A0A3Q0KG70_SCHMA Loading...

Smdr2

AlphaFold DB , UniProt , Accession A0A3Q0KG70, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,255 aa.

						>A0A3Q0KG70_SCHMA|A0A3Q0KG70
MAKTQSSNTQVSLSQKSEKDHENVKKNNVSFGKLFQYASTCHKFLIIIGNICAILLGISFPASILVFRSMINGLFNRSSSNNIYGLLGWYFLMAILIFVLCMWKCVCVEFASKRIVQQIQLLYYQAVLHKDVLWFDDHPTGDIINNLTENLNSIESGIGTKLSDFNQNMSGFLAGIIIGFIVKWKLALVACSTLPFVVIAFSLFGIAFKYFHGKEIKAYSRACTISNEVLSSIRTVIAFGGEKRESLRYQKELTSAELMGIKKATAFGSVGGCIGLVIFSSAALVFWFGVKLIRDEDADPGSVIAVFINILLGSIFLGNALPNIPYIMGAVTASKDIFATIDHVSEIEKKDRGKILSDFDGSITFRHVNFNYPSRPDVTILVNFCLTVKSGQTIALVGSSGSGKSTLIHMLQRFYDPTQGEILIQGVDLRELNIHNYRNQIGCVQQEPVLFDGTIRENIGLGKLNATDEEIHEAAIKANAHQFIMRLPQGYDTLVGEKGSNLSGGQKQRIAIARVLIRKPKLLLLDEATSALDTQSERIVQGALDKIVGGCTVIIIAHRLSTIINADYIIVLDQGCIREMGKHNELLKLNGLYATMYYGQEGIDKEQEDSTDDEVDHNQNDGSKRHLTNHHPSPFPKDDYSECSNVTTSSLHNKTVIWLTTNINTKISRAHNSLYLRLLSINRPEMIYIIMGCFCSIISGLLQPAFSLLYSEVYQVFDLRKTPDEMTKKINMVSGIMAGLGFIQLFIGATQGYLFGVAAERLTKRLRSNLFDSMLKQEIGWFDRSDNRPGALTAFLSTDASKVAQISGSRLSTAFEAVVLVIASLVIGFIYSWQLTLVMIPFIPVLLLSSRINMKRVSKNEDKIVAKGISIAKESISAHRTVKSLSLEEYFYQRFKLACIECSSTHLQEAIKIGLVQSIALSGPVLSLTACFALGNYLIQQNAISMISLFKVFITFSMCSQALGRITAFTTKTKEAEEAMGRIFTVIDRKPSIETNQGDQPKEKFNGLIEFKHVNFRYPTRPETKVLNNFTYRIQPGSKIALVGQSGCGKSTLIQLLQRFYDPTDHGLHNGIFFDGINLRQLAPYWIRRQIGIVSQEPILFNISLRDNIAYGDNSRIVSMDEIIEAAKLANIHDFILSLPNAYETLAGQDGSHLSGGQKQRIAIARAIIRKPTLLLLDEATSALDNENQRLVQKALDDAMVTRTSIIIAHRLNTIEKVDYIIVLSNGRIIEYGKLNELIHRKGEFFNLYKLDNTK
					

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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	36.5	Very low	35.6	Very low	229 Å²	229	120.3 Å²	120.3	100%	1.128	66%	0.66	S	S	*	*				0	-9.8	0	-83.7	176.7	165.1	0	0	115
2	A	39	Very low	35.5	Very low	90 Å²	90	115 Å²	115	74%	0.744	64%	0.638	S	S	*	*			trans	-95.5	-4.7	177.8	0	0	0	0	0	115.8
3	K	37.2	Very low	35.5	Very low	198 Å²	198	115 Å²	115	86%	0.861	64%	0.636	S	S	*	*	S	Bend	trans	-96.7	-0.7	-177.9	-82.5	-174.9	174.5	-179	0	115
4	T	36.7	Very low	35.6	Very low	100 Å²	100	110.8 Å²	110.8	61%	0.613	62%	0.618	S	S	*	*	S	Bend	trans	-106.8	-2.8	-176.1	-3.6	0	0	0	0	113.7
5	Q	32.6	Very low	35.5	Very low	151 Å²	151	109.6 Å²	109.6	71%	0.706	61%	0.606	S	S	*	*	S	Bend	trans	-93.9	-20.9	179.6	-86	177.7	-23.9	0	0	114	T9	Q5-T9 PolarHBondContact O-OG1 2.67Å; Q5-T9 VanDerWaalsContact O-OG1 3.09Å
6	S	35.7	Very low	35.4	Very low	81 Å²	81	111.3 Å²	111.3	57%	0.566	61%	0.605	S	S	*	*	H	α-helix	trans	-79.2	-24.3	-179.4	57.7	0	0	0	0	114.2
7	S	34.1	Very low	35.4	Very low	59 Å²	59	108.4 Å²	108.4	41%	0.413	60%	0.595	S	S	.	*	H	α-helix	trans	-77.1	-26.9	178.3	52.8	0	0	0	0	113.2	V11	S7-V11 WeakPolarHBondContact O-CG2 3.14Å
8	N	31.2	Very low	35.3	Very low	116 Å²	116	109.4 Å²	109.4	62%	0.62	60%	0.595	S	S	*	*	H	α-helix	trans	-82.1	-18.1	179.3	-79	-10.4	0	0	0	113.5	S12	N8-S12 PolarHBondContact O-N 3.33Å; N8-S12 PolarHBondContact O-OG 2.74Å
9	T	35.6	Very low	35.2	Very low	77 Å²	77	109.8 Å²	109.8	47%	0.472	59%	0.59	S	S	.	*	H	α-helix	trans	-79	-33	176.2	-22.7	0	0	0	0	111.8	Q5 S12 L13	Q5-T9 PolarHBondContact O-OG1 2.67Å; Q5-T9 VanDerWaalsContact O-OG1 3.09Å; T9-S12 WeakPolarHBondContact CA-OG 3.34Å; T9-S12 PolarHBondContact O-N 3.36Å; T9-S12 PolarHBondContact O-OG 3.23Å; T9-S12 VanDerWaalsContact O-OG 3.05Å; T9-L13 WeakPolarHBondContact O-CD1 3.41Å; T9-L13 PolarHBondContact O-N 3.06Å; T9-L13 VanDerWaalsContact O-N 3.16Å
10	Q	36.8	Very low	35.1	Very low	150 Å²	150	109.5 Å²	109.5	70%	0.701	59%	0.589	S	S	*	*	H	α-helix	trans	-72.3	-36.1	176.6	-78.1	-179.2	-27.4	0	0	112.7	S12 L13 S14	Q10-S12 VanDerWaalsContact C-N 3.33Å; Q10-L13 PolarHBondContact O-N 2.98Å; Q10-S14 PolarHBondContact O-N 3.3Å; Q10-S14 VanDerWaalsContact O-N 3.08Å; Q10-S14 PolarHBondContact O-OG 3.44Å
11	V	36.8	Very low	35.1	Very low	72 Å²	72	111.9 Å²	111.9	44%	0.436	60%	0.596	S	S	.	*	H	α-helix	trans	-70.2	-30.1	175.3	179.7	0	0	0	0	111.8	S7 S14 Q15	S7-V11 WeakPolarHBondContact O-CG2 3.14Å; V11-S14 PolarHBondContact O-OG 3.36Å; V11-Q15 HydrophobicContact CG1-CG 4.41Å; V11-Q15 WeakPolarHBondContact O-CB 3.4Å; V11-Q15 WeakPolarHBondContact O-CG 3.45Å; V11-Q15 PolarHBondContact O-N 3.26Å
12	S	33.7	Very low	34.8	Very low	57 Å²	57	108.6 Å²	108.6	40%	0.399	58%	0.577	S	S	.	*	H	α-helix	trans	-81.8	-23.3	178	50.3	0	0	0	0	113.9	N8 T9 Q10 K16	N8-S12 PolarHBondContact O-N 3.33Å; N8-S12 PolarHBondContact O-OG 2.74Å; T9-S12 WeakPolarHBondContact CA-OG 3.34Å; T9-S12 PolarHBondContact O-N 3.36Å; T9-S12 PolarHBondContact O-OG 3.23Å; T9-S12 VanDerWaalsContact O-OG 3.05Å; Q10-S12 VanDerWaalsContact C-N 3.33Å; S12-K16 VanDerWaalsContact O-CB 3.3Å; S12-K16 WeakPolarHBondContact O-CB 3.05Å; S12-K16 WeakPolarHBondContact O-CG 3.48Å; S12-K16 PolarHBondContact O-N 2.97Å
13	L	35.5	Very low	34.2	Very low	115 Å²	115	109.4 Å²	109.4	60%	0.602	57%	0.57	S	S	*	*	H	α-helix	trans	-80.1	-40.4	171.8	-80.2	157.4	0	0	0	112	T9 Q10 K16 S17	T9-L13 WeakPolarHBondContact O-CD1 3.41Å; T9-L13 PolarHBondContact O-N 3.06Å; T9-L13 VanDerWaalsContact O-N 3.16Å; Q10-L13 PolarHBondContact O-N 2.98Å; L13-K16 PolarHBondContact O-N 3.39Å; L13-S17 PolarHBondContact O-N 3.29Å
14	S	36.8	Very low	34.1	Very low	56 Å²	56	105.2 Å²	105.2	39%	0.392	56%	0.56	S	S	.	*	H	α-helix	trans	-66.8	-41.8	172.6	62	0	0	0	0	111.7	Q10 V11 K16 S17 E18	Q10-S14 PolarHBondContact O-N 3.3Å; Q10-S14 VanDerWaalsContact O-N 3.08Å; Q10-S14 PolarHBondContact O-OG 3.44Å; V11-S14 PolarHBondContact O-OG 3.36Å; S14-K16 VanDerWaalsContact C-N 3.3Å; S14-K16 PolarHBondContact O-N 3Å; S14-S17 PolarHBondContact O-N 2.67Å; S14-S17 PolarHBondContact O-OG 2.75Å; S14-E18 PolarHBondContact O-N 3.46Å
15	Q	35	Very low	33.9	Very low	93 Å²	93	108.7 Å²	108.7	44%	0.435	57%	0.567	S	S	.	*	H	α-helix	trans	-68.3	-24.6	172.4	-75	179.5	-5.4	0	0	113.5	V11 K19	V11-Q15 HydrophobicContact CG1-CG 4.41Å; V11-Q15 WeakPolarHBondContact O-CB 3.4Å; V11-Q15 WeakPolarHBondContact O-CG 3.45Å; V11-Q15 PolarHBondContact O-N 3.26Å; Q15-K19 WeakPolarHBondContact O-CB 3.14Å; Q15-K19 WeakPolarHBondContact O-CD 3.19Å; Q15-K19 WeakPolarHBondContact O-CG 3.44Å; Q15-K19 PolarHBondContact O-N 3.44Å
16	K	33.4	Very low	34.2	Very low	136 Å²	136	109.1 Å²	109.1	59%	0.591	57%	0.566	S	S	*	*	H	α-helix	trans	-74	-39.6	169.9	-97.6	-178.9	172.6	-178.9	0	111.4	S12 L13 S14 K19 D20	S12-K16 VanDerWaalsContact O-CB 3.3Å; S12-K16 WeakPolarHBondContact O-CB 3.05Å; S12-K16 WeakPolarHBondContact O-CG 3.48Å; S12-K16 PolarHBondContact O-N 2.97Å; L13-K16 PolarHBondContact O-N 3.39Å; S14-K16 VanDerWaalsContact C-N 3.3Å; S14-K16 PolarHBondContact O-N 3Å; K16-K19 CarbonylContact O-C 3.58Å; K16-K19 PolarHBondContact O-N 3.04Å; K16-D20 WeakPolarHBondContact O-CB 3.39Å; K16-D20 PolarHBondContact O-N 3.44Å
17	S	35.3	Very low	34.7	Very low	62 Å²	62	112 Å²	112	43%	0.434	58%	0.575	S	S	.	*	H	α-helix	trans	-66.8	-39	174.1	71.2	0	0	0	0	112.6	L13 S14 D20 H21	L13-S17 PolarHBondContact O-N 3.29Å; S14-S17 PolarHBondContact O-N 2.67Å; S14-S17 PolarHBondContact O-OG 2.75Å; S17-D20 PolarHBondContact O-N 3.02Å; S17-H21 WeakPolarHBondContact O-CB 3.41Å; S17-H21 PolarHBondContact O-CD2 3.01Å; S17-H21 PolarHBondContact O-N 3.3Å
18	E	34.1	Very low	35.7	Very low	128 Å²	128	115.5 Å²	115.5	60%	0.598	59%	0.59	S	S	*	*	H	α-helix	trans	-70.2	-36.9	173.4	-78.1	-178.8	151.2	0	0	111.9	S14 E22	S14-E18 PolarHBondContact O-N 3.46Å; E18-E22 WeakPolarHBondContact O-CB 3.22Å; E18-E22 PolarHBondContact O-N 2.97Å
19	K	32.7	Very low	37.4	Very low	116 Å²	116	110.9 Å²	110.9	50%	0.504	57%	0.566	S	S	.	*	H	α-helix	trans	-74.7	-26.8	174.8	-76.1	174.5	178.9	175.7	0	113.5	Q15 K16 N23	Q15-K19 WeakPolarHBondContact O-CB 3.14Å; Q15-K19 WeakPolarHBondContact O-CD 3.19Å; Q15-K19 WeakPolarHBondContact O-CG 3.44Å; Q15-K19 PolarHBondContact O-N 3.44Å; K16-K19 CarbonylContact O-C 3.58Å; K16-K19 PolarHBondContact O-N 3.04Å; K19-N23 WeakPolarHBondContact O-CB 3.45Å; K19-N23 PolarHBondContact O-N 3.06Å; K19-N23 PolarHBondContact O-ND2 3.31Å
20	D	32.6	Very low	39.6	Very low	104 Å²	104	110.3 Å²	110.3	56%	0.556	57%	0.565	S	S	*	*	H	α-helix	trans	-80.3	-29.8	174.7	-69.7	-22.5	0	0	0	110.8	K16 S17 N23 V24	K16-D20 WeakPolarHBondContact O-CB 3.39Å; K16-D20 PolarHBondContact O-N 3.44Å; S17-D20 PolarHBondContact O-N 3.02Å; D20-N23 PolarHBondContact O-N 2.99Å; D20-V24 PolarHBondContact O-N 3.28Å
21	H	34.9	Very low	41.9	Very low	160 Å²	160	106.7 Å²	106.7	74%	0.741	55%	0.547	S	S	*	.	H	α-helix	trans	-72.2	-30	166.2	-82.3	-63.3	0	0	0	113.4	S17	S17-H21 WeakPolarHBondContact O-CB 3.41Å; S17-H21 PolarHBondContact O-CD2 3.01Å; S17-H21 PolarHBondContact O-N 3.3Å
22	E	31.3	Very low	44.1	Very low	159 Å²	159	105.9 Å²	105.9	74%	0.743	55%	0.553	S	S	*	*	H	α-helix	trans	-80.6	-22.1	170.1	-78.7	-170.5	144.5	0	0	113.6	E18	E18-E22 WeakPolarHBondContact O-CB 3.22Å; E18-E22 PolarHBondContact O-N 2.97Å
23	N	26.9	Very low	46.6	Very low	108 Å²	108	108.4 Å²	108.4	58%	0.578	56%	0.557	S	S	*	*			trans	-94.8	5.9	-179.8	-79.1	-37	0	0	0	115.5	K19 D20 K25	K19-N23 WeakPolarHBondContact O-CB 3.45Å; K19-N23 PolarHBondContact O-N 3.06Å; K19-N23 PolarHBondContact O-ND2 3.31Å; D20-N23 PolarHBondContact O-N 2.99Å; N23-K25 PolarHBondContact O-N 3.13Å
24	V	34	Very low	49	Very low	110 Å²	110	102.9 Å²	102.9	67%	0.667	53%	0.528	S	S	*	.	S	Bend	trans	-68.2	76.9	151.4	-173.1	0	0	0	0	106.7	D20 K26	D20-V24 PolarHBondContact O-N 3.28Å; V24-K26 PolarHBondContact O-N 3.14Å
25	K	32.8	Very low	51.5	Low	172 Å²	172	101.8 Å²	101.8	75%	0.748	52%	0.516	S	S	*	.			trans	-42.8	111.1	173.2	-85.9	-179.2	176.3	175.2	0	106.9	N23 N27	N23-K25 PolarHBondContact O-N 3.13Å; K25-N27 VanDerWaalsContact C-N 3.31Å; K25-N27 PolarHBondContact O-N 2.91Å
26	K	39.3	Very low	54	Low	161 Å²	161	100.5 Å²	100.5	70%	0.7	51%	0.51	S	S	*	.			trans	-43.4	96.5	178	-71.6	170.8	178.7	171.5	0	108.2	V24 N28	V24-K26 PolarHBondContact O-N 3.14Å; K26-N28 PolarHBondContact O-N 2.8Å
27	N	45.2	Very low	56.5	Low	140 Å²	140	95.8 Å²	95.8	75%	0.749	49%	0.489	S	S	*	.			trans	-66.4	89.5	170	-94.1	-14.9	0	0	0	105.1	K25 V29	K25-N27 VanDerWaalsContact C-N 3.31Å; K25-N27 PolarHBondContact O-N 2.91Å; N27-V29 PolarHBondContact O-N 2.85Å
28	N	55.7	Low	59	Low	134 Å²	134	93.1 Å²	93.1	72%	0.717	47%	0.471	S	S	*	.			trans	-60	112.7	174.7	-75.4	-14.6	0	0	0	106.2	K26 S30	K26-N28 PolarHBondContact O-N 2.8Å; N28-S30 PolarHBondContact O-N 2.98Å; N28-S30 VanDerWaalsContact O-N 3.1Å
29	V	67.9	Low	61.6	Low	19 Å²	19	89 Å²	89	12%	0.115	46%	0.456	C	S	.	.			trans	-57.3	119	171	-179.1	0	0	0	0	106.2	N27 K33 V331 K335 F338	N27-V29 PolarHBondContact O-N 2.85Å; V29-K33 HydrophobicContact CG1-CB 3.65Å; V29-K33 HydrophobicContact CG1-CD 4.38Å; V29-V331 VanDerWaalsContact O-CG1 3.24Å; V29-V331 WeakPolarHBondContact O-CG1 3.38Å; V29-K335 HydrophobicContact CG2-CB 4.18Å; V29-K335 HydrophobicContact CG2-CG 4.4Å; V29-F338 HydrophobicContact CG1-CD2 4.04Å; V29-F338 HydrophobicContact CG1-CE2 4.25Å
30	S	81.4	Confident	64.3	Low	65 Å²	65	89.2 Å²	89.2	46%	0.455	47%	0.467	S	S	.	.			trans	-68.3	147.5	174.4	63.5	0	0	0	0	108.8	N28 G32 K33	N28-S30 PolarHBondContact O-N 2.98Å; N28-S30 VanDerWaalsContact O-N 3.1Å; S30-G32 PolarHBondContact O-N 3.48Å; S30-G32 VanDerWaalsContact O-N 3.08Å; S30-K33 WeakPolarHBondContact O-CB 3.36Å; S30-K33 PolarHBondContact O-N 3.46Å
31	F	83.5	Confident	67.1	Low	74 Å²	74	88.1 Å²	88.1	33%	0.325	47%	0.466	S	S	.	.	G	3₁₀ helix	trans	-53.9	-34.7	-179.7	-177.8	-101.5	0	0	0	112.6	K33 L34 F35 L162 I327 V331	F31-K33 VanDerWaalsContact C-N 3.29Å; F31-K33 PolarHBondContact O-N 3.11Å; F31-L34 HydrophobicContact CD2-CD1 3.52Å; F31-L34 HydrophobicContact CE2-CD1 3.67Å; F31-L34 HydrophobicContact CG-CD1 4.36Å; F31-L34 VanDerWaalsContact O-CB 3.3Å; F31-L34 WeakPolarHBondContact O-CB 3.42Å; F31-L34 WeakPolarHBondContact O-CG 3.06Å; F31-L34 PolarHBondContact O-N 3.04Å; F31-F35 HydrophobicContact CD1-CE2 4.46Å; F31-F35 AromaticContact CE1-CE2 3.84Å; F31-F35 HydrophobicContact CE1-CE2 3.84Å; F31-F35 HydrophobicContact CE1-CZ 4.48Å; F31-F35 HydrophobicContact CZ-CE2 4.04Å; F31-F35 HydrophobicContact CZ-CZ 4.34Å; F31-L162 HydrophobicContact CE1-CD1 4.4Å; F31-L162 HydrophobicContact CE1-CD2 4.34Å; F31-L162 HydrophobicContact CZ-CD1 3.82Å; F31-L162 HydrophobicContact CZ-CD2 3.8Å; F31-L162 HydrophobicContact CZ-CG 4.42Å; F31-I327 HydrophobicContact CD2-CG2 3.96Å; F31-I327 HydrophobicContact CE2-CG2 3.64Å; F31-V331 HydrophobicContact CD2-CG2 4.12Å
32	G	83.5	Confident	69.8	Low	55 Å²	55	82 Å²	82	57%	0.567	44%	0.438	S	S	*	.	G	3₁₀ helix	trans	-62.7	-29.9	175.8	0	0	0	0	0	114.5	S30 L34 F35	S30-G32 PolarHBondContact O-N 3.48Å; S30-G32 VanDerWaalsContact O-N 3.08Å; G32-L34 PolarHBondContact O-N 3.33Å; G32-F35 PolarHBondContact O-N 3.48Å
33	K	86.4	Confident	72.6	Confident	109 Å²	109	78.1 Å²	78.1	47%	0.474	42%	0.419	S	S	.	.	G	3₁₀ helix	trans	-68.6	-20.1	176.6	-78.2	-174.5	176.4	-169.2	0	113	V29 S30 F31 F35 Q36 F338	V29-K33 HydrophobicContact CG1-CB 3.65Å; V29-K33 HydrophobicContact CG1-CD 4.38Å; S30-K33 WeakPolarHBondContact O-CB 3.36Å; S30-K33 PolarHBondContact O-N 3.46Å; F31-K33 VanDerWaalsContact C-N 3.29Å; F31-K33 PolarHBondContact O-N 3.11Å; K33-F35 PolarHBondContact O-N 2.74Å; K33-F35 VanDerWaalsContact O-N 3.13Å; K33-Q36 VanDerWaalsContact O-CB 3.27Å; K33-Q36 WeakPolarHBondContact O-CB 3.3Å; K33-Q36 VanDerWaalsContact O-CG 3.22Å; K33-Q36 WeakPolarHBondContact O-CG 3.19Å; K33-Q36 PolarHBondContact O-N 3.46Å; K33-F338 WeakPolarHBondContact O-CE2 3.33Å
34	L	86.5	Confident	75.8	Confident	0 Å²	0	79.1 Å²	79.1	0%	0	42%	0.418	C	S	.	.	G	3₁₀ helix	trans	-57.5	-28.7	174.9	-66.7	175.5	0	0	0	112.7	F31 G32 I158 A330 V331 S334 F338	F31-L34 HydrophobicContact CD2-CD1 3.52Å; F31-L34 HydrophobicContact CE2-CD1 3.67Å; F31-L34 HydrophobicContact CG-CD1 4.36Å; F31-L34 VanDerWaalsContact O-CB 3.3Å; F31-L34 WeakPolarHBondContact O-CB 3.42Å; F31-L34 WeakPolarHBondContact O-CG 3.06Å; F31-L34 PolarHBondContact O-N 3.04Å; G32-L34 PolarHBondContact O-N 3.33Å; L34-I158 HydrophobicContact CB-CG2 4.07Å; L34-I158 HydrophobicContact CD1-CG2 4.02Å; L34-A330 HydrophobicContact CD1-CB 4.36Å; L34-V331 HydrophobicContact CD1-CG2 4Å; L34-S334 VanDerWaalsContact CD2-OG 3.26Å; L34-S334 WeakPolarHBondContact CD2-OG 3.46Å; L34-F338 HydrophobicContact CD2-CE2 4.26Å; L34-F338 HydrophobicContact CD2-CZ 4.45Å
35	F	89.3	Confident	78.7	Confident	33 Å²	33	75.6 Å²	75.6	15%	0.145	40%	0.395	C	S	.	.	G	3₁₀ helix	trans	-94.2	10.4	179.6	-56.9	-80.2	0	0	0	113.2	F31 G32 K33 Y37 A38 K43 I46 I115 I158 L162	F31-F35 HydrophobicContact CD1-CE2 4.46Å; F31-F35 AromaticContact CE1-CE2 3.84Å; F31-F35 HydrophobicContact CE1-CE2 3.84Å; F31-F35 HydrophobicContact CE1-CZ 4.48Å; F31-F35 HydrophobicContact CZ-CE2 4.04Å; F31-F35 HydrophobicContact CZ-CZ 4.34Å; G32-F35 PolarHBondContact O-N 3.48Å; K33-F35 PolarHBondContact O-N 2.74Å; K33-F35 VanDerWaalsContact O-N 3.13Å; F35-Y37 PolarHBondContact O-N 3.24Å; F35-A38 HydrophobicContact CB-CB 4.46Å; F35-A38 WeakPolarHBondContact O-CB 3.36Å; F35-A38 PolarHBondContact O-N 3.3Å; F35-A38 VanDerWaalsContact O-N 3.15Å; F35-K43 WeakPolarHBondContact O-CE 3.25Å; F35-K43 PolarHBondContact O-NZ 3.21Å; F35-I46 HydrophobicContact CD1-CD1 4.19Å; F35-I46 HydrophobicContact CE1-CD1 3.86Å; F35-I46 HydrophobicContact CE1-CG2 4.14Å; F35-I115 HydrophobicContact CD1-CD1 4.39Å; F35-I158 HydrophobicContact CE1-CB 3.94Å; F35-I158 HydrophobicContact CE1-CG2 4.27Å; F35-I158 HydrophobicContact CZ-CB 4.02Å; F35-I158 HydrophobicContact CZ-CG2 4.14Å; F35-L162 HydrophobicContact CZ-CD2 4.37Å
36	Q	87.7	Confident	81.5	Confident	66 Å²	66	67.9 Å²	67.9	31%	0.308	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-41.4	-173.9	72.5	-173.7	7.7	0	0	112.8	K33 A38	K33-Q36 VanDerWaalsContact O-CB 3.27Å; K33-Q36 WeakPolarHBondContact O-CB 3.3Å; K33-Q36 VanDerWaalsContact O-CG 3.22Å; K33-Q36 WeakPolarHBondContact O-CG 3.19Å; K33-Q36 PolarHBondContact O-N 3.46Å; Q36-A38 VanDerWaalsContact C-N 3.33Å; Q36-A38 PolarHBondContact O-N 2.75Å
37	Y	86	Confident	84.1	Confident	37 Å²	37	64.8 Å²	64.8	15%	0.145	35%	0.353	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.7	-0.2	179.1	-53.9	-66.4	0	0	0	113.8	F35 Q118 I119 L122 F338 I341 D342	F35-Y37 PolarHBondContact O-N 3.24Å; Y37-Q118 PolarHBondContact O-NE2 2.75Å; Y37-Q118 VanDerWaalsContact O-NE2 3.09Å; Y37-Q118 PolarHBondContact O-OE1 3.06Å; Y37-I119 HydrophobicContact CD2-CG1 4.05Å; Y37-L122 HydrophobicContact CD1-CD1 3.52Å; Y37-L122 HydrophobicContact CE1-CD1 4.14Å; Y37-L122 HydrophobicContact CG-CD1 3.79Å; Y37-F338 HydrophobicContact CD2-CD1 4.38Å; Y37-F338 AromaticContact CD2-CE1 3.9Å; Y37-F338 HydrophobicContact CD2-CE1 3.9Å; Y37-F338 HydrophobicContact CD2-CZ 4.21Å; Y37-F338 AromaticContact CE2-CD1 3.66Å; Y37-F338 HydrophobicContact CE2-CD1 3.66Å; Y37-F338 AromaticContact CE2-CE1 3.64Å; Y37-F338 HydrophobicContact CE2-CE1 3.64Å; Y37-F338 HydrophobicContact CE2-CG 4.19Å; Y37-F338 HydrophobicContact CE2-CZ 4.15Å; Y37-I341 HydrophobicContact CE1-CG2 4.03Å; Y37-I341 HydrophobicContact CE2-CD1 3.99Å; Y37-I341 HydrophobicContact CE2-CG2 4.44Å; Y37-I341 WeakPolarHBondContact OH-CG2 3.45Å; Y37-D342 PolarHBondContact OH-OD1 3.35Å
38	A	86.6	Confident	86.5	Confident	6 Å²	6	60.5 Å²	60.5	5%	0.05	33%	0.329	C	S	.	.	S	Bend	trans	-75.2	132.8	178.7	0	0	0	0	0	111.3	F35 Q36 K43 I115	F35-A38 HydrophobicContact CB-CB 4.46Å; F35-A38 WeakPolarHBondContact O-CB 3.36Å; F35-A38 PolarHBondContact O-N 3.3Å; F35-A38 VanDerWaalsContact O-N 3.15Å; Q36-A38 VanDerWaalsContact C-N 3.33Å; Q36-A38 PolarHBondContact O-N 2.75Å; A38-K43 HydrophobicContact CB-CD 4.46Å; A38-K43 HydrophobicContact CB-CG 3.76Å; A38-K43 WeakPolarHBondContact O-CE 3.33Å; A38-K43 PolarHBondContact O-NZ 3.13Å; A38-I115 HydrophobicContact CB-CD1 3.47Å; A38-I115 VanDerWaalsContact CB-CD1 3.47Å; A38-I115 HydrophobicContact CB-CG1 3.57Å; A38-I115 HydrophobicContact CB-CG2 4.34Å
39	S	89	Confident	88.4	Confident	41 Å²	41	54.1 Å²	54.1	29%	0.287	30%	0.295	S	S	.	.			trans	-59.1	153.7	170.9	80.9	0	0	0	0	111.2	C41 H42 K43	S39-C41 PolarHBondContact O-N 3Å; S39-H42 PolarHBondContact O-N 2.86Å; S39-H42 PolarHBondContact OG-CD2 3.06Å; S39-H42 PolarHBondContact OG-CE1 3.01Å; S39-H42 PolarHBondContact OG-N 3.11Å; S39-H42 VanDerWaalsContact OG-N 3.14Å; S39-H42 PolarHBondContact OG-ND1 2.98Å; S39-K43 WeakPolarHBondContact O-CG 3.42Å; S39-K43 PolarHBondContact O-N 2.67Å
40	T	89.6	Confident	89.6	Confident	121 Å²	121	54 Å²	54	74%	0.742	29%	0.294	S	S	*	.	H	α-helix	trans	-56.8	-36.2	178.6	-45.2	0	0	0	0	111.9	F44	T40-F44 WeakPolarHBondContact O-CB 3.37Å; T40-F44 PolarHBondContact O-N 2.94Å
41	C	92.3	Very high	90.3	Very high	80 Å²	80	55.1 Å²	55.1	54%	0.541	29%	0.294	S	S	.	.	H	α-helix	trans	-64.8	-46.3	174.8	-177	0	0	0	0	112	S39 K43 F44 L45	S39-C41 PolarHBondContact O-N 3Å; C41-K43 PolarHBondContact O-N 3.24Å; C41-F44 WeakPolarHBondContact O-CB 3.43Å; C41-F44 PolarHBondContact O-N 2.81Å; C41-L45 WeakPolarHBondContact O-CG 3.39Å; C41-L45 PolarHBondContact O-N 3.29Å
42	H	91.5	Very high	90.9	Very high	32 Å²	32	52.3 Å²	52.3	15%	0.148	28%	0.283	C	S	.	.	H	α-helix	trans	-67.3	-37.4	179.4	-56.5	154.1	0	0	0	112	S39 F44 L45 I46 A111 I115	S39-H42 PolarHBondContact O-N 2.86Å; S39-H42 PolarHBondContact OG-CD2 3.06Å; S39-H42 PolarHBondContact OG-CE1 3.01Å; S39-H42 PolarHBondContact OG-N 3.11Å; S39-H42 VanDerWaalsContact OG-N 3.14Å; S39-H42 PolarHBondContact OG-ND1 2.98Å; H42-F44 VanDerWaalsContact C-N 3.33Å; H42-F44 PolarHBondContact O-N 2.8Å; H42-L45 PolarHBondContact O-N 2.87Å; H42-I46 PolarHBondContact O-N 2.72Å; H42-A111 HydrophobicContact CB-CB 4.45Å; H42-I115 HydrophobicContact CB-CD1 4.11Å; H42-I115 HydrophobicContact CB-CG1 3.99Å
43	K	90.5	Very high	91.5	Very high	78 Å²	78	49.7 Å²	49.7	34%	0.339	26%	0.256	S	S	.	.	H	α-helix	trans	-58	-47.2	171.3	-72.3	174.3	176.3	163.3	0	110.9	F35 A38 S39 C41 L45 I46 I47	F35-K43 WeakPolarHBondContact O-CE 3.25Å; F35-K43 PolarHBondContact O-NZ 3.21Å; A38-K43 HydrophobicContact CB-CD 4.46Å; A38-K43 HydrophobicContact CB-CG 3.76Å; A38-K43 WeakPolarHBondContact O-CE 3.33Å; A38-K43 PolarHBondContact O-NZ 3.13Å; S39-K43 WeakPolarHBondContact O-CG 3.42Å; S39-K43 PolarHBondContact O-N 2.67Å; C41-K43 PolarHBondContact O-N 3.24Å; K43-L45 PolarHBondContact O-N 3.31Å; K43-I46 PolarHBondContact O-N 3.39Å; K43-I47 VanDerWaalsContact O-CG1 3.27Å; K43-I47 WeakPolarHBondContact O-CG1 3.49Å; K43-I47 PolarHBondContact O-N 2.97Å
44	F	93.3	Very high	91.9	Very high	128 Å²	128	47.9 Å²	47.9	56%	0.561	25%	0.251	S	S	*	.	H	α-helix	trans	-62.4	-42.2	178.3	-172.9	-111.3	0	0	0	112.4	T40 C41 H42 I46 I47 I48	T40-F44 WeakPolarHBondContact O-CB 3.37Å; T40-F44 PolarHBondContact O-N 2.94Å; C41-F44 WeakPolarHBondContact O-CB 3.43Å; C41-F44 PolarHBondContact O-N 2.81Å; H42-F44 VanDerWaalsContact C-N 3.33Å; H42-F44 PolarHBondContact O-N 2.8Å; F44-I46 PolarHBondContact O-N 2.89Å; F44-I47 PolarHBondContact O-N 3.3Å; F44-I48 HydrophobicContact CD1-CD1 3.56Å; F44-I48 HydrophobicContact CD1-CG1 4.42Å; F44-I48 HydrophobicContact CE1-CD1 3.17Å; F44-I48 HydrophobicContact CE1-CG1 4.17Å; F44-I48 HydrophobicContact CE2-CD1 4.34Å; F44-I48 HydrophobicContact CG-CD1 4.31Å; F44-I48 HydrophobicContact CZ-CD1 3.61Å; F44-I48 HydrophobicContact CZ-CG1 4.23Å; F44-I48 WeakPolarHBondContact O-CG1 3.17Å; F44-I48 PolarHBondContact O-N 2.92Å
45	L	93.8	Very high	92.4	Very high	36 Å²	36	51.7 Å²	51.7	19%	0.188	27%	0.271	C	S	.	.	H	α-helix	trans	-61.6	-42.2	175.6	-72.8	172.6	0	0	0	112.6	C41 H42 K43 I47 I48 G49 C107 F110 A111	C41-L45 WeakPolarHBondContact O-CG 3.39Å; C41-L45 PolarHBondContact O-N 3.29Å; H42-L45 PolarHBondContact O-N 2.87Å; K43-L45 PolarHBondContact O-N 3.31Å; L45-I47 VanDerWaalsContact C-N 3.35Å; L45-I48 PolarHBondContact O-N 2.86Å; L45-G49 PolarHBondContact O-N 2.99Å; L45-C107 HydrophobicContact CB-CB 4.48Å; L45-C107 WeakPolarHBondContact O-CB 3.22Å; L45-F110 HydrophobicContact CD1-CD1 4.05Å; L45-F110 HydrophobicContact CD1-CE1 4.35Å; L45-A111 HydrophobicContact CB-CB 3.99Å
46	I	92.8	Very high	92.6	Very high	10 Å²	10	50.1 Å²	50.1	5%	0.051	26%	0.264	C	S	.	.	H	α-helix	trans	-65.5	-39.6	176	-77.3	159.5	0	0	0	111.5	F35 H42 K43 F44 G49 N50 A111 I115	F35-I46 HydrophobicContact CD1-CD1 4.19Å; F35-I46 HydrophobicContact CE1-CD1 3.86Å; F35-I46 HydrophobicContact CE1-CG2 4.14Å; H42-I46 PolarHBondContact O-N 2.72Å; K43-I46 PolarHBondContact O-N 3.39Å; F44-I46 PolarHBondContact O-N 2.89Å; I46-G49 PolarHBondContact O-N 2.78Å; I46-N50 WeakPolarHBondContact CG2-ND2 3.45Å; I46-N50 WeakPolarHBondContact O-CB 3.49Å; I46-N50 PolarHBondContact O-N 2.78Å; I46-N50 PolarHBondContact O-ND2 3.17Å; I46-A111 HydrophobicContact CD1-CB 3.88Å; I46-A111 HydrophobicContact CG1-CB 3.62Å; I46-I115 HydrophobicContact CD1-CD1 3.22Å
47	I	93.9	Very high	92.8	Very high	97 Å²	97	47 Å²	47	50%	0.497	25%	0.249	S	C	.	.	H	α-helix	trans	-62	-49.8	175.6	-68.4	164.6	0	0	0	109.8	K43 F44 L45 G49 N50 I51	K43-I47 VanDerWaalsContact O-CG1 3.27Å; K43-I47 WeakPolarHBondContact O-CG1 3.49Å; K43-I47 PolarHBondContact O-N 2.97Å; F44-I47 PolarHBondContact O-N 3.3Å; L45-I47 VanDerWaalsContact C-N 3.35Å; I47-G49 VanDerWaalsContact C-N 3.32Å; I47-G49 PolarHBondContact O-N 2.79Å; I47-N50 PolarHBondContact O-N 3.4Å; I47-I51 HydrophobicContact CG2-CD1 3.81Å; I47-I51 HydrophobicContact CG2-CG1 4.47Å; I47-I51 VanDerWaalsContact O-CG1 3.3Å; I47-I51 WeakPolarHBondContact O-CG1 3.35Å; I47-I51 PolarHBondContact O-N 3.23Å
48	I	95.1	Very high	93.2	Very high	49 Å²	49	48.5 Å²	48.5	25%	0.251	26%	0.259	S	S	.	.	H	α-helix	trans	-57.3	-46.7	175.6	-71.9	172	0	0	0	110.9	F44 L45 N50 I51 C52	F44-I48 HydrophobicContact CD1-CD1 3.56Å; F44-I48 HydrophobicContact CD1-CG1 4.42Å; F44-I48 HydrophobicContact CE1-CD1 3.17Å; F44-I48 HydrophobicContact CE1-CG1 4.17Å; F44-I48 HydrophobicContact CE2-CD1 4.34Å; F44-I48 HydrophobicContact CG-CD1 4.31Å; F44-I48 HydrophobicContact CZ-CD1 3.61Å; F44-I48 HydrophobicContact CZ-CG1 4.23Å; F44-I48 WeakPolarHBondContact O-CG1 3.17Å; F44-I48 PolarHBondContact O-N 2.92Å; L45-I48 PolarHBondContact O-N 2.86Å; I48-N50 VanDerWaalsContact C-N 3.32Å; I48-N50 PolarHBondContact O-N 3.17Å; I48-I51 PolarHBondContact O-N 2.8Å; I48-C52 PolarHBondContact O-N 2.87Å; I48-C52 PolarHBondContact O-SG 3.32Å
49	G	94.8	Very high	93.5	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-60.5	-41.1	-179.8	0	0	0	0	0	112.6	L45 I46 I47 C52 A53	L45-G49 PolarHBondContact O-N 2.99Å; I46-G49 PolarHBondContact O-N 2.78Å; I47-G49 VanDerWaalsContact C-N 3.32Å; I47-G49 PolarHBondContact O-N 2.79Å; G49-C52 PolarHBondContact O-N 2.98Å; G49-A53 WeakPolarHBondContact O-CB 3.49Å; G49-A53 PolarHBondContact O-N 2.99Å
50	N	94.6	Very high	93.4	Very high	18 Å²	18	48.3 Å²	48.3	10%	0.096	25%	0.253	C	S	.	.	H	α-helix	trans	-71.7	-35.8	175.6	-79.9	-73.5	0	0	0	112.9	I46 I47 I48 C52 A53 I54 N166	I46-N50 WeakPolarHBondContact CG2-ND2 3.45Å; I46-N50 WeakPolarHBondContact O-CB 3.49Å; I46-N50 PolarHBondContact O-N 2.78Å; I46-N50 PolarHBondContact O-ND2 3.17Å; I47-N50 PolarHBondContact O-N 3.4Å; I48-N50 VanDerWaalsContact C-N 3.32Å; I48-N50 PolarHBondContact O-N 3.17Å; N50-C52 VanDerWaalsContact C-N 3.34Å; N50-A53 WeakPolarHBondContact O-CB 3.43Å; N50-A53 PolarHBondContact O-N 3.12Å; N50-I54 VanDerWaalsContact O-CG1 3.32Å; N50-I54 WeakPolarHBondContact O-CG1 3.36Å; N50-I54 PolarHBondContact O-N 2.77Å; N50-N166 PolarHBondContact OD1-ND2 3.46Å
51	I	96.2	Very high	93.4	Very high	88 Å²	88	42.5 Å²	42.5	45%	0.451	22%	0.218	S	C	.	.	H	α-helix	trans	-61.6	-45.7	171.2	-68.6	166.2	0	0	0	109.8	I47 I48 A53 I54 L55	I47-I51 HydrophobicContact CG2-CD1 3.81Å; I47-I51 HydrophobicContact CG2-CG1 4.47Å; I47-I51 VanDerWaalsContact O-CG1 3.3Å; I47-I51 WeakPolarHBondContact O-CG1 3.35Å; I47-I51 PolarHBondContact O-N 3.23Å; I48-I51 PolarHBondContact O-N 2.8Å; I51-A53 VanDerWaalsContact C-N 3.28Å; I51-A53 PolarHBondContact O-N 2.77Å; I51-I54 PolarHBondContact O-N 3.41Å; I51-L55 HydrophobicContact CG2-CD1 4.04Å; I51-L55 HydrophobicContact CG2-CG 4.41Å; I51-L55 WeakPolarHBondContact O-CG 3.46Å; I51-L55 PolarHBondContact O-N 2.97Å
52	C	95.8	Very high	93.3	Very high	15 Å²	15	39.9 Å²	39.9	10%	0.101	20%	0.202	C	C	.	.	H	α-helix	trans	-60.1	-39.4	174.8	-65.8	0	0	0	0	111.5	I48 G49 N50 L55 L56 L100 K104	I48-C52 PolarHBondContact O-N 2.87Å; I48-C52 PolarHBondContact O-SG 3.32Å; G49-C52 PolarHBondContact O-N 2.98Å; N50-C52 VanDerWaalsContact C-N 3.34Å; C52-L55 PolarHBondContact O-N 3.42Å; C52-L56 WeakPolarHBondContact O-CB 3.33Å; C52-L56 PolarHBondContact O-N 2.86Å; C52-L100 HydrophobicContact CB-CD2 4.4Å; C52-K104 HydrophobicContact CB-CB 3.98Å
53	A	95.1	Very high	93.1	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-62.6	-43.3	175.5	0	0	0	0	0	112.4	G49 N50 I51 L56 G57 K104 S163 Q167	G49-A53 WeakPolarHBondContact O-CB 3.49Å; G49-A53 PolarHBondContact O-N 2.99Å; N50-A53 WeakPolarHBondContact O-CB 3.43Å; N50-A53 PolarHBondContact O-N 3.12Å; I51-A53 VanDerWaalsContact C-N 3.28Å; I51-A53 PolarHBondContact O-N 2.77Å; A53-L56 PolarHBondContact O-N 3.49Å; A53-G57 PolarHBondContact O-N 3Å; A53-K104 HydrophobicContact CB-CD 4.05Å; A53-K104 HydrophobicContact CB-CG 4.08Å; A53-S163 WeakPolarHBondContact CB-O 3.41Å; A53-Q167 HydrophobicContact CB-CB 4.21Å; A53-Q167 WeakPolarHBondContact O-CA 3.35Å; A53-Q167 WeakPolarHBondContact O-CB 3.42Å
54	I	96.1	Very high	92.9	Very high	70 Å²	70	35.4 Å²	35.4	36%	0.359	18%	0.183	S	C	.	.	H	α-helix	trans	-64.4	-48.3	176.8	-68.3	164.9	0	0	0	110.7	N50 I51 L56 G57 I58 N166 S170	N50-I54 VanDerWaalsContact O-CG1 3.32Å; N50-I54 WeakPolarHBondContact O-CG1 3.36Å; N50-I54 PolarHBondContact O-N 2.77Å; I51-I54 PolarHBondContact O-N 3.41Å; I54-L56 VanDerWaalsContact C-N 3.28Å; I54-L56 PolarHBondContact O-N 3.07Å; I54-G57 PolarHBondContact O-N 2.94Å; I54-G57 VanDerWaalsContact O-N 3.17Å; I54-I58 HydrophobicContact CG2-CD1 3.91Å; I54-I58 WeakPolarHBondContact O-CG1 3.27Å; I54-I58 PolarHBondContact O-N 3.32Å; I54-N166 HydrophobicContact CG1-CB 4.26Å; I54-S170 WeakPolarHBondContact CA-OG 3.49Å; I54-S170 PolarHBondContact O-OG 3.11Å
55	L	95.6	Very high	92.7	Very high	81 Å²	81	32.2 Å²	32.2	42%	0.424	17%	0.171	S	C	.	.	H	α-helix	trans	-60.9	-39.6	177	-70.1	174.7	0	0	0	111.6	I51 C52 I58 S59 L100	I51-L55 HydrophobicContact CG2-CD1 4.04Å; I51-L55 HydrophobicContact CG2-CG 4.41Å; I51-L55 WeakPolarHBondContact O-CG 3.46Å; I51-L55 PolarHBondContact O-N 2.97Å; C52-L55 PolarHBondContact O-N 3.42Å; L55-I58 PolarHBondContact O-N 3.13Å; L55-S59 WeakPolarHBondContact O-CB 3.32Å; L55-S59 PolarHBondContact O-N 3.39Å; L55-S59 PolarHBondContact O-OG 3.21Å; L55-L100 HydrophobicContact CB-CD1 3.79Å; L55-L100 HydrophobicContact CB-CD2 4.08Å; L55-L100 HydrophobicContact CD1-CD2 4.09Å
56	L	94	Very high	92.3	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-63.5	-41.3	175.7	-179.2	62.3	0	0	0	111.6	C52 A53 I54 S59 F60 I97 L100 C101 K104 Q167 L921	C52-L56 WeakPolarHBondContact O-CB 3.33Å; C52-L56 PolarHBondContact O-N 2.86Å; A53-L56 PolarHBondContact O-N 3.49Å; I54-L56 VanDerWaalsContact C-N 3.28Å; I54-L56 PolarHBondContact O-N 3.07Å; L56-S59 PolarHBondContact O-N 3.28Å; L56-F60 HydrophobicContact CD1-CE2 4.28Å; L56-F60 HydrophobicContact CG-CE2 4.47Å; L56-F60 WeakPolarHBondContact O-CD2 3.49Å; L56-I97 HydrophobicContact CD1-CB 4.22Å; L56-I97 HydrophobicContact CD1-CG1 4.24Å; L56-I97 HydrophobicContact CD1-CG2 3.85Å; L56-L100 HydrophobicContact CB-CB 4.27Å; L56-L100 HydrophobicContact CD1-CB 4.37Å; L56-C101 HydrophobicContact CD2-CB 4.02Å; L56-K104 HydrophobicContact CD2-CD 4.17Å; L56-Q167 HydrophobicContact CD2-CG 4.44Å; L56-Q167 HydrophobicContact CG-CG 4.39Å; L56-L921 HydrophobicContact CD1-CD2 3.95Å; L56-L921 HydrophobicContact CD2-CD2 3.86Å; L56-L921 HydrophobicContact CG-CD2 4.25Å
57	G	93	Very high	91.9	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-61	-44.3	174.7	0	0	0	0	0	112.7	A53 I54 P61 Q167 G171	A53-G57 PolarHBondContact O-N 3Å; I54-G57 PolarHBondContact O-N 2.94Å; I54-G57 VanDerWaalsContact O-N 3.17Å; G57-P61 WeakPolarHBondContact O-CD 3.26Å; G57-Q167 VanDerWaalsContact CA-O 3.28Å; G57-Q167 WeakPolarHBondContact CA-O 3.31Å; G57-G171 VanDerWaalsContact O-CA 3.22Å; G57-G171 WeakPolarHBondContact O-CA 3.34Å
58	I	94.4	Very high	91.6	Very high	69 Å²	69	30 Å²	30	35%	0.354	16%	0.157	S	C	.	.	H	α-helix	trans	-67.8	-35	177.4	-63.6	165.3	0	0	0	111.9	I54 L55 F60 P61 A62 A174	I54-I58 HydrophobicContact CG2-CD1 3.91Å; I54-I58 WeakPolarHBondContact O-CG1 3.27Å; I54-I58 PolarHBondContact O-N 3.32Å; L55-I58 PolarHBondContact O-N 3.13Å; I58-F60 PolarHBondContact O-N 3.02Å; I58-P61 WeakPolarHBondContact O-CD 3.2Å; I58-A62 WeakPolarHBondContact O-CB 3.4Å; I58-A62 PolarHBondContact O-N 3.29Å; I58-A174 HydrophobicContact CB-CB 4.39Å; I58-A174 HydrophobicContact CG1-CB 4.1Å; I58-A174 HydrophobicContact CG2-CB 4.37Å
59	S	91.3	Very high	91.1	Very high	9 Å²	9	30.4 Å²	30.4	6%	0.063	16%	0.164	C	C	.	.	H	α-helix	trans	-58.8	-32.7	-176.6	-64	0	0	0	0	112.7	L55 L56 S63	L55-S59 WeakPolarHBondContact O-CB 3.32Å; L55-S59 PolarHBondContact O-N 3.39Å; L55-S59 PolarHBondContact O-OG 3.21Å; L56-S59 PolarHBondContact O-N 3.28Å; S59-S63 WeakPolarHBondContact O-CB 3.45Å; S59-S63 PolarHBondContact O-N 3.02Å
60	F	87.4	Confident	90.5	Very high	33 Å²	33	30.9 Å²	30.9	15%	0.145	17%	0.166	C	C	.	.	H	α-helix	trans	-66.1	-58.8	177.9	-77.5	-71.7	0	0	0	112.6	L56 I58 A62 S63 I97 F316 L921	L56-F60 HydrophobicContact CD1-CE2 4.28Å; L56-F60 HydrophobicContact CG-CE2 4.47Å; L56-F60 WeakPolarHBondContact O-CD2 3.49Å; I58-F60 PolarHBondContact O-N 3.02Å; F60-A62 VanDerWaalsContact C-N 3.26Å; F60-A62 PolarHBondContact O-N 3.11Å; F60-S63 WeakPolarHBondContact O-CB 3.48Å; F60-S63 PolarHBondContact O-N 3.22Å; F60-S63 VanDerWaalsContact O-N 3.14Å; F60-S63 PolarHBondContact O-OG 3.12Å; F60-I97 HydrophobicContact CE1-CD1 4.27Å; F60-I97 HydrophobicContact CZ-CG2 4.42Å; F60-F316 HydrophobicContact CB-CE2 4.24Å; F60-F316 HydrophobicContact CB-CZ 3.87Å; F60-F316 HydrophobicContact CD2-CZ 4.07Å; F60-F316 HydrophobicContact CG-CZ 4.07Å; F60-L921 HydrophobicContact CE1-CD1 4.47Å; F60-L921 HydrophobicContact CE2-CD1 4.19Å; F60-L921 HydrophobicContact CE2-CD2 4.13Å; F60-L921 HydrophobicContact CE2-CG 4.32Å; F60-L921 HydrophobicContact CZ-CD1 3.53Å; F60-L921 HydrophobicContact CZ-CD2 4Å; F60-L921 HydrophobicContact CZ-CG 3.69Å
61	P	90.5	Very high	89.9	Confident	0 Å²	0	30 Å²	30	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-56.9	-35.6	171.9	-30.8	38.7	0	0	0	114.6	G57 I58 S63 I64 G171 A174 I178 N309 F316	G57-P61 WeakPolarHBondContact O-CD 3.26Å; I58-P61 WeakPolarHBondContact O-CD 3.2Å; P61-S63 PolarHBondContact O-N 2.82Å; P61-I64 WeakPolarHBondContact O-CB 3.37Å; P61-I64 PolarHBondContact O-N 3.08Å; P61-G171 WeakPolarHBondContact CG-O 3.44Å; P61-A174 HydrophobicContact CB-CB 4.11Å; P61-A174 HydrophobicContact CG-CB 3.97Å; P61-I178 HydrophobicContact CB-CD1 3.64Å; P61-N309 WeakPolarHBondContact CA-OD1 3.39Å; P61-N309 WeakPolarHBondContact CB-OD1 3.35Å; P61-N309 PolarHBondContact O-OD1 3.42Å; P61-F316 HydrophobicContact CG-CE2 4.44Å
62	A	89.8	Confident	89.3	Confident	25 Å²	25	27.1 Å²	27.1	21%	0.207	15%	0.147	C	C	.	.	H	α-helix	trans	-64.5	-38.6	176	0	0	0	0	0	112.2	I58 F60 I64 L65	I58-A62 WeakPolarHBondContact O-CB 3.4Å; I58-A62 PolarHBondContact O-N 3.29Å; F60-A62 VanDerWaalsContact C-N 3.26Å; F60-A62 PolarHBondContact O-N 3.11Å; A62-I64 PolarHBondContact O-N 3.35Å; A62-I64 VanDerWaalsContact O-N 3.16Å; A62-L65 WeakPolarHBondContact O-CB 3.33Å; A62-L65 PolarHBondContact O-N 3.22Å
63	S	86.7	Confident	88.4	Confident	6 Å²	6	27.2 Å²	27.2	4%	0.042	15%	0.15	C	C	.	.	H	α-helix	trans	-59.5	-28	176	78.8	0	0	0	0	112.5	S59 F60 P61 L65 V66 F67	S59-S63 WeakPolarHBondContact O-CB 3.45Å; S59-S63 PolarHBondContact O-N 3.02Å; F60-S63 WeakPolarHBondContact O-CB 3.48Å; F60-S63 PolarHBondContact O-N 3.22Å; F60-S63 VanDerWaalsContact O-N 3.14Å; F60-S63 PolarHBondContact O-OG 3.12Å; P61-S63 PolarHBondContact O-N 2.82Å; S63-L65 VanDerWaalsContact C-N 3.33Å; S63-V66 PolarHBondContact O-N 3.49Å; S63-F67 PolarHBondContact O-N 3.2Å
64	I	87.8	Confident	87.5	Confident	9 Å²	9	28 Å²	28	5%	0.046	16%	0.155	C	C	.	.	H	α-helix	trans	-73.1	-26.2	178.3	-67.4	162.7	0	0	0	111.8	P61 A62 F67 R68 A305 I308 N309 L312	P61-I64 WeakPolarHBondContact O-CB 3.37Å; P61-I64 PolarHBondContact O-N 3.08Å; A62-I64 PolarHBondContact O-N 3.35Å; A62-I64 VanDerWaalsContact O-N 3.16Å; I64-F67 WeakPolarHBondContact O-CB 3.31Å; I64-F67 PolarHBondContact O-N 3.37Å; I64-R68 PolarHBondContact O-N 2.93Å; I64-A305 HydrophobicContact CG2-CB 3.8Å; I64-I308 HydrophobicContact CD1-CB 4.03Å; I64-I308 HydrophobicContact CD1-CG2 3.35Å; I64-I308 HydrophobicContact CG1-CG2 4.03Å; I64-I308 HydrophobicContact CG2-CB 4.39Å; I64-N309 WeakPolarHBondContact CD1-OD1 3.34Å; I64-L312 HydrophobicContact CD1-CD1 3.47Å; I64-L312 VanDerWaalsContact CD1-CD1 3.47Å; I64-L312 HydrophobicContact CD1-CG 4.47Å
65	L	87.6	Confident	86.5	Confident	62 Å²	62	26.1 Å²	26.1	33%	0.325	14%	0.143	S	C	.	.	H	α-helix	trans	-67.5	-38.9	170.9	-71.8	173.8	0	0	0	111.9	A62 S63 F67 R68 S69 I178 V182	A62-L65 WeakPolarHBondContact O-CB 3.33Å; A62-L65 PolarHBondContact O-N 3.22Å; S63-L65 VanDerWaalsContact C-N 3.33Å; L65-F67 VanDerWaalsContact C-N 3.31Å; L65-R68 WeakPolarHBondContact O-CB 3.39Å; L65-R68 PolarHBondContact O-N 3.11Å; L65-S69 PolarHBondContact O-N 2.86Å; L65-S69 PolarHBondContact O-OG 3.17Å; L65-I178 HydrophobicContact CD1-CD1 4.07Å; L65-I178 HydrophobicContact CD1-CG1 4.32Å; L65-I178 HydrophobicContact CD1-CG2 3.91Å; L65-I178 HydrophobicContact CD2-CG2 3.62Å; L65-I178 HydrophobicContact CG-CG2 3.66Å; L65-V182 HydrophobicContact CD2-CG2 3.5Å; L65-V182 VanDerWaalsContact CD2-CG2 3.5Å
66	V	85.9	Confident	85.3	Confident	25 Å²	25	27 Å²	27	15%	0.152	15%	0.149	C	C	.	.	H	α-helix	trans	-65.3	-41.4	172.8	-176.8	0	0	0	0	109.8	S63 R68 S69 M70 W89 Y90	S63-V66 PolarHBondContact O-N 3.49Å; V66-R68 VanDerWaalsContact C-N 3.35Å; V66-R68 PolarHBondContact O-N 3.01Å; V66-S69 PolarHBondContact O-N 3.44Å; V66-M70 PolarHBondContact O-N 3.34Å; V66-W89 HydrophobicContact CG1-CB 4.08Å; V66-Y90 HydrophobicContact CB-CD2 4.29Å; V66-Y90 HydrophobicContact CG1-CD2 4.14Å
67	F	84.7	Confident	83.7	Confident	8 Å²	8	37.4 Å²	37.4	4%	0.035	19%	0.188	C	C	.	.	H	α-helix	trans	-60.6	-39.8	175.5	-170.5	-112.8	0	0	0	112.8	S63 I64 L65 S69 M70 I71 I304 I308 F932 F953	S63-F67 PolarHBondContact O-N 3.2Å; I64-F67 WeakPolarHBondContact O-CB 3.31Å; I64-F67 PolarHBondContact O-N 3.37Å; L65-F67 VanDerWaalsContact C-N 3.31Å; F67-S69 PolarHBondContact O-N 3.5Å; F67-M70 HydrophobicContact CD2-CE 3.31Å; F67-M70 HydrophobicContact CE2-CE 3.32Å; F67-M70 HydrophobicContact CG-CE 4.46Å; F67-M70 HydrophobicContact CZ-CE 4.48Å; F67-M70 WeakPolarHBondContact O-CB 3.04Å; F67-M70 PolarHBondContact O-N 2.87Å; F67-I71 HydrophobicContact CD1-CD1 3.51Å; F67-I71 HydrophobicContact CD1-CG1 4.4Å; F67-I71 HydrophobicContact CE1-CD1 3.26Å; F67-I71 HydrophobicContact CE1-CG1 4.12Å; F67-I71 HydrophobicContact CG-CD1 4.27Å; F67-I71 HydrophobicContact CZ-CD1 3.81Å; F67-I71 HydrophobicContact CZ-CG1 4.21Å; F67-I71 WeakPolarHBondContact O-CG1 3.29Å; F67-I71 PolarHBondContact O-N 3.43Å; F67-I304 HydrophobicContact CD1-CG2 4.38Å; F67-I304 HydrophobicContact CE1-CG2 3.96Å; F67-I308 HydrophobicContact CD1-CD1 4.17Å; F67-I308 HydrophobicContact CE1-CD1 3.92Å; F67-F932 AromaticContact CE2-CE2 3.67Å; F67-F932 HydrophobicContact CE2-CE2 3.67Å; F67-F932 AromaticContact CE2-CZ 3.67Å; F67-F932 HydrophobicContact CE2-CZ 3.67Å; F67-F932 HydrophobicContact CZ-CZ 4.24Å; F67-F953 HydrophobicContact CE2-CE1 4.26Å; F67-F953 HydrophobicContact CE2-CZ 4.39Å; F67-F953 HydrophobicContact CZ-CD1 4.47Å; F67-F953 AromaticContact CZ-CE1 3.69Å; F67-F953 HydrophobicContact CZ-CE1 3.69Å; F67-F953 HydrophobicContact CZ-CZ 4.1Å
68	R	87.6	Confident	81.8	Confident	63 Å²	63	42.9 Å²	42.9	24%	0.238	23%	0.226	C	C	.	.	H	α-helix	trans	-54.2	-50.6	172.1	171.7	177.8	175.3	-142.5	-5.1	111.5	I64 L65 V66 M70 I71 N72 D299 S302 A305	I64-R68 PolarHBondContact O-N 2.93Å; L65-R68 WeakPolarHBondContact O-CB 3.39Å; L65-R68 PolarHBondContact O-N 3.11Å; V66-R68 VanDerWaalsContact C-N 3.35Å; V66-R68 PolarHBondContact O-N 3.01Å; R68-M70 VanDerWaalsContact C-N 3.3Å; R68-M70 PolarHBondContact O-N 2.99Å; R68-I71 PolarHBondContact O-N 3.42Å; R68-N72 PolarHBondContact O-N 2.99Å; R68-D299 IonicContact NH2-OD2 3.34Å; R68-S302 VanDerWaalsContact CZ-OG 3.29Å; R68-S302 PolarHBondContact NE-OG 2.65Å; R68-S302 PolarHBondContact NH2-OG 3.11Å; R68-A305 HydrophobicContact CB-CB 3.98Å; R68-A305 HydrophobicContact CG-CB 4.41Å
69	S	85	Confident	79.9	Confident	57 Å²	57	42.1 Å²	42.1	40%	0.399	23%	0.227	S	C	.	.	H	α-helix	trans	-63.1	-38.4	-179.6	-61.1	0	0	0	0	111.7	L65 V66 F67 N72 G73	L65-S69 PolarHBondContact O-N 2.86Å; L65-S69 PolarHBondContact O-OG 3.17Å; V66-S69 PolarHBondContact O-N 3.44Å; F67-S69 PolarHBondContact O-N 3.5Å; S69-N72 PolarHBondContact O-N 3.11Å; S69-G73 PolarHBondContact O-N 2.92Å
70	M	81.7	Confident	78.1	Confident	11 Å²	11	44.4 Å²	44.4	5%	0.054	24%	0.243	C	C	.	.	H	α-helix	trans	-64.6	-44.1	175.6	-173.9	-178	71.3	0	0	112	V66 F67 R68 G73 L74 L87 F932	V66-M70 PolarHBondContact O-N 3.34Å; F67-M70 HydrophobicContact CD2-CE 3.31Å; F67-M70 HydrophobicContact CE2-CE 3.32Å; F67-M70 HydrophobicContact CG-CE 4.46Å; F67-M70 HydrophobicContact CZ-CE 4.48Å; F67-M70 WeakPolarHBondContact O-CB 3.04Å; F67-M70 PolarHBondContact O-N 2.87Å; R68-M70 VanDerWaalsContact C-N 3.3Å; R68-M70 PolarHBondContact O-N 2.99Å; M70-G73 PolarHBondContact O-N 3.36Å; M70-L74 HydrophobicContact CG-CD1 4.31Å; M70-L74 WeakPolarHBondContact O-CG 3.38Å; M70-L74 PolarHBondContact O-N 3.39Å; M70-L87 HydrophobicContact SD-CD2 4.46Å; M70-F932 HydrophobicContact CE-CB 4.31Å; M70-F932 HydrophobicContact CE-CD1 3.35Å; M70-F932 HydrophobicContact CE-CD2 3.51Å; M70-F932 HydrophobicContact CE-CE1 3.37Å; M70-F932 HydrophobicContact CE-CE2 3.52Å; M70-F932 HydrophobicContact CE-CG 3.44Å; M70-F932 VanDerWaalsContact CE-CG 3.44Å; M70-F932 HydrophobicContact CE-CZ 3.47Å; M70-F932 VanDerWaalsContact CE-CZ 3.47Å; M70-F932 HydrophobicContact SD-CB 3.8Å; M70-F932 HydrophobicContact SD-CD1 3.67Å; M70-F932 HydrophobicContact SD-CD2 4.11Å; M70-F932 HydrophobicContact SD-CE1 4.29Å; M70-F932 HydrophobicContact SD-CG 3.58Å; M70-F932 VanDerWaalsContact SD-CG 3.58Å
71	I	82.7	Confident	76.8	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-61	-48.4	175.9	-69.5	161.5	0	0	0	110.7	F67 R68 G73 L74 F75 I304 Y714 F950	F67-I71 HydrophobicContact CD1-CD1 3.51Å; F67-I71 HydrophobicContact CD1-CG1 4.4Å; F67-I71 HydrophobicContact CE1-CD1 3.26Å; F67-I71 HydrophobicContact CE1-CG1 4.12Å; F67-I71 HydrophobicContact CG-CD1 4.27Å; F67-I71 HydrophobicContact CZ-CD1 3.81Å; F67-I71 HydrophobicContact CZ-CG1 4.21Å; F67-I71 WeakPolarHBondContact O-CG1 3.29Å; F67-I71 PolarHBondContact O-N 3.43Å; R68-I71 PolarHBondContact O-N 3.42Å; I71-G73 VanDerWaalsContact C-N 3.3Å; I71-G73 PolarHBondContact O-N 3.17Å; I71-L74 PolarHBondContact O-N 2.99Å; I71-F75 HydrophobicContact CG2-CD2 3.65Å; I71-F75 HydrophobicContact CG2-CE2 3.71Å; I71-F75 VanDerWaalsContact O-CD2 3.32Å; I71-F75 WeakPolarHBondContact O-CD2 3.43Å; I71-F75 PolarHBondContact O-N 3.03Å; I71-I304 HydrophobicContact CD1-CB 4.02Å; I71-I304 HydrophobicContact CD1-CD1 3.64Å; I71-I304 HydrophobicContact CD1-CG1 4.46Å; I71-I304 HydrophobicContact CD1-CG2 3.7Å; I71-I304 HydrophobicContact CG1-CD1 4.46Å; I71-I304 HydrophobicContact CG2-CD1 3.96Å; I71-Y714 HydrophobicContact CD1-CE1 4.28Å; I71-Y714 HydrophobicContact CG1-CE1 4.44Å; I71-F950 HydrophobicContact CG1-CE1 4.35Å; I71-F950 HydrophobicContact CG1-CZ 4.35Å
72	N	82.8	Confident	76	Confident	27 Å²	27	54.7 Å²	54.7	14%	0.144	30%	0.3	C	S	.	.	H	α-helix	trans	-61.1	-40.2	178.8	-73.3	-7.4	0	0	0	111.7	R68 S69 F75 N76 D299 G301	R68-N72 PolarHBondContact O-N 2.99Å; S69-N72 PolarHBondContact O-N 3.11Å; N72-F75 PolarHBondContact O-N 3.48Å; N72-N76 WeakPolarHBondContact O-CB 3.27Å; N72-N76 PolarHBondContact O-N 2.73Å; N72-D299 WeakPolarHBondContact OD1-CB 3.47Å; N72-G301 VanDerWaalsContact OD1-CA 3.24Å; N72-G301 WeakPolarHBondContact OD1-CA 3.25Å; N72-G301 PolarHBondContact OD1-N 3.2Å
73	G	77.7	Confident	75.3	Confident	16 Å²	16	54 Å²	54	17%	0.165	29%	0.292	C	S	.	.	H	α-helix	trans	-63.2	-40.6	175.9	0	0	0	0	0	113.3	S69 M70 I71	S69-G73 PolarHBondContact O-N 2.92Å; M70-G73 PolarHBondContact O-N 3.36Å; I71-G73 VanDerWaalsContact C-N 3.3Å; I71-G73 PolarHBondContact O-N 3.17Å
74	L	76.3	Confident	74.9	Confident	18 Å²	18	58.8 Å²	58.8	9%	0.094	31%	0.31	C	S	.	.	H	α-helix	trans	-67.3	-39.5	176.9	-72.2	166.8	0	0	0	112.3	M70 I71 I83 F932 M946 F950	M70-L74 HydrophobicContact CG-CD1 4.31Å; M70-L74 WeakPolarHBondContact O-CG 3.38Å; M70-L74 PolarHBondContact O-N 3.39Å; I71-L74 PolarHBondContact O-N 2.99Å; L74-I83 HydrophobicContact CD2-CD1 3.95Å; L74-I83 HydrophobicContact CG-CD1 4.5Å; L74-F932 HydrophobicContact CD1-CD1 4.35Å; L74-F932 HydrophobicContact CD1-CE1 4.21Å; L74-M946 HydrophobicContact CB-CE 3.31Å; L74-M946 HydrophobicContact CB-SD 4.15Å; L74-M946 HydrophobicContact CD1-CE 4.33Å; L74-M946 HydrophobicContact CG-CE 4.41Å; L74-F950 HydrophobicContact CD1-CZ 4.07Å
75	F	74.4	Confident	74.7	Confident	29 Å²	29	60.5 Å²	60.5	13%	0.127	33%	0.33	C	S	.	.	H	α-helix	trans	-76.1	-33.2	179.5	-82.4	-71.4	0	0	0	113.6	I71 N72 R77 P300 Y714 F717 D718 M946	I71-F75 HydrophobicContact CG2-CD2 3.65Å; I71-F75 HydrophobicContact CG2-CE2 3.71Å; I71-F75 VanDerWaalsContact O-CD2 3.32Å; I71-F75 WeakPolarHBondContact O-CD2 3.43Å; I71-F75 PolarHBondContact O-N 3.03Å; N72-F75 PolarHBondContact O-N 3.48Å; F75-R77 VanDerWaalsContact C-N 3.29Å; F75-R77 PolarHBondContact O-N 3.19Å; F75-P300 HydrophobicContact CD2-CB 4.36Å; F75-P300 HydrophobicContact CE2-CB 4.42Å; F75-Y714 HydrophobicContact CE2-CD1 4.2Å; F75-Y714 HydrophobicContact CZ-CD1 4.35Å; F75-Y714 WeakPolarHBondContact CZ-O 3.24Å; F75-F717 HydrophobicContact CE1-CB 3.98Å; F75-F717 HydrophobicContact CE2-CB 4.4Å; F75-F717 HydrophobicContact CE2-CD2 4.34Å; F75-F717 HydrophobicContact CZ-CB 3.84Å; F75-F717 HydrophobicContact CZ-CD2 4.24Å; F75-D718 HydrophobicContact CE1-CB 4.48Å; F75-M946 HydrophobicContact CD1-CE 3.86Å; F75-M946 HydrophobicContact CD1-SD 4.25Å; F75-M946 HydrophobicContact CD2-CE 3.46Å; F75-M946 VanDerWaalsContact CD2-CE 3.46Å; F75-M946 HydrophobicContact CE1-CE 3.82Å; F75-M946 HydrophobicContact CE1-SD 4.18Å; F75-M946 HydrophobicContact CE2-CE 3.42Å; F75-M946 VanDerWaalsContact CE2-CE 3.42Å; F75-M946 HydrophobicContact CG-CE 3.67Å; F75-M946 HydrophobicContact CZ-CE 3.6Å; F75-M946 HydrophobicContact CZ-SD 4.42Å
76	N	71	Confident	74.4	Confident	101 Å²	101	59.4 Å²	59.4	54%	0.54	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.2	-1.4	-175.3	-80.5	-1.9	0	0	0	114.8	N72 S78	N72-N76 WeakPolarHBondContact O-CB 3.27Å; N72-N76 PolarHBondContact O-N 2.73Å; N76-S78 PolarHBondContact O-N 3.27Å
77	R	59.9	Low	74.3	Confident	218 Å²	218	58.7 Å²	58.7	82%	0.823	32%	0.32	S	S	*	.			trans	47.6	-21.9	178.4	-78.7	-172.8	-179.2	176.5	2.7	118.7	F75 S79	F75-R77 VanDerWaalsContact C-N 3.29Å; F75-R77 PolarHBondContact O-N 3.19Å; R77-S79 PolarHBondContact O-N 3.23Å
78	S	51.8	Low	74.3	Confident	114 Å²	114	60.2 Å²	60.2	80%	0.797	34%	0.338	S	S	*	.	S	Bend	trans	-88.4	14.9	-172.9	-63.6	0	0	0	0	114.4	N76	N76-S78 PolarHBondContact O-N 3.27Å
79	S	54.8	Low	74.3	Confident	53 Å²	53	64.3 Å²	64.3	37%	0.371	35%	0.353	S	S	.	.			trans	-143.5	46.7	-177.3	-82.8	0	0	0	0	113.8	R77 N81 N82	R77-S79 PolarHBondContact O-N 3.23Å; S79-N81 PolarHBondContact O-N 3.3Å; S79-N82 PolarHBondContact O-N 3.16Å; S79-N82 VanDerWaalsContact O-N 3.14Å
80	S	54.4	Low	74.3	Confident	57 Å²	57	62.6 Å²	62.6	40%	0.399	34%	0.338	S	S	.	.	H	α-helix	trans	-58	-32.2	179.9	76.7	0	0	0	0	113.3	N82	S80-N82 VanDerWaalsContact C-N 3.33Å; S80-N82 PolarHBondContact O-N 2.81Å
81	N	58.7	Low	74.7	Confident	142 Å²	142	67.2 Å²	67.2	76%	0.759	36%	0.358	S	S	*	.	H	α-helix	trans	-71.2	-22.2	180	-75.4	-6.2	0	0	0	114	S79	S79-N81 PolarHBondContact O-N 3.3Å
82	N	74.3	Confident	75.1	Confident	108 Å²	108	71.4 Å²	71.4	58%	0.578	38%	0.38	S	S	*	.	H	α-helix	trans	-83.8	-12.5	-179.1	-78.6	-16.8	0	0	0	113.7	S79 S80 G85 L86	S79-N82 PolarHBondContact O-N 3.16Å; S79-N82 VanDerWaalsContact O-N 3.14Å; S80-N82 VanDerWaalsContact C-N 3.33Å; S80-N82 PolarHBondContact O-N 2.81Å; N82-G85 PolarHBondContact O-N 3.28Å; N82-L86 WeakPolarHBondContact O-CG 3.49Å; N82-L86 PolarHBondContact O-N 3.07Å
83	I	74.9	Confident	75.4	Confident	9 Å²	9	71.7 Å²	71.7	5%	0.046	38%	0.381	C	S	.	.	H	α-helix	trans	-71.5	-40.5	-174.6	-61.5	172.7	0	0	0	111.6	L74 G85 L86 L87 N936	L74-I83 HydrophobicContact CD2-CD1 3.95Å; L74-I83 HydrophobicContact CG-CD1 4.5Å; I83-G85 VanDerWaalsContact C-N 3.28Å; I83-G85 PolarHBondContact O-N 3.38Å; I83-L86 PolarHBondContact O-N 2.78Å; I83-L87 HydrophobicContact CG2-CD1 4.14Å; I83-L87 HydrophobicContact CG2-CG 4.49Å; I83-L87 WeakPolarHBondContact O-CG 3.41Å; I83-L87 PolarHBondContact O-N 3.05Å; I83-N936 VanDerWaalsContact CD1-OD1 3.31Å; I83-N936 WeakPolarHBondContact CD1-OD1 3.44Å; I83-N936 HydrophobicContact CG2-CB 4.24Å
84	Y	79.6	Confident	75.9	Confident	108 Å²	108	71 Å²	71	42%	0.424	37%	0.373	S	S	.	.	H	α-helix	trans	-64.6	-33.5	176.3	-66.9	-70.1	0	0	0	112.3	L87 G88	Y84-L87 HydrophobicContact CD1-CD1 4.09Å; Y84-L87 PolarHBondContact O-N 3.24Å; Y84-G88 PolarHBondContact O-N 2.96Å
85	G	82.4	Confident	76.6	Confident	45 Å²	45	74 Å²	74	46%	0.464	39%	0.389	S	S	.	.	H	α-helix	trans	-63.3	-43.3	171.6	0	0	0	0	0	112.6	N82 I83 G88 W89	N82-G85 PolarHBondContact O-N 3.28Å; I83-G85 VanDerWaalsContact C-N 3.28Å; I83-G85 PolarHBondContact O-N 3.38Å; G85-G88 PolarHBondContact O-N 2.94Å; G85-W89 VanDerWaalsContact O-CD1 3.24Å; G85-W89 PolarHBondContact O-N 3.02Å
86	L	82.1	Confident	77.5	Confident	38 Å²	38	75.7 Å²	75.7	20%	0.199	40%	0.399	C	S	.	.	H	α-helix	trans	-66.2	-36.9	175.8	-69.9	166.2	0	0	0	112.6	N82 I83 G88 W89 Y90	N82-L86 WeakPolarHBondContact O-CG 3.49Å; N82-L86 PolarHBondContact O-N 3.07Å; I83-L86 PolarHBondContact O-N 2.78Å; L86-G88 VanDerWaalsContact C-N 3.32Å; L86-W89 WeakPolarHBondContact O-CB 3.21Å; L86-W89 PolarHBondContact O-N 3.28Å; L86-Y90 PolarHBondContact O-N 2.9Å; L86-Y90 VanDerWaalsContact O-N 3.09Å
87	L	82.8	Confident	78.5	Confident	11 Å²	11	70.9 Å²	70.9	6%	0.058	37%	0.373	C	S	.	.	H	α-helix	trans	-63.2	-38.3	173.1	-74.7	165.4	0	0	0	111.8	M70 I83 Y84 W89 Y90 F91 T929 F932 A933	M70-L87 HydrophobicContact SD-CD2 4.46Å; I83-L87 HydrophobicContact CG2-CD1 4.14Å; I83-L87 HydrophobicContact CG2-CG 4.49Å; I83-L87 WeakPolarHBondContact O-CG 3.41Å; I83-L87 PolarHBondContact O-N 3.05Å; Y84-L87 HydrophobicContact CD1-CD1 4.09Å; Y84-L87 PolarHBondContact O-N 3.24Å; L87-W89 VanDerWaalsContact C-N 3.33Å; L87-W89 PolarHBondContact O-N 3.25Å; L87-Y90 PolarHBondContact O-N 2.78Å; L87-F91 PolarHBondContact O-N 2.76Å; L87-T929 HydrophobicContact CD2-CG2 4.44Å; L87-F932 HydrophobicContact CD2-CB 3.66Å; L87-A933 HydrophobicContact CD1-CB 3.99Å; L87-A933 HydrophobicContact CD2-CB 4.43Å
88	G	86.5	Confident	80.1	Confident	40 Å²	40	64 Å²	64	41%	0.412	35%	0.349	S	S	.	.	H	α-helix	trans	-58.3	-42.6	172.3	0	0	0	0	0	112.6	Y84 G85 L86 Y90 F91 L92	Y84-G88 PolarHBondContact O-N 2.96Å; G85-G88 PolarHBondContact O-N 2.94Å; L86-G88 VanDerWaalsContact C-N 3.32Å; G88-Y90 PolarHBondContact O-N 2.75Å; G88-F91 PolarHBondContact O-N 2.77Å; G88-L92 WeakPolarHBondContact O-CB 3.25Å; G88-L92 PolarHBondContact O-N 3.16Å
89	W	86.7	Confident	82.2	Confident	148 Å²	148	61.5 Å²	61.5	56%	0.561	33%	0.329	S	S	*	.	H	α-helix	trans	-63.7	-39.2	173.9	-76.8	107.8	0	0	0	112.9	V66 G85 L86 L87 L92 M93	V66-W89 HydrophobicContact CG1-CB 4.08Å; G85-W89 VanDerWaalsContact O-CD1 3.24Å; G85-W89 PolarHBondContact O-N 3.02Å; L86-W89 WeakPolarHBondContact O-CB 3.21Å; L86-W89 PolarHBondContact O-N 3.28Å; L87-W89 VanDerWaalsContact C-N 3.33Å; L87-W89 PolarHBondContact O-N 3.25Å; W89-L92 HydrophobicContact CE3-CD2 4.46Å; W89-L92 HydrophobicContact CZ3-CD2 4.47Å; W89-L92 PolarHBondContact O-N 3.11Å; W89-M93 WeakPolarHBondContact O-CG 3Å; W89-M93 PolarHBondContact O-N 3.02Å
90	Y	85.2	Confident	84.1	Confident	22 Å²	22	59.9 Å²	59.9	9%	0.086	32%	0.316	C	S	.	.	H	α-helix	trans	-68.3	-39.4	178.7	-150.1	-100.2	0	0	0	112.1	V66 L86 L87 G88 M93 A94 V925 L928 T929	V66-Y90 HydrophobicContact CB-CD2 4.29Å; V66-Y90 HydrophobicContact CG1-CD2 4.14Å; L86-Y90 PolarHBondContact O-N 2.9Å; L86-Y90 VanDerWaalsContact O-N 3.09Å; L87-Y90 PolarHBondContact O-N 2.78Å; G88-Y90 PolarHBondContact O-N 2.75Å; Y90-M93 WeakPolarHBondContact O-CB 3.31Å; Y90-M93 PolarHBondContact O-N 3.01Å; Y90-A94 PolarHBondContact O-N 2.91Å; Y90-V925 HydrophobicContact CD1-CG1 3.99Å; Y90-V925 HydrophobicContact CE1-CB 4.46Å; Y90-V925 HydrophobicContact CE1-CG1 3.39Å; Y90-L928 HydrophobicContact CD1-CG 4.5Å; Y90-L928 HydrophobicContact CE1-CB 3.94Å; Y90-L928 HydrophobicContact CE1-CD2 3.52Å; Y90-L928 HydrophobicContact CE1-CG 3.67Å; Y90-L928 WeakPolarHBondContact OH-CD2 3.3Å; Y90-T929 WeakPolarHBondContact CD1-OG1 3.43Å
91	F	89.3	Confident	85.9	Confident	107 Å²	107	57.1 Å²	57.1	47%	0.469	30%	0.297	S	S	.	.	H	α-helix	trans	-61.1	-44.1	171.5	-175.1	-109.7	0	0	0	111.9	L87 G88 M93 A94 I95 L926 T929	L87-F91 PolarHBondContact O-N 2.76Å; G88-F91 PolarHBondContact O-N 2.77Å; F91-M93 VanDerWaalsContact C-N 3.31Å; F91-M93 PolarHBondContact O-N 2.93Å; F91-A94 WeakPolarHBondContact O-CB 3.28Å; F91-A94 PolarHBondContact O-N 2.83Å; F91-A94 VanDerWaalsContact O-N 3.12Å; F91-I95 HydrophobicContact CD1-CD1 3.8Å; F91-I95 HydrophobicContact CE1-CD1 3.38Å; F91-I95 HydrophobicContact CE1-CG1 4.33Å; F91-I95 HydrophobicContact CZ-CD1 3.88Å; F91-I95 HydrophobicContact CZ-CG1 4.46Å; F91-I95 PolarHBondContact O-N 3.44Å; F91-L926 HydrophobicContact CD2-CD2 3.82Å; F91-L926 HydrophobicContact CE2-CD2 3.76Å; F91-T929 HydrophobicContact CB-CG2 4.01Å
92	L	91.2	Very high	87.6	Confident	88 Å²	88	52.3 Å²	52.3	46%	0.461	27%	0.271	S	S	.	.	H	α-helix	trans	-62.8	-37.5	176.7	-171.3	143.2	0	0	0	111.9	G88 W89 I95 L96	G88-L92 WeakPolarHBondContact O-CB 3.25Å; G88-L92 PolarHBondContact O-N 3.16Å; W89-L92 HydrophobicContact CE3-CD2 4.46Å; W89-L92 HydrophobicContact CZ3-CD2 4.47Å; W89-L92 PolarHBondContact O-N 3.11Å; L92-I95 PolarHBondContact O-N 2.83Å; L92-L96 WeakPolarHBondContact O-CB 3.39Å; L92-L96 PolarHBondContact O-N 3.21Å
93	M	88.8	Confident	88.5	Confident	34 Å²	34	54.3 Å²	54.3	17%	0.167	27%	0.27	C	S	.	.	H	α-helix	trans	-64.3	-38.3	172.6	-73.1	-67.2	165.8	0	0	112.3	W89 Y90 F91 L96 I97	W89-M93 WeakPolarHBondContact O-CG 3Å; W89-M93 PolarHBondContact O-N 3.02Å; Y90-M93 WeakPolarHBondContact O-CB 3.31Å; Y90-M93 PolarHBondContact O-N 3.01Å; F91-M93 VanDerWaalsContact C-N 3.31Å; F91-M93 PolarHBondContact O-N 2.93Å; M93-L96 PolarHBondContact O-N 2.79Å; M93-L96 HydrophobicContact SD-CD2 3.99Å; M93-I97 WeakPolarHBondContact O-CB 2.87Å; M93-I97 VanDerWaalsContact O-CG1 3.27Å; M93-I97 WeakPolarHBondContact O-CG1 3.15Å; M93-I97 PolarHBondContact O-N 3.17Å
94	A	88.5	Confident	89.4	Confident	1 Å²	1	54 Å²	54	1%	0.008	27%	0.268	C	S	.	.	H	α-helix	trans	-64.5	-40.6	176	0	0	0	0	0	112.2	Y90 F91 F98 V925 L926	Y90-A94 PolarHBondContact O-N 2.91Å; F91-A94 WeakPolarHBondContact O-CB 3.28Å; F91-A94 PolarHBondContact O-N 2.83Å; F91-A94 VanDerWaalsContact O-N 3.12Å; A94-F98 WeakPolarHBondContact O-CB 3.07Å; A94-F98 PolarHBondContact O-N 2.9Å; A94-V925 HydrophobicContact CB-CB 4.01Å; A94-V925 HydrophobicContact CB-CG1 3.72Å; A94-L926 HydrophobicContact CB-CD2 3.57Å; A94-L926 HydrophobicContact CB-CG 3.83Å
95	I	92.4	Very high	90	Very high	81 Å²	81	49.1 Å²	49.1	42%	0.415	25%	0.25	S	C	.	.	H	α-helix	trans	-63.9	-44.9	172.5	-66.5	170.3	0	0	0	110.5	F91 L92 I97 F98 V99	F91-I95 HydrophobicContact CD1-CD1 3.8Å; F91-I95 HydrophobicContact CE1-CD1 3.38Å; F91-I95 HydrophobicContact CE1-CG1 4.33Å; F91-I95 HydrophobicContact CZ-CD1 3.88Å; F91-I95 HydrophobicContact CZ-CG1 4.46Å; F91-I95 PolarHBondContact O-N 3.44Å; L92-I95 PolarHBondContact O-N 2.83Å; I95-I97 PolarHBondContact O-N 3.44Å; I95-F98 WeakPolarHBondContact O-CB 3.48Å; I95-F98 PolarHBondContact O-N 3.11Å; I95-V99 HydrophobicContact CG2-CG2 4.26Å; I95-V99 WeakPolarHBondContact O-CG2 3.46Å; I95-V99 PolarHBondContact O-N 2.94Å
96	L	93.3	Very high	90.5	Very high	65 Å²	65	48.3 Å²	48.3	34%	0.34	24%	0.236	S	C	.	.	H	α-helix	trans	-59.6	-46.4	178.1	179.9	66.8	0	0	0	111.2	L92 M93 F98 V99 L100	L92-L96 WeakPolarHBondContact O-CB 3.39Å; L92-L96 PolarHBondContact O-N 3.21Å; M93-L96 PolarHBondContact O-N 2.79Å; M93-L96 HydrophobicContact SD-CD2 3.99Å; L96-F98 VanDerWaalsContact C-N 3.32Å; L96-F98 PolarHBondContact O-N 2.65Å; L96-V99 PolarHBondContact O-N 2.98Å; L96-L100 HydrophobicContact CD1-CD1 3.93Å; L96-L100 HydrophobicContact CD1-CG 4.01Å; L96-L100 HydrophobicContact CD2-CD1 4.42Å; L96-L100 HydrophobicContact CG-CD1 3.79Å; L96-L100 HydrophobicContact CG-CG 4.26Å; L96-L100 WeakPolarHBondContact O-CB 3.3Å; L96-L100 VanDerWaalsContact O-CG 3.25Å; L96-L100 WeakPolarHBondContact O-CG 3.15Å; L96-L100 PolarHBondContact O-N 3.2Å
97	I	92.2	Very high	91	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-58.6	-43.8	175.2	-73.4	167.8	0	0	0	110.8	L56 F60 M93 I95 C101 L921 V925	L56-I97 HydrophobicContact CD1-CB 4.22Å; L56-I97 HydrophobicContact CD1-CG1 4.24Å; L56-I97 HydrophobicContact CD1-CG2 3.85Å; F60-I97 HydrophobicContact CE1-CD1 4.27Å; F60-I97 HydrophobicContact CZ-CG2 4.42Å; M93-I97 WeakPolarHBondContact O-CB 2.87Å; M93-I97 VanDerWaalsContact O-CG1 3.27Å; M93-I97 WeakPolarHBondContact O-CG1 3.15Å; M93-I97 PolarHBondContact O-N 3.17Å; I95-I97 PolarHBondContact O-N 3.44Å; I97-C101 WeakPolarHBondContact O-CB 3.37Å; I97-C101 PolarHBondContact O-N 3.43Å; I97-L921 HydrophobicContact CG2-CD2 4.26Å; I97-L921 HydrophobicContact CG2-CG 4.11Å; I97-V925 HydrophobicContact CD1-CG2 4.07Å
98	F	93.5	Very high	91.5	Very high	73 Å²	73	46.3 Å²	46.3	32%	0.32	23%	0.226	S	C	.	.	H	α-helix	trans	-61.1	-49.7	177.1	-179.2	-89.8	0	0	0	111.7	A94 I95 L96 C101 M102 S918 I919	A94-F98 WeakPolarHBondContact O-CB 3.07Å; A94-F98 PolarHBondContact O-N 2.9Å; I95-F98 WeakPolarHBondContact O-CB 3.48Å; I95-F98 PolarHBondContact O-N 3.11Å; L96-F98 VanDerWaalsContact C-N 3.32Å; L96-F98 PolarHBondContact O-N 2.65Å; F98-C101 PolarHBondContact O-N 2.84Å; F98-M102 WeakPolarHBondContact O-CB 3.28Å; F98-M102 PolarHBondContact O-N 2.9Å; F98-S918 VanDerWaalsContact CD2-CB 3.45Å; F98-S918 PolarHBondContact O-OG 3.07Å; F98-I919 HydrophobicContact CE2-CG1 3.91Å
99	V	94.9	Very high	91.7	Very high	62 Å²	62	45.7 Å²	45.7	38%	0.376	21%	0.212	S	C	.	.	H	α-helix	trans	-64.4	-49.8	-179.1	174	0	0	0	0	110.5	I95 L96 C101 M102 W103	I95-V99 HydrophobicContact CG2-CG2 4.26Å; I95-V99 WeakPolarHBondContact O-CG2 3.46Å; I95-V99 PolarHBondContact O-N 2.94Å; L96-V99 PolarHBondContact O-N 2.98Å; V99-C101 VanDerWaalsContact C-N 3.3Å; V99-C101 PolarHBondContact O-N 2.87Å; V99-M102 PolarHBondContact O-N 3.37Å; V99-W103 VanDerWaalsContact O-CD1 3.22Å; V99-W103 PolarHBondContact O-N 3.36Å
100	L	95.3	Very high	91.9	Very high	18 Å²	18	40.5 Å²	40.5	9%	0.094	19%	0.193	C	C	.	.	H	α-helix	trans	-60.1	-40.4	179.1	-70.4	175.5	0	0	0	112	C52 L55 L56 L96 K104	C52-L100 HydrophobicContact CB-CD2 4.4Å; L55-L100 HydrophobicContact CB-CD1 3.79Å; L55-L100 HydrophobicContact CB-CD2 4.08Å; L55-L100 HydrophobicContact CD1-CD2 4.09Å; L56-L100 HydrophobicContact CB-CB 4.27Å; L56-L100 HydrophobicContact CD1-CB 4.37Å; L96-L100 HydrophobicContact CD1-CD1 3.93Å; L96-L100 HydrophobicContact CD1-CG 4.01Å; L96-L100 HydrophobicContact CD2-CD1 4.42Å; L96-L100 HydrophobicContact CG-CD1 3.79Å; L96-L100 HydrophobicContact CG-CG 4.26Å; L96-L100 WeakPolarHBondContact O-CB 3.3Å; L96-L100 VanDerWaalsContact O-CG 3.25Å; L96-L100 WeakPolarHBondContact O-CG 3.15Å; L96-L100 PolarHBondContact O-N 3.2Å; L100-K104 WeakPolarHBondContact O-CB 3.45Å; L100-K104 PolarHBondContact O-N 3.29Å
101	C	92.4	Very high	92.2	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-66.5	-42.3	176.4	-170.4	0	0	0	0	111.7	L56 I97 F98 V99 K104 C105 L921	L56-C101 HydrophobicContact CD2-CB 4.02Å; I97-C101 WeakPolarHBondContact O-CB 3.37Å; I97-C101 PolarHBondContact O-N 3.43Å; F98-C101 PolarHBondContact O-N 2.84Å; V99-C101 VanDerWaalsContact C-N 3.3Å; V99-C101 PolarHBondContact O-N 2.87Å; C101-K104 PolarHBondContact O-N 3.32Å; C101-C105 WeakPolarHBondContact O-CB 3.48Å; C101-C105 PolarHBondContact O-N 3.07Å; C101-C105 PolarHBondContact O-SG 2.64Å; C101-L921 HydrophobicContact CB-CD2 4.32Å
102	M	93.2	Very high	92.4	Very high	41 Å²	41	34.4 Å²	34.4	20%	0.202	17%	0.167	C	C	.	.	H	α-helix	trans	-61	-50.4	179	-175.1	64.3	177.1	0	0	110.9	F98 V99 C105 V106 I911 L915 S918	F98-M102 WeakPolarHBondContact O-CB 3.28Å; F98-M102 PolarHBondContact O-N 2.9Å; V99-M102 PolarHBondContact O-N 3.37Å; M102-C105 PolarHBondContact O-N 3.2Å; M102-V106 HydrophobicContact CE-CG2 4.03Å; M102-V106 WeakPolarHBondContact O-CB 3.33Å; M102-V106 VanDerWaalsContact O-CG2 3.26Å; M102-V106 WeakPolarHBondContact O-CG2 3.29Å; M102-V106 PolarHBondContact O-N 3.48Å; M102-V106 HydrophobicContact SD-CG2 4.25Å; M102-I911 HydrophobicContact CE-CG2 3.99Å; M102-L915 HydrophobicContact CE-CB 4.31Å; M102-L915 HydrophobicContact SD-CB 4.26Å; M102-L915 PolarHBondContact SD-N 2.94Å; M102-S918 WeakPolarHBondContact CA-OG 3.37Å; M102-S918 WeakPolarHBondContact CB-OG 3.02Å; M102-S918 PolarHBondContact N-OG 3.24Å
103	W	93.8	Very high	92.2	Very high	150 Å²	150	31 Å²	31	57%	0.568	15%	0.149	S	C	*	.	H	α-helix	trans	-66.5	-42.1	179	-78.5	94.6	0	0	0	112.3	V99 C105 C107	V99-W103 VanDerWaalsContact O-CD1 3.22Å; V99-W103 PolarHBondContact O-N 3.36Å; W103-C105 PolarHBondContact O-N 3.08Å; W103-C107 WeakPolarHBondContact O-CB 3.46Å; W103-C107 PolarHBondContact O-N 2.98Å; W103-C107 PolarHBondContact O-SG 3.44Å
104	K	94.2	Very high	92.3	Very high	3 Å²	3	33 Å²	33	1%	0.013	15%	0.154	C	C	.	.	H	α-helix	trans	-51.8	-58.6	172.1	173.2	-157	141.4	177.3	0	110.3	C52 A53 L56 L100 C101 V108 S163 D164	C52-K104 HydrophobicContact CB-CB 3.98Å; A53-K104 HydrophobicContact CB-CD 4.05Å; A53-K104 HydrophobicContact CB-CG 4.08Å; L56-K104 HydrophobicContact CD2-CD 4.17Å; L100-K104 WeakPolarHBondContact O-CB 3.45Å; L100-K104 PolarHBondContact O-N 3.29Å; C101-K104 PolarHBondContact O-N 3.32Å; K104-V108 VanDerWaalsContact O-CB 3.28Å; K104-V108 WeakPolarHBondContact O-CB 3.48Å; K104-V108 WeakPolarHBondContact O-CG2 3.45Å; K104-V108 PolarHBondContact O-N 2.95Å; K104-S163 VanDerWaalsContact CE-OG 3.28Å; K104-S163 WeakPolarHBondContact CE-OG 3.45Å; K104-D164 IonicContact NZ-OD1 2.81Å; K104-D164 PolarHBondContact NZ-OD1 3.48Å
105	C	91	Very high	92.5	Very high	4 Å²	4	32.9 Å²	32.9	3%	0.027	15%	0.154	C	C	.	.	H	α-helix	trans	-65	-45.6	-172.9	-65.9	0	0	0	0	111.6	C101 M102 W103 E109 G914 Q917	C101-C105 WeakPolarHBondContact O-CB 3.48Å; C101-C105 PolarHBondContact O-N 3.07Å; C101-C105 PolarHBondContact O-SG 2.64Å; M102-C105 PolarHBondContact O-N 3.2Å; W103-C105 PolarHBondContact O-N 3.08Å; C105-E109 WeakPolarHBondContact O-CB 3.29Å; C105-E109 WeakPolarHBondContact O-CG 3.44Å; C105-E109 PolarHBondContact O-N 2.87Å; C105-G914 VanDerWaalsContact CB-CA 3.43Å; C105-Q917 PolarHBondContact SG-OE1 3.49Å
106	V	92.3	Very high	92.4	Very high	28 Å²	28	29.5 Å²	29.5	17%	0.17	14%	0.137	C	C	.	.	H	α-helix	trans	-62.8	-48.6	179.9	173.1	0	0	0	0	111.1	M102 F110 I911	M102-V106 HydrophobicContact CE-CG2 4.03Å; M102-V106 WeakPolarHBondContact O-CB 3.33Å; M102-V106 VanDerWaalsContact O-CG2 3.26Å; M102-V106 WeakPolarHBondContact O-CG2 3.29Å; M102-V106 PolarHBondContact O-N 3.48Å; M102-V106 HydrophobicContact SD-CG2 4.25Å; V106-F110 WeakPolarHBondContact O-CB 3.5Å; V106-F110 PolarHBondContact O-N 3.28Å; V106-F110 VanDerWaalsContact O-N 3.1Å; V106-I911 HydrophobicContact CG2-CG1 4.26Å
107	C	94	Very high	92.1	Very high	6 Å²	6	27.4 Å²	27.4	4%	0.041	13%	0.125	C	C	.	.	H	α-helix	trans	-65.7	-45.9	-178	-69.8	0	0	0	0	112.2	L45 W103 A111	L45-C107 HydrophobicContact CB-CB 4.48Å; L45-C107 WeakPolarHBondContact O-CB 3.22Å; W103-C107 WeakPolarHBondContact O-CB 3.46Å; W103-C107 PolarHBondContact O-N 2.98Å; W103-C107 PolarHBondContact O-SG 3.44Å; C107-A111 WeakPolarHBondContact O-CB 3.45Å; C107-A111 PolarHBondContact O-N 3.31Å; C107-A111 VanDerWaalsContact O-N 3.09Å
108	V	93.5	Very high	92.1	Very high	2 Å²	2	30.9 Å²	30.9	1%	0.012	14%	0.142	C	C	.	.	H	α-helix	trans	-69.4	-50.1	-176.6	174.9	0	0	0	0	111.2	K104 A111 S112 G159	K104-V108 VanDerWaalsContact O-CB 3.28Å; K104-V108 WeakPolarHBondContact O-CB 3.48Å; K104-V108 WeakPolarHBondContact O-CG2 3.45Å; K104-V108 PolarHBondContact O-N 2.95Å; V108-A111 PolarHBondContact O-N 2.86Å; V108-S112 WeakPolarHBondContact O-CB 3.06Å; V108-S112 PolarHBondContact O-N 3.35Å; V108-S112 PolarHBondContact O-OG 3.48Å; V108-G159 WeakPolarHBondContact CG1-O 3.38Å
109	E	89.3	Confident	92	Very high	26 Å²	26	27.4 Å²	27.4	12%	0.121	13%	0.126	C	C	.	.	H	α-helix	trans	-65.1	-42.9	-178.1	-69.3	-76.9	-166.1	0	0	112.1	C105 S112 K113 T160 A910 I913	C105-E109 WeakPolarHBondContact O-CB 3.29Å; C105-E109 WeakPolarHBondContact O-CG 3.44Å; C105-E109 PolarHBondContact O-N 2.87Å; E109-S112 PolarHBondContact O-OG 3.28Å; E109-S112 VanDerWaalsContact O-OG 3.12Å; E109-K113 WeakPolarHBondContact O-CG 3.21Å; E109-K113 PolarHBondContact O-N 3.19Å; E109-T160 VanDerWaalsContact CD-CG2 3.41Å; E109-T160 HydrophobicContact CG-CG2 4.17Å; E109-T160 WeakPolarHBondContact OE1-CG2 2.87Å; E109-A910 HydrophobicContact CB-CB 3.93Å; E109-I913 HydrophobicContact CG-CG2 4.31Å
110	F	91.4	Very high	91.8	Very high	39 Å²	39	26.1 Å²	26.1	17%	0.171	12%	0.116	C	C	.	.	H	α-helix	trans	-66.4	-45.1	178.9	179.8	-106.4	0	0	0	111.4	L45 V106 R114 H906 L907 A910	L45-F110 HydrophobicContact CD1-CD1 4.05Å; L45-F110 HydrophobicContact CD1-CE1 4.35Å; V106-F110 WeakPolarHBondContact O-CB 3.5Å; V106-F110 PolarHBondContact O-N 3.28Å; V106-F110 VanDerWaalsContact O-N 3.1Å; F110-R114 HydrophobicContact CD2-CG 4.5Å; F110-R114 HydrophobicContact CE1-CG 4.21Å; F110-R114 HydrophobicContact CE2-CG 4.16Å; F110-R114 HydrophobicContact CZ-CG 4.01Å; F110-R114 WeakPolarHBondContact O-CB 3.42Å; F110-R114 VanDerWaalsContact O-CG 3.22Å; F110-R114 WeakPolarHBondContact O-CG 3.39Å; F110-R114 PolarHBondContact O-N 3.14Å; F110-R114 VanDerWaalsContact O-N 3.17Å; F110-H906 HydrophobicContact CD2-CB 4.49Å; F110-L907 HydrophobicContact CD2-CB 3.94Å; F110-L907 HydrophobicContact CD2-CD1 3.96Å; F110-L907 HydrophobicContact CE2-CB 3.86Å; F110-L907 HydrophobicContact CE2-CD1 4.26Å; F110-L907 HydrophobicContact CG-CD1 4.28Å; F110-A910 HydrophobicContact CB-CB 4.15Å
111	A	92.7	Very high	91.6	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-70.8	-38.8	-178.3	0	0	0	0	0	112.7	H42 L45 I46 C107 V108 R114 I115	H42-A111 HydrophobicContact CB-CB 4.45Å; L45-A111 HydrophobicContact CB-CB 3.99Å; I46-A111 HydrophobicContact CD1-CB 3.88Å; I46-A111 HydrophobicContact CG1-CB 3.62Å; C107-A111 WeakPolarHBondContact O-CB 3.45Å; C107-A111 PolarHBondContact O-N 3.31Å; C107-A111 VanDerWaalsContact O-N 3.09Å; V108-A111 PolarHBondContact O-N 2.86Å; A111-R114 PolarHBondContact O-N 2.65Å; A111-I115 VanDerWaalsContact O-CG1 3.25Å; A111-I115 WeakPolarHBondContact O-CG1 3.4Å; A111-I115 PolarHBondContact O-N 2.87Å
112	S	91.7	Very high	91.6	Very high	1 Å²	1	29 Å²	29	1%	0.007	13%	0.131	C	C	.	.	H	α-helix	trans	-61.8	-48.9	177.3	59.1	0	0	0	0	111.4	V108 E109 R114 I115 V116	V108-S112 WeakPolarHBondContact O-CB 3.06Å; V108-S112 PolarHBondContact O-N 3.35Å; V108-S112 PolarHBondContact O-OG 3.48Å; E109-S112 PolarHBondContact O-OG 3.28Å; E109-S112 VanDerWaalsContact O-OG 3.12Å; S112-R114 VanDerWaalsContact C-N 3.34Å; S112-R114 PolarHBondContact O-N 2.99Å; S112-I115 PolarHBondContact O-N 2.88Å; S112-V116 WeakPolarHBondContact O-CG2 3.17Å; S112-V116 PolarHBondContact O-N 3.46Å
113	K	88.8	Confident	91.6	Very high	16 Å²	16	27.1 Å²	27.1	7%	0.07	12%	0.122	C	C	.	.	H	α-helix	trans	-59.7	-42.4	177.3	-70.6	-170	-175.3	-165.4	0	112.1	E109 V116 Q117 E155 E861 H906 E909	E109-K113 WeakPolarHBondContact O-CG 3.21Å; E109-K113 PolarHBondContact O-N 3.19Å; K113-V116 PolarHBondContact O-N 3.48Å; K113-Q117 VanDerWaalsContact O-CB 3.3Å; K113-Q117 WeakPolarHBondContact O-CB 3.49Å; K113-Q117 PolarHBondContact O-N 2.91Å; K113-E155 WeakPolarHBondContact CG-OE1 3.33Å; K113-E861 IonicContact NZ-OE1 3.97Å; K113-E861 PolarHBondContact NZ-OE1 3.38Å; K113-H906 HydrophobicContact CD-CB 4.18Å; K113-H906 WeakPolarHBondContact CD-ND1 3.15Å; K113-E909 IonicContact NZ-OE2 2.77Å; K113-E909 PolarHBondContact NZ-OE2 3.37Å
114	R	89.7	Confident	91.6	Very high	76 Å²	76	20 Å²	20	29%	0.287	10%	0.095	S	C	.	.	H	α-helix	trans	-65.4	-40.4	178.2	-74	-73.1	179.9	166.7	-7.5	113.1	F110 A111 S112 Q118 S903	F110-R114 HydrophobicContact CD2-CG 4.5Å; F110-R114 HydrophobicContact CE1-CG 4.21Å; F110-R114 HydrophobicContact CE2-CG 4.16Å; F110-R114 HydrophobicContact CZ-CG 4.01Å; F110-R114 WeakPolarHBondContact O-CB 3.42Å; F110-R114 VanDerWaalsContact O-CG 3.22Å; F110-R114 WeakPolarHBondContact O-CG 3.39Å; F110-R114 PolarHBondContact O-N 3.14Å; F110-R114 VanDerWaalsContact O-N 3.17Å; A111-R114 PolarHBondContact O-N 2.65Å; S112-R114 VanDerWaalsContact C-N 3.34Å; S112-R114 PolarHBondContact O-N 2.99Å; R114-Q118 PolarHBondContact O-N 3.38Å; R114-Q118 VanDerWaalsContact O-N 3.12Å; R114-S903 PolarHBondContact NE-OG 3.11Å; R114-S903 PolarHBondContact NH1-OG 3.13Å; R114-S903 PolarHBondContact NH2-O 2.81Å; R114-S903 PolarHBondContact NH2-OG 2.93Å; R114-S903 VanDerWaalsContact NH2-OG 3.1Å
115	I	92.1	Very high	91.5	Very high	0 Å²	0	23 Å²	23	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-66	-46.3	176.6	-70.2	167.1	0	0	0	110.4	F35 A38 H42 I46 A111 S112 Q117 Q118 I119 I158	F35-I115 HydrophobicContact CD1-CD1 4.39Å; A38-I115 HydrophobicContact CB-CD1 3.47Å; A38-I115 VanDerWaalsContact CB-CD1 3.47Å; A38-I115 HydrophobicContact CB-CG1 3.57Å; A38-I115 HydrophobicContact CB-CG2 4.34Å; H42-I115 HydrophobicContact CB-CD1 4.11Å; H42-I115 HydrophobicContact CB-CG1 3.99Å; I46-I115 HydrophobicContact CD1-CD1 3.22Å; A111-I115 VanDerWaalsContact O-CG1 3.25Å; A111-I115 WeakPolarHBondContact O-CG1 3.4Å; A111-I115 PolarHBondContact O-N 2.87Å; S112-I115 PolarHBondContact O-N 2.88Å; I115-Q117 PolarHBondContact O-N 3.29Å; I115-Q118 WeakPolarHBondContact O-CB 3.34Å; I115-Q118 PolarHBondContact O-N 3.02Å; I115-Q118 VanDerWaalsContact O-N 3.15Å; I115-I119 HydrophobicContact CG2-CD1 3.84Å; I115-I119 HydrophobicContact CG2-CG1 4.42Å; I115-I119 WeakPolarHBondContact O-CG1 3.41Å; I115-I119 PolarHBondContact O-N 3.22Å; I115-I158 HydrophobicContact CB-CD1 4.17Å; I115-I158 HydrophobicContact CG2-CD1 3.83Å
116	V	90.3	Very high	91.5	Very high	10 Å²	10	23.6 Å²	23.6	6%	0.061	11%	0.114	C	C	.	.	H	α-helix	trans	-64.6	-41.3	-180	171.4	0	0	0	0	111.4	S112 K113 Q118 I119 Q120 L151 I154 E155 I158	S112-V116 WeakPolarHBondContact O-CG2 3.17Å; S112-V116 PolarHBondContact O-N 3.46Å; K113-V116 PolarHBondContact O-N 3.48Å; V116-Q118 VanDerWaalsContact C-N 3.28Å; V116-Q118 PolarHBondContact O-N 3.24Å; V116-I119 PolarHBondContact O-N 3.22Å; V116-Q120 WeakPolarHBondContact O-CB 3.44Å; V116-Q120 PolarHBondContact O-N 3.47Å; V116-L151 HydrophobicContact CG1-CB 3.97Å; V116-L151 HydrophobicContact CG1-CD2 4.13Å; V116-L151 HydrophobicContact CG1-CG 4.5Å; V116-I154 HydrophobicContact CG2-CG2 4.25Å; V116-E155 HydrophobicContact CG2-CB 3.76Å; V116-E155 HydrophobicContact CG2-CG 4.17Å; V116-I158 HydrophobicContact CG2-CD1 4.27Å
117	Q	88.4	Confident	91.5	Very high	20 Å²	20	22.2 Å²	22.2	9%	0.093	11%	0.106	C	C	.	.	H	α-helix	trans	-57.9	-41.2	172.6	-176.1	-177.3	10.4	0	0	112	K113 I115 Q120 L121 C899 S903	K113-Q117 VanDerWaalsContact O-CB 3.3Å; K113-Q117 WeakPolarHBondContact O-CB 3.49Å; K113-Q117 PolarHBondContact O-N 2.91Å; I115-Q117 PolarHBondContact O-N 3.29Å; Q117-Q120 WeakPolarHBondContact O-CB 3.29Å; Q117-Q120 PolarHBondContact O-N 3.27Å; Q117-L121 WeakPolarHBondContact O-CG 3.32Å; Q117-L121 PolarHBondContact O-N 3.26Å; Q117-C899 HydrophobicContact CG-CB 4.33Å; Q117-C899 PolarHBondContact NE2-O 3.04Å; Q117-S903 PolarHBondContact OE1-OG 3.23Å
118	Q	90.7	Very high	91.3	Very high	73 Å²	73	22.3 Å²	22.3	34%	0.341	11%	0.106	S	C	.	.	H	α-helix	trans	-66.8	-43.2	177	-173.4	172.6	-1.2	0	0	111.7	Y37 R114 I115 V116 Q120 L121 L122	Y37-Q118 PolarHBondContact O-NE2 2.75Å; Y37-Q118 VanDerWaalsContact O-NE2 3.09Å; Y37-Q118 PolarHBondContact O-OE1 3.06Å; R114-Q118 PolarHBondContact O-N 3.38Å; R114-Q118 VanDerWaalsContact O-N 3.12Å; I115-Q118 WeakPolarHBondContact O-CB 3.34Å; I115-Q118 PolarHBondContact O-N 3.02Å; I115-Q118 VanDerWaalsContact O-N 3.15Å; V116-Q118 VanDerWaalsContact C-N 3.28Å; V116-Q118 PolarHBondContact O-N 3.24Å; Q118-Q120 VanDerWaalsContact C-N 3.29Å; Q118-Q120 PolarHBondContact O-N 2.72Å; Q118-L121 PolarHBondContact O-N 3.43Å; Q118-L122 HydrophobicContact CG-CD1 4.24Å; Q118-L122 VanDerWaalsContact O-CG 3.32Å; Q118-L122 WeakPolarHBondContact O-CG 3.43Å; Q118-L122 PolarHBondContact O-N 3.25Å
119	I	92	Very high	91	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-61.2	-40.5	173.6	-63.5	168.4	0	0	0	110.3	Y37 I115 V116 L122 Y123 L151 I154 I337 F338 I341	Y37-I119 HydrophobicContact CD2-CG1 4.05Å; I115-I119 HydrophobicContact CG2-CD1 3.84Å; I115-I119 HydrophobicContact CG2-CG1 4.42Å; I115-I119 WeakPolarHBondContact O-CG1 3.41Å; I115-I119 PolarHBondContact O-N 3.22Å; V116-I119 PolarHBondContact O-N 3.22Å; I119-L122 PolarHBondContact O-N 2.82Å; I119-Y123 WeakPolarHBondContact O-CB 3.22Å; I119-Y123 PolarHBondContact O-N 2.96Å; I119-L151 HydrophobicContact CB-CD2 4.15Å; I119-L151 HydrophobicContact CG2-CD2 3.67Å; I119-I154 HydrophobicContact CD1-CG2 4.32Å; I119-I337 HydrophobicContact CG2-CG2 3.86Å; I119-F338 HydrophobicContact CD1-CE1 4.16Å; I119-F338 HydrophobicContact CD1-CZ 4.31Å; I119-F338 HydrophobicContact CG1-CE1 4.47Å; I119-F338 HydrophobicContact CG2-CE1 4.11Å; I119-I341 HydrophobicContact CG2-CD1 4.18Å
120	Q	91	Very high	90.9	Very high	35 Å²	35	23.1 Å²	23.1	16%	0.164	11%	0.11	C	C	.	.	H	α-helix	trans	-61.8	-45.2	178.6	-167.6	179	33.5	0	0	111.9	V116 Q117 Q118 Y124 L147 L151 F895	V116-Q120 WeakPolarHBondContact O-CB 3.44Å; V116-Q120 PolarHBondContact O-N 3.47Å; Q117-Q120 WeakPolarHBondContact O-CB 3.29Å; Q117-Q120 PolarHBondContact O-N 3.27Å; Q118-Q120 VanDerWaalsContact C-N 3.29Å; Q118-Q120 PolarHBondContact O-N 2.72Å; Q120-Y124 VanDerWaalsContact O-CB 3.31Å; Q120-Y124 WeakPolarHBondContact O-CB 3.31Å; Q120-Y124 PolarHBondContact O-N 3.32Å; Q120-L147 HydrophobicContact CG-CD2 3.85Å; Q120-L147 PolarHBondContact NE2-O 2.89Å; Q120-L151 HydrophobicContact CB-CD1 3.67Å; Q120-L151 HydrophobicContact CG-CD1 3.59Å; Q120-F895 HydrophobicContact CG-CE1 4.04Å; Q120-F895 HydrophobicContact CG-CZ 3.84Å
121	L	91.9	Very high	90.6	Very high	27 Å²	27	22.7 Å²	22.7	14%	0.141	11%	0.109	C	C	.	.	H	α-helix	trans	-64.8	-44	176.4	-70.3	173	0	0	0	111.8	Q117 Q118 Q125 F895 K896 C899	Q117-L121 WeakPolarHBondContact O-CG 3.32Å; Q117-L121 PolarHBondContact O-N 3.26Å; Q118-L121 PolarHBondContact O-N 3.43Å; L121-Q125 VanDerWaalsContact O-CB 3.28Å; L121-Q125 WeakPolarHBondContact O-CB 3.45Å; L121-Q125 PolarHBondContact O-N 3.27Å; L121-F895 HydrophobicContact CD2-CD1 3.92Å; L121-F895 HydrophobicContact CD2-CE1 4.13Å; L121-K896 HydrophobicContact CD2-CB 4.06Å; L121-K896 HydrophobicContact CD2-CG 4.24Å; L121-C899 HydrophobicContact CD2-CB 4.09Å
122	L	92.3	Very high	90.3	Very high	52 Å²	52	22.7 Å²	22.7	27%	0.272	11%	0.109	S	C	.	.	H	α-helix	trans	-66.5	-42	178.3	-70.8	172.1	0	0	0	112.1	Y37 Q118 I119 Q125 A126 I341	Y37-L122 HydrophobicContact CD1-CD1 3.52Å; Y37-L122 HydrophobicContact CE1-CD1 4.14Å; Y37-L122 HydrophobicContact CG-CD1 3.79Å; Q118-L122 HydrophobicContact CG-CD1 4.24Å; Q118-L122 VanDerWaalsContact O-CG 3.32Å; Q118-L122 WeakPolarHBondContact O-CG 3.43Å; Q118-L122 PolarHBondContact O-N 3.25Å; I119-L122 PolarHBondContact O-N 2.82Å; L122-Q125 PolarHBondContact O-N 3.21Å; L122-A126 VanDerWaalsContact O-CB 3.28Å; L122-A126 WeakPolarHBondContact O-CB 3.28Å; L122-A126 PolarHBondContact O-N 2.93Å; L122-I341 HydrophobicContact CB-CD1 4.3Å; L122-I341 HydrophobicContact CB-CG2 4.44Å
123	Y	93.1	Very high	89.9	Confident	1 Å²	1	24.5 Å²	24.5	0%	0.004	12%	0.119	C	C	.	.	H	α-helix	trans	-63.6	-48.9	176.2	-179.5	-103.7	0	0	0	111	I119 Q125 A126 V127 I143 N146 L147 I337 T340 I341	I119-Y123 WeakPolarHBondContact O-CB 3.22Å; I119-Y123 PolarHBondContact O-N 2.96Å; Y123-Q125 VanDerWaalsContact C-N 3.33Å; Y123-Q125 PolarHBondContact O-N 3.43Å; Y123-A126 PolarHBondContact O-N 2.91Å; Y123-V127 HydrophobicContact CD1-CG2 4.13Å; Y123-V127 HydrophobicContact CD2-CG2 4.41Å; Y123-V127 HydrophobicContact CE1-CG2 3.72Å; Y123-V127 HydrophobicContact CE2-CG2 4.03Å; Y123-V127 HydrophobicContact CG-CG2 4.46Å; Y123-V127 VanDerWaalsContact O-CG2 3.29Å; Y123-V127 WeakPolarHBondContact O-CG2 3.47Å; Y123-V127 PolarHBondContact O-N 3.4Å; Y123-I143 HydrophobicContact CE1-CG2 4.11Å; Y123-N146 HydrophobicContact CE1-CB 3.74Å; Y123-N146 HydrophobicContact CE2-CB 4.45Å; Y123-N146 WeakPolarHBondContact OH-CB 3.05Å; Y123-N146 PolarHBondContact OH-ND2 3.01Å; Y123-N146 VanDerWaalsContact OH-ND2 3.08Å; Y123-L147 HydrophobicContact CD1-CD2 3.62Å; Y123-L147 HydrophobicContact CD1-CG 3.85Å; Y123-L147 HydrophobicContact CE1-CD2 4.19Å; Y123-L147 HydrophobicContact CE1-CG 3.88Å; Y123-I337 HydrophobicContact CD2-CB 4.27Å; Y123-I337 HydrophobicContact CD2-CG1 4.47Å; Y123-I337 HydrophobicContact CD2-CG2 3.69Å; Y123-I337 HydrophobicContact CE2-CB 4.47Å; Y123-I337 HydrophobicContact CE2-CG1 4.38Å; Y123-I337 HydrophobicContact CE2-CG2 4.37Å; Y123-I337 HydrophobicContact CG-CG2 4.13Å; Y123-T340 HydrophobicContact CD2-CG2 4.2Å; Y123-T340 HydrophobicContact CE2-CG2 3.7Å; Y123-I341 HydrophobicContact CD2-CG1 4.21Å
124	Y	92.9	Very high	89.8	Confident	0 Å²	0	25.3 Å²	25.3	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-62.1	-42	178.5	-176	-117.4	0	0	0	112	Q120 V127 L128 L147 A872 S875 I876 Y892 F895	Q120-Y124 VanDerWaalsContact O-CB 3.31Å; Q120-Y124 WeakPolarHBondContact O-CB 3.31Å; Q120-Y124 PolarHBondContact O-N 3.32Å; Y124-V127 PolarHBondContact O-N 3.46Å; Y124-L128 HydrophobicContact CD1-CD1 4.03Å; Y124-L128 HydrophobicContact CE1-CD1 3.55Å; Y124-L128 HydrophobicContact CE1-CG 4.27Å; Y124-L128 HydrophobicContact CE2-CD1 4.35Å; Y124-L128 HydrophobicContact CE2-CD2 4.27Å; Y124-L128 HydrophobicContact CE2-CG 4.2Å; Y124-L128 WeakPolarHBondContact O-CG 3.28Å; Y124-L128 PolarHBondContact O-N 3.09Å; Y124-L147 HydrophobicContact CD2-CD1 4.18Å; Y124-A872 HydrophobicContact CD2-CB 4.12Å; Y124-A872 HydrophobicContact CE2-CB 3.68Å; Y124-S875 WeakPolarHBondContact OH-CB 3.3Å; Y124-S875 PolarHBondContact OH-OG 3.28Å; Y124-I876 HydrophobicContact CE2-CD1 4.3Å; Y124-Y892 HydrophobicContact CD1-CD2 4.3Å; Y124-F895 HydrophobicContact CD1-CB 3.7Å; Y124-F895 AromaticContact CD1-CD1 3.36Å; Y124-F895 HydrophobicContact CD1-CD1 3.36Å; Y124-F895 HydrophobicContact CD1-CD2 4.21Å; Y124-F895 AromaticContact CD1-CE1 3.99Å; Y124-F895 HydrophobicContact CD1-CE1 3.99Å; Y124-F895 AromaticContact CD1-CG 3.49Å; Y124-F895 HydrophobicContact CD1-CG 3.49Å; Y124-F895 VanDerWaalsContact CD1-CG 3.49Å; Y124-F895 HydrophobicContact CE1-CB 3.34Å; Y124-F895 AromaticContact CE1-CD1 3.94Å; Y124-F895 HydrophobicContact CE1-CD1 3.94Å; Y124-F895 HydrophobicContact CE1-CD2 4.13Å; Y124-F895 AromaticContact CE1-CG 3.55Å; Y124-F895 HydrophobicContact CE1-CG 3.55Å; Y124-F895 AromaticContact CG-CD1 3.86Å; Y124-F895 HydrophobicContact CG-CD1 3.86Å; Y124-F895 HydrophobicContact CG-CE1 4.01Å; Y124-F895 HydrophobicContact CG-CG 4.14Å; Y124-F895 HydrophobicContact CG-CZ 4.42Å
125	Q	92	Very high	89.7	Confident	66 Å²	66	22.4 Å²	22.4	31%	0.308	11%	0.111	S	C	.	.	H	α-helix	trans	-58.6	-49.9	173	-170.6	174.3	3.1	0	0	111.1	L121 L122 Y123 V127 L128 H129 Y892	L121-Q125 VanDerWaalsContact O-CB 3.28Å; L121-Q125 WeakPolarHBondContact O-CB 3.45Å; L121-Q125 PolarHBondContact O-N 3.27Å; L122-Q125 PolarHBondContact O-N 3.21Å; Y123-Q125 VanDerWaalsContact C-N 3.33Å; Y123-Q125 PolarHBondContact O-N 3.43Å; Q125-V127 VanDerWaalsContact C-N 3.3Å; Q125-V127 PolarHBondContact O-N 2.82Å; Q125-L128 PolarHBondContact O-N 3.17Å; Q125-H129 WeakPolarHBondContact O-CB 3.49Å; Q125-H129 PolarHBondContact O-N 2.78Å; Q125-H129 PolarHBondContact O-ND1 2.72Å; Q125-Y892 HydrophobicContact CB-CD2 3.91Å; Q125-Y892 HydrophobicContact CB-CE2 3.66Å; Q125-Y892 HydrophobicContact CG-CD2 4.23Å; Q125-Y892 HydrophobicContact CG-CE2 4.07Å; Q125-Y892 PolarHBondContact OE1-OH 3Å
126	A	90.8	Very high	89.2	Confident	17 Å²	17	25.3 Å²	25.3	14%	0.14	13%	0.126	C	C	.	.	H	α-helix	trans	-59.9	-39.8	179.2	0	0	0	0	0	112.2	L122 Y123 H129 K130 I341	L122-A126 VanDerWaalsContact O-CB 3.28Å; L122-A126 WeakPolarHBondContact O-CB 3.28Å; L122-A126 PolarHBondContact O-N 2.93Å; Y123-A126 PolarHBondContact O-N 2.91Å; A126-H129 PolarHBondContact O-N 3.09Å; A126-K130 WeakPolarHBondContact O-CG 3.36Å; A126-K130 PolarHBondContact O-N 3.37Å; A126-K130 VanDerWaalsContact O-N 3.14Å; A126-I341 HydrophobicContact CB-CG1 4.42Å
127	V	92	Very high	88.8	Confident	0 Å²	0	29.5 Å²	29.5	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-63.1	-48.3	177.1	166.8	0	0	0	0	111.7	Y123 Y124 Q125 H129 K130 W134 F135 I143 T340 I876	Y123-V127 HydrophobicContact CD1-CG2 4.13Å; Y123-V127 HydrophobicContact CD2-CG2 4.41Å; Y123-V127 HydrophobicContact CE1-CG2 3.72Å; Y123-V127 HydrophobicContact CE2-CG2 4.03Å; Y123-V127 HydrophobicContact CG-CG2 4.46Å; Y123-V127 VanDerWaalsContact O-CG2 3.29Å; Y123-V127 WeakPolarHBondContact O-CG2 3.47Å; Y123-V127 PolarHBondContact O-N 3.4Å; Y124-V127 PolarHBondContact O-N 3.46Å; Q125-V127 VanDerWaalsContact C-N 3.3Å; Q125-V127 PolarHBondContact O-N 2.82Å; V127-H129 PolarHBondContact O-N 2.67Å; V127-H129 VanDerWaalsContact O-N 3.17Å; V127-K130 WeakPolarHBondContact O-CB 3.43Å; V127-K130 PolarHBondContact O-N 3.22Å; V127-W134 HydrophobicContact CG1-CZ3 4.47Å; V127-W134 HydrophobicContact CG2-CH2 4.32Å; V127-F135 HydrophobicContact CG1-CE1 3.94Å; V127-F135 HydrophobicContact CG1-CZ 3.83Å; V127-F135 WeakPolarHBondContact O-CZ 3.34Å; V127-I143 HydrophobicContact CG1-CG2 3.86Å; V127-I143 HydrophobicContact CG2-CG2 3.99Å; V127-T340 HydrophobicContact CG2-CG2 4.09Å; V127-I876 HydrophobicContact CG1-CD1 4.24Å; V127-I876 HydrophobicContact CG1-CG1 4.18Å
128	L	89.8	Confident	88.6	Confident	8 Å²	8	31.9 Å²	31.9	4%	0.042	16%	0.16	C	C	.	.	H	α-helix	trans	-58.5	-31.8	179.1	-71.7	174.3	0	0	0	112.4	Y124 Q125 K883 E888	Y124-L128 HydrophobicContact CD1-CD1 4.03Å; Y124-L128 HydrophobicContact CE1-CD1 3.55Å; Y124-L128 HydrophobicContact CE1-CG 4.27Å; Y124-L128 HydrophobicContact CE2-CD1 4.35Å; Y124-L128 HydrophobicContact CE2-CD2 4.27Å; Y124-L128 HydrophobicContact CE2-CG 4.2Å; Y124-L128 WeakPolarHBondContact O-CG 3.28Å; Y124-L128 PolarHBondContact O-N 3.09Å; Q125-L128 PolarHBondContact O-N 3.17Å; L128-K883 WeakPolarHBondContact O-CE 3.5Å; L128-K883 PolarHBondContact O-NZ 3.25Å; L128-K883 VanDerWaalsContact O-NZ 3.12Å; L128-E888 HydrophobicContact CB-CB 4.29Å; L128-E888 HydrophobicContact CB-CG 4.5Å; L128-E888 WeakPolarHBondContact CD1-O 3.34Å
129	H	87.5	Confident	88.3	Confident	43 Å²	43	32 Å²	32	20%	0.199	17%	0.167	C	C	.	.	H	α-helix	trans	-84.3	-13.8	-178.6	-79	86.9	0	0	0	113.4	Q125 A126 V127 E348	Q125-H129 WeakPolarHBondContact O-CB 3.49Å; Q125-H129 PolarHBondContact O-N 2.78Å; Q125-H129 PolarHBondContact O-ND1 2.72Å; A126-H129 PolarHBondContact O-N 3.09Å; V127-H129 PolarHBondContact O-N 2.67Å; V127-H129 VanDerWaalsContact O-N 3.17Å; H129-E348 WeakPolarHBondContact CA-OE1 3.37Å; H129-E348 WeakPolarHBondContact CB-OE1 3.42Å; H129-E348 WeakPolarHBondContact CB-OE2 3.21Å; H129-E348 IonicContact CD2-OE1 3.18Å; H129-E348 PolarHBondContact CD2-OE1 3.33Å; H129-E348 IonicContact CD2-OE2 3.23Å; H129-E348 PolarHBondContact CD2-OE2 3.48Å; H129-E348 IonicContact CG-OE1 3.51Å; H129-E348 IonicContact CG-OE2 3.62Å
130	K	88.5	Confident	87.9	Confident	2 Å²	2	35.2 Å²	35.2	1%	0.009	19%	0.186	C	C	.	.	S	Bend	trans	-63.4	141.5	174.1	-65.4	-54.3	-178.8	173.3	0	112.3	A126 V127 W134 F135 T340 H343 K883	A126-K130 WeakPolarHBondContact O-CG 3.36Å; A126-K130 PolarHBondContact O-N 3.37Å; A126-K130 VanDerWaalsContact O-N 3.14Å; V127-K130 WeakPolarHBondContact O-CB 3.43Å; V127-K130 PolarHBondContact O-N 3.22Å; K130-W134 HydrophobicContact CB-CB 4.01Å; K130-W134 HydrophobicContact CB-CD2 3.86Å; K130-W134 HydrophobicContact CB-CE3 3.64Å; K130-W134 HydrophobicContact CB-CG 4.03Å; K130-W134 HydrophobicContact CB-CZ3 4.41Å; K130-W134 HydrophobicContact CD-CD2 4.25Å; K130-W134 HydrophobicContact CD-CG 4.24Å; K130-W134 HydrophobicContact CG-CD2 3.66Å; K130-W134 HydrophobicContact CG-CE3 3.66Å; K130-W134 HydrophobicContact CG-CG 4.05Å; K130-W134 HydrophobicContact CG-CZ3 4.14Å; K130-F135 HydrophobicContact CB-CE2 4.11Å; K130-F135 WeakPolarHBondContact O-CE2 3.45Å; K130-T340 WeakPolarHBondContact CE-O 3.47Å; K130-T340 PolarHBondContact NZ-O 3.45Å; K130-H343 PolarHBondContact NZ-ND1 2.99Å; K130-H343 PolarHBondContact NZ-O 3.19Å; K130-K883 WeakPolarHBondContact O-CE 3.49Å; K130-K883 PolarHBondContact O-NZ 2.99Å
131	D	85	Confident	87.6	Confident	29 Å²	29	35.7 Å²	35.7	16%	0.155	20%	0.201	C	C	.	.			trans	-62.2	157.5	173.7	51.6	-34.2	0	0	0	112.9	L133 W134 F135 S345 I347	D131-L133 PolarHBondContact O-N 3.2Å; D131-W134 WeakPolarHBondContact O-CB 3.39Å; D131-W134 PolarHBondContact O-N 2.7Å; D131-F135 WeakPolarHBondContact O-CD2 3.27Å; D131-F135 PolarHBondContact O-N 2.97Å; D131-S345 PolarHBondContact N-OG 3.42Å; D131-S345 WeakPolarHBondContact OD1-CB 3.37Å; D131-S345 PolarHBondContact OD1-OG 3.3Å; D131-I347 HydrophobicContact CB-CD1 3.96Å
132	V	85.4	Confident	87.3	Confident	1 Å²	1	38.8 Å²	38.8	1%	0.006	22%	0.217	C	C	.	.	H	α-helix	trans	-59.9	-31.2	-179.4	-179.9	0	0	0	0	110.9	W134 F135 D136 F414 R880 K883	V132-W134 VanDerWaalsContact C-N 3.33Å; V132-W134 PolarHBondContact O-N 3.34Å; V132-F135 WeakPolarHBondContact O-CB 3.45Å; V132-F135 PolarHBondContact O-N 3.26Å; V132-F135 VanDerWaalsContact O-N 3.12Å; V132-D136 PolarHBondContact O-N 3.04Å; V132-F414 HydrophobicContact CB-CB 4.13Å; V132-F414 HydrophobicContact CB-CG 4.34Å; V132-F414 HydrophobicContact CG2-CB 3.93Å; V132-F414 HydrophobicContact CG2-CD1 3.63Å; V132-F414 HydrophobicContact CG2-CD2 4.16Å; V132-F414 HydrophobicContact CG2-CE1 4.13Å; V132-F414 HydrophobicContact CG2-CG 3.65Å; V132-R880 HydrophobicContact CG1-CG 4.07Å; V132-K883 HydrophobicContact CG2-CD 3.86Å
133	L	83.9	Confident	87.2	Confident	39 Å²	39	36.3 Å²	36.3	20%	0.204	20%	0.204	C	C	.	.	H	α-helix	trans	-56.8	-44.5	173.9	179.4	62.1	0	0	0	112.9	D131 F135 D136 D137 P373 Y415	D131-L133 PolarHBondContact O-N 3.2Å; L133-F135 VanDerWaalsContact C-N 3.27Å; L133-F135 PolarHBondContact O-N 2.94Å; L133-D136 WeakPolarHBondContact O-CB 3.35Å; L133-D136 PolarHBondContact O-N 3.22Å; L133-D136 VanDerWaalsContact O-N 3.14Å; L133-D137 PolarHBondContact O-N 3.28Å; L133-P373 HydrophobicContact CD1-CB 3.74Å; L133-P373 HydrophobicContact CD1-CG 3.43Å; L133-P373 VanDerWaalsContact CD1-CG 3.43Å; L133-P373 HydrophobicContact CD2-CB 4.22Å; L133-P373 HydrophobicContact CD2-CG 3.72Å; L133-P373 HydrophobicContact CG-CG 4.21Å; L133-Y415 HydrophobicContact CB-CD1 4.41Å; L133-Y415 HydrophobicContact CB-CE1 4.19Å; L133-Y415 HydrophobicContact CD1-CE1 4.29Å
134	W	86.8	Confident	87	Confident	33 Å²	33	37.8 Å²	37.8	13%	0.125	21%	0.212	C	C	.	.	H	α-helix	trans	-65	-34.3	178.4	-176.9	89.5	0	0	0	111.7	V127 K130 D131 V132 D136 D137 H138 I143 T340	V127-W134 HydrophobicContact CG1-CZ3 4.47Å; V127-W134 HydrophobicContact CG2-CH2 4.32Å; K130-W134 HydrophobicContact CB-CB 4.01Å; K130-W134 HydrophobicContact CB-CD2 3.86Å; K130-W134 HydrophobicContact CB-CE3 3.64Å; K130-W134 HydrophobicContact CB-CG 4.03Å; K130-W134 HydrophobicContact CB-CZ3 4.41Å; K130-W134 HydrophobicContact CD-CD2 4.25Å; K130-W134 HydrophobicContact CD-CG 4.24Å; K130-W134 HydrophobicContact CG-CD2 3.66Å; K130-W134 HydrophobicContact CG-CE3 3.66Å; K130-W134 HydrophobicContact CG-CG 4.05Å; K130-W134 HydrophobicContact CG-CZ3 4.14Å; D131-W134 WeakPolarHBondContact O-CB 3.39Å; D131-W134 PolarHBondContact O-N 2.7Å; V132-W134 VanDerWaalsContact C-N 3.33Å; V132-W134 PolarHBondContact O-N 3.34Å; W134-D136 VanDerWaalsContact C-N 3.35Å; W134-D137 PolarHBondContact O-N 2.9Å; W134-H138 AromaticContact CD1-CE1 3.68Å; W134-H138 AromaticContact CD1-ND1 3.77Å; W134-H138 HydrophobicContact CD2-CB 4.49Å; W134-H138 AromaticContact CD2-ND1 3.7Å; W134-H138 AromaticContact CE2-CD2 3.97Å; W134-H138 AromaticContact CE2-CE1 3.6Å; W134-H138 AromaticContact CE2-CG 3.7Å; W134-H138 AromaticContact CE2-ND1 3.45Å; W134-H138 AromaticContact CE2-NE2 3.89Å; W134-H138 HydrophobicContact CE3-CB 4.32Å; W134-H138 AromaticContact CG-ND1 3.92Å; W134-H138 HydrophobicContact CH2-CB 4.06Å; W134-H138 HydrophobicContact CZ2-CB 4.21Å; W134-H138 AromaticContact CZ2-CD2 3.68Å; W134-H138 AromaticContact CZ2-CG 3.67Å; W134-H138 AromaticContact CZ2-ND1 3.91Å; W134-H138 AromaticContact CZ2-NE2 3.94Å; W134-H138 HydrophobicContact CZ3-CB 4.12Å; W134-H138 AromaticContact NE1-CE1 3.22Å; W134-H138 PolarHBondContact NE1-CE1 3.13Å; W134-H138 AromaticContact NE1-ND1 3.48Å; W134-H138 PolarHBondContact NE1-ND1 2.95Å; W134-H138 AromaticContact NE1-NE2 3.69Å; W134-H138 WeakPolarHBondContact O-CB 3.45Å; W134-H138 PolarHBondContact O-N 3.11Å; W134-H138 VanDerWaalsContact O-N 3.11Å; W134-H138 PolarHBondContact O-ND1 3.18Å; W134-I143 HydrophobicContact CH2-CD1 3.97Å; W134-I143 HydrophobicContact CH2-CG1 4.02Å; W134-I143 HydrophobicContact CZ3-CD1 3.59Å; W134-I143 HydrophobicContact CZ3-CG1 4.17Å; W134-T340 HydrophobicContact CH2-CG2 4.08Å; W134-T340 HydrophobicContact CZ2-CG2 3.74Å
135	F	86.6	Confident	86.7	Confident	15 Å²	15	40.3 Å²	40.3	7%	0.066	23%	0.225	C	C	.	.	H	α-helix	trans	-69.6	-29.4	173.8	-76.2	-75.8	0	0	0	113.2	V127 K130 D131 V132 L133 D137 H138 I143 I876 H879	V127-F135 HydrophobicContact CG1-CE1 3.94Å; V127-F135 HydrophobicContact CG1-CZ 3.83Å; V127-F135 WeakPolarHBondContact O-CZ 3.34Å; K130-F135 HydrophobicContact CB-CE2 4.11Å; K130-F135 WeakPolarHBondContact O-CE2 3.45Å; D131-F135 WeakPolarHBondContact O-CD2 3.27Å; D131-F135 PolarHBondContact O-N 2.97Å; V132-F135 WeakPolarHBondContact O-CB 3.45Å; V132-F135 PolarHBondContact O-N 3.26Å; V132-F135 VanDerWaalsContact O-N 3.12Å; L133-F135 VanDerWaalsContact C-N 3.27Å; L133-F135 PolarHBondContact O-N 2.94Å; F135-D137 VanDerWaalsContact C-N 3.27Å; F135-D137 PolarHBondContact O-N 2.77Å; F135-H138 PolarHBondContact O-N 3.26Å; F135-I143 HydrophobicContact CD1-CD1 3.91Å; F135-I143 HydrophobicContact CE1-CD1 3.82Å; F135-I876 HydrophobicContact CE1-CG2 4.09Å; F135-H879 HydrophobicContact CD1-CB 4.33Å; F135-H879 HydrophobicContact CD2-CB 4.26Å; F135-H879 AromaticContact CD2-CD2 3.77Å; F135-H879 HydrophobicContact CE1-CB 4.23Å; F135-H879 HydrophobicContact CE2-CB 4.15Å; F135-H879 HydrophobicContact CG-CB 4.34Å; F135-H879 AromaticContact CG-CD2 3.71Å; F135-H879 AromaticContact CG-CG 3.85Å; F135-H879 HydrophobicContact CZ-CB 4.13Å
136	D	81.8	Confident	86.5	Confident	60 Å²	60	38 Å²	38	32%	0.321	22%	0.215	S	C	.	.	H	α-helix	trans	-67.5	-30.2	175	-65.2	-31.7	0	0	0	111.2	V132 L133 W134 Y415 R880	V132-D136 PolarHBondContact O-N 3.04Å; L133-D136 WeakPolarHBondContact O-CB 3.35Å; L133-D136 PolarHBondContact O-N 3.22Å; L133-D136 VanDerWaalsContact O-N 3.14Å; W134-D136 VanDerWaalsContact C-N 3.35Å; D136-Y415 PolarHBondContact OD2-OH 3.41Å; D136-R880 IonicContact OD1-NH2 3.43Å; D136-R880 PolarHBondContact OD1-NH2 2.73Å
137	D	81.8	Confident	86.3	Confident	99 Å²	99	37.3 Å²	37.3	53%	0.529	21%	0.209	S	C	.	.	H	α-helix	trans	-88.3	-21	177.4	-71.1	-19.8	0	0	0	114.2	L133 W134 F135	L133-D137 PolarHBondContact O-N 3.28Å; W134-D137 PolarHBondContact O-N 2.9Å; F135-D137 VanDerWaalsContact C-N 3.27Å; F135-D137 PolarHBondContact O-N 2.77Å
138	H	84	Confident	86	Confident	70 Å²	70	38.8 Å²	38.8	32%	0.324	22%	0.218	S	C	.	.	S	Bend	trans	-116.4	104.1	-175.5	-65.3	75.7	0	0	0	111.2	W134 F135 T140 I143	W134-H138 AromaticContact CD1-CE1 3.68Å; W134-H138 AromaticContact CD1-ND1 3.77Å; W134-H138 HydrophobicContact CD2-CB 4.49Å; W134-H138 AromaticContact CD2-ND1 3.7Å; W134-H138 AromaticContact CE2-CD2 3.97Å; W134-H138 AromaticContact CE2-CE1 3.6Å; W134-H138 AromaticContact CE2-CG 3.7Å; W134-H138 AromaticContact CE2-ND1 3.45Å; W134-H138 AromaticContact CE2-NE2 3.89Å; W134-H138 HydrophobicContact CE3-CB 4.32Å; W134-H138 AromaticContact CG-ND1 3.92Å; W134-H138 HydrophobicContact CH2-CB 4.06Å; W134-H138 HydrophobicContact CZ2-CB 4.21Å; W134-H138 AromaticContact CZ2-CD2 3.68Å; W134-H138 AromaticContact CZ2-CG 3.67Å; W134-H138 AromaticContact CZ2-ND1 3.91Å; W134-H138 AromaticContact CZ2-NE2 3.94Å; W134-H138 HydrophobicContact CZ3-CB 4.12Å; W134-H138 AromaticContact NE1-CE1 3.22Å; W134-H138 PolarHBondContact NE1-CE1 3.13Å; W134-H138 AromaticContact NE1-ND1 3.48Å; W134-H138 PolarHBondContact NE1-ND1 2.95Å; W134-H138 AromaticContact NE1-NE2 3.69Å; W134-H138 WeakPolarHBondContact O-CB 3.45Å; W134-H138 PolarHBondContact O-N 3.11Å; W134-H138 VanDerWaalsContact O-N 3.11Å; W134-H138 PolarHBondContact O-ND1 3.18Å; F135-H138 PolarHBondContact O-N 3.26Å; H138-T140 PolarHBondContact O-N 3.03Å; H138-I143 HydrophobicContact CB-CD1 4.44Å
139	P	85	Confident	85.7	Confident	76 Å²	76	44.3 Å²	44.3	49%	0.494	24%	0.244	S	C	.	.			trans	-54.7	140.7	176.3	-24.2	32.9	0	0	0	112	G141 D142 I143	P139-G141 PolarHBondContact O-N 3.23Å; P139-G141 VanDerWaalsContact O-N 3.1Å; P139-D142 PolarHBondContact O-N 2.9Å; P139-I143 PolarHBondContact O-N 3.28Å
140	T	84.6	Confident	85.7	Confident	67 Å²	67	44 Å²	44	41%	0.411	24%	0.244	S	C	.	.	H	α-helix	trans	-56.2	-32.8	-179.3	59.3	0	0	0	0	113	H138 D142 I143 I144 I876	H138-T140 PolarHBondContact O-N 3.03Å; T140-D142 PolarHBondContact O-N 3.39Å; T140-I143 PolarHBondContact O-N 3.49Å; T140-I144 WeakPolarHBondContact O-CG1 3.47Å; T140-I144 PolarHBondContact O-N 2.83Å; T140-I144 VanDerWaalsContact O-N 3.11Å; T140-I876 HydrophobicContact CG2-CG2 3.77Å
141	G	84.4	Confident	85.7	Confident	45 Å²	45	44 Å²	44	46%	0.464	24%	0.244	S	C	.	.	H	α-helix	trans	-60.2	-39.7	175.8	0	0	0	0	0	113.7	P139 I144 N145	P139-G141 PolarHBondContact O-N 3.23Å; P139-G141 VanDerWaalsContact O-N 3.1Å; G141-I144 PolarHBondContact O-N 3.15Å; G141-N145 WeakPolarHBondContact O-CB 3.38Å; G141-N145 PolarHBondContact O-N 2.8Å
142	D	85.8	Confident	85.8	Confident	91 Å²	91	47 Å²	47	49%	0.487	26%	0.26	S	S	.	.	H	α-helix	trans	-70.6	-37.1	-179	-67.9	-19.5	0	0	0	111.3	P139 T140 N145 N146	P139-D142 PolarHBondContact O-N 2.9Å; T140-D142 PolarHBondContact O-N 3.39Å; D142-N145 PolarHBondContact O-N 3.27Å; D142-N146 PolarHBondContact O-N 3.49Å; D142-N146 PolarHBondContact O-ND2 2.96Å
143	I	89.9	Confident	85.9	Confident	1 Å²	1	49.2 Å²	49.2	1%	0.005	28%	0.275	C	S	.	.	H	α-helix	trans	-64.7	-41.6	175.1	-54.7	171.6	0	0	0	110.6	Y123 V127 W134 F135 H138 P139 T140 N146 L147 I876	Y123-I143 HydrophobicContact CE1-CG2 4.11Å; V127-I143 HydrophobicContact CG1-CG2 3.86Å; V127-I143 HydrophobicContact CG2-CG2 3.99Å; W134-I143 HydrophobicContact CH2-CD1 3.97Å; W134-I143 HydrophobicContact CH2-CG1 4.02Å; W134-I143 HydrophobicContact CZ3-CD1 3.59Å; W134-I143 HydrophobicContact CZ3-CG1 4.17Å; F135-I143 HydrophobicContact CD1-CD1 3.91Å; F135-I143 HydrophobicContact CE1-CD1 3.82Å; H138-I143 HydrophobicContact CB-CD1 4.44Å; P139-I143 PolarHBondContact O-N 3.28Å; T140-I143 PolarHBondContact O-N 3.49Å; I143-N146 WeakPolarHBondContact O-CB 3.37Å; I143-N146 PolarHBondContact O-N 3.45Å; I143-L147 PolarHBondContact O-N 3.43Å; I143-I876 HydrophobicContact CD1-CG2 3.97Å; I143-I876 HydrophobicContact CG2-CD1 3.66Å
144	I	88.4	Confident	86.3	Confident	31 Å²	31	47.4 Å²	47.4	16%	0.159	27%	0.266	C	S	.	.	H	α-helix	trans	-67.9	-37.4	175.6	-64.1	-62.6	0	0	0	111.2	T140 G141 N146 L147 T148 I869 A872 K873 I876	T140-I144 WeakPolarHBondContact O-CG1 3.47Å; T140-I144 PolarHBondContact O-N 2.83Å; T140-I144 VanDerWaalsContact O-N 3.11Å; G141-I144 PolarHBondContact O-N 3.15Å; I144-N146 VanDerWaalsContact C-N 3.3Å; I144-N146 PolarHBondContact O-N 3Å; I144-L147 HydrophobicContact CD1-CD1 4.41Å; I144-L147 PolarHBondContact O-N 3.33Å; I144-T148 WeakPolarHBondContact O-CG2 3.31Å; I144-T148 PolarHBondContact O-N 2.81Å; I144-T148 PolarHBondContact O-OG1 2.98Å; I144-I869 HydrophobicContact CG2-CG2 4.03Å; I144-A872 HydrophobicContact CD1-CB 4.27Å; I144-K873 HydrophobicContact CD1-CB 4Å; I144-I876 HydrophobicContact CD1-CD1 4.14Å
145	N	86.3	Confident	86.5	Confident	53 Å²	53	47.9 Å²	47.9	28%	0.283	27%	0.27	S	S	.	.	H	α-helix	trans	-63.3	-39.1	173.7	-161.9	28.4	0	0	0	111.7	G141 D142 L147 T148 E149 N150	G141-N145 WeakPolarHBondContact O-CB 3.38Å; G141-N145 PolarHBondContact O-N 2.8Å; D142-N145 PolarHBondContact O-N 3.27Å; N145-L147 VanDerWaalsContact C-N 3.34Å; N145-L147 PolarHBondContact O-N 2.86Å; N145-T148 WeakPolarHBondContact CA-OG1 3.45Å; N145-T148 CarbonylContact O-C 3.29Å; N145-T148 PolarHBondContact O-N 3.27Å; N145-T148 VanDerWaalsContact O-N 3.13Å; N145-T148 PolarHBondContact O-OG1 2.63Å; N145-E149 PolarHBondContact O-N 2.82Å; N145-E149 VanDerWaalsContact OD1-CB 3.27Å; N145-E149 WeakPolarHBondContact OD1-CB 3.28Å; N145-E149 VanDerWaalsContact OD1-CD 3.28Å; N145-E149 WeakPolarHBondContact OD1-CG 3.49Å; N145-E149 PolarHBondContact OD1-OE2 2.83Å; N145-N150 PolarHBondContact O-N 3.23Å
146	N	88.3	Confident	86.5	Confident	18 Å²	18	49.1 Å²	49.1	10%	0.096	28%	0.28	C	S	.	.	I	π-helix	trans	-61.4	-40	172.3	-76.5	-28.2	0	0	0	112.7	Y123 D142 I143 I144 T148 N150 L151 I337	Y123-N146 HydrophobicContact CE1-CB 3.74Å; Y123-N146 HydrophobicContact CE2-CB 4.45Å; Y123-N146 WeakPolarHBondContact OH-CB 3.05Å; Y123-N146 PolarHBondContact OH-ND2 3.01Å; Y123-N146 VanDerWaalsContact OH-ND2 3.08Å; D142-N146 PolarHBondContact O-N 3.49Å; D142-N146 PolarHBondContact O-ND2 2.96Å; I143-N146 WeakPolarHBondContact O-CB 3.37Å; I143-N146 PolarHBondContact O-N 3.45Å; I144-N146 VanDerWaalsContact C-N 3.3Å; I144-N146 PolarHBondContact O-N 3Å; N146-T148 PolarHBondContact O-N 3.47Å; N146-N150 PolarHBondContact OD1-ND2 2.92Å; N146-L151 VanDerWaalsContact O-CG 3.3Å; N146-L151 WeakPolarHBondContact O-CG 3.43Å; N146-I337 HydrophobicContact CB-CG1 4.23Å
147	L	86.4	Confident	86.9	Confident	3 Å²	3	46.2 Å²	46.2	2%	0.016	26%	0.264	C	S	.	.	I	π-helix	trans	-73	-6.7	175.9	-77.9	168.9	0	0	0	114.6	Q120 Y123 Y124 I143 I144 N145 L151 A872 I876 F895	Q120-L147 HydrophobicContact CG-CD2 3.85Å; Q120-L147 PolarHBondContact NE2-O 2.89Å; Y123-L147 HydrophobicContact CD1-CD2 3.62Å; Y123-L147 HydrophobicContact CD1-CG 3.85Å; Y123-L147 HydrophobicContact CE1-CD2 4.19Å; Y123-L147 HydrophobicContact CE1-CG 3.88Å; Y124-L147 HydrophobicContact CD2-CD1 4.18Å; I143-L147 PolarHBondContact O-N 3.43Å; I144-L147 HydrophobicContact CD1-CD1 4.41Å; I144-L147 PolarHBondContact O-N 3.33Å; N145-L147 VanDerWaalsContact C-N 3.34Å; N145-L147 PolarHBondContact O-N 2.86Å; L147-L151 HydrophobicContact CD2-CD1 4.49Å; L147-A872 HydrophobicContact CD1-CB 3.77Å; L147-I876 HydrophobicContact CD1-CD1 4.2Å; L147-F895 HydrophobicContact CD2-CZ 4.38Å
148	T	85.3	Confident	87.4	Confident	31 Å²	31	41.5 Å²	41.5	19%	0.19	24%	0.239	C	C	.	.	I	π-helix	trans	-128.4	-85.8	-174	55	0	0	0	0	112.7	I144 N145 N146 N150 L151 N152 I869	I144-T148 WeakPolarHBondContact O-CG2 3.31Å; I144-T148 PolarHBondContact O-N 2.81Å; I144-T148 PolarHBondContact O-OG1 2.98Å; N145-T148 WeakPolarHBondContact CA-OG1 3.45Å; N145-T148 CarbonylContact O-C 3.29Å; N145-T148 PolarHBondContact O-N 3.27Å; N145-T148 VanDerWaalsContact O-N 3.13Å; N145-T148 PolarHBondContact O-OG1 2.63Å; N146-T148 PolarHBondContact O-N 3.47Å; T148-N150 PolarHBondContact O-N 2.98Å; T148-L151 PolarHBondContact O-N 2.73Å; T148-N152 VanDerWaalsContact O-CG 3.25Å; T148-N152 PolarHBondContact O-N 3.05Å; T148-N152 PolarHBondContact O-ND2 3.46Å; T148-I869 HydrophobicContact CG2-CD1 3.31Å; T148-I869 HydrophobicContact CG2-CG1 3.71Å; T148-I869 HydrophobicContact CG2-CG2 4.38Å
149	E	83.6	Confident	87.6	Confident	123 Å²	123	38.2 Å²	38.2	58%	0.575	22%	0.224	S	C	*	.	I	π-helix	trans	-65.5	-40.9	-172	-59.6	-171.5	166.7	0	0	113.2	N145 N152 S153	N145-E149 PolarHBondContact O-N 2.82Å; N145-E149 VanDerWaalsContact OD1-CB 3.27Å; N145-E149 WeakPolarHBondContact OD1-CB 3.28Å; N145-E149 VanDerWaalsContact OD1-CD 3.28Å; N145-E149 WeakPolarHBondContact OD1-CG 3.49Å; N145-E149 PolarHBondContact OD1-OE2 2.83Å; E149-N152 PolarHBondContact O-N 2.75Å; E149-S153 PolarHBondContact O-N 3.46Å; E149-S153 PolarHBondContact O-OG 3.48Å
150	N	88.3	Confident	87.7	Confident	37 Å²	37	36.2 Å²	36.2	20%	0.198	21%	0.211	C	C	.	.	I	π-helix	trans	-70.8	-36.5	-179.3	-79	-15	0	0	0	112	N145 N146 T148 S153 I154 A333 I337	N145-N150 PolarHBondContact O-N 3.23Å; N146-N150 PolarHBondContact OD1-ND2 2.92Å; T148-N150 PolarHBondContact O-N 2.98Å; N150-S153 WeakPolarHBondContact O-CB 3.43Å; N150-S153 PolarHBondContact O-N 3.19Å; N150-I154 WeakPolarHBondContact O-CG1 3.21Å; N150-I154 PolarHBondContact O-N 2.74Å; N150-A333 HydrophobicContact CB-CB 3.86Å; N150-I337 HydrophobicContact CB-CD1 3.93Å
151	L	88.4	Confident	88	Confident	3 Å²	3	35.7 Å²	35.7	2%	0.016	20%	0.203	C	C	.	.	H	α-helix	trans	-66.2	-40.8	171.8	-78.7	173.3	0	0	0	112.2	V116 I119 Q120 N146 L147 T148 S153 I154 E155 I337	V116-L151 HydrophobicContact CG1-CB 3.97Å; V116-L151 HydrophobicContact CG1-CD2 4.13Å; V116-L151 HydrophobicContact CG1-CG 4.5Å; I119-L151 HydrophobicContact CB-CD2 4.15Å; I119-L151 HydrophobicContact CG2-CD2 3.67Å; Q120-L151 HydrophobicContact CB-CD1 3.67Å; Q120-L151 HydrophobicContact CG-CD1 3.59Å; N146-L151 VanDerWaalsContact O-CG 3.3Å; N146-L151 WeakPolarHBondContact O-CG 3.43Å; L147-L151 HydrophobicContact CD2-CD1 4.49Å; T148-L151 PolarHBondContact O-N 2.73Å; L151-S153 PolarHBondContact O-N 3.31Å; L151-I154 HydrophobicContact CD2-CD1 4.44Å; L151-I154 WeakPolarHBondContact O-CB 3.12Å; L151-I154 PolarHBondContact O-N 3.41Å; L151-I154 VanDerWaalsContact O-N 3.16Å; L151-E155 PolarHBondContact O-N 3.48Å; L151-I337 HydrophobicContact CD2-CD1 4.18Å; L151-I337 HydrophobicContact CG-CD1 4.25Å
152	N	86.9	Confident	88.5	Confident	91 Å²	91	34.5 Å²	34.5	49%	0.487	19%	0.185	S	C	.	.	H	α-helix	trans	-62.6	-33.8	174	-70.9	-13.7	0	0	0	112.2	T148 E149 E155 S156	T148-N152 VanDerWaalsContact O-CG 3.25Å; T148-N152 PolarHBondContact O-N 3.05Å; T148-N152 PolarHBondContact O-ND2 3.46Å; E149-N152 PolarHBondContact O-N 2.75Å; N152-E155 WeakPolarHBondContact O-CB 3.26Å; N152-E155 PolarHBondContact O-N 3.13Å; N152-S156 WeakPolarHBondContact O-CB 3.35Å; N152-S156 PolarHBondContact O-N 2.8Å; N152-S156 PolarHBondContact O-OG 2.88Å
153	S	87.8	Confident	88.8	Confident	48 Å²	48	30.2 Å²	30.2	34%	0.336	16%	0.162	S	C	.	.	H	α-helix	trans	-67.5	-41.7	174.2	-61.7	0	0	0	0	111.5	E149 N150 L151 S156 G157	E149-S153 PolarHBondContact O-N 3.46Å; E149-S153 PolarHBondContact O-OG 3.48Å; N150-S153 WeakPolarHBondContact O-CB 3.43Å; N150-S153 PolarHBondContact O-N 3.19Å; L151-S153 PolarHBondContact O-N 3.31Å; S153-S156 PolarHBondContact O-N 3.44Å; S153-G157 PolarHBondContact O-N 2.78Å
