220 PolarHBondContact O-OG 3.02Å
221	R	97.7	Very high	98.3	Very high	122 Å²	122	44.9 Å²	44.9	46%	0.46	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.6	-14.2	-180	68.9	176.9	-179	85.7	-7.8	114.4	C144 L219	C144-R221 PolarHBondContact O-NH2 2.9Å; C144-R221 VanDerWaalsContact O-NH2 3.1Å; L219-R221 PolarHBondContact O-N 3.38Å; L219-R221 VanDerWaalsContact O-N 3.1Å
222	F	98.3	Very high	98.3	Very high	13 Å²	13	47 Å²	47	6%	0.057	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	140.3	-176.6	-66	-79.3	0	0	0	111.3	R35 I37 D143 I145 L176 L219 F224	R35-F222 HydrophobicContact CB-CD1 3.86Å; R35-F222 HydrophobicContact CB-CE1 4.16Å; R35-F222 HydrophobicContact CG-CD1 3.69Å; R35-F222 HydrophobicContact CG-CE1 3.68Å; I37-F222 HydrophobicContact CD1-CD1 4.22Å; I37-F222 HydrophobicContact CD1-CE1 4.35Å; I37-F222 HydrophobicContact CG1-CB 4.29Å; I37-F222 HydrophobicContact CG1-CD1 3.51Å; I37-F222 HydrophobicContact CG1-CE1 4.07Å; I37-F222 HydrophobicContact CG1-CG 4.12Å; D143-F222 HydrophobicContact CB-CE1 4.29Å; D143-F222 HydrophobicContact CB-CZ 4.23Å; I145-F222 HydrophobicContact CG2-CE2 3.78Å; I145-F222 HydrophobicContact CG2-CZ 3.68Å; L176-F222 HydrophobicContact CB-CZ 4.42Å; L176-F222 HydrophobicContact CD1-CD1 4.33Å; L176-F222 HydrophobicContact CD1-CD2 3.98Å; L176-F222 HydrophobicContact CD1-CE1 4Å; L176-F222 HydrophobicContact CD1-CE2 3.65Å; L176-F222 HydrophobicContact CD1-CG 4.31Å; L176-F222 HydrophobicContact CD1-CZ 3.63Å; L219-F222 HydrophobicContact CD2-CD2 4.09Å; L219-F222 HydrophobicContact CD2-CE2 3.99Å; L219-F222 WeakPolarHBondContact O-CD2 3.41Å; L219-F222 PolarHBondContact O-N 3.29Å; L219-F222 VanDerWaalsContact O-N 3.17Å; F222-F224 HydrophobicContact CB-CD1 4.28Å; F222-F224 HydrophobicContact CB-CE1 3.81Å; F222-F224 HydrophobicContact CB-CE2 4.31Å; F222-F224 HydrophobicContact CB-CZ 3.83Å; F222-F224 HydrophobicContact CD2-CZ 4.39Å; F222-F224 HydrophobicContact CG-CE1 4.44Å; F222-F224 HydrophobicContact CG-CZ 4.45Å; F222-F224 PolarHBondContact O-N 3.12Å
223	N	98.2	Very high	98.3	Very high	60 Å²	60	49.5 Å²	49.5	32%	0.321	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	95.1	169.8	-179.8	9.6	0	0	0	108.7	E34 R35 T36 I37	E34-N223 HydrophobicContact CG-CB 4.25Å; E34-N223 PolarHBondContact OE1-ND2 2.92Å; R35-N223 PolarHBondContact O-N 3.42Å; T36-N223 VanDerWaalsContact CA-O 3.3Å; T36-N223 WeakPolarHBondContact CA-O 3.39Å; I37-N223 PolarHBondContact N-O 3.07Å
224	F	98.5	Very high	98.3	Very high	26 Å²	26	52.4 Å²	52.4	11%	0.114	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	126.5	-179.4	-66.7	-54.3	0	0	0	112.4	I37 L39 I85 P92 L219 F222 Y226	I37-F224 HydrophobicContact CB-CD1 3.97Å; I37-F224 HydrophobicContact CB-CE1 4.11Å; I37-F224 HydrophobicContact CG2-CD1 4.21Å; I37-F224 HydrophobicContact CG2-CE1 4.17Å; I37-F224 WeakPolarHBondContact O-CA 3.33Å; L39-F224 HydrophobicContact CD1-CB 3.84Å; L39-F224 HydrophobicContact CD1-CD1 3.64Å; L39-F224 HydrophobicContact CD1-CD2 4.3Å; L39-F224 HydrophobicContact CD1-CE1 4.28Å; L39-F224 HydrophobicContact CD1-CG 3.67Å; L39-F224 HydrophobicContact