A0A096NMB9_PAPAN Loading...

Activating signal cointegrator 1

Transcription coactivator which associates with nuclear receptors, transcriptional coactivators including EP300, CREBBP and NCOA1, and basal transcription factors like TBP and TFIIA to facilitate nuclear receptors-mediated transcription. May thereby play an important role in establishing distinct coactivator complexes under different cellular conditions. Plays a role in thyroid hormone receptor and estrogen receptor transactivation. Also involved in androgen receptor transactivation. Plays a pivotal role in the transactivation of NF-kappa-B, SRF and AP1. Acts as a mediator of transrepression between nuclear receptor and either AP1 or NF-kappa-B. May play a role in the development of neuromuscular junction. May play a role in late myogenic differentiation. Also functions as part of the RQC trigger (RQT) complex that activates the ribosome quality control (RQC) pathway, a pathway that degrades nascent peptide chains during problematic translation.

AlphaFold DB , UniProt , Accession A0A096NMB9, Species PAPAN (Papio anubis, Olive baboon), Gene TRIP4, Length 581 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	32.5	Very low	42.2	Very low	240 Å²	240	106.3 Å²	106.3	100%	1.182	70%	0.698	S	S	*	*				0	134.5	0	-62.3	176.9	-175.5	0	0	107.3
2	A	27.5	Very low	45.2	Very low	104 Å²	104	98.7 Å²	98.7	86%	0.86	65%	0.647	S	S	*	*			trans	-98	122.5	175.6	0	0	0	0	0	109.8
3	V	31.5	Very low	48	Very low	140 Å²	140	92.4 Å²	92.4	85%	0.848	61%	0.605	S	S	*	*			trans	-97.9	86.7	177.1	-178	0	0	0	0	108.7	G5	V3-G5 PolarHBondContact O-N 3.31Å
4	A	30.5	Very low	50.2	Low	109 Å²	109	93.5 Å²	93.5	90%	0.901	60%	0.598	S	S	*	*			trans	-81	98.7	173.1	0	0	0	0	0	109.6
5	G	34.5	Very low	52.5	Low	69 Å²	69	90.5 Å²	90.5	71%	0.711	57%	0.57	S	S	*	*			trans	-179.8	44.8	-175.4	0	0	0	0	0	117.3	V3	V3-G5 PolarHBondContact O-N 3.31Å
6	A	34.6	Very low	54.4	Low	43 Å²	43	84.9 Å²	84.9	36%	0.355	54%	0.535	S	S	.	.			trans	-154.5	55.7	178.5	0	0	0	0	0	115.2	S8 G9	A6-S8 VanDerWaalsContact C-N 3.27Å; A6-S8 PolarHBondContact O-N 2.88Å; A6-G9 PolarHBondContact O-N 2.97Å
7	V	39	Very low	55.9	Low	134 Å²	134	81.2 Å²	81.2	81%	0.812	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.5	-10.4	-179.1	-171	0	0	0	0	113.3
8	S	50.2	Low	57.3	Low	84 Å²	84	80.8 Å²	80.8	59%	0.587	50%	0.502	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.4	-0.6	174.7	52.4	0	0	0	0	114.6	A6 N74	A6-S8 VanDerWaalsContact C-N 3.27Å; A6-S8 PolarHBondContact O-N 2.88Å; S8-N74 PolarHBondContact O-ND2 2.73Å
9	G	52.8	Low	58.5	Low	20 Å²	20	79.3 Å²	79.3	21%	0.206	49%	0.489	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.9	-33.5	-176.6	0	0	0	0	0	115	A6 L12 V13	A6-G9 PolarHBondContact O-N 2.97Å; G9-L12 PolarHBondContact O-N 2.95Å; G9-L12 VanDerWaalsContact O-N 3.1Å; G9-V13 PolarHBondContact O-N 3.41Å
10	E	59.3	Low	59.6	Low	136 Å²	136	75.7 Å²	75.7	64%	0.636	47%	0.466	S	S	*	.	H	α-helix	trans	-48.8	-48.5	-171.9	-61.3	-176.4	164	0	0	115.6	L12 V13 H14	E10-L12 VanDerWaalsContact C-N 3.28Å; E10-L12 PolarHBondContact O-N 3.06Å; E10-V13 PolarHBondContact O-N 2.89Å; E10-H14 WeakPolarHBondContact O-CB 3.16Å; E10-H14 PolarHBondContact O-N 3.5Å
11	P	72.1	Confident	60.7	Low	90 Å²	90	79.5 Å²	79.5	58%	0.584	47%	0.472	S	S	*	.	H	α-helix	trans	-67	-28.7	-177.2	26.3	-35.1	0	0	0	113.1	W15	P11-W15 WeakPolarHBondContact O-CB 3.38Å; P11-W15 PolarHBondContact O-N 3.46Å; P11-W15 VanDerWaalsContact O-N 3.16Å
12	L	78.5	Confident	62.8	Low	15 Å²	15	74.9 Å²	74.9	8%	0.079	45%	0.445	C	S	.	.	H	α-helix	trans	-81.4	-40.1	178.2	-171.6	56.5	0	0	0	111.3	G9 E10 W15 C16 L37 K70 W71 N74	G9-L12 PolarHBondContact O-N 2.95Å; G9-L12 VanDerWaalsContact O-N 3.1Å; E10-L12 VanDerWaalsContact C-N 3.28Å; E10-L12 PolarHBondContact O-N 3.06Å; L12-W15 HydrophobicContact CD1-CE3 4.08Å; L12-W15 PolarHBondContact O-N 2.98Å; L12-C16 WeakPolarHBondContact O-CB 3.47Å; L12-C16 PolarHBondContact O-N 3.33Å; L12-C16 PolarHBondContact O-SG 3.31Å; L12-C16 VanDerWaalsContact O-SG 3.39Å; L12-L37 HydrophobicContact CB-CD1 4.19Å; L12-L37 HydrophobicContact CD2-CD1 4.16Å; L12-L37 HydrophobicContact CD2-CD2 3.64Å; L12-L37 HydrophobicContact CG-CD1 3.93Å; L12-L37 HydrophobicContact CG-CD2 4Å; L12-K70 HydrophobicContact CD1-CB 3.8Å; L12-K70 HydrophobicContact CD1-CD 4.43Å; L12-W71 HydrophobicContact CD2-CB 4.43Å; L12-N74 HydrophobicContact CD2-CB 4.46Å
13	V	80.5	Confident	65.1	Low	17 Å²	17	73 Å²	73	10%	0.103	42%	0.423	C	S	.	.	H	α-helix	trans	-56.7	-51.6	171.8	174.8	0	0	0	0	110.5	G9 E10 W15 C16 T17 E30 I33 L37	G9-V13 PolarHBondContact O-N 3.41Å; E10-V13 PolarHBondContact O-N 2.89Å; V13-W15 VanDerWaalsContact C-N 3.34Å; V13-W15 PolarHBondContact O-N 3.21Å; V13-C16 PolarHBondContact O-N 2.84Å; V13-T17 PolarHBondContact O-N 2.81Å; V13-T17 PolarHBondContact O-OG1 2.97Å; V13-E30 HydrophobicContact CG1-CB 4.18Å; V13-E30 HydrophobicContact CG1-CG 4.14Å; V13-I33 HydrophobicContact CB-CG2 4.35Å; V13-I33 HydrophobicContact CG1-CG2 4.11Å; V13-I33 HydrophobicContact CG2-CG2 4.4Å; V13-L37 HydrophobicContact CG2-CD1 3.68Å
14	H	80	Confident	67.1	Low	108 Å²	108	68.9 Å²	68.9	50%	0.5	39%	0.394	S	S	.	.	H	α-helix	trans	-67.6	-29.9	-178.9	179.9	-91.4	0	0	0	113.1	E10 T17 Q18	E10-H14 WeakPolarHBondContact O-CB 3.16Å; E10-H14 PolarHBondContact O-N 3.5Å; H14-T17 WeakPolarHBondContact CA-OG1 3.42Å; H14-T17 PolarHBondContact O-OG1 3.45Å; H14-Q18 PolarHBondContact CE1-NE2 3.2Å; H14-Q18 WeakPolarHBondContact O-CB 3.35Å; H14-Q18 PolarHBondContact O-N 2.84Å
15	W	84.8	Confident	69	Low	48 Å²	48	66.7 Å²	66.7	18%	0.182	38%	0.382	C	S	.	.	H	α-helix	trans	-68.2	-44.5	170.2	177.5	81.5	0	0	0	111.5	P11 L12 V13 Q18 Q19 F63 E66 L67 K70	P11-W15 WeakPolarHBondContact O-CB 3.38Å; P11-W15 PolarHBondContact O-N 3.46Å; P11-W15 VanDerWaalsContact O-N 3.16Å; L12-W15 HydrophobicContact CD1-CE3 4.08Å; L12-W15 PolarHBondContact O-N 2.98Å; V13-W15 VanDerWaalsContact C-N 3.34Å; V13-W15 PolarHBondContact O-N 3.21Å; W15-Q18 PolarHBondContact O-N 3.25Å; W15-Q19 HydrophobicContact CD2-CG 4.09Å; W15-Q19 HydrophobicContact CG-CG 4.48Å; W15-Q19 HydrophobicContact CH2-CG 4.39Å; W15-Q19 HydrophobicContact CZ2-CG 3.69Å; W15-Q19 WeakPolarHBondContact O-CB 3.45Å; W15-Q19 WeakPolarHBondContact O-CG 3.39Å; W15-Q19 PolarHBondContact O-N 3.03Å; W15-F63 HydrophobicContact CH2-CD2 4.07Å; W15-F63 AromaticContact CH2-CE2 3.9Å; W15-F63 HydrophobicContact CH2-CE2 3.9Å; W15-F63 HydrophobicContact CZ3-CE2 4.03Å; W15-E66 HydrophobicContact CH2-CB 4.26Å; W15-E66 HydrophobicContact CH2-CG 3.94Å; W15-E66 HydrophobicContact CZ2-CG 4.09Å; W15-E66 WeakPolarHBondContact CZ2-OE1 3.47Å; W15-L67 HydrophobicContact CZ3-CB 4.23Å; W15-K70 HydrophobicContact CD2-CD 4.25Å; W15-K70 HydrophobicContact CE3-CD 4.1Å; W15-K70 HydrophobicContact CH2-CD 4.14Å; W15-K70 HydrophobicContact CZ2-CD 4.28Å; W15-K70 HydrophobicContact CZ3-CD 4.04Å
16	C	81.4	Confident	70.8	Confident	1 Å²	1	66.6 Å²	66.6	1%	0.007	37%	0.365	C	S	.	.	H	α-helix	trans	-62.9	-49.2	179.1	-76.5	0	0	0	0	112.6	L12 V13 Q18 Q19 L20 I33	L12-C16 WeakPolarHBondContact O-CB 3.47Å; L12-C16 PolarHBondContact O-N 3.33Å; L12-C16 PolarHBondContact O-SG 3.31Å; L12-C16 VanDerWaalsContact O-SG 3.39Å; V13-C16 PolarHBondContact O-N 2.84Å; C16-Q18 VanDerWaalsContact C-N 3.32Å; C16-Q18 PolarHBondContact O-N 3.06Å; C16-Q19 PolarHBondContact O-N 3.17Å; C16-L20 WeakPolarHBondContact O-CG 3.43Å; C16-L20 PolarHBondContact O-N 3.05Å; C16-I33 HydrophobicContact CB-CD1 4.44Å; C16-I33 HydrophobicContact CB-CG2 3.57Å
17	T	80.9	Confident	72.6	Confident	23 Å²	23	70.2 Å²	70.2	14%	0.141	38%	0.378	C	S	.	.	H	α-helix	trans	-56.9	-48.3	175.6	50.1	0	0	0	0	110.8	V13 H14 Q19 L20 R21 E30 I33	V13-T17 PolarHBondContact O-N 2.81Å; V13-T17 PolarHBondContact O-OG1 2.97Å; H14-T17 WeakPolarHBondContact CA-OG1 3.42Å; H14-T17 PolarHBondContact O-OG1 3.45Å; T17-Q19 VanDerWaalsContact C-N 3.33Å; T17-Q19 PolarHBondContact O-N 2.77Å; T17-L20 PolarHBondContact O-N 3.42Å; T17-R21 VanDerWaalsContact O-CB 3.31Å; T17-R21 WeakPolarHBondContact O-CB 3.26Å; T17-R21 PolarHBondContact O-N 2.61Å; T17-E30 HydrophobicContact CG2-CG 3.68Å; T17-I33 HydrophobicContact CG2-CD1 3.35Å
18	Q	81	Confident	74.3	Confident	73 Å²	73	65 Å²	65	34%	0.341	35%	0.346	S	S	.	.	H	α-helix	trans	-66	-34.1	-176.2	-164.7	-176.7	105.3	0	0	112.5	H14 W15 C16 K22	H14-Q18 PolarHBondContact CE1-NE2 3.2Å; H14-Q18 WeakPolarHBondContact O-CB 3.35Å; H14-Q18 PolarHBondContact O-N 2.84Å; W15-Q18 PolarHBondContact O-N 3.25Å; C16-Q18 VanDerWaalsContact C-N 3.32Å; C16-Q18 PolarHBondContact O-N 3.06Å; Q18-K22 HydrophobicContact CG-CD 3.94Å; Q18-K22 HydrophobicContact CG-CG 4.42Å; Q18-K22 VanDerWaalsContact O-CB 3.23Å; Q18-K22 WeakPolarHBondContact O-CB 3.36Å; Q18-K22 VanDerWaalsContact O-CG 3.23Å; Q18-K22 WeakPolarHBondContact O-CG 3.41Å; Q18-K22 PolarHBondContact O-N 2.98Å
19	Q	80.4	Confident	75.6	Confident	53 Å²	53	63.5 Å²	63.5	25%	0.248	34%	0.336	C	S	.	.	H	α-helix	trans	-73.2	-43.7	174.9	-74.4	-60.3	-23.8	0	0	113	W15 C16 T17 R21 K22 T23 F63	W15-Q19 HydrophobicContact CD2-CG 4.09Å; W15-Q19 HydrophobicContact CG-CG 4.48Å; W15-Q19 HydrophobicContact CH2-CG 4.39Å; W15-Q19 HydrophobicContact CZ2-CG 3.69Å; W15-Q19 WeakPolarHBondContact O-CB 3.45Å; W15-Q19 WeakPolarHBondContact O-CG 3.39Å; W15-Q19 PolarHBondContact O-N 3.03Å; C16-Q19 PolarHBondContact O-N 3.17Å; T17-Q19 VanDerWaalsContact C-N 3.33Å; T17-Q19 PolarHBondContact O-N 2.77Å; Q19-R21 VanDerWaalsContact C-N 3.28Å; Q19-R21 PolarHBondContact O-N 2.75Å; Q19-K22 PolarHBondContact O-N 2.76Å; Q19-T23 WeakPolarHBondContact O-CB 3.3Å; Q19-T23 PolarHBondContact O-N 2.72Å; Q19-T23 PolarHBondContact O-OG1 2.83Å; Q19-T23 PolarHBondContact OE1-OG1 3.44Å; Q19-T23 VanDerWaalsContact OE1-OG1 3.12Å; Q19-F63 HydrophobicContact CB-CD2 4.12Å; Q19-F63 HydrophobicContact CB-CE2 3.63Å; Q19-F63 HydrophobicContact CG-CE2 4.38Å
20	L	80.6	Confident	76.7	Confident	6 Å²	6	68.3 Å²	68.3	3%	0.031	35%	0.353	C	S	.	.	I	π-helix	trans	-58.8	-43.9	176.2	-70.3	167.9	0	0	0	110.9	C16 T17 F24 G25 L26 V28 I33 L53 F63	C16-L20 WeakPolarHBondContact O-CG 3.43Å; C16-L20 PolarHBondContact O-N 3.05Å; T17-L20 PolarHBondContact O-N 3.42Å; L20-F24 HydrophobicContact CD2-CD2 4.18Å; L20-F24 CarbonylContact O-C 3.59Å; L20-F24 PolarHBondContact O-N 3.31Å; L20-F24 VanDerWaalsContact O-N 3.11Å; L20-G25 PolarHBondContact O-N 3.47Å; L20-G25 VanDerWaalsContact O-N 3.09Å; L20-L26 CarbonylContact C-O 3.56Å; L20-L26 PolarHBondContact O-N 3.32Å; L20-V28 HydrophobicContact CD1-CB 4.29Å; L20-V28 HydrophobicContact CD1-CG2 4.19Å; L20-I33 HydrophobicContact CD1-CD1 3.84Å; L20-I33 HydrophobicContact CD1-CG1 4.2Å; L20-L53 HydrophobicContact CD2-CD2 3.69Å; L20-F63 HydrophobicContact CD2-CE1 3.74Å; L20-F63 HydrophobicContact CD2-CZ 3.88Å; L20-F63 HydrophobicContact CG-CE1 4.32Å; L20-F63 HydrophobicContact CG-CZ 3.95Å
21	R	81.1	Confident	77.4	Confident	156 Å²	156	69.1 Å²	69.1	59%	0.589	36%	0.357	S	S	*	.	I	π-helix	trans	-67.1	-44.8	177.4	-159.3	179.6	-155.5	-165.9	8	113.4	T17 Q19 G25 L26 D27	T17-R21 VanDerWaalsContact O-CB 3.31Å; T17-R21 WeakPolarHBondContact O-CB 3.26Å; T17-R21 PolarHBondContact O-N 2.61Å; Q19-R21 VanDerWaalsContact C-N 3.28Å; Q19-R21 PolarHBondContact O-N 2.75Å; R21-G25 WeakPolarHBondContact O-CA 3.34Å; R21-G25 PolarHBondContact O-N 3.24Å; R21-L26 PolarHBondContact N-O 2.92Å; R21-D27 VanDerWaalsContact CD-OD1 3.28Å; R21-D27 WeakPolarHBondContact CD-OD1 3.29Å; R21-D27 IonicContact CZ-OD1 3.11Å; R21-D27 IonicContact CZ-OD2 3.27Å; R21-D27 IonicContact NE-OD1 3.72Å; R21-D27 PolarHBondContact NE-OD1 3.31Å; R21-D27 IonicContact NE-OD2 3.24Å; R21-D27 PolarHBondContact NE-OD2 3.19Å; R21-D27 IonicContact NH2-OD1 3.07Å; R21-D27 PolarHBondContact NH2-OD1 3.22Å; R21-D27 IonicContact NH2-OD2 2.65Å; R21-D27 PolarHBondContact NH2-OD2 3.13Å
22	K	78.3	Confident	77.7	Confident	144 Å²	144	67.6 Å²	67.6	63%	0.626	34%	0.343	S	S	*	.	I	π-helix	trans	-76.4	-37.5	-178.4	-75.9	177.8	177.5	175.9	0	114.2	Q18 Q19	Q18-K22 HydrophobicContact CG-CD 3.94Å; Q18-K22 HydrophobicContact CG-CG 4.42Å; Q18-K22 VanDerWaalsContact O-CB 3.23Å; Q18-K22 WeakPolarHBondContact O-CB 3.36Å; Q18-K22 VanDerWaalsContact O-CG 3.23Å; Q18-K22 WeakPolarHBondContact O-CG 3.41Å; Q18-K22 PolarHBondContact O-N 2.98Å; Q19-K22 PolarHBondContact O-N 2.76Å
23	T	74.8	Confident	77.8	Confident	65 Å²	65	67.2 Å²	67.2	40%	0.399	34%	0.341	S	S	.	.	I	π-helix	trans	-101.3	-27.2	-166.4	-57.7	0	0	0	0	112.6	Q19	Q19-T23 WeakPolarHBondContact O-CB 3.3Å; Q19-T23 PolarHBondContact O-N 2.72Å; Q19-T23 PolarHBondContact O-OG1 2.83Å; Q19-T23 PolarHBondContact OE1-OG1 3.44Å; Q19-T23 VanDerWaalsContact OE1-OG1 3.12Å
24	F	74.8	Confident	77.8	Confident	53 Å²	53	71.6 Å²	71.6	23%	0.232	36%	0.36	C	S	.	.	I	π-helix	trans	-124.1	-8.6	-179	-54.3	-68	0	0	0	114.2	L20 L26 L53 K59 K60 F63	L20-F24 HydrophobicContact CD2-CD2 4.18Å; L20-F24 CarbonylContact O-C 3.59Å; L20-F24 PolarHBondContact O-N 3.31Å; L20-F24 VanDerWaalsContact O-N 3.11Å; F24-L26 VanDerWaalsContact C-N 3.25Å; F24-L26 HydrophobicContact CB-CD1 4.24Å; F24-L26 HydrophobicContact CB-CG 4.28Å; F24-L26 PolarHBondContact O-N 3.28Å; F24-L53 HydrophobicContact CD2-CD2 3.96Å; F24-L53 HydrophobicContact CE2-CD2 4.36Å; F24-L53 HydrophobicContact CG-CD2 4.17Å; F24-K59 HydrophobicContact CE1-CB 4.24Å; F24-K59 HydrophobicContact CZ-CB 4.43Å; F24-K60 HydrophobicContact CD1-CG 4.22Å; F24-K60 HydrophobicContact CE1-CB 4.46Å; F24-K60 HydrophobicContact CE1-CG 3.59Å; F24-K60 HydrophobicContact CZ-CG 4.1Å; F24-F63 HydrophobicContact CE2-CB 4.03Å; F24-F63 HydrophobicContact CE2-CD1 4.18Å; F24-F63 AromaticContact CE2-CG 3.99Å; F24-F63 HydrophobicContact CE2-CG 3.99Å; F24-F63 HydrophobicContact CZ-CB 4.14Å
25	G	69.4	Low	77.9	Confident	63 Å²	63	72.5 Å²	72.5	65%	0.649	36%	0.36	S	S	*	.			trans	72.4	15.8	179.1	0	0	0	0	0	114.3	L20 R21	L20-G25 PolarHBondContact O-N 3.47Å; L20-G25 VanDerWaalsContact O-N 3.09Å; R21-G25 WeakPolarHBondContact O-CA 3.34Å; R21-G25 PolarHBondContact O-N 3.24Å
26	L	73.1	Confident	77.7	Confident	67 Å²	67	70.5 Å²	70.5	35%	0.351	35%	0.353	S	S	.	.			trans	-93.9	115.9	-179.5	-63.1	172.4	0	0	0	109.6	L20 R21 F24 V28 L53	L20-L26 CarbonylContact C-O 3.56Å; L20-L26 PolarHBondContact O-N 3.32Å; R21-L26 PolarHBondContact N-O 2.92Å; F24-L26 VanDerWaalsContact C-N 3.25Å; F24-L26 HydrophobicContact CB-CD1 4.24Å; F24-L26 HydrophobicContact CB-CG 4.28Å; F24-L26 PolarHBondContact O-N 3.28Å; L26-V28 HydrophobicContact CB-CG2 4.01Å; L26-V28 PolarHBondContact O-N 3.35Å; L26-L53 HydrophobicContact CD1-CD2 3.94Å
27	D	71.9	Confident	77.6	Confident	119 Å²	119	71.9 Å²	71.9	64%	0.636	36%	0.361	S	S	*	.			trans	-84.5	92.8	169.8	-118.3	-8.4	0	0	0	108.5	R21	R21-D27 VanDerWaalsContact CD-OD1 3.28Å; R21-D27 WeakPolarHBondContact CD-OD1 3.29Å; R21-D27 IonicContact CZ-OD1 3.11Å; R21-D27 IonicContact CZ-OD2 3.27Å; R21-D27 IonicContact NE-OD1 3.72Å; R21-D27 PolarHBondContact NE-OD1 3.31Å; R21-D27 IonicContact NE-OD2 3.24Å; R21-D27 PolarHBondContact NE-OD2 3.19Å; R21-D27 IonicContact NH2-OD1 3.07Å; R21-D27 PolarHBondContact NH2-OD1 3.22Å; R21-D27 IonicContact NH2-OD2 2.65Å; R21-D27 PolarHBondContact NH2-OD2 3.13Å
28	V	74.5	Confident	77.6	Confident	24 Å²	24	74.6 Å²	74.6	15%	0.145	38%	0.381	C	S	.	.			trans	-99.6	133.3	-179.7	-179.3	0	0	0	0	108.8	L20 L26 I32 I33	L20-V28 HydrophobicContact CD1-CB 4.29Å; L20-V28 HydrophobicContact CD1-CG2 4.19Å; L26-V28 HydrophobicContact CB-CG2 4.01Å; L26-V28 PolarHBondContact O-N 3.35Å; V28-I32 HydrophobicContact CG1-CB 3.85Å; V28-I32 HydrophobicContact CG1-CD1 4.13Å; V28-I32 HydrophobicContact CG1-CG2 3.84Å; V28-I33 HydrophobicContact CB-CD1 4.24Å; V28-I33 HydrophobicContact CG1-CD1 4.05Å; V28-I33 HydrophobicContact CG1-CG1 4.14Å
29	S	77	Confident	77.6	Confident	53 Å²	53	72 Å²	72	37%	0.371	37%	0.369	S	S	.	.			trans	-65.9	147	179.2	59.5	0	0	0	0	112.1	E31 I32	S29-E31 PolarHBondContact O-N 3.22Å; S29-I32 PolarHBondContact O-N 3.32Å; S29-I32 VanDerWaalsContact O-N 3.1Å; S29-I32 WeakPolarHBondContact OG-CD1 3.48Å; S29-I32 WeakPolarHBondContact OG-CG1 3.11Å
30	E	75.3	Confident	77.4	Confident	120 Å²	120	78.6 Å²	78.6	56%	0.561	40%	0.399	S	S	*	.	H	α-helix	trans	-58	-33.5	179.6	-74	171.5	175.8	0	0	111.9	V13 T17 I32 I33 Q34	V13-E30 HydrophobicContact CG1-CB 4.18Å; V13-E30 HydrophobicContact CG1-CG 4.14Å; T17-E30 HydrophobicContact CG2-CG 3.68Å; E30-I32 PolarHBondContact O-N 3.16Å; E30-I33 PolarHBondContact O-N 3.39Å; E30-Q34 WeakPolarHBondContact O-CB 3.37Å; E30-Q34 PolarHBondContact O-N 3.02Å
31	E	75.6	Confident	77.7	Confident	153 Å²	153	79.8 Å²	79.8	72%	0.715	41%	0.408	S	S	*	.	H	α-helix	trans	-56.4	-42.6	174.8	-58.7	176.9	155.9	0	0	113.3	S29 I33 Q34 Y35	S29-E31 PolarHBondContact O-N 3.22Å; E31-I33 VanDerWaalsContact C-N 3.34Å; E31-Q34 PolarHBondContact O-N 2.79Å; E31-Y35 WeakPolarHBondContact O-CB 3.47Å; E31-Y35 PolarHBondContact O-N 2.94Å
32	I	78.8	Confident	77.8	Confident	59 Å²	59	73.5 Å²	73.5	30%	0.303	39%	0.39	S	S	.	.	H	α-helix	trans	-68.3	-37.7	179.8	-66.7	168.2	0	0	0	110.2	V28 S29 E30 Y35 V36 Y48 L52	V28-I32 HydrophobicContact CG1-CB 3.85Å; V28-I32 HydrophobicContact CG1-CD1 4.13Å; V28-I32 HydrophobicContact CG1-CG2 3.84Å; S29-I32 PolarHBondContact O-N 3.32Å; S29-I32 VanDerWaalsContact O-N 3.1Å; S29-I32 WeakPolarHBondContact OG-CD1 3.48Å; S29-I32 WeakPolarHBondContact OG-CG1 3.11Å; E30-I32 PolarHBondContact O-N 3.16Å; I32-Y35 WeakPolarHBondContact O-CB 3.46Å; I32-Y35 PolarHBondContact O-N 2.79Å; I32-V36 WeakPolarHBondContact O-CG2 3.38Å; I32-V36 PolarHBondContact O-N 3.36Å; I32-Y48 HydrophobicContact CG2-CE1 4.33Å; I32-L52 HydrophobicContact CG2-CD2 4.4Å
33	I	80.1	Confident	77.9	Confident	7 Å²	7	73.9 Å²	73.9	4%	0.036	39%	0.394	C	S	.	.	H	α-helix	trans	-74.9	-36	179.1	-70	155.9	0	0	0	110.7	V13 C16 T17 L20 V28 E30 E31 Y35 V36 L37	V13-I33 HydrophobicContact CB-CG2 4.35Å; V13-I33 HydrophobicContact CG1-CG2 4.11Å; V13-I33 HydrophobicContact CG2-CG2 4.4Å; C16-I33 HydrophobicContact CB-CD1 4.44Å; C16-I33 HydrophobicContact CB-CG2 3.57Å; T17-I33 HydrophobicContact CG2-CD1 3.35Å; L20-I33 HydrophobicContact CD1-CD1 3.84Å; L20-I33 HydrophobicContact CD1-CG1 4.2Å; V28-I33 HydrophobicContact CB-CD1 4.24Å; V28-I33 HydrophobicContact CG1-CD1 4.05Å; V28-I33 HydrophobicContact CG1-CG1 4.14Å; E30-I33 PolarHBondContact O-N 3.39Å; E31-I33 VanDerWaalsContact C-N 3.34Å; I33-Y35 VanDerWaalsContact C-N 3.32Å; I33-V36 PolarHBondContact O-N 3.49Å; I33-L37 HydrophobicContact CG2-CD1 4.26Å; I33-L37 WeakPolarHBondContact O-CG 3.48Å; I33-L37 PolarHBondContact O-N 3.06Å
34	Q	80.1	Confident	78.3	Confident	108 Å²	108	76.1 Å²	76.1	51%	0.505	40%	0.4	S	S	.	.	H	α-helix	trans	-65.5	-35.8	172.4	-165.7	168.3	21.8	0	0	111.5	E30 E31 S38	E30-Q34 WeakPolarHBondContact O-CB 3.37Å; E30-Q34 PolarHBondContact O-N 3.02Å; E31-Q34 PolarHBondContact O-N 2.79Å; Q34-S38 PolarHBondContact O-N 3.37Å
35	Y	81.3	Confident	78.7	Confident	127 Å²	127	73.7 Å²	73.7	50%	0.498	39%	0.389	S	S	.	.	H	α-helix	trans	-62.3	-50.4	168.2	175.6	-100	0	0	0	111.8	E31 I32 I33 L37 S38 I39 Y48	E31-Y35 WeakPolarHBondContact O-CB 3.47Å; E31-Y35 PolarHBondContact O-N 2.94Å; I32-Y35 WeakPolarHBondContact O-CB 3.46Å; I32-Y35 PolarHBondContact O-N 2.79Å; I33-Y35 VanDerWaalsContact C-N 3.32Å; Y35-L37 VanDerWaalsContact C-N 3.28Å; Y35-L37 PolarHBondContact O-N 3.12Å; Y35-S38 WeakPolarHBondContact O-CB 3.43Å; Y35-S38 PolarHBondContact O-N 3.05Å; Y35-S38 PolarHBondContact O-OG 2.9Å; Y35-I39 HydrophobicContact CE1-CD1 4.29Å; Y35-Y48 HydrophobicContact CD1-CE2 4.32Å; Y35-Y48 HydrophobicContact CE1-CD2 4.34Å; Y35-Y48 AromaticContact CE1-CE2 3.8Å; Y35-Y48 HydrophobicContact CE1-CE2 3.8Å
36	V	81.4	Confident	79.4	Confident	6 Å²	6	74.3 Å²	74.3	4%	0.036	37%	0.372	C	S	.	.	H	α-helix	trans	-56.7	-39.7	178.1	168.3	0	0	0	0	112.5	I32 I33 S38 I39 I45 Y48 V49	I32-V36 WeakPolarHBondContact O-CG2 3.38Å; I32-V36 PolarHBondContact O-N 3.36Å; I33-V36 PolarHBondContact O-N 3.49Å; V36-S38 VanDerWaalsContact C-N 3.26Å; V36-S38 PolarHBondContact O-N 3.19Å; V36-I39 PolarHBondContact O-N 2.96Å; V36-I45 HydrophobicContact CG1-CG2 4.23Å; V36-Y48 HydrophobicContact CG2-CD1 3.42Å; V36-Y48 VanDerWaalsContact CG2-CD1 3.42Å; V36-Y48 HydrophobicContact CG2-CE1 3.45Å; V36-Y48 VanDerWaalsContact CG2-CE1 3.45Å; V36-Y48 HydrophobicContact CG2-CG 4.45Å; V36-V49 HydrophobicContact CG1-CG2 3.86Å; V36-V49 HydrophobicContact CG2-CG2 4.47Å
37	L	79.3	Confident	79.9	Confident	31 Å²	31	77.8 Å²	77.8	16%	0.162	39%	0.386	C	S	.	.	H	α-helix	trans	-75.8	-11.1	178.3	-65	175.4	0	0	0	113.8	L12 V13 I33 Y35 W71	L12-L37 HydrophobicContact CB-CD1 4.19Å; L12-L37 HydrophobicContact CD2-CD1 4.16Å; L12-L37 HydrophobicContact CD2-CD2 3.64Å; L12-L37 HydrophobicContact CG-CD1 3.93Å; L12-L37 HydrophobicContact CG-CD2 4Å; V13-L37 HydrophobicContact CG2-CD1 3.68Å; I33-L37 HydrophobicContact CG2-CD1 4.26Å; I33-L37 WeakPolarHBondContact O-CG 3.48Å; I33-L37 PolarHBondContact O-N 3.06Å; Y35-L37 VanDerWaalsContact C-N 3.28Å; Y35-L37 PolarHBondContact O-N 3.12Å; L37-W71 PolarHBondContact O-NE1 3.38Å
38	S	80.6	Confident	80.6	Confident	80 Å²	80	76.3 Å²	76.3	56%	0.559	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.8	-2.3	175.1	74.3	0	0	0	0	114.6	Q34 Y35 V36	Q34-S38 PolarHBondContact O-N 3.37Å; Y35-S38 WeakPolarHBondContact O-CB 3.43Å; Y35-S38 PolarHBondContact O-N 3.05Å; Y35-S38 PolarHBondContact O-OG 2.9Å; V36-S38 VanDerWaalsContact C-N 3.26Å; V36-S38 PolarHBondContact O-N 3.19Å
39	I	82.1	Confident	80.9	Confident	17 Å²	17	75.4 Å²	75.4	9%	0.087	37%	0.367	C	S	.	.			trans	-77.9	126.8	178.9	-62	172.6	0	0	0	109.5	Y35 V36 S41 E44 I45 W71	Y35-I39 HydrophobicContact CE1-CD1 4.29Å; V36-I39 PolarHBondContact O-N 2.96Å; I39-S41 VanDerWaalsContact C-N 3.3Å; I39-S41 PolarHBondContact O-N 2.89Å; I39-E44 HydrophobicContact CG2-CB 3.68Å; I39-I45 HydrophobicContact CB-CD1 4.28Å; I39-I45 HydrophobicContact CB-CG1 3.79Å; I39-I45 HydrophobicContact CD1-CG1 4.3Å; I39-I45 HydrophobicContact CG2-CG1 3.84Å; I39-W71 WeakPolarHBondContact O-CZ2 3.27Å
40	E	76.4	Confident	81.3	Confident	192 Å²	192	74.3 Å²	74.3	90%	0.897	36%	0.358	S	S	*	.	S	Bend	trans	-74.8	-16.6	-178.4	-61.4	-177.1	177.4	0	0	113.6
41	S	86.3	Confident	81.7	Confident	31 Å²	31	74.8 Å²	74.8	22%	0.217	37%	0.365	C	S	.	.			trans	-108.1	120.2	-173.5	175.6	0	0	0	0	113	I39 E43 E44 I45	I39-S41 VanDerWaalsContact C-N 3.3Å; I39-S41 PolarHBondContact O-N 2.89Å; S41-E43 PolarHBondContact O-N 3.39Å; S41-E43 PolarHBondContact OG-N 3.2Å; S41-E44 VanDerWaalsContact CB-CD 3.41Å; S41-E44 WeakPolarHBondContact CB-OE1 3.47Å; S41-E44 PolarHBondContact O-N 3.35Å; S41-E44 PolarHBondContact OG-N 2.78Å; S41-E44 PolarHBondContact OG-OE1 3.31Å; S41-I45 WeakPolarHBondContact O-CG1 3.49Å; S41-I45 PolarHBondContact O-N 2.99Å; S41-I45 VanDerWaalsContact O-N 3.12Å
42	A	82.5	Confident	82.1	Confident	24 Å²	24	70.2 Å²	70.2	20%	0.198	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-11	174	0	0	0	0	0	114.1	R46 I68 W71	A42-R46 VanDerWaalsContact O-CD 3.31Å; A42-R46 WeakPolarHBondContact O-CD 3.44Å; A42-R46 VanDerWaalsContact O-CG 3.28Å; A42-R46 WeakPolarHBondContact O-CG 3.34Å; A42-R46 PolarHBondContact O-NE 3.48Å; A42-I68 HydrophobicContact CB-CG2 4.26Å; A42-W71 HydrophobicContact CB-CZ3 3.93Å
43	E	80.6	Confident	82	Confident	153 Å²	153	67.7 Å²	67.7	72%	0.715	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.9	-42.8	174.3	-63.9	-176.2	164.5	0	0	110.3	S41 I45 R46 E47	S41-E43 PolarHBondContact O-N 3.39Å; S41-E43 PolarHBondContact OG-N 3.2Å; E43-I45 VanDerWaalsContact C-N 3.34Å; E43-I45 PolarHBondContact O-N 3.29Å; E43-R46 WeakPolarHBondContact O-CB 3.5Å; E43-R46 PolarHBondContact O-N 3.34Å; E43-E47 PolarHBondContact O-N 3.49Å; E43-E47 VanDerWaalsContact O-N 3.14Å
44	E	83.3	Confident	81.9	Confident	112 Å²	112	75.3 Å²	75.3	52%	0.523	37%	0.367	S	S	.	.	H	α-helix	trans	-64.1	-37.3	175.3	-69.2	162.1	-137	0	0	112.1	I39 S41 R46 E47 Y48	I39-E44 HydrophobicContact CG2-CB 3.68Å; S41-E44 VanDerWaalsContact CB-CD 3.41Å; S41-E44 WeakPolarHBondContact CB-OE1 3.47Å; S41-E44 PolarHBondContact O-N 3.35Å; S41-E44 PolarHBondContact OG-N 2.78Å; S41-E44 PolarHBondContact OG-OE1 3.31Å; E44-R46 PolarHBondContact O-N 2.88Å; E44-E47 PolarHBondContact O-N 2.97Å; E44-Y48 WeakPolarHBondContact O-CB 3.36Å; E44-Y48 PolarHBondContact O-N 3.16Å
45	I	84	Confident	81.5	Confident	1 Å²	1	71.7 Å²	71.7	1%	0.005	36%	0.359	C	S	.	.	H	α-helix	trans	-59.1	-36.6	171.5	-67.6	170.8	0	0	0	111.1	V36 I39 S41 E43 V49 L67 I68 W71	V36-I45 HydrophobicContact CG1-CG2 4.23Å; I39-I45 HydrophobicContact CB-CD1 4.28Å; I39-I45 HydrophobicContact CB-CG1 3.79Å; I39-I45 HydrophobicContact CD1-CG1 4.3Å; I39-I45 HydrophobicContact CG2-CG1 3.84Å; S41-I45 WeakPolarHBondContact O-CG1 3.49Å; S41-I45 PolarHBondContact O-N 2.99Å; S41-I45 VanDerWaalsContact O-N 3.12Å; E43-I45 VanDerWaalsContact C-N 3.34Å; E43-I45 PolarHBondContact O-N 3.29Å; I45-V49 HydrophobicContact CG2-CG2 4.36Å; I45-V49 WeakPolarHBondContact O-CB 3.43Å; I45-V49 VanDerWaalsContact O-CG2 3.24Å; I45-V49 WeakPolarHBondContact O-CG2 3.31Å; I45-V49 PolarHBondContact O-N 3.36Å; I45-V49 VanDerWaalsContact O-N 3.09Å; I45-L67 HydrophobicContact CG2-CD2 3.77Å; I45-I68 HydrophobicContact CG2-CD1 4.24Å; I45-I68 HydrophobicContact CG2-CG1 3.9Å; I45-W71 HydrophobicContact CD1-CD2 3.85Å; I45-W71 HydrophobicContact CD1-CE3 4.21Å; I45-W71 HydrophobicContact CD1-CG 4.3Å; I45-W71 HydrophobicContact CD1-CH2 4.42Å; I45-W71 HydrophobicContact CD1-CZ2 4.03Å
46	R	83.4	Confident	81.1	Confident	77 Å²	77	69.6 Å²	69.6	29%	0.291	36%	0.356	S	S	.	.	H	α-helix	trans	-68.8	-46.5	178.7	-68.8	166.7	177.5	-81.9	-4.7	111.2	A42 E43 E44 T50 I64 E65 I68	A42-R46 VanDerWaalsContact O-CD 3.31Å; A42-R46 WeakPolarHBondContact O-CD 3.44Å; A42-R46 VanDerWaalsContact O-CG 3.28Å; A42-R46 WeakPolarHBondContact O-CG 3.34Å; A42-R46 PolarHBondContact O-NE 3.48Å; E43-R46 WeakPolarHBondContact O-CB 3.5Å; E43-R46 PolarHBondContact O-N 3.34Å; E44-R46 PolarHBondContact O-N 2.88Å; R46-T50 WeakPolarHBondContact O-CB 3.44Å; R46-T50 PolarHBondContact O-N 3.41Å; R46-T50 PolarHBondContact O-OG1 3.37Å; R46-I64 HydrophobicContact CB-CG2 4.48Å; R46-I64 HydrophobicContact CG-CG2 4.02Å; R46-E65 IonicContact CZ-OE1 3.82Å; R46-E65 IonicContact CZ-OE2 3.32Å; R46-E65 VanDerWaalsContact NH1-CD 3.29Å; R46-E65 IonicContact NH1-OE1 3.56Å; R46-E65 PolarHBondContact NH1-OE1 3Å; R46-E65 IonicContact NH1-OE2 2.7Å; R46-E65 PolarHBondContact NH1-OE2 2.73Å; R46-E65 IonicContact NH2-OE1 3.78Å; R46-E65 IonicContact NH2-OE2 3.44Å; R46-E65 PolarHBondContact NH2-OE2 2.93Å; R46-I68 HydrophobicContact CG-CD1 3.26Å
47	E	84.2	Confident	80.6	Confident	139 Å²	139	77.1 Å²	77.1	65%	0.65	39%	0.391	S	S	*	.	H	α-helix	trans	-64.1	-52.3	-180	-64.6	-170.6	156.3	0	0	110.5	E43 E44 V49 T50 D51	E43-E47 PolarHBondContact O-N 3.49Å; E43-E47 VanDerWaalsContact O-N 3.14Å; E44-E47 PolarHBondContact O-N 2.97Å; E47-V49 PolarHBondContact O-N 3.34Å; E47-T50 PolarHBondContact O-N 3.46Å; E47-T50 VanDerWaalsContact O-N 3.11Å; E47-D51 PolarHBondContact O-N 3.35Å
48	Y	85.1	Confident	80.6	Confident	88 Å²	88	78 Å²	78	35%	0.345	41%	0.408	S	S	.	.	H	α-helix	trans	-59.7	-43.3	-179	-168.5	-83.1	0	0	0	113	I32 Y35 V36 E44 D51 L52	I32-Y48 HydrophobicContact CG2-CE1 4.33Å; Y35-Y48 HydrophobicContact CD1-CE2 4.32Å; Y35-Y48 HydrophobicContact CE1-CD2 4.34Å; Y35-Y48 AromaticContact CE1-CE2 3.8Å; Y35-Y48 HydrophobicContact CE1-CE2 3.8Å; V36-Y48 HydrophobicContact CG2-CD1 3.42Å; V36-Y48 VanDerWaalsContact CG2-CD1 3.42Å; V36-Y48 HydrophobicContact CG2-CE1 3.45Å; V36-Y48 VanDerWaalsContact CG2-CE1 3.45Å; V36-Y48 HydrophobicContact CG2-CG 4.45Å; E44-Y48 WeakPolarHBondContact O-CB 3.36Å; E44-Y48 PolarHBondContact O-N 3.16Å; Y48-D51 PolarHBondContact O-N 2.95Å; Y48-L52 VanDerWaalsContact O-CB 3.29Å; Y48-L52 WeakPolarHBondContact O-CB 3.28Å; Y48-L52 PolarHBondContact O-N 3.17Å
49	V	82.1	Confident	80.3	Confident	5 Å²	5	81.4 Å²	81.4	3%	0.03	41%	0.412	C	S	.	.	H	α-helix	trans	-74.9	-28.3	178.1	-178.6	0	0	0	0	111.8	V36 I45 E47 L53 F63 I64	V36-V49 HydrophobicContact CG1-CG2 3.86Å; V36-V49 HydrophobicContact CG2-CG2 4.47Å; I45-V49 HydrophobicContact CG2-CG2 4.36Å; I45-V49 WeakPolarHBondContact O-CB 3.43Å; I45-V49 VanDerWaalsContact O-CG2 3.24Å; I45-V49 WeakPolarHBondContact O-CG2 3.31Å; I45-V49 PolarHBondContact O-N 3.36Å; I45-V49 VanDerWaalsContact O-N 3.09Å; E47-V49 PolarHBondContact O-N 3.34Å; V49-L53 HydrophobicContact CG1-CD1 3.85Å; V49-L53 HydrophobicContact CG1-CG 4.18Å; V49-L53 VanDerWaalsContact O-CB 3.25Å; V49-L53 WeakPolarHBondContact O-CB 3.48Å; V49-L53 VanDerWaalsContact O-CG 3.3Å; V49-L53 WeakPolarHBondContact O-CG 3.48Å; V49-L53 PolarHBondContact O-N 2.94Å; V49-F63 HydrophobicContact CG1-CE1 4.17Å; V49-I64 HydrophobicContact CB-CG1 4.28Å; V49-I64 HydrophobicContact CG1-CD1 4.28Å; V49-I64 HydrophobicContact CG1-CG1 3.71Å
50	T	84.7	Confident	80.2	Confident	31 Å²	31	83.3 Å²	83.3	19%	0.19	42%	0.42	C	S	.	.	H	α-helix	trans	-67.2	-39.4	172.4	-62	0	0	0	0	111.7	R46 E47 Q54 G55 N56	R46-T50 WeakPolarHBondContact O-CB 3.44Å; R46-T50 PolarHBondContact O-N 3.41Å; R46-T50 PolarHBondContact O-OG1 3.37Å; E47-T50 PolarHBondContact O-N 3.46Å; E47-T50 VanDerWaalsContact O-N 3.11Å; T50-Q54 CarbonylContact O-C 3.59Å; T50-Q54 WeakPolarHBondContact O-CA 3.4Å; T50-Q54 PolarHBondContact O-N 2.95Å; T50-G55 PolarHBondContact O-N 3.03Å; T50-N56 HydrophobicContact CG2-CB 4.16Å
51	D	84.3	Confident	80.3	Confident	130 Å²	130	74.7 Å²	74.7	70%	0.695	38%	0.383	S	S	*	.	H	α-helix	trans	-71	-45.4	175.6	-79.8	-6.1	0	0	0	111.5	E47 Y48 L53 Q54	E47-D51 PolarHBondContact O-N 3.35Å; Y48-D51 PolarHBondContact O-N 2.95Å; D51-L53 VanDerWaalsContact C-N 3.29Å; D51-L53 PolarHBondContact O-N 2.9Å; D51-Q54 WeakPolarHBondContact O-CG 3.42Å; D51-Q54 PolarHBondContact O-N 3.41Å
52	L	82.8	Confident	80.1	Confident	56 Å²	56	79.7 Å²	79.7	29%	0.293	40%	0.403	S	S	.	.	H	α-helix	trans	-58.6	-38.9	175.5	-178.4	64.4	0	0	0	112.3	I32 Y48	I32-L52 HydrophobicContact CG2-CD2 4.4Å; Y48-L52 VanDerWaalsContact O-CB 3.29Å; Y48-L52 WeakPolarHBondContact O-CB 3.28Å; Y48-L52 PolarHBondContact O-N 3.17Å
53	L	77.7	Confident	80.2	Confident	7 Å²	7	79.1 Å²	79.1	4%	0.037	40%	0.396	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.5	-8.5	175.5	-69.3	178.2	0	0	0	113.8	L20 F24 L26 V49 D51 K60 F63 I64	L20-L53 HydrophobicContact CD2-CD2 3.69Å; F24-L53 HydrophobicContact CD2-CD2 3.96Å; F24-L53 HydrophobicContact CE2-CD2 4.36Å; F24-L53 HydrophobicContact CG-CD2 4.17Å; L26-L53 HydrophobicContact CD1-CD2 3.94Å; V49-L53 HydrophobicContact CG1-CD1 3.85Å; V49-L53 HydrophobicContact CG1-CG 4.18Å; V49-L53 VanDerWaalsContact O-CB 3.25Å; V49-L53 WeakPolarHBondContact O-CB 3.48Å; V49-L53 VanDerWaalsContact O-CG 3.3Å; V49-L53 WeakPolarHBondContact O-CG 3.48Å; V49-L53 PolarHBondContact O-N 2.94Å; D51-L53 VanDerWaalsContact C-N 3.29Å; D51-L53 PolarHBondContact O-N 2.9Å; L53-K60 HydrophobicContact CB-CD 4.15Å; L53-K60 HydrophobicContact CB-CG 4.48Å; L53-K60 HydrophobicContact CD1-CB 4.16Å; L53-K60 HydrophobicContact CD1-CG 4.42Å; L53-K60 WeakPolarHBondContact O-CE 3.48Å; L53-K60 PolarHBondContact O-NZ 2.87Å; L53-F63 HydrophobicContact CD1-CD1 3.88Å; L53-F63 HydrophobicContact CD1-CE1 4.32Å; L53-I64 HydrophobicContact CD1-CD1 4.33Å; L53-I64 HydrophobicContact CD1-CG1 4.31Å
54	Q	78.1	Confident	80.4	Confident	167 Å²	167	72 Å²	72	78%	0.78	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.8	72	-172.2	-58.6	-179.8	3.7	0	0	112.3	T50 D51 K60	T50-Q54 CarbonylContact O-C 3.59Å; T50-Q54 WeakPolarHBondContact O-CA 3.4Å; T50-Q54 PolarHBondContact O-N 2.95Å; D51-Q54 WeakPolarHBondContact O-CG 3.42Å; D51-Q54 PolarHBondContact O-N 3.41Å; Q54-K60 PolarHBondContact O-NZ 3.35Å
55	G	72.3	Confident	80.5	Confident	31 Å²	31	71 Å²	71	32%	0.32	36%	0.358	S	S	.	.	S	Bend	trans	100.9	154.7	171	0	0	0	0	0	115.1	T50 E57 K60	T50-G55 PolarHBondContact O-N 3.03Å; G55-E57 PolarHBondContact O-N 3.1Å; G55-K60 WeakPolarHBondContact O-CD 3.17Å
56	N	71.2	Confident	80.6	Confident	84 Å²	84	75.2 Å²	75.2	45%	0.449	38%	0.377	S	S	.	.			trans	-93.3	12.2	-167	-160.5	9.2	0	0	0	114.5	T50 G58 G61	T50-N56 HydrophobicContact CG2-CB 4.16Å; N56-G58 PolarHBondContact O-N 3.32Å; N56-G61 PolarHBondContact O-N 2.93Å; N56-G61 WeakPolarHBondContact OD1-CA 3.38Å; N56-G61 PolarHBondContact OD1-N 3.3Å