154	I	91.8	Very high	88.9	Confident	0 Å²	0	31.8 Å²	31.8	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-60.9	-47.2	172.1	-67.1	169.8	0	0	0	110.3	V116 I119 N150 L151 S156 G157 I158 A333 I337	V116-I154 HydrophobicContact CG2-CG2 4.25Å; I119-I154 HydrophobicContact CD1-CG2 4.32Å; N150-I154 WeakPolarHBondContact O-CG1 3.21Å; N150-I154 PolarHBondContact O-N 2.74Å; L151-I154 HydrophobicContact CD2-CD1 4.44Å; L151-I154 WeakPolarHBondContact O-CB 3.12Å; L151-I154 PolarHBondContact O-N 3.41Å; L151-I154 VanDerWaalsContact O-N 3.16Å; I154-S156 PolarHBondContact O-N 2.95Å; I154-G157 PolarHBondContact O-N 3.33Å; I154-I158 HydrophobicContact CG2-CD1 4.22Å; I154-I158 HydrophobicContact CG2-CG2 4.34Å; I154-I158 WeakPolarHBondContact O-CG1 3.33Å; I154-I158 PolarHBondContact O-N 3.09Å; I154-A333 HydrophobicContact CD1-CB 4.47Å; I154-A333 HydrophobicContact CG1-CB 4.1Å; I154-I337 HydrophobicContact CD1-CD1 3.82Å
155	E	90.2	Very high	89.1	Confident	44 Å²	44	32.4 Å²	32.4	21%	0.206	17%	0.172	C	C	.	.	H	α-helix	trans	-54.1	-51.5	177.7	-166	-174.9	153.6	0	0	111.8	K113 V116 L151 N152 G157 G159	K113-E155 WeakPolarHBondContact CG-OE1 3.33Å; V116-E155 HydrophobicContact CG2-CB 3.76Å; V116-E155 HydrophobicContact CG2-CG 4.17Å; L151-E155 PolarHBondContact O-N 3.48Å; N152-E155 WeakPolarHBondContact O-CB 3.26Å; N152-E155 PolarHBondContact O-N 3.13Å; E155-G157 VanDerWaalsContact C-N 3.34Å; E155-G157 PolarHBondContact O-N 3.29Å; E155-G159 WeakPolarHBondContact O-CA 3.38Å; E155-G159 PolarHBondContact O-N 2.85Å
156	S	87.3	Confident	89.5	Confident	40 Å²	40	31.8 Å²	31.8	28%	0.28	17%	0.169	S	C	.	.	H	α-helix	trans	-62.8	-42.1	-178.4	-64.1	0	0	0	0	111.5	N152 S153 I154 K161	N152-S156 WeakPolarHBondContact O-CB 3.35Å; N152-S156 PolarHBondContact O-N 2.8Å; N152-S156 PolarHBondContact O-OG 2.88Å; S153-S156 PolarHBondContact O-N 3.44Å; I154-S156 PolarHBondContact O-N 2.95Å; S156-K161 WeakPolarHBondContact O-CB 3.42Å; S156-K161 VanDerWaalsContact O-CG 3.3Å; S156-K161 WeakPolarHBondContact O-CG 3.35Å; S156-K161 PolarHBondContact O-N 3.32Å
157	G	90	Very high	89.9	Confident	0 Å²	0	31.7 Å²	31.7	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-74.7	-32.5	-177.1	0	0	0	0	0	114.9	S153 I154 E155 L162	S153-G157 PolarHBondContact O-N 2.78Å; I154-G157 PolarHBondContact O-N 3.33Å; E155-G157 VanDerWaalsContact C-N 3.34Å; E155-G157 PolarHBondContact O-N 3.29Å; G157-L162 WeakPolarHBondContact O-CB 3.45Å
158	I	92.4	Very high	90.2	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-89.2	-22.8	175.8	72.2	-178.6	0	0	0	113.2	L34 F35 I115 V116 I154	L34-I158 HydrophobicContact CB-CG2 4.07Å; L34-I158 HydrophobicContact CD1-CG2 4.02Å; F35-I158 HydrophobicContact CE1-CB 3.94Å; F35-I158 HydrophobicContact CE1-CG2 4.27Å; F35-I158 HydrophobicContact CZ-CB 4.02Å; F35-I158 HydrophobicContact CZ-CG2 4.14Å; I115-I158 HydrophobicContact CB-CD1 4.17Å; I115-I158 HydrophobicContact CG2-CD1 3.83Å; V116-I158 HydrophobicContact CG2-CD1 4.27Å; I154-I158 HydrophobicContact CG2-CD1 4.22Å; I154-I158 HydrophobicContact CG2-CG2 4.34Å; I154-I158 WeakPolarHBondContact O-CG1 3.33Å; I154-I158 PolarHBondContact O-N 3.09Å
159	G	89.3	Confident	90.6	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.5	-119.4	-173.9	0	0	0	0	0	112.7	V108 E155 K161 L162 S163	V108-G159 WeakPolarHBondContact CG1-O 3.38Å; E155-G159 WeakPolarHBondContact O-CA 3.38Å; E155-G159 PolarHBondContact O-N 2.85Å; G159-K161 PolarHBondContact O-N 3.39Å; G159-L162 PolarHBondContact O-N 2.96Å; G159-S163 PolarHBondContact O-N 3.36Å
160	T	86.8	Confident	91.1	Very high	35 Å²	35	28.1 Å²	28.1	22%	0.215	15%	0.152	C	C	.	.	H	α-helix	trans	-57.2	-42.1	-170.3	50.2	0	0	0	0	114.1	E109 L162 S163 D164	E109-T160 VanDerWaalsContact CD-CG2 3.41Å; E109-T160 HydrophobicContact CG-CG2 4.17Å; E109-T160 WeakPolarHBondContact OE1-CG2 2.87Å; T160-L162 PolarHBondContact O-N 3.06Å; T160-S163 PolarHBondContact O-N 3.41Å; T160-S163 VanDerWaalsContact O-N 3.17Å; T160-S163 PolarHBondContact O-OG 3.02Å; T160-D164 WeakPolarHBondContact O-CB 3.12Å; T160-D164 PolarHBondContact O-N 2.92Å
161	K	91.2	Very high	91.3	Very high	56 Å²	56	26.4 Å²	26.4	24%	0.243	14%	0.143	C	C	.	.	H	α-helix	trans	-67.6	-35.8	-175.3	-57.4	-58.9	-178.9	-172.9	0	113.1	S156 G159 F165 N323 Y326	S156-K161 WeakPolarHBondContact O-CB 3.42Å; S156-K161 VanDerWaalsContact O-CG 3.3Å; S156-K161 WeakPolarHBondContact O-CG 3.35Å; S156-K161 PolarHBondContact O-N 3.32Å; G159-K161 PolarHBondContact O-N 3.39Å; K161-F165 WeakPolarHBondContact O-CB 3.38Å; K161-F165 PolarHBondContact O-N 3.04Å; K161-N323 HydrophobicContact CB-CB 4.35Å; K161-Y326 HydrophobicContact CD-CD2 4.47Å; K161-Y326 HydrophobicContact CG-CD1 4.41Å; K161-Y326 HydrophobicContact CG-CD2 4.37Å; K161-Y326 HydrophobicContact CG-CG 4Å
162	L	93.5	Very high	91.5	Very high	19 Å²	19	27.7 Å²	27.7	10%	0.099	15%	0.149	C	C	.	.	H	α-helix	trans	-64.1	-46	172.3	-177.5	66.7	0	0	0	111	F31 F35 G157 G159 T160 D164 F165 N166 I327	F31-L162 HydrophobicContact CE1-CD1 4.4Å; F31-L162 HydrophobicContact CE1-CD2 4.34Å; F31-L162 HydrophobicContact CZ-CD1 3.82Å; F31-L162 HydrophobicContact CZ-CD2 3.8Å; F31-L162 HydrophobicContact CZ-CG 4.42Å; F35-L162 HydrophobicContact CZ-CD2 4.37Å; G157-L162 WeakPolarHBondContact O-CB 3.45Å; G159-L162 PolarHBondContact O-N 2.96Å; T160-L162 PolarHBondContact O-N 3.06Å; L162-D164 PolarHBondContact O-N 3.24Å; L162-F165 WeakPolarHBondContact O-CB 3.49Å; L162-F165 PolarHBondContact O-N 3.39Å; L162-N166 PolarHBondContact O-N 3.37Å; L162-N166 PolarHBondContact O-ND2 2.95Å; L162-I327 HydrophobicContact CD1-CD1 4.01Å
163	S	93.1	Very high	91.8	Very high	1 Å²	1	27.6 Å²	27.6	1%	0.007	15%	0.148	C	C	.	.	H	α-helix	trans	-64.2	-39.9	179.1	76.2	0	0	0	0	112.3	A53 K104 G159 T160 N166 Q167	A53-S163 WeakPolarHBondContact CB-O 3.41Å; K104-S163 VanDerWaalsContact CE-OG 3.28Å; K104-S163 WeakPolarHBondContact CE-OG 3.45Å; G159-S163 PolarHBondContact O-N 3.36Å; T160-S163 PolarHBondContact O-N 3.41Å; T160-S163 VanDerWaalsContact O-N 3.17Å; T160-S163 PolarHBondContact O-OG 3.02Å; S163-N166 PolarHBondContact O-N 3.27Å; S163-Q167 WeakPolarHBondContact O-CB 3.37Å; S163-Q167 PolarHBondContact O-N 3.15Å
164	D	91.2	Very high	92	Very high	34 Å²	34	25.9 Å²	25.9	18%	0.182	14%	0.136	C	C	.	.	H	α-helix	trans	-68.7	-36.7	176.6	-70.3	-17.9	0	0	0	111.5	K104 T160 L162 N168	K104-D164 IonicContact NZ-OD1 2.81Å; K104-D164 PolarHBondContact NZ-OD1 3.48Å; T160-D164 WeakPolarHBondContact O-CB 3.12Å; T160-D164 PolarHBondContact O-N 2.92Å; L162-D164 PolarHBondContact O-N 3.24Å; D164-N168 VanDerWaalsContact O-CB 3.32Å; D164-N168 WeakPolarHBondContact O-CB 3.31Å; D164-N168 VanDerWaalsContact O-CG 3.28Å; D164-N168 PolarHBondContact O-N 3.45Å; D164-N168 PolarHBondContact O-ND2 3.04Å
165	F	94	Very high	92	Very high	44 Å²	44	25.9 Å²	25.9	19%	0.193	14%	0.136	C	C	.	.	H	α-helix	trans	-60.4	-50	171.5	175.3	-95	0	0	0	111.1	K161 L162 Q167 N168 M169 A320 N323 I324 I327	K161-F165 WeakPolarHBondContact O-CB 3.38Å; K161-F165 PolarHBondContact O-N 3.04Å; L162-F165 WeakPolarHBondContact O-CB 3.49Å; L162-F165 PolarHBondContact O-N 3.39Å; F165-Q167 PolarHBondContact O-N 3.1Å; F165-N168 PolarHBondContact O-N 3.33Å; F165-M169 HydrophobicContact CE2-CE 3.86Å; F165-M169 HydrophobicContact CZ-CE 3.79Å; F165-M169 VanDerWaalsContact O-CB 3.27Å; F165-M169 WeakPolarHBondContact O-CB 3.45Å; F165-M169 PolarHBondContact O-N 2.91Å; F165-A320 HydrophobicContact CD2-CB 4.15Å; F165-A320 HydrophobicContact CE2-CB 4.43Å; F165-N323 HydrophobicContact CB-CB 4.15Å; F165-I324 HydrophobicContact CD2-CG1 4.26Å; F165-I324 HydrophobicContact CE2-CD1 4.22Å; F165-I324 HydrophobicContact CE2-CG1 3.99Å; F165-I327 HydrophobicContact CB-CD1 4.31Å; F165-I327 HydrophobicContact CG-CD1 4.35Å
166	N	94.7	Very high	92	Very high	41 Å²	41	25.4 Å²	25.4	22%	0.219	13%	0.134	C	C	.	.	H	α-helix	trans	-63.8	-40.7	179.3	-73.6	-24.8	0	0	0	112.4	N50 I54 L162 S163 S170	N50-N166 PolarHBondContact OD1-ND2 3.46Å; I54-N166 HydrophobicContact CG1-CB 4.26Å; L162-N166 PolarHBondContact O-N 3.37Å; L162-N166 PolarHBondContact O-ND2 2.95Å; S163-N166 PolarHBondContact O-N 3.27Å; N166-S170 VanDerWaalsContact O-CB 3.28Å; N166-S170 WeakPolarHBondContact O-CB 3.4Å; N166-S170 PolarHBondContact O-N 2.85Å; N166-S170 PolarHBondContact O-OG 3.26Å
167	Q	94.8	Very high	92.2	Very high	16 Å²	16	28.1 Å²	28.1	8%	0.075	15%	0.145	C	C	.	.	H	α-helix	trans	-61	-49.1	174.6	179.1	-175.2	-25.6	0	0	111.9	A53 L56 G57 S163 F165 S170 G171	A53-Q167 HydrophobicContact CB-CB 4.21Å; A53-Q167 WeakPolarHBondContact O-CA 3.35Å; A53-Q167 WeakPolarHBondContact O-CB 3.42Å; L56-Q167 HydrophobicContact CD2-CG 4.44Å; L56-Q167 HydrophobicContact CG-CG 4.39Å; G57-Q167 VanDerWaalsContact CA-O 3.28Å; G57-Q167 WeakPolarHBondContact CA-O 3.31Å; S163-Q167 WeakPolarHBondContact O-CB 3.37Å; S163-Q167 PolarHBondContact O-N 3.15Å; F165-Q167 PolarHBondContact O-N 3.1Å; Q167-S170 PolarHBondContact O-OG 3.24Å; Q167-G171 PolarHBondContact O-N 3.29Å
168	N	92.9	Very high	92.3	Very high	18 Å²	18	29 Å²	29	10%	0.096	15%	0.149	C	C	.	.	H	α-helix	trans	-70.9	-40.3	-178.2	-72.3	-42.3	0	0	0	111.5	D164 F165 G171 F172 F316 A320	D164-N168 VanDerWaalsContact O-CB 3.32Å; D164-N168 WeakPolarHBondContact O-CB 3.31Å; D164-N168 VanDerWaalsContact O-CG 3.28Å; D164-N168 PolarHBondContact O-N 3.45Å; D164-N168 PolarHBondContact O-ND2 3.04Å; F165-N168 PolarHBondContact O-N 3.33Å; N168-G171 PolarHBondContact O-N 2.91Å; N168-F172 WeakPolarHBondContact O-CB 3.31Å; N168-F172 PolarHBondContact O-N 3.06Å; N168-F316 HydrophobicContact CB-CB 4.31Å; N168-F316 WeakPolarHBondContact CB-O 3.47Å; N168-F316 WeakPolarHBondContact O-CB 3.45Å; N168-F316 WeakPolarHBondContact OD1-CD1 3.41Å; N168-A320 HydrophobicContact CB-CB 3.82Å
169	M	93.5	Very high	92.2	Very high	49 Å²	49	29 Å²	29	24%	0.241	15%	0.149	C	C	.	.	H	α-helix	trans	-64.8	-42.9	177.9	-169.9	60.1	66.8	0	0	112	F165 F172 L173 L317 A320	F165-M169 HydrophobicContact CE2-CE 3.86Å; F165-M169 HydrophobicContact CZ-CE 3.79Å; F165-M169 VanDerWaalsContact O-CB 3.27Å; F165-M169 WeakPolarHBondContact O-CB 3.45Å; F165-M169 PolarHBondContact O-N 2.91Å; M169-F172 PolarHBondContact O-N 2.95Å; M169-F172 HydrophobicContact SD-CD1 4.02Å; M169-L173 HydrophobicContact CG-CD1 4.39Å; M169-L173 WeakPolarHBondContact O-CG 3.43Å; M169-L173 PolarHBondContact O-N 2.92Å; M169-L317 HydrophobicContact CE-CD1 4.44Å; M169-A320 HydrophobicContact CE-CB 4.42Å
170	S	94.9	Very high	92.4	Very high	15 Å²	15	32.9 Å²	32.9	11%	0.105	17%	0.166	C	C	.	.	H	α-helix	trans	-65	-40.4	175.1	56.7	0	0	0	0	112.3	I54 N166 Q167 L173 A174	I54-S170 WeakPolarHBondContact CA-OG 3.49Å; I54-S170 PolarHBondContact O-OG 3.11Å; N166-S170 VanDerWaalsContact O-CB 3.28Å; N166-S170 WeakPolarHBondContact O-CB 3.4Å; N166-S170 PolarHBondContact O-N 2.85Å; N166-S170 PolarHBondContact O-OG 3.26Å; Q167-S170 PolarHBondContact O-OG 3.24Å; S170-L173 PolarHBondContact O-N 3.32Å; S170-A174 WeakPolarHBondContact O-CB 3.45Å; S170-A174 PolarHBondContact O-N 3.28Å
171	G	92.9	Very high	92.6	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-63.3	-38.3	173.7	0	0	0	0	0	113.3	G57 P61 Q167 N168 G175 F316	G57-G171 VanDerWaalsContact O-CA 3.22Å; G57-G171 WeakPolarHBondContact O-CA 3.34Å; P61-G171 WeakPolarHBondContact CG-O 3.44Å; Q167-G171 PolarHBondContact O-N 3.29Å; N168-G171 PolarHBondContact O-N 2.91Å; G171-G175 PolarHBondContact O-N 3.01Å; G171-F316 VanDerWaalsContact C-CD2 3.41Å
172	F	91.6	Very high	92.5	Very high	31 Å²	31	35.2 Å²	35.2	14%	0.136	18%	0.179	C	C	.	.	H	α-helix	trans	-62	-52.9	173.5	166.2	-112.7	0	0	0	112.1	N168 M169 G175 I176 G313 F316 L317	N168-F172 WeakPolarHBondContact O-CB 3.31Å; N168-F172 PolarHBondContact O-N 3.06Å; M169-F172 PolarHBondContact O-N 2.95Å; M169-F172 HydrophobicContact SD-CD1 4.02Å; F172-G175 PolarHBondContact O-N 3Å; F172-I176 HydrophobicContact CD2-CD1 3.99Å; F172-I176 HydrophobicContact CD2-CG1 4.47Å; F172-I176 HydrophobicContact CE1-CD1 4.11Å; F172-I176 HydrophobicContact CE2-CD1 3.31Å; F172-I176 HydrophobicContact CE2-CG1 4.18Å; F172-I176 HydrophobicContact CZ-CD1 3.37Å; F172-I176 PolarHBondContact O-N 3.47Å; F172-I176 VanDerWaalsContact O-N 3.1Å; F172-G313 WeakPolarHBondContact CD2-O 3.39Å; F172-F316 HydrophobicContact CB-CB 4.19Å; F172-L317 HydrophobicContact CD1-CD1 4.41Å; F172-L317 HydrophobicContact CD2-CB 3.93Å; F172-L317 HydrophobicContact CE1-CD1 4.42Å; F172-L317 HydrophobicContact CE2-CB 4.19Å; F172-L317 HydrophobicContact CE2-CD2 3.97Å; F172-L317 HydrophobicContact CG-CB 4.2Å; F172-L317 HydrophobicContact CZ-CD2 4Å
173	L	93	Very high	92.4	Very high	89 Å²	89	37.5 Å²	37.5	47%	0.466	19%	0.189	S	C	.	.	H	α-helix	trans	-62.7	-45.2	180	-68	173.8	0	0	0	111.3	M169 S170 G175 I176 I177	M169-L173 HydrophobicContact CG-CD1 4.39Å; M169-L173 WeakPolarHBondContact O-CG 3.43Å; M169-L173 PolarHBondContact O-N 2.92Å; S170-L173 PolarHBondContact O-N 3.32Å; L173-G175 VanDerWaalsContact C-N 3.35Å; L173-G175 PolarHBondContact O-N 3.48Å; L173-I176 PolarHBondContact O-N 2.85Å; L173-I177 WeakPolarHBondContact O-CB 3.39Å; L173-I177 WeakPolarHBondContact O-CD1 3.37Å; L173-I177 WeakPolarHBondContact O-CG1 3.49Å; L173-I177 PolarHBondContact O-N 2.94Å
174	A	93.1	Very high	92.3	Very high	11 Å²	11	44.9 Å²	44.9	9%	0.091	22%	0.216	C	C	.	.	H	α-helix	trans	-62.3	-40.4	177.1	0	0	0	0	0	112.1	I58 P61 S170 I177 I178	I58-A174 HydrophobicContact CB-CB 4.39Å; I58-A174 HydrophobicContact CG1-CB 4.1Å; I58-A174 HydrophobicContact CG2-CB 4.37Å; P61-A174 HydrophobicContact CB-CB 4.11Å; P61-A174 HydrophobicContact CG-CB 3.97Å; S170-A174 WeakPolarHBondContact O-CB 3.45Å; S170-A174 PolarHBondContact O-N 3.28Å; A174-I177 PolarHBondContact O-N 3.07Å; A174-I178 VanDerWaalsContact O-CB 3.27Å; A174-I178 WeakPolarHBondContact O-CB 3.49Å; A174-I178 WeakPolarHBondContact O-CG1 3.08Å; A174-I178 PolarHBondContact O-N 3.12Å
175	G	90.8	Very high	92.4	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-59.3	-46.8	175.6	0	0	0	0	0	112.6	G171 F172 L173 G179 N309	G171-G175 PolarHBondContact O-N 3.01Å; F172-G175 PolarHBondContact O-N 3Å; L173-G175 VanDerWaalsContact C-N 3.35Å; L173-G175 PolarHBondContact O-N 3.48Å; G175-G179 PolarHBondContact O-N 3.14Å; G175-N309 WeakPolarHBondContact O-CB 3.44Å
176	I	90.4	Very high	92.2	Very high	34 Å²	34	44.7 Å²	44.7	17%	0.174	21%	0.214	C	C	.	.	H	α-helix	trans	-64.7	-51.1	177	-69.3	-179.5	0	0	0	111	F172 L173 I178 G179 F180 L194	F172-I176 HydrophobicContact CD2-CD1 3.99Å; F172-I176 HydrophobicContact CD2-CG1 4.47Å; F172-I176 HydrophobicContact CE1-CD1 4.11Å; F172-I176 HydrophobicContact CE2-CD1 3.31Å; F172-I176 HydrophobicContact CE2-CG1 4.18Å; F172-I176 HydrophobicContact CZ-CD1 3.37Å; F172-I176 PolarHBondContact O-N 3.47Å; F172-I176 VanDerWaalsContact O-N 3.1Å; L173-I176 PolarHBondContact O-N 2.85Å; I176-I178 VanDerWaalsContact C-N 3.34Å; I176-I178 PolarHBondContact O-N 3.24Å; I176-G179 WeakPolarHBondContact O-CA 3.46Å; I176-G179 PolarHBondContact O-N 3.39Å; I176-G179 VanDerWaalsContact O-N 3.1Å; I176-F180 HydrophobicContact CG2-CD2 3.69Å; I176-F180 HydrophobicContact CG2-CE2 3.68Å; I176-F180 WeakPolarHBondContact O-CD2 3.22Å; I176-F180 PolarHBondContact O-N 3.36Å; I176-L194 HydrophobicContact CD1-CD1 4Å
177	I	92.8	Very high	92	Very high	98 Å²	98	42.8 Å²	42.8	50%	0.503	20%	0.203	S	C	.	.	H	α-helix	trans	-57.4	-48.7	-177.9	-69.2	165.2	0	0	0	110.3	L173 A174 G179 F180 I181	L173-I177 WeakPolarHBondContact O-CB 3.39Å; L173-I177 WeakPolarHBondContact O-CD1 3.37Å; L173-I177 WeakPolarHBondContact O-CG1 3.49Å; L173-I177 PolarHBondContact O-N 2.94Å; A174-I177 PolarHBondContact O-N 3.07Å; I177-G179 VanDerWaalsContact C-N 3.31Å; I177-G179 PolarHBondContact O-N 3.49Å; I177-F180 PolarHBondContact O-N 3.13Å; I177-I181 HydrophobicContact CG2-CD1 3.67Å; I177-I181 HydrophobicContact CG2-CG1 4.42Å; I177-I181 VanDerWaalsContact O-CG1 3.28Å; I177-I181 WeakPolarHBondContact O-CG1 3.45Å; I177-I181 PolarHBondContact O-N 3.24Å
178	I	91.6	Very high	91.9	Very high	18 Å²	18	46.7 Å²	46.7	9%	0.092	22%	0.224	C	C	.	.	H	α-helix	trans	-63.6	-38.9	178.2	-68.5	175.6	0	0	0	111	P61 L65 A174 I176 F180 I181 V182 N309	P61-I178 HydrophobicContact CB-CD1 3.64Å; L65-I178 HydrophobicContact CD1-CD1 4.07Å; L65-I178 HydrophobicContact CD1-CG1 4.32Å; L65-I178 HydrophobicContact CD1-CG2 3.91Å; L65-I178 HydrophobicContact CD2-CG2 3.62Å; L65-I178 HydrophobicContact CG-CG2 3.66Å; A174-I178 VanDerWaalsContact O-CB 3.27Å; A174-I178 WeakPolarHBondContact O-CB 3.49Å; A174-I178 WeakPolarHBondContact O-CG1 3.08Å; A174-I178 PolarHBondContact O-N 3.12Å; I176-I178 VanDerWaalsContact C-N 3.34Å; I176-I178 PolarHBondContact O-N 3.24Å; I178-F180 PolarHBondContact O-N 2.76Å; I178-I181 PolarHBondContact O-N 3.42Å; I178-V182 HydrophobicContact CG2-CG2 4.19Å; I178-V182 VanDerWaalsContact O-CG2 3.3Å; I178-V182 WeakPolarHBondContact O-CG2 3.46Å; I178-V182 PolarHBondContact O-N 3.38Å; I178-N309 VanDerWaalsContact CG2-ND2 3.29Å; I178-N309 WeakPolarHBondContact CG2-ND2 3.5Å
179	G	90.5	Very high	91.8	Very high	0 Å²	0	47 Å²	47	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-55.3	-50	173.7	0	0	0	0	0	112.3	G175 I176 I177 V182 K183 A187	G175-G179 PolarHBondContact O-N 3.14Å; I176-G179 WeakPolarHBondContact O-CA 3.46Å; I176-G179 PolarHBondContact O-N 3.39Å; I176-G179 VanDerWaalsContact O-N 3.1Å; I177-G179 VanDerWaalsContact C-N 3.31Å; I177-G179 PolarHBondContact O-N 3.49Å; G179-V182 PolarHBondContact O-N 3.3Å; G179-K183 PolarHBondContact O-N 3.49Å; G179-A187 WeakPolarHBondContact O-CB 3.14Å
180	F	92.3	Very high	91.5	Very high	81 Å²	81	44.7 Å²	44.7	36%	0.355	22%	0.216	S	C	.	.	H	α-helix	trans	-64.6	-38.8	177.8	-83.4	-77.7	0	0	0	113.2	I176 I177 I178 W184 A187 C191	I176-F180 HydrophobicContact CG2-CD2 3.69Å; I176-F180 HydrophobicContact CG2-CE2 3.68Å; I176-F180 WeakPolarHBondContact O-CD2 3.22Å; I176-F180 PolarHBondContact O-N 3.36Å; I177-F180 PolarHBondContact O-N 3.13Å; I178-F180 PolarHBondContact O-N 2.76Å; F180-W184 HydrophobicContact CD1-CB 4.21Å; F180-W184 PolarHBondContact O-N 3.02Å; F180-A187 HydrophobicContact CD1-CB 4.01Å; F180-A187 HydrophobicContact CD2-CB 4.36Å; F180-A187 HydrophobicContact CE1-CB 4.26Å; F180-A187 HydrophobicContact CG-CB 4.06Å; F180-C191 VanDerWaalsContact CE2-SG 3.58Å
181	I	92.4	Very high	91.2	Very high	131 Å²	131	45.3 Å²	45.3	67%	0.672	22%	0.219	S	C	*	.	H	α-helix	trans	-64.1	-41.7	177	-69.1	167.5	0	0	0	111.3	I177 I178	I177-I181 HydrophobicContact CG2-CD1 3.67Å; I177-I181 HydrophobicContact CG2-CG1 4.42Å; I177-I181 VanDerWaalsContact O-CG1 3.28Å; I177-I181 WeakPolarHBondContact O-CG1 3.45Å; I177-I181 PolarHBondContact O-N 3.24Å; I178-I181 PolarHBondContact O-N 3.42Å
182	V	88.9	Confident	91	Very high	10 Å²	10	48.3 Å²	48.3	6%	0.061	24%	0.241	C	C	.	.	H	α-helix	trans	-69.1	-56.2	-176.4	170.3	0	0	0	0	111.3	L65 I178 G179 V306	L65-V182 HydrophobicContact CD2-CG2 3.5Å; L65-V182 VanDerWaalsContact CD2-CG2 3.5Å; I178-V182 HydrophobicContact CG2-CG2 4.19Å; I178-V182 VanDerWaalsContact O-CG2 3.3Å; I178-V182 WeakPolarHBondContact O-CG2 3.46Å; I178-V182 PolarHBondContact O-N 3.38Å; G179-V182 PolarHBondContact O-N 3.3Å; V182-V306 HydrophobicContact CB-CG2 4.04Å; V182-V306 HydrophobicContact CG1-CG2 3.93Å
183	K	90.3	Very high	90.7	Very high	67 Å²	67	47.5 Å²	47.5	29%	0.291	24%	0.238	S	C	.	.	H	α-helix	trans	-154.6	97.8	176.6	-73.8	-62.1	-179.3	171.7	0	110.7	G179 K185 L186 A187 V306	G179-K183 PolarHBondContact O-N 3.49Å; K183-K185 PolarHBondContact O-N 2.84Å; K183-L186 HydrophobicContact CB-CB 4.35Å; K183-L186 PolarHBondContact O-N 2.93Å; K183-A187 WeakPolarHBondContact O-CB 3.49Å; K183-A187 PolarHBondContact O-N 3Å; K183-V306 HydrophobicContact CB-CG2 4.3Å
184	W	92.3	Very high	90.2	Very high	156 Å²	156	44.4 Å²	44.4	59%	0.591	22%	0.222	S	C	*	.	H	α-helix	trans	-58.7	-37.8	-174.8	75.9	-94.1	0	0	0	114.6	F180 L186 A187 L188	F180-W184 HydrophobicContact CD1-CB 4.21Å; F180-W184 PolarHBondContact O-N 3.02Å; W184-L186 PolarHBondContact O-N 3.28Å; W184-A187 PolarHBondContact O-N 3.16Å; W184-L188 HydrophobicContact CZ3-CD1 4.42Å; W184-L188 WeakPolarHBondContact O-CB 3.49Å; W184-L188 PolarHBondContact O-N 3.22Å
185	K	93	Very high	89.8	Confident	74 Å²	74	47.3 Å²	47.3	32%	0.322	24%	0.24	S	C	.	.	H	α-helix	trans	-61.5	-45.9	179.1	-70.7	-178.8	179.4	168.9	0	111.9	K183 L188 V189 L292 E296	K183-K185 PolarHBondContact O-N 2.84Å; K185-L188 PolarHBondContact O-N 3.35Å; K185-V189 PolarHBondContact O-N 3.03Å; K185-L292 HydrophobicContact CB-CD1 4.48Å; K185-L292 HydrophobicContact CD-CD1 4.2Å; K185-E296 WeakPolarHBondContact CD-OE1 3.4Å; K185-E296 WeakPolarHBondContact CD-OE2 3.21Å; K185-E296 IonicContact NZ-OE1 3.89Å; K185-E296 PolarHBondContact NZ-OE1 2.93Å; K185-E296 IonicContact NZ-OE2 2.61Å; K185-E296 PolarHBondContact NZ-OE2 2.81Å
186	L	90.5	Very high	89.6	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-70.8	-38.8	177.6	-175.2	65.1	0	0	0	111.4	K183 W184 L188 V189 A190 V285 F288 L292 V303 V306	K183-L186 HydrophobicContact CB-CB 4.35Å; K183-L186 PolarHBondContact O-N 2.93Å; W184-L186 PolarHBondContact O-N 3.28Å; L186-L188 VanDerWaalsContact C-N 3.28Å; L186-L188 PolarHBondContact O-N 2.76Å; L186-V189 PolarHBondContact O-N 3.03Å; L186-A190 WeakPolarHBondContact O-CB 3.5Å; L186-A190 PolarHBondContact O-N 2.86Å; L186-V285 HydrophobicContact CD1-CG1 4.08Å; L186-V285 HydrophobicContact CG-CG1 4.43Å; L186-F288 HydrophobicContact CD1-CD1 3.84Å; L186-L292 HydrophobicContact CB-CD2 4.26Å; L186-V303 HydrophobicContact CD2-CB 4.04Å; L186-V303 HydrophobicContact CD2-CG1 3.93Å; L186-V303 HydrophobicContact CD2-CG2 4.06Å; L186-V306 HydrophobicContact CB-CG1 4.23Å; L186-V306 HydrophobicContact CD2-CB 3.83Å; L186-V306 HydrophobicContact CD2-CG1 3.99Å; L186-V306 HydrophobicContact CD2-CG2 4.28Å; L186-V306 HydrophobicContact CG-CB 4.25Å; L186-V306 HydrophobicContact CG-CG1 3.83Å
187	A	90.7	Very high	89.2	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-61.7	-37.3	176.7	0	0	0	0	0	112	G179 F180 K183 W184 A190 C191 V306 I310	G179-A187 WeakPolarHBondContact O-CB 3.14Å; F180-A187 HydrophobicContact CD1-CB 4.01Å; F180-A187 HydrophobicContact CD2-CB 4.36Å; F180-A187 HydrophobicContact CE1-CB 4.26Å; F180-A187 HydrophobicContact CG-CB 4.06Å; K183-A187 WeakPolarHBondContact O-CB 3.49Å; K183-A187 PolarHBondContact O-N 3Å; W184-A187 PolarHBondContact O-N 3.16Å; A187-A190 PolarHBondContact O-N 3.25Å; A187-C191 VanDerWaalsContact O-CB 3.27Å; A187-C191 WeakPolarHBondContact O-CB 3.41Å; A187-C191 PolarHBondContact O-N 2.88Å; A187-C191 PolarHBondContact O-SG 3.28Å; A187-V306 HydrophobicContact CB-CG1 4.09Å; A187-I310 HydrophobicContact CB-CD1 4.25Å
188	L	91.5	Very high	88.7	Confident	98 Å²	98	50.6 Å²	50.6	51%	0.513	26%	0.255	S	S	.	.	H	α-helix	trans	-65.2	-42.3	176.7	-167.5	141.9	0	0	0	111.9	W184 K185 L186 C191 S192	W184-L188 HydrophobicContact CZ3-CD1 4.42Å; W184-L188 WeakPolarHBondContact O-CB 3.49Å; W184-L188 PolarHBondContact O-N 3.22Å; K185-L188 PolarHBondContact O-N 3.35Å; L186-L188 VanDerWaalsContact C-N 3.28Å; L186-L188 PolarHBondContact O-N 2.76Å; L188-C191 PolarHBondContact O-N 2.85Å; L188-S192 PolarHBondContact O-N 3.3Å
189	V	91.1	Very high	88.4	Confident	25 Å²	25	54.1 Å²	54.1	15%	0.152	27%	0.274	C	S	.	.	H	α-helix	trans	-65.4	-40.7	174.3	172.8	0	0	0	0	111.8	K185 L186 S192 L284 F288	K185-V189 PolarHBondContact O-N 3.03Å; L186-V189 PolarHBondContact O-N 3.03Å; V189-S192 PolarHBondContact O-N 2.77Å; V189-S192 PolarHBondContact O-OG 3.37Å; V189-L284 HydrophobicContact CG1-CD2 3.23Å; V189-F288 HydrophobicContact CB-CD1 4.16Å; V189-F288 HydrophobicContact CB-CE1 4.47Å; V189-F288 HydrophobicContact CB-CG 4.48Å; V189-F288 HydrophobicContact CG1-CB 4.14Å; V189-F288 HydrophobicContact CG1-CD1 4.24Å; V189-F288 HydrophobicContact CG1-CG 4.1Å; V189-F288 HydrophobicContact CG2-CD1 3.75Å; V189-F288 HydrophobicContact CG2-CD2 4.29Å; V189-F288 HydrophobicContact CG2-CE1 3.65Å; V189-F288 HydrophobicContact CG2-CE2 4.2Å; V189-F288 HydrophobicContact CG2-CG 4.08Å; V189-F288 HydrophobicContact CG2-CZ 3.89Å
190	A	88.1	Confident	88.1	Confident	1 Å²	1	54.2 Å²	54.2	1%	0.008	28%	0.275	C	S	.	.	H	α-helix	trans	-69.8	-36.9	175.3	0	0	0	0	0	111.5	L186 A187 S192 T193 V285 I310	L186-A190 WeakPolarHBondContact O-CB 3.5Å; L186-A190 PolarHBondContact O-N 2.86Å; A187-A190 PolarHBondContact O-N 3.25Å; A190-S192 VanDerWaalsContact C-N 3.28Å; A190-S192 PolarHBondContact O-N 3.42Å; A190-T193 WeakPolarHBondContact O-CB 3.33Å; A190-T193 PolarHBondContact O-N 2.98Å; A190-T193 PolarHBondContact O-OG1 3.46Å; A190-V285 HydrophobicContact CB-CG1 4.43Å; A190-V285 HydrophobicContact CB-CG2 3.6Å; A190-I310 HydrophobicContact CB-CB 4.27Å; A190-I310 HydrophobicContact CB-CD1 3.21Å; A190-I310 HydrophobicContact CB-CG1 4.3Å; A190-I310 HydrophobicContact CB-CG2 4.02Å
191	C	87.9	Confident	87.4	Confident	27 Å²	27	53.5 Å²	53.5	18%	0.182	27%	0.271	C	S	.	.	H	α-helix	trans	-64.7	-29.1	174	-73.6	0	0	0	0	112.9	F180 A187 L188 T193 L194 P195	F180-C191 VanDerWaalsContact CE2-SG 3.58Å; A187-C191 VanDerWaalsContact O-CB 3.27Å; A187-C191 WeakPolarHBondContact O-CB 3.41Å; A187-C191 PolarHBondContact O-N 2.88Å; A187-C191 PolarHBondContact O-SG 3.28Å; L188-C191 PolarHBondContact O-N 2.85Å; C191-T193 PolarHBondContact O-N 3.2Å; C191-T193 VanDerWaalsContact O-N 3.15Å; C191-L194 HydrophobicContact CB-CD1 4.09Å; C191-L194 WeakPolarHBondContact O-CB 3.16Å; C191-L194 PolarHBondContact O-N 2.99Å; C191-P195 WeakPolarHBondContact O-CD 3.39Å
192	S	88.1	Confident	86.9	Confident	64 Å²	64	49.9 Å²	49.9	45%	0.448	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-15.1	174	76.4	0	0	0	0	113	L188 V189 A190	L188-S192 PolarHBondContact O-N 3.3Å; V189-S192 PolarHBondContact O-N 2.77Å; V189-S192 PolarHBondContact O-OG 3.37Å; A190-S192 VanDerWaalsContact C-N 3.28Å; A190-S192 PolarHBondContact O-N 3.42Å
193	T	84.9	Confident	86.6	Confident	14 Å²	14	53.5 Å²	53.5	9%	0.086	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.6	-19.8	173.2	73.2	0	0	0	0	113.3	A190 C191 F196 V197 L284	A190-T193 WeakPolarHBondContact O-CB 3.33Å; A190-T193 PolarHBondContact O-N 2.98Å; A190-T193 PolarHBondContact O-OG1 3.46Å; C191-T193 PolarHBondContact O-N 3.2Å; C191-T193 VanDerWaalsContact O-N 3.15Å; T193-F196 WeakPolarHBondContact O-CB 3.37Å; T193-F196 PolarHBondContact O-N 2.99Å; T193-V197 PolarHBondContact O-N 2.95Å; T193-L284 HydrophobicContact CG2-CD2 4.35Å
194	L	82.4	Confident	86.2	Confident	23 Å²	23	54 Å²	54	12%	0.12	28%	0.279	C	S	.	.	H	α-helix	trans	-58.5	-43.8	-178.2	-69.2	172.1	0	0	0	113.6	I176 C191 F196 V197 V198 I310 S314	I176-L194 HydrophobicContact CD1-CD1 4Å; C191-L194 HydrophobicContact CB-CD1 4.09Å; C191-L194 WeakPolarHBondContact O-CB 3.16Å; C191-L194 PolarHBondContact O-N 2.99Å; L194-F196 PolarHBondContact O-N 2.56Å; L194-V197 WeakPolarHBondContact O-CB 3.45Å; L194-V197 PolarHBondContact O-N 3.24Å; L194-V198 WeakPolarHBondContact O-CG2 3.45Å; L194-V198 PolarHBondContact O-N 3.04Å; L194-I310 HydrophobicContact CD2-CG2 4.17Å; L194-I310 HydrophobicContact CG-CG2 4.48Å; L194-S314 WeakPolarHBondContact CD2-OG 3.35Å
195	P	86.3	Confident	85.4	Confident	72 Å²	72	48.4 Å²	48.4	47%	0.468	27%	0.27	S	S	.	.	H	α-helix	trans	-56.2	-38.2	177.5	-26.9	35.6	0	0	0	112.9	C191 V198 I199	C191-P195 WeakPolarHBondContact O-CD 3.39Å; P195-V198 PolarHBondContact O-N 3.39Å; P195-I199 WeakPolarHBondContact O-CB 3.41Å; P195-I199 WeakPolarHBondContact O-CD1 3.48Å; P195-I199 WeakPolarHBondContact O-CG1 3.39Å; P195-I199 PolarHBondContact O-N 3.17Å
196	F	86.4	Confident	85	Confident	128 Å²	128	50.4 Å²	50.4	56%	0.561	28%	0.282	S	S	*	.	H	α-helix	trans	-67.1	-38.7	177.5	-62.9	-79.5	0	0	0	112.2	T193 L194 I199 A200 V277	T193-F196 WeakPolarHBondContact O-CB 3.37Å; T193-F196 PolarHBondContact O-N 2.99Å; L194-F196 PolarHBondContact O-N 2.56Å; F196-I199 PolarHBondContact O-N 2.81Å; F196-A200 WeakPolarHBondContact O-CB 3.42Å; F196-A200 PolarHBondContact O-N 2.91Å; F196-V277 HydrophobicContact CB-CG1 3.83Å; F196-V277 HydrophobicContact CB-CG2 4.36Å
197	V	81.6	Confident	84.7	Confident	12 Å²	12	51.1 Å²	51.1	7%	0.073	29%	0.288	C	S	.	.	H	α-helix	trans	-64	-46.6	174.5	-179.5	0	0	0	0	110.2	T193 L194 I199 A200 F201 V277	T193-V197 PolarHBondContact O-N 2.95Å; L194-V197 WeakPolarHBondContact O-CB 3.45Å; L194-V197 PolarHBondContact O-N 3.24Å; V197-I199 VanDerWaalsContact C-N 3.34Å; V197-I199 PolarHBondContact O-N 3.46Å; V197-A200 PolarHBondContact O-N 2.85Å; V197-F201 HydrophobicContact CG1-CD2 3.64Å; V197-F201 HydrophobicContact CG1-CE2 3.62Å; V197-F201 VanDerWaalsContact O-CD2 3.32Å; V197-F201 WeakPolarHBondContact O-CD2 3.31Å; V197-F201 PolarHBondContact O-N 3.38Å; V197-V277 HydrophobicContact CB-CG1 4.36Å; V197-V277 HydrophobicContact CG2-CG1 3.53Å
198	V	82	Confident	84.2	Confident	61 Å²	61	55.5 Å²	55.5	37%	0.37	31%	0.307	S	S	.	.	H	α-helix	trans	-61.1	-41.8	177	177.2	0	0	0	0	111.3	L194 P195 F201 S202 L317	L194-V198 WeakPolarHBondContact O-CG2 3.45Å; L194-V198 PolarHBondContact O-N 3.04Å; P195-V198 PolarHBondContact O-N 3.39Å; V198-F201 PolarHBondContact O-N 2.84Å; V198-S202 WeakPolarHBondContact O-CB 3.46Å; V198-S202 PolarHBondContact O-N 3.08Å; V198-S202 PolarHBondContact O-OG 2.71Å; V198-L317 HydrophobicContact CG2-CD2 4.01Å
199	I	85.2	Confident	83.7	Confident	93 Å²	93	59.1 Å²	59.1	48%	0.477	32%	0.319	S	S	.	.	H	α-helix	trans	-61.5	-46.5	175.6	-71	163	0	0	0	110.4	P195 F196 V197 F201 S202 L203	P195-I199 WeakPolarHBondContact O-CB 3.41Å; P195-I199 WeakPolarHBondContact O-CD1 3.48Å; P195-I199 WeakPolarHBondContact O-CG1 3.39Å; P195-I199 PolarHBondContact O-N 3.17Å; F196-I199 PolarHBondContact O-N 2.81Å; V197-I199 VanDerWaalsContact C-N 3.34Å; V197-I199 PolarHBondContact O-N 3.46Å; I199-F201 PolarHBondContact O-N 3.3Å; I199-S202 PolarHBondContact O-N 3.25Å; I199-L203 HydrophobicContact CG2-CD1 3.83Å; I199-L203 HydrophobicContact CG2-CG 4.24Å; I199-L203 WeakPolarHBondContact O-CB 3.49Å; I199-L203 VanDerWaalsContact O-CG 3.27Å; I199-L203 WeakPolarHBondContact O-CG 3.44Å; I199-L203 PolarHBondContact O-N 3.38Å
200	A	83.3	Confident	83.6	Confident	2 Å²	2	63.9 Å²	63.9	2%	0.017	34%	0.335	C	S	.	.	H	α-helix	trans	-61.2	-45.3	179.9	0	0	0	0	0	112.4	F196 V197 F204 I274 V277	F196-A200 WeakPolarHBondContact O-CB 3.42Å; F196-A200 PolarHBondContact O-N 2.91Å; V197-A200 PolarHBondContact O-N 2.85Å; A200-F204 PolarHBondContact O-N 2.91Å; A200-I274 HydrophobicContact CB-CG1 3.86Å; A200-V277 HydrophobicContact CB-CG2 4.43Å
201	F	78.7	Confident	83.6	Confident	65 Å²	65	66.2 Å²	66.2	29%	0.285	35%	0.345	S	S	.	.	H	α-helix	trans	-68.6	-33.7	174.8	-80.4	-72.3	0	0	0	112.9	V197 V198 I199 F204 G205 I274	V197-F201 HydrophobicContact CG1-CD2 3.64Å; V197-F201 HydrophobicContact CG1-CE2 3.62Å; V197-F201 VanDerWaalsContact O-CD2 3.32Å; V197-F201 WeakPolarHBondContact O-CD2 3.31Å; V197-F201 PolarHBondContact O-N 3.38Å; V198-F201 PolarHBondContact O-N 2.84Å; I199-F201 PolarHBondContact O-N 3.3Å; F201-F204 WeakPolarHBondContact O-CB 3.26Å; F201-F204 PolarHBondContact O-N 3.44Å; F201-G205 PolarHBondContact O-N 3.39Å; F201-I274 HydrophobicContact CD1-CD1 4.22Å; F201-I274 HydrophobicContact CE1-CD1 4.14Å; F201-I274 HydrophobicContact CZ-CG2 4.25Å
202	S	81.1	Confident	83.4	Confident	56 Å²	56	68.3 Å²	68.3	39%	0.392	35%	0.352	S	S	.	.	H	α-helix	trans	-68.1	-42.9	175.8	-61.4	0	0	0	0	111.5	V198 I199 F204 G205 I206	V198-S202 WeakPolarHBondContact O-CB 3.46Å; V198-S202 PolarHBondContact O-N 3.08Å; V198-S202 PolarHBondContact O-OG 2.71Å; I199-S202 PolarHBondContact O-N 3.25Å; S202-F204 VanDerWaalsContact C-N 3.27Å; S202-F204 PolarHBondContact O-N 3.31Å; S202-G205 PolarHBondContact O-N 3.47Å; S202-G205 VanDerWaalsContact O-N 3.17Å; S202-I206 WeakPolarHBondContact O-CG1 3.43Å; S202-I206 PolarHBondContact O-N 2.93Å
203	L	82.9	Confident	83.3	Confident	85 Å²	85	67.1 Å²	67.1	45%	0.445	35%	0.35	S	S	.	.	H	α-helix	trans	-59.4	-39	172.5	-73.5	171.1	0	0	0	111.2	I199 I206 A207	I199-L203 HydrophobicContact CG2-CD1 3.83Å; I199-L203 HydrophobicContact CG2-CG 4.24Å; I199-L203 WeakPolarHBondContact O-CB 3.49Å; I199-L203 VanDerWaalsContact O-CG 3.27Å; I199-L203 WeakPolarHBondContact O-CG 3.44Å; I199-L203 PolarHBondContact O-N 3.38Å; L203-I206 PolarHBondContact O-N 2.79Å; L203-A207 WeakPolarHBondContact O-CB 3.46Å; L203-A207 PolarHBondContact O-N 3.29Å
204	F	81.2	Confident	83.6	Confident	78 Å²	78	70.8 Å²	70.8	34%	0.342	37%	0.365	S	S	.	.	H	α-helix	trans	-58.7	-50.4	172.5	-174.2	-94.4	0	0	0	111.6	A200 F201 S202 I206 A207 F208 V270	A200-F204 PolarHBondContact O-N 2.91Å; F201-F204 WeakPolarHBondContact O-CB 3.26Å; F201-F204 PolarHBondContact O-N 3.44Å; S202-F204 VanDerWaalsContact C-N 3.27Å; S202-F204 PolarHBondContact O-N 3.31Å; F204-I206 PolarHBondContact O-N 3.17Å; F204-A207 PolarHBondContact O-N 2.87Å; F204-F208 WeakPolarHBondContact O-CB 3.32Å; F204-F208 PolarHBondContact O-N 2.98Å; F204-V270 HydrophobicContact CB-CG1 3.53Å; F204-V270 HydrophobicContact CD2-CB 4.25Å; F204-V270 HydrophobicContact CD2-CG1 3.74Å; F204-V270 HydrophobicContact CG-CG1 4.14Å
205	G	77.2	Confident	83.8	Confident	39 Å²	39	71.3 Å²	71.3	40%	0.402	37%	0.367	S	S	.	.	H	α-helix	trans	-60.5	-43.8	178.9	0	0	0	0	0	113.3	F201 S202 F208 K209	F201-G205 PolarHBondContact O-N 3.39Å; S202-G205 PolarHBondContact O-N 3.47Å; S202-G205 VanDerWaalsContact O-N 3.17Å; G205-F208 PolarHBondContact O-N 3.24Å; G205-K209 PolarHBondContact O-N 3.12Å
206	I	84.5	Confident	83.9	Confident	115 Å²	115	72.4 Å²	72.4	59%	0.59	37%	0.368	S	S	*	.	H	α-helix	trans	-66.2	-48.5	178.7	-65.8	165.8	0	0	0	110.8	S202 L203 F204 F208 K209 Y210	S202-I206 WeakPolarHBondContact O-CG1 3.43Å; S202-I206 PolarHBondContact O-N 2.93Å; L203-I206 PolarHBondContact O-N 2.79Å; F204-I206 PolarHBondContact O-N 3.17Å; I206-F208 VanDerWaalsContact C-N 3.32Å; I206-F208 PolarHBondContact O-N 3.41Å; I206-K209 PolarHBondContact O-N 3.3Å; I206-Y210 WeakPolarHBondContact O-CB 3.44Å; I206-Y210 PolarHBondContact O-N 3.44Å
207	A	82.6	Confident	84	Confident	15 Å²	15	73 Å²	73	12%	0.124	37%	0.37	C	S	.	.	H	α-helix	trans	-61	-42.5	177.4	0	0	0	0	0	111.1	L203 F204 Y210 F211	L203-A207 WeakPolarHBondContact O-CB 3.46Å; L203-A207 PolarHBondContact O-N 3.29Å; F204-A207 PolarHBondContact O-N 2.87Å; A207-Y210 PolarHBondContact O-N 2.96Å; A207-F211 HydrophobicContact CB-CD2 4.2Å; A207-F211 HydrophobicContact CB-CE2 4.42Å; A207-F211 WeakPolarHBondContact O-CB 3.46Å; A207-F211 VanDerWaalsContact O-CD2 3.28Å; A207-F211 WeakPolarHBondContact O-CD2 3.47Å; A207-F211 PolarHBondContact O-N 3.11Å
208	F	80.3	Confident	84.4	Confident	92 Å²	92	72.9 Å²	72.9	40%	0.404	37%	0.371	S	S	.	.	H	α-helix	trans	-56.6	-55.3	175.4	-175.8	-87.5	0	0	0	111	F204 G205 I206 Y210 H212 F267	F204-F208 WeakPolarHBondContact O-CB 3.32Å; F204-F208 PolarHBondContact O-N 2.98Å; G205-F208 PolarHBondContact O-N 3.24Å; I206-F208 VanDerWaalsContact C-N 3.32Å; I206-F208 PolarHBondContact O-N 3.41Å; F208-Y210 PolarHBondContact O-N 2.68Å; F208-H212 WeakPolarHBondContact O-CB 3.15Å; F208-H212 PolarHBondContact O-N 3.34Å; F208-F267 HydrophobicContact CB-CE1 4.11Å; F208-F267 HydrophobicContact CB-CZ 4.04Å; F208-F267 HydrophobicContact CD2-CE1 4.18Å; F208-F267 AromaticContact CD2-CE2 3.76Å; F208-F267 HydrophobicContact CD2-CE2 3.76Å; F208-F267 AromaticContact CD2-CZ 3.31Å; F208-F267 HydrophobicContact CD2-CZ 3.31Å; F208-F267 HydrophobicContact CE2-CE2 4.17Å; F208-F267 HydrophobicContact CE2-CZ 4.07Å; F208-F267 HydrophobicContact CG-CZ 4.02Å
209	K	81.9	Confident	84.8	Confident	175 Å²	175	71.2 Å²	71.2	76%	0.761	36%	0.358	S	S	*	.	H	α-helix	trans	-58.1	-45.5	179.8	-175.7	179.1	178.5	-179.5	0	112.3	G205 I206 G213	G205-K209 PolarHBondContact O-N 3.12Å; I206-K209 PolarHBondContact O-N 3.3Å; K209-G213 PolarHBondContact O-N 3.03Å
210	Y	89.4	Confident	85.1	Confident	125 Å²	125	69.3 Å²	69.3	49%	0.49	35%	0.353	S	S	.	.	H	α-helix	trans	-69.2	-53.2	-175.6	-178.9	-95	0	0	0	113.1	I206 A207 F208 K214	I206-Y210 WeakPolarHBondContact O-CB 3.44Å; I206-Y210 PolarHBondContact O-N 3.44Å; A207-Y210 PolarHBondContact O-N 2.96Å; F208-Y210 PolarHBondContact O-N 2.68Å; Y210-K214 HydrophobicContact CE1-CD 3.93Å; Y210-K214 PolarHBondContact O-N 3.48Å; Y210-K214 WeakPolarHBondContact OH-CE 3.37Å; Y210-K214 PolarHBondContact OH-NZ 3.2Å
211	F	88.6	Confident	85.4	Confident	49 Å²	49	76 Å²	76	22%	0.215	38%	0.378	C	S	.	.	H	α-helix	trans	-74	-39.5	-175.7	-73.1	-69.3	0	0	0	112.1	A207 K214 E215 K262 K263 A266	A207-F211 HydrophobicContact CB-CD2 4.2Å; A207-F211 HydrophobicContact CB-CE2 4.42Å; A207-F211 WeakPolarHBondContact O-CB 3.46Å; A207-F211 VanDerWaalsContact O-CD2 3.28Å; A207-F211 WeakPolarHBondContact O-CD2 3.47Å; A207-F211 PolarHBondContact O-N 3.11Å; F211-K214 PolarHBondContact O-N 3.45Å; F211-E215 PolarHBondContact O-N 3.23Å; F211-K262 HydrophobicContact CD1-CB 4.23Å; F211-K262 HydrophobicContact CE1-CB 4.01Å; F211-K263 HydrophobicContact CB-CB 3.88Å; F211-K263 HydrophobicContact CB-CG 4.11Å; F211-A266 HydrophobicContact CD2-CB 3.67Å; F211-A266 HydrophobicContact CE2-CB 3.45Å; F211-A266 VanDerWaalsContact CE2-CB 3.45Å; F211-A266 HydrophobicContact CZ-CB 4.13Å
212	H	81.9	Confident	86	Confident	71 Å²	71	72.9 Å²	72.9	33%	0.329	36%	0.364	S	S	.	.	H	α-helix	trans	-64.1	-42.1	177.6	-170.1	53.4	0	0	0	111.8	F208 K214 E215 I216	F208-H212 WeakPolarHBondContact O-CB 3.15Å; F208-H212 PolarHBondContact O-N 3.34Å; H212-K214 PolarHBondContact O-N 3.08Å; H212-E215 IonicContact ND1-OE2 3.21Å; H212-E215 PolarHBondContact O-N 3.5Å; H212-I216 WeakPolarHBondContact O-CG1 3.43Å; H212-I216 PolarHBondContact O-N 2.85Å; H212-I216 VanDerWaalsContact O-N 3.08Å
213	G	86.4	Confident	86.4	Confident	39 Å²	39	71.5 Å²	71.5	40%	0.402	35%	0.354	S	S	.	.	H	α-helix	trans	-62.7	-40	175.6	0	0	0	0	0	113.3	K209 K217	K209-G213 PolarHBondContact O-N 3.03Å; G213-K217 WeakPolarHBondContact O-CB 3.48Å; G213-K217 PolarHBondContact O-N 3.47Å; G213-K217 VanDerWaalsContact O-N 3.13Å
214	K	90.7	Very high	86.8	Confident	91 Å²	91	71.3 Å²	71.3	40%	0.396	36%	0.356	S	S	.	.	H	α-helix	trans	-66.7	-39.2	175.7	-80.7	-169.4	168.2	-171	0	113.1	Y210 F211 H212 K217 A218 M259	Y210-K214 HydrophobicContact CE1-CD 3.93Å; Y210-K214 PolarHBondContact O-N 3.48Å; Y210-K214 WeakPolarHBondContact OH-CE 3.37Å; Y210-K214 PolarHBondContact OH-NZ 3.2Å; F211-K214 PolarHBondContact O-N 3.45Å; H212-K214 PolarHBondContact O-N 3.08Å; K214-K217 PolarHBondContact O-N 3.17Å; K214-A218 WeakPolarHBondContact O-CB 3.33Å; K214-A218 PolarHBondContact O-N 3.09Å; K214-M259 HydrophobicContact CB-SD 4.38Å; K214-M259 HydrophobicContact CD-SD 4.36Å
215	E	87.7	Confident	87.2	Confident	35 Å²	35	68.6 Å²	68.6	16%	0.164	35%	0.345	C	S	.	.	H	α-helix	trans	-61.2	-50.4	175.6	178.5	-168.5	-167.3	0	0	111.4	F211 H212 K217 A218 Y219 K263	F211-E215 PolarHBondContact O-N 3.23Å; H212-E215 IonicContact ND1-OE2 3.21Å; H212-E215 PolarHBondContact O-N 3.5Å; E215-K217 VanDerWaalsContact C-N 3.3Å; E215-K217 PolarHBondContact O-N 2.95Å; E215-A218 PolarHBondContact O-N 2.96Å; E215-Y219 PolarHBondContact O-N 3.28Å; E215-K263 IonicContact OE1-NZ 3.15Å; E215-K263 PolarHBondContact OE1-NZ 3.09Å; E215-K263 WeakPolarHBondContact OE2-CD 3.07Å; E215-K263 WeakPolarHBondContact OE2-CE 3.41Å; E215-K263 IonicContact OE2-NZ 3.37Å; E215-K263 PolarHBondContact OE2-NZ 2.95Å
216	I	87.9	Confident	87.9	Confident	94 Å²	94	66.8 Å²	66.8	48%	0.482	33%	0.326	S	S	.	.	H	α-helix	trans	-58.2	-44.8	178.9	-68.4	170	0	0	0	110.4	H212 Y219 S220	H212-I216 WeakPolarHBondContact O-CG1 3.43Å; H212-I216 PolarHBondContact O-N 2.85Å; H212-I216 VanDerWaalsContact O-N 3.08Å; I216-Y219 PolarHBondContact O-N 2.72Å; I216-S220 WeakPolarHBondContact O-CB 3.35Å; I216-S220 PolarHBondContact O-N 3.44Å
217	K	90	Very high	88.2	Confident	140 Å²	140	64.6 Å²	64.6	61%	0.609	32%	0.316	S	S	*	.	H	α-helix	trans	-67.2	-34.5	178.7	-171.1	173.5	-176.8	173	0	113.4	G213 K214 E215 S220	G213-K217 WeakPolarHBondContact O-CB 3.48Å; G213-K217 PolarHBondContact O-N 3.47Å; G213-K217 VanDerWaalsContact O-N 3.13Å; K214-K217 PolarHBondContact O-N 3.17Å; E215-K217 VanDerWaalsContact C-N 3.3Å; E215-K217 PolarHBondContact O-N 2.95Å; K217-S220 PolarHBondContact O-OG 3.43Å
218	A	89	Confident	88.5	Confident	11 Å²	11	65.4 Å²	65.4	9%	0.091	32%	0.317	C	S	.	.	H	α-helix	trans	-68.6	-41.9	174.4	0	0	0	0	0	110.9	K214 E215 A256 M259	K214-A218 WeakPolarHBondContact O-CB 3.33Å; K214-A218 PolarHBondContact O-N 3.09Å; E215-A218 PolarHBondContact O-N 2.96Å; A218-A256 HydrophobicContact CB-CB 4.24Å; A218-M259 HydrophobicContact CB-CG 4.25Å
219	Y	90.4	Very high	89.1	Confident	26 Å²	26	61 Å²	61	10%	0.102	30%	0.298	C	S	.	.	H	α-helix	trans	-73.1	-30.3	178.8	-175.2	-115.2	0	0	0	113.7	E215 I216 R221 A222 C223 L253 R767 L796 S797	E215-Y219 PolarHBondContact O-N 3.28Å; I216-Y219 PolarHBondContact O-N 2.72Å; Y219-R221 PolarHBondContact O-N 3.09Å; Y219-A222 HydrophobicContact CD2-CB 4.25Å; Y219-A222 HydrophobicContact CE2-CB 4.34Å; Y219-A222 WeakPolarHBondContact O-CB 3.45Å; Y219-A222 PolarHBondContact O-N 3.29Å; Y219-A222 VanDerWaalsContact O-N 3.1Å; Y219-C223 WeakPolarHBondContact CE1-SG 3.48Å; Y219-C223 PolarHBondContact O-N 3.2Å; Y219-C223 PolarHBondContact O-SG 3Å; Y219-L253 HydrophobicContact CD2-CD2 4.25Å; Y219-L253 HydrophobicContact CE2-CD2 3.99Å; Y219-R767 VanDerWaalsContact CD2-NH1 3.28Å; Y219-R767 PolarHBondContact OH-NE 2.95Å; Y219-L796 PolarHBondContact OH-O 2.9Å; Y219-S797 WeakPolarHBondContact OH-CA 3.17Å; Y219-S797 WeakPolarHBondContact OH-CB 3.16Å; Y219-S797 PolarHBondContact OH-N 3.46Å
220	S	90.6	Very high	89.6	Confident	53 Å²	53	52.8 Å²	52.8	37%	0.371	26%	0.262	S	S	.	.	H	α-helix	trans	-60.3	-34.2	178.3	74.2	0	0	0	0	112.2	I216 K217 C223 T224	I216-S220 WeakPolarHBondContact O-CB 3.35Å; I216-S220 PolarHBondContact O-N 3.44Å; K217-S220 PolarHBondContact O-OG 3.43Å; S220-C223 WeakPolarHBondContact O-CB 2.98Å; S220-C223 PolarHBondContact O-N 3.18Å; S220-C223 VanDerWaalsContact O-N 3.16Å; S220-T224 PolarHBondContact O-N 3.35Å; S220-T224 PolarHBondContact O-OG1 3.34Å; S220-T224 VanDerWaalsContact O-OG1 3.1Å
221	R	89.6	Confident	89.6	Confident	142 Å²	142	50 Å²	50	54%	0.536	26%	0.261	S	S	.	.	H	α-helix	trans	-62.4	-43.1	174.3	-65.2	177.1	177.3	179.8	-4.5	112.4	Y219 C223 T224 I225 E252	Y219-R221 PolarHBondContact O-N 3.09Å; R221-C223 VanDerWaalsContact C-N 3.3Å; R221-C223 PolarHBondContact O-N 3.15Å; R221-T224 PolarHBondContact O-N 2.61Å; R221-I225 PolarHBondContact O-N 2.89Å; R221-E252 HydrophobicContact CB-CG 4.32Å; R221-E252 WeakPolarHBondContact CB-OE2 3.02Å; R221-E252 WeakPolarHBondContact CD-OE2 3.32Å
222	A	91.1	Very high	89.7	Confident	0 Å²	0	48 Å²	48	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-63.4	-38.4	173.6	0	0	0	0	0	111.1	Y219 I225 S226 Y249 E252 L253	Y219-A222 HydrophobicContact CD2-CB 4.25Å; Y219-A222 HydrophobicContact CE2-CB 4.34Å; Y219-A222 WeakPolarHBondContact O-CB 3.45Å; Y219-A222 PolarHBondContact O-N 3.29Å; Y219-A222 VanDerWaalsContact O-N 3.1Å; A222-I225 PolarHBondContact O-N 3.01Å; A222-S226 PolarHBondContact O-N 3.45Å; A222-S226 PolarHBondContact O-OG 2.96Å; A222-Y249 HydrophobicContact CB-CD2 4.1Å; A222-Y249 HydrophobicContact CB-CE2 3.76Å; A222-Y249 WeakPolarHBondContact O-CD2 3.49Å; A222-Y249 VanDerWaalsContact O-CE2 3.25Å; A222-Y249 WeakPolarHBondContact O-CE2 3.33Å; A222-E252 HydrophobicContact CB-CB 3.89Å; A222-L253 HydrophobicContact CB-CD2 4.18Å
223	C	91.3	Very high	90.3	Very high	26 Å²	26	45.1 Å²	45.1	18%	0.176	24%	0.24	C	C	.	.	H	α-helix	trans	-62.2	-46.2	175.5	-67.2	0	0	0	0	112.2	Y219 S220 R221 I225 S226 N227 T793	Y219-C223 WeakPolarHBondContact CE1-SG 3.48Å; Y219-C223 PolarHBondContact O-N 3.2Å; Y219-C223 PolarHBondContact O-SG 3Å; S220-C223 WeakPolarHBondContact O-CB 2.98Å; S220-C223 PolarHBondContact O-N 3.18Å; S220-C223 VanDerWaalsContact O-N 3.16Å; R221-C223 VanDerWaalsContact C-N 3.3Å; R221-C223 PolarHBondContact O-N 3.15Å; C223-I225 VanDerWaalsContact C-N 3.32Å; C223-I225 PolarHBondContact O-N 3Å; C223-S226 WeakPolarHBondContact CA-OG 3.34Å; C223-S226 PolarHBondContact O-N 3.03Å; C223-S226 VanDerWaalsContact O-N 3.16Å; C223-S226 PolarHBondContact O-OG 2.89Å; C223-N227 WeakPolarHBondContact O-CB 3.27Å; C223-N227 PolarHBondContact O-N 3.41Å; C223-T793 HydrophobicContact CB-CG2 4.34Å
224	T	89.5	Confident	90.5	Very high	82 Å²	82	48.9 Å²	48.9	50%	0.503	24%	0.242	S	C	.	.	H	α-helix	trans	-55.9	-47.4	176.7	-54.4	0	0	0	0	111.1	S220 R221 N227 E228	S220-T224 PolarHBondContact O-N 3.35Å; S220-T224 PolarHBondContact O-OG1 3.34Å; S220-T224 VanDerWaalsContact O-OG1 3.1Å; R221-T224 PolarHBondContact O-N 2.61Å; T224-N227 PolarHBondContact O-N 3.24Å; T224-E228 WeakPolarHBondContact O-CB 3.46Å; T224-E228 PolarHBondContact O-N 2.97Å
225	I	90.2	Very high	90.6	Very high	21 Å²	21	45.2 Å²	45.2	11%	0.108	23%	0.227	C	C	.	.	H	α-helix	trans	-60.1	-48.3	175.8	-70.1	165.9	0	0	0	111.2	R221 A222 C223 N227 E228 V229 R248 Y249 E252	R221-I225 PolarHBondContact O-N 2.89Å; A222-I225 PolarHBondContact O-N 3.01Å; C223-I225 VanDerWaalsContact C-N 3.32Å; C223-I225 PolarHBondContact O-N 3Å; I225-N227 VanDerWaalsContact C-N 3.31Å; I225-N227 PolarHBondContact O-N 3.34Å; I225-E228 PolarHBondContact O-N 3.1Å; I225-V229 HydrophobicContact CG2-CG2 4.29Å; I225-V229 WeakPolarHBondContact O-CB 3.33Å; I225-V229 WeakPolarHBondContact O-CG2 3.36Å; I225-V229 PolarHBondContact O-N 3.17Å; I225-R248 HydrophobicContact CD1-CG 4.18Å; I225-Y249 HydrophobicContact CG2-CD2 4.35Å; I225-E252 HydrophobicContact CD1-CB 4.26Å; I225-E252 HydrophobicContact CD1-CG 3.41Å; I225-E252 VanDerWaalsContact CD1-CG 3.41Å
226	S	92	Very high	90.8	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-62.3	-39.7	-179.2	69	0	0	0	0	112	A222 C223 V229 L230	A222-S226 PolarHBondContact O-N 3.45Å; A222-S226 PolarHBondContact O-OG 2.96Å; C223-S226 WeakPolarHBondContact CA-OG 3.34Å; C223-S226 PolarHBondContact O-N 3.03Å; C223-S226 VanDerWaalsContact O-N 3.16Å; C223-S226 PolarHBondContact O-OG 2.89Å; S226-V229 PolarHBondContact O-N 2.88Å; S226-L230 VanDerWaalsContact O-CB 3.24Å; S226-L230 WeakPolarHBondContact O-CB 3.48Å; S226-L230 WeakPolarHBondContact O-CD1 3.34Å; S226-L230 WeakPolarHBondContact O-CG 3.42Å; S226-L230 PolarHBondContact O-N 2.86Å
227	N	90.2	Very high	91	Very high	70 Å²	70	39.3 Å²	39.3	37%	0.374	20%	0.198	S	C	.	.	H	α-helix	trans	-67.7	-44.2	179.6	-171.9	50.3	0	0	0	111.3	C223 T224 I225 S231 T793	C223-N227 WeakPolarHBondContact O-CB 3.27Å; C223-N227 PolarHBondContact O-N 3.41Å; T224-N227 PolarHBondContact O-N 3.24Å; I225-N227 VanDerWaalsContact C-N 3.31Å; I225-N227 PolarHBondContact O-N 3.34Å; N227-S231 VanDerWaalsContact O-CB 3.28Å; N227-S231 WeakPolarHBondContact O-CB 3.36Å; N227-S231 PolarHBondContact O-N 2.92Å; N227-S231 PolarHBondContact O-OG 2.92Å; N227-T793 HydrophobicContact CB-CG2 4.44Å
228	E	90.2	Very high	91	Very high	31 Å²	31	32.9 Å²	32.9	15%	0.145	17%	0.171	C	C	.	.	H	α-helix	trans	-59.3	-45.6	175.3	-177	-169.1	174.7	0	0	112	T224 I225 S231 S232 R248 F1101 N1102	T224-E228 WeakPolarHBondContact O-CB 3.46Å; T224-E228 PolarHBondContact O-N 2.97Å; I225-E228 PolarHBondContact O-N 3.1Å; E228-S231 PolarHBondContact O-OG 2.88Å; E228-S232 WeakPolarHBondContact O-CB 3.28Å; E228-S232 PolarHBondContact O-N 2.9Å; E228-S232 VanDerWaalsContact O-N 3.14Å; E228-S232 PolarHBondContact O-OG 2.85Å; E228-R248 IonicContact OE1-NH2 3.62Å; E228-R248 IonicContact OE2-CZ 3.54Å; E228-R248 IonicContact OE2-NH1 2.6Å; E228-R248 IonicContact OE2-NH2 2.74Å; E228-R248 PolarHBondContact OE2-NH2 3.11Å; E228-F1101 HydrophobicContact CG-CD1 4.25Å; E228-F1101 WeakPolarHBondContact OE1-CA 3.45Å; E228-F1101 VanDerWaalsContact OE1-CB 3.24Å; E228-F1101 WeakPolarHBondContact OE1-CB 3.49Å; E228-F1101 WeakPolarHBondContact OE1-CD1 3.41Å; E228-N1102 PolarHBondContact OE1-N 2.73Å
229	V	92.7	Very high	91.1	Very high	0 Å²	0	33 Å²	33	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-69.3	-43.9	-178.9	171.8	0	0	0	0	111.1	I225 S226 S232 I233 V236 E245 F771 L775	I225-V229 HydrophobicContact CG2-CG2 4.29Å; I225-V229 WeakPolarHBondContact O-CB 3.33Å; I225-V229 WeakPolarHBondContact O-CG2 3.36Å; I225-V229 PolarHBondContact O-N 3.17Å; S226-V229 PolarHBondContact O-N 2.88Å; V229-S232 CarbonylContact O-C 3.53Å; V229-S232 PolarHBondContact O-N 2.89Å; V229-I233 WeakPolarHBondContact O-CA 3.43Å; V229-I233 PolarHBondContact O-N 2.8Å; V229-V236 HydrophobicContact CG1-CG2 4.18Å; V229-E245 HydrophobicContact CG1-CB 4Å; V229-E245 HydrophobicContact CG1-CG 4.16Å; V229-E245 HydrophobicContact CG2-CB 3.86Å; V229-E245 HydrophobicContact CG2-CG 3.75Å; V229-E245 VanDerWaalsContact CG2-OE2 3.27Å; V229-E245 WeakPolarHBondContact CG2-OE2 3.2Å; V229-F771 HydrophobicContact CB-CZ 4.12Å; V229-F771 HydrophobicContact CG1-CE2 4.47Å; V229-F771 HydrophobicContact CG1-CZ 3.84Å; V229-L775 HydrophobicContact CG1-CD2 3.69Å
230	L	92.2	Very high	91.1	Very high	2 Å²	2	32.7 Å²	32.7	1%	0.01	17%	0.173	C	C	.	.	H	α-helix	trans	-71.3	-35.2	-178.9	-68	168.5	0	0	0	112.2	S226 S232 F771 F782 P789 L792 L796	S226-L230 VanDerWaalsContact O-CB 3.24Å; S226-L230 WeakPolarHBondContact O-CB 3.48Å; S226-L230 WeakPolarHBondContact O-CD1 3.34Å; S226-L230 WeakPolarHBondContact O-CG 3.42Å; S226-L230 PolarHBondContact O-N 2.86Å; L230-S232 VanDerWaalsContact C-N 3.26Å; L230-S232 PolarHBondContact O-N 2.84Å; L230-F771 HydrophobicContact CG-CE2 4.37Å; L230-F782 HydrophobicContact CD2-CE1 3.86Å; L230-P789 HydrophobicContact CB-CB 4Å; L230-L792 HydrophobicContact CD1-CB 3.76Å; L230-L792 HydrophobicContact CD2-CD1 4.11Å; L230-L796 HydrophobicContact CD1-CD1 4.29Å
231	S	89.9	Confident	91	Very high	68 Å²	68	30.1 Å²	30.1	48%	0.476	16%	0.156	S	C	.	.	H	α-helix	trans	-68.5	-29.3	173.1	66.7	0	0	0	0	112.4	N227 E228	N227-S231 VanDerWaalsContact O-CB 3.28Å; N227-S231 WeakPolarHBondContact O-CB 3.36Å; N227-S231 PolarHBondContact O-N 2.92Å; N227-S231 PolarHBondContact O-OG 2.92Å; E228-S231 PolarHBondContact O-OG 2.88Å
232	S	90.8	Very high	91.2	Very high	6 Å²	6	24.7 Å²	24.7	4%	0.042	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.1	20.2	-176.9	-43.6	0	0	0	0	112.9	E228 V229 L230 R234 T235 V236 I1099	E228-S232 WeakPolarHBondContact O-CB 3.28Å; E228-S232 PolarHBondContact O-N 2.9Å; E228-S232 VanDerWaalsContact O-N 3.14Å; E228-S232 PolarHBondContact O-OG 2.85Å; V229-S232 CarbonylContact O-C 3.53Å; V229-S232 PolarHBondContact O-N 2.89Å; L230-S232 VanDerWaalsContact C-N 3.26Å; L230-S232 PolarHBondContact O-N 2.84Å; S232-R234 VanDerWaalsContact C-N 3.25Å; S232-R234 PolarHBondContact O-N 2.91Å; S232-R234 VanDerWaalsContact O-N 3.15Å; S232-T235 WeakPolarHBondContact O-CA 3.42Å; S232-T235 WeakPolarHBondContact O-CB 3.34Å; S232-T235 PolarHBondContact O-N 3.1Å; S232-V236 PolarHBondContact O-N 2.77Å; S232-I1099 WeakPolarHBondContact OG-CG2 3.48Å
233	I	93.4	Very high	91.2	Very high	11 Å²	11	32.5 Å²	32.5	6%	0.056	17%	0.17	C	C	.	.	H	α-helix	trans	-58.7	-35.1	-167.7	-170.4	60.8	0	0	0	113.1	V229 T235 V236 I237 L775 F782	V229-I233 WeakPolarHBondContact O-CA 3.43Å; V229-I233 PolarHBondContact O-N 2.8Å; I233-T235 VanDerWaalsContact C-N 3.31Å; I233-T235 PolarHBondContact O-N 2.84Å; I233-V236 PolarHBondContact O-N 2.81Å; I233-I237 HydrophobicContact CD1-CD1 4.01Å; I233-I237 HydrophobicContact CD1-CG1 4.03Å; I233-I237 HydrophobicContact CG1-CD1 3.73Å; I233-I237 HydrophobicContact CG1-CG1 4.16Å; I233-I237 WeakPolarHBondContact O-CB 3.49Å; I233-I237 VanDerWaalsContact O-CG1 3.28Å; I233-I237 WeakPolarHBondContact O-CG1 3.35Å; I233-I237 PolarHBondContact O-N 3.49Å; I233-L775 HydrophobicContact CD1-CD2 3.67Å; I233-F782 HydrophobicContact CD1-CE2 4.31Å; I233-F782 HydrophobicContact CD1-CZ 4.01Å; I233-F782 HydrophobicContact CG1-CD1 4.39Å; I233-F782 HydrophobicContact CG1-CD2 4.07Å; I233-F782 HydrophobicContact CG1-CE1 4.05Å; I233-F782 HydrophobicContact CG1-CE2 3.7Å; I233-F782 HydrophobicContact CG1-CG 4.39Å; I233-F782 HydrophobicContact CG1-CZ 3.68Å; I233-F782 HydrophobicContact CG2-CB 4.38Å; I233-F782 HydrophobicContact CG2-CD1 4.24Å; I233-F782 HydrophobicContact CG2-CD2 4.41Å; I233-F782 HydrophobicContact CG2-CG 4.09Å
234	R	91.4	Very high	91.2	Very high	117 Å²	117	35.3 Å²	35.3	44%	0.442	18%	0.177	S	C	.	.	H	α-helix	trans	-61.2	-40.7	176.8	-58.7	-168.1	174.4	159.6	-1.1	111.4	S232 A238 I779 D783	S232-R234 VanDerWaalsContact C-N 3.25Å; S232-R234 PolarHBondContact O-N 2.91Å; S232-R234 VanDerWaalsContact O-N 3.15Å; R234-A238 VanDerWaalsContact O-CB 3.26Å; R234-A238 WeakPolarHBondContact O-CB 3.46Å; R234-A238 PolarHBondContact O-N 2.98Å; R234-I779 HydrophobicContact CB-CD1 4.41Å; R234-I779 HydrophobicContact CG-CD1 4.08Å; R234-I779 HydrophobicContact CG-CG2 4.32Å; R234-D783 IonicContact CZ-OD1 2.67Å; R234-D783 IonicContact NH2-OD1 2.78Å; R234-D783 PolarHBondContact NH2-OD1 2.95Å
235	T	91.9	Very high	91.4	Very high	15 Å²	15	31.5 Å²	31.5	9%	0.092	15%	0.154	C	C	.	.	H	α-helix	trans	-69.5	-46	175.2	-52.3	0	0	0	0	110.7	S232 I233 I237 A238 F239 F1101	S232-T235 WeakPolarHBondContact O-CA 3.42Å; S232-T235 WeakPolarHBondContact O-CB 3.34Å; S232-T235 PolarHBondContact O-N 3.1Å; I233-T235 VanDerWaalsContact C-N 3.31Å; I233-T235 PolarHBondContact O-N 2.84Å; T235-I237 VanDerWaalsContact C-N 3.32Å; T235-I237 PolarHBondContact O-N 2.86Å; T235-A238 PolarHBondContact O-N 2.92Å; T235-F239 HydrophobicContact CG2-CD2 3.75Å; T235-F239 HydrophobicContact CG2-CE2 3.96Å; T235-F239 VanDerWaalsContact O-CD2 3.26Å; T235-F239 WeakPolarHBondContact O-CD2 3.37Å; T235-F239 PolarHBondContact O-N 2.76Å; T235-F239 VanDerWaalsContact O-N 3.1Å; T235-F1101 HydrophobicContact CG2-CE2 4.25Å; T235-F1101 HydrophobicContact CG2-CZ 4.14Å
236	V	92.6	Very high	91.5	Very high	0 Å²	0	31 Å²	31	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-57.6	-46.3	179.6	177.2	0	0	0	0	111	V229 S232 I233 F239 G240 G241 E245 F1101	V229-V236 HydrophobicContact CG1-CG2 4.18Å; S232-V236 PolarHBondContact O-N 2.77Å; I233-V236 PolarHBondContact O-N 2.81Å; V236-F239 PolarHBondContact O-N 2.89Å; V236-G240 PolarHBondContact O-N 3.43Å; V236-G241 PolarHBondContact O-N 2.7Å; V236-E245 HydrophobicContact CG1-CG 4.01Å; V236-E245 HydrophobicContact CG2-CG 4.41Å; V236-F1101 HydrophobicContact CG2-CE1 3.95Å; V236-F1101 HydrophobicContact CG2-CZ 3.83Å
237	I	91.8	Very high	91.6	Very high	4 Å²	4	35.5 Å²	35.5	2%	0.021	18%	0.176	C	C	.	.	H	α-helix	trans	-67.4	-41.4	178.4	-67.2	177.9	0	0	0	111.5	I233 T235 F239 G240 E242 I779 F1060 R1088	I233-I237 HydrophobicContact CD1-CD1 4.01Å; I233-I237 HydrophobicContact CD1-CG1 4.03Å; I233-I237 HydrophobicContact CG1-CD1 3.73Å; I233-I237 HydrophobicContact CG1-CG1 4.16Å; I233-I237 WeakPolarHBondContact O-CB 3.49Å; I233-I237 VanDerWaalsContact O-CG1 3.28Å; I233-I237 WeakPolarHBondContact O-CG1 3.35Å; I233-I237 PolarHBondContact O-N 3.49Å; T235-I237 VanDerWaalsContact C-N 3.32Å; T235-I237 PolarHBondContact O-N 2.86Å; I237-F239 VanDerWaalsContact C-N 3.25Å; I237-F239 PolarHBondContact O-N 3.05Å; I237-G240 PolarHBondContact O-N 3.05Å; I237-E242 HydrophobicContact CG1-CG 4.47Å; I237-I779 HydrophobicContact CD1-CD1 4.42Å; I237-I779 HydrophobicContact CD1-CG1 4.09Å; I237-F1060 HydrophobicContact CB-CE1 4.49Å; I237-F1060 HydrophobicContact CG2-CD1 4.33Å; I237-F1060 HydrophobicContact CG2-CE1 3.82Å; I237-R1088 VanDerWaalsContact O-CD 3.27Å; I237-R1088 WeakPolarHBondContact O-CD 3.46Å
238	A	90.5	Very high	91.7	Very high	5 Å²	5	34.8 Å²	34.8	4%	0.041	17%	0.168	C	C	.	.	H	α-helix	trans	-62.7	-30.1	178.7	0	0	0	0	0	113.8	R234 T235 F1060 I1093 R1170	R234-A238 VanDerWaalsContact O-CB 3.26Å; R234-A238 WeakPolarHBondContact O-CB 3.46Å; R234-A238 PolarHBondContact O-N 2.98Å; T235-A238 PolarHBondContact O-N 2.92Å; A238-F1060 HydrophobicContact CB-CZ 4.14Å; A238-I1093 HydrophobicContact CB-CG2 3.91Å; A238-R1170 PolarHBondContact O-NH1 2.82Å; A238-R1170 PolarHBondContact O-NH2 2.81Å
239	F	91.4	Very high	91.9	Very high	15 Å²	15	33.3 Å²	33.3	7%	0.066	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.1	3.9	-179.2	-73.1	-85.5	0	0	0	113.5	T235 V236 I237 G241 I1093 Y1111 G1112 N1114 R1166	T235-F239 HydrophobicContact CG2-CD2 3.75Å; T235-F239 HydrophobicContact CG2-CE2 3.96Å; T235-F239 VanDerWaalsContact O-CD2 3.26Å; T235-F239 WeakPolarHBondContact O-CD2 3.37Å; T235-F239 PolarHBondContact O-N 2.76Å; T235-F239 VanDerWaalsContact O-N 3.1Å; V236-F239 PolarHBondContact O-N 2.89Å; I237-F239 VanDerWaalsContact C-N 3.25Å; I237-F239 PolarHBondContact O-N 3.05Å; F239-G241 VanDerWaalsContact C-N 3.26Å; F239-G241 PolarHBondContact O-N 3.13Å; F239-I1093 HydrophobicContact CE2-CG2 3.99Å; F239-I1093 HydrophobicContact CZ-CG2 4.15Å; F239-Y1111 HydrophobicContact CB-CD1 3.84Å; F239-Y1111 HydrophobicContact CB-CE1 3.87Å; F239-Y1111 HydrophobicContact CG-CD1 4.18Å; F239-G1112 VanDerWaalsContact CD1-CA 3.5Å; F239-N1114 PolarHBondContact O-ND2 3.09Å; F239-R1166 HydrophobicContact CD1-CG 4.1Å; F239-R1166 HydrophobicContact CE1-CB 4.47Å; F239-R1166 HydrophobicContact CE1-CG 3.54Å; F239-R1166 HydrophobicContact CZ-CG 3.86Å
240	G	89.4	Confident	92	Very high	18 Å²	18	36.9 Å²	36.9	19%	0.186	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	62.7	32.1	-179.7	0	0	0	0	0	113.3	V236 I237 E242	V236-G240 PolarHBondContact O-N 3.43Å; I237-G240 PolarHBondContact O-N 3.05Å; G240-E242 WeakPolarHBondContact CA-OE2 3.17Å
241	G	89.6	Confident	92.1	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	21%	0.21	C	C	.	.			trans	-85	0.3	-173.5	0	0	0	0	0	114.9	V236 F239 K243 R244 E245	V236-G241 PolarHBondContact O-N 2.7Å; F239-G241 VanDerWaalsContact C-N 3.26Å; F239-G241 PolarHBondContact O-N 3.13Å; G241-K243 VanDerWaalsContact C-N 3.34Å; G241-K243 PolarHBondContact O-N 2.73Å; G241-R244 WeakPolarHBondContact O-CB 3.49Å; G241-R244 PolarHBondContact O-N 2.7Å; G241-R244 VanDerWaalsContact O-N 3.08Å; G241-E245 PolarHBondContact O-N 3.21Å
242	E	92.3	Very high	92.2	Very high	27 Å²	27	43.2 Å²	43.2	13%	0.126	20%	0.197	C	C	.	.	H	α-helix	trans	-56.6	-45.8	-169.8	-57.4	94.3	143.6	0	0	112	I237 G240 E245 S246 L775 R1088	I237-E242 HydrophobicContact CG1-CG 4.47Å; G240-E242 WeakPolarHBondContact CA-OE2 3.17Å; E242-E245 PolarHBondContact O-N 3.13Å; E242-S246 VanDerWaalsContact O-CB 3.27Å; E242-S246 WeakPolarHBondContact O-CB 3.34Å; E242-S246 PolarHBondContact O-N 3.24Å; E242-L775 HydrophobicContact CB-CB 4.26Å; E242-L775 HydrophobicContact CG-CB 4.46Å; E242-L775 WeakPolarHBondContact O-CD1 3.34Å; E242-R1088 IonicContact OE1-NH1 2.93Å
243	K	91.6	Very high	92.3	Very high	165 Å²	165	43 Å²	43	72%	0.717	20%	0.196	S	C	*	.	H	α-helix	trans	-67.4	-37.8	179.5	-171.8	177.2	-179.3	-178.5	0	112.4	G241 L247	G241-K243 VanDerWaalsContact C-N 3.34Å; G241-K243 PolarHBondContact O-N 2.73Å; K243-L247 HydrophobicContact CG-CD1 4.47Å; K243-L247 WeakPolarHBondContact O-CG 3.4Å; K243-L247 PolarHBondContact O-N 3.47Å; K243-L247 VanDerWaalsContact O-N 3.1Å
244	R	91.3	Very high	92.3	Very high	85 Å²	85	44.8 Å²	44.8	32%	0.321	21%	0.207	S	C	.	.	H	α-helix	trans	-64.9	-46.6	178.3	178.2	179.8	175.1	172.3	-0.4	110.4	G241 L247 R248 N1114	G241-R244 WeakPolarHBondContact O-CB 3.49Å; G241-R244 PolarHBondContact O-N 2.7Å; G241-R244 VanDerWaalsContact O-N 3.08Å; R244-L247 PolarHBondContact O-N 3.27Å; R244-R248 PolarHBondContact O-N 2.93Å; R244-N1114 VanDerWaalsContact CD-OD1 3.3Å; R244-N1114 WeakPolarHBondContact CD-OD1 3.19Å; R244-N1114 PolarHBondContact NH1-OD1 3.39Å
245	E	93.3	Very high	92.3	Very high	1 Å²	1	41 Å²	41	1%	0.005	20%	0.198	C	C	.	.	H	α-helix	trans	-69.4	-36.6	179.4	-64.3	-48.9	139.6	0	0	112.7	V229 V236 G241 E242 L247 R248 Y249 Y1111	V229-E245 HydrophobicContact CG1-CB 4Å; V229-E245 HydrophobicContact CG1-CG 4.16Å; V229-E245 HydrophobicContact CG2-CB 3.86Å; V229-E245 HydrophobicContact CG2-CG 3.75Å; V229-E245 VanDerWaalsContact CG2-OE2 3.27Å; V229-E245 WeakPolarHBondContact CG2-OE2 3.2Å; V236-E245 HydrophobicContact CG1-CG 4.01Å; V236-E245 HydrophobicContact CG2-CG 4.41Å; G241-E245 PolarHBondContact O-N 3.21Å; E242-E245 PolarHBondContact O-N 3.13Å; E245-L247 PolarHBondContact O-N 2.85Å; E245-R248 PolarHBondContact O-N 3.43Å; E245-R248 IonicContact OE2-CZ 2.57Å; E245-R248 IonicContact OE2-NE 2.71Å; E245-R248 PolarHBondContact OE2-NE 3.04Å; E245-R248 IonicContact OE2-NH1 3.11Å; E245-R248 PolarHBondContact OE2-NH1 3.39Å; E245-R248 IonicContact OE2-NH2 2.68Å; E245-Y249 WeakPolarHBondContact O-CB 3.44Å; E245-Y249 PolarHBondContact O-N 3.38Å; E245-Y1111 WeakPolarHBondContact CG-OH 3.49Å; E245-Y1111 VanDerWaalsContact OE1-CE2 3.26Å; E245-Y1111 WeakPolarHBondContact OE1-CE2 3.28Å; E245-Y1111 PolarHBondContact OE1-OH 3.43Å; E245-Y1111 VanDerWaalsContact OE1-OH 3.05Å
246	S	93.9	Very high	92.3	Very high	12 Å²	12	40.6 Å²	40.6	8%	0.084	20%	0.197	C	C	.	.	H	α-helix	trans	-58.1	-46.5	172.4	-172.8	0	0	0	0	111.6	E242 Y249 Q250 D772	E242-S246 VanDerWaalsContact O-CB 3.27Å; E242-S246 WeakPolarHBondContact O-CB 3.34Å; E242-S246 PolarHBondContact O-N 3.24Å; S246-Y249 PolarHBondContact O-N 2.88Å; S246-Q250 WeakPolarHBondContact O-CB 3.4Å; S246-Q250 PolarHBondContact O-N 3.29Å; S246-D772 PolarHBondContact OG-OD1 3.24Å
247	L	93.8	Very high	92.4	Very high	94 Å²	94	41.5 Å²	41.5	49%	0.492	20%	0.201	S	C	.	.	H	α-helix	trans	-66.1	-39.6	175.6	-71.3	170.7	0	0	0	112.7	K243 R244 E245 Y249 Q250 K251	K243-L247 HydrophobicContact CG-CD1 4.47Å; K243-L247 WeakPolarHBondContact O-CG 3.4Å; K243-L247 PolarHBondContact O-N 3.47Å; K243-L247 VanDerWaalsContact O-N 3.1Å; R244-L247 PolarHBondContact O-N 3.27Å; E245-L247 PolarHBondContact O-N 2.85Å; L247-Y249 VanDerWaalsContact C-N 3.35Å; L247-Q250 PolarHBondContact O-N 3.49Å; L247-K251 PolarHBondContact O-N 3.37Å
248	R	92.4	Very high	92.4	Very high	55 Å²	55	45.8 Å²	45.8	21%	0.208	22%	0.223	C	C	.	.	H	α-helix	trans	-59.5	-46.6	176.4	-162.2	178.8	81.8	167.1	11.8	110.9	I225 E228 R244 E245 K251 E252	I225-R248 HydrophobicContact CD1-CG 4.18Å; E228-R248 IonicContact OE1-NH2 3.62Å; E228-R248 IonicContact OE2-CZ 3.54Å; E228-R248 IonicContact OE2-NH1 2.6Å; E228-R248 IonicContact OE2-NH2 2.74Å; E228-R248 PolarHBondContact OE2-NH2 3.11Å; R244-R248 PolarHBondContact O-N 2.93Å; E245-R248 PolarHBondContact O-N 3.43Å; E245-R248 IonicContact OE2-CZ 2.57Å; E245-R248 IonicContact OE2-NE 2.71Å; E245-R248 PolarHBondContact OE2-NE 3.04Å; E245-R248 IonicContact OE2-NH1 3.11Å; E245-R248 PolarHBondContact OE2-NH1 3.39Å; E245-R248 IonicContact OE2-NH2 2.68Å; R248-K251 PolarHBondContact O-N 2.78Å; R248-E252 PolarHBondContact O-N 2.87Å
249	Y	94.1	Very high	92.5	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-64.2	-44.3	175.8	-176.2	-112.3	0	0	0	112.2	A222 I225 E245 S246 L247 K251 E252 L253 R767 F771	A222-Y249 HydrophobicContact CB-CD2 4.1Å; A222-Y249 HydrophobicContact CB-CE2 3.76Å; A222-Y249 WeakPolarHBondContact O-CD2 3.49Å; A222-Y249 VanDerWaalsContact O-CE2 3.25Å; A222-Y249 WeakPolarHBondContact O-CE2 3.33Å; I225-Y249 HydrophobicContact CG2-CD2 4.35Å; E245-Y249 WeakPolarHBondContact O-CB 3.44Å; E245-Y249 PolarHBondContact O-N 3.38Å; S246-Y249 PolarHBondContact O-N 2.88Å; L247-Y249 VanDerWaalsContact C-N 3.35Å; Y249-K251 VanDerWaalsContact C-N 3.29Å; Y249-K251 PolarHBondContact O-N 2.7Å; Y249-E252 PolarHBondContact O-N 3.07Å; Y249-L253 HydrophobicContact CD1-CD1 3.7Å; Y249-L253 HydrophobicContact CD1-CG 4.16Å; Y249-L253 HydrophobicContact CE1-CD1 3.39Å; Y249-L253 HydrophobicContact CE1-CD2 4.25Å; Y249-L253 HydrophobicContact CE1-CG 3.9Å; Y249-L253 WeakPolarHBondContact O-CG 3.43Å; Y249-L253 PolarHBondContact O-N 2.75Å; Y249-R767 HydrophobicContact CE1-CB 4.28Å; Y249-F771 HydrophobicContact CD1-CB 3.82Å; Y249-F771 AromaticContact CD1-CD1 3.49Å; Y249-F771 HydrophobicContact CD1-CD1 3.49Å; Y249-F771 VanDerWaalsContact CD1-CD1 3.49Å; Y249-F771 HydrophobicContact CD1-CD2 4.41Å; Y249-F771 HydrophobicContact CD1-CE1 4.1Å; Y249-F771 AromaticContact CD1-CG 3.66Å; Y249-F771 HydrophobicContact CD1-CG 3.66Å; Y249-F771 HydrophobicContact CE1-CB 3.71Å; Y249-F771 HydrophobicContact CE1-CD1 4.21Å; Y249-F771 HydrophobicContact CE1-CD2 4.45Å; Y249-F771 AromaticContact CE1-CG 3.89Å; Y249-F771 HydrophobicContact CE1-CG 3.89Å; Y249-F771 AromaticContact CG-CD1 3.78Å; Y249-F771 HydrophobicContact CG-CD1 3.78Å; Y249-F771 AromaticContact CG-CE1 3.88Å; Y249-F771 HydrophobicContact CG-CE1 3.88Å; Y249-F771 HydrophobicContact CG-CG 4.18Å; Y249-F771 HydrophobicContact CG-CZ 4.38Å
250	Q	94.8	Very high	92.5	Very high	75 Å²	75	47 Å²	47	35%	0.35	23%	0.229	S	C	.	.	H	α-helix	trans	-62	-34.3	179.2	-167.3	-177.3	19.3	0	0	113	S246 L247 L253 T254	S246-Q250 WeakPolarHBondContact O-CB 3.4Å; S246-Q250 PolarHBondContact O-N 3.29Å; L247-Q250 PolarHBondContact O-N 3.49Å; Q250-L253 PolarHBondContact O-N 2.55Å; Q250-T254 PolarHBondContact O-N 3.28Å; Q250-T254 VanDerWaalsContact O-N 3.09Å; Q250-T254 PolarHBondContact O-OG1 2.73Å
251	K	93.2	Very high	92.6	Very high	158 Å²	158	47.1 Å²	47.1	69%	0.687	23%	0.225	S	C	*	.	H	α-helix	trans	-62.5	-48.8	175.2	-172.5	-179.8	177.4	-176.4	0	111.4	L247 R248 Y249 T254 S255	L247-K251 PolarHBondContact O-N 3.37Å; R248-K251 PolarHBondContact O-N 2.78Å; Y249-K251 VanDerWaalsContact C-N 3.29Å; Y249-K251 PolarHBondContact O-N 2.7Å; K251-T254 WeakPolarHBondContact O-CB 3.18Å; K251-T254 PolarHBondContact O-N 3.38Å; K251-S255 PolarHBondContact O-N 3.41Å
252	E	92.5	Very high	92.7	Very high	44 Å²	44	52.5 Å²	52.5	21%	0.206	25%	0.249	C	C	.	.	H	α-helix	trans	-67.1	-36.5	177.1	-69.9	-53.5	130.6	0	0	112.2	R221 A222 I225 R248 Y249 T254 S255 A256	R221-E252 HydrophobicContact CB-CG 4.32Å; R221-E252 WeakPolarHBondContact CB-OE2 3.02Å; R221-E252 WeakPolarHBondContact CD-OE2 3.32Å; A222-E252 HydrophobicContact CB-CB 3.89Å; I225-E252 HydrophobicContact CD1-CB 4.26Å; I225-E252 HydrophobicContact CD1-CG 3.41Å; I225-E252 VanDerWaalsContact CD1-CG 3.41Å; R248-E252 PolarHBondContact O-N 2.87Å; Y249-E252 PolarHBondContact O-N 3.07Å; E252-T254 PolarHBondContact O-N 3.48Å; E252-S255 WeakPolarHBondContact O-CB 3.4Å; E252-S255 PolarHBondContact O-N 2.78Å; E252-S255 VanDerWaalsContact O-N 3.09Å; E252-S255 PolarHBondContact O-OG 3.12Å; E252-A256 PolarHBondContact O-N 3.41Å
253	L	93.3	Very high	92.6	Very high	3 Å²	3	52.8 Å²	52.8	2%	0.016	25%	0.25	C	C	.	.	H	α-helix	trans	-60	-32.6	173	-74.2	-179.6	0	0	0	113.1	Y219 A222 Y249 Q250 S255 A256 E257 K764 R767	Y219-L253 HydrophobicContact CD2-CD2 4.25Å; Y219-L253 HydrophobicContact CE2-CD2 3.99Å; A222-L253 HydrophobicContact CB-CD2 4.18Å; Y249-L253 HydrophobicContact CD1-CD1 3.7Å; Y249-L253 HydrophobicContact CD1-CG 4.16Å; Y249-L253 HydrophobicContact CE1-CD1 3.39Å; Y249-L253 HydrophobicContact CE1-CD2 4.25Å; Y249-L253 HydrophobicContact CE1-CG 3.9Å; Y249-L253 WeakPolarHBondContact O-CG 3.43Å; Y249-L253 PolarHBondContact O-N 2.75Å; Q250-L253 PolarHBondContact O-N 2.55Å; L253-S255 VanDerWaalsContact C-N 3.31Å; L253-A256 PolarHBondContact O-N 3.08Å; L253-E257 WeakPolarHBondContact O-CB 3.47Å; L253-E257 PolarHBondContact O-N 2.79Å; L253-K764 HydrophobicContact CB-CG 4.17Å; L253-R767 HydrophobicContact CD1-CB 3.76Å; L253-R767 HydrophobicContact CD2-CB 4.13Å
254	T	94	Very high	92.5	Very high	47 Å²	47	45.9 Å²	45.9	29%	0.288	22%	0.223	S	C	.	.	H	α-helix	trans	-67.4	-34.3	176.9	-55.1	0	0	0	0	111.5	Q250 K251 E252 E257 L258 K764	Q250-T254 PolarHBondContact O-N 3.28Å; Q250-T254 VanDerWaalsContact O-N 3.09Å; Q250-T254 PolarHBondContact O-OG1 2.73Å; K251-T254 WeakPolarHBondContact O-CB 3.18Å; K251-T254 PolarHBondContact O-N 3.38Å; E252-T254 PolarHBondContact O-N 3.48Å; T254-E257 PolarHBondContact O-N 3.1Å; T254-L258 WeakPolarHBondContact O-CG 3.37Å; T254-L258 PolarHBondContact O-N 3.04Å; T254-L258 VanDerWaalsContact O-N 3.14Å; T254-K764 VanDerWaalsContact OG1-CE 3.31Å; T254-K764 WeakPolarHBondContact OG1-CE 3.41Å; T254-K764 PolarHBondContact OG1-NZ 3.29Å
255	S	91.3	Very high	92.4	Very high	37 Å²	37	43.6 Å²	43.6	26%	0.259	22%	0.219	S	C	.	.	H	α-helix	trans	-65.6	-40.2	173.7	81.9	0	0	0	0	111.8	K251 E252 L253 M259	K251-S255 PolarHBondContact O-N 3.41Å; E252-S255 WeakPolarHBondContact O-CB 3.4Å; E252-S255 PolarHBondContact O-N 2.78Å; E252-S255 VanDerWaalsContact O-N 3.09Å; E252-S255 PolarHBondContact O-OG 3.12Å; L253-S255 VanDerWaalsContact C-N 3.31Å; S255-M259 WeakPolarHBondContact O-CG 3.25Å; S255-M259 PolarHBondContact O-N 2.82Å
256	A	91.5	Very high	92.2	Very high	7 Å²	7	44.3 Å²	44.3	6%	0.058	23%	0.225	C	C	.	.	H	α-helix	trans	-66.5	-43	175.7	0	0	0	0	0	111.8	A218 E252 L253 L258 M259 G260	A218-A256 HydrophobicContact CB-CB 4.24Å; E252-A256 PolarHBondContact O-N 3.41Å; L253-A256 PolarHBondContact O-N 3.08Å; A256-L258 PolarHBondContact O-N 3.48Å; A256-M259 PolarHBondContact O-N 3.06Å; A256-G260 PolarHBondContact O-N 3.47Å
257	E	93.9	Very high	91.9	Very high	19 Å²	19	46.1 Å²	46.1	9%	0.089	23%	0.231	C	C	.	.	H	α-helix	trans	-54	-50.9	174.6	-180	-163.2	167	0	0	111.4	L253 T254 M259 G260 I261 E760 R761 K764	L253-E257 WeakPolarHBondContact O-CB 3.47Å; L253-E257 PolarHBondContact O-N 2.79Å; T254-E257 PolarHBondContact O-N 3.1Å; E257-M259 VanDerWaalsContact C-N 3.34Å; E257-M259 PolarHBondContact O-N 3.32Å; E257-G260 PolarHBondContact O-N 3.32Å; E257-I261 HydrophobicContact CG-CD1 3.99Å; E257-I261 WeakPolarHBondContact O-CG1 3.38Å; E257-I261 PolarHBondContact O-N 3.05Å; E257-E760 HydrophobicContact CG-CB 4.24Å; E257-R761 WeakPolarHBondContact OE1-CG 3.27Å; E257-R761 IonicContact OE1-NE 2.85Å; E257-K764 HydrophobicContact CB-CD 4.31Å; E257-K764 HydrophobicContact CG-CD 4.47Å; E257-K764 WeakPolarHBondContact OE2-CD 3.49Å; E257-K764 WeakPolarHBondContact OE2-CE 3.44Å; E257-K764 IonicContact OE2-NZ 2.85Å; E257-K764 PolarHBondContact OE2-NZ 3.22Å
258	L	93.2	Very high	91.6	Very high	94 Å²	94	42.2 Å²	42.2	49%	0.492	21%	0.213	S	C	.	.	H	α-helix	trans	-64.2	-37.4	-178.5	-70	173.8	0	0	0	112.6	T254 A256 K262	T254-L258 WeakPolarHBondContact O-CG 3.37Å; T254-L258 PolarHBondContact O-N 3.04Å; T254-L258 VanDerWaalsContact O-N 3.14Å; A256-L258 PolarHBondContact O-N 3.48Å; L258-K262 WeakPolarHBondContact O-CG 3.42Å; L258-K262 PolarHBondContact O-N 2.87Å
259	M	92.2	Very high	91.4	Very high	45 Å²	45	41.9 Å²	41.9	22%	0.222	22%	0.22	C	C	.	.	H	α-helix	trans	-69.8	-39.3	174.6	-68.1	-57.5	108.5	0	0	111.6	K214 A218 S255 A256 E257 K262 K263	K214-M259 HydrophobicContact CB-SD 4.38Å; K214-M259 HydrophobicContact CD-SD 4.36Å; A218-M259 HydrophobicContact CB-CG 4.25Å; S255-M259 WeakPolarHBondContact O-CG 3.25Å; S255-M259 PolarHBondContact O-N 2.82Å; A256-M259 PolarHBondContact O-N 3.06Å; E257-M259 VanDerWaalsContact C-N 3.34Å; E257-M259 PolarHBondContact O-N 3.32Å; M259-K262 HydrophobicContact CE-CD 4.12Å; M259-K262 PolarHBondContact O-N 2.93Å; M259-K263 PolarHBondContact O-N 2.98Å
260	G	90.3	Very high	91	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-62.2	-42.2	175.6	0	0	0	0	0	112.9	A256 E257 K263 A264	A256-G260 PolarHBondContact O-N 3.47Å; E257-G260 PolarHBondContact O-N 3.32Å; G260-K263 WeakPolarHBondContact O-CB 3.39Å; G260-K263 PolarHBondContact O-N 3.43Å; G260-A264 PolarHBondContact O-N 3.32Å
261	I	92.1	Very high	90.6	Very high	22 Å²	22	40.9 Å²	40.9	11%	0.113	23%	0.225	C	C	.	.	H	α-helix	trans	-63.3	-45.2	175.9	-67.1	167.1	0	0	0	110.4	E257 K263 A264 T265 Y753 V757 E760	E257-I261 HydrophobicContact CG-CD1 3.99Å; E257-I261 WeakPolarHBondContact O-CG1 3.38Å; E257-I261 PolarHBondContact O-N 3.05Å; I261-K263 VanDerWaalsContact C-N 3.29Å; I261-K263 PolarHBondContact O-N 3.24Å; I261-A264 PolarHBondContact O-N 3.25Å; I261-T265 WeakPolarHBondContact O-CG2 3.44Å; I261-T265 PolarHBondContact O-N 3.08Å; I261-T265 PolarHBondContact O-OG1 2.81Å; I261-Y753 HydrophobicContact CG2-CD2 4.34Å; I261-Y753 HydrophobicContact CG2-CE2 4.25Å; I261-V757 HydrophobicContact CD1-CG2 4.19Å; I261-V757 HydrophobicContact CG1-CG2 4.3Å; I261-V757 HydrophobicContact CG2-CG2 3.97Å; I261-E760 HydrophobicContact CG1-CB 3.99Å; I261-E760 HydrophobicContact CG1-CG 4.27Å
262	K	92.1	Very high	90.3	Very high	112 Å²	112	33.3 Å²	33.3	49%	0.487	19%	0.192	S	C	.	.	H	α-helix	trans	-61.9	-35.9	176.6	-73.8	179.1	179.9	-175.6	0	112.8	F211 L258 M259 T265 A266	F211-K262 HydrophobicContact CD1-CB 4.23Å; F211-K262 HydrophobicContact CE1-CB 4.01Å; L258-K262 WeakPolarHBondContact O-CG 3.42Å; L258-K262 PolarHBondContact O-N 2.87Å; M259-K262 HydrophobicContact CE-CD 4.12Å; M259-K262 PolarHBondContact O-N 2.93Å; K262-T265 WeakPolarHBondContact CA-OG1 3.37Å; K262-T265 PolarHBondContact O-OG1 2.76Å; K262-A266 VanDerWaalsContact O-CB 3.28Å; K262-A266 WeakPolarHBondContact O-CB 3.46Å; K262-A266 PolarHBondContact O-N 3Å
263	K	90.2	Very high	90.1	Very high	34 Å²	34	33.1 Å²	33.1	15%	0.148	20%	0.195	C	C	.	.	H	α-helix	trans	-63.4	-49.6	172.9	175.8	-164.1	68.3	-173.1	0	110.8	F211 E215 M259 G260 I261 T265 A266 F267 E760	F211-K263 HydrophobicContact CB-CB 3.88Å; F211-K263 HydrophobicContact CB-CG 4.11Å; E215-K263 IonicContact OE1-NZ 3.15Å; E215-K263 PolarHBondContact OE1-NZ 3.09Å; E215-K263 WeakPolarHBondContact OE2-CD 3.07Å; E215-K263 WeakPolarHBondContact OE2-CE 3.41Å; E215-K263 IonicContact OE2-NZ 3.37Å; E215-K263 PolarHBondContact OE2-NZ 2.95Å; M259-K263 PolarHBondContact O-N 2.98Å; G260-K263 WeakPolarHBondContact O-CB 3.39Å; G260-K263 PolarHBondContact O-N 3.43Å; I261-K263 VanDerWaalsContact C-N 3.29Å; I261-K263 PolarHBondContact O-N 3.24Å; K263-T265 PolarHBondContact O-N 3.25Å; K263-A266 PolarHBondContact O-N 2.84Å; K263-F267 HydrophobicContact CD-CE2 4.25Å; K263-F267 HydrophobicContact CD-CZ 4.37Å; K263-F267 HydrophobicContact CG-CD2 4.32Å; K263-F267 HydrophobicContact CG-CE1 4.16Å; K263-F267 HydrophobicContact CG-CE2 3.88Å; K263-F267 HydrophobicContact CG-CZ 3.77Å; K263-F267 WeakPolarHBondContact O-CD1 3.27Å; K263-F267 WeakPolarHBondContact O-CG 3.48Å; K263-F267 PolarHBondContact O-N 2.93Å; K263-E760 IonicContact NZ-OE1 3.52Å
264	A	88.8	Confident	89.8	Confident	19 Å²	19	34.3 Å²	34.3	16%	0.157	20%	0.201	C	C	.	.	H	α-helix	trans	-63.2	-40.8	-177.6	0	0	0	0	0	112.4	G260 I261 F267 G268 G752 G756	G260-A264 PolarHBondContact O-N 3.32Å; I261-A264 PolarHBondContact O-N 3.25Å; A264-F267 PolarHBondContact O-N 3.16Å; A264-G268 PolarHBondContact O-N 2.99Å; A264-G752 WeakPolarHBondContact CB-O 3.35Å; A264-G756 VanDerWaalsContact CB-CA 3.42Å
265	T	90.3	Very high	89.4	Confident	38 Å²	38	32.6 Å²	32.6	23%	0.233	19%	0.193	C	C	.	.	H	α-helix	trans	-64.4	-46.5	173.7	54.6	0	0	0	0	112	I261 K262 K263 F267 G268 S269 Y753	I261-T265 WeakPolarHBondContact O-CG2 3.44Å; I261-T265 PolarHBondContact O-N 3.08Å; I261-T265 PolarHBondContact O-OG1 2.81Å; K262-T265 WeakPolarHBondContact CA-OG1 3.37Å; K262-T265 PolarHBondContact O-OG1 2.76Å; K263-T265 PolarHBondContact O-N 3.25Å; T265-F267 VanDerWaalsContact C-N 3.28Å; T265-F267 PolarHBondContact O-N 3.42Å; T265-G268 PolarHBondContact O-N 3.36Å; T265-S269 WeakPolarHBondContact O-CB 3.47Å; T265-S269 PolarHBondContact O-N 2.99Å; T265-S269 PolarHBondContact O-OG 3.17Å; T265-S269 VanDerWaalsContact O-OG 3.09Å; T265-Y753 HydrophobicContact CG2-CD2 3.49Å; T265-Y753 VanDerWaalsContact CG2-CD2 3.49Å; T265-Y753 HydrophobicContact CG2-CG 4.11Å
266	A	88.7	Confident	89.3	Confident	16 Å²	16	32.2 Å²	32.2	13%	0.132	19%	0.188	C	C	.	.	H	α-helix	trans	-58	-42.8	177.6	0	0	0	0	0	111.3	F211 K262 K263 S269 V270	F211-A266 HydrophobicContact CD2-CB 3.67Å; F211-A266 HydrophobicContact CE2-CB 3.45Å; F211-A266 VanDerWaalsContact CE2-CB 3.45Å; F211-A266 HydrophobicContact CZ-CB 4.13Å; K262-A266 VanDerWaalsContact O-CB 3.28Å; K262-A266 WeakPolarHBondContact O-CB 3.46Å; K262-A266 PolarHBondContact O-N 3Å; K263-A266 PolarHBondContact O-N 2.84Å; A266-S269 PolarHBondContact O-N 2.8Å; A266-V270 WeakPolarHBondContact O-CB 3.17Å; A266-V270 VanDerWaalsContact O-CG2 3.23Å; A266-V270 WeakPolarHBondContact O-CG2 3.42Å; A266-V270 PolarHBondContact O-N 2.87Å
267	F	86.4	Confident	89.2	Confident	49 Å²	49	33 Å²	33	22%	0.215	19%	0.192	C	C	.	.	H	α-helix	trans	-69.5	-39.4	178.9	-71.6	6.2	0	0	0	112.6	F208 K263 A264 T265 G271	F208-F267 HydrophobicContact CB-CE1 4.11Å; F208-F267 HydrophobicContact CB-CZ 4.04Å; F208-F267 HydrophobicContact CD2-CE1 4.18Å; F208-F267 AromaticContact CD2-CE2 3.76Å; F208-F267 HydrophobicContact CD2-CE2 3.76Å; F208-F267 AromaticContact CD2-CZ 3.31Å; F208-F267 HydrophobicContact CD2-CZ 3.31Å; F208-F267 HydrophobicContact CE2-CE2 4.17Å; F208-F267 HydrophobicContact CE2-CZ 4.07Å; F208-F267 HydrophobicContact CG-CZ 4.02Å; K263-F267 HydrophobicContact CD-CE2 4.25Å; K263-F267 HydrophobicContact CD-CZ 4.37Å; K263-F267 HydrophobicContact CG-CD2 4.32Å; K263-F267 HydrophobicContact CG-CE1 4.16Å; K263-F267 HydrophobicContact CG-CE2 3.88Å; K263-F267 HydrophobicContact CG-CZ 3.77Å; K263-F267 WeakPolarHBondContact O-CD1 3.27Å; K263-F267 WeakPolarHBondContact O-CG 3.48Å; K263-F267 PolarHBondContact O-N 2.93Å; A264-F267 PolarHBondContact O-N 3.16Å; T265-F267 VanDerWaalsContact C-N 3.28Å; T265-F267 PolarHBondContact O-N 3.42Å; F267-G271 PolarHBondContact O-N 3.4Å
268	G	87.6	Confident	88.8	Confident	12 Å²	12	34.3 Å²	34.3	12%	0.124	20%	0.199	C	C	.	.	H	α-helix	trans	-59.5	-47.6	172.7	0	0	0	0	0	112.2	A264 T265 G271 G272 G748	A264-G268 PolarHBondContact O-N 2.99Å; T265-G268 PolarHBondContact O-N 3.36Å; G268-G271 PolarHBondContact O-N 3.18Å; G268-G272 PolarHBondContact O-N 3.41Å; G268-G748 CarbonylContact C-O 3.59Å; G268-G748 WeakPolarHBondContact CA-O 3.21Å; G268-G748 CarbonylContact O-C 3.55Å; G268-G748 VanDerWaalsContact O-C 3.27Å
269	S	88.7	Confident	88.6	Confident	49 Å²	49	30.7 Å²	30.7	34%	0.343	18%	0.18	S	C	.	.	H	α-helix	trans	-64.1	-43.1	178.6	-61.7	0	0	0	0	112.6	T265 A266 G272 C273 A749	T265-S269 WeakPolarHBondContact O-CB 3.47Å; T265-S269 PolarHBondContact O-N 2.99Å; T265-S269 PolarHBondContact O-OG 3.17Å; T265-S269 VanDerWaalsContact O-OG 3.09Å; A266-S269 PolarHBondContact O-N 2.8Å; S269-G272 PolarHBondContact O-N 3.08Å; S269-C273 WeakPolarHBondContact O-CB 3.36Å; S269-C273 PolarHBondContact O-N 3.28Å; S269-A749 WeakPolarHBondContact OG-CB 3.36Å
270	V	86.9	Confident	88.4	Confident	20 Å²	20	30.4 Å²	30.4	12%	0.121	18%	0.182	C	C	.	.	H	α-helix	trans	-68.2	-40.3	177.7	177.6	0	0	0	0	111.2	F204 A266 G272 C273 I274	F204-V270 HydrophobicContact CB-CG1 3.53Å; F204-V270 HydrophobicContact CD2-CB 4.25Å; F204-V270 HydrophobicContact CD2-CG1 3.74Å; F204-V270 HydrophobicContact CG-CG1 4.14Å; A266-V270 WeakPolarHBondContact O-CB 3.17Å; A266-V270 VanDerWaalsContact O-CG2 3.23Å; A266-V270 WeakPolarHBondContact O-CG2 3.42Å; A266-V270 PolarHBondContact O-N 2.87Å; V270-G272 VanDerWaalsContact C-N 3.32Å; V270-G272 PolarHBondContact O-N 3.45Å; V270-C273 WeakPolarHBondContact O-CB 3.28Å; V270-C273 PolarHBondContact O-N 3.47Å; V270-C273 VanDerWaalsContact O-N 3.16Å; V270-I274 HydrophobicContact CG1-CD1 4.22Å; V270-I274 WeakPolarHBondContact O-CG1 3.47Å; V270-I274 PolarHBondContact O-N 3.27Å
271	G	84.6	Confident	88.3	Confident	33 Å²	33	31 Å²	31	34%	0.34	19%	0.186	S	C	.	.	H	α-helix	trans	-60.8	-41.4	173.5	0	0	0	0	0	112.5	F267 G268 I274 G275	F267-G271 PolarHBondContact O-N 3.4Å; G268-G271 PolarHBondContact O-N 3.18Å; G271-I274 PolarHBondContact O-N 3.31Å; G271-G275 PolarHBondContact O-N 3.34Å; G271-G275 VanDerWaalsContact O-N 3.08Å
272	G	88.3	Confident	88.1	Confident	0 Å²	0	30 Å²	30	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-61.6	-41.1	171.7	0	0	0	0	0	113	G268 S269 V270 G275 L276	G268-G272 PolarHBondContact O-N 3.41Å; S269-G272 PolarHBondContact O-N 3.08Å; V270-G272 VanDerWaalsContact C-N 3.32Å; V270-G272 PolarHBondContact O-N 3.45Å; G272-G275 PolarHBondContact O-N 2.95Å; G272-L276 PolarHBondContact O-N 2.99Å
273	C	88.3	Confident	88	Confident	39 Å²	39	24.9 Å²	24.9	26%	0.264	16%	0.16	S	C	.	.	H	α-helix	trans	-64	-41.9	176.3	-175.1	0	0	0	0	112.1	S269 V270 G275 L276 V277 L745	S269-C273 WeakPolarHBondContact O-CB 3.36Å; S269-C273 PolarHBondContact O-N 3.28Å; V270-C273 WeakPolarHBondContact O-CB 3.28Å; V270-C273 PolarHBondContact O-N 3.47Å; V270-C273 VanDerWaalsContact O-N 3.16Å; C273-G275 VanDerWaalsContact C-N 3.3Å; C273-G275 PolarHBondContact O-N 3.15Å; C273-L276 WeakPolarHBondContact O-CB 3.33Å; C273-L276 PolarHBondContact O-N 3.36Å; C273-V277 WeakPolarHBondContact O-CG2 3.29Å; C273-V277 PolarHBondContact O-N 3.5Å; C273-L745 HydrophobicContact CB-CD1 4.1Å
274	I	86	Confident	88.1	Confident	28 Å²	28	26.7 Å²	26.7	14%	0.144	17%	0.171	C	C	.	.	H	α-helix	trans	-58.7	-44.8	172.7	-67.5	165.8	0	0	0	110.1	A200 F201 V270 G271 V277 I278	A200-I274 HydrophobicContact CB-CG1 3.86Å; F201-I274 HydrophobicContact CD1-CD1 4.22Å; F201-I274 HydrophobicContact CE1-CD1 4.14Å; F201-I274 HydrophobicContact CZ-CG2 4.25Å; V270-I274 HydrophobicContact CG1-CD1 4.22Å; V270-I274 WeakPolarHBondContact O-CG1 3.47Å; V270-I274 PolarHBondContact O-N 3.27Å; G271-I274 PolarHBondContact O-N 3.31Å; I274-V277 PolarHBondContact O-N 2.99Å; I274-I278 HydrophobicContact CG2-CD1 3.74Å; I274-I278 HydrophobicContact CG2-CG1 4.48Å; I274-I278 VanDerWaalsContact O-CG1 3.28Å; I274-I278 WeakPolarHBondContact O-CG1 3.39Å; I274-I278 PolarHBondContact O-N 2.7Å
275	G	85.2	Confident	88.1	Confident	11 Å²	11	26 Å²	26	11%	0.113	16%	0.164	C	C	.	.	H	α-helix	trans	-60.3	-44.7	175.7	0	0	0	0	0	113.6	G271 G272 C273 I278 F279	G271-G275 PolarHBondContact O-N 3.34Å; G271-G275 VanDerWaalsContact O-N 3.08Å; G272-G275 PolarHBondContact O-N 2.95Å; C273-G275 VanDerWaalsContact C-N 3.3Å; C273-G275 PolarHBondContact O-N 3.15Å; G275-I278 PolarHBondContact O-N 2.93Å; G275-F279 PolarHBondContact O-N 3.32Å
276	L	90.6	Very high	88.1	Confident	30 Å²	30	24.2 Å²	24.2	16%	0.157	15%	0.153	C	C	.	.	H	α-helix	trans	-57.8	-49.2	175.5	174	70.6	0	0	0	111.6	G272 C273 I278 S280 F742 L745	G272-L276 PolarHBondContact O-N 2.99Å; C273-L276 WeakPolarHBondContact O-CB 3.33Å; C273-L276 PolarHBondContact O-N 3.36Å; L276-I278 VanDerWaalsContact C-N 3.34Å; L276-I278 PolarHBondContact O-N 3.33Å; L276-S280 WeakPolarHBondContact O-CB 3.32Å; L276-S280 PolarHBondContact O-N 3.37Å; L276-S280 PolarHBondContact O-OG 2.79Å; L276-F742 HydrophobicContact CD1-CD1 4.11Å; L276-F742 HydrophobicContact CD1-CD2 3.99Å; L276-F742 HydrophobicContact CD1-CE1 4.26Å; L276-F742 HydrophobicContact CD1-CE2 4.15Å; L276-F742 HydrophobicContact CD1-CG 3.97Å; L276-F742 HydrophobicContact CD1-CZ 4.28Å; L276-L745 HydrophobicContact CB-CB 4.47Å; L276-L745 HydrophobicContact CD2-CD2 4.19Å
277	V	88.1	Confident	88.3	Confident	23 Å²	23	28.8 Å²	28.8	14%	0.139	17%	0.167	C	C	.	.	H	α-helix	trans	-62.2	-44.4	-179.5	175.2	0	0	0	0	110.3	F196 V197 A200 C273 I274 S281	F196-V277 HydrophobicContact CB-CG1 3.83Å; F196-V277 HydrophobicContact CB-CG2 4.36Å; V197-V277 HydrophobicContact CB-CG1 4.36Å; V197-V277 HydrophobicContact CG2-CG1 3.53Å; A200-V277 HydrophobicContact CB-CG2 4.43Å; C273-V277 WeakPolarHBondContact O-CG2 3.29Å; C273-V277 PolarHBondContact O-N 3.5Å; I274-V277 PolarHBondContact O-N 2.99Å; V277-S281 WeakPolarHBondContact O-CB 3.23Å; V277-S281 PolarHBondContact O-N 3.31Å; V277-S281 PolarHBondContact O-OG 2.78Å
278	I	85.3	Confident	88.5	Confident	46 Å²	46	29 Å²	29	24%	0.236	17%	0.168	C	C	.	.	H	α-helix	trans	-63.1	-50.9	179.4	-68.5	169.9	0	0	0	111.2	I274 G275 L276 S280 S281 A282 L311	I274-I278 HydrophobicContact CG2-CD1 3.74Å; I274-I278 HydrophobicContact CG2-CG1 4.48Å; I274-I278 VanDerWaalsContact O-CG1 3.28Å; I274-I278 WeakPolarHBondContact O-CG1 3.39Å; I274-I278 PolarHBondContact O-N 2.7Å; G275-I278 PolarHBondContact O-N 2.93Å; L276-I278 VanDerWaalsContact C-N 3.34Å; L276-I278 PolarHBondContact O-N 3.33Å; I278-S280 PolarHBondContact O-N 2.73Å; I278-S281 PolarHBondContact O-N 2.84Å; I278-S281 PolarHBondContact O-OG 3.28Å; I278-A282 PolarHBondContact O-N 3.04Å; I278-L311 HydrophobicContact CG2-CD1 3.96Å
279	F	89	Confident	88.7	Confident	19 Å²	19	28.4 Å²	28.4	8%	0.083	16%	0.162	C	C	.	.	H	α-helix	trans	-69	-36.2	-178	-65.3	-19.7	0	0	0	112.9	G275 A282 A283 F706 L740 Q744	G275-F279 PolarHBondContact O-N 3.32Å; F279-A282 PolarHBondContact O-N 3Å; F279-A283 PolarHBondContact O-N 3.32Å; F279-F706 HydrophobicContact CD1-CD1 4.46Å; F279-F706 AromaticContact CD1-CD2 3.47Å; F279-F706 HydrophobicContact CD1-CD2 3.47Å; F279-F706 VanDerWaalsContact CD1-CD2 3.47Å; F279-F706 AromaticContact CD1-CE2 3.6Å; F279-F706 HydrophobicContact CD1-CE2 3.6Å; F279-F706 AromaticContact CD1-CG 3.94Å; F279-F706 HydrophobicContact CD1-CG 3.94Å; F279-F706 HydrophobicContact CD1-CZ 4.16Å; F279-F706 HydrophobicContact CE1-CB 4.04Å; F279-F706 HydrophobicContact CE1-CD1 4.02Å; F279-F706 AromaticContact CE1-CD2 3.67Å; F279-F706 HydrophobicContact CE1-CD2 3.67Å; F279-F706 HydrophobicContact CE1-CE1 4.43Å; F279-F706 HydrophobicContact CE1-CE2 4.12Å; F279-F706 AromaticContact CE1-CG 3.62Å; F279-F706 HydrophobicContact CE1-CG 3.62Å; F279-F706 HydrophobicContact CE1-CZ 4.48Å; F279-F706 HydrophobicContact CG-CD2 4.08Å; F279-F706 HydrophobicContact CG-CE2 4.32Å; F279-F706 HydrophobicContact CZ-CB 4.15Å; F279-F706 HydrophobicContact CZ-CD2 4.42Å; F279-F706 HydrophobicContact CZ-CG 4.23Å; F279-L740 HydrophobicContact CD2-CB 4.13Å; F279-L740 HydrophobicContact CE2-CB 4.5Å; F279-Q744 HydrophobicContact CE2-CB 4.25Å; F279-Q744 HydrophobicContact CE2-CG 4.42Å
280	S	89.3	Confident	88.7	Confident	38 Å²	38	26.2 Å²	26.2	27%	0.266	15%	0.147	S	C	.	.	H	α-helix	trans	-69.1	-37.9	175.4	-54.6	0	0	0	0	111.7	L276 I278 A282 A283 L284	L276-S280 WeakPolarHBondContact O-CB 3.32Å; L276-S280 PolarHBondContact O-N 3.37Å; L276-S280 PolarHBondContact O-OG 2.79Å; I278-S280 PolarHBondContact O-N 2.73Å; S280-A282 VanDerWaalsContact C-N 3.35Å; S280-A283 PolarHBondContact O-N 3.18Å; S280-L284 WeakPolarHBondContact O-CB 3.35Å; S280-L284 PolarHBondContact O-N 3.02Å
281	S	87.7	Confident	88.7	Confident	13 Å²	13	29.4 Å²	29.4	9%	0.091	16%	0.159	C	C	.	.	H	α-helix	trans	-62.8	-42.3	174	73.6	0	0	0	0	111.4	V277 I278 L284 V285	V277-S281 WeakPolarHBondContact O-CB 3.23Å; V277-S281 PolarHBondContact O-N 3.31Å; V277-S281 PolarHBondContact O-OG 2.78Å; I278-S281 PolarHBondContact O-N 2.84Å; I278-S281 PolarHBondContact O-OG 3.28Å; S281-L284 PolarHBondContact O-N 3.42Å; S281-V285 WeakPolarHBondContact O-CB 3.43Å; S281-V285 VanDerWaalsContact O-CG2 3.23Å; S281-V285 WeakPolarHBondContact O-CG2 3.18Å; S281-V285 PolarHBondContact O-N 3.35Å
282	A	87.6	Confident	89	Confident	0 Å²	0	28.2 Å²	28.2	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-62.2	-46.6	175.8	0	0	0	0	0	111.9	I278 F279 S280 L284 V285 F286 F307 F706	I278-A282 PolarHBondContact O-N 3.04Å; F279-A282 PolarHBondContact O-N 3Å; S280-A282 VanDerWaalsContact C-N 3.35Å; A282-L284 VanDerWaalsContact C-N 3.33Å; A282-L284 PolarHBondContact O-N 2.76Å; A282-V285 PolarHBondContact O-N 2.65Å; A282-F286 HydrophobicContact CB-CD2 4.38Å; A282-F286 HydrophobicContact CB-CE2 4.07Å; A282-F286 WeakPolarHBondContact O-CD2 3.5Å; A282-F286 WeakPolarHBondContact O-CG 3.33Å; A282-F286 PolarHBondContact O-N 3.27Å; A282-F307 HydrophobicContact CB-CE2 3.48Å; A282-F307 VanDerWaalsContact CB-CE2 3.48Å; A282-F307 HydrophobicContact CB-CZ 3.71Å; A282-F706 HydrophobicContact CB-CE2 3.9Å; A282-F706 HydrophobicContact CB-CZ 3.77Å
283	A	90.8	Very high	88.9	Confident	6 Å²	6	28.3 Å²	28.3	5%	0.05	15%	0.145	C	C	.	.	H	α-helix	trans	-56.5	-47.1	176.5	0	0	0	0	0	111.9	F279 S280 W287 S734 M737 A738	F279-A283 PolarHBondContact O-N 3.32Å; S280-A283 PolarHBondContact O-N 3.18Å; A283-W287 WeakPolarHBondContact O-CB 3.18Å; A283-W287 PolarHBondContact O-N 2.97Å; A283-S734 WeakPolarHBondContact CB-O 3.49Å; A283-M737 HydrophobicContact CB-CB 3.92Å; A283-A738 HydrophobicContact CB-CB 4.29Å
284	L	91.4	Very high	88.6	Confident	72 Å²	72	31.9 Å²	31.9	38%	0.377	15%	0.153	S	C	.	.	H	α-helix	trans	-66	-44.4	-179	-173.9	150.6	0	0	0	111.9	V189 T193 S280 S281 A282 F288	V189-L284 HydrophobicContact CG1-CD2 3.23Å; T193-L284 HydrophobicContact CG2-CD2 4.35Å; S280-L284 WeakPolarHBondContact O-CB 3.35Å; S280-L284 PolarHBondContact O-N 3.02Å; S281-L284 PolarHBondContact O-N 3.42Å; A282-L284 VanDerWaalsContact C-N 3.33Å; A282-L284 PolarHBondContact O-N 2.76Å; L284-F288 WeakPolarHBondContact O-CB 3.25Å; L284-F288 PolarHBondContact O-N 3.42Å
285	V	90.2	Very high	88.6	Confident	4 Å²	4	34.7 Å²	34.7	2%	0.024	17%	0.169	C	C	.	.	H	α-helix	trans	-66.7	-41	179.7	174.8	0	0	0	0	111.4	L186 A190 S281 A282 G289 F307	L186-V285 HydrophobicContact CD1-CG1 4.08Å; L186-V285 HydrophobicContact CG-CG1 4.43Å; A190-V285 HydrophobicContact CB-CG1 4.43Å; A190-V285 HydrophobicContact CB-CG2 3.6Å; S281-V285 WeakPolarHBondContact O-CB 3.43Å; S281-V285 VanDerWaalsContact O-CG2 3.23Å; S281-V285 WeakPolarHBondContact O-CG2 3.18Å; S281-V285 PolarHBondContact O-N 3.35Å; A282-V285 PolarHBondContact O-N 2.65Å; V285-G289 WeakPolarHBondContact O-CA 3.47Å; V285-G289 PolarHBondContact O-N 3.46Å; V285-F307 HydrophobicContact CB-CD2 4.21Å; V285-F307 HydrophobicContact CG1-CB 3.88Å; V285-F307 HydrophobicContact CG1-CD2 4.04Å; V285-F307 HydrophobicContact CG1-CG 4.42Å
286	F	90.4	Very high	88.5	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-70.4	-41.2	176.8	-67.2	-47.5	0	0	0	112.9	A282 G289 V290 F307 Y710 V713 I730 M737	A282-F286 HydrophobicContact CB-CD2 4.38Å; A282-F286 HydrophobicContact CB-CE2 4.07Å; A282-F286 WeakPolarHBondContact O-CD2 3.5Å; A282-F286 WeakPolarHBondContact O-CG 3.33Å; A282-F286 PolarHBondContact O-N 3.27Å; F286-G289 PolarHBondContact O-N 2.74Å; F286-V290 WeakPolarHBondContact O-CG2 3.35Å; F286-V290 PolarHBondContact O-N 2.92Å; F286-F307 HydrophobicContact CE1-CB 4.06Å; F286-F307 AromaticContact CE1-CD1 3.75Å; F286-F307 HydrophobicContact CE1-CD1 3.75Å; F286-F307 HydrophobicContact CE1-CD2 4.36Å; F286-F307 HydrophobicContact CE1-CE1 4.31Å; F286-F307 AromaticContact CE1-CG 3.76Å; F286-F307 HydrophobicContact CE1-CG 3.76Å; F286-F307 HydrophobicContact CE2-CD1 4.3Å; F286-F307 HydrophobicContact CE2-CD2 4.48Å; F286-F307 HydrophobicContact CE2-CE1 4.06Å; F286-F307 HydrophobicContact CE2-CE2 4.27Å; F286-F307 HydrophobicContact CE2-CG 4.49Å; F286-F307 HydrophobicContact CE2-CZ 4.03Å; F286-F307 HydrophobicContact CZ-CB 4.41Å; F286-F307 AromaticContact CZ-CD1 3.31Å; F286-F307 HydrophobicContact CZ-CD1 3.31Å; F286-F307 HydrophobicContact CZ-CD2 4.02Å; F286-F307 AromaticContact CZ-CE1 3.41Å; F286-F307 HydrophobicContact CZ-CE1 3.41Å; F286-F307 VanDerWaalsContact CZ-CE1 3.41Å; F286-F307 HydrophobicContact CZ-CE2 4.13Å; F286-F307 AromaticContact CZ-CG 3.62Å; F286-F307 HydrophobicContact CZ-CG 3.62Å; F286-F307 AromaticContact CZ-CZ 3.82Å; F286-F307 HydrophobicContact CZ-CZ 3.82Å; F286-Y710 HydrophobicContact CE1-CD2 4.07Å; F286-Y710 AromaticContact CE1-CE2 3.65Å; F286-Y710 HydrophobicContact CE1-CE2 3.65Å; F286-Y710 AromaticContact CE2-CD2 3.56Å; F286-Y710 HydrophobicContact CE2-CD2 3.56Å; F286-Y710 AromaticContact CE2-CE2 3.95Å; F286-Y710 HydrophobicContact CE2-CE2 3.95Å; F286-Y710 HydrophobicContact CE2-CG 4.48Å; F286-Y710 AromaticContact CZ-CD2 3.24Å; F286-Y710 HydrophobicContact CZ-CD2 3.24Å; F286-Y710 AromaticContact CZ-CE2 3.11Å; F286-Y710 HydrophobicContact CZ-CE2 3.11Å; F286-Y710 HydrophobicContact CZ-CG 4.37Å; F286-V713 HydrophobicContact CB-CG1 4.34Å; F286-V713 HydrophobicContact CB-CG2 4.39Å; F286-V713 HydrophobicContact CD1-CG1 3.87Å; F286-V713 HydrophobicContact CD2-CG2 4.04Å; F286-V713 HydrophobicContact CE1-CG1 4.41Å; F286-V713 HydrophobicContact CE2-CG2 4.49Å; F286-V713 HydrophobicContact CG-CG1 4.1Å; F286-V713 HydrophobicContact CG-CG2 4.08Å; F286-I730 HydrophobicContact CB-CD1 4.21Å; F286-M737 HydrophobicContact CD2-CE 4.03Å; F286-M737 HydrophobicContact CD2-SD 3.88Å; F286-M737 HydrophobicContact CE2-CE 4.16Å; F286-M737 HydrophobicContact CE2-SD 4.34Å
287	W	91.4	Very high	87.9	Confident	112 Å²	112	43.8 Å²	43.8	42%	0.424	21%	0.212	S	C	.	.	H	α-helix	trans	-58.4	-50.2	176.1	178.8	77.7	0	0	0	111.8	A283 K291 N731	A283-W287 WeakPolarHBondContact O-CB 3.18Å; A283-W287 PolarHBondContact O-N 2.97Å; W287-K291 PolarHBondContact O-N 2.89Å; W287-N731 PolarHBondContact NE1-OD1 3.36Å
288	F	91.7	Very high	87.6	Confident	53 Å²	53	42.8 Å²	42.8	23%	0.232	21%	0.206	C	C	.	.	H	α-helix	trans	-68.8	-35	176.9	-168.3	-94	0	0	0	112.2	L186 V189 L284 K291 L292	L186-F288 HydrophobicContact CD1-CD1 3.84Å; V189-F288 HydrophobicContact CB-CD1 4.16Å; V189-F288 HydrophobicContact CB-CE1 4.47Å; V189-F288 HydrophobicContact CB-CG 4.48Å; V189-F288 HydrophobicContact CG1-CB 4.14Å; V189-F288 HydrophobicContact CG1-CD1 4.24Å; V189-F288 HydrophobicContact CG1-CG 4.1Å; V189-F288 HydrophobicContact CG2-CD1 3.75Å; V189-F288 HydrophobicContact CG2-CD2 4.29Å; V189-F288 HydrophobicContact CG2-CE1 3.65Å; V189-F288 HydrophobicContact CG2-CE2 4.2Å; V189-F288 HydrophobicContact CG2-CG 4.08Å; V189-F288 HydrophobicContact CG2-CZ 3.89Å; L284-F288 WeakPolarHBondContact O-CB 3.25Å; L284-F288 PolarHBondContact O-N 3.42Å; F288-K291 WeakPolarHBondContact O-CB 3.35Å; F288-K291 PolarHBondContact O-N 2.76Å; F288-L292 PolarHBondContact O-N 2.84Å
289	G	90.5	Very high	87.5	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-61.2	-46.1	176	0	0	0	0	0	112.9	V285 F286 K291 L292 I293	V285-G289 WeakPolarHBondContact O-CA 3.47Å; V285-G289 PolarHBondContact O-N 3.46Å; F286-G289 PolarHBondContact O-N 2.74Å; G289-K291 VanDerWaalsContact C-N 3.33Å; G289-K291 PolarHBondContact O-N 3.43Å; G289-L292 WeakPolarHBondContact O-CB 3.07Å; G289-L292 PolarHBondContact O-N 2.85Å; G289-I293 WeakPolarHBondContact O-CG1 3.33Å; G289-I293 PolarHBondContact O-N 2.71Å
290	V	88.5	Confident	87.3	Confident	3 Å²	3	42.2 Å²	42.2	2%	0.018	20%	0.204	C	C	.	.	H	α-helix	trans	-64.1	-39.2	175.3	169.3	0	0	0	0	111.4	F286 L292 I293 R294 V716 F717 M726 I730	F286-V290 WeakPolarHBondContact O-CG2 3.35Å; F286-V290 PolarHBondContact O-N 2.92Å; V290-L292 VanDerWaalsContact C-N 3.3Å; V290-L292 PolarHBondContact O-N 2.87Å; V290-I293 PolarHBondContact O-N 3.02Å; V290-R294 PolarHBondContact O-N 2.63Å; V290-V716 HydrophobicContact CG1-CG1 3.99Å; V290-V716 HydrophobicContact CG2-CG1 3.95Å; V290-F717 HydrophobicContact CG2-CD1 4.41Å; V290-F717 HydrophobicContact CG2-CE1 3.79Å; V290-M726 HydrophobicContact CB-CE 4.47Å; V290-M726 HydrophobicContact CG1-CE 3.6Å; V290-M726 HydrophobicContact CG1-CG 3.82Å; V290-M726 HydrophobicContact CG1-SD 4.25Å; V290-I730 HydrophobicContact CB-CB 4.23Å; V290-I730 HydrophobicContact CB-CD1 4.45Å; V290-I730 HydrophobicContact CB-CG1 3.85Å; V290-I730 HydrophobicContact CB-CG2 4.26Å; V290-I730 HydrophobicContact CG1-CB 3.96Å; V290-I730 HydrophobicContact CG1-CG1 4.16Å; V290-I730 HydrophobicContact CG1-CG2 3.76Å; V290-I730 HydrophobicContact CG2-CB 4.18Å; V290-I730 HydrophobicContact CG2-CD1 3.73Å; V290-I730 HydrophobicContact CG2-CG1 3.67Å
291	K	88.8	Confident	87.2	Confident	87 Å²	87	40.4 Å²	40.4	38%	0.378	19%	0.192	S	C	.	.	H	α-helix	trans	-59	-42.4	172.7	-174.9	-179.6	178.8	-177.1	0	111.6	W287 F288 G289 R294 D295	W287-K291 PolarHBondContact O-N 2.89Å; F288-K291 WeakPolarHBondContact O-CB 3.35Å; F288-K291 PolarHBondContact O-N 2.76Å; G289-K291 VanDerWaalsContact C-N 3.33Å; G289-K291 PolarHBondContact O-N 3.43Å; K291-R294 PolarHBondContact O-N 3.26Å; K291-D295 VanDerWaalsContact CE-OD2 3.26Å; K291-D295 WeakPolarHBondContact CE-OD2 2.94Å; K291-D295 VanDerWaalsContact CG-OD2 3.27Å; K291-D295 WeakPolarHBondContact CG-OD2 3.39Å; K291-D295 WeakPolarHBondContact O-CB 3.14Å; K291-D295 VanDerWaalsContact O-CG 3.3Å; K291-D295 PolarHBondContact O-N 3.44Å
292	L	89.1	Confident	87.3	Confident	8 Å²	8	39.8 Å²	39.8	4%	0.042	19%	0.187	C	C	.	.	H	α-helix	trans	-67.5	-33.7	177.2	-160.7	74.5	0	0	0	112.8	K185 L186 F288 G289 V290 R294 E296 A298	K185-L292 HydrophobicContact CB-CD1 4.48Å; K185-L292 HydrophobicContact CD-CD1 4.2Å; L186-L292 HydrophobicContact CB-CD2 4.26Å; F288-L292 PolarHBondContact O-N 2.84Å; G289-L292 WeakPolarHBondContact O-CB 3.07Å; G289-L292 PolarHBondContact O-N 2.85Å; V290-L292 VanDerWaalsContact C-N 3.3Å; V290-L292 PolarHBondContact O-N 2.87Å; L292-R294 VanDerWaalsContact C-N 3.34Å; L292-E296 HydrophobicContact CD1-CB 4.16Å; L292-E296 HydrophobicContact CD1-CG 3.93Å; L292-E296 WeakPolarHBondContact CD1-OE1 3.34Å; L292-E296 HydrophobicContact CG-CB 4.35Å; L292-E296 CarbonylContact O-C 3.59Å; L292-E296 WeakPolarHBondContact O-CA 3.47Å; L292-E296 WeakPolarHBondContact O-CB 3.32Å; L292-E296 PolarHBondContact O-N 3.46Å; L292-A298 HydrophobicContact CB-CB 4.42Å; L292-A298 HydrophobicContact CD2-CB 4.09Å; L292-A298 HydrophobicContact CG-CB 4.02Å; L292-A298 PolarHBondContact O-N 3.29Å
293	I	86.4	Confident	87.4	Confident	3 Å²	3	39.9 Å²	39.9	2%	0.015	19%	0.187	C	C	.	.	H	α-helix	trans	-64.5	-41.3	172.9	-64.3	169.4	0	0	0	110.4	G289 V290 D297 A298 P300 V303 F717 M726	G289-I293 WeakPolarHBondContact O-CG1 3.33Å; G289-I293 PolarHBondContact O-N 2.71Å; V290-I293 PolarHBondContact O-N 3.02Å; I293-D297 WeakPolarHBondContact O-CA 3.13Å; I293-D297 PolarHBondContact O-N 2.76Å; I293-A298 HydrophobicContact CG1-CB 4.24Å; I293-A298 WeakPolarHBondContact CG1-O 3.46Å; I293-P300 HydrophobicContact CD1-CB 4.38Å; I293-P300 HydrophobicContact CD1-CG 4.33Å; I293-V303 HydrophobicContact CD1-CG2 3.79Å; I293-V303 HydrophobicContact CG1-CG2 3.83Å; I293-F717 HydrophobicContact CD1-CD1 3.37Å; I293-F717 HydrophobicContact CD1-CE1 3.2Å; I293-F717 HydrophobicContact CD1-CG 4.39Å; I293-F717 HydrophobicContact CD1-CZ 4.1Å; I293-M726 HydrophobicContact CB-CE 4.02Å; I293-M726 HydrophobicContact CG2-CE 3.74Å
294	R	83.7	Confident	87.3	Confident	113 Å²	113	39.6 Å²	39.6	43%	0.426	19%	0.185	S	C	.	.	H	α-helix	trans	-72.8	-43.9	-179.7	-173.8	-168.2	66.3	173.8	0.6	112.9	V290 K291 L292 P723	V290-R294 PolarHBondContact O-N 2.63Å; K291-R294 PolarHBondContact O-N 3.26Å; L292-R294 VanDerWaalsContact C-N 3.34Å; R294-P723 HydrophobicContact CG-CB 4.48Å
295	D	84.3	Confident	87.2	Confident	87 Å²	87	36.2 Å²	36.2	47%	0.465	17%	0.168	S	C	.	.	H	α-helix	trans	-90.8	-27.2	-169.7	-61.3	-7.6	0	0	0	112.5	K291	K291-D295 VanDerWaalsContact CE-OD2 3.26Å; K291-D295 WeakPolarHBondContact CE-OD2 2.94Å; K291-D295 VanDerWaalsContact CG-OD2 3.27Å; K291-D295 WeakPolarHBondContact CG-OD2 3.39Å; K291-D295 WeakPolarHBondContact O-CB 3.14Å; K291-D295 VanDerWaalsContact O-CG 3.3Å; K291-D295 PolarHBondContact O-N 3.44Å
296	E	83.3	Confident	87.2	Confident	96 Å²	96	36 Å²	36	45%	0.449	17%	0.166	S	C	.	.	H	α-helix	trans	-128.8	15.2	-174.2	-59.8	-174.7	-158.7	0	0	113.6	K185 L292 A298	K185-E296 WeakPolarHBondContact CD-OE1 3.4Å; K185-E296 WeakPolarHBondContact CD-OE2 3.21Å; K185-E296 IonicContact NZ-OE1 3.89Å; K185-E296 PolarHBondContact NZ-OE1 2.93Å; K185-E296 IonicContact NZ-OE2 2.61Å; K185-E296 PolarHBondContact NZ-OE2 2.81Å; L292-E296 HydrophobicContact CD1-CB 4.16Å; L292-E296 HydrophobicContact CD1-CG 3.93Å; L292-E296 WeakPolarHBondContact CD1-OE1 3.34Å; L292-E296 HydrophobicContact CG-CB 4.35Å; L292-E296 CarbonylContact O-C 3.59Å; L292-E296 WeakPolarHBondContact O-CA 3.47Å; L292-E296 WeakPolarHBondContact O-CB 3.32Å; L292-E296 PolarHBondContact O-N 3.46Å; E296-A298 PolarHBondContact O-N 2.61Å; E296-A298 VanDerWaalsContact O-N 3.07Å
297	D	77.8	Confident	87.1	Confident	137 Å²	137	36.5 Å²	36.5	73%	0.733	17%	0.169	S	C	*	.			trans	48.1	37.9	-178.6	-89.9	-33.1	0	0	0	113.5	I293	I293-D297 WeakPolarHBondContact O-CA 3.13Å; I293-D297 PolarHBondContact O-N 2.76Å
298	A	81.5	Confident	86.9	Confident	1 Å²	1	32.6 Å²	32.6	1%	0.008	16%	0.156	C	C	.	.			trans	-64.8	145.8	177.3	0	0	0	0	0	111.9	L292 I293 E296	L292-A298 HydrophobicContact CB-CB 4.42Å; L292-A298 HydrophobicContact CD2-CB 4.09Å; L292-A298 HydrophobicContact CG-CB 4.02Å; L292-A298 PolarHBondContact O-N 3.29Å; I293-A298 HydrophobicContact CG1-CB 4.24Å; I293-A298 WeakPolarHBondContact CG1-O 3.46Å; E296-A298 PolarHBondContact O-N 2.61Å; E296-A298 VanDerWaalsContact O-N 3.07Å
299	D	84.3	Confident	86.8	Confident	54 Å²	54	30 Å²	30	29%	0.289	15%	0.145	S	C	.	.			trans	-71.5	138.7	175.6	-34.3	-82.6	0	0	0	111.3	R68 N72 G301 S302 V303	R68-D299 IonicContact NH2-OD2 3.34Å; N72-D299 WeakPolarHBondContact OD1-CB 3.47Å; D299-G301 VanDerWaalsContact C-N 3.29Å; D299-G301 PolarHBondContact O-N 2.82Å; D299-S302 WeakPolarHBondContact O-CA 3.3Å; D299-S302 WeakPolarHBondContact O-CB 3.09Å; D299-S302 PolarHBondContact O-N 3.35Å; D299-S302 PolarHBondContact OD2-OG 3.21Å; D299-V303 PolarHBondContact O-N 2.79Å
300	P	84.8	Confident	86.6	Confident	0 Å²	0	30.4 Å²	30.4	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-57.4	-39.2	175.1	-27.7	35.5	0	0	0	114.1	F75 I293 S302 V303 I304 F717 R720	F75-P300 HydrophobicContact CD2-CB 4.36Å; F75-P300 HydrophobicContact CE2-CB 4.42Å; I293-P300 HydrophobicContact CD1-CB 4.38Å; I293-P300 HydrophobicContact CD1-CG 4.33Å; P300-S302 PolarHBondContact O-N 2.87Å; P300-V303 PolarHBondContact O-N 3.16Å; P300-V303 VanDerWaalsContact O-N 3.16Å; P300-I304 PolarHBondContact O-N 3.47Å; P300-I304 VanDerWaalsContact O-N 3.15Å; P300-F717 HydrophobicContact CB-CB 3.94Å; P300-F717 HydrophobicContact CB-CD1 4.18Å; P300-F717 HydrophobicContact CB-CD2 3.6Å; P300-F717 HydrophobicContact CB-CE2 4.07Å; P300-F717 HydrophobicContact CB-CG 3.66Å; P300-F717 HydrophobicContact CG-CB 3.93Å; P300-F717 HydrophobicContact CG-CD1 4.49Å; P300-F717 HydrophobicContact CG-CD2 4.48Å; P300-F717 HydrophobicContact CG-CG 4.09Å; P300-R720 VanDerWaalsContact CG-CZ 3.49Å
301	G	86.5	Confident	86.3	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-62.3	-30.5	176.4	0	0	0	0	0	112.1	N72 D299 A305	N72-G301 VanDerWaalsContact OD1-CA 3.24Å; N72-G301 WeakPolarHBondContact OD1-CA 3.25Å; N72-G301 PolarHBondContact OD1-N 3.2Å; D299-G301 VanDerWaalsContact C-N 3.29Å; D299-G301 PolarHBondContact O-N 2.82Å; G301-A305 VanDerWaalsContact O-CB 3.25Å; G301-A305 WeakPolarHBondContact O-CB 3.41Å; G301-A305 PolarHBondContact O-N 3.28Å