CD2-CD1 3.82Å; L39-F224 HydrophobicContact CD2-CE1 4.08Å; L39-F224 HydrophobicContact CG-CB 4.18Å; L39-F224 HydrophobicContact CG-CD1 3.7Å; L39-F224 HydrophobicContact CG-CE1 4.42Å; L39-F224 HydrophobicContact CG-CG 4.13Å; I85-F224 HydrophobicContact CD1-CE1 3.83Å; I85-F224 HydrophobicContact CD1-CZ 3.74Å; P92-F224 HydrophobicContact CG-CD2 4.07Å; P92-F224 HydrophobicContact CG-CE2 4.31Å; L219-F224 HydrophobicContact CB-CE2 4.42Å; L219-F224 HydrophobicContact CB-CZ 4.2Å; F222-F224 HydrophobicContact CB-CD1 4.28Å; F222-F224 HydrophobicContact CB-CE1 3.81Å; F222-F224 HydrophobicContact CB-CE2 4.31Å; F222-F224 HydrophobicContact CB-CZ 3.83Å; F222-F224 HydrophobicContact CD2-CZ 4.39Å; F222-F224 HydrophobicContact CG-CE1 4.44Å; F222-F224 HydrophobicContact CG-CZ 4.45Å; F222-F224 PolarHBondContact O-N 3.12Å; F224-Y226 HydrophobicContact CB-CE2 4.14Å
225	I	98.5	Very high	98.3	Very high	64 Å²	64	54.6 Å²	54.6	33%	0.328	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	117.6	168.9	-50.7	-56.8	0	0	0	108.1	T36 I37 N38 L39 N227	T36-I225 HydrophobicContact CG2-CD1 3.86Å; T36-I225 HydrophobicContact CG2-CG1 3.4Å; T36-I225 VanDerWaalsContact CG2-CG1 3.4Å; I37-I225 PolarHBondContact O-N 3.12Å; N38-I225 WeakPolarHBondContact OD1-CB 3.45Å; L39-I225 PolarHBondContact N-O 3.49Å; I225-N227 PolarHBondContact O-N 3.3Å; I225-N227 PolarHBondContact O-ND2 2.73Å
226	Y	98.4	Very high	98.2	Very high	64 Å²	64	59.2 Å²	59.2	25%	0.251	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	94.1	177.3	-56.7	-86.6	0	0	0	108.7	L39 H87 R90 P92 F224	L39-Y226 HydrophobicContact CD1-CD1 4.33Å; L39-Y226 HydrophobicContact CD1-CE1 3.98Å; H87-Y226 HydrophobicContact CB-CD1 3.59Å; H87-Y226 HydrophobicContact CB-CE1 3.98Å; H87-Y226 AromaticContact CG-CD1 3.66Å; R90-Y226 VanDerWaalsContact C-CE1 3.5Å; R90-Y226 HydrophobicContact CB-CD1 4.05Å; R90-Y226 HydrophobicContact CB-CD2 4.45Å; R90-Y226 HydrophobicContact CB-CE1 4.45Å; R90-Y226 HydrophobicContact CB-CG 4.03Å; R90-Y226 HydrophobicContact CG-CG 4.22Å; R90-Y226 VanDerWaalsContact O-CE1 3.27Å; R90-Y226 WeakPolarHBondContact O-CE1 3.46Å; P92-Y226 WeakPolarHBondContact CD-OH 3.47Å; P92-Y226 HydrophobicContact CG-CE1 4.04Å; P92-Y226 VanDerWaalsContact CG-OH 3.26Å; P92-Y226 WeakPolarHBondContact CG-OH 3.46Å; F224-Y226 HydrophobicContact CB-CE2 4.14Å
227	N	96.6	Very high	98.2	Very high	107 Å²	107	63 Å²	63	57%	0.572	32%	0.315	S	S	*	.			trans	-78	0	179.3	-60.1	-84.7	0	0	0	112.2	N38 L39 Y40 P41 H87 I225	N38-N227 WeakPolarHBondContact CB-ND2 3.25Å; N38-N227 PolarHBondContact OD1-ND2 2.69Å; L39-N227 WeakPolarHBondContact O-CB 3.37Å; L39-N227 PolarHBondContact O-N 2.86Å; L39-N227 PolarHBondContact O-ND2 3.1Å; Y40-N227 HydrophobicContact CD1-CB 3.62Å; Y40-N227 HydrophobicContact CE1-CB 3.72Å; P41-N227 WeakPolarHBondContact CD-O 3.44Å; H87-N227 PolarHBondContact CE1-O 2.91Å; H87-N227 PolarHBondContact NE2-O 2.79Å; I225-N227 PolarHBondContact O-N 3.3Å; I225-N227 PolarHBondContact O-ND2 2.73Å

Retrieved 227 of 227 residues in 89.5 ms (Link to these results)

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