57	E	72.3	Confident	80.7	Confident	163 Å²	163	71.8 Å²	71.8	76%	0.762	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72	128	-164.6	-68.6	-58.8	152.8	0	0	114.9	G55 K59 K60	G55-E57 PolarHBondContact O-N 3.1Å; E57-K59 PolarHBondContact O-N 2.59Å; E57-K60 PolarHBondContact O-N 2.86Å; E57-K60 VanDerWaalsContact O-N 3.11Å
58	G	78.2	Confident	80.8	Confident	50 Å²	50	65.3 Å²	65.3	52%	0.515	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.5	-106.7	170.8	0	0	0	0	0	114.4	N56 K60 G61 Q62	N56-G58 PolarHBondContact O-N 3.32Å; G58-K60 PolarHBondContact O-N 3.32Å; G58-G61 PolarHBondContact O-N 3.37Å; G58-Q62 PolarHBondContact O-N 3.19Å
59	K	75.8	Confident	80.8	Confident	151 Å²	151	64.3 Å²	64.3	66%	0.657	34%	0.338	S	S	*	.	H	α-helix	trans	-62.8	-29.3	-178.7	-66.4	-175.6	179.5	-178.1	0	112.8	F24 E57 F63	F24-K59 HydrophobicContact CE1-CB 4.24Å; F24-K59 HydrophobicContact CZ-CB 4.43Å; E57-K59 PolarHBondContact O-N 2.59Å; K59-F63 PolarHBondContact O-N 2.82Å; K59-F63 VanDerWaalsContact O-N 3.1Å
60	K	79.3	Confident	80.8	Confident	58 Å²	58	67.1 Å²	67.1	25%	0.252	35%	0.35	S	S	.	.	H	α-helix	trans	-65.8	-48.9	179	-64.5	-180	-179	-174.5	0	110.6	F24 L53 Q54 G55 E57 G58 Q62 F63 I64	F24-K60 HydrophobicContact CD1-CG 4.22Å; F24-K60 HydrophobicContact CE1-CB 4.46Å; F24-K60 HydrophobicContact CE1-CG 3.59Å; F24-K60 HydrophobicContact CZ-CG 4.1Å; L53-K60 HydrophobicContact CB-CD 4.15Å; L53-K60 HydrophobicContact CB-CG 4.48Å; L53-K60 HydrophobicContact CD1-CB 4.16Å; L53-K60 HydrophobicContact CD1-CG 4.42Å; L53-K60 WeakPolarHBondContact O-CE 3.48Å; L53-K60 PolarHBondContact O-NZ 2.87Å; Q54-K60 PolarHBondContact O-NZ 3.35Å; G55-K60 WeakPolarHBondContact O-CD 3.17Å; E57-K60 PolarHBondContact O-N 2.86Å; E57-K60 VanDerWaalsContact O-N 3.11Å; G58-K60 PolarHBondContact O-N 3.32Å; K60-Q62 PolarHBondContact O-N 2.97Å; K60-F63 PolarHBondContact O-N 2.86Å; K60-I64 WeakPolarHBondContact O-CG1 3.28Å; K60-I64 PolarHBondContact O-N 3.44Å
61	G	78.7	Confident	80.8	Confident	11 Å²	11	67.3 Å²	67.3	11%	0.113	35%	0.347	C	S	.	.	H	α-helix	trans	-64	-38.3	174.9	0	0	0	0	0	114	N56 G58 F63 I64 E65	N56-G61 PolarHBondContact O-N 2.93Å; N56-G61 WeakPolarHBondContact OD1-CA 3.38Å; N56-G61 PolarHBondContact OD1-N 3.3Å; G58-G61 PolarHBondContact O-N 3.37Å; G61-F63 VanDerWaalsContact C-N 3.31Å; G61-F63 PolarHBondContact O-N 3.32Å; G61-I64 PolarHBondContact O-N 2.83Å; G61-E65 WeakPolarHBondContact O-CG 3.1Å; G61-E65 PolarHBondContact O-N 3.04Å
62	Q	81.9	Confident	80.6	Confident	136 Å²	136	65.3 Å²	65.3	64%	0.636	33%	0.333	S	S	*	.	H	α-helix	trans	-59.6	-40.8	173.9	-71.7	175.9	-13.9	0	0	112.3	G58 K60 E66	G58-Q62 PolarHBondContact O-N 3.19Å; K60-Q62 PolarHBondContact O-N 2.97Å; Q62-E66 WeakPolarHBondContact O-CB 3.13Å; Q62-E66 PolarHBondContact O-N 3.03Å
63	F	85	Confident	80.4	Confident	11 Å²	11	68.4 Å²	68.4	5%	0.048	35%	0.345	C	S	.	.	H	α-helix	trans	-66.3	-40.8	174.1	170.3	-100	0	0	0	112.6	W15 Q19 L20 F24 V49 L53 K59 K60 G61 E66 L67	W15-F63 HydrophobicContact CH2-CD2 4.07Å; W15-F63 AromaticContact CH2-CE2 3.9Å; W15-F63 HydrophobicContact CH2-CE2 3.9Å; W15-F63 HydrophobicContact CZ3-CE2 4.03Å; Q19-F63 HydrophobicContact CB-CD2 4.12Å; Q19-F63 HydrophobicContact CB-CE2 3.63Å; Q19-F63 HydrophobicContact CG-CE2 4.38Å; L20-F63 HydrophobicContact CD2-CE1 3.74Å; L20-F63 HydrophobicContact CD2-CZ 3.88Å; L20-F63 HydrophobicContact CG-CE1 4.32Å; L20-F63 HydrophobicContact CG-CZ 3.95Å; F24-F63 HydrophobicContact CE2-CB 4.03Å; F24-F63 HydrophobicContact CE2-CD1 4.18Å; F24-F63 AromaticContact CE2-CG 3.99Å; F24-F63 HydrophobicContact CE2-CG 3.99Å; F24-F63 HydrophobicContact CZ-CB 4.14Å; V49-F63 HydrophobicContact CG1-CE1 4.17Å; L53-F63 HydrophobicContact CD1-CD1 3.88Å; L53-F63 HydrophobicContact CD1-CE1 4.32Å; K59-F63 PolarHBondContact O-N 2.82Å; K59-F63 VanDerWaalsContact O-N 3.1Å; K60-F63 PolarHBondContact O-N 2.86Å; G61-F63 VanDerWaalsContact C-N 3.31Å; G61-F63 PolarHBondContact O-N 3.32Å; F63-E66 PolarHBondContact O-N 3.3Å; F63-L67 HydrophobicContact CE1-CD1 3.89Å; F63-L67 HydrophobicContact CZ-CD1 3.76Å; F63-L67 VanDerWaalsContact O-CB 3.27Å; F63-L67 WeakPolarHBondContact O-CB 3.47Å; F63-L67 PolarHBondContact O-N 3.33Å
64	I	83.8	Confident	79.9	Confident	3 Å²	3	70.7 Å²	70.7	2%	0.015	36%	0.357	C	S	.	.	H	α-helix	trans	-62	-45.7	177.1	-68.8	164.4	0	0	0	111.1	R46 V49 L53 K60 G61 L67 I68	R46-I64 HydrophobicContact CB-CG2 4.48Å; R46-I64 HydrophobicContact CG-CG2 4.02Å; V49-I64 HydrophobicContact CB-CG1 4.28Å; V49-I64 HydrophobicContact CG1-CD1 4.28Å; V49-I64 HydrophobicContact CG1-CG1 3.71Å; L53-I64 HydrophobicContact CD1-CD1 4.33Å; L53-I64 HydrophobicContact CD1-CG1 4.31Å; K60-I64 WeakPolarHBondContact O-CG1 3.28Å; K60-I64 PolarHBondContact O-N 3.44Å; G61-I64 PolarHBondContact O-N 2.83Å; I64-L67 PolarHBondContact O-N 3.28Å; I64-I68 HydrophobicContact CG2-CD1 3.81Å; I64-I68 WeakPolarHBondContact O-CD1 3.38Å; I64-I68 WeakPolarHBondContact O-CG1 3.39Å; I64-I68 PolarHBondContact O-N 3.09Å; I64-I68 VanDerWaalsContact O-N 3.08Å
65	E	84.6	Confident	79.1	Confident	93 Å²	93	66.8 Å²	66.8	44%	0.435	34%	0.341	S	S	.	.	H	α-helix	trans	-63.2	-41.9	175.2	-63.7	-59.3	162.9	0	0	112.2	R46 G61 T69	R46-E65 IonicContact CZ-OE1 3.82Å; R46-E65 IonicContact CZ-OE2 3.32Å; R46-E65 VanDerWaalsContact NH1-CD 3.29Å; R46-E65 IonicContact NH1-OE1 3.56Å; R46-E65 PolarHBondContact NH1-OE1 3Å; R46-E65 IonicContact NH1-OE2 2.7Å; R46-E65 PolarHBondContact NH1-OE2 2.73Å; R46-E65 IonicContact NH2-OE1 3.78Å; R46-E65 IonicContact NH2-OE2 3.44Å; R46-E65 PolarHBondContact NH2-OE2 2.93Å; G61-E65 WeakPolarHBondContact O-CG 3.1Å; G61-E65 PolarHBondContact O-N 3.04Å; E65-T69 VanDerWaalsContact O-CB 3.28Å; E65-T69 WeakPolarHBondContact O-CB 3.46Å; E65-T69 PolarHBondContact O-N 2.86Å; E65-T69 PolarHBondContact O-OG1 3.29Å
66	E	86.5	Confident	78.3	Confident	88 Å²	88	71.7 Å²	71.7	41%	0.411	36%	0.356	S	S	.	.	H	α-helix	trans	-67	-40.5	178.8	-168.5	-177.8	174.4	0	0	112.1	W15 Q62 F63 T69 K70	W15-E66 HydrophobicContact CH2-CB 4.26Å; W15-E66 HydrophobicContact CH2-CG 3.94Å; W15-E66 HydrophobicContact CZ2-CG 4.09Å; W15-E66 WeakPolarHBondContact CZ2-OE1 3.47Å; Q62-E66 WeakPolarHBondContact O-CB 3.13Å; Q62-E66 PolarHBondContact O-N 3.03Å; F63-E66 PolarHBondContact O-N 3.3Å; E66-T69 PolarHBondContact O-N 3.11Å; E66-K70 HydrophobicContact CG-CD 4.39Å; E66-K70 WeakPolarHBondContact O-CG 3.24Å; E66-K70 PolarHBondContact O-N 2.75Å; E66-K70 VanDerWaalsContact OE1-CE 3.28Å; E66-K70 WeakPolarHBondContact OE1-CE 3.47Å; E66-K70 IonicContact OE1-NZ 3.68Å; E66-K70 PolarHBondContact OE1-NZ 3.04Å
67	L	85.6	Confident	77.3	Confident	6 Å²	6	74.7 Å²	74.7	3%	0.031	37%	0.367	C	S	.	.	H	α-helix	trans	-60.1	-48.7	175.8	-177.8	155.7	0	0	0	110.7	W15 I45 F63 I64 K70 W71	W15-L67 HydrophobicContact CZ3-CB 4.23Å; I45-L67 HydrophobicContact CG2-CD2 3.77Å; F63-L67 HydrophobicContact CE1-CD1 3.89Å; F63-L67 HydrophobicContact CZ-CD1 3.76Å; F63-L67 VanDerWaalsContact O-CB 3.27Å; F63-L67 WeakPolarHBondContact O-CB 3.47Å; F63-L67 PolarHBondContact O-N 3.33Å; I64-L67 PolarHBondContact O-N 3.28Å; L67-K70 PolarHBondContact O-N 2.79Å; L67-W71 WeakPolarHBondContact O-CB 3.4Å; L67-W71 PolarHBondContact O-N 2.9Å
68	I	85.9	Confident	76	Confident	3 Å²	3	70.3 Å²	70.3	2%	0.015	35%	0.354	C	S	.	.	H	α-helix	trans	-68.5	-38.2	-179.6	-66.8	165.2	0	0	0	111	A42 I45 R46 I64 K70 W71 Q72	A42-I68 HydrophobicContact CB-CG2 4.26Å; I45-I68 HydrophobicContact CG2-CD1 4.24Å; I45-I68 HydrophobicContact CG2-CG1 3.9Å; R46-I68 HydrophobicContact CG-CD1 3.26Å; I64-I68 HydrophobicContact CG2-CD1 3.81Å; I64-I68 WeakPolarHBondContact O-CD1 3.38Å; I64-I68 WeakPolarHBondContact O-CG1 3.39Å; I64-I68 PolarHBondContact O-N 3.09Å; I64-I68 VanDerWaalsContact O-N 3.08Å; I68-K70 PolarHBondContact O-N 3.03Å; I68-W71 PolarHBondContact O-N 2.77Å; I68-Q72 HydrophobicContact CG2-CG 4.31Å; I68-Q72 WeakPolarHBondContact O-CB 3.36Å; I68-Q72 WeakPolarHBondContact O-CG 3.39Å; I68-Q72 PolarHBondContact O-N 3.08Å
69	T	86	Confident	74.4	Confident	67 Å²	67	73.8 Å²	73.8	41%	0.411	36%	0.36	S	S	.	.	H	α-helix	trans	-62.9	-27.9	174.5	-56.8	0	0	0	0	112.3	E65 E66 K73	E65-T69 VanDerWaalsContact O-CB 3.28Å; E65-T69 WeakPolarHBondContact O-CB 3.46Å; E65-T69 PolarHBondContact O-N 2.86Å; E65-T69 PolarHBondContact O-OG1 3.29Å; E66-T69 PolarHBondContact O-N 3.11Å; T69-K73 WeakPolarHBondContact O-CD 3.38Å; T69-K73 VanDerWaalsContact O-CG 3.28Å; T69-K73 WeakPolarHBondContact O-CG 3.3Å
70	K	82.3	Confident	72.4	Confident	63 Å²	63	71.6 Å²	71.6	27%	0.274	36%	0.364	S	S	.	.	H	α-helix	trans	-85.2	-40.9	175.4	-73.4	175	-174.6	172.5	0	112.7	L12 W15 E66 L67 I68 K73 N74	L12-K70 HydrophobicContact CD1-CB 3.8Å; L12-K70 HydrophobicContact CD1-CD 4.43Å; W15-K70 HydrophobicContact CD2-CD 4.25Å; W15-K70 HydrophobicContact CE3-CD 4.1Å; W15-K70 HydrophobicContact CH2-CD 4.14Å; W15-K70 HydrophobicContact CZ2-CD 4.28Å; W15-K70 HydrophobicContact CZ3-CD 4.04Å; E66-K70 HydrophobicContact CG-CD 4.39Å; E66-K70 WeakPolarHBondContact O-CG 3.24Å; E66-K70 PolarHBondContact O-N 2.75Å; E66-K70 VanDerWaalsContact OE1-CE 3.28Å; E66-K70 WeakPolarHBondContact OE1-CE 3.47Å; E66-K70 IonicContact OE1-NZ 3.68Å; E66-K70 PolarHBondContact OE1-NZ 3.04Å; L67-K70 PolarHBondContact O-N 2.79Å; I68-K70 PolarHBondContact O-N 3.03Å; K70-K73 PolarHBondContact O-N 3.39Å; K70-K73 VanDerWaalsContact O-N 3.12Å; K70-N74 PolarHBondContact O-N 3.16Å
71	W	83.8	Confident	70.1	Confident	35 Å²	35	74.8 Å²	74.8	13%	0.133	38%	0.383	C	S	.	.	H	α-helix	trans	-56.2	-50.6	172.4	177.1	82	0	0	0	110.8	L12 L37 I39 A42 I45 L67 I68 K73 N74 D75	L12-W71 HydrophobicContact CD2-CB 4.43Å; L37-W71 PolarHBondContact O-NE1 3.38Å; I39-W71 WeakPolarHBondContact O-CZ2 3.27Å; A42-W71 HydrophobicContact CB-CZ3 3.93Å; I45-W71 HydrophobicContact CD1-CD2 3.85Å; I45-W71 HydrophobicContact CD1-CE3 4.21Å; I45-W71 HydrophobicContact CD1-CG 4.3Å; I45-W71 HydrophobicContact CD1-CH2 4.42Å; I45-W71 HydrophobicContact CD1-CZ2 4.03Å; L67-W71 WeakPolarHBondContact O-CB 3.4Å; L67-W71 PolarHBondContact O-N 2.9Å; I68-W71 PolarHBondContact O-N 2.77Å; W71-K73 PolarHBondContact O-N 3.46Å; W71-K73 VanDerWaalsContact O-N 3.14Å; W71-N74 PolarHBondContact O-N 3.16Å; W71-D75 WeakPolarHBondContact O-CB 3.25Å; W71-D75 PolarHBondContact O-N 3.37Å
72	Q	80.9	Confident	67.9	Low	88 Å²	88	80.1 Å²	80.1	41%	0.411	42%	0.416	S	S	.	.	H	α-helix	trans	-61.5	-22.1	175.8	-71.6	-178	-10.6	0	0	114.7	I68 Q76	I68-Q72 HydrophobicContact CG2-CG 4.31Å; I68-Q72 WeakPolarHBondContact O-CB 3.36Å; I68-Q72 WeakPolarHBondContact O-CG 3.39Å; I68-Q72 PolarHBondContact O-N 3.08Å; Q72-Q76 VanDerWaalsContact O-CG 3.24Å; Q72-Q76 WeakPolarHBondContact O-CG 3.43Å; Q72-Q76 PolarHBondContact O-N 2.95Å
73	K	78.2	Confident	65.8	Low	122 Å²	122	81.1 Å²	81.1	53%	0.53	43%	0.425	S	S	.	.	H	α-helix	trans	-85.9	-42.6	175.7	-77.4	177.8	-179.1	-172.2	0	112.1	T69 K70 W71 D75 Q76 E77	T69-K73 WeakPolarHBondContact O-CD 3.38Å; T69-K73 VanDerWaalsContact O-CG 3.28Å; T69-K73 WeakPolarHBondContact O-CG 3.3Å; K70-K73 PolarHBondContact O-N 3.39Å; K70-K73 VanDerWaalsContact O-N 3.12Å; W71-K73 PolarHBondContact O-N 3.46Å; W71-K73 VanDerWaalsContact O-N 3.14Å; K73-D75 PolarHBondContact O-N 3.26Å; K73-Q76 PolarHBondContact O-N 3.23Å; K73-E77 PolarHBondContact O-N 3.47Å
74	N	68.4	Low	63.4	Low	55 Å²	55	89.8 Å²	89.8	29%	0.294	47%	0.466	S	S	.	.	H	α-helix	trans	-58.2	-36.6	172.9	-152.5	54.7	0	0	0	110.5	S8 L12 K70 W71 Q76 S78	S8-N74 PolarHBondContact O-ND2 2.73Å; L12-N74 HydrophobicContact CD2-CB 4.46Å; K70-N74 PolarHBondContact O-N 3.16Å; W71-N74 PolarHBondContact O-N 3.16Å; N74-Q76 VanDerWaalsContact C-N 3.33Å; N74-S78 PolarHBondContact O-N 2.63Å; N74-S78 VanDerWaalsContact O-N 3.15Å
75	D	61.3	Low	60.9	Low	85 Å²	85	99.2 Å²	99.2	46%	0.455	51%	0.51	S	S	.	.	H	α-helix	trans	-81.9	-3.5	176.4	-150.2	47.6	0	0	0	114.6	W71 K73 S78 I79	W71-D75 WeakPolarHBondContact O-CB 3.25Å; W71-D75 PolarHBondContact O-N 3.37Å; K73-D75 PolarHBondContact O-N 3.26Å; D75-S78 VanDerWaalsContact C-OG 3.3Å; D75-S78 WeakPolarHBondContact CA-OG 3.42Å; D75-S78 PolarHBondContact O-OG 2.77Å; D75-S78 VanDerWaalsContact O-OG 3.11Å; D75-I79 WeakPolarHBondContact O-CD1 3.36Å; D75-I79 WeakPolarHBondContact O-CG1 3.34Å
76	Q	54.8	Low	58.3	Low	134 Å²	134	99.5 Å²	99.5	63%	0.626	52%	0.521	S	S	*	.	H	α-helix	trans	-97.9	-35.6	167.4	-79.5	172.7	16.4	0	0	111.6	Q72 K73 N74 S78 I79	Q72-Q76 VanDerWaalsContact O-CG 3.24Å; Q72-Q76 WeakPolarHBondContact O-CG 3.43Å; Q72-Q76 PolarHBondContact O-N 2.95Å; K73-Q76 PolarHBondContact O-N 3.23Å; N74-Q76 VanDerWaalsContact C-N 3.33Å; Q76-S78 PolarHBondContact O-N 3.24Å; Q76-I79 PolarHBondContact O-N 3.4Å
77	E	49.1	Very low	55.3	Low	146 Å²	146	104.2 Å²	104.2	68%	0.682	54%	0.54	S	S	*	.	H	α-helix	trans	-69.8	-23.1	173.6	-69	177.3	-174.5	0	0	111.9	K73 I79 S80	K73-E77 PolarHBondContact O-N 3.47Å; E77-I79 VanDerWaalsContact C-N 3.31Å; E77-S80 PolarHBondContact O-OG 3.34Å
78	S	46.1	Very low	52.6	Low	71 Å²	71	113.8 Å²	113.8	50%	0.497	58%	0.582	S	S	.	*	T	Hydrogen-bonded Turn	trans	-72.3	-17.2	169.7	66.6	0	0	0	0	114.6	N74 D75 Q76	N74-S78 PolarHBondContact O-N 2.63Å; N74-S78 VanDerWaalsContact O-N 3.15Å; D75-S78 VanDerWaalsContact C-OG 3.3Å; D75-S78 WeakPolarHBondContact CA-OG 3.42Å; D75-S78 PolarHBondContact O-OG 2.77Å; D75-S78 VanDerWaalsContact O-OG 3.11Å; Q76-S78 PolarHBondContact O-N 3.24Å
79	I	43.5	Very low	49.7	Very low	124 Å²	124	122.1 Å²	122.1	64%	0.636	62%	0.618	S	S	*	*	S	Bend	trans	-93.1	-13.8	-173.5	-69.7	175.8	0	0	0	112.5	D75 Q76 E77 D81	D75-I79 WeakPolarHBondContact O-CD1 3.36Å; D75-I79 WeakPolarHBondContact O-CG1 3.34Å; Q76-I79 PolarHBondContact O-N 3.4Å; E77-I79 VanDerWaalsContact C-N 3.31Å; I79-D81 VanDerWaalsContact C-N 3.27Å; I79-D81 PolarHBondContact O-N 2.88Å
80	S	34.9	Very low	46.8	Very low	105 Å²	105	124.4 Å²	124.4	73%	0.734	63%	0.628	S	S	*	*			trans	-83.1	52	180	48.9	0	0	0	0	114.9	E77	E77-S80 PolarHBondContact O-OG 3.34Å
81	D	30.9	Very low	43.9	Very low	124 Å²	124	130.5 Å²	130.5	66%	0.663	66%	0.657	S	S	*	*	S	Bend	trans	-130.9	127	166.3	-164.9	39.6	0	0	0	109.7	I79 L83	I79-D81 VanDerWaalsContact C-N 3.27Å; I79-D81 PolarHBondContact O-N 2.88Å; D81-L83 VanDerWaalsContact C-N 3.31Å; D81-L83 PolarHBondContact O-N 3.45Å
82	P	32.6	Very low	41.2	Very low	124 Å²	124	135.4 Å²	135.4	81%	0.805	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.5	48.5	-149	35.5	-37.9	0	0	0	115.1
83	L	36.9	Very low	38.7	Very low	157 Å²	157	139 Å²	139	82%	0.822	71%	0.706	S	S	*	*	T	Hydrogen-bonded Turn	trans	-128.3	5	-176.6	-81.2	173.7	0	0	0	116.8	D81	D81-L83 VanDerWaalsContact C-N 3.31Å; D81-L83 PolarHBondContact O-N 3.45Å
84	Q	35.3	Very low	36.2	Very low	193 Å²	193	139.8 Å²	139.8	90%	0.902	72%	0.716	S	S	*	*			trans	-121.3	59.4	174.3	-67.2	-162.9	6.9	0	0	114.1
85	Q	31.9	Very low	34.2	Very low	201 Å²	201	140 Å²	140	94%	0.939	73%	0.731	S	S	*	*			trans	-124.3	39.1	169.8	-127.8	176.1	29.2	0	0	114.5
86	C	28.9	Very low	32.7	Very low	98 Å²	98	143.3 Å²	143.3	66%	0.662	74%	0.743	S	S	*	*			trans	-152.6	124.8	159.6	-137	0	0	0	0	107.9
87	F	24.9	Very low	31.3	Very low	187 Å²	187	146.3 Å²	146.3	82%	0.82	75%	0.754	S	S	*	*	S	Bend	cis	-140.3	145.2	19.7	-62.6	-107.8	0	0	0	111.2
88	K	28.4	Very low	30.2	Very low	207 Å²	207	144.9 Å²	144.9	90%	0.9	76%	0.76	S	S	*	*			trans	178.9	73.6	138.4	-103.4	171.6	-178.5	178.4	0	112.1
89	K	23.8	Very low	29.2	Very low	178 Å²	178	144.6 Å²	144.6	77%	0.774	77%	0.769	S	S	*	*			trans	168.2	152.6	153.3	-100.8	-172.7	167.4	-157.4	0	110
90	D	24.9	Very low	28.4	Very low	116 Å²	116	145.5 Å²	145.5	62%	0.62	78%	0.775	S	S	*	*			cis	-105	-152.4	-14.9	-65.7	-82.6	0	0	0	108.8
91	E	22.9	Very low	28.1	Very low	191 Å²	191	147.9 Å²	147.9	89%	0.893	77%	0.774	S	S	*	*			cis	-121.5	161.8	34.3	-66.7	-168.5	119.8	0	0	115.1
92	I	27.3	Very low	28	Very low	138 Å²	138	147.6 Å²	147.6	71%	0.708	77%	0.772	S	S	*	*			trans	-130	134.8	172.8	-62.3	168.7	0	0	0	108.4
93	L	27.4	Very low	27.8	Very low	164 Å²	164	149.4 Å²	149.4	86%	0.859	77%	0.767	S	S	*	*			trans	-153.2	151.9	162.3	-67.2	176.5	0	0	0	108.8
94	D	26	Very low	27.3	Very low	138 Å²	138	153.3 Å²	153.3	74%	0.738	77%	0.771	S	S	*	*				-152.4	149.9	-56	-175.2	72.3	0	0	0	105.7
95	G	26.9	Very low	26.8	Very low	59 Å²	59	147.8 Å²	147.8	61%	0.608	77%	0.766	S	S	*	*			cis	162.7	-136	-1.2	0	0	0	0	0	110.5
96	Q	29.4	Very low	26.6	Very low	155 Å²	155	148.8 Å²	148.8	72%	0.724	76%	0.761	S	S	*	*			trans	58.4	103.5	176.4	-55.1	-159.7	8.9	0	0	116.9
97	K	25.6	Very low	26.7	Very low	196 Å²	196	152 Å²	152	85%	0.852	76%	0.763	S	S	*	*				74.5	139.2	96	-72.1	171.2	-178.6	178.5	0	114.4
98	S	25.5	Very low	26.7	Very low	116 Å²	116	152.9 Å²	152.9	81%	0.811	77%	0.767	S	S	*	*			cis	-128.3	162.2	5.2	55.4	0	0	0	0	110.6
99	G	25.8	Very low	26.5	Very low	66 Å²	66	146.2 Å²	146.2	68%	0.68	76%	0.758	S	S	*	*				77	124.1	56.9	0	0	0	0	0	109.6
100	D	25.9	Very low	26.8	Very low	143 Å²	143	149.5 Å²	149.5	77%	0.765	77%	0.765	S	S	*	*			cis	-149.7	148.6	17.6	-110.5	-19.9	0	0	0	110.9
101	H	28.6	Very low	26.9	Very low	154 Å²	154	150.7 Å²	150.7	71%	0.713	77%	0.771	S	S	*	*				57.2	135.4	90.6	-78.6	-5.7	0	0	0	115.6
102	L	28.3	Very low	27.2	Very low	118 Å²	118	150.7 Å²	150.7	62%	0.618	76%	0.763	S	S	*	*			cis	-160.6	151.8	5.8	-98.7	157.7	0	0	0	114
103	K	29.7	Very low	27.3	Very low	163 Å²	163	149.9 Å²	149.9	71%	0.709	76%	0.756	S	S	*	*			trans	33.6	125.8	143.9	-68.7	171.6	-164.3	157.5	0	123.5
104	R	25.7	Very low	27.2	Very low	239 Å²	239	149 Å²	149	90%	0.902	75%	0.748	S	S	*	*				60.1	133.1	126.9	-59.7	175.6	174.9	-171.2	-2.7	121.6
105	G	25.8	Very low	27.1	Very low	76 Å²	76	148.5 Å²	148.5	78%	0.784	75%	0.749	S	S	*	*				147.7	95	128.1	0	0	0	0	0	122.3
106	R	26.7	Very low	27.5	Very low	222 Å²	222	151.4 Å²	151.4	84%	0.838	76%	0.758	S	S	*	*			trans	39.3	125.6	142	-82.3	-176	165.6	-179.6	-0.7	123.2
107	K	30.1	Very low	27.3	Very low	165 Å²	165	147.8 Å²	147.8	72%	0.717	75%	0.754	S	S	*	*				78.5	110.2	128.2	-72	-176.5	175.1	-175.6	0	122.7
108	K	25.3	Very low	27.2	Very low	206 Å²	206	147.8 Å²	147.8	90%	0.896	75%	0.754	S	S	*	*				77.3	107.7	112.1	-168.3	-171.6	-178.5	-177	0	121.1
109	G	24.8	Very low	27.1	Very low	68 Å²	68	147.8 Å²	147.8	70%	0.701	75%	0.75	S	S	*	*				141.7	133.2	125.8	0	0	0	0	0	120
110	R	31	Very low	27.2	Very low	247 Å²	247	152 Å²	152	93%	0.932	75%	0.752	S	S	*	*			trans	63.5	134.6	162.7	-60.3	173.7	173.2	164.7	-4.6	116.8
111	N	25.2	Very low	27.6	Very low	140 Å²	140	151.2 Å²	151.2	75%	0.749	75%	0.754	S	S	*	*			cis	100.5	123.8	13.8	-167.3	35.5	0	0	0	116
112	R	30.1	Very low	27.4	Very low	192 Å²	192	150.7 Å²	150.7	73%	0.725	76%	0.757	S	S	*	*			trans	66.6	148.9	177.2	-72.1	175.9	161.1	-117.6	1.6	114.7
113	Q	28.8	Very low	27.3	Very low	121 Å²	121	152.1 Å²	152.1	57%	0.565	77%	0.771	S	S	*	*			cis	-167.2	167	0.9	-107.5	172.1	-91.2	0	0	107.4
114	E	26.7	Very low	27.1	Very low	144 Å²	144	150.8 Å²	150.8	67%	0.673	78%	0.777	S	S	*	*			cis	-162.8	154.6	-17.3	-123	157.2	-153	0	0	107.4
115	V	23.7	Very low	27.3	Very low	128 Å²	128	143.8 Å²	143.8	78%	0.776	77%	0.769	S	S	*	*				43.7	132	105.6	-177.2	0	0	0	0	115.1
116	P	35.9	Very low	27.4	Very low	121 Å²	121	146.5 Å²	146.5	79%	0.786	76%	0.762	S	S	*	*			cis	-131.5	-151.4	31	26.3	-0	0	0	0	114.2
117	A	25.1	Very low	27.5	Very low	78 Å²	78	141.6 Å²	141.6	65%	0.645	76%	0.756	S	S	*	*				-170.4	-174.7	-62.3	0	0	0	0	0	110.6
118	F	23	Very low	27.7	Very low	196 Å²	196	140.5 Å²	140.5	86%	0.86	75%	0.752	S	S	*	*			trans	71.6	145.1	175.5	-67.5	-91	0	0	0	118.4
119	T	23.2	Very low	28.3	Very low	117 Å²	117	137 Å²	137	72%	0.718	75%	0.748	S	S	*	*			cis	-166	156.2	-31.1	18.3	0	0	0	0	111.1
120	E	28.7	Very low	29	Very low	155 Å²	155	139 Å²	139	72%	0.724	75%	0.748	S	S	*	*			trans	-16.1	157.5	161.4	-51.8	-51.7	129.1	0	0	121.6
121	P	32.4	Very low	28.9	Very low	125 Å²	125	136 Å²	136	81%	0.812	74%	0.742	S	S	*	*				-142.9	162.1	93.7	39.1	-24.7	0	0	0	118.3
122	D	24.8	Very low	29.3	Very low	143 Å²	143	137.4 Å²	137.4	77%	0.765	75%	0.75	S	S	*	*			trans	-75.5	170.2	-172.5	-55.7	-98.1	0	0	0	119.1
123	T	26	Very low	29.7	Very low	149 Å²	149	136.3 Å²	136.3	91%	0.914	76%	0.758	S	S	*	*				-165.2	158.5	123.5	11.1	0	0	0	0	116
124	T	26.3	Very low	30.1	Very low	135 Å²	135	134.4 Å²	134.4	83%	0.828	76%	0.762	S	S	*	*			trans	-81.3	172.7	-171.1	51.4	0	0	0	0	116.4
125	A	29.4	Very low	30.5	Very low	91 Å²	91	137.1 Å²	137.1	75%	0.752	77%	0.772	S	S	*	*			cis	178.4	-170.6	-22.6	0	0	0	0	0	106.3
126	E	29	Very low	30.9	Very low	133 Å²	133	136 Å²	136	62%	0.621	78%	0.776	S	S	*	*			cis	-163.2	-165.8	-1.6	-147.1	-108.6	90.6	0	0	108.2	K128	E126-K128 VanDerWaalsContact OE1-CE 3.25Å; E126-K128 WeakPolarHBondContact OE1-CE 3.49Å; E126-K128 IonicContact OE1-NZ 3.46Å; E126-K128 PolarHBondContact OE1-NZ 2.96Å; E126-K128 IonicContact OE2-NZ 3.22Å; E126-K128 PolarHBondContact OE2-NZ 2.64Å
127	V	28.5	Very low	30.8	Very low	120 Å²	120	138.4 Å²	138.4	73%	0.727	78%	0.777	S	S	*	*			trans	75.7	150.5	159.2	161.1	0	0	0	0	118.6
128	K	34.1	Very low	30.9	Very low	142 Å²	142	143.8 Å²	143.8	62%	0.617	79%	0.789	S	S	*	*				-175.7	173.8	-51.8	-104.4	170.7	-169.9	125.7	0	110.6	E126	E126-K128 VanDerWaalsContact OE1-CE 3.25Å; E126-K128 WeakPolarHBondContact OE1-CE 3.49Å; E126-K128 IonicContact OE1-NZ 3.46Å; E126-K128 PolarHBondContact OE1-NZ 2.96Å; E126-K128 IonicContact OE2-NZ 3.22Å; E126-K128 PolarHBondContact OE2-NZ 2.64Å
129	T	37.2	Very low	31.2	Very low	132 Å²	132	141.8 Å²	141.8	81%	0.81	79%	0.787	S	S	*	*			trans	82.4	154.3	165.2	76.8	0	0	0	0	119.7
130	P	39.8	Very low	31.4	Very low	110 Å²	110	140.4 Å²	140.4	71%	0.714	78%	0.782	S	S	*	*			cis	-140.9	139.7	-35.9	33.1	-15.2	0	0	0	116.2
131	F	29.5	Very low	31.2	Very low	184 Å²	184	141.2 Å²	141.2	81%	0.807	79%	0.791	S	S	*	*			trans	-161.9	24.7	137.5	-132.8	-90	0	0	0	117.4	L133	F131-L133 VanDerWaalsContact C-N 3.32Å; F131-L133 PolarHBondContact O-N 3.37Å
132	D	34.2	Very low	31.2	Very low	169 Å²	169	139.5 Å²	139.5	90%	0.904	78%	0.783	S	S	*	*			trans	-84.3	56.3	177.6	-82.6	-53.9	0	0	0	114.1
133	L	38	Very low	31.8	Very low	170 Å²	170	139 Å²	139	89%	0.89	79%	0.785	S	S	*	*			trans	-143.4	46	-178.4	-77.3	-179.2	0	0	0	115.3	F131	F131-L133 VanDerWaalsContact C-N 3.32Å; F131-L133 PolarHBondContact O-N 3.37Å
134	A	36.6	Very low	32.7	Very low	80 Å²	80	141.1 Å²	141.1	66%	0.661	78%	0.781	S	S	*	*	S	Bend	trans	-151.9	43.4	178.2	0	0	0	0	0	118.3
135	K	35.3	Very low	33.9	Very low	201 Å²	201	143.7 Å²	143.7	87%	0.874	78%	0.781	S	S	*	*			trans	165.9	81.8	143.1	-94.7	174.4	176.3	-176.2	0	113.3
136	A	32.9	Very low	34.7	Very low	106 Å²	106	148.9 Å²	148.9	88%	0.876	79%	0.786	S	S	*	*			trans	-109	50.7	160.8	0	0	0	0	0	110.6
137	Q	33.4	Very low	35.9	Very low	171 Å²	171	149.4 Å²	149.4	80%	0.799	80%	0.799	S	S	*	*			trans	-162.6	128.1	172.7	-98.2	159.3	-5.6	0	0	104.5
138	E	27.5	Very low	37.6	Very low	190 Å²	190	152.5 Å²	152.5	89%	0.888	80%	0.802	S	S	*	*			cis	-117.9	164.6	22.1	-59.1	178.7	117.6	0	0	115.2
139	N	28.6	Very low	38.8	Very low	155 Å²	155	154.9 Å²	154.9	83%	0.829	81%	0.813	S	S	*	*			trans	-75.9	165.2	162.7	-94.7	-31.2	0	0	0	110.3
140	S	26.8	Very low	40	Very low	88 Å²	88	150.3 Å²	150.3	62%	0.615	79%	0.785	S	S	*	*			cis	-169.3	148.6	-2.7	42.6	0	0	0	0	110.2
141	N	25.9	Very low	41.6	Very low	171 Å²	171	148.8 Å²	148.8	91%	0.914	77%	0.771	S	S	*	*				-170.4	136.2	119.7	-102.5	-43.2	0	0	0	111.2
142	S	32.4	Very low	43	Very low	90 Å²	90	145 Å²	145	63%	0.629	76%	0.758	S	S	*	*			trans	-122.3	129.8	-171.4	74.1	0	0	0	0	113
143	V	36.1	Very low	44.3	Very low	133 Å²	133	146.4 Å²	146.4	81%	0.806	75%	0.752	S	S	*	*			trans	-122	92.6	162.5	-179	0	0	0	0	108.1	K145	V143-K145 PolarHBondContact O-N 2.82Å
144	K	45.3	Very low	46	Very low	193 Å²	193	141.1 Å²	141.1	84%	0.839	73%	0.727	S	S	*	*			trans	-70	90.1	-178	-65.2	179.7	-179.2	178.1	0	111.1
145	K	51.2	Low	47.3	Very low	189 Å²	189	146.5 Å²	146.5	82%	0.822	73%	0.73	S	S	*	*			trans	-76.5	125.6	165.4	-72.9	-175.3	178.2	177.4	0	109.2	V143	V143-K145 PolarHBondContact O-N 2.82Å
146	K	46.5	Very low	48.7	Very low	199 Å²	199	142.9 Å²	142.9	87%	0.865	72%	0.717	S	S	*	*			trans	-58	135.5	-178.1	-65.6	178.7	178.3	-179.5	0	110.9	K148	K146-K148 PolarHBondContact O-N 3.11Å
147	T	53.7	Low	50.2	Low	145 Å²	145	138 Å²	138	89%	0.89	68%	0.677	S	S	*	*			trans	-68.7	87.4	173.7	35.8	0	0	0	0	110.7	F149	T147-F149 PolarHBondContact O-N 3.43Å
148	K	64.6	Low	51.6	Low	184 Å²	184	135.2 Å²	135.2	80%	0.8	66%	0.664	S	S	*	*			trans	-59.1	130.4	161.1	-77.2	-170.3	174.7	-174.2	0	108.4	K146 V150	K146-K148 PolarHBondContact O-N 3.11Å; K148-V150 PolarHBondContact O-N 2.88Å
149	F	60.3	Low	53.2	Low	192 Å²	192	130.7 Å²	130.7	84%	0.842	65%	0.646	S	S	*	*			trans	-61.9	114	168.9	179.1	-97.8	0	0	0	108.7	T147	T147-F149 PolarHBondContact O-N 3.43Å
150	V	61.9	Low	54.8	Low	36 Å²	36	131.8 Å²	131.8	22%	0.218	64%	0.638	C	S	.	*			trans	-97.3	122.9	174.6	-178	0	0	0	0	107.2	K148 L152 E156	K148-V150 PolarHBondContact O-N 2.88Å; V150-L152 PolarHBondContact O-N 3.48Å; V150-E156 HydrophobicContact CG1-CB 4.01Å
151	N	72.6	Confident	56.5	Low	79 Å²	79	133 Å²	133	42%	0.422	64%	0.637	S	S	.	*			trans	-68.9	128	-179.8	-179.5	-0.4	0	0	0	110	Y153 T154	N151-Y153 PolarHBondContact O-N 3.48Å; N151-Y153 WeakPolarHBondContact OD1-CD2 3.13Å; N151-Y153 PolarHBondContact OD1-N 2.87Å; N151-T154 HydrophobicContact CB-CG2 4.22Å; N151-T154 PolarHBondContact O-N 3.13Å; N151-T154 PolarHBondContact O-OG1 3.22Å; N151-T154 VanDerWaalsContact O-OG1 3.08Å
152	L	59	Low	58.4	Low	103 Å²	103	126.2 Å²	126.2	54%	0.539	61%	0.605	S	S	.	*	T	Hydrogen-bonded Turn	trans	-56.5	-22.7	-176.3	-63.4	170.5	0	0	0	113.9	V150 L161	V150-L152 PolarHBondContact O-N 3.48Å; L152-L161 HydrophobicContact CD2-CD1 4.27Å; L152-L161 HydrophobicContact CD2-CD2 4.24Å; L152-L161 HydrophobicContact CD2-CG 4.47Å
153	Y	61.6	Low	60.1	Low	199 Å²	199	127.7 Å²	127.7	78%	0.78	61%	0.61	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.4	-1.7	-180	-58.5	-76.3	0	0	0	114.7	N151	N151-Y153 PolarHBondContact O-N 3.48Å; N151-Y153 WeakPolarHBondContact OD1-CD2 3.13Å; N151-Y153 PolarHBondContact OD1-N 2.87Å
154	T	73.8	Confident	62.1	Low	59 Å²	59	125.2 Å²	125.2	36%	0.362	59%	0.592	S	S	.	*	S	Bend	trans	-85.8	159.7	168.7	67.6	0	0	0	0	110.5	N151 E156 G157 Q158	N151-T154 HydrophobicContact CB-CG2 4.22Å; N151-T154 PolarHBondContact O-N 3.13Å; N151-T154 PolarHBondContact O-OG1 3.22Å; N151-T154 VanDerWaalsContact O-OG1 3.08Å; T154-E156 VanDerWaalsContact C-N 3.28Å; T154-E156 PolarHBondContact O-N 3.43Å; T154-G157 WeakPolarHBondContact O-CA 3.29Å; T154-G157 PolarHBondContact O-N 2.84Å; T154-G157 PolarHBondContact OG1-N 2.62Å; T154-Q158 PolarHBondContact O-N 3.07Å
155	R	64.9	Low	63.6	Low	193 Å²	193	120.6 Å²	120.6	73%	0.728	58%	0.576	S	S	*	*	H	α-helix	trans	-56.7	-43.6	177.5	-153	177.1	76.9	-160.9	4.1	111.6	G157 Q158 D159	R155-G157 PolarHBondContact O-N 2.93Å; R155-Q158 PolarHBondContact O-N 3.2Å; R155-Q158 VanDerWaalsContact O-N 3.1Å; R155-D159 WeakPolarHBondContact O-CB 3.34Å; R155-D159 PolarHBondContact O-N 3.34Å
156	E	62.9	Low	64.9	Low	126 Å²	126	117.4 Å²	117.4	59%	0.589	57%	0.574	S	S	*	*	H	α-helix	trans	-60.6	-25.1	173.4	-61.3	-178.5	-169.6	0	0	114.5	V150 T154 R160	V150-E156 HydrophobicContact CG1-CB 4.01Å; T154-E156 VanDerWaalsContact C-N 3.28Å; T154-E156 PolarHBondContact O-N 3.43Å; E156-R160 WeakPolarHBondContact O-CD 3.22Å; E156-R160 VanDerWaalsContact O-CG 3.24Å; E156-R160 WeakPolarHBondContact O-CG 3.33Å
157	G	64.4	Low	66.4	Low	4 Å²	4	110.8 Å²	110.8	4%	0.041	56%	0.562	C	S	.	*	H	α-helix	trans	-76.9	-44.3	172.7	0	0	0	0	0	111.8	T154 R155 R160 L161	T154-G157 WeakPolarHBondContact O-CA 3.29Å; T154-G157 PolarHBondContact O-N 2.84Å; T154-G157 PolarHBondContact OG1-N 2.62Å; R155-G157 PolarHBondContact O-N 2.93Å; G157-R160 PolarHBondContact O-N 2.96Å; G157-L161 PolarHBondContact O-N 2.88Å
158	Q	63.8	Low	67.8	Low	111 Å²	111	109 Å²	109	52%	0.519	54%	0.539	S	S	.	.	H	α-helix	trans	-66.6	-44.7	177.2	-66.2	177	-19.9	0	0	112	T154 R155 R160 L161	T154-Q158 PolarHBondContact O-N 3.07Å; R155-Q158 PolarHBondContact O-N 3.2Å; R155-Q158 VanDerWaalsContact O-N 3.1Å; Q158-R160 PolarHBondContact O-N 2.71Å; Q158-R160 VanDerWaalsContact O-N 3.11Å; Q158-L161 PolarHBondContact O-N 2.84Å
159	D	61.2	Low	68.6	Low	95 Å²	95	103.7 Å²	103.7	51%	0.508	52%	0.517	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-25.5	174.9	-64	-25.5	0	0	0	111.9	R155	R155-D159 WeakPolarHBondContact O-CB 3.34Å; R155-D159 PolarHBondContact O-N 3.34Å
160	R	62.7	Low	69.9	Low	179 Å²	179	99.1 Å²	99.1	68%	0.675	51%	0.507	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.5	-11.1	176.9	-74.8	178.3	-180	-161	2.6	115.1	E156 G157 Q158 A162	E156-R160 WeakPolarHBondContact O-CD 3.22Å; E156-R160 VanDerWaalsContact O-CG 3.24Å; E156-R160 WeakPolarHBondContact O-CG 3.33Å; G157-R160 PolarHBondContact O-N 2.96Å; Q158-R160 PolarHBondContact O-N 2.71Å; Q158-R160 VanDerWaalsContact O-N 3.11Å; R160-A162 VanDerWaalsContact C-N 3.35Å
161	L	62.2	Low	71	Confident	112 Å²	112	98.4 Å²	98.4	59%	0.586	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.1	-13.3	172.1	-69.9	169.4	0	0	0	112.1	L152 G157 Q158 V163	L152-L161 HydrophobicContact CD2-CD1 4.27Å; L152-L161 HydrophobicContact CD2-CD2 4.24Å; L152-L161 HydrophobicContact CD2-CG 4.47Å; G157-L161 PolarHBondContact O-N 2.88Å; Q158-L161 PolarHBondContact O-N 2.84Å; L161-V163 PolarHBondContact O-N 3.09Å
162	A	64.6	Low	71.6	Confident	29 Å²	29	100.3 Å²	100.3	24%	0.24	51%	0.513	C	S	.	.			trans	-75.6	86.4	173.9	0	0	0	0	0	111.4	R160 L164	R160-A162 VanDerWaalsContact C-N 3.35Å; A162-L164 PolarHBondContact O-N 3.44Å; A162-L164 VanDerWaalsContact O-N 3.08Å
163	V	69.7	Low	72.9	Confident	122 Å²	122	96 Å²	96	74%	0.739	49%	0.492	S	S	*	.			trans	-70.6	101.1	174.5	-178.8	0	0	0	0	109.8	L161 L165	L161-V163 PolarHBondContact O-N 3.09Å; V163-L165 PolarHBondContact O-N 3.21Å
164	L	76.4	Confident	74	Confident	80 Å²	80	90.8 Å²	90.8	42%	0.419	48%	0.477	S	S	.	.	P	Polyproline II helix	trans	-71.3	125	173.9	-67.2	174	0	0	0	110.9	A162 E193 Q194	A162-L164 PolarHBondContact O-N 3.44Å; A162-L164 VanDerWaalsContact O-N 3.08Å; L164-E193 HydrophobicContact CD1-CG 4.3Å; L164-Q194 HydrophobicContact CD2-CB 3.94Å
165	L	78.8	Confident	74.4	Confident	97 Å²	97	89.2 Å²	89.2	51%	0.508	47%	0.473	S	S	.	.	P	Polyproline II helix	trans	-73.6	140.1	171.5	-64.3	175	0	0	0	110.4	V163 G167 Q194	V163-L165 PolarHBondContact O-N 3.21Å; L165-G167 PolarHBondContact O-N 3.12Å; L165-Q194 PolarHBondContact O-NE2 2.84Å
166	P	76.7	Confident	75.2	Confident	121 Å²	121	88.3 Å²	88.3	79%	0.786	48%	0.477	S	S	*	.	S	Bend	trans	-67.7	129.8	177.9	28	-34.2	0	0	0	111.2	H169	P166-H169 PolarHBondContact O-NE2 3.13Å
167	G	77.9	Confident	76.2	Confident	60 Å²	60	89.8 Å²	89.8	62%	0.619	48%	0.481	S	S	*	.	S	Bend	trans	97.2	-170.9	-175.4	0	0	0	0	0	113	L165 Q194	L165-G167 PolarHBondContact O-N 3.12Å; G167-Q194 PolarHBondContact O-NE2 3.46Å
168	R	83.3	Confident	77.2	Confident	107 Å²	107	91 Å²	91	40%	0.404	49%	0.485	S	S	.	.			trans	-100.2	119.2	-178.5	-65.6	173.5	174.4	-90.2	-3.7	109	E195 G196 S197	R168-E195 WeakPolarHBondContact CG-O 3.45Å; R168-E195 PolarHBondContact NH1-O 3.07Å; R168-G196 VanDerWaalsContact NH1-CA 3.33Å; R168-G196 PolarHBondContact NH1-O 2.76Å; R168-G196 VanDerWaalsContact NH1-O 3.15Å; R168-S197 PolarHBondContact NH1-O 3.18Å; R168-S197 VanDerWaalsContact NH1-O 3.08Å; R168-S197 PolarHBondContact NH2-O 2.96Å
169	H	82.6	Confident	78.2	Confident	73 Å²	73	92.8 Å²	92.8	34%	0.338	49%	0.492	S	S	.	.			trans	-130.3	141.7	-177.9	-62.6	-78.3	0	0	0	109.5	P166 C171 Q194	P166-H169 PolarHBondContact O-NE2 3.13Å; H169-C171 PolarHBondContact O-N 2.97Å; H169-Q194 HydrophobicContact CB-CG 4.38Å; H169-Q194 PolarHBondContact N-O 3.31Å
170	P	86.3	Confident	79.6	Confident	96 Å²	96	93.1 Å²	93.1	62%	0.623	49%	0.493	S	S	*	.			trans	-59	134.3	176.8	25.7	-34	0	0	0	110.3	L201	P170-L201 HydrophobicContact CB-CD1 3.98Å
171	C	85.7	Confident	80.8	Confident	21 Å²	21	86.1 Å²	86.1	14%	0.142	47%	0.469	C	S	.	.			trans	-145.7	98.2	-176.3	-169	0	0	0	0	112.4	H169 C173 H178 Q194 E195	H169-C171 PolarHBondContact O-N 2.97Å; C171-C173 PolarHBondContact O-N 3.01Å; C171-H178 PolarHBondContact SG-CE1 2.87Å; C171-H178 PolarHBondContact SG-ND1 2.74Å; C171-Q194 HydrophobicContact CB-CB 3.93Å; C171-Q194 HydrophobicContact CB-CG 3.9Å; C171-E195 HydrophobicContact CB-CG 3.97Å; C171-E195 PolarHBondContact N-OE1 3.13Å