302	S	89.3	Confident	86.1	Confident	0 Å²	0	30.3 Å²	30.3	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-67.6	-40.2	176.2	-57.5	0	0	0	0	111.3	R68 D299 P300 A305 V306	R68-S302 VanDerWaalsContact CZ-OG 3.29Å; R68-S302 PolarHBondContact NE-OG 2.65Å; R68-S302 PolarHBondContact NH2-OG 3.11Å; D299-S302 WeakPolarHBondContact O-CA 3.3Å; D299-S302 WeakPolarHBondContact O-CB 3.09Å; D299-S302 PolarHBondContact O-N 3.35Å; D299-S302 PolarHBondContact OD2-OG 3.21Å; P300-S302 PolarHBondContact O-N 2.87Å; S302-A305 PolarHBondContact O-N 3.07Å; S302-V306 VanDerWaalsContact O-CG2 3.32Å; S302-V306 WeakPolarHBondContact O-CG2 3.33Å; S302-V306 PolarHBondContact O-N 2.84Å; S302-V306 VanDerWaalsContact O-N 3.14Å
303	V	89.8	Confident	85.9	Confident	1 Å²	1	30 Å²	30	1%	0.006	15%	0.148	C	C	.	.	H	α-helix	trans	-63	-47.3	176.2	176.2	0	0	0	0	111.4	L186 I293 D299 P300 V306 F307 F717	L186-V303 HydrophobicContact CD2-CB 4.04Å; L186-V303 HydrophobicContact CD2-CG1 3.93Å; L186-V303 HydrophobicContact CD2-CG2 4.06Å; I293-V303 HydrophobicContact CD1-CG2 3.79Å; I293-V303 HydrophobicContact CG1-CG2 3.83Å; D299-V303 PolarHBondContact O-N 2.79Å; P300-V303 PolarHBondContact O-N 3.16Å; P300-V303 VanDerWaalsContact O-N 3.16Å; V303-V306 PolarHBondContact O-N 2.82Å; V303-F307 PolarHBondContact O-N 3.33Å; V303-F307 VanDerWaalsContact O-N 3.11Å; V303-F717 HydrophobicContact CB-CZ 4.45Å; V303-F717 HydrophobicContact CG1-CZ 4.3Å
304	I	88.7	Confident	85.6	Confident	0 Å²	0	30.4 Å²	30.4	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-64.2	-43.5	179.5	-68.6	157.4	0	0	0	111.2	F67 I71 P300 V306 F307 I308 Y714 F717	F67-I304 HydrophobicContact CD1-CG2 4.38Å; F67-I304 HydrophobicContact CE1-CG2 3.96Å; I71-I304 HydrophobicContact CD1-CB 4.02Å; I71-I304 HydrophobicContact CD1-CD1 3.64Å; I71-I304 HydrophobicContact CD1-CG1 4.46Å; I71-I304 HydrophobicContact CD1-CG2 3.7Å; I71-I304 HydrophobicContact CG1-CD1 4.46Å; I71-I304 HydrophobicContact CG2-CD1 3.96Å; P300-I304 PolarHBondContact O-N 3.47Å; P300-I304 VanDerWaalsContact O-N 3.15Å; I304-V306 PolarHBondContact O-N 3.23Å; I304-F307 PolarHBondContact O-N 3.17Å; I304-I308 HydrophobicContact CG2-CD1 3.51Å; I304-I308 HydrophobicContact CG2-CG1 4.09Å; I304-I308 WeakPolarHBondContact O-CG1 3.41Å; I304-I308 PolarHBondContact O-N 3.43Å; I304-Y714 HydrophobicContact CD1-CD1 3.8Å; I304-Y714 HydrophobicContact CD1-CE1 3.17Å; I304-Y714 HydrophobicContact CD1-CE2 4.4Å; I304-Y714 HydrophobicContact CG1-CE1 4.26Å; I304-F717 HydrophobicContact CD1-CD2 4.34Å; I304-F717 HydrophobicContact CD1-CE2 3.69Å; I304-F717 HydrophobicContact CG1-CE2 3.97Å
305	A	89.9	Confident	85.4	Confident	1 Å²	1	28.3 Å²	28.3	1%	0.008	15%	0.147	C	C	.	.	H	α-helix	trans	-62.9	-42.1	-179	0	0	0	0	0	112.7	I64 R68 G301 S302 N309	I64-A305 HydrophobicContact CG2-CB 3.8Å; R68-A305 HydrophobicContact CB-CB 3.98Å; R68-A305 HydrophobicContact CG-CB 4.41Å; G301-A305 VanDerWaalsContact O-CB 3.25Å; G301-A305 WeakPolarHBondContact O-CB 3.41Å; G301-A305 PolarHBondContact O-N 3.28Å; S302-A305 PolarHBondContact O-N 3.07Å; A305-N309 WeakPolarHBondContact O-CB 3.01Å; A305-N309 PolarHBondContact O-N 2.76Å; A305-N309 PolarHBondContact O-ND2 2.8Å; A305-N309 VanDerWaalsContact O-ND2 3.08Å
306	V	90.5	Very high	85.6	Confident	0 Å²	0	25.1 Å²	25.1	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-64.4	-45.3	176.3	173.5	0	0	0	0	110.7	V182 K183 L186 A187 S302 V303 I304 I310	V182-V306 HydrophobicContact CB-CG2 4.04Å; V182-V306 HydrophobicContact CG1-CG2 3.93Å; K183-V306 HydrophobicContact CB-CG2 4.3Å; L186-V306 HydrophobicContact CB-CG1 4.23Å; L186-V306 HydrophobicContact CD2-CB 3.83Å; L186-V306 HydrophobicContact CD2-CG1 3.99Å; L186-V306 HydrophobicContact CD2-CG2 4.28Å; L186-V306 HydrophobicContact CG-CB 4.25Å; L186-V306 HydrophobicContact CG-CG1 3.83Å; A187-V306 HydrophobicContact CB-CG1 4.09Å; S302-V306 VanDerWaalsContact O-CG2 3.32Å; S302-V306 WeakPolarHBondContact O-CG2 3.33Å; S302-V306 PolarHBondContact O-N 2.84Å; S302-V306 VanDerWaalsContact O-N 3.14Å; V303-V306 PolarHBondContact O-N 2.82Å; I304-V306 PolarHBondContact O-N 3.23Å; V306-I310 HydrophobicContact CG1-CD1 3.68Å; V306-I310 WeakPolarHBondContact O-CB 3.42Å; V306-I310 WeakPolarHBondContact O-CG1 2.96Å; V306-I310 PolarHBondContact O-N 3.4Å; V306-I310 VanDerWaalsContact O-N 3.08Å
307	F	87.8	Confident	85.7	Confident	10 Å²	10	22 Å²	22	4%	0.044	12%	0.116	C	C	.	.	H	α-helix	trans	-59.2	-53.7	177.3	169.4	-106	0	0	0	112.3	A282 V285 F286 V303 I304 N309 I310 L311 Y710	A282-F307 HydrophobicContact CB-CE2 3.48Å; A282-F307 VanDerWaalsContact CB-CE2 3.48Å; A282-F307 HydrophobicContact CB-CZ 3.71Å; V285-F307 HydrophobicContact CB-CD2 4.21Å; V285-F307 HydrophobicContact CG1-CB 3.88Å; V285-F307 HydrophobicContact CG1-CD2 4.04Å; V285-F307 HydrophobicContact CG1-CG 4.42Å; F286-F307 HydrophobicContact CE1-CB 4.06Å; F286-F307 AromaticContact CE1-CD1 3.75Å; F286-F307 HydrophobicContact CE1-CD1 3.75Å; F286-F307 HydrophobicContact CE1-CD2 4.36Å; F286-F307 HydrophobicContact CE1-CE1 4.31Å; F286-F307 AromaticContact CE1-CG 3.76Å; F286-F307 HydrophobicContact CE1-CG 3.76Å; F286-F307 HydrophobicContact CE2-CD1 4.3Å; F286-F307 HydrophobicContact CE2-CD2 4.48Å; F286-F307 HydrophobicContact CE2-CE1 4.06Å; F286-F307 HydrophobicContact CE2-CE2 4.27Å; F286-F307 HydrophobicContact CE2-CG 4.49Å; F286-F307 HydrophobicContact CE2-CZ 4.03Å; F286-F307 HydrophobicContact CZ-CB 4.41Å; F286-F307 AromaticContact CZ-CD1 3.31Å; F286-F307 HydrophobicContact CZ-CD1 3.31Å; F286-F307 HydrophobicContact CZ-CD2 4.02Å; F286-F307 AromaticContact CZ-CE1 3.41Å; F286-F307 HydrophobicContact CZ-CE1 3.41Å; F286-F307 VanDerWaalsContact CZ-CE1 3.41Å; F286-F307 HydrophobicContact CZ-CE2 4.13Å; F286-F307 AromaticContact CZ-CG 3.62Å; F286-F307 HydrophobicContact CZ-CG 3.62Å; F286-F307 AromaticContact CZ-CZ 3.82Å; F286-F307 HydrophobicContact CZ-CZ 3.82Å; V303-F307 PolarHBondContact O-N 3.33Å; V303-F307 VanDerWaalsContact O-N 3.11Å; I304-F307 PolarHBondContact O-N 3.17Å; F307-N309 PolarHBondContact O-N 3.37Å; F307-I310 PolarHBondContact O-N 3.31Å; F307-L311 HydrophobicContact CE1-CD2 4.16Å; F307-L311 HydrophobicContact CZ-CD2 3.86Å; F307-L311 VanDerWaalsContact O-CB 3.32Å; F307-L311 WeakPolarHBondContact O-CB 3.41Å; F307-L311 PolarHBondContact O-N 2.78Å; F307-Y710 HydrophobicContact CD1-CE2 4.39Å; F307-Y710 HydrophobicContact CE1-CE2 4.32Å
308	I	87.7	Confident	85.7	Confident	30 Å²	30	16 Å²	16	15%	0.154	9%	0.087	C	C	.	.	H	α-helix	trans	-64.8	-42.1	-176.2	-59.7	174.5	0	0	0	110.3	I64 F67 I304 I310 L311 L312	I64-I308 HydrophobicContact CD1-CB 4.03Å; I64-I308 HydrophobicContact CD1-CG2 3.35Å; I64-I308 HydrophobicContact CG1-CG2 4.03Å; I64-I308 HydrophobicContact CG2-CB 4.39Å; F67-I308 HydrophobicContact CD1-CD1 4.17Å; F67-I308 HydrophobicContact CE1-CD1 3.92Å; I304-I308 HydrophobicContact CG2-CD1 3.51Å; I304-I308 HydrophobicContact CG2-CG1 4.09Å; I304-I308 WeakPolarHBondContact O-CG1 3.41Å; I304-I308 PolarHBondContact O-N 3.43Å; I308-I310 PolarHBondContact O-N 2.79Å; I308-L311 PolarHBondContact O-N 3Å; I308-L312 HydrophobicContact CG2-CD1 4.07Å; I308-L312 HydrophobicContact CG2-CG 4.11Å; I308-L312 WeakPolarHBondContact O-CB 3.28Å; I308-L312 WeakPolarHBondContact O-CG 3.49Å; I308-L312 PolarHBondContact O-N 3.48Å
309	N	90.3	Very high	85.6	Confident	0 Å²	0	20.2 Å²	20.2	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-64.3	-38.8	179.9	-83.3	-39.5	0	0	0	113	P61 I64 G175 I178 A305 F307 G313	P61-N309 WeakPolarHBondContact CA-OD1 3.39Å; P61-N309 WeakPolarHBondContact CB-OD1 3.35Å; P61-N309 PolarHBondContact O-OD1 3.42Å; I64-N309 WeakPolarHBondContact CD1-OD1 3.34Å; G175-N309 WeakPolarHBondContact O-CB 3.44Å; I178-N309 VanDerWaalsContact CG2-ND2 3.29Å; I178-N309 WeakPolarHBondContact CG2-ND2 3.5Å; A305-N309 WeakPolarHBondContact O-CB 3.01Å; A305-N309 PolarHBondContact O-N 2.76Å; A305-N309 PolarHBondContact O-ND2 2.8Å; A305-N309 VanDerWaalsContact O-ND2 3.08Å; F307-N309 PolarHBondContact O-N 3.37Å; N309-G313 PolarHBondContact O-N 2.82Å
310	I	86.4	Confident	85.7	Confident	8 Å²	8	17.6 Å²	17.6	4%	0.041	10%	0.095	C	C	.	.	H	α-helix	trans	-75.2	-36.6	179	-67.6	172.3	0	0	0	110.9	A187 A190 L194 V306 F307 I308 G313 S314	A187-I310 HydrophobicContact CB-CD1 4.25Å; A190-I310 HydrophobicContact CB-CB 4.27Å; A190-I310 HydrophobicContact CB-CD1 3.21Å; A190-I310 HydrophobicContact CB-CG1 4.3Å; A190-I310 HydrophobicContact CB-CG2 4.02Å; L194-I310 HydrophobicContact CD2-CG2 4.17Å; L194-I310 HydrophobicContact CG-CG2 4.48Å; V306-I310 HydrophobicContact CG1-CD1 3.68Å; V306-I310 WeakPolarHBondContact O-CB 3.42Å; V306-I310 WeakPolarHBondContact O-CG1 2.96Å; V306-I310 PolarHBondContact O-N 3.4Å; V306-I310 VanDerWaalsContact O-N 3.08Å; F307-I310 PolarHBondContact O-N 3.31Å; I308-I310 PolarHBondContact O-N 2.79Å; I310-G313 PolarHBondContact O-N 3.18Å; I310-S314 WeakPolarHBondContact O-CB 3.15Å; I310-S314 PolarHBondContact O-N 3.24Å; I310-S314 PolarHBondContact O-OG 3.21Å
311	L	82.4	Confident	85.6	Confident	38 Å²	38	21.4 Å²	21.4	20%	0.199	11%	0.114	C	C	.	.	H	α-helix	trans	-63	-51.1	172.4	-179	66.6	0	0	0	111.6	I278 F307 I308 G313 S314 I315	I278-L311 HydrophobicContact CG2-CD1 3.96Å; F307-L311 HydrophobicContact CE1-CD2 4.16Å; F307-L311 HydrophobicContact CZ-CD2 3.86Å; F307-L311 VanDerWaalsContact O-CB 3.32Å; F307-L311 WeakPolarHBondContact O-CB 3.41Å; F307-L311 PolarHBondContact O-N 2.78Å; I308-L311 PolarHBondContact O-N 3Å; L311-G313 VanDerWaalsContact C-N 3.32Å; L311-G313 PolarHBondContact O-N 3.26Å; L311-S314 WeakPolarHBondContact O-CB 3.45Å; L311-S314 PolarHBondContact O-N 2.66Å; L311-I315 HydrophobicContact CD1-CD1 4.49Å; L311-I315 HydrophobicContact CG-CD1 4.21Å; L311-I315 WeakPolarHBondContact O-CG1 3.29Å; L311-I315 PolarHBondContact O-N 3.41Å
312	L	83.4	Confident	85.3	Confident	50 Å²	50	24.9 Å²	24.9	26%	0.262	14%	0.137	S	C	.	.	H	α-helix	trans	-61.9	-41.1	176.7	-75	-173.4	0	0	0	111.5	I64 I308 S314 I315 F316	I64-L312 HydrophobicContact CD1-CD1 3.47Å; I64-L312 VanDerWaalsContact CD1-CD1 3.47Å; I64-L312 HydrophobicContact CD1-CG 4.47Å; I308-L312 HydrophobicContact CG2-CD1 4.07Å; I308-L312 HydrophobicContact CG2-CG 4.11Å; I308-L312 WeakPolarHBondContact O-CB 3.28Å; I308-L312 WeakPolarHBondContact O-CG 3.49Å; I308-L312 PolarHBondContact O-N 3.48Å; L312-S314 VanDerWaalsContact C-N 3.3Å; L312-S314 PolarHBondContact O-N 3.27Å; L312-I315 PolarHBondContact O-N 3.32Å; L312-F316 HydrophobicContact CB-CD2 4.45Å; L312-F316 HydrophobicContact CB-CE2 4.16Å; L312-F316 WeakPolarHBondContact O-CB 3.35Å; L312-F316 WeakPolarHBondContact O-CD2 3.41Å; L312-F316 VanDerWaalsContact O-CG 3.29Å; L312-F316 WeakPolarHBondContact O-CG 3.24Å; L312-F316 PolarHBondContact O-N 3.4Å
313	G	85.2	Confident	85.1	Confident	0 Å²	0	25.5 Å²	25.5	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-56.9	-45.8	174.5	0	0	0	0	0	111.5	F172 N309 I310 L311 I315 F316 L317	F172-G313 WeakPolarHBondContact CD2-O 3.39Å; N309-G313 PolarHBondContact O-N 2.82Å; I310-G313 PolarHBondContact O-N 3.18Å; L311-G313 VanDerWaalsContact C-N 3.32Å; L311-G313 PolarHBondContact O-N 3.26Å; G313-I315 VanDerWaalsContact C-N 3.35Å; G313-I315 PolarHBondContact O-N 2.95Å; G313-F316 PolarHBondContact O-N 3.15Å; G313-L317 PolarHBondContact O-N 3.02Å
314	S	80.4	Confident	85	Confident	12 Å²	12	28.9 Å²	28.9	8%	0.084	16%	0.158	C	C	.	.	H	α-helix	trans	-60.3	-42.7	177	-57	0	0	0	0	112.6	L194 I310 L311 L312 L317 G318	L194-S314 WeakPolarHBondContact CD2-OG 3.35Å; I310-S314 WeakPolarHBondContact O-CB 3.15Å; I310-S314 PolarHBondContact O-N 3.24Å; I310-S314 PolarHBondContact O-OG 3.21Å; L311-S314 WeakPolarHBondContact O-CB 3.45Å; L311-S314 PolarHBondContact O-N 2.66Å; L312-S314 VanDerWaalsContact C-N 3.3Å; L312-S314 PolarHBondContact O-N 3.27Å; S314-L317 PolarHBondContact O-N 3.05Å; S314-G318 PolarHBondContact O-N 3.15Å
315	I	80.1	Confident	84.8	Confident	69 Å²	69	33 Å²	33	35%	0.354	19%	0.185	S	C	.	.	H	α-helix	trans	-66.1	-42.6	176.7	-66	166.5	0	0	0	110.7	L311 L312 G313 L317 G318 N319	L311-I315 HydrophobicContact CD1-CD1 4.49Å; L311-I315 HydrophobicContact CG-CD1 4.21Å; L311-I315 WeakPolarHBondContact O-CG1 3.29Å; L311-I315 PolarHBondContact O-N 3.41Å; L312-I315 PolarHBondContact O-N 3.32Å; G313-I315 VanDerWaalsContact C-N 3.35Å; G313-I315 PolarHBondContact O-N 2.95Å; I315-L317 PolarHBondContact O-N 3.49Å; I315-G318 PolarHBondContact O-N 3.39Å; I315-N319 PolarHBondContact O-N 3.1Å
316	F	88.2	Confident	84.7	Confident	20 Å²	20	38.6 Å²	38.6	9%	0.088	21%	0.206	C	C	.	.	H	α-helix	trans	-61.1	-43.9	176.6	-72.1	-41.2	0	0	0	111.7	F60 P61 N168 G171 F172 L312 G313 G318 N319 A320	F60-F316 HydrophobicContact CB-CE2 4.24Å; F60-F316 HydrophobicContact CB-CZ 3.87Å; F60-F316 HydrophobicContact CD2-CZ 4.07Å; F60-F316 HydrophobicContact CG-CZ 4.07Å; P61-F316 HydrophobicContact CG-CE2 4.44Å; N168-F316 HydrophobicContact CB-CB 4.31Å; N168-F316 WeakPolarHBondContact CB-O 3.47Å; N168-F316 WeakPolarHBondContact O-CB 3.45Å; N168-F316 WeakPolarHBondContact OD1-CD1 3.41Å; G171-F316 VanDerWaalsContact C-CD2 3.41Å; F172-F316 HydrophobicContact CB-CB 4.19Å; L312-F316 HydrophobicContact CB-CD2 4.45Å; L312-F316 HydrophobicContact CB-CE2 4.16Å; L312-F316 WeakPolarHBondContact O-CB 3.35Å; L312-F316 WeakPolarHBondContact O-CD2 3.41Å; L312-F316 VanDerWaalsContact O-CG 3.29Å; L312-F316 WeakPolarHBondContact O-CG 3.24Å; L312-F316 PolarHBondContact O-N 3.4Å; G313-F316 PolarHBondContact O-N 3.15Å; F316-G318 VanDerWaalsContact C-N 3.33Å; F316-G318 PolarHBondContact O-N 2.89Å; F316-N319 CarbonylContact O-C 3.57Å; F316-N319 PolarHBondContact O-N 3.47Å; F316-N319 VanDerWaalsContact O-N 3.14Å; F316-A320 WeakPolarHBondContact O-CB 3.36Å; F316-A320 PolarHBondContact O-N 3.06Å
317	L	84.8	Confident	84.7	Confident	32 Å²	32	39.7 Å²	39.7	17%	0.168	21%	0.212	C	C	.	.	H	α-helix	trans	-59.5	-45.3	174.4	-175.9	62.4	0	0	0	111.4	M169 F172 V198 G313 S314 I315 N319 A320 L321	M169-L317 HydrophobicContact CE-CD1 4.44Å; F172-L317 HydrophobicContact CD1-CD1 4.41Å; F172-L317 HydrophobicContact CD2-CB 3.93Å; F172-L317 HydrophobicContact CE1-CD1 4.42Å; F172-L317 HydrophobicContact CE2-CB 4.19Å; F172-L317 HydrophobicContact CE2-CD2 3.97Å; F172-L317 HydrophobicContact CG-CB 4.2Å; F172-L317 HydrophobicContact CZ-CD2 4Å; V198-L317 HydrophobicContact CG2-CD2 4.01Å; G313-L317 PolarHBondContact O-N 3.02Å; S314-L317 PolarHBondContact O-N 3.05Å; I315-L317 PolarHBondContact O-N 3.49Å; L317-N319 VanDerWaalsContact C-N 3.25Å; L317-N319 PolarHBondContact O-N 2.88Å; L317-A320 PolarHBondContact O-N 3.5Å; L317-A320 VanDerWaalsContact O-N 3.17Å; L317-L321 WeakPolarHBondContact O-CG 3.41Å; L317-L321 PolarHBondContact O-N 3.28Å
318	G	77.3	Confident	84.7	Confident	11 Å²	11	44.5 Å²	44.5	11%	0.113	24%	0.236	C	C	.	.	H	α-helix	trans	-58.8	-33.1	175.3	0	0	0	0	0	113.9	S314 I315 F316 P322	S314-G318 PolarHBondContact O-N 3.15Å; I315-G318 PolarHBondContact O-N 3.39Å; F316-G318 VanDerWaalsContact C-N 3.33Å; F316-G318 PolarHBondContact O-N 2.89Å; G318-P322 WeakPolarHBondContact O-CD 3.35Å
319	N	80.3	Confident	84.7	Confident	88 Å²	88	44.1 Å²	44.1	47%	0.471	24%	0.239	S	C	.	.	H	α-helix	trans	-84.8	-21.2	177.1	-70.8	-21.2	0	0	0	113.9	I315 F316 L317 N323	I315-N319 PolarHBondContact O-N 3.1Å; F316-N319 CarbonylContact O-C 3.57Å; F316-N319 PolarHBondContact O-N 3.47Å; F316-N319 VanDerWaalsContact O-N 3.14Å; L317-N319 VanDerWaalsContact C-N 3.25Å; L317-N319 PolarHBondContact O-N 2.88Å; N319-N323 PolarHBondContact O-ND2 3.43Å
320	A	85.8	Confident	84.7	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-75	-43.4	178.1	0	0	0	0	0	111.9	F165 N168 M169 F316 L317 N323	F165-A320 HydrophobicContact CD2-CB 4.15Å; F165-A320 HydrophobicContact CE2-CB 4.43Å; N168-A320 HydrophobicContact CB-CB 3.82Å; M169-A320 HydrophobicContact CE-CB 4.42Å; F316-A320 WeakPolarHBondContact O-CB 3.36Å; F316-A320 PolarHBondContact O-N 3.06Å; L317-A320 PolarHBondContact O-N 3.5Å; L317-A320 VanDerWaalsContact O-N 3.17Å; A320-N323 WeakPolarHBondContact O-CB 3.47Å; A320-N323 PolarHBondContact O-N 3.34Å; A320-N323 VanDerWaalsContact O-N 3.12Å
321	L	82.2	Confident	84.9	Confident	79 Å²	79	45 Å²	45	41%	0.414	25%	0.245	S	C	.	.	G	3₁₀ helix	trans	-58.7	-41.3	-173.1	-65	173	0	0	0	114.4	L317 N323 I324	L317-L321 WeakPolarHBondContact O-CG 3.41Å; L317-L321 PolarHBondContact O-N 3.28Å; L321-N323 PolarHBondContact O-N 2.59Å; L321-N323 VanDerWaalsContact O-N 3.08Å; L321-I324 HydrophobicContact CD2-CD1 4.01Å; L321-I324 PolarHBondContact O-N 3.37Å
322	P	80.5	Confident	85.2	Confident	73 Å²	73	47.5 Å²	47.5	47%	0.474	26%	0.262	S	S	.	.	G	3₁₀ helix	trans	-63.7	-12	177.8	-24.2	35.5	0	0	0	115.2	G318 P325 Y326	G318-P322 WeakPolarHBondContact O-CD 3.35Å; P322-P325 WeakPolarHBondContact O-CD 3.49Å; P322-Y326 WeakPolarHBondContact O-CD2 3.32Å; P322-Y326 WeakPolarHBondContact O-CE2 3.49Å
323	N	84.6	Confident	85.4	Confident	13 Å²	13	45.4 Å²	45.4	7%	0.07	25%	0.252	C	S	.	.	G	3₁₀ helix	trans	-84.4	-21.5	177.9	-63.8	-33.2	0	0	0	112.9	K161 F165 N319 A320 L321 Y326 I327	K161-N323 HydrophobicContact CB-CB 4.35Å; F165-N323 HydrophobicContact CB-CB 4.15Å; N319-N323 PolarHBondContact O-ND2 3.43Å; A320-N323 WeakPolarHBondContact O-CB 3.47Å; A320-N323 PolarHBondContact O-N 3.34Å; A320-N323 VanDerWaalsContact O-N 3.12Å; L321-N323 PolarHBondContact O-N 2.59Å; L321-N323 VanDerWaalsContact O-N 3.08Å; N323-Y326 PolarHBondContact O-N 2.57Å; N323-I327 PolarHBondContact O-N 2.87Å
324	I	87.7	Confident	85.7	Confident	72 Å²	72	45.4 Å²	45.4	37%	0.369	25%	0.252	S	S	.	.	H	α-helix	trans	-59	-44.4	-178.2	-63.2	173.6	0	0	0	112.5	F165 L321 Y326 I327 M328	F165-I324 HydrophobicContact CD2-CG1 4.26Å; F165-I324 HydrophobicContact CE2-CD1 4.22Å; F165-I324 HydrophobicContact CE2-CG1 3.99Å; L321-I324 HydrophobicContact CD2-CD1 4.01Å; L321-I324 PolarHBondContact O-N 3.37Å; I324-Y326 PolarHBondContact O-N 2.85Å; I324-I327 PolarHBondContact O-N 2.96Å; I324-I327 VanDerWaalsContact O-N 3.15Å; I324-M328 HydrophobicContact CG2-CG 4.18Å; I324-M328 WeakPolarHBondContact O-CG 3.26Å; I324-M328 PolarHBondContact O-N 3.32Å
325	P	86	Confident	86	Confident	87 Å²	87	48.4 Å²	48.4	57%	0.565	26%	0.263	S	S	*	.	H	α-helix	trans	-58.9	-32.3	177.8	-26	35.9	0	0	0	114	P322 G329	P322-P325 WeakPolarHBondContact O-CD 3.49Å; P325-G329 PolarHBondContact O-N 3.31Å
326	Y	88	Confident	86.1	Confident	118 Å²	118	49.1 Å²	49.1	46%	0.463	27%	0.268	S	S	.	.	H	α-helix	trans	-71.1	-39.8	177.1	-65	-90.2	0	0	0	111.6	K161 P322 N323 I324 G329 A330	K161-Y326 HydrophobicContact CD-CD2 4.47Å; K161-Y326 HydrophobicContact CG-CD1 4.41Å; K161-Y326 HydrophobicContact CG-CD2 4.37Å; K161-Y326 HydrophobicContact CG-CG 4Å; P322-Y326 WeakPolarHBondContact O-CD2 3.32Å; P322-Y326 WeakPolarHBondContact O-CE2 3.49Å; N323-Y326 PolarHBondContact O-N 2.57Å; I324-Y326 PolarHBondContact O-N 2.85Å; Y326-G329 PolarHBondContact O-N 3.31Å; Y326-A330 PolarHBondContact O-N 3.49Å
327	I	89.8	Confident	86.2	Confident	24 Å²	24	48.2 Å²	48.2	12%	0.123	26%	0.264	C	S	.	.	H	α-helix	trans	-63.9	-45.4	175.2	-63.3	171	0	0	0	110.2	F31 L162 F165 N323 I324 A330 V331	F31-I327 HydrophobicContact CD2-CG2 3.96Å; F31-I327 HydrophobicContact CE2-CG2 3.64Å; L162-I327 HydrophobicContact CD1-CD1 4.01Å; F165-I327 HydrophobicContact CB-CD1 4.31Å; F165-I327 HydrophobicContact CG-CD1 4.35Å; N323-I327 PolarHBondContact O-N 2.87Å; I324-I327 PolarHBondContact O-N 2.96Å; I324-I327 VanDerWaalsContact O-N 3.15Å; I327-A330 PolarHBondContact O-N 3.35Å; I327-V331 PolarHBondContact O-N 2.85Å
328	M	88.4	Confident	86.5	Confident	110 Å²	110	46.9 Å²	46.9	54%	0.542	26%	0.257	S	S	.	.	H	α-helix	trans	-65.9	-38.7	176.1	-67	-59.6	-63.9	0	0	112	I324 A330 V331 T332	I324-M328 HydrophobicContact CG2-CG 4.18Å; I324-M328 WeakPolarHBondContact O-CG 3.26Å; I324-M328 PolarHBondContact O-N 3.32Å; M328-A330 VanDerWaalsContact C-N 3.33Å; M328-A330 PolarHBondContact O-N 2.91Å; M328-V331 WeakPolarHBondContact O-CB 3.27Å; M328-V331 PolarHBondContact O-N 3.34Å; M328-T332 PolarHBondContact O-N 3.01Å; M328-T332 PolarHBondContact O-OG1 3.19Å
329	G	87.6	Confident	87	Confident	22 Å²	22	49.2 Å²	49.2	23%	0.227	28%	0.275	C	S	.	.	H	α-helix	trans	-59	-40.8	174.4	0	0	0	0	0	112.9	P325 Y326 T332 A333	P325-G329 PolarHBondContact O-N 3.31Å; Y326-G329 PolarHBondContact O-N 3.31Å; G329-T332 WeakPolarHBondContact CA-OG1 3.44Å; G329-T332 PolarHBondContact O-N 2.97Å; G329-T332 PolarHBondContact O-OG1 3.22Å; G329-A333 VanDerWaalsContact O-CB 3.25Å; G329-A333 WeakPolarHBondContact O-CB 3.28Å; G329-A333 PolarHBondContact O-N 3.02Å
330	A	90.4	Very high	87.4	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-63.1	-42.1	173.6	0	0	0	0	0	112.3	L34 Y326 I327 M328 A333 S334	L34-A330 HydrophobicContact CD1-CB 4.36Å; Y326-A330 PolarHBondContact O-N 3.49Å; I327-A330 PolarHBondContact O-N 3.35Å; M328-A330 VanDerWaalsContact C-N 3.33Å; M328-A330 PolarHBondContact O-N 2.91Å; A330-A333 PolarHBondContact O-N 3.26Å; A330-S334 VanDerWaalsContact O-CB 3.31Å; A330-S334 WeakPolarHBondContact O-CB 3.36Å; A330-S334 PolarHBondContact O-N 3.32Å; A330-S334 PolarHBondContact O-OG 3.1Å
331	V	90.6	Very high	87.5	Confident	26 Å²	26	46.7 Å²	46.7	16%	0.158	26%	0.262	C	S	.	.	H	α-helix	trans	-62.1	-45.5	175.7	174.8	0	0	0	0	110.8	V29 F31 L34 I327 M328 S334 K335	V29-V331 VanDerWaalsContact O-CG1 3.24Å; V29-V331 WeakPolarHBondContact O-CG1 3.38Å; F31-V331 HydrophobicContact CD2-CG2 4.12Å; L34-V331 HydrophobicContact CD1-CG2 4Å; I327-V331 PolarHBondContact O-N 2.85Å; M328-V331 WeakPolarHBondContact O-CB 3.27Å; M328-V331 PolarHBondContact O-N 3.34Å; V331-S334 PolarHBondContact O-N 3.28Å; V331-S334 PolarHBondContact O-OG 3.3Å; V331-K335 PolarHBondContact O-N 3.42Å
332	T	87.8	Confident	87.6	Confident	92 Å²	92	47.7 Å²	47.7	56%	0.564	27%	0.267	S	S	*	.	H	α-helix	trans	-66.1	-43.8	179.1	51.3	0	0	0	0	112.4	M328 G329 S334 K335	M328-T332 PolarHBondContact O-N 3.01Å; M328-T332 PolarHBondContact O-OG1 3.19Å; G329-T332 WeakPolarHBondContact CA-OG1 3.44Å; G329-T332 PolarHBondContact O-N 2.97Å; G329-T332 PolarHBondContact O-OG1 3.22Å; T332-S334 VanDerWaalsContact C-N 3.33Å; T332-S334 PolarHBondContact O-N 3.5Å; T332-K335 VanDerWaalsContact O-CB 3.32Å; T332-K335 WeakPolarHBondContact O-CB 3.45Å; T332-K335 PolarHBondContact O-N 2.97Å
333	A	88.5	Confident	87.6	Confident	5 Å²	5	49.4 Å²	49.4	4%	0.041	27%	0.269	C	S	.	.	H	α-helix	trans	-64.1	-37.1	178.5	0	0	0	0	0	112.3	N150 I154 G329 A330 K335	N150-A333 HydrophobicContact CB-CB 3.86Å; I154-A333 HydrophobicContact CD1-CB 4.47Å; I154-A333 HydrophobicContact CG1-CB 4.1Å; G329-A333 VanDerWaalsContact O-CB 3.25Å; G329-A333 WeakPolarHBondContact O-CB 3.28Å; G329-A333 PolarHBondContact O-N 3.02Å; A330-A333 PolarHBondContact O-N 3.26Å; A333-K335 PolarHBondContact O-N 2.93Å
334	S	90.1	Very high	86.9	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-66.5	-23	178.4	72.7	0	0	0	0	113.8	L34 A330 V331 T332 F338	L34-S334 VanDerWaalsContact CD2-OG 3.26Å; L34-S334 WeakPolarHBondContact CD2-OG 3.46Å; A330-S334 VanDerWaalsContact O-CB 3.31Å; A330-S334 WeakPolarHBondContact O-CB 3.36Å; A330-S334 PolarHBondContact O-N 3.32Å; A330-S334 PolarHBondContact O-OG 3.1Å; V331-S334 PolarHBondContact O-N 3.28Å; V331-S334 PolarHBondContact O-OG 3.3Å; T332-S334 VanDerWaalsContact C-N 3.33Å; T332-S334 PolarHBondContact O-N 3.5Å; S334-F338 WeakPolarHBondContact O-CB 3.29Å; S334-F338 WeakPolarHBondContact O-CG 3.35Å; S334-F338 PolarHBondContact O-N 3.37Å
335	K	86.3	Confident	86.1	Confident	76 Å²	76	49.1 Å²	49.1	33%	0.33	27%	0.271	S	S	.	.	H	α-helix	trans	-60.5	-50.9	-175.9	-172.3	-168.7	171.8	-148.5	0	111.7	V29 V331 T332 A333 A339	V29-K335 HydrophobicContact CG2-CB 4.18Å; V29-K335 HydrophobicContact CG2-CG 4.4Å; V331-K335 PolarHBondContact O-N 3.42Å; T332-K335 VanDerWaalsContact O-CB 3.32Å; T332-K335 WeakPolarHBondContact O-CB 3.45Å; T332-K335 PolarHBondContact O-N 2.97Å; A333-K335 PolarHBondContact O-N 2.93Å; K335-A339 WeakPolarHBondContact O-CB 3.07Å; K335-A339 PolarHBondContact O-N 2.9Å
336	D	83.5	Confident	85.3	Confident	84 Å²	84	52 Å²	52	45%	0.449	28%	0.277	S	S	.	.	H	α-helix	trans	-78.5	-35.7	-175.2	-56.5	-26	0	0	0	110.8	T340	D336-T340 PolarHBondContact O-N 3.17Å; D336-T340 VanDerWaalsContact O-N 3.08Å; D336-T340 PolarHBondContact O-OG1 2.9Å
337	I	89.4	Confident	84.5	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-64	-51.2	175.5	-65.8	175.9	0	0	0	110.6	I119 Y123 N146 N150 L151 I154 T340 I341	I119-I337 HydrophobicContact CG2-CG2 3.86Å; Y123-I337 HydrophobicContact CD2-CB 4.27Å; Y123-I337 HydrophobicContact CD2-CG1 4.47Å; Y123-I337 HydrophobicContact CD2-CG2 3.69Å; Y123-I337 HydrophobicContact CE2-CB 4.47Å; Y123-I337 HydrophobicContact CE2-CG1 4.38Å; Y123-I337 HydrophobicContact CE2-CG2 4.37Å; Y123-I337 HydrophobicContact CG-CG2 4.13Å; N146-I337 HydrophobicContact CB-CG1 4.23Å; N150-I337 HydrophobicContact CB-CD1 3.93Å; L151-I337 HydrophobicContact CD2-CD1 4.18Å; L151-I337 HydrophobicContact CG-CD1 4.25Å; I154-I337 HydrophobicContact CD1-CD1 3.82Å; I337-T340 WeakPolarHBondContact O-CB 3.37Å; I337-T340 PolarHBondContact O-N 3.24Å; I337-I341 HydrophobicContact CG2-CD1 3.87Å; I337-I341 WeakPolarHBondContact O-CG1 3.48Å; I337-I341 PolarHBondContact O-N 2.68Å
338	F	91.5	Very high	83.4	Confident	5 Å²	5	47.9 Å²	47.9	2%	0.022	26%	0.262	C	S	.	.	H	α-helix	trans	-71.3	-35.1	-178	-64.7	-5.5	0	0	0	111.7	V29 K33 L34 Y37 I119 S334 T340 I341 D342	V29-F338 HydrophobicContact CG1-CD2 4.04Å; V29-F338 HydrophobicContact CG1-CE2 4.25Å; K33-F338 WeakPolarHBondContact O-CE2 3.33Å; L34-F338 HydrophobicContact CD2-CE2 4.26Å; L34-F338 HydrophobicContact CD2-CZ 4.45Å; Y37-F338 HydrophobicContact CD2-CD1 4.38Å; Y37-F338 AromaticContact CD2-CE1 3.9Å; Y37-F338 HydrophobicContact CD2-CE1 3.9Å; Y37-F338 HydrophobicContact CD2-CZ 4.21Å; Y37-F338 AromaticContact CE2-CD1 3.66Å; Y37-F338 HydrophobicContact CE2-CD1 3.66Å; Y37-F338 AromaticContact CE2-CE1 3.64Å; Y37-F338 HydrophobicContact CE2-CE1 3.64Å; Y37-F338 HydrophobicContact CE2-CG 4.19Å; Y37-F338 HydrophobicContact CE2-CZ 4.15Å; I119-F338 HydrophobicContact CD1-CE1 4.16Å; I119-F338 HydrophobicContact CD1-CZ 4.31Å; I119-F338 HydrophobicContact CG1-CE1 4.47Å; I119-F338 HydrophobicContact CG2-CE1 4.11Å; S334-F338 WeakPolarHBondContact O-CB 3.29Å; S334-F338 WeakPolarHBondContact O-CG 3.35Å; S334-F338 PolarHBondContact O-N 3.37Å; F338-T340 PolarHBondContact O-N 2.94Å; F338-I341 HydrophobicContact CD1-CD1 4.22Å; F338-I341 PolarHBondContact O-N 3.46Å; F338-D342 VanDerWaalsContact O-CB 3.31Å; F338-D342 WeakPolarHBondContact O-CB 3.44Å; F338-D342 VanDerWaalsContact O-CG 3.31Å; F338-D342 PolarHBondContact O-N 3.11Å
339	A	87.6	Confident	82	Confident	59 Å²	59	49.3 Å²	49.3	49%	0.488	27%	0.265	S	S	.	.	H	α-helix	trans	-58.4	-37	170.8	0	0	0	0	0	111.9	K335 H343	K335-A339 WeakPolarHBondContact O-CB 3.07Å; K335-A339 PolarHBondContact O-N 2.9Å; A339-H343 WeakPolarHBondContact O-CB 3.45Å; A339-H343 PolarHBondContact O-N 2.99Å
340	T	88.8	Confident	80.4	Confident	11 Å²	11	53.7 Å²	53.7	7%	0.067	28%	0.277	C	S	.	.	H	α-helix	trans	-70.1	-44.3	175.5	-53.3	0	0	0	0	111.5	Y123 V127 K130 W134 D336 I337 F338	Y123-T340 HydrophobicContact CD2-CG2 4.2Å; Y123-T340 HydrophobicContact CE2-CG2 3.7Å; V127-T340 HydrophobicContact CG2-CG2 4.09Å; K130-T340 WeakPolarHBondContact CE-O 3.47Å; K130-T340 PolarHBondContact NZ-O 3.45Å; W134-T340 HydrophobicContact CH2-CG2 4.08Å; W134-T340 HydrophobicContact CZ2-CG2 3.74Å; D336-T340 PolarHBondContact O-N 3.17Å; D336-T340 VanDerWaalsContact O-N 3.08Å; D336-T340 PolarHBondContact O-OG1 2.9Å; I337-T340 WeakPolarHBondContact O-CB 3.37Å; I337-T340 PolarHBondContact O-N 3.24Å; F338-T340 PolarHBondContact O-N 2.94Å
341	I	88.3	Confident	79	Confident	25 Å²	25	56.9 Å²	56.9	13%	0.128	30%	0.295	C	S	.	.	H	α-helix	trans	-66.9	-44	-179.6	-63.4	166.8	0	0	0	111.8	Y37 I119 L122 Y123 A126 I337 F338 H343	Y37-I341 HydrophobicContact CE1-CG2 4.03Å; Y37-I341 HydrophobicContact CE2-CD1 3.99Å; Y37-I341 HydrophobicContact CE2-CG2 4.44Å; Y37-I341 WeakPolarHBondContact OH-CG2 3.45Å; I119-I341 HydrophobicContact CG2-CD1 4.18Å; L122-I341 HydrophobicContact CB-CD1 4.3Å; L122-I341 HydrophobicContact CB-CG2 4.44Å; Y123-I341 HydrophobicContact CD2-CG1 4.21Å; A126-I341 HydrophobicContact CB-CG1 4.42Å; I337-I341 HydrophobicContact CG2-CD1 3.87Å; I337-I341 WeakPolarHBondContact O-CG1 3.48Å; I337-I341 PolarHBondContact O-N 2.68Å; F338-I341 HydrophobicContact CD1-CD1 4.22Å; F338-I341 PolarHBondContact O-N 3.46Å; I341-H343 VanDerWaalsContact C-N 3.32Å; I341-H343 PolarHBondContact O-N 3.37Å
342	D	85.4	Confident	77.7	Confident	100 Å²	100	67.6 Å²	67.6	54%	0.535	33%	0.332	S	S	.	.	H	α-helix	trans	-76.4	-21.6	-174.1	-67.9	-22.5	0	0	0	112.4	Y37 F338	Y37-D342 PolarHBondContact OH-OD1 3.35Å; F338-D342 VanDerWaalsContact O-CB 3.31Å; F338-D342 WeakPolarHBondContact O-CB 3.44Å; F338-D342 VanDerWaalsContact O-CG 3.31Å; F338-D342 PolarHBondContact O-N 3.11Å
343	H	78.6	Confident	77.1	Confident	109 Å²	109	64.1 Å²	64.1	51%	0.505	32%	0.315	S	S	.	.	P	Polyproline II helix	trans	-84.5	123.2	178.8	-176.6	-78.3	0	0	0	111.6	K130 A339 I341	K130-H343 PolarHBondContact NZ-ND1 2.99Å; K130-H343 PolarHBondContact NZ-O 3.19Å; A339-H343 WeakPolarHBondContact O-CB 3.45Å; A339-H343 PolarHBondContact O-N 2.99Å; I341-H343 VanDerWaalsContact C-N 3.32Å; I341-H343 PolarHBondContact O-N 3.37Å
344	V	71.1	Confident	76.9	Confident	76 Å²	76	69.9 Å²	69.9	46%	0.461	34%	0.339	S	S	.	.	P	Polyproline II helix	trans	-102.6	124.8	172	-176.3	0	0	0	0	109.3	K349	V344-K349 HydrophobicContact CB-CG 4.43Å; V344-K349 HydrophobicContact CG1-CG 3.85Å; V344-K349 WeakPolarHBondContact O-CE 3.13Å
345	S	71.4	Confident	76.6	Confident	3 Å²	3	75.3 Å²	75.3	2%	0.021	37%	0.366	C	S	.	.	P	Polyproline II helix	trans	-63.3	144.1	179	-68.3	0	0	0	0	111.5	D131 I347 E348 K349	D131-S345 PolarHBondContact N-OG 3.42Å; D131-S345 WeakPolarHBondContact OD1-CB 3.37Å; D131-S345 PolarHBondContact OD1-OG 3.3Å; S345-I347 VanDerWaalsContact C-N 3.3Å; S345-I347 PolarHBondContact O-N 3.46Å; S345-E348 PolarHBondContact O-N 2.98Å; S345-K349 PolarHBondContact O-N 3.03Å
346	E	69	Low	76.3	Confident	148 Å²	148	73 Å²	73	69%	0.692	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-36.8	-173.9	-63.5	-164.8	153.1	0	0	113.1	E348 K349	E346-E348 PolarHBondContact O-N 2.59Å; E346-K349 PolarHBondContact O-N 3.16Å
347	I	70.4	Confident	75.9	Confident	16 Å²	16	73.9 Å²	73.9	8%	0.082	37%	0.371	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-34.4	179.3	-59.9	179.3	0	0	0	111.2	D131 S345 R413 I434	D131-I347 HydrophobicContact CB-CD1 3.96Å; S345-I347 VanDerWaalsContact C-N 3.3Å; S345-I347 PolarHBondContact O-N 3.46Å; I347-R413 HydrophobicContact CG2-CG 4.41Å; I347-I434 HydrophobicContact CG2-CD1 3.38Å
348	E	66.5	Low	75.5	Confident	39 Å²	39	80.3 Å²	80.3	18%	0.182	41%	0.405	C	S	.	.	G	3₁₀ helix	trans	-89.5	-20.8	-177.9	-73.4	-160.8	165.2	0	0	115.1	H129 S345 E346 K350 D351	H129-E348 WeakPolarHBondContact CA-OE1 3.37Å; H129-E348 WeakPolarHBondContact CB-OE1 3.42Å; H129-E348 WeakPolarHBondContact CB-OE2 3.21Å; H129-E348 IonicContact CD2-OE1 3.18Å; H129-E348 PolarHBondContact CD2-OE1 3.33Å; H129-E348 IonicContact CD2-OE2 3.23Å; H129-E348 PolarHBondContact CD2-OE2 3.48Å; H129-E348 IonicContact CG-OE1 3.51Å; H129-E348 IonicContact CG-OE2 3.62Å; S345-E348 PolarHBondContact O-N 2.98Å; E346-E348 PolarHBondContact O-N 2.59Å; E348-K350 PolarHBondContact O-N 3.11Å; E348-D351 PolarHBondContact O-N 3.11Å
349	K	59	Low	75.1	Confident	140 Å²	140	80.7 Å²	80.7	61%	0.609	41%	0.407	S	S	*	.	G	3₁₀ helix	trans	-53.2	-20.6	175.4	-73.5	179.2	-176	167.1	0	112.4	V344 S345 E346	V344-K349 HydrophobicContact CB-CG 4.43Å; V344-K349 HydrophobicContact CG1-CG 3.85Å; V344-K349 WeakPolarHBondContact O-CE 3.13Å; S345-K349 PolarHBondContact O-N 3.03Å; E346-K349 PolarHBondContact O-N 3.16Å
350	K	54.6	Low	75	Confident	113 Å²	113	80.9 Å²	80.9	49%	0.491	40%	0.4	S	S	.	.	G	3₁₀ helix	trans	-106.9	25.3	-178.7	-63	-173.5	179	-179.7	0	114.7	E348 R352 G353	E348-K350 PolarHBondContact O-N 3.11Å; K350-R352 PolarHBondContact O-N 2.71Å; K350-G353 PolarHBondContact O-N 2.99Å
351	D	59.9	Low	74.7	Confident	68 Å²	68	80.4 Å²	80.4	36%	0.364	40%	0.396	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-12.4	173.8	-165.1	31.9	0	0	0	113.2	E348 G353 N433 H435	E348-D351 PolarHBondContact O-N 3.11Å; D351-G353 PolarHBondContact O-N 3.1Å; D351-N433 PolarHBondContact O-ND2 3.12Å; D351-N433 PolarHBondContact OD1-ND2 3.13Å; D351-H435 IonicContact OD1-CD2 3.51Å; D351-H435 PolarHBondContact OD1-CD2 3.15Å; D351-H435 IonicContact OD2-CD2 2.81Å
352	R	64.4	Low	74.8	Confident	251 Å²	251	80.4 Å²	80.4	95%	0.947	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.2	24.8	170	-59.4	-176.1	-177.1	174.5	0.9	114.6	K350	K350-R352 PolarHBondContact O-N 2.71Å
353	G	75.4	Confident	75.2	Confident	19 Å²	19	75.6 Å²	75.6	20%	0.196	37%	0.373	C	S	.	.	P	Polyproline II helix	trans	-66.5	171.8	-179.8	0	0	0	0	0	114.3	K350 D351 E431	K350-G353 PolarHBondContact O-N 2.99Å; D351-G353 PolarHBondContact O-N 3.1Å; G353-E431 CarbonylContact C-O 3.59Å; G353-E431 WeakPolarHBondContact CA-O 3.45Å
354	K	83.2	Confident	76	Confident	126 Å²	126	72 Å²	72	55%	0.548	36%	0.358	S	S	.	.	B	Isolated β-bridge	trans	-65.9	133.9	178.8	-170.5	177.6	179.2	-176.3	0	110.4	V427 E431 L432 N433	K354-V427 HydrophobicContact CD-CG1 4.49Å; K354-E431 PolarHBondContact N-O 3.37Å; K354-L432 HydrophobicContact CB-CD2 4.4Å; K354-L432 WeakPolarHBondContact O-CA 3.48Å; K354-N433 PolarHBondContact O-N 3.16Å; K354-N433 VanDerWaalsContact O-N 3.08Å
355	I	83.7	Confident	77.1	Confident	113 Å²	113	68.6 Å²	68.6	58%	0.579	34%	0.337	S	S	*	.	P	Polyproline II helix	trans	-94.1	121.4	174	-61.8	176.8	0	0	0	107.3	N433 N436	I355-N433 HydrophobicContact CG1-CB 4.15Å; I355-N436 VanDerWaalsContact CG2-ND2 3.28Å; I355-N436 WeakPolarHBondContact CG2-ND2 3.48Å
356	L	81.5	Confident	78.1	Confident	27 Å²	27	74.3 Å²	74.3	14%	0.141	36%	0.359	C	S	.	.	P	Polyproline II helix	trans	-88	118.4	170.5	-64.4	168.9	0	0	0	108.4	F359 I424 V427 L432	L356-F359 HydrophobicContact CD1-CD2 4.47Å; L356-I424 HydrophobicContact CD1-CG2 4.07Å; L356-V427 HydrophobicContact CD2-CG2 4.38Å; L356-L432 HydrophobicContact CD1-CD1 3.85Å; L356-L432 HydrophobicContact CD1-CD2 3.63Å; L356-L432 HydrophobicContact CD1-CG 4.42Å; L356-L432 HydrophobicContact CD2-CD2 4.42Å; L356-L432 HydrophobicContact CG-CD2 3.74Å
357	S	75.2	Confident	79.2	Confident	104 Å²	104	72.8 Å²	72.8	73%	0.727	35%	0.351	S	S	*	.	S	Bend	trans	-76.3	-40.9	177.6	50.5	0	0	0	0	112.4
358	D	80	Confident	80.2	Confident	134 Å²	134	72 Å²	72	72%	0.717	35%	0.348	S	S	*	.	S	Bend	trans	-112.6	68.1	-175	-65.2	-38.1	0	0	0	111.2	D360 Q425	D358-D360 PolarHBondContact O-N 2.93Å; D358-Q425 PolarHBondContact O-NE2 2.81Å; D358-Q425 PolarHBondContact O-OE1 2.9Å
359	F	83.2	Confident	81.4	Confident	14 Å²	14	72 Å²	72	6%	0.061	35%	0.349	C	S	.	.			trans	-71	115.8	177.9	179.9	-85.4	0	0	0	111	L356 G361 I424 Y437 Q440 K521 L522	L356-F359 HydrophobicContact CD1-CD2 4.47Å; F359-G361 VanDerWaalsContact CE1-CA 3.47Å; F359-I424 HydrophobicContact CD2-CG2 3.86Å; F359-I424 HydrophobicContact CE2-CG2 3.39Å; F359-I424 HydrophobicContact CZ-CG2 4.43Å; F359-Y437 HydrophobicContact CE2-CD2 4.18Å; F359-Y437 AromaticContact CE2-CE2 3.94Å; F359-Y437 HydrophobicContact CE2-CE2 3.94Å; F359-Y437 HydrophobicContact CZ-CE2 4.48Å; F359-Q440 HydrophobicContact CB-CG 4.24Å; F359-Q440 HydrophobicContact CD1-CB 4.01Å; F359-Q440 HydrophobicContact CE1-CB 4.28Å; F359-Q440 HydrophobicContact CG-CB 4.18Å; F359-Q440 HydrophobicContact CG-CG 4.33Å; F359-K521 HydrophobicContact CD1-CB 3.39Å; F359-K521 HydrophobicContact CD1-CG 4.14Å; F359-K521 HydrophobicContact CE1-CB 3.63Å; F359-L522 HydrophobicContact CE1-CB 3.84Å; F359-L522 HydrophobicContact CZ-CB 3.91Å; F359-L522 HydrophobicContact CZ-CD2 4.37Å
360	D	84.6	Confident	83	Confident	63 Å²	63	65.6 Å²	65.6	34%	0.337	32%	0.321	S	S	.	.			trans	-94.8	-12.1	-178.5	73.6	-9.9	0	0	0	113.5	D358 S362 S390 Q425	D358-D360 PolarHBondContact O-N 2.93Å; D360-S362 WeakPolarHBondContact OD1-CB 3.25Å; D360-S362 PolarHBondContact OD1-N 3.04Å; D360-S362 PolarHBondContact OD1-OG 3.44Å; D360-S362 PolarHBondContact OD2-OG 2.8Å; D360-S390 VanDerWaalsContact O-CB 3.28Å; D360-S390 WeakPolarHBondContact O-CB 3.32Å; D360-S390 PolarHBondContact O-OG 3.42Å; D360-Q425 WeakPolarHBondContact OD1-CG 3.36Å; D360-Q425 PolarHBondContact OD1-NE2 3.29Å
361	G	83.5	Confident	84.6	Confident	0 Å²	0	62 Å²	62	0%	0	31%	0.307	C	S	.	.			trans	81.8	18.9	-177.3	0	0	0	0	0	115.4	F359 T552	F359-G361 VanDerWaalsContact CE1-CA 3.47Å; G361-T552 WeakPolarHBondContact O-CB 3.26Å; G361-T552 WeakPolarHBondContact O-CG2 3.27Å; G361-T552 PolarHBondContact O-OG1 2.88Å
362	S	90.8	Very high	85.8	Confident	25 Å²	25	61 Å²	61	18%	0.175	30%	0.299	C	S	.	.			trans	-79.5	133.6	172	58.6	0	0	0	0	112.5	D360 V388 Q425	D360-S362 WeakPolarHBondContact OD1-CB 3.25Å; D360-S362 PolarHBondContact OD1-N 3.04Å; D360-S362 PolarHBondContact OD1-OG 3.44Å; D360-S362 PolarHBondContact OD2-OG 2.8Å; S362-V388 WeakPolarHBondContact CA-O 3.46Å; S362-Q425 PolarHBondContact O-N 3.23Å; S362-Q425 VanDerWaalsContact O-N 3.16Å; S362-Q425 WeakPolarHBondContact OG-CG 3.28Å
363	I	93.5	Very high	86.4	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	135.6	-172.5	-55.1	163.6	0	0	0	110	F365 T387 V388 L411 I422 L423 I424 L522 I554	I363-F365 HydrophobicContact CG2-CD2 4.02Å; I363-F365 HydrophobicContact CG2-CE2 3.63Å; I363-F365 HydrophobicContact CG2-CZ 4.33Å; I363-T387 CarbonylContact O-C 3.52Å; I363-V388 HydrophobicContact CB-CB 4.1Å; I363-V388 HydrophobicContact CB-CG2 4.21Å; I363-V388 PolarHBondContact N-O 2.79Å; I363-V388 PolarHBondContact O-N 3.41Å; I363-L411 HydrophobicContact CD1-CD1 4.39Å; I363-L411 HydrophobicContact CD1-CD2 4.08Å; I363-L411 HydrophobicContact CG2-CD2 3.7Å; I363-I422 HydrophobicContact CG2-CG2 4.39Å; I363-L423 CarbonylContact C-O 3.57Å; I363-L423 WeakPolarHBondContact CA-O 3.48Å; I363-I424 HydrophobicContact CB-CD1 4.4Å; I363-I424 HydrophobicContact CG1-CD1 3.9Å; I363-I424 HydrophobicContact CG2-CD1 4.18Å; I363-L522 HydrophobicContact CD1-CD1 3.65Å; I363-L522 HydrophobicContact CD1-CD2 3.66Å; I363-L522 HydrophobicContact CD1-CG 4.31Å; I363-L522 HydrophobicContact CG1-CD2 4.5Å; I363-I554 HydrophobicContact CD1-CD1 3.75Å
364	T	94.6	Very high	86.4	Confident	32 Å²	32	54.8 Å²	54.8	20%	0.196	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	115.7	175.5	-53.9	0	0	0	0	110.7	R366 L386 L423	T364-R366 HydrophobicContact CG2-CG 4.05Å; T364-L386 CarbonylContact C-O 3.54Å; T364-L386 WeakPolarHBondContact CA-O 3.43Å; T364-L423 PolarHBondContact N-O 3.05Å; T364-L423 PolarHBondContact O-N 3.43Å
365	F	93.7	Very high	86.4	Confident	5 Å²	5	57.3 Å²	57.3	2%	0.022	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	128.2	168.4	-63.2	-100.7	0	0	0	109.6	I363 V368 F384 C385 L386 L407 L411 I422	I363-F365 HydrophobicContact CG2-CD2 4.02Å; I363-F365 HydrophobicContact CG2-CE2 3.63Å; I363-F365 HydrophobicContact CG2-CZ 4.33Å; F365-V368 HydrophobicContact CB-CG2 4.24Å; F365-V368 HydrophobicContact CD1-CG2 4.18Å; F365-F384 HydrophobicContact CB-CD1 3.79Å; F365-F384 HydrophobicContact CB-CE1 3.88Å; F365-F384 AromaticContact CD1-CD1 3.93Å; F365-F384 HydrophobicContact CD1-CD1 3.93Å; F365-F384 AromaticContact CD1-CE1 3.87Å; F365-F384 HydrophobicContact CD1-CE1 3.87Å; F365-F384 AromaticContact CD2-CE1 3.9Å; F365-F384 HydrophobicContact CD2-CE1 3.9Å; F365-F384 HydrophobicContact CE1-CE1 4.35Å; F365-F384 HydrophobicContact CE2-CE1 4.36Å; F365-F384 AromaticContact CG-CD1 3.88Å; F365-F384 HydrophobicContact CG-CD1 3.88Å; F365-F384 AromaticContact CG-CE1 3.63Å; F365-F384 HydrophobicContact CG-CE1 3.63Å; F365-C385 WeakPolarHBondContact O-CA 3.17Å; F365-L386 HydrophobicContact CB-CB 4.37Å; F365-L386 HydrophobicContact CD2-CB 4.02Å; F365-L386 HydrophobicContact CD2-CD2 4.44Å; F365-L386 PolarHBondContact N-O 3.21Å; F365-L386 PolarHBondContact O-N 3.4Å; F365-L386 VanDerWaalsContact O-N 3.16Å; F365-L407 HydrophobicContact CD1-CD2 4.32Å; F365-L407 HydrophobicContact CE1-CD2 3.83Å; F365-L407 HydrophobicContact CZ-CD2 4.22Å; F365-L411 HydrophobicContact CE1-CD2 4.38Å; F365-L411 HydrophobicContact CE2-CD2 4.17Å; F365-L411 HydrophobicContact CZ-CD1 4.03Å; F365-L411 HydrophobicContact CZ-CD2 3.62Å; F365-L411 HydrophobicContact CZ-CG 3.74Å; F365-I422 HydrophobicContact CD1-CD1 3.93Å; F365-I422 HydrophobicContact CD1-CG1 3.72Å; F365-I422 HydrophobicContact CD1-CG2 4.35Å; F365-I422 HydrophobicContact CE1-CD1 3.67Å; F365-I422 HydrophobicContact CE1-CG1 3.96Å; F365-I422 HydrophobicContact CE1-CG2 4.25Å
366	R	93.5	Very high	86.3	Confident	123 Å²	123	55.6 Å²	55.6	46%	0.464	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	112	177.4	-68.1	-180	174.1	174.1	0.7	110.9	T364 V368 G420 E421 L423	T364-R366 HydrophobicContact CG2-CG 4.05Å; R366-V368 VanDerWaalsContact C-N 3.28Å; R366-V368 PolarHBondContact O-N 3Å; R366-G420 VanDerWaalsContact O-CA 3.26Å; R366-G420 WeakPolarHBondContact O-CA 3.35Å; R366-E421 HydrophobicContact CB-CG 3.88Å; R366-E421 WeakPolarHBondContact CD-OE1 3.31Å; R366-E421 HydrophobicContact CG-CG 4.48Å; R366-E421 IonicContact CZ-OE1 3.78Å; R366-E421 PolarHBondContact N-O 3.43Å; R366-E421 IonicContact NE-OE1 2.59Å; R366-E421 IonicContact NH1-OE1 2.71Å; R366-E421 PolarHBondContact NH1-OE1 2.95Å; R366-E421 PolarHBondContact O-N 3.37Å; R366-E421 VanDerWaalsContact O-N 3.09Å; R366-L423 HydrophobicContact CG-CD1 4.47Å; R366-L423 VanDerWaalsContact NE-CD1 3.34Å
367	H	91.7	Very high	86.4	Confident	117 Å²	117	61.8 Å²	61.8	54%	0.542	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	50.7	44.4	172.1	-59.8	-63.5	0	0	0	113.5	N369 N383 F384 C385 G420	H367-N369 PolarHBondContact O-N 3.38Å; H367-N383 WeakPolarHBondContact CA-OD1 3.22Å; H367-N383 WeakPolarHBondContact CB-OD1 3.49Å; H367-N383 PolarHBondContact ND1-OD1 3.06Å; H367-F384 PolarHBondContact N-O 2.91Å; H367-C385 PolarHBondContact N-SG 2.9Å; H367-C385 PolarHBondContact ND1-SG 3.43Å; H367-G420 WeakPolarHBondContact O-CA 3.41Å
368	V	92.2	Very high	86.8	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	120.7	-172.5	172	0	0	0	0	111.1	F365 R366 L381 N383 F384 M410 P417 Q419 I422	F365-V368 HydrophobicContact CB-CG2 4.24Å; F365-V368 HydrophobicContact CD1-CG2 4.18Å; R366-V368 VanDerWaalsContact C-N 3.28Å; R366-V368 PolarHBondContact O-N 3Å; V368-L381 HydrophobicContact CG1-CD1 4.31Å; V368-N383 PolarHBondContact O-N 2.93Å; V368-F384 HydrophobicContact CB-CB 4.25Å; V368-F384 PolarHBondContact N-O 2.9Å; V368-F384 PolarHBondContact O-N 3.15Å; V368-M410 HydrophobicContact CG1-CE 3.64Å; V368-M410 HydrophobicContact CG1-SD 4.23Å; V368-P417 HydrophobicContact CG1-CB 3.96Å; V368-Q419 WeakPolarHBondContact CA-O 3.3Å; V368-I422 HydrophobicContact CG2-CG1 4.09Å
369	N	91.8	Very high	87.1	Confident	39 Å²	39	58 Å²	58	21%	0.209	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	138.4	168.4	-61.8	-6.4	0	0	0	109.2	H367 L381 N383 T418 Q419	H367-N369 PolarHBondContact O-N 3.38Å; N369-L381 WeakPolarHBondContact CA-O 3.13Å; N369-N383 VanDerWaalsContact OD1-CA 3.24Å; N369-N383 WeakPolarHBondContact OD1-CA 3.22Å; N369-N383 PolarHBondContact OD1-N 3.41Å; N369-T418 WeakPolarHBondContact O-CB 3.28Å; N369-T418 PolarHBondContact O-N 3.44Å; N369-Q419 HydrophobicContact CB-CB 4.05Å; N369-Q419 PolarHBondContact N-O 3.24Å; N369-Q419 PolarHBondContact ND2-OE1 3.15Å; N369-Q419 PolarHBondContact O-N 3.04Å
370	F	91.1	Very high	87.4	Confident	4 Å²	4	58.7 Å²	58.7	2%	0.018	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	135.6	179.3	-177.7	-99.5	0	0	0	113.2	Y372 I380 L381 T406 M410 Y415	F370-Y372 AromaticContact CE1-CD1 3.71Å; F370-Y372 HydrophobicContact CE1-CD1 3.71Å; F370-Y372 HydrophobicContact CE1-CD2 4.02Å; F370-Y372 AromaticContact CE1-CE1 3.78Å; F370-Y372 HydrophobicContact CE1-CE1 3.78Å; F370-Y372 HydrophobicContact CE1-CE2 4.06Å; F370-Y372 AromaticContact CE1-CG 3.83Å; F370-Y372 HydrophobicContact CE1-CG 3.83Å; F370-Y372 AromaticContact CE1-CZ 3.94Å; F370-Y372 AromaticContact CZ-CD1 3.89Å; F370-Y372 HydrophobicContact CZ-CD1 3.89Å; F370-Y372 HydrophobicContact CZ-CE1 4.1Å; F370-Y372 HydrophobicContact CZ-CG 4.32Å; F370-I380 HydrophobicContact CD1-CB 4.4Å; F370-I380 WeakPolarHBondContact O-CB 3.2Å; F370-I380 PolarHBondContact O-N 3.37Å; F370-L381 HydrophobicContact CB-CB 4.17Å; F370-L381 HydrophobicContact CB-CD1 4.23Å; F370-L381 HydrophobicContact CB-CG 4.47Å; F370-L381 PolarHBondContact N-O 2.69Å; F370-L381 VanDerWaalsContact N-O 3.13Å; F370-L381 PolarHBondContact O-N 3.46Å; F370-L381 VanDerWaalsContact O-N 3.16Å; F370-T406 HydrophobicContact CD1-CG2 3.41Å; F370-T406 VanDerWaalsContact CD1-CG2 3.41Å; F370-T406 HydrophobicContact CE1-CG2 3.61Å; F370-T406 HydrophobicContact CG-CG2 4.32Å; F370-M410 HydrophobicContact CB-CE 4.15Å; F370-M410 HydrophobicContact CB-SD 4.08Å; F370-M410 HydrophobicContact CD2-CE 4.09Å; F370-M410 HydrophobicContact CD2-SD 4.35Å; F370-M410 HydrophobicContact CG-CE 4.26Å; F370-M410 HydrophobicContact CG-SD 4.07Å; F370-Y415 HydrophobicContact CE2-CG 4.2Å; F370-Y415 HydrophobicContact CZ-CD1 4.1Å; F370-Y415 HydrophobicContact CZ-CD2 4.36Å; F370-Y415 AromaticContact CZ-CG 3.78Å; F370-Y415 HydrophobicContact CZ-CG 3.78Å
371	N	88.7	Confident	87.7	Confident	39 Å²	39	55.8 Å²	55.8	21%	0.209	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	136.4	171.2	-55.9	9.6	0	0	0	107.7	P376 T379 T418	N371-P376 PolarHBondContact ND2-O 2.75Å; N371-T379 WeakPolarHBondContact OD1-CA 3.48Å; N371-T379 VanDerWaalsContact OD1-CG2 3.31Å; N371-T379 WeakPolarHBondContact OD1-CG2 3.34Å; N371-T418 PolarHBondContact N-OG1 2.89Å
372	Y	85.1	Confident	87.9	Confident	47 Å²	47	58.6 Å²	58.6	18%	0.184	31%	0.307	C	S	.	.			trans	-67.6	131.8	170.9	-78.8	-73.4	0	0	0	109.2	F370 S374 R375 I380 T406 H409 Y415	F370-Y372 AromaticContact CE1-CD1 3.71Å; F370-Y372 HydrophobicContact CE1-CD1 3.71Å; F370-Y372 HydrophobicContact CE1-CD2 4.02Å; F370-Y372 AromaticContact CE1-CE1 3.78Å; F370-Y372 HydrophobicContact CE1-CE1 3.78Å; F370-Y372 HydrophobicContact CE1-CE2 4.06Å; F370-Y372 AromaticContact CE1-CG 3.83Å; F370-Y372 HydrophobicContact CE1-CG 3.83Å; F370-Y372 AromaticContact CE1-CZ 3.94Å; F370-Y372 AromaticContact CZ-CD1 3.89Å; F370-Y372 HydrophobicContact CZ-CD1 3.89Å; F370-Y372 HydrophobicContact CZ-CE1 4.1Å; F370-Y372 HydrophobicContact CZ-CG 4.32Å; Y372-S374 PolarHBondContact O-N 3.16Å; Y372-R375 CarbonylContact O-C 3.37Å; Y372-R375 WeakPolarHBondContact O-CA 3.47Å; Y372-R375 PolarHBondContact O-N 3.47Å; Y372-I380 HydrophobicContact CD2-CD1 4.17Å; Y372-I380 HydrophobicContact CD2-CG1 3.73Å; Y372-I380 HydrophobicContact CE2-CG1 4.12Å; Y372-I380 HydrophobicContact CE2-CG2 4.42Å; Y372-T406 HydrophobicContact CE2-CG2 4.24Å; Y372-T406 PolarHBondContact OH-OG1 3.45Å; Y372-H409 PolarHBondContact OH-ND1 3.3Å; Y372-Y415 HydrophobicContact CD1-CE1 4.25Å; Y372-Y415 HydrophobicContact CE1-CD2 4.2Å; Y372-Y415 HydrophobicContact CE1-CE1 4.24Å; Y372-Y415 AromaticContact CE1-CE2 3.76Å; Y372-Y415 HydrophobicContact CE1-CE2 3.76Å; Y372-Y415 AromaticContact CE1-CZ 3.77Å
373	P	77.1	Confident	87.8	Confident	66 Å²	66	61.8 Å²	61.8	43%	0.429	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-22	-176.8	-22.5	33.6	0	0	0	114.2	L133 R375 P376	L133-P373 HydrophobicContact CD1-CB 3.74Å; L133-P373 HydrophobicContact CD1-CG 3.43Å; L133-P373 VanDerWaalsContact CD1-CG 3.43Å; L133-P373 HydrophobicContact CD2-CB 4.22Å; L133-P373 HydrophobicContact CD2-CG 3.72Å; L133-P373 HydrophobicContact CG-CG 4.21Å; P373-R375 PolarHBondContact O-N 3.37Å; P373-P376 WeakPolarHBondContact O-CD 3.46Å
374	S	76	Confident	87.7	Confident	73 Å²	73	61.9 Å²	61.9	51%	0.51	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-18.9	170.9	55.9	0	0	0	0	113.3	Y372	Y372-S374 PolarHBondContact O-N 3.16Å
375	R	83.1	Confident	87.6	Confident	179 Å²	179	63 Å²	63	68%	0.675	33%	0.332	S	S	*	.	S	Bend	trans	-141.9	69.1	177	-63.3	-175.2	-175.4	174.4	2.3	109.7	Y372 P373 D377 V378	Y372-R375 CarbonylContact O-C 3.37Å; Y372-R375 WeakPolarHBondContact O-CA 3.47Å; Y372-R375 PolarHBondContact O-N 3.47Å; P373-R375 PolarHBondContact O-N 3.37Å; R375-D377 PolarHBondContact O-N 3.5Å; R375-D377 VanDerWaalsContact O-N 3.11Å; R375-V378 HydrophobicContact CB-CB 4.34Å; R375-V378 HydrophobicContact CB-CG2 4.27Å; R375-V378 PolarHBondContact O-N 3.1Å
376	P	80.9	Confident	87.5	Confident	77 Å²	77	63.5 Å²	63.5	50%	0.5	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-25.4	-172.6	27.4	-34	0	0	0	112.5	N371 P373 V378	N371-P376 PolarHBondContact ND2-O 2.75Å; P373-P376 WeakPolarHBondContact O-CD 3.46Å; P376-V378 VanDerWaalsContact C-N 3.27Å; P376-V378 PolarHBondContact O-N 3.27Å
377	D	84.4	Confident	87.5	Confident	157 Å²	157	61.9 Å²	61.9	84%	0.84	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.1	-15.2	179	-57.6	-35.3	0	0	0	113.7	R375	R375-D377 PolarHBondContact O-N 3.5Å; R375-D377 VanDerWaalsContact O-N 3.11Å
378	V	84.1	Confident	87.5	Confident	72 Å²	72	56.4 Å²	56.4	44%	0.436	31%	0.313	S	S	.	.	S	Bend	trans	-105.3	109.4	-178	-175.1	0	0	0	0	109.5	R375 P376 I380	R375-V378 HydrophobicContact CB-CB 4.34Å; R375-V378 HydrophobicContact CB-CG2 4.27Å; R375-V378 PolarHBondContact O-N 3.1Å; P376-V378 VanDerWaalsContact C-N 3.27Å; P376-V378 PolarHBondContact O-N 3.27Å; V378-I380 HydrophobicContact CG1-CD1 3.96Å
379	T	84.6	Confident	87.5	Confident	87 Å²	87	63 Å²	63	53%	0.534	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	127.3	171.9	46.3	0	0	0	0	109.7	N371	N371-T379 WeakPolarHBondContact OD1-CA 3.48Å; N371-T379 VanDerWaalsContact OD1-CG2 3.31Å; N371-T379 WeakPolarHBondContact OD1-CG2 3.34Å
380	I	90	Very high	87.4	Confident	28 Å²	28	64.2 Å²	64.2	14%	0.144	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	-40.6	-176.8	-57.5	-66.2	0	0	0	111.3	F370 Y372 V378 T406 G575	F370-I380 HydrophobicContact CD1-CB 4.4Å; F370-I380 WeakPolarHBondContact O-CB 3.2Å; F370-I380 PolarHBondContact O-N 3.37Å; Y372-I380 HydrophobicContact CD2-CD1 4.17Å; Y372-I380 HydrophobicContact CD2-CG1 3.73Å; Y372-I380 HydrophobicContact CE2-CG1 4.12Å; Y372-I380 HydrophobicContact CE2-CG2 4.42Å; V378-I380 HydrophobicContact CG1-CD1 3.96Å; I380-T406 HydrophobicContact CG2-CG2 4.14Å; I380-G575 WeakPolarHBondContact O-CA 3.41Å
381	L	90.8	Very high	87.2	Confident	1 Å²	1	65.6 Å²	65.6	1%	0.005	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	134.9	174.2	-65.1	174.4	0	0	0	109.1	V368 N369 F370 T406 L407 M410	V368-L381 HydrophobicContact CG1-CD1 4.31Å; N369-L381 WeakPolarHBondContact CA-O 3.13Å; F370-L381 HydrophobicContact CB-CB 4.17Å; F370-L381 HydrophobicContact CB-CD1 4.23Å; F370-L381 HydrophobicContact CB-CG 4.47Å; F370-L381 PolarHBondContact N-O 2.69Å; F370-L381 VanDerWaalsContact N-O 3.13Å; F370-L381 PolarHBondContact O-N 3.46Å; F370-L381 VanDerWaalsContact O-N 3.16Å; L381-T406 HydrophobicContact CD1-CG2 4.28Å; L381-L407 HydrophobicContact CD1-CD2 3.69Å; L381-L407 HydrophobicContact CD1-CG 4.37Å; L381-L407 HydrophobicContact CD2-CD2 4.31Å; L381-L407 HydrophobicContact CD2-CG 4.49Å; L381-M410 HydrophobicContact CD1-SD 3.68Å
382	V	89.1	Confident	87.3	Confident	59 Å²	59	65.3 Å²	65.3	36%	0.358	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	112.3	-178.6	-177.4	0	0	0	0	108.9	F384 G575 C576	V382-F384 VanDerWaalsContact C-N 3.27Å; V382-F384 PolarHBondContact O-N 3.43Å; V382-G575 PolarHBondContact N-O 3.35Å; V382-C576 PolarHBondContact O-SG 2.92Å
383	N	88.9	Confident	87.5	Confident	92 Å²	92	63.4 Å²	63.4	49%	0.492	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	48.6	44.6	176.9	-163	22.5	0	0	0	113.4	H367 V368 N369 C385	H367-N383 WeakPolarHBondContact CA-OD1 3.22Å; H367-N383 WeakPolarHBondContact CB-OD1 3.49Å; H367-N383 PolarHBondContact ND1-OD1 3.06Å; V368-N383 PolarHBondContact O-N 2.93Å; N369-N383 VanDerWaalsContact OD1-CA 3.24Å; N369-N383 WeakPolarHBondContact OD1-CA 3.22Å; N369-N383 PolarHBondContact OD1-N 3.41Å; N383-C385 PolarHBondContact O-N 3.37Å
384	F	90.9	Very high	88.2	Confident	2 Å²	2	60.5 Å²	60.5	1%	0.009	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	124.9	-173.4	-178.6	-91.7	0	0	0	111.4	F365 H367 V368 V382 L386 L407 L572 I577	F365-F384 HydrophobicContact CB-CD1 3.79Å; F365-F384 HydrophobicContact CB-CE1 3.88Å; F365-F384 AromaticContact CD1-CD1 3.93Å; F365-F384 HydrophobicContact CD1-CD1 3.93Å; F365-F384 AromaticContact CD1-CE1 3.87Å; F365-F384 HydrophobicContact CD1-CE1 3.87Å; F365-F384 AromaticContact CD2-CE1 3.9Å; F365-F384 HydrophobicContact CD2-CE1 3.9Å; F365-F384 HydrophobicContact CE1-CE1 4.35Å; F365-F384 HydrophobicContact CE2-CE1 4.36Å; F365-F384 AromaticContact CG-CD1 3.88Å; F365-F384 HydrophobicContact CG-CD1 3.88Å; F365-F384 AromaticContact CG-CE1 3.63Å; F365-F384 HydrophobicContact CG-CE1 3.63Å; H367-F384 PolarHBondContact N-O 2.91Å; V368-F384 HydrophobicContact CB-CB 4.25Å; V368-F384 PolarHBondContact N-O 2.9Å; V368-F384 PolarHBondContact O-N 3.15Å; V382-F384 VanDerWaalsContact C-N 3.27Å; V382-F384 PolarHBondContact O-N 3.43Å; F384-L386 HydrophobicContact CE1-CB 3.73Å; F384-L386 HydrophobicContact CE1-CD2 4.33Å; F384-L386 HydrophobicContact CZ-CB 3.84Å; F384-L386 HydrophobicContact CZ-CD2 3.96Å; F384-L407 HydrophobicContact CD1-CD2 3.8Å; F384-L407 HydrophobicContact CE1-CD1 4.11Å; F384-L407 HydrophobicContact CE1-CD2 3.52Å; F384-L407 HydrophobicContact CE1-CG 4.5Å; F384-L407 HydrophobicContact CE2-CD1 3.91Å; F384-L407 HydrophobicContact CE2-CD2 4.38Å; F384-L407 HydrophobicContact CG-CD2 4.34Å; F384-L407 HydrophobicContact CZ-CD1 3.55Å; F384-L407 HydrophobicContact CZ-CD2 3.85Å; F384-L407 HydrophobicContact CZ-CG 4.38Å; F384-L572 HydrophobicContact CD2-CD2 3.98Å; F384-L572 HydrophobicContact CE2-CD2 3.66Å; F384-I577 HydrophobicContact CD2-CD1 4.07Å; F384-I577 HydrophobicContact CD2-CG1 3.79Å; F384-I577 HydrophobicContact CE2-CD1 3.54Å; F384-I577 HydrophobicContact CE2-CG1 3.4Å; F384-I577 VanDerWaalsContact CE2-CG1 3.4Å; F384-I577 HydrophobicContact CZ-CD1 3.99Å; F384-I577 HydrophobicContact CZ-CG1 4.32Å
385	C	91.9	Very high	89	Confident	57 Å²	57	57 Å²	57	39%	0.385	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	126.2	178.9	-69.1	0	0	0	0	110.2	F365 H367 N383 I577	F365-C385 WeakPolarHBondContact O-CA 3.17Å; H367-C385 PolarHBondContact N-SG 2.9Å; H367-C385 PolarHBondContact ND1-SG 3.43Å; N383-C385 PolarHBondContact O-N 3.37Å; C385-I577 WeakPolarHBondContact O-CD1 3.5Å
386	L	91.9	Very high	89.4	Confident	15 Å²	15	48.6 Å²	48.6	8%	0.079	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154	139.3	179.5	175.9	60.8	0	0	0	110.4	T364 F365 F384 V388 I570 I577 M580	T364-L386 CarbonylContact C-O 3.54Å; T364-L386 WeakPolarHBondContact CA-O 3.43Å; F365-L386 HydrophobicContact CB-CB 4.37Å; F365-L386 HydrophobicContact CD2-CB 4.02Å; F365-L386 HydrophobicContact CD2-CD2 4.44Å; F365-L386 PolarHBondContact N-O 3.21Å; F365-L386 PolarHBondContact O-N 3.4Å; F365-L386 VanDerWaalsContact O-N 3.16Å; F384-L386 HydrophobicContact CE1-CB 3.73Å; F384-L386 HydrophobicContact CE1-CD2 4.33Å; F384-L386 HydrophobicContact CZ-CB 3.84Å; F384-L386 HydrophobicContact CZ-CD2 3.96Å; L386-V388 HydrophobicContact CD2-CG2 4.09Å; L386-V388 HydrophobicContact CG-CG2 4.12Å; L386-I570 HydrophobicContact CD1-CD1 3.32Å; L386-I570 HydrophobicContact CD1-CG1 4.41Å; L386-I570 HydrophobicContact CD2-CD1 3.32Å; L386-I570 HydrophobicContact CG-CD1 3.93Å; L386-I577 HydrophobicContact CB-CD1 4.32Å; L386-M580 HydrophobicContact CD1-SD 4.31Å
387	T	93.2	Very high	89.8	Confident	89 Å²	89	45.3 Å²	45.3	55%	0.546	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	125.6	172.3	-54.2	0	0	0	0	110.1	I363	I363-T387 CarbonylContact O-C 3.52Å
388	V	92.3	Very high	89.9	Confident	1 Å²	1	38.4 Å²	38.4	1%	0.006	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	119	-179.7	-173.4	0	0	0	0	108.4	S362 I363 L386 I394 T552	S362-V388 WeakPolarHBondContact CA-O 3.46Å; I363-V388 HydrophobicContact CB-CB 4.1Å; I363-V388 HydrophobicContact CB-CG2 4.21Å; I363-V388 PolarHBondContact N-O 2.79Å; I363-V388 PolarHBondContact O-N 3.41Å; L386-V388 HydrophobicContact CD2-CG2 4.09Å; L386-V388 HydrophobicContact CG-CG2 4.12Å; V388-I394 HydrophobicContact CB-CD1 3.72Å; V388-I394 HydrophobicContact CG1-CD1 3.44Å; V388-I394 VanDerWaalsContact CG1-CD1 3.44Å; V388-I394 HydrophobicContact CG1-CG1 4.13Å; V388-I394 HydrophobicContact CG2-CD1 3.37Å; V388-T552 HydrophobicContact CG1-CG2 3.51Å
389	K	91	Very high	89.9	Confident	140 Å²	140	37.7 Å²	37.7	61%	0.609	23%	0.226	S	C	*	.			trans	-82.1	156.2	176.9	-55.5	179.5	179.2	177.1	0	110.4	G391 Q392	K389-G391 PolarHBondContact O-N 2.89Å; K389-Q392 HydrophobicContact CB-CG 3.98Å; K389-Q392 WeakPolarHBondContact O-CB 3.4Å; K389-Q392 PolarHBondContact O-N 3.35Å
390	S	89.8	Confident	89.7	Confident	64 Å²	64	39.1 Å²	39.1	45%	0.448	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54	133.5	174.9	178.8	0	0	0	0	111.3	D360 Q392	D360-S390 VanDerWaalsContact O-CB 3.28Å; D360-S390 WeakPolarHBondContact O-CB 3.32Å; D360-S390 PolarHBondContact O-OG 3.42Å; S390-Q392 VanDerWaalsContact C-N 3.26Å; S390-Q392 PolarHBondContact O-N 3.04Å
391	G	87.3	Confident	89.2	Confident	32 Å²	32	41.1 Å²	41.1	33%	0.33	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.2	-2.7	177	0	0	0	0	0	115.5	K389 T552	K389-G391 PolarHBondContact O-N 2.89Å; G391-T552 PolarHBondContact N-OG1 3.16Å
392	Q	90	Very high	88.9	Confident	33 Å²	33	41.1 Å²	41.1	15%	0.154	27%	0.268	C	S	.	.			trans	-76	146.9	178	-70.1	-173.4	-38.8	0	0	112.2	K389 S390 T552 V553 D567	K389-Q392 HydrophobicContact CB-CG 3.98Å; K389-Q392 WeakPolarHBondContact O-CB 3.4Å; K389-Q392 PolarHBondContact O-N 3.35Å; S390-Q392 VanDerWaalsContact C-N 3.26Å; S390-Q392 PolarHBondContact O-N 3.04Å; Q392-T552 WeakPolarHBondContact O-CA 3.36Å; Q392-T552 WeakPolarHBondContact O-CG2 3.22Å; Q392-V553 PolarHBondContact O-N 2.95Å; Q392-D567 WeakPolarHBondContact CA-OD2 2.97Å
393	T	90.6	Very high	88.6	Confident	8 Å²	8	38.5 Å²	38.5	5%	0.049	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	111.8	169.6	-58.5	0	0	0	0	109.7	V553 I555 A566 D567 Y568	T393-V553 CarbonylContact C-O 3.59Å; T393-V553 WeakPolarHBondContact CA-O 3.15Å; T393-V553 HydrophobicContact CG2-CB 4.16Å; T393-I555 HydrophobicContact CG2-CD1 3.84Å; T393-I555 HydrophobicContact CG2-CG1 4.36Å; T393-A566 HydrophobicContact CG2-CB 4.28Å; T393-D567 PolarHBondContact N-OD2 3.48Å; T393-D567 WeakPolarHBondContact O-CB 3.28Å; T393-D567 PolarHBondContact O-N 2.94Å; T393-Y568 PolarHBondContact O-N 3.28Å
394	I	92.4	Very high	88.6	Confident	4 Å²	4	35 Å²	35	2%	0.021	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	130.6	179.7	-65.4	-173.3	0	0	0	110.1	V388 V553 I554 I555 Y568 I570	V388-I394 HydrophobicContact CB-CD1 3.72Å; V388-I394 HydrophobicContact CG1-CD1 3.44Å; V388-I394 VanDerWaalsContact CG1-CD1 3.44Å; V388-I394 HydrophobicContact CG1-CG1 4.13Å; V388-I394 HydrophobicContact CG2-CD1 3.37Å; I394-V553 PolarHBondContact N-O 2.72Å; I394-I554 CarbonylContact O-C 3.54Å; I394-I554 WeakPolarHBondContact O-CA 3.3Å; I394-I555 PolarHBondContact O-N 2.82Å; I394-Y568 WeakPolarHBondContact CA-O 3.18Å; I394-I570 HydrophobicContact CG2-CD1 3.37Å; I394-I570 HydrophobicContact CG2-CG1 4Å
395	A	91.8	Very high	88.6	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	132.8	173.1	0	0	0	0	0	111.6	I555 I563 A566 Y568 I569 I570	A395-I555 CarbonylContact C-O 3.48Å; A395-I555 WeakPolarHBondContact CA-O 3.35Å; A395-I563 HydrophobicContact CB-CB 3.53Å; A395-I563 HydrophobicContact CB-CD1 4.03Å; A395-I563 HydrophobicContact CB-CG1 4.4Å; A395-I563 HydrophobicContact CB-CG2 3.51Å; A395-A566 HydrophobicContact CB-CB 3.76Å; A395-Y568 PolarHBondContact N-O 3.24Å; A395-I569 HydrophobicContact CB-CG1 4.17Å; A395-I569 HydrophobicContact CB-CG2 4.48Å; A395-I569 CarbonylContact O-C 3.57Å; A395-I569 WeakPolarHBondContact O-CA 3.5Å; A395-I570 PolarHBondContact O-N 2.93Å
396	L	91.8	Very high	88.5	Confident	3 Å²	3	34.2 Å²	34.2	2%	0.016	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	120.4	175.3	-62.2	173.8	0	0	0	109.4	L407 I554 I555 I556 I570 L572	L396-L407 HydrophobicContact CD1-CB 4.3Å; L396-L407 HydrophobicContact CD1-CD1 3.83Å; L396-L407 HydrophobicContact CD2-CD1 4.15Å; L396-I554 HydrophobicContact CD1-CG2 3.74Å; L396-I554 HydrophobicContact CG-CG2 4.21Å; L396-I555 PolarHBondContact N-O 2.81Å; L396-I556 HydrophobicContact CB-CG1 4.08Å; L396-I556 HydrophobicContact CD1-CD1 4.48Å; L396-I556 HydrophobicContact CD1-CG1 4Å; L396-I570 HydrophobicContact CD2-CB 4.01Å; L396-I570 HydrophobicContact CD2-CD1 3.99Å; L396-I570 HydrophobicContact CD2-CG2 4.3Å; L396-L572 HydrophobicContact CD2-CD1 4.36Å
397	V	90.3	Very high	88.5	Confident	7 Å²	7	33.7 Å²	33.7	4%	0.042	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	150	-177.1	-171.1	0	0	0	0	109.4	L560 I563 I569 I570 V571 L572 M596	V397-L560 HydrophobicContact CG1-CD2 3.64Å; V397-L560 HydrophobicContact CG2-CD2 4.09Å; V397-I563 HydrophobicContact CG2-CD1 3.16Å; V397-I569 HydrophobicContact CG2-CG2 3.72Å; V397-I570 PolarHBondContact N-O 3.37Å; V397-V571 CarbonylContact O-C 3.56Å; V397-V571 WeakPolarHBondContact O-CA 3.36Å; V397-L572 PolarHBondContact O-N 3.19Å; V397-M596 HydrophobicContact CG1-CE 3.71Å; V397-M596 HydrophobicContact CG1-SD 3.94Å
398	G	86.1	Confident	88.4	Confident	12 Å²	12	29.4 Å²	29.4	12%	0.124	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	165	171.7	177.6	0	0	0	0	0	112	K404 L572	G398-K404 PolarHBondContact O-NZ 2.69Å; G398-L572 VanDerWaalsContact CA-O 3.22Å; G398-L572 WeakPolarHBondContact CA-O 3.33Å
399	S	83.1	Confident	88.4	Confident	57 Å²	57	30.4 Å²	30.4	40%	0.399	20%	0.204	S	C	.	.	S	Bend	trans	-60.7	161.2	174.3	55.2	0	0	0	0	112.2	G401 S402 K404	S399-G401 PolarHBondContact O-N 2.92Å; S399-S402 VanDerWaalsContact O-CB 3.31Å; S399-S402 WeakPolarHBondContact O-CB 3.39Å; S399-S402 PolarHBondContact O-N 3.48Å; S399-S402 PolarHBondContact O-OG 3.13Å; S399-K404 PolarHBondContact O-NZ 2.79Å
400	S	80.6	Confident	88.4	Confident	118 Å²	118	23.8 Å²	23.8	83%	0.825	18%	0.175	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.2	133.6	171.5	-61.8	0	0	0	0	110.3
401	G	78.8	Confident	88.5	Confident	70 Å²	70	20.8 Å²	20.8	72%	0.722	15%	0.154	S	C	*	.	T	Hydrogen-bonded Turn	trans	83.7	1.2	-177.1	0	0	0	0	0	115.8	S399 G403	S399-G401 PolarHBondContact O-N 2.92Å; G401-G403 PolarHBondContact O-N 3.23Å
402	S	84.2	Confident	88.7	Confident	1 Å²	1	19.4 Å²	19.4	1%	0.007	14%	0.139	C	C	.	.	S	Bend	trans	-69.4	-4.8	176.6	54.4	0	0	0	0	115.5	S399 K404 L572 G575	S399-S402 VanDerWaalsContact O-CB 3.31Å; S399-S402 WeakPolarHBondContact O-CB 3.39Å; S399-S402 PolarHBondContact O-N 3.48Å; S399-S402 PolarHBondContact O-OG 3.13Å; S402-K404 WeakPolarHBondContact OG-CG 3.44Å; S402-L572 WeakPolarHBondContact CB-O 3.32Å; S402-G575 WeakPolarHBondContact O-CA 3.35Å; S402-G575 PolarHBondContact O-N 3.15Å
403	G	84.6	Confident	88.7	Confident	4 Å²	4	18 Å²	18	4%	0.041	13%	0.132	C	C	.	.	S	Bend	trans	98.5	8.8	177.9	0	0	0	0	0	116.2	G401 T406 L407	G401-G403 PolarHBondContact O-N 3.23Å; G403-T406 VanDerWaalsContact O-CB 3.26Å; G403-T406 WeakPolarHBondContact O-CB 3.26Å; G403-T406 PolarHBondContact O-N 3.26Å; G403-L407 PolarHBondContact O-N 2.9Å
404	K	89.1	Confident	88.6	Confident	18 Å²	18	17.8 Å²	17.8	8%	0.078	13%	0.13	C	C	.	.	H	α-helix	trans	-54	-63.2	-178.1	-51.4	-174.1	-64.2	-85.4	0	113.3	G398 S399 S402 T406 L407 I556 L572	G398-K404 PolarHBondContact O-NZ 2.69Å; S399-K404 PolarHBondContact O-NZ 2.79Å; S402-K404 WeakPolarHBondContact OG-CG 3.44Å; K404-T406 PolarHBondContact O-N 3.16Å; K404-L407 WeakPolarHBondContact O-CB 3.4Å; K404-L407 PolarHBondContact O-N 2.92Å; K404-I556 HydrophobicContact CB-CD1 3.88Å; K404-I556 HydrophobicContact CB-CG1 4.24Å; K404-I556 HydrophobicContact CB-CG2 3.9Å; K404-I556 HydrophobicContact CD-CG2 4.05Å; K404-I556 VanDerWaalsContact O-CD1 3.25Å; K404-I556 WeakPolarHBondContact O-CD1 3.45Å; K404-L572 HydrophobicContact CG-CD1 4.02Å
405	S	89.3	Confident	88.5	Confident	35 Å²	35	18.1 Å²	18.1	25%	0.245	13%	0.131	C	C	.	.	H	α-helix	trans	-65.8	-26.2	-178	-50.5	0	0	0	0	112.1	L407 I408 H409 D526	S405-L407 VanDerWaalsContact C-N 3.27Å; S405-L407 PolarHBondContact O-N 3.09Å; S405-I408 PolarHBondContact O-N 3.3Å; S405-I408 VanDerWaalsContact O-N 3.15Å; S405-H409 VanDerWaalsContact O-CG 3.28Å; S405-H409 PolarHBondContact O-N 3.04Å; S405-D526 PolarHBondContact OG-OD1 3.5Å
406	T	90.5	Very high	88.3	Confident	8 Å²	8	20.5 Å²	20.5	5%	0.049	14%	0.144	C	C	.	.	H	α-helix	trans	-58.1	-39.3	172	-50.3	0	0	0	0	111.6	F370 Y372 I380 L381 G403 K404 I408 H409 M410	F370-T406 HydrophobicContact CD1-CG2 3.41Å; F370-T406 VanDerWaalsContact CD1-CG2 3.41Å; F370-T406 HydrophobicContact CE1-CG2 3.61Å; F370-T406 HydrophobicContact CG-CG2 4.32Å; Y372-T406 HydrophobicContact CE2-CG2 4.24Å; Y372-T406 PolarHBondContact OH-OG1 3.45Å; I380-T406 HydrophobicContact CG2-CG2 4.14Å; L381-T406 HydrophobicContact CD1-CG2 4.28Å; G403-T406 VanDerWaalsContact O-CB 3.26Å; G403-T406 WeakPolarHBondContact O-CB 3.26Å; G403-T406 PolarHBondContact O-N 3.26Å; K404-T406 PolarHBondContact O-N 3.16Å; T406-I408 PolarHBondContact O-N 3.46Å; T406-H409 PolarHBondContact O-N 3.26Å; T406-M410 HydrophobicContact CG2-CG 4.44Å; T406-M410 HydrophobicContact CG2-SD 4.25Å; T406-M410 VanDerWaalsContact O-CG 3.27Å; T406-M410 WeakPolarHBondContact O-CG 3.45Å; T406-M410 PolarHBondContact O-N 3.36Å
407	L	91.8	Very high	88.2	Confident	3 Å²	3	21.1 Å²	21.1	2%	0.016	15%	0.148	C	C	.	.	H	α-helix	trans	-62.9	-41.9	175.8	-67.3	170.7	0	0	0	112.1	F365 L381 F384 L396 G403 K404 S405 M410 L411 L572	F365-L407 HydrophobicContact CD1-CD2 4.32Å; F365-L407 HydrophobicContact CE1-CD2 3.83Å; F365-L407 HydrophobicContact CZ-CD2 4.22Å; L381-L407 HydrophobicContact CD1-CD2 3.69Å; L381-L407 HydrophobicContact CD1-CG 4.37Å; L381-L407 HydrophobicContact CD2-CD2 4.31Å; L381-L407 HydrophobicContact CD2-CG 4.49Å; F384-L407 HydrophobicContact CD1-CD2 3.8Å; F384-L407 HydrophobicContact CE1-CD1 4.11Å; F384-L407 HydrophobicContact CE1-CD2 3.52Å; F384-L407 HydrophobicContact CE1-CG 4.5Å; F384-L407 HydrophobicContact CE2-CD1 3.91Å; F384-L407 HydrophobicContact CE2-CD2 4.38Å; F384-L407 HydrophobicContact CG-CD2 4.34Å; F384-L407 HydrophobicContact CZ-CD1 3.55Å; F384-L407 HydrophobicContact CZ-CD2 3.85Å; F384-L407 HydrophobicContact CZ-CG 4.38Å; L396-L407 HydrophobicContact CD1-CB 4.3Å; L396-L407 HydrophobicContact CD1-CD1 3.83Å; L396-L407 HydrophobicContact CD2-CD1 4.15Å; G403-L407 PolarHBondContact O-N 2.9Å; K404-L407 WeakPolarHBondContact O-CB 3.4Å; K404-L407 PolarHBondContact O-N 2.92Å; S405-L407 VanDerWaalsContact C-N 3.27Å; S405-L407 PolarHBondContact O-N 3.09Å; L407-M410 PolarHBondContact O-N 3.45Å; L407-L411 WeakPolarHBondContact O-CG 3.33Å; L407-L411 PolarHBondContact O-N 3.02Å; L407-L572 HydrophobicContact CD1-CD1 3.75Å
408	I	91.7	Very high	88.1	Confident	0 Å²	0	25 Å²	25	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-63.9	-41.2	174.7	-75.5	-174.3	0	0	0	111.1	S405 T406 L411 Q412 L524 D526 I556	S405-I408 PolarHBondContact O-N 3.3Å; S405-I408 VanDerWaalsContact O-N 3.15Å; T406-I408 PolarHBondContact O-N 3.46Å; I408-L411 PolarHBondContact O-N 3.36Å; I408-Q412 VanDerWaalsContact CG2-NE2 3.27Å; I408-Q412 WeakPolarHBondContact O-CG 3.17Å; I408-Q412 PolarHBondContact O-N 3.16Å; I408-Q412 PolarHBondContact O-NE2 3.32Å; I408-L524 HydrophobicContact CD1-CB 4.32Å; I408-L524 HydrophobicContact CG1-CB 4.45Å; I408-L524 HydrophobicContact CG2-CB 4.31Å; I408-L524 HydrophobicContact CG2-CD1 4.24Å; I408-D526 HydrophobicContact CD1-CB 3.68Å; I408-D526 HydrophobicContact CG2-CB 4.44Å; I408-I556 HydrophobicContact CB-CD1 4.4Å; I408-I556 HydrophobicContact CD1-CD1 3.35Å; I408-I556 HydrophobicContact CD1-CG1 3.75Å; I408-I556 HydrophobicContact CG1-CD1 3.72Å; I408-I556 HydrophobicContact CG1-CG1 4.34Å
409	H	90.8	Very high	88.3	Confident	22 Å²	22	30.2 Å²	30.2	10%	0.102	19%	0.193	C	C	.	.	H	α-helix	trans	-64.4	-39.3	176.7	-63.5	163.3	0	0	0	112.2	Y372 S405 T406 Q412 R413 F414 Y415	Y372-H409 PolarHBondContact OH-ND1 3.3Å; S405-H409 VanDerWaalsContact O-CG 3.28Å; S405-H409 PolarHBondContact O-N 3.04Å; T406-H409 PolarHBondContact O-N 3.26Å; H409-Q412 PolarHBondContact O-N 3.38Å; H409-R413 PolarHBondContact O-N 2.93Å; H409-F414 HydrophobicContact CB-CB 4.43Å; H409-F414 HydrophobicContact CB-CD2 4.31Å; H409-F414 WeakPolarHBondContact O-CB 3.27Å; H409-F414 PolarHBondContact O-N 3.25Å; H409-Y415 HydrophobicContact CB-CD2 3.8Å; H409-Y415 HydrophobicContact CB-CE2 3.85Å
410	M	91.3	Very high	88.7	Confident	0 Å²	0	28.9 Å²	28.9	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-69	-38.3	175.8	-68.1	180	85.7	0	0	111.9	V368 F370 L381 T406 L407 Q412 R413 P417 I422 L429	V368-M410 HydrophobicContact CG1-CE 3.64Å; V368-M410 HydrophobicContact CG1-SD 4.23Å; F370-M410 HydrophobicContact CB-CE 4.15Å; F370-M410 HydrophobicContact CB-SD 4.08Å; F370-M410 HydrophobicContact CD2-CE 4.09Å; F370-M410 HydrophobicContact CD2-SD 4.35Å; F370-M410 HydrophobicContact CG-CE 4.26Å; F370-M410 HydrophobicContact CG-SD 4.07Å; L381-M410 HydrophobicContact CD1-SD 3.68Å; T406-M410 HydrophobicContact CG2-CG 4.44Å; T406-M410 HydrophobicContact CG2-SD 4.25Å; T406-M410 VanDerWaalsContact O-CG 3.27Å; T406-M410 WeakPolarHBondContact O-CG 3.45Å; T406-M410 PolarHBondContact O-N 3.36Å; L407-M410 PolarHBondContact O-N 3.45Å; M410-Q412 VanDerWaalsContact C-N 3.3Å; M410-Q412 PolarHBondContact O-N 3.29Å; M410-R413 WeakPolarHBondContact O-CA 3.34Å; M410-R413 PolarHBondContact O-N 3.27Å; M410-P417 VanDerWaalsContact CE-CA 3.4Å; M410-P417 HydrophobicContact CE-CB 3.53Å; M410-P417 HydrophobicContact CE-CG 4.28Å; M410-I422 HydrophobicContact CB-CD1 3.8Å; M410-I422 HydrophobicContact CE-CD1 4.07Å; M410-L429 WeakPolarHBondContact O-CD2 3.47Å
411	L	92.8	Very high	89.3	Confident	1 Å²	1	26 Å²	26	1%	0.005	16%	0.162	C	C	.	.	H	α-helix	trans	-65	-32.2	174.2	-74.9	173.4	0	0	0	113.1	I363 F365 L407 I408 R413 I422 Y437 L524 I554	I363-L411 HydrophobicContact CD1-CD1 4.39Å; I363-L411 HydrophobicContact CD1-CD2 4.08Å; I363-L411 HydrophobicContact CG2-CD2 3.7Å; F365-L411 HydrophobicContact CE1-CD2 4.38Å; F365-L411 HydrophobicContact CE2-CD2 4.17Å; F365-L411 HydrophobicContact CZ-CD1 4.03Å; F365-L411 HydrophobicContact CZ-CD2 3.62Å; F365-L411 HydrophobicContact CZ-CG 3.74Å; L407-L411 WeakPolarHBondContact O-CG 3.33Å; L407-L411 PolarHBondContact O-N 3.02Å; I408-L411 PolarHBondContact O-N 3.36Å; L411-R413 PolarHBondContact O-N 2.99Å; L411-I422 HydrophobicContact CD2-CG2 4.18Å; L411-Y437 WeakPolarHBondContact O-CE1 3.22Å; L411-Y437 VanDerWaalsContact O-CZ 3.32Å; L411-Y437 PolarHBondContact O-OH 2.85Å; L411-L524 HydrophobicContact CB-CD1 4.09Å; L411-L524 HydrophobicContact CD1-CD2 3.91Å; L411-I554 HydrophobicContact CD1-CD1 3.44Å; L411-I554 VanDerWaalsContact CD1-CD1 3.44Å
412	Q	90.9	Very high	90	Very high	4 Å²	4	22.9 Å²	22.9	2%	0.019	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.4	-3.7	170.8	-71.2	177.7	88.3	0	0	113.2	I408 H409 M410 F414 R438 C443 L524 S884	I408-Q412 VanDerWaalsContact CG2-NE2 3.27Å; I408-Q412 WeakPolarHBondContact O-CG 3.17Å; I408-Q412 PolarHBondContact O-N 3.16Å; I408-Q412 PolarHBondContact O-NE2 3.32Å; H409-Q412 PolarHBondContact O-N 3.38Å; M410-Q412 VanDerWaalsContact C-N 3.3Å; M410-Q412 PolarHBondContact O-N 3.29Å; Q412-F414 VanDerWaalsContact C-N 3.28Å; Q412-F414 HydrophobicContact CB-CD1 4.1Å; Q412-F414 HydrophobicContact CB-CD2 4.23Å; Q412-F414 HydrophobicContact CB-CE1 4.03Å; Q412-F414 HydrophobicContact CB-CE2 4.15Å; Q412-F414 HydrophobicContact CB-CG 4.2Å; Q412-F414 HydrophobicContact CB-CZ 4.05Å; Q412-F414 PolarHBondContact O-N 3.23Å; Q412-R438 PolarHBondContact O-NE 3.36Å; Q412-R438 VanDerWaalsContact O-NE 3.15Å; Q412-C443 PolarHBondContact NE2-SG 3.26Å; Q412-C443 VanDerWaalsContact NE2-SG 3.43Å; Q412-L524 HydrophobicContact CG-CD1 3.82Å; Q412-S884 VanDerWaalsContact OE1-CB 3.32Å; Q412-S884 PolarHBondContact OE1-OG 3.23Å
413	R	90.3	Very high	90.4	Very high	4 Å²	4	23.1 Å²	23.1	2%	0.015	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.1	45.3	-173.7	-159.5	-178.7	173.7	-170.9	-11.7	111.5	I347 H409 M410 L411 D416 L429 R430 L432 I434 R438	I347-R413 HydrophobicContact CG2-CG 4.41Å; H409-R413 PolarHBondContact O-N 2.93Å; M410-R413 WeakPolarHBondContact O-CA 3.34Å; M410-R413 PolarHBondContact O-N 3.27Å; L411-R413 PolarHBondContact O-N 2.99Å; R413-D416 IonicContact NE-OD1 3.28Å; R413-L429 HydrophobicContact CB-CD1 4.44Å; R413-L429 HydrophobicContact CB-CD2 4.12Å; R413-L429 HydrophobicContact CB-CG 4.28Å; R413-L429 HydrophobicContact CG-CD2 4.35Å; R413-L429 HydrophobicContact CG-CG 4.23Å; R413-L429 PolarHBondContact NH1-O 3.43Å; R413-R430 VanDerWaalsContact CZ-CA 3.45Å; R413-R430 PolarHBondContact NH1-O 3.27Å; R413-R430 PolarHBondContact NH2-O 3.23Å; R413-L432 PolarHBondContact NH1-O 2.88Å; R413-L432 VanDerWaalsContact NH1-O 3.12Å; R413-I434 HydrophobicContact CB-CD1 4.22Å; R413-I434 HydrophobicContact CG-CD1 4.28Å; R413-R438 PolarHBondContact O-NH2 3.26Å
414	F	88.9	Confident	90.7	Very high	3 Å²	3	23 Å²	23	1%	0.013	13%	0.128	C	C	.	.	S	Bend	trans	-78.7	-29.4	166.3	-67.7	-17.6	0	0	0	111.5	V132 H409 Q412 R880 K883	V132-F414 HydrophobicContact CB-CB 4.13Å; V132-F414 HydrophobicContact CB-CG 4.34Å; V132-F414 HydrophobicContact CG2-CB 3.93Å; V132-F414 HydrophobicContact CG2-CD1 3.63Å; V132-F414 HydrophobicContact CG2-CD2 4.16Å; V132-F414 HydrophobicContact CG2-CE1 4.13Å; V132-F414 HydrophobicContact CG2-CG 3.65Å; H409-F414 HydrophobicContact CB-CB 4.43Å; H409-F414 HydrophobicContact CB-CD2 4.31Å; H409-F414 WeakPolarHBondContact O-CB 3.27Å; H409-F414 PolarHBondContact O-N 3.25Å; Q412-F414 VanDerWaalsContact C-N 3.28Å; Q412-F414 HydrophobicContact CB-CD1 4.1Å; Q412-F414 HydrophobicContact CB-CD2 4.23Å; Q412-F414 HydrophobicContact CB-CE1 4.03Å; Q412-F414 HydrophobicContact CB-CE2 4.15Å; Q412-F414 HydrophobicContact CB-CG 4.2Å; Q412-F414 HydrophobicContact CB-CZ 4.05Å; Q412-F414 PolarHBondContact O-N 3.23Å; F414-R880 HydrophobicContact CE2-CB 4.31Å; F414-K883 HydrophobicContact CE1-CB 3.93Å
415	Y	89	Confident	90.6	Very high	11 Å²	11	25 Å²	25	4%	0.043	14%	0.137	C	C	.	.	S	Bend	trans	-136.5	141.4	174.1	-47.8	-84.8	0	0	0	109	L133 D136 F370 Y372 H409	L133-Y415 HydrophobicContact CB-CD1 4.41Å; L133-Y415 HydrophobicContact CB-CE1 4.19Å; L133-Y415 HydrophobicContact CD1-CE1 4.29Å; D136-Y415 PolarHBondContact OD2-OH 3.41Å; F370-Y415 HydrophobicContact CE2-CG 4.2Å; F370-Y415 HydrophobicContact CZ-CD1 4.1Å; F370-Y415 HydrophobicContact CZ-CD2 4.36Å; F370-Y415 AromaticContact CZ-CG 3.78Å; F370-Y415 HydrophobicContact CZ-CG 3.78Å; Y372-Y415 HydrophobicContact CD1-CE1 4.25Å; Y372-Y415 HydrophobicContact CE1-CD2 4.2Å; Y372-Y415 HydrophobicContact CE1-CE1 4.24Å; Y372-Y415 AromaticContact CE1-CE2 3.76Å; Y372-Y415 HydrophobicContact CE1-CE2 3.76Å; Y372-Y415 AromaticContact CE1-CZ 3.77Å; H409-Y415 HydrophobicContact CB-CD2 3.8Å; H409-Y415 HydrophobicContact CB-CE2 3.85Å
416	D	88.7	Confident	90.5	Very high	50 Å²	50	26 Å²	26	27%	0.267	15%	0.154	S	C	.	.			trans	-89.3	150.7	170.3	-76.4	-24	0	0	0	109.9	R413	R413-D416 IonicContact NE-OD1 3.28Å
417	P	89.7	Confident	90.4	Very high	16 Å²	16	26.5 Å²	26.5	10%	0.104	16%	0.157	C	C	.	.			trans	-62.7	141.2	175.8	25.8	-34.3	0	0	0	111.9	V368 M410 Q419	V368-P417 HydrophobicContact CG1-CB 3.96Å; M410-P417 VanDerWaalsContact CE-CA 3.4Å; M410-P417 HydrophobicContact CE-CB 3.53Å; M410-P417 HydrophobicContact CE-CG 4.28Å; P417-Q419 VanDerWaalsContact C-N 3.35Å
418	T	88.3	Confident	90.3	Very high	89 Å²	89	27.2 Å²	27.2	55%	0.546	16%	0.161	S	C	.	.	S	Bend	trans	-67.6	-38.8	174.2	-48.2	0	0	0	0	110.8	N369 N371	N369-T418 WeakPolarHBondContact O-CB 3.28Å; N369-T418 PolarHBondContact O-N 3.44Å; N371-T418 PolarHBondContact N-OG1 2.89Å
419	Q	90.3	Very high	90.2	Very high	121 Å²	121	27.4 Å²	27.4	57%	0.565	16%	0.162	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-142.5	154.9	169.9	-59.6	178.1	-20.1	0	0	109.3	V368 N369 P417	V368-Q419 WeakPolarHBondContact CA-O 3.3Å; N369-Q419 HydrophobicContact CB-CB 4.05Å; N369-Q419 PolarHBondContact N-O 3.24Å; N369-Q419 PolarHBondContact ND2-OE1 3.15Å; N369-Q419 PolarHBondContact O-N 3.04Å; P417-Q419 VanDerWaalsContact C-N 3.35Å
420	G	90.4	Very high	90.1	Very high	28 Å²	28	29.8 Å²	29.8	29%	0.289	17%	0.17	S	C	.	.	E	Extended strand (participates in β ladder)	trans	90.1	-173.6	-175.2	0	0	0	0	0	113.5	R366 H367	R366-G420 VanDerWaalsContact O-CA 3.26Å; R366-G420 WeakPolarHBondContact O-CA 3.35Å; H367-G420 WeakPolarHBondContact O-CA 3.41Å
421	E	93.4	Very high	89.8	Confident	58 Å²	58	35.2 Å²	35.2	27%	0.271	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	149.4	-177.8	60.4	-176.3	-170.2	0	0	111.3	R366 L423	R366-E421 HydrophobicContact CB-CG 3.88Å; R366-E421 WeakPolarHBondContact CD-OE1 3.31Å; R366-E421 HydrophobicContact CG-CG 4.48Å; R366-E421 IonicContact CZ-OE1 3.78Å; R366-E421 PolarHBondContact N-O 3.43Å; R366-E421 IonicContact NE-OE1 2.59Å; R366-E421 IonicContact NH1-OE1 2.71Å; R366-E421 PolarHBondContact NH1-OE1 2.95Å; R366-E421 PolarHBondContact O-N 3.37Å; R366-E421 VanDerWaalsContact O-N 3.09Å; E421-L423 HydrophobicContact CB-CD2 4.49Å; E421-L423 HydrophobicContact CG-CD2 4.14Å; E421-L423 HydrophobicContact CG-CG 4.27Å
422	I	93.7	Very high	89.6	Confident	4 Å²	4	35.3 Å²	35.3	2%	0.021	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	115.3	172.6	-58.1	176	0	0	0	106.4	I363 F365 V368 M410 L411 L429	I363-I422 HydrophobicContact CG2-CG2 4.39Å; F365-I422 HydrophobicContact CD1-CD1 3.93Å; F365-I422 HydrophobicContact CD1-CG1 3.72Å; F365-I422 HydrophobicContact CD1-CG2 4.35Å; F365-I422 HydrophobicContact CE1-CD1 3.67Å; F365-I422 HydrophobicContact CE1-CG1 3.96Å; F365-I422 HydrophobicContact CE1-CG2 4.25Å; V368-I422 HydrophobicContact CG2-CG1 4.09Å; M410-I422 HydrophobicContact CB-CD1 3.8Å; M410-I422 HydrophobicContact CE-CD1 4.07Å; L411-I422 HydrophobicContact CD2-CG2 4.18Å; I422-L429 HydrophobicContact CB-CB 4.27Å; I422-L429 HydrophobicContact CB-CD2 4.34Å; I422-L429 HydrophobicContact CG2-CB 4.45Å; I422-L429 HydrophobicContact CG2-CD2 4.2Å; I422-L429 VanDerWaalsContact O-CB 3.28Å; I422-L429 WeakPolarHBondContact O-CB 3.26Å; I422-L429 PolarHBondContact O-N 3.45Å
423	L	93.5	Very high	89.4	Confident	7 Å²	7	36.2 Å²	36.2	4%	0.037	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	133.9	-177.8	-53.8	174.5	0	0	0	110.4	I363 T364 R366 E421 V427 D428	I363-L423 CarbonylContact C-O 3.57Å; I363-L423 WeakPolarHBondContact CA-O 3.48Å; T364-L423 PolarHBondContact N-O 3.05Å; T364-L423 PolarHBondContact O-N 3.43Å; R366-L423 HydrophobicContact CG-CD1 4.47Å; R366-L423 VanDerWaalsContact NE-CD1 3.34Å; E421-L423 HydrophobicContact CB-CD2 4.49Å; E421-L423 HydrophobicContact CG-CD2 4.14Å; E421-L423 HydrophobicContact CG-CG 4.27Å; L423-V427 CarbonylContact C-O 3.59Å; L423-V427 WeakPolarHBondContact CA-O 3.4Å; L423-D428 HydrophobicContact CD2-CB 4.01Å
424	I	91.1	Very high	89.2	Confident	0 Å²	0	36.4 Å²	36.4	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	116.1	173.5	-57.3	-59.3	0	0	0	106.5	L356 F359 I363 G426 V427 L429 L432 Y437	L356-I424 HydrophobicContact CD1-CG2 4.07Å; F359-I424 HydrophobicContact CD2-CG2 3.86Å; F359-I424 HydrophobicContact CE2-CG2 3.39Å; F359-I424 HydrophobicContact CZ-CG2 4.43Å; I363-I424 HydrophobicContact CB-CD1 4.4Å; I363-I424 HydrophobicContact CG1-CD1 3.9Å; I363-I424 HydrophobicContact CG2-CD1 4.18Å; I424-G426 PolarHBondContact O-N 3.4Å; I424-G426 VanDerWaalsContact O-N 3.1Å; I424-V427 PolarHBondContact N-O 3.15Å; I424-V427 PolarHBondContact O-N 3.38Å; I424-L429 HydrophobicContact CG1-CB 4.34Å; I424-L429 HydrophobicContact CG1-CD1 4.21Å; I424-L432 HydrophobicContact CB-CD1 3.93Å; I424-L432 HydrophobicContact CG1-CD1 4.14Å; I424-L432 HydrophobicContact CG2-CD1 4.17Å; I424-Y437 HydrophobicContact CD1-CE2 4.13Å; I424-Y437 HydrophobicContact CG1-CE2 3.89Å; I424-Y437 HydrophobicContact CG2-CE2 4.25Å
425	Q	87.1	Confident	89	Confident	60 Å²	60	38.5 Å²	38.5	28%	0.28	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	51	33.1	-172.1	-63.5	-179.9	-44	0	0	113.8	D358 D360 S362 V427	D358-Q425 PolarHBondContact O-NE2 2.81Å; D358-Q425 PolarHBondContact O-OE1 2.9Å; D360-Q425 WeakPolarHBondContact OD1-CG 3.36Å; D360-Q425 PolarHBondContact OD1-NE2 3.29Å; S362-Q425 PolarHBondContact O-N 3.23Å; S362-Q425 VanDerWaalsContact O-N 3.16Å; S362-Q425 WeakPolarHBondContact OG-CG 3.28Å; Q425-V427 VanDerWaalsContact C-N 3.27Å; Q425-V427 PolarHBondContact O-N 3.06Å
426	G	85.9	Confident	88.8	Confident	57 Å²	57	40.1 Å²	40.1	59%	0.588	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	79.4	-3.3	-177.4	0	0	0	0	0	115.7	I424	I424-G426 PolarHBondContact O-N 3.4Å; I424-G426 VanDerWaalsContact O-N 3.1Å
427	V	89.6	Confident	88.8	Confident	19 Å²	19	38.1 Å²	38.1	12%	0.115	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	134	173.5	-177.4	0	0	0	0	109.1	K354 L356 L423 I424 Q425 L429 E431 L432	K354-V427 HydrophobicContact CD-CG1 4.49Å; L356-V427 HydrophobicContact CD2-CG2 4.38Å; L423-V427 CarbonylContact C-O 3.59Å; L423-V427 WeakPolarHBondContact CA-O 3.4Å; I424-V427 PolarHBondContact N-O 3.15Å; I424-V427 PolarHBondContact O-N 3.38Å; Q425-V427 VanDerWaalsContact C-N 3.27Å; Q425-V427 PolarHBondContact O-N 3.06Å; V427-L429 PolarHBondContact O-N 3.05Å; V427-E431 HydrophobicContact CG1-CB 4.27Å; V427-L432 HydrophobicContact CB-CD2 4.27Å; V427-L432 HydrophobicContact CG1-CD2 3.72Å; V427-L432 HydrophobicContact CG1-CG 4.33Å
428	D	90.1	Very high	88.8	Confident	17 Å²	17	38 Å²	38	9%	0.091	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.9	130.3	176.5	-174.4	-12.9	0	0	0	110.9	L423 R430 E431	L423-D428 HydrophobicContact CD2-CB 4.01Å; D428-R430 PolarHBondContact O-N 3.18Å; D428-R430 WeakPolarHBondContact OD1-CB 3.41Å; D428-R430 PolarHBondContact OD1-N 3.11Å; D428-R430 IonicContact OD1-NE 3.66Å; D428-R430 PolarHBondContact OD1-NE 3.18Å; D428-R430 IonicContact OD2-CZ 2.78Å; D428-R430 IonicContact OD2-NE 3.74Å; D428-R430 PolarHBondContact OD2-NE 3.3Å; D428-R430 IonicContact OD2-NH2 2.99Å; D428-R430 PolarHBondContact OD2-NH2 3.41Å; D428-E431 HydrophobicContact CB-CG 4.22Å; D428-E431 WeakPolarHBondContact O-CB 3.5Å; D428-E431 PolarHBondContact O-N 2.93Å
429	L	89	Confident	88.7	Confident	5 Å²	5	37.2 Å²	37.2	3%	0.026	20%	0.2	C	C	.	.	G	3₁₀ helix	trans	-50.5	-30.4	175.3	178.2	57	0	0	0	112.1	M410 R413 I422 I424 V427 E431 L432 Y437	M410-L429 WeakPolarHBondContact O-CD2 3.47Å; R413-L429 HydrophobicContact CB-CD1 4.44Å; R413-L429 HydrophobicContact CB-CD2 4.12Å; R413-L429 HydrophobicContact CB-CG 4.28Å; R413-L429 HydrophobicContact CG-CD2 4.35Å; R413-L429 HydrophobicContact CG-CG 4.23Å; R413-L429 PolarHBondContact NH1-O 3.43Å; I422-L429 HydrophobicContact CB-CB 4.27Å; I422-L429 HydrophobicContact CB-CD2 4.34Å; I422-L429 HydrophobicContact CG2-CB 4.45Å; I422-L429 HydrophobicContact CG2-CD2 4.2Å; I422-L429 VanDerWaalsContact O-CB 3.28Å; I422-L429 WeakPolarHBondContact O-CB 3.26Å; I422-L429 PolarHBondContact O-N 3.45Å; I424-L429 HydrophobicContact CG1-CB 4.34Å; I424-L429 HydrophobicContact CG1-CD1 4.21Å; V427-L429 PolarHBondContact O-N 3.05Å; L429-E431 VanDerWaalsContact C-N 3.26Å; L429-E431 PolarHBondContact O-N 2.93Å; L429-L432 HydrophobicContact CD1-CD1 4.43Å; L429-L432 PolarHBondContact O-N 2.98Å; L429-Y437 HydrophobicContact CD1-CD1 3.72Å; L429-Y437 HydrophobicContact CD1-CD2 4.31Å; L429-Y437 HydrophobicContact CD1-CE1 3.24Å; L429-Y437 HydrophobicContact CD1-CE2 3.9Å; L429-Y437 HydrophobicContact CD1-CG 4.23Å
430	R	87.6	Confident	88.6	Confident	72 Å²	72	34 Å²	34	27%	0.272	18%	0.184	S	C	.	.	G	3₁₀ helix	trans	-68.2	-21	177.6	-64.9	177.8	-64.3	-162.7	-2.6	114.3	R413 D428	R413-R430 VanDerWaalsContact CZ-CA 3.45Å; R413-R430 PolarHBondContact NH1-O 3.27Å; R413-R430 PolarHBondContact NH2-O 3.23Å; D428-R430 PolarHBondContact O-N 3.18Å; D428-R430 WeakPolarHBondContact OD1-CB 3.41Å; D428-R430 PolarHBondContact OD1-N 3.11Å; D428-R430 IonicContact OD1-NE 3.66Å; D428-R430 PolarHBondContact OD1-NE 3.18Å; D428-R430 IonicContact OD2-CZ 2.78Å; D428-R430 IonicContact OD2-NE 3.74Å; D428-R430 PolarHBondContact OD2-NE 3.3Å; D428-R430 IonicContact OD2-NH2 2.99Å; D428-R430 PolarHBondContact OD2-NH2 3.41Å
431	E	86.7	Confident	88.6	Confident	113 Å²	113	33 Å²	33	53%	0.528	17%	0.172	S	C	.	.	G	3₁₀ helix	trans	-95	-12.5	-178.2	-62.3	-175.7	169.5	0	0	113.5	G353 K354 V427 D428 L429	G353-E431 CarbonylContact C-O 3.59Å; G353-E431 WeakPolarHBondContact CA-O 3.45Å; K354-E431 PolarHBondContact N-O 3.37Å; V427-E431 HydrophobicContact CG1-CB 4.27Å; D428-E431 HydrophobicContact CB-CG 4.22Å; D428-E431 WeakPolarHBondContact O-CB 3.5Å; D428-E431 PolarHBondContact O-N 2.93Å; L429-E431 VanDerWaalsContact C-N 3.26Å; L429-E431 PolarHBondContact O-N 2.93Å
432	L	86.9	Confident	88.4	Confident	3 Å²	3	30.2 Å²	30.2	2%	0.016	16%	0.16	C	C	.	.	B	Isolated β-bridge	trans	-79.2	150.2	-178.8	-61.3	-179.4	0	0	0	112.4	K354 L356 R413 I424 V427 L429 I434 Y437	K354-L432 HydrophobicContact CB-CD2 4.4Å; K354-L432 WeakPolarHBondContact O-CA 3.48Å; L356-L432 HydrophobicContact CD1-CD1 3.85Å; L356-L432 HydrophobicContact CD1-CD2 3.63Å; L356-L432 HydrophobicContact CD1-CG 4.42Å; L356-L432 HydrophobicContact CD2-CD2 4.42Å; L356-L432 HydrophobicContact CG-CD2 3.74Å; R413-L432 PolarHBondContact NH1-O 2.88Å; R413-L432 VanDerWaalsContact NH1-O 3.12Å; I424-L432 HydrophobicContact CB-CD1 3.93Å; I424-L432 HydrophobicContact CG1-CD1 4.14Å; I424-L432 HydrophobicContact CG2-CD1 4.17Å; V427-L432 HydrophobicContact CB-CD2 4.27Å; V427-L432 HydrophobicContact CG1-CD2 3.72Å; V427-L432 HydrophobicContact CG1-CG 4.33Å; L429-L432 HydrophobicContact CD1-CD1 4.43Å; L429-L432 PolarHBondContact O-N 2.98Å; L432-I434 PolarHBondContact O-N 3.28Å; L432-Y437 HydrophobicContact CD1-CD2 3.98Å; L432-Y437 HydrophobicContact CD1-CE2 4.43Å
433	N	87.3	Confident	88.3	Confident	24 Å²	24	30.7 Å²	30.7	13%	0.128	16%	0.163	C	C	.	.			trans	-66.5	123.9	166.1	172.7	-78.7	0	0	0	109.2	D351 K354 I355 H435 N436 Y437	D351-N433 PolarHBondContact O-ND2 3.12Å; D351-N433 PolarHBondContact OD1-ND2 3.13Å; K354-N433 PolarHBondContact O-N 3.16Å; K354-N433 VanDerWaalsContact O-N 3.08Å; I355-N433 HydrophobicContact CG1-CB 4.15Å; N433-H435 PolarHBondContact OD1-N 2.9Å; N433-N436 WeakPolarHBondContact OD1-CB 3.31Å; N433-N436 PolarHBondContact OD1-N 3.45Å; N433-Y437 VanDerWaalsContact O-CB 3.22Å; N433-Y437 WeakPolarHBondContact O-CB 3.46Å; N433-Y437 PolarHBondContact O-N 3.3Å
434	I	86.5	Confident	88.1	Confident	7 Å²	7	30.4 Å²	30.4	4%	0.036	16%	0.162	C	C	.	.	H	α-helix	trans	-72.7	-38.4	-169.3	-161.3	161.1	0	0	0	113	I347 R413 L432 Y437 R438	I347-I434 HydrophobicContact CG2-CD1 3.38Å; R413-I434 HydrophobicContact CB-CD1 4.22Å; R413-I434 HydrophobicContact CG-CD1 4.28Å; L432-I434 PolarHBondContact O-N 3.28Å; I434-Y437 PolarHBondContact O-N 3.34Å; I434-R438 HydrophobicContact CG1-CG 4.4Å; I434-R438 WeakPolarHBondContact O-CB 3.36Å; I434-R438 WeakPolarHBondContact O-CG 3.17Å; I434-R438 PolarHBondContact O-N 2.86Å
435	H	84	Confident	88	Confident	48 Å²	48	32.2 Å²	32.2	22%	0.222	17%	0.171	C	C	.	.	H	α-helix	trans	-65.6	-46.7	179.7	-73.8	-64.3	0	0	0	111.5	D351 N433 N439 E888	D351-H435 IonicContact OD1-CD2 3.51Å; D351-H435 PolarHBondContact OD1-CD2 3.15Å; D351-H435 IonicContact OD2-CD2 2.81Å; N433-H435 PolarHBondContact OD1-N 2.9Å; H435-N439 WeakPolarHBondContact O-CB 3.43Å; H435-N439 PolarHBondContact O-N 3.01Å; H435-N439 PolarHBondContact O-ND2 2.91Å; H435-E888 IonicContact CE1-OE2 3.52Å
436	N	85.5	Confident	87.9	Confident	45 Å²	45	33.1 Å²	33.1	24%	0.241	18%	0.175	C	C	.	.	H	α-helix	trans	-67.5	-39.3	177.4	-169.2	51.8	0	0	0	111.6	I355 N433 N439 Q440	I355-N436 VanDerWaalsContact CG2-ND2 3.28Å; I355-N436 WeakPolarHBondContact CG2-ND2 3.48Å; N433-N436 WeakPolarHBondContact OD1-CB 3.31Å; N433-N436 PolarHBondContact OD1-N 3.45Å; N436-N439 PolarHBondContact O-N 3.19Å; N436-Q440 WeakPolarHBondContact O-CG 3.41Å; N436-Q440 PolarHBondContact O-N 2.91Å
437	Y	88.9	Confident	87.7	Confident	8 Å²	8	37.6 Å²	37.6	3%	0.031	18%	0.18	C	C	.	.	H	α-helix	trans	-61.5	-49.5	175.7	173.1	-109.3	0	0	0	112	F359 L411 I424 L429 L432 N433 I434 N439 Q440 I441	F359-Y437 HydrophobicContact CE2-CD2 4.18Å; F359-Y437 AromaticContact CE2-CE2 3.94Å; F359-Y437 HydrophobicContact CE2-CE2 3.94Å; F359-Y437 HydrophobicContact CZ-CE2 4.48Å; L411-Y437 WeakPolarHBondContact O-CE1 3.22Å; L411-Y437 VanDerWaalsContact O-CZ 3.32Å; L411-Y437 PolarHBondContact O-OH 2.85Å; I424-Y437 HydrophobicContact CD1-CE2 4.13Å; I424-Y437 HydrophobicContact CG1-CE2 3.89Å; I424-Y437 HydrophobicContact CG2-CE2 4.25Å; L429-Y437 HydrophobicContact CD1-CD1 3.72Å; L429-Y437 HydrophobicContact CD1-CD2 4.31Å; L429-Y437 HydrophobicContact CD1-CE1 3.24Å; L429-Y437 HydrophobicContact CD1-CE2 3.9Å; L429-Y437 HydrophobicContact CD1-CG 4.23Å; L432-Y437 HydrophobicContact CD1-CD2 3.98Å; L432-Y437 HydrophobicContact CD1-CE2 4.43Å; N433-Y437 VanDerWaalsContact O-CB 3.22Å; N433-Y437 WeakPolarHBondContact O-CB 3.46Å; N433-Y437 PolarHBondContact O-N 3.3Å; I434-Y437 PolarHBondContact O-N 3.34Å; Y437-N439 VanDerWaalsContact C-N 3.27Å; Y437-N439 PolarHBondContact O-N 3.17Å; Y437-Q440 WeakPolarHBondContact O-CB 3.33Å; Y437-Q440 PolarHBondContact O-N 3Å; Y437-I441 HydrophobicContact CD1-CD1 3.73Å; Y437-I441 HydrophobicContact CD2-CD1 4.19Å; Y437-I441 HydrophobicContact CE1-CD1 3.21Å; Y437-I441 HydrophobicContact CE2-CD1 3.74Å; Y437-I441 HydrophobicContact CE2-CG1 4.46Å; Y437-I441 HydrophobicContact CG-CD1 4.19Å; Y437-I441 WeakPolarHBondContact O-CG1 3.38Å
438	R	89.6	Confident	87.5	Confident	12 Å²	12	38.2 Å²	38.2	5%	0.045	18%	0.184	C	C	.	.	H	α-helix	trans	-65	-28.7	178	-71.6	-176.2	-176.7	152.3	3	113.2	Q412 R413 I434 Q440 I441 K883 S886 E888	Q412-R438 PolarHBondContact O-NE 3.36Å; Q412-R438 VanDerWaalsContact O-NE 3.15Å; R413-R438 PolarHBondContact O-NH2 3.26Å; I434-R438 HydrophobicContact CG1-CG 4.4Å; I434-R438 WeakPolarHBondContact O-CB 3.36Å; I434-R438 WeakPolarHBondContact O-CG 3.17Å; I434-R438 PolarHBondContact O-N 2.86Å; R438-Q440 PolarHBondContact O-N 3.01Å; R438-I441 PolarHBondContact O-N 3.09Å; R438-I441 VanDerWaalsContact O-O 3.1Å; R438-K883 WeakPolarHBondContact CD-O 3.14Å; R438-K883 PolarHBondContact NH1-O 3.36Å; R438-S886 WeakPolarHBondContact CB-OG 3.3Å; R438-E888 IonicContact NH1-OE1 3.46Å
439	N	86.5	Confident	87.4	Confident	73 Å²	73	39.6 Å²	39.6	39%	0.39	19%	0.193	S	C	.	.	H	α-helix	trans	-65.4	-23.8	172.4	-75.9	-21.6	0	0	0	113.4	H435 N436 Y437	H435-N439 WeakPolarHBondContact O-CB 3.43Å; H435-N439 PolarHBondContact O-N 3.01Å; H435-N439 PolarHBondContact O-ND2 2.91Å; N436-N439 PolarHBondContact O-N 3.19Å; Y437-N439 VanDerWaalsContact C-N 3.27Å; Y437-N439 PolarHBondContact O-N 3.17Å
440	Q	87.3	Confident	87.4	Confident	53 Å²	53	40.6 Å²	40.6	25%	0.248	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.9	-9.3	175.3	-59.3	-60.7	-30.3	0	0	113.4	F359 N436 Y437 R438 K521 L522	F359-Q440 HydrophobicContact CB-CG 4.24Å; F359-Q440 HydrophobicContact CD1-CB 4.01Å; F359-Q440 HydrophobicContact CE1-CB 4.28Å; F359-Q440 HydrophobicContact CG-CB 4.18Å; F359-Q440 HydrophobicContact CG-CG 4.33Å; N436-Q440 WeakPolarHBondContact O-CG 3.41Å; N436-Q440 PolarHBondContact O-N 2.91Å; Y437-Q440 WeakPolarHBondContact O-CB 3.33Å; Y437-Q440 PolarHBondContact O-N 3Å; R438-Q440 PolarHBondContact O-N 3.01Å; Q440-K521 PolarHBondContact O-N 2.94Å; Q440-L522 PolarHBondContact O-N 3.16Å
441	I	90.2	Very high	87.6	Confident	7 Å²	7	37.4 Å²	37.4	4%	0.036	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	137.2	-175.1	-56.1	167.2	0	0	0	109.8	Y437 R438 L522 L524	Y437-I441 HydrophobicContact CD1-CD1 3.73Å; Y437-I441 HydrophobicContact CD2-CD1 4.19Å; Y437-I441 HydrophobicContact CE1-CD1 3.21Å; Y437-I441 HydrophobicContact CE2-CD1 3.74Å; Y437-I441 HydrophobicContact CE2-CG1 4.46Å; Y437-I441 HydrophobicContact CG-CD1 4.19Å; Y437-I441 WeakPolarHBondContact O-CG1 3.38Å; R438-I441 PolarHBondContact O-N 3.09Å; R438-I441 VanDerWaalsContact O-O 3.1Å; I441-L522 WeakPolarHBondContact CA-O 3.5Å; I441-L522 HydrophobicContact CD1-CD2 4.46Å; I441-L522 HydrophobicContact CG1-CB 4.38Å; I441-L522 HydrophobicContact CG1-CD2 4.17Å; I441-L524 HydrophobicContact CG2-CD1 3.68Å; I441-L524 HydrophobicContact CG2-CG 3.9Å
442	G	90.1	Very high	87.6	Confident	1 Å²	1	32.8 Å²	32.8	1%	0.01	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	125	167.4	0	0	0	0	0	109.6	P520 L522 L523 L524	G442-P520 VanDerWaalsContact N-CB 3.25Å; G442-L522 PolarHBondContact N-O 2.93Å; G442-L523 CarbonylContact O-C 3.45Å; G442-L523 WeakPolarHBondContact O-CA 3.42Å; G442-L524 PolarHBondContact O-N 2.98Å
443	C	91	Very high	87.6	Confident	13 Å²	13	33.2 Å²	33.2	9%	0.088	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	126	174	-169.2	0	0	0	0	110.3	Q412 V515 L524 S884	Q412-C443 PolarHBondContact NE2-SG 3.26Å; Q412-C443 VanDerWaalsContact NE2-SG 3.43Å; C443-V515 VanDerWaalsContact O-CG2 3.28Å; C443-V515 WeakPolarHBondContact O-CG2 3.43Å; C443-L524 CarbonylContact C-O 3.54Å; C443-L524 WeakPolarHBondContact CA-O 3.48Å; C443-L524 HydrophobicContact CB-CB 4.44Å; C443-S884 WeakPolarHBondContact CB-OG 3.28Å
444	V	89.8	Confident	87.8	Confident	2 Å²	2	32.9 Å²	32.9	1%	0.012	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	113.7	169.4	-175.1	0	0	0	0	107.4	Q508 I512 V515 L524 L525 D526 A528	V444-Q508 VanDerWaalsContact CG1-NE2 3.34Å; V444-I512 HydrophobicContact CG1-CG1 4.04Å; V444-I512 HydrophobicContact CG2-CG1 4.09Å; V444-V515 HydrophobicContact CG2-CB 4.42Å; V444-V515 HydrophobicContact CG2-CG2 4.11Å; V444-L524 PolarHBondContact N-O 3.03Å; V444-L525 HydrophobicContact CB-CD2 3.71Å; V444-L525 HydrophobicContact CG2-CD2 3.64Å; V444-D526 PolarHBondContact O-N 3.49Å; V444-A528 HydrophobicContact CB-CB 4.33Å; V444-A528 HydrophobicContact CG1-CB 3.79Å
445	Q	87.5	Confident	88.1	Confident	38 Å²	38	32.5 Å²	32.5	18%	0.178	17%	0.168	C	C	.	.			trans	-83.5	160.2	-177.9	-66.1	176.1	-31.9	0	0	111	E447 Q508 D526 T881	Q445-E447 VanDerWaalsContact C-N 3.35Å; Q445-E447 PolarHBondContact O-N 3.09Å; Q445-Q508 PolarHBondContact O-NE2 3.04Å; Q445-D526 CarbonylContact C-O 3.55Å; Q445-T881 PolarHBondContact OE1-OG1 3.43Å
446	Q	84.9	Confident	88.6	Confident	79 Å²	79	33.7 Å²	33.7	37%	0.369	17%	0.17	S	C	.	.	S	Bend	trans	-57.2	-45.8	176.3	-175.7	174.2	31.2	0	0	112.1	D526 E527 S530	Q446-D526 WeakPolarHBondContact CA-O 3.33Å; Q446-D526 PolarHBondContact N-O 2.82Å; Q446-E527 HydrophobicContact CB-CB 4.34Å; Q446-E527 HydrophobicContact CG-CB 4.15Å; Q446-E527 PolarHBondContact NE2-OE2 2.91Å; Q446-S530 WeakPolarHBondContact CG-OG 3.43Å; Q446-S530 PolarHBondContact NE2-OG 3.46Å
447	E	82.1	Confident	88.9	Confident	151 Å²	151	36.7 Å²	36.7	71%	0.706	18%	0.183	S	C	*	.	S	Bend	trans	-105.2	115.8	174.2	-68	-168.3	164.5	0	0	110.9	Q445 V449	Q445-E447 VanDerWaalsContact C-N 3.35Å; Q445-E447 PolarHBondContact O-N 3.09Å; E447-V449 PolarHBondContact O-N 3.29Å
448	P	86.1	Confident	89.1	Confident	31 Å²	31	36.4 Å²	36.4	20%	0.201	18%	0.182	C	C	.	.			trans	-74.8	116.7	-179.6	25.5	-29.9	0	0	0	111.7	K507 Q508 A511	P448-K507 HydrophobicContact CB-CB 4.04Å; P448-K507 HydrophobicContact CG-CB 3.55Å; P448-Q508 HydrophobicContact CG-CB 4.28Å; P448-A511 HydrophobicContact CB-CB 3.84Å
449	V	87.3	Confident	89.3	Confident	46 Å²	46	35.8 Å²	35.8	28%	0.279	18%	0.18	S	C	.	.			trans	-87.5	122.7	172.5	-174.9	0	0	0	0	110.6	E447 R514 A878 T881	E447-V449 PolarHBondContact O-N 3.29Å; V449-R514 VanDerWaalsContact O-CZ 3.25Å; V449-R514 PolarHBondContact O-NH1 2.77Å; V449-R514 PolarHBondContact O-NH2 3.15Å; V449-A878 HydrophobicContact CG1-CB 3.72Å; V449-T881 HydrophobicContact CB-CG2 4.4Å
450	L	90.3	Very high	89.6	Confident	26 Å²	26	33 Å²	33	14%	0.136	17%	0.168	C	C	.	.			trans	-109.1	137.3	168.5	-61	-177.7	0	0	0	109.5	N458 V495 L502 K507 I510	L450-N458 WeakPolarHBondContact CA-OD1 3.35Å; L450-V495 HydrophobicContact CB-CG2 4.44Å; L450-V495 HydrophobicContact CD1-CB 4.24Å; L450-V495 HydrophobicContact CD1-CG2 4.32Å; L450-L502 HydrophobicContact CD1-CD1 4.1Å; L450-K507 HydrophobicContact CD1-CB 4.26Å; L450-K507 HydrophobicContact CD1-CG 3.92Å; L450-I510 HydrophobicContact CD1-CD1 4.21Å; L450-I510 HydrophobicContact CD2-CB 4.12Å; L450-I510 HydrophobicContact CD2-CG2 3.61Å
451	F	90.2	Very high	89.9	Confident	5 Å²	5	31 Å²	31	2%	0.022	16%	0.159	C	C	.	.			trans	-86.7	153.4	-179.9	-65.1	-75.3	0	0	0	110.6	G453 N458 L461 E874 A878 T881 V882 L887 F891	F451-G453 PolarHBondContact O-N 3.34Å; F451-G453 VanDerWaalsContact O-N 3.13Å; F451-N458 PolarHBondContact N-OD1 3.24Å; F451-N458 PolarHBondContact O-ND2 3.12Å; F451-N458 PolarHBondContact O-OD1 2.96Å; F451-L461 HydrophobicContact CB-CD1 3.9Å; F451-L461 HydrophobicContact CD2-CD1 3.26Å; F451-L461 HydrophobicContact CE2-CD1 3.98Å; F451-L461 HydrophobicContact CG-CD1 3.81Å; F451-E874 WeakPolarHBondContact CA-OE1 3.28Å; F451-E874 WeakPolarHBondContact CB-OE1 3.46Å; F451-E874 HydrophobicContact CD1-CG 3.92Å; F451-E874 WeakPolarHBondContact CD1-OE1 3.22Å; F451-A878 HydrophobicContact CE1-CB 3.7Å; F451-A878 HydrophobicContact CZ-CB 4.11Å; F451-T881 HydrophobicContact CE2-CG2 4.22Å; F451-T881 HydrophobicContact CZ-CG2 4.22Å; F451-V882 HydrophobicContact CE1-CG2 3.89Å; F451-V882 HydrophobicContact CZ-CG2 3.83Å; F451-L887 HydrophobicContact CE2-CD1 4.33Å; F451-F891 HydrophobicContact CD1-CE1 4.41Å; F451-F891 HydrophobicContact CD1-CE2 4.28Å; F451-F891 AromaticContact CD1-CZ 3.53Å; F451-F891 HydrophobicContact CD1-CZ 3.53Å; F451-F891 AromaticContact CE1-CE2 3.91Å; F451-F891 HydrophobicContact CE1-CE2 3.91Å; F451-F891 AromaticContact CE1-CZ 3.58Å; F451-F891 HydrophobicContact CE1-CZ 3.58Å; F451-F891 HydrophobicContact CG-CZ 4.18Å; F451-F891 HydrophobicContact CZ-CE2 4.24Å; F451-F891 HydrophobicContact CZ-CZ 4.28Å
452	D	87	Confident	89.9	Confident	17 Å²	17	30.9 Å²	30.9	9%	0.091	16%	0.159	C	C	.	.	S	Bend	trans	-63.4	107.1	175.9	-103.2	9.7	0	0	0	110	V495 G496 E497 K498 E874	D452-V495 WeakPolarHBondContact CA-O 3.46Å; D452-G496 WeakPolarHBondContact OD1-CA 3.5Å; D452-E497 PolarHBondContact OD1-N 3.23Å; D452-K498 PolarHBondContact OD1-N 3.29Å; D452-K498 IonicContact OD2-NZ 2.9Å; D452-K498 PolarHBondContact OD2-NZ 2.88Å; D452-E874 PolarHBondContact N-OE1 3.26Å
453	G	87.3	Confident	89.9	Confident	12 Å²	12	34.6 Å²	34.6	12%	0.124	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	168.4	-166	-175.7	0	0	0	0	0	111.9	F451 E457 L494 V495	F451-G453 PolarHBondContact O-N 3.34Å; F451-G453 VanDerWaalsContact O-N 3.13Å; G453-E457 VanDerWaalsContact CA-OE2 3.23Å; G453-E457 WeakPolarHBondContact CA-OE2 3.1Å; G453-L494 CarbonylContact O-C 3.36Å; G453-L494 WeakPolarHBondContact O-CA 3.28Å; G453-V495 PolarHBondContact N-O 3.03Å; G453-V495 PolarHBondContact O-N 3.47Å
454	T	91.8	Very high	89.7	Confident	16 Å²	16	38.9 Å²	38.9	10%	0.098	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	163.8	173.5	63.8	0	0	0	0	111.8	R456 E457 N458 T493 L494	T454-R456 VanDerWaalsContact C-N 3.26Å; T454-R456 PolarHBondContact O-N 3.31Å; T454-E457 PolarHBondContact N-OE2 3.31Å; T454-E457 PolarHBondContact O-N 2.74Å; T454-E457 WeakPolarHBondContact OG1-CB 3.48Å; T454-E457 VanDerWaalsContact OG1-CG 3.27Å; T454-E457 WeakPolarHBondContact OG1-CG 3.34Å; T454-E457 PolarHBondContact OG1-N 3.14Å; T454-N458 PolarHBondContact O-N 2.98Å; T454-N458 PolarHBondContact O-ND2 2.65Å; T454-T493 WeakPolarHBondContact CA-O 3.38Å; T454-L494 HydrophobicContact CG2-CD2 3.99Å
455	I	92.9	Very high	89.6	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-60.6	-39.8	170.4	-65.7	174.4	0	0	0	110.2	N458 I459 I484 L487 Y491 T493 V495 L502 I510	I455-N458 PolarHBondContact O-N 3.45Å; I455-I459 HydrophobicContact CG2-CD1 4.03Å; I455-I459 WeakPolarHBondContact O-CG1 3.42Å; I455-I459 PolarHBondContact O-N 3.05Å; I455-I484 HydrophobicContact CD1-CG1 4.38Å; I455-I484 HydrophobicContact CD1-CG2 4.4Å; I455-I484 HydrophobicContact CG2-CD1 3.85Å; I455-I484 HydrophobicContact CG2-CG1 4.26Å; I455-I484 HydrophobicContact CG2-CG2 4.47Å; I455-L487 HydrophobicContact CD1-CD1 3.46Å; I455-L487 VanDerWaalsContact CD1-CD1 3.46Å; I455-Y491 HydrophobicContact CG2-CD1 4.39Å; I455-Y491 PolarHBondContact N-O 3.34Å; I455-T493 PolarHBondContact N-O 2.88Å; I455-V495 HydrophobicContact CD1-CG1 4.14Å; I455-V495 HydrophobicContact CG1-CG1 3.58Å; I455-V495 HydrophobicContact CG1-CG2 4.31Å; I455-L502 HydrophobicContact CD1-CD1 4.5Å; I455-I510 HydrophobicContact CD1-CD1 4.23Å; I455-I510 HydrophobicContact CG1-CD1 4.24Å; I455-I510 HydrophobicContact CG2-CD1 4.13Å; I455-I510 HydrophobicContact CG2-CG1 4.37Å
456	R	94	Very high	89.7	Confident	72 Å²	72	45.1 Å²	45.1	27%	0.272	24%	0.235	S	C	.	.	H	α-helix	trans	-55	-53.2	174.2	-172.2	-172.3	-67.7	116.8	11.7	111.4	T454 N458 I459 G460 D468 I471 Y491 D492	T454-R456 VanDerWaalsContact C-N 3.26Å; T454-R456 PolarHBondContact O-N 3.31Å; R456-N458 VanDerWaalsContact C-N 3.32Å; R456-N458 PolarHBondContact O-N 2.9Å; R456-I459 PolarHBondContact O-N 3.47Å; R456-G460 PolarHBondContact O-N 2.93Å; R456-D468 WeakPolarHBondContact CD-OD1 3.43Å; R456-D468 IonicContact NE-OD1 3.66Å; R456-D468 PolarHBondContact NE-OD1 2.89Å; R456-I471 HydrophobicContact CG-CD1 3.7Å; R456-Y491 PolarHBondContact N-O 3.18Å; R456-D492 IonicContact CZ-OD1 3.24Å; R456-D492 IonicContact CZ-OD2 2.64Å; R456-D492 IonicContact NH1-OD1 3.38Å; R456-D492 PolarHBondContact NH1-OD1 3.49Å; R456-D492 IonicContact NH1-OD2 2.91Å; R456-D492 IonicContact NH2-OD1 3.38Å; R456-D492 PolarHBondContact NH2-OD1 2.93Å; R456-D492 IonicContact NH2-OD2 3.71Å; R456-D492 PolarHBondContact NH2-OD2 3.3Å
457	E	92	Very high	90.1	Very high	108 Å²	108	44.8 Å²	44.8	51%	0.505	24%	0.238	S	C	.	.	H	α-helix	trans	-59.8	-42.4	178.8	-74.9	168.2	172	0	0	111.5	G453 T454 I459 G460 L461	G453-E457 VanDerWaalsContact CA-OE2 3.23Å; G453-E457 WeakPolarHBondContact CA-OE2 3.1Å; T454-E457 PolarHBondContact N-OE2 3.31Å; T454-E457 PolarHBondContact O-N 2.74Å; T454-E457 WeakPolarHBondContact OG1-CB 3.48Å; T454-E457 VanDerWaalsContact OG1-CG 3.27Å; T454-E457 WeakPolarHBondContact OG1-CG 3.34Å; T454-E457 PolarHBondContact OG1-N 3.14Å; E457-I459 PolarHBondContact O-N 2.72Å; E457-G460 CarbonylContact O-C 3.41Å; E457-G460 WeakPolarHBondContact O-CA 3.12Å; E457-G460 PolarHBondContact O-N 2.87Å; E457-G460 VanDerWaalsContact O-N 3.15Å; E457-L461 WeakPolarHBondContact O-CG 3.35Å; E457-L461 PolarHBondContact O-N 2.83Å
458	N	92.9	Very high	90.6	Very high	2 Å²	2	41.8 Å²	41.8	1%	0.011	23%	0.227	C	C	.	.	H	α-helix	trans	-62.3	-41.5	179.4	-92.2	-90.7	0	0	0	113.2	L450 F451 T454 I455 R456 V495 I510 R514	L450-N458 WeakPolarHBondContact CA-OD1 3.35Å; F451-N458 PolarHBondContact N-OD1 3.24Å; F451-N458 PolarHBondContact O-ND2 3.12Å; F451-N458 PolarHBondContact O-OD1 2.96Å; T454-N458 PolarHBondContact O-N 2.98Å; T454-N458 PolarHBondContact O-ND2 2.65Å; I455-N458 PolarHBondContact O-N 3.45Å; R456-N458 VanDerWaalsContact C-N 3.32Å; R456-N458 PolarHBondContact O-N 2.9Å; N458-V495 VanDerWaalsContact ND2-CG2 3.29Å; N458-V495 WeakPolarHBondContact ND2-CG2 3.14Å; N458-I510 HydrophobicContact CB-CG2 4.45Å; N458-R514 WeakPolarHBondContact O-CD 3.24Å; N458-R514 WeakPolarHBondContact O-CG 3.48Å
459	I	94.5	Very high	90.9	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-68	-41.7	173.9	-62.1	172.1	0	0	0	109.6	I455 R456 E457 L461 G462 I471 A475 I484 Y491 I510 A513 I517	I455-I459 HydrophobicContact CG2-CD1 4.03Å; I455-I459 WeakPolarHBondContact O-CG1 3.42Å; I455-I459 PolarHBondContact O-N 3.05Å; R456-I459 PolarHBondContact O-N 3.47Å; E457-I459 PolarHBondContact O-N 2.72Å; I459-L461 PolarHBondContact O-N 3.1Å; I459-G462 PolarHBondContact O-N 3.4Å; I459-I471 HydrophobicContact CB-CG2 4.05Å; I459-I471 HydrophobicContact CD1-CG2 4.1Å; I459-I471 HydrophobicContact CG2-CB 4.39Å; I459-I471 HydrophobicContact CG2-CG1 4.32Å; I459-I471 HydrophobicContact CG2-CG2 3.93Å; I459-A475 HydrophobicContact CD1-CB 4.22Å; I459-I484 HydrophobicContact CD1-CD1 4.48Å; I459-Y491 HydrophobicContact CD1-CE1 4.19Å; I459-I510 HydrophobicContact CG1-CG2 4.06Å; I459-A513 HydrophobicContact CD1-CB 4.13Å; I459-A513 HydrophobicContact CG1-CB 4.16Å; I459-A513 HydrophobicContact CG2-CB 4.3Å; I459-I517 HydrophobicContact CG2-CD1 4.02Å
460	G	93.3	Very high	91.2	Very high	14 Å²	14	48.1 Å²	48.1	14%	0.144	25%	0.251	C	S	.	.	H	α-helix	trans	-60.9	-24	176.9	0	0	0	0	0	114.8	R456 E457 G462 K463 L464	R456-G460 PolarHBondContact O-N 2.93Å; E457-G460 CarbonylContact O-C 3.41Å; E457-G460 WeakPolarHBondContact O-CA 3.12Å; E457-G460 PolarHBondContact O-N 2.87Å; E457-G460 VanDerWaalsContact O-N 3.15Å; G460-G462 PolarHBondContact O-N 3.37Å; G460-G462 VanDerWaalsContact O-N 3.11Å; G460-K463 CarbonylContact O-C 3.51Å; G460-K463 PolarHBondContact O-N 3.31Å; G460-L464 PolarHBondContact O-N 2.87Å
461	L	92.4	Very high	91.4	Very high	10 Å²	10	47.3 Å²	47.3	5%	0.052	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-18.4	171.9	-70.1	174.2	0	0	0	113.1	F451 E457 I459 L464 L887 Y890	F451-L461 HydrophobicContact CB-CD1 3.9Å; F451-L461 HydrophobicContact CD2-CD1 3.26Å; F451-L461 HydrophobicContact CE2-CD1 3.98Å; F451-L461 HydrophobicContact CG-CD1 3.81Å; E457-L461 WeakPolarHBondContact O-CG 3.35Å; E457-L461 PolarHBondContact O-N 2.83Å; I459-L461 PolarHBondContact O-N 3.1Å; L461-L464 HydrophobicContact CD2-CD2 4.28Å; L461-L887 HydrophobicContact CB-CD1 4.04Å; L461-L887 HydrophobicContact CD1-CD1 4.49Å; L461-L887 HydrophobicContact CD2-CD1 4.26Å; L461-L887 HydrophobicContact CD2-CD2 4.22Å; L461-L887 HydrophobicContact CG-CD1 4.49Å; L461-Y890 HydrophobicContact CD2-CD1 3.99Å; L461-Y890 HydrophobicContact CD2-CE1 3.6Å; L461-Y890 HydrophobicContact CD2-CE2 4.49Å
462	G	89.6	Confident	91.6	Very high	5 Å²	5	50.3 Å²	50.3	5%	0.052	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-44.1	169.4	0	0	0	0	0	112	I459 G460 R514 R518	I459-G462 PolarHBondContact O-N 3.4Å; G460-G462 PolarHBondContact O-N 3.37Å; G460-G462 VanDerWaalsContact O-N 3.11Å; G462-R514 VanDerWaalsContact CA-O 3.25Å; G462-R514 WeakPolarHBondContact CA-O 3.19Å; G462-R518 WeakPolarHBondContact O-CG 3.38Å; G462-R518 PolarHBondContact O-NE 2.89Å; G462-R518 PolarHBondContact O-NH2 3.2Å; G462-R518 VanDerWaalsContact O-NH2 3.1Å
463	K	90.4	Very high	91.9	Very high	79 Å²	79	53.5 Å²	53.5	34%	0.343	28%	0.275	S	S	.	.	S	Bend	trans	-141.8	102.6	179.4	178.9	-174.8	175.9	-167.5	0	108.3	G460 N465 A466 E470 I517	G460-K463 CarbonylContact O-C 3.51Å; G460-K463 PolarHBondContact O-N 3.31Å; K463-N465 PolarHBondContact O-N 3.43Å; K463-A466 HydrophobicContact CB-CB 4.23Å; K463-A466 HydrophobicContact CD-CB 4.42Å; K463-A466 HydrophobicContact CG-CB 4.39Å; K463-A466 WeakPolarHBondContact O-CB 3.36Å; K463-A466 PolarHBondContact O-N 2.88Å; K463-E470 WeakPolarHBondContact CD-OE2 3.46Å; K463-E470 WeakPolarHBondContact CE-OE2 3.47Å; K463-E470 IonicContact NZ-OE1 3.05Å; K463-E470 PolarHBondContact NZ-OE1 3.36Å; K463-E470 IonicContact NZ-OE2 3.91Å; K463-E470 PolarHBondContact NZ-OE2 3.08Å; K463-I517 HydrophobicContact CB-CG1 4.38Å; K463-I517 HydrophobicContact CB-CG2 4.12Å
464	L	86.9	Confident	92.1	Very high	103 Å²	103	53.1 Å²	53.1	54%	0.539	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-25.7	-169.3	-63.9	174.8	0	0	0	114.5	G460 L461 L887 Y890	G460-L464 PolarHBondContact O-N 2.87Å; L461-L464 HydrophobicContact CD2-CD2 4.28Å; L464-L887 HydrophobicContact CD2-CD2 4.1Å; L464-Y890 HydrophobicContact CD2-CD2 3.94Å; L464-Y890 HydrophobicContact CD2-CE2 4.38Å; L464-Y890 HydrophobicContact CD2-CG 4.34Å
465	N	88.9	Confident	92.2	Very high	147 Å²	147	52.4 Å²	52.4	79%	0.786	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.8	24.7	178.1	-60.5	-16.4	0	0	0	112.7	K463	K463-N465 PolarHBondContact O-N 3.43Å
466	A	89.6	Confident	92.2	Very high	24 Å²	24	57 Å²	57	20%	0.198	29%	0.29	C	S	.	.			trans	-66.7	140.2	179.8	0	0	0	0	0	111.9	K463 E470 I471 I517	K463-A466 HydrophobicContact CB-CB 4.23Å; K463-A466 HydrophobicContact CD-CB 4.42Å; K463-A466 HydrophobicContact CG-CB 4.39Å; K463-A466 WeakPolarHBondContact O-CB 3.36Å; K463-A466 PolarHBondContact O-N 2.88Å; A466-E470 WeakPolarHBondContact CA-OE2 3.37Å; A466-E470 HydrophobicContact CB-CB 4.45Å; A466-I471 HydrophobicContact CB-CG1 4.16Å; A466-I517 HydrophobicContact CB-CD1 3.48Å; A466-I517 VanDerWaalsContact CB-CD1 3.48Å; A466-I517 HydrophobicContact CB-CG1 4.27Å
467	T	93.6	Very high	91.9	Very high	72 Å²	72	58.1 Å²	58.1	44%	0.442	30%	0.296	S	S	.	.			trans	-78.9	157.5	169.9	62.5	0	0	0	0	110.3	E469 E470 I471	T467-E469 PolarHBondContact O-N 3.22Å; T467-E470 PolarHBondContact O-N 2.94Å; T467-E470 VanDerWaalsContact O-N 3.07Å; T467-E470 WeakPolarHBondContact OG1-CG 3.5Å; T467-E470 PolarHBondContact OG1-N 3.48Å; T467-I471 PolarHBondContact O-N 2.91Å; T467-I471 VanDerWaalsContact O-N 3.08Å
468	D	91.2	Very high	91.8	Very high	89 Å²	89	53 Å²	53	48%	0.476	27%	0.272	S	S	.	.	H	α-helix	trans	-57.7	-31.8	175.2	-77.6	-36.6	0	0	0	112.1	R456 I471 H472	R456-D468 WeakPolarHBondContact CD-OD1 3.43Å; R456-D468 IonicContact NE-OD1 3.66Å; R456-D468 PolarHBondContact NE-OD1 2.89Å; D468-I471 PolarHBondContact O-N 3.05Å; D468-H472 PolarHBondContact O-CD2 2.79Å; D468-H472 VanDerWaalsContact O-CG 3.29Å; D468-H472 PolarHBondContact O-N 2.79Å
469	E	93.7	Very high	91.7	Very high	158 Å²	158	54.8 Å²	54.8	74%	0.738	28%	0.282	S	S	*	.	H	α-helix	trans	-63.5	-45.2	174.5	-65.6	-179.6	173.9	0	0	112.1	T467 I471 H472 E473	T467-E469 PolarHBondContact O-N 3.22Å; E469-I471 VanDerWaalsContact C-N 3.31Å; E469-I471 PolarHBondContact O-N 3.27Å; E469-H472 PolarHBondContact O-N 3.49Å; E469-E473 WeakPolarHBondContact O-CB 3.45Å; E469-E473 PolarHBondContact O-N 2.98Å
470	E	93.4	Very high	91.6	Very high	52 Å²	52	54.8 Å²	54.8	24%	0.243	28%	0.282	C	S	.	.	H	α-helix	trans	-63.5	-37.9	176	-72.7	-179	163.6	0	0	111.6	K463 A466 T467 E473 A474 I517	K463-E470 WeakPolarHBondContact CD-OE2 3.46Å; K463-E470 WeakPolarHBondContact CE-OE2 3.47Å; K463-E470 IonicContact NZ-OE1 3.05Å; K463-E470 PolarHBondContact NZ-OE1 3.36Å; K463-E470 IonicContact NZ-OE2 3.91Å; K463-E470 PolarHBondContact NZ-OE2 3.08Å; A466-E470 WeakPolarHBondContact CA-OE2 3.37Å; A466-E470 HydrophobicContact CB-CB 4.45Å; T467-E470 PolarHBondContact O-N 2.94Å; T467-E470 VanDerWaalsContact O-N 3.07Å; T467-E470 WeakPolarHBondContact OG1-CG 3.5Å; T467-E470 PolarHBondContact OG1-N 3.48Å; E470-E473 PolarHBondContact O-N 3.08Å; E470-A474 VanDerWaalsContact O-CB 3.31Å; E470-A474 WeakPolarHBondContact O-CB 3.36Å; E470-A474 PolarHBondContact O-N 2.6Å; E470-I517 HydrophobicContact CB-CD1 4.34Å; E470-I517 HydrophobicContact CB-CG1 4.34Å
471	I	94.1	Very high	91.5	Very high	8 Å²	8	56.8 Å²	56.8	4%	0.041	29%	0.288	C	S	.	.	H	α-helix	trans	-64.2	-44.6	176	-67.2	173.5	0	0	0	110.6	R456 I459 A466 T467 D468 E469 A475 Y491 I517	R456-I471 HydrophobicContact CG-CD1 3.7Å; I459-I471 HydrophobicContact CB-CG2 4.05Å; I459-I471 HydrophobicContact CD1-CG2 4.1Å; I459-I471 HydrophobicContact CG2-CB 4.39Å; I459-I471 HydrophobicContact CG2-CG1 4.32Å; I459-I471 HydrophobicContact CG2-CG2 3.93Å; A466-I471 HydrophobicContact CB-CG1 4.16Å; T467-I471 PolarHBondContact O-N 2.91Å; T467-I471 VanDerWaalsContact O-N 3.08Å; D468-I471 PolarHBondContact O-N 3.05Å; E469-I471 VanDerWaalsContact C-N 3.31Å; E469-I471 PolarHBondContact O-N 3.27Å; I471-A475 VanDerWaalsContact O-CB 3.29Å; I471-A475 WeakPolarHBondContact O-CB 3.46Å; I471-A475 PolarHBondContact O-N 2.94Å; I471-Y491 HydrophobicContact CG2-CD1 4.23Å; I471-Y491 HydrophobicContact CG2-CE1 4.04Å; I471-I517 HydrophobicContact CG1-CD1 3.74Å
472	H	94	Very high	91.4	Very high	69 Å²	69	63.2 Å²	63.2	32%	0.319	32%	0.318	S	S	.	.	H	α-helix	trans	-64.6	-45.7	176.4	-70.9	177.1	0	0	0	111.7	D468 E469 A474 A475 I476 Y491	D468-H472 PolarHBondContact O-CD2 2.79Å; D468-H472 VanDerWaalsContact O-CG 3.29Å; D468-H472 PolarHBondContact O-N 2.79Å; E469-H472 PolarHBondContact O-N 3.49Å; H472-A474 PolarHBondContact O-N 2.98Å; H472-A475 PolarHBondContact O-N 3.02Å; H472-I476 VanDerWaalsContact O-CG1 3.26Å; H472-I476 WeakPolarHBondContact O-CG1 3.39Å; H472-I476 PolarHBondContact O-N 3.14Å; H472-Y491 AromaticContact CD2-CE1 3.9Å; H472-Y491 AromaticContact CD2-CE2 3.63Å; H472-Y491 AromaticContact CD2-CZ 3.46Å; H472-Y491 VanDerWaalsContact CD2-CZ 3.46Å; H472-Y491 AromaticContact NE2-CD2 3.8Å; H472-Y491 AromaticContact NE2-CE2 3.62Å; H472-Y491 AromaticContact NE2-CZ 3.94Å
473	E	92.8	Very high	91.4	Very high	84 Å²	84	63.7 Å²	63.7	39%	0.393	32%	0.318	S	S	.	.	H	α-helix	trans	-59.5	-46.4	178.1	-167	-164.6	154.5	0	0	111.3	E469 E470 A475 I476 K477	E469-E473 WeakPolarHBondContact O-CB 3.45Å; E469-E473 PolarHBondContact O-N 2.98Å; E470-E473 PolarHBondContact O-N 3.08Å; E473-A475 PolarHBondContact O-N 3.34Å; E473-I476 PolarHBondContact O-N 2.89Å; E473-K477 HydrophobicContact CG-CD 4.49Å; E473-K477 WeakPolarHBondContact O-CG 3.47Å; E473-K477 PolarHBondContact O-N 3.29Å; E473-K477 WeakPolarHBondContact OE1-CE 3.41Å; E473-K477 IonicContact OE1-NZ 2.99Å; E473-K477 PolarHBondContact OE1-NZ 3.45Å
474	A	92.4	Very high	91.5	Very high	4 Å²	4	59.9 Å²	59.9	3%	0.033	30%	0.302	C	S	.	.	H	α-helix	trans	-62.6	-41.9	176.9	0	0	0	0	0	111.8	E470 H472 K477 A478 I517	E470-A474 VanDerWaalsContact O-CB 3.31Å; E470-A474 WeakPolarHBondContact O-CB 3.36Å; E470-A474 PolarHBondContact O-N 2.6Å; H472-A474 PolarHBondContact O-N 2.98Å; A474-K477 PolarHBondContact O-N 3.29Å; A474-A478 WeakPolarHBondContact O-CB 3.42Å; A474-A478 PolarHBondContact O-N 2.89Å; A474-I517 HydrophobicContact CB-CB 3.97Å; A474-I517 HydrophobicContact CB-CG1 4.3Å
475	A	93.3	Very high	91.7	Very high	0 Å²	0	60.4 Å²	60.4	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-66.8	-33.7	176.6	0	0	0	0	0	113	I459 I471 H472 E473 N479 A480 H481 I484 Y491	I459-A475 HydrophobicContact CD1-CB 4.22Å; I471-A475 VanDerWaalsContact O-CB 3.29Å; I471-A475 WeakPolarHBondContact O-CB 3.46Å; I471-A475 PolarHBondContact O-N 2.94Å; H472-A475 PolarHBondContact O-N 3.02Å; E473-A475 PolarHBondContact O-N 3.34Å; A475-N479 PolarHBondContact O-N 3.2Å; A475-A480 HydrophobicContact CB-CB 4.36Å; A475-A480 WeakPolarHBondContact O-CA 3.44Å; A475-A480 WeakPolarHBondContact O-CB 3.49Å; A475-A480 PolarHBondContact O-N 2.9Å; A475-H481 HydrophobicContact CB-CB 4.4Å; A475-H481 PolarHBondContact O-N 3.22Å; A475-H481 VanDerWaalsContact O-N 3.12Å; A475-I484 HydrophobicContact CB-CD1 4.43Å; A475-Y491 HydrophobicContact CB-CE1 4.12Å; A475-Y491 WeakPolarHBondContact CB-OH 3.47Å
476	I	92.6	Very high	91.8	Very high	96 Å²	96	63.1 Å²	63.1	49%	0.492	30%	0.302	S	S	.	.	H	α-helix	trans	-68.5	-47.6	174.7	-69.7	165.4	0	0	0	109.8	H472 E473 A478 N479 H481	H472-I476 VanDerWaalsContact O-CG1 3.26Å; H472-I476 WeakPolarHBondContact O-CG1 3.39Å; H472-I476 PolarHBondContact O-N 3.14Å; E473-I476 PolarHBondContact O-N 2.89Å; I476-A478 PolarHBondContact O-N 3.04Å; I476-N479 PolarHBondContact O-N 2.87Å; I476-H481 HydrophobicContact CG1-CB 3.68Å
477	K	89.1	Confident	91.7	Very high	96 Å²	96	63.6 Å²	63.6	42%	0.417	30%	0.301	S	S	.	.	H	α-helix	trans	-58.4	-37.7	176.8	-74.8	174.5	170.4	171	0	112.2	E473 A474 N479 L516	E473-K477 HydrophobicContact CG-CD 4.49Å; E473-K477 WeakPolarHBondContact O-CG 3.47Å; E473-K477 PolarHBondContact O-N 3.29Å; E473-K477 WeakPolarHBondContact OE1-CE 3.41Å; E473-K477 IonicContact OE1-NZ 2.99Å; E473-K477 PolarHBondContact OE1-NZ 3.45Å; A474-K477 PolarHBondContact O-N 3.29Å; K477-N479 PolarHBondContact O-N 3.49Å; K477-L516 HydrophobicContact CB-CD1 3.89Å
478	A	89.3	Confident	91.2	Very high	0 Å²	0	66.3 Å²	66.3	0%	0	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.6	6.8	176.2	0	0	0	0	0	114.9	A474 I476 A480 R509 I512 A513 L516	A474-A478 WeakPolarHBondContact O-CB 3.42Å; A474-A478 PolarHBondContact O-N 2.89Å; I476-A478 PolarHBondContact O-N 3.04Å; A478-A480 HydrophobicContact CB-CB 4.4Å; A478-A480 PolarHBondContact O-N 3.46Å; A478-A480 VanDerWaalsContact O-N 3.12Å; A478-R509 WeakPolarHBondContact CB-O 3.26Å; A478-R509 WeakPolarHBondContact O-CG 3.29Å; A478-I512 HydrophobicContact CB-CB 4.21Å; A478-I512 HydrophobicContact CB-CG2 3.88Å; A478-A513 HydrophobicContact CB-CB 3.76Å; A478-L516 HydrophobicContact CB-CD1 4.35Å
479	N	90.5	Very high	91	Very high	40 Å²	40	65.8 Å²	65.8	21%	0.214	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	52.4	30.3	-172.8	-62.2	-30.4	0	0	0	113.4	A475 I476 K477 R509 I539 A543 K546	A475-N479 PolarHBondContact O-N 3.2Å; I476-N479 PolarHBondContact O-N 2.87Å; K477-N479 PolarHBondContact O-N 3.49Å; N479-R509 WeakPolarHBondContact O-CD 3.47Å; N479-R509 PolarHBondContact O-NH1 3.39Å; N479-I539 HydrophobicContact CB-CG2 3.96Å; N479-I539 PolarHBondContact ND2-O 2.7Å; N479-I539 VanDerWaalsContact ND2-O 3.08Å; N479-A543 HydrophobicContact CB-CB 4.35Å; N479-A543 PolarHBondContact ND2-N 2.97Å; N479-K546 PolarHBondContact OD1-NZ 3.5Å
480	A	91.6	Very high	90.8	Very high	0 Å²	0	58.9 Å²	58.9	0%	0	29%	0.286	C	S	.	.			trans	-96.5	-31.2	-177.1	0	0	0	0	0	113.3	A475 A478 Q482 F483 I484 R509	A475-A480 HydrophobicContact CB-CB 4.36Å; A475-A480 WeakPolarHBondContact O-CA 3.44Å; A475-A480 WeakPolarHBondContact O-CB 3.49Å; A475-A480 PolarHBondContact O-N 2.9Å; A478-A480 HydrophobicContact CB-CB 4.4Å; A478-A480 PolarHBondContact O-N 3.46Å; A478-A480 VanDerWaalsContact O-N 3.12Å; A480-Q482 VanDerWaalsContact C-N 3.33Å; A480-Q482 PolarHBondContact O-N 3.22Å; A480-F483 VanDerWaalsContact CA-CE1 3.46Å; A480-F483 HydrophobicContact CB-CD1 4.34Å; A480-F483 HydrophobicContact CB-CE1 3.66Å; A480-F483 HydrophobicContact CB-CZ 4.4Å; A480-F483 WeakPolarHBondContact O-CD1 3.44Å; A480-F483 WeakPolarHBondContact O-CE1 3.32Å; A480-F483 PolarHBondContact O-N 3.24Å; A480-I484 HydrophobicContact CB-CD1 3.83Å; A480-I484 VanDerWaalsContact O-CG1 3.29Å; A480-I484 WeakPolarHBondContact O-CG1 3.35Å; A480-I484 PolarHBondContact O-N 3.42Å; A480-I484 VanDerWaalsContact O-N 3.11Å; A480-R509 HydrophobicContact CB-CB 4.05Å
481	H	92.8	Very high	90.8	Very high	57 Å²	57	56.9 Å²	56.9	26%	0.264	28%	0.276	S	S	.	.	H	α-helix	trans	-52.2	-46.6	-173.4	-177.8	73.8	0	0	0	113.6	A475 I476 F483 I484 M485 Y491	A475-H481 HydrophobicContact CB-CB 4.4Å; A475-H481 PolarHBondContact O-N 3.22Å; A475-H481 VanDerWaalsContact O-N 3.12Å; I476-H481 HydrophobicContact CG1-CB 3.68Å; H481-F483 PolarHBondContact O-N 2.93Å; H481-I484 PolarHBondContact O-N 2.88Å; H481-M485 WeakPolarHBondContact O-CG 2.99Å; H481-M485 PolarHBondContact O-N 3.46Å; H481-Y491 AromaticContact ND1-CE2 3.72Å; H481-Y491 AromaticContact ND1-CZ 3.72Å; H481-Y491 PolarHBondContact ND1-OH 3Å
482	Q	90	Very high	90.7	Very high	145 Å²	145	60 Å²	60	68%	0.678	29%	0.293	S	S	*	.	H	α-helix	trans	-62.1	-38.7	-176.1	-68.1	-177.7	-4	0	0	113.6	A480 R486	A480-Q482 VanDerWaalsContact C-N 3.33Å; A480-Q482 PolarHBondContact O-N 3.22Å; Q482-R486 WeakPolarHBondContact O-CG 3.34Å
483	F	89.4	Confident	90.5	Very high	14 Å²	14	57.2 Å²	57.2	6%	0.061	28%	0.281	C	S	.	.	H	α-helix	trans	-81.5	-33.5	179.3	86.3	-99.9	0	0	0	111.4	A480 H481 M485 R486 L487 L502 Q506 R509 I510	A480-F483 VanDerWaalsContact CA-CE1 3.46Å; A480-F483 HydrophobicContact CB-CD1 4.34Å; A480-F483 HydrophobicContact CB-CE1 3.66Å; A480-F483 HydrophobicContact CB-CZ 4.4Å; A480-F483 WeakPolarHBondContact O-CD1 3.44Å; A480-F483 WeakPolarHBondContact O-CE1 3.32Å; A480-F483 PolarHBondContact O-N 3.24Å; H481-F483 PolarHBondContact O-N 2.93Å; F483-M485 VanDerWaalsContact C-N 3.28Å; F483-M485 PolarHBondContact O-N 3.15Å; F483-R486 WeakPolarHBondContact O-CB 3.49Å; F483-R486 PolarHBondContact O-N 2.81Å; F483-L487 PolarHBondContact O-N 3.48Å; F483-L502 HydrophobicContact CE2-CD2 4.48Å; F483-Q506 HydrophobicContact CD1-CG 4.33Å; F483-Q506 HydrophobicContact CD2-CB 4.28Å; F483-Q506 HydrophobicContact CD2-CG 3.75Å; F483-Q506 HydrophobicContact CE1-CB 4.29Å; F483-Q506 HydrophobicContact CE1-CG 4.24Å; F483-Q506 HydrophobicContact CE2-CB 3.69Å; F483-Q506 HydrophobicContact CE2-CG 3.7Å; F483-Q506 HydrophobicContact CG-CG 4.09Å; F483-Q506 HydrophobicContact CZ-CB 3.69Å; F483-Q506 HydrophobicContact CZ-CG 3.95Å; F483-R509 VanDerWaalsContact CD1-CZ 3.47Å; F483-R509 HydrophobicContact CE1-CB 4.15Å; F483-I510 HydrophobicContact CE2-CD1 4.41Å; F483-I510 HydrophobicContact CZ-CD1 3.99Å; F483-I510 HydrophobicContact CZ-CG1 3.93Å
484	I	92	Very high	90.3	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-59.1	-44.4	175.7	-67.3	166.3	0	0	0	109.4	I455 I459 A475 A480 H481 R486 L487 G490 Y491	I455-I484 HydrophobicContact CD1-CG1 4.38Å; I455-I484 HydrophobicContact CD1-CG2 4.4Å; I455-I484 HydrophobicContact CG2-CD1 3.85Å; I455-I484 HydrophobicContact CG2-CG1 4.26Å; I455-I484 HydrophobicContact CG2-CG2 4.47Å; I459-I484 HydrophobicContact CD1-CD1 4.48Å; A475-I484 HydrophobicContact CB-CD1 4.43Å; A480-I484 HydrophobicContact CB-CD1 3.83Å; A480-I484 VanDerWaalsContact O-CG1 3.29Å; A480-I484 WeakPolarHBondContact O-CG1 3.35Å; A480-I484 PolarHBondContact O-N 3.42Å; A480-I484 VanDerWaalsContact O-N 3.11Å; H481-I484 PolarHBondContact O-N 2.88Å; I484-R486 PolarHBondContact O-N 3.35Å; I484-L487 VanDerWaalsContact O-CB 3.31Å; I484-L487 WeakPolarHBondContact O-CB 3.36Å; I484-L487 PolarHBondContact O-N 2.91Å; I484-G490 WeakPolarHBondContact O-CA 3.3Å; I484-Y491 HydrophobicContact CD1-CE1 4.05Å; I484-Y491 HydrophobicContact CG2-CD1 4.01Å; I484-Y491 HydrophobicContact CG2-CD2 3.76Å; I484-Y491 HydrophobicContact CG2-CE1 4.17Å; I484-Y491 HydrophobicContact CG2-CE2 3.91Å; I484-Y491 HydrophobicContact CG2-CG 3.81Å
485	M	91.7	Very high	90	Very high	113 Å²	113	55.8 Å²	55.8	56%	0.557	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	-17.4	177.3	-68.2	-59.1	-67.5	0	0	114.4	H481 F483 Y491	H481-M485 WeakPolarHBondContact O-CG 2.99Å; H481-M485 PolarHBondContact O-N 3.46Å; F483-M485 VanDerWaalsContact C-N 3.28Å; F483-M485 PolarHBondContact O-N 3.15Å; M485-Y491 HydrophobicContact SD-CD2 4.34Å; M485-Y491 HydrophobicContact SD-CE2 4.17Å
486	R	89.9	Confident	89.2	Confident	204 Å²	204	57.2 Å²	57.2	77%	0.77	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.2	-12.3	173.2	-66.7	174.3	-171.3	179.3	2.2	112.8	Q482 F483 I484	Q482-R486 WeakPolarHBondContact O-CG 3.34Å; F483-R486 WeakPolarHBondContact O-CB 3.49Å; F483-R486 PolarHBondContact O-N 2.81Å; I484-R486 PolarHBondContact O-N 3.35Å
487	L	88.4	Confident	88	Confident	34 Å²	34	59.7 Å²	59.7	18%	0.178	30%	0.3	C	S	.	.	S	Bend	trans	-74.2	149.6	176.8	-63.1	171.8	0	0	0	110.5	I455 F483 I484 Q489 G490 T493 L502	I455-L487 HydrophobicContact CD1-CD1 3.46Å; I455-L487 VanDerWaalsContact CD1-CD1 3.46Å; F483-L487 PolarHBondContact O-N 3.48Å; I484-L487 VanDerWaalsContact O-CB 3.31Å; I484-L487 WeakPolarHBondContact O-CB 3.36Å; I484-L487 PolarHBondContact O-N 2.91Å; L487-Q489 PolarHBondContact O-N 3.34Å; L487-G490 PolarHBondContact O-N 3.35Å; L487-G490 VanDerWaalsContact O-N 3.07Å; L487-T493 HydrophobicContact CB-CG2 4.49Å; L487-T493 WeakPolarHBondContact CB-OG1 3.49Å; L487-T493 HydrophobicContact CD1-CG2 4.22Å; L487-L502 HydrophobicContact CD1-CD2 4Å; L487-L502 HydrophobicContact CD2-CD2 4.15Å
488	P	82.4	Confident	86.4	Confident	130 Å²	130	62.4 Å²	62.4	84%	0.844	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	-27.7	-174.4	-26.7	34.2	0	0	0	115.4
489	Q	87.2	Confident	85	Confident	77 Å²	77	63.5 Å²	63.5	36%	0.36	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-120.4	13.9	-178.8	-65.8	-179	-22.3	0	0	112.6	L487 Y491 D492	L487-Q489 PolarHBondContact O-N 3.34Å; Q489-Y491 PolarHBondContact O-N 3.08Å; Q489-D492 HydrophobicContact CB-CB 4.44Å; Q489-D492 WeakPolarHBondContact O-CB 3.16Å; Q489-D492 PolarHBondContact O-N 2.82Å
490	G	90.4	Very high	83.6	Confident	14 Å²	14	64 Å²	64	14%	0.144	33%	0.329	C	S	.	.	G	3₁₀ helix	trans	54.5	-129.4	-178.6	0	0	0	0	0	112.5	I484 L487 D492 T493	I484-G490 WeakPolarHBondContact O-CA 3.3Å; L487-G490 PolarHBondContact O-N 3.35Å; L487-G490 VanDerWaalsContact O-N 3.07Å; G490-D492 VanDerWaalsContact C-N 3.27Å; G490-D492 PolarHBondContact O-N 2.66Å; G490-T493 PolarHBondContact N-OG1 2.78Å; G490-T493 WeakPolarHBondContact O-CB 3.29Å; G490-T493 PolarHBondContact O-N 3.12Å; G490-T493 PolarHBondContact O-OG1 2.97Å
491	Y	93	Very high	82.6	Confident	10 Å²	10	71.9 Å²	71.9	4%	0.039	37%	0.371	C	S	.	.	G	3₁₀ helix	trans	-67.8	-20.9	177.3	-77.6	-91.2	0	0	0	114.6	I455 R456 I459 I471 H472 A475 H481 I484 M485 Q489 T493	I455-Y491 HydrophobicContact CG2-CD1 4.39Å; I455-Y491 PolarHBondContact N-O 3.34Å; R456-Y491 PolarHBondContact N-O 3.18Å; I459-Y491 HydrophobicContact CD1-CE1 4.19Å; I471-Y491 HydrophobicContact CG2-CD1 4.23Å; I471-Y491 HydrophobicContact CG2-CE1 4.04Å; H472-Y491 AromaticContact CD2-CE1 3.9Å; H472-Y491 AromaticContact CD2-CE2 3.63Å; H472-Y491 AromaticContact CD2-CZ 3.46Å; H472-Y491 VanDerWaalsContact CD2-CZ 3.46Å; H472-Y491 AromaticContact NE2-CD2 3.8Å; H472-Y491 AromaticContact NE2-CE2 3.62Å; H472-Y491 AromaticContact NE2-CZ 3.94Å; A475-Y491 HydrophobicContact CB-CE1 4.12Å; A475-Y491 WeakPolarHBondContact CB-OH 3.47Å; H481-Y491 AromaticContact ND1-CE2 3.72Å; H481-Y491 AromaticContact ND1-CZ 3.72Å; H481-Y491 PolarHBondContact ND1-OH 3Å; I484-Y491 HydrophobicContact CD1-CE1 4.05Å; I484-Y491 HydrophobicContact CG2-CD1 4.01Å; I484-Y491 HydrophobicContact CG2-CD2 3.76Å; I484-Y491 HydrophobicContact CG2-CE1 4.17Å; I484-Y491 HydrophobicContact CG2-CE2 3.91Å; I484-Y491 HydrophobicContact CG2-CG 3.81Å; M485-Y491 HydrophobicContact SD-CD2 4.34Å; M485-Y491 HydrophobicContact SD-CE2 4.17Å; Q489-Y491 PolarHBondContact O-N 3.08Å; Y491-T493 PolarHBondContact O-N 3.45Å
492	D	92	Very high	82.1	Confident	73 Å²	73	69.7 Å²	69.7	39%	0.39	36%	0.361	S	S	.	.	G	3₁₀ helix	trans	-84.1	-0.1	178	-70.3	-62.8	0	0	0	112.9	R456 Q489 G490 L494	R456-D492 IonicContact CZ-OD1 3.24Å; R456-D492 IonicContact CZ-OD2 2.64Å; R456-D492 IonicContact NH1-OD1 3.38Å; R456-D492 PolarHBondContact NH1-OD1 3.49Å; R456-D492 IonicContact NH1-OD2 2.91Å; R456-D492 IonicContact NH2-OD1 3.38Å; R456-D492 PolarHBondContact NH2-OD1 2.93Å; R456-D492 IonicContact NH2-OD2 3.71Å; R456-D492 PolarHBondContact NH2-OD2 3.3Å; Q489-D492 HydrophobicContact CB-CB 4.44Å; Q489-D492 WeakPolarHBondContact O-CB 3.16Å; Q489-D492 PolarHBondContact O-N 2.82Å; G490-D492 VanDerWaalsContact C-N 3.27Å; G490-D492 PolarHBondContact O-N 2.66Å; D492-L494 PolarHBondContact O-N 3.39Å
493	T	89.9	Confident	81.8	Confident	10 Å²	10	65.1 Å²	65.1	6%	0.061	35%	0.346	C	S	.	.			trans	-59.1	126.4	174.1	-53.6	0	0	0	0	110	T454 I455 L487 G490 Y491	T454-T493 WeakPolarHBondContact CA-O 3.38Å; I455-T493 PolarHBondContact N-O 2.88Å; L487-T493 HydrophobicContact CB-CG2 4.49Å; L487-T493 WeakPolarHBondContact CB-OG1 3.49Å; L487-T493 HydrophobicContact CD1-CG2 4.22Å; G490-T493 PolarHBondContact N-OG1 2.78Å; G490-T493 WeakPolarHBondContact O-CB 3.29Å; G490-T493 PolarHBondContact O-N 3.12Å; G490-T493 PolarHBondContact O-OG1 2.97Å; Y491-T493 PolarHBondContact O-N 3.45Å
494	L	88	Confident	81.5	Confident	56 Å²	56	66.4 Å²	66.4	29%	0.293	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	132.5	176.5	-67	168.2	0	0	0	110.9	G453 T454 D492 G499 S500 S649	G453-L494 CarbonylContact O-C 3.36Å; G453-L494 WeakPolarHBondContact O-CA 3.28Å; T454-L494 HydrophobicContact CG2-CD2 3.99Å; D492-L494 PolarHBondContact O-N 3.39Å; L494-G499 CarbonylContact O-C 3.58Å; L494-G499 WeakPolarHBondContact O-CA 3.33Å; L494-S500 PolarHBondContact O-N 2.88Å; L494-S649 VanDerWaalsContact CD1-CB 3.43Å
495	V	87.1	Confident	81.1	Confident	3 Å²	3	66.4 Å²	66.4	2%	0.018	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	165.8	176.3	-65.1	0	0	0	0	109.9	L450 D452 G453 I455 N458 L502	L450-V495 HydrophobicContact CB-CG2 4.44Å; L450-V495 HydrophobicContact CD1-CB 4.24Å; L450-V495 HydrophobicContact CD1-CG2 4.32Å; D452-V495 WeakPolarHBondContact CA-O 3.46Å; G453-V495 PolarHBondContact N-O 3.03Å; G453-V495 PolarHBondContact O-N 3.47Å; I455-V495 HydrophobicContact CD1-CG1 4.14Å; I455-V495 HydrophobicContact CG1-CG1 3.58Å; I455-V495 HydrophobicContact CG1-CG2 4.31Å; N458-V495 VanDerWaalsContact ND2-CG2 3.29Å; N458-V495 WeakPolarHBondContact ND2-CG2 3.14Å; V495-L502 HydrophobicContact CG1-CD1 3.57Å; V495-L502 HydrophobicContact CG1-CG 4.24Å
496	G	76.2	Confident	81	Confident	30 Å²	30	63.2 Å²	63.2	31%	0.309	35%	0.346	S	S	.	.	S	Bend	trans	110.4	-158.5	-174.3	0	0	0	0	0	112.5	D452 K498 G499	D452-G496 WeakPolarHBondContact OD1-CA 3.5Å; G496-K498 PolarHBondContact O-N 3.38Å; G496-G499 PolarHBondContact O-N 2.83Å
497	E	66.7	Low	81	Confident	148 Å²	148	57.3 Å²	57.3	69%	0.692	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-29.8	174	-76.9	-169.1	169.5	0	0	111.4	D452 K873	D452-E497 PolarHBondContact OD1-N 3.23Å; E497-K873 IonicContact OE1-NZ 3.14Å; E497-K873 PolarHBondContact OE1-NZ 2.93Å; E497-K873 IonicContact OE2-NZ 3.37Å
498	K	56.9	Low	80.9	Confident	153 Å²	153	55.7 Å²	55.7	67%	0.665	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.8	-7.8	-178.7	-63.8	-175.4	-174.4	94.5	0	114.8	D452 G496	D452-K498 PolarHBondContact OD1-N 3.29Å; D452-K498 IonicContact OD2-NZ 2.9Å; D452-K498 PolarHBondContact OD2-NZ 2.88Å; G496-K498 PolarHBondContact O-N 3.38Å
499	G	59.4	Low	81.3	Confident	22 Å²	22	50.7 Å²	50.7	23%	0.227	28%	0.282	C	S	.	.	S	Bend	trans	-103.6	-174.6	-165.4	0	0	0	0	0	116	L494 G496	L494-G499 CarbonylContact O-C 3.58Å; L494-G499 WeakPolarHBondContact O-CA 3.33Å; G496-G499 PolarHBondContact O-N 2.83Å
500	S	60.5	Low	81.6	Confident	52 Å²	52	47 Å²	47	36%	0.364	27%	0.265	S	S	.	.			trans	-68.1	142.6	175.8	59.7	0	0	0	0	112.2	L494 L502	L494-S500 PolarHBondContact O-N 2.88Å; S500-L502 PolarHBondContact O-N 2.72Å
501	N	70.5	Confident	81.6	Confident	164 Å²	164	46.7 Å²	46.7	88%	0.877	26%	0.26	S	S	*	.			trans	-70.7	94.6	173.1	-71.7	-22	0	0	0	110.7
502	L	83.1	Confident	81.4	Confident	12 Å²	12	46.3 Å²	46.3	6%	0.063	26%	0.259	C	S	.	.			trans	-75.2	149.6	168.4	-63.6	179.2	0	0	0	111	L450 I455 F483 L487 V495 S500 Q506 K507 I510	L450-L502 HydrophobicContact CD1-CD1 4.1Å; I455-L502 HydrophobicContact CD1-CD1 4.5Å; F483-L502 HydrophobicContact CE2-CD2 4.48Å; L487-L502 HydrophobicContact CD1-CD2 4Å; L487-L502 HydrophobicContact CD2-CD2 4.15Å; V495-L502 HydrophobicContact CG1-CD1 3.57Å; V495-L502 HydrophobicContact CG1-CG 4.24Å; S500-L502 PolarHBondContact O-N 2.72Å; L502-Q506 HydrophobicContact CB-CB 4.18Å; L502-K507 HydrophobicContact CB-CG 3.83Å; L502-K507 WeakPolarHBondContact O-CE 3.17Å; L502-I510 HydrophobicContact CD1-CD1 3.48Å; L502-I510 VanDerWaalsContact CD1-CD1 3.48Å
503	S	83.1	Confident	81.5	Confident	49 Å²	49	42.8 Å²	42.8	34%	0.343	24%	0.24	S	C	.	.			trans	-67.4	158.7	174.5	80.7	0	0	0	0	111.7	G505 Q506 K507	S503-G505 VanDerWaalsContact C-N 3.3Å; S503-G505 PolarHBondContact O-N 2.92Å; S503-Q506 WeakPolarHBondContact O-CB 3.29Å; S503-Q506 PolarHBondContact O-N 3.19Å; S503-Q506 VanDerWaalsContact O-N 3.09Å; S503-Q506 VanDerWaalsContact OG-CG 3.28Å; S503-Q506 WeakPolarHBondContact OG-CG 3.44Å; S503-Q506 PolarHBondContact OG-N 3.49Å; S503-K507 WeakPolarHBondContact O-CG 3.45Å; S503-K507 PolarHBondContact O-N 3.24Å
504	G	82.2	Confident	81.6	Confident	40 Å²	40	42.9 Å²	42.9	41%	0.412	24%	0.239	S	C	.	.	H	α-helix	trans	-52.5	-47.1	176.7	0	0	0	0	0	112.5	Q506 K507 Q508	G504-Q506 PolarHBondContact O-N 2.91Å; G504-K507 PolarHBondContact O-N 3.09Å; G504-Q508 PolarHBondContact O-N 2.72Å
505	G	84.7	Confident	81.7	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-66.1	-32	176.7	0	0	0	0	0	114.8	S503 R509 L532	S503-G505 VanDerWaalsContact C-N 3.3Å; S503-G505 PolarHBondContact O-N 2.92Å; G505-R509 WeakPolarHBondContact O-CG 3.48Å; G505-R509 PolarHBondContact O-N 3.33Å; G505-R509 VanDerWaalsContact O-N 3.13Å; G505-R509 PolarHBondContact O-NE 3.01Å; G505-L532 VanDerWaalsContact N-CD2 3.31Å
506	Q	88.8	Confident	81.8	Confident	47 Å²	47	41.2 Å²	41.2	22%	0.22	23%	0.231	C	C	.	.	H	α-helix	trans	-69.5	-43.8	173.2	-74	170.8	-12.3	0	0	111.5	F483 L502 S503 G504 Q508 R509 I510	F483-Q506 HydrophobicContact CD1-CG 4.33Å; F483-Q506 HydrophobicContact CD2-CB 4.28Å; F483-Q506 HydrophobicContact CD2-CG 3.75Å; F483-Q506 HydrophobicContact CE1-CB 4.29Å; F483-Q506 HydrophobicContact CE1-CG 4.24Å; F483-Q506 HydrophobicContact CE2-CB 3.69Å; F483-Q506 HydrophobicContact CE2-CG 3.7Å; F483-Q506 HydrophobicContact CG-CG 4.09Å; F483-Q506 HydrophobicContact CZ-CB 3.69Å; F483-Q506 HydrophobicContact CZ-CG 3.95Å; L502-Q506 HydrophobicContact CB-CB 4.18Å; S503-Q506 WeakPolarHBondContact O-CB 3.29Å; S503-Q506 PolarHBondContact O-N 3.19Å; S503-Q506 VanDerWaalsContact O-N 3.09Å; S503-Q506 VanDerWaalsContact OG-CG 3.28Å; S503-Q506 WeakPolarHBondContact OG-CG 3.44Å; S503-Q506 PolarHBondContact OG-N 3.49Å; G504-Q506 PolarHBondContact O-N 2.91Å; Q506-Q508 VanDerWaalsContact C-N 3.3Å; Q506-Q508 PolarHBondContact O-N 3.28Å; Q506-R509 PolarHBondContact O-N 3.26Å; Q506-I510 WeakPolarHBondContact O-CG1 3.39Å; Q506-I510 PolarHBondContact O-N 3.27Å; Q506-I510 VanDerWaalsContact O-N 3.14Å
507	K	89.5	Confident	82.5	Confident	79 Å²	79	40.3 Å²	40.3	34%	0.343	22%	0.219	S	C	.	.	H	α-helix	trans	-61.1	-41.9	175.3	-66.7	-179.5	-179.9	-179.1	0	111.2	P448 L450 L502 S503 G504 R509 I510 A511	P448-K507 HydrophobicContact CB-CB 4.04Å; P448-K507 HydrophobicContact CG-CB 3.55Å; L450-K507 HydrophobicContact CD1-CB 4.26Å; L450-K507 HydrophobicContact CD1-CG 3.92Å; L502-K507 HydrophobicContact CB-CG 3.83Å; L502-K507 WeakPolarHBondContact O-CE 3.17Å; S503-K507 WeakPolarHBondContact O-CG 3.45Å; S503-K507 PolarHBondContact O-N 3.24Å; G504-K507 PolarHBondContact O-N 3.09Å; K507-R509 PolarHBondContact O-N 2.87Å; K507-I510 PolarHBondContact O-N 2.83Å; K507-A511 PolarHBondContact O-N 2.96Å
508	Q	88.4	Confident	83.5	Confident	1 Å²	1	35.1 Å²	35.1	1%	0.005	19%	0.193	C	C	.	.	H	α-helix	trans	-62.6	-44	178.8	-162.6	69.6	-12.9	0	0	111.7	V444 Q445 P448 G504 Q506 I510 A511 I512 A528 L532	V444-Q508 VanDerWaalsContact CG1-NE2 3.34Å; Q445-Q508 PolarHBondContact O-NE2 3.04Å; P448-Q508 HydrophobicContact CG-CB 4.28Å; G504-Q508 PolarHBondContact O-N 2.72Å; Q506-Q508 VanDerWaalsContact C-N 3.3Å; Q506-Q508 PolarHBondContact O-N 3.28Å; Q508-I510 VanDerWaalsContact C-N 3.33Å; Q508-I510 PolarHBondContact O-N 3.35Å; Q508-A511 WeakPolarHBondContact O-CB 3.48Å; Q508-A511 PolarHBondContact O-N 3.12Å; Q508-A511 VanDerWaalsContact O-N 3.12Å; Q508-I512 HydrophobicContact CG-CD1 4.32Å; Q508-I512 WeakPolarHBondContact O-CG1 3.36Å; Q508-I512 PolarHBondContact O-N 3.39Å; Q508-A528 PolarHBondContact NE2-O 3.38Å; Q508-L532 HydrophobicContact CB-CD1 4.4Å; Q508-L532 HydrophobicContact CB-CD2 4.27Å; Q508-L532 HydrophobicContact CG-CD1 4.27Å
509	R	90	Very high	84.9	Confident	25 Å²	25	34.5 Å²	34.5	9%	0.094	19%	0.19	C	C	.	.	H	α-helix	trans	-62.2	-36.8	175.5	-74	-174.9	-73.3	177.3	-12.5	113.3	A478 N479 A480 F483 G505 Q506 K507 I512 A513 V540	A478-R509 WeakPolarHBondContact CB-O 3.26Å; A478-R509 WeakPolarHBondContact O-CG 3.29Å; N479-R509 WeakPolarHBondContact O-CD 3.47Å; N479-R509 PolarHBondContact O-NH1 3.39Å; A480-R509 HydrophobicContact CB-CB 4.05Å; F483-R509 VanDerWaalsContact CD1-CZ 3.47Å; F483-R509 HydrophobicContact CE1-CB 4.15Å; G505-R509 WeakPolarHBondContact O-CG 3.48Å; G505-R509 PolarHBondContact O-N 3.33Å; G505-R509 VanDerWaalsContact O-N 3.13Å; G505-R509 PolarHBondContact O-NE 3.01Å; Q506-R509 PolarHBondContact O-N 3.26Å; K507-R509 PolarHBondContact O-N 2.87Å; R509-I512 PolarHBondContact O-N 3.47Å; R509-A513 PolarHBondContact O-N 2.9Å; R509-V540 HydrophobicContact CG-CG2 3.7Å
510	I	92.2	Very high	86.4	Confident	0 Å²	0	34 Å²	34	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-67.1	-40.9	173.2	-64.7	167.2	0	0	0	110.6	L450 I455 N458 I459 F483 L502 Q506 K507 Q508 I512 A513 R514	L450-I510 HydrophobicContact CD1-CD1 4.21Å; L450-I510 HydrophobicContact CD2-CB 4.12Å; L450-I510 HydrophobicContact CD2-CG2 3.61Å; I455-I510 HydrophobicContact CD1-CD1 4.23Å; I455-I510 HydrophobicContact CG1-CD1 4.24Å; I455-I510 HydrophobicContact CG2-CD1 4.13Å; I455-I510 HydrophobicContact CG2-CG1 4.37Å; N458-I510 HydrophobicContact CB-CG2 4.45Å; I459-I510 HydrophobicContact CG1-CG2 4.06Å; F483-I510 HydrophobicContact CE2-CD1 4.41Å; F483-I510 HydrophobicContact CZ-CD1 3.99Å; F483-I510 HydrophobicContact CZ-CG1 3.93Å; L502-I510 HydrophobicContact CD1-CD1 3.48Å; L502-I510 VanDerWaalsContact CD1-CD1 3.48Å; Q506-I510 WeakPolarHBondContact O-CG1 3.39Å; Q506-I510 PolarHBondContact O-N 3.27Å; Q506-I510 VanDerWaalsContact O-N 3.14Å; K507-I510 PolarHBondContact O-N 2.83Å; Q508-I510 VanDerWaalsContact C-N 3.33Å; Q508-I510 PolarHBondContact O-N 3.35Å; I510-I512 VanDerWaalsContact C-N 3.34Å; I510-I512 PolarHBondContact O-N 2.91Å; I510-A513 PolarHBondContact O-N 3.34Å; I510-R514 WeakPolarHBondContact O-CB 3.1Å; I510-R514 PolarHBondContact O-N 3.45Å
511	A	90.7	Very high	87.7	Confident	6 Å²	6	36.3 Å²	36.3	5%	0.05	19%	0.186	C	C	.	.	H	α-helix	trans	-62.9	-39.3	175.2	0	0	0	0	0	112.1	P448 K507 Q508 R514 V515	P448-A511 HydrophobicContact CB-CB 3.84Å; K507-A511 PolarHBondContact O-N 2.96Å; Q508-A511 WeakPolarHBondContact O-CB 3.48Å; Q508-A511 PolarHBondContact O-N 3.12Å; Q508-A511 VanDerWaalsContact O-N 3.12Å; A511-R514 WeakPolarHBondContact O-CB 3.27Å; A511-R514 PolarHBondContact O-N 3.4Å; A511-V515 WeakPolarHBondContact O-CG2 3.45Å; A511-V515 PolarHBondContact O-N 2.63Å
512	I	90.3	Very high	88.7	Confident	2 Å²	2	28.5 Å²	28.5	1%	0.01	15%	0.145	C	C	.	.	H	α-helix	trans	-63.4	-45.5	173.3	-67	164.6	0	0	0	110.5	V444 A478 Q508 R509 I510 R514 V515 L516 V540 L544 I547	V444-I512 HydrophobicContact CG1-CG1 4.04Å; V444-I512 HydrophobicContact CG2-CG1 4.09Å; A478-I512 HydrophobicContact CB-CB 4.21Å; A478-I512 HydrophobicContact CB-CG2 3.88Å; Q508-I512 HydrophobicContact CG-CD1 4.32Å; Q508-I512 WeakPolarHBondContact O-CG1 3.36Å; Q508-I512 PolarHBondContact O-N 3.39Å; R509-I512 PolarHBondContact O-N 3.47Å; I510-I512 VanDerWaalsContact C-N 3.34Å; I510-I512 PolarHBondContact O-N 2.91Å; I512-R514 VanDerWaalsContact C-N 3.31Å; I512-R514 PolarHBondContact O-N 3.24Å; I512-V515 PolarHBondContact O-N 3.23Å; I512-V515 VanDerWaalsContact O-N 3.1Å; I512-L516 HydrophobicContact CG2-CD1 3.85Å; I512-L516 HydrophobicContact CG2-CG 4.16Å; I512-L516 WeakPolarHBondContact O-CB 3.41Å; I512-L516 WeakPolarHBondContact O-CG 3.2Å; I512-L516 PolarHBondContact O-N 3.49Å; I512-V540 HydrophobicContact CD1-CG1 3.65Å; I512-L544 HydrophobicContact CD1-CD2 4.33Å; I512-I547 HydrophobicContact CG2-CD1 4.19Å
513	A	92.7	Very high	89.1	Confident	0 Å²	0	28.1 Å²	28.1	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-58.7	-42.3	175.3	0	0	0	0	0	112	I459 A478 R509 I510 V515 L516 I517	I459-A513 HydrophobicContact CD1-CB 4.13Å; I459-A513 HydrophobicContact CG1-CB 4.16Å; I459-A513 HydrophobicContact CG2-CB 4.3Å; A478-A513 HydrophobicContact CB-CB 3.76Å; R509-A513 PolarHBondContact O-N 2.9Å; I510-A513 PolarHBondContact O-N 3.34Å; A513-V515 VanDerWaalsContact C-N 3.27Å; A513-V515 PolarHBondContact O-N 2.69Å; A513-L516 PolarHBondContact O-N 3.27Å; A513-I517 PolarHBondContact O-N 3.5Å; A513-I517 VanDerWaalsContact O-N 3.09Å
514	R	92.3	Very high	89.6	Confident	11 Å²	11	25.8 Å²	25.8	4%	0.042	13%	0.126	C	C	.	.	H	α-helix	trans	-62	-31.9	175.5	-178.7	177.2	63.5	-164.5	-2.2	112.9	V449 N458 G462 I510 A511 I512 I517 L885	V449-R514 VanDerWaalsContact O-CZ 3.25Å; V449-R514 PolarHBondContact O-NH1 2.77Å; V449-R514 PolarHBondContact O-NH2 3.15Å; N458-R514 WeakPolarHBondContact O-CD 3.24Å; N458-R514 WeakPolarHBondContact O-CG 3.48Å; G462-R514 VanDerWaalsContact CA-O 3.25Å; G462-R514 WeakPolarHBondContact CA-O 3.19Å; I510-R514 WeakPolarHBondContact O-CB 3.1Å; I510-R514 PolarHBondContact O-N 3.45Å; A511-R514 WeakPolarHBondContact O-CB 3.27Å; A511-R514 PolarHBondContact O-N 3.4Å; I512-R514 VanDerWaalsContact C-N 3.31Å; I512-R514 PolarHBondContact O-N 3.24Å; R514-I517 WeakPolarHBondContact O-CG2 3.48Å; R514-L885 HydrophobicContact CG-CD1 4.36Å
515	V	90.3	Very high	89.9	Confident	4 Å²	4	24 Å²	24	2%	0.024	11%	0.108	C	C	.	.	H	α-helix	trans	-78.2	-44.3	174.6	170.1	0	0	0	0	110.9	C443 V444 A511 I512 A513 I517 R518 P520 L523	C443-V515 VanDerWaalsContact O-CG2 3.28Å; C443-V515 WeakPolarHBondContact O-CG2 3.43Å; V444-V515 HydrophobicContact CG2-CB 4.42Å; V444-V515 HydrophobicContact CG2-CG2 4.11Å; A511-V515 WeakPolarHBondContact O-CG2 3.45Å; A511-V515 PolarHBondContact O-N 2.63Å; I512-V515 PolarHBondContact O-N 3.23Å; I512-V515 VanDerWaalsContact O-N 3.1Å; A513-V515 VanDerWaalsContact C-N 3.27Å; A513-V515 PolarHBondContact O-N 2.69Å; V515-I517 VanDerWaalsContact C-N 3.31Å; V515-I517 PolarHBondContact O-N 2.93Å; V515-R518 WeakPolarHBondContact O-CB 3.38Å; V515-R518 PolarHBondContact O-N 2.85Å; V515-R518 VanDerWaalsContact O-N 3.17Å; V515-P520 HydrophobicContact CG1-CG 4.13Å; V515-L523 HydrophobicContact CG1-CD1 3.68Å
516	L	89.2	Confident	90.2	Very high	21 Å²	21	24.8 Å²	24.8	11%	0.11	11%	0.111	C	C	.	.	H	α-helix	trans	-64.8	-31.2	-175.6	-80.3	-178.5	0	0	0	114.4	K477 A478 I512 A513 R518 K519 I547	K477-L516 HydrophobicContact CB-CD1 3.89Å; A478-L516 HydrophobicContact CB-CD1 4.35Å; I512-L516 HydrophobicContact CG2-CD1 3.85Å; I512-L516 HydrophobicContact CG2-CG 4.16Å; I512-L516 WeakPolarHBondContact O-CB 3.41Å; I512-L516 WeakPolarHBondContact O-CG 3.2Å; I512-L516 PolarHBondContact O-N 3.49Å; A513-L516 PolarHBondContact O-N 3.27Å; L516-R518 PolarHBondContact O-N 3.3Å; L516-R518 VanDerWaalsContact O-N 3.13Å; L516-K519 PolarHBondContact O-N 3.42Å; L516-I547 HydrophobicContact CD1-CD1 3.73Å; L516-I547 HydrophobicContact CD1-CG1 4.1Å; L516-I547 HydrophobicContact CD2-CB 4.49Å; L516-I547 HydrophobicContact CD2-CD1 3.64Å; L516-I547 HydrophobicContact CD2-CG1 3.81Å; L516-I547 HydrophobicContact CD2-CG2 3.82Å; L516-I547 HydrophobicContact CG-CD1 3.96Å; L516-I547 HydrophobicContact CG-CG1 4.47Å
517	I	91.3	Very high	90.1	Very high	10 Å²	10	23.9 Å²	23.9	5%	0.051	11%	0.107	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-21.7	177.6	-157.1	167	0	0	0	112.7	I459 K463 A466 E470 I471 A474 A513 R514 V515 K519	I459-I517 HydrophobicContact CG2-CD1 4.02Å; K463-I517 HydrophobicContact CB-CG1 4.38Å; K463-I517 HydrophobicContact CB-CG2 4.12Å; A466-I517 HydrophobicContact CB-CD1 3.48Å; A466-I517 VanDerWaalsContact CB-CD1 3.48Å; A466-I517 HydrophobicContact CB-CG1 4.27Å; E470-I517 HydrophobicContact CB-CD1 4.34Å; E470-I517 HydrophobicContact CB-CG1 4.34Å; I471-I517 HydrophobicContact CG1-CD1 3.74Å; A474-I517 HydrophobicContact CB-CB 3.97Å; A474-I517 HydrophobicContact CB-CG1 4.3Å; A513-I517 PolarHBondContact O-N 3.5Å; A513-I517 VanDerWaalsContact O-N 3.09Å; R514-I517 WeakPolarHBondContact O-CG2 3.48Å; V515-I517 VanDerWaalsContact C-N 3.31Å; V515-I517 PolarHBondContact O-N 2.93Å; I517-K519 VanDerWaalsContact C-N 3.34Å
518	R	86.7	Confident	89.6	Confident	40 Å²	40	20.4 Å²	20.4	15%	0.151	9%	0.093	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.3	-18.8	174	-65.5	-176.8	173.6	-148.4	-15.3	114	G462 V515 L516 L885	G462-R518 WeakPolarHBondContact O-CG 3.38Å; G462-R518 PolarHBondContact O-NE 2.89Å; G462-R518 PolarHBondContact O-NH2 3.2Å; G462-R518 VanDerWaalsContact O-NH2 3.1Å; V515-R518 WeakPolarHBondContact O-CB 3.38Å; V515-R518 PolarHBondContact O-N 2.85Å; V515-R518 VanDerWaalsContact O-N 3.17Å; L516-R518 PolarHBondContact O-N 3.3Å; L516-R518 VanDerWaalsContact O-N 3.13Å; R518-L885 VanDerWaalsContact NH1-CA 3.35Å; R518-L885 PolarHBondContact NH1-O 2.85Å; R518-L885 PolarHBondContact NH2-O 3.37Å
519	K	87.7	Confident	89.2	Confident	139 Å²	139	20.7 Å²	20.7	60%	0.604	10%	0.095	S	C	*	.			trans	52	58.5	-169.4	-58.8	179.2	179	177.7	0	111.8	L516 I517	L516-K519 PolarHBondContact O-N 3.42Å; I517-K519 VanDerWaalsContact C-N 3.34Å
520	P	89.1	Confident	88.5	Confident	12 Å²	12	21.2 Å²	21.2	8%	0.078	10%	0.103	C	C	.	.			trans	-64.7	146.5	-174.9	30.2	-36.5	0	0	0	111.8	G442 V515 L523 C551	G442-P520 VanDerWaalsContact N-CB 3.25Å; V515-P520 HydrophobicContact CG1-CG 4.13Å; P520-L523 HydrophobicContact CG-CD1 4.2Å; P520-C551 WeakPolarHBondContact O-CB 3.21Å
521	K	89.2	Confident	87.4	Confident	100 Å²	100	24.6 Å²	24.6	44%	0.435	13%	0.131	S	C	.	.	S	Bend	trans	-92.4	-19.9	175.6	-69.2	-68.3	-176.2	-179.4	0	112.6	F359 Q440 C551 T552	F359-K521 HydrophobicContact CD1-CB 3.39Å; F359-K521 HydrophobicContact CD1-CG 4.14Å; F359-K521 HydrophobicContact CE1-CB 3.63Å; Q440-K521 PolarHBondContact O-N 2.94Å; K521-C551 WeakPolarHBondContact O-CB 3.34Å; K521-T552 PolarHBondContact O-N 2.6Å
522	L	91.1	Very high	86.5	Confident	0 Å²	0	25 Å²	25	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	119.6	169.3	175.4	61.5	0	0	0	108.9	F359 I363 Q440 I441 G442 L524 T552 I554	F359-L522 HydrophobicContact CE1-CB 3.84Å; F359-L522 HydrophobicContact CZ-CB 3.91Å; F359-L522 HydrophobicContact CZ-CD2 4.37Å; I363-L522 HydrophobicContact CD1-CD1 3.65Å; I363-L522 HydrophobicContact CD1-CD2 3.66Å; I363-L522 HydrophobicContact CD1-CG 4.31Å; I363-L522 HydrophobicContact CG1-CD2 4.5Å; Q440-L522 PolarHBondContact O-N 3.16Å; I441-L522 WeakPolarHBondContact CA-O 3.5Å; I441-L522 HydrophobicContact CD1-CD2 4.46Å; I441-L522 HydrophobicContact CG1-CB 4.38Å; I441-L522 HydrophobicContact CG1-CD2 4.17Å; G442-L522 PolarHBondContact N-O 2.93Å; L522-L524 HydrophobicContact CD1-CD2 4.02Å; L522-L524 HydrophobicContact CD2-CD2 4.13Å; L522-L524 HydrophobicContact CG-CD2 3.92Å; L522-L524 HydrophobicContact CG-CG 4.37Å; L522-T552 WeakPolarHBondContact CA-O 3.21Å; L522-T552 HydrophobicContact CD1-CG2 4Å; L522-I554 HydrophobicContact CD1-CD1 4.39Å
523	L	91.8	Very high	85.7	Confident	4 Å²	4	28.8 Å²	28.8	2%	0.021	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	122.9	177.1	-172.3	68.3	0	0	0	110	G442 V515 P520 L525 I547 T552 V553 I554	G442-L523 CarbonylContact O-C 3.45Å; G442-L523 WeakPolarHBondContact O-CA 3.42Å; V515-L523 HydrophobicContact CG1-CD1 3.68Å; P520-L523 HydrophobicContact CG-CD1 4.2Å; L523-L525 HydrophobicContact CD1-CD2 4.28Å; L523-L525 HydrophobicContact CD2-CD1 4.42Å; L523-L525 HydrophobicContact CD2-CD2 4.05Å; L523-L525 HydrophobicContact CD2-CG 4.36Å; L523-L525 HydrophobicContact CG-CD2 3.9Å; L523-L525 HydrophobicContact CG-CG 4.23Å; L523-I547 HydrophobicContact CD2-CG2 3.87Å; L523-T552 PolarHBondContact N-O 3.18Å; L523-V553 HydrophobicContact CB-CG1 4.35Å; L523-V553 HydrophobicContact CB-CG2 4.27Å; L523-V553 HydrophobicContact CD2-CG1 4.37Å; L523-V553 HydrophobicContact CD2-CG2 4.5Å; L523-V553 CarbonylContact O-C 3.47Å; L523-V553 WeakPolarHBondContact O-CA 3.47Å; L523-I554 PolarHBondContact O-N 3.23Å
524	L	92.4	Very high	84.8	Confident	0 Å²	0	32.3 Å²	32.3	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	119.1	178.4	-53.1	179.7	0	0	0	108.6	I408 L411 Q412 I441 G442 C443 V444 L522 I554	I408-L524 HydrophobicContact CD1-CB 4.32Å; I408-L524 HydrophobicContact CG1-CB 4.45Å; I408-L524 HydrophobicContact CG2-CB 4.31Å; I408-L524 HydrophobicContact CG2-CD1 4.24Å; L411-L524 HydrophobicContact CB-CD1 4.09Å; L411-L524 HydrophobicContact CD1-CD2 3.91Å; Q412-L524 HydrophobicContact CG-CD1 3.82Å; I441-L524 HydrophobicContact CG2-CD1 3.68Å; I441-L524 HydrophobicContact CG2-CG 3.9Å; G442-L524 PolarHBondContact O-N 2.98Å; C443-L524 CarbonylContact C-O 3.54Å; C443-L524 WeakPolarHBondContact CA-O 3.48Å; C443-L524 HydrophobicContact CB-CB 4.44Å; V444-L524 PolarHBondContact N-O 3.03Å; L522-L524 HydrophobicContact CD1-CD2 4.02Å; L522-L524 HydrophobicContact CD2-CD2 4.13Å; L522-L524 HydrophobicContact CG-CD2 3.92Å; L522-L524 HydrophobicContact CG-CG 4.37Å; L524-I554 HydrophobicContact CD2-CB 3.99Å; L524-I554 HydrophobicContact CD2-CD1 4.18Å; L524-I554 HydrophobicContact CD2-CG1 4.44Å
525	L	90.4	Very high	83.8	Confident	4 Å²	4	38.8 Å²	38.8	2%	0.021	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	105	179.2	-55.7	-179.9	0	0	0	108.4	V444 L523 A528 L544 V553 I554 I555 I556	V444-L525 HydrophobicContact CB-CD2 3.71Å; V444-L525 HydrophobicContact CG2-CD2 3.64Å; L523-L525 HydrophobicContact CD1-CD2 4.28Å; L523-L525 HydrophobicContact CD2-CD1 4.42Å; L523-L525 HydrophobicContact CD2-CD2 4.05Å; L523-L525 HydrophobicContact CD2-CG 4.36Å; L523-L525 HydrophobicContact CG-CD2 3.9Å; L523-L525 HydrophobicContact CG-CG 4.23Å; L525-A528 HydrophobicContact CB-CB 4.43Å; L525-L544 HydrophobicContact CD1-CD1 3.99Å; L525-L544 HydrophobicContact CD1-CD2 3.73Å; L525-L544 HydrophobicContact CD1-CG 4.34Å; L525-L544 HydrophobicContact CD2-CD2 3.83Å; L525-L544 HydrophobicContact CG-CD2 4.48Å; L525-V553 HydrophobicContact CD1-CG1 4.12Å; L525-V553 HydrophobicContact CG-CG1 4.43Å; L525-I554 PolarHBondContact N-O 3.07Å; L525-I555 HydrophobicContact CB-CG2 4.29Å; L525-I555 HydrophobicContact CD1-CD1 4.15Å; L525-I555 HydrophobicContact CD1-CG1 4.01Å; L525-I556 PolarHBondContact O-N 2.97Å
526	D	89.9	Confident	83	Confident	15 Å²	15	39.1 Å²	39.1	8%	0.08	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	94.3	-178.9	-169.6	22	0	0	0	109.7	S405 I408 V444 Q445 Q446 A528 I556	S405-D526 PolarHBondContact OG-OD1 3.5Å; I408-D526 HydrophobicContact CD1-CB 3.68Å; I408-D526 HydrophobicContact CG2-CB 4.44Å; V444-D526 PolarHBondContact O-N 3.49Å; Q445-D526 CarbonylContact C-O 3.55Å; Q446-D526 WeakPolarHBondContact CA-O 3.33Å; Q446-D526 PolarHBondContact N-O 2.82Å; D526-A528 PolarHBondContact O-N 3.11Å; D526-I556 WeakPolarHBondContact OD1-CD1 3.42Å
527	E	85.9	Confident	82.4	Confident	29 Å²	29	38.8 Å²	38.8	14%	0.136	21%	0.205	C	C	.	.	S	Bend	trans	50.1	37.2	179.4	-62.5	-170.5	-178.1	0	0	113.3	Q446 T529 S530 I556	Q446-E527 HydrophobicContact CB-CB 4.34Å; Q446-E527 HydrophobicContact CG-CB 4.15Å; Q446-E527 PolarHBondContact NE2-OE2 2.91Å; E527-T529 PolarHBondContact O-N 3.44Å; E527-S530 PolarHBondContact O-N 3.4Å; E527-S530 PolarHBondContact O-OG 3.05Å; E527-I556 VanDerWaalsContact CA-O 3.25Å; E527-I556 WeakPolarHBondContact CA-O 3.42Å; E527-I556 HydrophobicContact CG-CB 4.44Å; E527-I556 HydrophobicContact CG-CG2 3.74Å; E527-I556 PolarHBondContact N-O 2.92Å
528	A	79.3	Confident	81.8	Confident	6 Å²	6	45.1 Å²	45.1	5%	0.05	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61	-12.2	-168.6	0	0	0	0	0	115	V444 Q508 L525 D526	V444-A528 HydrophobicContact CB-CB 4.33Å; V444-A528 HydrophobicContact CG1-CB 3.79Å; Q508-A528 PolarHBondContact NE2-O 3.38Å; L525-A528 HydrophobicContact CB-CB 4.43Å; D526-A528 PolarHBondContact O-N 3.11Å
529	T	81.1	Confident	81.5	Confident	7 Å²	7	46 Å²	46	4%	0.043	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-113.2	-5.4	177.5	67.5	0	0	0	0	114.5	E527 A531 L532 E537 V540	E527-T529 PolarHBondContact O-N 3.44Å; T529-A531 VanDerWaalsContact C-N 3.32Å; T529-A531 PolarHBondContact O-N 2.9Å; T529-L532 WeakPolarHBondContact O-CB 3.4Å; T529-L532 PolarHBondContact O-N 3.1Å; T529-L532 VanDerWaalsContact O-N 3.16Å; T529-E537 VanDerWaalsContact CB-OE1 3.26Å; T529-E537 WeakPolarHBondContact CB-OE1 3.46Å; T529-E537 HydrophobicContact CG2-CG 4.06Å; T529-E537 PolarHBondContact OG1-OE1 3.04Å; T529-V540 HydrophobicContact CG2-CG1 4.21Å
530	S	74.3	Confident	81	Confident	36 Å²	36	39.4 Å²	39.4	25%	0.252	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-31.3	-168.3	73.7	0	0	0	0	113.9	Q446 E527	Q446-S530 WeakPolarHBondContact CG-OG 3.43Å; Q446-S530 PolarHBondContact NE2-OG 3.46Å; E527-S530 PolarHBondContact O-N 3.4Å; E527-S530 PolarHBondContact O-OG 3.05Å
531	A	69.6	Low	80.5	Confident	71 Å²	71	40.4 Å²	40.4	59%	0.587	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-94.3	7.6	-178.7	0	0	0	0	0	113.3	T529	T529-A531 VanDerWaalsContact C-N 3.32Å; T529-A531 PolarHBondContact O-N 2.9Å
532	L	72.8	Confident	80	Confident	14 Å²	14	36.9 Å²	36.9	7%	0.073	20%	0.202	C	C	.	.	S	Bend	trans	-97.9	145.8	-176.9	-58.2	-174.2	0	0	0	111.8	G505 Q508 T529 E537 V540 R559	G505-L532 VanDerWaalsContact N-CD2 3.31Å; Q508-L532 HydrophobicContact CB-CD1 4.4Å; Q508-L532 HydrophobicContact CB-CD2 4.27Å; Q508-L532 HydrophobicContact CG-CD1 4.27Å; T529-L532 WeakPolarHBondContact O-CB 3.4Å; T529-L532 PolarHBondContact O-N 3.1Å; T529-L532 VanDerWaalsContact O-N 3.16Å; L532-E537 HydrophobicContact CB-CB 4.28Å; L532-V540 HydrophobicContact CD1-CB 3.95Å; L532-V540 HydrophobicContact CD1-CG1 4.16Å; L532-V540 HydrophobicContact CD1-CG2 3.68Å; L532-R559 PolarHBondContact O-NH2 3.11Å
533	D	73.1	Confident	79.4	Confident	81 Å²	81	36.9 Å²	36.9	43%	0.433	20%	0.202	S	C	.	.			trans	-63.9	152.2	163.9	61	-80	0	0	0	110.4	Q535 S536 E537	D533-Q535 PolarHBondContact O-N 2.69Å; D533-Q535 PolarHBondContact OD2-N 3.48Å; D533-S536 VanDerWaalsContact CG-OG 3.24Å; D533-S536 PolarHBondContact O-N 3Å; D533-S536 VanDerWaalsContact O-N 3.11Å; D533-S536 WeakPolarHBondContact OD1-CB 3.39Å; D533-S536 PolarHBondContact OD1-OG 2.9Å; D533-S536 WeakPolarHBondContact OD2-CB 3.4Å; D533-S536 PolarHBondContact OD2-N 3.45Å; D533-S536 PolarHBondContact OD2-OG 3.37Å; D533-S536 VanDerWaalsContact OD2-OG 3.11Å; D533-E537 WeakPolarHBondContact O-CB 3.42Å; D533-E537 PolarHBondContact O-N 3.44Å
534	T	72.4	Confident	78.7	Confident	74 Å²	74	37.1 Å²	37.1	45%	0.454	20%	0.204	S	C	.	.	H	α-helix	trans	-54.3	-36.7	-176	27.2	0	0	0	0	113.3	R538 R559	T534-R538 PolarHBondContact O-N 3.35Å; T534-R538 VanDerWaalsContact O-N 3.11Å; T534-R559 VanDerWaalsContact CG2-NH1 3.3Å
535	Q	72.8	Confident	78	Confident	147 Å²	147	40.8 Å²	40.8	69%	0.687	22%	0.223	S	C	*	.	H	α-helix	trans	-69.7	-48.6	177.4	-170.6	-177.6	9.8	0	0	111.6	D533 E537 R538 I539	D533-Q535 PolarHBondContact O-N 2.69Å; D533-Q535 PolarHBondContact OD2-N 3.48Å; Q535-E537 VanDerWaalsContact C-N 3.27Å; Q535-E537 PolarHBondContact O-N 2.85Å; Q535-R538 PolarHBondContact O-N 3.29Å; Q535-I539 WeakPolarHBondContact O-CG1 3.47Å; Q535-I539 PolarHBondContact O-N 2.99Å
536	S	73.6	Confident	77.2	Confident	12 Å²	12	47.3 Å²	47.3	8%	0.084	25%	0.251	C	S	.	.	H	α-helix	trans	-61.3	-36.6	174.8	-69.7	0	0	0	0	112.3	D533 I539 V540	D533-S536 VanDerWaalsContact CG-OG 3.24Å; D533-S536 PolarHBondContact O-N 3Å; D533-S536 VanDerWaalsContact O-N 3.11Å; D533-S536 WeakPolarHBondContact OD1-CB 3.39Å; D533-S536 PolarHBondContact OD1-OG 2.9Å; D533-S536 WeakPolarHBondContact OD2-CB 3.4Å; D533-S536 PolarHBondContact OD2-N 3.45Å; D533-S536 PolarHBondContact OD2-OG 3.37Å; D533-S536 VanDerWaalsContact OD2-OG 3.11Å; S536-I539 PolarHBondContact O-N 3.07Å; S536-V540 WeakPolarHBondContact O-CB 3.3Å; S536-V540 WeakPolarHBondContact O-CG2 3.45Å; S536-V540 PolarHBondContact O-N 2.93Å
537	E	76.5	Confident	76.5	Confident	13 Å²	13	47.8 Å²	47.8	6%	0.061	25%	0.254	C	S	.	.	H	α-helix	trans	-61.8	-50.9	176.7	174.7	169.4	-143	0	0	111.7	T529 L532 D533 Q535 I539 V540 Q541 R559	T529-E537 VanDerWaalsContact CB-OE1 3.26Å; T529-E537 WeakPolarHBondContact CB-OE1 3.46Å; T529-E537 HydrophobicContact CG2-CG 4.06Å; T529-E537 PolarHBondContact OG1-OE1 3.04Å; L532-E537 HydrophobicContact CB-CB 4.28Å; D533-E537 WeakPolarHBondContact O-CB 3.42Å; D533-E537 PolarHBondContact O-N 3.44Å; Q535-E537 VanDerWaalsContact C-N 3.27Å; Q535-E537 PolarHBondContact O-N 2.85Å; E537-I539 PolarHBondContact O-N 3.33Å; E537-V540 CarbonylContact O-C 3.56Å; E537-V540 PolarHBondContact O-N 3.42Å; E537-Q541 WeakPolarHBondContact O-CB 3.38Å; E537-Q541 PolarHBondContact O-N 3.43Å; E537-R559 WeakPolarHBondContact OE1-CD 3.24Å; E537-R559 IonicContact OE1-NE 3.71Å; E537-R559 PolarHBondContact OE1-NE 3.18Å; E537-R559 WeakPolarHBondContact OE2-CD 3.27Å; E537-R559 IonicContact OE2-CZ 3.73Å; E537-R559 IonicContact OE2-NE 2.85Å; E537-R559 PolarHBondContact OE2-NE 2.78Å; E537-R559 IonicContact OE2-NH1 2.69Å; E537-R559 PolarHBondContact OE2-NH1 2.8Å; E537-R559 IonicContact OE2-NH2 2.91Å; E537-R559 PolarHBondContact OE2-NH2 3.48Å
538	R	78.9	Confident	75.8	Confident	143 Å²	143	49.1 Å²	49.1	54%	0.54	26%	0.264	S	S	.	.	H	α-helix	trans	-55.1	-39.5	177.1	-74.1	-178.3	-178.6	167.5	0.3	111.9	T534 Q535 G542	T534-R538 PolarHBondContact O-N 3.35Å; T534-R538 VanDerWaalsContact O-N 3.11Å; Q535-R538 PolarHBondContact O-N 3.29Å; R538-G542 PolarHBondContact O-N 3.28Å
539	I	79.8	Confident	75.3	Confident	60 Å²	60	52.1 Å²	52.1	31%	0.308	30%	0.295	S	S	.	.	H	α-helix	trans	-69.5	-39.6	178.8	-60.7	166.6	0	0	0	111.8	N479 Q535 S536 E537 A543	N479-I539 HydrophobicContact CB-CG2 3.96Å; N479-I539 PolarHBondContact ND2-O 2.7Å; N479-I539 VanDerWaalsContact ND2-O 3.08Å; Q535-I539 WeakPolarHBondContact O-CG1 3.47Å; Q535-I539 PolarHBondContact O-N 2.99Å; S536-I539 PolarHBondContact O-N 3.07Å; E537-I539 PolarHBondContact O-N 3.33Å; I539-A543 PolarHBondContact O-N 2.95Å; I539-A543 VanDerWaalsContact O-N 3.13Å
540	V	77.6	Confident	75.1	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-70.4	-43.4	177.2	166.3	0	0	0	0	110.7	R509 I512 T529 L532 S536 E537 G542 A543 L544	R509-V540 HydrophobicContact CG-CG2 3.7Å; I512-V540 HydrophobicContact CD1-CG1 3.65Å; T529-V540 HydrophobicContact CG2-CG1 4.21Å; L532-V540 HydrophobicContact CD1-CB 3.95Å; L532-V540 HydrophobicContact CD1-CG1 4.16Å; L532-V540 HydrophobicContact CD1-CG2 3.68Å; S536-V540 WeakPolarHBondContact O-CB 3.3Å; S536-V540 WeakPolarHBondContact O-CG2 3.45Å; S536-V540 PolarHBondContact O-N 2.93Å; E537-V540 CarbonylContact O-C 3.56Å; E537-V540 PolarHBondContact O-N 3.42Å; V540-G542 PolarHBondContact O-N 3.5Å; V540-A543 CarbonylContact O-C 3.53Å; V540-A543 WeakPolarHBondContact O-CA 3.45Å; V540-A543 VanDerWaalsContact O-CB 3.28Å; V540-A543 WeakPolarHBondContact O-CB 3.39Å; V540-A543 PolarHBondContact O-N 3.37Å; V540-L544 HydrophobicContact CG1-CD1 4.12Å; V540-L544 HydrophobicContact CG1-CG 4.41Å; V540-L544 WeakPolarHBondContact O-CG 3.44Å; V540-L544 PolarHBondContact O-N 3.14Å
541	Q	78.3	Confident	75.7	Confident	33 Å²	33	53.6 Å²	53.6	15%	0.154	32%	0.316	C	S	.	.	H	α-helix	trans	-60.2	-47	174.7	-170.2	62.8	32.5	0	0	110.6	E537 A543 L544 D545	E537-Q541 WeakPolarHBondContact O-CB 3.38Å; E537-Q541 PolarHBondContact O-N 3.43Å; Q541-A543 PolarHBondContact O-N 3.31Å; Q541-A543 VanDerWaalsContact O-N 3.11Å; Q541-L544 CarbonylContact O-C 3.59Å; Q541-L544 WeakPolarHBondContact O-CA 3.34Å; Q541-L544 WeakPolarHBondContact O-CB 3.28Å; Q541-L544 PolarHBondContact O-N 3Å; Q541-D545 PolarHBondContact NE2-OD1 3.05Å; Q541-D545 VanDerWaalsContact O-CG 3.27Å; Q541-D545 PolarHBondContact O-N 3.26Å
542	G	79	Confident	76.7	Confident	26 Å²	26	50.2 Å²	50.2	27%	0.268	29%	0.288	S	S	.	.	H	α-helix	trans	-64.3	-15.9	173.5	0	0	0	0	0	114.3	R538 V540 K546	R538-G542 PolarHBondContact O-N 3.28Å; V540-G542 PolarHBondContact O-N 3.5Å; G542-K546 WeakPolarHBondContact O-CD 3.38Å; G542-K546 WeakPolarHBondContact O-CE 3.42Å; G542-K546 WeakPolarHBondContact O-CG 3.3Å
543	A	77.7	Confident	77.6	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-82.9	-40.2	167.1	0	0	0	0	0	111.4	N479 I539 V540 Q541 K546 I547	N479-A543 HydrophobicContact CB-CB 4.35Å; N479-A543 PolarHBondContact ND2-N 2.97Å; I539-A543 PolarHBondContact O-N 2.95Å; I539-A543 VanDerWaalsContact O-N 3.13Å; V540-A543 CarbonylContact O-C 3.53Å; V540-A543 WeakPolarHBondContact O-CA 3.45Å; V540-A543 VanDerWaalsContact O-CB 3.28Å; V540-A543 WeakPolarHBondContact O-CB 3.39Å; V540-A543 PolarHBondContact O-N 3.37Å; Q541-A543 PolarHBondContact O-N 3.31Å; Q541-A543 VanDerWaalsContact O-N 3.11Å; A543-K546 PolarHBondContact O-N 2.78Å; A543-I547 WeakPolarHBondContact O-CD1 3.34Å; A543-I547 VanDerWaalsContact O-CG1 3.32Å; A543-I547 WeakPolarHBondContact O-CG1 3.44Å
544	L	77.1	Confident	78.5	Confident	9 Å²	9	45.9 Å²	45.9	5%	0.047	26%	0.264	C	S	.	.	H	α-helix	trans	-65.8	-44.1	177.9	-68.3	172.7	0	0	0	112.3	I512 L525 V540 Q541 K546 I547 V548	I512-L544 HydrophobicContact CD1-CD2 4.33Å; L525-L544 HydrophobicContact CD1-CD1 3.99Å; L525-L544 HydrophobicContact CD1-CD2 3.73Å; L525-L544 HydrophobicContact CD1-CG 4.34Å; L525-L544 HydrophobicContact CD2-CD2 3.83Å; L525-L544 HydrophobicContact CG-CD2 4.48Å; V540-L544 HydrophobicContact CG1-CD1 4.12Å; V540-L544 HydrophobicContact CG1-CG 4.41Å; V540-L544 WeakPolarHBondContact O-CG 3.44Å; V540-L544 PolarHBondContact O-N 3.14Å; Q541-L544 CarbonylContact O-C 3.59Å; Q541-L544 WeakPolarHBondContact O-CA 3.34Å; Q541-L544 WeakPolarHBondContact O-CB 3.28Å; Q541-L544 PolarHBondContact O-N 3Å; L544-K546 PolarHBondContact O-N 3.49Å; L544-I547 HydrophobicContact CD2-CD1 4.14Å; L544-I547 WeakPolarHBondContact O-CA 3.32Å; L544-I547 VanDerWaalsContact O-CB 3.28Å; L544-I547 WeakPolarHBondContact O-CB 3.38Å; L544-I547 PolarHBondContact O-N 2.98Å; L544-V548 WeakPolarHBondContact O-CG2 3.28Å; L544-V548 PolarHBondContact O-N 3.4Å; L544-V548 VanDerWaalsContact O-N 3.14Å
545	D	77.7	Confident	79.4	Confident	77 Å²	77	43.1 Å²	43.1	41%	0.412	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-28.7	179.8	-64.6	-22.1	0	0	0	112.2	Q541 I547	Q541-D545 PolarHBondContact NE2-OD1 3.05Å; Q541-D545 VanDerWaalsContact O-CG 3.27Å; Q541-D545 PolarHBondContact O-N 3.26Å; D545-I547 PolarHBondContact O-N 3.4Å
546	K	74.8	Confident	80.2	Confident	141 Å²	141	36.2 Å²	36.2	61%	0.613	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.9	-15.8	173.9	-67.5	174	-173.7	178.6	0	113.4	N479 G542 A543 L544	N479-K546 PolarHBondContact OD1-NZ 3.5Å; G542-K546 WeakPolarHBondContact O-CD 3.38Å; G542-K546 WeakPolarHBondContact O-CE 3.42Å; G542-K546 WeakPolarHBondContact O-CG 3.3Å; A543-K546 PolarHBondContact O-N 2.78Å; L544-K546 PolarHBondContact O-N 3.49Å
547	I	75	Confident	80.5	Confident	25 Å²	25	36 Å²	36	13%	0.128	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.8	-33.3	-179	-48.4	164.1	0	0	0	109.8	I512 L516 L523 A543 L544 D545 G549 G550	I512-I547 HydrophobicContact CG2-CD1 4.19Å; L516-I547 HydrophobicContact CD1-CD1 3.73Å; L516-I547 HydrophobicContact CD1-CG1 4.1Å; L516-I547 HydrophobicContact CD2-CB 4.49Å; L516-I547 HydrophobicContact CD2-CD1 3.64Å; L516-I547 HydrophobicContact CD2-CG1 3.81Å; L516-I547 HydrophobicContact CD2-CG2 3.82Å; L516-I547 HydrophobicContact CG-CD1 3.96Å; L516-I547 HydrophobicContact CG-CG1 4.47Å; L523-I547 HydrophobicContact CD2-CG2 3.87Å; A543-I547 WeakPolarHBondContact O-CD1 3.34Å; A543-I547 VanDerWaalsContact O-CG1 3.32Å; A543-I547 WeakPolarHBondContact O-CG1 3.44Å; L544-I547 HydrophobicContact CD2-CD1 4.14Å; L544-I547 WeakPolarHBondContact O-CA 3.32Å; L544-I547 VanDerWaalsContact O-CB 3.28Å; L544-I547 WeakPolarHBondContact O-CB 3.38Å; L544-I547 PolarHBondContact O-N 2.98Å; D545-I547 PolarHBondContact O-N 3.4Å; I547-G549 PolarHBondContact O-N 2.98Å; I547-G550 PolarHBondContact O-N 3.34Å
548	V	69.9	Low	80.6	Confident	57 Å²	57	40.6 Å²	40.6	35%	0.345	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.8	122.8	177	177.1	0	0	0	0	109.5	L544	L544-V548 WeakPolarHBondContact O-CG2 3.28Å; L544-V548 PolarHBondContact O-N 3.4Å; L544-V548 VanDerWaalsContact O-N 3.14Å
549	G	69.3	Low	80.3	Confident	68 Å²	68	36 Å²	36	70%	0.701	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	117.7	-19.2	-178.3	0	0	0	0	0	115.1	I547	I547-G549 PolarHBondContact O-N 2.98Å
550	G	77	Confident	80.4	Confident	65 Å²	65	33.4 Å²	33.4	67%	0.67	20%	0.204	S	C	*	.	S	Bend	trans	-98.8	-12.5	178.7	0	0	0	0	0	115.8	I547	I547-G550 PolarHBondContact O-N 3.34Å
551	C	87.3	Confident	80.4	Confident	9 Å²	9	36 Å²	36	6%	0.061	22%	0.222	C	C	.	.	S	Bend	trans	-153.5	163	-172.7	57.8	0	0	0	0	110.7	P520 K521	P520-C551 WeakPolarHBondContact O-CB 3.21Å; K521-C551 WeakPolarHBondContact O-CB 3.34Å
552	T	91.4	Very high	80.2	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	133.8	168.3	-54.2	0	0	0	0	109.1	G361 V388 G391 Q392 K521 L522 L523	G361-T552 WeakPolarHBondContact O-CB 3.26Å; G361-T552 WeakPolarHBondContact O-CG2 3.27Å; G361-T552 PolarHBondContact O-OG1 2.88Å; V388-T552 HydrophobicContact CG1-CG2 3.51Å; G391-T552 PolarHBondContact N-OG1 3.16Å; Q392-T552 WeakPolarHBondContact O-CA 3.36Å; Q392-T552 WeakPolarHBondContact O-CG2 3.22Å; K521-T552 PolarHBondContact O-N 2.6Å; L522-T552 WeakPolarHBondContact CA-O 3.21Å; L522-T552 HydrophobicContact CD1-CG2 4Å; L523-T552 PolarHBondContact N-O 3.18Å
553	V	91.4	Very high	80.5	Confident	0 Å²	0	34.1 Å²	34.1	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	130.6	-178.5	-170.5	0	0	0	0	110.2	Q392 T393 I394 L523 L525 I555	Q392-V553 PolarHBondContact O-N 2.95Å; T393-V553 CarbonylContact C-O 3.59Å; T393-V553 WeakPolarHBondContact CA-O 3.15Å; T393-V553 HydrophobicContact CG2-CB 4.16Å; I394-V553 PolarHBondContact N-O 2.72Å; L523-V553 HydrophobicContact CB-CG1 4.35Å; L523-V553 HydrophobicContact CB-CG2 4.27Å; L523-V553 HydrophobicContact CD2-CG1 4.37Å; L523-V553 HydrophobicContact CD2-CG2 4.5Å; L523-V553 CarbonylContact O-C 3.47Å; L523-V553 WeakPolarHBondContact O-CA 3.47Å; L525-V553 HydrophobicContact CD1-CG1 4.12Å; L525-V553 HydrophobicContact CG-CG1 4.43Å; V553-I555 HydrophobicContact CG1-CD1 3.91Å; V553-I555 HydrophobicContact CG1-CG1 3.54Å
554	I	92.3	Very high	80.8	Confident	4 Å²	4	37 Å²	37	2%	0.021	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	118.6	169.9	-63.1	174.5	0	0	0	108	I363 I394 L396 L411 L522 L523 L524 L525	I363-I554 HydrophobicContact CD1-CD1 3.75Å; I394-I554 CarbonylContact O-C 3.54Å; I394-I554 WeakPolarHBondContact O-CA 3.3Å; L396-I554 HydrophobicContact CD1-CG2 3.74Å; L396-I554 HydrophobicContact CG-CG2 4.21Å; L411-I554 HydrophobicContact CD1-CD1 3.44Å; L411-I554 VanDerWaalsContact CD1-CD1 3.44Å; L522-I554 HydrophobicContact CD1-CD1 4.39Å; L523-I554 PolarHBondContact O-N 3.23Å; L524-I554 HydrophobicContact CD2-CB 3.99Å; L524-I554 HydrophobicContact CD2-CD1 4.18Å; L524-I554 HydrophobicContact CD2-CG1 4.44Å; L525-I554 PolarHBondContact N-O 3.07Å
555	I	90.7	Very high	81.2	Confident	17 Å²	17	43.2 Å²	43.2	9%	0.087	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	123.4	-174.2	-47.5	-173.2	0	0	0	109.2	T393 I394 A395 L396 L525 V553 A557 I563	T393-I555 HydrophobicContact CG2-CD1 3.84Å; T393-I555 HydrophobicContact CG2-CG1 4.36Å; I394-I555 PolarHBondContact O-N 2.82Å; A395-I555 CarbonylContact C-O 3.48Å; A395-I555 WeakPolarHBondContact CA-O 3.35Å; L396-I555 PolarHBondContact N-O 2.81Å; L525-I555 HydrophobicContact CB-CG2 4.29Å; L525-I555 HydrophobicContact CD1-CD1 4.15Å; L525-I555 HydrophobicContact CD1-CG1 4.01Å; V553-I555 HydrophobicContact CG1-CD1 3.91Å; V553-I555 HydrophobicContact CG1-CG1 3.54Å; I555-A557 HydrophobicContact CG2-CB 4.39Å; I555-I563 HydrophobicContact CG2-CG2 4.21Å
556	I	90.2	Very high	81.6	Confident	1 Å²	1	40 Å²	40	1%	0.005	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	115.3	162.2	-58.7	174.5	0	0	0	106.3	L396 K404 I408 L525 D526 E527	L396-I556 HydrophobicContact CB-CG1 4.08Å; L396-I556 HydrophobicContact CD1-CD1 4.48Å; L396-I556 HydrophobicContact CD1-CG1 4Å; K404-I556 HydrophobicContact CB-CD1 3.88Å; K404-I556 HydrophobicContact CB-CG1 4.24Å; K404-I556 HydrophobicContact CB-CG2 3.9Å; K404-I556 HydrophobicContact CD-CG2 4.05Å; K404-I556 VanDerWaalsContact O-CD1 3.25Å; K404-I556 WeakPolarHBondContact O-CD1 3.45Å; I408-I556 HydrophobicContact CB-CD1 4.4Å; I408-I556 HydrophobicContact CD1-CD1 3.35Å; I408-I556 HydrophobicContact CD1-CG1 3.75Å; I408-I556 HydrophobicContact CG1-CD1 3.72Å; I408-I556 HydrophobicContact CG1-CG1 4.34Å; L525-I556 PolarHBondContact O-N 2.97Å; D526-I556 WeakPolarHBondContact OD1-CD1 3.42Å; E527-I556 VanDerWaalsContact CA-O 3.25Å; E527-I556 WeakPolarHBondContact CA-O 3.42Å; E527-I556 HydrophobicContact CG-CB 4.44Å; E527-I556 HydrophobicContact CG-CG2 3.74Å; E527-I556 PolarHBondContact N-O 2.92Å
557	A	79.7	Confident	82.3	Confident	7 Å²	7	36.6 Å²	36.6	6%	0.058	23%	0.229	C	C	.	.			trans	-115.7	138.4	178.8	0	0	0	0	0	110.7	I555 T562 I563	I555-A557 HydrophobicContact CG2-CB 4.39Å; A557-T562 WeakPolarHBondContact CB-OG1 3.45Å; A557-I563 HydrophobicContact CB-CG2 3.4Å
558	H	76.9	Confident	83.1	Confident	110 Å²	110	39.6 Å²	39.6	51%	0.509	24%	0.239	S	C	.	.	S	Bend	trans	-81.5	-39.9	163.2	-173.4	-88.9	0	0	0	110.7	Q600	H558-Q600 PolarHBondContact O-NE2 2.92Å; H558-Q600 PolarHBondContact O-OE1 3.48Å
559	R	74.2	Confident	84.2	Confident	48 Å²	48	36.9 Å²	36.9	18%	0.181	22%	0.222	C	C	.	.	S	Bend	trans	-90.6	118.7	177.9	-54.8	-159.4	-163.6	-161.2	7.1	111	L532 T534 E537 S561 T562	L532-R559 PolarHBondContact O-NH2 3.11Å; T534-R559 VanDerWaalsContact CG2-NH1 3.3Å; E537-R559 WeakPolarHBondContact OE1-CD 3.24Å; E537-R559 IonicContact OE1-NE 3.71Å; E537-R559 PolarHBondContact OE1-NE 3.18Å; E537-R559 WeakPolarHBondContact OE2-CD 3.27Å; E537-R559 IonicContact OE2-CZ 3.73Å; E537-R559 IonicContact OE2-NE 2.85Å; E537-R559 PolarHBondContact OE2-NE 2.78Å; E537-R559 IonicContact OE2-NH1 2.69Å; E537-R559 PolarHBondContact OE2-NH1 2.8Å; E537-R559 IonicContact OE2-NH2 2.91Å; E537-R559 PolarHBondContact OE2-NH2 3.48Å; R559-S561 PolarHBondContact O-N 3.16Å; R559-T562 HydrophobicContact CB-CG2 4.45Å; R559-T562 PolarHBondContact O-N 3.46Å; R559-T562 PolarHBondContact O-OG1 2.86Å
560	L	80.4	Confident	85.3	Confident	4 Å²	4	33.7 Å²	33.7	2%	0.021	19%	0.189	C	C	.	.	G	3₁₀ helix	trans	-65.8	-22	-176.4	-71	167.1	0	0	0	113.4	V397 T562 I563 Y593 M596 Y597 Q600	V397-L560 HydrophobicContact CG1-CD2 3.64Å; V397-L560 HydrophobicContact CG2-CD2 4.09Å; L560-T562 VanDerWaalsContact C-N 3.26Å; L560-T562 PolarHBondContact O-N 3.47Å; L560-I563 HydrophobicContact CD2-CD1 3.61Å; L560-I563 HydrophobicContact CD2-CG1 4.34Å; L560-I563 WeakPolarHBondContact O-CG1 3.42Å; L560-I563 PolarHBondContact O-N 3.31Å; L560-Y593 HydrophobicContact CD2-CD2 4.39Å; L560-Y593 HydrophobicContact CD2-CE2 3.71Å; L560-M596 HydrophobicContact CD1-CB 4Å; L560-M596 WeakPolarHBondContact CD1-O 2.77Å; L560-Y597 HydrophobicContact CB-CD2 4.22Å; L560-Y597 HydrophobicContact CD1-CD2 4.36Å; L560-Q600 HydrophobicContact CD1-CB 4.17Å; L560-Q600 HydrophobicContact CD1-CG 4.13Å
561	S	77.5	Confident	86	Confident	55 Å²	55	30.6 Å²	30.6	39%	0.385	16%	0.157	S	C	.	.	G	3₁₀ helix	trans	-58.4	-34.8	174.6	53.6	0	0	0	0	113.4	R559 I563	R559-S561 PolarHBondContact O-N 3.16Å; S561-I563 PolarHBondContact O-N 2.95Å
562	T	75.5	Confident	86.1	Confident	18 Å²	18	30.1 Å²	30.1	11%	0.11	15%	0.154	C	C	.	.	G	3₁₀ helix	trans	-72.5	-13.3	-178.2	62.5	0	0	0	0	114.3	A557 R559 L560	A557-T562 WeakPolarHBondContact CB-OG1 3.45Å; R559-T562 HydrophobicContact CB-CG2 4.45Å; R559-T562 PolarHBondContact O-N 3.46Å; R559-T562 PolarHBondContact O-OG1 2.86Å; L560-T562 VanDerWaalsContact C-N 3.26Å; L560-T562 PolarHBondContact O-N 3.47Å
563	I	85.4	Confident	85.9	Confident	1 Å²	1	31.8 Å²	31.8	1%	0.005	16%	0.163	C	C	.	.	G	3₁₀ helix	trans	-115.7	2.9	-173.9	61	164.5	0	0	0	113.8	A395 V397 I555 A557 L560 S561 N565 A566 I569 Y593	A395-I563 HydrophobicContact CB-CB 3.53Å; A395-I563 HydrophobicContact CB-CD1 4.03Å; A395-I563 HydrophobicContact CB-CG1 4.4Å; A395-I563 HydrophobicContact CB-CG2 3.51Å; V397-I563 HydrophobicContact CG2-CD1 3.16Å; I555-I563 HydrophobicContact CG2-CG2 4.21Å; A557-I563 HydrophobicContact CB-CG2 3.4Å; L560-I563 HydrophobicContact CD2-CD1 3.61Å; L560-I563 HydrophobicContact CD2-CG1 4.34Å; L560-I563 WeakPolarHBondContact O-CG1 3.42Å; L560-I563 PolarHBondContact O-N 3.31Å; S561-I563 PolarHBondContact O-N 2.95Å; I563-N565 PolarHBondContact O-N 2.85Å; I563-A566 VanDerWaalsContact O-CB 3.26Å; I563-A566 WeakPolarHBondContact O-CB 3.32Å; I563-A566 PolarHBondContact O-N 3.43Å; I563-I569 HydrophobicContact CD1-CD1 4.24Å; I563-I569 HydrophobicContact CD1-CG2 4.19Å; I563-Y593 HydrophobicContact CD1-CE2 4.24Å
564	I	84	Confident	85.5	Confident	62 Å²	62	38.7 Å²	38.7	32%	0.318	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.2	-37.8	179.6	-65.2	174.8	0	0	0	110.8	A566	I564-A566 VanDerWaalsContact C-N 3.32Å; I564-A566 PolarHBondContact O-N 3.48Å
565	N	83.9	Confident	85	Confident	138 Å²	138	38.5 Å²	38.5	74%	0.738	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.9	7.9	-178.3	-63.1	-27.1	0	0	0	114	I563	I563-N565 PolarHBondContact O-N 2.85Å
566	A	87.2	Confident	84.8	Confident	10 Å²	10	39.6 Å²	39.6	8%	0.083	20%	0.203	C	C	.	.			trans	-70.1	143.3	176.4	0	0	0	0	0	111.2	T393 A395 I563 I564 Y568 I569	T393-A566 HydrophobicContact CG2-CB 4.28Å; A395-A566 HydrophobicContact CB-CB 3.76Å; I563-A566 VanDerWaalsContact O-CB 3.26Å; I563-A566 WeakPolarHBondContact O-CB 3.32Å; I563-A566 PolarHBondContact O-N 3.43Å; I564-A566 VanDerWaalsContact C-N 3.32Å; I564-A566 PolarHBondContact O-N 3.48Å; A566-Y568 VanDerWaalsContact C-N 3.26Å; A566-Y568 PolarHBondContact O-N 2.95Å; A566-I569 HydrophobicContact CB-CG1 4.29Å
567	D	89.9	Confident	84.8	Confident	70 Å²	70	42.1 Å²	42.1	37%	0.374	22%	0.216	S	C	.	.	S	Bend	trans	-62.7	-37.9	177.5	-66.9	-53.2	0	0	0	111.5	Q392 T393 K582	Q392-D567 WeakPolarHBondContact CA-OD2 2.97Å; T393-D567 PolarHBondContact N-OD2 3.48Å; T393-D567 WeakPolarHBondContact O-CB 3.28Å; T393-D567 PolarHBondContact O-N 2.94Å; D567-K582 WeakPolarHBondContact O-CG 3.27Å
568	Y	91.6	Very high	85.2	Confident	88 Å²	88	48.3 Å²	48.3	35%	0.345	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-143	137.3	175.2	-69.9	-82	0	0	0	110.7	T393 I394 A395 A566	T393-Y568 PolarHBondContact O-N 3.28Å; I394-Y568 WeakPolarHBondContact CA-O 3.18Å; A395-Y568 PolarHBondContact N-O 3.24Å; A566-Y568 VanDerWaalsContact C-N 3.26Å; A566-Y568 PolarHBondContact O-N 2.95Å
569	I	92.5	Very high	85.9	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	132.7	171.6	-55.8	177.4	0	0	0	107.6	A395 V397 I563 A566 M580 G581 H583 L586 Y593	A395-I569 HydrophobicContact CB-CG1 4.17Å; A395-I569 HydrophobicContact CB-CG2 4.48Å; A395-I569 CarbonylContact O-C 3.57Å; A395-I569 WeakPolarHBondContact O-CA 3.5Å; V397-I569 HydrophobicContact CG2-CG2 3.72Å; I563-I569 HydrophobicContact CD1-CD1 4.24Å; I563-I569 HydrophobicContact CD1-CG2 4.19Å; A566-I569 HydrophobicContact CB-CG1 4.29Å; I569-M580 VanDerWaalsContact O-CA 3.32Å; I569-M580 WeakPolarHBondContact O-CA 3.37Å; I569-G581 PolarHBondContact N-O 3.49Å; I569-G581 PolarHBondContact O-N 3.17Å; I569-G581 VanDerWaalsContact O-N 3.1Å; I569-H583 HydrophobicContact CD1-CB 4.01Å; I569-L586 HydrophobicContact CB-CD1 3.63Å; I569-L586 HydrophobicContact CG2-CD1 3.8Å; I569-Y593 HydrophobicContact CD1-CE1 4.42Å; I569-Y593 HydrophobicContact CD1-CE2 3.83Å; I569-Y593 VanDerWaalsContact CD1-OH 3.31Å; I569-Y593 WeakPolarHBondContact CD1-OH 3.24Å; I569-Y593 HydrophobicContact CG2-CD2 3.92Å; I569-Y593 HydrophobicContact CG2-CE2 3.72Å
570	I	92.2	Very high	86.7	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	122.3	-179.2	-56	171	0	0	0	108	L386 I394 A395 L396 V397 I577 M580	L386-I570 HydrophobicContact CD1-CD1 3.32Å; L386-I570 HydrophobicContact CD1-CG1 4.41Å; L386-I570 HydrophobicContact CD2-CD1 3.32Å; L386-I570 HydrophobicContact CG-CD1 3.93Å; I394-I570 HydrophobicContact CG2-CD1 3.37Å; I394-I570 HydrophobicContact CG2-CG1 4Å; A395-I570 PolarHBondContact O-N 2.93Å; L396-I570 HydrophobicContact CD2-CB 4.01Å; L396-I570 HydrophobicContact CD2-CD1 3.99Å; L396-I570 HydrophobicContact CD2-CG2 4.3Å; V397-I570 PolarHBondContact N-O 3.37Å; I570-I577 HydrophobicContact CG2-CB 4.34Å; I570-I577 HydrophobicContact CG2-CD1 3.93Å; I570-I577 HydrophobicContact CG2-CG1 3.8Å; I570-I577 HydrophobicContact CG2-CG2 3.74Å; I570-M580 HydrophobicContact CG1-CG 4.12Å; I570-M580 HydrophobicContact CG1-SD 4.5Å
571	V	91.6	Very high	87.2	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	117.4	179.4	-173.2	0	0	0	0	109.9	V397 R578 E579 L586 L592 Y593 M596	V397-V571 CarbonylContact O-C 3.56Å; V397-V571 WeakPolarHBondContact O-CA 3.36Å; V571-R578 PolarHBondContact O-N 3.48Å; V571-E579 HydrophobicContact CB-CB 3.95Å; V571-E579 HydrophobicContact CG2-CB 3.83Å; V571-E579 PolarHBondContact N-O 3.34Å; V571-L586 HydrophobicContact CG2-CD1 4.31Å; V571-L592 HydrophobicContact CG1-CB 4.13Å; V571-L592 HydrophobicContact CG1-CD2 3.7Å; V571-L592 HydrophobicContact CG1-CG 4.31Å; V571-Y593 HydrophobicContact CG2-CD2 4.22Å; V571-Y593 HydrophobicContact CG2-CG 4.41Å; V571-M596 HydrophobicContact CG1-CE 3.59Å
572	L	89.8	Confident	87.9	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	132.2	177.2	-77.8	165.6	0	0	0	110.7	F384 L396 V397 G398 S402 K404 L407 C576 I577	F384-L572 HydrophobicContact CD2-CD2 3.98Å; F384-L572 HydrophobicContact CE2-CD2 3.66Å; L396-L572 HydrophobicContact CD2-CD1 4.36Å; V397-L572 PolarHBondContact O-N 3.19Å; G398-L572 VanDerWaalsContact CA-O 3.22Å; G398-L572 WeakPolarHBondContact CA-O 3.33Å; S402-L572 WeakPolarHBondContact CB-O 3.32Å; K404-L572 HydrophobicContact CG-CD1 4.02Å; L407-L572 HydrophobicContact CD1-CD1 3.75Å; L572-C576 WeakPolarHBondContact CA-O 3.48Å; L572-I577 HydrophobicContact CD2-CG1 4.24Å
573	D	87	Confident	88.6	Confident	34 Å²	34	50.3 Å²	50.3	18%	0.182	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	128.6	170.8	176.3	48.1	0	0	0	109.1	G575 C576 R578 L592	D573-G575 PolarHBondContact O-N 3.14Å; D573-G575 VanDerWaalsContact O-N 3.11Å; D573-C576 PolarHBondContact N-O 2.94Å; D573-C576 PolarHBondContact O-N 2.97Å; D573-R578 HydrophobicContact CB-CG 3.52Å; D573-R578 IonicContact OD2-CZ 3.41Å; D573-R578 IonicContact OD2-NE 3.17Å; D573-R578 PolarHBondContact OD2-NE 3.06Å; D573-R578 IonicContact OD2-NH2 2.71Å; D573-R578 PolarHBondContact OD2-NH2 3.19Å; D573-L592 HydrophobicContact CB-CD2 4.06Å
574	Q	82.9	Confident	88.7	Confident	146 Å²	146	55.5 Å²	55.5	68%	0.682	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.4	36.3	-178.3	-58.8	-179.8	-6.9	0	0	114	C576	Q574-C576 VanDerWaalsContact C-N 3.32Å; Q574-C576 PolarHBondContact O-N 3.16Å
575	G	81.4	Confident	89.1	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	82.1	2	178.2	0	0	0	0	0	116	I380 V382 S402 D573	I380-G575 WeakPolarHBondContact O-CA 3.41Å; V382-G575 PolarHBondContact N-O 3.35Å; S402-G575 WeakPolarHBondContact O-CA 3.35Å; S402-G575 PolarHBondContact O-N 3.15Å; D573-G575 PolarHBondContact O-N 3.14Å; D573-G575 VanDerWaalsContact O-N 3.11Å
576	C	86.5	Confident	89.3	Confident	40 Å²	40	50.8 Å²	50.8	27%	0.27	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	149.7	178.1	-66.3	0	0	0	0	111.1	V382 L572 D573 Q574 R578	V382-C576 PolarHBondContact O-SG 2.92Å; L572-C576 WeakPolarHBondContact CA-O 3.48Å; D573-C576 PolarHBondContact N-O 2.94Å; D573-C576 PolarHBondContact O-N 2.97Å; Q574-C576 VanDerWaalsContact C-N 3.32Å; Q574-C576 PolarHBondContact O-N 3.16Å; C576-R578 PolarHBondContact O-N 3.38Å
577	I	90	Very high	89.4	Confident	53 Å²	53	51.6 Å²	51.6	27%	0.272	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	120.7	168.4	-58.5	176.3	0	0	0	108.4	F384 C385 L386 I570 L572 M580	F384-I577 HydrophobicContact CD2-CD1 4.07Å; F384-I577 HydrophobicContact CD2-CG1 3.79Å; F384-I577 HydrophobicContact CE2-CD1 3.54Å; F384-I577 HydrophobicContact CE2-CG1 3.4Å; F384-I577 VanDerWaalsContact CE2-CG1 3.4Å; F384-I577 HydrophobicContact CZ-CD1 3.99Å; F384-I577 HydrophobicContact CZ-CG1 4.32Å; C385-I577 WeakPolarHBondContact O-CD1 3.5Å; L386-I577 HydrophobicContact CB-CD1 4.32Å; I570-I577 HydrophobicContact CG2-CB 4.34Å; I570-I577 HydrophobicContact CG2-CD1 3.93Å; I570-I577 HydrophobicContact CG2-CG1 3.8Å; I570-I577 HydrophobicContact CG2-CG2 3.74Å; L572-I577 HydrophobicContact CD2-CG1 4.24Å; I577-M580 HydrophobicContact CG2-CB 4.43Å
578	R	89.7	Confident	89.3	Confident	138 Å²	138	56.6 Å²	56.6	52%	0.521	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	-43.6	176.2	-65.8	-61.9	-167.5	-176	-1	112.6	V571 D573 C576	V571-R578 PolarHBondContact O-N 3.48Å; D573-R578 HydrophobicContact CB-CG 3.52Å; D573-R578 IonicContact OD2-CZ 3.41Å; D573-R578 IonicContact OD2-NE 3.17Å; D573-R578 PolarHBondContact OD2-NE 3.06Å; D573-R578 IonicContact OD2-NH2 2.71Å; D573-R578 PolarHBondContact OD2-NH2 3.19Å; C576-R578 PolarHBondContact O-N 3.38Å
579	E	90.7	Very high	89.1	Confident	33 Å²	33	58 Å²	58	15%	0.154	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	145.4	-175.9	-69.5	159.5	-147.2	0	0	109.4	V571 L586 G591 L592 Y593	V571-E579 HydrophobicContact CB-CB 3.95Å; V571-E579 HydrophobicContact CG2-CB 3.83Å; V571-E579 PolarHBondContact N-O 3.34Å; E579-L586 HydrophobicContact CB-CD2 3.86Å; E579-G591 WeakPolarHBondContact OE1-CA 3.45Å; E579-L592 PolarHBondContact OE1-N 3.38Å; E579-L592 PolarHBondContact OE2-N 3.14Å; E579-Y593 WeakPolarHBondContact OE2-CB 3.33Å; E579-Y593 PolarHBondContact OE2-N 3.45Å; E579-Y593 VanDerWaalsContact OE2-N 3.09Å
580	M	91.3	Very high	88.6	Confident	110 Å²	110	63.7 Å²	63.7	54%	0.542	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	130	175.6	-178.3	179.9	75.1	0	0	109.1	L386 I569 I570 I577	L386-M580 HydrophobicContact CD1-SD 4.31Å; I569-M580 VanDerWaalsContact O-CA 3.32Å; I569-M580 WeakPolarHBondContact O-CA 3.37Å; I570-M580 HydrophobicContact CG1-CG 4.12Å; I570-M580 HydrophobicContact CG1-SD 4.5Å; I577-M580 HydrophobicContact CG2-CB 4.43Å
581	G	91.2	Very high	88.4	Confident	4 Å²	4	64.5 Å²	64.5	4%	0.041	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	171	-178.3	179.7	0	0	0	0	0	112.6	I569	I569-G581 PolarHBondContact N-O 3.49Å; I569-G581 PolarHBondContact O-N 3.17Å; I569-G581 VanDerWaalsContact O-N 3.1Å
582	K	91.5	Very high	88.1	Confident	109 Å²	109	67.5 Å²	67.5	47%	0.474	33%	0.331	S	S	.	.			trans	-72.3	158.3	169.6	-67.5	-178.9	177.3	-174.1	0	110.6	D567 N584 E585 L586	D567-K582 WeakPolarHBondContact O-CG 3.27Å; K582-N584 VanDerWaalsContact C-N 3.32Å; K582-N584 PolarHBondContact O-N 3Å; K582-E585 HydrophobicContact CB-CB 4.49Å; K582-E585 HydrophobicContact CB-CG 4.16Å; K582-E585 PolarHBondContact N-OE2 3.47Å; K582-E585 WeakPolarHBondContact O-CA 3.41Å; K582-E585 WeakPolarHBondContact O-CB 3.21Å; K582-E585 PolarHBondContact O-N 3.1Å; K582-L586 PolarHBondContact O-N 3.13Å
583	H	89.3	Confident	88	Confident	21 Å²	21	67.5 Å²	67.5	10%	0.097	33%	0.331	C	S	.	.	H	α-helix	trans	-44.8	-53.8	176.3	175.9	70.4	0	0	0	113.1	I569 E585 L586 L587 Y593 Y597	I569-H583 HydrophobicContact CD1-CB 4.01Å; H583-E585 VanDerWaalsContact C-N 3.28Å; H583-E585 PolarHBondContact O-N 3.07Å; H583-L586 PolarHBondContact O-N 3Å; H583-L587 VanDerWaalsContact NE2-CD1 3.31Å; H583-L587 WeakPolarHBondContact NE2-CD1 3.3Å; H583-L587 WeakPolarHBondContact O-CG 3.02Å; H583-L587 PolarHBondContact O-N 3.33Å; H583-Y593 AromaticContact ND1-CE1 3.59Å; H583-Y593 AromaticContact ND1-CZ 3.63Å; H583-Y593 PolarHBondContact ND1-OH 3.11Å; H583-Y597 AromaticContact CE1-CD2 3.94Å; H583-Y597 AromaticContact CE1-CE2 3.59Å; H583-Y597 AromaticContact CE1-CZ 3.93Å
584	N	89.4	Confident	88	Confident	110 Å²	110	66 Å²	66	59%	0.588	32%	0.323	S	S	*	.	H	α-helix	trans	-66.1	-25.6	-179.9	-67.9	-22.1	0	0	0	114.2	K582 K588	K582-N584 VanDerWaalsContact C-N 3.32Å; K582-N584 PolarHBondContact O-N 3Å; N584-K588 WeakPolarHBondContact O-CD 3.44Å; N584-K588 VanDerWaalsContact O-CG 3.27Å; N584-K588 WeakPolarHBondContact O-CG 3.48Å
585	E	91.3	Very high	88.1	Confident	100 Å²	100	63.5 Å²	63.5	47%	0.467	32%	0.318	S	S	.	.	H	α-helix	trans	-78.3	-44.1	177.7	-65.9	168.3	177	0	0	110.1	K582 H583 K588 L589	K582-E585 HydrophobicContact CB-CB 4.49Å; K582-E585 HydrophobicContact CB-CG 4.16Å; K582-E585 PolarHBondContact N-OE2 3.47Å; K582-E585 WeakPolarHBondContact O-CA 3.41Å; K582-E585 WeakPolarHBondContact O-CB 3.21Å; K582-E585 PolarHBondContact O-N 3.1Å; H583-E585 VanDerWaalsContact C-N 3.28Å; H583-E585 PolarHBondContact O-N 3.07Å; E585-K588 PolarHBondContact O-N 3.23Å; E585-L589 WeakPolarHBondContact O-CG 3.42Å; E585-L589 PolarHBondContact O-N 3.45Å
586	L	89	Confident	88.2	Confident	0 Å²	0	65.5 Å²	65.5	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-67.2	-36	178.5	-66	-173.4	0	0	0	112.9	I569 V571 E579 K582 H583 K588 L589 Y593	I569-L586 HydrophobicContact CB-CD1 3.63Å; I569-L586 HydrophobicContact CG2-CD1 3.8Å; V571-L586 HydrophobicContact CG2-CD1 4.31Å; E579-L586 HydrophobicContact CB-CD2 3.86Å; K582-L586 PolarHBondContact O-N 3.13Å; H583-L586 PolarHBondContact O-N 3Å; L586-K588 VanDerWaalsContact C-N 3.33Å; L586-K588 PolarHBondContact O-N 2.86Å; L586-L589 HydrophobicContact CD2-CD1 4.07Å; L586-L589 PolarHBondContact O-N 2.95Å; L586-Y593 HydrophobicContact CB-CD1 3.37Å; L586-Y593 HydrophobicContact CB-CE1 4.07Å; L586-Y593 HydrophobicContact CB-CG 3.8Å; L586-Y593 HydrophobicContact CD1-CD1 4.07Å; L586-Y593 HydrophobicContact CD1-CD2 4.1Å; L586-Y593 HydrophobicContact CD1-CG 3.8Å; L586-Y593 HydrophobicContact CG-CD1 4.39Å; L586-Y593 HydrophobicContact CG-CG 4.47Å
587	L	88.1	Confident	88.1	Confident	28 Å²	28	65 Å²	65	15%	0.147	32%	0.321	C	S	.	.	H	α-helix	trans	-62.6	-39.6	172.7	-74.2	-179.2	0	0	0	112.1	H583 L589 N590 Y593 A594 Y597	H583-L587 VanDerWaalsContact NE2-CD1 3.31Å; H583-L587 WeakPolarHBondContact NE2-CD1 3.3Å; H583-L587 WeakPolarHBondContact O-CG 3.02Å; H583-L587 PolarHBondContact O-N 3.33Å; L587-L589 VanDerWaalsContact C-N 3.27Å; L587-L589 PolarHBondContact O-N 3.27Å; L587-N590 PolarHBondContact O-N 3.48Å; L587-N590 PolarHBondContact O-OD1 3.43Å; L587-Y593 HydrophobicContact CD2-CD1 4.28Å; L587-Y593 HydrophobicContact CD2-CE1 4.13Å; L587-Y593 HydrophobicContact CG-CE1 4.21Å; L587-A594 HydrophobicContact CD2-CB 4.29Å; L587-Y597 HydrophobicContact CD1-CE1 4.47Å; L587-Y597 HydrophobicContact CD2-CD1 3.59Å; L587-Y597 HydrophobicContact CD2-CE1 4.26Å; L587-Y597 HydrophobicContact CD2-CG 3.85Å
588	K	88.1	Confident	87.6	Confident	175 Å²	175	68.7 Å²	68.7	76%	0.761	33%	0.332	S	S	*	.	H	α-helix	trans	-67.1	-26.9	177.9	-74	173.1	-175.9	-179.5	0	113.3	N584 E585 L586 N590	N584-K588 WeakPolarHBondContact O-CD 3.44Å; N584-K588 VanDerWaalsContact O-CG 3.27Å; N584-K588 WeakPolarHBondContact O-CG 3.48Å; E585-K588 PolarHBondContact O-N 3.23Å; L586-K588 VanDerWaalsContact C-N 3.33Å; L586-K588 PolarHBondContact O-N 2.86Å; K588-N590 PolarHBondContact O-N 3.38Å
589	L	86.9	Confident	87	Confident	118 Å²	118	64.3 Å²	64.3	62%	0.618	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.9	-14.9	177.9	-69	172.1	0	0	0	112.8	E585 L586 L587 G591	E585-L589 WeakPolarHBondContact O-CG 3.42Å; E585-L589 PolarHBondContact O-N 3.45Å; L586-L589 HydrophobicContact CD2-CD1 4.07Å; L586-L589 PolarHBondContact O-N 2.95Å; L587-L589 VanDerWaalsContact C-N 3.27Å; L587-L589 PolarHBondContact O-N 3.27Å; L589-G591 PolarHBondContact O-N 2.97Å; L589-G591 VanDerWaalsContact O-N 3.13Å
590	N	83.5	Confident	86	Confident	119 Å²	119	64.6 Å²	64.6	64%	0.636	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.1	35.7	-174.8	-75.8	-24.4	0	0	0	113	L587 K588	L587-N590 PolarHBondContact O-N 3.48Å; L587-N590 PolarHBondContact O-OD1 3.43Å; K588-N590 PolarHBondContact O-N 3.38Å
591	G	86.5	Confident	84.3	Confident	16 Å²	16	61.2 Å²	61.2	17%	0.165	31%	0.314	C	S	.	.	S	Bend	trans	-85.9	-158.3	-177.7	0	0	0	0	0	114.2	E579 L589 Y593 A594 T595	E579-G591 WeakPolarHBondContact OE1-CA 3.45Å; L589-G591 PolarHBondContact O-N 2.97Å; L589-G591 VanDerWaalsContact O-N 3.13Å; G591-Y593 VanDerWaalsContact C-N 3.28Å; G591-Y593 PolarHBondContact O-N 3.43Å; G591-A594 PolarHBondContact O-N 3.16Å; G591-T595 PolarHBondContact O-N 2.85Å; G591-T595 PolarHBondContact O-OG1 3.1Å
592	L	86.2	Confident	82.4	Confident	63 Å²	63	62.5 Å²	62.5	33%	0.33	33%	0.327	S	S	.	.	H	α-helix	trans	-62	-36	175.4	-161.8	77.3	0	0	0	111.1	V571 D573 E579 T595 M596	V571-L592 HydrophobicContact CG1-CB 4.13Å; V571-L592 HydrophobicContact CG1-CD2 3.7Å; V571-L592 HydrophobicContact CG1-CG 4.31Å; D573-L592 HydrophobicContact CB-CD2 4.06Å; E579-L592 PolarHBondContact OE1-N 3.38Å; E579-L592 PolarHBondContact OE2-N 3.14Å; L592-T595 PolarHBondContact O-N 3.38Å; L592-M596 HydrophobicContact CD2-CE 4.07Å; L592-M596 HydrophobicContact CG-CE 3.97Å; L592-M596 WeakPolarHBondContact O-CG 3.38Å; L592-M596 PolarHBondContact O-N 3.37Å
593	Y	88.6	Confident	80.4	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-60.4	-51.1	173.1	-177.3	-105.3	0	0	0	112	L560 I563 I569 V571 E579 H583 L586 L587 G591 T595 M596 Y597	L560-Y593 HydrophobicContact CD2-CD2 4.39Å; L560-Y593 HydrophobicContact CD2-CE2 3.71Å; I563-Y593 HydrophobicContact CD1-CE2 4.24Å; I569-Y593 HydrophobicContact CD1-CE1 4.42Å; I569-Y593 HydrophobicContact CD1-CE2 3.83Å; I569-Y593 VanDerWaalsContact CD1-OH 3.31Å; I569-Y593 WeakPolarHBondContact CD1-OH 3.24Å; I569-Y593 HydrophobicContact CG2-CD2 3.92Å; I569-Y593 HydrophobicContact CG2-CE2 3.72Å; V571-Y593 HydrophobicContact CG2-CD2 4.22Å; V571-Y593 HydrophobicContact CG2-CG 4.41Å; E579-Y593 WeakPolarHBondContact OE2-CB 3.33Å; E579-Y593 PolarHBondContact OE2-N 3.45Å; E579-Y593 VanDerWaalsContact OE2-N 3.09Å; H583-Y593 AromaticContact ND1-CE1 3.59Å; H583-Y593 AromaticContact ND1-CZ 3.63Å; H583-Y593 PolarHBondContact ND1-OH 3.11Å; L586-Y593 HydrophobicContact CB-CD1 3.37Å; L586-Y593 HydrophobicContact CB-CE1 4.07Å; L586-Y593 HydrophobicContact CB-CG 3.8Å; L586-Y593 HydrophobicContact CD1-CD1 4.07Å; L586-Y593 HydrophobicContact CD1-CD2 4.1Å; L586-Y593 HydrophobicContact CD1-CG 3.8Å; L586-Y593 HydrophobicContact CG-CD1 4.39Å; L586-Y593 HydrophobicContact CG-CG 4.47Å; L587-Y593 HydrophobicContact CD2-CD1 4.28Å; L587-Y593 HydrophobicContact CD2-CE1 4.13Å; L587-Y593 HydrophobicContact CG-CE1 4.21Å; G591-Y593 VanDerWaalsContact C-N 3.28Å; G591-Y593 PolarHBondContact O-N 3.43Å; Y593-T595 VanDerWaalsContact C-N 3.26Å; Y593-T595 PolarHBondContact O-N 3.44Å; Y593-M596 PolarHBondContact O-N 3.39Å; Y593-Y597 WeakPolarHBondContact O-CB 3.25Å; Y593-Y597 PolarHBondContact O-N 2.95Å
594	A	86.2	Confident	78.5	Confident	3 Å²	3	60.7 Å²	60.7	3%	0.025	32%	0.323	C	S	.	.	H	α-helix	trans	-62	-38.2	-179.6	0	0	0	0	0	111.1	L587 G591 Y597 Y598	L587-A594 HydrophobicContact CD2-CB 4.29Å; G591-A594 PolarHBondContact O-N 3.16Å; A594-Y597 PolarHBondContact O-N 3.29Å; A594-Y598 HydrophobicContact CB-CD2 4.36Å; A594-Y598 HydrophobicContact CB-CE2 4.12Å; A594-Y598 WeakPolarHBondContact O-CD2 3.39Å; A594-Y598 PolarHBondContact O-N 2.99Å
595	T	85	Confident	76.1	Confident	93 Å²	93	60.5 Å²	60.5	57%	0.571	32%	0.317	S	S	*	.	H	α-helix	trans	-62.9	-45.6	175.1	-53.5	0	0	0	0	111.7	G591 L592 Y593 Y597 G599	G591-T595 PolarHBondContact O-N 2.85Å; G591-T595 PolarHBondContact O-OG1 3.1Å; L592-T595 PolarHBondContact O-N 3.38Å; Y593-T595 VanDerWaalsContact C-N 3.26Å; Y593-T595 PolarHBondContact O-N 3.44Å; T595-Y597 VanDerWaalsContact C-N 3.35Å; T595-G599 PolarHBondContact O-N 2.67Å
596	M	83.6	Confident	73.6	Confident	43 Å²	43	58.7 Å²	58.7	21%	0.212	31%	0.309	C	S	.	.	H	α-helix	trans	-65.5	-39	174.8	-71.7	-172.4	-80	0	0	111.6	V397 L560 V571 L592 Y593 G599 Q600	V397-M596 HydrophobicContact CG1-CE 3.71Å; V397-M596 HydrophobicContact CG1-SD 3.94Å; L560-M596 HydrophobicContact CD1-CB 4Å; L560-M596 WeakPolarHBondContact CD1-O 2.77Å; V571-M596 HydrophobicContact CG1-CE 3.59Å; L592-M596 HydrophobicContact CD2-CE 4.07Å; L592-M596 HydrophobicContact CG-CE 3.97Å; L592-M596 WeakPolarHBondContact O-CG 3.38Å; L592-M596 PolarHBondContact O-N 3.37Å; Y593-M596 PolarHBondContact O-N 3.39Å; M596-G599 PolarHBondContact O-N 2.9Å; M596-Q600 PolarHBondContact O-N 2.78Å
597	Y	83.2	Confident	71.4	Confident	30 Å²	30	61.3 Å²	61.3	12%	0.118	32%	0.321	C	S	.	.	H	α-helix	trans	-63.6	-57.9	178.2	-174.7	-97	0	0	0	111.2	L560 H583 L587 Y593 A594 T595 G599 Q600 E601	L560-Y597 HydrophobicContact CB-CD2 4.22Å; L560-Y597 HydrophobicContact CD1-CD2 4.36Å; H583-Y597 AromaticContact CE1-CD2 3.94Å; H583-Y597 AromaticContact CE1-CE2 3.59Å; H583-Y597 AromaticContact CE1-CZ 3.93Å; L587-Y597 HydrophobicContact CD1-CE1 4.47Å; L587-Y597 HydrophobicContact CD2-CD1 3.59Å; L587-Y597 HydrophobicContact CD2-CE1 4.26Å; L587-Y597 HydrophobicContact CD2-CG 3.85Å; Y593-Y597 WeakPolarHBondContact O-CB 3.25Å; Y593-Y597 PolarHBondContact O-N 2.95Å; A594-Y597 PolarHBondContact O-N 3.29Å; T595-Y597 VanDerWaalsContact C-N 3.35Å; Y597-G599 PolarHBondContact O-N 3.02Å; Y597-Q600 CarbonylContact O-C 3.59Å; Y597-Q600 PolarHBondContact O-N 2.91Å; Y597-E601 HydrophobicContact CD1-CB 4.48Å; Y597-E601 HydrophobicContact CD1-CG 4.4Å; Y597-E601 HydrophobicContact CE1-CB 4.26Å; Y597-E601 HydrophobicContact CE1-CG 3.72Å; Y597-E601 VanDerWaalsContact CE1-OE1 3.24Å; Y597-E601 WeakPolarHBondContact CE1-OE1 3.47Å; Y597-E601 HydrophobicContact CE2-CG 4.49Å; Y597-E601 VanDerWaalsContact CZ-CD 3.48Å; Y597-E601 VanDerWaalsContact CZ-OE1 3.26Å; Y597-E601 WeakPolarHBondContact O-CB 3.35Å; Y597-E601 PolarHBondContact O-N 3.22Å; Y597-E601 VanDerWaalsContact OH-CD 3.31Å; Y597-E601 PolarHBondContact OH-OE1 3.17Å
598	Y	81.2	Confident	69.1	Low	129 Å²	129	64.7 Å²	64.7	51%	0.506	34%	0.336	S	S	.	.	H	α-helix	trans	-63.1	-30.7	177.8	-64.7	-56.9	0	0	0	112.8	A594 G602	A594-Y598 HydrophobicContact CB-CD2 4.36Å; A594-Y598 HydrophobicContact CB-CE2 4.12Å; A594-Y598 WeakPolarHBondContact O-CD2 3.39Å; A594-Y598 PolarHBondContact O-N 2.99Å; Y598-G602 PolarHBondContact O-N 3.33Å
599	G	75.8	Confident	66.6	Low	46 Å²	46	62 Å²	62	47%	0.474	33%	0.329	S	S	.	.	H	α-helix	trans	-65.2	-35.4	172.6	0	0	0	0	0	113.5	T595 M596 Y597 I603	T595-G599 PolarHBondContact O-N 2.67Å; M596-G599 PolarHBondContact O-N 2.9Å; Y597-G599 PolarHBondContact O-N 3.02Å; G599-I603 WeakPolarHBondContact O-CD1 3.18Å; G599-I603 WeakPolarHBondContact O-CG1 3.24Å
600	Q	70.6	Confident	64.5	Low	39 Å²	39	58.9 Å²	58.9	18%	0.182	32%	0.318	C	S	.	.	H	α-helix	trans	-87	-30.5	173.6	-72.7	-170.4	-1.9	0	0	113.2	H558 L560 M596 Y597 G602 I603 D604	H558-Q600 PolarHBondContact O-NE2 2.92Å; H558-Q600 PolarHBondContact O-OE1 3.48Å; L560-Q600 HydrophobicContact CD1-CB 4.17Å; L560-Q600 HydrophobicContact CD1-CG 4.13Å; M596-Q600 PolarHBondContact O-N 2.78Å; Y597-Q600 CarbonylContact O-C 3.59Å; Y597-Q600 PolarHBondContact O-N 2.91Å; Q600-G602 VanDerWaalsContact C-N 3.28Å; Q600-G602 PolarHBondContact O-N 3.44Å; Q600-I603 CarbonylContact O-C 3.59Å; Q600-I603 WeakPolarHBondContact O-CA 3.35Å; Q600-I603 WeakPolarHBondContact O-CB 3.37Å; Q600-I603 PolarHBondContact O-N 3.37Å; Q600-D604 WeakPolarHBondContact O-CB 3.32Å; Q600-D604 PolarHBondContact O-N 3.17Å
601	E	55.9	Low	62.4	Low	39 Å²	39	57 Å²	57	18%	0.182	31%	0.31	C	S	.	.	H	α-helix	trans	-69.5	-28.4	-179.3	-129	-163.9	-172.9	0	0	111.7	Y597 K605	Y597-E601 HydrophobicContact CD1-CB 4.48Å; Y597-E601 HydrophobicContact CD1-CG 4.4Å; Y597-E601 HydrophobicContact CE1-CB 4.26Å; Y597-E601 HydrophobicContact CE1-CG 3.72Å; Y597-E601 VanDerWaalsContact CE1-OE1 3.24Å; Y597-E601 WeakPolarHBondContact CE1-OE1 3.47Å; Y597-E601 HydrophobicContact CE2-CG 4.49Å; Y597-E601 VanDerWaalsContact CZ-CD 3.48Å; Y597-E601 VanDerWaalsContact CZ-OE1 3.26Å; Y597-E601 WeakPolarHBondContact O-CB 3.35Å; Y597-E601 PolarHBondContact O-N 3.22Å; Y597-E601 VanDerWaalsContact OH-CD 3.31Å; Y597-E601 PolarHBondContact OH-OE1 3.17Å; E601-K605 HydrophobicContact CG-CD 4.2Å; E601-K605 HydrophobicContact CG-CG 4.28Å; E601-K605 WeakPolarHBondContact O-CB 3.21Å; E601-K605 WeakPolarHBondContact O-CG 3.44Å; E601-K605 PolarHBondContact O-N 3.46Å; E601-K605 VanDerWaalsContact OE1-CE 3.27Å; E601-K605 WeakPolarHBondContact OE1-CE 3.42Å; E601-K605 IonicContact OE1-NZ 3.96Å; E601-K605 PolarHBondContact OE1-NZ 3.31Å; E601-K605 IonicContact OE2-NZ 2.72Å; E601-K605 PolarHBondContact OE2-NZ 3.18Å
602	G	51	Low	60	Low	31 Å²	31	61.9 Å²	61.9	32%	0.32	33%	0.333	S	S	.	.	H	α-helix	trans	-55.2	-57.9	162.5	0	0	0	0	0	109.2	Y598 Q600 D604 E606	Y598-G602 PolarHBondContact O-N 3.33Å; Q600-G602 VanDerWaalsContact C-N 3.28Å; Q600-G602 PolarHBondContact O-N 3.44Å; G602-D604 VanDerWaalsContact C-N 3.31Å; G602-D604 PolarHBondContact O-N 3.1Å; G602-E606 VanDerWaalsContact O-CB 3.28Å; G602-E606 WeakPolarHBondContact O-CB 3.47Å; G602-E606 WeakPolarHBondContact O-CG 3.45Å; G602-E606 PolarHBondContact O-N 2.94Å
603	I	50	Low	57.5	Low	64 Å²	64	66.9 Å²	66.9	33%	0.328	36%	0.36	S	S	.	.	H	α-helix	trans	-61.2	-33.5	-177.7	-54.3	168.9	0	0	0	113.5	G599 Q600 Q607	G599-I603 WeakPolarHBondContact O-CD1 3.18Å; G599-I603 WeakPolarHBondContact O-CG1 3.24Å; Q600-I603 CarbonylContact O-C 3.59Å; Q600-I603 WeakPolarHBondContact O-CA 3.35Å; Q600-I603 WeakPolarHBondContact O-CB 3.37Å; Q600-I603 PolarHBondContact O-N 3.37Å; I603-Q607 VanDerWaalsContact O-CG 3.3Å; I603-Q607 WeakPolarHBondContact O-CG 3.24Å; I603-Q607 PolarHBondContact O-NE2 2.87Å
604	D	48.3	Very low	54.8	Low	29 Å²	29	75.7 Å²	75.7	16%	0.155	40%	0.401	C	S	.	.	H	α-helix	trans	-92.1	-42.6	-173	-74.6	-18.5	0	0	0	112.9	Q600 G602 E606 Q607 E608	Q600-D604 WeakPolarHBondContact O-CB 3.32Å; Q600-D604 PolarHBondContact O-N 3.17Å; G602-D604 VanDerWaalsContact C-N 3.31Å; G602-D604 PolarHBondContact O-N 3.1Å; D604-E606 PolarHBondContact O-N 2.89Å; D604-Q607 CarbonylContact O-C 3.57Å; D604-Q607 WeakPolarHBondContact O-CA 3.44Å; D604-Q607 PolarHBondContact O-N 2.67Å; D604-E608 PolarHBondContact O-N 3.2Å
605	K	39.8	Very low	52.1	Low	106 Å²	106	81.8 Å²	81.8	46%	0.461	44%	0.438	S	S	.	.	H	α-helix	trans	-61.4	-29.8	174.8	-79.9	175.4	171.9	158	0	111.6	E601 Q607 D609	E601-K605 HydrophobicContact CG-CD 4.2Å; E601-K605 HydrophobicContact CG-CG 4.28Å; E601-K605 WeakPolarHBondContact O-CB 3.21Å; E601-K605 WeakPolarHBondContact O-CG 3.44Å; E601-K605 PolarHBondContact O-N 3.46Å; E601-K605 VanDerWaalsContact OE1-CE 3.27Å; E601-K605 WeakPolarHBondContact OE1-CE 3.42Å; E601-K605 IonicContact OE1-NZ 3.96Å; E601-K605 PolarHBondContact OE1-NZ 3.31Å; E601-K605 IonicContact OE2-NZ 2.72Å; E601-K605 PolarHBondContact OE2-NZ 3.18Å; K605-Q607 VanDerWaalsContact C-N 3.34Å; K605-D609 WeakPolarHBondContact O-CB 3.35Å; K605-D609 PolarHBondContact O-N 2.77Å; K605-D609 VanDerWaalsContact O-N 3.13Å
606	E	39.1	Very low	49.5	Very low	62 Å²	62	84.6 Å²	84.6	29%	0.29	45%	0.449	S	S	.	.	H	α-helix	trans	-84.3	-14.6	179.5	-62.6	173.6	132.9	0	0	113.8	G602 D604 T1254	G602-E606 VanDerWaalsContact O-CB 3.28Å; G602-E606 WeakPolarHBondContact O-CB 3.47Å; G602-E606 WeakPolarHBondContact O-CG 3.45Å; G602-E606 PolarHBondContact O-N 2.94Å; D604-E606 PolarHBondContact O-N 2.89Å; E606-T1254 HydrophobicContact CB-CG2 3.33Å; E606-T1254 WeakPolarHBondContact CB-OG1 3.48Å; E606-T1254 HydrophobicContact CG-CG2 3.34Å; E606-T1254 VanDerWaalsContact OE1-CA 3.31Å; E606-T1254 WeakPolarHBondContact OE1-CA 3.46Å; E606-T1254 WeakPolarHBondContact OE1-CB 3.43Å; E606-T1254 VanDerWaalsContact OE1-CG2 3.25Å; E606-T1254 WeakPolarHBondContact OE1-CG2 3.48Å; E606-T1254 WeakPolarHBondContact OE2-CA 3.21Å; E606-T1254 WeakPolarHBondContact OE2-CB 3.39Å
607	Q	42.3	Very low	46.8	Very low	55 Å²	55	91.2 Å²	91.2	26%	0.257	48%	0.48	S	S	.	.	H	α-helix	trans	-86.2	-34.2	165.9	-76.8	174	34.4	0	0	112.2	I603 D604 K605 S610 L1251	I603-Q607 VanDerWaalsContact O-CG 3.3Å; I603-Q607 WeakPolarHBondContact O-CG 3.24Å; I603-Q607 PolarHBondContact O-NE2 2.87Å; D604-Q607 CarbonylContact O-C 3.57Å; D604-Q607 WeakPolarHBondContact O-CA 3.44Å; D604-Q607 PolarHBondContact O-N 2.67Å; K605-Q607 VanDerWaalsContact C-N 3.34Å; Q607-S610 PolarHBondContact O-OG 3.27Å; Q607-L1251 HydrophobicContact CG-CD2 4.43Å
608	E	39.1	Very low	44.3	Very low	98 Å²	98	97.8 Å²	97.8	46%	0.458	52%	0.516	S	S	.	.	H	α-helix	trans	-74.3	-38.6	180	-72.9	-176.3	157.6	0	0	112.9	D604 S610 T611	D604-E608 PolarHBondContact O-N 3.2Å; E608-S610 PolarHBondContact O-N 3.5Å; E608-T611 PolarHBondContact O-N 3.43Å; E608-T611 VanDerWaalsContact O-N 3.14Å; E608-T611 PolarHBondContact O-OG1 3.17Å
609	D	36.8	Very low	41.8	Very low	118 Å²	118	100.3 Å²	100.3	63%	0.631	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69	8.9	175.3	-85.1	-5.3	0	0	0	114.5	K605 K1250	K605-D609 WeakPolarHBondContact O-CB 3.35Å; K605-D609 PolarHBondContact O-N 2.77Å; K605-D609 VanDerWaalsContact O-N 3.13Å; D609-K1250 PolarHBondContact O-NZ 3.36Å
610	S	42	Very low	39.5	Very low	53 Å²	53	105.4 Å²	105.4	37%	0.371	55%	0.549	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.8	-1.9	176.3	71.4	0	0	0	0	113.6	Q607 E608	Q607-S610 PolarHBondContact O-OG 3.27Å; E608-S610 PolarHBondContact O-N 3.5Å
611	T	39.2	Very low	37.7	Very low	79 Å²	79	111.4 Å²	111.4	49%	0.485	58%	0.583	S	S	.	*	T	Hydrogen-bonded Turn	trans	-128.2	1	-172	47.5	0	0	0	0	116.4	E608	E608-T611 PolarHBondContact O-N 3.43Å; E608-T611 VanDerWaalsContact O-N 3.14Å; E608-T611 PolarHBondContact O-OG1 3.17Å
612	D	35.5	Very low	36.4	Very low	119 Å²	119	112.6 Å²	112.6	64%	0.636	61%	0.605	S	S	*	*	S	Bend	trans	-105.2	10.6	-171	-75.8	-7.9	0	0	0	116.1
613	D	33.8	Very low	35.5	Very low	168 Å²	168	116.7 Å²	116.7	90%	0.898	63%	0.629	S	S	*	*	S	Bend	trans	-108.5	8.8	179.5	-79.6	-26.7	0	0	0	115.9
614	E	32.2	Very low	34.4	Very low	186 Å²	186	123 Å²	123	87%	0.869	65%	0.654	S	S	*	*	S	Bend	trans	-126.1	52.4	178.4	-71.9	-165	166	0	0	114
615	V	30.4	Very low	33.6	Very low	131 Å²	131	133 Å²	133	79%	0.794	69%	0.689	S	S	*	*	S	Bend	trans	-147.2	77.5	162	-166.9	0	0	0	0	110.8
616	D	28.9	Very low	33.3	Very low	151 Å²	151	135.5 Å²	135.5	81%	0.807	70%	0.703	S	S	*	*	S	Bend	trans	174.2	93.3	143.9	-96.9	-18.2	0	0	0	110.5
617	H	28.1	Very low	32.8	Very low	183 Å²	183	141.2 Å²	141.2	85%	0.847	73%	0.734	S	S	*	*			trans	167.1	95.1	146.7	-91.8	-53.4	0	0	0	109.1
618	N	29.5	Very low	32.3	Very low	167 Å²	167	143.9 Å²	143.9	89%	0.893	76%	0.755	S	S	*	*			trans	176.6	72	139.2	-87	-22	0	0	0	109.9
619	Q	29.2	Very low	31.7	Very low	182 Å²	182	146.7 Å²	146.7	85%	0.85	77%	0.773	S	S	*	*			trans	-93.8	138.7	145.4	-72.4	-179.3	3.7	0	0	107
620	N	28.5	Very low	31.4	Very low	153 Å²	153	149.9 Å²	149.9	82%	0.818	78%	0.783	S	S	*	*			trans	87.2	83.5	174.9	-57	-22	0	0	0	118.2
621	D	32.7	Very low	30.7	Very low	166 Å²	166	156 Å²	156	89%	0.888	81%	0.806	S	S	*	*				-177.4	125	121.6	-106.1	-16.3	0	0	0	107.1
622	G	28	Very low	30.3	Very low	63 Å²	63	157.6 Å²	157.6	65%	0.649	82%	0.817	S	S	*	*			cis	97.7	53.4	31.8	0	0	0	0	0	111.4
623	S	31.7	Very low	30	Very low	118 Å²	118	156.7 Å²	156.7	83%	0.825	82%	0.82	S	S	*	*			trans	-174.1	109.2	148.4	-90.7	0	0	0	0	115.5
624	K	27.7	Very low	29.8	Very low	195 Å²	195	154 Å²	154	85%	0.848	81%	0.812	S	S	*	*			trans	4	126.6	135	-60.3	172.3	178.3	174.2	0	116.4
625	R	32.2	Very low	29.7	Very low	239 Å²	239	154.8 Å²	154.8	90%	0.902	81%	0.813	S	S	*	*			trans	-167.7	102.1	134.3	-103.9	157.2	-170.8	-174	3.9	112.8
626	H	31.8	Very low	29.7	Very low	159 Å²	159	154.6 Å²	154.6	74%	0.736	81%	0.814	S	S	*	*			trans	45	103.6	137.8	-70.7	-75.2	0	0	0	120.1	T628	H626-T628 HydrophobicContact CB-CG2 4.48Å; H626-T628 PolarHBondContact O-N 3.14Å
627	L	28.4	Very low	29.7	Very low	182 Å²	182	156.5 Å²	156.5	95%	0.953	82%	0.816	S	S	*	*			trans	-62.8	111.3	139.1	-85.3	91.2	0	0	0	108.7
628	T	32	Very low	29.8	Very low	112 Å²	112	155.3 Å²	155.3	69%	0.687	82%	0.815	S	S	*	*			trans	-141.2	128.1	160.9	46.5	0	0	0	0	110.1	H626	H626-T628 HydrophobicContact CB-CG2 4.48Å; H626-T628 PolarHBondContact O-N 3.14Å
629	N	26.5	Very low	29.6	Very low	156 Å²	156	154 Å²	154	83%	0.834	81%	0.809	S	S	*	*			trans	-40.7	132	172.5	-65.9	-35.8	0	0	0	114.1
630	H	31.4	Very low	29.7	Very low	186 Å²	186	156.9 Å²	156.9	86%	0.861	81%	0.813	S	S	*	*			trans	-150.1	112.4	148.3	-100.3	-60.9	0	0	0	111.2
631	H	26.7	Very low	29.6	Very low	180 Å²	180	154.8 Å²	154.8	83%	0.833	81%	0.811	S	S	*	*			trans	-57.2	152.2	154.7	-81.7	-75.1	0	0	0	110.4
632	P	30.3	Very low	29.3	Very low	113 Å²	113	156 Å²	156	73%	0.734	81%	0.811	S	S	*	*				-148.9	125.7	98.2	35	-16	0	0	0	113.7
633	S	30	Very low	29.3	Very low	100 Å²	100	158.8 Å²	158.8	70%	0.699	82%	0.819	S	S	*	*				98.9	151.1	102.8	75.2	0	0	0	0	114.2
634	P	30.8	Very low	28.9	Very low	111 Å²	111	158.2 Å²	158.2	72%	0.721	82%	0.815	S	S	*	*			trans	-115.8	144.4	-140.3	37.8	-25.9	0	0	0	115.2
635	F	29.3	Very low	28.8	Very low	204 Å²	204	156.2 Å²	156.2	90%	0.895	81%	0.814	S	S	*	*			trans	-140.8	150.7	161.7	-79.4	-71.4	0	0	0	110.4