172	D	85.9	Confident	82.2	Confident	119 Å²	119	82.8 Å²	82.8	64%	0.636	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.1	30.6	-179.9	-51.2	-67.4	0	0	0	113.8	L174 R189	D172-L174 VanDerWaalsContact C-N 3.26Å; D172-L174 PolarHBondContact O-N 2.98Å; D172-R189 IonicContact OD1-CZ 3.45Å; D172-R189 VanDerWaalsContact OD1-CZ 3.22Å; D172-R189 IonicContact OD1-NH1 3.39Å; D172-R189 PolarHBondContact OD1-NH1 2.86Å; D172-R189 IonicContact OD1-NH2 3.99Å; D172-R189 PolarHBondContact OD1-NH2 3.14Å
173	C	85.1	Confident	83.4	Confident	12 Å²	12	85 Å²	85	8%	0.081	46%	0.459	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.4	-8.8	175.4	81.7	0	0	0	0	113.8	C171 G175 Q176 K177 C192	C171-C173 PolarHBondContact O-N 3.01Å; C173-G175 PolarHBondContact O-N 3Å; C173-Q176 VanDerWaalsContact O-CB 3.3Å; C173-Q176 WeakPolarHBondContact O-CB 3.25Å; C173-Q176 PolarHBondContact O-N 2.8Å; C173-K177 HydrophobicContact CB-CB 3.84Å; C173-K177 HydrophobicContact CB-CD 4.21Å; C173-K177 HydrophobicContact CB-CG 4.08Å; C173-C192 PolarHBondContact SG-SG 3.3Å
174	L	84.3	Confident	84.2	Confident	91 Å²	91	79.2 Å²	79.2	48%	0.476	42%	0.424	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.7	31.4	177.4	-57	176	0	0	0	114.4	D172 Q176 I190	D172-L174 VanDerWaalsContact C-N 3.26Å; D172-L174 PolarHBondContact O-N 2.98Å; L174-Q176 VanDerWaalsContact C-N 3.34Å; L174-I190 HydrophobicContact CD2-CB 4.45Å
175	G	82.4	Confident	84.6	Confident	26 Å²	26	82.1 Å²	82.1	27%	0.268	44%	0.439	S	S	.	.	T	Hydrogen-bonded Turn	trans	79	7.2	-177.2	0	0	0	0	0	115.6	C173 H178	C173-G175 PolarHBondContact O-N 3Å; G175-H178 CarbonylContact C-O 3.6Å; G175-H178 WeakPolarHBondContact CA-O 3.38Å
176	Q	83.2	Confident	84.9	Confident	174 Å²	174	82.9 Å²	82.9	81%	0.813	44%	0.443	S	S	*	.	S	Bend	trans	-85.2	-27.2	179.7	-60.7	-175.9	-9.1	0	0	114.1	C173 L174	C173-Q176 VanDerWaalsContact O-CB 3.3Å; C173-Q176 WeakPolarHBondContact O-CB 3.25Å; C173-Q176 PolarHBondContact O-N 2.8Å; L174-Q176 VanDerWaalsContact C-N 3.34Å
177	K	82.4	Confident	85.4	Confident	157 Å²	157	79.3 Å²	79.3	68%	0.683	42%	0.42	S	S	*	.	S	Bend	trans	-112.5	-22.9	-178.4	-61.1	-178.1	178.4	178.8	0	114.2	C173	C173-K177 HydrophobicContact CB-CB 3.84Å; C173-K177 HydrophobicContact CB-CD 4.21Å; C173-K177 HydrophobicContact CB-CG 4.08Å
178	H	85.2	Confident	85.8	Confident	28 Å²	28	78.7 Å²	78.7	13%	0.13	41%	0.414	C	S	.	.	S	Bend	trans	-126.9	150.1	179.1	-58.4	138.1	0	0	0	108	C171 G175 L180 C192 E193 Q194	C171-H178 PolarHBondContact SG-CE1 2.87Å; C171-H178 PolarHBondContact SG-ND1 2.74Å; G175-H178 CarbonylContact C-O 3.6Å; G175-H178 WeakPolarHBondContact CA-O 3.38Å; H178-L180 PolarHBondContact O-N 3.08Å; H178-C192 HydrophobicContact CB-CB 3.92Å; H178-E193 HydrophobicContact CB-CB 4.27Å; H178-Q194 WeakPolarHBondContact ND1-CB 3.32Å
179	K	86.5	Confident	86.1	Confident	149 Å²	149	76 Å²	76	65%	0.648	40%	0.404	S	S	*	.			trans	-54.5	134.9	-178.4	-169.9	-176.8	172.8	-169.7	0	110.8	I181 C192 E193	K179-I181 PolarHBondContact O-N 3.34Å; K179-C192 CarbonylContact O-C 3.57Å; K179-C192 WeakPolarHBondContact O-CA 3.41Å; K179-E193 HydrophobicContact CB-CB 4.21Å; K179-E193 WeakPolarHBondContact CB-OE2 3.39Å; K179-E193 PolarHBondContact O-N 2.88Å
180	L	90	Very high	86.5	Confident	102 Å²	102	75.5 Å²	75.5	53%	0.534	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62	131.6	172.8	175.7	61.3	0	0	0	110.1	H178 I190	H178-L180 PolarHBondContact O-N 3.08Å; L180-I190 HydrophobicContact CD1-CG2 3.35Å
181	I	88	Confident	86.6	Confident	33 Å²	33	71.1 Å²	71.1	17%	0.169	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	-66	167.2	-70.3	-177.7	0	0	0	109	K179 V191 T209	K179-I181 PolarHBondContact O-N 3.34Å; I181-V191 PolarHBondContact N-O 2.62Å; I181-T209 HydrophobicContact CG2-CG2 3.95Å
182	N	90.8	Very high	86.8	Confident	41 Å²	41	70.1 Å²	70.1	22%	0.219	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-170.9	169.5	-178.5	-151.3	-16.5	0	0	0	110	V191 V207 C208 Q213	N182-V191 PolarHBondContact O-N 2.8Å; N182-V207 HydrophobicContact CB-CG1 3.73Å; N182-C208 VanDerWaalsContact CB-O 3.29Å; N182-C208 WeakPolarHBondContact CB-O 3.22Å; N182-C208 PolarHBondContact ND2-O 2.86Å; N182-Q213 PolarHBondContact ND2-OE1 3.43Å
183	N	90.3	Very high	87	Confident	76 Å²	76	69.1 Å²	69.1	41%	0.406	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	145.9	171.1	69.2	-58.9	0	0	0	111.7	L185	N183-L185 PolarHBondContact O-N 3.37Å
184	C	87.3	Confident	87.1	Confident	1 Å²	1	69.1 Å²	69.1	1%	0.007	36%	0.358	C	S	.	.			trans	-75.2	115.4	172.5	-172.9	0	0	0	0	110.7	I186 C187 G188 R189 C200 V207	C184-I186 PolarHBondContact O-N 2.97Å; C184-I186 VanDerWaalsContact O-N 3.1Å; C184-C187 VanDerWaalsContact SG-SG 3.64Å; C184-G188 VanDerWaalsContact O-CA 3.29Å; C184-G188 WeakPolarHBondContact O-CA 3.48Å; C184-G188 PolarHBondContact O-N 2.86Å; C184-R189 WeakPolarHBondContact CB-O 3.38Å; C184-R189 PolarHBondContact N-O 2.92Å; C184-C200 HydrophobicContact CB-CB 4.41Å; C184-V207 HydrophobicContact CB-CG2 3.75Å
185	L	85.1	Confident	87.3	Confident	141 Å²	141	65.1 Å²	65.1	74%	0.738	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.3	-8.9	-178.1	-57.6	-179	0	0	0	114.8	N183	N183-L185 PolarHBondContact O-N 3.37Å
186	I	84.6	Confident	87.5	Confident	113 Å²	113	64.6 Å²	64.6	58%	0.579	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.3	-35.4	-178.8	-68.7	-172.7	0	0	0	113	C184 T205	C184-I186 PolarHBondContact O-N 2.97Å; C184-I186 VanDerWaalsContact O-N 3.1Å; I186-T205 HydrophobicContact CB-CG2 4.3Å; I186-T205 HydrophobicContact CD1-CG2 3.84Å; I186-T205 HydrophobicContact CG1-CG2 4.09Å
187	C	86.8	Confident	87.8	Confident	45 Å²	45	57 Å²	57	30%	0.304	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-119.6	-0.5	-179.9	72	0	0	0	0	115.1	C184 R189 F202 C203	C184-C187 VanDerWaalsContact SG-SG 3.64Å; C187-R189 PolarHBondContact O-N 2.86Å; C187-R189 VanDerWaalsContact O-N 3.11Å; C187-F202 HydrophobicContact CB-CD1 3.64Å; C187-F202 HydrophobicContact CB-CE1 3.97Å; C187-C203 HydrophobicContact CB-CB 4.19Å; C187-C203 PolarHBondContact SG-SG 3.31Å
188	G	87.2	Confident	88.1	Confident	48 Å²	48	49.7 Å²	49.7	50%	0.495	27%	0.266	S	S	.	.			trans	74	-12.2	-178.5	0	0	0	0	0	115.9	C184 I190	C184-G188 VanDerWaalsContact O-CA 3.29Å; C184-G188 WeakPolarHBondContact O-CA 3.48Å; C184-G188 PolarHBondContact O-N 2.86Å; G188-I190 PolarHBondContact O-N 3.49Å
189	R	87.9	Confident	88.3	Confident	51 Å²	51	50.3 Å²	50.3	19%	0.192	27%	0.273	C	S	.	.			trans	-56.4	128.7	-178.9	-174.5	174.9	177.5	99.4	-0.3	111	D172 C184 C187 E195	D172-R189 IonicContact OD1-CZ 3.45Å; D172-R189 VanDerWaalsContact OD1-CZ 3.22Å; D172-R189 IonicContact OD1-NH1 3.39Å; D172-R189 PolarHBondContact OD1-NH1 2.86Å; D172-R189 IonicContact OD1-NH2 3.99Å; D172-R189 PolarHBondContact OD1-NH2 3.14Å; C184-R189 WeakPolarHBondContact CB-O 3.38Å; C184-R189 PolarHBondContact N-O 2.92Å; C187-R189 PolarHBondContact O-N 2.86Å; C187-R189 VanDerWaalsContact O-N 3.11Å; R189-E195 IonicContact CZ-OE1 2.72Å; R189-E195 IonicContact NE-OE1 3.33Å; R189-E195 PolarHBondContact NE-OE1 3.45Å; R189-E195 IonicContact NE-OE2 3.34Å; R189-E195 IonicContact NH2-OE1 3.05Å; R189-E195 PolarHBondContact NH2-OE1 2.93Å
190	I	90.8	Very high	88.3	Confident	62 Å²	62	43.5 Å²	43.5	32%	0.318	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	115.6	179.2	-58.1	178.6	0	0	0	108.5	L174 L180 G188	L174-I190 HydrophobicContact CD2-CB 4.45Å; L180-I190 HydrophobicContact CD1-CG2 3.35Å; G188-I190 PolarHBondContact O-N 3.49Å
191	V	89.3	Confident	88.1	Confident	4 Å²	4	43.3 Å²	43.3	2%	0.024	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	133.4	-176.1	-178	0	0	0	0	109.7	I181 N182 E195 G196 V207	I181-V191 PolarHBondContact N-O 2.62Å; N182-V191 PolarHBondContact O-N 2.8Å; V191-E195 HydrophobicContact CG1-CB 3.84Å; V191-G196 WeakPolarHBondContact CG1-O 3.37Å; V191-V207 HydrophobicContact CB-CG1 4Å; V191-V207 HydrophobicContact CG2-CB 4.06Å; V191-V207 HydrophobicContact CG2-CG1 3.81Å; V191-V207 HydrophobicContact CG2-CG2 4.09Å
192	C	90.3	Very high	87.9	Confident	0 Å²	0	49 Å²	49	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	170.6	-176.5	75.7	0	0	0	0	112.7	C173 H178 K179 Q194 E195 G196	C173-C192 PolarHBondContact SG-SG 3.3Å; H178-C192 HydrophobicContact CB-CB 3.92Å; K179-C192 CarbonylContact O-C 3.57Å; K179-C192 WeakPolarHBondContact O-CA 3.41Å; C192-Q194 PolarHBondContact O-N 3.19Å; C192-Q194 VanDerWaalsContact O-N 3.1Å; C192-E195 PolarHBondContact O-N 3.44Å; C192-G196 PolarHBondContact O-N 2.95Å
193	E	88.8	Confident	87.6	Confident	98 Å²	98	49.2 Å²	49.2	46%	0.458	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.8	-31.6	-175.1	-163.1	158	-143	0	0	114.7	L164 H178 K179	L164-E193 HydrophobicContact CD1-CG 4.3Å; H178-E193 HydrophobicContact CB-CB 4.27Å; K179-E193 HydrophobicContact CB-CB 4.21Å; K179-E193 WeakPolarHBondContact CB-OE2 3.39Å; K179-E193 PolarHBondContact O-N 2.88Å
194	Q	87.6	Confident	87.2	Confident	12 Å²	12	48.1 Å²	48.1	6%	0.056	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-28	175.7	-177.6	62.5	93.2	0	0	114.1	L164 L165 G167 H169 C171 H178 C192	L164-Q194 HydrophobicContact CD2-CB 3.94Å; L165-Q194 PolarHBondContact O-NE2 2.84Å; G167-Q194 PolarHBondContact O-NE2 3.46Å; H169-Q194 HydrophobicContact CB-CG 4.38Å; H169-Q194 PolarHBondContact N-O 3.31Å; C171-Q194 HydrophobicContact CB-CB 3.93Å; C171-Q194 HydrophobicContact CB-CG 3.9Å; H178-Q194 WeakPolarHBondContact ND1-CB 3.32Å; C192-Q194 PolarHBondContact O-N 3.19Å; C192-Q194 VanDerWaalsContact O-N 3.1Å
195	E	88.3	Confident	87.1	Confident	7 Å²	7	49.9 Å²	49.9	3%	0.033	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.1	-33.1	174.4	-58.1	-165.4	145	0	0	111	R168 C171 R189 V191 C192 L201	R168-E195 WeakPolarHBondContact CG-O 3.45Å; R168-E195 PolarHBondContact NH1-O 3.07Å; C171-E195 HydrophobicContact CB-CG 3.97Å; C171-E195 PolarHBondContact N-OE1 3.13Å; R189-E195 IonicContact CZ-OE1 2.72Å; R189-E195 IonicContact NE-OE1 3.33Å; R189-E195 PolarHBondContact NE-OE1 3.45Å; R189-E195 IonicContact NE-OE2 3.34Å; R189-E195 IonicContact NH2-OE1 3.05Å; R189-E195 PolarHBondContact NH2-OE1 2.93Å; V191-E195 HydrophobicContact CG1-CB 3.84Å; C192-E195 PolarHBondContact O-N 3.44Å; E195-L201 HydrophobicContact CB-CD1 4.33Å; E195-L201 HydrophobicContact CG-CD1 4.16Å
196	G	88.1	Confident	87.2	Confident	14 Å²	14	46 Å²	46	14%	0.144	27%	0.268	C	S	.	.			trans	75.9	172.9	176.3	0	0	0	0	0	114.5	R168 V191 C192 G198	R168-G196 VanDerWaalsContact NH1-CA 3.33Å; R168-G196 PolarHBondContact NH1-O 2.76Å; R168-G196 VanDerWaalsContact NH1-O 3.15Å; V191-G196 WeakPolarHBondContact CG1-O 3.37Å; C192-G196 PolarHBondContact O-N 2.95Å; G196-G198 PolarHBondContact O-N 3.39Å
197	S	88.6	Confident	87.5	Confident	15 Å²	15	40.8 Å²	40.8	11%	0.105	24%	0.242	C	C	.	.	S	Bend	trans	-74.2	106.9	176.1	47.2	0	0	0	0	112.5	R168 V207 E212	R168-S197 PolarHBondContact NH1-O 3.18Å; R168-S197 VanDerWaalsContact NH1-O 3.08Å; R168-S197 PolarHBondContact NH2-O 2.96Å; S197-V207 CarbonylContact C-O 3.51Å; S197-V207 VanDerWaalsContact C-O 3.29Å; S197-V207 VanDerWaalsContact CA-O 3.25Å; S197-V207 WeakPolarHBondContact CA-O 3.47Å; S197-E212 WeakPolarHBondContact CB-OE1 3.36Å; S197-E212 WeakPolarHBondContact CB-OE2 3.23Å; S197-E212 VanDerWaalsContact OG-CD 3.31Å; S197-E212 PolarHBondContact OG-OE1 3.2Å; S197-E212 PolarHBondContact OG-OE2 2.94Å
198	G	87.9	Confident	87.6	Confident	3 Å²	3	39 Å²	39	3%	0.031	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-176.8	-171	-171.9	0	0	0	0	0	113.9	G196 C200 V207	G196-G198 PolarHBondContact O-N 3.39Å; G198-C200 PolarHBondContact O-N 2.85Å; G198-V207 PolarHBondContact N-O 3.49Å; G198-V207 PolarHBondContact O-N 3.26Å
199	P	89.4	Confident	87.7	Confident	42 Å²	42	38.9 Å²	38.9	27%	0.273	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.1	124.9	171.3	25.8	-33.6	0	0	0	110.1	L201 G204 L230 V234	P199-L201 PolarHBondContact O-N 3.47Å; P199-G204 VanDerWaalsContact CB-O 3.3Å; P199-G204 WeakPolarHBondContact CB-O 3.29Å; P199-L230 WeakPolarHBondContact CD-O 2.93Å; P199-V234 HydrophobicContact CG-CG2 4.05Å
200	C	88.1	Confident	87.6	Confident	5 Å²	5	42.9 Å²	42.9	3%	0.034	24%	0.24	C	C	.	.			trans	-59.1	124.2	-179.6	178.1	0	0	0	0	110.5	C184 G198 F202 C203 G204 T205 V207	C184-C200 HydrophobicContact CB-CB 4.41Å; G198-C200 PolarHBondContact O-N 2.85Å; C200-F202 PolarHBondContact O-N 3.34Å; C200-C203 PolarHBondContact O-N 3.44Å; C200-G204 WeakPolarHBondContact O-CA 3.27Å; C200-G204 PolarHBondContact O-N 3.29Å; C200-T205 VanDerWaalsContact CB-O 3.24Å; C200-T205 WeakPolarHBondContact CB-O 3.33Å; C200-T205 PolarHBondContact N-O 2.87Å; C200-V207 HydrophobicContact CB-CG2 4.02Å
201	L	85	Confident	87.4	Confident	99 Å²	99	47.6 Å²	47.6	52%	0.518	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-10.7	-175.1	-62.1	173.4	0	0	0	114.7	P170 E195 P199	P170-L201 HydrophobicContact CB-CD1 3.98Å; E195-L201 HydrophobicContact CB-CD1 4.33Å; E195-L201 HydrophobicContact CG-CD1 4.16Å; P199-L201 PolarHBondContact O-N 3.47Å
202	F	83.9	Confident	87.2	Confident	151 Å²	151	48.9 Å²	48.9	66%	0.662	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.7	-32.9	174.4	-178.2	-98.8	0	0	0	114.5	C187 C200	C187-F202 HydrophobicContact CB-CD1 3.64Å; C187-F202 HydrophobicContact CB-CE1 3.97Å; C200-F202 PolarHBondContact O-N 3.34Å
203	C	84.8	Confident	87	Confident	46 Å²	46	52 Å²	52	31%	0.311	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-140	8.3	-169.9	70.7	0	0	0	0	115.7	C187 C200 T205	C187-C203 HydrophobicContact CB-CB 4.19Å; C187-C203 PolarHBondContact SG-SG 3.31Å; C200-C203 PolarHBondContact O-N 3.44Å; C203-T205 PolarHBondContact O-N 2.8Å; C203-T205 PolarHBondContact SG-OG1 2.71Å
204	G	82.2	Confident	86.8	Confident	53 Å²	53	49.5 Å²	49.5	55%	0.546	27%	0.271	S	S	.	.			trans	68.3	-11.7	179.7	0	0	0	0	0	116	P199 C200 L206	P199-G204 VanDerWaalsContact CB-O 3.3Å; P199-G204 WeakPolarHBondContact CB-O 3.29Å; C200-G204 WeakPolarHBondContact O-CA 3.27Å; C200-G204 PolarHBondContact O-N 3.29Å; G204-L206 PolarHBondContact O-N 3.35Å
205	T	85.1	Confident	86.7	Confident	39 Å²	39	52.3 Å²	52.3	24%	0.239	29%	0.285	C	S	.	.			trans	-64.6	128.7	-178.3	-60.2	0	0	0	0	110.6	I186 C200 C203 V207	I186-T205 HydrophobicContact CB-CG2 4.3Å; I186-T205 HydrophobicContact CD1-CG2 3.84Å; I186-T205 HydrophobicContact CG1-CG2 4.09Å; C200-T205 VanDerWaalsContact CB-O 3.24Å; C200-T205 WeakPolarHBondContact CB-O 3.33Å; C200-T205 PolarHBondContact N-O 2.87Å; C203-T205 PolarHBondContact O-N 2.8Å; C203-T205 PolarHBondContact SG-OG1 2.71Å; T205-V207 PolarHBondContact O-N 3.1Å
206	L	87.6	Confident	86.4	Confident	58 Å²	58	53.4 Å²	53.4	30%	0.304	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.8	127.7	179.9	-177.6	64.1	0	0	0	111.6	G204 L216 L227 L230	G204-L206 PolarHBondContact O-N 3.35Å; L206-L216 HydrophobicContact CD2-CD1 3.89Å; L206-L227 HydrophobicContact CD2-CD1 3.54Å; L206-L230 HydrophobicContact CD1-CB 4.15Å; L206-L230 HydrophobicContact CD1-CD1 4.43Å
207	V	89.6	Confident	86.1	Confident	5 Å²	5	59.3 Å²	59.3	3%	0.03	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	118.6	176	-176.8	0	0	0	0	108.6	N182 C184 V191 S197 G198 C200 T205	N182-V207 HydrophobicContact CB-CG1 3.73Å; C184-V207 HydrophobicContact CB-CG2 3.75Å; V191-V207 HydrophobicContact CB-CG1 4Å; V191-V207 HydrophobicContact CG2-CB 4.06Å; V191-V207 HydrophobicContact CG2-CG1 3.81Å; V191-V207 HydrophobicContact CG2-CG2 4.09Å; S197-V207 CarbonylContact C-O 3.51Å; S197-V207 VanDerWaalsContact C-O 3.29Å; S197-V207 VanDerWaalsContact CA-O 3.25Å; S197-V207 WeakPolarHBondContact CA-O 3.47Å; G198-V207 PolarHBondContact N-O 3.49Å; G198-V207 PolarHBondContact O-N 3.26Å; C200-V207 HydrophobicContact CB-CG2 4.02Å; T205-V207 PolarHBondContact O-N 3.1Å
208	C	89.1	Confident	85.9	Confident	7 Å²	7	66.1 Å²	66.1	5%	0.047	34%	0.338	C	S	.	.			trans	-118.2	159.5	-174.7	-69.5	0	0	0	0	111.6	N182 E212 Q213 L216	N182-C208 VanDerWaalsContact CB-O 3.29Å; N182-C208 WeakPolarHBondContact CB-O 3.22Å; N182-C208 PolarHBondContact ND2-O 2.86Å; C208-E212 HydrophobicContact CB-CB 3.86Å; C208-Q213 HydrophobicContact CB-CB 4.21Å; C208-L216 VanDerWaalsContact SG-CD1 3.58Å
209	T	89.4	Confident	85.3	Confident	46 Å²	46	72.3 Å²	72.3	28%	0.282	37%	0.371	S	S	.	.			trans	-61.8	159.1	160.3	61.8	0	0	0	0	110.3	I181 E211 E212 Q213	I181-T209 HydrophobicContact CG2-CG2 3.95Å; T209-E211 VanDerWaalsContact C-N 3.29Å; T209-E211 PolarHBondContact O-N 2.99Å; T209-E212 WeakPolarHBondContact CB-OE2 3.4Å; T209-E212 WeakPolarHBondContact CG2-OE2 3.47Å; T209-E212 PolarHBondContact N-OE2 2.78Å; T209-E212 PolarHBondContact O-N 3.38Å; T209-E212 WeakPolarHBondContact OG1-CB 3.32Å; T209-E212 VanDerWaalsContact OG1-CD 3.24Å; T209-E212 VanDerWaalsContact OG1-CG 3.26Å; T209-E212 WeakPolarHBondContact OG1-CG 3.08Å; T209-E212 PolarHBondContact OG1-N 3.39Å; T209-E212 PolarHBondContact OG1-OE2 3.41Å; T209-Q213 WeakPolarHBondContact O-CB 3.39Å; T209-Q213 PolarHBondContact O-N 2.94Å
210	H	85.5	Confident	85.2	Confident	135 Å²	135	72.9 Å²	72.9	63%	0.625	38%	0.376	S	S	*	.	H	α-helix	trans	-56.7	-42.5	178.4	-169.8	-2.6	0	0	0	112	Q213 D214	H210-Q213 PolarHBondContact O-N 3.22Å; H210-D214 IonicContact CE1-OD1 2.87Å; H210-D214 PolarHBondContact CE1-OD1 2.81Å; H210-D214 IonicContact ND1-OD1 2.7Å; H210-D214 PolarHBondContact ND1-OD1 2.96Å; H210-D214 VanDerWaalsContact ND1-OD1 3.07Å; H210-D214 VanDerWaalsContact O-CB 3.28Å; H210-D214 WeakPolarHBondContact O-CB 3.4Å; H210-D214 PolarHBondContact O-N 3.14Å
211	E	86.1	Confident	84.9	Confident	160 Å²	160	78.6 Å²	78.6	75%	0.748	41%	0.406	S	S	*	.	H	α-helix	trans	-63.1	-43.4	178.7	-63.6	174.1	-148.3	0	0	112.7	T209 D214 I215	T209-E211 VanDerWaalsContact C-N 3.29Å; T209-E211 PolarHBondContact O-N 2.99Å; E211-D214 WeakPolarHBondContact O-CB 3.35Å; E211-I215 WeakPolarHBondContact O-CD1 3.36Å; E211-I215 VanDerWaalsContact O-CG1 3.3Å; E211-I215 WeakPolarHBondContact O-CG1 3.47Å; E211-I215 PolarHBondContact O-N 3.34Å; E211-I215 VanDerWaalsContact O-N 3.07Å
212	E	86.8	Confident	84.7	Confident	31 Å²	31	81.5 Å²	81.5	15%	0.145	42%	0.415	C	S	.	.	H	α-helix	trans	-66.6	-40.2	174.3	-72.1	164.4	134.2	0	0	111.7	S197 C208 T209 I215 L216 L226	S197-E212 WeakPolarHBondContact CB-OE1 3.36Å; S197-E212 WeakPolarHBondContact CB-OE2 3.23Å; S197-E212 VanDerWaalsContact OG-CD 3.31Å; S197-E212 PolarHBondContact OG-OE1 3.2Å; S197-E212 PolarHBondContact OG-OE2 2.94Å; C208-E212 HydrophobicContact CB-CB 3.86Å; T209-E212 WeakPolarHBondContact CB-OE2 3.4Å; T209-E212 WeakPolarHBondContact CG2-OE2 3.47Å; T209-E212 PolarHBondContact N-OE2 2.78Å; T209-E212 PolarHBondContact O-N 3.38Å; T209-E212 WeakPolarHBondContact OG1-CB 3.32Å; T209-E212 VanDerWaalsContact OG1-CD 3.24Å; T209-E212 VanDerWaalsContact OG1-CG 3.26Å; T209-E212 WeakPolarHBondContact OG1-CG 3.08Å; T209-E212 PolarHBondContact OG1-N 3.39Å; T209-E212 PolarHBondContact OG1-OE2 3.41Å; E212-I215 WeakPolarHBondContact O-CB 3.45Å; E212-I215 PolarHBondContact O-N 3.11Å; E212-I215 VanDerWaalsContact O-N 3.15Å; E212-L216 WeakPolarHBondContact O-CG 3.42Å; E212-L216 PolarHBondContact O-N 2.88Å; E212-L226 HydrophobicContact CB-CD2 4.02Å; E212-L226 HydrophobicContact CG-CD1 4.47Å; E212-L226 HydrophobicContact CG-CD2 4.14Å
213	Q	85.1	Confident	84.7	Confident	67 Å²	67	74.5 Å²	74.5	31%	0.313	39%	0.385	S	S	.	.	H	α-helix	trans	-65.6	-40.3	179	-171	169	3.7	0	0	111.5	N182 C208 T209 H210 I215 L216 Q217	N182-Q213 PolarHBondContact ND2-OE1 3.43Å; C208-Q213 HydrophobicContact CB-CB 4.21Å; T209-Q213 WeakPolarHBondContact O-CB 3.39Å; T209-Q213 PolarHBondContact O-N 2.94Å; H210-Q213 PolarHBondContact O-N 3.22Å; Q213-I215 VanDerWaalsContact C-N 3.31Å; Q213-I215 PolarHBondContact O-N 3.07Å; Q213-L216 WeakPolarHBondContact O-CB 3.28Å; Q213-L216 PolarHBondContact O-N 3.28Å; Q213-Q217 WeakPolarHBondContact O-CG 3.34Å; Q213-Q217 PolarHBondContact O-N 2.87Å
214	D	85.1	Confident	84.4	Confident	44 Å²	44	77.2 Å²	77.2	24%	0.235	39%	0.392	C	S	.	.	H	α-helix	trans	-59.2	-38.3	169.3	-103.6	54	0	0	0	112.6	H210 E211 R218	H210-D214 IonicContact CE1-OD1 2.87Å; H210-D214 PolarHBondContact CE1-OD1 2.81Å; H210-D214 IonicContact ND1-OD1 2.7Å; H210-D214 PolarHBondContact ND1-OD1 2.96Å; H210-D214 VanDerWaalsContact ND1-OD1 3.07Å; H210-D214 VanDerWaalsContact O-CB 3.28Å; H210-D214 WeakPolarHBondContact O-CB 3.4Å; H210-D214 PolarHBondContact O-N 3.14Å; E211-D214 WeakPolarHBondContact O-CB 3.35Å; D214-R218 WeakPolarHBondContact O-CG 3.5Å; D214-R218 PolarHBondContact O-NH1 2.94Å; D214-R218 IonicContact OD2-CZ 2.62Å; D214-R218 IonicContact OD2-NH1 2.77Å; D214-R218 IonicContact OD2-NH2 3.69Å; D214-R218 PolarHBondContact OD2-NH2 2.81Å
215	I	85.2	Confident	84.6	Confident	71 Å²	71	82.3 Å²	82.3	36%	0.364	40%	0.4	S	S	.	.	H	α-helix	trans	-70.6	-38.7	174.4	-69.7	163.3	0	0	0	110.3	E211 E212 Q213 R218 S223 L226	E211-I215 WeakPolarHBondContact O-CD1 3.36Å; E211-I215 VanDerWaalsContact O-CG1 3.3Å; E211-I215 WeakPolarHBondContact O-CG1 3.47Å; E211-I215 PolarHBondContact O-N 3.34Å; E211-I215 VanDerWaalsContact O-N 3.07Å; E212-I215 WeakPolarHBondContact O-CB 3.45Å; E212-I215 PolarHBondContact O-N 3.11Å; E212-I215 VanDerWaalsContact O-N 3.15Å; Q213-I215 VanDerWaalsContact C-N 3.31Å; Q213-I215 PolarHBondContact O-N 3.07Å; I215-R218 PolarHBondContact O-N 3.47Å; I215-S223 WeakPolarHBondContact O-CB 3.31Å; I215-L226 HydrophobicContact CB-CD2 3.96Å; I215-L226 HydrophobicContact CG2-CD2 3.7Å
216	L	82.8	Confident	84.5	Confident	31 Å²	31	82.1 Å²	82.1	16%	0.162	40%	0.397	C	S	.	.	H	α-helix	trans	-61.7	-48.2	176.6	-71.4	170.2	0	0	0	112.1	L206 C208 E212 Q213 R218 D219 L227	L206-L216 HydrophobicContact CD2-CD1 3.89Å; C208-L216 VanDerWaalsContact SG-CD1 3.58Å; E212-L216 WeakPolarHBondContact O-CG 3.42Å; E212-L216 PolarHBondContact O-N 2.88Å; Q213-L216 WeakPolarHBondContact O-CB 3.28Å; Q213-L216 PolarHBondContact O-N 3.28Å; L216-R218 PolarHBondContact O-N 3.15Å; L216-D219 PolarHBondContact O-N 3.18Å; L216-L227 HydrophobicContact CD2-CB 3.81Å; L216-L227 HydrophobicContact CD2-CD1 4.22Å
217	Q	81.1	Confident	84.2	Confident	137 Å²	137	82.3 Å²	82.3	64%	0.64	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-12.3	178.8	-72.9	178	10	0	0	115.4	Q213	Q213-Q217 WeakPolarHBondContact O-CG 3.34Å; Q213-Q217 PolarHBondContact O-N 2.87Å
218	R	84.9	Confident	83.9	Confident	158 Å²	158	88.1 Å²	88.1	60%	0.596	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.3	2	-178.2	-67.2	176.3	-171.8	109.4	2.4	114	D214 I215 L216 S220	D214-R218 WeakPolarHBondContact O-CG 3.5Å; D214-R218 PolarHBondContact O-NH1 2.94Å; D214-R218 IonicContact OD2-CZ 2.62Å; D214-R218 IonicContact OD2-NH1 2.77Å; D214-R218 IonicContact OD2-NH2 3.69Å; D214-R218 PolarHBondContact OD2-NH2 2.81Å; I215-R218 PolarHBondContact O-N 3.47Å; L216-R218 PolarHBondContact O-N 3.15Å; R218-S220 PolarHBondContact O-N 3.07Å
219	D	75.1	Confident	83.7	Confident	133 Å²	133	95.6 Å²	95.6	71%	0.711	45%	0.454	S	S	*	.			trans	44.7	24.4	173.2	-75.4	-35.3	0	0	0	117.5	L216 S223	L216-D219 PolarHBondContact O-N 3.18Å; D219-S223 WeakPolarHBondContact CA-OG 3.41Å
220	S	87.3	Confident	83.4	Confident	55 Å²	55	93.9 Å²	93.9	39%	0.385	44%	0.444	S	S	.	.			trans	-76.9	161.6	-178.2	-175.8	0	0	0	0	112.2	R218 K222 S223 Q224	R218-S220 PolarHBondContact O-N 3.07Å; S220-K222 CarbonylContact O-C 3.53Å; S220-K222 PolarHBondContact O-N 3.15Å; S220-K222 PolarHBondContact OG-N 3.34Å; S220-S223 PolarHBondContact N-OG 3.2Å; S220-S223 WeakPolarHBondContact O-CA 3.49Å; S220-S223 WeakPolarHBondContact O-CB 3.3Å; S220-S223 PolarHBondContact O-N 3.32Å; S220-S223 PolarHBondContact O-OG 3.43Å; S220-Q224 PolarHBondContact O-N 3.33Å; S220-Q224 VanDerWaalsContact O-N 3.14Å
221	N	80.5	Confident	83	Confident	124 Å²	124	92.9 Å²	92.9	66%	0.663	44%	0.441	S	S	*	.	H	α-helix	trans	-52.9	-19.4	164	-74.1	-39.4	0	0	0	113.6	K225	N221-K225 WeakPolarHBondContact O-CD 3.49Å; N221-K225 VanDerWaalsContact O-CG 3.31Å; N221-K225 WeakPolarHBondContact O-CG 3.47Å
222	K	82.4	Confident	82.1	Confident	161 Å²	161	88 Å²	88	70%	0.7	42%	0.424	S	S	*	.	H	α-helix	trans	-75.3	-40.4	168.5	-67.5	-178.2	178.7	178.7	0	112.8	S220 K225 L226	S220-K222 CarbonylContact O-C 3.53Å; S220-K222 PolarHBondContact O-N 3.15Å; S220-K222 PolarHBondContact OG-N 3.34Å; K222-K225 PolarHBondContact O-N 3.33Å; K222-L226 PolarHBondContact O-N 2.9Å
223	S	82.1	Confident	80.7	Confident	4 Å²	4	89.2 Å²	89.2	3%	0.028	45%	0.445	C	S	.	.	H	α-helix	trans	-68.2	-43.1	-179.1	81.4	0	0	0	0	111.7	I215 D219 S220 K225 L226 L227	I215-S223 WeakPolarHBondContact O-CB 3.31Å; D219-S223 WeakPolarHBondContact CA-OG 3.41Å; S220-S223 PolarHBondContact N-OG 3.2Å; S220-S223 WeakPolarHBondContact O-CA 3.49Å; S220-S223 WeakPolarHBondContact O-CB 3.3Å; S220-S223 PolarHBondContact O-N 3.32Å; S220-S223 PolarHBondContact O-OG 3.43Å; S223-K225 VanDerWaalsContact C-N 3.29Å; S223-K225 PolarHBondContact O-N 3.14Å; S223-L226 WeakPolarHBondContact O-CB 3.47Å; S223-L226 PolarHBondContact O-N 3.03Å; S223-L226 VanDerWaalsContact O-N 3.15Å; S223-L227 WeakPolarHBondContact O-CB 3.46Å; S223-L227 PolarHBondContact O-N 3.26Å
224	Q	80.1	Confident	79	Confident	102 Å²	102	90.8 Å²	90.8	48%	0.477	46%	0.459	S	S	.	.	H	α-helix	trans	-63.2	-34.7	177.1	-62	-175	5	0	0	112.5	S220 K228	S220-Q224 PolarHBondContact O-N 3.33Å; S220-Q224 VanDerWaalsContact O-N 3.14Å; Q224-K228 WeakPolarHBondContact O-CG 3.3Å; Q224-K228 PolarHBondContact O-N 3.41Å; Q224-K228 VanDerWaalsContact O-N 3.14Å
225	K	85.4	Confident	77.1	Confident	160 Å²	160	96 Å²	96	70%	0.696	48%	0.482	S	S	*	.	H	α-helix	trans	-70.4	-39.6	173.8	-74.1	178.3	-179.3	-174.9	0	112.1	N221 K222 S223 K229	N221-K225 WeakPolarHBondContact O-CD 3.49Å; N221-K225 VanDerWaalsContact O-CG 3.31Å; N221-K225 WeakPolarHBondContact O-CG 3.47Å; K222-K225 PolarHBondContact O-N 3.33Å; S223-K225 VanDerWaalsContact C-N 3.29Å; S223-K225 PolarHBondContact O-N 3.14Å; K225-K229 PolarHBondContact O-N 2.98Å
226	L	83.6	Confident	75.2	Confident	35 Å²	35	100.9 Å²	100.9	18%	0.183	51%	0.509	C	S	.	.	H	α-helix	trans	-62.9	-52.3	173.3	178.7	61.5	0	0	0	110.7	E212 I215 K222 S223 K228 K229 L230	E212-L226 HydrophobicContact CB-CD2 4.02Å; E212-L226 HydrophobicContact CG-CD1 4.47Å; E212-L226 HydrophobicContact CG-CD2 4.14Å; I215-L226 HydrophobicContact CB-CD2 3.96Å; I215-L226 HydrophobicContact CG2-CD2 3.7Å; K222-L226 PolarHBondContact O-N 2.9Å; S223-L226 WeakPolarHBondContact O-CB 3.47Å; S223-L226 PolarHBondContact O-N 3.03Å; S223-L226 VanDerWaalsContact O-N 3.15Å; L226-K228 VanDerWaalsContact C-N 3.34Å; L226-K228 PolarHBondContact O-N 2.83Å; L226-K229 WeakPolarHBondContact O-CA 3.34Å; L226-K229 WeakPolarHBondContact O-CB 3.29Å; L226-K229 PolarHBondContact O-N 2.64Å; L226-L230 HydrophobicContact CD1-CD1 4.05Å; L226-L230 HydrophobicContact CD1-CD2 4.24Å; L226-L230 HydrophobicContact CD1-CG 4.02Å; L226-L230 HydrophobicContact CG-CD1 4Å; L226-L230 HydrophobicContact CG-CG 4.3Å; L226-L230 WeakPolarHBondContact O-CG 3.34Å; L226-L230 PolarHBondContact O-N 2.68Å
227	L	81.6	Confident	73.1	Confident	63 Å²	63	104.5 Å²	104.5	33%	0.33	54%	0.537	S	S	.	.	H	α-helix	trans	-52.5	-49.5	179.1	-177.8	60.5	0	0	0	111.9	L206 L216 S223 K229 L230 M231	L206-L227 HydrophobicContact CD2-CD1 3.54Å; L216-L227 HydrophobicContact CD2-CB 3.81Å; L216-L227 HydrophobicContact CD2-CD1 4.22Å; S223-L227 WeakPolarHBondContact O-CB 3.46Å; S223-L227 PolarHBondContact O-N 3.26Å; L227-K229 VanDerWaalsContact C-N 3.34Å; L227-K229 PolarHBondContact O-N 3.33Å; L227-L230 PolarHBondContact O-N 3.45Å; L227-M231 HydrophobicContact CD1-CG 4.14Å; L227-M231 HydrophobicContact CD1-SD 3.71Å; L227-M231 HydrophobicContact CG-SD 3.94Å; L227-M231 WeakPolarHBondContact O-CG 3.26Å; L227-M231 PolarHBondContact O-N 3.34Å
228	K	82.5	Confident	70.9	Confident	127 Å²	127	101.7 Å²	101.7	55%	0.552	55%	0.545	S	S	*	.	H	α-helix	trans	-57.6	-44.7	175.9	-74.9	179.5	178.4	-174.3	0	112.1	Q224 L226 L230 M231 S232	Q224-K228 WeakPolarHBondContact O-CG 3.3Å; Q224-K228 PolarHBondContact O-N 3.41Å; Q224-K228 VanDerWaalsContact O-N 3.14Å; L226-K228 VanDerWaalsContact C-N 3.34Å; L226-K228 PolarHBondContact O-N 2.83Å; K228-L230 VanDerWaalsContact C-N 3.34Å; K228-L230 PolarHBondContact O-N 3.4Å; K228-M231 PolarHBondContact O-N 3.35Å; K228-S232 VanDerWaalsContact O-CB 3.29Å; K228-S232 WeakPolarHBondContact O-CB 3.36Å; K228-S232 PolarHBondContact O-N 2.84Å; K228-S232 PolarHBondContact O-OG 3.17Å
229	K	84.8	Confident	68.7	Low	163 Å²	163	103.1 Å²	103.1	71%	0.709	56%	0.555	S	S	*	*	H	α-helix	trans	-65.6	-31.6	177.8	-172.5	-177.6	177.3	-171.7	0	113.5	K225 L226 L227	K225-K229 PolarHBondContact O-N 2.98Å; L226-K229 WeakPolarHBondContact O-CA 3.34Å; L226-K229 WeakPolarHBondContact O-CB 3.29Å; L226-K229 PolarHBondContact O-N 2.64Å; L227-K229 VanDerWaalsContact C-N 3.34Å; L227-K229 PolarHBondContact O-N 3.33Å
230	L	82.6	Confident	66.7	Low	11 Å²	11	102.5 Å²	102.5	6%	0.058	56%	0.556	C	S	.	*	H	α-helix	trans	-79.8	-29.8	177.5	-60.6	-178.1	0	0	0	112.4	P199 L206 L226 L227 K228	P199-L230 WeakPolarHBondContact CD-O 2.93Å; L206-L230 HydrophobicContact CD1-CB 4.15Å; L206-L230 HydrophobicContact CD1-CD1 4.43Å; L226-L230 HydrophobicContact CD1-CD1 4.05Å; L226-L230 HydrophobicContact CD1-CD2 4.24Å; L226-L230 HydrophobicContact CD1-CG 4.02Å; L226-L230 HydrophobicContact CG-CD1 4Å; L226-L230 HydrophobicContact CG-CG 4.3Å; L226-L230 WeakPolarHBondContact O-CG 3.34Å; L226-L230 PolarHBondContact O-N 2.68Å; L227-L230 PolarHBondContact O-N 3.45Å; K228-L230 VanDerWaalsContact C-N 3.34Å; K228-L230 PolarHBondContact O-N 3.4Å
231	M	77.6	Confident	64.4	Low	113 Å²	113	107 Å²	107	56%	0.557	58%	0.576	S	S	*	*	H	α-helix	trans	-84.9	-35.5	177.8	-67.5	-177.4	71.4	0	0	113.4	L227 K228 G233	L227-M231 HydrophobicContact CD1-CG 4.14Å; L227-M231 HydrophobicContact CD1-SD 3.71Å; L227-M231 HydrophobicContact CG-SD 3.94Å; L227-M231 WeakPolarHBondContact O-CG 3.26Å; L227-M231 PolarHBondContact O-N 3.34Å; K228-M231 PolarHBondContact O-N 3.35Å; M231-G233 PolarHBondContact O-N 2.88Å
232	S	66.8	Low	62.4	Low	57 Å²	57	107.9 Å²	107.9	40%	0.399	58%	0.579	S	S	.	*	G	3₁₀ helix	trans	-70.4	1	-178.4	74.2	0	0	0	0	114.5	K228 V234 E235	K228-S232 VanDerWaalsContact O-CB 3.29Å; K228-S232 WeakPolarHBondContact O-CB 3.36Å; K228-S232 PolarHBondContact O-N 2.84Å; K228-S232 PolarHBondContact O-OG 3.17Å; S232-V234 PolarHBondContact O-N 3.23Å; S232-V234 VanDerWaalsContact O-N 3.17Å; S232-E235 WeakPolarHBondContact CA-OE1 3.46Å; S232-E235 WeakPolarHBondContact CB-OE1 3.4Å; S232-E235 PolarHBondContact O-N 2.96Å
233	G	57.7	Low	60.2	Low	58 Å²	58	104.6 Å²	104.6	60%	0.598	58%	0.576	S	S	*	*	G	3₁₀ helix	trans	-68.6	-2.7	175.1	0	0	0	0	0	114.8	M231	M231-G233 PolarHBondContact O-N 2.88Å
234	V	51	Low	58.4	Low	100 Å²	100	109.6 Å²	109.6	61%	0.606	61%	0.607	S	S	*	*	G	3₁₀ helix	trans	-97.6	-12.3	179.1	-173.5	0	0	0	0	112.1	P199 S232 N236	P199-V234 HydrophobicContact CG-CG2 4.05Å; S232-V234 PolarHBondContact O-N 3.23Å; S232-V234 VanDerWaalsContact O-N 3.17Å; V234-N236 VanDerWaalsContact C-N 3.31Å; V234-N236 PolarHBondContact O-N 3.44Å
235	E	45.2	Very low	56.7	Low	152 Å²	152	113.3 Å²	113.3	71%	0.71	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.7	55.3	-165	-65.1	179.3	-129.2	0	0	114.5	S232	S232-E235 WeakPolarHBondContact CA-OE1 3.46Å; S232-E235 WeakPolarHBondContact CB-OE1 3.4Å; S232-E235 PolarHBondContact O-N 2.96Å
236	N	45	Very low	54.5	Low	174 Å²	174	111.5 Å²	111.5	93%	0.93	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.5	11.5	166.6	-102.8	-10.4	0	0	0	113.5	V234	V234-N236 VanDerWaalsContact C-N 3.31Å; V234-N236 PolarHBondContact O-N 3.44Å
237	S	38.5	Very low	52.8	Low	107 Å²	107	117 Å²	117	75%	0.748	65%	0.648	S	S	*	*	S	Bend	trans	-145.8	105	170.1	58.8	0	0	0	0	112.8
238	G	35.1	Very low	51.3	Low	78 Å²	78	120.4 Å²	120.4	80%	0.804	67%	0.666	S	S	*	*			trans	94.5	113.3	166.1	0	0	0	0	0	115.5
239	K	38.3	Very low	49.7	Very low	188 Å²	188	117.3 Å²	117.3	82%	0.817	66%	0.659	S	S	*	*			trans	-69	126.3	163.6	-82	-171.3	169.2	-164.7	0	110.4
240	V	32.9	Very low	48	Very low	121 Å²	121	116.7 Å²	116.7	73%	0.733	66%	0.658	S	S	*	*			trans	-140.5	112.3	150.2	-175.5	0	0	0	0	107.8	I242	V240-I242 HydrophobicContact CG1-CG1 4.14Å; V240-I242 PolarHBondContact O-N 3.19Å