636	P	30.7	Very low	28.7	Very low	126 Å²	126	150.2 Å²	150.2	82%	0.818	80%	0.803	S	S	*	*			trans	-88.5	156.9	-130.7	-11.6	29.7	0	0	0	116.3
637	K	27.6	Very low	28.6	Very low	192 Å²	192	146.8 Å²	146.8	84%	0.835	79%	0.793	S	S	*	*			trans	-50.9	139.2	177.5	-62.9	165.9	174.5	178.3	0	114.3
638	D	29.8	Very low	28.6	Very low	157 Å²	157	144.3 Å²	144.3	84%	0.84	79%	0.786	S	S	*	*			trans	-144.8	99.1	137.9	-86.2	-29.1	0	0	0	109
639	D	26.2	Very low	28.6	Very low	141 Å²	141	143 Å²	143	75%	0.754	78%	0.782	S	S	*	*	S	Bend	trans	33.7	81	153	-64.4	-11	0	0	0	121.3
640	Y	31.7	Very low	28.9	Very low	242 Å²	242	137.8 Å²	137.8	95%	0.949	76%	0.758	S	S	*	*			trans	-150.9	90.6	144.1	-74.9	-76.1	0	0	0	110.4
641	S	25.2	Very low	28.9	Very low	109 Å²	109	133.4 Å²	133.4	76%	0.762	74%	0.74	S	S	*	*			trans	-141	108.9	164.9	60.4	0	0	0	0	109.8
642	E	27.8	Very low	29.2	Very low	191 Å²	191	132.5 Å²	132.5	89%	0.893	74%	0.736	S	S	*	*			trans	177.9	145.1	132.7	-99.7	175	-174.5	0	0	110.3
643	C	26.9	Very low	29.3	Very low	122 Å²	122	132.9 Å²	132.9	82%	0.824	73%	0.732	S	S	*	*			trans	89.9	63.4	177.6	-59	0	0	0	0	117.9
644	S	24.6	Very low	29.4	Very low	105 Å²	105	135.1 Å²	135.1	73%	0.734	73%	0.729	S	S	*	*			trans	-59.7	147	133.7	38.8	0	0	0	0	111
645	N	25.7	Very low	29.4	Very low	154 Å²	154	132.1 Å²	132.1	82%	0.824	71%	0.709	S	S	*	*			trans	82.2	56.9	168.6	-52.4	-13.1	0	0	0	118.8
646	V	30.2	Very low	29.7	Very low	112 Å²	112	125.9 Å²	125.9	68%	0.679	69%	0.687	S	S	*	*			trans	-147.1	130.9	151.4	-172.6	0	0	0	0	110.9
647	T	29.1	Very low	29.8	Very low	87 Å²	87	123.5 Å²	123.5	53%	0.534	67%	0.667	S	S	.	*			trans	-36	129.2	176	40.2	0	0	0	0	116.5	S649	T647-S649 VanDerWaalsContact C-N 3.35Å; T647-S649 PolarHBondContact O-N 3.32Å; T647-S649 VanDerWaalsContact O-N 3.09Å
648	T	28.9	Very low	30.1	Very low	130 Å²	130	122 Å²	122	80%	0.798	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.3	32.7	-166.3	30.2	0	0	0	0	117.2
649	S	30.5	Very low	30.4	Very low	85 Å²	85	118.6 Å²	118.6	59%	0.594	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-123.9	-7.3	176.2	59.6	0	0	0	0	114.9	L494 T647	L494-S649 VanDerWaalsContact CD1-CB 3.43Å; T647-S649 VanDerWaalsContact C-N 3.35Å; T647-S649 PolarHBondContact O-N 3.32Å; T647-S649 VanDerWaalsContact O-N 3.09Å
650	S	32.5	Very low	30.9	Very low	47 Å²	47	115.3 Å²	115.3	33%	0.329	62%	0.622	S	S	.	*	S	Bend	trans	-94.8	-7.4	173.6	71.7	0	0	0	0	114.1	K654	S650-K654 WeakPolarHBondContact O-CB 3.18Å; S650-K654 PolarHBondContact O-N 3.37Å
651	L	33.2	Very low	31.2	Very low	94 Å²	94	107.3 Å²	107.3	49%	0.492	60%	0.599	S	S	.	*	H	α-helix	trans	-74.4	-25.5	-173.9	-103.3	95.6	0	0	0	114.2	N653 T655	L651-N653 PolarHBondContact O-N 3.07Å; L651-T655 WeakPolarHBondContact CD2-OG1 3.4Å; L651-T655 WeakPolarHBondContact CG-OG1 3.49Å; L651-T655 WeakPolarHBondContact O-CA 3.41Å; L651-T655 WeakPolarHBondContact O-CB 3.45Å; L651-T655 PolarHBondContact O-N 2.89Å; L651-T655 PolarHBondContact O-OG1 3.28Å
652	H	32.6	Very low	31.6	Very low	161 Å²	161	105.2 Å²	105.2	75%	0.745	58%	0.579	S	S	*	*	H	α-helix	trans	-72.1	-36.5	-179.1	-146	66.5	0	0	0	112.3	V656	H652-V656 WeakPolarHBondContact O-CB 3.38Å; H652-V656 WeakPolarHBondContact O-CG2 3.06Å; H652-V656 PolarHBondContact O-N 3.32Å
653	N	32.7	Very low	32.4	Very low	121 Å²	121	99.8 Å²	99.8	65%	0.647	56%	0.555	S	S	*	*	H	α-helix	trans	-84	-33.8	174.9	-83.9	-22.9	0	0	0	113.4	L651 I657	L651-N653 PolarHBondContact O-N 3.07Å; N653-I657 WeakPolarHBondContact O-CB 3.41Å; N653-I657 VanDerWaalsContact O-CD1 3.32Å; N653-I657 WeakPolarHBondContact O-CD1 3.45Å; N653-I657 WeakPolarHBondContact O-CG1 3.21Å; N653-I657 PolarHBondContact O-N 2.95Å; N653-I657 VanDerWaalsContact O-N 3.07Å
654	K	30.7	Very low	32.9	Very low	146 Å²	146	97.9 Å²	97.9	64%	0.635	54%	0.537	S	S	*	.	H	α-helix	trans	-79.8	-26.6	174.8	-78.3	-176.2	175.4	177.9	0	113.7	S650 W658	S650-K654 WeakPolarHBondContact O-CB 3.18Å; S650-K654 PolarHBondContact O-N 3.37Å; K654-W658 WeakPolarHBondContact O-CA 3.27Å; K654-W658 WeakPolarHBondContact O-CB 3.26Å; K654-W658 PolarHBondContact O-N 2.88Å
655	T	31.6	Very low	33.5	Very low	49 Å²	49	97.4 Å²	97.4	30%	0.301	53%	0.53	S	S	.	.	H	α-helix	trans	-81.5	-32.3	175.7	-44.8	0	0	0	0	110.6	L651 W658 L659	L651-T655 WeakPolarHBondContact CD2-OG1 3.4Å; L651-T655 WeakPolarHBondContact CG-OG1 3.49Å; L651-T655 WeakPolarHBondContact O-CA 3.41Å; L651-T655 WeakPolarHBondContact O-CB 3.45Å; L651-T655 PolarHBondContact O-N 2.89Å; L651-T655 PolarHBondContact O-OG1 3.28Å; T655-W658 PolarHBondContact O-N 3.02Å; T655-L659 HydrophobicContact CG2-CD1 3.78Å; T655-L659 HydrophobicContact CG2-CG 4.26Å; T655-L659 WeakPolarHBondContact O-CA 3.34Å; T655-L659 WeakPolarHBondContact O-CB 3.2Å; T655-L659 WeakPolarHBondContact O-CD1 3.42Å; T655-L659 VanDerWaalsContact O-CG 3.3Å; T655-L659 WeakPolarHBondContact O-CG 3.43Å; T655-L659 PolarHBondContact O-N 2.86Å
656	V	34.8	Very low	34	Very low	73 Å²	73	98.7 Å²	98.7	44%	0.442	53%	0.528	S	S	.	.	H	α-helix	trans	-67.9	-38.9	167.7	174.7	0	0	0	0	110.4	H652 T660	H652-V656 WeakPolarHBondContact O-CB 3.38Å; H652-V656 WeakPolarHBondContact O-CG2 3.06Å; H652-V656 PolarHBondContact O-N 3.32Å; V656-T660 HydrophobicContact CG1-CG2 4.31Å; V656-T660 WeakPolarHBondContact O-CB 3.46Å; V656-T660 WeakPolarHBondContact O-CG2 3.45Å; V656-T660 PolarHBondContact O-N 3.44Å; V656-T660 PolarHBondContact O-OG1 3.21Å
657	I	34	Very low	34.5	Very low	76 Å²	76	95.9 Å²	95.9	39%	0.39	51%	0.508	S	S	.	.	H	α-helix	trans	-69.6	-39.9	173.7	-67.5	167.6	0	0	0	111.5	N653 T660 T661	N653-I657 WeakPolarHBondContact O-CB 3.41Å; N653-I657 VanDerWaalsContact O-CD1 3.32Å; N653-I657 WeakPolarHBondContact O-CD1 3.45Å; N653-I657 WeakPolarHBondContact O-CG1 3.21Å; N653-I657 PolarHBondContact O-N 2.95Å; N653-I657 VanDerWaalsContact O-N 3.07Å; I657-T660 VanDerWaalsContact CA-OG1 3.3Å; I657-T660 WeakPolarHBondContact CA-OG1 3.44Å; I657-T660 CarbonylContact O-C 3.58Å; I657-T660 PolarHBondContact O-N 3.14Å; I657-T660 PolarHBondContact O-OG1 3.23Å; I657-T660 VanDerWaalsContact O-OG1 3.12Å; I657-T661 WeakPolarHBondContact O-CB 3.29Å; I657-T661 PolarHBondContact O-N 3.09Å; I657-T661 PolarHBondContact O-OG1 3.5Å
658	W	33.2	Very low	34.9	Very low	161 Å²	161	95.5 Å²	95.5	61%	0.61	51%	0.51	S	S	*	.	H	α-helix	trans	-74.8	-37.7	179.5	-168	87.6	0	0	0	112.1	K654 T655 T661 N662	K654-W658 WeakPolarHBondContact O-CA 3.27Å; K654-W658 WeakPolarHBondContact O-CB 3.26Å; K654-W658 PolarHBondContact O-N 2.88Å; T655-W658 PolarHBondContact O-N 3.02Å; W658-T661 PolarHBondContact O-N 2.93Å; W658-N662 WeakPolarHBondContact CZ2-ND2 3.38Å; W658-N662 PolarHBondContact NE1-ND2 3.33Å; W658-N662 VanDerWaalsContact O-CB 3.25Å; W658-N662 WeakPolarHBondContact O-CB 3.28Å; W658-N662 PolarHBondContact O-N 3.05Å
659	L	35.5	Very low	35.5	Very low	84 Å²	84	100.7 Å²	100.7	44%	0.44	52%	0.515	S	S	.	.	H	α-helix	trans	-63.1	-47.4	167.3	-79.1	157.6	0	0	0	109.8	T655 T661 I663	T655-L659 HydrophobicContact CG2-CD1 3.78Å; T655-L659 HydrophobicContact CG2-CG 4.26Å; T655-L659 WeakPolarHBondContact O-CA 3.34Å; T655-L659 WeakPolarHBondContact O-CB 3.2Å; T655-L659 WeakPolarHBondContact O-CD1 3.42Å; T655-L659 VanDerWaalsContact O-CG 3.3Å; T655-L659 WeakPolarHBondContact O-CG 3.43Å; T655-L659 PolarHBondContact O-N 2.86Å; L659-T661 VanDerWaalsContact C-N 3.26Å; L659-T661 PolarHBondContact O-N 3.4Å; L659-I663 HydrophobicContact CB-CD1 3.94Å; L659-I663 HydrophobicContact CD2-CD1 3.83Å; L659-I663 HydrophobicContact CD2-CG1 4.4Å; L659-I663 WeakPolarHBondContact O-CA 3.08Å; L659-I663 WeakPolarHBondContact O-CB 3.46Å; L659-I663 WeakPolarHBondContact O-CD1 3.4Å; L659-I663 WeakPolarHBondContact O-CG1 3.49Å; L659-I663 PolarHBondContact O-N 2.91Å
660	T	38	Very low	36.4	Very low	72 Å²	72	98.2 Å²	98.2	44%	0.442	50%	0.499	S	S	.	.	H	α-helix	trans	-68.9	-22	178.2	54.7	0	0	0	0	113.5	V656 I657 N664	V656-T660 HydrophobicContact CG1-CG2 4.31Å; V656-T660 WeakPolarHBondContact O-CB 3.46Å; V656-T660 WeakPolarHBondContact O-CG2 3.45Å; V656-T660 PolarHBondContact O-N 3.44Å; V656-T660 PolarHBondContact O-OG1 3.21Å; I657-T660 VanDerWaalsContact CA-OG1 3.3Å; I657-T660 WeakPolarHBondContact CA-OG1 3.44Å; I657-T660 CarbonylContact O-C 3.58Å; I657-T660 PolarHBondContact O-N 3.14Å; I657-T660 PolarHBondContact O-OG1 3.23Å; I657-T660 VanDerWaalsContact O-OG1 3.12Å; T660-N664 VanDerWaalsContact O-CB 3.28Å; T660-N664 WeakPolarHBondContact O-CB 3.23Å; T660-N664 PolarHBondContact O-ND2 3.04Å
661	T	36.6	Very low	37.2	Very low	75 Å²	75	98.3 Å²	98.3	46%	0.46	49%	0.494	S	S	.	.	H	α-helix	trans	-90.3	-39.1	177.8	-45.2	0	0	0	0	112	I657 W658 L659 N664 T665	I657-T661 WeakPolarHBondContact O-CB 3.29Å; I657-T661 PolarHBondContact O-N 3.09Å; I657-T661 PolarHBondContact O-OG1 3.5Å; W658-T661 PolarHBondContact O-N 2.93Å; L659-T661 VanDerWaalsContact C-N 3.26Å; L659-T661 PolarHBondContact O-N 3.4Å; T661-N664 PolarHBondContact O-N 2.99Å; T661-T665 PolarHBondContact O-N 3.12Å
662	N	35.4	Very low	38.1	Very low	64 Å²	64	99.9 Å²	99.9	34%	0.342	50%	0.503	S	S	.	.	H	α-helix	trans	-84.7	-23.9	177.3	-79.1	-5.9	0	0	0	114.1	W658 N664 T665 K666	W658-N662 WeakPolarHBondContact CZ2-ND2 3.38Å; W658-N662 PolarHBondContact NE1-ND2 3.33Å; W658-N662 VanDerWaalsContact O-CB 3.25Å; W658-N662 WeakPolarHBondContact O-CB 3.28Å; W658-N662 PolarHBondContact O-N 3.05Å; N662-N664 VanDerWaalsContact C-N 3.35Å; N662-T665 PolarHBondContact O-OG1 3.04Å; N662-T665 VanDerWaalsContact O-OG1 3.08Å; N662-K666 PolarHBondContact O-N 3.49Å
663	I	42.8	Very low	39.8	Very low	78 Å²	78	95.5 Å²	95.5	40%	0.4	49%	0.491	S	S	.	.	H	α-helix	trans	-70.4	-37.5	166.3	-66.2	168.9	0	0	0	109	L659 T665 K666 I667	L659-I663 HydrophobicContact CB-CD1 3.94Å; L659-I663 HydrophobicContact CD2-CD1 3.83Å; L659-I663 HydrophobicContact CD2-CG1 4.4Å; L659-I663 WeakPolarHBondContact O-CA 3.08Å; L659-I663 WeakPolarHBondContact O-CB 3.46Å; L659-I663 WeakPolarHBondContact O-CD1 3.4Å; L659-I663 WeakPolarHBondContact O-CG1 3.49Å; L659-I663 PolarHBondContact O-N 2.91Å; I663-T665 VanDerWaalsContact C-N 3.28Å; I663-T665 PolarHBondContact O-N 3.46Å; I663-K666 PolarHBondContact O-N 2.9Å; I663-I667 HydrophobicContact CG2-CD1 3.19Å; I663-I667 HydrophobicContact CG2-CG1 3.66Å; I663-I667 WeakPolarHBondContact O-CB 3.09Å; I663-I667 WeakPolarHBondContact O-CG1 3.45Å; I663-I667 PolarHBondContact O-N 3.38Å
664	N	39.2	Very low	41.6	Very low	82 Å²	82	90.9 Å²	90.9	44%	0.439	47%	0.466	S	S	.	.	H	α-helix	trans	-64.2	-27.7	177.5	-90.2	-29.3	0	0	0	114	T660 T661 N662 S668	T660-N664 VanDerWaalsContact O-CB 3.28Å; T660-N664 WeakPolarHBondContact O-CB 3.23Å; T660-N664 PolarHBondContact O-ND2 3.04Å; T661-N664 PolarHBondContact O-N 2.99Å; N662-N664 VanDerWaalsContact C-N 3.35Å; N664-S668 PolarHBondContact O-N 3.13Å; N664-S668 PolarHBondContact O-OG 2.99Å
665	T	37	Very low	43.6	Very low	95 Å²	95	86.8 Å²	86.8	58%	0.583	45%	0.447	S	S	*	.	H	α-helix	trans	-81.8	-35.2	175.9	53.2	0	0	0	0	113.1	T661 N662 I663	T661-T665 PolarHBondContact O-N 3.12Å; N662-T665 PolarHBondContact O-OG1 3.04Å; N662-T665 VanDerWaalsContact O-OG1 3.08Å; I663-T665 VanDerWaalsContact C-N 3.28Å; I663-T665 PolarHBondContact O-N 3.46Å
666	K	36.5	Very low	45.7	Very low	181 Å²	181	90.3 Å²	90.3	79%	0.787	46%	0.463	S	S	*	.	H	α-helix	trans	-75.1	-32.7	171.4	-83.1	-174.7	177.2	179.3	0	113.2	N662 I663 S668	N662-K666 PolarHBondContact O-N 3.49Å; I663-K666 PolarHBondContact O-N 2.9Å; K666-S668 VanDerWaalsContact C-N 3.31Å; K666-S668 PolarHBondContact O-N 3.31Å
667	I	40.4	Very low	47.7	Very low	52 Å²	52	91.6 Å²	91.6	27%	0.267	46%	0.46	S	S	.	.	H	α-helix	trans	-69.2	-27.7	175.8	-71.2	-175.5	0	0	0	111.9	I663 R669 A670 H671	I663-I667 HydrophobicContact CG2-CD1 3.19Å; I663-I667 HydrophobicContact CG2-CG1 3.66Å; I663-I667 WeakPolarHBondContact O-CB 3.09Å; I663-I667 WeakPolarHBondContact O-CG1 3.45Å; I663-I667 PolarHBondContact O-N 3.38Å; I667-R669 VanDerWaalsContact C-N 3.27Å; I667-R669 PolarHBondContact O-N 3.5Å; I667-R669 VanDerWaalsContact O-N 3.16Å; I667-A670 CarbonylContact O-C 3.16Å; I667-A670 WeakPolarHBondContact O-CA 3.36Å; I667-A670 WeakPolarHBondContact O-CB 3.08Å; I667-A670 PolarHBondContact O-N 3.01Å; I667-H671 PolarHBondContact O-CD2 3.19Å; I667-H671 PolarHBondContact O-N 3.46Å
668	S	37.5	Very low	50	Low	80 Å²	80	88.4 Å²	88.4	56%	0.559	44%	0.444	S	S	*	.	H	α-helix	trans	-58.8	-32	-177	-75.1	0	0	0	0	114.5	N664 K666 H671	N664-S668 PolarHBondContact O-N 3.13Å; N664-S668 PolarHBondContact O-OG 2.99Å; K666-S668 VanDerWaalsContact C-N 3.31Å; K666-S668 PolarHBondContact O-N 3.31Å; S668-H671 VanDerWaalsContact CA-CD2 3.47Å; S668-H671 WeakPolarHBondContact CA-CD2 3.36Å
669	R	40.9	Very low	52.1	Low	239 Å²	239	85 Å²	85	90%	0.902	44%	0.437	S	S	*	.	H	α-helix	trans	-87.3	-17.7	171.5	-74.4	-178.7	-178.5	154.3	0.7	113.6	I667	I667-R669 VanDerWaalsContact C-N 3.27Å; I667-R669 PolarHBondContact O-N 3.5Å; I667-R669 VanDerWaalsContact O-N 3.16Å
670	A	48.2	Very low	54.3	Low	33 Å²	33	84.5 Å²	84.5	27%	0.273	44%	0.44	S	S	.	.	H	α-helix	trans	-84.3	-18.3	179.4	0	0	0	0	0	113.9	I667 N672 S673 L674	I667-A670 CarbonylContact O-C 3.16Å; I667-A670 WeakPolarHBondContact O-CA 3.36Å; I667-A670 WeakPolarHBondContact O-CB 3.08Å; I667-A670 PolarHBondContact O-N 3.01Å; A670-N672 VanDerWaalsContact C-N 3.34Å; A670-N672 PolarHBondContact O-N 3.19Å; A670-S673 WeakPolarHBondContact O-CB 3.34Å; A670-S673 PolarHBondContact O-N 3.11Å; A670-S673 PolarHBondContact O-OG 3.48Å; A670-L674 PolarHBondContact O-N 3.39Å
671	H	51.1	Low	56.4	Low	48 Å²	48	82.4 Å²	82.4	22%	0.222	43%	0.426	C	S	.	.	H	α-helix	trans	-52.8	-44.5	-175.6	-74.8	-75.9	0	0	0	114.1	I667 S668 S673 L674 Y675 E977	I667-H671 PolarHBondContact O-CD2 3.19Å; I667-H671 PolarHBondContact O-N 3.46Å; S668-H671 VanDerWaalsContact CA-CD2 3.47Å; S668-H671 WeakPolarHBondContact CA-CD2 3.36Å; H671-S673 VanDerWaalsContact C-N 3.28Å; H671-S673 PolarHBondContact O-N 2.89Å; H671-L674 PolarHBondContact O-N 3.36Å; H671-Y675 WeakPolarHBondContact O-CD2 3.41Å; H671-E977 IonicContact CE1-OE2 2.87Å; H671-E977 PolarHBondContact CE1-OE2 3.14Å; H671-E977 IonicContact ND1-OE1 3.81Å; H671-E977 IonicContact ND1-OE2 3.77Å; H671-E977 PolarHBondContact ND1-OE2 3.37Å; H671-E977 VanDerWaalsContact ND1-OE2 3.13Å
672	N	52.1	Low	58.7	Low	127 Å²	127	79 Å²	79	68%	0.679	41%	0.405	S	S	*	.	H	α-helix	trans	-66.1	-31.1	179.9	-75.4	-4	0	0	0	112.5	A670 L676	A670-N672 VanDerWaalsContact C-N 3.34Å; A670-N672 PolarHBondContact O-N 3.19Å; N672-L676 WeakPolarHBondContact O-CD1 3.46Å; N672-L676 WeakPolarHBondContact O-CG 3.28Å; N672-L676 PolarHBondContact O-N 3.11Å
673	S	67.1	Low	61.1	Low	70 Å²	70	85.3 Å²	85.3	49%	0.49	42%	0.424	S	S	.	.	H	α-helix	trans	-70	-32.9	178.8	75	0	0	0	0	112.6	A670 H671 R677	A670-S673 WeakPolarHBondContact O-CB 3.34Å; A670-S673 PolarHBondContact O-N 3.11Å; A670-S673 PolarHBondContact O-OG 3.48Å; H671-S673 VanDerWaalsContact C-N 3.28Å; H671-S673 PolarHBondContact O-N 2.89Å; S673-R677 WeakPolarHBondContact O-CB 3.34Å; S673-R677 PolarHBondContact O-N 3.02Å; S673-R677 VanDerWaalsContact O-N 3.1Å
674	L	71	Confident	63.2	Low	23 Å²	23	85.3 Å²	85.3	12%	0.12	43%	0.43	C	S	.	.	H	α-helix	trans	-70.8	-42.2	-177.7	-65	167.2	0	0	0	111.9	A670 H671 R677 L678 F984	A670-L674 PolarHBondContact O-N 3.39Å; H671-L674 PolarHBondContact O-N 3.36Å; L674-R677 WeakPolarHBondContact O-CB 3.38Å; L674-R677 PolarHBondContact O-N 2.9Å; L674-L678 PolarHBondContact O-N 3.35Å; L674-F984 HydrophobicContact CD2-CD2 3.61Å; L674-F984 HydrophobicContact CD2-CE2 4.31Å; L674-F984 HydrophobicContact CD2-CG 4.49Å
675	Y	72.9	Confident	65.6	Low	60 Å²	60	81.7 Å²	81.7	24%	0.235	41%	0.41	C	S	.	.	H	α-helix	trans	-69.5	-44.7	178.9	-78.1	-70.8	0	0	0	113	H671 R677 L678 L679 I806 E977 M980	H671-Y675 WeakPolarHBondContact O-CD2 3.41Å; Y675-R677 PolarHBondContact O-N 3.42Å; Y675-L678 PolarHBondContact O-N 3.36Å; Y675-L678 VanDerWaalsContact O-N 3.16Å; Y675-L679 WeakPolarHBondContact O-CG 3.43Å; Y675-L679 PolarHBondContact O-N 2.78Å; Y675-I806 HydrophobicContact CE1-CD1 4.11Å; Y675-I806 HydrophobicContact CE1-CG2 4.27Å; Y675-E977 HydrophobicContact CE2-CG 3.83Å; Y675-E977 VanDerWaalsContact CE2-OE1 3.24Å; Y675-E977 WeakPolarHBondContact CE2-OE1 3.35Å; Y675-E977 WeakPolarHBondContact OH-CG 3.12Å; Y675-E977 PolarHBondContact OH-OE1 3.37Å; Y675-M980 HydrophobicContact CD1-CE 4.11Å; Y675-M980 HydrophobicContact CE1-CE 3.73Å; Y675-M980 HydrophobicContact CE2-CE 4.44Å
676	L	74.4	Confident	67.9	Low	124 Å²	124	80 Å²	80	65%	0.649	40%	0.396	S	S	*	.	H	α-helix	trans	-57.9	-38.4	174.3	-73.9	169.3	0	0	0	110.8	N672 L679 S680	N672-L676 WeakPolarHBondContact O-CD1 3.46Å; N672-L676 WeakPolarHBondContact O-CG 3.28Å; N672-L676 PolarHBondContact O-N 3.11Å; L676-L679 PolarHBondContact O-N 3.18Å; L676-S680 PolarHBondContact O-N 3.35Å
677	R	77.9	Confident	70.4	Confident	100 Å²	100	77 Å²	77	38%	0.377	39%	0.388	S	S	.	.	H	α-helix	trans	-68.8	-42.1	175.3	-170.2	173.1	-164.3	166	1.1	113.2	S673 L674 Y675 L679 S680 I681 F984 D988	S673-R677 WeakPolarHBondContact O-CB 3.34Å; S673-R677 PolarHBondContact O-N 3.02Å; S673-R677 VanDerWaalsContact O-N 3.1Å; L674-R677 WeakPolarHBondContact O-CB 3.38Å; L674-R677 PolarHBondContact O-N 2.9Å; Y675-R677 PolarHBondContact O-N 3.42Å; R677-L679 VanDerWaalsContact C-N 3.31Å; R677-L679 PolarHBondContact O-N 3.28Å; R677-S680 WeakPolarHBondContact O-CB 3.31Å; R677-S680 PolarHBondContact O-N 2.88Å; R677-S680 VanDerWaalsContact O-N 3.11Å; R677-S680 PolarHBondContact O-OG 3.12Å; R677-I681 PolarHBondContact O-N 3.45Å; R677-I681 VanDerWaalsContact O-N 3.13Å; R677-F984 HydrophobicContact CB-CZ 4.46Å; R677-F984 HydrophobicContact CG-CE1 4.17Å; R677-F984 HydrophobicContact CG-CE2 4.5Å; R677-F984 HydrophobicContact CG-CZ 4.07Å; R677-D988 IonicContact CZ-OD1 3.87Å; R677-D988 IonicContact CZ-OD2 3.17Å; R677-D988 VanDerWaalsContact CZ-OD2 3.28Å; R677-D988 VanDerWaalsContact NH1-CG 3.32Å; R677-D988 IonicContact NH1-OD1 3.52Å; R677-D988 PolarHBondContact NH1-OD1 2.93Å; R677-D988 IonicContact NH1-OD2 3.22Å; R677-D988 PolarHBondContact NH1-OD2 2.77Å; R677-D988 VanDerWaalsContact NH2-CG 3.31Å; R677-D988 IonicContact NH2-OD1 2.9Å; R677-D988 PolarHBondContact NH2-OD1 3.45Å; R677-D988 IonicContact NH2-OD2 3.49Å; R677-D988 PolarHBondContact NH2-OD2 3.12Å
678	L	81.5	Confident	72.8	Confident	8 Å²	8	77.9 Å²	77.9	4%	0.042	39%	0.388	C	S	.	.	H	α-helix	trans	-59.7	-44.7	174.1	-175	69.1	0	0	0	111.1	L674 Y675 S680 I681 N682 L762 L766 V803 M980	L674-L678 PolarHBondContact O-N 3.35Å; Y675-L678 PolarHBondContact O-N 3.36Å; Y675-L678 VanDerWaalsContact O-N 3.16Å; L678-S680 PolarHBondContact O-N 3.49Å; L678-I681 PolarHBondContact O-N 3.35Å; L678-I681 VanDerWaalsContact O-N 3.1Å; L678-N682 WeakPolarHBondContact O-CB 3.5Å; L678-N682 PolarHBondContact O-N 3.13Å; L678-L762 HydrophobicContact CD1-CD2 4.24Å; L678-L766 HydrophobicContact CD1-CD1 4.44Å; L678-V803 HydrophobicContact CD1-CG1 3.5Å; L678-V803 HydrophobicContact CD2-CG1 3.99Å; L678-V803 HydrophobicContact CG-CG1 4.4Å; L678-M980 HydrophobicContact CB-SD 4.08Å; L678-M980 HydrophobicContact CD1-SD 4.46Å; L678-M980 HydrophobicContact CD2-SD 3.73Å; L678-M980 HydrophobicContact CG-SD 4.3Å
679	L	77.8	Confident	75.3	Confident	91 Å²	91	74.7 Å²	74.7	48%	0.476	37%	0.365	S	S	.	.	H	α-helix	trans	-59.4	-36.2	174.9	-73.4	169.8	0	0	0	111.8	Y675 L676 R677 I681 N682 R683 M686	Y675-L679 WeakPolarHBondContact O-CG 3.43Å; Y675-L679 PolarHBondContact O-N 2.78Å; L676-L679 PolarHBondContact O-N 3.18Å; R677-L679 VanDerWaalsContact C-N 3.31Å; R677-L679 PolarHBondContact O-N 3.28Å; L679-I681 PolarHBondContact O-N 3.35Å; L679-N682 CarbonylContact O-C 3.56Å; L679-N682 PolarHBondContact O-N 2.9Å; L679-R683 PolarHBondContact O-N 3.47Å; L679-M686 HydrophobicContact CD2-SD 4.42Å
680	S	81.8	Confident	77.6	Confident	72 Å²	72	68.6 Å²	68.6	50%	0.503	35%	0.349	S	S	.	.	H	α-helix	trans	-64.3	-37.5	175	81.9	0	0	0	0	112.9	L676 R677 L678 N682 R683	L676-S680 PolarHBondContact O-N 3.35Å; R677-S680 WeakPolarHBondContact O-CB 3.31Å; R677-S680 PolarHBondContact O-N 2.88Å; R677-S680 VanDerWaalsContact O-N 3.11Å; R677-S680 PolarHBondContact O-OG 3.12Å; L678-S680 PolarHBondContact O-N 3.49Å; S680-N682 VanDerWaalsContact C-N 3.31Å; S680-R683 VanDerWaalsContact O-CB 3.23Å; S680-R683 WeakPolarHBondContact O-CB 3.46Å; S680-R683 PolarHBondContact O-N 3Å
681	I	83.3	Confident	79.7	Confident	29 Å²	29	71.8 Å²	71.8	15%	0.149	36%	0.359	C	S	.	.	H	α-helix	trans	-71.2	-31.7	175.4	-65.8	176.6	0	0	0	111.1	R677 L678 L679 R683 L762 R765 L766 F984	R677-I681 PolarHBondContact O-N 3.45Å; R677-I681 VanDerWaalsContact O-N 3.13Å; L678-I681 PolarHBondContact O-N 3.35Å; L678-I681 VanDerWaalsContact O-N 3.1Å; L679-I681 PolarHBondContact O-N 3.35Å; I681-R683 VanDerWaalsContact C-N 3.28Å; I681-R683 PolarHBondContact O-N 3.13Å; I681-L762 HydrophobicContact CG2-CD1 3.82Å; I681-R765 HydrophobicContact CG2-CG 4.35Å; I681-R765 PolarHBondContact O-NH1 3.29Å; I681-L766 HydrophobicContact CD1-CD2 4.4Å; I681-L766 HydrophobicContact CG2-CD2 4.43Å; I681-F984 HydrophobicContact CD1-CE1 3.49Å; I681-F984 VanDerWaalsContact CD1-CE1 3.49Å; I681-F984 HydrophobicContact CD1-CZ 3.97Å
682	N	83.9	Confident	81.6	Confident	2 Å²	2	69.5 Å²	69.5	1%	0.011	35%	0.349	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85	2.5	179.2	-153.5	14.6	0	0	0	113.5	L678 L679 S680 E685 M686 I689 L762 S807	L678-N682 WeakPolarHBondContact O-CB 3.5Å; L678-N682 PolarHBondContact O-N 3.13Å; L679-N682 CarbonylContact O-C 3.56Å; L679-N682 PolarHBondContact O-N 2.9Å; S680-N682 VanDerWaalsContact C-N 3.31Å; N682-E685 PolarHBondContact O-N 3.37Å; N682-M686 PolarHBondContact O-N 3.19Å; N682-I689 WeakPolarHBondContact ND2-CD1 3.35Å; N682-L762 HydrophobicContact CB-CD1 4.23Å; N682-S807 WeakPolarHBondContact ND2-CB 2.95Å
683	R	85.4	Confident	83.4	Confident	197 Å²	197	64.8 Å²	64.8	74%	0.743	33%	0.325	S	S	*	.	G	3₁₀ helix	trans	-50.9	-42.4	-177.1	-170.8	178.2	-179.7	-176.8	0.6	114.3	L679 S680 I681 E685 M686	L679-R683 PolarHBondContact O-N 3.47Å; S680-R683 VanDerWaalsContact O-CB 3.23Å; S680-R683 WeakPolarHBondContact O-CB 3.46Å; S680-R683 PolarHBondContact O-N 3Å; I681-R683 VanDerWaalsContact C-N 3.28Å; I681-R683 PolarHBondContact O-N 3.13Å; R683-E685 PolarHBondContact O-N 3.5Å; R683-M686 WeakPolarHBondContact O-CB 3.29Å; R683-M686 VanDerWaalsContact O-CG 3.3Å; R683-M686 WeakPolarHBondContact O-CG 3.48Å; R683-M686 PolarHBondContact O-N 3.32Å
684	P	87.7	Confident	84.6	Confident	79 Å²	79	67.8 Å²	67.8	51%	0.513	33%	0.329	S	S	.	.	G	3₁₀ helix	trans	-63.6	-24.7	-180	-22.7	35.2	0	0	0	114.2	R765	P684-R765 VanDerWaalsContact CD-NH1 3.33Å
685	E	88.1	Confident	85.6	Confident	5 Å²	5	67.4 Å²	67.4	2%	0.023	33%	0.329	C	S	.	.	G	3₁₀ helix	trans	-100.2	3.8	-178.5	-65.5	72.4	-160.2	0	0	112.8	N682 R683 I687 Y688 I689 A758 R761 R765	N682-E685 PolarHBondContact O-N 3.37Å; R683-E685 PolarHBondContact O-N 3.5Å; E685-I687 PolarHBondContact O-N 3.2Å; E685-I687 VanDerWaalsContact O-N 3.17Å; E685-Y688 HydrophobicContact CB-CD2 4.43Å; E685-Y688 WeakPolarHBondContact O-CB 3.43Å; E685-Y688 PolarHBondContact O-N 2.87Å; E685-I689 PolarHBondContact O-N 3.04Å; E685-I689 VanDerWaalsContact O-N 3.11Å; E685-A758 HydrophobicContact CB-CB 4.29Å; E685-R761 HydrophobicContact CG-CB 4.06Å; E685-R765 IonicContact OE1-CZ 3.12Å; E685-R765 IonicContact OE1-NH1 3.94Å; E685-R765 IonicContact OE1-NH2 3.13Å; E685-R765 PolarHBondContact OE1-NH2 3.32Å; E685-R765 IonicContact OE2-CZ 2.71Å; E685-R765 IonicContact OE2-NH1 3.12Å; E685-R765 PolarHBondContact OE2-NH1 3.27Å; E685-R765 IonicContact OE2-NH2 2.94Å; E685-R765 PolarHBondContact OE2-NH2 3.45Å
686	M	85.5	Confident	86.4	Confident	61 Å²	61	64.6 Å²	64.6	30%	0.3	32%	0.318	S	S	.	.	H	α-helix	trans	-57.7	-33.7	-177.2	-73.7	-64.5	-63.3	0	0	113.3	L679 N682 R683 Y688 I689 I690	L679-M686 HydrophobicContact CD2-SD 4.42Å; N682-M686 PolarHBondContact O-N 3.19Å; R683-M686 WeakPolarHBondContact O-CB 3.29Å; R683-M686 VanDerWaalsContact O-CG 3.3Å; R683-M686 WeakPolarHBondContact O-CG 3.48Å; R683-M686 PolarHBondContact O-N 3.32Å; M686-Y688 VanDerWaalsContact C-N 3.34Å; M686-Y688 PolarHBondContact O-N 3.44Å; M686-I689 PolarHBondContact O-N 2.87Å; M686-I689 HydrophobicContact SD-CD1 4.15Å; M686-I690 WeakPolarHBondContact O-CB 3.42Å; M686-I690 WeakPolarHBondContact O-CD1 3.31Å; M686-I690 WeakPolarHBondContact O-CG1 3.36Å; M686-I690 PolarHBondContact O-N 3.13Å
687	I	90.1	Very high	87.3	Confident	118 Å²	118	61.7 Å²	61.7	61%	0.605	30%	0.302	S	S	*	.	H	α-helix	trans	-60.6	-45.5	175.6	-62.6	170.7	0	0	0	110.4	E685 I689 I690 M691	E685-I687 PolarHBondContact O-N 3.2Å; E685-I687 VanDerWaalsContact O-N 3.17Å; I687-I689 VanDerWaalsContact C-N 3.32Å; I687-I689 PolarHBondContact O-N 3.02Å; I687-I690 PolarHBondContact O-N 3.04Å; I687-M691 HydrophobicContact CG2-SD 4.05Å; I687-M691 WeakPolarHBondContact O-CB 3.48Å; I687-M691 VanDerWaalsContact O-CG 3.29Å; I687-M691 WeakPolarHBondContact O-CG 3.44Å; I687-M691 PolarHBondContact O-N 2.7Å
688	Y	91.4	Very high	88	Confident	69 Å²	69	59.6 Å²	59.6	27%	0.271	30%	0.298	S	S	.	.	H	α-helix	trans	-65.4	-37.2	178.3	-61	-89.7	0	0	0	111.7	E685 M686 G692 L754 V757	E685-Y688 HydrophobicContact CB-CD2 4.43Å; E685-Y688 WeakPolarHBondContact O-CB 3.43Å; E685-Y688 PolarHBondContact O-N 2.87Å; M686-Y688 VanDerWaalsContact C-N 3.34Å; M686-Y688 PolarHBondContact O-N 3.44Å; Y688-G692 PolarHBondContact O-N 3.44Å; Y688-L754 HydrophobicContact CD1-CD2 3.85Å; Y688-V757 HydrophobicContact CD1-CB 4.48Å; Y688-V757 HydrophobicContact CD1-CG1 4.18Å; Y688-V757 HydrophobicContact CE1-CG1 4.2Å; Y688-V757 HydrophobicContact CG-CG1 4.38Å
689	I	88.2	Confident	88.3	Confident	14 Å²	14	59.2 Å²	59.2	7%	0.072	30%	0.296	C	S	.	.	H	α-helix	trans	-69.1	-44.3	177.3	-62.8	166.6	0	0	0	110.7	N682 E685 M686 I687 G692 C693 F755 A758 L811	N682-I689 WeakPolarHBondContact ND2-CD1 3.35Å; E685-I689 PolarHBondContact O-N 3.04Å; E685-I689 VanDerWaalsContact O-N 3.11Å; M686-I689 PolarHBondContact O-N 2.87Å; M686-I689 HydrophobicContact SD-CD1 4.15Å; I687-I689 VanDerWaalsContact C-N 3.32Å; I687-I689 PolarHBondContact O-N 3.02Å; I689-G692 CarbonylContact O-C 3.27Å; I689-G692 PolarHBondContact O-N 3.23Å; I689-C693 WeakPolarHBondContact O-CB 3.2Å; I689-C693 PolarHBondContact O-N 3.35Å; I689-C693 PolarHBondContact O-SG 3.1Å; I689-F755 HydrophobicContact CG2-CE1 4.47Å; I689-A758 HydrophobicContact CD1-CB 4.25Å; I689-A758 HydrophobicContact CG1-CB 3.69Å; I689-L811 HydrophobicContact CG2-CD2 4.4Å
690	I	90.5	Very high	88.9	Confident	110 Å²	110	54.9 Å²	54.9	56%	0.564	27%	0.273	S	S	*	.	H	α-helix	trans	-62.8	-47.5	178.1	-68.7	163.6	0	0	0	110.1	M686 I687 G692 C693 F694	M686-I690 WeakPolarHBondContact O-CB 3.42Å; M686-I690 WeakPolarHBondContact O-CD1 3.31Å; M686-I690 WeakPolarHBondContact O-CG1 3.36Å; M686-I690 PolarHBondContact O-N 3.13Å; I687-I690 PolarHBondContact O-N 3.04Å; I690-G692 VanDerWaalsContact C-N 3.29Å; I690-G692 PolarHBondContact O-N 3.05Å; I690-C693 PolarHBondContact O-N 3.48Å; I690-F694 PolarHBondContact O-N 2.81Å
691	M	91.9	Very high	89.4	Confident	101 Å²	101	55.5 Å²	55.5	50%	0.498	27%	0.27	S	S	.	.	H	α-helix	trans	-61.1	-40.1	174.1	-69.6	179.8	71.6	0	0	111.4	I687 F694 C695 L754	I687-M691 HydrophobicContact CG2-SD 4.05Å; I687-M691 WeakPolarHBondContact O-CB 3.48Å; I687-M691 VanDerWaalsContact O-CG 3.29Å; I687-M691 WeakPolarHBondContact O-CG 3.44Å; I687-M691 PolarHBondContact O-N 2.7Å; M691-F694 WeakPolarHBondContact O-CB 3.45Å; M691-F694 PolarHBondContact O-N 3.46Å; M691-C695 PolarHBondContact O-N 3.44Å; M691-C695 PolarHBondContact O-SG 3.09Å; M691-L754 HydrophobicContact CB-CD1 3.72Å; M691-L754 HydrophobicContact CB-CD2 4.33Å
692	G	90.9	Very high	89.7	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-64.4	-40.5	176.3	0	0	0	0	0	112.6	Y688 I689 I690 F694 C695 S696 F755	Y688-G692 PolarHBondContact O-N 3.44Å; I689-G692 CarbonylContact O-C 3.27Å; I689-G692 PolarHBondContact O-N 3.23Å; I690-G692 VanDerWaalsContact C-N 3.29Å; I690-G692 PolarHBondContact O-N 3.05Å; G692-F694 VanDerWaalsContact C-N 3.33Å; G692-C695 PolarHBondContact O-N 3.16Å; G692-S696 WeakPolarHBondContact O-CB 3.48Å; G692-S696 PolarHBondContact O-N 3.37Å; G692-S696 PolarHBondContact O-OG 3.36Å; G692-F755 VanDerWaalsContact C-CZ 3.44Å; G692-F755 VanDerWaalsContact CA-CE2 3.47Å; G692-F755 VanDerWaalsContact O-CE2 3.22Å; G692-F755 WeakPolarHBondContact O-CE2 3.45Å
693	C	89.9	Confident	89.8	Confident	27 Å²	27	55.9 Å²	55.9	18%	0.182	27%	0.272	C	S	.	.	H	α-helix	trans	-62.5	-41.9	173.5	-73.2	0	0	0	0	110.6	I689 I690 S696 I697 F815	I689-C693 WeakPolarHBondContact O-CB 3.2Å; I689-C693 PolarHBondContact O-N 3.35Å; I689-C693 PolarHBondContact O-SG 3.1Å; I690-C693 PolarHBondContact O-N 3.48Å; C693-S696 CarbonylContact O-C 3.33Å; C693-S696 WeakPolarHBondContact O-CB 3.49Å; C693-S696 PolarHBondContact O-N 3.19Å; C693-S696 VanDerWaalsContact O-N 3.12Å; C693-I697 WeakPolarHBondContact O-CG1 3.42Å; C693-I697 PolarHBondContact O-N 3.44Å; C693-F815 HydrophobicContact CB-CE1 4.32Å
694	F	92.6	Very high	90.1	Very high	133 Å²	133	46.6 Å²	46.6	58%	0.583	24%	0.237	S	C	*	.	H	α-helix	trans	-60.3	-46.8	173.5	-172.4	-99.9	0	0	0	112	I690 M691 G692 S696 I697 I698	I690-F694 PolarHBondContact O-N 2.81Å; M691-F694 WeakPolarHBondContact O-CB 3.45Å; M691-F694 PolarHBondContact O-N 3.46Å; G692-F694 VanDerWaalsContact C-N 3.33Å; F694-S696 VanDerWaalsContact C-N 3.27Å; F694-S696 PolarHBondContact O-N 3.12Å; F694-I697 WeakPolarHBondContact O-CB 3.49Å; F694-I697 PolarHBondContact O-N 3.01Å; F694-I698 HydrophobicContact CD1-CD1 3.89Å; F694-I698 HydrophobicContact CE1-CD1 3.56Å; F694-I698 HydrophobicContact CE1-CG1 4.37Å; F694-I698 HydrophobicContact CZ-CD1 4.24Å; F694-I698 WeakPolarHBondContact O-CG1 3.45Å; F694-I698 PolarHBondContact O-N 3.4Å; F694-I698 VanDerWaalsContact O-N 3.11Å
695	C	91.7	Very high	90.2	Very high	16 Å²	16	44.5 Å²	44.5	11%	0.108	23%	0.226	C	C	.	.	H	α-helix	trans	-58.6	-38.4	172	-68.4	0	0	0	0	112.4	M691 G692 I698 S699 I747 Q751	M691-C695 PolarHBondContact O-N 3.44Å; M691-C695 PolarHBondContact O-SG 3.09Å; G692-C695 PolarHBondContact O-N 3.16Å; C695-I698 PolarHBondContact O-N 3.42Å; C695-S699 WeakPolarHBondContact O-CB 3.48Å; C695-S699 PolarHBondContact O-N 3.26Å; C695-I747 HydrophobicContact CB-CG2 4.22Å; C695-I747 WeakPolarHBondContact O-CG2 3.43Å; C695-Q751 HydrophobicContact CB-CB 4.12Å
696	S	90.4	Very high	90.3	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-69.8	-31.4	178.1	-54.8	0	0	0	0	112.5	G692 C693 F694 G700 F755 S812	G692-S696 WeakPolarHBondContact O-CB 3.48Å; G692-S696 PolarHBondContact O-N 3.37Å; G692-S696 PolarHBondContact O-OG 3.36Å; C693-S696 CarbonylContact O-C 3.33Å; C693-S696 WeakPolarHBondContact O-CB 3.49Å; C693-S696 PolarHBondContact O-N 3.19Å; C693-S696 VanDerWaalsContact O-N 3.12Å; F694-S696 VanDerWaalsContact C-N 3.27Å; F694-S696 PolarHBondContact O-N 3.12Å; S696-G700 PolarHBondContact O-N 2.94Å; S696-F755 VanDerWaalsContact OG-CE2 3.28Å; S696-F755 WeakPolarHBondContact OG-CE2 3.38Å; S696-S812 PolarHBondContact OG-OG 2.95Å
697	I	92.3	Very high	90.4	Very high	63 Å²	63	41.9 Å²	41.9	32%	0.323	21%	0.213	S	C	.	.	H	α-helix	trans	-63.6	-50.2	171.2	-67.6	166.8	0	0	0	109.1	C693 F694 S699 G700 L701 F815 V819	C693-I697 WeakPolarHBondContact O-CG1 3.42Å; C693-I697 PolarHBondContact O-N 3.44Å; F694-I697 WeakPolarHBondContact O-CB 3.49Å; F694-I697 PolarHBondContact O-N 3.01Å; I697-S699 VanDerWaalsContact C-N 3.32Å; I697-S699 PolarHBondContact O-N 3.16Å; I697-G700 PolarHBondContact O-N 3.4Å; I697-L701 HydrophobicContact CG2-CD1 3.87Å; I697-L701 HydrophobicContact CG2-CG 4.39Å; I697-L701 WeakPolarHBondContact O-CB 3.5Å; I697-L701 VanDerWaalsContact O-CG 3.3Å; I697-L701 WeakPolarHBondContact O-CG 3.33Å; I697-L701 PolarHBondContact O-N 3.48Å; I697-F815 HydrophobicContact CD1-CE1 4.1Å; I697-F815 HydrophobicContact CG1-CD1 4.3Å; I697-F815 HydrophobicContact CG1-CE1 3.65Å; I697-V819 HydrophobicContact CG1-CG2 4.14Å; I697-V819 HydrophobicContact CG2-CG1 4.5Å
698	I	92.5	Very high	90.4	Very high	56 Å²	56	38.5 Å²	38.5	29%	0.287	20%	0.196	S	C	.	.	H	α-helix	trans	-62.1	-44.6	179.7	-54.4	165.5	0	0	0	109.8	F694 C695 G700 L701 L702 I747	F694-I698 HydrophobicContact CD1-CD1 3.89Å; F694-I698 HydrophobicContact CE1-CD1 3.56Å; F694-I698 HydrophobicContact CE1-CG1 4.37Å; F694-I698 HydrophobicContact CZ-CD1 4.24Å; F694-I698 WeakPolarHBondContact O-CG1 3.45Å; F694-I698 PolarHBondContact O-N 3.4Å; F694-I698 VanDerWaalsContact O-N 3.11Å; C695-I698 PolarHBondContact O-N 3.42Å; I698-G700 VanDerWaalsContact C-N 3.35Å; I698-G700 PolarHBondContact O-N 3Å; I698-L701 PolarHBondContact O-N 3.47Å; I698-L701 VanDerWaalsContact O-N 3.12Å; I698-L702 HydrophobicContact CG2-CG 4.5Å; I698-L702 WeakPolarHBondContact O-CG 3.46Å; I698-L702 PolarHBondContact O-N 3.06Å; I698-I747 HydrophobicContact CB-CD1 3.77Å; I698-I747 HydrophobicContact CD1-CD1 4.39Å; I698-I747 HydrophobicContact CG2-CD1 3.22Å
699	S	89.1	Confident	90.4	Very high	1 Å²	1	36.4 Å²	36.4	1%	0.007	19%	0.189	C	C	.	.	H	α-helix	trans	-61.7	-40.5	176.6	-161.9	0	0	0	0	113.1	C695 I697 L701 L702 Q744	C695-S699 WeakPolarHBondContact O-CB 3.48Å; C695-S699 PolarHBondContact O-N 3.26Å; I697-S699 VanDerWaalsContact C-N 3.32Å; I697-S699 PolarHBondContact O-N 3.16Å; S699-L701 VanDerWaalsContact C-N 3.28Å; S699-L701 PolarHBondContact O-N 3.18Å; S699-L702 PolarHBondContact O-N 3.38Å; S699-Q744 PolarHBondContact OG-NE2 2.67Å; S699-Q744 PolarHBondContact OG-OE1 3.47Å
700	G	89.1	Confident	90.5	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-65.2	-28.9	174.7	0	0	0	0	0	113.5	S696 I697 I698 P704	S696-G700 PolarHBondContact O-N 2.94Å; I697-G700 PolarHBondContact O-N 3.4Å; I698-G700 VanDerWaalsContact C-N 3.35Å; I698-G700 PolarHBondContact O-N 3Å; G700-P704 WeakPolarHBondContact O-CD 3.41Å
701	L	92.1	Very high	90.3	Very high	84 Å²	84	31.1 Å²	31.1	44%	0.44	16%	0.162	S	C	.	.	H	α-helix	trans	-84	-20.7	175.6	-69.7	174.4	0	0	0	113.7	I697 I698 S699 Q703 P704 A705 V819 A823	I697-L701 HydrophobicContact CG2-CD1 3.87Å; I697-L701 HydrophobicContact CG2-CG 4.39Å; I697-L701 WeakPolarHBondContact O-CB 3.5Å; I697-L701 VanDerWaalsContact O-CG 3.3Å; I697-L701 WeakPolarHBondContact O-CG 3.33Å; I697-L701 PolarHBondContact O-N 3.48Å; I698-L701 PolarHBondContact O-N 3.47Å; I698-L701 VanDerWaalsContact O-N 3.12Å; S699-L701 VanDerWaalsContact C-N 3.28Å; S699-L701 PolarHBondContact O-N 3.18Å; L701-Q703 PolarHBondContact O-N 2.62Å; L701-P704 WeakPolarHBondContact O-CD 3.44Å; L701-A705 VanDerWaalsContact O-CB 3.27Å; L701-A705 WeakPolarHBondContact O-CB 3.29Å; L701-A705 PolarHBondContact O-N 2.95Å; L701-V819 HydrophobicContact CD2-CG1 4.21Å; L701-V819 HydrophobicContact CG-CG1 4.09Å; L701-A823 HydrophobicContact CD2-CB 3.87Å
702	L	90.5	Very high	90.2	Very high	9 Å²	9	28.2 Å²	28.2	5%	0.047	15%	0.147	C	C	.	.	H	α-helix	trans	-65.3	-36.5	178.4	-77.2	168	0	0	0	112.6	I698 S699 A705 F706 L740 I743 Q744 I747	I698-L702 HydrophobicContact CG2-CG 4.5Å; I698-L702 WeakPolarHBondContact O-CG 3.46Å; I698-L702 PolarHBondContact O-N 3.06Å; S699-L702 PolarHBondContact O-N 3.38Å; L702-A705 PolarHBondContact O-N 3.4Å; L702-F706 WeakPolarHBondContact O-CB 3.31Å; L702-F706 PolarHBondContact O-N 2.89Å; L702-L740 HydrophobicContact CD2-CB 4.33Å; L702-L740 HydrophobicContact CD2-CD2 3.74Å; L702-L740 HydrophobicContact CD2-CG 4.47Å; L702-I743 HydrophobicContact CD1-CG2 4.02Å; L702-I743 HydrophobicContact CD2-CB 4.44Å; L702-I743 HydrophobicContact CD2-CG2 3.96Å; L702-Q744 HydrophobicContact CD1-CB 4.2Å; L702-I747 HydrophobicContact CD1-CD1 3.98Å
703	Q	86.6	Confident	90	Very high	30 Å²	30	28.2 Å²	28.2	14%	0.14	15%	0.147	C	C	.	.	H	α-helix	trans	-69.6	-45.5	178.7	-65.7	179.3	24.4	0	0	113	L701 A705 F706 S707 E816 L820	L701-Q703 PolarHBondContact O-N 2.62Å; Q703-A705 VanDerWaalsContact C-N 3.34Å; Q703-F706 PolarHBondContact O-N 3.21Å; Q703-S707 PolarHBondContact O-N 2.98Å; Q703-E816 PolarHBondContact NE2-OE1 3.49Å; Q703-E816 VanDerWaalsContact NE2-OE1 3.12Å; Q703-L820 HydrophobicContact CB-CD1 3.99Å
704	P	90	Very high	89.8	Confident	3 Å²	3	27 Å²	27	2%	0.019	14%	0.138	C	C	.	.	H	α-helix	trans	-63	-37.4	170.4	-23.2	33.7	0	0	0	112.9	G700 L701 F706 S707 L708 L820 A823 I827	G700-P704 WeakPolarHBondContact O-CD 3.41Å; L701-P704 WeakPolarHBondContact O-CD 3.44Å; P704-F706 VanDerWaalsContact C-N 3.35Å; P704-F706 PolarHBondContact O-N 2.81Å; P704-S707 WeakPolarHBondContact O-CB 3.32Å; P704-S707 PolarHBondContact O-N 3.46Å; P704-S707 VanDerWaalsContact O-N 3.16Å; P704-L708 WeakPolarHBondContact O-CG 3.35Å; P704-L708 PolarHBondContact O-N 2.93Å; P704-L820 HydrophobicContact CG-CD1 3.67Å; P704-A823 HydrophobicContact CB-CB 4.36Å; P704-A823 HydrophobicContact CG-CB 3.84Å; P704-I827 HydrophobicContact CB-CD1 3.58Å
705	A	91.4	Very high	89.4	Confident	34 Å²	34	23.6 Å²	23.6	28%	0.281	12%	0.124	S	C	.	.	H	α-helix	trans	-60.6	-45.2	173.9	0	0	0	0	0	111.3	L701 L702 Q703 S707 L708 L709 L740	L701-A705 VanDerWaalsContact O-CB 3.27Å; L701-A705 WeakPolarHBondContact O-CB 3.29Å; L701-A705 PolarHBondContact O-N 2.95Å; L702-A705 PolarHBondContact O-N 3.4Å; Q703-A705 VanDerWaalsContact C-N 3.34Å; A705-S707 VanDerWaalsContact C-N 3.33Å; A705-S707 PolarHBondContact O-N 3.26Å; A705-L708 PolarHBondContact O-N 3.43Å; A705-L709 WeakPolarHBondContact O-CG 3.26Å; A705-L709 PolarHBondContact O-N 3.34Å; A705-L740 HydrophobicContact CB-CD1 4.03Å
706	F	89.5	Confident	89.1	Confident	12 Å²	12	22.9 Å²	22.9	5%	0.053	12%	0.119	C	C	.	.	H	α-helix	trans	-61	-41.4	172.6	-179.9	-97.8	0	0	0	111.8	F279 A282 L702 Q703 P704 L708 L709 Y710 M737 L740	F279-F706 HydrophobicContact CD1-CD1 4.46Å; F279-F706 AromaticContact CD1-CD2 3.47Å; F279-F706 HydrophobicContact CD1-CD2 3.47Å; F279-F706 VanDerWaalsContact CD1-CD2 3.47Å; F279-F706 AromaticContact CD1-CE2 3.6Å; F279-F706 HydrophobicContact CD1-CE2 3.6Å; F279-F706 AromaticContact CD1-CG 3.94Å; F279-F706 HydrophobicContact CD1-CG 3.94Å; F279-F706 HydrophobicContact CD1-CZ 4.16Å; F279-F706 HydrophobicContact CE1-CB 4.04Å; F279-F706 HydrophobicContact CE1-CD1 4.02Å; F279-F706 AromaticContact CE1-CD2 3.67Å; F279-F706 HydrophobicContact CE1-CD2 3.67Å; F279-F706 HydrophobicContact CE1-CE1 4.43Å; F279-F706 HydrophobicContact CE1-CE2 4.12Å; F279-F706 AromaticContact CE1-CG 3.62Å; F279-F706 HydrophobicContact CE1-CG 3.62Å; F279-F706 HydrophobicContact CE1-CZ 4.48Å; F279-F706 HydrophobicContact CG-CD2 4.08Å; F279-F706 HydrophobicContact CG-CE2 4.32Å; F279-F706 HydrophobicContact CZ-CB 4.15Å; F279-F706 HydrophobicContact CZ-CD2 4.42Å; F279-F706 HydrophobicContact CZ-CG 4.23Å; A282-F706 HydrophobicContact CB-CE2 3.9Å; A282-F706 HydrophobicContact CB-CZ 3.77Å; L702-F706 WeakPolarHBondContact O-CB 3.31Å; L702-F706 PolarHBondContact O-N 2.89Å; Q703-F706 PolarHBondContact O-N 3.21Å; P704-F706 VanDerWaalsContact C-N 3.35Å; P704-F706 PolarHBondContact O-N 2.81Å; F706-L708 VanDerWaalsContact C-N 3.31Å; F706-L708 PolarHBondContact O-N 3.32Å; F706-L709 PolarHBondContact O-N 3.27Å; F706-Y710 VanDerWaalsContact O-CB 3.28Å; F706-Y710 WeakPolarHBondContact O-CB 3.34Å; F706-Y710 PolarHBondContact O-N 2.93Å; F706-M737 HydrophobicContact CE2-CG 4.41Å; F706-M737 HydrophobicContact CE2-SD 4.34Å; F706-L740 HydrophobicContact CB-CD1 4.34Å
707	S	88	Confident	88.7	Confident	0 Å²	0	23 Å²	23	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-58.4	-41.9	174.8	173.7	0	0	0	0	112.4	Q703 P704 A705 S711 I954 T955	Q703-S707 PolarHBondContact O-N 2.98Å; P704-S707 WeakPolarHBondContact O-CB 3.32Å; P704-S707 PolarHBondContact O-N 3.46Å; P704-S707 VanDerWaalsContact O-N 3.16Å; A705-S707 VanDerWaalsContact C-N 3.33Å; A705-S707 PolarHBondContact O-N 3.26Å; S707-S711 PolarHBondContact O-N 3.33Å; S707-I954 WeakPolarHBondContact OG-CB 3.27Å; S707-I954 WeakPolarHBondContact OG-CG2 3.34Å; S707-T955 VanDerWaalsContact OG-CA 3.31Å; S707-T955 WeakPolarHBondContact OG-CA 3.47Å; S707-T955 PolarHBondContact OG-N 2.98Å; S707-T955 PolarHBondContact OG-OG1 3.05Å
708	L	90.9	Very high	88	Confident	46 Å²	46	24.9 Å²	24.9	24%	0.241	13%	0.131	C	C	.	.	H	α-helix	trans	-68.1	-46.5	178	-71.1	175	0	0	0	111	P704 A705 F706 Y710 S711 E712 I827 Y831 K951	P704-L708 WeakPolarHBondContact O-CG 3.35Å; P704-L708 PolarHBondContact O-N 2.93Å; A705-L708 PolarHBondContact O-N 3.43Å; F706-L708 VanDerWaalsContact C-N 3.31Å; F706-L708 PolarHBondContact O-N 3.32Å; L708-Y710 VanDerWaalsContact C-N 3.28Å; L708-Y710 PolarHBondContact O-N 2.74Å; L708-S711 WeakPolarHBondContact O-CB 3.19Å; L708-S711 PolarHBondContact O-N 3.09Å; L708-S711 VanDerWaalsContact O-N 3.12Å; L708-S711 PolarHBondContact O-OG 3.4Å; L708-E712 WeakPolarHBondContact O-CG 2.95Å; L708-E712 PolarHBondContact O-N 3.06Å; L708-I827 HydrophobicContact CD1-CD1 4.08Å; L708-I827 HydrophobicContact CD2-CG2 3.93Å; L708-I827 HydrophobicContact CG-CD1 4.41Å; L708-Y831 HydrophobicContact CD2-CE2 3.73Å; L708-K951 HydrophobicContact CD2-CD 4.3Å; L708-K951 HydrophobicContact CD2-CG 4.31Å
709	L	90.9	Very high	87.4	Confident	25 Å²	25	24.3 Å²	24.3	13%	0.131	13%	0.128	C	C	.	.	H	α-helix	trans	-60.2	-40.9	175.4	-67.8	172.2	0	0	0	111.7	A705 F706 S711 E712 V713 V733 I736 M737 L740	A705-L709 WeakPolarHBondContact O-CG 3.26Å; A705-L709 PolarHBondContact O-N 3.34Å; F706-L709 PolarHBondContact O-N 3.27Å; L709-S711 VanDerWaalsContact C-N 3.31Å; L709-S711 PolarHBondContact O-N 3.47Å; L709-E712 WeakPolarHBondContact O-CB 3.45Å; L709-E712 PolarHBondContact O-N 2.72Å; L709-V713 PolarHBondContact O-N 3.5Å; L709-V733 HydrophobicContact CB-CG1 4.4Å; L709-I736 HydrophobicContact CD1-CB 4.2Å; L709-I736 HydrophobicContact CD1-CG2 3.58Å; L709-I736 HydrophobicContact CD2-CB 4.22Å; L709-I736 HydrophobicContact CD2-CD1 4.45Å; L709-I736 HydrophobicContact CD2-CG2 3.93Å; L709-I736 HydrophobicContact CG-CG2 4.4Å; L709-M737 HydrophobicContact CB-CE 3.69Å; L709-M737 HydrophobicContact CB-CG 3.94Å; L709-M737 HydrophobicContact CD1-CG 3.93Å; L709-M737 WeakPolarHBondContact O-CE 3.47Å; L709-L740 HydrophobicContact CD1-CD1 3.44Å; L709-L740 VanDerWaalsContact CD1-CD1 3.44Å; L709-L740 HydrophobicContact CD1-CG 4.05Å
710	Y	88.8	Confident	86.5	Confident	13 Å²	13	28.7 Å²	28.7	5%	0.051	14%	0.144	C	C	.	.	H	α-helix	trans	-63.7	-38.8	176.4	178.7	-143.5	0	0	0	111.4	F286 F307 F706 L708 E712 V713 Y714 I954	F286-Y710 HydrophobicContact CE1-CD2 4.07Å; F286-Y710 AromaticContact CE1-CE2 3.65Å; F286-Y710 HydrophobicContact CE1-CE2 3.65Å; F286-Y710 AromaticContact CE2-CD2 3.56Å; F286-Y710 HydrophobicContact CE2-CD2 3.56Å; F286-Y710 AromaticContact CE2-CE2 3.95Å; F286-Y710 HydrophobicContact CE2-CE2 3.95Å; F286-Y710 HydrophobicContact CE2-CG 4.48Å; F286-Y710 AromaticContact CZ-CD2 3.24Å; F286-Y710 HydrophobicContact CZ-CD2 3.24Å; F286-Y710 AromaticContact CZ-CE2 3.11Å; F286-Y710 HydrophobicContact CZ-CE2 3.11Å; F286-Y710 HydrophobicContact CZ-CG 4.37Å; F307-Y710 HydrophobicContact CD1-CE2 4.39Å; F307-Y710 HydrophobicContact CE1-CE2 4.32Å; F706-Y710 VanDerWaalsContact O-CB 3.28Å; F706-Y710 WeakPolarHBondContact O-CB 3.34Å; F706-Y710 PolarHBondContact O-N 2.93Å; L708-Y710 VanDerWaalsContact C-N 3.28Å; L708-Y710 PolarHBondContact O-N 2.74Å; Y710-E712 VanDerWaalsContact C-N 3.32Å; Y710-E712 PolarHBondContact O-N 3.22Å; Y710-V713 WeakPolarHBondContact O-CB 3.05Å; Y710-V713 PolarHBondContact O-N 3.32Å; Y710-Y714 HydrophobicContact CD2-CE2 4.37Å; Y710-Y714 HydrophobicContact CE1-CE2 4.5Å; Y710-Y714 AromaticContact CE2-CE2 3.89Å; Y710-Y714 HydrophobicContact CE2-CE2 3.89Å; Y710-Y714 AromaticContact CZ-CE2 3.97Å; Y710-Y714 WeakPolarHBondContact O-CD2 3.42Å; Y710-Y714 PolarHBondContact OH-OH 2.88Å; Y710-Y714 VanDerWaalsContact OH-OH 3.13Å; Y710-I954 HydrophobicContact CD1-CB 4.39Å; Y710-I954 HydrophobicContact CD1-CD1 3.46Å; Y710-I954 VanDerWaalsContact CD1-CD1 3.46Å; Y710-I954 HydrophobicContact CD1-CG1 3.88Å; Y710-I954 HydrophobicContact CD1-CG2 3.57Å; Y710-I954 HydrophobicContact CE1-CD1 3.71Å; Y710-I954 HydrophobicContact CE1-CG1 3.92Å; Y710-I954 HydrophobicContact CE1-CG2 4.2Å; Y710-I954 HydrophobicContact CG-CD1 4.02Å
711	S	88.3	Confident	85.7	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-65	-33	173.8	78.9	0	0	0	0	113.4	S707 L708 L709 V713 Y714 K951	S707-S711 PolarHBondContact O-N 3.33Å; L708-S711 WeakPolarHBondContact O-CB 3.19Å; L708-S711 PolarHBondContact O-N 3.09Å; L708-S711 VanDerWaalsContact O-N 3.12Å; L708-S711 PolarHBondContact O-OG 3.4Å; L709-S711 VanDerWaalsContact C-N 3.31Å; L709-S711 PolarHBondContact O-N 3.47Å; S711-V713 PolarHBondContact O-N 3.02Å; S711-Y714 WeakPolarHBondContact O-CB 3.36Å; S711-Y714 PolarHBondContact O-N 3.27Å; S711-Y714 VanDerWaalsContact O-N 3.07Å; S711-K951 VanDerWaalsContact CB-CG 3.46Å; S711-K951 WeakPolarHBondContact OG-CE 3.32Å; S711-K951 WeakPolarHBondContact OG-CG 3.39Å
712	E	88.4	Confident	85.2	Confident	40 Å²	40	36.6 Å²	36.6	19%	0.187	18%	0.18	C	C	.	.	H	α-helix	trans	-67	-25.3	177.6	-72.4	-67.5	142.2	0	0	112.3	L708 L709 Y710 Y714 Q715 V716 K729 V733 K951	L708-E712 WeakPolarHBondContact O-CG 2.95Å; L708-E712 PolarHBondContact O-N 3.06Å; L709-E712 WeakPolarHBondContact O-CB 3.45Å; L709-E712 PolarHBondContact O-N 2.72Å; Y710-E712 VanDerWaalsContact C-N 3.32Å; Y710-E712 PolarHBondContact O-N 3.22Å; E712-Y714 PolarHBondContact O-N 3.46Å; E712-Q715 WeakPolarHBondContact O-CB 3.27Å; E712-Q715 PolarHBondContact O-N 3.09Å; E712-Q715 PolarHBondContact OE2-OE1 2.75Å; E712-V716 PolarHBondContact O-N 3.46Å; E712-V716 VanDerWaalsContact O-N 3.13Å; E712-K729 WeakPolarHBondContact OE2-CE 3.42Å; E712-K729 IonicContact OE2-NZ 2.81Å; E712-K729 PolarHBondContact OE2-NZ 3.43Å; E712-V733 HydrophobicContact CB-CG2 4.21Å; E712-K951 WeakPolarHBondContact OE1-CE 3.48Å; E712-K951 IonicContact OE1-NZ 2.97Å; E712-K951 PolarHBondContact OE1-NZ 3.47Å
713	V	88	Confident	84.6	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-59	-34.8	171.6	-178.8	0	0	0	0	110.8	F286 L709 Y710 S711 Q715 V716 F717 V733 M737	F286-V713 HydrophobicContact CB-CG1 4.34Å; F286-V713 HydrophobicContact CB-CG2 4.39Å; F286-V713 HydrophobicContact CD1-CG1 3.87Å; F286-V713 HydrophobicContact CD2-CG2 4.04Å; F286-V713 HydrophobicContact CE1-CG1 4.41Å; F286-V713 HydrophobicContact CE2-CG2 4.49Å; F286-V713 HydrophobicContact CG-CG1 4.1Å; F286-V713 HydrophobicContact CG-CG2 4.08Å; L709-V713 PolarHBondContact O-N 3.5Å; Y710-V713 WeakPolarHBondContact O-CB 3.05Å; Y710-V713 PolarHBondContact O-N 3.32Å; S711-V713 PolarHBondContact O-N 3.02Å; V713-Q715 VanDerWaalsContact C-N 3.31Å; V713-Q715 PolarHBondContact O-N 3.32Å; V713-V716 WeakPolarHBondContact O-CB 3.35Å; V713-V716 PolarHBondContact O-N 3.23Å; V713-F717 HydrophobicContact CG1-CE1 4.1Å; V713-F717 HydrophobicContact CG1-CE2 3.89Å; V713-F717 HydrophobicContact CG1-CZ 3.53Å; V713-F717 WeakPolarHBondContact O-CD2 3.08Å; V713-F717 WeakPolarHBondContact O-CG 3.43Å; V713-F717 PolarHBondContact O-N 2.91Å; V713-V733 HydrophobicContact CG2-CG1 4.01Å; V713-M737 HydrophobicContact CG2-CE 3.82Å
714	Y	85.7	Confident	84.4	Confident	2 Å²	2	44.1 Å²	44.1	1%	0.008	22%	0.224	C	C	.	.	H	α-helix	trans	-66	-33.8	175	-66.9	-101.2	0	0	0	112.2	I71 F75 I304 Y710 S711 E712 F717 F950 I954	I71-Y714 HydrophobicContact CD1-CE1 4.28Å; I71-Y714 HydrophobicContact CG1-CE1 4.44Å; F75-Y714 HydrophobicContact CE2-CD1 4.2Å; F75-Y714 HydrophobicContact CZ-CD1 4.35Å; F75-Y714 WeakPolarHBondContact CZ-O 3.24Å; I304-Y714 HydrophobicContact CD1-CD1 3.8Å; I304-Y714 HydrophobicContact CD1-CE1 3.17Å; I304-Y714 HydrophobicContact CD1-CE2 4.4Å; I304-Y714 HydrophobicContact CG1-CE1 4.26Å; Y710-Y714 HydrophobicContact CD2-CE2 4.37Å; Y710-Y714 HydrophobicContact CE1-CE2 4.5Å; Y710-Y714 AromaticContact CE2-CE2 3.89Å; Y710-Y714 HydrophobicContact CE2-CE2 3.89Å; Y710-Y714 AromaticContact CZ-CE2 3.97Å; Y710-Y714 WeakPolarHBondContact O-CD2 3.42Å; Y710-Y714 PolarHBondContact OH-OH 2.88Å; Y710-Y714 VanDerWaalsContact OH-OH 3.13Å; S711-Y714 WeakPolarHBondContact O-CB 3.36Å; S711-Y714 PolarHBondContact O-N 3.27Å; S711-Y714 VanDerWaalsContact O-N 3.07Å; E712-Y714 PolarHBondContact O-N 3.46Å; Y714-F717 WeakPolarHBondContact O-CB 3.25Å; Y714-F717 PolarHBondContact O-N 2.99Å; Y714-F950 AromaticContact CD1-CD1 3.91Å; Y714-F950 HydrophobicContact CD1-CD1 3.91Å; Y714-F950 AromaticContact CD1-CD2 3.61Å; Y714-F950 HydrophobicContact CD1-CD2 3.61Å; Y714-F950 AromaticContact CD1-CE1 3.89Å; Y714-F950 HydrophobicContact CD1-CE1 3.89Å; Y714-F950 AromaticContact CD1-CE2 3.57Å; Y714-F950 HydrophobicContact CD1-CE2 3.57Å; Y714-F950 AromaticContact CD1-CG 3.79Å; Y714-F950 HydrophobicContact CD1-CG 3.79Å; Y714-F950 AromaticContact CD1-CZ 3.73Å; Y714-F950 HydrophobicContact CD1-CZ 3.73Å; Y714-F950 HydrophobicContact CD2-CB 4.31Å; Y714-F950 HydrophobicContact CD2-CG 4.31Å; Y714-F950 AromaticContact CE1-CD1 3.57Å; Y714-F950 HydrophobicContact CE1-CD1 3.57Å; Y714-F950 HydrophobicContact CE1-CD2 4.16Å; Y714-F950 AromaticContact CE1-CE1 3.46Å; Y714-F950 HydrophobicContact CE1-CE1 3.46Å; Y714-F950 VanDerWaalsContact CE1-CE1 3.46Å; Y714-F950 HydrophobicContact CE1-CE2 4.05Å; Y714-F950 AromaticContact CE1-CG 3.94Å; Y714-F950 HydrophobicContact CE1-CG 3.94Å; Y714-F950 AromaticContact CE1-CZ 3.72Å; Y714-F950 HydrophobicContact CE1-CZ 3.72Å; Y714-F950 HydrophobicContact CE2-CD1 4.44Å; Y714-F950 HydrophobicContact CE2-CG 4.49Å; Y714-F950 HydrophobicContact CG-CB 4.34Å; Y714-F950 HydrophobicContact CG-CD1 4.44Å; Y714-F950 AromaticContact CG-CD2 3.87Å; Y714-F950 HydrophobicContact CG-CD2 3.87Å; Y714-F950 HydrophobicContact CG-CE2 4.27Å; Y714-F950 AromaticContact CG-CG 3.97Å; Y714-F950 HydrophobicContact CG-CG 3.97Å; Y714-F950 AromaticContact CZ-CD1 3.89Å; Y714-I954 HydrophobicContact CD2-CD1 4.45Å; Y714-I954 HydrophobicContact CE2-CD1 3.85Å
715	Q	84.2	Confident	84.2	Confident	62 Å²	62	49.3 Å²	49.3	29%	0.29	25%	0.248	S	C	.	.	H	α-helix	trans	-69.9	-33.9	175.1	-172.3	172.7	20.5	0	0	111.9	E712 V713 F717 D718 I947	E712-Q715 WeakPolarHBondContact O-CB 3.27Å; E712-Q715 PolarHBondContact O-N 3.09Å; E712-Q715 PolarHBondContact OE2-OE1 2.75Å; V713-Q715 VanDerWaalsContact C-N 3.31Å; V713-Q715 PolarHBondContact O-N 3.32Å; Q715-F717 PolarHBondContact O-N 3.46Å; Q715-D718 WeakPolarHBondContact O-CB 3.33Å; Q715-D718 PolarHBondContact O-N 3.33Å; Q715-I947 HydrophobicContact CB-CD1 3.76Å; Q715-I947 HydrophobicContact CB-CG1 4.19Å; Q715-I947 HydrophobicContact CG-CD1 3.58Å
716	V	85.5	Confident	83.8	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-59.2	-32.8	173.5	177.4	0	0	0	0	111	V290 E712 V713 D718 L719 M726 K729 I730	V290-V716 HydrophobicContact CG1-CG1 3.99Å; V290-V716 HydrophobicContact CG2-CG1 3.95Å; E712-V716 PolarHBondContact O-N 3.46Å; E712-V716 VanDerWaalsContact O-N 3.13Å; V713-V716 WeakPolarHBondContact O-CB 3.35Å; V713-V716 PolarHBondContact O-N 3.23Å; V716-D718 VanDerWaalsContact C-N 3.27Å; V716-D718 PolarHBondContact O-N 3.25Å; V716-L719 PolarHBondContact O-N 3.13Å; V716-M726 HydrophobicContact CG1-CG 3.6Å; V716-K729 HydrophobicContact CG2-CB 4.14Å; V716-K729 HydrophobicContact CG2-CD 4.01Å; V716-K729 HydrophobicContact CG2-CG 3.81Å; V716-I730 HydrophobicContact CG1-CB 4.24Å
717	F	81.6	Confident	83.6	Confident	2 Å²	2	48.9 Å²	48.9	1%	0.009	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-13.4	177	-55.7	-36.2	0	0	0	114.9	F75 V290 I293 P300 V303 I304 V713 Y714 Q715 R720	F75-F717 HydrophobicContact CE1-CB 3.98Å; F75-F717 HydrophobicContact CE2-CB 4.4Å; F75-F717 HydrophobicContact CE2-CD2 4.34Å; F75-F717 HydrophobicContact CZ-CB 3.84Å; F75-F717 HydrophobicContact CZ-CD2 4.24Å; V290-F717 HydrophobicContact CG2-CD1 4.41Å; V290-F717 HydrophobicContact CG2-CE1 3.79Å; I293-F717 HydrophobicContact CD1-CD1 3.37Å; I293-F717 HydrophobicContact CD1-CE1 3.2Å; I293-F717 HydrophobicContact CD1-CG 4.39Å; I293-F717 HydrophobicContact CD1-CZ 4.1Å; P300-F717 HydrophobicContact CB-CB 3.94Å; P300-F717 HydrophobicContact CB-CD1 4.18Å; P300-F717 HydrophobicContact CB-CD2 3.6Å; P300-F717 HydrophobicContact CB-CE2 4.07Å; P300-F717 HydrophobicContact CB-CG 3.66Å; P300-F717 HydrophobicContact CG-CB 3.93Å; P300-F717 HydrophobicContact CG-CD1 4.49Å; P300-F717 HydrophobicContact CG-CD2 4.48Å; P300-F717 HydrophobicContact CG-CG 4.09Å; V303-F717 HydrophobicContact CB-CZ 4.45Å; V303-F717 HydrophobicContact CG1-CZ 4.3Å; I304-F717 HydrophobicContact CD1-CD2 4.34Å; I304-F717 HydrophobicContact CD1-CE2 3.69Å; I304-F717 HydrophobicContact CG1-CE2 3.97Å; V713-F717 HydrophobicContact CG1-CE1 4.1Å; V713-F717 HydrophobicContact CG1-CE2 3.89Å; V713-F717 HydrophobicContact CG1-CZ 3.53Å; V713-F717 WeakPolarHBondContact O-CD2 3.08Å; V713-F717 WeakPolarHBondContact O-CG 3.43Å; V713-F717 PolarHBondContact O-N 2.91Å; Y714-F717 WeakPolarHBondContact O-CB 3.25Å; Y714-F717 PolarHBondContact O-N 2.99Å; Q715-F717 PolarHBondContact O-N 3.46Å; F717-R720 WeakPolarHBondContact O-CG 3.49Å; F717-R720 PolarHBondContact O-NE 2.86Å
718	D	77.7	Confident	83.7	Confident	103 Å²	103	56.8 Å²	56.8	55%	0.551	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.7	-22.9	174.1	-153.2	22.2	0	0	0	111.4	F75 Q715 V716 R720	F75-D718 HydrophobicContact CE1-CB 4.48Å; Q715-D718 WeakPolarHBondContact O-CB 3.33Å; Q715-D718 PolarHBondContact O-N 3.33Å; V716-D718 VanDerWaalsContact C-N 3.27Å; V716-D718 PolarHBondContact O-N 3.25Å; D718-R720 PolarHBondContact O-N 2.74Å; D718-R720 VanDerWaalsContact O-N 3.08Å
719	L	79.4	Confident	83.6	Confident	44 Å²	44	56.6 Å²	56.6	23%	0.23	27%	0.274	C	S	.	.	G	3₁₀ helix	trans	-79.2	23	178.7	-62.5	173.7	0	0	0	113.8	V716 K721 T722 M726 K729	V716-L719 PolarHBondContact O-N 3.13Å; L719-K721 PolarHBondContact O-N 3.28Å; L719-T722 CarbonylContact O-C 3.56Å; L719-T722 PolarHBondContact O-N 3.37Å; L719-M726 HydrophobicContact CB-CB 4.41Å; L719-K729 HydrophobicContact CD1-CD 4Å
720	R	71	Confident	83.6	Confident	94 Å²	94	55.6 Å²	55.6	36%	0.355	27%	0.269	S	S	.	.	G	3₁₀ helix	trans	-60	-23	-179.4	-64.7	-167.4	-142.6	176	18.7	113.3	P300 F717 D718 T722	P300-R720 VanDerWaalsContact CG-CZ 3.49Å; F717-R720 WeakPolarHBondContact O-CG 3.49Å; F717-R720 PolarHBondContact O-NE 2.86Å; D718-R720 PolarHBondContact O-N 2.74Å; D718-R720 VanDerWaalsContact O-N 3.08Å; R720-T722 VanDerWaalsContact C-N 3.31Å
721	K	71.6	Confident	83.8	Confident	199 Å²	199	59 Å²	59	87%	0.865	29%	0.289	S	S	*	.	G	3₁₀ helix	trans	-75.4	-18	177.6	-64	-175.9	179.3	-178.1	0	113.3	L719	L719-K721 PolarHBondContact O-N 3.28Å
722	T	82.1	Confident	84	Confident	51 Å²	51	64.3 Å²	64.3	31%	0.313	32%	0.315	S	S	.	.			trans	-127.2	82.7	-177.8	47.5	0	0	0	0	110.8	L719 R720 D724 E725 M726	L719-T722 CarbonylContact O-C 3.56Å; L719-T722 PolarHBondContact O-N 3.37Å; R720-T722 VanDerWaalsContact C-N 3.31Å; T722-D724 VanDerWaalsContact C-N 3.28Å; T722-D724 PolarHBondContact O-N 3.09Å; T722-E725 WeakPolarHBondContact CB-OE2 3.29Å; T722-E725 PolarHBondContact O-N 3.02Å; T722-E725 VanDerWaalsContact O-N 3.16Å; T722-E725 PolarHBondContact OG1-OE2 3.36Å; T722-M726 PolarHBondContact O-N 3.29Å
723	P	77.4	Confident	84.1	Confident	63 Å²	63	62.6 Å²	62.6	41%	0.409	31%	0.307	S	S	.	.	H	α-helix	trans	-62	-32.1	-172.4	24.1	-33.8	0	0	0	113.7	R294 M726 T727	R294-P723 HydrophobicContact CG-CB 4.48Å; P723-M726 PolarHBondContact O-N 3.41Å; P723-T727 WeakPolarHBondContact O-CG2 3.41Å; P723-T727 PolarHBondContact O-N 3.45Å; P723-T727 PolarHBondContact O-OG1 3.38Å
724	D	82.3	Confident	84.2	Confident	134 Å²	134	63 Å²	63	72%	0.717	31%	0.31	S	S	*	.	H	α-helix	trans	-69	-39.2	177.8	-65.6	-26.7	0	0	0	111.9	T722 T727 K728	T722-D724 VanDerWaalsContact C-N 3.28Å; T722-D724 PolarHBondContact O-N 3.09Å; D724-T727 PolarHBondContact O-OG1 2.61Å; D724-K728 WeakPolarHBondContact O-CB 3.21Å; D724-K728 PolarHBondContact O-N 2.66Å; D724-K728 VanDerWaalsContact O-N 3.11Å
725	E	84.8	Confident	84.5	Confident	111 Å²	111	65.1 Å²	65.1	52%	0.519	33%	0.332	S	S	.	.	H	α-helix	trans	-70.4	-38.5	175.3	-64.9	-175.2	151.9	0	0	111.5	T722 T727 K728 K729	T722-E725 WeakPolarHBondContact CB-OE2 3.29Å; T722-E725 PolarHBondContact O-N 3.02Å; T722-E725 VanDerWaalsContact O-N 3.16Å; T722-E725 PolarHBondContact OG1-OE2 3.36Å; E725-T727 PolarHBondContact O-N 3.17Å; E725-K728 PolarHBondContact O-N 3.47Å; E725-K729 VanDerWaalsContact O-CB 3.29Å; E725-K729 WeakPolarHBondContact O-CB 3.45Å; E725-K729 PolarHBondContact O-N 2.94Å
726	M	84.3	Confident	85	Confident	4 Å²	4	65.9 Å²	65.9	2%	0.02	34%	0.337	C	S	.	.	H	α-helix	trans	-57.9	-47.3	176.1	-173	-177.6	-174.8	0	0	111.3	V290 I293 V716 L719 T722 P723 I730	V290-M726 HydrophobicContact CB-CE 4.47Å; V290-M726 HydrophobicContact CG1-CE 3.6Å; V290-M726 HydrophobicContact CG1-CG 3.82Å; V290-M726 HydrophobicContact CG1-SD 4.25Å; I293-M726 HydrophobicContact CB-CE 4.02Å; I293-M726 HydrophobicContact CG2-CE 3.74Å; V716-M726 HydrophobicContact CG1-CG 3.6Å; L719-M726 HydrophobicContact CB-CB 4.41Å; T722-M726 PolarHBondContact O-N 3.29Å; P723-M726 PolarHBondContact O-N 3.41Å; M726-I730 WeakPolarHBondContact O-CG2 3.39Å; M726-I730 PolarHBondContact O-N 3.36Å
727	T	85.4	Confident	85.3	Confident	34 Å²	34	65.9 Å²	65.9	21%	0.209	34%	0.337	C	S	.	.	H	α-helix	trans	-68.7	-42.5	179.5	55.8	0	0	0	0	112.5	P723 D724 E725 K729 I730 N731	P723-T727 WeakPolarHBondContact O-CG2 3.41Å; P723-T727 PolarHBondContact O-N 3.45Å; P723-T727 PolarHBondContact O-OG1 3.38Å; D724-T727 PolarHBondContact O-OG1 2.61Å; E725-T727 PolarHBondContact O-N 3.17Å; T727-K729 PolarHBondContact O-N 2.9Å; T727-I730 VanDerWaalsContact O-CG2 3.3Å; T727-I730 WeakPolarHBondContact O-CG2 3.32Å; T727-N731 WeakPolarHBondContact O-CB 3.35Å; T727-N731 PolarHBondContact O-N 3.35Å; T727-N731 PolarHBondContact O-ND2 3.4Å
728	K	88.9	Confident	85.7	Confident	166 Å²	166	67.2 Å²	67.2	72%	0.722	35%	0.348	S	S	*	.	H	α-helix	trans	-61.7	-44.1	176.1	-170.4	176.8	-178.7	179.8	0	111.3	D724 E725 M732	D724-K728 WeakPolarHBondContact O-CB 3.21Å; D724-K728 PolarHBondContact O-N 2.66Å; D724-K728 VanDerWaalsContact O-N 3.11Å; E725-K728 PolarHBondContact O-N 3.47Å; K728-M732 PolarHBondContact O-N 3.4Å; K728-M732 VanDerWaalsContact O-N 3.14Å
729	K	89.5	Confident	86.4	Confident	41 Å²	41	63.7 Å²	63.7	18%	0.178	34%	0.336	C	S	.	.	H	α-helix	trans	-69.8	-42	-179.1	-167.6	168.6	179.2	173.9	0	112.2	E712 V716 L719 E725 T727 M732 V733	E712-K729 WeakPolarHBondContact OE2-CE 3.42Å; E712-K729 IonicContact OE2-NZ 2.81Å; E712-K729 PolarHBondContact OE2-NZ 3.43Å; V716-K729 HydrophobicContact CG2-CB 4.14Å; V716-K729 HydrophobicContact CG2-CD 4.01Å; V716-K729 HydrophobicContact CG2-CG 3.81Å; L719-K729 HydrophobicContact CD1-CD 4Å; E725-K729 VanDerWaalsContact O-CB 3.29Å; E725-K729 WeakPolarHBondContact O-CB 3.45Å; E725-K729 PolarHBondContact O-N 2.94Å; T727-K729 PolarHBondContact O-N 2.9Å; K729-M732 PolarHBondContact O-N 3.45Å; K729-V733 HydrophobicContact CG-CG2 4.4Å; K729-V733 WeakPolarHBondContact O-CG2 3.04Å; K729-V733 PolarHBondContact O-N 3.49Å
730	I	92	Very high	87.1	Confident	4 Å²	4	62.5 Å²	62.5	2%	0.021	33%	0.33	C	S	.	.	H	α-helix	trans	-67.8	-37.5	177.2	-169	58.7	0	0	0	112.7	F286 V290 V716 M726 T727 M732 V733 S734	F286-I730 HydrophobicContact CB-CD1 4.21Å; V290-I730 HydrophobicContact CB-CB 4.23Å; V290-I730 HydrophobicContact CB-CD1 4.45Å; V290-I730 HydrophobicContact CB-CG1 3.85Å; V290-I730 HydrophobicContact CB-CG2 4.26Å; V290-I730 HydrophobicContact CG1-CB 3.96Å; V290-I730 HydrophobicContact CG1-CG1 4.16Å; V290-I730 HydrophobicContact CG1-CG2 3.76Å; V290-I730 HydrophobicContact CG2-CB 4.18Å; V290-I730 HydrophobicContact CG2-CD1 3.73Å; V290-I730 HydrophobicContact CG2-CG1 3.67Å; V716-I730 HydrophobicContact CG1-CB 4.24Å; M726-I730 WeakPolarHBondContact O-CG2 3.39Å; M726-I730 PolarHBondContact O-N 3.36Å; T727-I730 VanDerWaalsContact O-CG2 3.3Å; T727-I730 WeakPolarHBondContact O-CG2 3.32Å; I730-M732 VanDerWaalsContact C-N 3.28Å; I730-M732 PolarHBondContact O-N 3.15Å; I730-V733 PolarHBondContact O-N 3.12Å; I730-S734 WeakPolarHBondContact CD1-OG 3.26Å; I730-S734 WeakPolarHBondContact O-CB 3.42Å; I730-S734 PolarHBondContact O-N 2.78Å; I730-S734 PolarHBondContact O-OG 2.97Å
731	N	91.2	Very high	88	Confident	86 Å²	86	58 Å²	58	46%	0.46	31%	0.313	S	S	.	.	H	α-helix	trans	-61.7	-41.7	176.3	-73.7	-14.2	0	0	0	110.4	W287 T727 G735	W287-N731 PolarHBondContact NE1-OD1 3.36Å; T727-N731 WeakPolarHBondContact O-CB 3.35Å; T727-N731 PolarHBondContact O-N 3.35Å; T727-N731 PolarHBondContact O-ND2 3.4Å; N731-G735 PolarHBondContact O-N 2.92Å
732	M	92.3	Very high	89	Confident	111 Å²	111	53.8 Å²	53.8	55%	0.547	30%	0.295	S	S	.	.	H	α-helix	trans	-64.3	-52.6	175	-172.6	-177.7	75.8	0	0	111.8	K728 K729 I730 S734 G735 I736	K728-M732 PolarHBondContact O-N 3.4Å; K728-M732 VanDerWaalsContact O-N 3.14Å; K729-M732 PolarHBondContact O-N 3.45Å; I730-M732 VanDerWaalsContact C-N 3.28Å; I730-M732 PolarHBondContact O-N 3.15Å; M732-S734 PolarHBondContact O-N 3.22Å; M732-G735 PolarHBondContact O-N 2.78Å; M732-I736 HydrophobicContact CG-CD1 3.93Å; M732-I736 VanDerWaalsContact O-CG1 3.24Å; M732-I736 WeakPolarHBondContact O-CG1 3.3Å; M732-I736 PolarHBondContact O-N 2.76Å
733	V	91.4	Very high	89.5	Confident	4 Å²	4	55.1 Å²	55.1	2%	0.024	30%	0.299	C	S	.	.	H	α-helix	trans	-61.8	-45.2	-178	172.7	0	0	0	0	111.4	L709 E712 V713 K729 I730 I736 M737	L709-V733 HydrophobicContact CB-CG1 4.4Å; E712-V733 HydrophobicContact CB-CG2 4.21Å; V713-V733 HydrophobicContact CG2-CG1 4.01Å; K729-V733 HydrophobicContact CG-CG2 4.4Å; K729-V733 WeakPolarHBondContact O-CG2 3.04Å; K729-V733 PolarHBondContact O-N 3.49Å; I730-V733 PolarHBondContact O-N 3.12Å; V733-I736 PolarHBondContact O-N 3.22Å; V733-M737 HydrophobicContact CG1-CE 3.87Å; V733-M737 HydrophobicContact CG1-SD 4.4Å; V733-M737 WeakPolarHBondContact O-CG 3.39Å; V733-M737 PolarHBondContact O-N 3.16Å
734	S	90.8	Very high	90.1	Very high	9 Å²	9	53.4 Å²	53.4	6%	0.063	29%	0.286	C	S	.	.	H	α-helix	trans	-67.3	-39	179.5	-51.3	0	0	0	0	111.6	A283 I730 M732 M737 A738	A283-S734 WeakPolarHBondContact CB-O 3.49Å; I730-S734 WeakPolarHBondContact CD1-OG 3.26Å; I730-S734 WeakPolarHBondContact O-CB 3.42Å; I730-S734 PolarHBondContact O-N 2.78Å; I730-S734 PolarHBondContact O-OG 2.97Å; M732-S734 PolarHBondContact O-N 3.22Å; S734-M737 PolarHBondContact O-N 2.94Å; S734-A738 PolarHBondContact O-N 3.39Å
735	G	91.8	Very high	90.5	Very high	46 Å²	46	49.2 Å²	49.2	47%	0.474	26%	0.263	S	S	.	.	H	α-helix	trans	-61.3	-43.6	173.8	0	0	0	0	0	112.5	N731 M732 A738 G739	N731-G735 PolarHBondContact O-N 2.92Å; M732-G735 PolarHBondContact O-N 2.78Å; G735-A738 PolarHBondContact O-N 3.36Å; G735-G739 PolarHBondContact O-N 2.84Å
736	I	93.9	Very high	90.9	Very high	78 Å²	78	50.6 Å²	50.6	40%	0.4	27%	0.268	S	S	.	.	H	α-helix	trans	-66.3	-41.8	176.3	-60.8	163.8	0	0	0	110.6	L709 M732 V733 A738 G739 L740	L709-I736 HydrophobicContact CD1-CB 4.2Å; L709-I736 HydrophobicContact CD1-CG2 3.58Å; L709-I736 HydrophobicContact CD2-CB 4.22Å; L709-I736 HydrophobicContact CD2-CD1 4.45Å; L709-I736 HydrophobicContact CD2-CG2 3.93Å; L709-I736 HydrophobicContact CG-CG2 4.4Å; M732-I736 HydrophobicContact CG-CD1 3.93Å; M732-I736 VanDerWaalsContact O-CG1 3.24Å; M732-I736 WeakPolarHBondContact O-CG1 3.3Å; M732-I736 PolarHBondContact O-N 2.76Å; V733-I736 PolarHBondContact O-N 3.22Å; I736-A738 PolarHBondContact O-N 3.48Å; I736-G739 CarbonylContact O-C 3.54Å; I736-G739 WeakPolarHBondContact O-CA 3.45Å; I736-G739 PolarHBondContact O-N 2.88Å; I736-G739 VanDerWaalsContact O-N 3.14Å; I736-L740 WeakPolarHBondContact O-CG 3.35Å; I736-L740 PolarHBondContact O-N 2.8Å
737	M	91.5	Very high	91.3	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-58.8	-45.9	176.1	-75.9	-179.6	175.6	0	0	112.3	A283 F286 F706 L709 V713 V733 S734 G739 L740 G741	A283-M737 HydrophobicContact CB-CB 3.92Å; F286-M737 HydrophobicContact CD2-CE 4.03Å; F286-M737 HydrophobicContact CD2-SD 3.88Å; F286-M737 HydrophobicContact CE2-CE 4.16Å; F286-M737 HydrophobicContact CE2-SD 4.34Å; F706-M737 HydrophobicContact CE2-CG 4.41Å; F706-M737 HydrophobicContact CE2-SD 4.34Å; L709-M737 HydrophobicContact CB-CE 3.69Å; L709-M737 HydrophobicContact CB-CG 3.94Å; L709-M737 HydrophobicContact CD1-CG 3.93Å; L709-M737 WeakPolarHBondContact O-CE 3.47Å; V713-M737 HydrophobicContact CG2-CE 3.82Å; V733-M737 HydrophobicContact CG1-CE 3.87Å; V733-M737 HydrophobicContact CG1-SD 4.4Å; V733-M737 WeakPolarHBondContact O-CG 3.39Å; V733-M737 PolarHBondContact O-N 3.16Å; S734-M737 PolarHBondContact O-N 2.94Å; M737-G739 VanDerWaalsContact C-N 3.31Å; M737-G739 PolarHBondContact O-N 3.43Å; M737-L740 PolarHBondContact O-N 2.6Å; M737-G741 PolarHBondContact O-N 3.36Å
738	A	90.6	Very high	91.5	Very high	29 Å²	29	50 Å²	50	24%	0.24	27%	0.265	C	S	.	.	H	α-helix	trans	-62	-40.7	174.6	0	0	0	0	0	111.3	A283 S734 G735 I736 L740 G741 F742	A283-A738 HydrophobicContact CB-CB 4.29Å; S734-A738 PolarHBondContact O-N 3.39Å; G735-A738 PolarHBondContact O-N 3.36Å; I736-A738 PolarHBondContact O-N 3.48Å; A738-L740 PolarHBondContact O-N 3.27Å; A738-G741 WeakPolarHBondContact O-CA 3.29Å; A738-G741 PolarHBondContact O-N 3.32Å; A738-F742 WeakPolarHBondContact O-CD2 3.47Å; A738-F742 PolarHBondContact O-N 3.08Å
739	G	92.9	Very high	91.5	Very high	29 Å²	29	43.4 Å²	43.4	30%	0.299	24%	0.242	S	C	.	.	H	α-helix	trans	-58	-43	173.1	0	0	0	0	0	113.6	G735 I736 M737 G741 F742 I743	G735-G739 PolarHBondContact O-N 2.84Å; I736-G739 CarbonylContact O-C 3.54Å; I736-G739 WeakPolarHBondContact O-CA 3.45Å; I736-G739 PolarHBondContact O-N 2.88Å; I736-G739 VanDerWaalsContact O-N 3.14Å; M737-G739 VanDerWaalsContact C-N 3.31Å; M737-G739 PolarHBondContact O-N 3.43Å; G739-G741 PolarHBondContact O-N 2.78Å; G739-F742 PolarHBondContact O-N 3.33Å; G739-I743 WeakPolarHBondContact O-CG1 3.32Å; G739-I743 PolarHBondContact O-N 2.91Å
740	L	92.6	Very high	91.7	Very high	19 Å²	19	44.7 Å²	44.7	10%	0.099	25%	0.253	C	S	.	.	H	α-helix	trans	-60	-34.6	173.4	-65.8	-168.7	0	0	0	111.9	F279 L702 A705 F706 L709 I736 M737 A738 I743 Q744	F279-L740 HydrophobicContact CD2-CB 4.13Å; F279-L740 HydrophobicContact CE2-CB 4.5Å; L702-L740 HydrophobicContact CD2-CB 4.33Å; L702-L740 HydrophobicContact CD2-CD2 3.74Å; L702-L740 HydrophobicContact CD2-CG 4.47Å; A705-L740 HydrophobicContact CB-CD1 4.03Å; F706-L740 HydrophobicContact CB-CD1 4.34Å; L709-L740 HydrophobicContact CD1-CD1 3.44Å; L709-L740 VanDerWaalsContact CD1-CD1 3.44Å; L709-L740 HydrophobicContact CD1-CG 4.05Å; I736-L740 WeakPolarHBondContact O-CG 3.35Å; I736-L740 PolarHBondContact O-N 2.8Å; M737-L740 PolarHBondContact O-N 2.6Å; A738-L740 PolarHBondContact O-N 3.27Å; L740-I743 HydrophobicContact CD2-CD1 4.32Å; L740-I743 PolarHBondContact O-N 2.88Å; L740-Q744 WeakPolarHBondContact O-CB 3.28Å; L740-Q744 PolarHBondContact O-N 3.16Å
741	G	90.8	Very high	91.6	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-60	-46.2	174.3	0	0	0	0	0	112.9	M737 A738 G739 Q744 L745	M737-G741 PolarHBondContact O-N 3.36Å; A738-G741 WeakPolarHBondContact O-CA 3.29Å; A738-G741 PolarHBondContact O-N 3.32Å; G739-G741 PolarHBondContact O-N 2.78Å; G741-Q744 PolarHBondContact O-N 3.29Å; G741-L745 PolarHBondContact O-N 3.46Å; G741-L745 VanDerWaalsContact O-N 3.11Å
742	F	92.4	Very high	91.5	Very high	111 Å²	111	42.1 Å²	42.1	49%	0.487	24%	0.241	S	C	.	.	H	α-helix	trans	-64.8	-42.8	175.7	-78.7	-78.9	0	0	0	111.8	L276 A738 G739 Q744 L745 F746	L276-F742 HydrophobicContact CD1-CD1 4.11Å; L276-F742 HydrophobicContact CD1-CD2 3.99Å; L276-F742 HydrophobicContact CD1-CE1 4.26Å; L276-F742 HydrophobicContact CD1-CE2 4.15Å; L276-F742 HydrophobicContact CD1-CG 3.97Å; L276-F742 HydrophobicContact CD1-CZ 4.28Å; A738-F742 WeakPolarHBondContact O-CD2 3.47Å; A738-F742 PolarHBondContact O-N 3.08Å; G739-F742 PolarHBondContact O-N 3.33Å; F742-Q744 VanDerWaalsContact C-N 3.29Å; F742-Q744 PolarHBondContact O-N 2.75Å; F742-L745 WeakPolarHBondContact O-CB 3.22Å; F742-L745 PolarHBondContact O-N 3.38Å; F742-L745 VanDerWaalsContact O-N 3.15Å; F742-F746 WeakPolarHBondContact O-CD2 3.45Å; F742-F746 PolarHBondContact O-N 3.4Å
743	I	93.6	Very high	91.5	Very high	78 Å²	78	41.9 Å²	41.9	40%	0.4	24%	0.235	S	C	.	.	H	α-helix	trans	-59.3	-42.8	176.6	-66.4	167.2	0	0	0	110.6	L702 G739 L740 L745 F746 I747	L702-I743 HydrophobicContact CD1-CG2 4.02Å; L702-I743 HydrophobicContact CD2-CB 4.44Å; L702-I743 HydrophobicContact CD2-CG2 3.96Å; G739-I743 WeakPolarHBondContact O-CG1 3.32Å; G739-I743 PolarHBondContact O-N 2.91Å; L740-I743 HydrophobicContact CD2-CD1 4.32Å; L740-I743 PolarHBondContact O-N 2.88Å; I743-L745 VanDerWaalsContact C-N 3.33Å; I743-L745 PolarHBondContact O-N 3.04Å; I743-F746 PolarHBondContact O-N 3.32Å; I743-I747 HydrophobicContact CG2-CD1 3.41Å; I743-I747 VanDerWaalsContact CG2-CD1 3.41Å; I743-I747 HydrophobicContact CG2-CG1 4.3Å; I743-I747 WeakPolarHBondContact O-CB 3.35Å; I743-I747 WeakPolarHBondContact O-CG1 3.3Å; I743-I747 PolarHBondContact O-N 3.4Å
744	Q	89.4	Confident	91.6	Very high	28 Å²	28	42.1 Å²	42.1	13%	0.131	24%	0.236	C	C	.	.	H	α-helix	trans	-63	-35.9	176.7	-175.9	66.1	23	0	0	112.6	F279 S699 L702 L740 G741 F742 G748	F279-Q744 HydrophobicContact CE2-CB 4.25Å; F279-Q744 HydrophobicContact CE2-CG 4.42Å; S699-Q744 PolarHBondContact OG-NE2 2.67Å; S699-Q744 PolarHBondContact OG-OE1 3.47Å; L702-Q744 HydrophobicContact CD1-CB 4.2Å; L740-Q744 WeakPolarHBondContact O-CB 3.28Å; L740-Q744 PolarHBondContact O-N 3.16Å; G741-Q744 PolarHBondContact O-N 3.29Å; F742-Q744 VanDerWaalsContact C-N 3.29Å; F742-Q744 PolarHBondContact O-N 2.75Å; Q744-G748 PolarHBondContact O-N 3.27Å
745	L	91.1	Very high	91.6	Very high	46 Å²	46	41.9 Å²	41.9	24%	0.241	23%	0.234	C	C	.	.	H	α-helix	trans	-62.3	-51.9	175.4	177.1	66.7	0	0	0	111.5	C273 L276 G741 F742 I743 G748 A749	C273-L745 HydrophobicContact CB-CD1 4.1Å; L276-L745 HydrophobicContact CB-CB 4.47Å; L276-L745 HydrophobicContact CD2-CD2 4.19Å; G741-L745 PolarHBondContact O-N 3.46Å; G741-L745 VanDerWaalsContact O-N 3.11Å; F742-L745 WeakPolarHBondContact O-CB 3.22Å; F742-L745 PolarHBondContact O-N 3.38Å; F742-L745 VanDerWaalsContact O-N 3.15Å; I743-L745 VanDerWaalsContact C-N 3.33Å; I743-L745 PolarHBondContact O-N 3.04Å; L745-G748 PolarHBondContact O-N 2.91Å; L745-A749 PolarHBondContact O-N 2.95Å; L745-A749 VanDerWaalsContact O-N 3.1Å
746	F	92.9	Very high	91.5	Very high	139 Å²	139	40 Å²	40	61%	0.61	21%	0.214	S	C	*	.	H	α-helix	trans	-65	-45.9	-178.7	-72.5	-70	0	0	0	111.5	F742 I743 A749 T750	F742-F746 WeakPolarHBondContact O-CD2 3.45Å; F742-F746 PolarHBondContact O-N 3.4Å; I743-F746 PolarHBondContact O-N 3.32Å; F746-A749 PolarHBondContact O-N 3.01Å; F746-T750 PolarHBondContact O-N 3.37Å; F746-T750 PolarHBondContact O-OG1 3.02Å; F746-T750 VanDerWaalsContact O-OG1 3.05Å
747	I	92.5	Very high	91.4	Very high	19 Å²	19	36.3 Å²	36.3	10%	0.097	20%	0.196	C	C	.	.	H	α-helix	trans	-65.3	-42.8	179.5	-69.6	170.4	0	0	0	111	C695 I698 L702 I743 A749 T750 Q751	C695-I747 HydrophobicContact CB-CG2 4.22Å; C695-I747 WeakPolarHBondContact O-CG2 3.43Å; I698-I747 HydrophobicContact CB-CD1 3.77Å; I698-I747 HydrophobicContact CD1-CD1 4.39Å; I698-I747 HydrophobicContact CG2-CD1 3.22Å; L702-I747 HydrophobicContact CD1-CD1 3.98Å; I743-I747 HydrophobicContact CG2-CD1 3.41Å; I743-I747 VanDerWaalsContact CG2-CD1 3.41Å; I743-I747 HydrophobicContact CG2-CG1 4.3Å; I743-I747 WeakPolarHBondContact O-CB 3.35Å; I743-I747 WeakPolarHBondContact O-CG1 3.3Å; I743-I747 PolarHBondContact O-N 3.4Å; I747-A749 VanDerWaalsContact C-N 3.33Å; I747-A749 PolarHBondContact O-N 2.73Å; I747-T750 PolarHBondContact O-N 3.44Å; I747-Q751 WeakPolarHBondContact O-CB 3.41Å; I747-Q751 PolarHBondContact O-N 3.47Å
748	G	88.8	Confident	91.3	Very high	7 Å²	7	36.3 Å²	36.3	7%	0.072	20%	0.196	C	C	.	.	H	α-helix	trans	-58.6	-44.2	176.8	0	0	0	0	0	112.4	G268 Q744 L745 G752	G268-G748 CarbonylContact C-O 3.59Å; G268-G748 WeakPolarHBondContact CA-O 3.21Å; G268-G748 CarbonylContact O-C 3.55Å; G268-G748 VanDerWaalsContact O-C 3.27Å; Q744-G748 PolarHBondContact O-N 3.27Å; L745-G748 PolarHBondContact O-N 2.91Å; G748-G752 PolarHBondContact O-N 3.33Å
749	A	90.5	Very high	91.3	Very high	28 Å²	28	35.5 Å²	35.5	23%	0.231	19%	0.189	C	C	.	.	H	α-helix	trans	-64.2	-47.6	176.6	0	0	0	0	0	112.3	S269 L745 F746 I747 G752 Y753	S269-A749 WeakPolarHBondContact OG-CB 3.36Å; L745-A749 PolarHBondContact O-N 2.95Å; L745-A749 VanDerWaalsContact O-N 3.1Å; F746-A749 PolarHBondContact O-N 3.01Å; I747-A749 VanDerWaalsContact C-N 3.33Å; I747-A749 PolarHBondContact O-N 2.73Å; A749-G752 PolarHBondContact O-N 2.99Å; A749-Y753 PolarHBondContact O-N 2.88Å
750	T	92.1	Very high	91.2	Very high	68 Å²	68	35.3 Å²	35.3	42%	0.417	18%	0.181	S	C	.	.	H	α-helix	trans	-65.6	-44.8	179.1	-56.9	0	0	0	0	111.8	F746 I747 G752 Y753 L754	F746-T750 PolarHBondContact O-N 3.37Å; F746-T750 PolarHBondContact O-OG1 3.02Å; F746-T750 VanDerWaalsContact O-OG1 3.05Å; I747-T750 PolarHBondContact O-N 3.44Å; T750-G752 VanDerWaalsContact C-N 3.34Å; T750-G752 PolarHBondContact O-N 3.39Å; T750-Y753 WeakPolarHBondContact O-CB 3.19Å; T750-Y753 PolarHBondContact O-N 3.33Å; T750-L754 HydrophobicContact CG2-CD1 3.78Å; T750-L754 HydrophobicContact CG2-CG 4.2Å; T750-L754 WeakPolarHBondContact O-CB 3.36Å; T750-L754 VanDerWaalsContact O-CG 3.25Å; T750-L754 WeakPolarHBondContact O-CG 3.24Å; T750-L754 PolarHBondContact O-N 3.43Å
751	Q	90.6	Very high	91.1	Very high	22 Å²	22	38.1 Å²	38.1	10%	0.103	19%	0.19	C	C	.	.	H	α-helix	trans	-59.6	-44.3	176	-179.3	-176.5	-25.7	0	0	111.3	C695 I747 Y753 L754 F755 S812	C695-Q751 HydrophobicContact CB-CB 4.12Å; I747-Q751 WeakPolarHBondContact O-CB 3.41Å; I747-Q751 PolarHBondContact O-N 3.47Å; Q751-Y753 PolarHBondContact O-N 3.41Å; Q751-L754 PolarHBondContact O-N 3.24Å; Q751-F755 HydrophobicContact CG-CD2 4Å; Q751-F755 HydrophobicContact CG-CE2 4.22Å; Q751-F755 PolarHBondContact O-N 3.38Å; Q751-F755 VanDerWaalsContact O-N 3.1Å; Q751-S812 WeakPolarHBondContact CG-OG 3.15Å; Q751-S812 PolarHBondContact NE2-OG 3.31Å
752	G	89.1	Confident	91.1	Very high	13 Å²	13	38.1 Å²	38.1	13%	0.134	19%	0.19	C	C	.	.	H	α-helix	trans	-61.3	-40.5	175.4	0	0	0	0	0	113	A264 G748 A749 T750 G756	A264-G752 WeakPolarHBondContact CB-O 3.35Å; G748-G752 PolarHBondContact O-N 3.33Å; A749-G752 PolarHBondContact O-N 2.99Å; T750-G752 VanDerWaalsContact C-N 3.34Å; T750-G752 PolarHBondContact O-N 3.39Å; G752-G756 WeakPolarHBondContact O-CA 3.49Å; G752-G756 PolarHBondContact O-N 3.09Å
753	Y	92.6	Very high	91	Very high	107 Å²	107	33.3 Å²	33.3	42%	0.42	17%	0.17	S	C	.	.	H	α-helix	trans	-64.5	-54.1	173.9	179.7	-108.1	0	0	0	112.2	I261 T265 A749 T750 Q751 G756 V757	I261-Y753 HydrophobicContact CG2-CD2 4.34Å; I261-Y753 HydrophobicContact CG2-CE2 4.25Å; T265-Y753 HydrophobicContact CG2-CD2 3.49Å; T265-Y753 VanDerWaalsContact CG2-CD2 3.49Å; T265-Y753 HydrophobicContact CG2-CG 4.11Å; A749-Y753 PolarHBondContact O-N 2.88Å; T750-Y753 WeakPolarHBondContact O-CB 3.19Å; T750-Y753 PolarHBondContact O-N 3.33Å; Q751-Y753 PolarHBondContact O-N 3.41Å; Y753-G756 PolarHBondContact O-N 2.99Å; Y753-V757 HydrophobicContact CD2-CG2 4.09Å; Y753-V757 HydrophobicContact CE1-CG2 4.2Å; Y753-V757 HydrophobicContact CE2-CG2 3.76Å; Y753-V757 HydrophobicContact CG-CG2 4.48Å; Y753-V757 WeakPolarHBondContact O-CG2 3.1Å; Y753-V757 PolarHBondContact O-N 3.23Å
754	L	92.7	Very high	91	Very high	8 Å²	8	31.7 Å²	31.7	4%	0.042	16%	0.16	C	C	.	.	H	α-helix	trans	-61.6	-51.5	-172.6	-68.4	173.7	0	0	0	112.1	Y688 M691 T750 Q751 G756 V757 A758	Y688-L754 HydrophobicContact CD1-CD2 3.85Å; M691-L754 HydrophobicContact CB-CD1 3.72Å; M691-L754 HydrophobicContact CB-CD2 4.33Å; T750-L754 HydrophobicContact CG2-CD1 3.78Å; T750-L754 HydrophobicContact CG2-CG 4.2Å; T750-L754 WeakPolarHBondContact O-CB 3.36Å; T750-L754 VanDerWaalsContact O-CG 3.25Å; T750-L754 WeakPolarHBondContact O-CG 3.24Å; T750-L754 PolarHBondContact O-N 3.43Å; Q751-L754 PolarHBondContact O-N 3.24Å; L754-G756 VanDerWaalsContact C-N 3.32Å; L754-V757 PolarHBondContact O-N 2.92Å; L754-A758 PolarHBondContact O-N 3.41Å; L754-A758 VanDerWaalsContact O-N 3.12Å
755	F	90.5	Very high	91.1	Very high	4 Å²	4	33.6 Å²	33.6	2%	0.018	17%	0.166	C	C	.	.	H	α-helix	trans	-71.5	-28.1	176.5	-76.6	-71.9	0	0	0	112.9	I689 G692 S696 Q751 A759 G808 L811 S812	I689-F755 HydrophobicContact CG2-CE1 4.47Å; G692-F755 VanDerWaalsContact C-CZ 3.44Å; G692-F755 VanDerWaalsContact CA-CE2 3.47Å; G692-F755 VanDerWaalsContact O-CE2 3.22Å; G692-F755 WeakPolarHBondContact O-CE2 3.45Å; S696-F755 VanDerWaalsContact OG-CE2 3.28Å; S696-F755 WeakPolarHBondContact OG-CE2 3.38Å; Q751-F755 HydrophobicContact CG-CD2 4Å; Q751-F755 HydrophobicContact CG-CE2 4.22Å; Q751-F755 PolarHBondContact O-N 3.38Å; Q751-F755 VanDerWaalsContact O-N 3.1Å; F755-A759 VanDerWaalsContact O-CB 3.24Å; F755-A759 WeakPolarHBondContact O-CB 3.15Å; F755-A759 PolarHBondContact O-N 3.1Å; F755-G808 WeakPolarHBondContact CD1-O 3.47Å; F755-L811 HydrophobicContact CE1-CB 4.4Å; F755-L811 HydrophobicContact CE1-CD2 4.21Å; F755-L811 HydrophobicContact CE1-CG 4.47Å; F755-S812 VanDerWaalsContact CD2-CB 3.46Å; F755-S812 VanDerWaalsContact CE2-OG 3.28Å; F755-S812 WeakPolarHBondContact CE2-OG 3.39Å
756	G	90.2	Very high	91.1	Very high	6 Å²	6	31.4 Å²	31.4	6%	0.062	15%	0.154	C	C	.	.	H	α-helix	trans	-61.6	-49.6	172.5	0	0	0	0	0	112.1	A264 G752 Y753 L754 A759 E760	A264-G756 VanDerWaalsContact CB-CA 3.42Å; G752-G756 WeakPolarHBondContact O-CA 3.49Å; G752-G756 PolarHBondContact O-N 3.09Å; Y753-G756 PolarHBondContact O-N 2.99Å; L754-G756 VanDerWaalsContact C-N 3.32Å; G756-A759 PolarHBondContact O-N 2.99Å; G756-E760 WeakPolarHBondContact O-CB 3.3Å; G756-E760 VanDerWaalsContact O-CG 3.29Å; G756-E760 WeakPolarHBondContact O-CG 3.34Å; G756-E760 PolarHBondContact O-N 3.31Å
757	V	91.7	Very high	91.1	Very high	1 Å²	1	25.9 Å²	25.9	1%	0.006	13%	0.129	C	C	.	.	H	α-helix	trans	-60.9	-46.4	176.6	172.8	0	0	0	0	111	I261 Y688 Y753 L754 A759 R761	I261-V757 HydrophobicContact CD1-CG2 4.19Å; I261-V757 HydrophobicContact CG1-CG2 4.3Å; I261-V757 HydrophobicContact CG2-CG2 3.97Å; Y688-V757 HydrophobicContact CD1-CB 4.48Å; Y688-V757 HydrophobicContact CD1-CG1 4.18Å; Y688-V757 HydrophobicContact CE1-CG1 4.2Å; Y688-V757 HydrophobicContact CG-CG1 4.38Å; Y753-V757 HydrophobicContact CD2-CG2 4.09Å; Y753-V757 HydrophobicContact CE1-CG2 4.2Å; Y753-V757 HydrophobicContact CE2-CG2 3.76Å; Y753-V757 HydrophobicContact CG-CG2 4.48Å; Y753-V757 WeakPolarHBondContact O-CG2 3.1Å; Y753-V757 PolarHBondContact O-N 3.23Å; L754-V757 PolarHBondContact O-N 2.92Å; V757-A759 PolarHBondContact O-N 3.38Å; V757-R761 HydrophobicContact CG1-CG 4.45Å; V757-R761 VanDerWaalsContact O-CB 3.26Å; V757-R761 WeakPolarHBondContact O-CB 3.44Å; V757-R761 WeakPolarHBondContact O-CG 3.49Å; V757-R761 PolarHBondContact O-N 3.19Å; V757-R761 VanDerWaalsContact O-N 3.12Å
758	A	90.1	Very high	91.1	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-61.7	-44.1	178.9	0	0	0	0	0	112.5	E685 I689 L754 L762	E685-A758 HydrophobicContact CB-CB 4.29Å; I689-A758 HydrophobicContact CD1-CB 4.25Å; I689-A758 HydrophobicContact CG1-CB 3.69Å; L754-A758 PolarHBondContact O-N 3.41Å; L754-A758 VanDerWaalsContact O-N 3.12Å; A758-L762 VanDerWaalsContact O-CB 3.29Å; A758-L762 WeakPolarHBondContact O-CB 3.38Å; A758-L762 PolarHBondContact O-N 3.34Å
759	A	89.6	Confident	91.3	Very high	13 Å²	13	28.5 Å²	28.5	11%	0.107	14%	0.143	C	C	.	.	H	α-helix	trans	-69.3	-47.4	-178.2	0	0	0	0	0	113	F755 G756 V757 L762 T763	F755-A759 VanDerWaalsContact O-CB 3.24Å; F755-A759 WeakPolarHBondContact O-CB 3.15Å; F755-A759 PolarHBondContact O-N 3.1Å; G756-A759 PolarHBondContact O-N 2.99Å; V757-A759 PolarHBondContact O-N 3.38Å; A759-L762 PolarHBondContact O-N 3.18Å; A759-T763 WeakPolarHBondContact O-CB 3.21Å; A759-T763 PolarHBondContact O-N 3.16Å; A759-T763 PolarHBondContact O-OG1 3.47Å
760	E	91	Very high	91.4	Very high	25 Å²	25	27.1 Å²	27.1	12%	0.117	13%	0.132	C	C	.	.	H	α-helix	trans	-74.3	-35.9	-173.3	-63.9	-65.9	167.9	0	0	111.5	E257 I261 K263 G756 T763 K764	E257-E760 HydrophobicContact CG-CB 4.24Å; I261-E760 HydrophobicContact CG1-CB 3.99Å; I261-E760 HydrophobicContact CG1-CG 4.27Å; K263-E760 IonicContact NZ-OE1 3.52Å; G756-E760 WeakPolarHBondContact O-CB 3.3Å; G756-E760 VanDerWaalsContact O-CG 3.29Å; G756-E760 WeakPolarHBondContact O-CG 3.34Å; G756-E760 PolarHBondContact O-N 3.31Å; E760-T763 PolarHBondContact O-N 3.46Å; E760-K764 PolarHBondContact O-N 3.04Å
761	R	91.7	Very high	91.6	Very high	78 Å²	78	23.9 Å²	23.9	29%	0.294	11%	0.112	S	C	.	.	H	α-helix	trans	-65	-42.7	171.4	-76.2	-178.6	178.6	171.7	5.7	112.2	E257 E685 V757 T763 K764 R765	E257-R761 WeakPolarHBondContact OE1-CG 3.27Å; E257-R761 IonicContact OE1-NE 2.85Å; E685-R761 HydrophobicContact CG-CB 4.06Å; V757-R761 HydrophobicContact CG1-CG 4.45Å; V757-R761 VanDerWaalsContact O-CB 3.26Å; V757-R761 WeakPolarHBondContact O-CB 3.44Å; V757-R761 WeakPolarHBondContact O-CG 3.49Å; V757-R761 PolarHBondContact O-N 3.19Å; V757-R761 VanDerWaalsContact O-N 3.12Å; R761-T763 VanDerWaalsContact C-N 3.33Å; R761-K764 PolarHBondContact O-N 3.31Å; R761-R765 WeakPolarHBondContact O-CB 3.33Å; R761-R765 PolarHBondContact O-N 3Å
762	L	90.4	Very high	91.7	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-61.8	-43.5	174.5	-177.9	65.4	0	0	0	110.8	L678 I681 N682 A758 A759 K764 R765 L766 S807	L678-L762 HydrophobicContact CD1-CD2 4.24Å; I681-L762 HydrophobicContact CG2-CD1 3.82Å; N682-L762 HydrophobicContact CB-CD1 4.23Å; A758-L762 VanDerWaalsContact O-CB 3.29Å; A758-L762 WeakPolarHBondContact O-CB 3.38Å; A758-L762 PolarHBondContact O-N 3.34Å; A759-L762 PolarHBondContact O-N 3.18Å; L762-K764 PolarHBondContact O-N 3.23Å; L762-R765 PolarHBondContact O-N 3.32Å; L762-L766 HydrophobicContact CD1-CD1 4.24Å; L762-L766 HydrophobicContact CD1-CG 4.1Å; L762-L766 HydrophobicContact CD2-CD1 4.4Å; L762-L766 HydrophobicContact CG-CD1 3.92Å; L762-L766 HydrophobicContact CG-CG 4.22Å; L762-L766 WeakPolarHBondContact O-CB 3.44Å; L762-L766 WeakPolarHBondContact O-CG 3.32Å; L762-L766 PolarHBondContact O-N 3.29Å; L762-S807 WeakPolarHBondContact CD2-OG 3.12Å
763	T	90.7	Very high	91.9	Very high	10 Å²	10	25.2 Å²	25.2	6%	0.061	12%	0.117	C	C	.	.	H	α-helix	trans	-57.9	-48.9	177.1	-56.2	0	0	0	0	111.3	A759 E760 R761 L766 R767 A804	A759-T763 WeakPolarHBondContact O-CB 3.21Å; A759-T763 PolarHBondContact O-N 3.16Å; A759-T763 PolarHBondContact O-OG1 3.47Å; E760-T763 PolarHBondContact O-N 3.46Å; R761-T763 VanDerWaalsContact C-N 3.33Å; T763-L766 PolarHBondContact O-N 3.1Å; T763-R767 WeakPolarHBondContact O-CB 3.33Å; T763-R767 WeakPolarHBondContact O-CG 3.44Å; T763-R767 PolarHBondContact O-N 2.77Å; T763-A804 WeakPolarHBondContact OG1-CB 3.33Å
764	K	92.3	Very high	91.9	Very high	43 Å²	43	20.1 Å²	20.1	19%	0.187	10%	0.097	C	C	.	.	H	α-helix	trans	-59.1	-46.4	175.1	170.9	179.1	170.1	179.3	0	111.9	L253 T254 E257 E760 R761 L762 R767 S768	L253-K764 HydrophobicContact CB-CG 4.17Å; T254-K764 VanDerWaalsContact OG1-CE 3.31Å; T254-K764 WeakPolarHBondContact OG1-CE 3.41Å; T254-K764 PolarHBondContact OG1-NZ 3.29Å; E257-K764 HydrophobicContact CB-CD 4.31Å; E257-K764 HydrophobicContact CG-CD 4.47Å; E257-K764 WeakPolarHBondContact OE2-CD 3.49Å; E257-K764 WeakPolarHBondContact OE2-CE 3.44Å; E257-K764 IonicContact OE2-NZ 2.85Å; E257-K764 PolarHBondContact OE2-NZ 3.22Å; E760-K764 PolarHBondContact O-N 3.04Å; R761-K764 PolarHBondContact O-N 3.31Å; L762-K764 PolarHBondContact O-N 3.23Å; K764-R767 PolarHBondContact O-N 3.4Å; K764-S768 WeakPolarHBondContact O-CB 2.97Å; K764-S768 PolarHBondContact O-N 3.5Å
765	R	91.5	Very high	91.9	Very high	68 Å²	68	19.8 Å²	19.8	26%	0.257	10%	0.096	S	C	.	.	H	α-helix	trans	-64.8	-45	-179	-172.1	177.7	-66.2	135.1	11.4	111.6	I681 P684 E685 R761 L762 S768 N769	I681-R765 HydrophobicContact CG2-CG 4.35Å; I681-R765 PolarHBondContact O-NH1 3.29Å; P684-R765 VanDerWaalsContact CD-NH1 3.33Å; E685-R765 IonicContact OE1-CZ 3.12Å; E685-R765 IonicContact OE1-NH1 3.94Å; E685-R765 IonicContact OE1-NH2 3.13Å; E685-R765 PolarHBondContact OE1-NH2 3.32Å; E685-R765 IonicContact OE2-CZ 2.71Å; E685-R765 IonicContact OE2-NH1 3.12Å; E685-R765 PolarHBondContact OE2-NH1 3.27Å; E685-R765 IonicContact OE2-NH2 2.94Å; E685-R765 PolarHBondContact OE2-NH2 3.45Å; R761-R765 WeakPolarHBondContact O-CB 3.33Å; R761-R765 PolarHBondContact O-N 3Å; L762-R765 PolarHBondContact O-N 3.32Å; R765-S768 PolarHBondContact O-N 3.01Å; R765-N769 VanDerWaalsContact O-CB 3.28Å; R765-N769 WeakPolarHBondContact O-CB 3.28Å; R765-N769 PolarHBondContact O-N 3.07Å; R765-N769 PolarHBondContact O-OD1 2.9Å
766	L	90.8	Very high	92	Very high	1 Å²	1	24.3 Å²	24.3	1%	0.005	12%	0.116	C	C	.	.	H	α-helix	trans	-60.5	-49.2	175.8	-74.3	174.6	0	0	0	111.1	L678 I681 L762 T763 S768 N769 L770 V803	L678-L766 HydrophobicContact CD1-CD1 4.44Å; I681-L766 HydrophobicContact CD1-CD2 4.4Å; I681-L766 HydrophobicContact CG2-CD2 4.43Å; L762-L766 HydrophobicContact CD1-CD1 4.24Å; L762-L766 HydrophobicContact CD1-CG 4.1Å; L762-L766 HydrophobicContact CD2-CD1 4.4Å; L762-L766 HydrophobicContact CG-CD1 3.92Å; L762-L766 HydrophobicContact CG-CG 4.22Å; L762-L766 WeakPolarHBondContact O-CB 3.44Å; L762-L766 WeakPolarHBondContact O-CG 3.32Å; L762-L766 PolarHBondContact O-N 3.29Å; T763-L766 PolarHBondContact O-N 3.1Å; L766-S768 PolarHBondContact O-N 3.28Å; L766-N769 PolarHBondContact O-N 2.93Å; L766-L770 WeakPolarHBondContact O-CB 3.39Å; L766-L770 PolarHBondContact O-N 3.42Å; L766-V803 HydrophobicContact CD1-CB 4.02Å; L766-V803 HydrophobicContact CD1-CG1 3.65Å
767	R	93.6	Very high	92.1	Very high	23 Å²	23	24.2 Å²	24.2	9%	0.087	11%	0.113	C	C	.	.	H	α-helix	trans	-62.5	-42.7	178.2	-72.9	179.4	172.7	153	-1	112.3	Y219 Y249 L253 T763 K764 F771 L796 S797 A800	Y219-R767 VanDerWaalsContact CD2-NH1 3.28Å; Y219-R767 PolarHBondContact OH-NE 2.95Å; Y249-R767 HydrophobicContact CE1-CB 4.28Å; L253-R767 HydrophobicContact CD1-CB 3.76Å; L253-R767 HydrophobicContact CD2-CB 4.13Å; T763-R767 WeakPolarHBondContact O-CB 3.33Å; T763-R767 WeakPolarHBondContact O-CG 3.44Å; T763-R767 PolarHBondContact O-N 2.77Å; K764-R767 PolarHBondContact O-N 3.4Å; R767-F771 WeakPolarHBondContact O-CB 3.4Å; R767-F771 PolarHBondContact O-N 3.47Å; R767-L796 PolarHBondContact NE-O 3.44Å; R767-L796 VanDerWaalsContact NE-O 3.12Å; R767-S797 PolarHBondContact NH2-O 2.97Å; R767-A800 HydrophobicContact CG-CB 3.55Å
768	S	93.7	Very high	92.1	Very high	13 Å²	13	25.1 Å²	25.1	9%	0.091	12%	0.118	C	C	.	.	H	α-helix	trans	-64.8	-48.3	178	-168.2	0	0	0	0	111.7	K764 R765 L766 F771 D772	K764-S768 WeakPolarHBondContact O-CB 2.97Å; K764-S768 PolarHBondContact O-N 3.5Å; R765-S768 PolarHBondContact O-N 3.01Å; L766-S768 PolarHBondContact O-N 3.28Å; S768-F771 PolarHBondContact O-N 3.29Å; S768-D772 VanDerWaalsContact O-CB 3.24Å; S768-D772 WeakPolarHBondContact O-CB 3.44Å; S768-D772 PolarHBondContact O-N 3.46Å
769	N	92.1	Very high	92.2	Very high	67 Å²	67	25.2 Å²	25.2	36%	0.358	12%	0.118	S	C	.	.	H	α-helix	trans	-67.4	-38.1	179.8	-70.3	-0.6	0	0	0	111.7	R765 L766 S773 I987	R765-N769 VanDerWaalsContact O-CB 3.28Å; R765-N769 WeakPolarHBondContact O-CB 3.28Å; R765-N769 PolarHBondContact O-N 3.07Å; R765-N769 PolarHBondContact O-OD1 2.9Å; L766-N769 PolarHBondContact O-N 2.93Å; N769-S773 WeakPolarHBondContact O-CB 3.48Å; N769-S773 PolarHBondContact O-N 2.68Å; N769-I987 HydrophobicContact CB-CD1 4.46Å
770	L	92.8	Very high	92.1	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-66.7	-46.4	177.4	-177.1	59.6	0	0	0	110.8	L766 S773 M774 F795 L796 I983 V986 I987	L766-L770 WeakPolarHBondContact O-CB 3.39Å; L766-L770 PolarHBondContact O-N 3.42Å; L770-S773 PolarHBondContact O-N 3.09Å; L770-M774 HydrophobicContact CD1-CE 3.91Å; L770-M774 HydrophobicContact CD2-CE 4.07Å; L770-M774 HydrophobicContact CG-CE 3.68Å; L770-M774 HydrophobicContact CG-SD 4.47Å; L770-M774 VanDerWaalsContact O-CG 3.27Å; L770-M774 WeakPolarHBondContact O-CG 3.49Å; L770-M774 PolarHBondContact O-N 3.23Å; L770-F795 HydrophobicContact CD1-CE1 3.95Å; L770-F795 HydrophobicContact CD1-CZ 4.49Å; L770-F795 HydrophobicContact CD2-CD1 4.22Å; L770-F795 HydrophobicContact CD2-CE1 3.92Å; L770-F795 HydrophobicContact CD2-CZ 4.31Å; L770-F795 HydrophobicContact CG-CE1 4.42Å; L770-L796 HydrophobicContact CB-CD2 4.07Å; L770-L796 HydrophobicContact CD2-CD2 3.86Å; L770-L796 HydrophobicContact CD2-CG 4.48Å; L770-L796 HydrophobicContact CG-CD2 3.89Å; L770-I983 HydrophobicContact CD1-CG2 4.41Å; L770-I983 HydrophobicContact CD2-CG1 4.11Å; L770-V986 HydrophobicContact CD1-CB 3.91Å; L770-V986 HydrophobicContact CD1-CG1 3.79Å; L770-I987 HydrophobicContact CD1-CG1 4.12Å
771	F	95.1	Very high	92.1	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-63.1	-44.3	175.7	-172	-112.3	0	0	0	111.8	V229 L230 Y249 R767 S768 S773 M774 L775 L796	V229-F771 HydrophobicContact CB-CZ 4.12Å; V229-F771 HydrophobicContact CG1-CE2 4.47Å; V229-F771 HydrophobicContact CG1-CZ 3.84Å; L230-F771 HydrophobicContact CG-CE2 4.37Å; Y249-F771 HydrophobicContact CD1-CB 3.82Å; Y249-F771 AromaticContact CD1-CD1 3.49Å; Y249-F771 HydrophobicContact CD1-CD1 3.49Å; Y249-F771 VanDerWaalsContact CD1-CD1 3.49Å; Y249-F771 HydrophobicContact CD1-CD2 4.41Å; Y249-F771 HydrophobicContact CD1-CE1 4.1Å; Y249-F771 AromaticContact CD1-CG 3.66Å; Y249-F771 HydrophobicContact CD1-CG 3.66Å; Y249-F771 HydrophobicContact CE1-CB 3.71Å; Y249-F771 HydrophobicContact CE1-CD1 4.21Å; Y249-F771 HydrophobicContact CE1-CD2 4.45Å; Y249-F771 AromaticContact CE1-CG 3.89Å; Y249-F771 HydrophobicContact CE1-CG 3.89Å; Y249-F771 AromaticContact CG-CD1 3.78Å; Y249-F771 HydrophobicContact CG-CD1 3.78Å; Y249-F771 AromaticContact CG-CE1 3.88Å; Y249-F771 HydrophobicContact CG-CE1 3.88Å; Y249-F771 HydrophobicContact CG-CG 4.18Å; Y249-F771 HydrophobicContact CG-CZ 4.38Å; R767-F771 WeakPolarHBondContact O-CB 3.4Å; R767-F771 PolarHBondContact O-N 3.47Å; S768-F771 PolarHBondContact O-N 3.29Å; F771-S773 VanDerWaalsContact C-N 3.33Å; F771-S773 PolarHBondContact O-N 3.28Å; F771-M774 WeakPolarHBondContact O-CB 3.24Å; F771-M774 PolarHBondContact O-N 2.97Å; F771-L775 HydrophobicContact CD1-CD1 3.95Å; F771-L775 HydrophobicContact CD1-CG 4.46Å; F771-L775 HydrophobicContact CE1-CD1 3.62Å; F771-L775 HydrophobicContact CE1-CG 4.28Å; F771-L775 HydrophobicContact CZ-CD1 4.11Å; F771-L775 HydrophobicContact CZ-CD2 4.33Å; F771-L775 HydrophobicContact CZ-CG 4.39Å; F771-L775 WeakPolarHBondContact O-CG 3.43Å; F771-L775 PolarHBondContact O-N 3.12Å; F771-L796 HydrophobicContact CB-CD2 4.1Å; F771-L796 HydrophobicContact CD2-CD1 3.84Å
772	D	93.9	Very high	92.2	Very high	49 Å²	49	21.5 Å²	21.5	26%	0.262	10%	0.103	S	C	.	.	H	α-helix	trans	-62	-39	175.4	-168.2	60.4	0	0	0	112.1	S246 S768 K776	S246-D772 PolarHBondContact OG-OD1 3.24Å; S768-D772 VanDerWaalsContact O-CB 3.24Å; S768-D772 WeakPolarHBondContact O-CB 3.44Å; S768-D772 PolarHBondContact O-N 3.46Å; D772-K776 WeakPolarHBondContact O-CG 3.17Å; D772-K776 PolarHBondContact O-N 3.2Å; D772-K776 WeakPolarHBondContact OD2-CE 3.46Å; D772-K776 IonicContact OD2-NZ 3.27Å; D772-K776 PolarHBondContact OD2-NZ 2.78Å
773	S	92	Very high	92	Very high	13 Å²	13	23.7 Å²	23.7	9%	0.091	12%	0.115	C	C	.	.	H	α-helix	trans	-68.1	-37.9	174.4	-164.9	0	0	0	0	112.3	N769 L770 F771 K776 Q777 V986	N769-S773 WeakPolarHBondContact O-CB 3.48Å; N769-S773 PolarHBondContact O-N 2.68Å; L770-S773 PolarHBondContact O-N 3.09Å; F771-S773 VanDerWaalsContact C-N 3.33Å; F771-S773 PolarHBondContact O-N 3.28Å; S773-K776 PolarHBondContact O-N 2.93Å; S773-Q777 WeakPolarHBondContact O-CG 2.92Å; S773-Q777 PolarHBondContact O-NE2 3.47Å; S773-V986 PolarHBondContact OG-O 3.35Å
774	M	93.6	Very high	91.7	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-61.1	-47.6	174.5	-72.9	169.7	179	0	0	111.1	L770 F771 K776 Q777 W781 F782 L792 F795 L796 V986	L770-M774 HydrophobicContact CD1-CE 3.91Å; L770-M774 HydrophobicContact CD2-CE 4.07Å; L770-M774 HydrophobicContact CG-CE 3.68Å; L770-M774 HydrophobicContact CG-SD 4.47Å; L770-M774 VanDerWaalsContact O-CG 3.27Å; L770-M774 WeakPolarHBondContact O-CG 3.49Å; L770-M774 PolarHBondContact O-N 3.23Å; F771-M774 WeakPolarHBondContact O-CB 3.24Å; F771-M774 PolarHBondContact O-N 2.97Å; M774-K776 PolarHBondContact O-N 3.12Å; M774-Q777 WeakPolarHBondContact O-CB 3.31Å; M774-Q777 WeakPolarHBondContact O-CG 3.39Å; M774-Q777 PolarHBondContact O-N 2.85Å; M774-W781 HydrophobicContact CG-CH2 4.11Å; M774-W781 HydrophobicContact CG-CZ3 4.41Å; M774-F782 WeakPolarHBondContact O-CZ 3.18Å; M774-L792 HydrophobicContact CE-CD2 4.08Å; M774-F795 HydrophobicContact CE-CD1 3.37Å; M774-F795 HydrophobicContact CE-CE1 3.73Å; M774-L796 HydrophobicContact CE-CD2 4.4Å; M774-L796 HydrophobicContact CE-CG 4.11Å; M774-L796 HydrophobicContact SD-CD1 3.92Å; M774-L796 HydrophobicContact SD-CD2 4.3Å; M774-L796 HydrophobicContact SD-CG 4.08Å; M774-V986 HydrophobicContact CG-CG1 4.11Å
775	L	93.1	Very high	90.9	Very high	2 Å²	2	30.8 Å²	30.8	1%	0.01	15%	0.15	C	C	.	.	H	α-helix	trans	-63.2	-22.9	179.9	-66.7	179.7	0	0	0	113.6	V229 I233 E242 F771 Q777	V229-L775 HydrophobicContact CG1-CD2 3.69Å; I233-L775 HydrophobicContact CD1-CD2 3.67Å; E242-L775 HydrophobicContact CB-CB 4.26Å; E242-L775 HydrophobicContact CG-CB 4.46Å; E242-L775 WeakPolarHBondContact O-CD1 3.34Å; F771-L775 HydrophobicContact CD1-CD1 3.95Å; F771-L775 HydrophobicContact CD1-CG 4.46Å; F771-L775 HydrophobicContact CE1-CD1 3.62Å; F771-L775 HydrophobicContact CE1-CG 4.28Å; F771-L775 HydrophobicContact CZ-CD1 4.11Å; F771-L775 HydrophobicContact CZ-CD2 4.33Å; F771-L775 HydrophobicContact CZ-CG 4.39Å; F771-L775 WeakPolarHBondContact O-CG 3.43Å; F771-L775 PolarHBondContact O-N 3.12Å; L775-Q777 VanDerWaalsContact C-N 3.35Å
776	K	91.5	Very high	90.3	Very high	99 Å²	99	33.5 Å²	33.5	43%	0.43	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.6	-12.7	175	-71.5	170.3	-170.7	166.4	0	113.8	D772 S773 M774 P991	D772-K776 WeakPolarHBondContact O-CG 3.17Å; D772-K776 PolarHBondContact O-N 3.2Å; D772-K776 WeakPolarHBondContact OD2-CE 3.46Å; D772-K776 IonicContact OD2-NZ 3.27Å; D772-K776 PolarHBondContact OD2-NZ 2.78Å; S773-K776 PolarHBondContact O-N 2.93Å; M774-K776 PolarHBondContact O-N 3.12Å; K776-P991 WeakPolarHBondContact O-CB 3.28Å; K776-P991 WeakPolarHBondContact O-CG 3.26Å
777	Q	92.7	Very high	90.1	Very high	4 Å²	4	34.5 Å²	34.5	2%	0.019	18%	0.175	C	C	.	.	S	Bend	trans	-70.9	149.3	-179.2	-54.8	-55.9	-47.5	0	0	111.4	S773 M774 L775 W781 F782 R989	S773-Q777 WeakPolarHBondContact O-CG 2.92Å; S773-Q777 PolarHBondContact O-NE2 3.47Å; M774-Q777 WeakPolarHBondContact O-CB 3.31Å; M774-Q777 WeakPolarHBondContact O-CG 3.39Å; M774-Q777 PolarHBondContact O-N 2.85Å; L775-Q777 VanDerWaalsContact C-N 3.35Å; Q777-W781 HydrophobicContact CB-CB 4.01Å; Q777-W781 HydrophobicContact CB-CD2 3.89Å; Q777-W781 HydrophobicContact CB-CE3 3.74Å; Q777-W781 HydrophobicContact CB-CG 4.04Å; Q777-W781 HydrophobicContact CB-CZ3 4.49Å; Q777-W781 HydrophobicContact CG-CD2 3.89Å; Q777-W781 HydrophobicContact CG-CE3 3.88Å; Q777-W781 HydrophobicContact CG-CG 4.3Å; Q777-W781 HydrophobicContact CG-CZ3 4.28Å; Q777-F782 HydrophobicContact CB-CE2 4.02Å; Q777-R989 PolarHBondContact NE2-O 2.96Å; Q777-R989 VanDerWaalsContact NE2-O 3.17Å
778	E	91.2	Very high	89.7	Confident	20 Å²	20	41.2 Å²	41.2	9%	0.093	20%	0.201	C	C	.	.			trans	-71.2	160	174.4	72.5	-83.4	-160.2	0	0	112.2	G780 W781 F782 R989 P991 S992 I993	E778-G780 VanDerWaalsContact C-N 3.26Å; E778-G780 PolarHBondContact O-N 2.97Å; E778-W781 VanDerWaalsContact O-CB 3.28Å; E778-W781 WeakPolarHBondContact O-CB 3.43Å; E778-W781 PolarHBondContact O-N 3.39Å; E778-F782 WeakPolarHBondContact O-CD2 3.45Å; E778-R989 VanDerWaalsContact CD-NH1 3.32Å; E778-R989 IonicContact OE1-CZ 3.54Å; E778-R989 IonicContact OE1-NH1 2.95Å; E778-R989 PolarHBondContact OE1-NH1 3.2Å; E778-R989 IonicContact OE1-NH2 3.48Å; E778-R989 PolarHBondContact OE1-NH2 3.17Å; E778-R989 IonicContact OE2-CZ 2.74Å; E778-R989 IonicContact OE2-NH1 3Å; E778-R989 PolarHBondContact OE2-NH1 3.46Å; E778-R989 IonicContact OE2-NH2 3.17Å; E778-P991 WeakPolarHBondContact OE2-CA 3.39Å; E778-P991 WeakPolarHBondContact OE2-CB 3.45Å; E778-S992 VanDerWaalsContact CG-OG 3.27Å; E778-S992 WeakPolarHBondContact CG-OG 3.19Å; E778-S992 PolarHBondContact OE1-OG 3.47Å; E778-S992 PolarHBondContact OE2-N 3.36Å; E778-I993 HydrophobicContact CB-CB 4.29Å; E778-I993 HydrophobicContact CB-CD1 4.48Å
779	I	92.1	Very high	89.4	Confident	2 Å²	2	42.7 Å²	42.7	1%	0.01	21%	0.21	C	C	.	.	H	α-helix	trans	-62.8	-34	-176.4	-54.6	-157.3	0	0	0	112.2	R234 I237 W781 F782 D783 F1060 Y1061	R234-I779 HydrophobicContact CB-CD1 4.41Å; R234-I779 HydrophobicContact CG-CD1 4.08Å; R234-I779 HydrophobicContact CG-CG2 4.32Å; I237-I779 HydrophobicContact CD1-CD1 4.42Å; I237-I779 HydrophobicContact CD1-CG1 4.09Å; I779-W781 PolarHBondContact O-N 3.03Å; I779-W781 VanDerWaalsContact O-N 3.09Å; I779-F782 WeakPolarHBondContact O-CA 3.43Å; I779-F782 WeakPolarHBondContact O-CB 3.42Å; I779-F782 PolarHBondContact O-N 3.14Å; I779-D783 PolarHBondContact O-N 3.06Å; I779-F1060 HydrophobicContact CB-CB 4.26Å; I779-F1060 HydrophobicContact CD1-CB 3.78Å; I779-F1060 HydrophobicContact CD1-CD1 3.31Å; I779-F1060 HydrophobicContact CD1-CD2 3.43Å; I779-F1060 VanDerWaalsContact CD1-CD2 3.43Å; I779-F1060 HydrophobicContact CD1-CE1 3.54Å; I779-F1060 HydrophobicContact CD1-CE2 3.64Å; I779-F1060 HydrophobicContact CD1-CG 3.24Å; I779-F1060 HydrophobicContact CD1-CZ 3.68Å; I779-F1060 HydrophobicContact CG1-CB 4.04Å; I779-F1060 HydrophobicContact CG1-CD1 4.04Å; I779-F1060 HydrophobicContact CG1-CG 4Å; I779-Y1061 HydrophobicContact CB-CE1 4.47Å; I779-Y1061 WeakPolarHBondContact CG2-OH 3.49Å
780	G	88.3	Confident	88.9	Confident	6 Å²	6	41.7 Å²	41.7	6%	0.062	22%	0.216	C	C	.	.	H	α-helix	trans	-60.2	-19.9	174	0	0	0	0	0	114.5	E778	E778-G780 VanDerWaalsContact C-N 3.26Å; E778-G780 PolarHBondContact O-N 2.97Å
781	W	92	Very high	88.5	Confident	10 Å²	10	44 Å²	44	4%	0.038	23%	0.234	C	C	.	.	H	α-helix	trans	-75.7	-40	170.9	-175.5	81.4	0	0	0	111.7	M774 Q777 E778 I779 D783 R784 N787 L792 V986 R989	M774-W781 HydrophobicContact CG-CH2 4.11Å; M774-W781 HydrophobicContact CG-CZ3 4.41Å; Q777-W781 HydrophobicContact CB-CB 4.01Å; Q777-W781 HydrophobicContact CB-CD2 3.89Å; Q777-W781 HydrophobicContact CB-CE3 3.74Å; Q777-W781 HydrophobicContact CB-CG 4.04Å; Q777-W781 HydrophobicContact CB-CZ3 4.49Å; Q777-W781 HydrophobicContact CG-CD2 3.89Å; Q777-W781 HydrophobicContact CG-CE3 3.88Å; Q777-W781 HydrophobicContact CG-CG 4.3Å; Q777-W781 HydrophobicContact CG-CZ3 4.28Å; E778-W781 VanDerWaalsContact O-CB 3.28Å; E778-W781 WeakPolarHBondContact O-CB 3.43Å; E778-W781 PolarHBondContact O-N 3.39Å; I779-W781 PolarHBondContact O-N 3.03Å; I779-W781 VanDerWaalsContact O-N 3.09Å; W781-D783 VanDerWaalsContact C-N 3.33Å; W781-R784 PolarHBondContact O-N 3.49Å; W781-N787 HydrophobicContact CD2-CB 4.45Å; W781-N787 VanDerWaalsContact CD2-ND2 3.34Å; W781-N787 HydrophobicContact CE3-CB 4.3Å; W781-N787 HydrophobicContact CH2-CB 4.34Å; W781-N787 HydrophobicContact CZ2-CB 4.48Å; W781-N787 WeakPolarHBondContact CZ2-OD1 3.08Å; W781-N787 HydrophobicContact CZ3-CB 4.25Å; W781-N787 PolarHBondContact NE1-ND2 2.83Å; W781-N787 WeakPolarHBondContact O-CB 3.41Å; W781-N787 PolarHBondContact O-ND2 3.48Å; W781-L792 HydrophobicContact CH2-CD1 3.98Å; W781-L792 HydrophobicContact CH2-CD2 3.55Å; W781-L792 HydrophobicContact CH2-CG 4.44Å; W781-L792 HydrophobicContact CZ2-CD2 4.41Å; W781-L792 HydrophobicContact CZ3-CD1 3.67Å; W781-L792 HydrophobicContact CZ3-CD2 4.14Å; W781-V986 HydrophobicContact CH2-CG1 4.37Å; W781-V986 HydrophobicContact CZ2-CG1 4.16Å; W781-V986 HydrophobicContact CZ2-CG2 4.21Å; W781-R989 VanDerWaalsContact CD1-NH1 3.31Å
782	F	92.1	Very high	88.3	Confident	21 Å²	21	44.2 Å²	44.2	9%	0.092	24%	0.235	C	C	.	.	H	α-helix	trans	-71.7	-24.5	177.8	-68.9	-79.8	0	0	0	113.4	L230 I233 M774 Q777 E778 I779 R784 L792	L230-F782 HydrophobicContact CD2-CE1 3.86Å; I233-F782 HydrophobicContact CD1-CE2 4.31Å; I233-F782 HydrophobicContact CD1-CZ 4.01Å; I233-F782 HydrophobicContact CG1-CD1 4.39Å; I233-F782 HydrophobicContact CG1-CD2 4.07Å; I233-F782 HydrophobicContact CG1-CE1 4.05Å; I233-F782 HydrophobicContact CG1-CE2 3.7Å; I233-F782 HydrophobicContact CG1-CG 4.39Å; I233-F782 HydrophobicContact CG1-CZ 3.68Å; I233-F782 HydrophobicContact CG2-CB 4.38Å; I233-F782 HydrophobicContact CG2-CD1 4.24Å; I233-F782 HydrophobicContact CG2-CD2 4.41Å; I233-F782 HydrophobicContact CG2-CG 4.09Å; M774-F782 WeakPolarHBondContact O-CZ 3.18Å; Q777-F782 HydrophobicContact CB-CE2 4.02Å; E778-F782 WeakPolarHBondContact O-CD2 3.45Å; I779-F782 WeakPolarHBondContact O-CA 3.43Å; I779-F782 WeakPolarHBondContact O-CB 3.42Å; I779-F782 PolarHBondContact O-N 3.14Å; F782-R784 PolarHBondContact O-N 2.72Å; F782-L792 HydrophobicContact CD1-CD1 3.98Å; F782-L792 HydrophobicContact CE1-CD1 3.85Å
783	D	87.2	Confident	88.1	Confident	47 Å²	47	42.7 Å²	42.7	25%	0.251	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-13.2	176.9	-65	-31.4	0	0	0	113.4	R234 I779 W781 T1020 Y1061	R234-D783 IonicContact CZ-OD1 2.67Å; R234-D783 IonicContact NH2-OD1 2.78Å; R234-D783 PolarHBondContact NH2-OD1 2.95Å; I779-D783 PolarHBondContact O-N 3.06Å; W781-D783 VanDerWaalsContact C-N 3.33Å; D783-T1020 HydrophobicContact CB-CG2 3.74Å; D783-Y1061 WeakPolarHBondContact OD2-CE1 3.31Å; D783-Y1061 PolarHBondContact OD2-OH 3.15Å