241	D	39.4	Very low	46.6	Very low	148 Å²	148	122.5 Å²	122.5	79%	0.791	69%	0.685	S	S	*	*			trans	-73.6	95.4	-178.2	-65.1	-76.1	0	0	0	111.3
242	I	38.2	Very low	45.6	Very low	143 Å²	143	122.1 Å²	122.1	73%	0.733	68%	0.682	S	S	*	*			trans	-97.3	117.2	175	-62.4	-178.1	0	0	0	110.2	V240	V240-I242 HydrophobicContact CG1-CG1 4.14Å; V240-I242 PolarHBondContact O-N 3.19Å
243	S	35.6	Very low	45.4	Very low	92 Å²	92	124.4 Å²	124.4	64%	0.643	69%	0.689	S	S	*	*			trans	-67.6	140.5	-175.5	-169.2	0	0	0	0	112.8	K245	S243-K245 PolarHBondContact O-N 3.41Å
244	T	44.6	Very low	45.8	Very low	109 Å²	109	130.8 Å²	130.8	67%	0.669	70%	0.695	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.8	42.4	-167.1	45.6	0	0	0	0	114.4
245	K	44.2	Very low	46.7	Very low	181 Å²	181	131.2 Å²	131.2	79%	0.787	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.2	-26.7	177.4	-88.7	-172.4	170.5	-176.4	0	115.9	S243 L247	S243-K245 PolarHBondContact O-N 3.41Å; K245-L247 PolarHBondContact O-N 2.94Å
246	D	39.5	Very low	48.2	Very low	121 Å²	121	129.5 Å²	129.5	65%	0.647	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.8	31.7	-166.2	-58.6	-45.4	0	0	0	115.2	P249	D246-P249 WeakPolarHBondContact O-CD 3.4Å
247	L	48	Very low	49.9	Very low	150 Å²	150	123.4 Å²	123.4	79%	0.785	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.2	-11.9	-179.6	-72.8	174	0	0	0	115	K245	K245-L247 PolarHBondContact O-N 2.94Å
248	L	50.9	Low	52.2	Low	136 Å²	136	120 Å²	120	71%	0.712	64%	0.636	S	S	*	*	S	Bend	trans	-84.4	-33.1	178.4	-69.2	171.5	0	0	0	115.6	H250 Q251 E252	L248-H250 VanDerWaalsContact C-N 3.34Å; L248-H250 PolarHBondContact O-N 3.01Å; L248-Q251 PolarHBondContact O-N 3.06Å; L248-E252 PolarHBondContact O-N 2.81Å
249	P	48.1	Very low	54.7	Low	62 Å²	62	121.4 Å²	121.4	40%	0.403	62%	0.624	S	S	.	*	H	α-helix	trans	-58.8	-37.7	-179.9	-27.4	35.7	0	0	0	114.5	D246 Q251 E252 L253	D246-P249 WeakPolarHBondContact O-CD 3.4Å; P249-Q251 PolarHBondContact O-N 3Å; P249-E252 PolarHBondContact O-N 3.33Å; P249-L253 WeakPolarHBondContact O-CB 3.29Å; P249-L253 VanDerWaalsContact O-CG 3.23Å; P249-L253 WeakPolarHBondContact O-CG 3.45Å; P249-L253 PolarHBondContact O-N 3.46Å
250	H	49.4	Very low	57.3	Low	149 Å²	149	117 Å²	117	69%	0.69	61%	0.607	S	S	*	*	H	α-helix	trans	-66.5	-33.9	-174.7	-100.4	-67.7	0	0	0	113.8	L248 R254	L248-H250 VanDerWaalsContact C-N 3.34Å; L248-H250 PolarHBondContact O-N 3.01Å; H250-R254 WeakPolarHBondContact O-CB 3.48Å; H250-R254 PolarHBondContact O-N 2.88Å; H250-R254 VanDerWaalsContact O-N 3.1Å
251	Q	53.5	Low	60	Low	133 Å²	133	118.4 Å²	118.4	62%	0.621	60%	0.603	S	S	*	*	H	α-helix	trans	-74	-41.7	176.5	-171.8	166.2	-7	0	0	110.9	L248 P249 L253 R254 I255	L248-Q251 PolarHBondContact O-N 3.06Å; P249-Q251 PolarHBondContact O-N 3Å; Q251-L253 PolarHBondContact O-N 2.88Å; Q251-R254 PolarHBondContact O-N 3.04Å; Q251-I255 HydrophobicContact CG-CD1 4.11Å; Q251-I255 WeakPolarHBondContact O-CG1 3.42Å; Q251-I255 PolarHBondContact O-N 3.22Å
252	E	55.5	Low	62.5	Low	106 Å²	106	114.1 Å²	114.1	50%	0.495	59%	0.588	S	S	.	*	H	α-helix	trans	-59.9	-44.2	171.4	-77.8	-161.6	-174.2	0	0	112.6	L248 P249 R254 I255 K256	L248-E252 PolarHBondContact O-N 2.81Å; P249-E252 PolarHBondContact O-N 3.33Å; E252-R254 VanDerWaalsContact C-N 3.28Å; E252-R254 PolarHBondContact O-N 3.45Å; E252-I255 PolarHBondContact O-N 3.27Å; E252-K256 HydrophobicContact CB-CD 4.43Å; E252-K256 VanDerWaalsContact O-CB 3.29Å; E252-K256 WeakPolarHBondContact O-CB 3.46Å; E252-K256 VanDerWaalsContact O-CG 3.27Å; E252-K256 WeakPolarHBondContact O-CG 3.36Å; E252-K256 PolarHBondContact O-N 3.24Å; E252-K256 IonicContact OE2-NZ 3.87Å; E252-K256 PolarHBondContact OE2-NZ 3.15Å
253	L	62.3	Low	65.1	Low	104 Å²	104	110.9 Å²	110.9	55%	0.545	57%	0.572	S	S	.	*	H	α-helix	trans	-62.7	-35.5	177.9	-73.2	167.1	0	0	0	111.7	P249 Q251 S257	P249-L253 WeakPolarHBondContact O-CB 3.29Å; P249-L253 VanDerWaalsContact O-CG 3.23Å; P249-L253 WeakPolarHBondContact O-CG 3.45Å; P249-L253 PolarHBondContact O-N 3.46Å; Q251-L253 PolarHBondContact O-N 2.88Å; L253-S257 VanDerWaalsContact O-CB 3.32Å; L253-S257 WeakPolarHBondContact O-CB 3.29Å; L253-S257 PolarHBondContact O-N 2.94Å; L253-S257 PolarHBondContact O-OG 3.28Å
254	R	67.6	Low	67.8	Low	192 Å²	192	112.6 Å²	112.6	73%	0.725	57%	0.568	S	S	*	*	H	α-helix	trans	-70.2	-36.1	174.3	-164.1	172.3	-174.7	169.1	1.2	112.4	H250 Q251 E252 S257 G258	H250-R254 WeakPolarHBondContact O-CB 3.48Å; H250-R254 PolarHBondContact O-N 2.88Å; H250-R254 VanDerWaalsContact O-N 3.1Å; Q251-R254 PolarHBondContact O-N 3.04Å; E252-R254 VanDerWaalsContact C-N 3.28Å; E252-R254 PolarHBondContact O-N 3.45Å; R254-S257 PolarHBondContact O-OG 2.96Å; R254-G258 PolarHBondContact O-N 3.47Å
255	I	69.8	Low	69.9	Low	109 Å²	109	112.7 Å²	112.7	56%	0.559	56%	0.56	S	S	*	*	H	α-helix	trans	-71.5	-46.2	174.7	-67.8	164.5	0	0	0	110.8	Q251 E252 G258 L259	Q251-I255 HydrophobicContact CG-CD1 4.11Å; Q251-I255 WeakPolarHBondContact O-CG1 3.42Å; Q251-I255 PolarHBondContact O-N 3.22Å; E252-I255 PolarHBondContact O-N 3.27Å; I255-G258 CarbonylContact O-C 3.45Å; I255-G258 WeakPolarHBondContact O-CA 3.47Å; I255-G258 PolarHBondContact O-N 3.08Å; I255-G258 VanDerWaalsContact O-N 3.13Å; I255-L259 PolarHBondContact O-N 3.11Å
256	K	74.9	Confident	72.2	Confident	117 Å²	117	109 Å²	109	51%	0.509	54%	0.544	S	S	.	.	H	α-helix	trans	-61.9	-45.4	178.4	-74.3	165.1	175.2	167.9	0	111.7	E252 G258 L259 E260	E252-K256 HydrophobicContact CB-CD 4.43Å; E252-K256 VanDerWaalsContact O-CB 3.29Å; E252-K256 WeakPolarHBondContact O-CB 3.46Å; E252-K256 VanDerWaalsContact O-CG 3.27Å; E252-K256 WeakPolarHBondContact O-CG 3.36Å; E252-K256 PolarHBondContact O-N 3.24Å; E252-K256 IonicContact OE2-NZ 3.87Å; E252-K256 PolarHBondContact OE2-NZ 3.15Å; K256-G258 VanDerWaalsContact C-N 3.31Å; K256-G258 PolarHBondContact O-N 2.85Å; K256-L259 PolarHBondContact O-N 3.29Å; K256-E260 WeakPolarHBondContact O-CB 3.42Å; K256-E260 PolarHBondContact O-N 3.1Å
257	S	81.7	Confident	74.8	Confident	45 Å²	45	106.8 Å²	106.8	32%	0.315	53%	0.532	S	S	.	.	H	α-helix	trans	-70.7	-23.7	173.6	58.8	0	0	0	0	113.7	L253 R254 K261	L253-S257 VanDerWaalsContact O-CB 3.32Å; L253-S257 WeakPolarHBondContact O-CB 3.29Å; L253-S257 PolarHBondContact O-N 2.94Å; L253-S257 PolarHBondContact O-OG 3.28Å; R254-S257 PolarHBondContact O-OG 2.96Å; S257-K261 WeakPolarHBondContact O-CB 3.24Å; S257-K261 WeakPolarHBondContact O-CD 3.25Å; S257-K261 WeakPolarHBondContact O-CG 3.49Å; S257-K261 PolarHBondContact O-N 3.5Å
258	G	85.8	Confident	76.9	Confident	36 Å²	36	105.4 Å²	105.4	37%	0.371	52%	0.52	S	S	.	.	H	α-helix	trans	-67.9	-47.8	167.4	0	0	0	0	0	112.3	R254 I255 K256 K261 A262	R254-G258 PolarHBondContact O-N 3.47Å; I255-G258 CarbonylContact O-C 3.45Å; I255-G258 WeakPolarHBondContact O-CA 3.47Å; I255-G258 PolarHBondContact O-N 3.08Å; I255-G258 VanDerWaalsContact O-N 3.13Å; K256-G258 VanDerWaalsContact C-N 3.31Å; K256-G258 PolarHBondContact O-N 2.85Å; G258-K261 PolarHBondContact O-N 2.86Å; G258-A262 PolarHBondContact O-N 2.92Å
259	L	88.9	Confident	78.7	Confident	107 Å²	107	103.3 Å²	103.3	56%	0.56	51%	0.509	S	S	*	.	H	α-helix	trans	-61.5	-44	175.8	178.5	62.5	0	0	0	111.7	I255 K256 K261 A262 I263	I255-L259 PolarHBondContact O-N 3.11Å; K256-L259 PolarHBondContact O-N 3.29Å; L259-K261 VanDerWaalsContact C-N 3.34Å; L259-K261 PolarHBondContact O-N 2.95Å; L259-A262 WeakPolarHBondContact O-CB 3.3Å; L259-A262 PolarHBondContact O-N 2.81Å; L259-A262 VanDerWaalsContact O-N 3.14Å; L259-I263 HydrophobicContact CD1-CD1 4.2Å; L259-I263 HydrophobicContact CD1-CG1 4.41Å; L259-I263 HydrophobicContact CG-CD1 4.01Å; L259-I263 WeakPolarHBondContact O-CG1 3.44Å; L259-I263 PolarHBondContact O-N 3.04Å
260	E	91.7	Very high	80.5	Confident	97 Å²	97	104.1 Å²	104.1	45%	0.453	51%	0.509	S	S	.	.	H	α-helix	trans	-60.6	-41.7	176.2	-167.1	-159.6	146.9	0	0	111.9	K256 I263 K264	K256-E260 WeakPolarHBondContact O-CB 3.42Å; K256-E260 PolarHBondContact O-N 3.1Å; E260-I263 PolarHBondContact O-N 2.81Å; E260-K264 HydrophobicContact CG-CD 4.38Å; E260-K264 WeakPolarHBondContact O-CB 3.4Å; E260-K264 WeakPolarHBondContact O-CG 3.42Å; E260-K264 PolarHBondContact O-N 2.81Å; E260-K264 WeakPolarHBondContact OE1-CE 3.28Å; E260-K264 IonicContact OE1-NZ 2.62Å; E260-K264 PolarHBondContact OE1-NZ 2.65Å
261	K	91.4	Very high	82.2	Confident	149 Å²	149	101.1 Å²	101.1	65%	0.648	50%	0.496	S	S	*	.	H	α-helix	trans	-64.8	-39.2	173.1	-74.9	169.3	-176.3	177	0	112.1	S257 G258 L259 K264 H265	S257-K261 WeakPolarHBondContact O-CB 3.24Å; S257-K261 WeakPolarHBondContact O-CD 3.25Å; S257-K261 WeakPolarHBondContact O-CG 3.49Å; S257-K261 PolarHBondContact O-N 3.5Å; G258-K261 PolarHBondContact O-N 2.86Å; L259-K261 VanDerWaalsContact C-N 3.34Å; L259-K261 PolarHBondContact O-N 2.95Å; K261-K264 PolarHBondContact O-N 3.3Å; K261-H265 WeakPolarHBondContact O-CB 3.31Å; K261-H265 PolarHBondContact O-N 3.08Å
262	A	89.9	Confident	83.6	Confident	58 Å²	58	99 Å²	99	48%	0.479	49%	0.485	S	S	.	.	H	α-helix	trans	-65.9	-41	176.2	0	0	0	0	0	112.2	G258 L259 H265 K266	G258-A262 PolarHBondContact O-N 2.92Å; L259-A262 WeakPolarHBondContact O-CB 3.3Å; L259-A262 PolarHBondContact O-N 2.81Å; L259-A262 VanDerWaalsContact O-N 3.14Å; A262-H265 PolarHBondContact O-N 3.17Å; A262-K266 PolarHBondContact O-N 3.02Å
263	I	92.8	Very high	84.7	Confident	76 Å²	76	99.2 Å²	99.2	39%	0.39	49%	0.489	S	S	.	.	H	α-helix	trans	-63.1	-51.1	173.8	-68.4	165.9	0	0	0	110	L259 E260 H265 K266 D267	L259-I263 HydrophobicContact CD1-CD1 4.2Å; L259-I263 HydrophobicContact CD1-CG1 4.41Å; L259-I263 HydrophobicContact CG-CD1 4.01Å; L259-I263 WeakPolarHBondContact O-CG1 3.44Å; L259-I263 PolarHBondContact O-N 3.04Å; E260-I263 PolarHBondContact O-N 2.81Å; I263-H265 PolarHBondContact O-N 2.9Å; I263-K266 WeakPolarHBondContact O-CB 3.45Å; I263-K266 PolarHBondContact O-N 3.28Å; I263-D267 WeakPolarHBondContact CG2-OD2 3.36Å; I263-D267 PolarHBondContact O-N 2.72Å
264	K	92.4	Very high	85.4	Confident	128 Å²	128	102.7 Å²	102.7	56%	0.557	50%	0.495	S	S	*	.	H	α-helix	trans	-58.4	-32.9	175.5	-75.3	173.1	171.2	175.1	0	112.8	E260 K261 K268	E260-K264 HydrophobicContact CG-CD 4.38Å; E260-K264 WeakPolarHBondContact O-CB 3.4Å; E260-K264 WeakPolarHBondContact O-CG 3.42Å; E260-K264 PolarHBondContact O-N 2.81Å; E260-K264 WeakPolarHBondContact OE1-CE 3.28Å; E260-K264 IonicContact OE1-NZ 2.62Å; E260-K264 PolarHBondContact OE1-NZ 2.65Å; K261-K264 PolarHBondContact O-N 3.3Å; K264-K268 VanDerWaalsContact O-CB 3.25Å; K264-K268 WeakPolarHBondContact O-CB 3.48Å; K264-K268 PolarHBondContact O-N 3.4Å
265	H	89.1	Confident	85.3	Confident	111 Å²	111	95.4 Å²	95.4	51%	0.514	47%	0.472	S	S	.	.	H	α-helix	trans	-72.9	-42.2	173.8	-165.3	-94.7	0	0	0	112.4	K261 A262 I263 K268 L269	K261-H265 WeakPolarHBondContact O-CB 3.31Å; K261-H265 PolarHBondContact O-N 3.08Å; A262-H265 PolarHBondContact O-N 3.17Å; I263-H265 PolarHBondContact O-N 2.9Å; H265-K268 PolarHBondContact O-N 3.26Å; H265-L269 WeakPolarHBondContact O-CG 3.42Å; H265-L269 PolarHBondContact O-N 3.3Å
266	K	93.8	Very high	85.1	Confident	104 Å²	104	91.8 Å²	91.8	45%	0.452	46%	0.456	S	S	.	.	H	α-helix	trans	-58.3	-47.5	172.2	-179.3	-171.4	65.3	63	0	111.1	A262 I263 K268 L269 L270	A262-K266 PolarHBondContact O-N 3.02Å; I263-K266 WeakPolarHBondContact O-CB 3.45Å; I263-K266 PolarHBondContact O-N 3.28Å; K266-K268 VanDerWaalsContact C-N 3.34Å; K266-L269 PolarHBondContact O-N 3.35Å; K266-L269 VanDerWaalsContact O-N 3.13Å; K266-L270 HydrophobicContact CD-CD1 4.47Å; K266-L270 HydrophobicContact CG-CD1 4.04Å; K266-L270 HydrophobicContact CG-CG 4.5Å; K266-L270 WeakPolarHBondContact O-CG 3.49Å; K266-L270 PolarHBondContact O-N 3.33Å
267	D	93.3	Very high	84.2	Confident	74 Å²	74	92 Å²	92	40%	0.396	46%	0.462	S	S	.	.	H	α-helix	trans	-69.2	-35.1	-178.4	-63	-28	0	0	0	111.2	I263 L270 E271	I263-D267 WeakPolarHBondContact CG2-OD2 3.36Å; I263-D267 PolarHBondContact O-N 2.72Å; D267-L270 PolarHBondContact O-N 3.09Å; D267-E271 VanDerWaalsContact O-CB 3.3Å; D267-E271 WeakPolarHBondContact O-CB 3.39Å; D267-E271 PolarHBondContact O-N 3.5Å
268	K	91.4	Very high	83	Confident	121 Å²	121	99.8 Å²	99.8	53%	0.526	48%	0.484	S	S	.	.	H	α-helix	trans	-62	-41.5	167.6	-175.5	-179.6	178.5	-174.3	0	112.2	K264 H265 K266 E271 F272	K264-K268 VanDerWaalsContact O-CB 3.25Å; K264-K268 WeakPolarHBondContact O-CB 3.48Å; K264-K268 PolarHBondContact O-N 3.4Å; H265-K268 PolarHBondContact O-N 3.26Å; K266-K268 VanDerWaalsContact C-N 3.34Å; K268-E271 PolarHBondContact O-N 3.11Å; K268-F272 HydrophobicContact CD-CE2 4.46Å; K268-F272 HydrophobicContact CG-CD2 3.94Å; K268-F272 HydrophobicContact CG-CE2 4Å; K268-F272 WeakPolarHBondContact O-CB 3.42Å; K268-F272 VanDerWaalsContact O-CD2 3.22Å; K268-F272 WeakPolarHBondContact O-CD2 3.43Å; K268-F272 PolarHBondContact O-N 2.81Å
269	L	89.1	Confident	81.6	Confident	91 Å²	91	104 Å²	104	48%	0.476	49%	0.489	S	S	.	.	H	α-helix	trans	-66	-44.6	176.7	-73.6	174	0	0	0	111.7	H265 K266 E271 F272 D273	H265-L269 WeakPolarHBondContact O-CG 3.42Å; H265-L269 PolarHBondContact O-N 3.3Å; K266-L269 PolarHBondContact O-N 3.35Å; K266-L269 VanDerWaalsContact O-N 3.13Å; L269-E271 VanDerWaalsContact C-N 3.33Å; L269-E271 PolarHBondContact O-N 3.48Å; L269-F272 CarbonylContact O-C 3.51Å; L269-F272 WeakPolarHBondContact O-CA 3.47Å; L269-F272 WeakPolarHBondContact O-CB 3.49Å; L269-F272 PolarHBondContact O-N 3.41Å; L269-F272 VanDerWaalsContact O-N 3.11Å; L269-D273 PolarHBondContact O-N 3.2Å
270	L	86.4	Confident	80	Confident	80 Å²	80	103.7 Å²	103.7	42%	0.419	49%	0.491	S	S	.	.	H	α-helix	trans	-63	-37.9	175.6	-69.5	169.1	0	0	0	112.2	K266 D267 D273 R274	K266-L270 HydrophobicContact CD-CD1 4.47Å; K266-L270 HydrophobicContact CG-CD1 4.04Å; K266-L270 HydrophobicContact CG-CG 4.5Å; K266-L270 WeakPolarHBondContact O-CG 3.49Å; K266-L270 PolarHBondContact O-N 3.33Å; D267-L270 PolarHBondContact O-N 3.09Å; L270-D273 PolarHBondContact O-N 3.4Å; L270-R274 VanDerWaalsContact O-CG 3.28Å; L270-R274 WeakPolarHBondContact O-CG 3.39Å; L270-R274 PolarHBondContact O-N 3.1Å
271	E	84.2	Confident	78	Confident	85 Å²	85	104.3 Å²	104.3	40%	0.397	49%	0.494	S	S	.	.	H	α-helix	trans	-73.1	-30.8	173.7	-161.7	57.2	-145.8	0	0	111.8	D267 K268 L269 R274 T275	D267-E271 VanDerWaalsContact O-CB 3.3Å; D267-E271 WeakPolarHBondContact O-CB 3.39Å; D267-E271 PolarHBondContact O-N 3.5Å; K268-E271 PolarHBondContact O-N 3.11Å; L269-E271 VanDerWaalsContact C-N 3.33Å; L269-E271 PolarHBondContact O-N 3.48Å; E271-R274 WeakPolarHBondContact OE2-CD 3.21Å; E271-R274 IonicContact OE2-CZ 3.9Å; E271-R274 IonicContact OE2-NE 2.77Å; E271-R274 IonicContact OE2-NH1 3.72Å; E271-R274 PolarHBondContact OE2-NH1 2.94Å; E271-T275 HydrophobicContact CG-CG2 4.31Å; E271-T275 VanDerWaalsContact O-CB 3.27Å; E271-T275 WeakPolarHBondContact O-CB 3.25Å; E271-T275 VanDerWaalsContact O-CG2 3.25Å; E271-T275 WeakPolarHBondContact O-CG2 3.41Å; E271-T275 PolarHBondContact O-N 3.15Å; E271-T275 PolarHBondContact O-OG1 3.22Å
272	F	82.8	Confident	76.4	Confident	90 Å²	90	103.3 Å²	103.3	40%	0.395	50%	0.501	S	S	.	.	H	α-helix	trans	-63.5	-43.1	167.7	-95.6	-122.3	0	0	0	111	K268 L269 T275 S276 R279	K268-F272 HydrophobicContact CD-CE2 4.46Å; K268-F272 HydrophobicContact CG-CD2 3.94Å; K268-F272 HydrophobicContact CG-CE2 4Å; K268-F272 WeakPolarHBondContact O-CB 3.42Å; K268-F272 VanDerWaalsContact O-CD2 3.22Å; K268-F272 WeakPolarHBondContact O-CD2 3.43Å; K268-F272 PolarHBondContact O-N 2.81Å; L269-F272 CarbonylContact O-C 3.51Å; L269-F272 WeakPolarHBondContact O-CA 3.47Å; L269-F272 WeakPolarHBondContact O-CB 3.49Å; L269-F272 PolarHBondContact O-N 3.41Å; L269-F272 VanDerWaalsContact O-N 3.11Å; F272-T275 PolarHBondContact O-N 2.91Å; F272-T275 PolarHBondContact O-OG1 2.93Å; F272-S276 WeakPolarHBondContact O-CA 3.23Å; F272-S276 VanDerWaalsContact O-CB 3.24Å; F272-S276 WeakPolarHBondContact O-CB 3.43Å; F272-S276 PolarHBondContact O-N 3.29Å; F272-R279 PolarHBondContact O-NH2 3.39Å
273	D	78.6	Confident	74.6	Confident	109 Å²	109	105.2 Å²	105.2	58%	0.583	50%	0.502	S	S	*	.	H	α-helix	trans	-64.3	-47.5	176.5	-72	-17.5	0	0	0	111.2	L269 L270 T275 S276	L269-D273 PolarHBondContact O-N 3.2Å; L270-D273 PolarHBondContact O-N 3.4Å; D273-T275 PolarHBondContact O-N 2.75Å; D273-S276 WeakPolarHBondContact O-CB 3.48Å; D273-S276 PolarHBondContact O-N 2.89Å; D273-S276 PolarHBondContact O-OG 3.05Å
274	R	77.3	Confident	72.2	Confident	177 Å²	177	105.9 Å²	105.9	67%	0.668	51%	0.506	S	S	*	.	H	α-helix	trans	-57.3	-44.4	174.6	-72.8	164.6	173.5	175.8	-1.7	113.3	L270 E271	L270-R274 VanDerWaalsContact O-CG 3.28Å; L270-R274 WeakPolarHBondContact O-CG 3.39Å; L270-R274 PolarHBondContact O-N 3.1Å; E271-R274 WeakPolarHBondContact OE2-CD 3.21Å; E271-R274 IonicContact OE2-CZ 3.9Å; E271-R274 IonicContact OE2-NE 2.77Å; E271-R274 IonicContact OE2-NH1 3.72Å; E271-R274 PolarHBondContact OE2-NH1 2.94Å
275	T	67	Low	70.3	Confident	40 Å²	40	106 Å²	106	25%	0.245	51%	0.513	C	S	.	.	H	α-helix	trans	-84	-13.2	-178.9	58.8	0	0	0	0	113.2	E271 F272 D273 I277 R278 R279	E271-T275 HydrophobicContact CG-CG2 4.31Å; E271-T275 VanDerWaalsContact O-CB 3.27Å; E271-T275 WeakPolarHBondContact O-CB 3.25Å; E271-T275 VanDerWaalsContact O-CG2 3.25Å; E271-T275 WeakPolarHBondContact O-CG2 3.41Å; E271-T275 PolarHBondContact O-N 3.15Å; E271-T275 PolarHBondContact O-OG1 3.22Å; F272-T275 PolarHBondContact O-N 2.91Å; F272-T275 PolarHBondContact O-OG1 2.93Å; D273-T275 PolarHBondContact O-N 2.75Å; T275-I277 VanDerWaalsContact C-N 3.34Å; T275-I277 PolarHBondContact O-N 2.95Å; T275-R278 CarbonylContact O-C 3.59Å; T275-R278 WeakPolarHBondContact O-CA 3.21Å; T275-R278 PolarHBondContact O-N 3.15Å; T275-R279 VanDerWaalsContact O-CG 3.29Å; T275-R279 WeakPolarHBondContact O-CG 3.23Å; T275-R279 PolarHBondContact O-N 2.92Å; T275-R279 PolarHBondContact OG1-NE 3.36Å; T275-R279 VanDerWaalsContact OG1-NE 3.08Å
276	S	64.9	Low	68.4	Low	33 Å²	33	108.4 Å²	108.4	23%	0.231	52%	0.524	C	S	.	.	H	α-helix	trans	-51.6	-54.9	-174.8	62.8	0	0	0	0	110.6	F272 D273 R278 R279 T280	F272-S276 WeakPolarHBondContact O-CA 3.23Å; F272-S276 VanDerWaalsContact O-CB 3.24Å; F272-S276 WeakPolarHBondContact O-CB 3.43Å; F272-S276 PolarHBondContact O-N 3.29Å; D273-S276 WeakPolarHBondContact O-CB 3.48Å; D273-S276 PolarHBondContact O-N 2.89Å; D273-S276 PolarHBondContact O-OG 3.05Å; S276-R278 VanDerWaalsContact C-N 3.27Å; S276-R278 PolarHBondContact O-N 3.42Å; S276-R279 CarbonylContact O-C 3.6Å; S276-R279 PolarHBondContact O-N 3.18Å; S276-T280 PolarHBondContact O-N 2.97Å; S276-T280 PolarHBondContact O-OG1 2.89Å
277	I	55.7	Low	66.4	Low	122 Å²	122	106.6 Å²	106.6	63%	0.626	53%	0.525	S	S	*	.	H	α-helix	trans	-52	-44.2	176.3	-57.3	174	0	0	0	111.1	T275 R279 Q281	T275-I277 VanDerWaalsContact C-N 3.34Å; T275-I277 PolarHBondContact O-N 2.95Å; I277-R279 PolarHBondContact O-N 3.43Å; I277-Q281 WeakPolarHBondContact O-CB 3.2Å; I277-Q281 PolarHBondContact O-N 3.48Å
278	R	56.3	Low	64.3	Low	208 Å²	208	107.5 Å²	107.5	79%	0.785	53%	0.529	S	S	*	.	H	α-helix	trans	-75.2	-17.9	179.9	-69	-176.4	174.4	174.5	-2.8	115.4	T275 S276	T275-R278 CarbonylContact O-C 3.59Å; T275-R278 WeakPolarHBondContact O-CA 3.21Å; T275-R278 PolarHBondContact O-N 3.15Å; S276-R278 VanDerWaalsContact C-N 3.27Å; S276-R278 PolarHBondContact O-N 3.42Å
279	R	56.4	Low	62.2	Low	125 Å²	125	111 Å²	111	47%	0.472	54%	0.541	S	S	.	.	H	α-helix	trans	-114.7	-1.4	-178.6	72.3	-162.7	163.8	63	9.4	113.7	F272 T275 S276 I277	F272-R279 PolarHBondContact O-NH2 3.39Å; T275-R279 VanDerWaalsContact O-CG 3.29Å; T275-R279 WeakPolarHBondContact O-CG 3.23Å; T275-R279 PolarHBondContact O-N 2.92Å; T275-R279 PolarHBondContact OG1-NE 3.36Å; T275-R279 VanDerWaalsContact OG1-NE 3.08Å; S276-R279 CarbonylContact O-C 3.6Å; S276-R279 PolarHBondContact O-N 3.18Å; I277-R279 PolarHBondContact O-N 3.43Å
280	T	56.4	Low	60.2	Low	99 Å²	99	113.3 Å²	113.3	61%	0.607	55%	0.547	S	S	*	.	H	α-helix	trans	-117.7	1.4	163.8	67.5	0	0	0	0	112.2	S276 V282	S276-T280 PolarHBondContact O-N 2.97Å; S276-T280 PolarHBondContact O-OG1 2.89Å; T280-V282 VanDerWaalsContact C-N 3.27Å; T280-V282 PolarHBondContact O-N 3.27Å
281	Q	49.8	Very low	58.7	Low	110 Å²	110	111.8 Å²	111.8	51%	0.514	55%	0.546	S	S	.	.			trans	-62.8	97.3	155.6	176.9	170.7	-0.4	0	0	106.3	I277 I283	I277-Q281 WeakPolarHBondContact O-CB 3.2Å; I277-Q281 PolarHBondContact O-N 3.48Å; Q281-I283 PolarHBondContact O-N 3.15Å; Q281-I283 VanDerWaalsContact O-N 3.13Å
282	V	57.8	Low	57.3	Low	129 Å²	129	109.4 Å²	109.4	78%	0.782	54%	0.539	S	S	*	.			trans	-61.1	112.1	160.3	178	0	0	0	0	104.8	T280 D284	T280-V282 VanDerWaalsContact C-N 3.27Å; T280-V282 PolarHBondContact O-N 3.27Å; V282-D284 PolarHBondContact O-N 2.94Å; V282-D284 VanDerWaalsContact O-N 3.12Å
283	I	50.3	Low	55.9	Low	98 Å²	98	109.6 Å²	109.6	50%	0.503	54%	0.544	S	S	.	.			trans	-68.6	107.7	167.7	-63	171.5	0	0	0	104.7	Q281 D285 D288	Q281-I283 PolarHBondContact O-N 3.15Å; Q281-I283 VanDerWaalsContact O-N 3.13Å; I283-D285 PolarHBondContact O-N 3.1Å; I283-D288 HydrophobicContact CG2-CB 4.28Å
284	D	44.1	Very low	54.9	Low	90 Å²	90	108.7 Å²	108.7	48%	0.481	55%	0.546	S	S	.	.			trans	-82.7	103.4	167.4	-177.1	-6.5	0	0	0	106	V282 E286 S287 D288	V282-D284 PolarHBondContact O-N 2.94Å; V282-D284 VanDerWaalsContact O-N 3.12Å; D284-E286 PolarHBondContact O-N 2.91Å; D284-E286 VanDerWaalsContact O-N 3.09Å; D284-E286 PolarHBondContact OD1-N 2.93Å; D284-S287 WeakPolarHBondContact CB-OG 3.3Å; D284-S287 WeakPolarHBondContact O-CA 3.34Å; D284-S287 WeakPolarHBondContact O-CB 3.34Å; D284-S287 PolarHBondContact O-N 3.5Å; D284-S287 PolarHBondContact O-OG 3.43Å; D284-D288 PolarHBondContact O-N 2.98Å
285	D	50.8	Low	54.4	Low	131 Å²	131	102.6 Å²	102.6	70%	0.701	53%	0.527	S	S	*	.	H	α-helix	trans	-58.1	-22.8	-173.9	-71.8	-32.6	0	0	0	112.4	I283 S287	I283-D285 PolarHBondContact O-N 3.1Å; D285-S287 VanDerWaalsContact C-N 3.34Å
286	E	50.4	Low	54.3	Low	160 Å²	160	108.7 Å²	108.7	75%	0.748	55%	0.553	S	S	*	*	H	α-helix	trans	-74.7	-24	173.9	-63.2	-168.6	170.8	0	0	112.6	D284 F290	D284-E286 PolarHBondContact O-N 2.91Å; D284-E286 VanDerWaalsContact O-N 3.09Å; D284-E286 PolarHBondContact OD1-N 2.93Å; E286-F290 WeakPolarHBondContact O-CD2 3.25Å
287	S	50.8	Low	54.4	Low	67 Å²	67	118.5 Å²	118.5	47%	0.469	59%	0.585	S	S	.	*	H	α-helix	trans	-89.4	-46	-179.3	72.3	0	0	0	0	113.4	D284 D285 Y289 F290	D284-S287 WeakPolarHBondContact CB-OG 3.3Å; D284-S287 WeakPolarHBondContact O-CA 3.34Å; D284-S287 WeakPolarHBondContact O-CB 3.34Å; D284-S287 PolarHBondContact O-N 3.5Å; D284-S287 PolarHBondContact O-OG 3.43Å; D285-S287 VanDerWaalsContact C-N 3.34Å; S287-Y289 PolarHBondContact O-N 3.26Å; S287-F290 PolarHBondContact O-N 3.41Å; S287-F290 VanDerWaalsContact O-N 3.16Å
288	D	49.1	Very low	55.1	Low	92 Å²	92	114.5 Å²	114.5	49%	0.492	56%	0.564	S	S	.	*	H	α-helix	trans	-71	-15.6	-178.7	-96.7	7.3	0	0	0	112.5	I283 D284 F290	I283-D288 HydrophobicContact CG2-CB 4.28Å; D284-D288 PolarHBondContact O-N 2.98Å; D288-F290 PolarHBondContact O-N 3.15Å
289	Y	47.7	Very low	56.2	Low	194 Å²	194	106.7 Å²	106.7	76%	0.761	54%	0.542	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.9	-22.5	172.1	-154.2	-92.1	0	0	0	113.1	S287	S287-Y289 PolarHBondContact O-N 3.26Å
290	F	48.2	Very low	57.3	Low	140 Å²	140	108.5 Å²	108.5	61%	0.614	55%	0.553	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.6	51.7	-179.3	-66.3	-77.2	0	0	0	112.4	E286 S287 D288 S292	E286-F290 WeakPolarHBondContact O-CD2 3.25Å; S287-F290 PolarHBondContact O-N 3.41Å; S287-F290 VanDerWaalsContact O-N 3.16Å; D288-F290 PolarHBondContact O-N 3.15Å; F290-S292 VanDerWaalsContact C-N 3.34Å; F290-S292 PolarHBondContact O-N 3.37Å
291	A	54.4	Low	58.4	Low	48 Å²	48	108.4 Å²	108.4	40%	0.397	55%	0.549	S	S	.	.			trans	-63.3	86.8	174.3	0	0	0	0	0	112.6	D293 S294 N295	A291-D293 PolarHBondContact O-N 3.37Å; A291-S294 WeakPolarHBondContact CB-OG 3.34Å; A291-S294 PolarHBondContact O-N 3Å; A291-S294 PolarHBondContact O-OG 3.39Å; A291-S294 VanDerWaalsContact O-OG 3.04Å; A291-N295 PolarHBondContact O-N 3.37Å
292	S	54	Low	59.8	Low	36 Å²	36	104.4 Å²	104.4	25%	0.252	53%	0.53	S	S	.	.	T	Hydrogen-bonded Turn	trans	-38.6	-44.9	-178.5	-61.5	0	0	0	0	114.3	F290	F290-S292 VanDerWaalsContact C-N 3.34Å; F290-S292 PolarHBondContact O-N 3.37Å
293	D	53.4	Low	60.8	Low	93 Å²	93	100.7 Å²	100.7	50%	0.497	50%	0.502	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-38.6	-179.2	-74.4	-14.1	0	0	0	114.2	A291 Q307	A291-D293 PolarHBondContact O-N 3.37Å; D293-Q307 WeakPolarHBondContact OD1-CG 3.3Å; D293-Q307 PolarHBondContact OD1-NE2 2.84Å
294	S	59	Low	62.2	Low	90 Å²	90	101.5 Å²	101.5	63%	0.629	50%	0.504	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.5	-10.6	-174.5	71.1	0	0	0	0	113.8	A291 Q296	A291-S294 WeakPolarHBondContact CB-OG 3.34Å; A291-S294 PolarHBondContact O-N 3Å; A291-S294 PolarHBondContact O-OG 3.39Å; A291-S294 VanDerWaalsContact O-OG 3.04Å; S294-Q296 PolarHBondContact O-N 3.32Å
295	N	65.9	Low	64	Low	50 Å²	50	99.7 Å²	99.7	27%	0.267	50%	0.495	S	S	.	.			trans	-61	97.3	-178.5	-83.3	-39	0	0	0	111.3	A291 W297 L298 R303	A291-N295 PolarHBondContact O-N 3.37Å; N295-W297 PolarHBondContact O-N 2.96Å; N295-W297 VanDerWaalsContact O-N 3.09Å; N295-L298 HydrophobicContact CB-CD1 3.94Å; N295-L298 HydrophobicContact CB-CG 4.11Å; N295-L298 PolarHBondContact O-N 2.98Å; N295-R303 VanDerWaalsContact O-CZ 3.31Å; N295-R303 PolarHBondContact O-NE 2.67Å; N295-R303 VanDerWaalsContact O-NE 3.11Å; N295-R303 PolarHBondContact O-NH2 3.26Å
296	Q	65.4	Low	65.1	Low	167 Å²	167	94.6 Å²	94.6	78%	0.78	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-25.4	-178	-171.8	173.4	6.1	0	0	113.1	S294 R303	S294-Q296 PolarHBondContact O-N 3.32Å; Q296-R303 VanDerWaalsContact C-NH2 3.29Å; Q296-R303 PolarHBondContact O-NH2 2.98Å
297	W	66.3	Low	66.4	Low	239 Å²	239	91 Å²	91	91%	0.905	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.5	-14.9	-174.8	-58.4	100.7	0	0	0	115.5	N295	N295-W297 PolarHBondContact O-N 2.96Å; N295-W297 VanDerWaalsContact O-N 3.09Å
298	L	71.3	Confident	68	Low	38 Å²	38	95.2 Å²	95.2	20%	0.199	46%	0.461	C	S	.	.	S	Bend	trans	-79.6	149.9	175.1	-65.3	175.8	0	0	0	111.8	N295 E302 R303 L306 I356	N295-L298 HydrophobicContact CB-CD1 3.94Å; N295-L298 HydrophobicContact CB-CG 4.11Å; N295-L298 PolarHBondContact O-N 2.98Å; L298-E302 HydrophobicContact CB-CB 4.46Å; L298-E302 HydrophobicContact CD2-CB 4.48Å; L298-R303 HydrophobicContact CB-CG 3.86Å; L298-R303 HydrophobicContact CD1-CG 4.22Å; L298-R303 PolarHBondContact O-NH1 3.43Å; L298-R303 PolarHBondContact O-NH2 2.94Å; L298-L306 HydrophobicContact CD1-CD1 3.63Å; L298-I356 HydrophobicContact CD2-CG2 4.16Å
299	S	79	Confident	69.4	Low	45 Å²	45	93.3 Å²	93.3	32%	0.315	45%	0.447	S	S	.	.			trans	-69.3	168.6	168.3	74.9	0	0	0	0	111.4	E302 R303	S299-E302 WeakPolarHBondContact CA-OE2 3.41Å; S299-E302 WeakPolarHBondContact CB-OE2 2.98Å; S299-E302 PolarHBondContact N-OE2 2.69Å; S299-E302 WeakPolarHBondContact OG-CG 3.47Å; S299-E302 PolarHBondContact OG-N 2.94Å; S299-E302 PolarHBondContact OG-OE2 3.17Å; S299-R303 PolarHBondContact O-N 2.87Å; S299-R303 PolarHBondContact O-NH1 3.35Å
300	K	79.8	Confident	70.7	Confident	163 Å²	163	88.2 Å²	88.2	71%	0.709	43%	0.43	S	S	*	.	H	α-helix	trans	-62.9	-44.5	175.8	-66.7	-172.1	177.5	-173.9	0	111.8	E302 R303 E304	K300-E302 PolarHBondContact O-N 3.29Å; K300-R303 PolarHBondContact O-N 2.96Å; K300-E304 WeakPolarHBondContact O-CG 3.23Å; K300-E304 PolarHBondContact O-N 2.99Å
301	L	79.8	Confident	72	Confident	97 Å²	97	87.5 Å²	87.5	51%	0.508	43%	0.429	S	S	.	.	H	α-helix	trans	-62.6	-43.4	-179	-173.1	65	0	0	0	111.6	E304 T305	L301-E304 PolarHBondContact O-N 3.37Å; L301-T305 WeakPolarHBondContact O-CG2 3.47Å; L301-T305 PolarHBondContact O-N 2.99Å; L301-T305 PolarHBondContact O-OG1 3.11Å
302	E	78.4	Confident	73.1	Confident	25 Å²	25	89.7 Å²	89.7	12%	0.117	43%	0.431	C	S	.	.	H	α-helix	trans	-64.3	-41.9	177.9	-71.9	146.1	173.4	0	0	112	L298 S299 K300 T305 L306 N362	L298-E302 HydrophobicContact CB-CB 4.46Å; L298-E302 HydrophobicContact CD2-CB 4.48Å; S299-E302 WeakPolarHBondContact CA-OE2 3.41Å; S299-E302 WeakPolarHBondContact CB-OE2 2.98Å; S299-E302 PolarHBondContact N-OE2 2.69Å; S299-E302 WeakPolarHBondContact OG-CG 3.47Å; S299-E302 PolarHBondContact OG-N 2.94Å; S299-E302 PolarHBondContact OG-OE2 3.17Å; K300-E302 PolarHBondContact O-N 3.29Å; E302-T305 WeakPolarHBondContact CA-OG1 3.38Å; E302-T305 PolarHBondContact O-N 3.44Å; E302-T305 PolarHBondContact O-OG1 3.27Å; E302-L306 WeakPolarHBondContact O-CG 3.29Å; E302-L306 PolarHBondContact O-N 2.96Å; E302-N362 PolarHBondContact OE1-ND2 3.01Å
303	R	78.1	Confident	73.8	Confident	52 Å²	52	89.4 Å²	89.4	20%	0.196	43%	0.426	C	S	.	.	H	α-helix	trans	-61.2	-46.7	173	-69.2	-168	-160.5	83.1	2.9	111.9	N295 Q296 L298 S299 K300 T305 L306 Q307	N295-R303 VanDerWaalsContact O-CZ 3.31Å; N295-R303 PolarHBondContact O-NE 2.67Å; N295-R303 VanDerWaalsContact O-NE 3.11Å; N295-R303 PolarHBondContact O-NH2 3.26Å; Q296-R303 VanDerWaalsContact C-NH2 3.29Å; Q296-R303 PolarHBondContact O-NH2 2.98Å; L298-R303 HydrophobicContact CB-CG 3.86Å; L298-R303 HydrophobicContact CD1-CG 4.22Å; L298-R303 PolarHBondContact O-NH1 3.43Å; L298-R303 PolarHBondContact O-NH2 2.94Å; S299-R303 PolarHBondContact O-N 2.87Å; S299-R303 PolarHBondContact O-NH1 3.35Å; K300-R303 PolarHBondContact O-N 2.96Å; R303-T305 VanDerWaalsContact C-N 3.27Å; R303-T305 PolarHBondContact O-N 3.34Å; R303-L306 PolarHBondContact O-N 3.01Å; R303-Q307 WeakPolarHBondContact O-CB 3.25Å; R303-Q307 WeakPolarHBondContact O-CG 3.38Å; R303-Q307 PolarHBondContact O-N 3.27Å
304	E	80.6	Confident	74.6	Confident	115 Å²	115	91.8 Å²	91.8	54%	0.537	43%	0.429	S	S	.	.	H	α-helix	trans	-60.5	-36.2	178	-72.5	165.2	-150.9	0	0	111.6	K300 L301 K308	K300-E304 WeakPolarHBondContact O-CG 3.23Å; K300-E304 PolarHBondContact O-N 2.99Å; L301-E304 PolarHBondContact O-N 3.37Å; E304-K308 WeakPolarHBondContact O-CB 3.29Å; E304-K308 PolarHBondContact O-N 3.48Å
305	T	80.8	Confident	75.4	Confident	51 Å²	51	94.2 Å²	94.2	31%	0.313	43%	0.43	S	S	.	.	H	α-helix	trans	-69.9	-40.2	173.4	53.7	0	0	0	0	113.6	L301 E302 R303 R309	L301-T305 WeakPolarHBondContact O-CG2 3.47Å; L301-T305 PolarHBondContact O-N 2.99Å; L301-T305 PolarHBondContact O-OG1 3.11Å; E302-T305 WeakPolarHBondContact CA-OG1 3.38Å; E302-T305 PolarHBondContact O-N 3.44Å; E302-T305 PolarHBondContact O-OG1 3.27Å; R303-T305 VanDerWaalsContact C-N 3.27Å; R303-T305 PolarHBondContact O-N 3.34Å; T305-R309 WeakPolarHBondContact O-CB 3.4Å; T305-R309 PolarHBondContact O-N 2.95Å; T305-R309 VanDerWaalsContact O-N 3.13Å
306	L	75.6	Confident	75.6	Confident	24 Å²	24	94.6 Å²	94.6	13%	0.126	43%	0.431	C	S	.	.	H	α-helix	trans	-66.3	-45.5	176.7	-74.7	171.8	0	0	0	111.6	L298 E302 R303 K308 R309 E310 I353 I356	L298-L306 HydrophobicContact CD1-CD1 3.63Å; E302-L306 WeakPolarHBondContact O-CG 3.29Å; E302-L306 PolarHBondContact O-N 2.96Å; R303-L306 PolarHBondContact O-N 3.01Å; L306-K308 PolarHBondContact O-N 2.93Å; L306-R309 PolarHBondContact O-N 2.96Å; L306-R309 VanDerWaalsContact O-N 3.16Å; L306-E310 PolarHBondContact O-N 3.42Å; L306-I353 HydrophobicContact CD2-CG1 4.27Å; L306-I356 HydrophobicContact CD1-CD1 4.09Å; L306-I356 HydrophobicContact CD2-CD1 3.65Å; L306-I356 HydrophobicContact CG-CD1 3.59Å
307	Q	77.9	Confident	75.5	Confident	85 Å²	85	92.3 Å²	92.3	40%	0.397	42%	0.416	S	S	.	.	H	α-helix	trans	-57.3	-47.8	177.6	-77.3	176.6	-10.9	0	0	111.6	D293 R303 R309 E310 E311	D293-Q307 WeakPolarHBondContact OD1-CG 3.3Å; D293-Q307 PolarHBondContact OD1-NE2 2.84Å; R303-Q307 WeakPolarHBondContact O-CB 3.25Å; R303-Q307 WeakPolarHBondContact O-CG 3.38Å; R303-Q307 PolarHBondContact O-N 3.27Å; Q307-R309 VanDerWaalsContact C-N 3.3Å; Q307-R309 PolarHBondContact O-N 3.5Å; Q307-E310 PolarHBondContact O-N 3.5Å; Q307-E311 WeakPolarHBondContact O-CB 3.48Å; Q307-E311 PolarHBondContact O-N 2.91Å
308	K	82.7	Confident	75.3	Confident	156 Å²	156	87.7 Å²	87.7	68%	0.678	40%	0.404	S	S	*	.	H	α-helix	trans	-62	-38	177.7	-171.8	-179.4	178.1	-171.6	0	112.3	E304 L306 E312	E304-K308 WeakPolarHBondContact O-CB 3.29Å; E304-K308 PolarHBondContact O-N 3.48Å; L306-K308 PolarHBondContact O-N 2.93Å; K308-E312 WeakPolarHBondContact O-CB 3.45Å; K308-E312 PolarHBondContact O-N 2.88Å
309	R	78.8	Confident	75.3	Confident	51 Å²	51	88.7 Å²	88.7	19%	0.192	42%	0.417	C	S	.	.	H	α-helix	trans	-72.1	-37.7	178.1	-173.4	59.3	172.5	172.6	1	112.4	T305 L306 Q307 E312 L313 D350	T305-R309 WeakPolarHBondContact O-CB 3.4Å; T305-R309 PolarHBondContact O-N 2.95Å; T305-R309 VanDerWaalsContact O-N 3.13Å; L306-R309 PolarHBondContact O-N 2.96Å; L306-R309 VanDerWaalsContact O-N 3.16Å; Q307-R309 VanDerWaalsContact C-N 3.3Å; Q307-R309 PolarHBondContact O-N 3.5Å; R309-E312 VanDerWaalsContact CD-OE2 3.29Å; R309-E312 WeakPolarHBondContact CD-OE2 2.87Å; R309-E312 IonicContact CZ-OE2 3.65Å; R309-E312 IonicContact NE-OE2 3.84Å; R309-E312 IonicContact NH1-OE2 2.75Å; R309-E312 PolarHBondContact NH1-OE2 2.95Å; R309-E312 PolarHBondContact O-N 3.33Å; R309-L313 HydrophobicContact CG-CD1 4.2Å; R309-L313 WeakPolarHBondContact O-CB 3.3Å; R309-L313 VanDerWaalsContact O-CG 3.28Å; R309-L313 WeakPolarHBondContact O-CG 3.45Å; R309-L313 PolarHBondContact O-N 3.01Å; R309-D350 IonicContact CZ-OD2 3.24Å; R309-D350 VanDerWaalsContact CZ-OD2 3.24Å; R309-D350 IonicContact NE-OD1 3.59Å; R309-D350 IonicContact NE-OD2 2.75Å; R309-D350 PolarHBondContact NE-OD2 2.8Å; R309-D350 IonicContact NH2-OD1 2.83Å; R309-D350 IonicContact NH2-OD2 2.72Å; R309-D350 PolarHBondContact NH2-OD2 3.36Å
310	E	74.6	Confident	74.4	Confident	87 Å²	87	90 Å²	90	41%	0.407	43%	0.426	S	S	.	.	H	α-helix	trans	-64.6	-42.3	172.9	-169	-173.9	147.3	0	0	111.3	L306 Q307 L313 R314	L306-E310 PolarHBondContact O-N 3.42Å; Q307-E310 PolarHBondContact O-N 3.5Å; E310-L313 PolarHBondContact O-N 2.74Å; E310-R314 WeakPolarHBondContact O-CB 3.17Å; E310-R314 PolarHBondContact O-N 2.87Å
311	E	76.1	Confident	73.4	Confident	126 Å²	126	92.5 Å²	92.5	59%	0.589	43%	0.431	S	S	*	.	H	α-helix	trans	-60.6	-46.6	175.8	-171.4	163.4	-127.9	0	0	111.4	Q307 R314 E315	Q307-E311 WeakPolarHBondContact O-CB 3.48Å; Q307-E311 PolarHBondContact O-N 2.91Å; E311-R314 CarbonylContact O-C 3.54Å; E311-R314 WeakPolarHBondContact O-CA 3.26Å; E311-R314 WeakPolarHBondContact O-CB 3.36Å; E311-R314 PolarHBondContact O-N 2.76Å; E311-E315 WeakPolarHBondContact O-CG 3.28Å; E311-E315 PolarHBondContact O-N 3.3Å
312	E	78.1	Confident	72.3	Confident	94 Å²	94	95.7 Å²	95.7	44%	0.439	45%	0.448	S	S	.	.	H	α-helix	trans	-58.6	-48.4	173.6	-178.5	176.5	-126.5	0	0	112.4	K308 R309 R314 E315 L316	K308-E312 WeakPolarHBondContact O-CB 3.45Å; K308-E312 PolarHBondContact O-N 2.88Å; R309-E312 VanDerWaalsContact CD-OE2 3.29Å; R309-E312 WeakPolarHBondContact CD-OE2 2.87Å; R309-E312 IonicContact CZ-OE2 3.65Å; R309-E312 IonicContact NE-OE2 3.84Å; R309-E312 IonicContact NH1-OE2 2.75Å; R309-E312 PolarHBondContact NH1-OE2 2.95Å; R309-E312 PolarHBondContact O-N 3.33Å; E312-R314 PolarHBondContact O-N 3.36Å; E312-E315 PolarHBondContact O-N 3.34Å; E312-L316 HydrophobicContact CG-CD1 4.44Å; E312-L316 WeakPolarHBondContact O-CB 3.3Å; E312-L316 WeakPolarHBondContact O-CG 3.46Å; E312-L316 PolarHBondContact O-N 3.22Å
313	L	69.3	Low	71.4	Confident	29 Å²	29	98.9 Å²	98.9	15%	0.152	47%	0.473	C	S	.	.	H	α-helix	trans	-64.5	-21.6	175.3	-70.8	168.6	0	0	0	112.9	R309 E310 R317 Y345	R309-L313 HydrophobicContact CG-CD1 4.2Å; R309-L313 WeakPolarHBondContact O-CB 3.3Å; R309-L313 VanDerWaalsContact O-CG 3.28Å; R309-L313 WeakPolarHBondContact O-CG 3.45Å; R309-L313 PolarHBondContact O-N 3.01Å; E310-L313 PolarHBondContact O-N 2.74Å; L313-R317 WeakPolarHBondContact O-CG 3.36Å; L313-R317 PolarHBondContact O-N 3.31Å; L313-R317 PolarHBondContact O-NE 3.36Å; L313-Y345 HydrophobicContact CD2-CD2 4.04Å
314	R	68.8	Low	70.7	Confident	144 Å²	144	102.2 Å²	102.2	54%	0.543	49%	0.489	S	S	.	.	H	α-helix	trans	-86.7	-38.7	177.1	-177.5	175.5	-173	164.8	1	111.7	E310 E311 E312 R317 H318	E310-R314 WeakPolarHBondContact O-CB 3.17Å; E310-R314 PolarHBondContact O-N 2.87Å; E311-R314 CarbonylContact O-C 3.54Å; E311-R314 WeakPolarHBondContact O-CA 3.26Å; E311-R314 WeakPolarHBondContact O-CB 3.36Å; E311-R314 PolarHBondContact O-N 2.76Å; E312-R314 PolarHBondContact O-N 3.36Å; R314-R317 WeakPolarHBondContact O-CB 3.46Å; R314-R317 PolarHBondContact O-N 3.13Å; R314-H318 PolarHBondContact O-CD2 3.48Å; R314-H318 PolarHBondContact O-N 2.85Å
315	E	75.1	Confident	70	Confident	140 Å²	140	104 Å²	104	65%	0.654	50%	0.495	S	S	*	.	H	α-helix	trans	-62.1	-43.7	169.6	-70.9	-161.6	145.9	0	0	110.8	E311 E312 R317 H318 A319	E311-E315 WeakPolarHBondContact O-CG 3.28Å; E311-E315 PolarHBondContact O-N 3.3Å; E312-E315 PolarHBondContact O-N 3.34Å; E315-R317 VanDerWaalsContact C-N 3.32Å; E315-R317 PolarHBondContact O-N 3.44Å; E315-H318 CarbonylContact O-C 3.45Å; E315-H318 PolarHBondContact O-N 3.46Å; E315-H318 VanDerWaalsContact O-N 3.12Å; E315-A319 PolarHBondContact O-N 2.97Å
316	L	71	Confident	69.5	Low	58 Å²	58	105 Å²	105	30%	0.304	50%	0.501	S	S	.	.	H	α-helix	trans	-58.6	-40	173.6	-74.4	168.6	0	0	0	112.8	E312 A319	E312-L316 HydrophobicContact CG-CD1 4.44Å; E312-L316 WeakPolarHBondContact O-CB 3.3Å; E312-L316 WeakPolarHBondContact O-CG 3.46Å; E312-L316 PolarHBondContact O-N 3.22Å; L316-A319 WeakPolarHBondContact O-CB 3.42Å
317	R	62.8	Low	69.4	Low	119 Å²	119	107.1 Å²	107.1	45%	0.449	52%	0.515	S	S	.	.	H	α-helix	trans	-65.4	-36.2	174	-85	176	-91.1	-165.7	-1.4	113.5	L313 R314 E315 Y345	L313-R317 WeakPolarHBondContact O-CG 3.36Å; L313-R317 PolarHBondContact O-N 3.31Å; L313-R317 PolarHBondContact O-NE 3.36Å; R314-R317 WeakPolarHBondContact O-CB 3.46Å; R314-R317 PolarHBondContact O-N 3.13Å; E315-R317 VanDerWaalsContact C-N 3.32Å; E315-R317 PolarHBondContact O-N 3.44Å; R317-Y345 WeakPolarHBondContact CD-OH 3.42Å; R317-Y345 HydrophobicContact CG-CD2 4.04Å; R317-Y345 HydrophobicContact CG-CE1 4.26Å; R317-Y345 HydrophobicContact CG-CE2 3.55Å; R317-Y345 VanDerWaalsContact NE-CE2 3.32Å
318	H	63.7	Low	69.4	Low	143 Å²	143	107.6 Å²	107.6	66%	0.662	52%	0.519	S	S	*	.	H	α-helix	trans	-96.7	-0.1	-177.8	-67.7	-58.1	0	0	0	114	R314 E315 S320	R314-H318 PolarHBondContact O-CD2 3.48Å; R314-H318 PolarHBondContact O-N 2.85Å; E315-H318 CarbonylContact O-C 3.45Å; E315-H318 PolarHBondContact O-N 3.46Å; E315-H318 VanDerWaalsContact O-N 3.12Å; H318-S320 PolarHBondContact O-N 3.31Å
319	A	71	Confident	69.3	Low	58 Å²	58	103.4 Å²	103.4	48%	0.479	51%	0.505	S	S	.	.			trans	-55	129.5	177	0	0	0	0	0	111.2	E315 L316 R321	E315-A319 PolarHBondContact O-N 2.97Å; L316-A319 WeakPolarHBondContact O-CB 3.42Å; A319-R321 PolarHBondContact O-N 2.9Å
320	S	59.2	Low	68.9	Low	72 Å²	72	109.5 Å²	109.5	50%	0.503	53%	0.533	S	S	.	.			trans	-64.1	128.6	-171.9	-176.9	0	0	0	0	111.8	H318 L322 S323	H318-S320 PolarHBondContact O-N 3.31Å; S320-L322 PolarHBondContact O-N 3.49Å; S320-S323 PolarHBondContact O-N 3.18Å; S320-S323 PolarHBondContact O-OG 3.05Å; S320-S323 VanDerWaalsContact O-OG 3.05Å
321	R	59	Low	68.9	Low	216 Å²	216	109.7 Å²	109.7	82%	0.815	55%	0.549	S	S	*	.	G	3₁₀ helix	trans	-57.8	-12.9	177.7	-62.3	175.6	71.3	120.7	-2.9	113.7	A319 S323 K324	A319-R321 PolarHBondContact O-N 2.9Å; R321-S323 VanDerWaalsContact C-N 3.26Å; R321-S323 PolarHBondContact O-N 2.86Å; R321-K324 PolarHBondContact O-N 2.99Å
322	L	56.8	Low	68.6	Low	164 Å²	164	105.7 Å²	105.7	86%	0.859	54%	0.541	S	S	*	.	G	3₁₀ helix	trans	-66.5	-18.4	173.4	-72.2	166.8	0	0	0	114.3	S320 K324	S320-L322 PolarHBondContact O-N 3.49Å; L322-K324 VanDerWaalsContact C-N 3.31Å
323	S	59.5	Low	68.5	Low	92 Å²	92	112.1 Å²	112.1	64%	0.643	56%	0.562	S	S	*	*	G	3₁₀ helix	trans	-78.8	-12.5	177.1	62.5	0	0	0	0	113.9	S320 R321 K325	S320-S323 PolarHBondContact O-N 3.18Å; S320-S323 PolarHBondContact O-OG 3.05Å; S320-S323 VanDerWaalsContact O-OG 3.05Å; R321-S323 VanDerWaalsContact C-N 3.26Å; R321-S323 PolarHBondContact O-N 2.86Å; S323-K325 PolarHBondContact O-N 3.36Å; S323-K325 VanDerWaalsContact O-N 3.17Å
324	K	63.3	Low	68.2	Low	123 Å²	123	117.5 Å²	117.5	54%	0.535	58%	0.584	S	S	.	*			trans	-70.8	109.5	-176.7	-67.8	-160	170.9	-151.2	0	111.4	R321 L322	R321-K324 PolarHBondContact O-N 2.99Å; L322-K324 VanDerWaalsContact C-N 3.31Å
325	K	66.5	Low	68.6	Low	151 Å²	151	115.9 Å²	115.9	66%	0.657	59%	0.585	S	S	*	*			trans	-76.8	134.9	167.7	-65.4	172.8	-174.9	169	0	109.5	S323 E338	S323-K325 PolarHBondContact O-N 3.36Å; S323-K325 VanDerWaalsContact O-N 3.17Å; K325-E338 WeakPolarHBondContact CB-OE2 3.24Å; K325-E338 WeakPolarHBondContact CD-OE2 3.33Å
326	V	70.6	Confident	68	Low	72 Å²	72	114.2 Å²	114.2	44%	0.436	58%	0.58	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-125.9	122.5	173.3	178.4	0	0	0	0	106.9	I328 I335 E337	V326-I328 HydrophobicContact CG1-CG1 4.3Å; V326-I335 HydrophobicContact CG1-CG2 3.38Å; V326-E337 HydrophobicContact CG1-CG 4.43Å
327	T	72.7	Confident	67.6	Low	69 Å²	69	118.3 Å²	118.3	42%	0.423	60%	0.597	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-100.7	134	177.6	65.3	0	0	0	0	109.6	L336	T327-L336 PolarHBondContact N-O 2.77Å; T327-L336 PolarHBondContact O-N 3.24Å; T327-L336 WeakPolarHBondContact OG1-CB 3.43Å; T327-L336 PolarHBondContact OG1-O 3.47Å
328	I	78.5	Confident	67.4	Low	95 Å²	95	118.6 Å²	118.6	49%	0.487	60%	0.604	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-120.4	110.8	-172.9	-57.6	176.7	0	0	0	108.1	V326 F330 I335	V326-I328 HydrophobicContact CG1-CG1 4.3Å; I328-F330 HydrophobicContact CB-CE2 4.18Å; I328-F330 HydrophobicContact CB-CZ 4.46Å; I328-F330 HydrophobicContact CG2-CD2 4.3Å; I328-F330 HydrophobicContact CG2-CE1 4.31Å; I328-F330 HydrophobicContact CG2-CE2 3.96Å; I328-F330 HydrophobicContact CG2-CZ 3.97Å; I328-F330 WeakPolarHBondContact O-CD2 3.48Å; I328-F330 PolarHBondContact O-N 3.23Å; I328-I335 HydrophobicContact CG1-CG1 4.49Å
329	D	78.9	Confident	66.8	Low	69 Å²	69	120 Å²	120	37%	0.369	61%	0.611	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-86.5	104.8	172.5	174.9	15.1	0	0	0	109.9	A331 G332 R333 K334	D329-A331 VanDerWaalsContact C-N 3.31Å; D329-A331 PolarHBondContact O-N 3.04Å; D329-A331 WeakPolarHBondContact OD1-CA 3.41Å; D329-A331 WeakPolarHBondContact OD1-CB 3.4Å; D329-A331 PolarHBondContact OD1-N 3.48Å; D329-G332 PolarHBondContact OD1-N 2.75Å; D329-G332 WeakPolarHBondContact OD2-CA 3.44Å; D329-G332 PolarHBondContact OD2-N 2.95Å; D329-R333 VanDerWaalsContact O-CA 3.3Å; D329-R333 WeakPolarHBondContact O-CA 3.36Å; D329-R333 PolarHBondContact O-N 3.02Å; D329-K334 PolarHBondContact N-O 2.79Å; D329-K334 PolarHBondContact O-N 3.23Å
330	F	71.1	Confident	66.1	Low	179 Å²	179	121.7 Å²	121.7	79%	0.785	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.1	-22.1	177.4	-68.1	-88.2	0	0	0	113.6	I328	I328-F330 HydrophobicContact CB-CE2 4.18Å; I328-F330 HydrophobicContact CB-CZ 4.46Å; I328-F330 HydrophobicContact CG2-CD2 4.3Å; I328-F330 HydrophobicContact CG2-CE1 4.31Å; I328-F330 HydrophobicContact CG2-CE2 3.96Å; I328-F330 HydrophobicContact CG2-CZ 3.97Å; I328-F330 WeakPolarHBondContact O-CD2 3.48Å; I328-F330 PolarHBondContact O-N 3.23Å
331	A	74.8	Confident	65.9	Low	91 Å²	91	123.2 Å²	123.2	75%	0.752	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.2	-50.8	178.8	0	0	0	0	0	111.2	D329 R333	D329-A331 VanDerWaalsContact C-N 3.31Å; D329-A331 PolarHBondContact O-N 3.04Å; D329-A331 WeakPolarHBondContact OD1-CA 3.41Å; D329-A331 WeakPolarHBondContact OD1-CB 3.4Å; D329-A331 PolarHBondContact OD1-N 3.48Å; A331-R333 VanDerWaalsContact C-N 3.26Å; A331-R333 PolarHBondContact O-N 2.86Å
332	G	70.2	Confident	65.7	Low	41 Å²	41	116 Å²	116	42%	0.423	60%	0.6	S	S	.	*	T	Hydrogen-bonded Turn	trans	-75.3	-9.6	175.4	0	0	0	0	0	114.7	D329 K334	D329-G332 PolarHBondContact OD1-N 2.75Å; D329-G332 WeakPolarHBondContact OD2-CA 3.44Å; D329-G332 PolarHBondContact OD2-N 2.95Å; G332-K334 VanDerWaalsContact C-N 3.26Å; G332-K334 PolarHBondContact O-N 2.7Å
333	R	75.4	Confident	65.6	Low	230 Å²	230	110.5 Å²	110.5	87%	0.868	58%	0.578	S	S	*	*	T	Hydrogen-bonded Turn	trans	52.6	42.9	-173.7	-72.7	-176.8	-88.5	173.3	-8.9	112.3	D329 A331	D329-R333 VanDerWaalsContact O-CA 3.3Å; D329-R333 WeakPolarHBondContact O-CA 3.36Å; D329-R333 PolarHBondContact O-N 3.02Å; A331-R333 VanDerWaalsContact C-N 3.26Å; A331-R333 PolarHBondContact O-N 2.86Å
334	K	64.1	Low	65.4	Low	141 Å²	141	112.2 Å²	112.2	61%	0.613	58%	0.576	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-122.8	140.8	178.5	-74.5	-177.2	178	-177.2	0	110.9	D329 G332	D329-K334 PolarHBondContact N-O 2.79Å; D329-K334 PolarHBondContact O-N 3.23Å; G332-K334 VanDerWaalsContact C-N 3.26Å; G332-K334 PolarHBondContact O-N 2.7Å
335	I	75.6	Confident	64.9	Low	111 Å²	111	109.9 Å²	109.9	57%	0.569	56%	0.564	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-94.6	124.2	165.9	-59.1	176.2	0	0	0	106.2	V326 I328 E337	V326-I335 HydrophobicContact CG1-CG2 3.38Å; I328-I335 HydrophobicContact CG1-CG1 4.49Å; I335-E337 HydrophobicContact CG2-CG 4.19Å
336	L	63.8	Low	64.1	Low	104 Å²	104	109.1 Å²	109.1	55%	0.545	56%	0.563	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-107.9	96.3	171.9	-68.1	174.5	0	0	0	106.9	T327	T327-L336 PolarHBondContact N-O 2.77Å; T327-L336 PolarHBondContact O-N 3.24Å; T327-L336 WeakPolarHBondContact OG1-CB 3.43Å; T327-L336 PolarHBondContact OG1-O 3.47Å
337	E	62.2	Low	63.5	Low	144 Å²	144	109 Å²	109	67%	0.673	57%	0.565	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-70.2	128.4	163.8	-57.5	-167.3	167.7	0	0	107.7	V326 I335 E339	V326-E337 HydrophobicContact CG1-CG 4.43Å; I335-E337 HydrophobicContact CG2-CG 4.19Å; E337-E339 PolarHBondContact O-N 3.25Å
338	E	59	Low	62.4	Low	125 Å²	125	117.4 Å²	117.4	58%	0.584	59%	0.589	S	S	*	*	P	Polyproline II helix	trans	-64.2	126.7	174.1	-75.7	-177.3	127.6	0	0	108.8	K325 N340	K325-E338 WeakPolarHBondContact CB-OE2 3.24Å; K325-E338 WeakPolarHBondContact CD-OE2 3.33Å; E338-N340 PolarHBondContact O-N 2.87Å
339	E	51.6	Low	61.1	Low	173 Å²	173	118.3 Å²	118.3	81%	0.808	59%	0.594	S	S	*	*	P	Polyproline II helix	trans	-73.6	121.7	-160.2	-168.1	172.2	178.1	0	0	113	E337	E337-E339 PolarHBondContact O-N 3.25Å
340	N	56	Low	60.5	Low	93 Å²	93	116.3 Å²	116.3	50%	0.497	58%	0.584	S	S	.	*			trans	54	69.2	155.9	-73.3	-40.6	0	0	0	119.6	E338 L342 A343	E338-N340 PolarHBondContact O-N 2.87Å; N340-L342 PolarHBondContact O-N 2.95Å; N340-A343 HydrophobicContact CB-CB 3.6Å; N340-A343 PolarHBondContact O-N 3.01Å
341	S	54.8	Low	60.3	Low	105 Å²	105	115.5 Å²	115.5	73%	0.734	58%	0.582	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.3	14.4	148.7	-40.2	0	0	0	0	114.2
342	L	54.5	Low	59.9	Low	63 Å²	63	113.6 Å²	113.6	33%	0.33	56%	0.561	S	S	.	*	T	Hydrogen-bonded Turn	trans	-133.6	-2.6	-179	-76.4	170.1	0	0	0	113.3	N340 E344 Y345 H346	N340-L342 PolarHBondContact O-N 2.95Å; L342-E344 VanDerWaalsContact C-N 3.31Å; L342-Y345 PolarHBondContact O-N 3.33Å; L342-H346 PolarHBondContact O-CD2 3.44Å; L342-H346 PolarHBondContact O-N 3.42Å
343	A	54.8	Low	59.8	Low	50 Å²	50	116.3 Å²	116.3	41%	0.413	57%	0.565	S	S	.	*	T	Hydrogen-bonded Turn	trans	-67.2	-37.3	172.5	0	0	0	0	0	110.9	N340 Y345 H346 S347	N340-A343 HydrophobicContact CB-CB 3.6Å; N340-A343 PolarHBondContact O-N 3.01Å; A343-Y345 VanDerWaalsContact C-N 3.31Å; A343-Y345 PolarHBondContact O-N 3.41Å; A343-H346 CarbonylContact O-C 3.33Å; A343-H346 WeakPolarHBondContact O-CA 3.18Å; A343-H346 PolarHBondContact O-N 3.18Å; A343-S347 PolarHBondContact O-N 2.95Å
344	E	55.4	Low	59.4	Low	127 Å²	127	109.8 Å²	109.8	59%	0.593	55%	0.545	S	S	*	.	G	3₁₀ helix	trans	-60.2	-39	176.8	-164.6	164.5	-148.9	0	0	112	L342 H346 S347	L342-E344 VanDerWaalsContact C-N 3.31Å; E344-H346 PolarHBondContact O-N 3.43Å; E344-S347 PolarHBondContact O-N 3.16Å
345	Y	53.2	Low	59.7	Low	74 Å²	74	104.6 Å²	104.6	29%	0.29	53%	0.528	S	S	.	.	G	3₁₀ helix	trans	-67.3	-20.8	172.4	178	-103.2	0	0	0	113.8	L313 R317 L342 A343	L313-Y345 HydrophobicContact CD2-CD2 4.04Å; R317-Y345 WeakPolarHBondContact CD-OH 3.42Å; R317-Y345 HydrophobicContact CG-CD2 4.04Å; R317-Y345 HydrophobicContact CG-CE1 4.26Å; R317-Y345 HydrophobicContact CG-CE2 3.55Å; R317-Y345 VanDerWaalsContact NE-CE2 3.32Å; L342-Y345 PolarHBondContact O-N 3.33Å; A343-Y345 VanDerWaalsContact C-N 3.31Å; A343-Y345 PolarHBondContact O-N 3.41Å
346	H	49.8	Very low	59.3	Low	136 Å²	136	100.8 Å²	100.8	63%	0.63	51%	0.508	S	S	*	.	G	3₁₀ helix	trans	-108.1	11.7	179	-71.3	-56	0	0	0	113.6	L342 A343 E344 R348	L342-H346 PolarHBondContact O-CD2 3.44Å; L342-H346 PolarHBondContact O-N 3.42Å; A343-H346 CarbonylContact O-C 3.33Å; A343-H346 WeakPolarHBondContact O-CA 3.18Å; A343-H346 PolarHBondContact O-N 3.18Å; E344-H346 PolarHBondContact O-N 3.43Å; H346-R348 PolarHBondContact O-N 3.39Å
347	S	56.9	Low	59.4	Low	69 Å²	69	99.7 Å²	99.7	48%	0.483	52%	0.515	S	S	.	.			trans	-61.2	124.6	168.2	-175.4	0	0	0	0	109.7	A343 E344 L349	A343-S347 PolarHBondContact O-N 2.95Å; E344-S347 PolarHBondContact O-N 3.16Å; S347-L349 PolarHBondContact O-N 3.05Å; S347-L349 PolarHBondContact OG-N 3.12Å; S347-L349 PolarHBondContact OG-O 3.36Å
348	R	50	Low	59.8	Low	246 Å²	246	98.1 Å²	98.1	93%	0.928	51%	0.511	S	S	*	.	S	Bend	trans	-75.4	-3	171.7	-69	-175	174.7	-171.4	-3.3	113.1	H346	H346-R348 PolarHBondContact O-N 3.39Å
349	L	51.3	Low	60	Low	113 Å²	113	94 Å²	94	59%	0.592	50%	0.502	S	S	*	.			trans	-126.5	97.7	178.3	-61.5	174.3	0	0	0	107.2	S347	S347-L349 PolarHBondContact O-N 3.05Å; S347-L349 PolarHBondContact OG-N 3.12Å; S347-L349 PolarHBondContact OG-O 3.36Å
350	D	65.9	Low	60.6	Low	27 Å²	27	89.1 Å²	89.1	14%	0.144	48%	0.484	C	S	.	.			trans	-86.8	112.9	162.6	-164.5	-57.4	0	0	0	108.1	R309 T352 I353 Q354	R309-D350 IonicContact CZ-OD2 3.24Å; R309-D350 VanDerWaalsContact CZ-OD2 3.24Å; R309-D350 IonicContact NE-OD1 3.59Å; R309-D350 IonicContact NE-OD2 2.75Å; R309-D350 PolarHBondContact NE-OD2 2.8Å; R309-D350 IonicContact NH2-OD1 2.83Å; R309-D350 IonicContact NH2-OD2 2.72Å; R309-D350 PolarHBondContact NH2-OD2 3.36Å; D350-T352 PolarHBondContact O-N 3.1Å; D350-T352 VanDerWaalsContact O-N 3.16Å; D350-T352 WeakPolarHBondContact OD1-CB 3.24Å; D350-T352 PolarHBondContact OD1-N 3.39Å; D350-T352 PolarHBondContact OD1-OG1 2.95Å; D350-I353 HydrophobicContact CB-CB 4.27Å; D350-I353 HydrophobicContact CB-CD1 3.96Å; D350-I353 HydrophobicContact CB-CG1 4.01Å; D350-I353 PolarHBondContact O-N 3.31Å; D350-I353 VanDerWaalsContact O-N 3.17Å; D350-Q354 PolarHBondContact O-N 3.1Å
351	E	66.8	Low	60.7	Low	162 Å²	162	87.8 Å²	87.8	76%	0.757	48%	0.476	S	S	*	.	H	α-helix	trans	-57.7	-29.3	-177	-59.4	-174.2	162.4	0	0	112.2	A355	E351-A355 VanDerWaalsContact O-CB 3.26Å; E351-A355 WeakPolarHBondContact O-CB 3.34Å; E351-A355 PolarHBondContact O-N 3.03Å
352	T	66.3	Low	60.5	Low	51 Å²	51	87.6 Å²	87.6	31%	0.313	47%	0.467	S	S	.	.	H	α-helix	trans	-71.3	-44.7	179	69.8	0	0	0	0	111.4	D350 Q354 A355 I356	D350-T352 PolarHBondContact O-N 3.1Å; D350-T352 VanDerWaalsContact O-N 3.16Å; D350-T352 WeakPolarHBondContact OD1-CB 3.24Å; D350-T352 PolarHBondContact OD1-N 3.39Å; D350-T352 PolarHBondContact OD1-OG1 2.95Å; T352-Q354 VanDerWaalsContact C-N 3.32Å; T352-Q354 PolarHBondContact O-N 3.06Å; T352-A355 PolarHBondContact O-N 3.48Å; T352-I356 WeakPolarHBondContact O-CG1 3.46Å; T352-I356 PolarHBondContact O-N 3.26Å; T352-I356 VanDerWaalsContact O-N 3.1Å
353	I	67.9	Low	60.3	Low	98 Å²	98	91.6 Å²	91.6	50%	0.503	48%	0.484	S	S	.	.	H	α-helix	trans	-64.9	-41	175.9	-59.6	179.5	0	0	0	109.6	L306 D350 I356 A357	L306-I353 HydrophobicContact CD2-CG1 4.27Å; D350-I353 HydrophobicContact CB-CB 4.27Å; D350-I353 HydrophobicContact CB-CD1 3.96Å; D350-I353 HydrophobicContact CB-CG1 4.01Å; D350-I353 PolarHBondContact O-N 3.31Å; D350-I353 VanDerWaalsContact O-N 3.17Å; I353-I356 PolarHBondContact O-N 3.4Å; I353-A357 WeakPolarHBondContact O-CB 3.26Å; I353-A357 PolarHBondContact O-N 3.48Å
354	Q	67.6	Low	59.6	Low	94 Å²	94	94.2 Å²	94.2	44%	0.439	50%	0.497	S	S	.	.	H	α-helix	trans	-67.5	-36.4	177.8	-163.3	172.1	20.5	0	0	112.5	D350 T352 I356 A357 N358	D350-Q354 PolarHBondContact O-N 3.1Å; T352-Q354 VanDerWaalsContact C-N 3.32Å; T352-Q354 PolarHBondContact O-N 3.06Å; Q354-I356 VanDerWaalsContact C-N 3.34Å; Q354-A357 PolarHBondContact O-N 3.43Å; Q354-N358 VanDerWaalsContact O-CB 3.31Å; Q354-N358 WeakPolarHBondContact O-CB 3.4Å; Q354-N358 VanDerWaalsContact O-CG 3.23Å; Q354-N358 PolarHBondContact O-N 3.11Å; Q354-N358 PolarHBondContact O-ND2 3.46Å
355	A	69.6	Low	59.1	Low	31 Å²	31	96.4 Å²	96.4	26%	0.256	51%	0.512	S	S	.	.	H	α-helix	trans	-67.6	-31.8	174.7	0	0	0	0	0	113.2	E351 T352 G359 T360	E351-A355 VanDerWaalsContact O-CB 3.26Å; E351-A355 WeakPolarHBondContact O-CB 3.34Å; E351-A355 PolarHBondContact O-N 3.03Å; T352-A355 PolarHBondContact O-N 3.48Å; A355-G359 PolarHBondContact O-N 3.43Å; A355-T360 PolarHBondContact O-N 3.42Å
356	I	67.8	Low	58.2	Low	31 Å²	31	98.8 Å²	98.8	16%	0.159	53%	0.534	C	S	.	.	H	α-helix	trans	-73.9	-47.5	172.9	-67.2	170.2	0	0	0	110.4	L298 L306 T352 I353 Q354 N358 G359 L361	L298-I356 HydrophobicContact CD2-CG2 4.16Å; L306-I356 HydrophobicContact CD1-CD1 4.09Å; L306-I356 HydrophobicContact CD2-CD1 3.65Å; L306-I356 HydrophobicContact CG-CD1 3.59Å; T352-I356 WeakPolarHBondContact O-CG1 3.46Å; T352-I356 PolarHBondContact O-N 3.26Å; T352-I356 VanDerWaalsContact O-N 3.1Å; I353-I356 PolarHBondContact O-N 3.4Å; Q354-I356 VanDerWaalsContact C-N 3.34Å; I356-N358 VanDerWaalsContact C-N 3.25Å; I356-N358 PolarHBondContact O-N 3.33Å; I356-G359 PolarHBondContact O-N 3.41Å; I356-L361 HydrophobicContact CD1-CD1 4.15Å; I356-L361 HydrophobicContact CG1-CD1 3.52Å
357	A	66	Low	57.9	Low	82 Å²	82	101.4 Å²	101.4	68%	0.678	54%	0.544	S	S	*	.	H	α-helix	trans	-60	-34.3	178.5	0	0	0	0	0	113.1	I353 Q354	I353-A357 WeakPolarHBondContact O-CB 3.26Å; I353-A357 PolarHBondContact O-N 3.48Å; Q354-A357 PolarHBondContact O-N 3.43Å
358	N	69.8	Low	56.9	Low	111 Å²	111	106.6 Å²	106.6	59%	0.594	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85	-4.4	175.6	-67.2	-17.3	0	0	0	113.8	Q354 I356 T360	Q354-N358 VanDerWaalsContact O-CB 3.31Å; Q354-N358 WeakPolarHBondContact O-CB 3.4Å; Q354-N358 VanDerWaalsContact O-CG 3.23Å; Q354-N358 PolarHBondContact O-N 3.11Å; Q354-N358 PolarHBondContact O-ND2 3.46Å; I356-N358 VanDerWaalsContact C-N 3.25Å; I356-N358 PolarHBondContact O-N 3.33Å; N358-T360 WeakPolarHBondContact CB-OG1 3.45Å; N358-T360 PolarHBondContact O-N 3.47Å
359	G	64.6	Low	56.1	Low	38 Å²	38	102.1 Å²	102.1	39%	0.392	56%	0.559	S	S	.	*	T	Hydrogen-bonded Turn	trans	68.6	6.7	-177.9	0	0	0	0	0	115.5	A355 I356 L361	A355-G359 PolarHBondContact O-N 3.43Å; I356-G359 PolarHBondContact O-N 3.41Å; G359-L361 PolarHBondContact O-N 3.35Å
360	T	63.2	Low	55.5	Low	70 Å²	70	108.2 Å²	108.2	43%	0.429	57%	0.574	S	S	.	*	G	3₁₀ helix	trans	-67.4	-23.4	-171.5	-35.1	0	0	0	0	113.2	A355 N358 N362 Q363	A355-T360 PolarHBondContact O-N 3.42Å; N358-T360 WeakPolarHBondContact CB-OG1 3.45Å; N358-T360 PolarHBondContact O-N 3.47Å; T360-N362 PolarHBondContact O-N 3.09Å; T360-Q363 PolarHBondContact O-N 3.35Å
361	L	59.3	Low	53.9	Low	65 Å²	65	112.7 Å²	112.7	34%	0.34	61%	0.608	S	S	.	*	G	3₁₀ helix	trans	-59	-23.7	-173.3	-141.4	156.5	0	0	0	113.6	I356 G359	I356-L361 HydrophobicContact CD1-CD1 4.15Å; I356-L361 HydrophobicContact CG1-CD1 3.52Å; G359-L361 PolarHBondContact O-N 3.35Å
362	N	50.8	Low	52.9	Low	101 Å²	101	110.2 Å²	110.2	54%	0.54	61%	0.608	S	S	.	*	G	3₁₀ helix	trans	-100.3	2.4	177.6	-61.4	-71.9	0	0	0	114.5	E302 T360	E302-N362 PolarHBondContact OE1-ND2 3.01Å; T360-N362 PolarHBondContact O-N 3.09Å
363	Q	50	Low	51.5	Low	148 Å²	148	116.8 Å²	116.8	69%	0.692	64%	0.636	S	S	*	*	S	Bend	trans	-92.2	123.4	178.2	-68.9	-165.8	6.5	0	0	112	T360	T360-Q363 PolarHBondContact O-N 3.35Å
364	P	40.3	Very low	50.4	Low	104 Å²	104	120.7 Å²	120.7	68%	0.675	65%	0.652	S	S	*	*			trans	-68.3	134.3	169.8	29	-33.1	0	0	0	109.9	T366	P364-T366 VanDerWaalsContact C-N 3.32Å; P364-T366 PolarHBondContact O-N 2.64Å; P364-T366 PolarHBondContact O-OG1 2.93Å
365	L	44.7	Very low	49.2	Very low	174 Å²	174	122.6 Å²	122.6	91%	0.911	67%	0.672	S	S	*	*			trans	-60.1	84.2	-173.3	-172.4	75.6	0	0	0	112.9
366	T	33.9	Very low	47.9	Very low	123 Å²	123	129.1 Å²	129.1	76%	0.755	70%	0.702	S	S	*	*			trans	-98.4	105.8	-176	-53.5	0	0	0	0	108.8	P364 L368	P364-T366 VanDerWaalsContact C-N 3.32Å; P364-T366 PolarHBondContact O-N 2.64Å; P364-T366 PolarHBondContact O-OG1 2.93Å; T366-L368 PolarHBondContact O-N 3.11Å
367	K	43.1	Very low	46.6	Very low	192 Å²	192	130.4 Å²	130.4	84%	0.835	72%	0.723	S	S	*	*			trans	-63.8	122.6	179.4	-61.3	177.9	-178.4	179.3	0	110.6
368	L	35.7	Very low	45.8	Very low	178 Å²	178	133.1 Å²	133.1	93%	0.932	73%	0.731	S	S	*	*			trans	-146	167.5	153.8	-148.3	60.6	0	0	0	110.8	T366	T366-L368 PolarHBondContact O-N 3.11Å
369	D	32.7	Very low	44.8	Very low	151 Å²	151	136 Å²	136	81%	0.807	75%	0.745	S	S	*	*			trans	-85.5	168.4	-153.6	-136.5	-38.8	0	0	0	115.2	S371	D369-S371 PolarHBondContact O-N 2.65Å
370	R	38.8	Very low	43.8	Very low	242 Å²	242	139.4 Å²	139.4	91%	0.913	76%	0.758	S	S	*	*			trans	-71.8	122.2	174.9	-71.2	171.6	63.5	-167.1	1.1	111.3
371	S	32.7	Very low	43.1	Very low	120 Å²	120	140.2 Å²	140.2	84%	0.839	76%	0.76	S	S	*	*			trans	-122.4	141.4	143.7	57.6	0	0	0	0	109.2	D369	D369-S371 PolarHBondContact O-N 2.65Å
372	S	46.9	Very low	43.2	Very low	111 Å²	111	142.6 Å²	142.6	78%	0.776	78%	0.779	S	S	*	*			trans	-84.7	127	-171.1	50.5	0	0	0	0	112.7
373	E	37	Very low	43.3	Very low	189 Å²	189	144 Å²	144	88%	0.883	79%	0.786	S	S	*	*				-166.3	141	127.4	-107.1	166.1	-148.2	0	0	109.6
374	E	43.8	Very low	43.3	Very low	180 Å²	180	142 Å²	142	84%	0.841	78%	0.779	S	S	*	*			trans	-90.5	121.8	178.4	-71.1	-177.1	119.5	0	0	110.7	L376	E374-L376 PolarHBondContact O-N 3.24Å; E374-L376 VanDerWaalsContact O-N 3.08Å
375	P	42.7	Very low	44.1	Very low	133 Å²	133	147.5 Å²	147.5	86%	0.864	79%	0.787	S	S	*	*			trans	-77.4	93.3	169.5	-8.4	26	0	0	0	109.9	G377	P375-G377 PolarHBondContact O-N 3.07Å
376	L	43.2	Very low	44.6	Very low	169 Å²	169	146.7 Å²	146.7	89%	0.885	78%	0.779	S	S	*	*			trans	-64.6	123.8	167	-78.2	166.9	0	0	0	110.3	E374	E374-L376 PolarHBondContact O-N 3.24Å; E374-L376 VanDerWaalsContact O-N 3.08Å
377	G	39.8	Very low	45.4	Very low	58 Å²	58	146.1 Å²	146.1	60%	0.598	78%	0.78	S	S	*	*	S	Bend	trans	101.4	91.9	160.4	0	0	0	0	0	116.8	P375	P375-G377 PolarHBondContact O-N 3.07Å
378	V	48.9	Very low	45.9	Very low	139 Å²	139	142.3 Å²	142.3	84%	0.842	78%	0.775	S	S	*	*	S	Bend		32.3	108.7	127.5	-174.5	0	0	0	0	117.7	V380	V378-V380 PolarHBondContact O-N 2.95Å
379	L	48.6	Very low	47.1	Very low	171 Å²	171	140.1 Å²	140.1	90%	0.895	77%	0.772	S	S	*	*			trans	58.5	33	145.2	-146.2	82.2	0	0	0	118.7
380	V	44.2	Very low	48.3	Very low	110 Å²	110	141.4 Å²	141.4	67%	0.667	77%	0.773	S	S	*	*			trans	-77.6	123.3	162.8	-176.8	0	0	0	0	109.5	V378	V378-V380 PolarHBondContact O-N 2.95Å
381	N	48.7	Very low	48.8	Very low	86 Å²	86	139.4 Å²	139.4	46%	0.46	77%	0.765	S	S	.	*			trans	-59	122	171.4	173.6	-10.7	0	0	0	109.2	N383 M384	N381-N383 PolarHBondContact O-N 3.43Å; N381-N383 PolarHBondContact OD1-N 3.12Å; N381-N383 VanDerWaalsContact OD1-N 3.16Å; N381-N383 PolarHBondContact OD1-ND2 3.34Å; N381-M384 HydrophobicContact CB-CG 4.11Å; N381-M384 HydrophobicContact CB-SD 4.21Å; N381-M384 PolarHBondContact O-N 3.14Å
382	P	61	Low	50	Low	116 Å²	116	138.1 Å²	138.1	75%	0.753	75%	0.752	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.8	-3.6	-171.2	25.3	-35.2	0	0	0	115.1
383	N	52.5	Low	49.9	Very low	129 Å²	129	137 Å²	137	69%	0.69	74%	0.737	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100	0.9	174.3	-61.2	-78.5	0	0	0	114.1	N381 Y385	N381-N383 PolarHBondContact O-N 3.43Å; N381-N383 PolarHBondContact OD1-N 3.12Å; N381-N383 VanDerWaalsContact OD1-N 3.16Å; N381-N383 PolarHBondContact OD1-ND2 3.34Å; N383-Y385 PolarHBondContact O-N 2.79Å
384	M	50.8	Low	50.4	Low	108 Å²	108	135.1 Å²	135.1	53%	0.532	73%	0.728	S	S	.	*			trans	-94.4	89.4	-178.3	-72.4	-170.7	67.9	0	0	113.1	N381 Q386	N381-M384 HydrophobicContact CB-CG 4.11Å; N381-M384 HydrophobicContact CB-SD 4.21Å; N381-M384 PolarHBondContact O-N 3.14Å; M384-Q386 PolarHBondContact O-N 2.8Å
385	Y	57.2	Low	50.1	Low	218 Å²	218	132.1 Å²	132.1	86%	0.855	72%	0.722	S	S	*	*			trans	-76.5	58.2	170	-63.4	-83.9	0	0	0	112.4	N383	N383-Y385 PolarHBondContact O-N 2.79Å
386	Q	54.9	Low	49.8	Very low	157 Å²	157	129.4 Å²	129.4	73%	0.734	72%	0.718	S	S	*	*			trans	-128.8	136.3	174.5	-66.8	-173	-1	0	0	110.5	M384	M384-Q386 PolarHBondContact O-N 2.8Å
387	S	50.4	Low	49.3	Very low	111 Å²	111	128 Å²	128	78%	0.776	72%	0.717	S	S	*	*	P	Polyproline II helix	trans	-65	139.4	174.4	52.5	0	0	0	0	110.7
388	P	53.8	Low	49.3	Very low	113 Å²	113	130 Å²	130	73%	0.734	73%	0.728	S	S	*	*	P	Polyproline II helix	trans	-60.1	143.9	179	25.6	-34.6	0	0	0	111.3	Q390	P388-Q390 PolarHBondContact O-N 2.85Å
389	P	59.7	Low	48.6	Very low	132 Å²	132	129.2 Å²	129.2	86%	0.857	73%	0.729	S	S	*	*	P	Polyproline II helix	trans	-65.8	126.3	-178.6	26.7	-34.1	0	0	0	110.9
390	Q	59	Low	48.2	Very low	178 Å²	178	129.7 Å²	129.7	83%	0.832	73%	0.726	S	S	*	*	P	Polyproline II helix	trans	-83.7	128.7	177.1	-175	174.5	-8.2	0	0	110.6	P388	P388-Q390 PolarHBondContact O-N 2.85Å
391	W	48.8	Very low	47.7	Very low	200 Å²	200	134.5 Å²	134.5	76%	0.758	74%	0.738	S	S	*	*	P	Polyproline II helix	trans	-67.4	136.4	173.3	-176.3	81.9	0	0	0	111.2	D393	W391-D393 HydrophobicContact CE3-CB 4.45Å; W391-D393 HydrophobicContact CH2-CB 3.67Å; W391-D393 VanDerWaalsContact CH2-OD2 3.3Å; W391-D393 WeakPolarHBondContact CH2-OD2 3.5Å; W391-D393 HydrophobicContact CZ2-CB 4.43Å; W391-D393 HydrophobicContact CZ3-CB 3.67Å
392	V	59	Low	46.9	Very low	92 Å²	92	140 Å²	140	56%	0.558	76%	0.758	S	S	*	*			trans	-121.4	120	179.2	-179.5	0	0	0	0	108.5
393	D	44.1	Very low	45.5	Very low	87 Å²	87	138.7 Å²	138.7	47%	0.465	76%	0.757	S	S	.	*			trans	-75.4	133.9	175.1	-156.3	-30.1	0	0	0	110.2	W391 T395	W391-D393 HydrophobicContact CE3-CB 4.45Å; W391-D393 HydrophobicContact CH2-CB 3.67Å; W391-D393 VanDerWaalsContact CH2-OD2 3.3Å; W391-D393 WeakPolarHBondContact CH2-OD2 3.5Å; W391-D393 HydrophobicContact CZ2-CB 4.43Å; W391-D393 HydrophobicContact CZ3-CB 3.67Å; D393-T395 PolarHBondContact OD1-N 3.04Å; D393-T395 PolarHBondContact OD1-OG1 2.88Å
394	H	46.8	Very low	44.2	Very low	150 Å²	150	142.8 Å²	142.8	69%	0.694	77%	0.769	S	S	*	*			trans	-114.8	6	-178.6	-73.3	-53.1	0	0	0	113.2
395	T	38.6	Very low	43.2	Very low	117 Å²	117	148.8 Å²	148.8	72%	0.718	79%	0.786	S	S	*	*	S	Bend	trans	-87.7	114.6	168.5	59.3	0	0	0	0	109.8	D393	D393-T395 PolarHBondContact OD1-N 3.04Å; D393-T395 PolarHBondContact OD1-OG1 2.88Å
396	G	35.8	Very low	41.8	Very low	76 Å²	76	144.4 Å²	144.4	78%	0.784	79%	0.787	S	S	*	*			trans	-82.8	129.9	-155.7	0	0	0	0	0	116
397	T	32.6	Very low	40.6	Very low	141 Å²	141	142.6 Å²	142.6	87%	0.865	79%	0.792	S	S	*	*			trans	-144.4	131.7	143.3	-44.2	0	0	0	0	109.4
398	A	40.3	Very low	39.6	Very low	98 Å²	98	140.7 Å²	140.7	81%	0.81	79%	0.789	S	S	*	*			trans	-79.8	125.3	-177.4	0	0	0	0	0	111.9
399	S	33.1	Very low	38.6	Very low	124 Å²	124	143.9 Å²	143.9	87%	0.867	80%	0.799	S	S	*	*			trans	-153.6	147.6	163.4	-88.1	0	0	0	0	112.1
400	Q	40.3	Very low	37.3	Very low	181 Å²	181	141.5 Å²	141.5	85%	0.846	80%	0.798	S	S	*	*			trans	-89.9	134.3	-160.3	-56.7	177	4	0	0	113.6
401	K	33.9	Very low	36.2	Very low	210 Å²	210	141 Å²	141	91%	0.913	80%	0.801	S	S	*	*			trans	-134.6	151.4	142.6	-73.5	-166.4	177	174.9	0	110.2
402	K	31.5	Very low	35.4	Very low	201 Å²	201	139 Å²	139	87%	0.874	80%	0.8	S	S	*	*			trans	-86.1	152.2	-168.6	-70.5	178.8	178	175.6	0	112.3
403	A	31.7	Very low	34.1	Very low	89 Å²	89	142.9 Å²	142.9	74%	0.736	81%	0.81	S	S	*	*			trans	-67.6	156.4	-174.5	0	0	0	0	0	114.7
404	F	25.7	Very low	33.7	Very low	215 Å²	215	146 Å²	146	94%	0.943	83%	0.826	S	S	*	*			trans	-109.9	153.1	140	-120.2	-99.2	0	0	0	109.1
405	R	29.5	Very low	33.2	Very low	235 Å²	235	142.5 Å²	142.5	89%	0.887	82%	0.818	S	S	*	*			trans	-95.8	135.8	-170.8	-66.2	178.6	177	173.4	-2.5	112.3
406	S	28.2	Very low	33.2	Very low	126 Å²	126	141.3 Å²	141.3	88%	0.881	81%	0.807	S	S	*	*			trans	-133.8	154.4	140.7	-168.1	0	0	0	0	108.2
407	S	29.9	Very low	33.4	Very low	119 Å²	119	144.9 Å²	144.9	83%	0.832	80%	0.804	S	S	*	*			trans	-116.7	127.7	-166	-61.3	0	0	0	0	112.1
408	G	30.3	Very low	33.8	Very low	70 Å²	70	144.9 Å²	144.9	72%	0.722	79%	0.794	S	S	*	*			trans	148.3	145.7	164.9	0	0	0	0	0	114.9	G410	G408-G410 PolarHBondContact O-N 3.48Å
409	L	31.2	Very low	33.9	Very low	181 Å²	181	146.7 Å²	146.7	95%	0.948	79%	0.785	S	S	*	*			trans	55.5	50.8	158.7	-57.5	175.9	0	0	0	118	L411	L409-L411 PolarHBondContact O-N 2.93Å