784	R	84.9	Confident	87.8	Confident	126 Å²	126	44.2 Å²	44.2	48%	0.475	24%	0.241	S	C	.	.	S	Bend	trans	-68.2	140.6	176.9	-64.1	-177.7	178.1	-169.3	-3.2	110.6	W781 F782 D786 N787 T1020	W781-R784 PolarHBondContact O-N 3.49Å; F782-R784 PolarHBondContact O-N 2.72Å; R784-D786 PolarHBondContact O-N 3.48Å; R784-D786 VanDerWaalsContact O-N 3.1Å; R784-N787 HydrophobicContact CB-CB 4.47Å; R784-N787 PolarHBondContact O-N 3.28Å; R784-T1020 HydrophobicContact CG-CG2 4.47Å
785	S	75.7	Confident	87.5	Confident	75 Å²	75	45.5 Å²	45.5	52%	0.524	25%	0.247	S	C	.	.	G	3₁₀ helix	trans	-55.1	-31.6	178.1	49.8	0	0	0	0	113.8	N787 R788	S785-N787 VanDerWaalsContact C-N 3.31Å; S785-R788 WeakPolarHBondContact O-CD 3.09Å; S785-R788 WeakPolarHBondContact O-CG 3.41Å
786	D	77.4	Confident	87.4	Confident	125 Å²	125	45.4 Å²	45.4	67%	0.668	25%	0.246	S	C	*	.	G	3₁₀ helix	trans	-77.6	-21	-175.8	-51.6	-15	0	0	0	111.9	R784	R784-D786 PolarHBondContact O-N 3.48Å; R784-D786 VanDerWaalsContact O-N 3.1Å
787	N	88.2	Confident	87.2	Confident	22 Å²	22	42 Å²	42	12%	0.118	24%	0.236	C	C	.	.	G	3₁₀ helix	trans	-107.8	29.2	-174.4	-62.1	-29.4	0	0	0	112.3	W781 R784 S785 L792	W781-N787 HydrophobicContact CD2-CB 4.45Å; W781-N787 VanDerWaalsContact CD2-ND2 3.34Å; W781-N787 HydrophobicContact CE3-CB 4.3Å; W781-N787 HydrophobicContact CH2-CB 4.34Å; W781-N787 HydrophobicContact CZ2-CB 4.48Å; W781-N787 WeakPolarHBondContact CZ2-OD1 3.08Å; W781-N787 HydrophobicContact CZ3-CB 4.25Å; W781-N787 PolarHBondContact NE1-ND2 2.83Å; W781-N787 WeakPolarHBondContact O-CB 3.41Å; W781-N787 PolarHBondContact O-ND2 3.48Å; R784-N787 HydrophobicContact CB-CB 4.47Å; R784-N787 PolarHBondContact O-N 3.28Å; S785-N787 VanDerWaalsContact C-N 3.31Å; N787-L792 HydrophobicContact CB-CD1 4.31Å; N787-L792 HydrophobicContact CB-CD2 4.29Å; N787-L792 HydrophobicContact CB-CG 4.46Å; N787-L792 VanDerWaalsContact O-CD1 3.32Å; N787-L792 WeakPolarHBondContact O-CD1 3.18Å
788	R	84.1	Confident	86.8	Confident	164 Å²	164	44.9 Å²	44.9	62%	0.619	25%	0.253	S	S	*	.			trans	-62.1	148.6	173.1	-71.9	172.5	-176.4	175.7	3.3	110.4	S785 G790 A791 L792	S785-R788 WeakPolarHBondContact O-CD 3.09Å; S785-R788 WeakPolarHBondContact O-CG 3.41Å; R788-G790 VanDerWaalsContact C-N 3.33Å; R788-G790 PolarHBondContact O-N 3.09Å; R788-A791 WeakPolarHBondContact O-CB 3.25Å; R788-A791 PolarHBondContact O-N 3.28Å; R788-L792 PolarHBondContact O-N 2.98Å
789	P	86.6	Confident	86.5	Confident	45 Å²	45	44 Å²	44	29%	0.292	25%	0.249	S	C	.	.	H	α-helix	trans	-50	-47.9	-177.3	-28.8	34.3	0	0	0	113.9	L230 A791 L792 T793	L230-P789 HydrophobicContact CB-CB 4Å; P789-A791 PolarHBondContact O-N 2.97Å; P789-L792 PolarHBondContact O-N 3.18Å; P789-T793 PolarHBondContact O-N 2.96Å; P789-T793 PolarHBondContact O-OG1 3.1Å
790	G	83.2	Confident	86.2	Confident	46 Å²	46	43.9 Å²	43.9	47%	0.474	25%	0.248	S	C	.	.	H	α-helix	trans	-63.6	-37.1	178.6	0	0	0	0	0	114.1	R788 A794	R788-G790 VanDerWaalsContact C-N 3.33Å; R788-G790 PolarHBondContact O-N 3.09Å; G790-A794 WeakPolarHBondContact O-CB 3.18Å; G790-A794 PolarHBondContact O-N 3.45Å
791	A	84.7	Confident	86.1	Confident	47 Å²	47	45.5 Å²	45.5	39%	0.388	26%	0.259	S	S	.	.	H	α-helix	trans	-68.2	-40.5	176	0	0	0	0	0	111.5	R788 P789 A794 F795	R788-A791 WeakPolarHBondContact O-CB 3.25Å; R788-A791 PolarHBondContact O-N 3.28Å; P789-A791 PolarHBondContact O-N 2.97Å; A791-A794 PolarHBondContact O-N 2.89Å; A791-F795 VanDerWaalsContact O-CB 3.29Å; A791-F795 WeakPolarHBondContact O-CB 3.18Å; A791-F795 PolarHBondContact O-N 2.82Å
792	L	90.4	Very high	85.7	Confident	5 Å²	5	48.4 Å²	48.4	3%	0.026	27%	0.272	C	S	.	.	H	α-helix	trans	-67.8	-38.6	176.4	-66.1	-178.7	0	0	0	112.5	L230 M774 W781 F782 N787 R788 P789 F795 L796	L230-L792 HydrophobicContact CD1-CB 3.76Å; L230-L792 HydrophobicContact CD2-CD1 4.11Å; M774-L792 HydrophobicContact CE-CD2 4.08Å; W781-L792 HydrophobicContact CH2-CD1 3.98Å; W781-L792 HydrophobicContact CH2-CD2 3.55Å; W781-L792 HydrophobicContact CH2-CG 4.44Å; W781-L792 HydrophobicContact CZ2-CD2 4.41Å; W781-L792 HydrophobicContact CZ3-CD1 3.67Å; W781-L792 HydrophobicContact CZ3-CD2 4.14Å; F782-L792 HydrophobicContact CD1-CD1 3.98Å; F782-L792 HydrophobicContact CE1-CD1 3.85Å; N787-L792 HydrophobicContact CB-CD1 4.31Å; N787-L792 HydrophobicContact CB-CD2 4.29Å; N787-L792 HydrophobicContact CB-CG 4.46Å; N787-L792 VanDerWaalsContact O-CD1 3.32Å; N787-L792 WeakPolarHBondContact O-CD1 3.18Å; R788-L792 PolarHBondContact O-N 2.98Å; P789-L792 PolarHBondContact O-N 3.18Å; L792-F795 WeakPolarHBondContact O-CB 3.26Å; L792-F795 PolarHBondContact O-N 3.44Å; L792-L796 PolarHBondContact O-N 3.12Å
793	T	89.3	Confident	85.4	Confident	18 Å²	18	47.4 Å²	47.4	11%	0.11	27%	0.268	C	S	.	.	H	α-helix	trans	-64.6	-41.2	172.4	-61.4	0	0	0	0	111.7	C223 N227 P789 F795 L796 S797	C223-T793 HydrophobicContact CB-CG2 4.34Å; N227-T793 HydrophobicContact CB-CG2 4.44Å; P789-T793 PolarHBondContact O-N 2.96Å; P789-T793 PolarHBondContact O-OG1 3.1Å; T793-F795 VanDerWaalsContact C-N 3.32Å; T793-F795 PolarHBondContact O-N 2.96Å; T793-L796 PolarHBondContact O-N 3.02Å; T793-S797 PolarHBondContact O-N 3.21Å; T793-S797 VanDerWaalsContact O-N 3.14Å; T793-S797 PolarHBondContact O-OG 3.31Å
794	A	85.7	Confident	85	Confident	44 Å²	44	45.4 Å²	45.4	36%	0.364	26%	0.258	S	S	.	.	H	α-helix	trans	-64.7	-36.2	173.2	0	0	0	0	0	112.3	G790 A791 S797 T798	G790-A794 WeakPolarHBondContact O-CB 3.18Å; G790-A794 PolarHBondContact O-N 3.45Å; A791-A794 PolarHBondContact O-N 2.89Å; A794-S797 WeakPolarHBondContact CA-OG 3.36Å; A794-S797 PolarHBondContact O-N 3.08Å; A794-S797 PolarHBondContact O-OG 3.03Å; A794-T798 WeakPolarHBondContact O-CB 3.16Å; A794-T798 PolarHBondContact O-N 3.28Å; A794-T798 PolarHBondContact O-OG1 3.41Å
795	F	88	Confident	84.6	Confident	27 Å²	27	43.2 Å²	43.2	12%	0.118	25%	0.253	C	S	.	.	H	α-helix	trans	-67	-41.3	176.1	179.5	-130.8	0	0	0	112	L770 M774 A791 L792 T793 S797 D799 R982 I983 V986	L770-F795 HydrophobicContact CD1-CE1 3.95Å; L770-F795 HydrophobicContact CD1-CZ 4.49Å; L770-F795 HydrophobicContact CD2-CD1 4.22Å; L770-F795 HydrophobicContact CD2-CE1 3.92Å; L770-F795 HydrophobicContact CD2-CZ 4.31Å; L770-F795 HydrophobicContact CG-CE1 4.42Å; M774-F795 HydrophobicContact CE-CD1 3.37Å; M774-F795 HydrophobicContact CE-CE1 3.73Å; A791-F795 VanDerWaalsContact O-CB 3.29Å; A791-F795 WeakPolarHBondContact O-CB 3.18Å; A791-F795 PolarHBondContact O-N 2.82Å; L792-F795 WeakPolarHBondContact O-CB 3.26Å; L792-F795 PolarHBondContact O-N 3.44Å; T793-F795 VanDerWaalsContact C-N 3.32Å; T793-F795 PolarHBondContact O-N 2.96Å; F795-S797 VanDerWaalsContact C-N 3.32Å; F795-S797 PolarHBondContact O-N 2.98Å; F795-D799 HydrophobicContact CD2-CB 3.74Å; F795-D799 VanDerWaalsContact CD2-OD2 3.3Å; F795-D799 WeakPolarHBondContact CD2-OD2 3.45Å; F795-D799 HydrophobicContact CE2-CB 3.83Å; F795-D799 WeakPolarHBondContact CE2-OD2 3.37Å; F795-D799 WeakPolarHBondContact O-CB 3.42Å; F795-D799 PolarHBondContact O-N 3.46Å; F795-R982 HydrophobicContact CE2-CB 3.66Å; F795-R982 HydrophobicContact CZ-CB 3.88Å; F795-I983 HydrophobicContact CE2-CG1 3.96Å; F795-I983 HydrophobicContact CZ-CB 4.5Å; F795-I983 HydrophobicContact CZ-CG1 3.84Å; F795-V986 HydrophobicContact CE1-CB 4.48Å; F795-V986 HydrophobicContact CE1-CG2 3.94Å; F795-V986 HydrophobicContact CZ-CG2 4.36Å
796	L	90.1	Very high	84.8	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-64	-33.5	173.1	-77.4	159.9	0	0	0	113.3	Y219 L230 R767 L770 F771 M774 L792 T793 A800	Y219-L796 PolarHBondContact OH-O 2.9Å; L230-L796 HydrophobicContact CD1-CD1 4.29Å; R767-L796 PolarHBondContact NE-O 3.44Å; R767-L796 VanDerWaalsContact NE-O 3.12Å; L770-L796 HydrophobicContact CB-CD2 4.07Å; L770-L796 HydrophobicContact CD2-CD2 3.86Å; L770-L796 HydrophobicContact CD2-CG 4.48Å; L770-L796 HydrophobicContact CG-CD2 3.89Å; F771-L796 HydrophobicContact CB-CD2 4.1Å; F771-L796 HydrophobicContact CD2-CD1 3.84Å; M774-L796 HydrophobicContact CE-CD2 4.4Å; M774-L796 HydrophobicContact CE-CG 4.11Å; M774-L796 HydrophobicContact SD-CD1 3.92Å; M774-L796 HydrophobicContact SD-CD2 4.3Å; M774-L796 HydrophobicContact SD-CG 4.08Å; L792-L796 PolarHBondContact O-N 3.12Å; T793-L796 PolarHBondContact O-N 3.02Å; L796-A800 WeakPolarHBondContact O-CB 3.35Å
797	S	86.5	Confident	84.6	Confident	29 Å²	29	35 Å²	35	20%	0.203	20%	0.203	C	C	.	.	H	α-helix	trans	-80.5	-54.2	-177.6	64	0	0	0	0	113.3	Y219 R767 T793 A794 F795 S801	Y219-S797 WeakPolarHBondContact OH-CA 3.17Å; Y219-S797 WeakPolarHBondContact OH-CB 3.16Å; Y219-S797 PolarHBondContact OH-N 3.46Å; R767-S797 PolarHBondContact NH2-O 2.97Å; T793-S797 PolarHBondContact O-N 3.21Å; T793-S797 VanDerWaalsContact O-N 3.14Å; T793-S797 PolarHBondContact O-OG 3.31Å; A794-S797 WeakPolarHBondContact CA-OG 3.36Å; A794-S797 PolarHBondContact O-N 3.08Å; A794-S797 PolarHBondContact O-OG 3.03Å; F795-S797 VanDerWaalsContact C-N 3.32Å; F795-S797 PolarHBondContact O-N 2.98Å; S797-S801 PolarHBondContact O-OG 3.07Å
798	T	84.9	Confident	84	Confident	63 Å²	63	34 Å²	34	39%	0.387	20%	0.198	S	C	.	.	H	α-helix	trans	-80.9	-55	-170.3	58.5	0	0	0	0	112.1	A794 S801 K802	A794-T798 WeakPolarHBondContact O-CB 3.16Å; A794-T798 PolarHBondContact O-N 3.28Å; A794-T798 PolarHBondContact O-OG1 3.41Å; T798-S801 PolarHBondContact O-N 3.26Å; T798-S801 PolarHBondContact O-OG 3.48Å; T798-K802 WeakPolarHBondContact O-CG 3.38Å; T798-K802 PolarHBondContact O-N 3.45Å
799	D	85.8	Confident	83.5	Confident	1 Å²	1	30 Å²	30	1%	0.005	20%	0.195	C	C	.	.	H	α-helix	trans	-68.3	-42.7	-171.6	-81.9	18.8	0	0	0	112.4	F795 S801 K802 V803 A979 R982 I983	F795-D799 HydrophobicContact CD2-CB 3.74Å; F795-D799 VanDerWaalsContact CD2-OD2 3.3Å; F795-D799 WeakPolarHBondContact CD2-OD2 3.45Å; F795-D799 HydrophobicContact CE2-CB 3.83Å; F795-D799 WeakPolarHBondContact CE2-OD2 3.37Å; F795-D799 WeakPolarHBondContact O-CB 3.42Å; F795-D799 PolarHBondContact O-N 3.46Å; D799-S801 PolarHBondContact O-N 3.44Å; D799-K802 PolarHBondContact O-N 2.62Å; D799-K802 VanDerWaalsContact O-N 3.13Å; D799-V803 WeakPolarHBondContact O-CG2 3.49Å; D799-V803 PolarHBondContact O-N 2.96Å; D799-A979 HydrophobicContact CB-CB 3.86Å; D799-R982 IonicContact OD1-CZ 3.97Å; D799-R982 IonicContact OD1-NH2 3.19Å; D799-R982 PolarHBondContact OD1-NH2 3.45Å; D799-R982 IonicContact OD2-CZ 2.68Å; D799-R982 IonicContact OD2-NE 2.84Å; D799-R982 PolarHBondContact OD2-NE 2.83Å; D799-R982 IonicContact OD2-NH2 3.37Å; D799-R982 PolarHBondContact OD2-NH2 3.45Å; D799-I983 HydrophobicContact CB-CD1 4.07Å; D799-I983 HydrophobicContact CB-CG1 4.32Å
800	A	85.7	Confident	83.1	Confident	0 Å²	0	32.7 Å²	32.7	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-59.4	-36.7	176.6	0	0	0	0	0	112.1	R767 L796 A804	R767-A800 HydrophobicContact CG-CB 3.55Å; L796-A800 WeakPolarHBondContact O-CB 3.35Å; A800-A804 PolarHBondContact O-N 3.36Å; A800-A804 VanDerWaalsContact O-N 3.16Å
801	S	85.3	Confident	83	Confident	40 Å²	40	32.7 Å²	32.7	28%	0.28	19%	0.188	S	C	.	.	H	α-helix	trans	-71.6	-36.6	177	79.3	0	0	0	0	112.8	S797 T798 D799 A804 Q805	S797-S801 PolarHBondContact O-OG 3.07Å; T798-S801 PolarHBondContact O-N 3.26Å; T798-S801 PolarHBondContact O-OG 3.48Å; D799-S801 PolarHBondContact O-N 3.44Å; S801-A804 PolarHBondContact O-N 3.03Å; S801-Q805 WeakPolarHBondContact O-CG 3.41Å; S801-Q805 PolarHBondContact O-N 3.3Å
802	K	84.9	Confident	83	Confident	71 Å²	71	30.6 Å²	30.6	31%	0.309	17%	0.171	S	C	.	.	H	α-helix	trans	-62.2	-44.8	175.4	-73.2	174.5	178.3	174.1	0	110.8	T798 D799 Q805 A976 A979	T798-K802 WeakPolarHBondContact O-CG 3.38Å; T798-K802 PolarHBondContact O-N 3.45Å; D799-K802 PolarHBondContact O-N 2.62Å; D799-K802 VanDerWaalsContact O-N 3.13Å; K802-Q805 PolarHBondContact O-N 2.88Å; K802-A976 HydrophobicContact CB-CB 4.49Å; K802-A976 WeakPolarHBondContact O-CB 3.49Å; K802-A979 HydrophobicContact CB-CB 4.25Å; K802-A979 HydrophobicContact CD-CB 4.46Å
803	V	84.2	Confident	82.7	Confident	1 Å²	1	32.6 Å²	32.6	1%	0.006	18%	0.183	C	C	.	.	H	α-helix	trans	-63.7	-45.1	177.9	178	0	0	0	0	111.7	L678 L766 D799 Q805 I806 A979 M980 I983	L678-V803 HydrophobicContact CD1-CG1 3.5Å; L678-V803 HydrophobicContact CD2-CG1 3.99Å; L678-V803 HydrophobicContact CG-CG1 4.4Å; L766-V803 HydrophobicContact CD1-CB 4.02Å; L766-V803 HydrophobicContact CD1-CG1 3.65Å; D799-V803 WeakPolarHBondContact O-CG2 3.49Å; D799-V803 PolarHBondContact O-N 2.96Å; V803-Q805 PolarHBondContact O-N 3.42Å; V803-I806 WeakPolarHBondContact O-CB 3.31Å; V803-I806 PolarHBondContact O-N 3.03Å; V803-I806 VanDerWaalsContact O-N 3.09Å; V803-A979 HydrophobicContact CG2-CB 3.92Å; V803-M980 HydrophobicContact CB-CG 4.15Å; V803-M980 HydrophobicContact CG1-CG 3.58Å; V803-M980 HydrophobicContact CG1-SD 4.18Å; V803-M980 HydrophobicContact CG2-CB 4.31Å; V803-M980 HydrophobicContact CG2-CG 3.48Å; V803-M980 VanDerWaalsContact CG2-CG 3.48Å; V803-I983 HydrophobicContact CG2-CD1 3.8Å
804	A	79.4	Confident	82.4	Confident	5 Å²	5	32.1 Å²	32.1	4%	0.041	18%	0.181	C	C	.	.	H	α-helix	trans	-66	-23.3	-179.4	0	0	0	0	0	114.1	T763 A800 S801 I806 S807 G808	T763-A804 WeakPolarHBondContact OG1-CB 3.33Å; A800-A804 PolarHBondContact O-N 3.36Å; A800-A804 VanDerWaalsContact O-N 3.16Å; S801-A804 PolarHBondContact O-N 3.03Å; A804-I806 PolarHBondContact O-N 3.01Å; A804-S807 PolarHBondContact O-N 3.01Å; A804-S807 PolarHBondContact O-OG 3.49Å; A804-G808 PolarHBondContact O-N 3.01Å
805	Q	76.7	Confident	82.5	Confident	80 Å²	80	33.8 Å²	33.8	37%	0.374	18%	0.18	S	C	.	.	H	α-helix	trans	-62.4	-27.6	173.2	-74.7	177.6	36.8	0	0	112.3	S801 K802 V803 R810	S801-Q805 WeakPolarHBondContact O-CG 3.41Å; S801-Q805 PolarHBondContact O-N 3.3Å; K802-Q805 PolarHBondContact O-N 2.88Å; V803-Q805 PolarHBondContact O-N 3.42Å; Q805-R810 WeakPolarHBondContact O-CB 3.43Å
806	I	79.3	Confident	82.6	Confident	19 Å²	19	33.2 Å²	33.2	10%	0.097	18%	0.178	C	C	.	.	H	α-helix	trans	-66.3	-36.4	178.2	-61.9	166.1	0	0	0	111.9	Y675 V803 A804 L811 T973 A976 M980	Y675-I806 HydrophobicContact CE1-CD1 4.11Å; Y675-I806 HydrophobicContact CE1-CG2 4.27Å; V803-I806 WeakPolarHBondContact O-CB 3.31Å; V803-I806 PolarHBondContact O-N 3.03Å; V803-I806 VanDerWaalsContact O-N 3.09Å; A804-I806 PolarHBondContact O-N 3.01Å; I806-L811 WeakPolarHBondContact O-CB 3.23Å; I806-T973 HydrophobicContact CG1-CG2 4.46Å; I806-A976 HydrophobicContact CD1-CB 3.24Å; I806-A976 HydrophobicContact CG1-CB 3.6Å; I806-M980 HydrophobicContact CD1-CE 3.82Å; I806-M980 HydrophobicContact CD1-SD 4.26Å
807	S	74.3	Confident	82.4	Confident	7 Å²	7	33.2 Å²	33.2	5%	0.049	18%	0.178	C	C	.	.	H	α-helix	trans	-94.5	-7.9	-175.6	66	0	0	0	0	114.3	N682 L762 A804	N682-S807 WeakPolarHBondContact ND2-CB 2.95Å; L762-S807 WeakPolarHBondContact CD2-OG 3.12Å; A804-S807 PolarHBondContact O-N 3.01Å; A804-S807 PolarHBondContact O-OG 3.49Å
808	G	75.6	Confident	82.6	Confident	1 Å²	1	34.9 Å²	34.9	1%	0.01	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.4	-141.2	-172.7	0	0	0	0	0	115	F755 A804 R810 L811 S812	F755-G808 WeakPolarHBondContact CD1-O 3.47Å; A804-G808 PolarHBondContact O-N 3.01Å; G808-R810 PolarHBondContact O-N 3.03Å; G808-R810 VanDerWaalsContact O-N 3.14Å; G808-L811 VanDerWaalsContact O-CB 3.28Å; G808-L811 WeakPolarHBondContact O-CB 3.45Å; G808-L811 PolarHBondContact O-N 3.32Å; G808-L811 VanDerWaalsContact O-N 3.07Å; G808-S812 PolarHBondContact O-N 3.17Å
809	S	72.6	Confident	83	Confident	80 Å²	80	32.9 Å²	32.9	56%	0.559	18%	0.175	S	C	*	.	H	α-helix	trans	-58.7	-27	-177.2	58.3	0	0	0	0	114.2	S812 T813	S809-S812 WeakPolarHBondContact O-CB 3.25Å; S809-S812 PolarHBondContact O-N 3.33Å; S809-T813 PolarHBondContact O-N 2.77Å; S809-T813 PolarHBondContact O-OG1 3.02Å
810	R	77.7	Confident	83.2	Confident	103 Å²	103	32.9 Å²	32.9	39%	0.389	18%	0.175	S	C	.	.	H	α-helix	trans	-71.4	-36.5	176.9	-61.3	-66.5	-175	167.9	-2.7	112.3	Q805 G808 S812 T813 A814 F969	Q805-R810 WeakPolarHBondContact O-CB 3.43Å; G808-R810 PolarHBondContact O-N 3.03Å; G808-R810 VanDerWaalsContact O-N 3.14Å; R810-S812 VanDerWaalsContact C-N 3.27Å; R810-S812 PolarHBondContact O-N 3.02Å; R810-T813 WeakPolarHBondContact CA-OG1 3.33Å; R810-T813 PolarHBondContact O-N 3.09Å; R810-T813 PolarHBondContact O-OG1 3.11Å; R810-A814 WeakPolarHBondContact O-CB 3.48Å; R810-A814 PolarHBondContact O-N 2.97Å; R810-F969 HydrophobicContact CB-CD2 4.14Å; R810-F969 HydrophobicContact CB-CE2 4.41Å
811	L	81.4	Confident	83.3	Confident	46 Å²	46	34 Å²	34	24%	0.241	18%	0.181	C	C	.	.	H	α-helix	trans	-56.9	-47.6	170.9	-171.1	56.3	0	0	0	110.1	I689 F755 I806 G808 T813 A814 F815 F969	I689-L811 HydrophobicContact CG2-CD2 4.4Å; F755-L811 HydrophobicContact CE1-CB 4.4Å; F755-L811 HydrophobicContact CE1-CD2 4.21Å; F755-L811 HydrophobicContact CE1-CG 4.47Å; I806-L811 WeakPolarHBondContact O-CB 3.23Å; G808-L811 VanDerWaalsContact O-CB 3.28Å; G808-L811 WeakPolarHBondContact O-CB 3.45Å; G808-L811 PolarHBondContact O-N 3.32Å; G808-L811 VanDerWaalsContact O-N 3.07Å; L811-T813 PolarHBondContact O-N 3.06Å; L811-A814 PolarHBondContact O-N 3.29Å; L811-F815 WeakPolarHBondContact O-CB 3.41Å; L811-F815 PolarHBondContact O-N 3.17Å; L811-F969 HydrophobicContact CD1-CZ 4.35Å
812	S	85.5	Confident	83.7	Confident	3 Å²	3	36.7 Å²	36.7	2%	0.021	19%	0.192	C	C	.	.	H	α-helix	trans	-57.3	-49.3	178.5	-172.3	0	0	0	0	112.2	S696 Q751 F755 G808 S809 R810 A814 F815 E816	S696-S812 PolarHBondContact OG-OG 2.95Å; Q751-S812 WeakPolarHBondContact CG-OG 3.15Å; Q751-S812 PolarHBondContact NE2-OG 3.31Å; F755-S812 VanDerWaalsContact CD2-CB 3.46Å; F755-S812 VanDerWaalsContact CE2-OG 3.28Å; F755-S812 WeakPolarHBondContact CE2-OG 3.39Å; G808-S812 PolarHBondContact O-N 3.17Å; S809-S812 WeakPolarHBondContact O-CB 3.25Å; S809-S812 PolarHBondContact O-N 3.33Å; R810-S812 VanDerWaalsContact C-N 3.27Å; R810-S812 PolarHBondContact O-N 3.02Å; S812-A814 VanDerWaalsContact C-N 3.3Å; S812-A814 PolarHBondContact O-N 3.42Å; S812-F815 PolarHBondContact O-N 3.44Å; S812-E816 WeakPolarHBondContact O-CB 3.49Å; S812-E816 PolarHBondContact O-N 3.03Å
813	T	83.6	Confident	84	Confident	46 Å²	46	34 Å²	34	28%	0.282	18%	0.182	S	C	.	.	H	α-helix	trans	-64.6	-33	177.7	54.7	0	0	0	0	113.4	S809 R810 L811 A817	S809-T813 PolarHBondContact O-N 2.77Å; S809-T813 PolarHBondContact O-OG1 3.02Å; R810-T813 WeakPolarHBondContact CA-OG1 3.33Å; R810-T813 PolarHBondContact O-N 3.09Å; R810-T813 PolarHBondContact O-OG1 3.11Å; L811-T813 PolarHBondContact O-N 3.06Å; T813-A817 VanDerWaalsContact O-CB 3.27Å; T813-A817 WeakPolarHBondContact O-CB 3.41Å; T813-A817 PolarHBondContact O-N 3.27Å; T813-A817 VanDerWaalsContact O-N 3.09Å
814	A	84	Confident	84.2	Confident	9 Å²	9	34.1 Å²	34.1	7%	0.074	18%	0.184	C	C	.	.	H	α-helix	trans	-71.5	-43.2	176.5	0	0	0	0	0	110.8	R810 L811 S812 A817 V818 F969	R810-A814 WeakPolarHBondContact O-CB 3.48Å; R810-A814 PolarHBondContact O-N 2.97Å; L811-A814 PolarHBondContact O-N 3.29Å; S812-A814 VanDerWaalsContact C-N 3.3Å; S812-A814 PolarHBondContact O-N 3.42Å; A814-A817 PolarHBondContact O-N 3.39Å; A814-V818 WeakPolarHBondContact O-CG2 3.39Å; A814-V818 PolarHBondContact O-N 3.46Å; A814-F969 HydrophobicContact CB-CB 4.06Å; A814-F969 HydrophobicContact CB-CD1 3.94Å; A814-F969 HydrophobicContact CB-CD2 3.85Å; A814-F969 HydrophobicContact CB-CE1 4.32Å; A814-F969 HydrophobicContact CB-CE2 4.25Å; A814-F969 HydrophobicContact CB-CG 3.68Å; A814-F969 HydrophobicContact CB-CZ 4.46Å
815	F	87.4	Confident	84.7	Confident	78 Å²	78	36.1 Å²	36.1	34%	0.342	19%	0.193	S	C	.	.	H	α-helix	trans	-66	-45.3	178.4	-153.4	-101.2	0	0	0	111.6	C693 I697 L811 S812 A817 V818 V819	C693-F815 HydrophobicContact CB-CE1 4.32Å; I697-F815 HydrophobicContact CD1-CE1 4.1Å; I697-F815 HydrophobicContact CG1-CD1 4.3Å; I697-F815 HydrophobicContact CG1-CE1 3.65Å; L811-F815 WeakPolarHBondContact O-CB 3.41Å; L811-F815 PolarHBondContact O-N 3.17Å; S812-F815 PolarHBondContact O-N 3.44Å; F815-A817 VanDerWaalsContact C-N 3.29Å; F815-A817 PolarHBondContact O-N 3.36Å; F815-V818 PolarHBondContact O-N 3.35Å; F815-V819 HydrophobicContact CD1-CG2 4.13Å; F815-V819 HydrophobicContact CE1-CG2 4.13Å; F815-V819 WeakPolarHBondContact O-CG2 3.41Å; F815-V819 PolarHBondContact O-N 3.13Å
816	E	88.8	Confident	85.5	Confident	16 Å²	16	36 Å²	36	8%	0.075	20%	0.198	C	C	.	.	H	α-helix	trans	-54	-46.7	171.1	-175.9	-162	143.2	0	0	110.8	Q703 S812 V819 L820 R965	Q703-E816 PolarHBondContact NE2-OE1 3.49Å; Q703-E816 VanDerWaalsContact NE2-OE1 3.12Å; S812-E816 WeakPolarHBondContact O-CB 3.49Å; S812-E816 PolarHBondContact O-N 3.03Å; E816-V819 PolarHBondContact O-N 3.37Å; E816-L820 WeakPolarHBondContact O-CB 3.48Å; E816-L820 PolarHBondContact O-N 3.48Å; E816-R965 IonicContact OE1-NH1 3.85Å; E816-R965 PolarHBondContact OE1-NH1 3Å
817	A	87.9	Confident	86	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-66.4	-38	179.6	0	0	0	0	0	112.9	T813 A814 F815 L820 V821 A962 R965 I966	T813-A817 VanDerWaalsContact O-CB 3.27Å; T813-A817 WeakPolarHBondContact O-CB 3.41Å; T813-A817 PolarHBondContact O-N 3.27Å; T813-A817 VanDerWaalsContact O-N 3.09Å; A814-A817 PolarHBondContact O-N 3.39Å; F815-A817 VanDerWaalsContact C-N 3.29Å; F815-A817 PolarHBondContact O-N 3.36Å; A817-L820 PolarHBondContact O-N 3.22Å; A817-V821 VanDerWaalsContact O-CG2 3.25Å; A817-V821 WeakPolarHBondContact O-CG2 3.03Å; A817-V821 PolarHBondContact O-N 2.82Å; A817-A962 HydrophobicContact CB-CB 4.1Å; A817-R965 HydrophobicContact CB-CB 4.2Å; A817-I966 HydrophobicContact CB-CD1 4.13Å; A817-I966 HydrophobicContact CB-CG1 3.61Å
818	V	89.9	Confident	86.8	Confident	64 Å²	64	36 Å²	36	39%	0.388	20%	0.198	S	C	.	.	H	α-helix	trans	-65.3	-47.9	174.9	169.9	0	0	0	0	110.7	A814 F815 L820 V821 I822 I966	A814-V818 WeakPolarHBondContact O-CG2 3.39Å; A814-V818 PolarHBondContact O-N 3.46Å; F815-V818 PolarHBondContact O-N 3.35Å; V818-L820 VanDerWaalsContact C-N 3.3Å; V818-L820 PolarHBondContact O-N 3.46Å; V818-V821 PolarHBondContact O-N 3.08Å; V818-I822 HydrophobicContact CG1-CD1 3.73Å; V818-I822 HydrophobicContact CG1-CG1 4.44Å; V818-I822 WeakPolarHBondContact O-CG1 3.25Å; V818-I822 PolarHBondContact O-N 3.33Å; V818-I966 HydrophobicContact CG2-CD1 4.32Å
819	V	92.2	Very high	87.6	Confident	21 Å²	21	40.4 Å²	40.4	13%	0.127	22%	0.217	C	C	.	.	H	α-helix	trans	-59.2	-44.3	176.7	172.4	0	0	0	0	110.5	I697 L701 F815 E816 V821 I822 A823	I697-V819 HydrophobicContact CG1-CG2 4.14Å; I697-V819 HydrophobicContact CG2-CG1 4.5Å; L701-V819 HydrophobicContact CD2-CG1 4.21Å; L701-V819 HydrophobicContact CG-CG1 4.09Å; F815-V819 HydrophobicContact CD1-CG2 4.13Å; F815-V819 HydrophobicContact CE1-CG2 4.13Å; F815-V819 WeakPolarHBondContact O-CG2 3.41Å; F815-V819 PolarHBondContact O-N 3.13Å; E816-V819 PolarHBondContact O-N 3.37Å; V819-V821 PolarHBondContact O-N 2.85Å; V819-I822 PolarHBondContact O-N 3.36Å; V819-A823 WeakPolarHBondContact O-CB 3.4Å; V819-A823 PolarHBondContact O-N 2.95Å
820	L	90.7	Very high	88.5	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-59.3	-45.7	176.2	172.7	56.6	0	0	0	112	Q703 P704 E816 A817 V818 S824 A962	Q703-L820 HydrophobicContact CB-CD1 3.99Å; P704-L820 HydrophobicContact CG-CD1 3.67Å; E816-L820 WeakPolarHBondContact O-CB 3.48Å; E816-L820 PolarHBondContact O-N 3.48Å; A817-L820 PolarHBondContact O-N 3.22Å; V818-L820 VanDerWaalsContact C-N 3.3Å; V818-L820 PolarHBondContact O-N 3.46Å; L820-S824 WeakPolarHBondContact O-CB 3.47Å; L820-S824 PolarHBondContact O-N 3.42Å; L820-S824 PolarHBondContact O-OG 2.95Å; L820-A962 HydrophobicContact CB-CB 4.33Å; L820-A962 HydrophobicContact CD2-CB 3.47Å; L820-A962 VanDerWaalsContact CD2-CB 3.47Å; L820-A962 HydrophobicContact CG-CB 3.83Å
821	V	88.9	Confident	89.1	Confident	23 Å²	23	41.4 Å²	41.4	14%	0.139	22%	0.217	C	C	.	.	H	α-helix	trans	-63.6	-47	177.4	171.2	0	0	0	0	111.1	A817 V818 V819 S824 L825 A962 L963 I966	A817-V821 VanDerWaalsContact O-CG2 3.25Å; A817-V821 WeakPolarHBondContact O-CG2 3.03Å; A817-V821 PolarHBondContact O-N 2.82Å; V818-V821 PolarHBondContact O-N 3.08Å; V819-V821 PolarHBondContact O-N 2.85Å; V821-S824 PolarHBondContact O-N 2.91Å; V821-L825 HydrophobicContact CG1-CD1 3.97Å; V821-L825 WeakPolarHBondContact O-CG 3.32Å; V821-L825 PolarHBondContact O-N 3.49Å; V821-A962 HydrophobicContact CG2-CB 3.89Å; V821-L963 HydrophobicContact CG2-CD1 3.76Å; V821-I966 HydrophobicContact CG2-CD1 4.06Å
822	I	91.8	Very high	89.6	Confident	98 Å²	98	39.4 Å²	39.4	50%	0.503	21%	0.207	S	C	.	.	H	α-helix	trans	-61.9	-52.1	179.3	-65.9	167.8	0	0	0	110.4	V818 V819 S824 L825 V826	V818-I822 HydrophobicContact CG1-CD1 3.73Å; V818-I822 HydrophobicContact CG1-CG1 4.44Å; V818-I822 WeakPolarHBondContact O-CG1 3.25Å; V818-I822 PolarHBondContact O-N 3.33Å; V819-I822 PolarHBondContact O-N 3.36Å; I822-S824 VanDerWaalsContact C-N 3.26Å; I822-S824 PolarHBondContact O-N 3.23Å; I822-L825 PolarHBondContact O-N 3.22Å; I822-V826 HydrophobicContact CG2-CG2 4.33Å; I822-V826 VanDerWaalsContact O-CG2 3.29Å; I822-V826 WeakPolarHBondContact O-CG2 3.36Å; I822-V826 PolarHBondContact O-N 3.39Å
823	A	91.6	Very high	89.9	Confident	13 Å²	13	46.2 Å²	46.2	11%	0.107	23%	0.232	C	C	.	.	H	α-helix	trans	-59.2	-40.3	178.8	0	0	0	0	0	111.4	L701 P704 V819 V826 I827	L701-A823 HydrophobicContact CD2-CB 3.87Å; P704-A823 HydrophobicContact CB-CB 4.36Å; P704-A823 HydrophobicContact CG-CB 3.84Å; V819-A823 WeakPolarHBondContact O-CB 3.4Å; V819-A823 PolarHBondContact O-N 2.95Å; A823-V826 PolarHBondContact O-N 3.27Å; A823-I827 WeakPolarHBondContact O-CB 3.27Å; A823-I827 WeakPolarHBondContact O-CD1 3.44Å; A823-I827 VanDerWaalsContact O-CG1 3.23Å; A823-I827 WeakPolarHBondContact O-CG1 3.41Å; A823-I827 PolarHBondContact O-N 2.86Å
824	S	89.7	Confident	90.4	Very high	5 Å²	5	46.6 Å²	46.6	4%	0.035	23%	0.231	C	C	.	.	H	α-helix	trans	-66	-42	178.8	-62	0	0	0	0	112.8	L820 V821 I822 G828 T955	L820-S824 WeakPolarHBondContact O-CB 3.47Å; L820-S824 PolarHBondContact O-N 3.42Å; L820-S824 PolarHBondContact O-OG 2.95Å; V821-S824 PolarHBondContact O-N 2.91Å; I822-S824 VanDerWaalsContact C-N 3.26Å; I822-S824 PolarHBondContact O-N 3.23Å; S824-G828 PolarHBondContact O-N 3.42Å; S824-T955 VanDerWaalsContact CB-CG2 3.45Å; S824-T955 WeakPolarHBondContact O-CG2 3.32Å
825	L	89.7	Confident	90.7	Very high	47 Å²	47	46.2 Å²	46.2	25%	0.246	23%	0.227	C	C	.	.	H	α-helix	trans	-67	-44.4	176.2	-73	172.1	0	0	0	111.4	V821 I822 G828 F829 T836 I840 I843	V821-L825 HydrophobicContact CG1-CD1 3.97Å; V821-L825 WeakPolarHBondContact O-CG 3.32Å; V821-L825 PolarHBondContact O-N 3.49Å; I822-L825 PolarHBondContact O-N 3.22Å; L825-G828 PolarHBondContact O-N 2.91Å; L825-F829 WeakPolarHBondContact O-CD2 3.39Å; L825-F829 PolarHBondContact O-N 3.37Å; L825-T836 HydrophobicContact CD2-CG2 4.34Å; L825-I840 HydrophobicContact CD2-CG1 4.27Å; L825-I843 HydrophobicContact CD2-CD1 4.18Å
826	V	92.5	Very high	90.9	Very high	77 Å²	77	42.8 Å²	42.8	47%	0.467	21%	0.213	S	C	.	.	H	α-helix	trans	-59.3	-49	177.4	170.4	0	0	0	0	110.7	I822 A823 G828 F829 I830	I822-V826 HydrophobicContact CG2-CG2 4.33Å; I822-V826 VanDerWaalsContact O-CG2 3.29Å; I822-V826 WeakPolarHBondContact O-CG2 3.36Å; I822-V826 PolarHBondContact O-N 3.39Å; A823-V826 PolarHBondContact O-N 3.27Å; V826-G828 VanDerWaalsContact C-N 3.31Å; V826-G828 PolarHBondContact O-N 3.09Å; V826-F829 PolarHBondContact O-N 3.18Å; V826-I830 HydrophobicContact CG1-CD1 3.7Å; V826-I830 HydrophobicContact CG1-CG1 4.48Å; V826-I830 VanDerWaalsContact O-CG1 3.25Å; V826-I830 WeakPolarHBondContact O-CG1 3.33Å; V826-I830 PolarHBondContact O-N 3.46Å
827	I	91.1	Very high	91	Very high	24 Å²	24	46 Å²	46	12%	0.123	23%	0.23	C	C	.	.	H	α-helix	trans	-58.8	-45.4	175.3	-72.4	164.6	0	0	0	110.4	P704 L708 A823 F829 I830 Y831 T955	P704-I827 HydrophobicContact CB-CD1 3.58Å; L708-I827 HydrophobicContact CD1-CD1 4.08Å; L708-I827 HydrophobicContact CD2-CG2 3.93Å; L708-I827 HydrophobicContact CG-CD1 4.41Å; A823-I827 WeakPolarHBondContact O-CB 3.27Å; A823-I827 WeakPolarHBondContact O-CD1 3.44Å; A823-I827 VanDerWaalsContact O-CG1 3.23Å; A823-I827 WeakPolarHBondContact O-CG1 3.41Å; A823-I827 PolarHBondContact O-N 2.86Å; I827-F829 PolarHBondContact O-N 2.98Å; I827-I830 PolarHBondContact O-N 3.35Å; I827-Y831 HydrophobicContact CG2-CD2 3.79Å; I827-Y831 HydrophobicContact CG2-CE2 3.91Å; I827-Y831 VanDerWaalsContact O-CD2 3.23Å; I827-Y831 WeakPolarHBondContact O-CD2 3.34Å; I827-Y831 PolarHBondContact O-N 3.04Å; I827-T955 HydrophobicContact CB-CG2 4.11Å; I827-T955 HydrophobicContact CG2-CG2 3.97Å
828	G	89.6	Confident	91.1	Very high	3 Å²	3	48.3 Å²	48.3	3%	0.031	24%	0.244	C	C	.	.	H	α-helix	trans	-54	-53.1	176.5	0	0	0	0	0	112.6	S824 L825 V826 I830 Y831 S832 T836	S824-G828 PolarHBondContact O-N 3.42Å; L825-G828 PolarHBondContact O-N 2.91Å; V826-G828 VanDerWaalsContact C-N 3.31Å; V826-G828 PolarHBondContact O-N 3.09Å; G828-I830 PolarHBondContact O-N 3.28Å; G828-Y831 PolarHBondContact O-N 2.83Å; G828-S832 CarbonylContact O-C 3.55Å; G828-S832 VanDerWaalsContact O-C 3.29Å; G828-S832 PolarHBondContact O-N 3.38Å; G828-T836 VanDerWaalsContact CA-OG1 3.25Å; G828-T836 WeakPolarHBondContact CA-OG1 3.14Å; G828-T836 PolarHBondContact O-OG1 2.94Å
829	F	92.8	Very high	90.9	Very high	92 Å²	92	45.4 Å²	45.4	40%	0.404	23%	0.226	S	C	.	.	H	α-helix	trans	-64.5	-35.7	-179	-81.4	-67.8	0	0	0	113.6	L825 V826 I827 W833 T836 L837 I840	L825-F829 WeakPolarHBondContact O-CD2 3.39Å; L825-F829 PolarHBondContact O-N 3.37Å; V826-F829 PolarHBondContact O-N 3.18Å; I827-F829 PolarHBondContact O-N 2.98Å; F829-W833 HydrophobicContact CD1-CB 3.86Å; F829-W833 HydrophobicContact CE1-CB 4.46Å; F829-T836 HydrophobicContact CD1-CG2 4.33Å; F829-T836 HydrophobicContact CD2-CG2 3.97Å; F829-T836 HydrophobicContact CE1-CG2 4.23Å; F829-T836 HydrophobicContact CE2-CG2 3.86Å; F829-T836 HydrophobicContact CG-CG2 4.19Å; F829-T836 HydrophobicContact CZ-CG2 4Å; F829-T836 PolarHBondContact N-OG1 3.03Å; F829-L837 HydrophobicContact CE1-CD2 4.41Å; F829-I840 HydrophobicContact CE2-CD1 4.17Å; F829-I840 HydrophobicContact CZ-CD1 3.69Å
830	I	93	Very high	90.7	Very high	126 Å²	126	47.2 Å²	47.2	65%	0.646	24%	0.235	S	C	*	.	H	α-helix	trans	-64.9	-43.2	177.8	-70.2	166.9	0	0	0	111.1	V826 I827 G828	V826-I830 HydrophobicContact CG1-CD1 3.7Å; V826-I830 HydrophobicContact CG1-CG1 4.48Å; V826-I830 VanDerWaalsContact O-CG1 3.25Å; V826-I830 WeakPolarHBondContact O-CG1 3.33Å; V826-I830 PolarHBondContact O-N 3.46Å; I827-I830 PolarHBondContact O-N 3.35Å; G828-I830 PolarHBondContact O-N 3.28Å
831	Y	90.1	Very high	90.5	Very high	79 Å²	79	51.1 Å²	51.1	31%	0.31	26%	0.26	S	S	.	.	H	α-helix	trans	-86.3	-37.5	-175.2	-73.4	-71.1	0	0	0	114	L708 I827 G828 K951	L708-Y831 HydrophobicContact CD2-CE2 3.73Å; I827-Y831 HydrophobicContact CG2-CD2 3.79Å; I827-Y831 HydrophobicContact CG2-CE2 3.91Å; I827-Y831 VanDerWaalsContact O-CD2 3.23Å; I827-Y831 WeakPolarHBondContact O-CD2 3.34Å; I827-Y831 PolarHBondContact O-N 3.04Å; G828-Y831 PolarHBondContact O-N 2.83Å; Y831-K951 HydrophobicContact CD1-CD 3.64Å; Y831-K951 HydrophobicContact CD2-CB 4.16Å; Y831-K951 HydrophobicContact CD2-CD 4.04Å; Y831-K951 HydrophobicContact CE1-CD 3.37Å; Y831-K951 HydrophobicContact CE2-CD 3.83Å; Y831-K951 HydrophobicContact CG-CB 4.19Å; Y831-K951 HydrophobicContact CG-CD 3.97Å; Y831-K951 VanDerWaalsContact CZ-CD 3.47Å; Y831-K951 PolarHBondContact OH-NZ 3.46Å
832	S	91.2	Very high	90.3	Very high	4 Å²	4	52.3 Å²	52.3	3%	0.028	26%	0.264	C	S	.	.			trans	-161.7	107.8	168.8	175.2	0	0	0	0	110.6	G828 Q834 L835 T836	G828-S832 CarbonylContact O-C 3.55Å; G828-S832 VanDerWaalsContact O-C 3.29Å; G828-S832 PolarHBondContact O-N 3.38Å; S832-Q834 VanDerWaalsContact C-N 3.27Å; S832-Q834 PolarHBondContact O-N 3.36Å; S832-Q834 PolarHBondContact OG-OE1 3.14Å; S832-L835 PolarHBondContact OG-N 2.72Å; S832-T836 PolarHBondContact O-N 3Å; S832-T836 PolarHBondContact O-OG1 3.21Å
833	W	92.6	Very high	89.9	Confident	146 Å²	146	48.9 Å²	48.9	55%	0.553	25%	0.246	S	C	*	.	H	α-helix	trans	-63.6	-33.6	173.2	73.1	-89.2	0	0	0	112	F829 T836 L837	F829-W833 HydrophobicContact CD1-CB 3.86Å; F829-W833 HydrophobicContact CE1-CB 4.46Å; W833-T836 PolarHBondContact O-N 3.19Å; W833-L837 HydrophobicContact CE3-CD1 3.4Å; W833-L837 HydrophobicContact CE3-CG 4.27Å; W833-L837 HydrophobicContact CZ3-CD1 3.39Å; W833-L837 WeakPolarHBondContact O-CG 3.39Å; W833-L837 PolarHBondContact O-N 2.9Å
834	Q	92.9	Very high	89.5	Confident	53 Å²	53	51.9 Å²	51.9	25%	0.248	26%	0.264	C	S	.	.	H	α-helix	trans	-64.8	-46.6	-179.6	-55.9	103.1	-21	0	0	112.2	S832 T836 L837 L938	S832-Q834 VanDerWaalsContact C-N 3.27Å; S832-Q834 PolarHBondContact O-N 3.36Å; S832-Q834 PolarHBondContact OG-OE1 3.14Å; Q834-T836 VanDerWaalsContact C-N 3.35Å; Q834-L837 PolarHBondContact O-N 2.96Å; Q834-L938 HydrophobicContact CB-CD1 3.83Å; Q834-L938 HydrophobicContact CG-CD1 4.49Å
835	L	90.8	Very high	89.1	Confident	1 Å²	1	55 Å²	55	1%	0.005	28%	0.283	C	S	.	.	H	α-helix	trans	-66.5	-39	178.3	-69.4	177.4	0	0	0	111.9	S832 L837 V838 M839 L934 L938 I944 L949 V952	S832-L835 PolarHBondContact OG-N 2.72Å; L835-L837 VanDerWaalsContact C-N 3.33Å; L835-L837 PolarHBondContact O-N 3.26Å; L835-V838 PolarHBondContact O-N 2.85Å; L835-M839 WeakPolarHBondContact O-CG 3.42Å; L835-M839 PolarHBondContact O-N 2.77Å; L835-L934 HydrophobicContact CD2-CB 4.17Å; L835-L934 HydrophobicContact CD2-CD2 4.13Å; L835-L934 HydrophobicContact CD2-CG 4.13Å; L835-L938 HydrophobicContact CD2-CD1 4.09Å; L835-L938 HydrophobicContact CG-CD1 4.2Å; L835-I944 HydrophobicContact CD1-CD1 3.66Å; L835-I944 HydrophobicContact CG-CD1 4.22Å; L835-L949 HydrophobicContact CD1-CB 4.36Å; L835-L949 HydrophobicContact CD1-CD1 3.61Å; L835-L949 HydrophobicContact CD2-CD1 4.29Å; L835-V952 HydrophobicContact CB-CB 4.46Å; L835-V952 HydrophobicContact CB-CG1 3.9Å; L835-V952 HydrophobicContact CB-CG2 4.5Å; L835-V952 HydrophobicContact CD1-CB 4.36Å; L835-V952 HydrophobicContact CD1-CG2 4.4Å
836	T	90.7	Very high	88.6	Confident	6 Å²	6	53.3 Å²	53.3	4%	0.037	27%	0.274	C	S	.	.	H	α-helix	trans	-64.7	-38.1	-179.9	-55.2	0	0	0	0	111.6	L825 G828 F829 S832 W833 Q834 V838 M839 I840	L825-T836 HydrophobicContact CD2-CG2 4.34Å; G828-T836 VanDerWaalsContact CA-OG1 3.25Å; G828-T836 WeakPolarHBondContact CA-OG1 3.14Å; G828-T836 PolarHBondContact O-OG1 2.94Å; F829-T836 HydrophobicContact CD1-CG2 4.33Å; F829-T836 HydrophobicContact CD2-CG2 3.97Å; F829-T836 HydrophobicContact CE1-CG2 4.23Å; F829-T836 HydrophobicContact CE2-CG2 3.86Å; F829-T836 HydrophobicContact CG-CG2 4.19Å; F829-T836 HydrophobicContact CZ-CG2 4Å; F829-T836 PolarHBondContact N-OG1 3.03Å; S832-T836 PolarHBondContact O-N 3Å; S832-T836 PolarHBondContact O-OG1 3.21Å; W833-T836 PolarHBondContact O-N 3.19Å; Q834-T836 VanDerWaalsContact C-N 3.35Å; T836-V838 VanDerWaalsContact C-N 3.32Å; T836-V838 PolarHBondContact O-N 3.4Å; T836-M839 WeakPolarHBondContact O-CB 3.28Å; T836-M839 PolarHBondContact O-N 3.27Å; T836-M839 VanDerWaalsContact O-N 3.11Å; T836-I840 HydrophobicContact CG2-CD1 4.4Å; T836-I840 WeakPolarHBondContact O-CG1 3.29Å; T836-I840 PolarHBondContact O-N 3.23Å; T836-I840 VanDerWaalsContact O-N 3.17Å
837	L	91.2	Very high	87.8	Confident	84 Å²	84	52.6 Å²	52.6	44%	0.44	27%	0.267	S	S	.	.	H	α-helix	trans	-62.4	-34.9	175.4	-77	178.3	0	0	0	113.5	F829 W833 Q834 L835 M839 I840 P841	F829-L837 HydrophobicContact CE1-CD2 4.41Å; W833-L837 HydrophobicContact CE3-CD1 3.4Å; W833-L837 HydrophobicContact CE3-CG 4.27Å; W833-L837 HydrophobicContact CZ3-CD1 3.39Å; W833-L837 WeakPolarHBondContact O-CG 3.39Å; W833-L837 PolarHBondContact O-N 2.9Å; Q834-L837 PolarHBondContact O-N 2.96Å; L835-L837 VanDerWaalsContact C-N 3.33Å; L835-L837 PolarHBondContact O-N 3.26Å; L837-M839 PolarHBondContact O-N 3.2Å; L837-I840 HydrophobicContact CD2-CD1 4.31Å; L837-P841 WeakPolarHBondContact O-CD 3.41Å
838	V	89.6	Confident	87.1	Confident	48 Å²	48	56.4 Å²	56.4	29%	0.291	29%	0.287	S	S	.	.	H	α-helix	trans	-68.4	-27.1	175.7	171.5	0	0	0	0	112.2	L835 T836 P841 A930 L934	L835-V838 PolarHBondContact O-N 2.85Å; T836-V838 VanDerWaalsContact C-N 3.32Å; T836-V838 PolarHBondContact O-N 3.4Å; V838-P841 WeakPolarHBondContact O-CD 3.41Å; V838-A930 HydrophobicContact CG1-CB 3.87Å; V838-L934 HydrophobicContact CB-CD2 4.33Å; V838-L934 HydrophobicContact CG2-CD2 3.34Å
839	M	86.1	Confident	86.3	Confident	3 Å²	3	56.5 Å²	56.5	2%	0.015	29%	0.288	C	S	.	.	H	α-helix	trans	-83.8	-33	-177.2	-73	-61.1	-171.2	0	0	114.1	L835 T836 L837 P841 F842 S927 C931 F956	L835-M839 WeakPolarHBondContact O-CG 3.42Å; L835-M839 PolarHBondContact O-N 2.77Å; T836-M839 WeakPolarHBondContact O-CB 3.28Å; T836-M839 PolarHBondContact O-N 3.27Å; T836-M839 VanDerWaalsContact O-N 3.11Å; L837-M839 PolarHBondContact O-N 3.2Å; M839-P841 VanDerWaalsContact C-CD 3.5Å; M839-F842 WeakPolarHBondContact O-CB 3.35Å; M839-F842 PolarHBondContact O-N 3.44Å; M839-S927 WeakPolarHBondContact CE-O 3.45Å; M839-C931 HydrophobicContact CE-CB 3.13Å; M839-C931 WeakPolarHBondContact CE-SG 3.22Å; M839-F956 HydrophobicContact CB-CD1 4.45Å; M839-F956 HydrophobicContact CB-CD2 3.68Å; M839-F956 HydrophobicContact CB-CE1 4.34Å; M839-F956 HydrophobicContact CB-CE2 3.55Å; M839-F956 HydrophobicContact CB-CG 4.13Å; M839-F956 HydrophobicContact CB-CZ 3.89Å; M839-F956 HydrophobicContact CE-CD1 4.06Å; M839-F956 HydrophobicContact CE-CE1 4.47Å; M839-F956 HydrophobicContact CG-CD1 4.16Å; M839-F956 HydrophobicContact CG-CD2 4.09Å; M839-F956 HydrophobicContact CG-CE1 4.34Å; M839-F956 HydrophobicContact CG-CE2 4.28Å; M839-F956 HydrophobicContact CG-CG 4.02Å; M839-F956 HydrophobicContact CG-CZ 4.39Å; M839-F956 HydrophobicContact SD-CD1 3.53Å; M839-F956 VanDerWaalsContact SD-CD1 3.53Å; M839-F956 HydrophobicContact SD-CD2 4.42Å; M839-F956 HydrophobicContact SD-CE1 3.47Å; M839-F956 WeakPolarHBondContact SD-CE1 3.28Å; M839-F956 HydrophobicContact SD-CE2 4.37Å; M839-F956 HydrophobicContact SD-CG 4.01Å; M839-F956 HydrophobicContact SD-CZ 3.91Å
840	I	88	Confident	85.3	Confident	60 Å²	60	53.3 Å²	53.3	31%	0.308	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.9	-42.9	-177.4	-74.2	166.3	0	0	0	113.4	L825 F829 T836 L837 F842 I843 P844	L825-I840 HydrophobicContact CD2-CG1 4.27Å; F829-I840 HydrophobicContact CE2-CD1 4.17Å; F829-I840 HydrophobicContact CZ-CD1 3.69Å; T836-I840 HydrophobicContact CG2-CD1 4.4Å; T836-I840 WeakPolarHBondContact O-CG1 3.29Å; T836-I840 PolarHBondContact O-N 3.23Å; T836-I840 VanDerWaalsContact O-N 3.17Å; L837-I840 HydrophobicContact CD2-CD1 4.31Å; I840-F842 PolarHBondContact O-N 2.97Å; I840-F842 VanDerWaalsContact O-N 3.09Å; I840-I843 WeakPolarHBondContact O-CB 3.49Å; I840-I843 PolarHBondContact O-N 3.25Å; I840-P844 WeakPolarHBondContact O-CD 3.43Å
841	P	87.8	Confident	84.3	Confident	81 Å²	81	52.3 Å²	52.3	53%	0.526	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.6	-24.9	177.8	-28.5	35.5	0	0	0	115.1	L837 V838 M839	L837-P841 WeakPolarHBondContact O-CD 3.41Å; V838-P841 WeakPolarHBondContact O-CD 3.41Å; M839-P841 VanDerWaalsContact C-CD 3.5Å
842	F	84.2	Confident	83.3	Confident	49 Å²	49	51.8 Å²	51.8	22%	0.215	27%	0.267	C	S	.	.	H	α-helix	trans	-77.5	-23.8	178.1	-67.7	-86.8	0	0	0	112.9	M839 I840 V845 L846 L926 A930 F956	M839-F842 WeakPolarHBondContact O-CB 3.35Å; M839-F842 PolarHBondContact O-N 3.44Å; I840-F842 PolarHBondContact O-N 2.97Å; I840-F842 VanDerWaalsContact O-N 3.09Å; F842-V845 PolarHBondContact O-N 3.27Å; F842-L846 WeakPolarHBondContact O-CG 3.47Å; F842-L846 PolarHBondContact O-N 3.26Å; F842-L846 VanDerWaalsContact O-N 3.11Å; F842-L926 HydrophobicContact CE1-CB 4.02Å; F842-A930 HydrophobicContact CE2-CB 4.45Å; F842-F956 HydrophobicContact CB-CZ 4.36Å
843	I	83.7	Confident	82.1	Confident	25 Å²	25	54.1 Å²	54.1	13%	0.128	28%	0.279	C	S	.	.	H	α-helix	trans	-61.2	-53.2	-179.3	-67.8	175.6	0	0	0	111.5	L825 I840 V845 L846 L847 F956 L963	L825-I843 HydrophobicContact CD2-CD1 4.18Å; I840-I843 WeakPolarHBondContact O-CB 3.49Å; I840-I843 PolarHBondContact O-N 3.25Å; I843-V845 VanDerWaalsContact C-N 3.3Å; I843-V845 PolarHBondContact O-N 2.75Å; I843-L846 PolarHBondContact O-N 3.43Å; I843-L847 HydrophobicContact CG2-CD1 4.32Å; I843-L847 PolarHBondContact O-N 2.81Å; I843-L847 VanDerWaalsContact O-N 3.09Å; I843-F956 HydrophobicContact CD1-CE2 4.17Å; I843-F956 HydrophobicContact CG1-CE2 3.96Å; I843-F956 HydrophobicContact CG1-CZ 4.39Å; I843-L963 HydrophobicContact CB-CD2 3.9Å; I843-L963 HydrophobicContact CG1-CD2 4.08Å; I843-L963 HydrophobicContact CG2-CD2 3.6Å; I843-L963 HydrophobicContact CG2-CG 4.3Å; I843-L963 WeakPolarHBondContact O-CD2 3.34Å
844	P	82.7	Confident	80.8	Confident	76 Å²	76	49.8 Å²	49.8	49%	0.494	27%	0.266	S	S	.	.	H	α-helix	trans	-59.7	-36.9	177.4	-25.4	33.8	0	0	0	113.9	I840 L847 L848	I840-P844 WeakPolarHBondContact O-CD 3.43Å; P844-L847 PolarHBondContact O-N 3.38Å; P844-L848 WeakPolarHBondContact O-CB 3.41Å; P844-L848 PolarHBondContact O-N 2.83Å
845	V	81.5	Confident	79.3	Confident	70 Å²	70	53.8 Å²	53.8	42%	0.424	28%	0.282	S	S	.	.	H	α-helix	trans	-63.4	-44.2	179.6	177.5	0	0	0	0	110.6	F842 I843 L848 S849 I919	F842-V845 PolarHBondContact O-N 3.27Å; I843-V845 VanDerWaalsContact C-N 3.3Å; I843-V845 PolarHBondContact O-N 2.75Å; V845-L848 PolarHBondContact O-N 3.45Å; V845-S849 PolarHBondContact O-N 3.26Å; V845-I919 HydrophobicContact CG1-CG2 3.53Å
846	L	77.9	Confident	77.7	Confident	13 Å²	13	57 Å²	57	7%	0.068	29%	0.294	C	S	.	.	H	α-helix	trans	-64.7	-40.9	176.2	-68.8	169.9	0	0	0	112.2	F842 I843 S849 S850 P924 S960 L963	F842-L846 WeakPolarHBondContact O-CG 3.47Å; F842-L846 PolarHBondContact O-N 3.26Å; F842-L846 VanDerWaalsContact O-N 3.11Å; I843-L846 PolarHBondContact O-N 3.43Å; L846-S849 PolarHBondContact O-OG 2.87Å; L846-S850 PolarHBondContact O-N 3.14Å; L846-S850 VanDerWaalsContact O-N 3.1Å; L846-S850 PolarHBondContact O-OG 3.2Å; L846-P924 HydrophobicContact CD2-CG 4.23Å; L846-S960 VanDerWaalsContact CD1-OG 3.28Å; L846-S960 WeakPolarHBondContact CD1-OG 3.35Å; L846-L963 HydrophobicContact CB-CD2 4.01Å; L846-L963 HydrophobicContact CD1-CD2 4.23Å
847	L	77.6	Confident	76	Confident	61 Å²	61	62.8 Å²	62.8	32%	0.319	33%	0.329	S	S	.	.	H	α-helix	trans	-64.9	-42.9	175.8	-70.4	174.4	0	0	0	112.1	I843 P844 S850 R851 L963 T967	I843-L847 HydrophobicContact CG2-CD1 4.32Å; I843-L847 PolarHBondContact O-N 2.81Å; I843-L847 VanDerWaalsContact O-N 3.09Å; P844-L847 PolarHBondContact O-N 3.38Å; L847-S850 PolarHBondContact O-N 2.94Å; L847-R851 WeakPolarHBondContact O-CB 3.29Å; L847-R851 PolarHBondContact O-N 2.93Å; L847-L963 HydrophobicContact CD2-CB 3.91Å; L847-L963 HydrophobicContact CD2-CD2 4.4Å; L847-L963 HydrophobicContact CD2-CG 4.08Å; L847-L963 HydrophobicContact CG-CD2 4.15Å; L847-L963 HydrophobicContact CG-CG 4.33Å; L847-T967 WeakPolarHBondContact CD2-OG1 3.34Å
848	L	76	Confident	74.1	Confident	104 Å²	104	61.7 Å²	61.7	55%	0.545	33%	0.329	S	S	.	.	H	α-helix	trans	-64.2	-44.4	179.5	-175.2	61.1	0	0	0	110.9	P844 V845 S850 R851 I852	P844-L848 WeakPolarHBondContact O-CB 3.41Å; P844-L848 PolarHBondContact O-N 2.83Å; V845-L848 PolarHBondContact O-N 3.45Å; L848-S850 VanDerWaalsContact C-N 3.31Å; L848-S850 PolarHBondContact O-N 3.21Å; L848-R851 PolarHBondContact O-N 3.49Å; L848-I852 HydrophobicContact CD1-CD1 4.22Å; L848-I852 HydrophobicContact CD1-CG1 4.39Å; L848-I852 HydrophobicContact CG-CD1 3.99Å; L848-I852 VanDerWaalsContact O-CG1 3.29Å; L848-I852 WeakPolarHBondContact O-CG1 3.42Å; L848-I852 PolarHBondContact O-N 2.9Å
849	S	73	Confident	72.3	Confident	6 Å²	6	66.2 Å²	66.2	4%	0.042	34%	0.344	C	S	.	.	H	α-helix	trans	-58.5	-45.1	176.4	74.3	0	0	0	0	111.7	V845 L846 R851 I852 N853 V916	V845-S849 PolarHBondContact O-N 3.26Å; L846-S849 PolarHBondContact O-OG 2.87Å; S849-R851 PolarHBondContact O-N 3.11Å; S849-I852 PolarHBondContact O-N 3.12Å; S849-N853 PolarHBondContact O-N 3.47Å; S849-V916 WeakPolarHBondContact O-CG1 3.35Å
850	S	71.4	Confident	70.4	Confident	25 Å²	25	72.3 Å²	72.3	18%	0.175	38%	0.377	C	S	.	.	H	α-helix	trans	-65	-38.5	178.3	-59.8	0	0	0	0	112.3	L846 L847 L848 N853 M854 T967	L846-S850 PolarHBondContact O-N 3.14Å; L846-S850 VanDerWaalsContact O-N 3.1Å; L846-S850 PolarHBondContact O-OG 3.2Å; L847-S850 PolarHBondContact O-N 2.94Å; L848-S850 VanDerWaalsContact C-N 3.31Å; L848-S850 PolarHBondContact O-N 3.21Å; S850-N853 PolarHBondContact O-N 3.22Å; S850-M854 PolarHBondContact O-N 3.02Å; S850-T967 VanDerWaalsContact CB-CG2 3.47Å
851	R	70.5	Confident	68.8	Low	105 Å²	105	73.1 Å²	73.1	40%	0.396	38%	0.38	S	S	.	.	H	α-helix	trans	-68.2	-39.3	179.4	-173.3	-179.1	178.7	100.1	-8.8	111.7	L847 L848 S849 K855 T967	L847-R851 WeakPolarHBondContact O-CB 3.29Å; L847-R851 PolarHBondContact O-N 2.93Å; L848-R851 PolarHBondContact O-N 3.49Å; S849-R851 PolarHBondContact O-N 3.11Å; R851-K855 PolarHBondContact O-N 3.34Å; R851-T967 HydrophobicContact CB-CG2 4.04Å
852	I	70.8	Confident	67.5	Low	67 Å²	67	74.1 Å²	74.1	34%	0.344	38%	0.381	S	S	.	.	H	α-helix	trans	-68.4	-42.4	176.8	-61.1	165.2	0	0	0	109.7	L848 S849 M854 K855 R856 V916	L848-I852 HydrophobicContact CD1-CD1 4.22Å; L848-I852 HydrophobicContact CD1-CG1 4.39Å; L848-I852 HydrophobicContact CG-CD1 3.99Å; L848-I852 VanDerWaalsContact O-CG1 3.29Å; L848-I852 WeakPolarHBondContact O-CG1 3.42Å; L848-I852 PolarHBondContact O-N 2.9Å; S849-I852 PolarHBondContact O-N 3.12Å; I852-M854 VanDerWaalsContact C-N 3.33Å; I852-M854 PolarHBondContact O-N 3.26Å; I852-K855 PolarHBondContact O-N 3.48Å; I852-R856 VanDerWaalsContact CG2-NH2 3.33Å; I852-R856 WeakPolarHBondContact O-CG 3.41Å; I852-R856 PolarHBondContact O-NE 3Å; I852-V916 HydrophobicContact CB-CG1 4.25Å; I852-V916 HydrophobicContact CB-CG2 4.23Å; I852-V916 HydrophobicContact CD1-CG2 4.14Å; I852-V916 HydrophobicContact CG2-CG2 3.93Å
853	N	66.2	Low	66.4	Low	54 Å²	54	78 Å²	78	29%	0.289	40%	0.397	S	S	.	.	H	α-helix	trans	-54.5	-45.2	176	-79.7	-19.1	0	0	0	112.5	S849 S850 R856 V916	S849-N853 PolarHBondContact O-N 3.47Å; S850-N853 PolarHBondContact O-N 3.22Å; N853-R856 PolarHBondContact OD1-NH1 3.32Å; N853-V916 WeakPolarHBondContact OD1-CG1 3.21Å
854	M	63.4	Low	65.2	Low	55 Å²	55	79.1 Å²	79.1	27%	0.271	40%	0.403	S	S	.	.	H	α-helix	trans	-75.8	-33.5	179.8	-100.9	107.6	61.7	0	0	115.1	S850 I852 R856 V857 T967 A968 T971	S850-M854 PolarHBondContact O-N 3.02Å; I852-M854 VanDerWaalsContact C-N 3.33Å; I852-M854 PolarHBondContact O-N 3.26Å; M854-R856 PolarHBondContact O-N 3.5Å; M854-R856 VanDerWaalsContact O-N 3.12Å; M854-V857 PolarHBondContact O-N 2.93Å; M854-T967 HydrophobicContact CE-CG2 3.58Å; M854-T967 WeakPolarHBondContact CE-O 3.32Å; M854-A968 HydrophobicContact CE-CB 4.31Å; M854-A968 VanDerWaalsContact CE-N 3.3Å; M854-A968 HydrophobicContact SD-CB 4.5Å; M854-T971 HydrophobicContact CB-CG2 3.5Å; M854-T971 HydrophobicContact CE-CG2 3.68Å; M854-T971 HydrophobicContact CG-CG2 4Å
855	K	62.8	Low	64.6	Low	137 Å²	137	78.3 Å²	78.3	60%	0.596	40%	0.397	S	S	*	.	H	α-helix	trans	-62.2	-20.4	179.8	-86.2	-171.7	174.2	-171.2	0	113	R851 I852 V857	R851-K855 PolarHBondContact O-N 3.34Å; I852-K855 PolarHBondContact O-N 3.48Å; K855-V857 VanDerWaalsContact C-N 3.3Å; K855-V857 PolarHBondContact O-N 3.49Å
856	R	57.5	Low	64.3	Low	67 Å²	67	77.4 Å²	77.4	25%	0.253	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-26.3	-177.1	-71.1	165.2	-174.6	170.6	-2.4	113.9	I852 N853 M854 S858 K912	I852-R856 VanDerWaalsContact CG2-NH2 3.33Å; I852-R856 WeakPolarHBondContact O-CG 3.41Å; I852-R856 PolarHBondContact O-NE 3Å; N853-R856 PolarHBondContact OD1-NH1 3.32Å; M854-R856 PolarHBondContact O-N 3.5Å; M854-R856 VanDerWaalsContact O-N 3.12Å; R856-S858 PolarHBondContact O-N 3.02Å; R856-S858 VanDerWaalsContact O-N 3.13Å; R856-K912 PolarHBondContact NH2-O 2.92Å
857	V	53.5	Low	64.4	Low	128 Å²	128	82 Å²	82	78%	0.776	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.7	0.2	-170.3	-178.4	0	0	0	0	113.3	M854 K855	M854-V857 PolarHBondContact O-N 2.93Å; K855-V857 VanDerWaalsContact C-N 3.3Å; K855-V857 PolarHBondContact O-N 3.49Å
858	S	51.4	Low	64.7	Low	62 Å²	62	79.3 Å²	79.3	43%	0.434	40%	0.403	S	S	.	.	S	Bend	trans	-138.2	-10	-156.9	170.7	0	0	0	0	120.9	R856	R856-S858 PolarHBondContact O-N 3.02Å; R856-S858 VanDerWaalsContact O-N 3.13Å
859	K	52.1	Low	65.2	Low	142 Å²	142	76 Å²	76	62%	0.617	39%	0.386	S	S	*	.	S	Bend	trans	-137.5	-25	-167	-71.4	-166.4	177.6	-171.4	0	121.9
860	N	47.5	Very low	65.8	Low	132 Å²	132	77.4 Å²	77.4	71%	0.706	40%	0.396	S	S	*	.	S	Bend	trans	-112.4	-38.2	-172.1	-80.5	3.7	0	0	0	114.9	D862	N860-D862 VanDerWaalsContact C-N 3.32Å; N860-D862 PolarHBondContact O-N 3.31Å
861	E	53.7	Low	66.6	Low	76 Å²	76	76.6 Å²	76.6	36%	0.355	39%	0.389	S	S	.	.	H	α-helix	trans	-63.4	-39.8	-179.6	-69.9	176.4	151.1	0	0	111.5	K113 K863 I864 V865	K113-E861 IonicContact NZ-OE1 3.97Å; K113-E861 PolarHBondContact NZ-OE1 3.38Å; E861-K863 PolarHBondContact O-N 3.35Å; E861-K863 VanDerWaalsContact O-N 3.11Å; E861-I864 PolarHBondContact O-N 3.37Å; E861-V865 WeakPolarHBondContact O-CB 3.43Å; E861-V865 VanDerWaalsContact O-CG2 3.3Å; E861-V865 WeakPolarHBondContact O-CG2 3.27Å; E861-V865 PolarHBondContact O-N 3.25Å
862	D	60	Low	67.5	Low	102 Å²	102	71.6 Å²	71.6	55%	0.545	37%	0.37	S	S	.	.	H	α-helix	trans	-57.2	-33.6	-175.7	-60.9	-23.8	0	0	0	113.6	N860 A866	N860-D862 VanDerWaalsContact C-N 3.32Å; N860-D862 PolarHBondContact O-N 3.31Å; D862-A866 WeakPolarHBondContact O-CB 3.14Å; D862-A866 PolarHBondContact O-N 2.97Å
863	K	60.9	Low	68.4	Low	131 Å²	131	72.9 Å²	72.9	57%	0.57	37%	0.373	S	S	*	.	H	α-helix	trans	-74.1	-43.8	-176.8	-72.8	-172.7	179.7	-178.7	0	113.1	E861 K867	E861-K863 PolarHBondContact O-N 3.35Å; E861-K863 VanDerWaalsContact O-N 3.11Å; K863-K867 PolarHBondContact O-N 2.82Å
864	I	59.8	Low	69.5	Low	49 Å²	49	71.6 Å²	71.6	25%	0.251	37%	0.365	S	S	.	.	H	α-helix	trans	-74	-41.8	-178.1	-58.1	176.3	0	0	0	109.1	E861 A866 K867 G868 C902	E861-I864 PolarHBondContact O-N 3.37Å; I864-A866 PolarHBondContact O-N 2.99Å; I864-K867 WeakPolarHBondContact O-CB 2.85Å; I864-K867 PolarHBondContact O-N 3.39Å; I864-G868 PolarHBondContact O-N 3.35Å; I864-C902 HydrophobicContact CG2-CB 3.77Å
865	V	70.1	Confident	70.8	Confident	59 Å²	59	69 Å²	69	36%	0.358	35%	0.353	S	S	.	.	H	α-helix	trans	-62.7	-41.5	175	173.8	0	0	0	0	111	E861 K867 G868 I869	E861-V865 WeakPolarHBondContact O-CB 3.43Å; E861-V865 VanDerWaalsContact O-CG2 3.3Å; E861-V865 WeakPolarHBondContact O-CG2 3.27Å; E861-V865 PolarHBondContact O-N 3.25Å; V865-K867 VanDerWaalsContact C-N 3.28Å; V865-K867 PolarHBondContact O-N 3.35Å; V865-G868 PolarHBondContact O-N 3.17Å; V865-G868 VanDerWaalsContact O-N 3.16Å; V865-I869 HydrophobicContact CG1-CD1 3.54Å; V865-I869 HydrophobicContact CG1-CG1 4.28Å; V865-I869 WeakPolarHBondContact O-CD1 3.49Å; V865-I869 WeakPolarHBondContact O-CG1 3.48Å; V865-I869 PolarHBondContact O-N 3.48Å
866	A	75.1	Confident	72.2	Confident	51 Å²	51	62.5 Å²	62.5	42%	0.421	33%	0.325	S	S	.	.	H	α-helix	trans	-60.3	-33.4	175.7	0	0	0	0	0	113.6	D862 I864 I869 S870	D862-A866 WeakPolarHBondContact O-CB 3.14Å; D862-A866 PolarHBondContact O-N 2.97Å; I864-A866 PolarHBondContact O-N 2.99Å; A866-I869 PolarHBondContact O-N 3.31Å; A866-S870 VanDerWaalsContact O-CB 3.32Å; A866-S870 WeakPolarHBondContact O-CB 3.22Å; A866-S870 PolarHBondContact O-N 3.36Å
867	K	80.3	Confident	73.6	Confident	108 Å²	108	63 Å²	63	47%	0.47	34%	0.338	S	S	.	.	H	α-helix	trans	-64.8	-45.6	175.2	-176.9	-177.4	171.3	-167.9	0	111.1	K863 I864 V865 S870 I871 E901	K863-K867 PolarHBondContact O-N 2.82Å; I864-K867 WeakPolarHBondContact O-CB 2.85Å; I864-K867 PolarHBondContact O-N 3.39Å; V865-K867 VanDerWaalsContact C-N 3.28Å; V865-K867 PolarHBondContact O-N 3.35Å; K867-S870 PolarHBondContact O-N 2.93Å; K867-I871 WeakPolarHBondContact O-CD1 3.19Å; K867-I871 WeakPolarHBondContact O-CG1 3.27Å; K867-I871 PolarHBondContact O-N 2.97Å; K867-E901 IonicContact NZ-OE2 3.37Å; K867-E901 PolarHBondContact NZ-OE2 3.13Å
868	G	84	Confident	75.4	Confident	5 Å²	5	57.1 Å²	57.1	5%	0.052	30%	0.303	C	S	.	.	H	α-helix	trans	-61.4	-46	175	0	0	0	0	0	112.3	I864 V865 S870 I871 A872 F895	I864-G868 PolarHBondContact O-N 3.35Å; V865-G868 PolarHBondContact O-N 3.17Å; V865-G868 VanDerWaalsContact O-N 3.16Å; G868-S870 VanDerWaalsContact C-N 3.35Å; G868-S870 PolarHBondContact O-N 3.44Å; G868-I871 PolarHBondContact O-N 3.17Å; G868-A872 PolarHBondContact O-N 3.21Å; G868-F895 WeakPolarHBondContact O-CD2 3.38Å; G868-F895 WeakPolarHBondContact O-CE2 3.49Å
869	I	85.3	Confident	77.2	Confident	35 Å²	35	55.5 Å²	55.5	18%	0.179	29%	0.289	C	S	.	.	H	α-helix	trans	-63.8	-38.9	178.3	-63.4	158.8	0	0	0	111.7	I144 T148 V865 A866 I871 A872 K873	I144-I869 HydrophobicContact CG2-CG2 4.03Å; T148-I869 HydrophobicContact CG2-CD1 3.31Å; T148-I869 HydrophobicContact CG2-CG1 3.71Å; T148-I869 HydrophobicContact CG2-CG2 4.38Å; V865-I869 HydrophobicContact CG1-CD1 3.54Å; V865-I869 HydrophobicContact CG1-CG1 4.28Å; V865-I869 WeakPolarHBondContact O-CD1 3.49Å; V865-I869 WeakPolarHBondContact O-CG1 3.48Å; V865-I869 PolarHBondContact O-N 3.48Å; A866-I869 PolarHBondContact O-N 3.31Å; I869-I871 VanDerWaalsContact C-N 3.32Å; I869-I871 PolarHBondContact O-N 2.96Å; I869-A872 PolarHBondContact O-N 2.94Å; I869-K873 WeakPolarHBondContact O-CB 3.4Å; I869-K873 PolarHBondContact O-N 2.89Å
870	S	85.3	Confident	79	Confident	36 Å²	36	52.7 Å²	52.7	25%	0.252	28%	0.275	S	S	.	.	H	α-helix	trans	-59.5	-42.7	176.7	-178.1	0	0	0	0	111.7	A866 K867 G868 E874	A866-S870 VanDerWaalsContact O-CB 3.32Å; A866-S870 WeakPolarHBondContact O-CB 3.22Å; A866-S870 PolarHBondContact O-N 3.36Å; K867-S870 PolarHBondContact O-N 2.93Å; G868-S870 VanDerWaalsContact C-N 3.35Å; G868-S870 PolarHBondContact O-N 3.44Å; S870-E874 WeakPolarHBondContact O-CB 3.44Å; S870-E874 PolarHBondContact O-N 3.43Å
871	I	87.6	Confident	81	Confident	7 Å²	7	46.8 Å²	46.8	4%	0.036	24%	0.243	C	C	.	.	H	α-helix	trans	-65.2	-43.8	176.8	-64.2	158.3	0	0	0	110.1	K867 G868 I869 E874 S875 F891 R894 A898	K867-I871 WeakPolarHBondContact O-CD1 3.19Å; K867-I871 WeakPolarHBondContact O-CG1 3.27Å; K867-I871 PolarHBondContact O-N 2.97Å; G868-I871 PolarHBondContact O-N 3.17Å; I869-I871 VanDerWaalsContact C-N 3.32Å; I869-I871 PolarHBondContact O-N 2.96Å; I871-E874 PolarHBondContact O-N 3.35Å; I871-S875 PolarHBondContact O-N 2.9Å; I871-S875 PolarHBondContact O-OG 3.5Å; I871-F891 HydrophobicContact CG2-CD1 4Å; I871-R894 HydrophobicContact CD1-CG 3.93Å; I871-R894 HydrophobicContact CG1-CG 4.48Å; I871-R894 HydrophobicContact CG2-CB 4.39Å; I871-R894 HydrophobicContact CG2-CG 4.36Å; I871-A898 HydrophobicContact CD1-CB 4.28Å
872	A	90.1	Very high	82.8	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-61.1	-49	177.1	0	0	0	0	0	111.5	Y124 I144 L147 G868 I869 E874 S875 I876 F895	Y124-A872 HydrophobicContact CD2-CB 4.12Å; Y124-A872 HydrophobicContact CE2-CB 3.68Å; I144-A872 HydrophobicContact CD1-CB 4.27Å; L147-A872 HydrophobicContact CD1-CB 3.77Å; G868-A872 PolarHBondContact O-N 3.21Å; I869-A872 PolarHBondContact O-N 2.94Å; A872-E874 VanDerWaalsContact C-N 3.33Å; A872-E874 PolarHBondContact O-N 2.95Å; A872-S875 PolarHBondContact O-N 3.36Å; A872-S875 PolarHBondContact O-OG 3.35Å; A872-I876 HydrophobicContact CB-CD1 4.29Å; A872-I876 WeakPolarHBondContact O-CB 3.43Å; A872-I876 WeakPolarHBondContact O-CD1 3.2Å; A872-I876 VanDerWaalsContact O-CG1 3.25Å; A872-I876 WeakPolarHBondContact O-CG1 3.39Å; A872-I876 PolarHBondContact O-N 3.46Å; A872-F895 HydrophobicContact CB-CD2 4.27Å; A872-F895 HydrophobicContact CB-CE2 4.06Å
873	K	89.6	Confident	84.2	Confident	95 Å²	95	38.8 Å²	38.8	41%	0.413	20%	0.202	S	C	.	.	H	α-helix	trans	-55	-47.9	177.4	-175.2	-164.4	174.2	-147.9	0	111.6	I144 E497 I869 I876 S877	I144-K873 HydrophobicContact CD1-CB 4Å; E497-K873 IonicContact OE1-NZ 3.14Å; E497-K873 PolarHBondContact OE1-NZ 2.93Å; E497-K873 IonicContact OE2-NZ 3.37Å; I869-K873 WeakPolarHBondContact O-CB 3.4Å; I869-K873 PolarHBondContact O-N 2.89Å; K873-I876 PolarHBondContact O-N 3.25Å; K873-S877 WeakPolarHBondContact O-CB 3.16Å; K873-S877 PolarHBondContact O-N 3.35Å; K873-S877 PolarHBondContact O-OG 3.46Å; K873-S877 VanDerWaalsContact O-OG 3.05Å
874	E	89	Confident	85.5	Confident	26 Å²	26	33 Å²	33	12%	0.121	18%	0.178	C	C	.	.	H	α-helix	trans	-59.8	-47.9	178.7	-180	-173.6	-174.8	0	0	112.1	F451 D452 S870 I871 A872 S877 A878 R894	F451-E874 WeakPolarHBondContact CA-OE1 3.28Å; F451-E874 WeakPolarHBondContact CB-OE1 3.46Å; F451-E874 HydrophobicContact CD1-CG 3.92Å; F451-E874 WeakPolarHBondContact CD1-OE1 3.22Å; D452-E874 PolarHBondContact N-OE1 3.26Å; S870-E874 WeakPolarHBondContact O-CB 3.44Å; S870-E874 PolarHBondContact O-N 3.43Å; I871-E874 PolarHBondContact O-N 3.35Å; A872-E874 VanDerWaalsContact C-N 3.33Å; A872-E874 PolarHBondContact O-N 2.95Å; E874-S877 PolarHBondContact O-OG 3Å; E874-A878 WeakPolarHBondContact O-CB 3.2Å; E874-A878 PolarHBondContact O-N 2.91Å; E874-R894 IonicContact OE2-NH1 2.78Å
875	S	91.8	Very high	86.9	Confident	1 Å²	1	31 Å²	31	1%	0.007	17%	0.168	C	C	.	.	H	α-helix	trans	-67.8	-37	179.6	65.2	0	0	0	0	113.4	Y124 I871 A872 A878 H879	Y124-S875 WeakPolarHBondContact OH-CB 3.3Å; Y124-S875 PolarHBondContact OH-OG 3.28Å; I871-S875 PolarHBondContact O-N 2.9Å; I871-S875 PolarHBondContact O-OG 3.5Å; A872-S875 PolarHBondContact O-N 3.36Å; A872-S875 PolarHBondContact O-OG 3.35Å; S875-A878 CarbonylContact O-C 3.59Å; S875-H879 WeakPolarHBondContact O-CA 3.35Å; S875-H879 PolarHBondContact O-N 3.31Å; S875-H879 VanDerWaalsContact O-N 3.16Å
876	I	91.8	Very high	87.8	Confident	1 Å²	1	29.3 Å²	29.3	1%	0.005	16%	0.159	C	C	.	.	H	α-helix	trans	-78.3	-39.7	-176	-69.6	162	0	0	0	110.9	Y124 V127 F135 T140 I143 I144 L147 A872 K873 A878 H879	Y124-I876 HydrophobicContact CE2-CD1 4.3Å; V127-I876 HydrophobicContact CG1-CD1 4.24Å; V127-I876 HydrophobicContact CG1-CG1 4.18Å; F135-I876 HydrophobicContact CE1-CG2 4.09Å; T140-I876 HydrophobicContact CG2-CG2 3.77Å; I143-I876 HydrophobicContact CD1-CG2 3.97Å; I143-I876 HydrophobicContact CG2-CD1 3.66Å; I144-I876 HydrophobicContact CD1-CD1 4.14Å; L147-I876 HydrophobicContact CD1-CD1 4.2Å; A872-I876 HydrophobicContact CB-CD1 4.29Å; A872-I876 WeakPolarHBondContact O-CB 3.43Å; A872-I876 WeakPolarHBondContact O-CD1 3.2Å; A872-I876 VanDerWaalsContact O-CG1 3.25Å; A872-I876 WeakPolarHBondContact O-CG1 3.39Å; A872-I876 PolarHBondContact O-N 3.46Å; K873-I876 PolarHBondContact O-N 3.25Å; I876-A878 PolarHBondContact O-N 3.39Å; I876-H879 WeakPolarHBondContact O-CB 3.28Å; I876-H879 PolarHBondContact O-N 3.01Å; I876-H879 PolarHBondContact O-ND1 2.75Å
877	S	88	Confident	88.5	Confident	76 Å²	76	27 Å²	27	53%	0.531	14%	0.14	S	C	.	.	H	α-helix	trans	-63.8	-34.6	174.7	64.2	0	0	0	0	111.7	K873 E874	K873-S877 WeakPolarHBondContact O-CB 3.16Å; K873-S877 PolarHBondContact O-N 3.35Å; K873-S877 PolarHBondContact O-OG 3.46Å; K873-S877 VanDerWaalsContact O-OG 3.05Å; E874-S877 PolarHBondContact O-OG 3Å
878	A	89.6	Confident	89	Confident	6 Å²	6	22 Å²	22	5%	0.05	12%	0.118	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.9	22.5	178.1	0	0	0	0	0	113.9	V449 F451 E874 S875 I876 R880 T881 V882	V449-A878 HydrophobicContact CG1-CB 3.72Å; F451-A878 HydrophobicContact CE1-CB 3.7Å; F451-A878 HydrophobicContact CZ-CB 4.11Å; E874-A878 WeakPolarHBondContact O-CB 3.2Å; E874-A878 PolarHBondContact O-N 2.91Å; S875-A878 CarbonylContact O-C 3.59Å; I876-A878 PolarHBondContact O-N 3.39Å; A878-R880 VanDerWaalsContact C-N 3.26Å; A878-R880 PolarHBondContact O-N 2.71Å; A878-R880 VanDerWaalsContact O-N 3.09Å; A878-T881 WeakPolarHBondContact O-CA 3.37Å; A878-T881 WeakPolarHBondContact O-CB 3.31Å; A878-T881 PolarHBondContact O-N 2.85Å; A878-V882 HydrophobicContact CB-CG2 4.38Å; A878-V882 WeakPolarHBondContact O-CG2 3.26Å; A878-V882 PolarHBondContact O-N 3.28Å
879	H	89.9	Confident	89.3	Confident	28 Å²	28	26.3 Å²	26.3	13%	0.13	14%	0.137	C	C	.	.	H	α-helix	trans	-53.4	-36.7	-169.6	65.1	-83.1	0	0	0	114.1	F135 S875 I876 V882 K883	F135-H879 HydrophobicContact CD1-CB 4.33Å; F135-H879 HydrophobicContact CD2-CB 4.26Å; F135-H879 AromaticContact CD2-CD2 3.77Å; F135-H879 HydrophobicContact CE1-CB 4.23Å; F135-H879 HydrophobicContact CE2-CB 4.15Å; F135-H879 HydrophobicContact CG-CB 4.34Å; F135-H879 AromaticContact CG-CD2 3.71Å; F135-H879 AromaticContact CG-CG 3.85Å; F135-H879 HydrophobicContact CZ-CB 4.13Å; S875-H879 WeakPolarHBondContact O-CA 3.35Å; S875-H879 PolarHBondContact O-N 3.31Å; S875-H879 VanDerWaalsContact O-N 3.16Å; I876-H879 WeakPolarHBondContact O-CB 3.28Å; I876-H879 PolarHBondContact O-N 3.01Å; I876-H879 PolarHBondContact O-ND1 2.75Å; H879-V882 PolarHBondContact O-N 3.15Å; H879-K883 WeakPolarHBondContact O-CB 3.2Å; H879-K883 WeakPolarHBondContact O-CG 3.37Å; H879-K883 PolarHBondContact O-N 3.33Å
880	R	89.2	Confident	89.6	Confident	83 Å²	83	28.5 Å²	28.5	31%	0.313	14%	0.143	S	C	.	.	H	α-helix	trans	-64.4	-43.2	176.1	-62.5	-172.5	-177.7	172	-0.6	111.7	V132 D136 F414 A878 S884	V132-R880 HydrophobicContact CG1-CG 4.07Å; D136-R880 IonicContact OD1-NH2 3.43Å; D136-R880 PolarHBondContact OD1-NH2 2.73Å; F414-R880 HydrophobicContact CE2-CB 4.31Å; A878-R880 VanDerWaalsContact C-N 3.26Å; A878-R880 PolarHBondContact O-N 2.71Å; A878-R880 VanDerWaalsContact O-N 3.09Å; R880-S884 WeakPolarHBondContact O-CB 3.15Å; R880-S884 PolarHBondContact O-N 3.18Å
881	T	90.8	Very high	89.9	Confident	7 Å²	7	26.8 Å²	26.8	4%	0.043	13%	0.131	C	C	.	.	H	α-helix	trans	-69.1	-41.7	176.9	-44.2	0	0	0	0	111.1	Q445 V449 F451 A878 S884 L885	Q445-T881 PolarHBondContact OE1-OG1 3.43Å; V449-T881 HydrophobicContact CB-CG2 4.4Å; F451-T881 HydrophobicContact CE2-CG2 4.22Å; F451-T881 HydrophobicContact CZ-CG2 4.22Å; A878-T881 WeakPolarHBondContact O-CA 3.37Å; A878-T881 WeakPolarHBondContact O-CB 3.31Å; A878-T881 PolarHBondContact O-N 2.85Å; T881-S884 PolarHBondContact O-N 3.17Å; T881-L885 HydrophobicContact CG2-CD1 3.99Å; T881-L885 WeakPolarHBondContact O-CB 3.5Å; T881-L885 WeakPolarHBondContact O-CG 3.21Å; T881-L885 PolarHBondContact O-N 3.46Å
882	V	91.2	Very high	90.2	Very high	2 Å²	2	27.8 Å²	27.8	1%	0.012	14%	0.135	C	C	.	.	H	α-helix	trans	-59.5	-47	176	173.9	0	0	0	0	110.7	F451 A878 H879 L885 S886 L887 E888 F891	F451-V882 HydrophobicContact CE1-CG2 3.89Å; F451-V882 HydrophobicContact CZ-CG2 3.83Å; A878-V882 HydrophobicContact CB-CG2 4.38Å; A878-V882 WeakPolarHBondContact O-CG2 3.26Å; A878-V882 PolarHBondContact O-N 3.28Å; H879-V882 PolarHBondContact O-N 3.15Å; V882-L885 CarbonylContact O-C 3.04Å; V882-L885 PolarHBondContact O-N 3.36Å; V882-S886 PolarHBondContact O-N 2.95Å; V882-L887 HydrophobicContact CG1-CB 4.01Å; V882-L887 PolarHBondContact O-N 2.96Å; V882-E888 HydrophobicContact CG1-CG 4.39Å; V882-F891 HydrophobicContact CG1-CD2 4.03Å; V882-F891 HydrophobicContact CG1-CE2 4.47Å; V882-F891 HydrophobicContact CG2-CD2 4.05Å; V882-F891 HydrophobicContact CG2-CE2 3.78Å
883	K	89.1	Confident	90.4	Very high	8 Å²	8	31.5 Å²	31.5	4%	0.035	15%	0.152	C	C	.	.	H	α-helix	trans	-68.5	-42.9	178	-79.4	-179.5	177.2	-84.2	0	113.4	L128 K130 V132 F414 R438 H879 L885 S886 E888	L128-K883 WeakPolarHBondContact O-CE 3.5Å; L128-K883 PolarHBondContact O-NZ 3.25Å; L128-K883 VanDerWaalsContact O-NZ 3.12Å; K130-K883 WeakPolarHBondContact O-CE 3.49Å; K130-K883 PolarHBondContact O-NZ 2.99Å; V132-K883 HydrophobicContact CG2-CD 3.86Å; F414-K883 HydrophobicContact CE1-CB 3.93Å; R438-K883 WeakPolarHBondContact CD-O 3.14Å; R438-K883 PolarHBondContact NH1-O 3.36Å; H879-K883 WeakPolarHBondContact O-CB 3.2Å; H879-K883 WeakPolarHBondContact O-CG 3.37Å; H879-K883 PolarHBondContact O-N 3.33Å; K883-L885 PolarHBondContact O-N 2.89Å; K883-S886 PolarHBondContact O-N 2.91Å; K883-E888 WeakPolarHBondContact CA-OE1 3.32Å; K883-E888 WeakPolarHBondContact CG-OE1 3.42Å
884	S	88.8	Confident	90.5	Very high	9 Å²	9	31 Å²	31	6%	0.063	15%	0.148	C	C	.	.	H	α-helix	trans	-57.2	-41.5	175.6	-168.8	0	0	0	0	110.7	Q412 C443 R880 T881	Q412-S884 VanDerWaalsContact OE1-CB 3.32Å; Q412-S884 PolarHBondContact OE1-OG 3.23Å; C443-S884 WeakPolarHBondContact CB-OG 3.28Å; R880-S884 WeakPolarHBondContact O-CB 3.15Å; R880-S884 PolarHBondContact O-N 3.18Å; T881-S884 PolarHBondContact O-N 3.17Å
885	L	89.4	Confident	90.6	Very high	9 Å²	9	29.8 Å²	29.8	5%	0.047	14%	0.142	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.6	-0.7	177.6	-63.5	174.1	0	0	0	114.1	R514 R518 T881 V882 K883 L887	R514-L885 HydrophobicContact CG-CD1 4.36Å; R518-L885 VanDerWaalsContact NH1-CA 3.35Å; R518-L885 PolarHBondContact NH1-O 2.85Å; R518-L885 PolarHBondContact NH2-O 3.37Å; T881-L885 HydrophobicContact CG2-CD1 3.99Å; T881-L885 WeakPolarHBondContact O-CB 3.5Å; T881-L885 WeakPolarHBondContact O-CG 3.21Å; T881-L885 PolarHBondContact O-N 3.46Å; V882-L885 CarbonylContact O-C 3.04Å; V882-L885 PolarHBondContact O-N 3.36Å; K883-L885 PolarHBondContact O-N 2.89Å; L885-L887 VanDerWaalsContact C-N 3.26Å; L885-L887 HydrophobicContact CB-CD1 3.66Å; L885-L887 HydrophobicContact CB-CG 3.67Å; L885-L887 HydrophobicContact CD1-CD1 3.75Å; L885-L887 HydrophobicContact CG-CD1 4.38Å; L885-L887 PolarHBondContact O-N 3.28Å
886	S	88.1	Confident	90.6	Very high	23 Å²	23	33.2 Å²	33.2	16%	0.161	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.6	42.4	-174.3	-57.2	0	0	0	0	113.7	R438 V882 K883 E888	R438-S886 WeakPolarHBondContact CB-OG 3.3Å; V882-S886 PolarHBondContact O-N 2.95Å; K883-S886 PolarHBondContact O-N 2.91Å; S886-E888 WeakPolarHBondContact CA-OE2 3.45Å
887	L	90.2	Very high	90.6	Very high	3 Å²	3	38.5 Å²	38.5	2%	0.016	19%	0.185	C	C	.	.			trans	-94.1	10.2	-176.9	-70.5	173.8	0	0	0	113.7	F451 L461 L464 V882 L885 E889 Y890 F891	F451-L887 HydrophobicContact CE2-CD1 4.33Å; L461-L887 HydrophobicContact CB-CD1 4.04Å; L461-L887 HydrophobicContact CD1-CD1 4.49Å; L461-L887 HydrophobicContact CD2-CD1 4.26Å; L461-L887 HydrophobicContact CD2-CD2 4.22Å; L461-L887 HydrophobicContact CG-CD1 4.49Å; L464-L887 HydrophobicContact CD2-CD2 4.1Å; V882-L887 HydrophobicContact CG1-CB 4.01Å; V882-L887 PolarHBondContact O-N 2.96Å; L885-L887 VanDerWaalsContact C-N 3.26Å; L885-L887 HydrophobicContact CB-CD1 3.66Å; L885-L887 HydrophobicContact CB-CG 3.67Å; L885-L887 HydrophobicContact CD1-CD1 3.75Å; L885-L887 HydrophobicContact CG-CD1 4.38Å; L885-L887 PolarHBondContact O-N 3.28Å; L887-E889 PolarHBondContact O-N 2.88Å; L887-Y890 WeakPolarHBondContact O-CB 3.49Å; L887-Y890 PolarHBondContact O-N 3.21Å; L887-F891 HydrophobicContact CB-CD2 4.09Å; L887-F891 HydrophobicContact CB-CE2 4.17Å; L887-F891 HydrophobicContact CD1-CE2 4.41Å; L887-F891 WeakPolarHBondContact O-CD2 3.48Å; L887-F891 PolarHBondContact O-N 3.36Å; L887-F891 VanDerWaalsContact O-N 3.15Å
888	E	90.5	Very high	90.5	Very high	3 Å²	3	35.1 Å²	35.1	1%	0.014	16%	0.161	C	C	.	.	H	α-helix	trans	-56.7	-48.1	-175.9	-58.7	90	162.3	0	0	111.3	L128 H435 R438 V882 K883 S886 Y890 F891 Y892	L128-E888 HydrophobicContact CB-CB 4.29Å; L128-E888 HydrophobicContact CB-CG 4.5Å; L128-E888 WeakPolarHBondContact CD1-O 3.34Å; H435-E888 IonicContact CE1-OE2 3.52Å; R438-E888 IonicContact NH1-OE1 3.46Å; V882-E888 HydrophobicContact CG1-CG 4.39Å; K883-E888 WeakPolarHBondContact CA-OE1 3.32Å; K883-E888 WeakPolarHBondContact CG-OE1 3.42Å; S886-E888 WeakPolarHBondContact CA-OE2 3.45Å; E888-Y890 PolarHBondContact O-N 2.93Å; E888-F891 PolarHBondContact O-N 3.4Å; E888-Y892 WeakPolarHBondContact O-CB 3.36Å; E888-Y892 PolarHBondContact O-N 3.05Å
889	E	89.8	Confident	90.3	Very high	94 Å²	94	35.2 Å²	35.2	44%	0.439	16%	0.161	S	C	.	.	H	α-helix	trans	-66.3	-36	-179.7	-174.4	57	-153.1	0	0	112.4	L887 Y892 Q893	L887-E889 PolarHBondContact O-N 2.88Å; E889-Y892 PolarHBondContact O-N 3.48Å; E889-Q893 WeakPolarHBondContact O-CG 3.35Å; E889-Q893 PolarHBondContact O-N 2.79Å; E889-Q893 WeakPolarHBondContact OE1-CG 3.42Å; E889-Q893 PolarHBondContact OE1-NE2 3.47Å
890	Y	91.4	Very high	90.1	Very high	82 Å²	82	38 Å²	38	32%	0.322	18%	0.176	S	C	.	.	H	α-helix	trans	-61.4	-48.7	177.4	171.1	-98.2	0	0	0	111.4	L461 L464 L887 E888 Q893 R894	L461-Y890 HydrophobicContact CD2-CD1 3.99Å; L461-Y890 HydrophobicContact CD2-CE1 3.6Å; L461-Y890 HydrophobicContact CD2-CE2 4.49Å; L464-Y890 HydrophobicContact CD2-CD2 3.94Å; L464-Y890 HydrophobicContact CD2-CE2 4.38Å; L464-Y890 HydrophobicContact CD2-CG 4.34Å; L887-Y890 WeakPolarHBondContact O-CB 3.49Å; L887-Y890 PolarHBondContact O-N 3.21Å; E888-Y890 PolarHBondContact O-N 2.93Å; Y890-Q893 PolarHBondContact O-N 2.75Å; Y890-R894 PolarHBondContact O-N 3.09Å; Y890-R894 VanDerWaalsContact O-N 3.1Å
891	F	92.8	Very high	89.7	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-68.3	-36.9	177.9	-81.2	-74.8	0	0	0	112.2	F451 I871 V882 L887 E888 R894 F895	F451-F891 HydrophobicContact CD1-CE1 4.41Å; F451-F891 HydrophobicContact CD1-CE2 4.28Å; F451-F891 AromaticContact CD1-CZ 3.53Å; F451-F891 HydrophobicContact CD1-CZ 3.53Å; F451-F891 AromaticContact CE1-CE2 3.91Å; F451-F891 HydrophobicContact CE1-CE2 3.91Å; F451-F891 AromaticContact CE1-CZ 3.58Å; F451-F891 HydrophobicContact CE1-CZ 3.58Å; F451-F891 HydrophobicContact CG-CZ 4.18Å; F451-F891 HydrophobicContact CZ-CE2 4.24Å; F451-F891 HydrophobicContact CZ-CZ 4.28Å; I871-F891 HydrophobicContact CG2-CD1 4Å; V882-F891 HydrophobicContact CG1-CD2 4.03Å; V882-F891 HydrophobicContact CG1-CE2 4.47Å; V882-F891 HydrophobicContact CG2-CD2 4.05Å; V882-F891 HydrophobicContact CG2-CE2 3.78Å; L887-F891 HydrophobicContact CB-CD2 4.09Å; L887-F891 HydrophobicContact CB-CE2 4.17Å; L887-F891 HydrophobicContact CD1-CE2 4.41Å; L887-F891 WeakPolarHBondContact O-CD2 3.48Å; L887-F891 PolarHBondContact O-N 3.36Å; L887-F891 VanDerWaalsContact O-N 3.15Å; E888-F891 PolarHBondContact O-N 3.4Å; F891-R894 PolarHBondContact O-N 2.9Å; F891-F895 WeakPolarHBondContact O-CB 3.42Å; F891-F895 PolarHBondContact O-N 3.24Å
892	Y	93.3	Very high	89	Confident	27 Å²	27	39 Å²	39	11%	0.106	19%	0.186	C	C	.	.	H	α-helix	trans	-58.2	-47.8	173.2	177.2	-107.3	0	0	0	112.2	Y124 Q125 E888 E889 R894 F895 K896	Y124-Y892 HydrophobicContact CD1-CD2 4.3Å; Q125-Y892 HydrophobicContact CB-CD2 3.91Å; Q125-Y892 HydrophobicContact CB-CE2 3.66Å; Q125-Y892 HydrophobicContact CG-CD2 4.23Å; Q125-Y892 HydrophobicContact CG-CE2 4.07Å; Q125-Y892 PolarHBondContact OE1-OH 3Å; E888-Y892 WeakPolarHBondContact O-CB 3.36Å; E888-Y892 PolarHBondContact O-N 3.05Å; E889-Y892 PolarHBondContact O-N 3.48Å; Y892-R894 PolarHBondContact O-N 3.43Å; Y892-F895 PolarHBondContact O-N 3.08Å; Y892-K896 HydrophobicContact CE1-CD 4.28Å; Y892-K896 VanDerWaalsContact O-CB 3.3Å; Y892-K896 WeakPolarHBondContact O-CB 3.15Å; Y892-K896 PolarHBondContact O-N 3.29Å
893	Q	93.4	Very high	88.3	Confident	78 Å²	78	39.2 Å²	39.2	36%	0.364	19%	0.187	S	C	.	.	H	α-helix	trans	-64.8	-41.4	178.4	-68.4	-65.7	-13.6	0	0	112.3	E889 Y890 F895 K896 L897	E889-Q893 WeakPolarHBondContact O-CG 3.35Å; E889-Q893 PolarHBondContact O-N 2.79Å; E889-Q893 WeakPolarHBondContact OE1-CG 3.42Å; E889-Q893 PolarHBondContact OE1-NE2 3.47Å; Y890-Q893 PolarHBondContact O-N 2.75Å; Q893-F895 VanDerWaalsContact C-N 3.34Å; Q893-F895 PolarHBondContact O-N 3.49Å; Q893-K896 PolarHBondContact O-N 3.16Å; Q893-L897 WeakPolarHBondContact O-CG 3.17Å; Q893-L897 PolarHBondContact O-N 3.05Å
894	R	91.5	Very high	87.8	Confident	85 Å²	85	42.9 Å²	42.9	32%	0.321	21%	0.214	S	C	.	.	H	α-helix	trans	-62.5	-41.7	177	-163.7	-177.2	172.3	-175.8	0.4	111.6	I871 E874 Y890 F891 Y892 A898	I871-R894 HydrophobicContact CD1-CG 3.93Å; I871-R894 HydrophobicContact CG1-CG 4.48Å; I871-R894 HydrophobicContact CG2-CB 4.39Å; I871-R894 HydrophobicContact CG2-CG 4.36Å; E874-R894 IonicContact OE2-NH1 2.78Å; Y890-R894 PolarHBondContact O-N 3.09Å; Y890-R894 VanDerWaalsContact O-N 3.1Å; F891-R894 PolarHBondContact O-N 2.9Å; Y892-R894 PolarHBondContact O-N 3.43Å; R894-A898 PolarHBondContact O-N 3.24Å
895	F	91.9	Very high	87.4	Confident	1 Å²	1	44.3 Å²	44.3	0%	0.004	22%	0.222	C	C	.	.	H	α-helix	trans	-66	-44.2	174.6	-174	-98.8	0	0	0	111.6	Q120 L121 Y124 L147 G868 A872 F891 Y892 Q893 L897 A898 C899	Q120-F895 HydrophobicContact CG-CE1 4.04Å; Q120-F895 HydrophobicContact CG-CZ 3.84Å; L121-F895 HydrophobicContact CD2-CD1 3.92Å; L121-F895 HydrophobicContact CD2-CE1 4.13Å; Y124-F895 HydrophobicContact CD1-CB 3.7Å; Y124-F895 AromaticContact CD1-CD1 3.36Å; Y124-F895 HydrophobicContact CD1-CD1 3.36Å; Y124-F895 HydrophobicContact CD1-CD2 4.21Å; Y124-F895 AromaticContact CD1-CE1 3.99Å; Y124-F895 HydrophobicContact CD1-CE1 3.99Å; Y124-F895 AromaticContact CD1-CG 3.49Å; Y124-F895 HydrophobicContact CD1-CG 3.49Å; Y124-F895 VanDerWaalsContact CD1-CG 3.49Å; Y124-F895 HydrophobicContact CE1-CB 3.34Å; Y124-F895 AromaticContact CE1-CD1 3.94Å; Y124-F895 HydrophobicContact CE1-CD1 3.94Å; Y124-F895 HydrophobicContact CE1-CD2 4.13Å; Y124-F895 AromaticContact CE1-CG 3.55Å; Y124-F895 HydrophobicContact CE1-CG 3.55Å; Y124-F895 AromaticContact CG-CD1 3.86Å; Y124-F895 HydrophobicContact CG-CD1 3.86Å; Y124-F895 HydrophobicContact CG-CE1 4.01Å; Y124-F895 HydrophobicContact CG-CG 4.14Å; Y124-F895 HydrophobicContact CG-CZ 4.42Å; L147-F895 HydrophobicContact CD2-CZ 4.38Å; G868-F895 WeakPolarHBondContact O-CD2 3.38Å; G868-F895 WeakPolarHBondContact O-CE2 3.49Å; A872-F895 HydrophobicContact CB-CD2 4.27Å; A872-F895 HydrophobicContact CB-CE2 4.06Å; F891-F895 WeakPolarHBondContact O-CB 3.42Å; F891-F895 PolarHBondContact O-N 3.24Å; Y892-F895 PolarHBondContact O-N 3.08Å; Q893-F895 VanDerWaalsContact C-N 3.34Å; Q893-F895 PolarHBondContact O-N 3.49Å; F895-L897 VanDerWaalsContact C-N 3.34Å; F895-L897 PolarHBondContact O-N 2.97Å; F895-A898 WeakPolarHBondContact O-CB 3.47Å; F895-A898 PolarHBondContact O-N 3.19Å; F895-A898 VanDerWaalsContact O-N 3.13Å; F895-C899 WeakPolarHBondContact CE1-SG 3.46Å; F895-C899 PolarHBondContact O-N 2.82Å; F895-C899 PolarHBondContact O-SG 3.16Å; F895-C899 VanDerWaalsContact O-SG 3.42Å
896	K	92.2	Very high	87.1	Confident	72 Å²	72	44.7 Å²	44.7	31%	0.313	22%	0.224	S	C	.	.	H	α-helix	trans	-58.3	-43.2	176.6	-176.3	-179.8	177.3	-177.6	0	112.4	L121 Y892 Q893 C899 I900	L121-K896 HydrophobicContact CD2-CB 4.06Å; L121-K896 HydrophobicContact CD2-CG 4.24Å; Y892-K896 HydrophobicContact CE1-CD 4.28Å; Y892-K896 VanDerWaalsContact O-CB 3.3Å; Y892-K896 WeakPolarHBondContact O-CB 3.15Å; Y892-K896 PolarHBondContact O-N 3.29Å; Q893-K896 PolarHBondContact O-N 3.16Å; K896-C899 PolarHBondContact O-N 3.39Å; K896-I900 HydrophobicContact CG-CD1 3.97Å; K896-I900 VanDerWaalsContact O-CG1 3.27Å; K896-I900 WeakPolarHBondContact O-CG1 3.28Å; K896-I900 PolarHBondContact O-N 3.38Å
897	L	90.8	Very high	87	Confident	113 Å²	113	47.4 Å²	47.4	59%	0.592	24%	0.236	S	C	*	.	H	α-helix	trans	-61.4	-42.9	175	-72.1	171.9	0	0	0	111.9	Q893 F895 C899 I900 E901	Q893-L897 WeakPolarHBondContact O-CG 3.17Å; Q893-L897 PolarHBondContact O-N 3.05Å; F895-L897 VanDerWaalsContact C-N 3.34Å; F895-L897 PolarHBondContact O-N 2.97Å; L897-C899 VanDerWaalsContact C-N 3.34Å; L897-C899 PolarHBondContact O-N 3.06Å; L897-I900 PolarHBondContact O-N 2.66Å; L897-E901 PolarHBondContact O-N 3.02Å
898	A	87.3	Confident	86.7	Confident	5 Å²	5	52.8 Å²	52.8	4%	0.041	26%	0.261	C	S	.	.	H	α-helix	trans	-63	-39.2	175.5	0	0	0	0	0	112.2	I871 R894 F895 C902	I871-A898 HydrophobicContact CD1-CB 4.28Å; R894-A898 PolarHBondContact O-N 3.24Å; F895-A898 WeakPolarHBondContact O-CB 3.47Å; F895-A898 PolarHBondContact O-N 3.19Å; F895-A898 VanDerWaalsContact O-N 3.13Å; A898-C902 PolarHBondContact O-N 3.23Å
899	C	85.7	Confident	86.2	Confident	8 Å²	8	54.5 Å²	54.5	5%	0.054	27%	0.269	C	S	.	.	H	α-helix	trans	-67.1	-40.3	174.1	-67.2	0	0	0	0	112	Q117 L121 F895 K896 L897 E901 C902 S903	Q117-C899 HydrophobicContact CG-CB 4.33Å; Q117-C899 PolarHBondContact NE2-O 3.04Å; L121-C899 HydrophobicContact CD2-CB 4.09Å; F895-C899 WeakPolarHBondContact CE1-SG 3.46Å; F895-C899 PolarHBondContact O-N 2.82Å; F895-C899 PolarHBondContact O-SG 3.16Å; F895-C899 VanDerWaalsContact O-SG 3.42Å; K896-C899 PolarHBondContact O-N 3.39Å; L897-C899 VanDerWaalsContact C-N 3.34Å; L897-C899 PolarHBondContact O-N 3.06Å; C899-E901 VanDerWaalsContact C-N 3.34Å; C899-E901 PolarHBondContact O-N 3.47Å; C899-C902 WeakPolarHBondContact O-CB 3.48Å; C899-C902 PolarHBondContact O-N 3.42Å; C899-S903 PolarHBondContact O-N 3.2Å
900	I	85	Confident	86	Confident	87 Å²	87	50.1 Å²	50.1	45%	0.446	25%	0.249	S	C	.	.	H	α-helix	trans	-63.4	-41.1	177.8	-70.2	164.7	0	0	0	111	K896 L897 C902 S903 S904	K896-I900 HydrophobicContact CG-CD1 3.97Å; K896-I900 VanDerWaalsContact O-CG1 3.27Å; K896-I900 WeakPolarHBondContact O-CG1 3.28Å; K896-I900 PolarHBondContact O-N 3.38Å; L897-I900 PolarHBondContact O-N 2.66Å; I900-C902 VanDerWaalsContact C-N 3.28Å; I900-C902 PolarHBondContact O-N 3.25Å; I900-S903 VanDerWaalsContact O-CB 3.22Å; I900-S903 WeakPolarHBondContact O-CB 3.47Å; I900-S903 PolarHBondContact O-N 3.4Å; I900-S904 PolarHBondContact O-N 3.46Å
901	E	81.7	Confident	85.9	Confident	94 Å²	94	49.7 Å²	49.7	44%	0.439	25%	0.252	S	S	.	.	H	α-helix	trans	-55.4	-45.7	175	-166.7	175.3	-176.8	0	0	110.5	K867 L897 C899 S903 S904	K867-E901 IonicContact NZ-OE2 3.37Å; K867-E901 PolarHBondContact NZ-OE2 3.13Å; L897-E901 PolarHBondContact O-N 3.02Å; C899-E901 VanDerWaalsContact C-N 3.34Å; C899-E901 PolarHBondContact O-N 3.47Å; E901-S903 PolarHBondContact O-N 3.05Å; E901-S904 PolarHBondContact O-OG 2.91Å
902	C	76	Confident	85.4	Confident	17 Å²	17	55.5 Å²	55.5	12%	0.115	28%	0.277	C	S	.	.	H	α-helix	trans	-63.1	-39.8	173.9	-161.9	0	0	0	0	112.8	I864 A898 C899 I900 S904 T905 H906	I864-C902 HydrophobicContact CG2-CB 3.77Å; A898-C902 PolarHBondContact O-N 3.23Å; C899-C902 WeakPolarHBondContact O-CB 3.48Å; C899-C902 PolarHBondContact O-N 3.42Å; I900-C902 VanDerWaalsContact C-N 3.28Å; I900-C902 PolarHBondContact O-N 3.25Å; C902-S904 PolarHBondContact O-N 3.42Å; C902-S904 VanDerWaalsContact O-N 3.15Å; C902-T905 PolarHBondContact O-N 2.91Å; C902-T905 PolarHBondContact O-OG1 3.38Å; C902-T905 VanDerWaalsContact O-OG1 3.09Å; C902-H906 PolarHBondContact O-CE1 3.26Å; C902-H906 VanDerWaalsContact SG-CE1 3.57Å
903	S	76.4	Confident	84.9	Confident	6 Å²	6	55.5 Å²	55.5	4%	0.042	28%	0.278	C	S	.	.	H	α-helix	trans	-60.6	-28.5	-176.4	-149.3	0	0	0	0	114.8	R114 Q117 C899 I900 E901 T905 H906	R114-S903 PolarHBondContact NE-OG 3.11Å; R114-S903 PolarHBondContact NH1-OG 3.13Å; R114-S903 PolarHBondContact NH2-O 2.81Å; R114-S903 PolarHBondContact NH2-OG 2.93Å; R114-S903 VanDerWaalsContact NH2-OG 3.1Å; Q117-S903 PolarHBondContact OE1-OG 3.23Å; C899-S903 PolarHBondContact O-N 3.2Å; I900-S903 VanDerWaalsContact O-CB 3.22Å; I900-S903 WeakPolarHBondContact O-CB 3.47Å; I900-S903 PolarHBondContact O-N 3.4Å; E901-S903 PolarHBondContact O-N 3.05Å; S903-T905 VanDerWaalsContact C-N 3.27Å; S903-T905 PolarHBondContact O-N 3.46Å; S903-H906 VanDerWaalsContact CA-CD2 3.5Å; S903-H906 WeakPolarHBondContact CA-CD2 3.46Å
904	S	77.7	Confident	84.6	Confident	85 Å²	85	51.8 Å²	51.8	59%	0.594	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.8	-26.1	-177.5	71	0	0	0	0	113.1	I900 E901 C902	I900-S904 PolarHBondContact O-N 3.46Å; E901-S904 PolarHBondContact O-OG 2.91Å; C902-S904 PolarHBondContact O-N 3.42Å; C902-S904 VanDerWaalsContact O-N 3.15Å
905	T	80.7	Confident	84.4	Confident	39 Å²	39	51.4 Å²	51.4	24%	0.239	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.3	-18.8	-177.1	64.8	0	0	0	0	113.5	C902 S903 L907 Q908 E909	C902-T905 PolarHBondContact O-N 2.91Å; C902-T905 PolarHBondContact O-OG1 3.38Å; C902-T905 VanDerWaalsContact O-OG1 3.09Å; S903-T905 VanDerWaalsContact C-N 3.27Å; S903-T905 PolarHBondContact O-N 3.46Å; T905-L907 VanDerWaalsContact C-N 3.35Å; T905-L907 PolarHBondContact O-N 3.48Å; T905-Q908 PolarHBondContact O-N 2.92Å; T905-Q908 VanDerWaalsContact O-N 3.14Å; T905-E909 WeakPolarHBondContact O-CG 3.13Å; T905-E909 PolarHBondContact O-N 2.94Å; T905-E909 PolarHBondContact OG1-OE1 3.42Å
906	H	82	Confident	84	Confident	16 Å²	16	51.8 Å²	51.8	7%	0.074	27%	0.267	C	S	.	.	H	α-helix	trans	-56.8	-40.8	-172.8	-67.1	-25.9	0	0	0	114.2	F110 K113 C902 S903 E909 A910	F110-H906 HydrophobicContact CD2-CB 4.49Å; K113-H906 HydrophobicContact CD-CB 4.18Å; K113-H906 WeakPolarHBondContact CD-ND1 3.15Å; C902-H906 PolarHBondContact O-CE1 3.26Å; C902-H906 VanDerWaalsContact SG-CE1 3.57Å; S903-H906 VanDerWaalsContact CA-CD2 3.5Å; S903-H906 WeakPolarHBondContact CA-CD2 3.46Å; H906-E909 IonicContact ND1-OE2 2.72Å; H906-E909 PolarHBondContact O-N 3.22Å; H906-A910 WeakPolarHBondContact O-CB 2.96Å; H906-A910 PolarHBondContact O-N 3.34Å
907	L	86.3	Confident	83.6	Confident	80 Å²	80	51 Å²	51	42%	0.419	27%	0.265	S	S	.	.	H	α-helix	trans	-67.9	-43.4	179.5	-178.5	63.1	0	0	0	111.6	F110 T905 E909 A910 I911	F110-L907 HydrophobicContact CD2-CB 3.94Å; F110-L907 HydrophobicContact CD2-CD1 3.96Å; F110-L907 HydrophobicContact CE2-CB 3.86Å; F110-L907 HydrophobicContact CE2-CD1 4.26Å; F110-L907 HydrophobicContact CG-CD1 4.28Å; T905-L907 VanDerWaalsContact C-N 3.35Å; T905-L907 PolarHBondContact O-N 3.48Å; L907-E909 VanDerWaalsContact C-N 3.27Å; L907-E909 PolarHBondContact O-N 2.85Å; L907-A910 PolarHBondContact O-N 2.99Å; L907-I911 HydrophobicContact CD1-CD1 4.21Å; L907-I911 HydrophobicContact CD1-CG1 4.42Å; L907-I911 HydrophobicContact CG-CD1 3.97Å; L907-I911 VanDerWaalsContact O-CG1 3.29Å; L907-I911 WeakPolarHBondContact O-CG1 3.25Å; L907-I911 PolarHBondContact O-N 2.63Å
908	Q	83.6	Confident	83.5	Confident	117 Å²	117	45.6 Å²	45.6	55%	0.547	24%	0.236	S	C	.	.	H	α-helix	trans	-64.2	-37.1	178.8	-64	-174.8	-1.2	0	0	111.2	T905 K912	T905-Q908 PolarHBondContact O-N 2.92Å; T905-Q908 VanDerWaalsContact O-N 3.14Å; Q908-K912 WeakPolarHBondContact O-CB 3.47Å; Q908-K912 WeakPolarHBondContact O-CD 3.23Å; Q908-K912 WeakPolarHBondContact O-CG 3.4Å; Q908-K912 PolarHBondContact O-N 2.99Å
909	E	80.5	Confident	83.4	Confident	39 Å²	39	47.9 Å²	47.9	18%	0.182	25%	0.248	C	C	.	.	H	α-helix	trans	-66.3	-47.7	173.8	-72.6	166.8	-175.4	0	0	111.7	K113 T905 H906 L907 I911 K912 I913	K113-E909 IonicContact NZ-OE2 2.77Å; K113-E909 PolarHBondContact NZ-OE2 3.37Å; T905-E909 WeakPolarHBondContact O-CG 3.13Å; T905-E909 PolarHBondContact O-N 2.94Å; T905-E909 PolarHBondContact OG1-OE1 3.42Å; H906-E909 IonicContact ND1-OE2 2.72Å; H906-E909 PolarHBondContact O-N 3.22Å; L907-E909 VanDerWaalsContact C-N 3.27Å; L907-E909 PolarHBondContact O-N 2.85Å; E909-I911 VanDerWaalsContact C-N 3.3Å; E909-I911 PolarHBondContact O-N 2.9Å; E909-K912 PolarHBondContact O-N 3.47Å; E909-K912 VanDerWaalsContact O-N 3.16Å; E909-I913 WeakPolarHBondContact O-CB 3.25Å; E909-I913 VanDerWaalsContact O-CG1 3.24Å; E909-I913 WeakPolarHBondContact O-CG1 3.33Å; E909-I913 PolarHBondContact O-N 2.99Å
910	A	86.2	Confident	83.2	Confident	2 Å²	2	48.8 Å²	48.8	2%	0.017	26%	0.256	C	S	.	.	H	α-helix	trans	-58	-41.9	177.3	0	0	0	0	0	111.9	E109 F110 H906 L907 I913 G914	E109-A910 HydrophobicContact CB-CB 3.93Å; F110-A910 HydrophobicContact CB-CB 4.15Å; H906-A910 WeakPolarHBondContact O-CB 2.96Å; H906-A910 PolarHBondContact O-N 3.34Å; L907-A910 PolarHBondContact O-N 2.99Å; A910-I913 PolarHBondContact O-N 3.03Å; A910-G914 PolarHBondContact O-N 3.33Å
911	I	89.2	Confident	83.1	Confident	73 Å²	73	47 Å²	47	37%	0.374	25%	0.246	S	C	.	.	H	α-helix	trans	-64.3	-46.2	175.3	-68.2	167.8	0	0	0	111.2	M102 V106 L907 E909 I913 G914 L915	M102-I911 HydrophobicContact CE-CG2 3.99Å; V106-I911 HydrophobicContact CG2-CG1 4.26Å; L907-I911 HydrophobicContact CD1-CD1 4.21Å; L907-I911 HydrophobicContact CD1-CG1 4.42Å; L907-I911 HydrophobicContact CG-CD1 3.97Å; L907-I911 VanDerWaalsContact O-CG1 3.29Å; L907-I911 WeakPolarHBondContact O-CG1 3.25Å; L907-I911 PolarHBondContact O-N 2.63Å; E909-I911 VanDerWaalsContact C-N 3.3Å; E909-I911 PolarHBondContact O-N 2.9Å; I911-I913 VanDerWaalsContact C-N 3.27Å; I911-I913 PolarHBondContact O-N 3.46Å; I911-G914 PolarHBondContact O-N 2.94Å; I911-L915 WeakPolarHBondContact O-CB 3.19Å; I911-L915 PolarHBondContact O-N 3.43Å
912	K	83.3	Confident	83.3	Confident	122 Å²	122	42.7 Å²	42.7	53%	0.53	23%	0.227	S	C	.	.	H	α-helix	trans	-60.5	-40.5	176.3	-73.9	167.2	-173.8	170.4	0	110.9	R856 Q908 E909 V916	R856-K912 PolarHBondContact NH2-O 2.92Å; Q908-K912 WeakPolarHBondContact O-CB 3.47Å; Q908-K912 WeakPolarHBondContact O-CD 3.23Å; Q908-K912 WeakPolarHBondContact O-CG 3.4Å; Q908-K912 PolarHBondContact O-N 2.99Å; E909-K912 PolarHBondContact O-N 3.47Å; E909-K912 VanDerWaalsContact O-N 3.16Å; K912-V916 WeakPolarHBondContact O-CG2 3.29Å; K912-V916 PolarHBondContact O-N 2.94Å
913	I	81.1	Confident	83.6	Confident	26 Å²	26	42.2 Å²	42.2	13%	0.133	23%	0.225	C	C	.	.	H	α-helix	trans	-64.2	-53.7	178.4	-69.4	164.4	0	0	0	110.6	E109 E909 A910 I911 L915 V916 Q917	E109-I913 HydrophobicContact CG-CG2 4.31Å; E909-I913 WeakPolarHBondContact O-CB 3.25Å; E909-I913 VanDerWaalsContact O-CG1 3.24Å; E909-I913 WeakPolarHBondContact O-CG1 3.33Å; E909-I913 PolarHBondContact O-N 2.99Å; A910-I913 PolarHBondContact O-N 3.03Å; I911-I913 VanDerWaalsContact C-N 3.27Å; I911-I913 PolarHBondContact O-N 3.46Å; I913-L915 VanDerWaalsContact C-N 3.33Å; I913-L915 PolarHBondContact O-N 3.18Å; I913-V916 PolarHBondContact O-N 3.34Å; I913-Q917 PolarHBondContact O-N 2.88Å
914	G	87.4	Confident	83.8	Confident	0 Å²	0	44 Å²	44	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-56.5	-44.8	178.8	0	0	0	0	0	112.6	C105 A910 I911 V916 Q917 S918	C105-G914 VanDerWaalsContact CB-CA 3.43Å; A910-G914 PolarHBondContact O-N 3.33Å; I911-G914 PolarHBondContact O-N 2.94Å; G914-V916 PolarHBondContact O-N 3.35Å; G914-Q917 PolarHBondContact O-N 2.83Å; G914-S918 VanDerWaalsContact O-CB 3.23Å; G914-S918 WeakPolarHBondContact O-CB 3.18Å; G914-S918 PolarHBondContact O-N 2.86Å; G914-S918 PolarHBondContact O-OG 3.47Å
915	L	88.3	Confident	84.1	Confident	78 Å²	78	40.4 Å²	40.4	41%	0.408	21%	0.211	S	C	.	.	H	α-helix	trans	-61.1	-46.2	-178.2	-175.6	149.9	0	0	0	111.5	M102 I911 I913 S918 I919	M102-L915 HydrophobicContact CE-CB 4.31Å; M102-L915 HydrophobicContact SD-CB 4.26Å; M102-L915 PolarHBondContact SD-N 2.94Å; I911-L915 WeakPolarHBondContact O-CB 3.19Å; I911-L915 PolarHBondContact O-N 3.43Å; I913-L915 VanDerWaalsContact C-N 3.33Å; I913-L915 PolarHBondContact O-N 3.18Å; L915-S918 PolarHBondContact O-N 3.25Å; L915-I919 HydrophobicContact CD2-CD1 3.56Å; L915-I919 HydrophobicContact CG-CD1 4.37Å; L915-I919 VanDerWaalsContact O-CG1 3.31Å; L915-I919 WeakPolarHBondContact O-CG1 3.48Å; L915-I919 PolarHBondContact O-N 3.34Å; L915-I919 VanDerWaalsContact O-N 3.07Å
916	V	83.3	Confident	84.3	Confident	9 Å²	9	41 Å²	41	6%	0.055	21%	0.212	C	C	.	.	H	α-helix	trans	-70.9	-40.4	-177.3	171.2	0	0	0	0	112.2	S849 I852 N853 K912 I913 G914 S918 I919 A920	S849-V916 WeakPolarHBondContact O-CG1 3.35Å; I852-V916 HydrophobicContact CB-CG1 4.25Å; I852-V916 HydrophobicContact CB-CG2 4.23Å; I852-V916 HydrophobicContact CD1-CG2 4.14Å; I852-V916 HydrophobicContact CG2-CG2 3.93Å; N853-V916 WeakPolarHBondContact OD1-CG1 3.21Å; K912-V916 WeakPolarHBondContact O-CG2 3.29Å; K912-V916 PolarHBondContact O-N 2.94Å; I913-V916 PolarHBondContact O-N 3.34Å; G914-V916 PolarHBondContact O-N 3.35Å; V916-S918 VanDerWaalsContact C-N 3.32Å; V916-I919 PolarHBondContact O-N 3.24Å; V916-A920 WeakPolarHBondContact O-CB 3.37Å; V916-A920 PolarHBondContact O-N 3.42Å
917	Q	82.9	Confident	84.5	Confident	54 Å²	54	40.5 Å²	40.5	25%	0.252	21%	0.21	S	C	.	.	H	α-helix	trans	-67.4	-36.7	177	-168.5	169.4	-4	0	0	111.5	C105 I913 G914 A920 L921	C105-Q917 PolarHBondContact SG-OE1 3.49Å; I913-Q917 PolarHBondContact O-N 2.88Å; G914-Q917 PolarHBondContact O-N 2.83Å; Q917-A920 PolarHBondContact O-N 3.11Å; Q917-L921 WeakPolarHBondContact O-CB 3.3Å; Q917-L921 PolarHBondContact O-N 3.33Å
918	S	88.8	Confident	84.3	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-64.3	-44.1	176.9	-56.1	0	0	0	0	111.6	F98 M102 G914 L915 V916 L921 S922	F98-S918 VanDerWaalsContact CD2-CB 3.45Å; F98-S918 PolarHBondContact O-OG 3.07Å; M102-S918 WeakPolarHBondContact CA-OG 3.37Å; M102-S918 WeakPolarHBondContact CB-OG 3.02Å; M102-S918 PolarHBondContact N-OG 3.24Å; G914-S918 VanDerWaalsContact O-CB 3.23Å; G914-S918 WeakPolarHBondContact O-CB 3.18Å; G914-S918 PolarHBondContact O-N 2.86Å; G914-S918 PolarHBondContact O-OG 3.47Å; L915-S918 PolarHBondContact O-N 3.25Å; V916-S918 VanDerWaalsContact C-N 3.32Å; S918-L921 PolarHBondContact O-N 3.3Å; S918-S922 WeakPolarHBondContact O-CB 3.48Å; S918-S922 PolarHBondContact O-N 2.94Å; S918-S922 PolarHBondContact O-OG 3.18Å
919	I	85.3	Confident	84.4	Confident	54 Å²	54	32.5 Å²	32.5	28%	0.277	17%	0.172	S	C	.	.	H	α-helix	trans	-62.7	-45.1	174.4	-67.4	172.6	0	0	0	111.1	F98 V845 L915 V916 L921 G923	F98-I919 HydrophobicContact CE2-CG1 3.91Å; V845-I919 HydrophobicContact CG1-CG2 3.53Å; L915-I919 HydrophobicContact CD2-CD1 3.56Å; L915-I919 HydrophobicContact CG-CD1 4.37Å; L915-I919 VanDerWaalsContact O-CG1 3.31Å; L915-I919 WeakPolarHBondContact O-CG1 3.48Å; L915-I919 PolarHBondContact O-N 3.34Å; L915-I919 VanDerWaalsContact O-N 3.07Å; V916-I919 PolarHBondContact O-N 3.24Å; I919-L921 PolarHBondContact O-N 3.23Å; I919-G923 WeakPolarHBondContact O-CA 3.43Å; I919-G923 PolarHBondContact O-N 2.83Å
920	A	81.1	Confident	84.8	Confident	27 Å²	27	32.1 Å²	32.1	22%	0.223	18%	0.176	C	C	.	.	H	α-helix	trans	-60.9	-35.2	-179.1	0	0	0	0	0	112.1	V916 Q917 P924	V916-A920 WeakPolarHBondContact O-CB 3.37Å; V916-A920 PolarHBondContact O-N 3.42Å; Q917-A920 PolarHBondContact O-N 3.11Å; A920-P924 WeakPolarHBondContact O-CD 3.4Å
921	L	83	Confident	84.9	Confident	48 Å²	48	32.1 Å²	32.1	25%	0.251	18%	0.175	S	C	.	.	H	α-helix	trans	-89.3	-37	-175.2	-165.7	63.7	0	0	0	113.5	L56 F60 I97 C101 Q917 S918 I919	L56-L921 HydrophobicContact CD1-CD2 3.95Å; L56-L921 HydrophobicContact CD2-CD2 3.86Å; L56-L921 HydrophobicContact CG-CD2 4.25Å; F60-L921 HydrophobicContact CE1-CD1 4.47Å; F60-L921 HydrophobicContact CE2-CD1 4.19Å; F60-L921 HydrophobicContact CE2-CD2 4.13Å; F60-L921 HydrophobicContact CE2-CG 4.32Å; F60-L921 HydrophobicContact CZ-CD1 3.53Å; F60-L921 HydrophobicContact CZ-CD2 4Å; F60-L921 HydrophobicContact CZ-CG 3.69Å; I97-L921 HydrophobicContact CG2-CD2 4.26Å; I97-L921 HydrophobicContact CG2-CG 4.11Å; C101-L921 HydrophobicContact CB-CD2 4.32Å; Q917-L921 WeakPolarHBondContact O-CB 3.3Å; Q917-L921 PolarHBondContact O-N 3.33Å; S918-L921 PolarHBondContact O-N 3.3Å; I919-L921 PolarHBondContact O-N 3.23Å
922	S	86.5	Confident	84.8	Confident	5 Å²	5	28.9 Å²	28.9	4%	0.035	16%	0.159	C	C	.	.	H	α-helix	trans	-81.7	-27.2	177.9	72	0	0	0	0	113.2	S918 V925 L926	S918-S922 WeakPolarHBondContact O-CB 3.48Å; S918-S922 PolarHBondContact O-N 2.94Å; S918-S922 PolarHBondContact O-OG 3.18Å; S922-V925 PolarHBondContact O-N 3.43Å; S922-L926 PolarHBondContact O-N 2.92Å
923	G	82.5	Confident	84.9	Confident	7 Å²	7	24.7 Å²	24.7	7%	0.072	15%	0.147	C	C	.	.	H	α-helix	trans	-51	-49.5	-177.7	0	0	0	0	0	114.3	I919 V925 L926 S927	I919-G923 WeakPolarHBondContact O-CA 3.43Å; I919-G923 PolarHBondContact O-N 2.83Å; G923-V925 VanDerWaalsContact C-N 3.32Å; G923-V925 PolarHBondContact O-N 2.84Å; G923-L926 PolarHBondContact O-N 2.71Å; G923-S927 PolarHBondContact O-N 2.81Å
924	P	79.7	Confident	85.3	Confident	43 Å²	43	25.9 Å²	25.9	28%	0.279	15%	0.154	S	C	.	.	H	α-helix	trans	-61.6	-36.8	177.4	-25.7	36.6	0	0	0	113.3	L846 A920 S927 L928	L846-P924 HydrophobicContact CD2-CG 4.23Å; A920-P924 WeakPolarHBondContact O-CD 3.4Å; P924-S927 WeakPolarHBondContact CA-OG 3.42Å; P924-S927 PolarHBondContact O-N 3.34Å; P924-S927 PolarHBondContact O-OG 3.12Å; P924-L928 WeakPolarHBondContact O-CB 3.04Å; P924-L928 PolarHBondContact O-N 2.87Å
925	V	83.7	Confident	85.4	Confident	10 Å²	10	25.9 Å²	25.9	6%	0.061	15%	0.154	C	C	.	.	H	α-helix	trans	-71.3	-37.9	178.6	-171.9	0	0	0	0	111	Y90 A94 I97 S922 G923 L928 T929	Y90-V925 HydrophobicContact CD1-CG1 3.99Å; Y90-V925 HydrophobicContact CE1-CB 4.46Å; Y90-V925 HydrophobicContact CE1-CG1 3.39Å; A94-V925 HydrophobicContact CB-CB 4.01Å; A94-V925 HydrophobicContact CB-CG1 3.72Å; I97-V925 HydrophobicContact CD1-CG2 4.07Å; S922-V925 PolarHBondContact O-N 3.43Å; G923-V925 VanDerWaalsContact C-N 3.32Å; G923-V925 PolarHBondContact O-N 2.84Å; V925-L928 WeakPolarHBondContact O-CB 3.45Å; V925-L928 PolarHBondContact O-N 2.92Å; V925-T929 PolarHBondContact O-N 3.46Å; V925-T929 PolarHBondContact O-OG1 3.03Å
926	L	86.1	Confident	85.2	Confident	52 Å²	52	22.5 Å²	22.5	27%	0.272	14%	0.136	S	C	.	.	H	α-helix	trans	-64.6	-44.7	172.6	-72.1	172.5	0	0	0	111.8	F91 A94 F842 S922 G923 L928 T929 A930	F91-L926 HydrophobicContact CD2-CD2 3.82Å; F91-L926 HydrophobicContact CE2-CD2 3.76Å; A94-L926 HydrophobicContact CB-CD2 3.57Å; A94-L926 HydrophobicContact CB-CG 3.83Å; F842-L926 HydrophobicContact CE1-CB 4.02Å; S922-L926 PolarHBondContact O-N 2.92Å; G923-L926 PolarHBondContact O-N 2.71Å; L926-L928 PolarHBondContact O-N 2.8Å; L926-T929 WeakPolarHBondContact O-CB 3.45Å; L926-T929 PolarHBondContact O-N 3.42Å; L926-A930 PolarHBondContact O-N 3.22Å
927	S	85.4	Confident	85.3	Confident	4 Å²	4	27.5 Å²	27.5	3%	0.028	15%	0.154	C	C	.	.	H	α-helix	trans	-59.3	-37.2	176	74.2	0	0	0	0	111.4	M839 G923 P924 A930 C931 F956	M839-S927 WeakPolarHBondContact CE-O 3.45Å; G923-S927 PolarHBondContact O-N 2.81Å; P924-S927 WeakPolarHBondContact CA-OG 3.42Å; P924-S927 PolarHBondContact O-N 3.34Å; P924-S927 PolarHBondContact O-OG 3.12Å; S927-A930 PolarHBondContact O-N 2.97Å; S927-C931 PolarHBondContact O-N 3.39Å; S927-F956 WeakPolarHBondContact OG-CE1 3.5Å
928	L	82.8	Confident	85.6	Confident	17 Å²	17	25.5 Å²	25.5	9%	0.089	15%	0.146	C	C	.	.	H	α-helix	trans	-66.9	-43.4	177.9	-177.9	56	0	0	0	112.1	Y90 P924 V925 L926 A930 C931 F932 F953	Y90-L928 HydrophobicContact CD1-CG 4.5Å; Y90-L928 HydrophobicContact CE1-CB 3.94Å; Y90-L928 HydrophobicContact CE1-CD2 3.52Å; Y90-L928 HydrophobicContact CE1-CG 3.67Å; Y90-L928 WeakPolarHBondContact OH-CD2 3.3Å; P924-L928 WeakPolarHBondContact O-CB 3.04Å; P924-L928 PolarHBondContact O-N 2.87Å; V925-L928 WeakPolarHBondContact O-CB 3.45Å; V925-L928 PolarHBondContact O-N 2.92Å; L926-L928 PolarHBondContact O-N 2.8Å; L928-A930 VanDerWaalsContact C-N 3.33Å; L928-A930 PolarHBondContact O-N 3.2Å; L928-C931 VanDerWaalsContact O-CB 3.23Å; L928-C931 WeakPolarHBondContact O-CB 3.38Å; L928-C931 PolarHBondContact O-N 2.97Å; L928-F932 HydrophobicContact CD1-CD2 3.56Å; L928-F932 HydrophobicContact CD1-CE2 3.36Å; L928-F932 HydrophobicContact CG-CD2 4.17Å; L928-F932 HydrophobicContact CG-CE2 4.28Å; L928-F932 WeakPolarHBondContact O-CD2 3.5Å; L928-F932 PolarHBondContact O-N 2.95Å; L928-F932 VanDerWaalsContact O-N 3.13Å; L928-F953 HydrophobicContact CD1-CD2 3.11Å; L928-F953 HydrophobicContact CD1-CE2 3.08Å; L928-F953 HydrophobicContact CD1-CG 4.06Å; L928-F953 HydrophobicContact CD1-CZ 3.99Å; L928-F953 HydrophobicContact CD2-CE2 3.94Å; L928-F953 HydrophobicContact CD2-CZ 4.45Å; L928-F953 HydrophobicContact CG-CD2 4.49Å; L928-F953 HydrophobicContact CG-CE2 4.16Å
929	T	86	Confident	85.5	Confident	13 Å²	13	27.4 Å²	27.4	8%	0.08	16%	0.155	C	C	.	.	H	α-helix	trans	-57.6	-47.6	173.8	-46.8	0	0	0	0	110.9	L87 Y90 F91 V925 L926 C931 F932 A933	L87-T929 HydrophobicContact CD2-CG2 4.44Å; Y90-T929 WeakPolarHBondContact CD1-OG1 3.43Å; F91-T929 HydrophobicContact CB-CG2 4.01Å; V925-T929 PolarHBondContact O-N 3.46Å; V925-T929 PolarHBondContact O-OG1 3.03Å; L926-T929 WeakPolarHBondContact O-CB 3.45Å; L926-T929 PolarHBondContact O-N 3.42Å; T929-C931 VanDerWaalsContact C-N 3.32Å; T929-C931 PolarHBondContact O-N 3.1Å; T929-F932 PolarHBondContact O-N 3.46Å; T929-A933 WeakPolarHBondContact O-CB 3.48Å; T929-A933 PolarHBondContact O-N 3.49Å
930	A	88	Confident	85.4	Confident	31 Å²	31	29 Å²	29	26%	0.256	16%	0.162	S	C	.	.	H	α-helix	trans	-62.9	-39.2	179.1	0	0	0	0	0	111.9	V838 F842 L926 S927 L928 L934	V838-A930 HydrophobicContact CG1-CB 3.87Å; F842-A930 HydrophobicContact CE2-CB 4.45Å; L926-A930 PolarHBondContact O-N 3.22Å; S927-A930 PolarHBondContact O-N 2.97Å; L928-A930 VanDerWaalsContact C-N 3.33Å; L928-A930 PolarHBondContact O-N 3.2Å; A930-L934 PolarHBondContact O-N 3.06Å; A930-L934 VanDerWaalsContact O-N 3.11Å
931	C	88.4	Confident	85.7	Confident	1 Å²	1	32.8 Å²	32.8	1%	0.007	18%	0.175	C	C	.	.	H	α-helix	trans	-55	-54.3	174.7	-153.3	0	0	0	0	112.1	M839 S927 L928 T929 G935	M839-C931 HydrophobicContact CE-CB 3.13Å; M839-C931 WeakPolarHBondContact CE-SG 3.22Å; S927-C931 PolarHBondContact O-N 3.39Å; L928-C931 VanDerWaalsContact O-CB 3.23Å; L928-C931 WeakPolarHBondContact O-CB 3.38Å; L928-C931 PolarHBondContact O-N 2.97Å; T929-C931 VanDerWaalsContact C-N 3.32Å; T929-C931 PolarHBondContact O-N 3.1Å; C931-G935 WeakPolarHBondContact O-CA 3.46Å; C931-G935 PolarHBondContact O-N 3.31Å
932	F	86.4	Confident	85.7	Confident	5 Å²	5	37.8 Å²	37.8	2%	0.022	20%	0.202	C	C	.	.	H	α-helix	trans	-76.3	-30	-172.3	-82.7	-77.2	0	0	0	111.8	F67 M70 L74 L87 L928 T929 N936 L949 F950 F953	F67-F932 AromaticContact CE2-CE2 3.67Å; F67-F932 HydrophobicContact CE2-CE2 3.67Å; F67-F932 AromaticContact CE2-CZ 3.67Å; F67-F932 HydrophobicContact CE2-CZ 3.67Å; F67-F932 HydrophobicContact CZ-CZ 4.24Å; M70-F932 HydrophobicContact CE-CB 4.31Å; M70-F932 HydrophobicContact CE-CD1 3.35Å; M70-F932 HydrophobicContact CE-CD2 3.51Å; M70-F932 HydrophobicContact CE-CE1 3.37Å; M70-F932 HydrophobicContact CE-CE2 3.52Å; M70-F932 HydrophobicContact CE-CG 3.44Å; M70-F932 VanDerWaalsContact CE-CG 3.44Å; M70-F932 HydrophobicContact CE-CZ 3.47Å; M70-F932 VanDerWaalsContact CE-CZ 3.47Å; M70-F932 HydrophobicContact SD-CB 3.8Å; M70-F932 HydrophobicContact SD-CD1 3.67Å; M70-F932 HydrophobicContact SD-CD2 4.11Å; M70-F932 HydrophobicContact SD-CE1 4.29Å; M70-F932 HydrophobicContact SD-CG 3.58Å; M70-F932 VanDerWaalsContact SD-CG 3.58Å; L74-F932 HydrophobicContact CD1-CD1 4.35Å; L74-F932 HydrophobicContact CD1-CE1 4.21Å; L87-F932 HydrophobicContact CD2-CB 3.66Å; L928-F932 HydrophobicContact CD1-CD2 3.56Å; L928-F932 HydrophobicContact CD1-CE2 3.36Å; L928-F932 HydrophobicContact CG-CD2 4.17Å; L928-F932 HydrophobicContact CG-CE2 4.28Å; L928-F932 WeakPolarHBondContact O-CD2 3.5Å; L928-F932 PolarHBondContact O-N 2.95Å; L928-F932 VanDerWaalsContact O-N 3.13Å; T929-F932 PolarHBondContact O-N 3.46Å; F932-N936 WeakPolarHBondContact O-CB 3.4Å; F932-N936 PolarHBondContact O-N 3.3Å; F932-L949 HydrophobicContact CD1-CD2 3.73Å; F932-L949 HydrophobicContact CD1-CG 4.27Å; F932-L949 HydrophobicContact CE1-CD2 3.8Å; F932-L949 HydrophobicContact CE1-CG 4.06Å; F932-F950 HydrophobicContact CE1-CD1 4.37Å; F932-F950 AromaticContact CE1-CE1 3.83Å; F932-F950 HydrophobicContact CE1-CE1 3.83Å; F932-F950 HydrophobicContact CE1-CZ 4.39Å; F932-F950 HydrophobicContact CZ-CD1 4.12Å; F932-F950 AromaticContact CZ-CE1 3.81Å; F932-F950 HydrophobicContact CZ-CE1 3.81Å; F932-F953 HydrophobicContact CE2-CD1 4.29Å; F932-F953 HydrophobicContact CE2-CD2 4.25Å; F932-F953 HydrophobicContact CE2-CG 4.06Å; F932-F953 HydrophobicContact CZ-CD1 4.15Å; F932-F953 HydrophobicContact CZ-CG 4.23Å
933	A	87.3	Confident	85.7	Confident	35 Å²	35	40 Å²	40	29%	0.289	22%	0.22	S	C	.	.	H	α-helix	trans	-62.5	-54	172.5	0	0	0	0	0	111.7	L87 T929 Y937	L87-A933 HydrophobicContact CD1-CB 3.99Å; L87-A933 HydrophobicContact CD2-CB 4.43Å; T929-A933 WeakPolarHBondContact O-CB 3.48Å; T929-A933 PolarHBondContact O-N 3.49Å; A933-Y937 PolarHBondContact O-N 2.91Å
934	L	88.8	Confident	85.9	Confident	51 Å²	51	40.6 Å²	40.6	27%	0.267	22%	0.221	S	C	.	.	H	α-helix	trans	-67.8	-39.1	176.7	-177.1	65.2	0	0	0	111.3	L835 V838 A930 N936 Y937 L938	L835-L934 HydrophobicContact CD2-CB 4.17Å; L835-L934 HydrophobicContact CD2-CD2 4.13Å; L835-L934 HydrophobicContact CD2-CG 4.13Å; V838-L934 HydrophobicContact CB-CD2 4.33Å; V838-L934 HydrophobicContact CG2-CD2 3.34Å; A930-L934 PolarHBondContact O-N 3.06Å; A930-L934 VanDerWaalsContact O-N 3.11Å; L934-N936 PolarHBondContact O-N 2.91Å; L934-Y937 HydrophobicContact CD1-CD1 4.4Å; L934-Y937 WeakPolarHBondContact O-CB 3.44Å; L934-Y937 PolarHBondContact O-N 3.35Å; L934-L938 HydrophobicContact CD1-CD1 4.34Å; L934-L938 HydrophobicContact CD1-CG 4.2Å; L934-L938 HydrophobicContact CD2-CD1 4.18Å; L934-L938 HydrophobicContact CG-CD1 3.84Å; L934-L938 HydrophobicContact CG-CG 4.15Å; L934-L938 WeakPolarHBondContact O-CB 3.25Å; L934-L938 WeakPolarHBondContact O-CG 3.5Å; L934-L938 PolarHBondContact O-N 3.24Å
935	G	88.5	Confident	86.1	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-59.3	-47	178.6	0	0	0	0	0	112.9	C931 Y937 L938 I939	C931-G935 WeakPolarHBondContact O-CA 3.46Å; C931-G935 PolarHBondContact O-N 3.31Å; G935-Y937 VanDerWaalsContact C-N 3.34Å; G935-Y937 PolarHBondContact O-N 3.2Å; G935-L938 PolarHBondContact O-N 3.24Å; G935-I939 WeakPolarHBondContact O-CB 3.49Å; G935-I939 WeakPolarHBondContact O-CD1 3.43Å; G935-I939 WeakPolarHBondContact O-CG1 3.3Å; G935-I939 PolarHBondContact O-N 3.45Å
936	N	84	Confident	86	Confident	7 Å²	7	42.8 Å²	42.8	4%	0.037	24%	0.235	C	C	.	.	H	α-helix	trans	-61.9	-42.5	176	-175.9	58.8	0	0	0	111.6	I83 F932 L934 I939 Q940	I83-N936 VanDerWaalsContact CD1-OD1 3.31Å; I83-N936 WeakPolarHBondContact CD1-OD1 3.44Å; I83-N936 HydrophobicContact CG2-CB 4.24Å; F932-N936 WeakPolarHBondContact O-CB 3.4Å; F932-N936 PolarHBondContact O-N 3.3Å; L934-N936 PolarHBondContact O-N 2.91Å; N936-I939 PolarHBondContact O-N 2.95Å; N936-Q940 PolarHBondContact ND2-NE2 2.9Å; N936-Q940 WeakPolarHBondContact O-CG 3.45Å; N936-Q940 PolarHBondContact O-N 3.42Å
937	Y	87	Confident	86	Confident	113 Å²	113	41.9 Å²	41.9	44%	0.443	23%	0.23	S	C	.	.	H	α-helix	trans	-61.3	-46.1	175.7	179.6	-100.7	0	0	0	112.3	A933 L934 G935 I939 Q940 Q941	A933-Y937 PolarHBondContact O-N 2.91Å; L934-Y937 HydrophobicContact CD1-CD1 4.4Å; L934-Y937 WeakPolarHBondContact O-CB 3.44Å; L934-Y937 PolarHBondContact O-N 3.35Å; G935-Y937 VanDerWaalsContact C-N 3.34Å; G935-Y937 PolarHBondContact O-N 3.2Å; Y937-I939 VanDerWaalsContact C-N 3.34Å; Y937-I939 PolarHBondContact O-N 2.86Å; Y937-Q940 PolarHBondContact O-N 2.89Å; Y937-Q941 HydrophobicContact CE1-CG 4.47Å; Y937-Q941 VanDerWaalsContact CE1-NE2 3.35Å; Y937-Q941 WeakPolarHBondContact O-CG 3.38Å; Y937-Q941 PolarHBondContact O-N 3.42Å; Y937-Q941 VanDerWaalsContact O-N 3.09Å; Y937-Q941 PolarHBondContact OH-NE2 2.84Å