410	G	33.6	Very low	34.2	Very low	81 Å²	81	148.4 Å²	148.4	84%	0.835	78%	0.784	S	S	*	*			trans	-81	89	161.1	0	0	0	0	0	112.2	G408	G408-G410 PolarHBondContact O-N 3.48Å
411	L	35.6	Very low	34.5	Very low	168 Å²	168	148.6 Å²	148.6	88%	0.88	78%	0.777	S	S	*	*			trans	-154.9	1.4	168.6	-116.5	172.7	0	0	0	117.3	L409	L409-L411 PolarHBondContact O-N 2.93Å
412	E	32.8	Very low	34.9	Very low	157 Å²	157	145.7 Å²	145.7	73%	0.734	77%	0.77	S	S	*	*			trans	-119.8	20.7	-172.4	-62	-161.9	142.2	0	0	115.8	N414 S415	E412-N414 PolarHBondContact O-N 3.26Å; E412-S415 PolarHBondContact O-OG 3.46Å; E412-S415 VanDerWaalsContact O-OG 3.11Å
413	F	31.6	Very low	35.6	Very low	175 Å²	175	141.2 Å²	141.2	77%	0.768	75%	0.752	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82	-13.8	-170.7	-132.2	-93.2	0	0	0	116.2
414	N	34.5	Very low	36.5	Very low	151 Å²	151	141.9 Å²	141.9	81%	0.807	74%	0.743	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.2	-13.6	-176.3	-76.3	-1.3	0	0	0	114.6	E412	E412-N414 PolarHBondContact O-N 3.26Å
415	S	36.3	Very low	37.7	Very low	77 Å²	77	137.9 Å²	137.9	54%	0.538	73%	0.727	S	S	.	*	S	Bend	trans	-77.5	-29.2	179.9	45.5	0	0	0	0	113.1	E412	E412-S415 PolarHBondContact O-OG 3.46Å; E412-S415 VanDerWaalsContact O-OG 3.11Å
416	L	39.5	Very low	39.1	Very low	93 Å²	93	134.7 Å²	134.7	49%	0.487	72%	0.722	S	S	.	*	G	3₁₀ helix	trans	-76.1	-22.2	-172.5	-65.2	169.5	0	0	0	114	H418 Q419	L416-H418 PolarHBondContact O-N 2.9Å; L416-H418 VanDerWaalsContact O-N 3.15Å; L416-Q419 PolarHBondContact O-N 2.79Å
417	Q	40.3	Very low	40.3	Very low	151 Å²	151	136.2 Å²	136.2	71%	0.706	71%	0.714	S	S	*	*	G	3₁₀ helix	trans	-68.6	-18.2	-170.5	-144.5	173.1	30	0	0	113.9
418	H	40.6	Very low	41.4	Very low	141 Å²	141	133.2 Å²	133.2	65%	0.653	69%	0.686	S	S	*	*	G	3₁₀ helix	trans	-89.5	-11.8	171.3	-91.2	-124.9	0	0	0	114.1	L416	L416-H418 PolarHBondContact O-N 2.9Å; L416-H418 VanDerWaalsContact O-N 3.15Å
419	Q	41.6	Very low	42.7	Very low	136 Å²	136	133.1 Å²	133.1	64%	0.636	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.2	-8.4	-176.1	-69.4	-170.4	-26.2	0	0	114.4	L416 R421	L416-Q419 PolarHBondContact O-N 2.79Å; Q419-R421 PolarHBondContact O-N 2.93Å
420	L	40.5	Very low	43.9	Very low	159 Å²	159	127.4 Å²	127.4	83%	0.832	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.1	4.2	177.6	-65.9	177.4	0	0	0	114.4
421	R	46.6	Very low	45.5	Very low	185 Å²	185	131 Å²	131	70%	0.698	65%	0.645	S	S	*	*	S	Bend	trans	-101.3	84.2	165.6	-167.1	-176.6	-150.6	146.3	10.1	109.4	Q419 Q423	Q419-R421 PolarHBondContact O-N 2.93Å; R421-Q423 HydrophobicContact CG-CG 4.22Å; R421-Q423 PolarHBondContact O-N 2.94Å
422	I	42.1	Very low	47.7	Very low	150 Å²	150	123.6 Å²	123.6	77%	0.769	61%	0.606	S	S	*	*			trans	-64.9	98.7	172.4	-61.2	167.5	0	0	0	108.5
423	Q	45.8	Very low	50	Low	106 Å²	106	116.7 Å²	116.7	50%	0.495	58%	0.577	S	S	.	*			trans	-138.1	105.9	164.2	-70.2	-172.7	-51.6	0	0	105	R421 Q425	R421-Q423 HydrophobicContact CG-CG 4.22Å; R421-Q423 PolarHBondContact O-N 2.94Å; Q423-Q425 PolarHBondContact O-N 3.01Å
424	D	49.6	Very low	52.9	Low	103 Å²	103	108.4 Å²	108.4	55%	0.551	54%	0.54	S	S	*	.			trans	-59.9	125.4	-168.8	-51.8	-60.8	0	0	0	110.7	E426 F427 Q428	D424-E426 PolarHBondContact O-N 2.84Å; D424-F427 HydrophobicContact CB-CB 4.17Å; D424-F427 WeakPolarHBondContact O-CB 3.39Å; D424-F427 PolarHBondContact O-N 2.81Å; D424-Q428 PolarHBondContact O-N 3.01Å
425	Q	51.4	Low	55.7	Low	132 Å²	132	106 Å²	106	62%	0.617	52%	0.52	S	S	*	.	H	α-helix	trans	-58.1	-41.8	-173.4	-168.5	-172.5	-53.4	0	0	110.9	Q423 F427 Q428 E429	Q423-Q425 PolarHBondContact O-N 3.01Å; Q425-F427 PolarHBondContact O-N 2.85Å; Q425-Q428 PolarHBondContact O-N 2.91Å; Q425-Q428 VanDerWaalsContact O-N 3.15Å; Q425-E429 WeakPolarHBondContact CG-OE1 3.49Å; Q425-E429 PolarHBondContact NE2-OE1 3.36Å; Q425-E429 WeakPolarHBondContact O-CG 3.3Å; Q425-E429 PolarHBondContact O-N 2.83Å
426	E	58.6	Low	58.5	Low	167 Å²	167	102.4 Å²	102.4	78%	0.78	50%	0.495	S	S	*	.	H	α-helix	trans	-58.6	-33.8	175.9	-56.4	-174.1	158.9	0	0	112.6	D424 E429 G430	D424-E426 PolarHBondContact O-N 2.84Å; E426-E429 PolarHBondContact O-N 2.76Å; E426-G430 PolarHBondContact O-N 2.87Å
427	F	54.8	Low	61.2	Low	159 Å²	159	98 Å²	98	70%	0.697	47%	0.472	S	S	*	.	H	α-helix	trans	-74.8	-33.7	179.4	-143.2	-80.8	0	0	0	111.8	D424 Q425 F431	D424-F427 HydrophobicContact CB-CB 4.17Å; D424-F427 WeakPolarHBondContact O-CB 3.39Å; D424-F427 PolarHBondContact O-N 2.81Å; Q425-F427 PolarHBondContact O-N 2.85Å; F427-F431 PolarHBondContact O-N 3.33Å; F427-F431 VanDerWaalsContact O-N 3.08Å
428	Q	53.1	Low	63.8	Low	56 Å²	56	91 Å²	91	26%	0.262	44%	0.439	S	S	.	.	H	α-helix	trans	-74.9	-32.5	171.8	-66.2	-168.8	-2.6	0	0	112.7	D424 Q425 G430	D424-Q428 PolarHBondContact O-N 3.01Å; Q425-Q428 PolarHBondContact O-N 2.91Å; Q425-Q428 VanDerWaalsContact O-N 3.15Å; Q428-G430 VanDerWaalsContact C-N 3.3Å
429	E	56.2	Low	66.4	Low	68 Å²	68	84.3 Å²	84.3	32%	0.318	41%	0.408	S	S	.	.	H	α-helix	trans	-69.3	-29.6	172	-71.2	177.1	-167.4	0	0	112.1	Q425 E426 R466	Q425-E429 WeakPolarHBondContact CG-OE1 3.49Å; Q425-E429 PolarHBondContact NE2-OE1 3.36Å; Q425-E429 WeakPolarHBondContact O-CG 3.3Å; Q425-E429 PolarHBondContact O-N 2.83Å; E426-E429 PolarHBondContact O-N 2.76Å; E429-R466 PolarHBondContact O-NH2 3.08Å
430	G	56.5	Low	68.8	Low	60 Å²	60	82.4 Å²	82.4	62%	0.619	40%	0.399	S	S	*	.	H	α-helix	trans	-73.9	-41.9	172	0	0	0	0	0	114.8	E426 Q428 D432	E426-G430 PolarHBondContact O-N 2.87Å; Q428-G430 VanDerWaalsContact C-N 3.3Å; G430-D432 PolarHBondContact O-N 2.98Å
431	F	67.9	Low	71.3	Confident	158 Å²	158	74.9 Å²	74.9	69%	0.693	36%	0.36	S	S	*	.			trans	-82.4	72.6	-172	-163.6	-97.4	0	0	0	114.3	F427 G433	F427-F431 PolarHBondContact O-N 3.33Å; F427-F431 VanDerWaalsContact O-N 3.08Å; F431-G433 VanDerWaalsContact C-N 3.34Å; F431-G433 PolarHBondContact O-N 3.41Å
432	D	81.1	Confident	73.5	Confident	12 Å²	12	66.1 Å²	66.1	6%	0.064	33%	0.327	C	S	.	.			trans	-72	86.7	171.3	-178.6	-12.1	0	0	0	111.6	G430 G434 R466 W468 H567 K571	G430-D432 PolarHBondContact O-N 2.98Å; D432-G434 VanDerWaalsContact C-N 3.3Å; D432-G434 PolarHBondContact O-N 3.11Å; D432-G434 PolarHBondContact OD1-N 3.4Å; D432-R466 WeakPolarHBondContact OD2-CD 3.33Å; D432-R466 IonicContact OD2-CZ 3.48Å; D432-R466 IonicContact OD2-NH1 2.81Å; D432-R466 PolarHBondContact OD2-NH1 3.41Å; D432-W468 PolarHBondContact OD1-NE1 3.42Å; D432-W468 VanDerWaalsContact OD2-CZ2 3.3Å; D432-W468 WeakPolarHBondContact OD2-CZ2 3.34Å; D432-H567 PolarHBondContact O-CE1 2.8Å; D432-H567 PolarHBondContact O-NE2 3.1Å; D432-H567 IonicContact OD1-CD2 3.22Å; D432-H567 IonicContact OD1-CE1 2.64Å; D432-H567 IonicContact OD1-NE2 2.78Å; D432-H567 PolarHBondContact OD1-NE2 3.08Å; D432-H567 IonicContact OD2-NE2 2.71Å; D432-K571 PolarHBondContact O-NZ 3.2Å; D432-K571 IonicContact OD1-NZ 2.77Å; D432-K571 WeakPolarHBondContact OD2-CE 3.09Å; D432-K571 IonicContact OD2-NZ 3.76Å
433	G	82.1	Confident	75.9	Confident	12 Å²	12	62.7 Å²	62.7	12%	0.124	30%	0.304	C	S	.	.			trans	-77.1	0.8	-179.9	0	0	0	0	0	116.1	F431 K561	F431-G433 VanDerWaalsContact C-N 3.34Å; F431-G433 PolarHBondContact O-N 3.41Å; G433-K561 VanDerWaalsContact O-CE 3.28Å; G433-K561 WeakPolarHBondContact O-CE 3.48Å
434	G	90.9	Very high	78.2	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	28%	0.281	C	S	.	.			trans	78.2	27.7	173.8	0	0	0	0	0	115.8	D432 L562 H567	D432-G434 VanDerWaalsContact C-N 3.3Å; D432-G434 PolarHBondContact O-N 3.11Å; D432-G434 PolarHBondContact OD1-N 3.4Å; G434-L562 WeakPolarHBondContact O-CB 3.43Å; G434-L562 WeakPolarHBondContact O-CG 3.21Å; G434-L562 PolarHBondContact O-N 2.92Å; G434-H567 WeakPolarHBondContact CA-CE1 3.26Å; G434-H567 WeakPolarHBondContact CA-NE2 3.32Å; G434-H567 PolarHBondContact N-CE1 3.09Å; G434-H567 VanDerWaalsContact N-CE1 3.34Å; G434-H567 PolarHBondContact N-NE2 3.17Å
435	W	94.2	Very high	80.3	Confident	102 Å²	102	52.8 Å²	52.8	39%	0.386	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	139.8	174.5	-63.9	109.1	0	0	0	111.7	H463 L467 W468 I559 W560 K561	W435-H463 AromaticContact CD1-CD2 3.41Å; W435-H463 VanDerWaalsContact CD1-CD2 3.41Å; W435-H463 AromaticContact CD1-NE2 3.09Å; W435-H463 AromaticContact CG-CD2 3.64Å; W435-H463 AromaticContact CG-NE2 3.48Å; W435-H463 AromaticContact NE1-CD2 3.98Å; W435-L467 HydrophobicContact CB-CD1 4.2Å; W435-W468 WeakPolarHBondContact O-CB 3.46Å; W435-W468 VanDerWaalsContact O-CD1 3.24Å; W435-W468 PolarHBondContact O-N 3.35Å; W435-I559 HydrophobicContact CB-CG2 4.07Å; W435-I559 HydrophobicContact CD2-CG2 4.26Å; W435-I559 HydrophobicContact CE3-CG2 3.7Å; W435-I559 HydrophobicContact CG-CG2 4.45Å; W435-I559 HydrophobicContact CZ3-CG2 4.47Å; W435-W560 CarbonylContact C-O 3.52Å; W435-K561 HydrophobicContact CE3-CB 4.07Å; W435-K561 HydrophobicContact CZ3-CB 4.01Å
436	C	95.3	Very high	82.3	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	141.3	-177	-177.7	0	0	0	0	111.6	W468 I559 W560 L562	C436-W468 CarbonylContact C-O 3.51Å; C436-W468 WeakPolarHBondContact CA-O 3.43Å; C436-W468 HydrophobicContact CB-CB 4.11Å; C436-W468 PolarHBondContact SG-O 2.81Å; C436-W468 VanDerWaalsContact SG-O 3.41Å; C436-I559 VanDerWaalsContact O-CA 3.31Å; C436-I559 WeakPolarHBondContact O-CA 3.47Å; C436-W560 HydrophobicContact CB-CD2 4.45Å; C436-W560 HydrophobicContact CB-CZ2 4.27Å; C436-W560 PolarHBondContact N-O 3.49Å; C436-W560 PolarHBondContact O-N 2.86Å; C436-L562 HydrophobicContact CB-CD1 4.37Å; C436-L562 HydrophobicContact CB-CD2 3.62Å; C436-L562 HydrophobicContact CB-CG 3.78Å
437	L	95.6	Very high	83.9	Confident	2 Å²	2	38.8 Å²	38.8	1%	0.01	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	137.4	169	178.8	61.3	0	0	0	109.6	I439 E455 W459 L467 W468 A470 F539 I559	L437-I439 HydrophobicContact CD2-CD1 4.35Å; L437-I439 HydrophobicContact CD2-CG1 4.3Å; L437-I439 HydrophobicContact CG-CG1 4.15Å; L437-E455 HydrophobicContact CD2-CG 4.13Å; L437-W459 HydrophobicContact CD1-CZ2 4.21Å; L437-L467 HydrophobicContact CB-CD1 4.13Å; L437-L467 HydrophobicContact CB-CD2 3.92Å; L437-L467 HydrophobicContact CB-CG 4.21Å; L437-L467 HydrophobicContact CD2-CD2 4.19Å; L437-W468 PolarHBondContact N-O 2.62Å; L437-A470 PolarHBondContact O-N 2.83Å; L437-F539 HydrophobicContact CD2-CD2 4.02Å; L437-F539 HydrophobicContact CD2-CE2 3.99Å; L437-I559 HydrophobicContact CB-CG1 4.12Å; L437-I559 HydrophobicContact CD1-CG1 4.21Å
438	S	95.4	Very high	85.7	Confident	2 Å²	2	31.3 Å²	31.3	1%	0.014	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	131.4	171.1	-156.3	0	0	0	0	112	R457 A470 T472 G555 N556	S438-R457 PolarHBondContact O-NH1 3.22Å; S438-R457 VanDerWaalsContact O-NH1 3.13Å; S438-R457 PolarHBondContact O-NH2 3.27Å; S438-A470 CarbonylContact C-O 3.17Å; S438-A470 WeakPolarHBondContact CA-O 3.45Å; S438-A470 PolarHBondContact OG-O 2.8Å; S438-T472 VanDerWaalsContact OG-CG2 3.27Å; S438-T472 WeakPolarHBondContact OG-CG2 3.48Å; S438-T472 PolarHBondContact OG-N 2.95Å; S438-G555 WeakPolarHBondContact OG-CA 3.16Å; S438-N556 VanDerWaalsContact CB-O 3.26Å; S438-N556 WeakPolarHBondContact CB-O 3.4Å
439	I	94.3	Very high	87.4	Confident	1 Å²	1	33.8 Å²	33.8	1%	0.005	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	143.8	-174.3	-57	-174.8	0	0	0	108.8	L437 W443 A444 L447 E455 I469 A470 T472	L437-I439 HydrophobicContact CD2-CD1 4.35Å; L437-I439 HydrophobicContact CD2-CG1 4.3Å; L437-I439 HydrophobicContact CG-CG1 4.15Å; I439-W443 HydrophobicContact CG2-CB 4.13Å; I439-A444 HydrophobicContact CB-CB 3.78Å; I439-A444 HydrophobicContact CG2-CB 3.91Å; I439-L447 HydrophobicContact CD1-CD2 3.37Å; I439-E455 HydrophobicContact CD1-CB 4.4Å; I439-E455 HydrophobicContact CD1-CG 3.84Å; I439-E455 HydrophobicContact CG1-CG 4.36Å; I439-E455 WeakPolarHBondContact CG2-OE1 3.46Å; I439-I469 HydrophobicContact CD1-CD1 3.92Å; I439-I469 HydrophobicContact CD1-CG2 3.97Å; I439-I469 HydrophobicContact CG1-CG2 4.37Å; I439-A470 PolarHBondContact N-O 2.92Å; I439-T472 WeakPolarHBondContact O-CG2 3.3Å; I439-T472 PolarHBondContact O-N 3.27Å
440	H	92.9	Very high	89	Confident	97 Å²	97	31.3 Å²	31.3	45%	0.449	16%	0.156	S	C	.	.			trans	-70.2	143.1	175.6	-68.4	-55.9	0	0	0	111.2	W443 A444 T472	H440-W443 HydrophobicContact CB-CE3 3.98Å; H440-W443 HydrophobicContact CB-CZ3 4.07Å; H440-W443 PolarHBondContact O-N 3.04Å; H440-A444 PolarHBondContact O-N 3.24Å; H440-T472 PolarHBondContact ND1-OG1 3.26Å
441	Q	93.2	Very high	90.6	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.4	147.3	167	-70.9	-69.4	24.8	0	0	109.5	S445 A471 P476 P503	Q441-S445 PolarHBondContact NE2-OG 3.37Å; Q441-S445 PolarHBondContact OE1-OG 3.42Å; Q441-A471 HydrophobicContact CG-CB 3.91Å; Q441-P476 HydrophobicContact CB-CB 4.13Å; Q441-P476 HydrophobicContact CB-CG 3.92Å; Q441-P503 PolarHBondContact NE2-O 3Å
442	P	93.4	Very high	91.7	Very high	1 Å²	1	21.9 Å²	21.9	1%	0.006	10%	0.098	C	C	.	.	T	Hydrogen-bonded Turn	cis	-85.5	-9.5	5.6	33.6	-34.2	0	0	0	115.2	A444 S445 L446 P476 V481 L484 Y502	P442-A444 PolarHBondContact O-N 3.05Å; P442-A444 VanDerWaalsContact O-N 3.14Å; P442-S445 PolarHBondContact O-N 2.87Å; P442-S445 VanDerWaalsContact O-N 3.13Å; P442-L446 WeakPolarHBondContact O-CG 3.34Å; P442-L446 PolarHBondContact O-N 3.17Å; P442-L446 VanDerWaalsContact O-N 3.17Å; P442-P476 HydrophobicContact CB-CB 4.47Å; P442-V481 HydrophobicContact CB-CG2 4.12Å; P442-V481 HydrophobicContact CG-CG2 4.27Å; P442-L484 HydrophobicContact CG-CD1 3.44Å; P442-L484 VanDerWaalsContact CG-CD1 3.44Å; P442-Y502 HydrophobicContact CB-CD1 3.49Å; P442-Y502 VanDerWaalsContact CB-CD1 3.49Å; P442-Y502 HydrophobicContact CB-CE1 3.46Å; P442-Y502 VanDerWaalsContact CB-CE1 3.46Å; P442-Y502 HydrophobicContact CB-CG 4.38Å
443	W	92.8	Very high	92.2	Very high	79 Å²	79	26.2 Å²	26.2	30%	0.299	11%	0.114	S	C	.	.	H	α-helix	trans	-57.7	-31.4	-175.1	-56.6	-80.5	0	0	0	114	I439 H440 L446 L447 K452 L484	I439-W443 HydrophobicContact CG2-CB 4.13Å; H440-W443 HydrophobicContact CB-CE3 3.98Å; H440-W443 HydrophobicContact CB-CZ3 4.07Å; H440-W443 PolarHBondContact O-N 3.04Å; W443-L446 PolarHBondContact O-N 3.39Å; W443-L447 WeakPolarHBondContact O-CB 3.39Å; W443-L447 PolarHBondContact O-N 3.08Å; W443-K452 HydrophobicContact CB-CD 4.28Å; W443-L484 HydrophobicContact CD2-CD1 4.31Å; W443-L484 HydrophobicContact CH2-CD1 4.39Å; W443-L484 HydrophobicContact CZ2-CD1 3.64Å; W443-L484 HydrophobicContact CZ2-CD2 4.36Å
444	A	94.1	Very high	92.7	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-59.1	-46.7	176.4	0	0	0	0	0	112.4	I439 H440 P442 V448 A471 L508	I439-A444 HydrophobicContact CB-CB 3.78Å; I439-A444 HydrophobicContact CG2-CB 3.91Å; H440-A444 PolarHBondContact O-N 3.24Å; P442-A444 PolarHBondContact O-N 3.05Å; P442-A444 VanDerWaalsContact O-N 3.14Å; A444-V448 PolarHBondContact O-N 3.32Å; A444-A471 HydrophobicContact CB-CB 4.39Å; A444-L508 HydrophobicContact CB-CD1 3.79Å
445	S	93	Very high	92.8	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-67.7	-38.5	173.6	-71.5	0	0	0	0	112.2	Q441 P442 L447 V448 R449	Q441-S445 PolarHBondContact NE2-OG 3.37Å; Q441-S445 PolarHBondContact OE1-OG 3.42Å; P442-S445 PolarHBondContact O-N 2.87Å; P442-S445 VanDerWaalsContact O-N 3.13Å; S445-L447 VanDerWaalsContact C-N 3.31Å; S445-L447 PolarHBondContact O-N 3.47Å; S445-V448 WeakPolarHBondContact O-CG2 3.1Å; S445-R449 WeakPolarHBondContact O-CB 3.36Å; S445-R449 WeakPolarHBondContact O-CG 3.24Å; S445-R449 PolarHBondContact O-N 3.19Å
446	L	92.6	Very high	92.7	Very high	3 Å²	3	22 Å²	22	2%	0.016	10%	0.098	C	C	.	.	H	α-helix	trans	-64.7	-33.4	178.6	-60.9	-180	0	0	0	112.8	P442 W443 G450 I451 K452 Y488 F498	P442-L446 WeakPolarHBondContact O-CG 3.34Å; P442-L446 PolarHBondContact O-N 3.17Å; P442-L446 VanDerWaalsContact O-N 3.17Å; W443-L446 PolarHBondContact O-N 3.39Å; L446-G450 PolarHBondContact O-N 2.91Å; L446-I451 HydrophobicContact CB-CB 4.26Å; L446-I451 HydrophobicContact CD2-CB 4.34Å; L446-I451 HydrophobicContact CD2-CD1 3.7Å; L446-I451 HydrophobicContact CD2-CG2 4.29Å; L446-I451 WeakPolarHBondContact O-CB 3.36Å; L446-I451 PolarHBondContact O-N 3.31Å; L446-K452 HydrophobicContact CB-CB 4.14Å; L446-K452 PolarHBondContact O-N 3.07Å; L446-Y488 HydrophobicContact CD1-CD2 4.1Å; L446-Y488 HydrophobicContact CD1-CE2 4.15Å; L446-F498 HydrophobicContact CD2-CD1 3.7Å; L446-F498 HydrophobicContact CD2-CE1 3.93Å
447	L	93.4	Very high	92.6	Very high	2 Å²	2	23.5 Å²	23.5	1%	0.01	10%	0.104	C	C	.	.	H	α-helix	trans	-72.9	-46.9	179.7	-170.2	73.6	0	0	0	111.8	I439 W443 S445 R449 G450 K452 E455 I469 V511 C541 P544	I439-L447 HydrophobicContact CD1-CD2 3.37Å; W443-L447 WeakPolarHBondContact O-CB 3.39Å; W443-L447 PolarHBondContact O-N 3.08Å; S445-L447 VanDerWaalsContact C-N 3.31Å; S445-L447 PolarHBondContact O-N 3.47Å; L447-R449 PolarHBondContact O-N 2.86Å; L447-G450 PolarHBondContact O-N 3.47Å; L447-K452 HydrophobicContact CD1-CB 4.45Å; L447-K452 HydrophobicContact CD1-CG 4.44Å; L447-E455 HydrophobicContact CD2-CB 4.45Å; L447-I469 HydrophobicContact CD2-CD1 3.99Å; L447-I469 HydrophobicContact CD2-CG1 4.2Å; L447-V511 HydrophobicContact CD2-CG1 4.4Å; L447-V511 HydrophobicContact CG-CG1 4.13Å; L447-C541 HydrophobicContact CD1-CB 4.2Å; L447-P544 VanDerWaalsContact O-CB 3.3Å; L447-P544 WeakPolarHBondContact O-CB 3.21Å
448	V	92.6	Very high	92.4	Very high	2 Å²	2	28.1 Å²	28.1	1%	0.012	14%	0.136	C	C	.	.	H	α-helix	trans	-70.9	-13	176.5	-59.8	0	0	0	0	113.7	A444 S445 I469 L508 E546	A444-V448 PolarHBondContact O-N 3.32Å; S445-V448 WeakPolarHBondContact O-CG2 3.1Å; V448-I469 HydrophobicContact CG1-CB 3.67Å; V448-I469 HydrophobicContact CG1-CG1 4.08Å; V448-I469 HydrophobicContact CG1-CG2 3.85Å; V448-L508 HydrophobicContact CG1-CB 4.18Å; V448-L508 HydrophobicContact CG2-CB 4.05Å; V448-L508 HydrophobicContact CG2-CD1 4.32Å; V448-E546 HydrophobicContact CB-CB 4.37Å; V448-E546 HydrophobicContact CG2-CB 4.1Å; V448-E546 HydrophobicContact CG2-CG 4.19Å; V448-E546 PolarHBondContact O-N 2.96Å
449	R	89.1	Confident	92.3	Very high	108 Å²	108	30.8 Å²	30.8	41%	0.408	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.8	-4.3	169.1	-77.6	-79.4	173.6	143.7	-6.1	113.9	S445 L447 I451 P499 E546	S445-R449 WeakPolarHBondContact O-CB 3.36Å; S445-R449 WeakPolarHBondContact O-CG 3.24Å; S445-R449 PolarHBondContact O-N 3.19Å; L447-R449 PolarHBondContact O-N 2.86Å; R449-I451 HydrophobicContact CB-CD1 3.89Å; R449-I451 HydrophobicContact CB-CG1 3.94Å; R449-I451 PolarHBondContact O-N 3.05Å; R449-P499 HydrophobicContact CG-CG 4.46Å; R449-E546 IonicContact CZ-OE2 3.8Å; R449-E546 VanDerWaalsContact CZ-OE2 3.22Å; R449-E546 IonicContact NE-OE2 3.59Å; R449-E546 PolarHBondContact NE-OE2 3.45Å; R449-E546 IonicContact NH2-OE2 3.84Å; R449-E546 PolarHBondContact NH2-OE2 3.19Å
450	G	89.1	Confident	92.3	Very high	16 Å²	16	36 Å²	36	17%	0.165	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	70.5	10.5	-178	0	0	0	0	0	115.7	L446 L447 R492 P544	L446-G450 PolarHBondContact O-N 2.91Å; L447-G450 PolarHBondContact O-N 3.47Å; G450-R492 PolarHBondContact O-NH2 3.12Å; G450-P544 VanDerWaalsContact CA-CG 3.45Å
451	I	90.1	Very high	92.2	Very high	9 Å²	9	31.7 Å²	31.7	5%	0.046	15%	0.147	C	C	.	.	S	Bend	trans	-71.1	-54.7	177.9	-58.7	170.6	0	0	0	108.4	L446 R449 Y488 R492 V496 E497 F498	L446-I451 HydrophobicContact CB-CB 4.26Å; L446-I451 HydrophobicContact CD2-CB 4.34Å; L446-I451 HydrophobicContact CD2-CD1 3.7Å; L446-I451 HydrophobicContact CD2-CG2 4.29Å; L446-I451 WeakPolarHBondContact O-CB 3.36Å; L446-I451 PolarHBondContact O-N 3.31Å; R449-I451 HydrophobicContact CB-CD1 3.89Å; R449-I451 HydrophobicContact CB-CG1 3.94Å; R449-I451 PolarHBondContact O-N 3.05Å; I451-Y488 HydrophobicContact CG2-CD1 3.81Å; I451-Y488 HydrophobicContact CG2-CG 3.96Å; I451-R492 PolarHBondContact O-NE 3.14Å; I451-V496 HydrophobicContact CB-CG1 4.38Å; I451-V496 HydrophobicContact CD1-CG1 3.85Å; I451-V496 HydrophobicContact CG1-CG1 3.74Å; I451-V496 HydrophobicContact CG2-CG1 3.85Å; I451-E497 WeakPolarHBondContact CD1-O 3.42Å; I451-F498 HydrophobicContact CD1-CD1 3.89Å; I451-F498 HydrophobicContact CD1-CE1 4.15Å; I451-F498 HydrophobicContact CG2-CE1 4.06Å; I451-F498 HydrophobicContact CG2-CZ 4.5Å
452	K	91.3	Very high	92	Very high	11 Å²	11	36.4 Å²	36.4	5%	0.048	18%	0.178	C	C	.	.	S	Bend	trans	-84.7	141.9	165.2	-169.8	-177.6	-165.2	-159.8	0	108.7	W443 L446 L447 V454 E455 Y488 E532	W443-K452 HydrophobicContact CB-CD 4.28Å; L446-K452 HydrophobicContact CB-CB 4.14Å; L446-K452 PolarHBondContact O-N 3.07Å; L447-K452 HydrophobicContact CD1-CB 4.45Å; L447-K452 HydrophobicContact CD1-CG 4.44Å; K452-V454 VanDerWaalsContact CD-O 3.23Å; K452-V454 WeakPolarHBondContact CD-O 3.46Å; K452-V454 WeakPolarHBondContact CE-O 2.79Å; K452-V454 WeakPolarHBondContact CG-O 3.47Å; K452-V454 PolarHBondContact NZ-O 2.68Å; K452-E455 IonicContact NZ-OE2 3.98Å; K452-E455 PolarHBondContact NZ-OE2 3.49Å; K452-Y488 HydrophobicContact CB-CE1 3.99Å; K452-Y488 HydrophobicContact CG-CE1 4.23Å; K452-Y488 WeakPolarHBondContact CG-OH 3.28Å; K452-E532 WeakPolarHBondContact CG-OE2 3.23Å
453	R	90.3	Very high	91.8	Very high	103 Å²	103	37.9 Å²	37.9	39%	0.389	18%	0.184	S	C	.	.			trans	-114.9	-15.6	-178.2	-63.7	180	66.4	-167	0.9	113.9	E532 C541	R453-E532 PolarHBondContact N-OE2 3.08Å; R453-C541 WeakPolarHBondContact O-CB 3.45Å; R453-C541 PolarHBondContact O-N 3.03Å
454	V	93.3	Very high	91.6	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	159.1	179.2	-63.6	0	0	0	0	112.9	K452 F522 I529 E532 V538 F539 I540	K452-V454 VanDerWaalsContact CD-O 3.23Å; K452-V454 WeakPolarHBondContact CD-O 3.46Å; K452-V454 WeakPolarHBondContact CE-O 2.79Å; K452-V454 WeakPolarHBondContact CG-O 3.47Å; K452-V454 PolarHBondContact NZ-O 2.68Å; V454-F522 HydrophobicContact CB-CZ 4.41Å; V454-F522 HydrophobicContact CG1-CE2 3.73Å; V454-F522 HydrophobicContact CG1-CZ 3.83Å; V454-F522 HydrophobicContact CG2-CZ 4Å; V454-I529 HydrophobicContact CG1-CD1 4.04Å; V454-E532 HydrophobicContact CG2-CB 3.54Å; V454-E532 PolarHBondContact N-OE2 3.25Å; V454-V538 HydrophobicContact CB-CG1 3.6Å; V454-V538 HydrophobicContact CG1-CG1 3.92Å; V454-V538 HydrophobicContact CG2-CG1 3.97Å; V454-F539 CarbonylContact C-O 3.54Å; V454-F539 VanDerWaalsContact CA-O 3.23Å; V454-F539 WeakPolarHBondContact CA-O 3.26Å; V454-F539 WeakPolarHBondContact CB-O 3.39Å; V454-I540 HydrophobicContact CG1-CG1 4.39Å
455	E	93.5	Very high	91.4	Very high	13 Å²	13	36.9 Å²	36.9	6%	0.061	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	128.8	170.7	176.9	62.1	171.4	0	0	111.5	L437 I439 L447 K452 R457 F539	L437-E455 HydrophobicContact CD2-CG 4.13Å; I439-E455 HydrophobicContact CD1-CB 4.4Å; I439-E455 HydrophobicContact CD1-CG 3.84Å; I439-E455 HydrophobicContact CG1-CG 4.36Å; I439-E455 WeakPolarHBondContact CG2-OE1 3.46Å; L447-E455 HydrophobicContact CD2-CB 4.45Å; K452-E455 IonicContact NZ-OE2 3.98Å; K452-E455 PolarHBondContact NZ-OE2 3.49Å; E455-R457 IonicContact OE1-CZ 3.08Å; E455-R457 IonicContact OE1-NE 2.76Å; E455-R457 PolarHBondContact OE1-NE 2.71Å; E455-R457 IonicContact OE1-NH2 3.66Å; E455-R457 PolarHBondContact OE1-NH2 3.36Å; E455-F539 HydrophobicContact CB-CB 4.46Å; E455-F539 PolarHBondContact N-O 3.01Å; E455-F539 PolarHBondContact O-N 2.96Å
456	G	92.2	Very high	91.3	Very high	12 Å²	12	39.6 Å²	39.6	12%	0.124	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	134.8	-177.4	0	0	0	0	0	112.2	S533 S535	G456-S533 WeakPolarHBondContact CA-OG 3.25Å; G456-S535 VanDerWaalsContact C-CB 3.46Å; G456-S535 VanDerWaalsContact C-OG 3.29Å; G456-S535 VanDerWaalsContact CA-CB 3.41Å; G456-S535 WeakPolarHBondContact CA-OG 3.03Å
457	R	92.1	Very high	91.4	Very high	32 Å²	32	39.5 Å²	39.5	12%	0.121	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	157.9	172.3	-67.2	-64.7	154.4	131.8	-3.4	112.8	S438 E455 W459 S535 F537 F539 P557	S438-R457 PolarHBondContact O-NH1 3.22Å; S438-R457 VanDerWaalsContact O-NH1 3.13Å; S438-R457 PolarHBondContact O-NH2 3.27Å; E455-R457 IonicContact OE1-CZ 3.08Å; E455-R457 IonicContact OE1-NE 2.76Å; E455-R457 PolarHBondContact OE1-NE 2.71Å; E455-R457 IonicContact OE1-NH2 3.66Å; E455-R457 PolarHBondContact OE1-NH2 3.36Å; R457-W459 HydrophobicContact CG-CZ2 4.33Å; R457-W459 PolarHBondContact O-N 2.89Å; R457-S535 VanDerWaalsContact N-CB 3.27Å; R457-S535 PolarHBondContact N-OG 3.45Å; R457-F537 PolarHBondContact N-O 3.5Å; R457-F537 PolarHBondContact O-N 2.95Å; R457-F537 VanDerWaalsContact O-N 3.11Å; R457-F537 VanDerWaalsContact O-O 3.13Å; R457-F539 HydrophobicContact CB-CE1 4.14Å; R457-F539 HydrophobicContact CB-CE2 4.26Å; R457-F539 HydrophobicContact CB-CZ 3.75Å; R457-F539 HydrophobicContact CG-CD2 4.4Å; R457-F539 HydrophobicContact CG-CE1 4.44Å; R457-F539 HydrophobicContact CG-CE2 3.69Å; R457-F539 HydrophobicContact CG-CZ 3.71Å; R457-P557 PolarHBondContact NH1-O 2.91Å; R457-P557 VanDerWaalsContact NH1-O 3.14Å
458	S	92.9	Very high	91.5	Very high	99 Å²	99	39.4 Å²	39.4	69%	0.692	19%	0.192	S	C	*	.	S	Bend	trans	-78	1.1	173.9	52.3	0	0	0	0	114.2
459	W	93.4	Very high	91.7	Very high	59 Å²	59	39.4 Å²	39.4	22%	0.223	19%	0.192	C	C	.	.	S	Bend	trans	-143.2	142.4	-173.2	55.4	-86.4	0	0	0	111.2	L437 R457 F537 F539 K558 I559	L437-W459 HydrophobicContact CD1-CZ2 4.21Å; R457-W459 HydrophobicContact CG-CZ2 4.33Å; R457-W459 PolarHBondContact O-N 2.89Å; W459-F537 VanDerWaalsContact C-CD2 3.5Å; W459-F539 HydrophobicContact CE3-CZ 4.36Å; W459-F539 HydrophobicContact CH2-CE2 4.13Å; W459-F539 AromaticContact CH2-CZ 3.99Å; W459-F539 HydrophobicContact CH2-CZ 3.99Å; W459-F539 HydrophobicContact CZ2-CE2 4.34Å; W459-F539 HydrophobicContact CZ2-CZ 4.21Å; W459-F539 HydrophobicContact CZ3-CZ 4.09Å; W459-F539 WeakPolarHBondContact O-CE1 3.39Å; W459-K558 HydrophobicContact CZ2-CB 4.3Å; W459-K558 HydrophobicContact CZ2-CG 4.42Å; W459-I559 HydrophobicContact CH2-CB 4.19Å; W459-I559 HydrophobicContact CH2-CD1 3.94Å; W459-I559 HydrophobicContact CH2-CG1 3.87Å; W459-I559 HydrophobicContact CZ3-CD1 4.42Å
460	Y	93.1	Very high	92	Very high	111 Å²	111	34.2 Å²	34.2	44%	0.435	17%	0.172	S	C	.	.			trans	-75	145.7	179.3	176.6	-91.6	0	0	0	112.2	P462 R464 C516 F537	Y460-P462 HydrophobicContact CE1-CB 4.09Å; Y460-R464 PolarHBondContact OH-NH2 2.87Å; Y460-C516 HydrophobicContact CD2-CB 4.25Å; Y460-C516 WeakPolarHBondContact CD2-SG 3.27Å; Y460-C516 HydrophobicContact CE2-CB 3.92Å; Y460-C516 VanDerWaalsContact CE2-O 3.24Å; Y460-C516 WeakPolarHBondContact CE2-O 3.34Å; Y460-F537 AromaticContact CD2-CD1 3.97Å; Y460-F537 HydrophobicContact CD2-CD1 3.97Å; Y460-F537 HydrophobicContact CD2-CE1 4.09Å; Y460-F537 HydrophobicContact CG-CD1 4.45Å; Y460-F537 HydrophobicContact CG-CE1 4.42Å
461	T	90.2	Very high	92.3	Very high	6 Å²	6	33.5 Å²	33.5	4%	0.037	17%	0.165	C	C	.	.			trans	-121.8	130.1	170.7	-170.8	0	0	0	0	112.6	H463 R464 L513 C516 F539 I559	T461-H463 VanDerWaalsContact C-N 3.31Å; T461-H463 WeakPolarHBondContact OG1-CB 3.47Å; T461-H463 PolarHBondContact OG1-N 2.87Å; T461-R464 PolarHBondContact O-NH1 2.94Å; T461-L513 HydrophobicContact CG2-CD1 3.85Å; T461-C516 HydrophobicContact CG2-CB 3.96Å; T461-C516 PolarHBondContact N-SG 3.49Å; T461-C516 VanDerWaalsContact N-SG 3.42Å; T461-C516 WeakPolarHBondContact O-CB 3.33Å; T461-F539 HydrophobicContact CG2-CD1 3.86Å; T461-F539 HydrophobicContact CG2-CD2 4.19Å; T461-F539 HydrophobicContact CG2-CE1 3.62Å; T461-F539 HydrophobicContact CG2-CE2 3.94Å; T461-F539 HydrophobicContact CG2-CG 4.16Å; T461-F539 HydrophobicContact CG2-CZ 3.65Å; T461-I559 HydrophobicContact CG2-CD1 4.43Å
462	P	89.9	Confident	92.5	Very high	99 Å²	99	34 Å²	34	64%	0.643	17%	0.168	S	C	*	.			trans	-83.8	-3.4	169.1	34.9	-35	0	0	0	113	Y460 R464	Y460-P462 HydrophobicContact CE1-CB 4.09Å; P462-R464 VanDerWaalsContact C-NH1 3.34Å
463	H	88.5	Confident	92.5	Very high	31 Å²	31	37.5 Å²	37.5	14%	0.144	20%	0.199	C	C	.	.			trans	-62.6	135.8	177.8	-178.3	-76.5	0	0	0	111	W435 T461 G465 R466 L513 I559	W435-H463 AromaticContact CD1-CD2 3.41Å; W435-H463 VanDerWaalsContact CD1-CD2 3.41Å; W435-H463 AromaticContact CD1-NE2 3.09Å; W435-H463 AromaticContact CG-CD2 3.64Å; W435-H463 AromaticContact CG-NE2 3.48Å; W435-H463 AromaticContact NE1-CD2 3.98Å; T461-H463 VanDerWaalsContact C-N 3.31Å; T461-H463 WeakPolarHBondContact OG1-CB 3.47Å; T461-H463 PolarHBondContact OG1-N 2.87Å; H463-G465 PolarHBondContact CE1-O 3.43Å; H463-R466 PolarHBondContact CE1-O 3.17Å; H463-L513 WeakPolarHBondContact O-CD2 3.44Å; H463-I559 HydrophobicContact CB-CD1 4.35Å
464	R	89.3	Confident	92.6	Very high	52 Å²	52	37.2 Å²	37.2	20%	0.196	20%	0.201	C	C	.	.			trans	-136.5	154.6	175.5	-61.7	-63.9	179.3	-81.7	-1.2	109.4	Y460 T461 P462 L513 I514 D515	Y460-R464 PolarHBondContact OH-NH2 2.87Å; T461-R464 PolarHBondContact O-NH1 2.94Å; P462-R464 VanDerWaalsContact C-NH1 3.34Å; R464-L513 WeakPolarHBondContact CA-O 3.28Å; R464-I514 VanDerWaalsContact CD-O 3.23Å; R464-I514 WeakPolarHBondContact CD-O 3.33Å; R464-I514 PolarHBondContact NE-O 2.97Å; R464-D515 IonicContact CZ-OD1 3.5Å; R464-D515 VanDerWaalsContact CZ-OD1 3.27Å; R464-D515 IonicContact NE-OD1 2.73Å; R464-D515 PolarHBondContact NE-OD1 3.32Å; R464-D515 IonicContact NH2-OD1 3.35Å; R464-D515 PolarHBondContact NH2-OD1 2.91Å
465	G	89.9	Confident	92.4	Very high	7 Å²	7	44.7 Å²	44.7	7%	0.072	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	82.3	-159.7	-170.4	0	0	0	0	0	113.1	H463 L467 L513	H463-G465 PolarHBondContact CE1-O 3.43Å; G465-L467 PolarHBondContact O-N 3.28Å; G465-L513 PolarHBondContact N-O 2.88Å; G465-L513 PolarHBondContact O-N 3.11Å
466	R	91.4	Very high	92.4	Very high	56 Å²	56	45.3 Å²	45.3	21%	0.211	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	127	-163.8	-166.7	170.4	-59.1	132.2	14.8	114.9	E429 D432 H463 C510 D512	E429-R466 PolarHBondContact O-NH2 3.08Å; D432-R466 WeakPolarHBondContact OD2-CD 3.33Å; D432-R466 IonicContact OD2-CZ 3.48Å; D432-R466 IonicContact OD2-NH1 2.81Å; D432-R466 PolarHBondContact OD2-NH1 3.41Å; H463-R466 PolarHBondContact CE1-O 3.17Å; R466-C510 HydrophobicContact CG-CB 3.97Å; R466-D512 VanDerWaalsContact CA-OD1 3.29Å; R466-D512 WeakPolarHBondContact CA-OD1 3.29Å; R466-D512 VanDerWaalsContact CB-OD1 3.3Å; R466-D512 WeakPolarHBondContact CB-OD1 3.14Å; R466-D512 WeakPolarHBondContact CG-OD1 3.36Å; R466-D512 IonicContact NE-OD1 2.62Å
467	L	94.3	Very high	92.4	Very high	2 Å²	2	46.4 Å²	46.4	1%	0.01	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	122.5	177.3	-178	64.3	0	0	0	110.8	W435 L437 G465 I469 C510 V511 L513 I559	W435-L467 HydrophobicContact CB-CD1 4.2Å; L437-L467 HydrophobicContact CB-CD1 4.13Å; L437-L467 HydrophobicContact CB-CD2 3.92Å; L437-L467 HydrophobicContact CB-CG 4.21Å; L437-L467 HydrophobicContact CD2-CD2 4.19Å; G465-L467 PolarHBondContact O-N 3.28Å; L467-I469 HydrophobicContact CD2-CD1 4.4Å; L467-I469 HydrophobicContact CG-CD1 4.3Å; L467-C510 WeakPolarHBondContact O-CA 3.46Å; L467-C510 WeakPolarHBondContact O-CB 2.97Å; L467-V511 HydrophobicContact CB-CG2 4.41Å; L467-V511 PolarHBondContact N-O 3.3Å; L467-V511 PolarHBondContact O-N 3.21Å; L467-V511 VanDerWaalsContact O-O 3.09Å; L467-L513 HydrophobicContact CD2-CD1 3.86Å; L467-I559 HydrophobicContact CD1-CD1 4.13Å; L467-I559 HydrophobicContact CD1-CG1 4.01Å; L467-I559 HydrophobicContact CD2-CD1 4.38Å
468	W	95.2	Very high	92.4	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	140	176.6	-63	89.2	0	0	0	111.1	D432 W435 C436 L437 L507 C510 M547 L562 H567 A570 K571 L574	D432-W468 PolarHBondContact OD1-NE1 3.42Å; D432-W468 VanDerWaalsContact OD2-CZ2 3.3Å; D432-W468 WeakPolarHBondContact OD2-CZ2 3.34Å; W435-W468 WeakPolarHBondContact O-CB 3.46Å; W435-W468 VanDerWaalsContact O-CD1 3.24Å; W435-W468 PolarHBondContact O-N 3.35Å; C436-W468 CarbonylContact C-O 3.51Å; C436-W468 WeakPolarHBondContact CA-O 3.43Å; C436-W468 HydrophobicContact CB-CB 4.11Å; C436-W468 PolarHBondContact SG-O 2.81Å; C436-W468 VanDerWaalsContact SG-O 3.41Å; L437-W468 PolarHBondContact N-O 2.62Å; W468-L507 HydrophobicContact CB-CD1 4.47Å; W468-L507 HydrophobicContact CE3-CD2 4.04Å; W468-C510 HydrophobicContact CD2-CB 4.02Å; W468-C510 HydrophobicContact CE3-CB 3.72Å; W468-C510 HydrophobicContact CG-CB 4.49Å; W468-C510 HydrophobicContact CZ3-CB 4.07Å; W468-M547 HydrophobicContact CE3-SD 4.08Å; W468-M547 HydrophobicContact CZ3-SD 3.53Å; W468-M547 VanDerWaalsContact CZ3-SD 3.53Å; W468-L562 HydrophobicContact CB-CD1 3.87Å; W468-L562 HydrophobicContact CD2-CD1 4.24Å; W468-L562 HydrophobicContact CG-CD1 3.67Å; W468-H567 AromaticContact CE2-CD2 3.85Å; W468-H567 AromaticContact CZ2-CD2 3.97Å; W468-H567 AromaticContact NE1-CD2 3.56Å; W468-H567 AromaticContact NE1-NE2 3.59Å; W468-A570 HydrophobicContact CE3-CB 3.92Å; W468-A570 HydrophobicContact CH2-CB 3.59Å; W468-A570 HydrophobicContact CZ2-CB 4.2Å; W468-A570 HydrophobicContact CZ3-CB 3.47Å; W468-A570 VanDerWaalsContact CZ3-CB 3.47Å; W468-K571 HydrophobicContact CH2-CG 4.23Å; W468-K571 HydrophobicContact CZ2-CG 3.88Å; W468-L574 HydrophobicContact CH2-CD1 3.4Å; W468-L574 HydrophobicContact CH2-CG 3.96Å; W468-L574 HydrophobicContact CZ2-CD1 4.3Å; W468-L574 HydrophobicContact CZ3-CD1 3.79Å; W468-L574 HydrophobicContact CZ3-CD2 4.38Å; W468-L574 HydrophobicContact CZ3-CG 4.06Å
469	I	95.8	Very high	92.3	Very high	1 Å²	1	51.9 Å²	51.9	1%	0.005	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	127	-173.7	-58.2	-55	0	0	0	110.8	I439 L447 V448 L467 L508 G509 V511	I439-I469 HydrophobicContact CD1-CD1 3.92Å; I439-I469 HydrophobicContact CD1-CG2 3.97Å; I439-I469 HydrophobicContact CG1-CG2 4.37Å; L447-I469 HydrophobicContact CD2-CD1 3.99Å; L447-I469 HydrophobicContact CD2-CG1 4.2Å; V448-I469 HydrophobicContact CG1-CB 3.67Å; V448-I469 HydrophobicContact CG1-CG1 4.08Å; V448-I469 HydrophobicContact CG1-CG2 3.85Å; L467-I469 HydrophobicContact CD2-CD1 4.4Å; L467-I469 HydrophobicContact CG-CD1 4.3Å; I469-L508 PolarHBondContact O-N 3.43Å; I469-G509 PolarHBondContact N-O 2.68Å; I469-V511 HydrophobicContact CD1-CG2 3.88Å; I469-V511 HydrophobicContact CG1-CG1 4.19Å; I469-V511 HydrophobicContact CG1-CG2 3.97Å
470	A	95.8	Very high	92.2	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	128.7	-178.5	0	0	0	0	0	112.4	L437 S438 I439 T472 C506 I553	L437-A470 PolarHBondContact O-N 2.83Å; S438-A470 CarbonylContact C-O 3.17Å; S438-A470 WeakPolarHBondContact CA-O 3.45Å; S438-A470 PolarHBondContact OG-O 2.8Å; I439-A470 PolarHBondContact N-O 2.92Å; A470-T472 PolarHBondContact O-N 3.02Å; A470-C506 WeakPolarHBondContact CA-O 3.42Å; A470-I553 HydrophobicContact CB-CD1 3.43Å; A470-I553 VanDerWaalsContact CB-CD1 3.43Å; A470-I553 HydrophobicContact CB-CG1 4.35Å
471	A	95.3	Very high	92.2	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	127.6	170.1	0	0	0	0	0	110.9	Q441 A444 P503 G505 C506 L508	Q441-A471 HydrophobicContact CG-CB 3.91Å; A444-A471 HydrophobicContact CB-CB 4.39Å; A471-P503 WeakPolarHBondContact CB-O 3.28Å; A471-G505 VanDerWaalsContact O-CA 3.26Å; A471-G505 WeakPolarHBondContact O-CA 3.39Å; A471-G505 PolarHBondContact O-N 2.73Å; A471-C506 PolarHBondContact N-O 3.41Å; A471-C506 PolarHBondContact O-N 3.11Å; A471-L508 HydrophobicContact CB-CD1 4.15Å; A471-L508 HydrophobicContact CB-CD2 4.17Å; A471-L508 HydrophobicContact CB-CG 4.21Å
472	T	94.4	Very high	92.3	Very high	20 Å²	20	50.8 Å²	50.8	12%	0.123	28%	0.281	C	S	.	.			trans	-61.6	169	169.8	63.6	0	0	0	0	111.9	S438 I439 H440 A470 K474 S504 G505	S438-T472 VanDerWaalsContact OG-CG2 3.27Å; S438-T472 WeakPolarHBondContact OG-CG2 3.48Å; S438-T472 PolarHBondContact OG-N 2.95Å; I439-T472 WeakPolarHBondContact O-CG2 3.3Å; I439-T472 PolarHBondContact O-N 3.27Å; H440-T472 PolarHBondContact ND1-OG1 3.26Å; A470-T472 PolarHBondContact O-N 3.02Å; T472-K474 VanDerWaalsContact C-N 3.29Å; T472-K474 PolarHBondContact O-N 3.3Å; T472-S504 CarbonylContact O-C 3.57Å; T472-S504 WeakPolarHBondContact O-CA 3.24Å; T472-S504 WeakPolarHBondContact O-CB 3.45Å; T472-G505 PolarHBondContact O-N 3.04Å
473	A	92.4	Very high	92.3	Very high	85 Å²	85	52 Å²	52	70%	0.702	28%	0.278	S	S	*	.	S	Bend	trans	-71	-15.1	177.4	0	0	0	0	0	114.8	K475	A473-K475 PolarHBondContact O-N 2.88Å
474	K	91	Very high	92.4	Very high	97 Å²	97	52 Å²	52	42%	0.422	28%	0.278	S	S	.	.	P	Polyproline II helix	trans	-67.6	121.3	173.9	-168.5	-153.9	169	-161.1	0	109.1	T472 E480	T472-K474 VanDerWaalsContact C-N 3.29Å; T472-K474 PolarHBondContact O-N 3.3Å; K474-E480 VanDerWaalsContact NZ-CD 3.26Å; K474-E480 IonicContact NZ-OE1 2.75Å; K474-E480 PolarHBondContact NZ-OE1 3Å; K474-E480 IonicContact NZ-OE2 2.67Å; K474-E480 PolarHBondContact NZ-OE2 2.9Å; K474-E480 VanDerWaalsContact NZ-OE2 3.08Å
475	K	89.7	Confident	92.5	Very high	156 Å²	156	51.3 Å²	51.3	68%	0.678	28%	0.278	S	S	*	.	P	Polyproline II helix	trans	-75.4	140.7	166.3	-65.6	-178.5	178.8	-177	0	109.5	A473	A473-K475 PolarHBondContact O-N 2.88Å
476	P	92.8	Very high	92.5	Very high	26 Å²	26	53.9 Å²	53.9	17%	0.169	30%	0.298	C	S	.	.	P	Polyproline II helix	trans	-74.3	153.2	177.4	34.2	-34.7	0	0	0	110.6	Q441 P442 E480 V481 Y502	Q441-P476 HydrophobicContact CB-CB 4.13Å; Q441-P476 HydrophobicContact CB-CG 3.92Å; P442-P476 HydrophobicContact CB-CB 4.47Å; P476-E480 WeakPolarHBondContact CA-OE2 3.28Å; P476-V481 HydrophobicContact CB-CG2 3.89Å; P476-V481 HydrophobicContact CG-CG2 3.97Å; P476-Y502 HydrophobicContact CG-CG 4.21Å
477	S	93.4	Very high	92.4	Very high	35 Å²	35	54.6 Å²	54.6	25%	0.245	31%	0.309	C	S	.	.	P	Polyproline II helix	trans	-78	151.2	169.1	107	0	0	0	0	110.5	Q479 E480 V481	S477-Q479 PolarHBondContact O-N 2.95Å; S477-Q479 PolarHBondContact OG-N 3.45Å; S477-E480 PolarHBondContact N-OE2 3.41Å; S477-E480 PolarHBondContact O-N 3.19Å; S477-E480 WeakPolarHBondContact OG-CG 3.2Å; S477-E480 PolarHBondContact OG-N 3.4Å; S477-V481 WeakPolarHBondContact O-CG2 3.31Å; S477-V481 PolarHBondContact O-N 2.77Å
478	P	91	Very high	92.1	Very high	110 Å²	110	54.8 Å²	54.8	71%	0.714	31%	0.309	S	S	*	.	H	α-helix	trans	-65	-24.7	176.7	27.1	-34.3	0	0	0	112.6	S482	P478-S482 WeakPolarHBondContact O-CB 3.47Å; P478-S482 PolarHBondContact O-N 2.64Å
479	Q	92.6	Very high	91.8	Very high	137 Å²	137	59.7 Å²	59.7	64%	0.64	33%	0.328	S	S	*	.	H	α-helix	trans	-72.3	-49.2	173.2	-68.4	166.7	-44.2	0	0	110.7	S477 V481 S482 E483	S477-Q479 PolarHBondContact O-N 2.95Å; S477-Q479 PolarHBondContact OG-N 3.45Å; Q479-V481 PolarHBondContact O-N 2.78Å; Q479-S482 PolarHBondContact O-N 2.81Å; Q479-E483 WeakPolarHBondContact O-CB 3.46Å; Q479-E483 WeakPolarHBondContact O-CG 3.44Å; Q479-E483 PolarHBondContact O-N 3.01Å
480	E	90.4	Very high	91.4	Very high	56 Å²	56	67 Å²	67	26%	0.262	37%	0.366	S	S	.	.	H	α-helix	trans	-52.7	-42.9	174.3	-70.2	171.3	169.4	0	0	111.1	K474 P476 S477 L484	K474-E480 VanDerWaalsContact NZ-CD 3.26Å; K474-E480 IonicContact NZ-OE1 2.75Å; K474-E480 PolarHBondContact NZ-OE1 3Å; K474-E480 IonicContact NZ-OE2 2.67Å; K474-E480 PolarHBondContact NZ-OE2 2.9Å; K474-E480 VanDerWaalsContact NZ-OE2 3.08Å; P476-E480 WeakPolarHBondContact CA-OE2 3.28Å; S477-E480 PolarHBondContact N-OE2 3.41Å; S477-E480 PolarHBondContact O-N 3.19Å; S477-E480 WeakPolarHBondContact OG-CG 3.2Å; S477-E480 PolarHBondContact OG-N 3.4Å; E480-L484 WeakPolarHBondContact O-CB 3.38Å; E480-L484 WeakPolarHBondContact O-CD1 3.32Å; E480-L484 VanDerWaalsContact O-CG 3.26Å; E480-L484 WeakPolarHBondContact O-CG 3.18Å; E480-L484 PolarHBondContact O-N 3.34Å
481	V	92.3	Very high	90.8	Very high	20 Å²	20	70.4 Å²	70.4	12%	0.121	38%	0.384	C	S	.	.	H	α-helix	trans	-65.9	-49.8	176.1	177.1	0	0	0	0	111.6	P442 P476 S477 Q479 L484 Q485 Y502	P442-V481 HydrophobicContact CB-CG2 4.12Å; P442-V481 HydrophobicContact CG-CG2 4.27Å; P476-V481 HydrophobicContact CB-CG2 3.89Å; P476-V481 HydrophobicContact CG-CG2 3.97Å; S477-V481 WeakPolarHBondContact O-CG2 3.31Å; S477-V481 PolarHBondContact O-N 2.77Å; Q479-V481 PolarHBondContact O-N 2.78Å; V481-L484 PolarHBondContact O-N 3.01Å; V481-Q485 HydrophobicContact CG1-CG 4.3Å; V481-Q485 WeakPolarHBondContact O-CB 3.49Å; V481-Q485 VanDerWaalsContact O-CG 3.3Å; V481-Q485 WeakPolarHBondContact O-CG 3.5Å; V481-Q485 PolarHBondContact O-N 2.94Å; V481-Y502 HydrophobicContact CG1-CE2 3.92Å; V481-Y502 HydrophobicContact CG2-CD2 4.37Å; V481-Y502 HydrophobicContact CG2-CE2 4.41Å
482	S	92.3	Very high	90	Very high	77 Å²	77	75.4 Å²	75.4	54%	0.538	40%	0.403	S	S	.	.	H	α-helix	trans	-62.7	-45.2	-176.2	-168.7	0	0	0	0	112.5	P478 Q479 Q485 A486	P478-S482 WeakPolarHBondContact O-CB 3.47Å; P478-S482 PolarHBondContact O-N 2.64Å; Q479-S482 PolarHBondContact O-N 2.81Å; S482-Q485 PolarHBondContact O-N 3.29Å; S482-A486 PolarHBondContact O-N 3.18Å
483	E	91.4	Very high	89.2	Confident	125 Å²	125	75.9 Å²	75.9	58%	0.584	41%	0.412	S	S	*	.	H	α-helix	trans	-61.8	-48.3	177.3	-70.9	165.8	-159.6	0	0	111.1	Q479 Q485 A486 T487	Q479-E483 WeakPolarHBondContact O-CB 3.46Å; Q479-E483 WeakPolarHBondContact O-CG 3.44Å; Q479-E483 PolarHBondContact O-N 3.01Å; E483-Q485 PolarHBondContact O-N 3.27Å; E483-A486 WeakPolarHBondContact O-CB 3.44Å; E483-A486 PolarHBondContact O-N 3.38Å; E483-T487 PolarHBondContact O-N 3.05Å; E483-T487 PolarHBondContact O-OG1 3.15Å; E483-T487 VanDerWaalsContact O-OG1 3.09Å
484	L	89.9	Confident	88.2	Confident	29 Å²	29	80.6 Å²	80.6	15%	0.152	42%	0.416	C	S	.	.	H	α-helix	trans	-66.1	-36.1	177.7	-71	167.7	0	0	0	112.2	P442 W443 E480 V481 A486 T487 Y488	P442-L484 HydrophobicContact CG-CD1 3.44Å; P442-L484 VanDerWaalsContact CG-CD1 3.44Å; W443-L484 HydrophobicContact CD2-CD1 4.31Å; W443-L484 HydrophobicContact CH2-CD1 4.39Å; W443-L484 HydrophobicContact CZ2-CD1 3.64Å; W443-L484 HydrophobicContact CZ2-CD2 4.36Å; E480-L484 WeakPolarHBondContact O-CB 3.38Å; E480-L484 WeakPolarHBondContact O-CD1 3.32Å; E480-L484 VanDerWaalsContact O-CG 3.26Å; E480-L484 WeakPolarHBondContact O-CG 3.18Å; E480-L484 PolarHBondContact O-N 3.34Å; V481-L484 PolarHBondContact O-N 3.01Å; L484-A486 VanDerWaalsContact C-N 3.34Å; L484-A486 PolarHBondContact O-N 3.47Å; L484-T487 PolarHBondContact O-N 3.4Å; L484-Y488 HydrophobicContact CD2-CE2 4.28Å; L484-Y488 WeakPolarHBondContact O-CD2 3.39Å; L484-Y488 PolarHBondContact O-N 3.45Å
485	Q	90.4	Very high	87.5	Confident	39 Å²	39	83.5 Å²	83.5	18%	0.182	44%	0.437	C	S	.	.	H	α-helix	trans	-61.5	-41.5	172	-73.7	-169.6	16.1	0	0	112	V481 S482 E483 R489 F498	V481-Q485 HydrophobicContact CG1-CG 4.3Å; V481-Q485 WeakPolarHBondContact O-CB 3.49Å; V481-Q485 VanDerWaalsContact O-CG 3.3Å; V481-Q485 WeakPolarHBondContact O-CG 3.5Å; V481-Q485 PolarHBondContact O-N 2.94Å; S482-Q485 PolarHBondContact O-N 3.29Å; E483-Q485 PolarHBondContact O-N 3.27Å; Q485-R489 WeakPolarHBondContact O-CB 3.4Å; Q485-R489 WeakPolarHBondContact O-CG 3.31Å; Q485-R489 PolarHBondContact O-N 3.23Å; Q485-F498 HydrophobicContact CB-CD1 4.43Å; Q485-F498 HydrophobicContact CB-CE1 4.24Å; Q485-F498 HydrophobicContact CB-CE2 4.46Å; Q485-F498 HydrophobicContact CB-CZ 4.25Å; Q485-F498 HydrophobicContact CG-CB 4.36Å; Q485-F498 HydrophobicContact CG-CD1 3.63Å; Q485-F498 HydrophobicContact CG-CD2 4.23Å; Q485-F498 HydrophobicContact CG-CE1 3.89Å; Q485-F498 HydrophobicContact CG-CE2 4.48Å; Q485-F498 HydrophobicContact CG-CG 3.8Å; Q485-F498 HydrophobicContact CG-CZ 4.31Å
486	A	90.3	Very high	87	Confident	60 Å²	60	77.6 Å²	77.6	50%	0.496	41%	0.413	S	S	.	.	H	α-helix	trans	-63.3	-45	175.6	0	0	0	0	0	111.7	S482 E483 L484 R489 L490	S482-A486 PolarHBondContact O-N 3.18Å; E483-A486 WeakPolarHBondContact O-CB 3.44Å; E483-A486 PolarHBondContact O-N 3.38Å; L484-A486 VanDerWaalsContact C-N 3.34Å; L484-A486 PolarHBondContact O-N 3.47Å; A486-R489 PolarHBondContact O-N 2.92Å; A486-L490 PolarHBondContact O-N 2.97Å
487	T	89.7	Confident	86.4	Confident	71 Å²	71	83.8 Å²	83.8	44%	0.436	44%	0.44	S	S	.	.	H	α-helix	trans	-61.7	-49.4	177.5	-56.8	0	0	0	0	112.3	E483 L484 R489 L490 L491	E483-T487 PolarHBondContact O-N 3.05Å; E483-T487 PolarHBondContact O-OG1 3.15Å; E483-T487 VanDerWaalsContact O-OG1 3.09Å; L484-T487 PolarHBondContact O-N 3.4Å; T487-R489 PolarHBondContact O-N 3.17Å; T487-L490 WeakPolarHBondContact O-CB 3.23Å; T487-L490 PolarHBondContact O-N 3.4Å; T487-L490 VanDerWaalsContact O-N 3.13Å; T487-L491 HydrophobicContact CG2-CD1 4.01Å; T487-L491 WeakPolarHBondContact O-CG 3.39Å; T487-L491 PolarHBondContact O-N 2.98Å
488	Y	87.9	Confident	86.1	Confident	7 Å²	7	83.2 Å²	83.2	3%	0.027	43%	0.433	C	S	.	.	H	α-helix	trans	-70.9	-28.3	-179.7	-80	-86.5	0	0	0	113	L446 I451 K452 L484 L490 L491 R492 E532	L446-Y488 HydrophobicContact CD1-CD2 4.1Å; L446-Y488 HydrophobicContact CD1-CE2 4.15Å; I451-Y488 HydrophobicContact CG2-CD1 3.81Å; I451-Y488 HydrophobicContact CG2-CG 3.96Å; K452-Y488 HydrophobicContact CB-CE1 3.99Å; K452-Y488 HydrophobicContact CG-CE1 4.23Å; K452-Y488 WeakPolarHBondContact CG-OH 3.28Å; L484-Y488 HydrophobicContact CD2-CE2 4.28Å; L484-Y488 WeakPolarHBondContact O-CD2 3.39Å; L484-Y488 PolarHBondContact O-N 3.45Å; Y488-L490 VanDerWaalsContact C-N 3.28Å; Y488-L490 PolarHBondContact O-N 3.29Å; Y488-L491 PolarHBondContact O-N 3.24Å; Y488-R492 HydrophobicContact CD1-CG 4.21Å; Y488-R492 WeakPolarHBondContact O-CB 3.38Å; Y488-R492 PolarHBondContact O-N 2.94Å; Y488-E532 HydrophobicContact CE1-CG 4.05Å
489	R	89.5	Confident	85.9	Confident	102 Å²	102	78.6 Å²	78.6	39%	0.385	40%	0.403	S	S	.	.	H	α-helix	trans	-64	-31	168.7	-76.7	174.2	-174.6	122.6	9.9	113	Q485 A486 T487 G493 F498	Q485-R489 WeakPolarHBondContact O-CB 3.4Å; Q485-R489 WeakPolarHBondContact O-CG 3.31Å; Q485-R489 PolarHBondContact O-N 3.23Å; A486-R489 PolarHBondContact O-N 2.92Å; T487-R489 PolarHBondContact O-N 3.17Å; R489-G493 WeakPolarHBondContact CA-O 3.48Å; R489-G493 CarbonylContact O-C 3.56Å; R489-G493 WeakPolarHBondContact O-CA 3.48Å; R489-G493 PolarHBondContact O-N 2.9Å; R489-G493 VanDerWaalsContact O-O 3.07Å; R489-F498 HydrophobicContact CG-CE2 3.68Å; R489-F498 HydrophobicContact CG-CZ 4.08Å
490	L	86.4	Confident	85.4	Confident	155 Å²	155	79.4 Å²	79.4	81%	0.812	41%	0.412	S	S	*	.	H	α-helix	trans	-76	-42.7	175	-173.1	64.9	0	0	0	111.7	A486 T487 Y488	A486-L490 PolarHBondContact O-N 2.97Å; T487-L490 WeakPolarHBondContact O-CB 3.23Å; T487-L490 PolarHBondContact O-N 3.4Å; T487-L490 VanDerWaalsContact O-N 3.13Å; Y488-L490 VanDerWaalsContact C-N 3.28Å; Y488-L490 PolarHBondContact O-N 3.29Å
491	L	83.6	Confident	85.2	Confident	72 Å²	72	82.8 Å²	82.8	38%	0.377	43%	0.432	S	S	.	.	H	α-helix	trans	-75.4	-32.3	-177.8	-67.2	172.9	0	0	0	114.3	T487 Y488	T487-L491 HydrophobicContact CG2-CD1 4.01Å; T487-L491 WeakPolarHBondContact O-CG 3.39Å; T487-L491 PolarHBondContact O-N 2.98Å; Y488-L491 PolarHBondContact O-N 3.24Å
492	R	79.4	Confident	85.1	Confident	104 Å²	104	83.4 Å²	83.4	39%	0.392	43%	0.432	S	S	.	.	H	α-helix	trans	-119.1	-3.5	-169.3	-53.8	-77	-89.3	123.2	4.1	113.7	G450 I451 Y488 V496	G450-R492 PolarHBondContact O-NH2 3.12Å; I451-R492 PolarHBondContact O-NE 3.14Å; Y488-R492 HydrophobicContact CD1-CG 4.21Å; Y488-R492 WeakPolarHBondContact O-CB 3.38Å; Y488-R492 PolarHBondContact O-N 2.94Å; R492-V496 HydrophobicContact CB-CG2 3.83Å
493	G	77.2	Confident	85.1	Confident	30 Å²	30	81.5 Å²	81.5	31%	0.309	42%	0.418	S	S	.	.			trans	99.4	169	-177.9	0	0	0	0	0	114	R489 D495 V496	R489-G493 WeakPolarHBondContact CA-O 3.48Å; R489-G493 CarbonylContact O-C 3.56Å; R489-G493 WeakPolarHBondContact O-CA 3.48Å; R489-G493 PolarHBondContact O-N 2.9Å; R489-G493 VanDerWaalsContact O-O 3.07Å; G493-D495 VanDerWaalsContact C-N 3.33Å; G493-D495 PolarHBondContact O-N 3.29Å; G493-V496 WeakPolarHBondContact O-CG2 3.44Å
494	K	70.4	Confident	85.1	Confident	184 Å²	184	77.2 Å²	77.2	80%	0.8	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.7	-23.1	-175.7	-70.8	-177.4	179	176.9	0	113.5	V496	K494-V496 PolarHBondContact O-N 2.68Å; K494-V496 VanDerWaalsContact O-N 3.14Å
495	D	76	Confident	85.3	Confident	159 Å²	159	76.8 Å²	76.8	85%	0.85	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.3	19.5	-170	-44.5	-61.4	0	0	0	113.4	G493	G493-D495 VanDerWaalsContact C-N 3.33Å; G493-D495 PolarHBondContact O-N 3.29Å
496	V	80.2	Confident	85.4	Confident	31 Å²	31	76.1 Å²	76.1	19%	0.188	40%	0.404	C	S	.	.			trans	-84.5	114.1	179.9	178.4	0	0	0	0	110.7	I451 R492 G493 K494 F498	I451-V496 HydrophobicContact CB-CG1 4.38Å; I451-V496 HydrophobicContact CD1-CG1 3.85Å; I451-V496 HydrophobicContact CG1-CG1 3.74Å; I451-V496 HydrophobicContact CG2-CG1 3.85Å; R492-V496 HydrophobicContact CB-CG2 3.83Å; G493-V496 WeakPolarHBondContact O-CG2 3.44Å; K494-V496 PolarHBondContact O-N 2.68Å; K494-V496 VanDerWaalsContact O-N 3.14Å; V496-F498 HydrophobicContact CB-CE2 3.87Å; V496-F498 HydrophobicContact CB-CZ 4.18Å; V496-F498 HydrophobicContact CG1-CD2 4.2Å; V496-F498 HydrophobicContact CG1-CE1 4.18Å; V496-F498 HydrophobicContact CG1-CE2 3.67Å; V496-F498 HydrophobicContact CG1-CZ 3.68Å; V496-F498 WeakPolarHBondContact O-CD2 3.45Å; V496-F498 WeakPolarHBondContact O-CE2 3.19Å; V496-F498 PolarHBondContact O-N 2.92Å
497	E	80.9	Confident	85.6	Confident	157 Å²	157	73.2 Å²	73.2	73%	0.734	38%	0.38	S	S	*	.	P	Polyproline II helix	trans	-73.6	117.8	170.4	-65.6	-169.1	173	0	0	111.6	I451	I451-E497 WeakPolarHBondContact CD1-O 3.42Å
498	F	86.9	Confident	85.8	Confident	23 Å²	23	69.9 Å²	69.9	10%	0.101	36%	0.359	C	S	.	.	P	Polyproline II helix	trans	-95.4	143.7	174.9	-67.5	-88.5	0	0	0	111.1	L446 I451 Q485 R489 V496	L446-F498 HydrophobicContact CD2-CD1 3.7Å; L446-F498 HydrophobicContact CD2-CE1 3.93Å; I451-F498 HydrophobicContact CD1-CD1 3.89Å; I451-F498 HydrophobicContact CD1-CE1 4.15Å; I451-F498 HydrophobicContact CG2-CE1 4.06Å; I451-F498 HydrophobicContact CG2-CZ 4.5Å; Q485-F498 HydrophobicContact CB-CD1 4.43Å; Q485-F498 HydrophobicContact CB-CE1 4.24Å; Q485-F498 HydrophobicContact CB-CE2 4.46Å; Q485-F498 HydrophobicContact CB-CZ 4.25Å; Q485-F498 HydrophobicContact CG-CB 4.36Å; Q485-F498 HydrophobicContact CG-CD1 3.63Å; Q485-F498 HydrophobicContact CG-CD2 4.23Å; Q485-F498 HydrophobicContact CG-CE1 3.89Å; Q485-F498 HydrophobicContact CG-CE2 4.48Å; Q485-F498 HydrophobicContact CG-CG 3.8Å; Q485-F498 HydrophobicContact CG-CZ 4.31Å; R489-F498 HydrophobicContact CG-CE2 3.68Å; R489-F498 HydrophobicContact CG-CZ 4.08Å; V496-F498 HydrophobicContact CB-CE2 3.87Å; V496-F498 HydrophobicContact CB-CZ 4.18Å; V496-F498 HydrophobicContact CG1-CD2 4.2Å; V496-F498 HydrophobicContact CG1-CE1 4.18Å; V496-F498 HydrophobicContact CG1-CE2 3.67Å; V496-F498 HydrophobicContact CG1-CZ 3.68Å; V496-F498 WeakPolarHBondContact O-CD2 3.45Å; V496-F498 WeakPolarHBondContact O-CE2 3.19Å; V496-F498 PolarHBondContact O-N 2.92Å
499	P	85.2	Confident	86.1	Confident	12 Å²	12	69.5 Å²	69.5	8%	0.078	36%	0.358	C	S	.	.	P	Polyproline II helix	trans	-68.8	140.9	174.8	26.5	-30.3	0	0	0	111.1	R449 Y502	R449-P499 HydrophobicContact CG-CG 4.46Å; P499-Y502 HydrophobicContact CG-CE1 3.96Å; P499-Y502 WeakPolarHBondContact O-CE2 3.49Å; P499-Y502 VanDerWaalsContact O-CZ 3.31Å; P499-Y502 PolarHBondContact O-OH 3.35Å
500	N	83.8	Confident	86.3	Confident	154 Å²	154	64.7 Å²	64.7	82%	0.824	34%	0.34	S	S	*	.	S	Bend	trans	-67.4	-40.5	178.3	-62	-19	0	0	0	111.9
501	D	85.3	Confident	86.7	Confident	128 Å²	128	57.4 Å²	57.4	68%	0.684	30%	0.302	S	S	*	.			trans	-116.1	140.1	-173	-68.6	-65.9	0	0	0	112.9	P503	D501-P503 VanDerWaalsContact C-CD 3.5Å; D501-P503 VanDerWaalsContact O-CD 3.23Å; D501-P503 WeakPolarHBondContact O-CD 3.37Å
502	Y	90.9	Very high	87.1	Confident	32 Å²	32	54.3 Å²	54.3	13%	0.125	29%	0.286	C	S	.	.			trans	-117.9	76.2	-179.9	-63.4	-94	0	0	0	110.7	P442 P476 V481 P499	P442-Y502 HydrophobicContact CB-CD1 3.49Å; P442-Y502 VanDerWaalsContact CB-CD1 3.49Å; P442-Y502 HydrophobicContact CB-CE1 3.46Å; P442-Y502 VanDerWaalsContact CB-CE1 3.46Å; P442-Y502 HydrophobicContact CB-CG 4.38Å; P476-Y502 HydrophobicContact CG-CG 4.21Å; V481-Y502 HydrophobicContact CG1-CE2 3.92Å; V481-Y502 HydrophobicContact CG2-CD2 4.37Å; V481-Y502 HydrophobicContact CG2-CE2 4.41Å; P499-Y502 HydrophobicContact CG-CE1 3.96Å; P499-Y502 WeakPolarHBondContact O-CE2 3.49Å; P499-Y502 VanDerWaalsContact O-CZ 3.31Å; P499-Y502 PolarHBondContact O-OH 3.35Å
503	P	91.6	Very high	87.7	Confident	38 Å²	38	49.4 Å²	49.4	25%	0.247	27%	0.267	C	S	.	.			trans	-64	140.3	-179	25.7	-33.5	0	0	0	111.6	Q441 A471 D501 L508 K550	Q441-P503 PolarHBondContact NE2-O 3Å; A471-P503 WeakPolarHBondContact CB-O 3.28Å; D501-P503 VanDerWaalsContact C-CD 3.5Å; D501-P503 VanDerWaalsContact O-CD 3.23Å; D501-P503 WeakPolarHBondContact O-CD 3.37Å; P503-L508 HydrophobicContact CG-CD2 3.9Å; P503-K550 HydrophobicContact CG-CD 4.03Å
504	S	92.2	Very high	88.4	Confident	35 Å²	35	50.9 Å²	50.9	25%	0.245	27%	0.267	C	S	.	.	S	Bend	trans	-113	138	-177.4	57.8	0	0	0	0	111.1	T472	T472-S504 CarbonylContact O-C 3.57Å; T472-S504 WeakPolarHBondContact O-CA 3.24Å; T472-S504 WeakPolarHBondContact O-CB 3.45Å
505	G	92.9	Very high	89.3	Confident	19 Å²	19	43.9 Å²	43.9	20%	0.196	24%	0.238	C	C	.	.	S	Bend	trans	77.8	27.2	-179.4	0	0	0	0	0	114.5	A471 T472 I553	A471-G505 VanDerWaalsContact O-CA 3.26Å; A471-G505 WeakPolarHBondContact O-CA 3.39Å; A471-G505 PolarHBondContact O-N 2.73Å; T472-G505 PolarHBondContact O-N 3.04Å; G505-I553 CarbonylContact C-O 3.55Å; G505-I553 PolarHBondContact O-N 3.01Å
506	C	93.6	Very high	90.2	Very high	25 Å²	25	36.5 Å²	36.5	17%	0.169	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	147.9	-177.8	-67.2	0	0	0	0	112.2	A470 A471 K550 F551	A470-C506 WeakPolarHBondContact CA-O 3.42Å; A471-C506 PolarHBondContact N-O 3.41Å; A471-C506 PolarHBondContact O-N 3.11Å; C506-K550 HydrophobicContact CB-CB 4.37Å; C506-F551 CarbonylContact C-O 3.4Å; C506-F551 VanDerWaalsContact CA-O 3.25Å; C506-F551 WeakPolarHBondContact CA-O 3.33Å
507	L	95.2	Very high	90.7	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	125.6	166.2	-163.7	147.8	0	0	0	108.6	W468 M547 K550 F551 I553 L562 I566 A570	W468-L507 HydrophobicContact CB-CD1 4.47Å; W468-L507 HydrophobicContact CE3-CD2 4.04Å; L507-M547 HydrophobicContact CD2-CE 3.52Å; L507-M547 HydrophobicContact CD2-SD 3.34Å; L507-M547 WeakPolarHBondContact CD2-SD 3.3Å; L507-K550 WeakPolarHBondContact O-CA 3.28Å; L507-K550 WeakPolarHBondContact O-CB 3.38Å; L507-F551 HydrophobicContact CB-CB 4.37Å; L507-F551 PolarHBondContact N-O 3.27Å; L507-I553 HydrophobicContact CB-CD1 3.61Å; L507-I553 HydrophobicContact CB-CG1 4.02Å; L507-I553 HydrophobicContact CD1-CD1 4.04Å; L507-I553 HydrophobicContact CG-CD1 4.17Å; L507-L562 HydrophobicContact CD1-CD1 3.72Å; L507-L562 HydrophobicContact CD1-CD2 3.77Å; L507-L562 HydrophobicContact CD1-CG 4.43Å; L507-I566 HydrophobicContact CD1-CG2 4.14Å; L507-A570 HydrophobicContact CD2-CB 4.18Å
508	L	93.5	Very high	91.3	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	-34.9	-173.5	-55.7	-175.5	0	0	0	113.3	A444 V448 I469 A471 P503 M547 K550	A444-L508 HydrophobicContact CB-CD1 3.79Å; V448-L508 HydrophobicContact CG1-CB 4.18Å; V448-L508 HydrophobicContact CG2-CB 4.05Å; V448-L508 HydrophobicContact CG2-CD1 4.32Å; I469-L508 PolarHBondContact O-N 3.43Å; A471-L508 HydrophobicContact CB-CD1 4.15Å; A471-L508 HydrophobicContact CB-CD2 4.17Å; A471-L508 HydrophobicContact CB-CG 4.21Å; P503-L508 HydrophobicContact CG-CD2 3.9Å; L508-M547 PolarHBondContact O-N 3.13Å; L508-K550 HydrophobicContact CD2-CD 4.21Å
509	G	93.7	Very high	91.5	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	166.9	-160.4	-166.2	0	0	0	0	0	112.5	I469 Q545	I469-G509 PolarHBondContact N-O 2.68Å; G509-Q545 CarbonylContact C-O 3.29Å; G509-Q545 WeakPolarHBondContact CA-O 3.36Å
510	C	93.6	Very high	91.8	Very high	1 Å²	1	35.7 Å²	35.7	1%	0.007	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	166.4	173.6	63.1	0	0	0	0	112.7	R466 L467 W468 Q545 L574	R466-C510 HydrophobicContact CG-CB 3.97Å; L467-C510 WeakPolarHBondContact O-CA 3.46Å; L467-C510 WeakPolarHBondContact O-CB 2.97Å; W468-C510 HydrophobicContact CD2-CB 4.02Å; W468-C510 HydrophobicContact CE3-CB 3.72Å; W468-C510 HydrophobicContact CG-CB 4.49Å; W468-C510 HydrophobicContact CZ3-CB 4.07Å; C510-Q545 PolarHBondContact N-O 3.03Å; C510-Q545 PolarHBondContact O-N 3.42Å; C510-L574 VanDerWaalsContact SG-CD1 3.58Å
511	V	93.9	Very high	92.1	Very high	1 Å²	1	31.8 Å²	31.8	1%	0.006	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	155.3	169.8	-60.7	0	0	0	0	108.2	L447 L467 I469 C541 P544	L447-V511 HydrophobicContact CD2-CG1 4.4Å; L447-V511 HydrophobicContact CG-CG1 4.13Å; L467-V511 HydrophobicContact CB-CG2 4.41Å; L467-V511 PolarHBondContact N-O 3.3Å; L467-V511 PolarHBondContact O-N 3.21Å; L467-V511 VanDerWaalsContact O-O 3.09Å; I469-V511 HydrophobicContact CD1-CG2 3.88Å; I469-V511 HydrophobicContact CG1-CG1 4.19Å; I469-V511 HydrophobicContact CG1-CG2 3.97Å; V511-C541 HydrophobicContact CB-CB 3.98Å; V511-C541 HydrophobicContact CG1-CB 4.38Å; V511-C541 HydrophobicContact CG2-CB 3.94Å; V511-P544 HydrophobicContact CG1-CB 4.23Å
512	D	93.1	Very high	92.3	Very high	8 Å²	8	25.7 Å²	25.7	4%	0.043	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	120.4	171.3	-62.5	-37.9	0	0	0	109.2	R466 I514 C541 K542 N543	R466-D512 VanDerWaalsContact CA-OD1 3.29Å; R466-D512 WeakPolarHBondContact CA-OD1 3.29Å; R466-D512 VanDerWaalsContact CB-OD1 3.3Å; R466-D512 WeakPolarHBondContact CB-OD1 3.14Å; R466-D512 WeakPolarHBondContact CG-OD1 3.36Å; R466-D512 IonicContact NE-OD1 2.62Å; D512-I514 HydrophobicContact CB-CD1 4.32Å; D512-I514 PolarHBondContact O-N 3.5Å; D512-C541 WeakPolarHBondContact O-CA 3.47Å; D512-K542 PolarHBondContact N-O 3.05Å; D512-K542 PolarHBondContact O-N 2.87Å; D512-N543 HydrophobicContact CB-CB 4.34Å; D512-N543 VanDerWaalsContact OD2-CB 3.25Å; D512-N543 WeakPolarHBondContact OD2-CB 3.4Å; D512-N543 PolarHBondContact OD2-ND2 3.39Å
513	L	92.7	Very high	92.3	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87	110.5	-178.8	-164.4	169.6	0	0	0	109	T461 H463 R464 G465 L467 D515 F539	T461-L513 HydrophobicContact CG2-CD1 3.85Å; H463-L513 WeakPolarHBondContact O-CD2 3.44Å; R464-L513 WeakPolarHBondContact CA-O 3.28Å; G465-L513 PolarHBondContact N-O 2.88Å; G465-L513 PolarHBondContact O-N 3.11Å; L467-L513 HydrophobicContact CD2-CD1 3.86Å; L513-D515 VanDerWaalsContact CD2-O 3.26Å; L513-D515 WeakPolarHBondContact CD2-O 3.42Å; L513-F539 HydrophobicContact CD1-CB 4.01Å; L513-F539 HydrophobicContact CD1-CD2 4.06Å; L513-F539 HydrophobicContact CD1-CG 4.12Å; L513-F539 HydrophobicContact CG-CB 4.32Å
514	I	90.5	Very high	92.2	Very high	62 Å²	62	33 Å²	33	32%	0.318	17%	0.169	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	-42.6	-172.5	-52.2	-55.1	0	0	0	112	R464 D512 I540 K542	R464-I514 VanDerWaalsContact CD-O 3.23Å; R464-I514 WeakPolarHBondContact CD-O 3.33Å; R464-I514 PolarHBondContact NE-O 2.97Å; D512-I514 HydrophobicContact CB-CD1 4.32Å; D512-I514 PolarHBondContact O-N 3.5Å; I514-I540 PolarHBondContact N-O 3.06Å; I514-K542 HydrophobicContact CD1-CB 4.21Å; I514-K542 HydrophobicContact CD1-CD 4.19Å; I514-K542 HydrophobicContact CD1-CG 4.36Å; I514-K542 HydrophobicContact CG1-CB 3.92Å; I514-K542 HydrophobicContact CG1-CD 3.73Å; I514-K542 HydrophobicContact CG1-CG 3.66Å
515	D	90.8	Very high	92	Very high	36 Å²	36	36.1 Å²	36.1	19%	0.193	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	167.3	172.4	-149.1	-0.9	0	0	0	113.2	R464 L513 L517 I540	R464-D515 IonicContact CZ-OD1 3.5Å; R464-D515 VanDerWaalsContact CZ-OD1 3.27Å; R464-D515 IonicContact NE-OD1 2.73Å; R464-D515 PolarHBondContact NE-OD1 3.32Å; R464-D515 IonicContact NH2-OD1 3.35Å; R464-D515 PolarHBondContact NH2-OD1 2.91Å; L513-D515 VanDerWaalsContact CD2-O 3.26Å; L513-D515 WeakPolarHBondContact CD2-O 3.42Å; D515-L517 WeakPolarHBondContact OD2-CD2 3.33Å; D515-I540 HydrophobicContact CB-CD1 4.5Å; D515-I540 PolarHBondContact O-N 3.06Å
516	C	93.1	Very high	91.7	Very high	5 Å²	5	38.4 Å²	38.4	3%	0.034	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	98.2	174.5	172.4	0	0	0	0	108.3	Y460 T461 V538 F539	Y460-C516 HydrophobicContact CD2-CB 4.25Å; Y460-C516 WeakPolarHBondContact CD2-SG 3.27Å; Y460-C516 HydrophobicContact CE2-CB 3.92Å; Y460-C516 VanDerWaalsContact CE2-O 3.24Å; Y460-C516 WeakPolarHBondContact CE2-O 3.34Å; T461-C516 HydrophobicContact CG2-CB 3.96Å; T461-C516 PolarHBondContact N-SG 3.49Å; T461-C516 VanDerWaalsContact N-SG 3.42Å; T461-C516 WeakPolarHBondContact O-CB 3.33Å; C516-V538 WeakPolarHBondContact CA-O 3.38Å; C516-F539 HydrophobicContact CB-CD1 4.09Å; C516-F539 WeakPolarHBondContact SG-CD1 3.42Å; C516-F539 VanDerWaalsContact SG-CE1 3.53Å
517	L	92.4	Very high	91.2	Very high	3 Å²	3	40.5 Å²	40.5	2%	0.016	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	156.2	-176.2	-62.5	-175.5	0	0	0	111.8	D515 Q521 F522 Q525 F526 F537 V538 I540	D515-L517 WeakPolarHBondContact OD2-CD2 3.33Å; L517-Q521 HydrophobicContact CB-CB 4.13Å; L517-Q521 HydrophobicContact CD1-CB 4.38Å; L517-Q521 HydrophobicContact CD2-CB 4.32Å; L517-F522 HydrophobicContact CB-CB 4.18Å; L517-F522 HydrophobicContact CD1-CB 4.45Å; L517-Q525 HydrophobicContact CD1-CB 4.38Å; L517-Q525 HydrophobicContact CD1-CG 4.49Å; L517-Q525 VanDerWaalsContact CD1-OE1 3.31Å; L517-F526 HydrophobicContact CD1-CD2 4.21Å; L517-F526 HydrophobicContact CD1-CE2 4.18Å; L517-F537 WeakPolarHBondContact O-CA 3.4Å; L517-V538 PolarHBondContact N-O 3.39Å; L517-V538 PolarHBondContact O-N 3.24Å; L517-I540 HydrophobicContact CD1-CD1 3.67Å; L517-I540 HydrophobicContact CG-CD1 3.96Å
518	S	93.4	Very high	90.5	Very high	34 Å²	34	47.3 Å²	47.3	24%	0.238	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	155.4	161.4	66.8	0	0	0	0	111	K520 Q521 F522 P536	S518-K520 PolarHBondContact O-N 2.89Å; S518-Q521 VanDerWaalsContact N-OE1 3.11Å; S518-Q521 PolarHBondContact O-N 3.32Å; S518-Q521 WeakPolarHBondContact OG-CG 3.47Å; S518-Q521 PolarHBondContact OG-N 3.49Å; S518-Q521 PolarHBondContact OG-OE1 3.22Å; S518-F522 WeakPolarHBondContact O-CB 3.49Å; S518-F522 PolarHBondContact O-N 3.42Å; S518-P536 CarbonylContact C-O 3.51Å; S518-P536 WeakPolarHBondContact CA-O 2.94Å
519	Q	90.8	Very high	90	Very high	25 Å²	25	48.2 Å²	48.2	12%	0.117	24%	0.239	C	C	.	.	H	α-helix	trans	-59.2	-19.7	-179.5	-176.2	60.6	-22.4	0	0	114.1	K523 S533 D534 P536	Q519-K523 WeakPolarHBondContact O-CD 3.26Å; Q519-K523 VanDerWaalsContact O-CG 3.29Å; Q519-K523 WeakPolarHBondContact O-CG 3.47Å; Q519-S533 PolarHBondContact NE2-O 2.89Å; Q519-D534 PolarHBondContact NE2-OD1 2.86Å; Q519-P536 PolarHBondContact N-O 2.92Å
520	K	90.2	Very high	89.4	Confident	144 Å²	144	49.3 Å²	49.3	63%	0.626	25%	0.247	S	C	*	.	H	α-helix	trans	-75.4	-57.5	169.3	179.4	178.8	169.2	-178.6	0	111.2	S518 F522 K523 E524	S518-K520 PolarHBondContact O-N 2.89Å; K520-F522 PolarHBondContact O-N 3.35Å; K520-K523 PolarHBondContact O-N 2.81Å; K520-K523 VanDerWaalsContact O-N 3.08Å; K520-E524 WeakPolarHBondContact CE-OE1 3.16Å; K520-E524 IonicContact NZ-OE1 3.56Å; K520-E524 WeakPolarHBondContact O-CG 3.32Å; K520-E524 PolarHBondContact O-N 2.9Å
521	Q	90.2	Very high	88.8	Confident	72 Å²	72	55.1 Å²	55.1	34%	0.336	27%	0.273	S	S	.	.	H	α-helix	trans	-58.8	-35.8	-179.8	-68.7	162.9	-56.6	0	0	112.1	L517 S518 E524 Q525	L517-Q521 HydrophobicContact CB-CB 4.13Å; L517-Q521 HydrophobicContact CD1-CB 4.38Å; L517-Q521 HydrophobicContact CD2-CB 4.32Å; S518-Q521 VanDerWaalsContact N-OE1 3.11Å; S518-Q521 PolarHBondContact O-N 3.32Å; S518-Q521 WeakPolarHBondContact OG-CG 3.47Å; S518-Q521 PolarHBondContact OG-N 3.49Å; S518-Q521 PolarHBondContact OG-OE1 3.22Å; Q521-E524 PolarHBondContact O-N 3.24Å; Q521-Q525 WeakPolarHBondContact O-CB 3.23Å; Q521-Q525 WeakPolarHBondContact O-CG 3.46Å; Q521-Q525 PolarHBondContact O-N 2.83Å
522	F	90.6	Very high	88.2	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-62.7	-44	176	179.1	-122.6	0	0	0	112.2	V454 L517 S518 K520 E524 F526 I529 V538	V454-F522 HydrophobicContact CB-CZ 4.41Å; V454-F522 HydrophobicContact CG1-CE2 3.73Å; V454-F522 HydrophobicContact CG1-CZ 3.83Å; V454-F522 HydrophobicContact CG2-CZ 4Å; L517-F522 HydrophobicContact CB-CB 4.18Å; L517-F522 HydrophobicContact CD1-CB 4.45Å; S518-F522 WeakPolarHBondContact O-CB 3.49Å; S518-F522 PolarHBondContact O-N 3.42Å; K520-F522 PolarHBondContact O-N 3.35Å; F522-E524 VanDerWaalsContact C-N 3.31Å; F522-E524 PolarHBondContact O-N 2.7Å; F522-F526 HydrophobicContact CD2-CB 4.01Å; F522-F526 HydrophobicContact CD2-CD2 4.17Å; F522-F526 HydrophobicContact CD2-CG 4.46Å; F522-F526 HydrophobicContact CE2-CB 3.76Å; F522-F526 HydrophobicContact CE2-CD2 4.43Å; F522-F526 HydrophobicContact CE2-CG 4.33Å; F522-F526 WeakPolarHBondContact O-CA 3.19Å; F522-F526 PolarHBondContact O-N 3.14Å; F522-I529 HydrophobicContact CE2-CD1 3.98Å; F522-I529 HydrophobicContact CE2-CG1 4Å; F522-I529 HydrophobicContact CZ-CD1 4.18Å; F522-I529 HydrophobicContact CZ-CG1 3.9Å; F522-I529 WeakPolarHBondContact CZ-O 3.47Å; F522-V538 HydrophobicContact CB-CB 4.3Å; F522-V538 HydrophobicContact CB-CG2 4.3Å; F522-V538 HydrophobicContact CD1-CB 4.11Å; F522-V538 HydrophobicContact CD1-CG1 3.9Å; F522-V538 HydrophobicContact CD1-CG2 3.8Å; F522-V538 HydrophobicContact CD2-CB 4.38Å; F522-V538 HydrophobicContact CD2-CG1 3.98Å; F522-V538 HydrophobicContact CE1-CG1 3.89Å; F522-V538 HydrophobicContact CE1-CG2 4.38Å; F522-V538 HydrophobicContact CE2-CG1 4Å; F522-V538 HydrophobicContact CG-CB 4Å; F522-V538 HydrophobicContact CG-CG1 3.94Å; F522-V538 HydrophobicContact CG-CG2 4.1Å; F522-V538 HydrophobicContact CZ-CG1 3.95Å