938	L	89.2	Confident	86.2	Confident	13 Å²	13	42.6 Å²	42.6	7%	0.068	23%	0.234	C	C	.	.	H	α-helix	trans	-67.2	-33.1	178	-69	173.8	0	0	0	112.7	Q834 L835 L934 G935 Q941 N942 A943 I944	Q834-L938 HydrophobicContact CB-CD1 3.83Å; Q834-L938 HydrophobicContact CG-CD1 4.49Å; L835-L938 HydrophobicContact CD2-CD1 4.09Å; L835-L938 HydrophobicContact CG-CD1 4.2Å; L934-L938 HydrophobicContact CD1-CD1 4.34Å; L934-L938 HydrophobicContact CD1-CG 4.2Å; L934-L938 HydrophobicContact CD2-CD1 4.18Å; L934-L938 HydrophobicContact CG-CD1 3.84Å; L934-L938 HydrophobicContact CG-CG 4.15Å; L934-L938 WeakPolarHBondContact O-CB 3.25Å; L934-L938 WeakPolarHBondContact O-CG 3.5Å; L934-L938 PolarHBondContact O-N 3.24Å; G935-L938 PolarHBondContact O-N 3.24Å; L938-Q941 PolarHBondContact O-N 3.4Å; L938-N942 PolarHBondContact O-N 3.34Å; L938-A943 HydrophobicContact CB-CB 4.41Å; L938-A943 HydrophobicContact CD2-CB 4.14Å; L938-A943 PolarHBondContact O-N 3.08Å; L938-I944 HydrophobicContact CB-CD1 3.65Å; L938-I944 HydrophobicContact CB-CG1 3.65Å; L938-I944 HydrophobicContact CB-CG2 4.29Å; L938-I944 HydrophobicContact CD1-CD1 4.08Å; L938-I944 HydrophobicContact CD1-CG2 4.33Å
939	I	85.9	Confident	86.5	Confident	39 Å²	39	41.8 Å²	41.8	20%	0.2	23%	0.23	C	C	.	.	H	α-helix	trans	-67	-42.7	173	-70.2	165.8	0	0	0	110.3	G935 N936 Y937 Q941 N942 I944 M946 L949	G935-I939 WeakPolarHBondContact O-CB 3.49Å; G935-I939 WeakPolarHBondContact O-CD1 3.43Å; G935-I939 WeakPolarHBondContact O-CG1 3.3Å; G935-I939 PolarHBondContact O-N 3.45Å; N936-I939 PolarHBondContact O-N 2.95Å; Y937-I939 VanDerWaalsContact C-N 3.34Å; Y937-I939 PolarHBondContact O-N 2.86Å; I939-Q941 PolarHBondContact O-N 3.37Å; I939-N942 PolarHBondContact O-N 2.89Å; I939-I944 HydrophobicContact CG1-CD1 4.18Å; I939-I944 HydrophobicContact CG1-CG1 3.75Å; I939-M946 HydrophobicContact CD1-CB 4.3Å; I939-L949 HydrophobicContact CD1-CB 4.32Å; I939-L949 HydrophobicContact CD1-CD2 3.67Å
940	Q	83.7	Confident	86.6	Confident	89 Å²	89	41.2 Å²	41.2	42%	0.416	23%	0.226	S	C	.	.	H	α-helix	trans	-62.4	-32.2	176.6	-73.6	176.9	-3.3	0	0	112.4	N936 Y937 N942	N936-Q940 PolarHBondContact ND2-NE2 2.9Å; N936-Q940 WeakPolarHBondContact O-CG 3.45Å; N936-Q940 PolarHBondContact O-N 3.42Å; Y937-Q940 PolarHBondContact O-N 2.89Å; Q940-N942 VanDerWaalsContact C-N 3.25Å; Q940-N942 PolarHBondContact O-N 3.26Å
941	Q	86.5	Confident	86.6	Confident	106 Å²	106	40.5 Å²	40.5	50%	0.495	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.7	1.7	173.2	-67.1	-168.4	-18.7	0	0	114.2	Y937 L938 I939 A943	Y937-Q941 HydrophobicContact CE1-CG 4.47Å; Y937-Q941 VanDerWaalsContact CE1-NE2 3.35Å; Y937-Q941 WeakPolarHBondContact O-CG 3.38Å; Y937-Q941 PolarHBondContact O-N 3.42Å; Y937-Q941 VanDerWaalsContact O-N 3.09Å; Y937-Q941 PolarHBondContact OH-NE2 2.84Å; L938-Q941 PolarHBondContact O-N 3.4Å; I939-Q941 PolarHBondContact O-N 3.37Å; Q941-A943 HydrophobicContact CB-CB 4.48Å; Q941-A943 PolarHBondContact O-N 3.37Å; Q941-A943 VanDerWaalsContact O-N 3.17Å
942	N	82.6	Confident	86.7	Confident	153 Å²	153	40.6 Å²	40.6	82%	0.818	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.9	24.1	-171.7	-63.8	-50.8	0	0	0	114.2	L938 I939 Q940	L938-N942 PolarHBondContact O-N 3.34Å; I939-N942 PolarHBondContact O-N 2.89Å; Q940-N942 VanDerWaalsContact C-N 3.25Å; Q940-N942 PolarHBondContact O-N 3.26Å
943	A	86.8	Confident	86.7	Confident	52 Å²	52	41.3 Å²	41.3	43%	0.43	22%	0.221	S	C	.	.	S	Bend	trans	-80.9	-28.4	-180	0	0	0	0	0	112.7	L938 Q941	L938-A943 HydrophobicContact CB-CB 4.41Å; L938-A943 HydrophobicContact CD2-CB 4.14Å; L938-A943 PolarHBondContact O-N 3.08Å; Q941-A943 HydrophobicContact CB-CB 4.48Å; Q941-A943 PolarHBondContact O-N 3.37Å; Q941-A943 VanDerWaalsContact O-N 3.17Å
944	I	86.6	Confident	86.7	Confident	18 Å²	18	39.9 Å²	39.9	9%	0.092	21%	0.209	C	C	.	.	S	Bend	trans	-135.8	153.2	177.9	69.1	175.8	0	0	0	111.1	L835 L938 I939 L949	L835-I944 HydrophobicContact CD1-CD1 3.66Å; L835-I944 HydrophobicContact CG-CD1 4.22Å; L938-I944 HydrophobicContact CB-CD1 3.65Å; L938-I944 HydrophobicContact CB-CG1 3.65Å; L938-I944 HydrophobicContact CB-CG2 4.29Å; L938-I944 HydrophobicContact CD1-CD1 4.08Å; L938-I944 HydrophobicContact CD1-CG2 4.33Å; I939-I944 HydrophobicContact CG1-CD1 4.18Å; I939-I944 HydrophobicContact CG1-CG1 3.75Å; I944-L949 HydrophobicContact CD1-CB 4.41Å
945	S	85.1	Confident	86.6	Confident	59 Å²	59	37.6 Å²	37.6	41%	0.413	20%	0.197	S	C	.	.			trans	-80	154.2	169.8	79.9	0	0	0	0	111.4	I947 S948 L949	S945-I947 PolarHBondContact O-N 2.86Å; S945-S948 WeakPolarHBondContact O-CB 3.34Å; S945-S948 PolarHBondContact O-N 2.86Å; S945-S948 VanDerWaalsContact O-N 3.14Å; S945-S948 PolarHBondContact OG-N 3.43Å; S945-S948 PolarHBondContact OG-OG 3.18Å; S945-L949 PolarHBondContact O-N 2.92Å
946	M	82.1	Confident	86.5	Confident	41 Å²	41	38.3 Å²	38.3	20%	0.202	20%	0.2	C	C	.	.	H	α-helix	trans	-58.8	-33.9	173.4	-178.1	178.2	177.3	0	0	112.2	L74 F75 I939 L949 F950	L74-M946 HydrophobicContact CB-CE 3.31Å; L74-M946 HydrophobicContact CB-SD 4.15Å; L74-M946 HydrophobicContact CD1-CE 4.33Å; L74-M946 HydrophobicContact CG-CE 4.41Å; F75-M946 HydrophobicContact CD1-CE 3.86Å; F75-M946 HydrophobicContact CD1-SD 4.25Å; F75-M946 HydrophobicContact CD2-CE 3.46Å; F75-M946 VanDerWaalsContact CD2-CE 3.46Å; F75-M946 HydrophobicContact CE1-CE 3.82Å; F75-M946 HydrophobicContact CE1-SD 4.18Å; F75-M946 HydrophobicContact CE2-CE 3.42Å; F75-M946 VanDerWaalsContact CE2-CE 3.42Å; F75-M946 HydrophobicContact CG-CE 3.67Å; F75-M946 HydrophobicContact CZ-CE 3.6Å; F75-M946 HydrophobicContact CZ-SD 4.42Å; I939-M946 HydrophobicContact CD1-CB 4.3Å; M946-L949 WeakPolarHBondContact O-CB 3.41Å; M946-L949 PolarHBondContact O-N 3.46Å; M946-F950 HydrophobicContact CE-CE2 3.48Å; M946-F950 VanDerWaalsContact CE-CE2 3.48Å; M946-F950 HydrophobicContact CE-CZ 3.94Å; M946-F950 HydrophobicContact CG-CD2 4.14Å; M946-F950 HydrophobicContact CG-CE2 3.65Å; M946-F950 WeakPolarHBondContact O-CD2 3.25Å; M946-F950 PolarHBondContact O-N 2.86Å; M946-F950 HydrophobicContact SD-CE2 4.36Å
947	I	86	Confident	86.4	Confident	33 Å²	33	39.9 Å²	39.9	17%	0.169	21%	0.212	C	C	.	.	H	α-helix	trans	-68.2	-40.5	177.8	-60.5	159.9	0	0	0	110.5	Q715 S945 L949 F950 K951	Q715-I947 HydrophobicContact CB-CD1 3.76Å; Q715-I947 HydrophobicContact CB-CG1 4.19Å; Q715-I947 HydrophobicContact CG-CD1 3.58Å; S945-I947 PolarHBondContact O-N 2.86Å; I947-L949 VanDerWaalsContact C-N 3.26Å; I947-L949 PolarHBondContact O-N 3.38Å; I947-F950 PolarHBondContact O-N 2.81Å; I947-K951 HydrophobicContact CG2-CD 4Å; I947-K951 HydrophobicContact CG2-CG 4.32Å; I947-K951 WeakPolarHBondContact O-CB 3.45Å; I947-K951 WeakPolarHBondContact O-CG 3.14Å; I947-K951 PolarHBondContact O-N 2.92Å
948	S	88.1	Confident	86.1	Confident	18 Å²	18	36.5 Å²	36.5	13%	0.126	20%	0.2	C	C	.	.	H	α-helix	trans	-58	-40.1	175.4	-59.2	0	0	0	0	111.3	S945 K951 V952	S945-S948 WeakPolarHBondContact O-CB 3.34Å; S945-S948 PolarHBondContact O-N 2.86Å; S945-S948 VanDerWaalsContact O-N 3.14Å; S945-S948 PolarHBondContact OG-N 3.43Å; S945-S948 PolarHBondContact OG-OG 3.18Å; S948-K951 PolarHBondContact O-N 2.85Å; S948-V952 WeakPolarHBondContact O-CG2 3.24Å; S948-V952 PolarHBondContact O-N 3.29Å; S948-V952 VanDerWaalsContact O-N 3.07Å
949	L	89	Confident	85.9	Confident	0 Å²	0	36 Å²	36	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-60.4	-49.4	175.6	175.8	59.8	0	0	0	112	L835 F932 I939 I944 S945 M946 I947 K951 V952 F953	L835-L949 HydrophobicContact CD1-CB 4.36Å; L835-L949 HydrophobicContact CD1-CD1 3.61Å; L835-L949 HydrophobicContact CD2-CD1 4.29Å; F932-L949 HydrophobicContact CD1-CD2 3.73Å; F932-L949 HydrophobicContact CD1-CG 4.27Å; F932-L949 HydrophobicContact CE1-CD2 3.8Å; F932-L949 HydrophobicContact CE1-CG 4.06Å; I939-L949 HydrophobicContact CD1-CB 4.32Å; I939-L949 HydrophobicContact CD1-CD2 3.67Å; I944-L949 HydrophobicContact CD1-CB 4.41Å; S945-L949 PolarHBondContact O-N 2.92Å; M946-L949 WeakPolarHBondContact O-CB 3.41Å; M946-L949 PolarHBondContact O-N 3.46Å; I947-L949 VanDerWaalsContact C-N 3.26Å; I947-L949 PolarHBondContact O-N 3.38Å; L949-K951 PolarHBondContact O-N 3.22Å; L949-V952 PolarHBondContact O-N 3.49Å; L949-F953 WeakPolarHBondContact O-CB 3.07Å; L949-F953 PolarHBondContact O-N 3.01Å
950	F	87.8	Confident	85.6	Confident	1 Å²	1	35 Å²	35	0%	0.004	20%	0.195	C	C	.	.	H	α-helix	trans	-67.4	-35.8	178.8	-69.7	-64.4	0	0	0	113	I71 L74 Y714 F932 M946 I947 F953 I954	I71-F950 HydrophobicContact CG1-CE1 4.35Å; I71-F950 HydrophobicContact CG1-CZ 4.35Å; L74-F950 HydrophobicContact CD1-CZ 4.07Å; Y714-F950 AromaticContact CD1-CD1 3.91Å; Y714-F950 HydrophobicContact CD1-CD1 3.91Å; Y714-F950 AromaticContact CD1-CD2 3.61Å; Y714-F950 HydrophobicContact CD1-CD2 3.61Å; Y714-F950 AromaticContact CD1-CE1 3.89Å; Y714-F950 HydrophobicContact CD1-CE1 3.89Å; Y714-F950 AromaticContact CD1-CE2 3.57Å; Y714-F950 HydrophobicContact CD1-CE2 3.57Å; Y714-F950 AromaticContact CD1-CG 3.79Å; Y714-F950 HydrophobicContact CD1-CG 3.79Å; Y714-F950 AromaticContact CD1-CZ 3.73Å; Y714-F950 HydrophobicContact CD1-CZ 3.73Å; Y714-F950 HydrophobicContact CD2-CB 4.31Å; Y714-F950 HydrophobicContact CD2-CG 4.31Å; Y714-F950 AromaticContact CE1-CD1 3.57Å; Y714-F950 HydrophobicContact CE1-CD1 3.57Å; Y714-F950 HydrophobicContact CE1-CD2 4.16Å; Y714-F950 AromaticContact CE1-CE1 3.46Å; Y714-F950 HydrophobicContact CE1-CE1 3.46Å; Y714-F950 VanDerWaalsContact CE1-CE1 3.46Å; Y714-F950 HydrophobicContact CE1-CE2 4.05Å; Y714-F950 AromaticContact CE1-CG 3.94Å; Y714-F950 HydrophobicContact CE1-CG 3.94Å; Y714-F950 AromaticContact CE1-CZ 3.72Å; Y714-F950 HydrophobicContact CE1-CZ 3.72Å; Y714-F950 HydrophobicContact CE2-CD1 4.44Å; Y714-F950 HydrophobicContact CE2-CG 4.49Å; Y714-F950 HydrophobicContact CG-CB 4.34Å; Y714-F950 HydrophobicContact CG-CD1 4.44Å; Y714-F950 AromaticContact CG-CD2 3.87Å; Y714-F950 HydrophobicContact CG-CD2 3.87Å; Y714-F950 HydrophobicContact CG-CE2 4.27Å; Y714-F950 AromaticContact CG-CG 3.97Å; Y714-F950 HydrophobicContact CG-CG 3.97Å; Y714-F950 AromaticContact CZ-CD1 3.89Å; F932-F950 HydrophobicContact CE1-CD1 4.37Å; F932-F950 AromaticContact CE1-CE1 3.83Å; F932-F950 HydrophobicContact CE1-CE1 3.83Å; F932-F950 HydrophobicContact CE1-CZ 4.39Å; F932-F950 HydrophobicContact CZ-CD1 4.12Å; F932-F950 AromaticContact CZ-CE1 3.81Å; F932-F950 HydrophobicContact CZ-CE1 3.81Å; M946-F950 HydrophobicContact CE-CE2 3.48Å; M946-F950 VanDerWaalsContact CE-CE2 3.48Å; M946-F950 HydrophobicContact CE-CZ 3.94Å; M946-F950 HydrophobicContact CG-CD2 4.14Å; M946-F950 HydrophobicContact CG-CE2 3.65Å; M946-F950 WeakPolarHBondContact O-CD2 3.25Å; M946-F950 PolarHBondContact O-N 2.86Å; M946-F950 HydrophobicContact SD-CE2 4.36Å; I947-F950 PolarHBondContact O-N 2.81Å; F950-F953 HydrophobicContact CD1-CD1 4.28Å; F950-F953 PolarHBondContact O-N 2.76Å; F950-I954 HydrophobicContact CB-CD1 4.48Å; F950-I954 WeakPolarHBondContact O-CD1 3.49Å; F950-I954 VanDerWaalsContact O-CG1 3.26Å; F950-I954 WeakPolarHBondContact O-CG1 3.45Å; F950-I954 PolarHBondContact O-N 3.02Å
951	K	89.5	Confident	85.2	Confident	17 Å²	17	36 Å²	36	7%	0.074	20%	0.199	C	C	.	.	H	α-helix	trans	-57	-53.7	174	-80.3	179.5	178	-177.3	0	111	L708 S711 E712 Y831 I947 S948 L949 F953 T955	L708-K951 HydrophobicContact CD2-CD 4.3Å; L708-K951 HydrophobicContact CD2-CG 4.31Å; S711-K951 VanDerWaalsContact CB-CG 3.46Å; S711-K951 WeakPolarHBondContact OG-CE 3.32Å; S711-K951 WeakPolarHBondContact OG-CG 3.39Å; E712-K951 WeakPolarHBondContact OE1-CE 3.48Å; E712-K951 IonicContact OE1-NZ 2.97Å; E712-K951 PolarHBondContact OE1-NZ 3.47Å; Y831-K951 HydrophobicContact CD1-CD 3.64Å; Y831-K951 HydrophobicContact CD2-CB 4.16Å; Y831-K951 HydrophobicContact CD2-CD 4.04Å; Y831-K951 HydrophobicContact CE1-CD 3.37Å; Y831-K951 HydrophobicContact CE2-CD 3.83Å; Y831-K951 HydrophobicContact CG-CB 4.19Å; Y831-K951 HydrophobicContact CG-CD 3.97Å; Y831-K951 VanDerWaalsContact CZ-CD 3.47Å; Y831-K951 PolarHBondContact OH-NZ 3.46Å; I947-K951 HydrophobicContact CG2-CD 4Å; I947-K951 HydrophobicContact CG2-CG 4.32Å; I947-K951 WeakPolarHBondContact O-CB 3.45Å; I947-K951 WeakPolarHBondContact O-CG 3.14Å; I947-K951 PolarHBondContact O-N 2.92Å; S948-K951 PolarHBondContact O-N 2.85Å; L949-K951 PolarHBondContact O-N 3.22Å; K951-F953 PolarHBondContact O-N 2.73Å; K951-T955 VanDerWaalsContact O-CB 3.24Å; K951-T955 WeakPolarHBondContact O-CB 3.34Å; K951-T955 PolarHBondContact O-N 3.34Å; K951-T955 PolarHBondContact O-OG1 3.12Å
952	V	89.9	Confident	85	Confident	3 Å²	3	31 Å²	31	2%	0.018	18%	0.176	C	C	.	.	H	α-helix	trans	-61.8	-44.2	178.9	177.3	0	0	0	0	111.1	L835 S948 L949 F956	L835-V952 HydrophobicContact CB-CB 4.46Å; L835-V952 HydrophobicContact CB-CG1 3.9Å; L835-V952 HydrophobicContact CB-CG2 4.5Å; L835-V952 HydrophobicContact CD1-CB 4.36Å; L835-V952 HydrophobicContact CD1-CG2 4.4Å; S948-V952 WeakPolarHBondContact O-CG2 3.24Å; S948-V952 PolarHBondContact O-N 3.29Å; S948-V952 VanDerWaalsContact O-N 3.07Å; L949-V952 PolarHBondContact O-N 3.49Å; V952-F956 VanDerWaalsContact O-CB 3.28Å; V952-F956 WeakPolarHBondContact O-CB 3.1Å; V952-F956 PolarHBondContact O-N 3.1Å
953	F	86.7	Confident	84.8	Confident	20 Å²	20	23.9 Å²	23.9	9%	0.088	14%	0.137	C	C	.	.	H	α-helix	trans	-59.3	-54.2	-179.7	155.6	-118.7	0	0	0	113.4	F67 L928 F932 L949 F950 K951 T955 F956 S957	F67-F953 HydrophobicContact CE2-CE1 4.26Å; F67-F953 HydrophobicContact CE2-CZ 4.39Å; F67-F953 HydrophobicContact CZ-CD1 4.47Å; F67-F953 AromaticContact CZ-CE1 3.69Å; F67-F953 HydrophobicContact CZ-CE1 3.69Å; F67-F953 HydrophobicContact CZ-CZ 4.1Å; L928-F953 HydrophobicContact CD1-CD2 3.11Å; L928-F953 HydrophobicContact CD1-CE2 3.08Å; L928-F953 HydrophobicContact CD1-CG 4.06Å; L928-F953 HydrophobicContact CD1-CZ 3.99Å; L928-F953 HydrophobicContact CD2-CE2 3.94Å; L928-F953 HydrophobicContact CD2-CZ 4.45Å; L928-F953 HydrophobicContact CG-CD2 4.49Å; L928-F953 HydrophobicContact CG-CE2 4.16Å; F932-F953 HydrophobicContact CE2-CD1 4.29Å; F932-F953 HydrophobicContact CE2-CD2 4.25Å; F932-F953 HydrophobicContact CE2-CG 4.06Å; F932-F953 HydrophobicContact CZ-CD1 4.15Å; F932-F953 HydrophobicContact CZ-CG 4.23Å; L949-F953 WeakPolarHBondContact O-CB 3.07Å; L949-F953 PolarHBondContact O-N 3.01Å; F950-F953 HydrophobicContact CD1-CD1 4.28Å; F950-F953 PolarHBondContact O-N 2.76Å; K951-F953 PolarHBondContact O-N 2.73Å; F953-T955 VanDerWaalsContact C-N 3.3Å; F953-T955 PolarHBondContact O-N 2.86Å; F953-F956 PolarHBondContact O-N 2.75Å; F953-S957 WeakPolarHBondContact CD2-OG 3.45Å; F953-S957 WeakPolarHBondContact CE2-OG 3.41Å; F953-S957 WeakPolarHBondContact O-CB 3.49Å; F953-S957 PolarHBondContact O-N 3.37Å; F953-S957 PolarHBondContact O-OG 2.94Å
954	I	86.6	Confident	84.1	Confident	5 Å²	5	23 Å²	23	3%	0.026	13%	0.133	C	C	.	.	H	α-helix	trans	-66.3	-41.1	-174.5	-62.5	161.8	0	0	0	109.4	S707 Y710 Y714 F950 S957 M958	S707-I954 WeakPolarHBondContact OG-CB 3.27Å; S707-I954 WeakPolarHBondContact OG-CG2 3.34Å; Y710-I954 HydrophobicContact CD1-CB 4.39Å; Y710-I954 HydrophobicContact CD1-CD1 3.46Å; Y710-I954 VanDerWaalsContact CD1-CD1 3.46Å; Y710-I954 HydrophobicContact CD1-CG1 3.88Å; Y710-I954 HydrophobicContact CD1-CG2 3.57Å; Y710-I954 HydrophobicContact CE1-CD1 3.71Å; Y710-I954 HydrophobicContact CE1-CG1 3.92Å; Y710-I954 HydrophobicContact CE1-CG2 4.2Å; Y710-I954 HydrophobicContact CG-CD1 4.02Å; Y714-I954 HydrophobicContact CD2-CD1 4.45Å; Y714-I954 HydrophobicContact CE2-CD1 3.85Å; F950-I954 HydrophobicContact CB-CD1 4.48Å; F950-I954 WeakPolarHBondContact O-CD1 3.49Å; F950-I954 VanDerWaalsContact O-CG1 3.26Å; F950-I954 WeakPolarHBondContact O-CG1 3.45Å; F950-I954 PolarHBondContact O-N 3.02Å; I954-S957 PolarHBondContact O-N 2.96Å; I954-M958 WeakPolarHBondContact O-CG 3.43Å; I954-M958 PolarHBondContact O-N 3.47Å; I954-M958 VanDerWaalsContact O-N 3.15Å
955	T	87.1	Confident	83.7	Confident	2 Å²	2	26.4 Å²	26.4	1%	0.012	15%	0.145	C	C	.	.	H	α-helix	trans	-64.3	-43.8	179.6	-66.5	0	0	0	0	111.1	S707 S824 I827 K951 F953 S957 M958 C959	S707-T955 VanDerWaalsContact OG-CA 3.31Å; S707-T955 WeakPolarHBondContact OG-CA 3.47Å; S707-T955 PolarHBondContact OG-N 2.98Å; S707-T955 PolarHBondContact OG-OG1 3.05Å; S824-T955 VanDerWaalsContact CB-CG2 3.45Å; S824-T955 WeakPolarHBondContact O-CG2 3.32Å; I827-T955 HydrophobicContact CB-CG2 4.11Å; I827-T955 HydrophobicContact CG2-CG2 3.97Å; K951-T955 VanDerWaalsContact O-CB 3.24Å; K951-T955 WeakPolarHBondContact O-CB 3.34Å; K951-T955 PolarHBondContact O-N 3.34Å; K951-T955 PolarHBondContact O-OG1 3.12Å; F953-T955 VanDerWaalsContact C-N 3.3Å; F953-T955 PolarHBondContact O-N 2.86Å; T955-S957 PolarHBondContact O-N 3.29Å; T955-M958 PolarHBondContact O-N 2.88Å; T955-C959 PolarHBondContact O-N 2.95Å
956	F	85.6	Confident	83.3	Confident	16 Å²	16	25.6 Å²	25.6	7%	0.07	14%	0.136	C	C	.	.	H	α-helix	trans	-65.1	-38	175.6	-175.3	-100.3	0	0	0	112.9	M839 F842 I843 S927 V952 F953 M958 C959 S960	M839-F956 HydrophobicContact CB-CD1 4.45Å; M839-F956 HydrophobicContact CB-CD2 3.68Å; M839-F956 HydrophobicContact CB-CE1 4.34Å; M839-F956 HydrophobicContact CB-CE2 3.55Å; M839-F956 HydrophobicContact CB-CG 4.13Å; M839-F956 HydrophobicContact CB-CZ 3.89Å; M839-F956 HydrophobicContact CE-CD1 4.06Å; M839-F956 HydrophobicContact CE-CE1 4.47Å; M839-F956 HydrophobicContact CG-CD1 4.16Å; M839-F956 HydrophobicContact CG-CD2 4.09Å; M839-F956 HydrophobicContact CG-CE1 4.34Å; M839-F956 HydrophobicContact CG-CE2 4.28Å; M839-F956 HydrophobicContact CG-CG 4.02Å; M839-F956 HydrophobicContact CG-CZ 4.39Å; M839-F956 HydrophobicContact SD-CD1 3.53Å; M839-F956 VanDerWaalsContact SD-CD1 3.53Å; M839-F956 HydrophobicContact SD-CD2 4.42Å; M839-F956 HydrophobicContact SD-CE1 3.47Å; M839-F956 WeakPolarHBondContact SD-CE1 3.28Å; M839-F956 HydrophobicContact SD-CE2 4.37Å; M839-F956 HydrophobicContact SD-CG 4.01Å; M839-F956 HydrophobicContact SD-CZ 3.91Å; F842-F956 HydrophobicContact CB-CZ 4.36Å; I843-F956 HydrophobicContact CD1-CE2 4.17Å; I843-F956 HydrophobicContact CG1-CE2 3.96Å; I843-F956 HydrophobicContact CG1-CZ 4.39Å; S927-F956 WeakPolarHBondContact OG-CE1 3.5Å; V952-F956 VanDerWaalsContact O-CB 3.28Å; V952-F956 WeakPolarHBondContact O-CB 3.1Å; V952-F956 PolarHBondContact O-N 3.1Å; F953-F956 PolarHBondContact O-N 2.75Å; F956-M958 VanDerWaalsContact C-N 3.28Å; F956-M958 PolarHBondContact O-N 3.04Å; F956-C959 VanDerWaalsContact O-CB 3.27Å; F956-C959 WeakPolarHBondContact O-CB 3.09Å; F956-C959 PolarHBondContact O-N 3.42Å; F956-C959 VanDerWaalsContact O-N 3.13Å; F956-S960 PolarHBondContact O-N 2.93Å
957	S	81.9	Confident	82.8	Confident	40 Å²	40	24 Å²	24	28%	0.28	13%	0.129	S	C	.	.	H	α-helix	trans	-62.1	-36.7	177.8	-60.4	0	0	0	0	112.3	F953 I954 T955	F953-S957 WeakPolarHBondContact CD2-OG 3.45Å; F953-S957 WeakPolarHBondContact CE2-OG 3.41Å; F953-S957 WeakPolarHBondContact O-CB 3.49Å; F953-S957 PolarHBondContact O-N 3.37Å; F953-S957 PolarHBondContact O-OG 2.94Å; I954-S957 PolarHBondContact O-N 2.96Å; T955-S957 PolarHBondContact O-N 3.29Å
958	M	81.3	Confident	82.1	Confident	42 Å²	42	23.9 Å²	23.9	21%	0.207	13%	0.132	C	C	.	.	H	α-helix	trans	-72.5	-39.4	173	-64.2	-61.3	171.9	0	0	111.7	I954 T955 F956 S960 Q961 A962	I954-M958 WeakPolarHBondContact O-CG 3.43Å; I954-M958 PolarHBondContact O-N 3.47Å; I954-M958 VanDerWaalsContact O-N 3.15Å; T955-M958 PolarHBondContact O-N 2.88Å; F956-M958 VanDerWaalsContact C-N 3.28Å; F956-M958 PolarHBondContact O-N 3.04Å; M958-S960 PolarHBondContact O-N 2.9Å; M958-Q961 PolarHBondContact O-N 3Å; M958-A962 PolarHBondContact O-N 3.35Å
959	C	84.4	Confident	81.5	Confident	1 Å²	1	25.2 Å²	25.2	1%	0.007	14%	0.136	C	C	.	.	H	α-helix	trans	-55	-48.1	173.9	-174.3	0	0	0	0	111.8	T955 F956 Q961 A962 L963	T955-C959 PolarHBondContact O-N 2.95Å; F956-C959 VanDerWaalsContact O-CB 3.27Å; F956-C959 WeakPolarHBondContact O-CB 3.09Å; F956-C959 PolarHBondContact O-N 3.42Å; F956-C959 VanDerWaalsContact O-N 3.13Å; C959-Q961 PolarHBondContact O-N 3.46Å; C959-Q961 VanDerWaalsContact O-N 3.13Å; C959-A962 WeakPolarHBondContact O-CA 3.3Å; C959-A962 WeakPolarHBondContact O-CB 3.36Å; C959-A962 PolarHBondContact O-N 2.85Å; C959-L963 WeakPolarHBondContact O-CD1 3.4Å; C959-L963 PolarHBondContact O-N 2.9Å
960	S	80.2	Confident	80.6	Confident	20 Å²	20	27.6 Å²	27.6	14%	0.14	15%	0.15	C	C	.	.	H	α-helix	trans	-54.6	-34.3	-179.9	-177.5	0	0	0	0	113.4	L846 F956 M958	L846-S960 VanDerWaalsContact CD1-OG 3.28Å; L846-S960 WeakPolarHBondContact CD1-OG 3.35Å; F956-S960 PolarHBondContact O-N 2.93Å; M958-S960 PolarHBondContact O-N 2.9Å
961	Q	76.3	Confident	79.7	Confident	110 Å²	110	29.2 Å²	29.2	51%	0.514	16%	0.16	S	C	.	.	H	α-helix	trans	-73	-31.3	177.6	-63.1	179.3	45	0	0	112.2	M958 C959	M958-Q961 PolarHBondContact O-N 3Å; C959-Q961 PolarHBondContact O-N 3.46Å; C959-Q961 VanDerWaalsContact O-N 3.13Å
962	A	81.1	Confident	78.9	Confident	0 Å²	0	31.8 Å²	31.8	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-65.3	-39	178.2	0	0	0	0	0	112.3	A817 L820 V821 M958 C959 G964 R965 I966	A817-A962 HydrophobicContact CB-CB 4.1Å; L820-A962 HydrophobicContact CB-CB 4.33Å; L820-A962 HydrophobicContact CD2-CB 3.47Å; L820-A962 VanDerWaalsContact CD2-CB 3.47Å; L820-A962 HydrophobicContact CG-CB 3.83Å; V821-A962 HydrophobicContact CG2-CB 3.89Å; M958-A962 PolarHBondContact O-N 3.35Å; C959-A962 WeakPolarHBondContact O-CA 3.3Å; C959-A962 WeakPolarHBondContact O-CB 3.36Å; C959-A962 PolarHBondContact O-N 2.85Å; A962-G964 VanDerWaalsContact C-N 3.27Å; A962-G964 PolarHBondContact O-N 3.44Å; A962-R965 WeakPolarHBondContact O-CB 3.42Å; A962-R965 PolarHBondContact O-N 2.99Å; A962-I966 PolarHBondContact O-N 3.29Å
963	L	77.9	Confident	78.2	Confident	3 Å²	3	32.4 Å²	32.4	2%	0.016	18%	0.175	C	C	.	.	H	α-helix	trans	-57.6	-38.2	-178.4	-84.6	67.8	0	0	0	112.6	V821 I843 L846 L847 C959 R965 I966 T967	V821-L963 HydrophobicContact CG2-CD1 3.76Å; I843-L963 HydrophobicContact CB-CD2 3.9Å; I843-L963 HydrophobicContact CG1-CD2 4.08Å; I843-L963 HydrophobicContact CG2-CD2 3.6Å; I843-L963 HydrophobicContact CG2-CG 4.3Å; I843-L963 WeakPolarHBondContact O-CD2 3.34Å; L846-L963 HydrophobicContact CB-CD2 4.01Å; L846-L963 HydrophobicContact CD1-CD2 4.23Å; L847-L963 HydrophobicContact CD2-CB 3.91Å; L847-L963 HydrophobicContact CD2-CD2 4.4Å; L847-L963 HydrophobicContact CD2-CG 4.08Å; L847-L963 HydrophobicContact CG-CD2 4.15Å; L847-L963 HydrophobicContact CG-CG 4.33Å; C959-L963 WeakPolarHBondContact O-CD1 3.4Å; C959-L963 PolarHBondContact O-N 2.9Å; L963-R965 VanDerWaalsContact C-N 3.31Å; L963-R965 PolarHBondContact O-N 3.18Å; L963-I966 PolarHBondContact O-N 3.37Å; L963-T967 PolarHBondContact O-N 2.97Å; L963-T967 PolarHBondContact O-OG1 2.92Å
964	G	73.2	Confident	77.7	Confident	33 Å²	33	36.4 Å²	36.4	34%	0.34	19%	0.193	S	C	.	.	H	α-helix	trans	-62.5	-38.7	176.7	0	0	0	0	0	112.4	A962 T967 A968	A962-G964 VanDerWaalsContact C-N 3.27Å; A962-G964 PolarHBondContact O-N 3.44Å; G964-T967 PolarHBondContact O-N 3.41Å; G964-A968 PolarHBondContact O-N 2.87Å; G964-A968 VanDerWaalsContact O-N 3.16Å
965	R	77.2	Confident	77.1	Confident	90 Å²	90	40.5 Å²	40.5	34%	0.34	21%	0.212	S	C	.	.	H	α-helix	trans	-67.3	-39.9	178.8	-56.3	-178.7	-172.7	177.8	3.3	111.9	E816 A817 A962 L963 T967 A968 F969	E816-R965 IonicContact OE1-NH1 3.85Å; E816-R965 PolarHBondContact OE1-NH1 3Å; A817-R965 HydrophobicContact CB-CB 4.2Å; A962-R965 WeakPolarHBondContact O-CB 3.42Å; A962-R965 PolarHBondContact O-N 2.99Å; L963-R965 VanDerWaalsContact C-N 3.31Å; L963-R965 PolarHBondContact O-N 3.18Å; R965-T967 VanDerWaalsContact C-N 3.32Å; R965-T967 PolarHBondContact O-N 3.12Å; R965-A968 PolarHBondContact O-N 3.24Å; R965-F969 PolarHBondContact O-N 2.76Å
966	I	77.5	Confident	76.9	Confident	43 Å²	43	40.5 Å²	40.5	22%	0.221	21%	0.211	C	C	.	.	H	α-helix	trans	-62.2	-42.5	176.7	-62.7	172	0	0	0	110.6	A817 V818 V821 A962 L963 A968 F969 T970	A817-I966 HydrophobicContact CB-CD1 4.13Å; A817-I966 HydrophobicContact CB-CG1 3.61Å; V818-I966 HydrophobicContact CG2-CD1 4.32Å; V821-I966 HydrophobicContact CG2-CD1 4.06Å; A962-I966 PolarHBondContact O-N 3.29Å; L963-I966 PolarHBondContact O-N 3.37Å; I966-A968 VanDerWaalsContact C-N 3.34Å; I966-A968 PolarHBondContact O-N 3.49Å; I966-F969 WeakPolarHBondContact O-CB 3.38Å; I966-F969 PolarHBondContact O-N 3.32Å; I966-T970 PolarHBondContact O-N 2.92Å; I966-T970 PolarHBondContact O-OG1 2.91Å; I966-T970 VanDerWaalsContact O-OG1 3.04Å
967	T	71.7	Confident	76.6	Confident	8 Å²	8	41.7 Å²	41.7	5%	0.049	22%	0.217	C	C	.	.	H	α-helix	trans	-64.9	-42.4	-179.7	-48	0	0	0	0	110.4	L847 S850 R851 M854 L963 G964 R965 F969 T970 T971	L847-T967 WeakPolarHBondContact CD2-OG1 3.34Å; S850-T967 VanDerWaalsContact CB-CG2 3.47Å; R851-T967 HydrophobicContact CB-CG2 4.04Å; M854-T967 HydrophobicContact CE-CG2 3.58Å; M854-T967 WeakPolarHBondContact CE-O 3.32Å; L963-T967 PolarHBondContact O-N 2.97Å; L963-T967 PolarHBondContact O-OG1 2.92Å; G964-T967 PolarHBondContact O-N 3.41Å; R965-T967 VanDerWaalsContact C-N 3.32Å; R965-T967 PolarHBondContact O-N 3.12Å; T967-F969 VanDerWaalsContact C-N 3.26Å; T967-F969 PolarHBondContact O-N 3.08Å; T967-T970 WeakPolarHBondContact O-CB 3.43Å; T967-T970 PolarHBondContact O-N 3.19Å; T967-T971 PolarHBondContact O-N 3.13Å
968	A	70.8	Confident	76.4	Confident	29 Å²	29	45.3 Å²	45.3	24%	0.24	23%	0.23	C	C	.	.	H	α-helix	trans	-59.5	-33.7	177.8	0	0	0	0	0	113.4	M854 G964 R965 I966 T971	M854-A968 HydrophobicContact CE-CB 4.31Å; M854-A968 VanDerWaalsContact CE-N 3.3Å; M854-A968 HydrophobicContact SD-CB 4.5Å; G964-A968 PolarHBondContact O-N 2.87Å; G964-A968 VanDerWaalsContact O-N 3.16Å; R965-A968 PolarHBondContact O-N 3.24Å; I966-A968 VanDerWaalsContact C-N 3.34Å; I966-A968 PolarHBondContact O-N 3.49Å; A968-T971 PolarHBondContact O-OG1 3.4Å
969	F	76.4	Confident	76.6	Confident	47 Å²	47	43.3 Å²	43.3	21%	0.206	22%	0.22	C	C	.	.	H	α-helix	trans	-69.5	-38.2	174	-179	-102.4	0	0	0	112.3	R810 L811 A814 R965 I966 T967 T971 K972 T973	R810-F969 HydrophobicContact CB-CD2 4.14Å; R810-F969 HydrophobicContact CB-CE2 4.41Å; L811-F969 HydrophobicContact CD1-CZ 4.35Å; A814-F969 HydrophobicContact CB-CB 4.06Å; A814-F969 HydrophobicContact CB-CD1 3.94Å; A814-F969 HydrophobicContact CB-CD2 3.85Å; A814-F969 HydrophobicContact CB-CE1 4.32Å; A814-F969 HydrophobicContact CB-CE2 4.25Å; A814-F969 HydrophobicContact CB-CG 3.68Å; A814-F969 HydrophobicContact CB-CZ 4.46Å; R965-F969 PolarHBondContact O-N 2.76Å; I966-F969 WeakPolarHBondContact O-CB 3.38Å; I966-F969 PolarHBondContact O-N 3.32Å; T967-F969 VanDerWaalsContact C-N 3.26Å; T967-F969 PolarHBondContact O-N 3.08Å; F969-T971 VanDerWaalsContact C-N 3.32Å; F969-T971 PolarHBondContact O-N 3.01Å; F969-K972 PolarHBondContact O-N 2.87Å; F969-T973 HydrophobicContact CD1-CG2 3.92Å; F969-T973 HydrophobicContact CD2-CG2 4.39Å; F969-T973 HydrophobicContact CE1-CG2 3.53Å; F969-T973 HydrophobicContact CE2-CG2 4.04Å; F969-T973 HydrophobicContact CG-CG2 4.33Å; F969-T973 HydrophobicContact CZ-CG2 3.6Å; F969-T973 VanDerWaalsContact O-CG2 3.31Å; F969-T973 WeakPolarHBondContact O-CG2 3.46Å; F969-T973 PolarHBondContact O-N 3.11Å; F969-T973 PolarHBondContact O-OG1 2.96Å
970	T	70.3	Confident	76.7	Confident	50 Å²	50	43.3 Å²	43.3	31%	0.307	22%	0.22	S	C	.	.	H	α-helix	trans	-66.6	-27.5	-175.6	-53.8	0	0	0	0	113.8	I966 T967 T973	I966-T970 PolarHBondContact O-N 2.92Å; I966-T970 PolarHBondContact O-OG1 2.91Å; I966-T970 VanDerWaalsContact O-OG1 3.04Å; T967-T970 WeakPolarHBondContact O-CB 3.43Å; T967-T970 PolarHBondContact O-N 3.19Å; T970-T973 VanDerWaalsContact CA-OG1 3.26Å; T970-T973 WeakPolarHBondContact CA-OG1 3.46Å; T970-T973 PolarHBondContact O-OG1 3.25Å
971	T	68.4	Low	76.9	Confident	34 Å²	34	43.2 Å²	43.2	21%	0.209	22%	0.222	C	C	.	.	H	α-helix	trans	-83.9	-41.1	178.4	52.5	0	0	0	0	111.8	M854 T967 A968 F969 T973 K974 E975	M854-T971 HydrophobicContact CB-CG2 3.5Å; M854-T971 HydrophobicContact CE-CG2 3.68Å; M854-T971 HydrophobicContact CG-CG2 4Å; T967-T971 PolarHBondContact O-N 3.13Å; A968-T971 PolarHBondContact O-OG1 3.4Å; F969-T971 VanDerWaalsContact C-N 3.32Å; F969-T971 PolarHBondContact O-N 3.01Å; T971-T973 VanDerWaalsContact C-N 3.3Å; T971-T973 PolarHBondContact O-N 3Å; T971-K974 WeakPolarHBondContact O-CB 3.47Å; T971-K974 PolarHBondContact O-N 3.46Å; T971-E975 PolarHBondContact O-N 3.29Å
972	K	72.4	Confident	77.3	Confident	72 Å²	72	44.1 Å²	44.1	31%	0.313	22%	0.22	S	C	.	.	H	α-helix	trans	-66.5	-32.3	176.9	-69	-168.9	169.5	-158.1	0	113.1	F969 K974 E975 A976	F969-K972 PolarHBondContact O-N 2.87Å; K972-K974 VanDerWaalsContact C-N 3.29Å; K972-K974 PolarHBondContact O-N 3.48Å; K972-E975 PolarHBondContact O-N 3.13Å; K972-A976 WeakPolarHBondContact O-CB 3.32Å; K972-A976 PolarHBondContact O-N 3.36Å
973	T	76.4	Confident	77.6	Confident	15 Å²	15	44.2 Å²	44.2	9%	0.092	22%	0.221	C	C	.	.	H	α-helix	trans	-60	-38.8	173.3	38.2	0	0	0	0	111.7	I806 F969 T970 T971 A976 E977	I806-T973 HydrophobicContact CG1-CG2 4.46Å; F969-T973 HydrophobicContact CD1-CG2 3.92Å; F969-T973 HydrophobicContact CD2-CG2 4.39Å; F969-T973 HydrophobicContact CE1-CG2 3.53Å; F969-T973 HydrophobicContact CE2-CG2 4.04Å; F969-T973 HydrophobicContact CG-CG2 4.33Å; F969-T973 HydrophobicContact CZ-CG2 3.6Å; F969-T973 VanDerWaalsContact O-CG2 3.31Å; F969-T973 WeakPolarHBondContact O-CG2 3.46Å; F969-T973 PolarHBondContact O-N 3.11Å; F969-T973 PolarHBondContact O-OG1 2.96Å; T970-T973 VanDerWaalsContact CA-OG1 3.26Å; T970-T973 WeakPolarHBondContact CA-OG1 3.46Å; T970-T973 PolarHBondContact O-OG1 3.25Å; T971-T973 VanDerWaalsContact C-N 3.3Å; T971-T973 PolarHBondContact O-N 3Å; T973-A976 CarbonylContact O-C 3.55Å; T973-A976 PolarHBondContact O-N 3.38Å; T973-E977 VanDerWaalsContact O-CG 3.32Å; T973-E977 WeakPolarHBondContact O-CG 3.29Å; T973-E977 PolarHBondContact O-N 3.48Å
974	K	74.7	Confident	78.1	Confident	105 Å²	105	44.4 Å²	44.4	46%	0.457	22%	0.222	S	C	.	.	H	α-helix	trans	-64.3	-45.9	175.4	-67.5	-169.5	171.2	-147.7	0	113.4	T971 K972 A976 E977 E978	T971-K974 WeakPolarHBondContact O-CB 3.47Å; T971-K974 PolarHBondContact O-N 3.46Å; K972-K974 VanDerWaalsContact C-N 3.29Å; K972-K974 PolarHBondContact O-N 3.48Å; K974-A976 PolarHBondContact O-N 3.45Å; K974-E977 WeakPolarHBondContact O-CB 3.42Å; K974-E977 PolarHBondContact O-N 3.01Å; K974-E978 PolarHBondContact O-N 3.44Å
975	E	74.1	Confident	78.7	Confident	91 Å²	91	47.2 Å²	47.2	43%	0.425	23%	0.232	S	C	.	.	H	α-helix	trans	-60.6	-37.6	175.7	-68.1	173.7	-160.5	0	0	111.4	T971 K972 A979	T971-E975 PolarHBondContact O-N 3.29Å; K972-E975 PolarHBondContact O-N 3.13Å; E975-A979 WeakPolarHBondContact O-CB 3.15Å; E975-A979 PolarHBondContact O-N 2.81Å
976	A	82.7	Confident	79.2	Confident	1 Å²	1	43.6 Å²	43.6	1%	0.008	22%	0.22	C	C	.	.	H	α-helix	trans	-75.3	-29.5	177.4	0	0	0	0	0	112.6	K802 I806 K972 T973 K974 A979 M980	K802-A976 HydrophobicContact CB-CB 4.49Å; K802-A976 WeakPolarHBondContact O-CB 3.49Å; I806-A976 HydrophobicContact CD1-CB 3.24Å; I806-A976 HydrophobicContact CG1-CB 3.6Å; K972-A976 WeakPolarHBondContact O-CB 3.32Å; K972-A976 PolarHBondContact O-N 3.36Å; T973-A976 CarbonylContact O-C 3.55Å; T973-A976 PolarHBondContact O-N 3.38Å; K974-A976 PolarHBondContact O-N 3.45Å; A976-A979 PolarHBondContact O-N 3.35Å; A976-M980 WeakPolarHBondContact O-CB 3.35Å; A976-M980 WeakPolarHBondContact O-CG 3.23Å; A976-M980 PolarHBondContact O-N 3.15Å
977	E	80.1	Confident	79.7	Confident	41 Å²	41	43.5 Å²	43.5	19%	0.192	22%	0.22	C	C	.	.	H	α-helix	trans	-63.1	-46.1	169	-76.5	173	-176.9	0	0	112.1	H671 Y675 T973 K974 A979 M980 G981	H671-E977 IonicContact CE1-OE2 2.87Å; H671-E977 PolarHBondContact CE1-OE2 3.14Å; H671-E977 IonicContact ND1-OE1 3.81Å; H671-E977 IonicContact ND1-OE2 3.77Å; H671-E977 PolarHBondContact ND1-OE2 3.37Å; H671-E977 VanDerWaalsContact ND1-OE2 3.13Å; Y675-E977 HydrophobicContact CE2-CG 3.83Å; Y675-E977 VanDerWaalsContact CE2-OE1 3.24Å; Y675-E977 WeakPolarHBondContact CE2-OE1 3.35Å; Y675-E977 WeakPolarHBondContact OH-CG 3.12Å; Y675-E977 PolarHBondContact OH-OE1 3.37Å; T973-E977 VanDerWaalsContact O-CG 3.32Å; T973-E977 WeakPolarHBondContact O-CG 3.29Å; T973-E977 PolarHBondContact O-N 3.48Å; K974-E977 WeakPolarHBondContact O-CB 3.42Å; K974-E977 PolarHBondContact O-N 3.01Å; E977-A979 VanDerWaalsContact C-N 3.34Å; E977-M980 HydrophobicContact CB-CE 4.26Å; E977-M980 HydrophobicContact CG-CE 3.88Å; E977-M980 PolarHBondContact O-N 3Å; E977-G981 PolarHBondContact O-N 2.93Å
978	E	78.2	Confident	80.5	Confident	117 Å²	117	46.4 Å²	46.4	55%	0.547	24%	0.235	S	C	.	.	H	α-helix	trans	-61.2	-44.6	175.6	-69.4	176.5	-176	0	0	110.8	K974 G981 R982	K974-E978 PolarHBondContact O-N 3.44Å; E978-G981 PolarHBondContact O-N 2.93Å; E978-R982 PolarHBondContact O-N 3.02Å; E978-R982 VanDerWaalsContact O-N 3.15Å
979	A	84.6	Confident	81.3	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-62.4	-43.2	174.4	0	0	0	0	0	112.5	D799 K802 V803 E975 A976 E977 G981 R982 I983	D799-A979 HydrophobicContact CB-CB 3.86Å; K802-A979 HydrophobicContact CB-CB 4.25Å; K802-A979 HydrophobicContact CD-CB 4.46Å; V803-A979 HydrophobicContact CG2-CB 3.92Å; E975-A979 WeakPolarHBondContact O-CB 3.15Å; E975-A979 PolarHBondContact O-N 2.81Å; A976-A979 PolarHBondContact O-N 3.35Å; E977-A979 VanDerWaalsContact C-N 3.34Å; A979-G981 VanDerWaalsContact C-N 3.34Å; A979-G981 PolarHBondContact O-N 2.99Å; A979-R982 PolarHBondContact O-N 3.18Å; A979-I983 WeakPolarHBondContact O-CB 3.46Å; A979-I983 VanDerWaalsContact O-CG1 3.29Å; A979-I983 WeakPolarHBondContact O-CG1 3.27Å; A979-I983 PolarHBondContact O-N 2.88Å
980	M	86.4	Confident	81.8	Confident	1 Å²	1	54 Å²	54	1%	0.005	26%	0.26	C	S	.	.	H	α-helix	trans	-59.4	-44.5	175	-80.4	-172.4	-63	0	0	111.5	Y675 L678 V803 I806 A976 E977 R982 I983 F984	Y675-M980 HydrophobicContact CD1-CE 4.11Å; Y675-M980 HydrophobicContact CE1-CE 3.73Å; Y675-M980 HydrophobicContact CE2-CE 4.44Å; L678-M980 HydrophobicContact CB-SD 4.08Å; L678-M980 HydrophobicContact CD1-SD 4.46Å; L678-M980 HydrophobicContact CD2-SD 3.73Å; L678-M980 HydrophobicContact CG-SD 4.3Å; V803-M980 HydrophobicContact CB-CG 4.15Å; V803-M980 HydrophobicContact CG1-CG 3.58Å; V803-M980 HydrophobicContact CG1-SD 4.18Å; V803-M980 HydrophobicContact CG2-CB 4.31Å; V803-M980 HydrophobicContact CG2-CG 3.48Å; V803-M980 VanDerWaalsContact CG2-CG 3.48Å; I806-M980 HydrophobicContact CD1-CE 3.82Å; I806-M980 HydrophobicContact CD1-SD 4.26Å; A976-M980 WeakPolarHBondContact O-CB 3.35Å; A976-M980 WeakPolarHBondContact O-CG 3.23Å; A976-M980 PolarHBondContact O-N 3.15Å; E977-M980 HydrophobicContact CB-CE 4.26Å; E977-M980 HydrophobicContact CG-CE 3.88Å; E977-M980 PolarHBondContact O-N 3Å; M980-R982 VanDerWaalsContact C-N 3.35Å; M980-R982 PolarHBondContact O-N 3.12Å; M980-I983 PolarHBondContact O-N 3.47Å; M980-F984 HydrophobicContact CB-CD2 4.24Å; M980-F984 HydrophobicContact CB-CE2 4.13Å; M980-F984 HydrophobicContact CG-CE2 4.34Å; M980-F984 WeakPolarHBondContact O-CB 3.28Å; M980-F984 WeakPolarHBondContact O-CD2 3.49Å; M980-F984 PolarHBondContact O-N 2.98Å
981	G	84.8	Confident	82.7	Confident	17 Å²	17	52.7 Å²	52.7	18%	0.175	25%	0.253	C	S	.	.	H	α-helix	trans	-55.5	-49.6	176.5	0	0	0	0	0	111.4	E977 E978 A979 T985	E977-G981 PolarHBondContact O-N 2.93Å; E978-G981 PolarHBondContact O-N 2.93Å; A979-G981 VanDerWaalsContact C-N 3.34Å; A979-G981 PolarHBondContact O-N 2.99Å; G981-T985 WeakPolarHBondContact O-CG2 3.5Å; G981-T985 PolarHBondContact O-N 3.47Å; G981-T985 PolarHBondContact O-OG1 3.39Å
982	R	84.3	Confident	83.4	Confident	129 Å²	129	55 Å²	55	49%	0.487	27%	0.271	S	S	.	.	H	α-helix	trans	-63	-46.8	176.6	-65.2	-166.9	-65.5	-156.7	-0.4	112.5	F795 D799 E978 A979 M980 F984 T985 V986	F795-R982 HydrophobicContact CE2-CB 3.66Å; F795-R982 HydrophobicContact CZ-CB 3.88Å; D799-R982 IonicContact OD1-CZ 3.97Å; D799-R982 IonicContact OD1-NH2 3.19Å; D799-R982 PolarHBondContact OD1-NH2 3.45Å; D799-R982 IonicContact OD2-CZ 2.68Å; D799-R982 IonicContact OD2-NE 2.84Å; D799-R982 PolarHBondContact OD2-NE 2.83Å; D799-R982 IonicContact OD2-NH2 3.37Å; D799-R982 PolarHBondContact OD2-NH2 3.45Å; E978-R982 PolarHBondContact O-N 3.02Å; E978-R982 VanDerWaalsContact O-N 3.15Å; A979-R982 PolarHBondContact O-N 3.18Å; M980-R982 VanDerWaalsContact C-N 3.35Å; M980-R982 PolarHBondContact O-N 3.12Å; R982-F984 PolarHBondContact O-N 3.36Å; R982-T985 WeakPolarHBondContact CA-OG1 3.35Å; R982-T985 PolarHBondContact O-N 3.26Å; R982-T985 PolarHBondContact O-OG1 2.89Å; R982-V986 PolarHBondContact O-N 2.89Å
983	I	87.4	Confident	84.1	Confident	2 Å²	2	52 Å²	52	1%	0.01	26%	0.258	C	S	.	.	H	α-helix	trans	-59.3	-48.3	-179.9	-71.5	176.1	0	0	0	110.8	L770 F795 D799 V803 A979 M980 T985 V986 I987	L770-I983 HydrophobicContact CD1-CG2 4.41Å; L770-I983 HydrophobicContact CD2-CG1 4.11Å; F795-I983 HydrophobicContact CE2-CG1 3.96Å; F795-I983 HydrophobicContact CZ-CB 4.5Å; F795-I983 HydrophobicContact CZ-CG1 3.84Å; D799-I983 HydrophobicContact CB-CD1 4.07Å; D799-I983 HydrophobicContact CB-CG1 4.32Å; V803-I983 HydrophobicContact CG2-CD1 3.8Å; A979-I983 WeakPolarHBondContact O-CB 3.46Å; A979-I983 VanDerWaalsContact O-CG1 3.29Å; A979-I983 WeakPolarHBondContact O-CG1 3.27Å; A979-I983 PolarHBondContact O-N 2.88Å; M980-I983 PolarHBondContact O-N 3.47Å; I983-T985 PolarHBondContact O-N 3.39Å; I983-V986 PolarHBondContact O-N 3.26Å; I983-I987 HydrophobicContact CG2-CD1 3.54Å; I983-I987 HydrophobicContact CG2-CG1 4.24Å; I983-I987 WeakPolarHBondContact O-CG1 3.24Å; I983-I987 PolarHBondContact O-N 3.41Å
984	F	88	Confident	84.5	Confident	7 Å²	7	54.9 Å²	54.9	3%	0.031	27%	0.271	C	S	.	.	H	α-helix	trans	-68.3	-33.8	179.9	-68.7	-48.3	0	0	0	112.5	L674 R677 I681 M980 R982 V986 I987 D988	L674-F984 HydrophobicContact CD2-CD2 3.61Å; L674-F984 HydrophobicContact CD2-CE2 4.31Å; L674-F984 HydrophobicContact CD2-CG 4.49Å; R677-F984 HydrophobicContact CB-CZ 4.46Å; R677-F984 HydrophobicContact CG-CE1 4.17Å; R677-F984 HydrophobicContact CG-CE2 4.5Å; R677-F984 HydrophobicContact CG-CZ 4.07Å; I681-F984 HydrophobicContact CD1-CE1 3.49Å; I681-F984 VanDerWaalsContact CD1-CE1 3.49Å; I681-F984 HydrophobicContact CD1-CZ 3.97Å; M980-F984 HydrophobicContact CB-CD2 4.24Å; M980-F984 HydrophobicContact CB-CE2 4.13Å; M980-F984 HydrophobicContact CG-CE2 4.34Å; M980-F984 WeakPolarHBondContact O-CB 3.28Å; M980-F984 WeakPolarHBondContact O-CD2 3.49Å; M980-F984 PolarHBondContact O-N 2.98Å; R982-F984 PolarHBondContact O-N 3.36Å; F984-V986 PolarHBondContact O-N 2.96Å; F984-I987 PolarHBondContact O-N 2.94Å; F984-D988 WeakPolarHBondContact O-CB 3.19Å; F984-D988 PolarHBondContact O-N 3.18Å
985	T	87	Confident	84.8	Confident	93 Å²	93	51.5 Å²	51.5	57%	0.571	26%	0.259	S	S	*	.	H	α-helix	trans	-59.9	-32.2	172.9	60.4	0	0	0	0	113	G981 R982 I983 R989	G981-T985 WeakPolarHBondContact O-CG2 3.5Å; G981-T985 PolarHBondContact O-N 3.47Å; G981-T985 PolarHBondContact O-OG1 3.39Å; R982-T985 WeakPolarHBondContact CA-OG1 3.35Å; R982-T985 PolarHBondContact O-N 3.26Å; R982-T985 PolarHBondContact O-OG1 2.89Å; I983-T985 PolarHBondContact O-N 3.39Å; T985-R989 VanDerWaalsContact O-CB 3.28Å; T985-R989 WeakPolarHBondContact O-CB 3.31Å; T985-R989 PolarHBondContact O-N 3.49Å
986	V	88.2	Confident	85.1	Confident	14 Å²	14	52.1 Å²	52.1	9%	0.085	27%	0.265	C	S	.	.	H	α-helix	trans	-84.3	-38.2	176.8	178.6	0	0	0	0	112.2	L770 S773 M774 W781 F795 R982 I983 F984 D988	L770-V986 HydrophobicContact CD1-CB 3.91Å; L770-V986 HydrophobicContact CD1-CG1 3.79Å; S773-V986 PolarHBondContact OG-O 3.35Å; M774-V986 HydrophobicContact CG-CG1 4.11Å; W781-V986 HydrophobicContact CH2-CG1 4.37Å; W781-V986 HydrophobicContact CZ2-CG1 4.16Å; W781-V986 HydrophobicContact CZ2-CG2 4.21Å; F795-V986 HydrophobicContact CE1-CB 4.48Å; F795-V986 HydrophobicContact CE1-CG2 3.94Å; F795-V986 HydrophobicContact CZ-CG2 4.36Å; R982-V986 PolarHBondContact O-N 2.89Å; I983-V986 PolarHBondContact O-N 3.26Å; F984-V986 PolarHBondContact O-N 2.96Å; V986-D988 VanDerWaalsContact C-N 3.3Å; V986-D988 PolarHBondContact O-N 3.44Å
987	I	88	Confident	85	Confident	41 Å²	41	57.9 Å²	57.9	21%	0.21	29%	0.292	C	S	.	.	H	α-helix	trans	-66	-35.2	176.5	-68.9	177.3	0	0	0	111.3	N769 L770 I983 F984	N769-I987 HydrophobicContact CB-CD1 4.46Å; L770-I987 HydrophobicContact CD1-CG1 4.12Å; I983-I987 HydrophobicContact CG2-CD1 3.54Å; I983-I987 HydrophobicContact CG2-CG1 4.24Å; I983-I987 WeakPolarHBondContact O-CG1 3.24Å; I983-I987 PolarHBondContact O-N 3.41Å; F984-I987 PolarHBondContact O-N 2.94Å
988	D	87.2	Confident	85	Confident	68 Å²	68	57.7 Å²	57.7	36%	0.364	30%	0.301	S	S	.	.	S	Bend	trans	-90.4	-14.2	-175.7	-60.6	-20.4	0	0	0	113.7	R677 F984 V986 K990	R677-D988 IonicContact CZ-OD1 3.87Å; R677-D988 IonicContact CZ-OD2 3.17Å; R677-D988 VanDerWaalsContact CZ-OD2 3.28Å; R677-D988 VanDerWaalsContact NH1-CG 3.32Å; R677-D988 IonicContact NH1-OD1 3.52Å; R677-D988 PolarHBondContact NH1-OD1 2.93Å; R677-D988 IonicContact NH1-OD2 3.22Å; R677-D988 PolarHBondContact NH1-OD2 2.77Å; R677-D988 VanDerWaalsContact NH2-CG 3.31Å; R677-D988 IonicContact NH2-OD1 2.9Å; R677-D988 PolarHBondContact NH2-OD1 3.45Å; R677-D988 IonicContact NH2-OD2 3.49Å; R677-D988 PolarHBondContact NH2-OD2 3.12Å; F984-D988 WeakPolarHBondContact O-CB 3.19Å; F984-D988 PolarHBondContact O-N 3.18Å; V986-D988 VanDerWaalsContact C-N 3.3Å; V986-D988 PolarHBondContact O-N 3.44Å; D988-K990 PolarHBondContact O-N 3.42Å
989	R	88.2	Confident	85.3	Confident	65 Å²	65	57.2 Å²	57.2	25%	0.245	30%	0.302	C	S	.	.			trans	-65.5	107	178.1	-176.7	179	-171.1	-93.2	-4.4	108.8	Q777 E778 W781 T985	Q777-R989 PolarHBondContact NE2-O 2.96Å; Q777-R989 VanDerWaalsContact NE2-O 3.17Å; E778-R989 VanDerWaalsContact CD-NH1 3.32Å; E778-R989 IonicContact OE1-CZ 3.54Å; E778-R989 IonicContact OE1-NH1 2.95Å; E778-R989 PolarHBondContact OE1-NH1 3.2Å; E778-R989 IonicContact OE1-NH2 3.48Å; E778-R989 PolarHBondContact OE1-NH2 3.17Å; E778-R989 IonicContact OE2-CZ 2.74Å; E778-R989 IonicContact OE2-NH1 3Å; E778-R989 PolarHBondContact OE2-NH1 3.46Å; E778-R989 IonicContact OE2-NH2 3.17Å; W781-R989 VanDerWaalsContact CD1-NH1 3.31Å; T985-R989 VanDerWaalsContact O-CB 3.28Å; T985-R989 WeakPolarHBondContact O-CB 3.31Å; T985-R989 PolarHBondContact O-N 3.49Å
990	K	86.8	Confident	85.4	Confident	170 Å²	170	62.1 Å²	62.1	74%	0.739	33%	0.325	S	S	*	.			trans	-68.4	126.8	165.5	-61.6	-170	179	-175.1	0	108.6	D988	D988-K990 PolarHBondContact O-N 3.42Å
991	P	88.6	Confident	85.2	Confident	23 Å²	23	63.7 Å²	63.7	15%	0.149	34%	0.335	C	S	.	.			trans	-65.7	151.6	177.2	30.8	-35.8	0	0	0	109.7	K776 E778 I993 E994	K776-P991 WeakPolarHBondContact O-CB 3.28Å; K776-P991 WeakPolarHBondContact O-CG 3.26Å; E778-P991 WeakPolarHBondContact OE2-CA 3.39Å; E778-P991 WeakPolarHBondContact OE2-CB 3.45Å; P991-I993 PolarHBondContact O-N 3.1Å; P991-E994 HydrophobicContact CG-CG 3.78Å
992	S	84.4	Confident	84.8	Confident	84 Å²	84	73.2 Å²	73.2	59%	0.587	37%	0.372	S	S	*	.	S	Bend	trans	-68.6	-26.7	174	51.5	0	0	0	0	112.2	E778	E778-S992 VanDerWaalsContact CG-OG 3.27Å; E778-S992 WeakPolarHBondContact CG-OG 3.19Å; E778-S992 PolarHBondContact OE1-OG 3.47Å; E778-S992 PolarHBondContact OE2-N 3.36Å
993	I	86.2	Confident	84.4	Confident	9 Å²	9	75 Å²	75	5%	0.046	39%	0.386	C	S	.	.	S	Bend	trans	-123.3	97.6	178.2	-55.8	173.7	0	0	0	108.2	E778 P991 R1059 P1084	E778-I993 HydrophobicContact CB-CB 4.29Å; E778-I993 HydrophobicContact CB-CD1 4.48Å; P991-I993 PolarHBondContact O-N 3.1Å; I993-R1059 HydrophobicContact CG2-CG 4.35Å; I993-P1084 HydrophobicContact CG2-CB 4.43Å; I993-P1084 HydrophobicContact CG2-CG 3.67Å
994	E	85.7	Confident	84.1	Confident	75 Å²	75	82.7 Å²	82.7	35%	0.35	42%	0.419	S	S	.	.			trans	-75.7	130.7	175.5	-73	-173.6	-169.2	0	0	111.2	P991 N996 Q997 P1084	P991-E994 HydrophobicContact CG-CG 3.78Å; E994-N996 PolarHBondContact O-N 3.5Å; E994-Q997 HydrophobicContact CB-CB 3.65Å; E994-Q997 PolarHBondContact O-N 2.89Å; E994-Q997 PolarHBondContact OE2-OE1 3.33Å; E994-P1084 WeakPolarHBondContact O-CD 3.01Å; E994-P1084 WeakPolarHBondContact O-CG 3.23Å
995	T	80.7	Confident	84	Confident	33 Å²	33	82.6 Å²	82.6	20%	0.202	42%	0.418	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-34.8	-171.1	44.5	0	0	0	0	115	P1084 Y1085	T995-P1084 WeakPolarHBondContact O-CD 3.18Å; T995-Y1085 WeakPolarHBondContact O-CB 3.4Å; T995-Y1085 PolarHBondContact O-N 3.45Å
996	N	80.4	Confident	83.9	Confident	105 Å²	105	83.7 Å²	83.7	56%	0.561	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.2	1.8	-175.8	-69.2	-30.6	0	0	0	113.8	E994	E994-N996 PolarHBondContact O-N 3.5Å
997	Q	80.2	Confident	83.8	Confident	122 Å²	122	83 Å²	83	57%	0.57	42%	0.417	S	S	*	.			trans	-85.3	121.1	-177.8	-166.7	179.8	22.6	0	0	110.3	E994 A1083	E994-Q997 HydrophobicContact CB-CB 3.65Å; E994-Q997 PolarHBondContact O-N 2.89Å; E994-Q997 PolarHBondContact OE2-OE1 3.33Å; Q997-A1083 WeakPolarHBondContact O-CA 3.34Å
998	G	80.7	Confident	84	Confident	37 Å²	37	82.2 Å²	82.2	38%	0.381	41%	0.413	S	S	.	.	S	Bend	trans	131.1	173.2	-179.6	0	0	0	0	0	112.7	Q1081	G998-Q1081 CarbonylContact C-O 3.49Å; G998-Q1081 WeakPolarHBondContact CA-O 3.39Å
999	D	83.9	Confident	84.3	Confident	106 Å²	106	79 Å²	79	57%	0.567	40%	0.395	S	S	*	.	B	Isolated β-bridge	trans	-68.9	143	178.2	-64.6	-30.6	0	0	0	110.8	P1001 Q1081 L1082 A1083	D999-P1001 WeakPolarHBondContact O-CD 3.23Å; D999-Q1081 PolarHBondContact N-O 3.24Å; D999-L1082 WeakPolarHBondContact O-CA 3.33Å; D999-A1083 PolarHBondContact O-N 3.49Å
1000	Q	85.7	Confident	84.5	Confident	104 Å²	104	77 Å²	77	49%	0.486	39%	0.389	S	S	.	.			trans	-117.4	87.8	170.3	-62.7	-171.1	8	0	0	108	K1002 A1083 W1086	Q1000-K1002 PolarHBondContact O-N 2.77Å; Q1000-A1083 HydrophobicContact CG-CB 3.86Å; Q1000-W1086 HydrophobicContact CB-CG 4.48Å; Q1000-W1086 HydrophobicContact CG-CB 4.15Å
1001	P	82.8	Confident	84.7	Confident	34 Å²	34	69.3 Å²	69.3	22%	0.221	36%	0.356	C	S	.	.			trans	-54.4	133.5	179	-24.1	32	0	0	0	111	D999 E1003 I1077 L1082 W1086	D999-P1001 WeakPolarHBondContact O-CD 3.23Å; P1001-E1003 VanDerWaalsContact C-N 3.3Å; P1001-I1077 HydrophobicContact CG-CD1 4.15Å; P1001-L1082 VanDerWaalsContact CD-CD2 3.5Å; P1001-L1082 HydrophobicContact CG-CD2 3.46Å; P1001-L1082 VanDerWaalsContact CG-CD2 3.46Å; P1001-W1086 HydrophobicContact CB-CZ2 3.95Å; P1001-W1086 HydrophobicContact CG-CH2 4.22Å; P1001-W1086 HydrophobicContact CG-CZ2 3.98Å; P1001-W1086 PolarHBondContact O-NE1 3.08Å
1002	K	77.3	Confident	84.7	Confident	216 Å²	216	71.7 Å²	71.7	94%	0.939	36%	0.364	S	S	*	.	S	Bend	trans	-76	-24.9	171.6	-68	-177.3	-179.6	177.3	0	111.7	Q1000	Q1000-K1002 PolarHBondContact O-N 2.77Å
1003	E	75.9	Confident	84.9	Confident	167 Å²	167	71.7 Å²	71.7	78%	0.78	35%	0.354	S	S	*	.	S	Bend	trans	-67.3	144.7	177	-64.9	-177.6	-179.7	0	0	110.7	P1001 F1005	P1001-E1003 VanDerWaalsContact C-N 3.3Å; E1003-F1005 PolarHBondContact O-N 2.9Å
1004	K	80.7	Confident	85	Confident	164 Å²	164	71.2 Å²	71.2	71%	0.713	35%	0.352	S	S	*	.	P	Polyproline II helix	trans	-71.6	128.2	-179.6	-171	179.2	179.6	-175	0	108.7	N1006	K1004-N1006 PolarHBondContact O-N 3.09Å
1005	F	85.5	Confident	85.2	Confident	4 Å²	4	69.4 Å²	69.4	2%	0.018	34%	0.344	C	S	.	.	P	Polyproline II helix	trans	-60.7	118.2	173.5	179.3	-132	0	0	0	109.6	E1003 G1007 I1009 F1074 D1075 W1086 Q1090 T1173 L1174	E1003-F1005 PolarHBondContact O-N 2.9Å; F1005-G1007 VanDerWaalsContact C-N 3.33Å; F1005-I1009 HydrophobicContact CZ-CG1 4.19Å; F1005-F1074 HydrophobicContact CD2-CB 4.21Å; F1005-F1074 HydrophobicContact CD2-CD2 4.41Å; F1005-F1074 HydrophobicContact CE1-CD2 4.07Å; F1005-F1074 HydrophobicContact CE1-CE2 4.15Å; F1005-F1074 HydrophobicContact CE2-CB 3.56Å; F1005-F1074 HydrophobicContact CE2-CD1 4.42Å; F1005-F1074 AromaticContact CE2-CD2 3.87Å; F1005-F1074 HydrophobicContact CE2-CD2 3.87Å; F1005-F1074 AromaticContact CE2-CG 3.72Å; F1005-F1074 HydrophobicContact CE2-CG 3.72Å; F1005-F1074 HydrophobicContact CZ-CB 4.11Å; F1005-F1074 HydrophobicContact CZ-CD1 4.12Å; F1005-F1074 AromaticContact CZ-CD2 3.68Å; F1005-F1074 HydrophobicContact CZ-CD2 3.68Å; F1005-F1074 HydrophobicContact CZ-CE1 4.48Å; F1005-F1074 HydrophobicContact CZ-CE2 4.06Å; F1005-F1074 AromaticContact CZ-CG 3.72Å; F1005-F1074 HydrophobicContact CZ-CG 3.72Å; F1005-F1074 HydrophobicContact CZ-CZ 4.46Å; F1005-D1075 WeakPolarHBondContact CA-OD2 3.06Å; F1005-D1075 HydrophobicContact CD2-CB 4.44Å; F1005-D1075 WeakPolarHBondContact CD2-OD2 3.41Å; F1005-W1086 HydrophobicContact CB-CH2 3.92Å; F1005-W1086 HydrophobicContact CB-CZ2 4.33Å; F1005-W1086 HydrophobicContact CD2-CH2 4.48Å; F1005-W1086 HydrophobicContact CG-CH2 4.35Å; F1005-Q1090 HydrophobicContact CB-CG 4.11Å; F1005-Q1090 HydrophobicContact CD1-CB 3.94Å; F1005-Q1090 HydrophobicContact CD1-CG 4.25Å; F1005-T1173 VanDerWaalsContact CD1-OG1 3.22Å; F1005-T1173 WeakPolarHBondContact CD1-OG1 3.28Å; F1005-T1173 WeakPolarHBondContact O-CG2 3.48Å; F1005-L1174 HydrophobicContact CE1-CB 4.28Å
1006	N	86	Confident	85.7	Confident	117 Å²	117	68 Å²	68	63%	0.626	34%	0.335	S	S	*	.			trans	-75.6	-25.2	-178.1	-69	-38.9	0	0	0	111.8	K1004 P1036 D1075	K1004-N1006 PolarHBondContact O-N 3.09Å; N1006-P1036 WeakPolarHBondContact O-CB 3.33Å; N1006-D1075 PolarHBondContact N-OD2 3.06Å
1007	G	85.7	Confident	86.2	Confident	0 Å²	0	67 Å²	67	0%	0	32%	0.324	C	S	.	.			trans	100.8	18.7	178.6	0	0	0	0	0	114.4	F1005 D1075 T1204	F1005-G1007 VanDerWaalsContact C-N 3.33Å; G1007-D1075 PolarHBondContact N-OD1 3.05Å; G1007-T1204 PolarHBondContact O-OG1 2.97Å
1008	L	92	Very high	86.5	Confident	23 Å²	23	63.3 Å²	63.3	12%	0.12	31%	0.305	C	S	.	.			trans	-82	126.2	172	-178.2	77.4	0	0	0	109.5	R1033 I1034 P1036 F1074 D1075	L1008-R1033 HydrophobicContact CD1-CG 4.29Å; L1008-I1034 WeakPolarHBondContact CD1-O 3.28Å; L1008-P1036 HydrophobicContact CB-CG 4.08Å; L1008-F1074 WeakPolarHBondContact O-CA 3.4Å; L1008-D1075 WeakPolarHBondContact CB-OD1 3.27Å; L1008-D1075 PolarHBondContact N-OD1 2.69Å; L1008-D1075 PolarHBondContact O-N 3.47Å
1009	I	92.7	Very high	86.7	Confident	0 Å²	0	65.4 Å²	65.4	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	128	179.2	-53.4	167	0	0	0	109.4	F1005 F1011 R1033 I1034 L1057 I1072 F1073 F1074 L1174 I1206	F1005-I1009 HydrophobicContact CZ-CG1 4.19Å; I1009-F1011 HydrophobicContact CG2-CD2 4.23Å; I1009-F1011 HydrophobicContact CG2-CE2 3.74Å; I1009-F1011 HydrophobicContact CG2-CZ 4.24Å; I1009-R1033 CarbonylContact O-C 3.56Å; I1009-R1033 WeakPolarHBondContact O-CA 3.28Å; I1009-I1034 HydrophobicContact CB-CB 4.05Å; I1009-I1034 HydrophobicContact CB-CD1 4.34Å; I1009-I1034 HydrophobicContact CB-CG1 4.41Å; I1009-I1034 HydrophobicContact CD1-CD1 4.36Å; I1009-I1034 PolarHBondContact N-O 2.98Å; I1009-I1034 VanDerWaalsContact N-O 3.11Å; I1009-I1034 PolarHBondContact O-N 2.94Å; I1009-L1057 HydrophobicContact CD1-CD2 4.36Å; I1009-L1057 HydrophobicContact CG2-CD2 3.65Å; I1009-I1072 HydrophobicContact CG2-CG2 4.33Å; I1009-F1073 WeakPolarHBondContact CA-O 3.39Å; I1009-F1074 HydrophobicContact CB-CE1 4.48Å; I1009-F1074 HydrophobicContact CD1-CE1 4.24Å; I1009-F1074 HydrophobicContact CG1-CD1 4.06Å; I1009-F1074 HydrophobicContact CG1-CE1 3.86Å; I1009-F1074 HydrophobicContact CG2-CD1 4.26Å; I1009-F1074 HydrophobicContact CG2-CE1 4Å; I1009-L1174 HydrophobicContact CD1-CD1 3.68Å; I1009-L1174 HydrophobicContact CD1-CD2 3.5Å; I1009-L1174 HydrophobicContact CD1-CG 4.23Å; I1009-I1206 HydrophobicContact CD1-CD1 4.21Å
1010	E	92	Very high	86.6	Confident	24 Å²	24	63.3 Å²	63.3	11%	0.112	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	123.9	176.4	-61.6	179.4	176.8	0	0	110.8	K1012 R1033 I1072 F1073	E1010-K1012 WeakPolarHBondContact OE2-CE 3.47Å; E1010-K1012 IonicContact OE2-NZ 2.78Å; E1010-K1012 PolarHBondContact OE2-NZ 3.29Å; E1010-R1033 HydrophobicContact CG-CB 4.34Å; E1010-R1033 HydrophobicContact CG-CG 3.85Å; E1010-R1033 IonicContact OE1-CZ 3.24Å; E1010-R1033 VanDerWaalsContact OE1-CZ 3.24Å; E1010-R1033 IonicContact OE1-NE 2.77Å; E1010-R1033 PolarHBondContact OE1-NE 2.91Å; E1010-R1033 IonicContact OE1-NH2 3.4Å; E1010-R1033 PolarHBondContact OE1-NH2 2.73Å; E1010-I1072 CarbonylContact O-C 3.59Å; E1010-I1072 VanDerWaalsContact O-CA 3.32Å; E1010-I1072 WeakPolarHBondContact O-CA 3.32Å; E1010-F1073 HydrophobicContact CB-CB 4.22Å; E1010-F1073 PolarHBondContact N-O 3.01Å; E1010-F1073 PolarHBondContact O-N 3.41Å
1011	F	91.4	Very high	86.5	Confident	8 Å²	8	66.8 Å²	66.8	4%	0.035	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	124.9	166.3	-60.9	-97.6	0	0	0	108.2	I1009 V1014 F1030 T1031 Y1032 I1034 L1053 L1057 I1072	I1009-F1011 HydrophobicContact CG2-CD2 4.23Å; I1009-F1011 HydrophobicContact CG2-CE2 3.74Å; I1009-F1011 HydrophobicContact CG2-CZ 4.24Å; F1011-V1014 HydrophobicContact CB-CG2 4.16Å; F1011-V1014 HydrophobicContact CD1-CG2 4.23Å; F1011-F1030 HydrophobicContact CB-CD1 3.72Å; F1011-F1030 HydrophobicContact CB-CE1 3.76Å; F1011-F1030 AromaticContact CD1-CD1 3.93Å; F1011-F1030 HydrophobicContact CD1-CD1 3.93Å; F1011-F1030 AromaticContact CD1-CE1 3.84Å; F1011-F1030 HydrophobicContact CD1-CE1 3.84Å; F1011-F1030 AromaticContact CD2-CE1 3.82Å; F1011-F1030 HydrophobicContact CD2-CE1 3.82Å; F1011-F1030 HydrophobicContact CE1-CE1 4.35Å; F1011-F1030 HydrophobicContact CE2-CE1 4.32Å; F1011-F1030 AromaticContact CG-CD1 3.85Å; F1011-F1030 HydrophobicContact CG-CD1 3.85Å; F1011-F1030 AromaticContact CG-CE1 3.54Å; F1011-F1030 HydrophobicContact CG-CE1 3.54Å; F1011-T1031 CarbonylContact O-C 3.58Å; F1011-T1031 VanDerWaalsContact O-CA 3.27Å; F1011-T1031 WeakPolarHBondContact O-CA 3.39Å; F1011-T1031 WeakPolarHBondContact O-CG2 3.34Å; F1011-Y1032 PolarHBondContact N-O 3.34Å; F1011-Y1032 PolarHBondContact O-N 3.39Å; F1011-I1034 HydrophobicContact CE2-CD1 4.04Å; F1011-L1053 HydrophobicContact CD1-CD2 4.25Å; F1011-L1053 HydrophobicContact CE1-CD2 3.86Å; F1011-L1053 HydrophobicContact CZ-CD2 4.42Å; F1011-L1057 HydrophobicContact CE1-CD2 4.21Å; F1011-L1057 HydrophobicContact CE1-CG 4.35Å; F1011-L1057 HydrophobicContact CE2-CD2 4.39Å; F1011-L1057 HydrophobicContact CZ-CD1 3.99Å; F1011-L1057 HydrophobicContact CZ-CD2 3.66Å; F1011-L1057 HydrophobicContact CZ-CG 3.84Å; F1011-I1072 HydrophobicContact CD1-CD1 4Å; F1011-I1072 HydrophobicContact CD1-CG1 3.72Å; F1011-I1072 HydrophobicContact CD1-CG2 4.24Å; F1011-I1072 HydrophobicContact CE1-CD1 3.82Å; F1011-I1072 HydrophobicContact CE1-CG1 4.02Å; F1011-I1072 HydrophobicContact CE1-CG2 4.15Å
1012	K	89.8	Confident	86.4	Confident	73 Å²	73	68.6 Å²	68.6	32%	0.317	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	110.5	178	-64.6	-178.9	-177.9	158.6	0	109.7	E1010 V1014 H1069 N1070 G1071 F1073	E1010-K1012 WeakPolarHBondContact OE2-CE 3.47Å; E1010-K1012 IonicContact OE2-NZ 2.78Å; E1010-K1012 PolarHBondContact OE2-NZ 3.29Å; K1012-V1014 VanDerWaalsContact C-N 3.35Å; K1012-V1014 PolarHBondContact O-N 3.37Å; K1012-H1069 WeakPolarHBondContact CB-O 3.34Å; K1012-N1070 WeakPolarHBondContact O-CA 3.17Å; K1012-G1071 PolarHBondContact N-O 2.91Å; K1012-G1071 PolarHBondContact O-N 2.91Å; K1012-F1073 HydrophobicContact CB-CE2 4.13Å; K1012-F1073 HydrophobicContact CD-CD2 4.08Å; K1012-F1073 HydrophobicContact CD-CE2 3.71Å; K1012-F1073 HydrophobicContact CD-CZ 4.37Å; K1012-F1073 HydrophobicContact CG-CD2 4.32Å; K1012-F1073 HydrophobicContact CG-CE2 4.1Å
1013	H	88	Confident	86.6	Confident	84 Å²	84	66.1 Å²	66.1	39%	0.389	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	51	47.2	173.5	-60.6	-59	0	0	0	114.4	N1015 N1029 F1030 T1031 N1070	H1013-N1015 PolarHBondContact O-N 3.17Å; H1013-N1029 WeakPolarHBondContact CA-OD1 3.09Å; H1013-N1029 WeakPolarHBondContact CB-OD1 3.22Å; H1013-N1029 VanDerWaalsContact CG-OD1 3.28Å; H1013-N1029 PolarHBondContact ND1-OD1 2.95Å; H1013-F1030 PolarHBondContact N-O 3.21Å; H1013-T1031 PolarHBondContact N-OG1 3.01Å; H1013-N1070 HydrophobicContact CB-CB 4.4Å
1014	V	88.7	Confident	86.9	Confident	0 Å²	0	61.7 Å²	61.7	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	116	-174.2	-179.5	0	0	0	0	110.9	F1011 K1012 L1027 N1029 F1030 L1056 P1063 G1071 I1072	F1011-V1014 HydrophobicContact CB-CG2 4.16Å; F1011-V1014 HydrophobicContact CD1-CG2 4.23Å; K1012-V1014 VanDerWaalsContact C-N 3.35Å; K1012-V1014 PolarHBondContact O-N 3.37Å; V1014-L1027 HydrophobicContact CG1-CD1 4.3Å; V1014-N1029 PolarHBondContact O-N 3.22Å; V1014-F1030 HydrophobicContact CB-CB 4.36Å; V1014-F1030 PolarHBondContact N-O 3.36Å; V1014-F1030 PolarHBondContact O-N 2.91Å; V1014-L1056 HydrophobicContact CG1-CD1 4.23Å; V1014-P1063 HydrophobicContact CG1-CB 4.11Å; V1014-P1063 HydrophobicContact CG1-CG 3.99Å; V1014-G1071 WeakPolarHBondContact CG2-O 3.48Å; V1014-I1072 HydrophobicContact CG2-CG1 3.99Å
1015	N	90.4	Very high	87.1	Confident	36 Å²	36	59.6 Å²	59.6	19%	0.193	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	140.4	167.1	-69.2	-39	0	0	0	109.5	H1013 L1027 N1028 N1029 P1063 T1064 D1065	H1013-N1015 PolarHBondContact O-N 3.17Å; N1015-L1027 WeakPolarHBondContact CA-O 3.5Å; N1015-N1028 WeakPolarHBondContact OD1-CA 3.35Å; N1015-N1029 WeakPolarHBondContact OD1-CA 3.45Å; N1015-N1029 PolarHBondContact OD1-N 3.02Å; N1015-P1063 CarbonylContact O-C 3.51Å; N1015-P1063 WeakPolarHBondContact O-CB 3.44Å; N1015-T1064 PolarHBondContact O-N 3.05Å; N1015-D1065 HydrophobicContact CB-CB 4.2Å; N1015-D1065 WeakPolarHBondContact CB-OD2 3.4Å; N1015-D1065 PolarHBondContact ND2-OD2 3.29Å
1016	F	90.6	Very high	87.2	Confident	3 Å²	3	60.4 Å²	60.4	1%	0.013	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	141.6	178.3	-178.8	-103.1	0	0	0	113.9	Y1018 V1026 L1027 T1052 L1056 Y1061 D1062 T1064	F1016-Y1018 AromaticContact CE1-CD1 3.83Å; F1016-Y1018 HydrophobicContact CE1-CD1 3.83Å; F1016-Y1018 AromaticContact CE1-CD2 3.9Å; F1016-Y1018 HydrophobicContact CE1-CD2 3.9Å; F1016-Y1018 AromaticContact CE1-CE1 3.85Å; F1016-Y1018 HydrophobicContact CE1-CE1 3.85Å; F1016-Y1018 AromaticContact CE1-CE2 3.92Å; F1016-Y1018 HydrophobicContact CE1-CE2 3.92Å; F1016-Y1018 AromaticContact CE1-CG 3.85Å; F1016-Y1018 HydrophobicContact CE1-CG 3.85Å; F1016-Y1018 AromaticContact CE1-CZ 3.88Å; F1016-Y1018 AromaticContact CZ-CD1 3.92Å; F1016-Y1018 HydrophobicContact CZ-CD1 3.92Å; F1016-Y1018 HydrophobicContact CZ-CE1 4.1Å; F1016-Y1018 HydrophobicContact CZ-CG 4.24Å; F1016-V1026 HydrophobicContact CD1-CB 4.4Å; F1016-V1026 PolarHBondContact O-N 3.46Å; F1016-L1027 HydrophobicContact CB-CB 4.01Å; F1016-L1027 HydrophobicContact CB-CD1 4.1Å; F1016-L1027 HydrophobicContact CB-CG 4.26Å; F1016-L1027 PolarHBondContact N-O 3.24Å; F1016-L1027 VanDerWaalsContact N-O 3.11Å; F1016-L1027 PolarHBondContact O-N 3.21Å; F1016-T1052 HydrophobicContact CD1-CG2 3.3Å; F1016-T1052 HydrophobicContact CE1-CG2 3.45Å; F1016-T1052 VanDerWaalsContact CE1-CG2 3.45Å; F1016-T1052 HydrophobicContact CG-CG2 4.24Å; F1016-T1052 HydrophobicContact CZ-CG2 4.49Å; F1016-L1056 HydrophobicContact CB-CD1 4.21Å; F1016-L1056 HydrophobicContact CD2-CD1 4.48Å; F1016-L1056 HydrophobicContact CD2-CD2 3.81Å; F1016-L1056 HydrophobicContact CE2-CD2 3.93Å; F1016-L1056 HydrophobicContact CG-CD1 4.2Å; F1016-L1056 HydrophobicContact CG-CD2 4.3Å; F1016-Y1061 VanDerWaalsContact CE2-CB 3.5Å; F1016-Y1061 HydrophobicContact CE2-CG 4.08Å; F1016-Y1061 HydrophobicContact CZ-CD1 4.25Å; F1016-Y1061 HydrophobicContact CZ-CD2 4.08Å; F1016-Y1061 AromaticContact CZ-CG 3.74Å; F1016-Y1061 HydrophobicContact CZ-CG 3.74Å; F1016-D1062 WeakPolarHBondContact CD2-O 3.44Å; F1016-D1062 WeakPolarHBondContact CE2-O 3.37Å; F1016-T1064 WeakPolarHBondContact CA-OG1 3.26Å
1017	R	89.7	Confident	87.4	Confident	86 Å²	86	54.9 Å²	54.9	33%	0.325	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	137.8	172.3	-49.1	-168.1	-170.3	-162.3	5.2	109.1	P1022 K1025 T1064	R1017-P1022 WeakPolarHBondContact CD-O 3.42Å; R1017-P1022 PolarHBondContact NH1-O 3.5Å; R1017-K1025 HydrophobicContact CG-CG 4.11Å; R1017-T1064 HydrophobicContact CG-CG2 4.48Å; R1017-T1064 PolarHBondContact N-OG1 3.02Å
1018	Y	88	Confident	87.4	Confident	44 Å²	44	56.6 Å²	56.6	17%	0.173	28%	0.275	C	S	.	.			trans	-68.8	136.4	174.3	-80.1	-77.2	0	0	0	110.7	F1016 T1020 R1021 V1026 T1052 Q1055 Y1061	F1016-Y1018 AromaticContact CE1-CD1 3.83Å; F1016-Y1018 HydrophobicContact CE1-CD1 3.83Å; F1016-Y1018 AromaticContact CE1-CD2 3.9Å; F1016-Y1018 HydrophobicContact CE1-CD2 3.9Å; F1016-Y1018 AromaticContact CE1-CE1 3.85Å; F1016-Y1018 HydrophobicContact CE1-CE1 3.85Å; F1016-Y1018 AromaticContact CE1-CE2 3.92Å; F1016-Y1018 HydrophobicContact CE1-CE2 3.92Å; F1016-Y1018 AromaticContact CE1-CG 3.85Å; F1016-Y1018 HydrophobicContact CE1-CG 3.85Å; F1016-Y1018 AromaticContact CE1-CZ 3.88Å; F1016-Y1018 AromaticContact CZ-CD1 3.92Å; F1016-Y1018 HydrophobicContact CZ-CD1 3.92Å; F1016-Y1018 HydrophobicContact CZ-CE1 4.1Å; F1016-Y1018 HydrophobicContact CZ-CG 4.24Å; Y1018-T1020 PolarHBondContact O-N 3.26Å; Y1018-T1020 VanDerWaalsContact O-N 3.13Å; Y1018-R1021 CarbonylContact O-C 3.4Å; Y1018-R1021 PolarHBondContact O-N 3.43Å; Y1018-V1026 HydrophobicContact CD2-CG2 3.8Å; Y1018-V1026 HydrophobicContact CE2-CG2 4.01Å; Y1018-T1052 HydrophobicContact CE2-CG2 4.33Å; Y1018-T1052 PolarHBondContact OH-OG1 3.21Å; Y1018-Q1055 PolarHBondContact OH-OE1 3.41Å; Y1018-Y1061 HydrophobicContact CD1-CE1 4.2Å; Y1018-Y1061 HydrophobicContact CD1-CE2 4.5Å; Y1018-Y1061 HydrophobicContact CE1-CD2 4.37Å; Y1018-Y1061 HydrophobicContact CE1-CE1 4.3Å; Y1018-Y1061 AromaticContact CE1-CE2 3.82Å; Y1018-Y1061 HydrophobicContact CE1-CE2 3.82Å; Y1018-Y1061 AromaticContact CE1-CZ 3.78Å
1019	P	84.2	Confident	87.1	Confident	80 Å²	80	59.2 Å²	59.2	52%	0.519	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-28	-179.8	-26.3	34.4	0	0	0	114.5	R1021 Y1061	P1019-R1021 VanDerWaalsContact C-N 3.35Å; P1019-Y1061 HydrophobicContact CG-CD1 4.43Å
1020	T	81.6	Confident	87	Confident	62 Å²	62	59.4 Å²	59.4	38%	0.38	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.2	-17.2	177.6	50.8	0	0	0	0	113.4	D783 R784 Y1018	D783-T1020 HydrophobicContact CB-CG2 3.74Å; R784-T1020 HydrophobicContact CG-CG2 4.47Å; Y1018-T1020 PolarHBondContact O-N 3.26Å; Y1018-T1020 VanDerWaalsContact O-N 3.13Å
1021	R	84.1	Confident	86.9	Confident	177 Å²	177	61.3 Å²	61.3	67%	0.668	30%	0.304	S	S	*	.			trans	-137.2	69.4	-179.5	-62.3	-176.4	-176.9	174.5	1.2	110.1	Y1018 P1019 E1023 T1024	Y1018-R1021 CarbonylContact O-C 3.4Å; Y1018-R1021 PolarHBondContact O-N 3.43Å; P1019-R1021 VanDerWaalsContact C-N 3.35Å; R1021-E1023 PolarHBondContact O-N 3.18Å; R1021-E1023 VanDerWaalsContact O-N 3.16Å; R1021-T1024 WeakPolarHBondContact CB-OG1 3.38Å; R1021-T1024 PolarHBondContact O-N 3.09Å; R1021-T1024 PolarHBondContact O-OG1 2.94Å
1022	P	80.9	Confident	86.9	Confident	72 Å²	72	62.8 Å²	62.8	47%	0.468	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65	-19.5	-174	26.8	-35.4	0	0	0	113.7	R1017	R1017-P1022 WeakPolarHBondContact CD-O 3.42Å; R1017-P1022 PolarHBondContact NH1-O 3.5Å
1023	E	81.8	Confident	87	Confident	164 Å²	164	65.6 Å²	65.6	77%	0.766	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.9	-29.6	-179.7	-57.6	-54.8	153.9	0	0	113.4	R1021	R1021-E1023 PolarHBondContact O-N 3.18Å; R1021-E1023 VanDerWaalsContact O-N 3.16Å
1024	T	81.7	Confident	87.2	Confident	75 Å²	75	61.8 Å²	61.8	46%	0.46	30%	0.301	S	S	.	.			trans	-95.7	116.6	-175	52.6	0	0	0	0	111.3	R1021	R1021-T1024 WeakPolarHBondContact CB-OG1 3.38Å; R1021-T1024 PolarHBondContact O-N 3.09Å; R1021-T1024 PolarHBondContact O-OG1 2.94Å
1025	K	83.9	Confident	87.3	Confident	119 Å²	119	66.4 Å²	66.4	52%	0.517	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	127.8	170.8	-67	-176.1	-178.3	-178.4	0	110.4	R1017 N1028	R1017-K1025 HydrophobicContact CG-CG 4.11Å; K1025-N1028 WeakPolarHBondContact CB-OD1 3.36Å; K1025-N1028 WeakPolarHBondContact CD-OD1 3.5Å
1026	V	88.5	Confident	87.3	Confident	22 Å²	22	67.7 Å²	67.7	13%	0.133	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	-42.6	179.4	-179.2	0	0	0	0	111.3	F1016 Y1018 T1052 G1227	F1016-V1026 HydrophobicContact CD1-CB 4.4Å; F1016-V1026 PolarHBondContact O-N 3.46Å; Y1018-V1026 HydrophobicContact CD2-CG2 3.8Å; Y1018-V1026 HydrophobicContact CE2-CG2 4.01Å; V1026-T1052 HydrophobicContact CG1-CG2 4.21Å; V1026-G1227 WeakPolarHBondContact O-CA 3.34Å
1027	L	89.3	Confident	87.2	Confident	0 Å²	0	69.6 Å²	69.6	0%	0	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	137.3	174.9	-62.4	176.9	0	0	0	110.4	V1014 N1015 F1016 T1052 L1053 L1056	V1014-L1027 HydrophobicContact CG1-CD1 4.3Å; N1015-L1027 WeakPolarHBondContact CA-O 3.5Å; F1016-L1027 HydrophobicContact CB-CB 4.01Å; F1016-L1027 HydrophobicContact CB-CD1 4.1Å; F1016-L1027 HydrophobicContact CB-CG 4.26Å; F1016-L1027 PolarHBondContact N-O 3.24Å; F1016-L1027 VanDerWaalsContact N-O 3.11Å; F1016-L1027 PolarHBondContact O-N 3.21Å; L1027-T1052 HydrophobicContact CD1-CG2 4.31Å; L1027-L1053 HydrophobicContact CD1-CD2 3.7Å; L1027-L1053 HydrophobicContact CD1-CG 4.31Å; L1027-L1053 HydrophobicContact CD2-CD2 4.32Å; L1027-L1053 HydrophobicContact CD2-CG 4.38Å; L1027-L1056 HydrophobicContact CD1-CD1 3.53Å
1028	N	86.7	Confident	87.2	Confident	36 Å²	36	66 Å²	66	19%	0.193	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	90.2	-173.4	-73.5	-42.2	0	0	0	110.8	N1015 K1025 N1226 G1227 R1228	N1015-N1028 WeakPolarHBondContact OD1-CA 3.35Å; K1025-N1028 WeakPolarHBondContact CB-OD1 3.36Å; K1025-N1028 WeakPolarHBondContact CD-OD1 3.5Å; N1028-N1226 PolarHBondContact ND2-O 3.28Å; N1028-G1227 PolarHBondContact N-O 2.96Å; N1028-R1228 HydrophobicContact CB-CG 4.14Å; N1028-R1228 WeakPolarHBondContact O-CG 3.4Å; N1028-R1228 PolarHBondContact O-NE 3.44Å
1029	N	86	Confident	87.3	Confident	78 Å²	78	66.1 Å²	66.1	42%	0.417	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	63.8	38.3	175.2	-159.8	29.3	0	0	0	113.3	H1013 V1014 N1015 T1031	H1013-N1029 WeakPolarHBondContact CA-OD1 3.09Å; H1013-N1029 WeakPolarHBondContact CB-OD1 3.22Å; H1013-N1029 VanDerWaalsContact CG-OD1 3.28Å; H1013-N1029 PolarHBondContact ND1-OD1 2.95Å; V1014-N1029 PolarHBondContact O-N 3.22Å; N1015-N1029 WeakPolarHBondContact OD1-CA 3.45Å; N1015-N1029 PolarHBondContact OD1-N 3.02Å; N1029-T1031 PolarHBondContact O-N 2.92Å; N1029-T1031 PolarHBondContact O-OG1 3.29Å
1030	F	89.2	Confident	87.7	Confident	4 Å²	4	62.4 Å²	62.4	2%	0.018	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	126.9	-176.8	-179.5	-91.3	0	0	0	111.4	F1011 H1013 V1014 L1053 L1224 I1229	F1011-F1030 HydrophobicContact CB-CD1 3.72Å; F1011-F1030 HydrophobicContact CB-CE1 3.76Å; F1011-F1030 AromaticContact CD1-CD1 3.93Å; F1011-F1030 HydrophobicContact CD1-CD1 3.93Å; F1011-F1030 AromaticContact CD1-CE1 3.84Å; F1011-F1030 HydrophobicContact CD1-CE1 3.84Å; F1011-F1030 AromaticContact CD2-CE1 3.82Å; F1011-F1030 HydrophobicContact CD2-CE1 3.82Å; F1011-F1030 HydrophobicContact CE1-CE1 4.35Å; F1011-F1030 HydrophobicContact CE2-CE1 4.32Å; F1011-F1030 AromaticContact CG-CD1 3.85Å; F1011-F1030 HydrophobicContact CG-CD1 3.85Å; F1011-F1030 AromaticContact CG-CE1 3.54Å; F1011-F1030 HydrophobicContact CG-CE1 3.54Å; H1013-F1030 PolarHBondContact N-O 3.21Å; V1014-F1030 HydrophobicContact CB-CB 4.36Å; V1014-F1030 PolarHBondContact N-O 3.36Å; V1014-F1030 PolarHBondContact O-N 2.91Å; F1030-L1053 HydrophobicContact CD1-CD2 3.76Å; F1030-L1053 HydrophobicContact CE1-CD1 4.21Å; F1030-L1053 HydrophobicContact CE1-CD2 3.72Å; F1030-L1053 HydrophobicContact CE2-CD1 3.99Å; F1030-L1053 HydrophobicContact CG-CD2 4.23Å; F1030-L1053 HydrophobicContact CZ-CD1 3.79Å; F1030-L1053 HydrophobicContact CZ-CD2 4.15Å; F1030-L1224 HydrophobicContact CD2-CD2 3.75Å; F1030-L1224 HydrophobicContact CE2-CD2 3.52Å; F1030-I1229 HydrophobicContact CD2-CD1 4.12Å; F1030-I1229 HydrophobicContact CD2-CG1 3.74Å; F1030-I1229 HydrophobicContact CE2-CD1 3.51Å; F1030-I1229 HydrophobicContact CE2-CG1 3.31Å; F1030-I1229 HydrophobicContact CZ-CD1 3.9Å; F1030-I1229 HydrophobicContact CZ-CG1 4.19Å
1031	T	90.3	Very high	88.1	Confident	65 Å²	65	59.5 Å²	59.5	40%	0.399	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	122.7	-177.1	-56.8	0	0	0	0	110	F1011 H1013 N1029 I1229	F1011-T1031 CarbonylContact O-C 3.58Å; F1011-T1031 VanDerWaalsContact O-CA 3.27Å; F1011-T1031 WeakPolarHBondContact O-CA 3.39Å; F1011-T1031 WeakPolarHBondContact O-CG2 3.34Å; H1013-T1031 PolarHBondContact N-OG1 3.01Å; N1029-T1031 PolarHBondContact O-N 2.92Å; N1029-T1031 PolarHBondContact O-OG1 3.29Å; T1031-I1229 WeakPolarHBondContact O-CD1 3.39Å
1032	Y	91.2	Very high	88.5	Confident	39 Å²	39	51.4 Å²	51.4	15%	0.153	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.9	153.6	179.2	-165.7	-99.8	0	0	0	112.1	F1011 I1034 I1040 I1222 I1229 Y1232	F1011-Y1032 PolarHBondContact N-O 3.34Å; F1011-Y1032 PolarHBondContact O-N 3.39Å; Y1032-I1034 HydrophobicContact CD1-CG1 3.87Å; Y1032-I1034 HydrophobicContact CE1-CG1 4.02Å; Y1032-I1040 HydrophobicContact CE1-CD1 3.87Å; Y1032-I1222 HydrophobicContact CD1-CD1 3.55Å; Y1032-I1222 HydrophobicContact CD2-CD1 4.08Å; Y1032-I1222 HydrophobicContact CE1-CD1 3.45Å; Y1032-I1222 VanDerWaalsContact CE1-CD1 3.45Å; Y1032-I1222 HydrophobicContact CE1-CG1 4.37Å; Y1032-I1222 HydrophobicContact CE2-CD1 3.95Å; Y1032-I1222 HydrophobicContact CE2-CG1 4.25Å; Y1032-I1222 HydrophobicContact CG-CD1 3.88Å; Y1032-I1229 HydrophobicContact CD2-CD1 3.76Å; Y1032-I1229 HydrophobicContact CG-CD1 4.08Å; Y1032-Y1232 HydrophobicContact CE2-CD2 4.32Å; Y1032-Y1232 HydrophobicContact CE2-CG 4.35Å
1033	R	92.5	Very high	88.8	Confident	131 Å²	131	48.7 Å²	48.7	49%	0.494	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	123.2	178.9	179.2	168.4	-164.3	-153	-2.6	111.3	L1008 I1009 E1010	L1008-R1033 HydrophobicContact CD1-CG 4.29Å; I1009-R1033 CarbonylContact O-C 3.56Å; I1009-R1033 WeakPolarHBondContact O-CA 3.28Å; E1010-R1033 HydrophobicContact CG-CB 4.34Å; E1010-R1033 HydrophobicContact CG-CG 3.85Å; E1010-R1033 IonicContact OE1-CZ 3.24Å; E1010-R1033 VanDerWaalsContact OE1-CZ 3.24Å; E1010-R1033 IonicContact OE1-NE 2.77Å; E1010-R1033 PolarHBondContact OE1-NE 2.91Å; E1010-R1033 IonicContact OE1-NH2 3.4Å; E1010-R1033 PolarHBondContact OE1-NH2 2.73Å
1034	I	92.2	Very high	88.9	Confident	5 Å²	5	41.3 Å²	41.3	3%	0.026	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	124	-179.5	-55.5	-176.1	0	0	0	108.8	L1008 I1009 F1011 Y1032 I1040 T1204 I1206	L1008-I1034 WeakPolarHBondContact CD1-O 3.28Å; I1009-I1034 HydrophobicContact CB-CB 4.05Å; I1009-I1034 HydrophobicContact CB-CD1 4.34Å; I1009-I1034 HydrophobicContact CB-CG1 4.41Å; I1009-I1034 HydrophobicContact CD1-CD1 4.36Å; I1009-I1034 PolarHBondContact N-O 2.98Å; I1009-I1034 VanDerWaalsContact N-O 3.11Å; I1009-I1034 PolarHBondContact O-N 2.94Å; F1011-I1034 HydrophobicContact CE2-CD1 4.04Å; Y1032-I1034 HydrophobicContact CD1-CG1 3.87Å; Y1032-I1034 HydrophobicContact CE1-CG1 4.02Å; I1034-I1040 HydrophobicContact CB-CD1 3.84Å; I1034-I1040 HydrophobicContact CD1-CD1 3.98Å; I1034-I1040 HydrophobicContact CG1-CD1 3.53Å; I1034-I1040 HydrophobicContact CG2-CD1 3.51Å; I1034-I1040 HydrophobicContact CG2-CG1 4.48Å; I1034-T1204 HydrophobicContact CG2-CG2 3.61Å; I1034-I1206 HydrophobicContact CD1-CD1 3.48Å; I1034-I1206 VanDerWaalsContact CD1-CD1 3.48Å; I1034-I1206 HydrophobicContact CD1-CG1 4.01Å
1035	Q	91.4	Very high	88.8	Confident	96 Å²	96	43.4 Å²	43.4	45%	0.449	23%	0.225	S	C	.	.	P	Polyproline II helix	trans	-81.4	148.9	179.8	-64.1	-63	-20.1	0	0	111.7	G1037 S1038	Q1035-G1037 PolarHBondContact O-N 2.85Å; Q1035-S1038 PolarHBondContact N-OG 3.48Å; Q1035-S1038 WeakPolarHBondContact O-CB 3.27Å; Q1035-S1038 PolarHBondContact O-N 2.65Å; Q1035-S1038 PolarHBondContact O-OG 3.26Å
1036	P	89.8	Confident	88.5	Confident	63 Å²	63	43 Å²	43	41%	0.409	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.3	133.4	172	-29.7	37.8	0	0	0	112.9	N1006 L1008 S1038	N1006-P1036 WeakPolarHBondContact O-CB 3.33Å; L1008-P1036 HydrophobicContact CB-CG 4.08Å; P1036-S1038 PolarHBondContact O-N 2.89Å
1037	G	87.1	Confident	88	Confident	43 Å²	43	45.5 Å²	45.5	44%	0.443	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	74	-3.7	178.8	0	0	0	0	0	115.5	Q1035 T1204	Q1035-G1037 PolarHBondContact O-N 2.85Å; G1037-T1204 PolarHBondContact N-OG1 3.36Å
1038	S	90.5	Very high	87.7	Confident	11 Å²	11	46 Å²	46	8%	0.077	27%	0.27	C	S	.	.			trans	-74.1	145.7	177.6	65.9	0	0	0	0	112.4	Q1035 P1036 T1204 S1205	Q1035-S1038 PolarHBondContact N-OG 3.48Å; Q1035-S1038 WeakPolarHBondContact O-CB 3.27Å; Q1035-S1038 PolarHBondContact O-N 2.65Å; Q1035-S1038 PolarHBondContact O-OG 3.26Å; P1036-S1038 PolarHBondContact O-N 2.89Å; S1038-T1204 WeakPolarHBondContact O-CA 3.28Å; S1038-S1205 PolarHBondContact O-N 3.29Å
1039	K	91.2	Very high	87.6	Confident	47 Å²	47	44.4 Å²	44.4	20%	0.204	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	123.6	173.1	-58.1	165.7	-176.4	179.7	0	108	M1200 S1205 V1218 D1219 Y1220	K1039-M1200 HydrophobicContact CB-CE 3.86Å; K1039-M1200 HydrophobicContact CD-CE 3.67Å; K1039-M1200 HydrophobicContact CG-CE 3.61Å; K1039-S1205 CarbonylContact C-O 3.6Å; K1039-S1205 WeakPolarHBondContact CA-O 3.48Å; K1039-V1218 HydrophobicContact CB-CG1 4.13Å; K1039-V1218 WeakPolarHBondContact O-CG1 3.41Å; K1039-D1219 PolarHBondContact N-OD2 2.97Å; K1039-D1219 WeakPolarHBondContact O-CB 3.07Å; K1039-D1219 PolarHBondContact O-N 3.09Å; K1039-Y1220 PolarHBondContact O-N 3.46Å
1040	I	91.8	Very high	87.7	Confident	2 Å²	2	41.3 Å²	41.3	1%	0.01	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	135.2	-176.4	-60.7	-176.9	0	0	0	110.6	Y1032 I1034 S1205 I1206 I1207 Y1220 I1222	Y1032-I1040 HydrophobicContact CE1-CD1 3.87Å; I1034-I1040 HydrophobicContact CB-CD1 3.84Å; I1034-I1040 HydrophobicContact CD1-CD1 3.98Å; I1034-I1040 HydrophobicContact CG1-CD1 3.53Å; I1034-I1040 HydrophobicContact CG2-CD1 3.51Å; I1034-I1040 HydrophobicContact CG2-CG1 4.48Å; I1040-S1205 PolarHBondContact N-O 3.34Å; I1040-I1206 CarbonylContact O-C 3.52Å; I1040-I1206 WeakPolarHBondContact O-CA 3.34Å; I1040-I1207 PolarHBondContact O-N 3.32Å; I1040-Y1220 CarbonylContact C-O 3.51Å; I1040-Y1220 VanDerWaalsContact CA-O 3.29Å; I1040-Y1220 WeakPolarHBondContact CA-O 3.44Å; I1040-I1222 HydrophobicContact CG2-CD1 3.6Å; I1040-I1222 HydrophobicContact CG2-CG1 3.91Å
1041	A	90.8	Very high	87.7	Confident	0 Å²	0	43 Å²	43	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	131.1	173.3	0	0	0	0	0	110.4	V1043 I1207 I1215 V1218 Y1220 I1221 I1222	A1041-V1043 HydrophobicContact CB-CG2 4.4Å; A1041-I1207 CarbonylContact C-O 3.59Å; A1041-I1207 VanDerWaalsContact CA-O 3.29Å; A1041-I1207 WeakPolarHBondContact CA-O 3.45Å; A1041-I1215 HydrophobicContact CB-CG1 4.34Å; A1041-I1215 HydrophobicContact CB-CG2 4.15Å; A1041-V1218 HydrophobicContact CB-CB 4.43Å; A1041-V1218 HydrophobicContact CB-CG1 3.9Å; A1041-V1218 HydrophobicContact CB-CG2 4.32Å; A1041-V1218 VanDerWaalsContact N-CG1 3.34Å; A1041-Y1220 PolarHBondContact N-O 3.47Å; A1041-I1221 HydrophobicContact CB-CG1 4.27Å; A1041-I1221 HydrophobicContact CB-CG2 4.47Å; A1041-I1221 CarbonylContact O-C 3.6Å; A1041-I1221 WeakPolarHBondContact O-CA 3.43Å; A1041-I1222 PolarHBondContact O-N 3.08Å
1042	L	90.6	Very high	87.7	Confident	8 Å²	8	40.3 Å²	40.3	4%	0.042	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	116	171.6	-60.4	179.1	0	0	0	108.7	L1053 I1206 I1207 I1208 I1222 L1224	L1042-L1053 HydrophobicContact CD1-CB 4.32Å; L1042-L1053 HydrophobicContact CD1-CD1 4.01Å; L1042-L1053 HydrophobicContact CD2-CD1 4.41Å; L1042-I1206 HydrophobicContact CD1-CG2 3.68Å; L1042-I1206 HydrophobicContact CG-CG2 3.94Å; L1042-I1207 PolarHBondContact N-O 3.27Å; L1042-I1208 HydrophobicContact CB-CG1 4.14Å; L1042-I1208 HydrophobicContact CD1-CG1 4.15Å; L1042-I1222 HydrophobicContact CD2-CB 3.97Å; L1042-I1222 HydrophobicContact CD2-CD1 3.99Å; L1042-I1222 HydrophobicContact CD2-CG1 4.45Å; L1042-I1222 HydrophobicContact CD2-CG2 4.36Å; L1042-L1224 HydrophobicContact CB-CD1 4.44Å; L1042-L1224 HydrophobicContact CD2-CD1 4.31Å
1043	V	87.8	Confident	87.7	Confident	14 Å²	14	38.6 Å²	38.6	9%	0.085	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	151.7	-175.8	-174.2	0	0	0	0	109	A1041 I1215 I1221 I1222 V1223 L1224 F1245 L1248	A1041-V1043 HydrophobicContact CB-CG2 4.4Å; V1043-I1215 HydrophobicContact CG2-CD1 3.71Å; V1043-I1221 HydrophobicContact CB-CG2 4.4Å; V1043-I1221 HydrophobicContact CG2-CG2 3.82Å; V1043-I1222 PolarHBondContact N-O 3.36Å; V1043-V1223 CarbonylContact O-C 2.94Å; V1043-V1223 WeakPolarHBondContact O-CA 3.46Å; V1043-L1224 PolarHBondContact O-N 2.9Å; V1043-F1245 HydrophobicContact CG1-CD2 4.48Å; V1043-F1245 HydrophobicContact CG1-CE2 4.4Å; V1043-F1245 HydrophobicContact CG2-CE2 4.38Å; V1043-L1248 HydrophobicContact CG1-CD1 3.94Å
1044	G	83.5	Confident	87.7	Confident	9 Å²	9	32.4 Å²	32.4	9%	0.093	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	153.9	169.6	-178.6	0	0	0	0	0	112.4	K1050 L1224	G1044-K1050 WeakPolarHBondContact O-CE 3.29Å; G1044-K1050 PolarHBondContact O-NZ 2.9Å; G1044-L1224 WeakPolarHBondContact CA-O 3.2Å
1045	Q	81	Confident	87.7	Confident	119 Å²	119	33.5 Å²	33.5	56%	0.556	22%	0.217	S	C	*	.	S	Bend	trans	-62.1	159.8	179.9	-62.9	-177.3	3.2	0	0	112.6	G1047 C1048	Q1045-G1047 PolarHBondContact O-N 2.86Å; Q1045-C1048 WeakPolarHBondContact O-CB 3.46Å; Q1045-C1048 PolarHBondContact O-N 3.21Å; Q1045-C1048 PolarHBondContact O-SG 2.82Å
1046	S	77.9	Confident	87.7	Confident	111 Å²	111	29 Å²	29	78%	0.776	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.3	132	175.1	-66.7	0	0	0	0	111.2
1047	G	76.9	Confident	87.9	Confident	75 Å²	75	26.1 Å²	26.1	77%	0.773	18%	0.177	S	C	*	.	T	Hydrogen-bonded Turn	trans	83.1	2.3	179.9	0	0	0	0	0	115.9	Q1045 G1049	Q1045-G1047 PolarHBondContact O-N 2.86Å; G1047-G1049 PolarHBondContact O-N 3.24Å
1048	C	82.9	Confident	88.1	Confident	9 Å²	9	24.2 Å²	24.2	6%	0.061	16%	0.156	C	C	.	.	S	Bend	trans	-73.7	-5.5	178.7	72.3	0	0	0	0	115	Q1045 L1224 G1227	Q1045-C1048 WeakPolarHBondContact O-CB 3.46Å; Q1045-C1048 PolarHBondContact O-N 3.21Å; Q1045-C1048 PolarHBondContact O-SG 2.82Å; C1048-L1224 HydrophobicContact CB-CB 4.44Å; C1048-L1224 WeakPolarHBondContact CB-O 3.33Å; C1048-L1224 PolarHBondContact SG-O 3.43Å; C1048-G1227 WeakPolarHBondContact O-CA 3.4Å; C1048-G1227 PolarHBondContact O-N 2.83Å
1049	G	84.8	Confident	88.2	Confident	3 Å²	3	24.6 Å²	24.6	3%	0.031	16%	0.156	C	C	.	.	S	Bend	trans	109.1	7.7	175.5	0	0	0	0	0	116.5	G1047 T1052 L1053	G1047-G1049 PolarHBondContact O-N 3.24Å; G1049-T1052 VanDerWaalsContact O-CB 3.31Å; G1049-T1052 WeakPolarHBondContact O-CB 3.44Å; G1049-T1052 PolarHBondContact O-N 2.88Å; G1049-L1053 PolarHBondContact O-N 3.03Å; G1049-L1053 VanDerWaalsContact O-N 3.11Å
1050	K	88.2	Confident	88.2	Confident	13 Å²	13	22.9 Å²	22.9	6%	0.057	15%	0.149	C	C	.	.	H	α-helix	trans	-51.2	-62	179.3	-62.5	176	-60.1	-178.7	0	112.9	G1044 T1052 L1053 I1208 L1224	G1044-K1050 WeakPolarHBondContact O-CE 3.29Å; G1044-K1050 PolarHBondContact O-NZ 2.9Å; K1050-T1052 PolarHBondContact O-N 3.3Å; K1050-L1053 WeakPolarHBondContact O-CB 3.5Å; K1050-L1053 PolarHBondContact O-N 3.06Å; K1050-L1053 VanDerWaalsContact O-N 3.15Å; K1050-I1208 VanDerWaalsContact C-CD1 3.41Å; K1050-I1208 HydrophobicContact CB-CD1 3.94Å; K1050-I1208 HydrophobicContact CB-CG1 4.19Å; K1050-I1208 HydrophobicContact CB-CG2 4.02Å; K1050-I1208 HydrophobicContact CD-CG2 4.16Å; K1050-I1208 WeakPolarHBondContact O-CD1 3.48Å; K1050-L1224 HydrophobicContact CG-CD1 3.96Å
1051	S	88.6	Confident	88.2	Confident	40 Å²	40	23.2 Å²	23.2	28%	0.28	15%	0.15	S	C	.	.	H	α-helix	trans	-65.9	-28.1	-178.9	-46.9	0	0	0	0	111.9	L1053 I1054 Q1055 D1178	S1051-L1053 VanDerWaalsContact C-N 3.33Å; S1051-L1053 PolarHBondContact O-N 3.32Å; S1051-I1054 PolarHBondContact O-N 3.48Å; S1051-Q1055 VanDerWaalsContact O-CG 3.31Å; S1051-Q1055 WeakPolarHBondContact O-CG 3.44Å; S1051-Q1055 PolarHBondContact O-N 3.4Å; S1051-D1178 PolarHBondContact OG-OD1 3.17Å
1052	T	91	Very high	88.1	Confident	9 Å²	9	25 Å²	25	6%	0.055	16%	0.159	C	C	.	.	H	α-helix	trans	-62.6	-38.4	175.1	-51.3	0	0	0	0	111.8	F1016 Y1018 V1026 L1027 G1049 K1050 I1054 Q1055 L1056	F1016-T1052 HydrophobicContact CD1-CG2 3.3Å; F1016-T1052 HydrophobicContact CE1-CG2 3.45Å; F1016-T1052 VanDerWaalsContact CE1-CG2 3.45Å; F1016-T1052 HydrophobicContact CG-CG2 4.24Å; F1016-T1052 HydrophobicContact CZ-CG2 4.49Å; Y1018-T1052 HydrophobicContact CE2-CG2 4.33Å; Y1018-T1052 PolarHBondContact OH-OG1 3.21Å; V1026-T1052 HydrophobicContact CG1-CG2 4.21Å; L1027-T1052 HydrophobicContact CD1-CG2 4.31Å; G1049-T1052 VanDerWaalsContact O-CB 3.31Å; G1049-T1052 WeakPolarHBondContact O-CB 3.44Å; G1049-T1052 PolarHBondContact O-N 2.88Å; K1050-T1052 PolarHBondContact O-N 3.3Å; T1052-I1054 PolarHBondContact O-N 3.14Å; T1052-Q1055 PolarHBondContact O-N 2.94Å; T1052-L1056 HydrophobicContact CG2-CD1 4.29Å; T1052-L1056 HydrophobicContact CG2-CG 4.45Å; T1052-L1056 VanDerWaalsContact O-CG 3.31Å; T1052-L1056 WeakPolarHBondContact O-CG 3.18Å; T1052-L1056 PolarHBondContact O-N 3.43Å
1053	L	91.6	Very high	87.9	Confident	3 Å²	3	25.3 Å²	25.3	2%	0.016	16%	0.162	C	C	.	.	H	α-helix	trans	-61.7	-43.5	175.1	-69.8	169.1	0	0	0	112	F1011 L1027 F1030 L1042 G1049 K1050 S1051 Q1055 L1056 L1057 L1224	F1011-L1053 HydrophobicContact CD1-CD2 4.25Å; F1011-L1053 HydrophobicContact CE1-CD2 3.86Å; F1011-L1053 HydrophobicContact CZ-CD2 4.42Å; L1027-L1053 HydrophobicContact CD1-CD2 3.7Å; L1027-L1053 HydrophobicContact CD1-CG 4.31Å; L1027-L1053 HydrophobicContact CD2-CD2 4.32Å; L1027-L1053 HydrophobicContact CD2-CG 4.38Å; F1030-L1053 HydrophobicContact CD1-CD2 3.76Å; F1030-L1053 HydrophobicContact CE1-CD1 4.21Å; F1030-L1053 HydrophobicContact CE1-CD2 3.72Å; F1030-L1053 HydrophobicContact CE2-CD1 3.99Å; F1030-L1053 HydrophobicContact CG-CD2 4.23Å; F1030-L1053 HydrophobicContact CZ-CD1 3.79Å; F1030-L1053 HydrophobicContact CZ-CD2 4.15Å; L1042-L1053 HydrophobicContact CD1-CB 4.32Å; L1042-L1053 HydrophobicContact CD1-CD1 4.01Å; L1042-L1053 HydrophobicContact CD2-CD1 4.41Å; G1049-L1053 PolarHBondContact O-N 3.03Å; G1049-L1053 VanDerWaalsContact O-N 3.11Å; K1050-L1053 WeakPolarHBondContact O-CB 3.5Å; K1050-L1053 PolarHBondContact O-N 3.06Å; K1050-L1053 VanDerWaalsContact O-N 3.15Å; S1051-L1053 VanDerWaalsContact C-N 3.33Å; S1051-L1053 PolarHBondContact O-N 3.32Å; L1053-Q1055 VanDerWaalsContact C-N 3.33Å; L1053-Q1055 PolarHBondContact O-N 3.46Å; L1053-L1056 PolarHBondContact O-N 2.93Å; L1053-L1057 WeakPolarHBondContact O-CG 3.48Å; L1053-L1057 PolarHBondContact O-N 3.33Å; L1053-L1224 HydrophobicContact CD1-CD1 3.64Å; L1053-L1224 HydrophobicContact CD1-CD2 4.44Å
1054	I	91.9	Very high	87.6	Confident	1 Å²	1	27.5 Å²	27.5	1%	0.005	18%	0.176	C	C	.	.	H	α-helix	trans	-62.6	-39.5	175.1	-73.5	-170.1	0	0	0	111.5	S1051 T1052 L1057 Q1058 I1093 L1176 D1178 I1208	S1051-I1054 PolarHBondContact O-N 3.48Å; T1052-I1054 PolarHBondContact O-N 3.14Å; I1054-L1057 PolarHBondContact O-N 2.96Å; I1054-Q1058 WeakPolarHBondContact O-CG 3.1Å; I1054-Q1058 PolarHBondContact O-N 3.44Å; I1054-Q1058 PolarHBondContact O-NE2 3.29Å; I1054-Q1058 VanDerWaalsContact O-NE2 3.12Å; I1054-I1093 HydrophobicContact CG2-CD1 4.25Å; I1054-L1176 HydrophobicContact CD1-CB 4.33Å; I1054-L1176 HydrophobicContact CG2-CB 4.25Å; I1054-L1176 HydrophobicContact CG2-CD1 4.01Å; I1054-D1178 HydrophobicContact CD1-CB 4.05Å; I1054-I1208 HydrophobicContact CB-CD1 4.48Å; I1054-I1208 HydrophobicContact CD1-CD1 3.34Å; I1054-I1208 HydrophobicContact CD1-CG1 3.71Å; I1054-I1208 HydrophobicContact CG1-CD1 3.81Å; I1054-I1208 HydrophobicContact CG1-CG1 4.39Å
1055	Q	92.3	Very high	86.9	Confident	27 Å²	27	31 Å²	31	13%	0.126	19%	0.192	C	C	.	.	H	α-helix	trans	-68.9	-36.4	178	-69.3	172.8	3.6	0	0	112.4	Y1018 S1051 T1052 L1053 Q1058 R1059 F1060 Y1061	Y1018-Q1055 PolarHBondContact OH-OE1 3.41Å; S1051-Q1055 VanDerWaalsContact O-CG 3.31Å; S1051-Q1055 WeakPolarHBondContact O-CG 3.44Å; S1051-Q1055 PolarHBondContact O-N 3.4Å; T1052-Q1055 PolarHBondContact O-N 2.94Å; L1053-Q1055 VanDerWaalsContact C-N 3.33Å; L1053-Q1055 PolarHBondContact O-N 3.46Å; Q1055-Q1058 PolarHBondContact O-N 3.34Å; Q1055-R1059 PolarHBondContact O-N 3.45Å; Q1055-F1060 HydrophobicContact CB-CD2 4.18Å; Q1055-F1060 HydrophobicContact CG-CD2 4.17Å; Q1055-F1060 WeakPolarHBondContact O-CB 3.39Å; Q1055-F1060 PolarHBondContact O-N 3.36Å; Q1055-F1060 VanDerWaalsContact O-N 3.08Å; Q1055-Y1061 HydrophobicContact CB-CD2 4.12Å; Q1055-Y1061 HydrophobicContact CB-CE2 3.94Å; Q1055-Y1061 HydrophobicContact CG-CE2 4.45Å
1056	L	92.5	Very high	86	Confident	2 Å²	2	28.8 Å²	28.8	1%	0.01	18%	0.182	C	C	.	.	H	α-helix	trans	-68.6	-37.9	175	-71.5	173.7	0	0	0	112	V1014 F1016 L1027 T1052 L1053 Q1058 R1059 Y1061 I1072	V1014-L1056 HydrophobicContact CG1-CD1 4.23Å; F1016-L1056 HydrophobicContact CB-CD1 4.21Å; F1016-L1056 HydrophobicContact CD2-CD1 4.48Å; F1016-L1056 HydrophobicContact CD2-CD2 3.81Å; F1016-L1056 HydrophobicContact CE2-CD2 3.93Å; F1016-L1056 HydrophobicContact CG-CD1 4.2Å; F1016-L1056 HydrophobicContact CG-CD2 4.3Å; L1027-L1056 HydrophobicContact CD1-CD1 3.53Å; T1052-L1056 HydrophobicContact CG2-CD1 4.29Å; T1052-L1056 HydrophobicContact CG2-CG 4.45Å; T1052-L1056 VanDerWaalsContact O-CG 3.31Å; T1052-L1056 WeakPolarHBondContact O-CG 3.18Å; T1052-L1056 PolarHBondContact O-N 3.43Å; L1053-L1056 PolarHBondContact O-N 2.93Å; L1056-Q1058 VanDerWaalsContact C-N 3.31Å; L1056-Q1058 PolarHBondContact O-N 3.17Å; L1056-R1059 WeakPolarHBondContact O-CA 3.33Å; L1056-R1059 PolarHBondContact O-N 2.9Å; L1056-Y1061 WeakPolarHBondContact CD2-O 3.18Å; L1056-I1072 HydrophobicContact CB-CD1 3.69Å
1057	L	92.6	Very high	85.2	Confident	2 Å²	2	25.1 Å²	25.1	1%	0.01	16%	0.161	C	C	.	.	H	α-helix	trans	-63.1	-35.7	174.9	-74.8	171.2	0	0	0	113.1	I1009 F1011 L1053 I1054 R1059 I1072 F1074 I1087 L1176 I1206	I1009-L1057 HydrophobicContact CD1-CD2 4.36Å; I1009-L1057 HydrophobicContact CG2-CD2 3.65Å; F1011-L1057 HydrophobicContact CE1-CD2 4.21Å; F1011-L1057 HydrophobicContact CE1-CG 4.35Å; F1011-L1057 HydrophobicContact CE2-CD2 4.39Å; F1011-L1057 HydrophobicContact CZ-CD1 3.99Å; F1011-L1057 HydrophobicContact CZ-CD2 3.66Å; F1011-L1057 HydrophobicContact CZ-CG 3.84Å; L1053-L1057 WeakPolarHBondContact O-CG 3.48Å; L1053-L1057 PolarHBondContact O-N 3.33Å; I1054-L1057 PolarHBondContact O-N 2.96Å; L1057-R1059 PolarHBondContact O-N 3.5Å; L1057-I1072 HydrophobicContact CD2-CG2 3.98Å; L1057-F1074 HydrophobicContact CD2-CE1 3.68Å; L1057-F1074 HydrophobicContact CD2-CZ 4.15Å; L1057-I1087 WeakPolarHBondContact O-CG2 3.45Å; L1057-L1176 HydrophobicContact CB-CD1 4.3Å; L1057-L1176 HydrophobicContact CD1-CD2 4.04Å; L1057-I1206 HydrophobicContact CD1-CD1 3.45Å; L1057-I1206 VanDerWaalsContact CD1-CD1 3.45Å
1058	Q	91.4	Very high	84.5	Confident	4 Å²	4	28.6 Å²	28.6	2%	0.019	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.3	-4	173.2	-70.3	173.2	88.6	0	0	113.4	I1054 Q1055 L1056 F1060 R1088 I1091 I1093 L1176	I1054-Q1058 WeakPolarHBondContact O-CG 3.1Å; I1054-Q1058 PolarHBondContact O-N 3.44Å; I1054-Q1058 PolarHBondContact O-NE2 3.29Å; I1054-Q1058 VanDerWaalsContact O-NE2 3.12Å; Q1055-Q1058 PolarHBondContact O-N 3.34Å; L1056-Q1058 VanDerWaalsContact C-N 3.31Å; L1056-Q1058 PolarHBondContact O-N 3.17Å; Q1058-F1060 VanDerWaalsContact C-N 3.28Å; Q1058-F1060 HydrophobicContact CB-CD1 3.9Å; Q1058-F1060 HydrophobicContact CB-CD2 4.21Å; Q1058-F1060 HydrophobicContact CB-CE1 3.89Å; Q1058-F1060 HydrophobicContact CB-CE2 4.2Å; Q1058-F1060 HydrophobicContact CB-CG 4.09Å; Q1058-F1060 HydrophobicContact CB-CZ 4.06Å; Q1058-F1060 HydrophobicContact CG-CZ 4.48Å; Q1058-F1060 PolarHBondContact O-N 2.87Å; Q1058-R1088 PolarHBondContact O-NE 3.23Å; Q1058-R1088 VanDerWaalsContact O-NE 3.17Å; Q1058-I1091 HydrophobicContact CG-CD1 4.29Å; Q1058-I1091 HydrophobicContact CG-CG2 4.49Å; Q1058-I1093 VanDerWaalsContact CD-CD1 3.48Å; Q1058-I1093 VanDerWaalsContact OE1-CD1 3.24Å; Q1058-L1176 HydrophobicContact CG-CD1 4Å
1059	R	92.1	Very high	84	Confident	19 Å²	19	35.4 Å²	35.4	7%	0.072	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	52.1	48.3	-174.3	-159.5	169.4	175.6	-149.4	-10.8	111.6	I993 Q1055 L1056 L1057 D1062 L1079 R1080 L1082 I1087 R1088	I993-R1059 HydrophobicContact CG2-CG 4.35Å; Q1055-R1059 PolarHBondContact O-N 3.45Å; L1056-R1059 WeakPolarHBondContact O-CA 3.33Å; L1056-R1059 PolarHBondContact O-N 2.9Å; L1057-R1059 PolarHBondContact O-N 3.5Å; R1059-D1062 IonicContact NE-OD1 3.85Å; R1059-D1062 PolarHBondContact NE-OD1 3.07Å; R1059-L1079 VanDerWaalsContact CZ-O 3.26Å; R1059-L1079 PolarHBondContact NE-O 2.83Å; R1059-L1079 PolarHBondContact NH1-O 3.21Å; R1059-R1080 PolarHBondContact NH1-O 3.05Å; R1059-R1080 PolarHBondContact NH2-O 3.28Å; R1059-L1082 PolarHBondContact NH1-O 3.33Å; R1059-I1087 HydrophobicContact CB-CD1 4.36Å; R1059-R1088 PolarHBondContact O-NH2 2.98Å
1060	F	91.7	Very high	83.9	Confident	10 Å²	10	37.8 Å²	37.8	4%	0.044	20%	0.204	C	C	.	.	S	Bend	trans	-78.1	-28.5	167.6	-68.9	-16.4	0	0	0	111.9	I237 A238 I779 Q1055 Q1058	I237-F1060 HydrophobicContact CB-CE1 4.49Å; I237-F1060 HydrophobicContact CG2-CD1 4.33Å; I237-F1060 HydrophobicContact CG2-CE1 3.82Å; A238-F1060 HydrophobicContact CB-CZ 4.14Å; I779-F1060 HydrophobicContact CB-CB 4.26Å; I779-F1060 HydrophobicContact CD1-CB 3.78Å; I779-F1060 HydrophobicContact CD1-CD1 3.31Å; I779-F1060 HydrophobicContact CD1-CD2 3.43Å; I779-F1060 VanDerWaalsContact CD1-CD2 3.43Å; I779-F1060 HydrophobicContact CD1-CE1 3.54Å; I779-F1060 HydrophobicContact CD1-CE2 3.64Å; I779-F1060 HydrophobicContact CD1-CG 3.24Å; I779-F1060 HydrophobicContact CD1-CZ 3.68Å; I779-F1060 HydrophobicContact CG1-CB 4.04Å; I779-F1060 HydrophobicContact CG1-CD1 4.04Å; I779-F1060 HydrophobicContact CG1-CG 4Å; Q1055-F1060 HydrophobicContact CB-CD2 4.18Å; Q1055-F1060 HydrophobicContact CG-CD2 4.17Å; Q1055-F1060 WeakPolarHBondContact O-CB 3.39Å; Q1055-F1060 PolarHBondContact O-N 3.36Å; Q1055-F1060 VanDerWaalsContact O-N 3.08Å; Q1058-F1060 VanDerWaalsContact C-N 3.28Å; Q1058-F1060 HydrophobicContact CB-CD1 3.9Å; Q1058-F1060 HydrophobicContact CB-CD2 4.21Å; Q1058-F1060 HydrophobicContact CB-CE1 3.89Å; Q1058-F1060 HydrophobicContact CB-CE2 4.2Å; Q1058-F1060 HydrophobicContact CB-CG 4.09Å; Q1058-F1060 HydrophobicContact CB-CZ 4.06Å; Q1058-F1060 HydrophobicContact CG-CZ 4.48Å; Q1058-F1060 PolarHBondContact O-N 2.87Å
1061	Y	91.9	Very high	83.8	Confident	9 Å²	9	37.4 Å²	37.4	4%	0.035	20%	0.203	C	C	.	.	S	Bend	trans	-136.6	155	171.4	-41.9	-88.6	0	0	0	108.1	I779 D783 F1016 Y1018 P1019 Q1055 L1056	I779-Y1061 HydrophobicContact CB-CE1 4.47Å; I779-Y1061 WeakPolarHBondContact CG2-OH 3.49Å; D783-Y1061 WeakPolarHBondContact OD2-CE1 3.31Å; D783-Y1061 PolarHBondContact OD2-OH 3.15Å; F1016-Y1061 VanDerWaalsContact CE2-CB 3.5Å; F1016-Y1061 HydrophobicContact CE2-CG 4.08Å; F1016-Y1061 HydrophobicContact CZ-CD1 4.25Å; F1016-Y1061 HydrophobicContact CZ-CD2 4.08Å; F1016-Y1061 AromaticContact CZ-CG 3.74Å; F1016-Y1061 HydrophobicContact CZ-CG 3.74Å; Y1018-Y1061 HydrophobicContact CD1-CE1 4.2Å; Y1018-Y1061 HydrophobicContact CD1-CE2 4.5Å; Y1018-Y1061 HydrophobicContact CE1-CD2 4.37Å; Y1018-Y1061 HydrophobicContact CE1-CE1 4.3Å; Y1018-Y1061 AromaticContact CE1-CE2 3.82Å; Y1018-Y1061 HydrophobicContact CE1-CE2 3.82Å; Y1018-Y1061 AromaticContact CE1-CZ 3.78Å; P1019-Y1061 HydrophobicContact CG-CD1 4.43Å; Q1055-Y1061 HydrophobicContact CB-CD2 4.12Å; Q1055-Y1061 HydrophobicContact CB-CE2 3.94Å; Q1055-Y1061 HydrophobicContact CG-CE2 4.45Å; L1056-Y1061 WeakPolarHBondContact CD2-O 3.18Å
1062	D	89	Confident	83.9	Confident	37 Å²	37	35.7 Å²	35.7	20%	0.198	19%	0.191	C	C	.	.			trans	-92.4	152	163.4	-75.4	-21.6	0	0	0	108.3	F1016 R1059	F1016-D1062 WeakPolarHBondContact CD2-O 3.44Å; F1016-D1062 WeakPolarHBondContact CE2-O 3.37Å; R1059-D1062 IonicContact NE-OD1 3.85Å; R1059-D1062 PolarHBondContact NE-OD1 3.07Å
1063	P	87.4	Confident	84	Confident	16 Å²	16	36 Å²	36	10%	0.104	19%	0.192	C	C	.	.			trans	-48.1	175.6	167.1	-27.9	34.5	0	0	0	114.4	V1014 N1015 H1066 I1072	V1014-P1063 HydrophobicContact CG1-CB 4.11Å; V1014-P1063 HydrophobicContact CG1-CG 3.99Å; N1015-P1063 CarbonylContact O-C 3.51Å; N1015-P1063 WeakPolarHBondContact O-CB 3.44Å; P1063-H1066 VanDerWaalsContact CA-CE1 3.5Å; P1063-H1066 WeakPolarHBondContact CA-CE1 3.32Å; P1063-H1066 PolarHBondContact O-CE1 3.43Å; P1063-H1066 PolarHBondContact O-NE2 3.14Å; P1063-I1072 HydrophobicContact CG-CD1 4.5Å
1064	T	81.4	Confident	83.9	Confident	60 Å²	60	36 Å²	36	37%	0.368	19%	0.192	S	C	.	.	S	Bend	trans	-95	-44.1	177.4	-51.6	0	0	0	0	112.2	N1015 F1016 R1017	N1015-T1064 PolarHBondContact O-N 3.05Å; F1016-T1064 WeakPolarHBondContact CA-OG1 3.26Å; R1017-T1064 HydrophobicContact CG-CG2 4.48Å; R1017-T1064 PolarHBondContact N-OG1 3.02Å
1065	D	68.3	Low	83.7	Confident	83 Å²	83	38.4 Å²	38.4	44%	0.444	21%	0.205	S	C	.	.	S	Bend	trans	-99.5	119.6	179	-64.4	-31.2	0	0	0	109.4	N1015	N1015-D1065 HydrophobicContact CB-CB 4.2Å; N1015-D1065 WeakPolarHBondContact CB-OD2 3.4Å; N1015-D1065 PolarHBondContact ND2-OD2 3.29Å
1066	H	60.8	Low	83.4	Confident	72 Å²	72	39.4 Å²	39.4	33%	0.333	22%	0.222	S	C	.	.			trans	-128.2	99.5	-172.5	-53.2	-65.4	0	0	0	111.7	P1063	P1063-H1066 VanDerWaalsContact CA-CE1 3.5Å; P1063-H1066 WeakPolarHBondContact CA-CE1 3.32Å; P1063-H1066 PolarHBondContact O-CE1 3.43Å; P1063-H1066 PolarHBondContact O-NE2 3.14Å
1067	G	62.3	Low	83.2	Confident	33 Å²	33	42.1 Å²	42.1	34%	0.34	24%	0.236	S	C	.	.			trans	-95	166.7	161.9	0	0	0	0	0	110.7	H1069 N1070	G1067-H1069 PolarHBondContact O-N 2.9Å; G1067-N1070 PolarHBondContact O-N 2.98Å; G1067-N1070 VanDerWaalsContact O-N 3.17Å
1068	L	62.5	Low	83	Confident	149 Å²	149	42.8 Å²	42.8	78%	0.78	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56	-29.9	170.2	-79.2	156.2	0	0	0	112.3
1069	H	72	Confident	82.8	Confident	151 Å²	151	43 Å²	43	70%	0.699	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-100.8	-6.8	-179.7	-57.4	-61.9	0	0	0	114.4	K1012 G1067	K1012-H1069 WeakPolarHBondContact CB-O 3.34Å; G1067-H1069 PolarHBondContact O-N 2.9Å
1070	N	82.5	Confident	82.5	Confident	54 Å²	54	48 Å²	48	29%	0.289	26%	0.259	S	S	.	.	S	Bend	trans	-111.8	128.8	-177.5	-59.4	-9.6	0	0	0	109.6	K1012 H1013 G1067	K1012-N1070 WeakPolarHBondContact O-CA 3.17Å; H1013-N1070 HydrophobicContact CB-CB 4.4Å; G1067-N1070 PolarHBondContact O-N 2.98Å; G1067-N1070 VanDerWaalsContact O-N 3.17Å
1071	G	86.8	Confident	82.2	Confident	4 Å²	4	52.6 Å²	52.6	4%	0.041	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	149.4	-158.1	-175.3	0	0	0	0	0	112.1	K1012 V1014	K1012-G1071 PolarHBondContact N-O 2.91Å; K1012-G1071 PolarHBondContact O-N 2.91Å; V1014-G1071 WeakPolarHBondContact CG2-O 3.48Å
1072	I	91.2	Very high	82.1	Confident	4 Å²	4	52.2 Å²	52.2	2%	0.021	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	133.6	-178.5	-53.1	172.1	0	0	0	107.5	I1009 E1010 F1011 V1014 L1056 L1057 P1063 L1079	I1009-I1072 HydrophobicContact CG2-CG2 4.33Å; E1010-I1072 CarbonylContact O-C 3.59Å; E1010-I1072 VanDerWaalsContact O-CA 3.32Å; E1010-I1072 WeakPolarHBondContact O-CA 3.32Å; F1011-I1072 HydrophobicContact CD1-CD1 4Å; F1011-I1072 HydrophobicContact CD1-CG1 3.72Å; F1011-I1072 HydrophobicContact CD1-CG2 4.24Å; F1011-I1072 HydrophobicContact CE1-CD1 3.82Å; F1011-I1072 HydrophobicContact CE1-CG1 4.02Å; F1011-I1072 HydrophobicContact CE1-CG2 4.15Å; V1014-I1072 HydrophobicContact CG2-CG1 3.99Å; L1056-I1072 HydrophobicContact CB-CD1 3.69Å; L1057-I1072 HydrophobicContact CD2-CG2 3.98Å; P1063-I1072 HydrophobicContact CG-CD1 4.5Å; I1072-L1079 HydrophobicContact CB-CD1 3.59Å; I1072-L1079 HydrophobicContact CB-CG 4.05Å; I1072-L1079 HydrophobicContact CD1-CD1 4.24Å; I1072-L1079 HydrophobicContact CG2-CD1 3.45Å; I1072-L1079 VanDerWaalsContact CG2-CD1 3.45Å; I1072-L1079 HydrophobicContact CG2-CG 3.98Å; I1072-L1079 PolarHBondContact O-N 3.38Å
1073	F	91.3	Very high	82.1	Confident	17 Å²	17	50.4 Å²	50.4	8%	0.075	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	136.4	-174.5	-57.2	-104.1	0	0	0	110.8	I1009 E1010 K1012 G1076 I1077 N1078	I1009-F1073 WeakPolarHBondContact CA-O 3.39Å; E1010-F1073 HydrophobicContact CB-CB 4.22Å; E1010-F1073 PolarHBondContact N-O 3.01Å; E1010-F1073 PolarHBondContact O-N 3.41Å; K1012-F1073 HydrophobicContact CB-CE2 4.13Å; K1012-F1073 HydrophobicContact CD-CD2 4.08Å; K1012-F1073 HydrophobicContact CD-CE2 3.71Å; K1012-F1073 HydrophobicContact CD-CZ 4.37Å; K1012-F1073 HydrophobicContact CG-CD2 4.32Å; K1012-F1073 HydrophobicContact CG-CE2 4.1Å; F1073-G1076 WeakPolarHBondContact CD1-O 3.47Å; F1073-I1077 CarbonylContact C-O 3.59Å; F1073-I1077 WeakPolarHBondContact CA-O 3.44Å; F1073-N1078 HydrophobicContact CD1-CB 3.86Å; F1073-N1078 HydrophobicContact CE1-CB 3.7Å; F1073-N1078 HydrophobicContact CZ-CB 4.39Å
1074	F	90.5	Very high	82.2	Confident	2 Å²	2	49.7 Å²	49.7	1%	0.009	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	118.7	171.3	-83.4	14.6	0	0	0	108.2	F1005 L1008 I1009 L1057 G1076 I1077 L1079 L1082 W1086 I1087 I1091 L1174	F1005-F1074 HydrophobicContact CD2-CB 4.21Å; F1005-F1074 HydrophobicContact CD2-CD2 4.41Å; F1005-F1074 HydrophobicContact CE1-CD2 4.07Å; F1005-F1074 HydrophobicContact CE1-CE2 4.15Å; F1005-F1074 HydrophobicContact CE2-CB 3.56Å; F1005-F1074 HydrophobicContact CE2-CD1 4.42Å; F1005-F1074 AromaticContact CE2-CD2 3.87Å; F1005-F1074 HydrophobicContact CE2-CD2 3.87Å; F1005-F1074 AromaticContact CE2-CG 3.72Å; F1005-F1074 HydrophobicContact CE2-CG 3.72Å; F1005-F1074 HydrophobicContact CZ-CB 4.11Å; F1005-F1074 HydrophobicContact CZ-CD1 4.12Å; F1005-F1074 AromaticContact CZ-CD2 3.68Å; F1005-F1074 HydrophobicContact CZ-CD2 3.68Å; F1005-F1074 HydrophobicContact CZ-CE1 4.48Å; F1005-F1074 HydrophobicContact CZ-CE2 4.06Å; F1005-F1074 AromaticContact CZ-CG 3.72Å; F1005-F1074 HydrophobicContact CZ-CG 3.72Å; F1005-F1074 HydrophobicContact CZ-CZ 4.46Å; L1008-F1074 WeakPolarHBondContact O-CA 3.4Å; I1009-F1074 HydrophobicContact CB-CE1 4.48Å; I1009-F1074 HydrophobicContact CD1-CE1 4.24Å; I1009-F1074 HydrophobicContact CG1-CD1 4.06Å; I1009-F1074 HydrophobicContact CG1-CE1 3.86Å; I1009-F1074 HydrophobicContact CG2-CD1 4.26Å; I1009-F1074 HydrophobicContact CG2-CE1 4Å; L1057-F1074 HydrophobicContact CD2-CE1 3.68Å; L1057-F1074 HydrophobicContact CD2-CZ 4.15Å; F1074-G1076 PolarHBondContact O-N 3.47Å; F1074-I1077 PolarHBondContact N-O 3.17Å; F1074-I1077 PolarHBondContact O-N 2.93Å; F1074-L1079 HydrophobicContact CB-CD2 4.45Å; F1074-L1079 HydrophobicContact CD1-CD2 3.74Å; F1074-L1079 HydrophobicContact CD1-CG 4.34Å; F1074-L1079 HydrophobicContact CD2-CD2 3.78Å; F1074-L1079 HydrophobicContact CE1-CD1 4.46Å; F1074-L1079 HydrophobicContact CE1-CD2 3.83Å; F1074-L1079 HydrophobicContact CE1-CG 4.45Å; F1074-L1079 HydrophobicContact CE2-CD2 3.89Å; F1074-L1079 HydrophobicContact CG-CD2 3.71Å; F1074-L1079 HydrophobicContact CZ-CD2 3.9Å; F1074-L1082 HydrophobicContact CB-CD1 4Å; F1074-W1086 HydrophobicContact CD2-CZ3 4.47Å; F1074-I1087 HydrophobicContact CE2-CG2 3.88Å; F1074-I1087 HydrophobicContact CZ-CG2 4.38Å; F1074-I1091 HydrophobicContact CZ-CD1 4.44Å; F1074-L1174 HydrophobicContact CZ-CD2 4.06Å
1075	D	88	Confident	82.5	Confident	52 Å²	52	50.5 Å²	50.5	28%	0.278	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	48	35.1	-175.3	-63.4	-17.8	0	0	0	113.4	F1005 N1006 G1007 L1008	F1005-D1075 WeakPolarHBondContact CA-OD2 3.06Å; F1005-D1075 HydrophobicContact CD2-CB 4.44Å; F1005-D1075 WeakPolarHBondContact CD2-OD2 3.41Å; N1006-D1075 PolarHBondContact N-OD2 3.06Å; G1007-D1075 PolarHBondContact N-OD1 3.05Å; L1008-D1075 WeakPolarHBondContact CB-OD1 3.27Å; L1008-D1075 PolarHBondContact N-OD1 2.69Å; L1008-D1075 PolarHBondContact O-N 3.47Å
1076	G	85.5	Confident	83.6	Confident	47 Å²	47	47.7 Å²	47.7	49%	0.485	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	88	-7.9	-179.3	0	0	0	0	0	115.7	F1073 F1074	F1073-G1076 WeakPolarHBondContact CD1-O 3.47Å; F1074-G1076 PolarHBondContact O-N 3.47Å
1077	I	87.4	Confident	85	Confident	60 Å²	60	44.2 Å²	44.2	31%	0.308	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	130.6	176.9	-53.3	172.5	0	0	0	109.5	P1001 F1073 F1074 L1079 Q1081 L1082	P1001-I1077 HydrophobicContact CG-CD1 4.15Å; F1073-I1077 CarbonylContact C-O 3.59Å; F1073-I1077 WeakPolarHBondContact CA-O 3.44Å; F1074-I1077 PolarHBondContact N-O 3.17Å; F1074-I1077 PolarHBondContact O-N 2.93Å; I1077-L1079 PolarHBondContact O-N 3.39Å; I1077-Q1081 HydrophobicContact CG2-CB 4.16Å; I1077-L1082 HydrophobicContact CB-CD1 4.34Å; I1077-L1082 HydrophobicContact CB-CD2 4.45Å; I1077-L1082 HydrophobicContact CB-CG 4.41Å; I1077-L1082 HydrophobicContact CD1-CD2 4.33Å; I1077-L1082 HydrophobicContact CG2-CD1 4.22Å; I1077-L1082 HydrophobicContact CG2-CD2 3.86Å; I1077-L1082 HydrophobicContact CG2-CG 3.77Å
1078	N	88	Confident	86.4	Confident	16 Å²	16	43.5 Å²	43.5	9%	0.086	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	133.3	178.9	-168.4	-50.1	0	0	0	110.2	F1073 R1080 Q1081	F1073-N1078 HydrophobicContact CD1-CB 3.86Å; F1073-N1078 HydrophobicContact CE1-CB 3.7Å; F1073-N1078 HydrophobicContact CZ-CB 4.39Å; N1078-R1080 PolarHBondContact O-N 2.91Å; N1078-R1080 PolarHBondContact OD1-N 2.82Å; N1078-Q1081 WeakPolarHBondContact O-CB 3.1Å; N1078-Q1081 PolarHBondContact O-N 3.4Å