523	K	89.4	Confident	87.9	Confident	99 Å²	99	55.9 Å²	55.9	43%	0.43	28%	0.278	S	S	.	.	H	α-helix	trans	-67.3	-31	175.8	-72.5	174.3	-179.9	175.5	0	112.7	Q519 K520 D534	Q519-K523 WeakPolarHBondContact O-CD 3.26Å; Q519-K523 VanDerWaalsContact O-CG 3.29Å; Q519-K523 WeakPolarHBondContact O-CG 3.47Å; K520-K523 PolarHBondContact O-N 2.81Å; K520-K523 VanDerWaalsContact O-N 3.08Å; K523-D534 IonicContact NZ-OD1 2.64Å
524	E	90.1	Very high	87.6	Confident	124 Å²	124	62.4 Å²	62.4	58%	0.579	31%	0.313	S	S	*	.	H	α-helix	trans	-76.2	-38.2	177.1	-69.9	169.1	161.3	0	0	113	K520 Q521 F522	K520-E524 WeakPolarHBondContact CE-OE1 3.16Å; K520-E524 IonicContact NZ-OE1 3.56Å; K520-E524 WeakPolarHBondContact O-CG 3.32Å; K520-E524 PolarHBondContact O-N 2.9Å; Q521-E524 PolarHBondContact O-N 3.24Å; F522-E524 VanDerWaalsContact C-N 3.31Å; F522-E524 PolarHBondContact O-N 2.7Å
525	Q	88.4	Confident	87.6	Confident	100 Å²	100	61.2 Å²	61.2	47%	0.467	31%	0.31	S	S	.	.	H	α-helix	trans	-92.3	-28.9	-176.8	-66.1	-178.2	17.4	0	0	114.3	L517 Q521	L517-Q525 HydrophobicContact CD1-CB 4.38Å; L517-Q525 HydrophobicContact CD1-CG 4.49Å; L517-Q525 VanDerWaalsContact CD1-OE1 3.31Å; Q521-Q525 WeakPolarHBondContact O-CB 3.23Å; Q521-Q525 WeakPolarHBondContact O-CG 3.46Å; Q521-Q525 PolarHBondContact O-N 2.83Å
526	F	86.5	Confident	87.6	Confident	68 Å²	68	63 Å²	63	30%	0.298	32%	0.323	S	S	.	.			trans	-135.4	62.8	-171.4	-64.7	-80.8	0	0	0	112.3	L517 F522 D528 I529 S530 I540	L517-F526 HydrophobicContact CD1-CD2 4.21Å; L517-F526 HydrophobicContact CD1-CE2 4.18Å; F522-F526 HydrophobicContact CD2-CB 4.01Å; F522-F526 HydrophobicContact CD2-CD2 4.17Å; F522-F526 HydrophobicContact CD2-CG 4.46Å; F522-F526 HydrophobicContact CE2-CB 3.76Å; F522-F526 HydrophobicContact CE2-CD2 4.43Å; F522-F526 HydrophobicContact CE2-CG 4.33Å; F522-F526 WeakPolarHBondContact O-CA 3.19Å; F522-F526 PolarHBondContact O-N 3.14Å; F526-D528 VanDerWaalsContact C-N 3.29Å; F526-D528 PolarHBondContact O-N 3.13Å; F526-I529 HydrophobicContact CB-CD1 4.05Å; F526-I529 HydrophobicContact CB-CG1 3.75Å; F526-I529 HydrophobicContact CD1-CD1 4.28Å; F526-I529 HydrophobicContact CG-CD1 4.36Å; F526-I529 PolarHBondContact O-N 3.44Å; F526-S530 PolarHBondContact O-N 3.14Å; F526-I540 HydrophobicContact CD2-CD1 3.8Å; F526-I540 HydrophobicContact CE2-CD1 3.42Å; F526-I540 VanDerWaalsContact CE2-CD1 3.42Å; F526-I540 HydrophobicContact CZ-CD1 4.11Å
527	P	83.6	Confident	87.6	Confident	68 Å²	68	65.8 Å²	65.8	44%	0.442	34%	0.335	S	S	.	.	G	3₁₀ helix	trans	-59	-37	-175.8	24.3	-34.7	0	0	0	113.3	I529 S530	P527-I529 VanDerWaalsContact C-N 3.27Å; P527-I529 PolarHBondContact O-N 3.17Å; P527-S530 VanDerWaalsContact O-CB 3.28Å; P527-S530 WeakPolarHBondContact O-CB 3.5Å; P527-S530 PolarHBondContact O-N 3.13Å; P527-S530 PolarHBondContact O-OG 3.14Å
528	D	81.1	Confident	87.7	Confident	144 Å²	144	65.6 Å²	65.6	77%	0.77	33%	0.334	S	S	*	.	G	3₁₀ helix	trans	-68.2	-21.7	-174	-49.4	-42	0	0	0	114.6	F526 Q531	F526-D528 VanDerWaalsContact C-N 3.29Å; F526-D528 PolarHBondContact O-N 3.13Å; D528-Q531 PolarHBondContact O-OE1 3.01Å
529	I	82.5	Confident	87.8	Confident	18 Å²	18	64 Å²	64	9%	0.092	32%	0.323	C	S	.	.	G	3₁₀ helix	trans	-117.3	10.5	177.8	55.8	171.3	0	0	0	111.9	V454 F522 F526 P527 Q531 E532	V454-I529 HydrophobicContact CG1-CD1 4.04Å; F522-I529 HydrophobicContact CE2-CD1 3.98Å; F522-I529 HydrophobicContact CE2-CG1 4Å; F522-I529 HydrophobicContact CZ-CD1 4.18Å; F522-I529 HydrophobicContact CZ-CG1 3.9Å; F522-I529 WeakPolarHBondContact CZ-O 3.47Å; F526-I529 HydrophobicContact CB-CD1 4.05Å; F526-I529 HydrophobicContact CB-CG1 3.75Å; F526-I529 HydrophobicContact CD1-CD1 4.28Å; F526-I529 HydrophobicContact CG-CD1 4.36Å; F526-I529 PolarHBondContact O-N 3.44Å; P527-I529 VanDerWaalsContact C-N 3.27Å; P527-I529 PolarHBondContact O-N 3.17Å; I529-Q531 PolarHBondContact O-N 3.42Å; I529-E532 HydrophobicContact CB-CG 4.31Å; I529-E532 WeakPolarHBondContact O-CB 3.27Å; I529-E532 PolarHBondContact O-N 2.94Å
530	S	81.1	Confident	87.9	Confident	24 Å²	24	63.6 Å²	63.6	17%	0.168	32%	0.322	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-19	-177.8	62.6	0	0	0	0	114	F526 P527	F526-S530 PolarHBondContact O-N 3.14Å; P527-S530 VanDerWaalsContact O-CB 3.28Å; P527-S530 WeakPolarHBondContact O-CB 3.5Å; P527-S530 PolarHBondContact O-N 3.13Å; P527-S530 PolarHBondContact O-OG 3.14Å
531	Q	81.1	Confident	88.1	Confident	122 Å²	122	57.3 Å²	57.3	57%	0.57	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.6	-8.2	177.3	-46.7	81.7	-2.6	0	0	113.5	D528 I529 S533	D528-Q531 PolarHBondContact O-OE1 3.01Å; I529-Q531 PolarHBondContact O-N 3.42Å; Q531-S533 VanDerWaalsContact C-N 3.27Å; Q531-S533 PolarHBondContact O-N 3.42Å
532	E	81.8	Confident	88.2	Confident	14 Å²	14	58.8 Å²	58.8	7%	0.065	30%	0.301	C	S	.	.	S	Bend	trans	-72.4	-16.1	178.6	-73.9	-166	-165.6	0	0	113.6	K452 R453 V454 Y488 I529	K452-E532 WeakPolarHBondContact CG-OE2 3.23Å; R453-E532 PolarHBondContact N-OE2 3.08Å; V454-E532 HydrophobicContact CG2-CB 3.54Å; V454-E532 PolarHBondContact N-OE2 3.25Å; Y488-E532 HydrophobicContact CE1-CG 4.05Å; I529-E532 HydrophobicContact CB-CG 4.31Å; I529-E532 WeakPolarHBondContact O-CB 3.27Å; I529-E532 PolarHBondContact O-N 2.94Å
533	S	85.2	Confident	88.2	Confident	11 Å²	11	62.4 Å²	62.4	8%	0.077	32%	0.32	C	S	.	.			trans	-152.5	130.8	-176.9	173.6	0	0	0	0	112.6	G456 Q519 Q531 S535	G456-S533 WeakPolarHBondContact CA-OG 3.25Å; Q519-S533 PolarHBondContact NE2-O 2.89Å; Q531-S533 VanDerWaalsContact C-N 3.27Å; Q531-S533 PolarHBondContact O-N 3.42Å; S533-S535 PolarHBondContact OG-N 2.86Å
534	D	86.2	Confident	88.3	Confident	137 Å²	137	60.4 Å²	60.4	73%	0.733	32%	0.317	S	S	*	.			trans	-107.1	11.4	168.4	-155.5	39.1	0	0	0	114.7	Q519 K523	Q519-D534 PolarHBondContact NE2-OD1 2.86Å; K523-D534 IonicContact NZ-OD1 2.64Å
535	S	90.3	Very high	88.4	Confident	38 Å²	38	57.5 Å²	57.5	27%	0.266	30%	0.304	S	S	.	.	S	Bend	trans	-73.3	150.9	175.9	-65.8	0	0	0	0	112.5	G456 R457 S533 F537	G456-S535 VanDerWaalsContact C-CB 3.46Å; G456-S535 VanDerWaalsContact C-OG 3.29Å; G456-S535 VanDerWaalsContact CA-CB 3.41Å; G456-S535 WeakPolarHBondContact CA-OG 3.03Å; R457-S535 VanDerWaalsContact N-CB 3.27Å; R457-S535 PolarHBondContact N-OG 3.45Å; S533-S535 PolarHBondContact OG-N 2.86Å; S535-F537 VanDerWaalsContact C-N 3.28Å; S535-F537 PolarHBondContact O-N 2.87Å
536	P	92.3	Very high	88.5	Confident	72 Å²	72	53.9 Å²	53.9	47%	0.468	29%	0.287	S	S	.	.	S	Bend	trans	-66.8	-26.8	-176.5	27.8	-36.4	0	0	0	113.6	S518 Q519	S518-P536 CarbonylContact C-O 3.51Å; S518-P536 WeakPolarHBondContact CA-O 2.94Å; Q519-P536 PolarHBondContact N-O 2.92Å
537	F	93.5	Very high	88.7	Confident	64 Å²	64	50.8 Å²	50.8	28%	0.281	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	137.7	169.1	-61.9	-76.6	0	0	0	110.4	R457 W459 Y460 L517 S535 F539	R457-F537 PolarHBondContact N-O 3.5Å; R457-F537 PolarHBondContact O-N 2.95Å; R457-F537 VanDerWaalsContact O-N 3.11Å; R457-F537 VanDerWaalsContact O-O 3.13Å; W459-F537 VanDerWaalsContact C-CD2 3.5Å; Y460-F537 AromaticContact CD2-CD1 3.97Å; Y460-F537 HydrophobicContact CD2-CD1 3.97Å; Y460-F537 HydrophobicContact CD2-CE1 4.09Å; Y460-F537 HydrophobicContact CG-CD1 4.45Å; Y460-F537 HydrophobicContact CG-CE1 4.42Å; L517-F537 WeakPolarHBondContact O-CA 3.4Å; S535-F537 VanDerWaalsContact C-N 3.28Å; S535-F537 PolarHBondContact O-N 2.87Å; F537-F539 HydrophobicContact CB-CE1 4.46Å
538	V	94.4	Very high	88.8	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	116	-174.2	-173.5	0	0	0	0	109.3	V454 C516 L517 F522	V454-V538 HydrophobicContact CB-CG1 3.6Å; V454-V538 HydrophobicContact CG1-CG1 3.92Å; V454-V538 HydrophobicContact CG2-CG1 3.97Å; C516-V538 WeakPolarHBondContact CA-O 3.38Å; L517-V538 PolarHBondContact N-O 3.39Å; L517-V538 PolarHBondContact O-N 3.24Å; F522-V538 HydrophobicContact CB-CB 4.3Å; F522-V538 HydrophobicContact CB-CG2 4.3Å; F522-V538 HydrophobicContact CD1-CB 4.11Å; F522-V538 HydrophobicContact CD1-CG1 3.9Å; F522-V538 HydrophobicContact CD1-CG2 3.8Å; F522-V538 HydrophobicContact CD2-CB 4.38Å; F522-V538 HydrophobicContact CD2-CG1 3.98Å; F522-V538 HydrophobicContact CE1-CG1 3.89Å; F522-V538 HydrophobicContact CE1-CG2 4.38Å; F522-V538 HydrophobicContact CE2-CG1 4Å; F522-V538 HydrophobicContact CG-CB 4Å; F522-V538 HydrophobicContact CG-CG1 3.94Å; F522-V538 HydrophobicContact CG-CG2 4.1Å; F522-V538 HydrophobicContact CZ-CG1 3.95Å
539	F	94.9	Very high	89.1	Confident	1 Å²	1	48.2 Å²	48.2	0%	0.004	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	124	179.3	-56.3	-6	0	0	0	108.6	L437 V454 E455 R457 W459 T461 L513 C516 F537	L437-F539 HydrophobicContact CD2-CD2 4.02Å; L437-F539 HydrophobicContact CD2-CE2 3.99Å; V454-F539 CarbonylContact C-O 3.54Å; V454-F539 VanDerWaalsContact CA-O 3.23Å; V454-F539 WeakPolarHBondContact CA-O 3.26Å; V454-F539 WeakPolarHBondContact CB-O 3.39Å; E455-F539 HydrophobicContact CB-CB 4.46Å; E455-F539 PolarHBondContact N-O 3.01Å; E455-F539 PolarHBondContact O-N 2.96Å; R457-F539 HydrophobicContact CB-CE1 4.14Å; R457-F539 HydrophobicContact CB-CE2 4.26Å; R457-F539 HydrophobicContact CB-CZ 3.75Å; R457-F539 HydrophobicContact CG-CD2 4.4Å; R457-F539 HydrophobicContact CG-CE1 4.44Å; R457-F539 HydrophobicContact CG-CE2 3.69Å; R457-F539 HydrophobicContact CG-CZ 3.71Å; W459-F539 HydrophobicContact CE3-CZ 4.36Å; W459-F539 HydrophobicContact CH2-CE2 4.13Å; W459-F539 AromaticContact CH2-CZ 3.99Å; W459-F539 HydrophobicContact CH2-CZ 3.99Å; W459-F539 HydrophobicContact CZ2-CE2 4.34Å; W459-F539 HydrophobicContact CZ2-CZ 4.21Å; W459-F539 HydrophobicContact CZ3-CZ 4.09Å; W459-F539 WeakPolarHBondContact O-CE1 3.39Å; T461-F539 HydrophobicContact CG2-CD1 3.86Å; T461-F539 HydrophobicContact CG2-CD2 4.19Å; T461-F539 HydrophobicContact CG2-CE1 3.62Å; T461-F539 HydrophobicContact CG2-CE2 3.94Å; T461-F539 HydrophobicContact CG2-CG 4.16Å; T461-F539 HydrophobicContact CG2-CZ 3.65Å; L513-F539 HydrophobicContact CD1-CB 4.01Å; L513-F539 HydrophobicContact CD1-CD2 4.06Å; L513-F539 HydrophobicContact CD1-CG 4.12Å; L513-F539 HydrophobicContact CG-CB 4.32Å; C516-F539 HydrophobicContact CB-CD1 4.09Å; C516-F539 WeakPolarHBondContact SG-CD1 3.42Å; C516-F539 VanDerWaalsContact SG-CE1 3.53Å; F537-F539 HydrophobicContact CB-CE1 4.46Å
540	I	93.7	Very high	89.5	Confident	16 Å²	16	50.9 Å²	50.9	8%	0.082	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	117.6	-178.4	-59.3	-178.8	0	0	0	109.3	V454 I514 D515 L517 F526	V454-I540 HydrophobicContact CG1-CG1 4.39Å; I514-I540 PolarHBondContact N-O 3.06Å; D515-I540 HydrophobicContact CB-CD1 4.5Å; D515-I540 PolarHBondContact O-N 3.06Å; L517-I540 HydrophobicContact CD1-CD1 3.67Å; L517-I540 HydrophobicContact CG-CD1 3.96Å; F526-I540 HydrophobicContact CD2-CD1 3.8Å; F526-I540 HydrophobicContact CE2-CD1 3.42Å; F526-I540 VanDerWaalsContact CE2-CD1 3.42Å; F526-I540 HydrophobicContact CZ-CD1 4.11Å
541	C	93.5	Very high	90.1	Very high	11 Å²	11	52 Å²	52	7%	0.074	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	136.6	-175.3	-61.6	0	0	0	0	111.2	L447 R453 V511 D512	L447-C541 HydrophobicContact CD1-CB 4.2Å; R453-C541 WeakPolarHBondContact O-CB 3.45Å; R453-C541 PolarHBondContact O-N 3.03Å; V511-C541 HydrophobicContact CB-CB 3.98Å; V511-C541 HydrophobicContact CG1-CB 4.38Å; V511-C541 HydrophobicContact CG2-CB 3.94Å; D512-C541 WeakPolarHBondContact O-CA 3.47Å
542	K	91.5	Very high	90.6	Very high	104 Å²	104	51 Å²	51	45%	0.452	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	-179.8	167.9	-69.8	-171.8	-168.1	171.5	0	110.2	D512 I514	D512-K542 PolarHBondContact N-O 3.05Å; D512-K542 PolarHBondContact O-N 2.87Å; I514-K542 HydrophobicContact CD1-CB 4.21Å; I514-K542 HydrophobicContact CD1-CD 4.19Å; I514-K542 HydrophobicContact CD1-CG 4.36Å; I514-K542 HydrophobicContact CG1-CB 3.92Å; I514-K542 HydrophobicContact CG1-CD 3.73Å; I514-K542 HydrophobicContact CG1-CG 3.66Å
543	N	90.9	Very high	91.2	Very high	76 Å²	76	51.5 Å²	51.5	41%	0.406	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	47.9	55	172.1	-52.7	-14	0	0	0	114.2	D512 Q545	D512-N543 HydrophobicContact CB-CB 4.34Å; D512-N543 VanDerWaalsContact OD2-CB 3.25Å; D512-N543 WeakPolarHBondContact OD2-CB 3.4Å; D512-N543 PolarHBondContact OD2-ND2 3.39Å; N543-Q545 PolarHBondContact O-N 2.94Å
544	P	92.7	Very high	91.4	Very high	56 Å²	56	60 Å²	60	36%	0.364	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	126.8	-177.3	31.3	-34.6	0	0	0	111.4	L447 G450 V511	L447-P544 VanDerWaalsContact O-CB 3.3Å; L447-P544 WeakPolarHBondContact O-CB 3.21Å; G450-P544 VanDerWaalsContact CA-CG 3.45Å; V511-P544 HydrophobicContact CG1-CB 4.23Å
545	Q	91.3	Very high	91.3	Very high	64 Å²	64	55 Å²	55	30%	0.299	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	108.3	-176.8	-62.9	175.8	7	0	0	110.7	G509 C510 N543 L574	G509-Q545 CarbonylContact C-O 3.29Å; G509-Q545 WeakPolarHBondContact CA-O 3.36Å; C510-Q545 PolarHBondContact N-O 3.03Å; C510-Q545 PolarHBondContact O-N 3.42Å; N543-Q545 PolarHBondContact O-N 2.94Å; Q545-L574 HydrophobicContact CB-CD2 3.8Å
546	E	91.1	Very high	91	Very high	23 Å²	23	56.8 Å²	56.8	11%	0.107	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	134.4	171.2	-173.8	178.4	-154.8	0	0	111.1	V448 R449 K550 Q577	V448-E546 HydrophobicContact CB-CB 4.37Å; V448-E546 HydrophobicContact CG2-CB 4.1Å; V448-E546 HydrophobicContact CG2-CG 4.19Å; V448-E546 PolarHBondContact O-N 2.96Å; R449-E546 IonicContact CZ-OE2 3.8Å; R449-E546 VanDerWaalsContact CZ-OE2 3.22Å; R449-E546 IonicContact NE-OE2 3.59Å; R449-E546 PolarHBondContact NE-OE2 3.45Å; R449-E546 IonicContact NH2-OE2 3.84Å; R449-E546 PolarHBondContact NH2-OE2 3.19Å; E546-K550 WeakPolarHBondContact OE1-CE 3.32Å; E546-K550 IonicContact OE1-NZ 2.81Å; E546-K550 PolarHBondContact OE1-NZ 3.18Å; E546-Q577 WeakPolarHBondContact O-CG 3.25Å; E546-Q577 PolarHBondContact O-NE2 2.67Å
547	M	90.1	Very high	90.5	Very high	3 Å²	3	58.1 Å²	58.1	2%	0.015	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	139.5	178.4	-74.1	162.8	40.9	0	0	113.1	W468 L507 L508 V549 F551 A570 L574	W468-M547 HydrophobicContact CE3-SD 4.08Å; W468-M547 HydrophobicContact CZ3-SD 3.53Å; W468-M547 VanDerWaalsContact CZ3-SD 3.53Å; L507-M547 HydrophobicContact CD2-CE 3.52Å; L507-M547 HydrophobicContact CD2-SD 3.34Å; L507-M547 WeakPolarHBondContact CD2-SD 3.3Å; L508-M547 PolarHBondContact O-N 3.13Å; M547-V549 VanDerWaalsContact C-N 3.31Å; M547-V549 WeakPolarHBondContact CE-O 3.49Å; M547-V549 PolarHBondContact O-N 3.46Å; M547-F551 HydrophobicContact CE-CD2 3.62Å; M547-F551 HydrophobicContact CE-CE2 3.55Å; M547-A570 HydrophobicContact CE-CB 3.73Å; M547-A570 HydrophobicContact SD-CB 3.81Å; M547-L574 HydrophobicContact CG-CD2 3.59Å; M547-L574 HydrophobicContact CG-CG 4.19Å; M547-L574 HydrophobicContact SD-CD2 4.44Å
548	V	85.5	Confident	90.4	Very high	86 Å²	86	61.8 Å²	61.8	52%	0.521	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.4	-37.5	174	-172.6	0	0	0	0	112.3	K576 Q577	V548-K576 HydrophobicContact CG2-CB 4.29Å; V548-Q577 HydrophobicContact CG2-CG 4.08Å
549	V	88.8	Confident	90.4	Very high	73 Å²	73	63.3 Å²	63.3	44%	0.442	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	116.5	-179.2	179.8	0	0	0	0	109	M547 F551	M547-V549 VanDerWaalsContact C-N 3.31Å; M547-V549 WeakPolarHBondContact CE-O 3.49Å; M547-V549 PolarHBondContact O-N 3.46Å; V549-F551 HydrophobicContact CG1-CE1 4.2Å; V549-F551 HydrophobicContact CG1-CE2 4.47Å; V549-F551 HydrophobicContact CG1-CZ 4.04Å
550	K	90.8	Very high	90.3	Very high	73 Å²	73	65.7 Å²	65.7	32%	0.317	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	127.5	-176.9	-64.6	173.2	-178.9	172.2	0	109.8	P503 C506 L507 L508 E546	P503-K550 HydrophobicContact CG-CD 4.03Å; C506-K550 HydrophobicContact CB-CB 4.37Å; L507-K550 WeakPolarHBondContact O-CA 3.28Å; L507-K550 WeakPolarHBondContact O-CB 3.38Å; L508-K550 HydrophobicContact CD2-CD 4.21Å; E546-K550 WeakPolarHBondContact OE1-CE 3.32Å; E546-K550 IonicContact OE1-NZ 2.81Å; E546-K550 PolarHBondContact OE1-NZ 3.18Å
551	F	92.4	Very high	90.4	Very high	47 Å²	47	71.4 Å²	71.4	21%	0.206	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	132.6	-175	-64.1	-79	0	0	0	111.4	C506 L507 M547 V549 I553 I566 A570	C506-F551 CarbonylContact C-O 3.4Å; C506-F551 VanDerWaalsContact CA-O 3.25Å; C506-F551 WeakPolarHBondContact CA-O 3.33Å; L507-F551 HydrophobicContact CB-CB 4.37Å; L507-F551 PolarHBondContact N-O 3.27Å; M547-F551 HydrophobicContact CE-CD2 3.62Å; M547-F551 HydrophobicContact CE-CE2 3.55Å; V549-F551 HydrophobicContact CG1-CE1 4.2Å; V549-F551 HydrophobicContact CG1-CE2 4.47Å; V549-F551 HydrophobicContact CG1-CZ 4.04Å; F551-I553 PolarHBondContact O-N 3.43Å; F551-I566 HydrophobicContact CB-CD1 4.41Å; F551-I566 HydrophobicContact CB-CG2 4.11Å; F551-I566 HydrophobicContact CD1-CD1 4.43Å; F551-I566 HydrophobicContact CG-CG2 4.34Å; F551-A570 HydrophobicContact CE2-CB 4.44Å
552	P	92.6	Very high	90.4	Very high	102 Å²	102	71.5 Å²	71.5	66%	0.662	37%	0.37	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.2	124.5	177.4	28.9	-33.8	0	0	0	110.7
553	I	93.1	Very high	90.4	Very high	25 Å²	25	70.8 Å²	70.8	13%	0.128	37%	0.371	C	S	.	.			trans	-146.4	149.2	-178.5	50.6	161.2	0	0	0	111.9	A470 G505 L507 F551 W560 L562 I566	A470-I553 HydrophobicContact CB-CD1 3.43Å; A470-I553 VanDerWaalsContact CB-CD1 3.43Å; A470-I553 HydrophobicContact CB-CG1 4.35Å; G505-I553 CarbonylContact C-O 3.55Å; G505-I553 PolarHBondContact O-N 3.01Å; L507-I553 HydrophobicContact CB-CD1 3.61Å; L507-I553 HydrophobicContact CB-CG1 4.02Å; L507-I553 HydrophobicContact CD1-CD1 4.04Å; L507-I553 HydrophobicContact CG-CD1 4.17Å; F551-I553 PolarHBondContact O-N 3.43Å; I553-W560 HydrophobicContact CB-CH2 4.47Å; I553-W560 HydrophobicContact CD1-CH2 4.33Å; I553-W560 HydrophobicContact CD1-CZ2 4Å; I553-L562 HydrophobicContact CD1-CD2 4.48Å; I553-I566 HydrophobicContact CG2-CG2 4.19Å
554	K	89.2	Confident	90.5	Very high	188 Å²	188	70.3 Å²	70.3	82%	0.817	37%	0.374	S	S	*	.			trans	-81.3	120	171.2	-63.9	-177.4	-179.8	-178.8	0	109	W560	K554-W560 WeakPolarHBondContact O-CZ2 3.37Å
555	G	83.9	Confident	90.4	Very high	34 Å²	34	75.5 Å²	75.5	35%	0.351	39%	0.391	S	S	.	.			trans	-80.2	147.2	178	0	0	0	0	0	113.1	S438	S438-G555 WeakPolarHBondContact OG-CA 3.16Å
556	N	85.7	Confident	90.4	Very high	74 Å²	74	74.3 Å²	74.3	40%	0.396	39%	0.386	S	S	.	.			trans	-116.5	153.4	174.1	-62.3	-60.7	0	0	0	111	S438 W560	S438-N556 VanDerWaalsContact CB-O 3.26Å; S438-N556 WeakPolarHBondContact CB-O 3.4Å; N556-W560 HydrophobicContact CB-CB 4.45Å; N556-W560 HydrophobicContact CB-CG 4.03Å; N556-W560 VanDerWaalsContact ND2-CG 3.26Å
557	P	81.1	Confident	90.5	Very high	101 Å²	101	74.3 Å²	74.3	66%	0.656	39%	0.386	S	S	*	.	S	Bend	trans	-76	-20.6	-176.7	29.7	-36	0	0	0	114.5	R457	R457-P557 PolarHBondContact NH1-O 2.91Å; R457-P557 VanDerWaalsContact NH1-O 3.14Å
558	K	91.4	Very high	90.5	Very high	140 Å²	140	79.2 Å²	79.2	61%	0.609	41%	0.409	S	S	*	.	S	Bend	trans	-104.1	167.4	171.9	-67.3	-172.3	177	-174.7	0	110.5	W459	W459-K558 HydrophobicContact CZ2-CB 4.3Å; W459-K558 HydrophobicContact CZ2-CG 4.42Å
559	I	93.7	Very high	90.8	Very high	33 Å²	33	76 Å²	76	17%	0.169	39%	0.393	C	S	.	.			trans	-60.8	137.1	167.8	-76.4	162.6	0	0	0	109.6	W435 C436 L437 W459 T461 H463 L467	W435-I559 HydrophobicContact CB-CG2 4.07Å; W435-I559 HydrophobicContact CD2-CG2 4.26Å; W435-I559 HydrophobicContact CE3-CG2 3.7Å; W435-I559 HydrophobicContact CG-CG2 4.45Å; W435-I559 HydrophobicContact CZ3-CG2 4.47Å; C436-I559 VanDerWaalsContact O-CA 3.31Å; C436-I559 WeakPolarHBondContact O-CA 3.47Å; L437-I559 HydrophobicContact CB-CG1 4.12Å; L437-I559 HydrophobicContact CD1-CG1 4.21Å; W459-I559 HydrophobicContact CH2-CB 4.19Å; W459-I559 HydrophobicContact CH2-CD1 3.94Å; W459-I559 HydrophobicContact CH2-CG1 3.87Å; W459-I559 HydrophobicContact CZ3-CD1 4.42Å; T461-I559 HydrophobicContact CG2-CD1 4.43Å; H463-I559 HydrophobicContact CB-CD1 4.35Å; L467-I559 HydrophobicContact CD1-CD1 4.13Å; L467-I559 HydrophobicContact CD1-CG1 4.01Å; L467-I559 HydrophobicContact CD2-CD1 4.38Å
560	W	94.1	Very high	90.9	Very high	51 Å²	51	72.5 Å²	72.5	19%	0.193	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	161.6	-179.2	63.5	-72.7	0	0	0	110.2	W435 C436 I553 K554 N556 L562	W435-W560 CarbonylContact C-O 3.52Å; C436-W560 HydrophobicContact CB-CD2 4.45Å; C436-W560 HydrophobicContact CB-CZ2 4.27Å; C436-W560 PolarHBondContact N-O 3.49Å; C436-W560 PolarHBondContact O-N 2.86Å; I553-W560 HydrophobicContact CB-CH2 4.47Å; I553-W560 HydrophobicContact CD1-CH2 4.33Å; I553-W560 HydrophobicContact CD1-CZ2 4Å; K554-W560 WeakPolarHBondContact O-CZ2 3.37Å; N556-W560 HydrophobicContact CB-CB 4.45Å; N556-W560 HydrophobicContact CB-CG 4.03Å; N556-W560 VanDerWaalsContact ND2-CG 3.26Å; W560-L562 HydrophobicContact CH2-CD2 3.74Å; W560-L562 HydrophobicContact CZ2-CD2 4.03Å; W560-L562 HydrophobicContact CZ3-CD2 4.19Å
561	K	94.3	Very high	90.8	Very high	135 Å²	135	72.6 Å²	72.6	59%	0.587	37%	0.373	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.5	130.8	-178	-166.5	170.6	-176.6	171.1	0	111.3	G433 W435	G433-K561 VanDerWaalsContact O-CE 3.28Å; G433-K561 WeakPolarHBondContact O-CE 3.48Å; W435-K561 HydrophobicContact CE3-CB 4.07Å; W435-K561 HydrophobicContact CZ3-CB 4.01Å
562	L	93.5	Very high	90.5	Very high	14 Å²	14	77.2 Å²	77.2	7%	0.073	39%	0.393	C	S	.	.	P	Polyproline II helix	trans	-65.6	153.9	177.6	-66.6	173.7	0	0	0	112.2	G434 C436 W468 L507 I553 W560 H567	G434-L562 WeakPolarHBondContact O-CB 3.43Å; G434-L562 WeakPolarHBondContact O-CG 3.21Å; G434-L562 PolarHBondContact O-N 2.92Å; C436-L562 HydrophobicContact CB-CD1 4.37Å; C436-L562 HydrophobicContact CB-CD2 3.62Å; C436-L562 HydrophobicContact CB-CG 3.78Å; W468-L562 HydrophobicContact CB-CD1 3.87Å; W468-L562 HydrophobicContact CD2-CD1 4.24Å; W468-L562 HydrophobicContact CG-CD1 3.67Å; L507-L562 HydrophobicContact CD1-CD1 3.72Å; L507-L562 HydrophobicContact CD1-CD2 3.77Å; L507-L562 HydrophobicContact CD1-CG 4.43Å; I553-L562 HydrophobicContact CD1-CD2 4.48Å; W560-L562 HydrophobicContact CH2-CD2 3.74Å; W560-L562 HydrophobicContact CZ2-CD2 4.03Å; W560-L562 HydrophobicContact CZ3-CD2 4.19Å; L562-H567 HydrophobicContact CB-CB 4.21Å; L562-H567 HydrophobicContact CD1-CB 4.47Å
563	D	93.3	Very high	90.1	Very high	88 Å²	88	72.7 Å²	72.7	47%	0.471	36%	0.364	S	S	.	.	P	Polyproline II helix	trans	-60.6	134.7	161.6	171.8	22.7	0	0	0	109.8	K565 I566 H567	D563-K565 PolarHBondContact O-N 3.35Å; D563-K565 PolarHBondContact OD1-N 2.94Å; D563-I566 HydrophobicContact CB-CG1 4.19Å; D563-I566 PolarHBondContact O-N 3.48Å; D563-H567 WeakPolarHBondContact O-CB 3.35Å; D563-H567 PolarHBondContact O-N 3.23Å
564	S	91.2	Very high	89.5	Confident	67 Å²	67	72.1 Å²	72.1	47%	0.469	36%	0.362	S	S	.	.	H	α-helix	trans	-52.2	-36.9	178.6	-175.8	0	0	0	0	112.5	H567 Q568	S564-H567 PolarHBondContact O-N 2.91Å; S564-Q568 WeakPolarHBondContact O-CB 3.41Å; S564-Q568 VanDerWaalsContact O-CG 3.25Å; S564-Q568 WeakPolarHBondContact O-CG 3.41Å; S564-Q568 PolarHBondContact O-N 3.45Å; S564-Q568 PolarHBondContact OG-NE2 3.17Å
565	K	91.9	Very high	88.6	Confident	165 Å²	165	70.2 Å²	70.2	72%	0.717	36%	0.357	S	S	*	.	H	α-helix	trans	-66	-45.7	177.2	-62.6	178.6	179.2	176.4	0	112	D563 G569	D563-K565 PolarHBondContact O-N 3.35Å; D563-K565 PolarHBondContact OD1-N 2.94Å; K565-G569 PolarHBondContact O-N 3.34Å
566	I	91.9	Very high	87.5	Confident	39 Å²	39	75.7 Å²	75.7	20%	0.2	37%	0.371	C	S	.	.	H	α-helix	trans	-66.5	-42	177.4	-57.9	-59.6	0	0	0	110.4	L507 F551 I553 D563 G569 A570	L507-I566 HydrophobicContact CD1-CG2 4.14Å; F551-I566 HydrophobicContact CB-CD1 4.41Å; F551-I566 HydrophobicContact CB-CG2 4.11Å; F551-I566 HydrophobicContact CD1-CD1 4.43Å; F551-I566 HydrophobicContact CG-CG2 4.34Å; I553-I566 HydrophobicContact CG2-CG2 4.19Å; D563-I566 HydrophobicContact CB-CG1 4.19Å; D563-I566 PolarHBondContact O-N 3.48Å; I566-G569 CarbonylContact O-C 3.54Å; I566-G569 PolarHBondContact O-N 2.88Å; I566-A570 VanDerWaalsContact O-CB 3.3Å; I566-A570 WeakPolarHBondContact O-CB 3.39Å; I566-A570 PolarHBondContact O-N 3.18Å
567	H	92.2	Very high	86	Confident	22 Å²	22	75 Å²	75	10%	0.102	37%	0.366	C	S	.	.	H	α-helix	trans	-61.4	-45	177.7	-177.4	-148.8	0	0	0	112.9	D432 G434 W468 L562 D563 S564 A570 K571	D432-H567 PolarHBondContact O-CE1 2.8Å; D432-H567 PolarHBondContact O-NE2 3.1Å; D432-H567 IonicContact OD1-CD2 3.22Å; D432-H567 IonicContact OD1-CE1 2.64Å; D432-H567 IonicContact OD1-NE2 2.78Å; D432-H567 PolarHBondContact OD1-NE2 3.08Å; D432-H567 IonicContact OD2-NE2 2.71Å; G434-H567 WeakPolarHBondContact CA-CE1 3.26Å; G434-H567 WeakPolarHBondContact CA-NE2 3.32Å; G434-H567 PolarHBondContact N-CE1 3.09Å; G434-H567 VanDerWaalsContact N-CE1 3.34Å; G434-H567 PolarHBondContact N-NE2 3.17Å; W468-H567 AromaticContact CE2-CD2 3.85Å; W468-H567 AromaticContact CZ2-CD2 3.97Å; W468-H567 AromaticContact NE1-CD2 3.56Å; W468-H567 AromaticContact NE1-NE2 3.59Å; L562-H567 HydrophobicContact CB-CB 4.21Å; L562-H567 HydrophobicContact CD1-CB 4.47Å; D563-H567 WeakPolarHBondContact O-CB 3.35Å; D563-H567 PolarHBondContact O-N 3.23Å; S564-H567 PolarHBondContact O-N 2.91Å; H567-A570 PolarHBondContact O-N 3.38Å; H567-K571 PolarHBondContact CE1-NZ 2.95Å; H567-K571 VanDerWaalsContact NE2-CE 3.26Å; H567-K571 WeakPolarHBondContact NE2-CE 3.48Å; H567-K571 PolarHBondContact NE2-NZ 2.99Å; H567-K571 WeakPolarHBondContact O-CG 3.43Å; H567-K571 PolarHBondContact O-N 3.23Å
568	Q	90.7	Very high	84.6	Confident	106 Å²	106	75.9 Å²	75.9	50%	0.495	37%	0.365	S	S	.	.	H	α-helix	trans	-65.7	-37.8	173.8	-70.7	176.3	37.8	0	0	112.4	S564 K572	S564-Q568 WeakPolarHBondContact O-CB 3.41Å; S564-Q568 VanDerWaalsContact O-CG 3.25Å; S564-Q568 WeakPolarHBondContact O-CG 3.41Å; S564-Q568 PolarHBondContact O-N 3.45Å; S564-Q568 PolarHBondContact OG-NE2 3.17Å; Q568-K572 WeakPolarHBondContact O-CG 3.36Å; Q568-K572 PolarHBondContact O-N 3.27Å
569	G	90.5	Very high	82	Confident	19 Å²	19	78.7 Å²	78.7	20%	0.196	38%	0.377	C	S	.	.	H	α-helix	trans	-62.8	-41.1	172.5	0	0	0	0	0	112.5	K565 I566 K572 G573	K565-G569 PolarHBondContact O-N 3.34Å; I566-G569 CarbonylContact O-C 3.54Å; I566-G569 PolarHBondContact O-N 2.88Å; G569-K572 PolarHBondContact O-N 3.28Å; G569-G573 PolarHBondContact O-N 3.3Å
570	A	90.6	Very high	79.4	Confident	0 Å²	0	81.3 Å²	81.3	0%	0	40%	0.403	C	S	.	.	H	α-helix	trans	-68.2	-45.4	180	0	0	0	0	0	112.2	W468 L507 M547 F551 I566 H567 K572 G573 L574	W468-A570 HydrophobicContact CE3-CB 3.92Å; W468-A570 HydrophobicContact CH2-CB 3.59Å; W468-A570 HydrophobicContact CZ2-CB 4.2Å; W468-A570 HydrophobicContact CZ3-CB 3.47Å; W468-A570 VanDerWaalsContact CZ3-CB 3.47Å; L507-A570 HydrophobicContact CD2-CB 4.18Å; M547-A570 HydrophobicContact CE-CB 3.73Å; M547-A570 HydrophobicContact SD-CB 3.81Å; F551-A570 HydrophobicContact CE2-CB 4.44Å; I566-A570 VanDerWaalsContact O-CB 3.3Å; I566-A570 WeakPolarHBondContact O-CB 3.39Å; I566-A570 PolarHBondContact O-N 3.18Å; H567-A570 PolarHBondContact O-N 3.38Å; A570-K572 VanDerWaalsContact C-N 3.28Å; A570-K572 PolarHBondContact O-N 3.43Å; A570-G573 WeakPolarHBondContact O-CA 3.45Å; A570-G573 PolarHBondContact O-N 3.07Å; A570-L574 PolarHBondContact O-N 3.05Å; A570-L574 VanDerWaalsContact O-N 3.13Å
571	K	88.9	Confident	76.7	Confident	75 Å²	75	87.8 Å²	87.8	33%	0.326	45%	0.449	S	S	.	.	H	α-helix	trans	-53.7	-43.3	171.2	-76.3	177.1	169.8	170.7	0	112.2	D432 W468 H567 G573 L574 M575	D432-K571 PolarHBondContact O-NZ 3.2Å; D432-K571 IonicContact OD1-NZ 2.77Å; D432-K571 WeakPolarHBondContact OD2-CE 3.09Å; D432-K571 IonicContact OD2-NZ 3.76Å; W468-K571 HydrophobicContact CH2-CG 4.23Å; W468-K571 HydrophobicContact CZ2-CG 3.88Å; H567-K571 PolarHBondContact CE1-NZ 2.95Å; H567-K571 VanDerWaalsContact NE2-CE 3.26Å; H567-K571 WeakPolarHBondContact NE2-CE 3.48Å; H567-K571 PolarHBondContact NE2-NZ 2.99Å; H567-K571 WeakPolarHBondContact O-CG 3.43Å; H567-K571 PolarHBondContact O-N 3.23Å; K571-G573 VanDerWaalsContact C-N 3.3Å; K571-G573 PolarHBondContact O-N 3.05Å; K571-L574 PolarHBondContact O-N 2.86Å; K571-M575 PolarHBondContact O-N 3.08Å
572	K	87	Confident	75.8	Confident	144 Å²	144	85.5 Å²	85.5	63%	0.626	44%	0.442	S	S	*	.	H	α-helix	trans	-69.6	-24	174.5	-70.1	173.5	-179.6	177.7	0	113.7	Q568 G569 A570	Q568-K572 WeakPolarHBondContact O-CG 3.36Å; Q568-K572 PolarHBondContact O-N 3.27Å; G569-K572 PolarHBondContact O-N 3.28Å; A570-K572 VanDerWaalsContact C-N 3.28Å; A570-K572 PolarHBondContact O-N 3.43Å
573	G	83.1	Confident	74.9	Confident	7 Å²	7	89.2 Å²	89.2	7%	0.072	46%	0.461	C	S	.	.	H	α-helix	trans	-71.1	-37.9	174.4	0	0	0	0	0	113.2	G569 A570 K571	G569-G573 PolarHBondContact O-N 3.3Å; A570-G573 WeakPolarHBondContact O-CA 3.45Å; A570-G573 PolarHBondContact O-N 3.07Å; K571-G573 VanDerWaalsContact C-N 3.3Å; K571-G573 PolarHBondContact O-N 3.05Å
574	L	82.5	Confident	73.9	Confident	13 Å²	13	89.3 Å²	89.3	7%	0.068	46%	0.46	C	S	.	.	H	α-helix	trans	-67.5	-43.1	176.9	-62.1	177.3	0	0	0	112.4	W468 C510 Q545 M547 A570 K571 K576 Q577 N578	W468-L574 HydrophobicContact CH2-CD1 3.4Å; W468-L574 HydrophobicContact CH2-CG 3.96Å; W468-L574 HydrophobicContact CZ2-CD1 4.3Å; W468-L574 HydrophobicContact CZ3-CD1 3.79Å; W468-L574 HydrophobicContact CZ3-CD2 4.38Å; W468-L574 HydrophobicContact CZ3-CG 4.06Å; C510-L574 VanDerWaalsContact SG-CD1 3.58Å; Q545-L574 HydrophobicContact CB-CD2 3.8Å; M547-L574 HydrophobicContact CG-CD2 3.59Å; M547-L574 HydrophobicContact CG-CG 4.19Å; M547-L574 HydrophobicContact SD-CD2 4.44Å; A570-L574 PolarHBondContact O-N 3.05Å; A570-L574 VanDerWaalsContact O-N 3.13Å; K571-L574 PolarHBondContact O-N 2.86Å; L574-K576 PolarHBondContact O-N 2.91Å; L574-Q577 PolarHBondContact O-N 2.64Å; L574-N578 PolarHBondContact O-OD1 2.75Å
575	M	69.4	Low	72.8	Confident	147 Å²	147	90.6 Å²	90.6	72%	0.724	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.4	-13.8	-177.7	-74.8	178.8	155.6	0	0	115.5	K571	K571-M575 PolarHBondContact O-N 3.08Å
576	K	59.7	Low	71.6	Confident	150 Å²	150	85.9 Å²	85.9	65%	0.652	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.7	-21.2	174.8	-67.6	-170.3	175.3	-172.7	0	114.2	V548 L574	V548-K576 HydrophobicContact CG2-CB 4.29Å; L574-K576 PolarHBondContact O-N 2.91Å
577	Q	56.1	Low	70.3	Confident	58 Å²	58	89.1 Å²	89.1	27%	0.271	46%	0.46	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.7	-29	-177.5	-61.3	-70.3	48.8	0	0	112.8	E546 V548 L574 K579 A580	E546-Q577 WeakPolarHBondContact O-CG 3.25Å; E546-Q577 PolarHBondContact O-NE2 2.67Å; V548-Q577 HydrophobicContact CG2-CG 4.08Å; L574-Q577 PolarHBondContact O-N 2.64Å; Q577-K579 PolarHBondContact O-N 3.01Å; Q577-A580 PolarHBondContact O-N 3.23Å
578	N	50	Low	68.7	Low	120 Å²	120	93.9 Å²	93.9	64%	0.642	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.5	23.8	-179.1	-57	29.3	0	0	0	114.6	L574	L574-N578 PolarHBondContact O-OD1 2.75Å
579	K	38.2	Very low	67	Low	200 Å²	200	92.9 Å²	92.9	87%	0.87	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-125.3	1.5	170.4	-71.3	-166.7	172.1	-167.6	0	112.9	Q577	Q577-K579 PolarHBondContact O-N 3.01Å
580	A	39	Very low	65.1	Low	87 Å²	87	99.1 Å²	99.1	72%	0.719	51%	0.509	S	S	*	.			trans	-142.4	16.5	-172.4	0	0	0	0	0	113.2	Q577	Q577-A580 PolarHBondContact O-N 3.23Å
581	V	36.5	Very low	62.8	Low	188 Å²	188	108.1 Å²	108.1	100%	1.139	56%	0.555	S	S	*	*			trans	-133	0	174.4	-176.1	0	0	0	0	107.3

Retrieved 581 of 581 residues in 270.4 ms (Link to these results)

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