1079	L	88.1	Confident	87.7	Confident	7 Å²	7	42.5 Å²	42.5	4%	0.037	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.5	-29.8	178.3	-78.5	-175.7	0	0	0	112.8	R1059 I1072 F1074 I1077 Q1081 L1082 I1087	R1059-L1079 VanDerWaalsContact CZ-O 3.26Å; R1059-L1079 PolarHBondContact NE-O 2.83Å; R1059-L1079 PolarHBondContact NH1-O 3.21Å; I1072-L1079 HydrophobicContact CB-CD1 3.59Å; I1072-L1079 HydrophobicContact CB-CG 4.05Å; I1072-L1079 HydrophobicContact CD1-CD1 4.24Å; I1072-L1079 HydrophobicContact CG2-CD1 3.45Å; I1072-L1079 VanDerWaalsContact CG2-CD1 3.45Å; I1072-L1079 HydrophobicContact CG2-CG 3.98Å; I1072-L1079 PolarHBondContact O-N 3.38Å; F1074-L1079 HydrophobicContact CB-CD2 4.45Å; F1074-L1079 HydrophobicContact CD1-CD2 3.74Å; F1074-L1079 HydrophobicContact CD1-CG 4.34Å; F1074-L1079 HydrophobicContact CD2-CD2 3.78Å; F1074-L1079 HydrophobicContact CE1-CD1 4.46Å; F1074-L1079 HydrophobicContact CE1-CD2 3.83Å; F1074-L1079 HydrophobicContact CE1-CG 4.45Å; F1074-L1079 HydrophobicContact CE2-CD2 3.89Å; F1074-L1079 HydrophobicContact CG-CD2 3.71Å; F1074-L1079 HydrophobicContact CZ-CD2 3.9Å; I1077-L1079 PolarHBondContact O-N 3.39Å; L1079-Q1081 VanDerWaalsContact C-N 3.28Å; L1079-Q1081 PolarHBondContact O-N 3.4Å; L1079-L1082 HydrophobicContact CD2-CD1 4.46Å; L1079-L1082 PolarHBondContact O-N 3.16Å; L1079-I1087 HydrophobicContact CB-CD1 4.44Å; L1079-I1087 HydrophobicContact CD2-CD1 3.63Å; L1079-I1087 HydrophobicContact CD2-CG1 3.89Å; L1079-I1087 HydrophobicContact CD2-CG2 4.22Å
1080	R	85.2	Confident	88.5	Confident	126 Å²	126	37 Å²	37	48%	0.475	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-29.1	178.4	-67.5	-175.8	72	-160.7	-0.2	113.9	R1059 N1078	R1059-R1080 PolarHBondContact NH1-O 3.05Å; R1059-R1080 PolarHBondContact NH2-O 3.28Å; N1078-R1080 PolarHBondContact O-N 2.91Å; N1078-R1080 PolarHBondContact OD1-N 2.82Å
1081	Q	86.7	Confident	88.9	Confident	105 Å²	105	34.7 Å²	34.7	49%	0.491	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81	-26.3	178.3	-67.7	173.8	-21.8	0	0	112	G998 D999 I1077 N1078 L1079	G998-Q1081 CarbonylContact C-O 3.49Å; G998-Q1081 WeakPolarHBondContact CA-O 3.39Å; D999-Q1081 PolarHBondContact N-O 3.24Å; I1077-Q1081 HydrophobicContact CG2-CB 4.16Å; N1078-Q1081 WeakPolarHBondContact O-CB 3.1Å; N1078-Q1081 PolarHBondContact O-N 3.4Å; L1079-Q1081 VanDerWaalsContact C-N 3.28Å; L1079-Q1081 PolarHBondContact O-N 3.4Å
1082	L	88.7	Confident	89.2	Confident	1 Å²	1	34.5 Å²	34.5	1%	0.005	16%	0.162	C	C	.	.	B	Isolated β-bridge	trans	-84.2	145.7	-178.1	-65.8	170.3	0	0	0	111.8	D999 P1001 R1059 F1074 I1077 L1079 W1086 I1087	D999-L1082 WeakPolarHBondContact O-CA 3.33Å; P1001-L1082 VanDerWaalsContact CD-CD2 3.5Å; P1001-L1082 HydrophobicContact CG-CD2 3.46Å; P1001-L1082 VanDerWaalsContact CG-CD2 3.46Å; R1059-L1082 PolarHBondContact NH1-O 3.33Å; F1074-L1082 HydrophobicContact CB-CD1 4Å; I1077-L1082 HydrophobicContact CB-CD1 4.34Å; I1077-L1082 HydrophobicContact CB-CD2 4.45Å; I1077-L1082 HydrophobicContact CB-CG 4.41Å; I1077-L1082 HydrophobicContact CD1-CD2 4.33Å; I1077-L1082 HydrophobicContact CG2-CD1 4.22Å; I1077-L1082 HydrophobicContact CG2-CD2 3.86Å; I1077-L1082 HydrophobicContact CG2-CG 3.77Å; L1079-L1082 HydrophobicContact CD2-CD1 4.46Å; L1079-L1082 PolarHBondContact O-N 3.16Å; L1082-W1086 HydrophobicContact CD1-CE3 4.32Å; L1082-W1086 HydrophobicContact CD1-CZ3 3.88Å; L1082-W1086 HydrophobicContact CD2-CE3 4.31Å; L1082-W1086 HydrophobicContact CD2-CZ3 4.22Å; L1082-I1087 HydrophobicContact CB-CD1 3.85Å; L1082-I1087 HydrophobicContact CB-CG1 3.95Å; L1082-I1087 HydrophobicContact CD1-CG1 4.39Å
1083	A	89.8	Confident	89.2	Confident	0 Å²	0	34.9 Å²	34.9	0%	0	16%	0.164	C	C	.	.			trans	-66.7	129.8	173.8	0	0	0	0	0	111.4	Q997 D999 Q1000 Y1085 W1086 I1087	Q997-A1083 WeakPolarHBondContact O-CA 3.34Å; D999-A1083 PolarHBondContact O-N 3.49Å; Q1000-A1083 HydrophobicContact CG-CB 3.86Å; A1083-Y1085 PolarHBondContact O-N 3.47Å; A1083-W1086 HydrophobicContact CB-CB 4.36Å; A1083-W1086 WeakPolarHBondContact O-CB 3.37Å; A1083-W1086 PolarHBondContact O-N 2.87Å; A1083-I1087 PolarHBondContact O-N 3.32Å; A1083-I1087 VanDerWaalsContact O-N 3.09Å
1084	P	89.7	Confident	89.2	Confident	0 Å²	0	34.1 Å²	34.1	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-53.4	-36.7	176.6	-27.3	33.3	0	0	0	114.1	I993 E994 T995 W1086 I1087 R1088	I993-P1084 HydrophobicContact CG2-CB 4.43Å; I993-P1084 HydrophobicContact CG2-CG 3.67Å; E994-P1084 WeakPolarHBondContact O-CD 3.01Å; E994-P1084 WeakPolarHBondContact O-CG 3.23Å; T995-P1084 WeakPolarHBondContact O-CD 3.18Å; P1084-W1086 VanDerWaalsContact C-N 3.34Å; P1084-W1086 PolarHBondContact O-N 2.87Å; P1084-I1087 PolarHBondContact O-N 2.99Å; P1084-R1088 VanDerWaalsContact O-CG 3.28Å; P1084-R1088 WeakPolarHBondContact O-CG 3.28Å; P1084-R1088 PolarHBondContact O-N 2.91Å
1085	Y	88.2	Confident	89.1	Confident	77 Å²	77	36 Å²	36	30%	0.302	17%	0.174	S	C	.	.	H	α-helix	trans	-58.6	-42.9	174.2	176.3	-101.9	0	0	0	112.6	T995 A1083 R1089	T995-Y1085 WeakPolarHBondContact O-CB 3.4Å; T995-Y1085 PolarHBondContact O-N 3.45Å; A1083-Y1085 PolarHBondContact O-N 3.47Å; Y1085-R1089 WeakPolarHBondContact O-CB 3.4Å; Y1085-R1089 PolarHBondContact O-N 2.9Å; Y1085-R1089 VanDerWaalsContact O-N 3.15Å
1086	W	90.3	Very high	89	Confident	24 Å²	24	37.7 Å²	37.7	9%	0.091	18%	0.18	C	C	.	.	H	α-helix	trans	-67.6	-44.2	177.4	-178	98.6	0	0	0	111.2	Q1000 P1001 F1005 F1074 L1082 A1083 P1084 R1088 R1089 Q1090	Q1000-W1086 HydrophobicContact CB-CG 4.48Å; Q1000-W1086 HydrophobicContact CG-CB 4.15Å; P1001-W1086 HydrophobicContact CB-CZ2 3.95Å; P1001-W1086 HydrophobicContact CG-CH2 4.22Å; P1001-W1086 HydrophobicContact CG-CZ2 3.98Å; P1001-W1086 PolarHBondContact O-NE1 3.08Å; F1005-W1086 HydrophobicContact CB-CH2 3.92Å; F1005-W1086 HydrophobicContact CB-CZ2 4.33Å; F1005-W1086 HydrophobicContact CD2-CH2 4.48Å; F1005-W1086 HydrophobicContact CG-CH2 4.35Å; F1074-W1086 HydrophobicContact CD2-CZ3 4.47Å; L1082-W1086 HydrophobicContact CD1-CE3 4.32Å; L1082-W1086 HydrophobicContact CD1-CZ3 3.88Å; L1082-W1086 HydrophobicContact CD2-CE3 4.31Å; L1082-W1086 HydrophobicContact CD2-CZ3 4.22Å; A1083-W1086 HydrophobicContact CB-CB 4.36Å; A1083-W1086 WeakPolarHBondContact O-CB 3.37Å; A1083-W1086 PolarHBondContact O-N 2.87Å; P1084-W1086 VanDerWaalsContact C-N 3.34Å; P1084-W1086 PolarHBondContact O-N 2.87Å; W1086-R1088 PolarHBondContact O-N 3.16Å; W1086-R1089 WeakPolarHBondContact O-CB 3.34Å; W1086-R1089 PolarHBondContact O-N 2.98Å; W1086-Q1090 HydrophobicContact CE3-CG 4.45Å; W1086-Q1090 HydrophobicContact CH2-CG 4.35Å; W1086-Q1090 HydrophobicContact CZ2-CG 4.41Å; W1086-Q1090 HydrophobicContact CZ3-CG 4.36Å; W1086-Q1090 PolarHBondContact O-N 3.21Å
1087	I	90.7	Very high	88.8	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-55.1	-55.1	176.6	-68.2	159.7	0	0	0	110.2	L1057 R1059 F1074 L1079 L1082 A1083 P1084 R1089 Q1090 I1091	L1057-I1087 WeakPolarHBondContact O-CG2 3.45Å; R1059-I1087 HydrophobicContact CB-CD1 4.36Å; F1074-I1087 HydrophobicContact CE2-CG2 3.88Å; F1074-I1087 HydrophobicContact CZ-CG2 4.38Å; L1079-I1087 HydrophobicContact CB-CD1 4.44Å; L1079-I1087 HydrophobicContact CD2-CD1 3.63Å; L1079-I1087 HydrophobicContact CD2-CG1 3.89Å; L1079-I1087 HydrophobicContact CD2-CG2 4.22Å; L1082-I1087 HydrophobicContact CB-CD1 3.85Å; L1082-I1087 HydrophobicContact CB-CG1 3.95Å; L1082-I1087 HydrophobicContact CD1-CG1 4.39Å; A1083-I1087 PolarHBondContact O-N 3.32Å; A1083-I1087 VanDerWaalsContact O-N 3.09Å; P1084-I1087 PolarHBondContact O-N 2.99Å; I1087-R1089 VanDerWaalsContact C-N 3.26Å; I1087-R1089 PolarHBondContact O-N 3.43Å; I1087-Q1090 PolarHBondContact O-N 3.4Å; I1087-Q1090 VanDerWaalsContact O-N 3.09Å; I1087-I1091 HydrophobicContact CG2-CD1 3.84Å; I1087-I1091 WeakPolarHBondContact O-CG1 3.41Å
1088	R	91.1	Very high	88.7	Confident	17 Å²	17	41.1 Å²	41.1	6%	0.064	18%	0.184	C	C	.	.	H	α-helix	trans	-63.1	-33.5	-176	-66.8	170.9	-163.7	154.1	0.9	111.8	I237 E242 Q1058 R1059 P1084 W1086 Q1090 I1091 R1170	I237-R1088 VanDerWaalsContact O-CD 3.27Å; I237-R1088 WeakPolarHBondContact O-CD 3.46Å; E242-R1088 IonicContact OE1-NH1 2.93Å; Q1058-R1088 PolarHBondContact O-NE 3.23Å; Q1058-R1088 VanDerWaalsContact O-NE 3.17Å; R1059-R1088 PolarHBondContact O-NH2 2.98Å; P1084-R1088 VanDerWaalsContact O-CG 3.28Å; P1084-R1088 WeakPolarHBondContact O-CG 3.28Å; P1084-R1088 PolarHBondContact O-N 2.91Å; W1086-R1088 PolarHBondContact O-N 3.16Å; R1088-Q1090 VanDerWaalsContact C-N 3.27Å; R1088-Q1090 PolarHBondContact O-N 2.88Å; R1088-I1091 PolarHBondContact O-N 3.37Å; R1088-I1091 VanDerWaalsContact O-N 3.08Å; R1088-I1091 VanDerWaalsContact O-O 3.12Å; R1088-R1170 PolarHBondContact O-NH1 3.11Å
1089	R	89	Confident	88.7	Confident	129 Å²	129	43.4 Å²	43.4	49%	0.487	20%	0.196	S	C	.	.	H	α-helix	trans	-61.7	-32.2	176.5	-172	176.3	172	-172	-1.5	113.1	Y1085 W1086 I1087 I1091 R1170	Y1085-R1089 WeakPolarHBondContact O-CB 3.4Å; Y1085-R1089 PolarHBondContact O-N 2.9Å; Y1085-R1089 VanDerWaalsContact O-N 3.15Å; W1086-R1089 WeakPolarHBondContact O-CB 3.34Å; W1086-R1089 PolarHBondContact O-N 2.98Å; I1087-R1089 VanDerWaalsContact C-N 3.26Å; I1087-R1089 PolarHBondContact O-N 3.43Å; R1089-I1091 VanDerWaalsContact C-N 3.28Å; R1089-I1091 PolarHBondContact O-N 2.9Å; R1089-R1170 VanDerWaalsContact O-CD 3.29Å; R1089-R1170 WeakPolarHBondContact O-CD 3.27Å
1090	Q	89.9	Confident	88.7	Confident	36 Å²	36	44 Å²	44	17%	0.168	20%	0.199	C	C	.	.	H	α-helix	trans	-78.4	-12.4	177	-54.5	-55.2	-30.7	0	0	113.5	F1005 W1086 I1087 R1088 P1172 T1173 L1174	F1005-Q1090 HydrophobicContact CB-CG 4.11Å; F1005-Q1090 HydrophobicContact CD1-CB 3.94Å; F1005-Q1090 HydrophobicContact CD1-CG 4.25Å; W1086-Q1090 HydrophobicContact CE3-CG 4.45Å; W1086-Q1090 HydrophobicContact CH2-CG 4.35Å; W1086-Q1090 HydrophobicContact CZ2-CG 4.41Å; W1086-Q1090 HydrophobicContact CZ3-CG 4.36Å; W1086-Q1090 PolarHBondContact O-N 3.21Å; I1087-Q1090 PolarHBondContact O-N 3.4Å; I1087-Q1090 VanDerWaalsContact O-N 3.09Å; R1088-Q1090 VanDerWaalsContact C-N 3.27Å; R1088-Q1090 PolarHBondContact O-N 2.88Å; Q1090-P1172 WeakPolarHBondContact O-CB 3.43Å; Q1090-T1173 PolarHBondContact O-N 3.46Å; Q1090-L1174 PolarHBondContact O-N 3.38Å
1091	I	91.4	Very high	88.8	Confident	4 Å²	4	38.1 Å²	38.1	2%	0.021	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	127.1	-173.1	-61.7	175.1	0	0	0	110.5	Q1058 F1074 I1087 R1088 R1089 R1170 L1174 L1176	Q1058-I1091 HydrophobicContact CG-CD1 4.29Å; Q1058-I1091 HydrophobicContact CG-CG2 4.49Å; F1074-I1091 HydrophobicContact CZ-CD1 4.44Å; I1087-I1091 HydrophobicContact CG2-CD1 3.84Å; I1087-I1091 WeakPolarHBondContact O-CG1 3.41Å; R1088-I1091 PolarHBondContact O-N 3.37Å; R1088-I1091 VanDerWaalsContact O-N 3.08Å; R1088-I1091 VanDerWaalsContact O-O 3.12Å; R1089-I1091 VanDerWaalsContact C-N 3.28Å; R1089-I1091 PolarHBondContact O-N 2.9Å; I1091-R1170 VanDerWaalsContact O-CZ 3.25Å; I1091-R1170 PolarHBondContact O-NH1 3.15Å; I1091-L1174 CarbonylContact C-O 3.6Å; I1091-L1174 WeakPolarHBondContact CA-O 3.41Å; I1091-L1174 HydrophobicContact CD1-CD2 4.34Å; I1091-L1174 HydrophobicContact CG1-CB 4.38Å; I1091-L1174 HydrophobicContact CG1-CD2 4.04Å; I1091-L1174 HydrophobicContact CG1-CG 4.48Å; I1091-L1176 HydrophobicContact CD1-CD1 4.37Å; I1091-L1176 HydrophobicContact CG2-CB 4.46Å; I1091-L1176 HydrophobicContact CG2-CD1 3.49Å; I1091-L1176 VanDerWaalsContact CG2-CD1 3.49Å; I1091-L1176 HydrophobicContact CG2-CG 3.76Å
1092	G	91.7	Very high	88.8	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	129.1	160.7	0	0	0	0	0	108.9	L1174 L1175 L1176	G1092-L1174 PolarHBondContact N-O 3.04Å; G1092-L1175 CarbonylContact O-C 3.56Å; G1092-L1175 WeakPolarHBondContact O-CA 3.24Å; G1092-L1176 PolarHBondContact O-N 3.31Å
1093	I	92.5	Very high	88.7	Confident	13 Å²	13	36.7 Å²	36.7	7%	0.067	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	136.3	177.4	-177.2	158.7	0	0	0	111.3	A238 F239 I1054 Q1058 L1176	A238-I1093 HydrophobicContact CB-CG2 3.91Å; F239-I1093 HydrophobicContact CE2-CG2 3.99Å; F239-I1093 HydrophobicContact CZ-CG2 4.15Å; I1054-I1093 HydrophobicContact CG2-CD1 4.25Å; Q1058-I1093 VanDerWaalsContact CD-CD1 3.48Å; Q1058-I1093 VanDerWaalsContact OE1-CD1 3.24Å; I1093-L1176 WeakPolarHBondContact CA-O 3.34Å
1094	V	91.7	Very high	88.8	Confident	1 Å²	1	37 Å²	37	1%	0.006	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	112.6	167.2	-174.3	0	0	0	0	107.3	I1164 A1167 L1176 L1177 D1178 A1180	V1094-I1164 HydrophobicContact CG1-CG1 4.16Å; V1094-I1164 HydrophobicContact CG2-CG1 4.01Å; V1094-A1167 HydrophobicContact CG2-CB 3.97Å; V1094-L1176 PolarHBondContact N-O 3.18Å; V1094-L1177 HydrophobicContact CB-CD2 3.72Å; V1094-L1177 HydrophobicContact CG2-CD2 3.67Å; V1094-D1178 PolarHBondContact O-N 3.13Å; V1094-A1180 HydrophobicContact CB-CB 4.44Å; V1094-A1180 HydrophobicContact CG1-CB 3.81Å
1095	S	88.3	Confident	89	Confident	42 Å²	42	37 Å²	37	29%	0.294	18%	0.175	S	C	.	.			trans	-88.1	162.6	-179.1	-56.4	0	0	0	0	111.9	E1097 D1178	S1095-E1097 PolarHBondContact O-N 3.36Å; S1095-D1178 CarbonylContact C-O 3.42Å
1096	Q	84.3	Confident	89.2	Confident	86 Å²	86	37.3 Å²	37.3	40%	0.402	18%	0.175	S	C	.	.	S	Bend	trans	-54.2	-47.9	176	178.1	164.8	37.9	0	0	112.8	Q1160 D1178 E1179 S1182	Q1096-Q1160 PolarHBondContact O-NE2 3.15Å; Q1096-D1178 WeakPolarHBondContact CA-O 3.41Å; Q1096-D1178 PolarHBondContact N-O 3.42Å; Q1096-E1179 HydrophobicContact CB-CB 4.29Å; Q1096-E1179 HydrophobicContact CG-CB 4.34Å; Q1096-E1179 PolarHBondContact NE2-OE2 3.11Å; Q1096-S1182 WeakPolarHBondContact CG-OG 3.32Å; Q1096-S1182 PolarHBondContact NE2-OG 3.39Å
1097	E	82.4	Confident	89.3	Confident	162 Å²	162	39 Å²	39	76%	0.757	19%	0.186	S	C	*	.	S	Bend	trans	-114.1	101.4	173.9	-68.5	-171.5	167.4	0	0	109.7	S1095 I1099	S1095-E1097 PolarHBondContact O-N 3.36Å; E1097-I1099 PolarHBondContact O-N 2.95Å
1098	P	85.4	Confident	89.4	Confident	18 Å²	18	39 Å²	39	12%	0.117	19%	0.186	C	C	.	.	P	Polyproline II helix	trans	-73.3	120.3	-179	27.8	-35.2	0	0	0	111.8	K1159 Q1160 A1163	P1098-K1159 HydrophobicContact CG-CB 3.73Å; P1098-Q1160 VanDerWaalsContact CD-CD 3.45Å; P1098-Q1160 HydrophobicContact CG-CG 4.35Å; P1098-A1163 HydrophobicContact CB-CB 3.48Å; P1098-A1163 VanDerWaalsContact CB-CB 3.48Å; P1098-A1163 HydrophobicContact CG-CB 4.46Å
1099	I	86.7	Confident	89.6	Confident	63 Å²	63	38.1 Å²	38.1	32%	0.323	18%	0.183	S	C	.	.	P	Polyproline II helix	trans	-83.9	122.6	177	-54.3	176.2	0	0	0	110.3	S232 E1097 R1166	S232-I1099 WeakPolarHBondContact OG-CG2 3.48Å; E1097-I1099 PolarHBondContact O-N 2.95Å; I1099-R1166 PolarHBondContact O-NH1 3.38Å; I1099-R1166 PolarHBondContact O-NH2 3.2Å; I1099-R1166 VanDerWaalsContact O-NH2 3.12Å
1100	L	89.2	Confident	89.8	Confident	21 Å²	21	32.6 Å²	32.6	11%	0.11	16%	0.164	C	C	.	.	P	Polyproline II helix	trans	-103.3	130.8	170.4	-57.4	-175.3	0	0	0	109.7	N1108 A1147 L1154 K1159 I1162	L1100-N1108 WeakPolarHBondContact CA-OD1 3.15Å; L1100-A1147 HydrophobicContact CB-CB 4.26Å; L1100-A1147 HydrophobicContact CD1-CB 4.03Å; L1100-L1154 HydrophobicContact CD1-CD1 3.74Å; L1100-K1159 HydrophobicContact CD1-CB 4.3Å; L1100-K1159 HydrophobicContact CD1-CG 3.9Å; L1100-I1162 HydrophobicContact CD1-CD1 3.93Å; L1100-I1162 HydrophobicContact CD2-CB 4.2Å; L1100-I1162 HydrophobicContact CD2-CG2 3.61Å
1101	F	87.7	Confident	89.9	Confident	1 Å²	1	30.9 Å²	30.9	0%	0.004	16%	0.156	C	C	.	.	P	Polyproline II helix	trans	-76.6	157.3	177	-62.4	-73.6	0	0	0	110.4	E228 T235 V236 I1103 N1108 Y1111	E228-F1101 HydrophobicContact CG-CD1 4.25Å; E228-F1101 WeakPolarHBondContact OE1-CA 3.45Å; E228-F1101 VanDerWaalsContact OE1-CB 3.24Å; E228-F1101 WeakPolarHBondContact OE1-CB 3.49Å; E228-F1101 WeakPolarHBondContact OE1-CD1 3.41Å; T235-F1101 HydrophobicContact CG2-CE2 4.25Å; T235-F1101 HydrophobicContact CG2-CZ 4.14Å; V236-F1101 HydrophobicContact CG2-CE1 3.95Å; V236-F1101 HydrophobicContact CG2-CZ 3.83Å; F1101-I1103 HydrophobicContact CB-CD1 3.81Å; F1101-I1103 HydrophobicContact CB-CG1 3.93Å; F1101-I1103 PolarHBondContact O-N 3.18Å; F1101-N1108 PolarHBondContact N-OD1 3.19Å; F1101-N1108 PolarHBondContact O-ND2 3.4Å; F1101-Y1111 HydrophobicContact CD2-CD1 4.34Å; F1101-Y1111 HydrophobicContact CD2-CD2 4.17Å; F1101-Y1111 HydrophobicContact CD2-CE1 4.41Å; F1101-Y1111 HydrophobicContact CD2-CE2 4.25Å; F1101-Y1111 HydrophobicContact CD2-CG 4.21Å; F1101-Y1111 AromaticContact CE2-CD1 3.61Å; F1101-Y1111 HydrophobicContact CE2-CD1 3.61Å; F1101-Y1111 HydrophobicContact CE2-CD2 4.11Å; F1101-Y1111 AromaticContact CE2-CE1 3.45Å; F1101-Y1111 HydrophobicContact CE2-CE1 3.45Å; F1101-Y1111 VanDerWaalsContact CE2-CE1 3.45Å; F1101-Y1111 AromaticContact CE2-CE2 3.98Å; F1101-Y1111 HydrophobicContact CE2-CE2 3.98Å; F1101-Y1111 AromaticContact CE2-CG 3.94Å; F1101-Y1111 HydrophobicContact CE2-CG 3.94Å; F1101-Y1111 AromaticContact CE2-CZ 3.64Å; F1101-Y1111 HydrophobicContact CZ-CD1 4.4Å; F1101-Y1111 AromaticContact CZ-CE1 3.8Å; F1101-Y1111 HydrophobicContact CZ-CE1 3.8Å; F1101-Y1111 HydrophobicContact CZ-CE2 4.44Å; F1101-Y1111 AromaticContact CZ-CZ 3.81Å
1102	N	86	Confident	89.9	Confident	51 Å²	51	30.8 Å²	30.8	27%	0.273	16%	0.156	S	C	.	.	S	Bend	trans	-75.1	60.9	179.2	-161.6	9.2	0	0	0	112.3	E228 A1147 D1150	E228-N1102 PolarHBondContact OE1-N 2.73Å; N1102-A1147 VanDerWaalsContact CA-O 3.27Å; N1102-A1147 WeakPolarHBondContact CA-O 3.45Å; N1102-A1147 PolarHBondContact OD1-O 3.4Å; N1102-D1150 PolarHBondContact ND2-OD2 3.23Å
1103	I	87.7	Confident	89.8	Confident	26 Å²	26	31.6 Å²	31.6	13%	0.133	16%	0.161	C	C	.	.	S	Bend	trans	-142.7	174.1	-175.9	63.5	-170.9	0	0	0	109.3	F1101 D1107 N1108 A1147	F1101-I1103 HydrophobicContact CB-CD1 3.81Å; F1101-I1103 HydrophobicContact CB-CG1 3.93Å; F1101-I1103 PolarHBondContact O-N 3.18Å; I1103-D1107 HydrophobicContact CB-CB 4.15Å; I1103-D1107 HydrophobicContact CD1-CB 3.66Å; I1103-D1107 HydrophobicContact CG1-CB 3.87Å; I1103-N1108 WeakPolarHBondContact CG1-ND2 3.49Å; I1103-N1108 PolarHBondContact O-ND2 3.34Å; I1103-A1147 PolarHBondContact O-N 3.47Å
1104	S	91.7	Very high	89.6	Confident	7 Å²	7	33.1 Å²	33.1	5%	0.049	17%	0.169	C	C	.	.	B	Isolated β-bridge	trans	-59.8	155.3	178.3	64.8	0	0	0	0	112	R1106 D1107 N1108 T1145	S1104-R1106 PolarHBondContact O-N 3.5Å; S1104-D1107 PolarHBondContact O-N 3.14Å; S1104-D1107 VanDerWaalsContact O-N 3.14Å; S1104-D1107 WeakPolarHBondContact OG-CB 3.35Å; S1104-D1107 VanDerWaalsContact OG-CG 3.29Å; S1104-D1107 PolarHBondContact OG-N 3.45Å; S1104-D1107 VanDerWaalsContact OG-N 3.16Å; S1104-D1107 PolarHBondContact OG-OD2 3.01Å; S1104-N1108 PolarHBondContact O-N 3.02Å; S1104-N1108 PolarHBondContact O-ND2 3.01Å; S1104-T1145 CarbonylContact C-O 3.58Å; S1104-T1145 WeakPolarHBondContact CA-O 3.46Å
1105	L	92.5	Very high	89.2	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-57.9	-38	173.2	-74.7	176.7	0	0	0	111.8	N1108 I1109 I1136 L1139 Y1143 T1145 A1147 L1154 I1162	L1105-N1108 PolarHBondContact O-N 3.34Å; L1105-I1109 WeakPolarHBondContact O-CG1 3.17Å; L1105-I1109 PolarHBondContact O-N 3.21Å; L1105-I1136 HydrophobicContact CD1-CG1 4.18Å; L1105-I1136 HydrophobicContact CD1-CG2 4.35Å; L1105-L1139 HydrophobicContact CD1-CD1 3.57Å; L1105-Y1143 PolarHBondContact N-O 3.16Å; L1105-T1145 PolarHBondContact N-O 3.32Å; L1105-A1147 HydrophobicContact CD2-CB 3.82Å; L1105-A1147 HydrophobicContact CG-CB 4.49Å; L1105-L1154 HydrophobicContact CD2-CD1 4.01Å; L1105-I1162 HydrophobicContact CD2-CD1 3.48Å; L1105-I1162 VanDerWaalsContact CD2-CD1 3.48Å; L1105-I1162 HydrophobicContact CD2-CG1 4.34Å
1106	R	93.8	Very high	89.3	Confident	83 Å²	83	39 Å²	39	31%	0.313	19%	0.193	S	C	.	.	H	α-helix	trans	-51.2	-56.2	169.8	179.1	-171.3	171.4	-175.5	0.6	111.9	S1104 N1108 I1109 A1110 M1120 I1123 Y1143 E1144	S1104-R1106 PolarHBondContact O-N 3.5Å; R1106-N1108 VanDerWaalsContact C-N 3.3Å; R1106-N1108 PolarHBondContact O-N 3.37Å; R1106-I1109 PolarHBondContact O-N 3.44Å; R1106-A1110 WeakPolarHBondContact O-CB 3.37Å; R1106-A1110 PolarHBondContact O-N 3.05Å; R1106-M1120 WeakPolarHBondContact CD-SD 3.34Å; R1106-M1120 HydrophobicContact CG-CE 4.15Å; R1106-M1120 HydrophobicContact CG-SD 3.67Å; R1106-M1120 PolarHBondContact NE-SD 2.86Å; R1106-I1123 HydrophobicContact CG-CD1 3.78Å; R1106-Y1143 PolarHBondContact N-O 3Å; R1106-E1144 IonicContact NH1-OE1 2.84Å; R1106-E1144 PolarHBondContact NH1-OE1 2.86Å
1107	D	92.1	Very high	89.4	Confident	58 Å²	58	42.9 Å²	42.9	31%	0.31	22%	0.215	S	C	.	.	H	α-helix	trans	-70.8	-29.8	-174.6	-72.2	-22.5	0	0	0	112.1	I1103 S1104 Y1111	I1103-D1107 HydrophobicContact CB-CB 4.15Å; I1103-D1107 HydrophobicContact CD1-CB 3.66Å; I1103-D1107 HydrophobicContact CG1-CB 3.87Å; S1104-D1107 PolarHBondContact O-N 3.14Å; S1104-D1107 VanDerWaalsContact O-N 3.14Å; S1104-D1107 WeakPolarHBondContact OG-CB 3.35Å; S1104-D1107 VanDerWaalsContact OG-CG 3.29Å; S1104-D1107 PolarHBondContact OG-N 3.45Å; S1104-D1107 VanDerWaalsContact OG-N 3.16Å; S1104-D1107 PolarHBondContact OG-OD2 3.01Å; D1107-Y1111 WeakPolarHBondContact O-CB 3.38Å; D1107-Y1111 PolarHBondContact O-N 3.29Å
1108	N	92.6	Very high	89.8	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-63.7	-40.8	172	-94	-73.8	0	0	0	112.1	L1100 F1101 I1103 S1104 L1105 R1106 Y1111 I1162 R1166	L1100-N1108 WeakPolarHBondContact CA-OD1 3.15Å; F1101-N1108 PolarHBondContact N-OD1 3.19Å; F1101-N1108 PolarHBondContact O-ND2 3.4Å; I1103-N1108 WeakPolarHBondContact CG1-ND2 3.49Å; I1103-N1108 PolarHBondContact O-ND2 3.34Å; S1104-N1108 PolarHBondContact O-N 3.02Å; S1104-N1108 PolarHBondContact O-ND2 3.01Å; L1105-N1108 PolarHBondContact O-N 3.34Å; R1106-N1108 VanDerWaalsContact C-N 3.3Å; R1106-N1108 PolarHBondContact O-N 3.37Å; N1108-Y1111 WeakPolarHBondContact O-CB 3.31Å; N1108-I1162 HydrophobicContact CB-CG2 4.46Å; N1108-R1166 WeakPolarHBondContact O-CG 3.19Å; N1108-R1166 PolarHBondContact O-NE 2.91Å; N1108-R1166 PolarHBondContact OD1-NH2 3.46Å
1109	I	94.3	Very high	90.2	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-72	-45.6	175.8	-66.2	168.7	0	0	0	109.9	L1105 R1106 Y1111 G1112 I1123 A1127 I1136 Y1143 I1162 A1165 I1169	L1105-I1109 WeakPolarHBondContact O-CG1 3.17Å; L1105-I1109 PolarHBondContact O-N 3.21Å; R1106-I1109 PolarHBondContact O-N 3.44Å; I1109-Y1111 PolarHBondContact O-N 2.83Å; I1109-G1112 PolarHBondContact O-N 3.3Å; I1109-G1112 VanDerWaalsContact O-N 3.08Å; I1109-I1123 HydrophobicContact CB-CG2 4.15Å; I1109-I1123 HydrophobicContact CD1-CG2 4.23Å; I1109-I1123 HydrophobicContact CG2-CB 4.48Å; I1109-I1123 HydrophobicContact CG2-CG1 4.49Å; I1109-I1123 HydrophobicContact CG2-CG2 3.88Å; I1109-A1127 HydrophobicContact CD1-CB 4.38Å; I1109-I1136 HydrophobicContact CD1-CD1 4.07Å; I1109-Y1143 HydrophobicContact CD1-CE1 4.26Å; I1109-I1162 HydrophobicContact CG1-CG2 4.08Å; I1109-A1165 HydrophobicContact CD1-CB 4.28Å; I1109-A1165 HydrophobicContact CG1-CB 4.12Å; I1109-A1165 HydrophobicContact CG2-CB 4.1Å; I1109-I1169 HydrophobicContact CG2-CD1 3.72Å
1110	A	93.7	Very high	90.5	Very high	13 Å²	13	37.2 Å²	37.2	11%	0.107	19%	0.192	C	C	.	.	H	α-helix	trans	-61.9	-24.2	177.4	0	0	0	0	0	113.6	R1106 G1112 D1113 V1118 I1123	R1106-A1110 WeakPolarHBondContact O-CB 3.37Å; R1106-A1110 PolarHBondContact O-N 3.05Å; A1110-G1112 PolarHBondContact O-N 2.91Å; A1110-D1113 PolarHBondContact O-N 3.46Å; A1110-D1113 VanDerWaalsContact O-N 3.16Å; A1110-V1118 HydrophobicContact CB-CB 4.33Å; A1110-V1118 HydrophobicContact CB-CG2 4.37Å; A1110-I1123 HydrophobicContact CB-CD1 4.01Å
1111	Y	92.9	Very high	90.7	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.1	-17.7	173.4	-153.6	-92.1	0	0	0	113.5	F239 E245 F1101 D1107 N1108 I1109 D1113 N1114	F239-Y1111 HydrophobicContact CB-CD1 3.84Å; F239-Y1111 HydrophobicContact CB-CE1 3.87Å; F239-Y1111 HydrophobicContact CG-CD1 4.18Å; E245-Y1111 WeakPolarHBondContact CG-OH 3.49Å; E245-Y1111 VanDerWaalsContact OE1-CE2 3.26Å; E245-Y1111 WeakPolarHBondContact OE1-CE2 3.28Å; E245-Y1111 PolarHBondContact OE1-OH 3.43Å; E245-Y1111 VanDerWaalsContact OE1-OH 3.05Å; F1101-Y1111 HydrophobicContact CD2-CD1 4.34Å; F1101-Y1111 HydrophobicContact CD2-CD2 4.17Å; F1101-Y1111 HydrophobicContact CD2-CE1 4.41Å; F1101-Y1111 HydrophobicContact CD2-CE2 4.25Å; F1101-Y1111 HydrophobicContact CD2-CG 4.21Å; F1101-Y1111 AromaticContact CE2-CD1 3.61Å; F1101-Y1111 HydrophobicContact CE2-CD1 3.61Å; F1101-Y1111 HydrophobicContact CE2-CD2 4.11Å; F1101-Y1111 AromaticContact CE2-CE1 3.45Å; F1101-Y1111 HydrophobicContact CE2-CE1 3.45Å; F1101-Y1111 VanDerWaalsContact CE2-CE1 3.45Å; F1101-Y1111 AromaticContact CE2-CE2 3.98Å; F1101-Y1111 HydrophobicContact CE2-CE2 3.98Å; F1101-Y1111 AromaticContact CE2-CG 3.94Å; F1101-Y1111 HydrophobicContact CE2-CG 3.94Å; F1101-Y1111 AromaticContact CE2-CZ 3.64Å; F1101-Y1111 HydrophobicContact CZ-CD1 4.4Å; F1101-Y1111 AromaticContact CZ-CE1 3.8Å; F1101-Y1111 HydrophobicContact CZ-CE1 3.8Å; F1101-Y1111 HydrophobicContact CZ-CE2 4.44Å; F1101-Y1111 AromaticContact CZ-CZ 3.81Å; D1107-Y1111 WeakPolarHBondContact O-CB 3.38Å; D1107-Y1111 PolarHBondContact O-N 3.29Å; N1108-Y1111 WeakPolarHBondContact O-CB 3.31Å; I1109-Y1111 PolarHBondContact O-N 2.83Å; Y1111-D1113 PolarHBondContact O-N 3.2Å; Y1111-N1114 PolarHBondContact O-ND2 2.82Å; Y1111-N1114 VanDerWaalsContact O-ND2 3.14Å
1112	G	90	Very high	91	Very high	1 Å²	1	44 Å²	44	1%	0.01	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-31.3	175.1	0	0	0	0	0	115.3	F239 I1109 A1110 R1166 I1169 R1170	F239-G1112 VanDerWaalsContact CD1-CA 3.5Å; I1109-G1112 PolarHBondContact O-N 3.3Å; I1109-G1112 VanDerWaalsContact O-N 3.08Å; A1110-G1112 PolarHBondContact O-N 2.91Å; G1112-R1166 WeakPolarHBondContact CA-O 3.43Å; G1112-I1169 VanDerWaalsContact CA-CG2 3.47Å; G1112-R1170 PolarHBondContact O-NE 3.37Å
1113	D	90.5	Very high	91.3	Very high	18 Å²	18	41.7 Å²	41.7	10%	0.096	22%	0.215	C	C	.	.			trans	-134.5	96	178.9	-176.5	3.2	0	0	0	110.2	A1110 Y1111 S1115 R1116 V1118 I1169 R1170	A1110-D1113 PolarHBondContact O-N 3.46Å; A1110-D1113 VanDerWaalsContact O-N 3.16Å; Y1111-D1113 PolarHBondContact O-N 3.2Å; D1113-S1115 VanDerWaalsContact C-N 3.28Å; D1113-S1115 PolarHBondContact O-N 2.94Å; D1113-S1115 WeakPolarHBondContact OD1-CB 3.41Å; D1113-S1115 PolarHBondContact OD1-N 3.1Å; D1113-S1115 PolarHBondContact OD1-OG 3.45Å; D1113-R1116 WeakPolarHBondContact OD2-CG 3.4Å; D1113-R1116 IonicContact OD2-NE 2.72Å; D1113-R1116 PolarHBondContact OD2-NE 2.95Å; D1113-R1116 VanDerWaalsContact OD2-NE 3.11Å; D1113-V1118 HydrophobicContact CB-CG2 4.18Å; D1113-I1169 HydrophobicContact CB-CG2 4.26Å; D1113-R1170 HydrophobicContact CB-CB 4.16Å
1114	N	87.9	Confident	91.7	Very high	45 Å²	45	42.5 Å²	42.5	24%	0.241	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85	3	177.8	-67.1	-60.1	0	0	0	113.4	F239 R244 Y1111	F239-N1114 PolarHBondContact O-ND2 3.09Å; R244-N1114 VanDerWaalsContact CD-OD1 3.3Å; R244-N1114 WeakPolarHBondContact CD-OD1 3.19Å; R244-N1114 PolarHBondContact NH1-OD1 3.39Å; Y1111-N1114 PolarHBondContact O-ND2 2.82Å; Y1111-N1114 VanDerWaalsContact O-ND2 3.14Å
1115	S	84.3	Confident	91.7	Very high	54 Å²	54	46.9 Å²	46.9	38%	0.378	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.5	-22.5	-178	74.1	0	0	0	0	113.5	D1113	D1113-S1115 VanDerWaalsContact C-N 3.28Å; D1113-S1115 PolarHBondContact O-N 2.94Å; D1113-S1115 WeakPolarHBondContact OD1-CB 3.41Å; D1113-S1115 PolarHBondContact OD1-N 3.1Å; D1113-S1115 PolarHBondContact OD1-OG 3.45Å
1116	R	89	Confident	91.7	Very high	113 Å²	113	47 Å²	47	43%	0.426	24%	0.24	S	C	.	.	S	Bend	trans	-145.3	167.1	-179.9	63.7	178.5	178.6	129.9	4	110.9	D1113 V1118 E1122	D1113-R1116 WeakPolarHBondContact OD2-CG 3.4Å; D1113-R1116 IonicContact OD2-NE 2.72Å; D1113-R1116 PolarHBondContact OD2-NE 2.95Å; D1113-R1116 VanDerWaalsContact OD2-NE 3.11Å; R1116-V1118 PolarHBondContact O-N 2.85Å; R1116-E1122 IonicContact CZ-OE1 3.89Å; R1116-E1122 IonicContact CZ-OE2 3.52Å; R1116-E1122 IonicContact NH1-OE1 2.92Å; R1116-E1122 PolarHBondContact NH1-OE1 3.45Å; R1116-E1122 IonicContact NH1-OE2 3.43Å; R1116-E1122 PolarHBondContact NH1-OE2 3.13Å; R1116-E1122 VanDerWaalsContact NH1-OE2 3.15Å; R1116-E1122 IonicContact NH2-OE1 2.74Å; R1116-E1122 PolarHBondContact NH2-OE1 3.01Å; R1116-E1122 IonicContact NH2-OE2 2.78Å; R1116-E1122 PolarHBondContact NH2-OE2 3.45Å
1117	I	86.7	Confident	91.7	Very high	167 Å²	167	43.1 Å²	43.1	86%	0.856	23%	0.225	S	C	*	.	P	Polyproline II helix	trans	-80.3	117.1	168.6	-58.6	171.3	0	0	0	107.2
1118	V	90.1	Very high	91.8	Very high	10 Å²	10	46 Å²	46	6%	0.061	24%	0.235	C	C	.	.	P	Polyproline II helix	trans	-77.4	135.3	-179.5	-173.1	0	0	0	0	110	A1110 D1113 R1116 E1122 I1123 I1169	A1110-V1118 HydrophobicContact CB-CB 4.33Å; A1110-V1118 HydrophobicContact CB-CG2 4.37Å; D1113-V1118 HydrophobicContact CB-CG2 4.18Å; R1116-V1118 PolarHBondContact O-N 2.85Å; V1118-E1122 HydrophobicContact CG1-CB 3.85Å; V1118-E1122 VanDerWaalsContact CG1-OE2 3.3Å; V1118-E1122 WeakPolarHBondContact CG1-OE2 3.12Å; V1118-I1123 HydrophobicContact CG1-CD1 4.42Å; V1118-I1123 HydrophobicContact CG1-CG1 3.84Å; V1118-I1169 HydrophobicContact CB-CD1 4.43Å; V1118-I1169 HydrophobicContact CG1-CD1 3.54Å; V1118-I1169 HydrophobicContact CG1-CG1 3.93Å; V1118-I1169 HydrophobicContact CG2-CD1 4.39Å
1119	S	93.8	Very high	91.6	Very high	50 Å²	50	49.3 Å²	49.3	35%	0.35	25%	0.252	S	S	.	.	P	Polyproline II helix	trans	-73.6	155.9	175.5	67.8	0	0	0	0	111.6	D1121 E1122 I1123	S1119-D1121 VanDerWaalsContact C-N 3.25Å; S1119-D1121 PolarHBondContact O-N 3.19Å; S1119-E1122 PolarHBondContact O-N 3.49Å; S1119-E1122 WeakPolarHBondContact OG-CG 3.22Å; S1119-E1122 PolarHBondContact OG-N 3.46Å; S1119-I1123 WeakPolarHBondContact O-CG1 3.37Å; S1119-I1123 PolarHBondContact O-N 3.44Å
1120	M	93.3	Very high	91.4	Very high	63 Å²	63	49.3 Å²	49.3	31%	0.31	25%	0.252	S	S	.	.	H	α-helix	trans	-64	-32.5	177.1	-73.8	-59.8	-82	0	0	112.6	R1106 E1122 I1123 I1124 Y1143	R1106-M1120 WeakPolarHBondContact CD-SD 3.34Å; R1106-M1120 HydrophobicContact CG-CE 4.15Å; R1106-M1120 HydrophobicContact CG-SD 3.67Å; R1106-M1120 PolarHBondContact NE-SD 2.86Å; M1120-E1122 VanDerWaalsContact C-N 3.32Å; M1120-E1122 PolarHBondContact O-N 2.95Å; M1120-I1123 PolarHBondContact O-N 2.85Å; M1120-I1123 HydrophobicContact SD-CD1 3.86Å; M1120-I1124 VanDerWaalsContact O-CG1 3.29Å; M1120-I1124 WeakPolarHBondContact O-CG1 3.38Å; M1120-I1124 PolarHBondContact O-N 3.49Å; M1120-Y1143 HydrophobicContact CE-CG 4.46Å
1121	D	93.9	Very high	91.3	Very high	125 Å²	125	51.1 Å²	51.1	67%	0.668	26%	0.26	S	S	*	.	H	α-helix	trans	-62.4	-41.4	178.6	-59.1	-37.1	0	0	0	111.4	S1119 I1124 E1125	S1119-D1121 VanDerWaalsContact C-N 3.25Å; S1119-D1121 PolarHBondContact O-N 3.19Å; D1121-I1124 PolarHBondContact O-N 2.7Å; D1121-E1125 WeakPolarHBondContact O-CB 3.32Å; D1121-E1125 PolarHBondContact O-N 3.36Å
1122	E	93.5	Very high	91.2	Very high	41 Å²	41	51.1 Å²	51.1	19%	0.192	26%	0.26	C	S	.	.	H	α-helix	trans	-67.9	-37.1	176	-71.6	178	169.6	0	0	112.1	R1116 V1118 S1119 M1120 I1124 E1125 A1126	R1116-E1122 IonicContact CZ-OE1 3.89Å; R1116-E1122 IonicContact CZ-OE2 3.52Å; R1116-E1122 IonicContact NH1-OE1 2.92Å; R1116-E1122 PolarHBondContact NH1-OE1 3.45Å; R1116-E1122 IonicContact NH1-OE2 3.43Å; R1116-E1122 PolarHBondContact NH1-OE2 3.13Å; R1116-E1122 VanDerWaalsContact NH1-OE2 3.15Å; R1116-E1122 IonicContact NH2-OE1 2.74Å; R1116-E1122 PolarHBondContact NH2-OE1 3.01Å; R1116-E1122 IonicContact NH2-OE2 2.78Å; R1116-E1122 PolarHBondContact NH2-OE2 3.45Å; V1118-E1122 HydrophobicContact CG1-CB 3.85Å; V1118-E1122 VanDerWaalsContact CG1-OE2 3.3Å; V1118-E1122 WeakPolarHBondContact CG1-OE2 3.12Å; S1119-E1122 PolarHBondContact O-N 3.49Å; S1119-E1122 WeakPolarHBondContact OG-CG 3.22Å; S1119-E1122 PolarHBondContact OG-N 3.46Å; M1120-E1122 VanDerWaalsContact C-N 3.32Å; M1120-E1122 PolarHBondContact O-N 2.95Å; E1122-I1124 VanDerWaalsContact C-N 3.34Å; E1122-E1125 PolarHBondContact O-N 2.75Å; E1122-A1126 WeakPolarHBondContact O-CB 3.35Å; E1122-A1126 PolarHBondContact O-N 3.34Å
1123	I	94	Very high	91.3	Very high	1 Å²	1	52.2 Å²	52.2	1%	0.005	27%	0.265	C	S	.	.	H	α-helix	trans	-63.6	-43.3	175.1	-66.1	170.1	0	0	0	110.1	R1106 I1109 A1110 V1118 S1119 M1120 A1126 A1127 Y1143 I1169	R1106-I1123 HydrophobicContact CG-CD1 3.78Å; I1109-I1123 HydrophobicContact CB-CG2 4.15Å; I1109-I1123 HydrophobicContact CD1-CG2 4.23Å; I1109-I1123 HydrophobicContact CG2-CB 4.48Å; I1109-I1123 HydrophobicContact CG2-CG1 4.49Å; I1109-I1123 HydrophobicContact CG2-CG2 3.88Å; A1110-I1123 HydrophobicContact CB-CD1 4.01Å; V1118-I1123 HydrophobicContact CG1-CD1 4.42Å; V1118-I1123 HydrophobicContact CG1-CG1 3.84Å; S1119-I1123 WeakPolarHBondContact O-CG1 3.37Å; S1119-I1123 PolarHBondContact O-N 3.44Å; M1120-I1123 PolarHBondContact O-N 2.85Å; M1120-I1123 HydrophobicContact SD-CD1 3.86Å; I1123-A1126 PolarHBondContact O-N 3.42Å; I1123-A1127 VanDerWaalsContact O-CB 3.28Å; I1123-A1127 WeakPolarHBondContact O-CB 3.45Å; I1123-A1127 PolarHBondContact O-N 2.91Å; I1123-Y1143 HydrophobicContact CG2-CD1 4.23Å; I1123-Y1143 HydrophobicContact CG2-CE1 3.91Å; I1123-I1169 HydrophobicContact CG1-CD1 3.9Å
1124	I	94.7	Very high	91.4	Very high	43 Å²	43	57.5 Å²	57.5	22%	0.221	29%	0.293	C	S	.	.	H	α-helix	trans	-66.7	-42.5	177.7	-67.7	164.8	0	0	0	110.6	M1120 D1121 E1122 A1127 K1128 Y1143	M1120-I1124 VanDerWaalsContact O-CG1 3.29Å; M1120-I1124 WeakPolarHBondContact O-CG1 3.38Å; M1120-I1124 PolarHBondContact O-N 3.49Å; D1121-I1124 PolarHBondContact O-N 2.7Å; E1122-I1124 VanDerWaalsContact C-N 3.34Å; I1124-A1127 PolarHBondContact O-N 3.22Å; I1124-K1128 HydrophobicContact CG2-CD 4.08Å; I1124-K1128 HydrophobicContact CG2-CG 4.4Å; I1124-K1128 WeakPolarHBondContact O-CB 3.32Å; I1124-K1128 WeakPolarHBondContact O-CG 3.4Å; I1124-K1128 PolarHBondContact O-N 3.07Å; I1124-Y1143 HydrophobicContact CG1-CE2 4.1Å
1125	E	93	Very high	91.4	Very high	99 Å²	99	57.7 Å²	57.7	46%	0.463	29%	0.292	S	S	.	.	H	α-helix	trans	-58.5	-48.7	175.2	-169.7	-170.8	165.7	0	0	110.9	D1121 E1122 A1127 K1128 L1129	D1121-E1125 WeakPolarHBondContact O-CB 3.32Å; D1121-E1125 PolarHBondContact O-N 3.36Å; E1122-E1125 PolarHBondContact O-N 2.75Å; E1125-A1127 PolarHBondContact O-N 3.01Å; E1125-K1128 PolarHBondContact O-N 3.35Å; E1125-L1129 WeakPolarHBondContact O-CG 3.37Å; E1125-L1129 PolarHBondContact O-N 3.46Å
1126	A	92.6	Very high	91.8	Very high	4 Å²	4	55.1 Å²	55.1	3%	0.033	27%	0.274	C	S	.	.	H	α-helix	trans	-62.8	-40.1	176.7	0	0	0	0	0	112.5	E1122 I1123 L1129 A1130 A1165 I1169	E1122-A1126 WeakPolarHBondContact O-CB 3.35Å; E1122-A1126 PolarHBondContact O-N 3.34Å; I1123-A1126 PolarHBondContact O-N 3.42Å; A1126-L1129 PolarHBondContact O-N 3.12Å; A1126-A1130 WeakPolarHBondContact O-CB 3.49Å; A1126-A1130 PolarHBondContact O-N 3.28Å; A1126-A1165 HydrophobicContact CB-CB 4.39Å; A1126-I1169 HydrophobicContact CB-CB 4.37Å; A1126-I1169 HydrophobicContact CB-CG1 4.3Å
1127	A	93.3	Very high	91.9	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-68.5	-33.2	177.5	0	0	0	0	0	113	I1109 I1123 I1124 E1125 N1131 I1132 H1133 Y1143	I1109-A1127 HydrophobicContact CD1-CB 4.38Å; I1123-A1127 VanDerWaalsContact O-CB 3.28Å; I1123-A1127 WeakPolarHBondContact O-CB 3.45Å; I1123-A1127 PolarHBondContact O-N 2.91Å; I1124-A1127 PolarHBondContact O-N 3.22Å; E1125-A1127 PolarHBondContact O-N 3.01Å; A1127-N1131 PolarHBondContact O-N 3.35Å; A1127-I1132 HydrophobicContact CB-CG2 3.9Å; A1127-I1132 WeakPolarHBondContact O-CG2 3.21Å; A1127-I1132 PolarHBondContact O-N 3.49Å; A1127-H1133 HydrophobicContact CB-CB 4.24Å; A1127-H1133 PolarHBondContact O-N 2.86Å; A1127-Y1143 HydrophobicContact CB-CE1 4.31Å; A1127-Y1143 WeakPolarHBondContact CB-OH 3.2Å
1128	K	93	Very high	92.1	Very high	119 Å²	119	50.5 Å²	50.5	52%	0.517	27%	0.266	S	S	.	.	H	α-helix	trans	-68.8	-46.5	173.1	-76.4	176.6	177.9	179.6	0	111	I1124 E1125 A1130 N1131 H1133	I1124-K1128 HydrophobicContact CG2-CD 4.08Å; I1124-K1128 HydrophobicContact CG2-CG 4.4Å; I1124-K1128 WeakPolarHBondContact O-CB 3.32Å; I1124-K1128 WeakPolarHBondContact O-CG 3.4Å; I1124-K1128 PolarHBondContact O-N 3.07Å; E1125-K1128 PolarHBondContact O-N 3.35Å; K1128-A1130 PolarHBondContact O-N 3.44Å; K1128-N1131 PolarHBondContact O-N 3.49Å; K1128-H1133 VanDerWaalsContact CE-CD2 3.46Å; K1128-H1133 WeakPolarHBondContact CE-CD2 3.33Å; K1128-H1133 HydrophobicContact CG-CB 3.77Å
1129	L	89.8	Confident	92.1	Very high	70 Å²	70	51.3 Å²	51.3	37%	0.366	27%	0.27	S	S	.	.	H	α-helix	trans	-59.3	-35.1	174.7	-71.6	172.6	0	0	0	112.4	E1125 A1126 N1131 I1168	E1125-L1129 WeakPolarHBondContact O-CG 3.37Å; E1125-L1129 PolarHBondContact O-N 3.46Å; A1126-L1129 PolarHBondContact O-N 3.12Å; L1129-N1131 VanDerWaalsContact C-N 3.26Å; L1129-N1131 PolarHBondContact O-N 3.02Å; L1129-I1168 HydrophobicContact CB-CD1 4.46Å; L1129-I1168 HydrophobicContact CD1-CG2 4.04Å
1130	A	90.6	Very high	91.7	Very high	0 Å²	0	54.9 Å²	54.9	0%	0	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.8	5	176.3	0	0	0	0	0	114.4	A1126 K1128 I1132 R1161 I1164 A1165	A1126-A1130 WeakPolarHBondContact O-CB 3.49Å; A1126-A1130 PolarHBondContact O-N 3.28Å; K1128-A1130 PolarHBondContact O-N 3.44Å; A1130-I1132 VanDerWaalsContact C-N 3.26Å; A1130-I1132 HydrophobicContact CB-CG2 4.32Å; A1130-I1132 PolarHBondContact O-N 2.7Å; A1130-R1161 VanDerWaalsContact CB-O 3.31Å; A1130-R1161 WeakPolarHBondContact CB-O 3.35Å; A1130-R1161 WeakPolarHBondContact O-CB 3.18Å; A1130-R1161 VanDerWaalsContact O-CD 3.27Å; A1130-R1161 WeakPolarHBondContact O-CD 3.36Å; A1130-R1161 WeakPolarHBondContact O-CG 3.5Å; A1130-I1164 HydrophobicContact CB-CB 4.19Å; A1130-I1164 HydrophobicContact CB-CG2 3.96Å; A1130-A1165 HydrophobicContact CB-CB 3.77Å
1131	N	90.2	Very high	91.4	Very high	51 Å²	51	57 Å²	57	27%	0.273	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.9	37	-177.2	-64.6	-50.2	0	0	0	113.8	A1127 K1128 L1129 R1161	A1127-N1131 PolarHBondContact O-N 3.35Å; K1128-N1131 PolarHBondContact O-N 3.49Å; L1129-N1131 VanDerWaalsContact C-N 3.26Å; L1129-N1131 PolarHBondContact O-N 3.02Å; N1131-R1161 PolarHBondContact O-NH1 2.9Å
1132	I	91.2	Very high	91.3	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	28%	0.283	C	S	.	.			trans	-117.4	-12.8	-179.8	-161.2	63.8	0	0	0	113.6	A1127 A1130 D1134 F1135 I1136 Q1158 R1161 I1162	A1127-I1132 HydrophobicContact CB-CG2 3.9Å; A1127-I1132 WeakPolarHBondContact O-CG2 3.21Å; A1127-I1132 PolarHBondContact O-N 3.49Å; A1130-I1132 VanDerWaalsContact C-N 3.26Å; A1130-I1132 HydrophobicContact CB-CG2 4.32Å; A1130-I1132 PolarHBondContact O-N 2.7Å; I1132-D1134 PolarHBondContact O-N 3.36Å; I1132-F1135 HydrophobicContact CD1-CB 4Å; I1132-F1135 HydrophobicContact CD1-CD1 3.66Å; I1132-F1135 HydrophobicContact CD1-CG 4.1Å; I1132-F1135 HydrophobicContact CG1-CD1 4.28Å; I1132-F1135 WeakPolarHBondContact O-CB 3.43Å; I1132-F1135 PolarHBondContact O-N 3.21Å; I1132-I1136 HydrophobicContact CG1-CD1 4.25Å; I1132-I1136 HydrophobicContact CG1-CG1 4.13Å; I1132-I1136 HydrophobicContact CG2-CD1 3.93Å; I1132-I1136 WeakPolarHBondContact O-CG1 3.48Å; I1132-I1136 PolarHBondContact O-N 3.01Å; I1132-Q1158 HydrophobicContact CD1-CB 4.26Å; I1132-Q1158 HydrophobicContact CD1-CG 4.29Å; I1132-R1161 HydrophobicContact CB-CB 3.95Å; I1132-R1161 HydrophobicContact CD1-CB 4.03Å; I1132-R1161 HydrophobicContact CG1-CB 4.19Å; I1132-I1162 HydrophobicContact CG1-CG1 4.18Å
1133	H	93.1	Very high	91.3	Very high	24 Å²	24	51.2 Å²	51.2	11%	0.111	28%	0.277	C	S	.	.	H	α-helix	trans	-52.9	-50.1	-176	-179	52.3	0	0	0	114	A1127 K1128 F1135 I1136 L1137 Y1143	A1127-H1133 HydrophobicContact CB-CB 4.24Å; A1127-H1133 PolarHBondContact O-N 2.86Å; K1128-H1133 VanDerWaalsContact CE-CD2 3.46Å; K1128-H1133 WeakPolarHBondContact CE-CD2 3.33Å; K1128-H1133 HydrophobicContact CG-CB 3.77Å; H1133-F1135 VanDerWaalsContact C-N 3.29Å; H1133-F1135 PolarHBondContact O-N 2.85Å; H1133-I1136 PolarHBondContact O-N 3.37Å; H1133-I1136 VanDerWaalsContact O-N 3.16Å; H1133-L1137 PolarHBondContact O-N 3.34Å; H1133-Y1143 AromaticContact ND1-CE2 3.88Å; H1133-Y1143 AromaticContact ND1-CZ 3.74Å; H1133-Y1143 PolarHBondContact ND1-OH 3.26Å
1134	D	90.6	Very high	91.2	Very high	129 Å²	129	55.9 Å²	55.9	69%	0.69	30%	0.299	S	S	*	.	H	α-helix	trans	-65.5	-35.7	-176.9	-55.9	-29.8	0	0	0	111.7	I1132 L1137 S1138	I1132-D1134 PolarHBondContact O-N 3.36Å; D1134-L1137 PolarHBondContact O-N 2.94Å; D1134-S1138 PolarHBondContact O-N 2.84Å; D1134-S1138 VanDerWaalsContact O-N 3.14Å
1135	F	89.7	Confident	91	Very high	48 Å²	48	54.4 Å²	54.4	21%	0.211	29%	0.292	C	S	.	.	H	α-helix	trans	-66.4	-44.2	173.8	173.4	-98.4	0	0	0	111.4	I1132 H1133 L1137 S1138 L1139 L1154 Q1158	I1132-F1135 HydrophobicContact CD1-CB 4Å; I1132-F1135 HydrophobicContact CD1-CD1 3.66Å; I1132-F1135 HydrophobicContact CD1-CG 4.1Å; I1132-F1135 HydrophobicContact CG1-CD1 4.28Å; I1132-F1135 WeakPolarHBondContact O-CB 3.43Å; I1132-F1135 PolarHBondContact O-N 3.21Å; H1133-F1135 VanDerWaalsContact C-N 3.29Å; H1133-F1135 PolarHBondContact O-N 2.85Å; F1135-L1137 VanDerWaalsContact C-N 3.29Å; F1135-L1137 PolarHBondContact O-N 2.91Å; F1135-S1138 WeakPolarHBondContact O-CB 3.45Å; F1135-S1138 PolarHBondContact O-N 2.6Å; F1135-S1138 PolarHBondContact O-OG 2.92Å; F1135-L1139 HydrophobicContact CE1-CD1 4.05Å; F1135-L1139 HydrophobicContact CE1-CD2 4.38Å; F1135-L1139 HydrophobicContact CE1-CG 4.36Å; F1135-L1139 HydrophobicContact CZ-CD2 4.03Å; F1135-L1139 HydrophobicContact CZ-CG 4.45Å; F1135-L1139 PolarHBondContact O-N 3.18Å; F1135-L1154 HydrophobicContact CE1-CD2 3.62Å; F1135-L1154 HydrophobicContact CZ-CD2 3.88Å; F1135-Q1158 HydrophobicContact CD1-CG 4.3Å; F1135-Q1158 HydrophobicContact CE1-CB 4.42Å; F1135-Q1158 HydrophobicContact CE1-CG 4.05Å; F1135-Q1158 HydrophobicContact CE2-CG 4.46Å; F1135-Q1158 HydrophobicContact CZ-CG 4.13Å; F1135-Q1158 VanDerWaalsContact CZ-NE2 3.34Å; F1135-Q1158 VanDerWaalsContact CZ-OE1 3.3Å
1136	I	91.6	Very high	90.8	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-59.4	-44.2	177.5	-65.4	174.5	0	0	0	109.8	L1105 I1109 I1132 H1133 S1138 L1139 A1142 Y1143	L1105-I1136 HydrophobicContact CD1-CG1 4.18Å; L1105-I1136 HydrophobicContact CD1-CG2 4.35Å; I1109-I1136 HydrophobicContact CD1-CD1 4.07Å; I1132-I1136 HydrophobicContact CG1-CD1 4.25Å; I1132-I1136 HydrophobicContact CG1-CG1 4.13Å; I1132-I1136 HydrophobicContact CG2-CD1 3.93Å; I1132-I1136 WeakPolarHBondContact O-CG1 3.48Å; I1132-I1136 PolarHBondContact O-N 3.01Å; H1133-I1136 PolarHBondContact O-N 3.37Å; H1133-I1136 VanDerWaalsContact O-N 3.16Å; I1136-S1138 PolarHBondContact O-N 2.81Å; I1136-L1139 WeakPolarHBondContact O-CB 3.34Å; I1136-L1139 PolarHBondContact O-N 2.96Å; I1136-L1139 VanDerWaalsContact O-N 3.09Å; I1136-A1142 VanDerWaalsContact CG2-C 3.47Å; I1136-A1142 VanDerWaalsContact O-CA 3.26Å; I1136-A1142 WeakPolarHBondContact O-CA 3.28Å; I1136-Y1143 HydrophobicContact CD1-CD1 4.14Å; I1136-Y1143 HydrophobicContact CD1-CE1 3.67Å; I1136-Y1143 HydrophobicContact CG2-CD1 3.77Å; I1136-Y1143 HydrophobicContact CG2-CD2 3.85Å; I1136-Y1143 HydrophobicContact CG2-CE1 3.98Å; I1136-Y1143 HydrophobicContact CG2-CE2 4.08Å; I1136-Y1143 HydrophobicContact CG2-CG 3.7Å
1137	L	91.9	Very high	90.4	Very high	98 Å²	98	54.2 Å²	54.2	51%	0.513	29%	0.293	S	S	.	.	H	α-helix	trans	-64	-24.7	177.3	-70.2	178.1	0	0	0	113.9	H1133 D1134 F1135 L1139 A1142	H1133-L1137 PolarHBondContact O-N 3.34Å; D1134-L1137 PolarHBondContact O-N 2.94Å; F1135-L1137 VanDerWaalsContact C-N 3.29Å; F1135-L1137 PolarHBondContact O-N 2.91Å; L1137-L1139 VanDerWaalsContact C-N 3.26Å; L1137-L1139 PolarHBondContact O-N 2.72Å; L1137-A1142 HydrophobicContact CD2-CB 4.36Å
1138	S	90.9	Very high	89.5	Confident	85 Å²	85	55.5 Å²	55.5	59%	0.594	31%	0.306	S	S	*	.	H	α-helix	trans	-73.4	-16.2	174.8	78.6	0	0	0	0	113.8	D1134 F1135 I1136	D1134-S1138 PolarHBondContact O-N 2.84Å; D1134-S1138 VanDerWaalsContact O-N 3.14Å; F1135-S1138 WeakPolarHBondContact O-CB 3.45Å; F1135-S1138 PolarHBondContact O-N 2.6Å; F1135-S1138 PolarHBondContact O-OG 2.92Å; I1136-S1138 PolarHBondContact O-N 2.81Å
1139	L	89.1	Confident	88.2	Confident	28 Å²	28	58.7 Å²	58.7	15%	0.147	32%	0.323	C	S	.	.	S	Bend	trans	-76.7	146.7	177.7	-62.7	172.4	0	0	0	110.9	L1105 F1135 I1136 L1137 N1141 A1142 T1145	L1105-L1139 HydrophobicContact CD1-CD1 3.57Å; F1135-L1139 HydrophobicContact CE1-CD1 4.05Å; F1135-L1139 HydrophobicContact CE1-CD2 4.38Å; F1135-L1139 HydrophobicContact CE1-CG 4.36Å; F1135-L1139 HydrophobicContact CZ-CD2 4.03Å; F1135-L1139 HydrophobicContact CZ-CG 4.45Å; F1135-L1139 PolarHBondContact O-N 3.18Å; I1136-L1139 WeakPolarHBondContact O-CB 3.34Å; I1136-L1139 PolarHBondContact O-N 2.96Å; I1136-L1139 VanDerWaalsContact O-N 3.09Å; L1137-L1139 VanDerWaalsContact C-N 3.26Å; L1137-L1139 PolarHBondContact O-N 2.72Å; L1139-N1141 PolarHBondContact O-N 3.27Å; L1139-N1141 VanDerWaalsContact O-N 3.12Å; L1139-A1142 PolarHBondContact O-N 3.21Å; L1139-T1145 HydrophobicContact CD1-CG2 4.16Å
1140	P	85.2	Confident	86.7	Confident	124 Å²	124	61.5 Å²	61.5	81%	0.805	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-33.2	-174	19.4	-31.3	0	0	0	114.1
1141	N	88.5	Confident	85.2	Confident	109 Å²	109	62.3 Å²	62.3	58%	0.583	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.8	13.1	178.5	-64.9	-20	0	0	0	112.8	L1139 Y1143 E1144	L1139-N1141 PolarHBondContact O-N 3.27Å; L1139-N1141 VanDerWaalsContact O-N 3.12Å; N1141-Y1143 PolarHBondContact O-N 2.99Å; N1141-E1144 PolarHBondContact O-N 3.32Å
1142	A	91.9	Very high	83.9	Confident	27 Å²	27	61.9 Å²	61.9	22%	0.223	35%	0.348	C	S	.	.	G	3₁₀ helix	trans	44.5	-122.9	-175.4	0	0	0	0	0	113.2	I1136 L1137 L1139 E1144 T1145	I1136-A1142 VanDerWaalsContact CG2-C 3.47Å; I1136-A1142 VanDerWaalsContact O-CA 3.26Å; I1136-A1142 WeakPolarHBondContact O-CA 3.28Å; L1137-A1142 HydrophobicContact CD2-CB 4.36Å; L1139-A1142 PolarHBondContact O-N 3.21Å; A1142-E1144 VanDerWaalsContact C-N 3.26Å; A1142-E1144 PolarHBondContact O-N 3.05Å; A1142-T1145 VanDerWaalsContact O-CB 3.32Å; A1142-T1145 WeakPolarHBondContact O-CB 3.18Å; A1142-T1145 PolarHBondContact O-N 3.46Å; A1142-T1145 PolarHBondContact O-OG1 3.05Å
1143	Y	93	Very high	83	Confident	17 Å²	17	70.9 Å²	70.9	7%	0.067	39%	0.39	C	S	.	.	G	3₁₀ helix	trans	-67.6	-19	179.8	-79.4	-80.7	0	0	0	114.8	L1105 R1106 I1109 M1120 I1123 I1124 A1127 H1133 I1136 N1141 T1145	L1105-Y1143 PolarHBondContact N-O 3.16Å; R1106-Y1143 PolarHBondContact N-O 3Å; I1109-Y1143 HydrophobicContact CD1-CE1 4.26Å; M1120-Y1143 HydrophobicContact CE-CG 4.46Å; I1123-Y1143 HydrophobicContact CG2-CD1 4.23Å; I1123-Y1143 HydrophobicContact CG2-CE1 3.91Å; I1124-Y1143 HydrophobicContact CG1-CE2 4.1Å; A1127-Y1143 HydrophobicContact CB-CE1 4.31Å; A1127-Y1143 WeakPolarHBondContact CB-OH 3.2Å; H1133-Y1143 AromaticContact ND1-CE2 3.88Å; H1133-Y1143 AromaticContact ND1-CZ 3.74Å; H1133-Y1143 PolarHBondContact ND1-OH 3.26Å; I1136-Y1143 HydrophobicContact CD1-CD1 4.14Å; I1136-Y1143 HydrophobicContact CD1-CE1 3.67Å; I1136-Y1143 HydrophobicContact CG2-CD1 3.77Å; I1136-Y1143 HydrophobicContact CG2-CD2 3.85Å; I1136-Y1143 HydrophobicContact CG2-CE1 3.98Å; I1136-Y1143 HydrophobicContact CG2-CE2 4.08Å; I1136-Y1143 HydrophobicContact CG2-CG 3.7Å; N1141-Y1143 PolarHBondContact O-N 2.99Å; Y1143-T1145 VanDerWaalsContact C-N 3.27Å
1144	E	92	Very high	82.5	Confident	98 Å²	98	70.5 Å²	70.5	46%	0.458	39%	0.388	S	S	.	.	G	3₁₀ helix	trans	-87.6	2.5	177.3	-63.1	-60.6	158.7	0	0	112.4	R1106 N1141 A1142 L1146	R1106-E1144 IonicContact NH1-OE1 2.84Å; R1106-E1144 PolarHBondContact NH1-OE1 2.86Å; N1141-E1144 PolarHBondContact O-N 3.32Å; A1142-E1144 VanDerWaalsContact C-N 3.26Å; A1142-E1144 PolarHBondContact O-N 3.05Å; E1144-L1146 PolarHBondContact O-N 3.19Å
1145	T	90.4	Very high	82.2	Confident	12 Å²	12	66.2 Å²	66.2	7%	0.074	37%	0.368	C	S	.	.	P	Polyproline II helix	trans	-61.2	127.7	171.3	-52.8	0	0	0	0	109.8	S1104 L1105 L1139 A1142 Y1143 S1152	S1104-T1145 CarbonylContact C-O 3.58Å; S1104-T1145 WeakPolarHBondContact CA-O 3.46Å; L1105-T1145 PolarHBondContact N-O 3.32Å; L1139-T1145 HydrophobicContact CD1-CG2 4.16Å; A1142-T1145 VanDerWaalsContact O-CB 3.32Å; A1142-T1145 WeakPolarHBondContact O-CB 3.18Å; A1142-T1145 PolarHBondContact O-N 3.46Å; A1142-T1145 PolarHBondContact O-OG1 3.05Å; Y1143-T1145 VanDerWaalsContact C-N 3.27Å; T1145-S1152 WeakPolarHBondContact CG2-OG 3.27Å
1146	L	88.3	Confident	81.9	Confident	99 Å²	99	65.7 Å²	65.7	52%	0.518	38%	0.376	S	S	.	.	B	Isolated β-bridge	trans	-72.6	128.7	175.3	-64.2	173.8	0	0	0	109.9	E1144 G1151 S1152	E1144-L1146 PolarHBondContact O-N 3.19Å; L1146-G1151 WeakPolarHBondContact O-CA 3.45Å; L1146-S1152 PolarHBondContact O-N 3.47Å; L1146-S1152 PolarHBondContact O-OG 3.14Å
1147	A	83.1	Confident	81.6	Confident	0 Å²	0	65.8 Å²	65.8	0%	0	38%	0.377	C	S	.	.	P	Polyproline II helix	trans	-103.3	167.3	169.1	0	0	0	0	0	109.8	L1100 N1102 I1103 L1105 L1154	L1100-A1147 HydrophobicContact CB-CB 4.26Å; L1100-A1147 HydrophobicContact CD1-CB 4.03Å; N1102-A1147 VanDerWaalsContact CA-O 3.27Å; N1102-A1147 WeakPolarHBondContact CA-O 3.45Å; N1102-A1147 PolarHBondContact OD1-O 3.4Å; I1103-A1147 PolarHBondContact O-N 3.47Å; L1105-A1147 HydrophobicContact CD2-CB 3.82Å; L1105-A1147 HydrophobicContact CG-CB 4.49Å; A1147-L1154 HydrophobicContact CB-CD1 4.36Å
1148	G	75.4	Confident	81.4	Confident	27 Å²	27	62.6 Å²	62.6	28%	0.278	36%	0.36	S	S	.	.	S	Bend	trans	116.5	-163.3	178.5	0	0	0	0	0	112.8	G1151	G1148-G1151 PolarHBondContact O-N 3.14Å
1149	Q	66.3	Low	81.3	Confident	186 Å²	186	62.5 Å²	62.5	87%	0.869	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.9	-33.4	-179.2	-72.5	-178.8	-16.9	0	0	113
1150	D	57.4	Low	81.3	Confident	129 Å²	129	61.5 Å²	61.5	69%	0.69	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.1	0.6	179.2	-57.3	-37.9	0	0	0	112.9	N1102	N1102-D1150 PolarHBondContact ND2-OD2 3.23Å
1151	G	59.8	Low	81.6	Confident	17 Å²	17	56.5 Å²	56.5	18%	0.175	31%	0.309	C	S	.	.	S	Bend	trans	-101.5	-169.3	-173.2	0	0	0	0	0	114.2	L1146 G1148	L1146-G1151 WeakPolarHBondContact O-CA 3.45Å; G1148-G1151 PolarHBondContact O-N 3.14Å
1152	S	62.6	Low	81.8	Confident	43 Å²	43	51.4 Å²	51.4	30%	0.301	28%	0.281	S	S	.	.			trans	-61.1	135.3	176.9	59.5	0	0	0	0	112.4	T1145 L1146 L1154	T1145-S1152 WeakPolarHBondContact CG2-OG 3.27Å; L1146-S1152 PolarHBondContact O-N 3.47Å; L1146-S1152 PolarHBondContact O-OG 3.14Å; S1152-L1154 PolarHBondContact O-N 3.41Å
1153	H	72.3	Confident	81.8	Confident	189 Å²	189	50.4 Å²	50.4	88%	0.875	27%	0.273	S	S	*	.			trans	-72.9	93.8	175.9	-67.1	-64	0	0	0	110.5
1154	L	82.1	Confident	81.7	Confident	15 Å²	15	49.7 Å²	49.7	8%	0.079	27%	0.27	C	S	.	.			trans	-80.3	142.6	173.2	-60.8	172.4	0	0	0	111.1	L1100 L1105 F1135 A1147 S1152 Q1158 K1159 I1162	L1100-L1154 HydrophobicContact CD1-CD1 3.74Å; L1105-L1154 HydrophobicContact CD2-CD1 4.01Å; F1135-L1154 HydrophobicContact CE1-CD2 3.62Å; F1135-L1154 HydrophobicContact CZ-CD2 3.88Å; A1147-L1154 HydrophobicContact CB-CD1 4.36Å; S1152-L1154 PolarHBondContact O-N 3.41Å; L1154-Q1158 HydrophobicContact CB-CB 4.24Å; L1154-K1159 HydrophobicContact CB-CG 3.87Å; L1154-K1159 WeakPolarHBondContact O-CE 3.47Å; L1154-I1162 HydrophobicContact CD1-CD1 3.56Å
1155	S	84.1	Confident	81.8	Confident	39 Å²	39	45 Å²	45	27%	0.273	25%	0.249	S	C	.	.			trans	-64.8	157.5	172.6	81.5	0	0	0	0	111.1	G1157 Q1158 K1159	S1155-G1157 VanDerWaalsContact C-N 3.26Å; S1155-G1157 PolarHBondContact O-N 3.19Å; S1155-Q1158 PolarHBondContact O-N 3.37Å; S1155-Q1158 VanDerWaalsContact O-N 3.09Å; S1155-Q1158 VanDerWaalsContact OG-CD 3.3Å; S1155-Q1158 VanDerWaalsContact OG-CG 3.29Å; S1155-Q1158 WeakPolarHBondContact OG-CG 3.43Å; S1155-Q1158 PolarHBondContact OG-N 3.33Å; S1155-K1159 WeakPolarHBondContact O-CG 3.49Å; S1155-K1159 PolarHBondContact O-N 3.4Å
1156	G	83	Confident	81.9	Confident	37 Å²	37	44.7 Å²	44.7	38%	0.381	25%	0.246	S	C	.	.	H	α-helix	trans	-50.9	-48.7	175.2	0	0	0	0	0	111.4	Q1158 K1159 Q1160	G1156-Q1158 VanDerWaalsContact C-N 3.31Å; G1156-Q1158 PolarHBondContact O-N 2.91Å; G1156-K1159 WeakPolarHBondContact O-CB 3.19Å; G1156-K1159 PolarHBondContact O-N 3.45Å; G1156-K1159 VanDerWaalsContact O-N 3.09Å; G1156-Q1160 PolarHBondContact O-N 3.24Å; G1156-Q1160 PolarHBondContact O-OE1 3.08Å
1157	G	85.2	Confident	82.1	Confident	2 Å²	2	40 Å²	40	2%	0.021	22%	0.221	C	C	.	.	H	α-helix	trans	-61.2	-34.5	178.9	0	0	0	0	0	115	S1155 R1161	S1155-G1157 VanDerWaalsContact C-N 3.26Å; S1155-G1157 PolarHBondContact O-N 3.19Å; G1157-R1161 WeakPolarHBondContact O-CG 3.48Å; G1157-R1161 PolarHBondContact O-N 2.99Å; G1157-R1161 VanDerWaalsContact O-N 3.15Å
1158	Q	88.5	Confident	82.5	Confident	31 Å²	31	40.2 Å²	40.2	15%	0.145	22%	0.222	C	C	.	.	H	α-helix	trans	-69.5	-42.9	174.9	-69.3	160.7	1.3	0	0	111.1	I1132 F1135 L1154 S1155 G1156 Q1160 R1161 I1162	I1132-Q1158 HydrophobicContact CD1-CB 4.26Å; I1132-Q1158 HydrophobicContact CD1-CG 4.29Å; F1135-Q1158 HydrophobicContact CD1-CG 4.3Å; F1135-Q1158 HydrophobicContact CE1-CB 4.42Å; F1135-Q1158 HydrophobicContact CE1-CG 4.05Å; F1135-Q1158 HydrophobicContact CE2-CG 4.46Å; F1135-Q1158 HydrophobicContact CZ-CG 4.13Å; F1135-Q1158 VanDerWaalsContact CZ-NE2 3.34Å; F1135-Q1158 VanDerWaalsContact CZ-OE1 3.3Å; L1154-Q1158 HydrophobicContact CB-CB 4.24Å; S1155-Q1158 PolarHBondContact O-N 3.37Å; S1155-Q1158 VanDerWaalsContact O-N 3.09Å; S1155-Q1158 VanDerWaalsContact OG-CD 3.3Å; S1155-Q1158 VanDerWaalsContact OG-CG 3.29Å; S1155-Q1158 WeakPolarHBondContact OG-CG 3.43Å; S1155-Q1158 PolarHBondContact OG-N 3.33Å; G1156-Q1158 VanDerWaalsContact C-N 3.31Å; G1156-Q1158 PolarHBondContact O-N 2.91Å; Q1158-Q1160 VanDerWaalsContact C-N 3.33Å; Q1158-Q1160 PolarHBondContact O-N 3.3Å; Q1158-R1161 PolarHBondContact O-N 3.42Å; Q1158-I1162 WeakPolarHBondContact O-CG1 3.38Å; Q1158-I1162 PolarHBondContact O-N 3.42Å
1159	K	89.2	Confident	83.3	Confident	83 Å²	83	39.3 Å²	39.3	36%	0.361	21%	0.211	S	C	.	.	H	α-helix	trans	-61.9	-41.8	175.8	-63.1	178.6	178.8	175.1	0	111.6	P1098 L1100 L1154 S1155 G1156 R1161 I1162 A1163	P1098-K1159 HydrophobicContact CG-CB 3.73Å; L1100-K1159 HydrophobicContact CD1-CB 4.3Å; L1100-K1159 HydrophobicContact CD1-CG 3.9Å; L1154-K1159 HydrophobicContact CB-CG 3.87Å; L1154-K1159 WeakPolarHBondContact O-CE 3.47Å; S1155-K1159 WeakPolarHBondContact O-CG 3.49Å; S1155-K1159 PolarHBondContact O-N 3.4Å; G1156-K1159 WeakPolarHBondContact O-CB 3.19Å; G1156-K1159 PolarHBondContact O-N 3.45Å; G1156-K1159 VanDerWaalsContact O-N 3.09Å; K1159-R1161 PolarHBondContact O-N 3.1Å; K1159-I1162 PolarHBondContact O-N 3.46Å; K1159-A1163 PolarHBondContact O-N 2.99Å
1160	Q	89.4	Confident	84.2	Confident	8 Å²	8	32 Å²	32	4%	0.037	18%	0.176	C	C	.	.	H	α-helix	trans	-56	-49.8	173.8	-107.2	72.1	-5.3	0	0	111.7	Q1096 P1098 G1156 Q1158 I1162 A1163 I1164 A1180 L1184 V1192	Q1096-Q1160 PolarHBondContact O-NE2 3.15Å; P1098-Q1160 VanDerWaalsContact CD-CD 3.45Å; P1098-Q1160 HydrophobicContact CG-CG 4.35Å; G1156-Q1160 PolarHBondContact O-N 3.24Å; G1156-Q1160 PolarHBondContact O-OE1 3.08Å; Q1158-Q1160 VanDerWaalsContact C-N 3.33Å; Q1158-Q1160 PolarHBondContact O-N 3.3Å; Q1160-I1162 VanDerWaalsContact C-N 3.32Å; Q1160-I1162 PolarHBondContact O-N 3.28Å; Q1160-A1163 WeakPolarHBondContact O-CB 3.39Å; Q1160-A1163 PolarHBondContact O-N 3.46Å; Q1160-A1163 VanDerWaalsContact O-N 3.1Å; Q1160-I1164 WeakPolarHBondContact O-CG1 3.35Å; Q1160-I1164 PolarHBondContact O-N 3.37Å; Q1160-A1180 VanDerWaalsContact CG-O 3.29Å; Q1160-A1180 WeakPolarHBondContact CG-O 3.12Å; Q1160-L1184 HydrophobicContact CG-CD1 4.46Å; Q1160-V1192 HydrophobicContact CB-CG1 4.26Å; Q1160-V1192 HydrophobicContact CB-CG2 3.96Å; Q1160-V1192 HydrophobicContact CG-CG1 4.43Å
1161	R	90.7	Very high	85.7	Confident	19 Å²	19	32.1 Å²	32.1	7%	0.072	17%	0.17	C	C	.	.	H	α-helix	trans	-63.1	-36.5	178.3	-71.6	-176.4	-78.8	175.4	-7.3	112.9	A1130 N1131 I1132 G1157 Q1158 K1159 A1163 I1164 A1165 V1192	A1130-R1161 VanDerWaalsContact CB-O 3.31Å; A1130-R1161 WeakPolarHBondContact CB-O 3.35Å; A1130-R1161 WeakPolarHBondContact O-CB 3.18Å; A1130-R1161 VanDerWaalsContact O-CD 3.27Å; A1130-R1161 WeakPolarHBondContact O-CD 3.36Å; A1130-R1161 WeakPolarHBondContact O-CG 3.5Å; N1131-R1161 PolarHBondContact O-NH1 2.9Å; I1132-R1161 HydrophobicContact CB-CB 3.95Å; I1132-R1161 HydrophobicContact CD1-CB 4.03Å; I1132-R1161 HydrophobicContact CG1-CB 4.19Å; G1157-R1161 WeakPolarHBondContact O-CG 3.48Å; G1157-R1161 PolarHBondContact O-N 2.99Å; G1157-R1161 VanDerWaalsContact O-N 3.15Å; Q1158-R1161 PolarHBondContact O-N 3.42Å; K1159-R1161 PolarHBondContact O-N 3.1Å; R1161-A1163 VanDerWaalsContact C-N 3.33Å; R1161-A1163 PolarHBondContact O-N 3.46Å; R1161-I1164 WeakPolarHBondContact O-CB 3.2Å; R1161-I1164 PolarHBondContact O-N 3.42Å; R1161-A1165 PolarHBondContact O-N 3.06Å; R1161-V1192 HydrophobicContact CG-CG2 3.87Å
1162	I	92.3	Very high	87.2	Confident	1 Å²	1	31.5 Å²	31.5	1%	0.005	16%	0.163	C	C	.	.	H	α-helix	trans	-63.9	-40.5	173.2	-65.7	159.3	0	0	0	110.9	L1100 L1105 N1108 I1109 I1132 L1154 Q1158 K1159 Q1160 I1164 A1165 R1166	L1100-I1162 HydrophobicContact CD1-CD1 3.93Å; L1100-I1162 HydrophobicContact CD2-CB 4.2Å; L1100-I1162 HydrophobicContact CD2-CG2 3.61Å; L1105-I1162 HydrophobicContact CD2-CD1 3.48Å; L1105-I1162 VanDerWaalsContact CD2-CD1 3.48Å; L1105-I1162 HydrophobicContact CD2-CG1 4.34Å; N1108-I1162 HydrophobicContact CB-CG2 4.46Å; I1109-I1162 HydrophobicContact CG1-CG2 4.08Å; I1132-I1162 HydrophobicContact CG1-CG1 4.18Å; L1154-I1162 HydrophobicContact CD1-CD1 3.56Å; Q1158-I1162 WeakPolarHBondContact O-CG1 3.38Å; Q1158-I1162 PolarHBondContact O-N 3.42Å; K1159-I1162 PolarHBondContact O-N 3.46Å; Q1160-I1162 VanDerWaalsContact C-N 3.32Å; Q1160-I1162 PolarHBondContact O-N 3.28Å; I1162-I1164 VanDerWaalsContact C-N 3.34Å; I1162-A1165 PolarHBondContact O-N 3.24Å; I1162-R1166 WeakPolarHBondContact O-CB 3.44Å; I1162-R1166 PolarHBondContact O-N 3.4Å
1163	A	91.7	Very high	88.5	Confident	7 Å²	7	30.7 Å²	30.7	6%	0.058	16%	0.156	C	C	.	.	H	α-helix	trans	-66.2	-35.6	175.1	0	0	0	0	0	112.7	P1098 K1159 Q1160 R1161 R1166 A1167	P1098-A1163 HydrophobicContact CB-CB 3.48Å; P1098-A1163 VanDerWaalsContact CB-CB 3.48Å; P1098-A1163 HydrophobicContact CG-CB 4.46Å; K1159-A1163 PolarHBondContact O-N 2.99Å; Q1160-A1163 WeakPolarHBondContact O-CB 3.39Å; Q1160-A1163 PolarHBondContact O-N 3.46Å; Q1160-A1163 VanDerWaalsContact O-N 3.1Å; R1161-A1163 VanDerWaalsContact C-N 3.33Å; R1161-A1163 PolarHBondContact O-N 3.46Å; A1163-R1166 WeakPolarHBondContact O-CB 3.42Å; A1163-R1166 PolarHBondContact O-N 2.93Å; A1163-A1167 WeakPolarHBondContact O-CB 3.39Å; A1163-A1167 PolarHBondContact O-N 3.34Å
1164	I	92.1	Very high	89.5	Confident	2 Å²	2	21.7 Å²	21.7	1%	0.01	11%	0.114	C	C	.	.	H	α-helix	trans	-61.9	-48.6	171.7	-66.7	167.1	0	0	0	110.1	V1094 A1130 Q1160 R1161 I1162 R1166 A1167 I1168 V1192 A1195 L1196	V1094-I1164 HydrophobicContact CG1-CG1 4.16Å; V1094-I1164 HydrophobicContact CG2-CG1 4.01Å; A1130-I1164 HydrophobicContact CB-CB 4.19Å; A1130-I1164 HydrophobicContact CB-CG2 3.96Å; Q1160-I1164 WeakPolarHBondContact O-CG1 3.35Å; Q1160-I1164 PolarHBondContact O-N 3.37Å; R1161-I1164 WeakPolarHBondContact O-CB 3.2Å; R1161-I1164 PolarHBondContact O-N 3.42Å; I1162-I1164 VanDerWaalsContact C-N 3.34Å; I1164-R1166 VanDerWaalsContact C-N 3.3Å; I1164-R1166 PolarHBondContact O-N 2.95Å; I1164-A1167 PolarHBondContact O-N 3.14Å; I1164-A1167 VanDerWaalsContact O-N 3.11Å; I1164-I1168 HydrophobicContact CG2-CD1 3.53Å; I1164-I1168 HydrophobicContact CG2-CG1 4.35Å; I1164-I1168 VanDerWaalsContact O-CG1 3.28Å; I1164-I1168 WeakPolarHBondContact O-CG1 3.29Å; I1164-I1168 PolarHBondContact O-N 3.48Å; I1164-V1192 HydrophobicContact CD1-CG1 4.02Å; I1164-A1195 HydrophobicContact CD1-CB 4.08Å; I1164-L1196 HydrophobicContact CD1-CD2 3.58Å; I1164-L1196 HydrophobicContact CD1-CG 3.87Å; I1164-L1196 HydrophobicContact CG1-CD2 3.83Å
1165	A	93.6	Very high	90	Very high	0 Å²	0	21 Å²	21	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-57.8	-43.8	175.4	0	0	0	0	0	111.6	I1109 A1126 A1130 R1161 I1162 A1167 I1168 I1169	I1109-A1165 HydrophobicContact CD1-CB 4.28Å; I1109-A1165 HydrophobicContact CG1-CB 4.12Å; I1109-A1165 HydrophobicContact CG2-CB 4.1Å; A1126-A1165 HydrophobicContact CB-CB 4.39Å; A1130-A1165 HydrophobicContact CB-CB 3.77Å; R1161-A1165 PolarHBondContact O-N 3.06Å; I1162-A1165 PolarHBondContact O-N 3.24Å; A1165-A1167 VanDerWaalsContact C-N 3.35Å; A1165-A1167 PolarHBondContact O-N 3.49Å; A1165-I1168 PolarHBondContact O-N 3.3Å; A1165-I1169 PolarHBondContact O-N 2.98Å
1166	R	93.5	Very high	90.4	Very high	4 Å²	4	19.2 Å²	19.2	2%	0.015	10%	0.098	C	C	.	.	H	α-helix	trans	-60.7	-40.3	175.1	-170.9	-166.5	-70.4	167.1	-0	112.2	F239 I1099 N1108 G1112 I1162 A1163 I1164 I1169	F239-R1166 HydrophobicContact CD1-CG 4.1Å; F239-R1166 HydrophobicContact CE1-CB 4.47Å; F239-R1166 HydrophobicContact CE1-CG 3.54Å; F239-R1166 HydrophobicContact CZ-CG 3.86Å; I1099-R1166 PolarHBondContact O-NH1 3.38Å; I1099-R1166 PolarHBondContact O-NH2 3.2Å; I1099-R1166 VanDerWaalsContact O-NH2 3.12Å; N1108-R1166 WeakPolarHBondContact O-CG 3.19Å; N1108-R1166 PolarHBondContact O-NE 2.91Å; N1108-R1166 PolarHBondContact OD1-NH2 3.46Å; G1112-R1166 WeakPolarHBondContact CA-O 3.43Å; I1162-R1166 WeakPolarHBondContact O-CB 3.44Å; I1162-R1166 PolarHBondContact O-N 3.4Å; A1163-R1166 WeakPolarHBondContact O-CB 3.42Å; A1163-R1166 PolarHBondContact O-N 2.93Å; I1164-R1166 VanDerWaalsContact C-N 3.3Å; I1164-R1166 PolarHBondContact O-N 2.95Å; R1166-I1169 WeakPolarHBondContact O-CG2 3.43Å
1167	A	92.1	Very high	90.8	Very high	0 Å²	0	17.5 Å²	17.5	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-69.6	-37.2	178.9	0	0	0	0	0	112.5	V1094 A1163 I1164 A1165 P1172 L1175	V1094-A1167 HydrophobicContact CG2-CB 3.97Å; A1163-A1167 WeakPolarHBondContact O-CB 3.39Å; A1163-A1167 PolarHBondContact O-N 3.34Å; I1164-A1167 PolarHBondContact O-N 3.14Å; I1164-A1167 VanDerWaalsContact O-N 3.11Å; A1165-A1167 VanDerWaalsContact C-N 3.35Å; A1165-A1167 PolarHBondContact O-N 3.49Å; A1167-P1172 WeakPolarHBondContact O-CD 3.36Å; A1167-P1172 WeakPolarHBondContact O-CG 3.41Å; A1167-L1175 HydrophobicContact CB-CD1 4.41Å
1168	I	91.6	Very high	91	Very high	5 Å²	5	18.5 Å²	18.5	3%	0.026	9%	0.085	C	C	.	.	H	α-helix	trans	-78.1	-28.9	-174.4	-66.5	167.3	0	0	0	112.6	L1129 I1164 A1165 R1170 K1171 A1199	L1129-I1168 HydrophobicContact CB-CD1 4.46Å; L1129-I1168 HydrophobicContact CD1-CG2 4.04Å; I1164-I1168 HydrophobicContact CG2-CD1 3.53Å; I1164-I1168 HydrophobicContact CG2-CG1 4.35Å; I1164-I1168 VanDerWaalsContact O-CG1 3.28Å; I1164-I1168 WeakPolarHBondContact O-CG1 3.29Å; I1164-I1168 PolarHBondContact O-N 3.48Å; A1165-I1168 PolarHBondContact O-N 3.3Å; I1168-R1170 PolarHBondContact O-N 3.08Å; I1168-R1170 VanDerWaalsContact O-N 3.11Å; I1168-K1171 WeakPolarHBondContact O-CA 3.46Å; I1168-K1171 PolarHBondContact O-N 2.63Å; I1168-A1199 HydrophobicContact CD1-CB 3.56Å; I1168-A1199 HydrophobicContact CG1-CB 4.1Å
1169	I	91	Very high	90.9	Very high	8 Å²	8	18.4 Å²	18.4	4%	0.041	9%	0.085	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-32.2	-170	-152.6	166.6	0	0	0	114.3	I1109 G1112 D1113 V1118 I1123 A1126 A1165 R1166 K1171	I1109-I1169 HydrophobicContact CG2-CD1 3.72Å; G1112-I1169 VanDerWaalsContact CA-CG2 3.47Å; D1113-I1169 HydrophobicContact CB-CG2 4.26Å; V1118-I1169 HydrophobicContact CB-CD1 4.43Å; V1118-I1169 HydrophobicContact CG1-CD1 3.54Å; V1118-I1169 HydrophobicContact CG1-CG1 3.93Å; V1118-I1169 HydrophobicContact CG2-CD1 4.39Å; I1123-I1169 HydrophobicContact CG1-CD1 3.9Å; A1126-I1169 HydrophobicContact CB-CB 4.37Å; A1126-I1169 HydrophobicContact CB-CG1 4.3Å; A1165-I1169 PolarHBondContact O-N 2.98Å; R1166-I1169 WeakPolarHBondContact O-CG2 3.43Å; I1169-K1171 PolarHBondContact O-N 3.06Å
1170	R	86.6	Confident	90.5	Very high	34 Å²	34	14.7 Å²	14.7	13%	0.128	7%	0.069	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.4	-1.4	176.5	71.3	172.8	84.7	174	14.4	113.8	A238 R1088 R1089 I1091 G1112 D1113 I1168 P1172	A238-R1170 PolarHBondContact O-NH1 2.82Å; A238-R1170 PolarHBondContact O-NH2 2.81Å; R1088-R1170 PolarHBondContact O-NH1 3.11Å; R1089-R1170 VanDerWaalsContact O-CD 3.29Å; R1089-R1170 WeakPolarHBondContact O-CD 3.27Å; I1091-R1170 VanDerWaalsContact O-CZ 3.25Å; I1091-R1170 PolarHBondContact O-NH1 3.15Å; G1112-R1170 PolarHBondContact O-NE 3.37Å; D1113-R1170 HydrophobicContact CB-CB 4.16Å; I1168-R1170 PolarHBondContact O-N 3.08Å; I1168-R1170 VanDerWaalsContact O-N 3.11Å; R1170-P1172 HydrophobicContact CG-CB 4.29Å; R1170-P1172 HydrophobicContact CG-CG 4.44Å
1171	K	88.2	Confident	90.1	Very high	130 Å²	130	14.5 Å²	14.5	57%	0.565	7%	0.069	S	C	*	.			trans	50.6	60.7	-174.6	-61.6	179.4	179	179.6	0	112.2	I1168 I1169	I1168-K1171 WeakPolarHBondContact O-CA 3.46Å; I1168-K1171 PolarHBondContact O-N 2.63Å; I1169-K1171 PolarHBondContact O-N 3.06Å
1172	P	90.8	Very high	89.2	Confident	4 Å²	4	14.5 Å²	14.5	3%	0.026	7%	0.072	C	C	.	.			trans	-67.4	149.5	-175.2	31.4	-36.4	0	0	0	111.4	Q1090 A1167 R1170 R1203	Q1090-P1172 WeakPolarHBondContact O-CB 3.43Å; A1167-P1172 WeakPolarHBondContact O-CD 3.36Å; A1167-P1172 WeakPolarHBondContact O-CG 3.41Å; R1170-P1172 HydrophobicContact CG-CB 4.29Å; R1170-P1172 HydrophobicContact CG-CG 4.44Å; P1172-R1203 WeakPolarHBondContact O-CD 3.25Å; P1172-R1203 WeakPolarHBondContact O-CG 3.32Å; P1172-R1203 PolarHBondContact O-NE 3.24Å; P1172-R1203 VanDerWaalsContact O-NE 3.15Å
1173	T	90.7	Very high	88	Confident	26 Å²	26	19.3 Å²	19.3	16%	0.16	11%	0.112	C	C	.	.	S	Bend	trans	-87.2	-29	172.5	47.5	0	0	0	0	111.8	F1005 Q1090 T1204	F1005-T1173 VanDerWaalsContact CD1-OG1 3.22Å; F1005-T1173 WeakPolarHBondContact CD1-OG1 3.28Å; F1005-T1173 WeakPolarHBondContact O-CG2 3.48Å; Q1090-T1173 PolarHBondContact O-N 3.46Å; T1173-T1204 PolarHBondContact O-N 2.93Å
1174	L	92.5	Very high	87.1	Confident	0 Å²	0	19.5 Å²	19.5	0%	0	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	123.3	173	-179.5	59	0	0	0	110.7	F1005 I1009 F1074 Q1090 I1091 G1092 L1176 T1204 I1206	F1005-L1174 HydrophobicContact CE1-CB 4.28Å; I1009-L1174 HydrophobicContact CD1-CD1 3.68Å; I1009-L1174 HydrophobicContact CD1-CD2 3.5Å; I1009-L1174 HydrophobicContact CD1-CG 4.23Å; F1074-L1174 HydrophobicContact CZ-CD2 4.06Å; Q1090-L1174 PolarHBondContact O-N 3.38Å; I1091-L1174 CarbonylContact C-O 3.6Å; I1091-L1174 WeakPolarHBondContact CA-O 3.41Å; I1091-L1174 HydrophobicContact CD1-CD2 4.34Å; I1091-L1174 HydrophobicContact CG1-CB 4.38Å; I1091-L1174 HydrophobicContact CG1-CD2 4.04Å; I1091-L1174 HydrophobicContact CG1-CG 4.48Å; G1092-L1174 PolarHBondContact N-O 3.04Å; L1174-L1176 HydrophobicContact CD1-CD2 4.04Å; L1174-L1176 HydrophobicContact CD2-CD2 4.02Å; L1174-L1176 HydrophobicContact CD2-CG 4.48Å; L1174-L1176 HydrophobicContact CG-CD2 3.88Å; L1174-L1176 HydrophobicContact CG-CG 4.28Å; L1174-T1204 CarbonylContact C-O 3.57Å; L1174-T1204 WeakPolarHBondContact CA-O 3.3Å; L1174-T1204 HydrophobicContact CD1-CG2 3.94Å; L1174-T1204 WeakPolarHBondContact CD1-O 3.47Å; L1174-I1206 HydrophobicContact CD1-CD1 4.25Å; L1174-I1206 HydrophobicContact CD1-CG1 4.29Å
1175	L	93.2	Very high	86.4	Confident	2 Å²	2	23.7 Å²	23.7	1%	0.01	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	123	174.3	-169.9	66.8	0	0	0	109.9	G1092 A1167 L1177 A1199 M1200 T1204 S1205 I1206	G1092-L1175 CarbonylContact O-C 3.56Å; G1092-L1175 WeakPolarHBondContact O-CA 3.24Å; A1167-L1175 HydrophobicContact CB-CD1 4.41Å; L1175-L1177 HydrophobicContact CD1-CD2 4.31Å; L1175-L1177 HydrophobicContact CD2-CD1 4.32Å; L1175-L1177 HydrophobicContact CD2-CD2 4.04Å; L1175-L1177 HydrophobicContact CD2-CG 4.32Å; L1175-L1177 HydrophobicContact CG-CD2 3.86Å; L1175-L1177 HydrophobicContact CG-CG 4.17Å; L1175-A1199 HydrophobicContact CD2-CB 4.03Å; L1175-M1200 HydrophobicContact CD2-CG 3.96Å; L1175-T1204 PolarHBondContact N-O 2.96Å; L1175-S1205 CarbonylContact O-C 3.53Å; L1175-S1205 WeakPolarHBondContact O-CA 3.22Å; L1175-I1206 PolarHBondContact O-N 3.34Å
1176	L	93.4	Very high	85.5	Confident	0 Å²	0	29.6 Å²	29.6	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	117.3	178.3	-57.6	-177.8	0	0	0	109.1	I1054 L1057 Q1058 I1091 G1092 I1093 V1094 L1174 I1206	I1054-L1176 HydrophobicContact CD1-CB 4.33Å; I1054-L1176 HydrophobicContact CG2-CB 4.25Å; I1054-L1176 HydrophobicContact CG2-CD1 4.01Å; L1057-L1176 HydrophobicContact CB-CD1 4.3Å; L1057-L1176 HydrophobicContact CD1-CD2 4.04Å; Q1058-L1176 HydrophobicContact CG-CD1 4Å; I1091-L1176 HydrophobicContact CD1-CD1 4.37Å; I1091-L1176 HydrophobicContact CG2-CB 4.46Å; I1091-L1176 HydrophobicContact CG2-CD1 3.49Å; I1091-L1176 VanDerWaalsContact CG2-CD1 3.49Å; I1091-L1176 HydrophobicContact CG2-CG 3.76Å; G1092-L1176 PolarHBondContact O-N 3.31Å; I1093-L1176 WeakPolarHBondContact CA-O 3.34Å; V1094-L1176 PolarHBondContact N-O 3.18Å; L1174-L1176 HydrophobicContact CD1-CD2 4.04Å; L1174-L1176 HydrophobicContact CD2-CD2 4.02Å; L1174-L1176 HydrophobicContact CD2-CG 4.48Å; L1174-L1176 HydrophobicContact CG-CD2 3.88Å; L1174-L1176 HydrophobicContact CG-CG 4.28Å; L1176-I1206 HydrophobicContact CD2-CB 3.86Å; L1176-I1206 HydrophobicContact CD2-CD1 3.86Å; L1176-I1206 HydrophobicContact CD2-CG1 4.15Å
1177	L	91.5	Very high	84.6	Confident	1 Å²	1	36.5 Å²	36.5	1%	0.005	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	105	-177.7	-56.6	-179.9	0	0	0	108.5	V1094 L1175 L1196 M1200 I1206 I1207 I1208	V1094-L1177 HydrophobicContact CB-CD2 3.72Å; V1094-L1177 HydrophobicContact CG2-CD2 3.67Å; L1175-L1177 HydrophobicContact CD1-CD2 4.31Å; L1175-L1177 HydrophobicContact CD2-CD1 4.32Å; L1175-L1177 HydrophobicContact CD2-CD2 4.04Å; L1175-L1177 HydrophobicContact CD2-CG 4.32Å; L1175-L1177 HydrophobicContact CG-CD2 3.86Å; L1175-L1177 HydrophobicContact CG-CG 4.17Å; L1177-L1196 HydrophobicContact CD1-CB 4.45Å; L1177-L1196 HydrophobicContact CD1-CD1 4.47Å; L1177-L1196 HydrophobicContact CD1-CD2 3.82Å; L1177-L1196 HydrophobicContact CD1-CG 4.47Å; L1177-L1196 HydrophobicContact CD2-CD2 3.57Å; L1177-L1196 HydrophobicContact CG-CD2 4.32Å; L1177-M1200 HydrophobicContact CD1-CG 4.23Å; L1177-M1200 HydrophobicContact CD1-SD 3.87Å; L1177-I1206 PolarHBondContact N-O 3.16Å; L1177-I1207 HydrophobicContact CB-CB 4.46Å; L1177-I1207 HydrophobicContact CB-CG2 4.06Å; L1177-I1207 HydrophobicContact CD1-CD1 4.34Å; L1177-I1207 HydrophobicContact CD1-CG1 4.1Å; L1177-I1207 HydrophobicContact CD1-CG2 4.49Å; L1177-I1207 CarbonylContact O-C 3.59Å; L1177-I1207 WeakPolarHBondContact O-CA 3.38Å; L1177-I1208 PolarHBondContact O-N 2.98Å
1178	D	89.5	Confident	84	Confident	23 Å²	23	37.6 Å²	37.6	12%	0.123	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	95.4	-177.9	-169	12.1	0	0	0	109.2	S1051 I1054 V1094 S1095 Q1096 A1180 I1208	S1051-D1178 PolarHBondContact OG-OD1 3.17Å; I1054-D1178 HydrophobicContact CD1-CB 4.05Å; V1094-D1178 PolarHBondContact O-N 3.13Å; S1095-D1178 CarbonylContact C-O 3.42Å; Q1096-D1178 WeakPolarHBondContact CA-O 3.41Å; Q1096-D1178 PolarHBondContact N-O 3.42Å; D1178-A1180 PolarHBondContact O-N 3.23Å; D1178-A1180 VanDerWaalsContact O-N 3.08Å; D1178-I1208 WeakPolarHBondContact OD1-CD1 3.44Å
1179	E	85.2	Confident	83.5	Confident	29 Å²	29	38.2 Å²	38.2	14%	0.136	21%	0.207	C	C	.	.	S	Bend	trans	51.1	36.3	178.2	-60.1	-170.8	174.9	0	0	114.6	Q1096 T1181 S1182 I1208	Q1096-E1179 HydrophobicContact CB-CB 4.29Å; Q1096-E1179 HydrophobicContact CG-CB 4.34Å; Q1096-E1179 PolarHBondContact NE2-OE2 3.11Å; E1179-T1181 PolarHBondContact O-N 3.28Å; E1179-S1182 WeakPolarHBondContact O-CB 3.34Å; E1179-S1182 PolarHBondContact O-N 3.02Å; E1179-S1182 PolarHBondContact O-OG 3.44Å; E1179-I1208 WeakPolarHBondContact CA-O 3.45Å; E1179-I1208 HydrophobicContact CG-CB 4.38Å; E1179-I1208 HydrophobicContact CG-CG2 3.75Å; E1179-I1208 PolarHBondContact N-O 3.06Å
1180	A	81.1	Confident	83	Confident	5 Å²	5	47.3 Å²	47.3	4%	0.041	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-17.1	-171.4	0	0	0	0	0	115.1	V1094 Q1160 D1178 L1196	V1094-A1180 HydrophobicContact CB-CB 4.44Å; V1094-A1180 HydrophobicContact CG1-CB 3.81Å; Q1160-A1180 VanDerWaalsContact CG-O 3.29Å; Q1160-A1180 WeakPolarHBondContact CG-O 3.12Å; D1178-A1180 PolarHBondContact O-N 3.23Å; D1178-A1180 VanDerWaalsContact O-N 3.08Å; A1180-L1196 HydrophobicContact CB-CD1 3.93Å
1181	T	81.3	Confident	82.9	Confident	5 Å²	5	48.8 Å²	48.8	3%	0.031	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.6	1.5	179	55	0	0	0	0	114.1	E1179 V1192 L1196 R1211 T1214	E1179-T1181 PolarHBondContact O-N 3.28Å; T1181-V1192 HydrophobicContact CG2-CG1 4.4Å; T1181-L1196 HydrophobicContact CG2-CD1 3.96Å; T1181-R1211 PolarHBondContact O-NH1 2.76Å; T1181-T1214 PolarHBondContact OG1-OG1 3.37Å
1182	S	71.6	Confident	82.7	Confident	19 Å²	19	42.6 Å²	42.6	13%	0.133	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.4	148.6	177.3	65.6	0	0	0	0	111.5	Q1096 E1179 L1184	Q1096-S1182 WeakPolarHBondContact CG-OG 3.32Å; Q1096-S1182 PolarHBondContact NE2-OG 3.39Å; E1179-S1182 WeakPolarHBondContact O-CB 3.34Å; E1179-S1182 PolarHBondContact O-N 3.02Å; E1179-S1182 PolarHBondContact O-OG 3.44Å; S1182-L1184 PolarHBondContact O-N 3.26Å
1183	A	66.1	Low	82.4	Confident	102 Å²	102	43.5 Å²	43.5	84%	0.843	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	60	21.7	-179.2	0	0	0	0	0	116.6
1184	L	74	Confident	82.2	Confident	11 Å²	11	47.9 Å²	47.9	6%	0.058	25%	0.245	C	C	.	.			trans	-99.8	141.9	172.6	-60.3	179	0	0	0	111.6	Q1160 S1182 Q1189 V1192 R1211	Q1160-L1184 HydrophobicContact CG-CD1 4.46Å; S1182-L1184 PolarHBondContact O-N 3.26Å; L1184-Q1189 HydrophobicContact CB-CB 4.1Å; L1184-V1192 HydrophobicContact CD1-CB 3.85Å; L1184-V1192 HydrophobicContact CD1-CG1 3.96Å; L1184-V1192 HydrophobicContact CD1-CG2 3.75Å; L1184-R1211 PolarHBondContact O-NH1 3.37Å
1185	D	76.1	Confident	81.8	Confident	89 Å²	89	47.9 Å²	47.9	48%	0.476	25%	0.245	S	C	.	.			trans	-63.5	159.4	165.8	61.6	21.8	0	0	0	110.7	E1187 N1188 Q1189	D1185-E1187 PolarHBondContact O-N 3.37Å; D1185-N1188 PolarHBondContact O-N 3.41Å; D1185-N1188 WeakPolarHBondContact OD1-CA 3.33Å; D1185-N1188 WeakPolarHBondContact OD1-CB 3.34Å; D1185-N1188 PolarHBondContact OD1-N 2.94Å; D1185-N1188 PolarHBondContact OD1-ND2 3.31Å; D1185-N1188 PolarHBondContact OD2-ND2 3.36Å; D1185-Q1189 WeakPolarHBondContact O-CB 3.49Å; D1185-Q1189 PolarHBondContact O-N 3.4Å
1186	N	74.9	Confident	81.5	Confident	124 Å²	124	48 Å²	48	66%	0.663	25%	0.245	S	C	*	.	H	α-helix	trans	-60.8	-33.3	-171.8	-70.8	-17	0	0	0	112.9	R1190	N1186-R1190 WeakPolarHBondContact O-CG 3.42Å; N1186-R1190 PolarHBondContact O-N 3.46Å
1187	E	75.7	Confident	81.1	Confident	149 Å²	149	49.1 Å²	49.1	70%	0.696	25%	0.251	S	S	*	.	H	α-helix	trans	-72.9	-51.8	179.6	-169.6	-179.9	174.9	0	0	111.9	D1185 Q1189 R1190 L1191	D1185-E1187 PolarHBondContact O-N 3.37Å; E1187-Q1189 PolarHBondContact O-N 2.95Å; E1187-R1190 PolarHBondContact O-N 2.99Å; E1187-L1191 PolarHBondContact O-N 3.37Å
1188	N	78.7	Confident	80.8	Confident	23 Å²	23	52.4 Å²	52.4	12%	0.123	27%	0.269	C	S	.	.	H	α-helix	trans	-66.3	-31.1	176.5	-68.8	-66.2	0	0	0	111.5	D1185 L1191 V1192	D1185-N1188 PolarHBondContact O-N 3.41Å; D1185-N1188 WeakPolarHBondContact OD1-CA 3.33Å; D1185-N1188 WeakPolarHBondContact OD1-CB 3.34Å; D1185-N1188 PolarHBondContact OD1-N 2.94Å; D1185-N1188 PolarHBondContact OD1-ND2 3.31Å; D1185-N1188 PolarHBondContact OD2-ND2 3.36Å; N1188-L1191 PolarHBondContact O-N 3Å; N1188-V1192 WeakPolarHBondContact O-CB 3.17Å; N1188-V1192 VanDerWaalsContact O-CG2 3.26Å; N1188-V1192 WeakPolarHBondContact O-CG2 3.45Å; N1188-V1192 PolarHBondContact O-N 3.34Å
1189	Q	80.6	Confident	80.6	Confident	18 Å²	18	51.5 Å²	51.5	8%	0.084	26%	0.264	C	S	.	.	H	α-helix	trans	-59.3	-47.1	174.2	-178	-171	-9.7	0	0	111	L1184 D1185 E1187 L1191 V1192 Q1193	L1184-Q1189 HydrophobicContact CB-CB 4.1Å; D1185-Q1189 WeakPolarHBondContact O-CB 3.49Å; D1185-Q1189 PolarHBondContact O-N 3.4Å; E1187-Q1189 PolarHBondContact O-N 2.95Å; Q1189-L1191 VanDerWaalsContact C-N 3.31Å; Q1189-L1191 PolarHBondContact O-N 3.37Å; Q1189-V1192 PolarHBondContact O-N 2.84Å; Q1189-Q1193 VanDerWaalsContact O-CB 3.24Å; Q1189-Q1193 WeakPolarHBondContact O-CB 3.47Å; Q1189-Q1193 PolarHBondContact O-N 2.96Å
1190	R	81.9	Confident	80.7	Confident	200 Å²	200	50.3 Å²	50.3	76%	0.755	26%	0.259	S	S	*	.	H	α-helix	trans	-60	-42.8	178.6	-75.1	176.1	179.9	177.8	1	111.6	N1186 E1187 K1194	N1186-R1190 WeakPolarHBondContact O-CG 3.42Å; N1186-R1190 PolarHBondContact O-N 3.46Å; E1187-R1190 PolarHBondContact O-N 2.99Å; R1190-K1194 WeakPolarHBondContact O-CB 3.43Å; R1190-K1194 PolarHBondContact O-N 3.4Å
1191	L	83.3	Confident	80.7	Confident	65 Å²	65	54.9 Å²	54.9	34%	0.34	29%	0.286	S	S	.	.	H	α-helix	trans	-67.3	-42.8	178.8	-67.1	175	0	0	0	112.6	E1187 N1188 Q1189 K1194 A1195	E1187-L1191 PolarHBondContact O-N 3.37Å; N1188-L1191 PolarHBondContact O-N 3Å; Q1189-L1191 VanDerWaalsContact C-N 3.31Å; Q1189-L1191 PolarHBondContact O-N 3.37Å; L1191-K1194 PolarHBondContact O-N 2.92Å; L1191-A1195 PolarHBondContact O-N 2.94Å
1192	V	84.5	Confident	80.7	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-66.4	-44.6	176.3	170.9	0	0	0	0	110.5	Q1160 R1161 I1164 T1181 L1184 N1188 Q1189 K1194 A1195 L1196	Q1160-V1192 HydrophobicContact CB-CG1 4.26Å; Q1160-V1192 HydrophobicContact CB-CG2 3.96Å; Q1160-V1192 HydrophobicContact CG-CG1 4.43Å; R1161-V1192 HydrophobicContact CG-CG2 3.87Å; I1164-V1192 HydrophobicContact CD1-CG1 4.02Å; T1181-V1192 HydrophobicContact CG2-CG1 4.4Å; L1184-V1192 HydrophobicContact CD1-CB 3.85Å; L1184-V1192 HydrophobicContact CD1-CG1 3.96Å; L1184-V1192 HydrophobicContact CD1-CG2 3.75Å; N1188-V1192 WeakPolarHBondContact O-CB 3.17Å; N1188-V1192 VanDerWaalsContact O-CG2 3.26Å; N1188-V1192 WeakPolarHBondContact O-CG2 3.45Å; N1188-V1192 PolarHBondContact O-N 3.34Å; Q1189-V1192 PolarHBondContact O-N 2.84Å; V1192-K1194 VanDerWaalsContact C-N 3.32Å; V1192-K1194 PolarHBondContact O-N 3.35Å; V1192-A1195 WeakPolarHBondContact O-CB 3.43Å; V1192-A1195 PolarHBondContact O-N 2.97Å; V1192-A1195 VanDerWaalsContact O-N 3.16Å; V1192-L1196 HydrophobicContact CG1-CD1 4.15Å; V1192-L1196 HydrophobicContact CG1-CG 4.37Å; V1192-L1196 WeakPolarHBondContact O-CG 3.47Å; V1192-L1196 PolarHBondContact O-N 3.33Å
1193	Q	84.6	Confident	81.5	Confident	22 Å²	22	60.5 Å²	60.5	10%	0.103	32%	0.316	C	S	.	.	H	α-helix	trans	-59.7	-44.1	177.2	-174.7	64.9	52.4	0	0	111.1	Q1189 A1195 L1196 D1197 T1214	Q1189-Q1193 VanDerWaalsContact O-CB 3.24Å; Q1189-Q1193 WeakPolarHBondContact O-CB 3.47Å; Q1189-Q1193 PolarHBondContact O-N 2.96Å; Q1193-A1195 VanDerWaalsContact C-N 3.35Å; Q1193-A1195 PolarHBondContact O-N 2.98Å; Q1193-L1196 WeakPolarHBondContact O-CB 3.4Å; Q1193-L1196 PolarHBondContact O-N 2.9Å; Q1193-D1197 PolarHBondContact NE2-OD1 2.98Å; Q1193-D1197 PolarHBondContact O-N 2.97Å; Q1193-T1214 PolarHBondContact OE1-OG1 2.78Å
1194	K	85.8	Confident	82.8	Confident	119 Å²	119	55.8 Å²	55.8	52%	0.517	28%	0.277	S	S	.	.	H	α-helix	trans	-59	-46.1	174.8	-172.2	-179.2	178.8	-174.5	0	111.7	R1190 L1191 V1192 L1196 D1197 D1198	R1190-K1194 WeakPolarHBondContact O-CB 3.43Å; R1190-K1194 PolarHBondContact O-N 3.4Å; L1191-K1194 PolarHBondContact O-N 2.92Å; V1192-K1194 VanDerWaalsContact C-N 3.32Å; V1192-K1194 PolarHBondContact O-N 3.35Å; K1194-L1196 VanDerWaalsContact C-N 3.3Å; K1194-L1196 PolarHBondContact O-N 3.23Å; K1194-D1197 PolarHBondContact O-N 3.47Å; K1194-D1198 WeakPolarHBondContact O-CB 3.41Å; K1194-D1198 VanDerWaalsContact O-CG 3.23Å; K1194-D1198 PolarHBondContact O-N 3.46Å
1195	A	85.6	Confident	83.6	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-61.9	-35.9	176.2	0	0	0	0	0	112.9	I1164 L1191 V1192 Q1193 A1199	I1164-A1195 HydrophobicContact CD1-CB 4.08Å; L1191-A1195 PolarHBondContact O-N 2.94Å; V1192-A1195 WeakPolarHBondContact O-CB 3.43Å; V1192-A1195 PolarHBondContact O-N 2.97Å; V1192-A1195 VanDerWaalsContact O-N 3.16Å; Q1193-A1195 VanDerWaalsContact C-N 3.35Å; Q1193-A1195 PolarHBondContact O-N 2.98Å; A1195-A1199 VanDerWaalsContact O-CB 3.32Å; A1195-A1199 WeakPolarHBondContact O-CB 3.03Å; A1195-A1199 PolarHBondContact O-N 3.04Å; A1195-A1199 VanDerWaalsContact O-N 3.08Å
1196	L	86	Confident	84.4	Confident	3 Å²	3	51.2 Å²	51.2	2%	0.016	25%	0.252	C	S	.	.	H	α-helix	trans	-68.2	-46.1	174.4	-69.5	175.3	0	0	0	111.6	I1164 L1177 A1180 T1181 V1192 Q1193 K1194 D1198 A1199 M1200	I1164-L1196 HydrophobicContact CD1-CD2 3.58Å; I1164-L1196 HydrophobicContact CD1-CG 3.87Å; I1164-L1196 HydrophobicContact CG1-CD2 3.83Å; L1177-L1196 HydrophobicContact CD1-CB 4.45Å; L1177-L1196 HydrophobicContact CD1-CD1 4.47Å; L1177-L1196 HydrophobicContact CD1-CD2 3.82Å; L1177-L1196 HydrophobicContact CD1-CG 4.47Å; L1177-L1196 HydrophobicContact CD2-CD2 3.57Å; L1177-L1196 HydrophobicContact CG-CD2 4.32Å; A1180-L1196 HydrophobicContact CB-CD1 3.93Å; T1181-L1196 HydrophobicContact CG2-CD1 3.96Å; V1192-L1196 HydrophobicContact CG1-CD1 4.15Å; V1192-L1196 HydrophobicContact CG1-CG 4.37Å; V1192-L1196 WeakPolarHBondContact O-CG 3.47Å; V1192-L1196 PolarHBondContact O-N 3.33Å; Q1193-L1196 WeakPolarHBondContact O-CB 3.4Å; Q1193-L1196 PolarHBondContact O-N 2.9Å; K1194-L1196 VanDerWaalsContact C-N 3.3Å; K1194-L1196 PolarHBondContact O-N 3.23Å; L1196-D1198 VanDerWaalsContact C-N 3.31Å; L1196-D1198 PolarHBondContact O-N 3.39Å; L1196-A1199 WeakPolarHBondContact O-CB 3.45Å; L1196-A1199 PolarHBondContact O-N 2.96Å; L1196-A1199 VanDerWaalsContact O-N 3.11Å; L1196-M1200 WeakPolarHBondContact O-CG 3.33Å; L1196-M1200 PolarHBondContact O-N 3.3Å
1197	D	86	Confident	85.2	Confident	25 Å²	25	45.6 Å²	45.6	13%	0.134	22%	0.222	C	C	.	.	H	α-helix	trans	-57.7	-46.3	178	-67.4	-13.2	0	0	0	110.7	Q1193 K1194 A1199 M1200 V1201 K1217	Q1193-D1197 PolarHBondContact NE2-OD1 2.98Å; Q1193-D1197 PolarHBondContact O-N 2.97Å; K1194-D1197 PolarHBondContact O-N 3.47Å; D1197-A1199 VanDerWaalsContact C-N 3.31Å; D1197-A1199 PolarHBondContact O-N 3.25Å; D1197-M1200 PolarHBondContact O-N 2.65Å; D1197-V1201 WeakPolarHBondContact O-CG2 3.42Å; D1197-K1217 WeakPolarHBondContact OD2-CD 3.27Å; D1197-K1217 IonicContact OD2-NZ 2.65Å; D1197-K1217 PolarHBondContact OD2-NZ 3.15Å
1198	D	85.1	Confident	85.9	Confident	70 Å²	70	38.5 Å²	38.5	37%	0.374	19%	0.189	S	C	.	.	H	α-helix	trans	-63.1	-37	177	-67.3	-24.5	0	0	0	111.6	K1194 L1196	K1194-D1198 WeakPolarHBondContact O-CB 3.41Å; K1194-D1198 VanDerWaalsContact O-CG 3.23Å; K1194-D1198 PolarHBondContact O-N 3.46Å; L1196-D1198 VanDerWaalsContact C-N 3.31Å; L1196-D1198 PolarHBondContact O-N 3.39Å
1199	A	85.3	Confident	85.9	Confident	3 Å²	3	37.6 Å²	37.6	3%	0.025	19%	0.185	C	C	.	.	H	α-helix	trans	-70.2	-29.6	176.8	0	0	0	0	0	113.4	I1168 L1175 A1195 L1196 D1197 R1203	I1168-A1199 HydrophobicContact CD1-CB 3.56Å; I1168-A1199 HydrophobicContact CG1-CB 4.1Å; L1175-A1199 HydrophobicContact CD2-CB 4.03Å; A1195-A1199 VanDerWaalsContact O-CB 3.32Å; A1195-A1199 WeakPolarHBondContact O-CB 3.03Å; A1195-A1199 PolarHBondContact O-N 3.04Å; A1195-A1199 VanDerWaalsContact O-N 3.08Å; L1196-A1199 WeakPolarHBondContact O-CB 3.45Å; L1196-A1199 PolarHBondContact O-N 2.96Å; L1196-A1199 VanDerWaalsContact O-N 3.11Å; D1197-A1199 VanDerWaalsContact C-N 3.31Å; D1197-A1199 PolarHBondContact O-N 3.25Å; A1199-R1203 WeakPolarHBondContact O-CD 3.33Å; A1199-R1203 PolarHBondContact O-NH1 2.99Å
1200	M	85.9	Confident	85.6	Confident	5 Å²	5	41.3 Å²	41.3	3%	0.025	20%	0.202	C	C	.	.	H	α-helix	trans	-83.9	-18	-173.6	-72	169.9	55.5	0	0	114.6	K1039 L1175 L1177 L1196 D1197 T1202 R1203 S1205 I1207	K1039-M1200 HydrophobicContact CB-CE 3.86Å; K1039-M1200 HydrophobicContact CD-CE 3.67Å; K1039-M1200 HydrophobicContact CG-CE 3.61Å; L1175-M1200 HydrophobicContact CD2-CG 3.96Å; L1177-M1200 HydrophobicContact CD1-CG 4.23Å; L1177-M1200 HydrophobicContact CD1-SD 3.87Å; L1196-M1200 WeakPolarHBondContact O-CG 3.33Å; L1196-M1200 PolarHBondContact O-N 3.3Å; D1197-M1200 PolarHBondContact O-N 2.65Å; M1200-T1202 PolarHBondContact O-N 3.34Å; M1200-R1203 PolarHBondContact O-N 2.99Å; M1200-S1205 WeakPolarHBondContact CG-OG 3.24Å; M1200-I1207 HydrophobicContact CE-CD1 3.43Å; M1200-I1207 VanDerWaalsContact CE-CD1 3.43Å; M1200-I1207 HydrophobicContact CE-CG1 4.23Å; M1200-I1207 HydrophobicContact SD-CD1 3.64Å; M1200-I1207 HydrophobicContact SD-CG1 4.43Å
1201	V	82.2	Confident	85	Confident	100 Å²	100	35.7 Å²	35.7	61%	0.606	18%	0.181	S	C	*	.	T	Hydrogen-bonded Turn	trans	-50.9	-37.6	-168.3	179.3	0	0	0	0	114	D1197	D1197-V1201 WeakPolarHBondContact O-CG2 3.42Å
1202	T	81.3	Confident	84.3	Confident	111 Å²	111	33.5 Å²	33.5	68%	0.681	17%	0.169	S	C	*	.	T	Hydrogen-bonded Turn	trans	-113	9.5	-172.6	55.5	0	0	0	0	114.4	M1200	M1200-T1202 PolarHBondContact O-N 3.34Å
1203	R	88.4	Confident	83.5	Confident	32 Å²	32	38.3 Å²	38.3	12%	0.121	20%	0.195	C	C	.	.	S	Bend	trans	-130.9	140.8	-165.4	-59.8	178.1	178.5	81.3	3.3	111.6	P1172 A1199 M1200 S1205	P1172-R1203 WeakPolarHBondContact O-CD 3.25Å; P1172-R1203 WeakPolarHBondContact O-CG 3.32Å; P1172-R1203 PolarHBondContact O-NE 3.24Å; P1172-R1203 VanDerWaalsContact O-NE 3.15Å; A1199-R1203 WeakPolarHBondContact O-CD 3.33Å; A1199-R1203 PolarHBondContact O-NH1 2.99Å; M1200-R1203 PolarHBondContact O-N 2.99Å; R1203-S1205 PolarHBondContact O-N 3.29Å; R1203-S1205 PolarHBondContact O-OG 2.95Å
1204	T	92.1	Very high	82.9	Confident	3 Å²	3	37.6 Å²	37.6	2%	0.018	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.1	125.4	165.9	-55.4	0	0	0	0	107.5	G1007 I1034 G1037 S1038 T1173 L1174 L1175	G1007-T1204 PolarHBondContact O-OG1 2.97Å; I1034-T1204 HydrophobicContact CG2-CG2 3.61Å; G1037-T1204 PolarHBondContact N-OG1 3.36Å; S1038-T1204 WeakPolarHBondContact O-CA 3.28Å; T1173-T1204 PolarHBondContact O-N 2.93Å; L1174-T1204 CarbonylContact C-O 3.57Å; L1174-T1204 WeakPolarHBondContact CA-O 3.3Å; L1174-T1204 HydrophobicContact CD1-CG2 3.94Å; L1174-T1204 WeakPolarHBondContact CD1-O 3.47Å; L1175-T1204 PolarHBondContact N-O 2.96Å
1205	S	92.4	Very high	82.5	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	127.6	-169.8	-59.5	0	0	0	0	111	S1038 K1039 I1040 L1175 M1200 R1203	S1038-S1205 PolarHBondContact O-N 3.29Å; K1039-S1205 CarbonylContact C-O 3.6Å; K1039-S1205 WeakPolarHBondContact CA-O 3.48Å; I1040-S1205 PolarHBondContact N-O 3.34Å; L1175-S1205 CarbonylContact O-C 3.53Å; L1175-S1205 WeakPolarHBondContact O-CA 3.22Å; M1200-S1205 WeakPolarHBondContact CG-OG 3.24Å; R1203-S1205 PolarHBondContact O-N 3.29Å; R1203-S1205 PolarHBondContact O-OG 2.95Å
1206	I	92.7	Very high	82.1	Confident	3 Å²	3	38 Å²	38	2%	0.015	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	121.5	174.7	-56.9	175	0	0	0	107.9	I1009 I1034 I1040 L1042 L1057 L1174 L1175 L1176 L1177	I1009-I1206 HydrophobicContact CD1-CD1 4.21Å; I1034-I1206 HydrophobicContact CD1-CD1 3.48Å; I1034-I1206 VanDerWaalsContact CD1-CD1 3.48Å; I1034-I1206 HydrophobicContact CD1-CG1 4.01Å; I1040-I1206 CarbonylContact O-C 3.52Å; I1040-I1206 WeakPolarHBondContact O-CA 3.34Å; L1042-I1206 HydrophobicContact CD1-CG2 3.68Å; L1042-I1206 HydrophobicContact CG-CG2 3.94Å; L1057-I1206 HydrophobicContact CD1-CD1 3.45Å; L1057-I1206 VanDerWaalsContact CD1-CD1 3.45Å; L1174-I1206 HydrophobicContact CD1-CD1 4.25Å; L1174-I1206 HydrophobicContact CD1-CG1 4.29Å; L1175-I1206 PolarHBondContact O-N 3.34Å; L1176-I1206 HydrophobicContact CD2-CB 3.86Å; L1176-I1206 HydrophobicContact CD2-CD1 3.86Å; L1176-I1206 HydrophobicContact CD2-CG1 4.15Å; L1177-I1206 PolarHBondContact N-O 3.16Å
1207	I	91.7	Very high	81.7	Confident	6 Å²	6	44 Å²	44	3%	0.031	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	126.5	-176.6	-39.3	-176.2	0	0	0	109.2	I1040 A1041 L1042 L1177 M1200 A1209 T1214 V1218	I1040-I1207 PolarHBondContact O-N 3.32Å; A1041-I1207 CarbonylContact C-O 3.59Å; A1041-I1207 VanDerWaalsContact CA-O 3.29Å; A1041-I1207 WeakPolarHBondContact CA-O 3.45Å; L1042-I1207 PolarHBondContact N-O 3.27Å; L1177-I1207 HydrophobicContact CB-CB 4.46Å; L1177-I1207 HydrophobicContact CB-CG2 4.06Å; L1177-I1207 HydrophobicContact CD1-CD1 4.34Å; L1177-I1207 HydrophobicContact CD1-CG1 4.1Å; L1177-I1207 HydrophobicContact CD1-CG2 4.49Å; L1177-I1207 CarbonylContact O-C 3.59Å; L1177-I1207 WeakPolarHBondContact O-CA 3.38Å; M1200-I1207 HydrophobicContact CE-CD1 3.43Å; M1200-I1207 VanDerWaalsContact CE-CD1 3.43Å; M1200-I1207 HydrophobicContact CE-CG1 4.23Å; M1200-I1207 HydrophobicContact SD-CD1 3.64Å; M1200-I1207 HydrophobicContact SD-CG1 4.43Å; I1207-A1209 HydrophobicContact CG2-CB 4.3Å; I1207-T1214 HydrophobicContact CG2-CG2 3.95Å; I1207-V1218 HydrophobicContact CD1-CG2 3.83Å
1208	I	89.8	Confident	81.7	Confident	1 Å²	1	43.5 Å²	43.5	1%	0.005	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	108.8	161.3	-61.2	172.6	0	0	0	106	L1042 K1050 I1054 L1177 D1178 E1179	L1042-I1208 HydrophobicContact CB-CG1 4.14Å; L1042-I1208 HydrophobicContact CD1-CG1 4.15Å; K1050-I1208 VanDerWaalsContact C-CD1 3.41Å; K1050-I1208 HydrophobicContact CB-CD1 3.94Å; K1050-I1208 HydrophobicContact CB-CG1 4.19Å; K1050-I1208 HydrophobicContact CB-CG2 4.02Å; K1050-I1208 HydrophobicContact CD-CG2 4.16Å; K1050-I1208 WeakPolarHBondContact O-CD1 3.48Å; I1054-I1208 HydrophobicContact CB-CD1 4.48Å; I1054-I1208 HydrophobicContact CD1-CD1 3.34Å; I1054-I1208 HydrophobicContact CD1-CG1 3.71Å; I1054-I1208 HydrophobicContact CG1-CD1 3.81Å; I1054-I1208 HydrophobicContact CG1-CG1 4.39Å; L1177-I1208 PolarHBondContact O-N 2.98Å; D1178-I1208 WeakPolarHBondContact OD1-CD1 3.44Å; E1179-I1208 WeakPolarHBondContact CA-O 3.45Å; E1179-I1208 HydrophobicContact CG-CB 4.38Å; E1179-I1208 HydrophobicContact CG-CG2 3.75Å; E1179-I1208 PolarHBondContact N-O 3.06Å
1209	A	77.9	Confident	81.8	Confident	3 Å²	3	43.4 Å²	43.4	3%	0.025	22%	0.219	C	C	.	.			trans	-111.7	133.5	-179.3	0	0	0	0	0	109.6	I1207 T1214 I1215	I1207-A1209 HydrophobicContact CG2-CB 4.3Å; A1209-T1214 HydrophobicContact CB-CG2 4.3Å; A1209-I1215 HydrophobicContact CB-CD1 3.95Å; A1209-I1215 HydrophobicContact CB-CG1 3.57Å
1210	H	74.9	Confident	82.1	Confident	97 Å²	97	47.8 Å²	47.8	45%	0.449	24%	0.236	S	C	.	.	S	Bend	trans	-102.3	-13.2	164.8	-163.2	-58.7	0	0	0	111.2
1211	R	70	Confident	82.3	Confident	82 Å²	82	47.5 Å²	47.5	31%	0.309	23%	0.234	S	C	.	.	S	Bend	trans	-110.7	132.9	179.8	-67.9	-173.5	175.6	171.5	5.2	110	T1181 L1184 N1213 T1214	T1181-R1211 PolarHBondContact O-NH1 2.76Å; L1184-R1211 PolarHBondContact O-NH1 3.37Å; R1211-N1213 PolarHBondContact O-N 3.13Å; R1211-T1214 PolarHBondContact O-N 3.34Å
1212	L	67.4	Low	82.7	Confident	19 Å²	19	42.9 Å²	42.9	10%	0.099	21%	0.206	C	C	.	.	G	3₁₀ helix	trans	-60.2	-38.6	-177.9	-69.4	176.5	0	0	0	113.9	T1214 I1215 E1216 Y1249 D1252 N1253	L1212-T1214 PolarHBondContact O-N 3.07Å; L1212-I1215 HydrophobicContact CD2-CD1 4.3Å; L1212-I1215 WeakPolarHBondContact O-CA 3.22Å; L1212-I1215 WeakPolarHBondContact O-CB 3.48Å; L1212-I1215 PolarHBondContact O-N 3.28Å; L1212-E1216 PolarHBondContact O-N 2.9Å; L1212-Y1249 HydrophobicContact CD1-CD2 3.8Å; L1212-Y1249 HydrophobicContact CD1-CE2 3.86Å; L1212-Y1249 HydrophobicContact CD1-CG 4.46Å; L1212-Y1249 HydrophobicContact CD2-CD2 3.5Å; L1212-Y1249 HydrophobicContact CD2-CE2 4.01Å; L1212-Y1249 HydrophobicContact CD2-CG 4.46Å; L1212-Y1249 HydrophobicContact CG-CD2 4.26Å; L1212-Y1249 HydrophobicContact CG-CE2 4.44Å; L1212-D1252 HydrophobicContact CD1-CB 3.44Å; L1212-D1252 VanDerWaalsContact CD1-CB 3.44Å; L1212-D1252 HydrophobicContact CD2-CB 4.36Å; L1212-D1252 HydrophobicContact CG-CB 3.65Å; L1212-N1253 HydrophobicContact CD1-CB 4.43Å; L1212-N1253 VanDerWaalsContact CD1-OD1 3.28Å; L1212-N1253 WeakPolarHBondContact CD1-OD1 3.36Å
1213	N	69.3	Low	83.1	Confident	101 Å²	101	37.6 Å²	37.6	54%	0.54	17%	0.174	S	C	.	.	G	3₁₀ helix	trans	-57.8	-25.6	-179.5	-63.7	-3	0	0	0	113.3	R1211 I1215	R1211-N1213 PolarHBondContact O-N 3.13Å; N1213-I1215 VanDerWaalsContact C-N 3.32Å
1214	T	72.2	Confident	83	Confident	6 Å²	6	36 Å²	36	4%	0.037	17%	0.168	C	C	.	.	G	3₁₀ helix	trans	-79.4	-17.9	178.3	-52.6	0	0	0	0	111.9	T1181 Q1193 I1207 A1209 R1211 L1212	T1181-T1214 PolarHBondContact OG1-OG1 3.37Å; Q1193-T1214 PolarHBondContact OE1-OG1 2.78Å; I1207-T1214 HydrophobicContact CG2-CG2 3.95Å; A1209-T1214 HydrophobicContact CB-CG2 4.3Å; R1211-T1214 PolarHBondContact O-N 3.34Å; L1212-T1214 PolarHBondContact O-N 3.07Å
1215	I	77.1	Confident	82.7	Confident	4 Å²	4	36.8 Å²	36.8	2%	0.021	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.9	-23	-174.8	-57.1	171.6	0	0	0	111.9	A1041 V1043 A1209 L1212 N1213 K1217 V1218 I1221	A1041-I1215 HydrophobicContact CB-CG1 4.34Å; A1041-I1215 HydrophobicContact CB-CG2 4.15Å; V1043-I1215 HydrophobicContact CG2-CD1 3.71Å; A1209-I1215 HydrophobicContact CB-CD1 3.95Å; A1209-I1215 HydrophobicContact CB-CG1 3.57Å; L1212-I1215 HydrophobicContact CD2-CD1 4.3Å; L1212-I1215 WeakPolarHBondContact O-CA 3.22Å; L1212-I1215 WeakPolarHBondContact O-CB 3.48Å; L1212-I1215 PolarHBondContact O-N 3.28Å; N1213-I1215 VanDerWaalsContact C-N 3.32Å; I1215-K1217 PolarHBondContact O-N 3.38Å; I1215-K1217 VanDerWaalsContact O-N 3.11Å; I1215-V1218 WeakPolarHBondContact O-CB 3.32Å; I1215-V1218 WeakPolarHBondContact O-CG2 3.48Å; I1215-V1218 PolarHBondContact O-N 3Å; I1215-V1218 VanDerWaalsContact O-N 3.16Å; I1215-I1221 HydrophobicContact CG2-CD1 3.3Å; I1215-I1221 HydrophobicContact CG2-CG1 3.57Å
1216	E	76.1	Confident	82.2	Confident	125 Å²	125	42.9 Å²	42.9	58%	0.584	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.7	-31.7	-174.7	-68.1	-172.7	159.6	0	0	114.8	L1212	L1212-E1216 PolarHBondContact O-N 2.9Å
1217	K	78	Confident	81.7	Confident	127 Å²	127	42.8 Å²	42.8	55%	0.552	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-99.1	15	-175.5	-63.5	-176.2	-177.7	176	0	114.1	D1197 I1215	D1197-K1217 WeakPolarHBondContact OD2-CD 3.27Å; D1197-K1217 IonicContact OD2-NZ 2.65Å; D1197-K1217 PolarHBondContact OD2-NZ 3.15Å; I1215-K1217 PolarHBondContact O-N 3.38Å; I1215-K1217 VanDerWaalsContact O-N 3.11Å
1218	V	85.1	Confident	81.5	Confident	15 Å²	15	49.7 Å²	49.7	9%	0.091	23%	0.231	C	C	.	.			trans	-98.6	143.2	-174.5	-176.6	0	0	0	0	110.2	K1039 A1041 I1207 I1215 Y1220	K1039-V1218 HydrophobicContact CB-CG1 4.13Å; K1039-V1218 WeakPolarHBondContact O-CG1 3.41Å; A1041-V1218 HydrophobicContact CB-CB 4.43Å; A1041-V1218 HydrophobicContact CB-CG1 3.9Å; A1041-V1218 HydrophobicContact CB-CG2 4.32Å; A1041-V1218 VanDerWaalsContact N-CG1 3.34Å; I1207-V1218 HydrophobicContact CD1-CG2 3.83Å; I1215-V1218 WeakPolarHBondContact O-CB 3.32Å; I1215-V1218 WeakPolarHBondContact O-CG2 3.48Å; I1215-V1218 PolarHBondContact O-N 3Å; I1215-V1218 VanDerWaalsContact O-N 3.16Å; V1218-Y1220 WeakPolarHBondContact CG1-O 3.23Å
1219	D	88.6	Confident	81.4	Confident	68 Å²	68	51.8 Å²	51.8	36%	0.364	24%	0.241	S	C	.	.	S	Bend	trans	-73.3	-39.3	-177	-56.1	-51.4	0	0	0	111.9	K1039	K1039-D1219 PolarHBondContact N-OD2 2.97Å; K1039-D1219 WeakPolarHBondContact O-CB 3.07Å; K1039-D1219 PolarHBondContact O-N 3.09Å
1220	Y	90.7	Very high	81.9	Confident	95 Å²	95	55.4 Å²	55.4	37%	0.373	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	146.6	-178.9	-61.7	-81.8	0	0	0	112.4	K1039 I1040 A1041 V1218 K1234	K1039-Y1220 PolarHBondContact O-N 3.46Å; I1040-Y1220 CarbonylContact C-O 3.51Å; I1040-Y1220 VanDerWaalsContact CA-O 3.29Å; I1040-Y1220 WeakPolarHBondContact CA-O 3.44Å; A1041-Y1220 PolarHBondContact N-O 3.47Å; V1218-Y1220 WeakPolarHBondContact CG1-O 3.23Å; Y1220-K1234 HydrophobicContact CD1-CG 4.48Å; Y1220-K1234 HydrophobicContact CE1-CG 4.31Å
1221	I	90.5	Very high	82.5	Confident	0 Å²	0	52 Å²	52	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	138	176.6	-55.4	165.2	0	0	0	108.1	A1041 V1043 I1215 V1223 Y1232 G1233 L1235 L1238 F1245	A1041-I1221 HydrophobicContact CB-CG1 4.27Å; A1041-I1221 HydrophobicContact CB-CG2 4.47Å; A1041-I1221 CarbonylContact O-C 3.6Å; A1041-I1221 WeakPolarHBondContact O-CA 3.43Å; V1043-I1221 HydrophobicContact CB-CG2 4.4Å; V1043-I1221 HydrophobicContact CG2-CG2 3.82Å; I1215-I1221 HydrophobicContact CG2-CD1 3.3Å; I1215-I1221 HydrophobicContact CG2-CG1 3.57Å; I1221-V1223 HydrophobicContact CG2-CG2 4.46Å; I1221-Y1232 WeakPolarHBondContact O-CA 3.29Å; I1221-G1233 PolarHBondContact N-O 3.3Å; I1221-G1233 PolarHBondContact O-N 3.42Å; I1221-G1233 VanDerWaalsContact O-N 3.13Å; I1221-L1235 HydrophobicContact CD1-CB 3.94Å; I1221-L1235 HydrophobicContact CD1-CD1 3.65Å; I1221-L1235 HydrophobicContact CD1-CG 4.42Å; I1221-L1238 HydrophobicContact CB-CD1 3.61Å; I1221-L1238 HydrophobicContact CD1-CD1 4.22Å; I1221-L1238 HydrophobicContact CG1-CD1 4.48Å; I1221-L1238 HydrophobicContact CG2-CD1 3.88Å; I1221-F1245 HydrophobicContact CD1-CE1 4.27Å; I1221-F1245 HydrophobicContact CD1-CE2 4.06Å; I1221-F1245 HydrophobicContact CD1-CZ 3.7Å; I1221-F1245 HydrophobicContact CG2-CD2 3.92Å; I1221-F1245 HydrophobicContact CG2-CE2 3.69Å; I1221-F1245 HydrophobicContact CG2-CZ 4.43Å
1222	I	90.4	Very high	83.4	Confident	2 Å²	2	54.3 Å²	54.3	1%	0.01	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	120.8	176.3	-56	175.7	0	0	0	107.8	Y1032 I1040 A1041 L1042 V1043 I1229	Y1032-I1222 HydrophobicContact CD1-CD1 3.55Å; Y1032-I1222 HydrophobicContact CD2-CD1 4.08Å; Y1032-I1222 HydrophobicContact CE1-CD1 3.45Å; Y1032-I1222 VanDerWaalsContact CE1-CD1 3.45Å; Y1032-I1222 HydrophobicContact CE1-CG1 4.37Å; Y1032-I1222 HydrophobicContact CE2-CD1 3.95Å; Y1032-I1222 HydrophobicContact CE2-CG1 4.25Å; Y1032-I1222 HydrophobicContact CG-CD1 3.88Å; I1040-I1222 HydrophobicContact CG2-CD1 3.6Å; I1040-I1222 HydrophobicContact CG2-CG1 3.91Å; A1041-I1222 PolarHBondContact O-N 3.08Å; L1042-I1222 HydrophobicContact CD2-CB 3.97Å; L1042-I1222 HydrophobicContact CD2-CD1 3.99Å; L1042-I1222 HydrophobicContact CD2-CG1 4.45Å; L1042-I1222 HydrophobicContact CD2-CG2 4.36Å; V1043-I1222 PolarHBondContact N-O 3.36Å; I1222-I1229 HydrophobicContact CG2-CB 4.43Å; I1222-I1229 HydrophobicContact CG2-CD1 3.98Å; I1222-I1229 HydrophobicContact CG2-CG1 3.79Å; I1222-I1229 HydrophobicContact CG2-CG2 3.95Å
1223	V	89.3	Confident	84.4	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	122.7	176.2	-174.5	0	0	0	0	110.5	V1043 I1221 I1229 I1230 E1231 E1244 F1245 L1248	V1043-V1223 CarbonylContact O-C 2.94Å; V1043-V1223 WeakPolarHBondContact O-CA 3.46Å; I1221-V1223 HydrophobicContact CG2-CG2 4.46Å; V1223-I1229 WeakPolarHBondContact O-CA 3.45Å; V1223-I1230 PolarHBondContact O-N 3.39Å; V1223-E1231 HydrophobicContact CB-CB 4.19Å; V1223-E1231 HydrophobicContact CG2-CB 4.32Å; V1223-E1231 PolarHBondContact N-O 3.37Å; V1223-E1244 HydrophobicContact CG1-CB 4.44Å; V1223-F1245 HydrophobicContact CG2-CB 3.65Å; V1223-F1245 HydrophobicContact CG2-CD2 3.64Å; V1223-F1245 HydrophobicContact CG2-CG 4.06Å; V1223-L1248 HydrophobicContact CG1-CD1 4.15Å
1224	L	88	Confident	85.3	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	128.9	-176.3	-78	162	0	0	0	111.3	F1030 L1042 V1043 G1044 C1048 K1050 L1053 R1228 I1229	F1030-L1224 HydrophobicContact CD2-CD2 3.75Å; F1030-L1224 HydrophobicContact CE2-CD2 3.52Å; L1042-L1224 HydrophobicContact CB-CD1 4.44Å; L1042-L1224 HydrophobicContact CD2-CD1 4.31Å; V1043-L1224 PolarHBondContact O-N 2.9Å; G1044-L1224 WeakPolarHBondContact CA-O 3.2Å; C1048-L1224 HydrophobicContact CB-CB 4.44Å; C1048-L1224 WeakPolarHBondContact CB-O 3.33Å; C1048-L1224 PolarHBondContact SG-O 3.43Å; K1050-L1224 HydrophobicContact CG-CD1 3.96Å; L1053-L1224 HydrophobicContact CD1-CD1 3.64Å; L1053-L1224 HydrophobicContact CD1-CD2 4.44Å; L1224-R1228 WeakPolarHBondContact CA-O 3.43Å; L1224-I1229 HydrophobicContact CD2-CG1 4.44Å
1225	S	85.3	Confident	85.9	Confident	18 Å²	18	55.6 Å²	55.6	13%	0.126	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	137.8	168.4	-173.3	0	0	0	0	110	G1227 R1228	S1225-G1227 PolarHBondContact O-N 3.02Å; S1225-R1228 PolarHBondContact N-O 2.75Å; S1225-R1228 PolarHBondContact O-N 2.99Å
1226	N	82.3	Confident	86.3	Confident	129 Å²	129	60.9 Å²	60.9	69%	0.69	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.4	33.4	-178.5	-64.5	-40.7	0	0	0	114.5	N1028	N1028-N1226 PolarHBondContact ND2-O 3.28Å
1227	G	82.2	Confident	86.8	Confident	0 Å²	0	59 Å²	59	0%	0	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	77.9	14.8	179.4	0	0	0	0	0	115.9	V1026 N1028 C1048 S1225	V1026-G1227 WeakPolarHBondContact O-CA 3.34Å; N1028-G1227 PolarHBondContact N-O 2.96Å; C1048-G1227 WeakPolarHBondContact O-CA 3.4Å; C1048-G1227 PolarHBondContact O-N 2.83Å; S1225-G1227 PolarHBondContact O-N 3.02Å
1228	R	86.7	Confident	87.1	Confident	152 Å²	152	53 Å²	53	57%	0.574	25%	0.248	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-125.3	155.3	178.5	-73.1	177.7	-177.7	175.9	5.1	111.4	N1028 L1224 S1225	N1028-R1228 HydrophobicContact CB-CG 4.14Å; N1028-R1228 WeakPolarHBondContact O-CG 3.4Å; N1028-R1228 PolarHBondContact O-NE 3.44Å; L1224-R1228 WeakPolarHBondContact CA-O 3.43Å; S1225-R1228 PolarHBondContact N-O 2.75Å; S1225-R1228 PolarHBondContact O-N 2.99Å
1229	I	88.4	Confident	87	Confident	44 Å²	44	54.1 Å²	54.1	23%	0.226	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	121	170.1	-57.5	175.7	0	0	0	107.6	F1030 T1031 Y1032 I1222 V1223 L1224 Y1232	F1030-I1229 HydrophobicContact CD2-CD1 4.12Å; F1030-I1229 HydrophobicContact CD2-CG1 3.74Å; F1030-I1229 HydrophobicContact CE2-CD1 3.51Å; F1030-I1229 HydrophobicContact CE2-CG1 3.31Å; F1030-I1229 HydrophobicContact CZ-CD1 3.9Å; F1030-I1229 HydrophobicContact CZ-CG1 4.19Å; T1031-I1229 WeakPolarHBondContact O-CD1 3.39Å; Y1032-I1229 HydrophobicContact CD2-CD1 3.76Å; Y1032-I1229 HydrophobicContact CG-CD1 4.08Å; I1222-I1229 HydrophobicContact CG2-CB 4.43Å; I1222-I1229 HydrophobicContact CG2-CD1 3.98Å; I1222-I1229 HydrophobicContact CG2-CG1 3.79Å; I1222-I1229 HydrophobicContact CG2-CG2 3.95Å; V1223-I1229 WeakPolarHBondContact O-CA 3.45Å; L1224-I1229 HydrophobicContact CD2-CG1 4.44Å; I1229-Y1232 HydrophobicContact CG2-CD1 4.45Å
1230	I	87.5	Confident	86.8	Confident	80 Å²	80	58.2 Å²	58.2	41%	0.41	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	-49.9	170.3	-62.1	167.5	0	0	0	109.6	V1223 E1244	V1223-I1230 PolarHBondContact O-N 3.39Å; I1230-E1244 HydrophobicContact CD1-CB 4.38Å; I1230-E1244 VanDerWaalsContact CD1-CD 3.42Å; I1230-E1244 HydrophobicContact CD1-CG 4.29Å; I1230-E1244 WeakPolarHBondContact CD1-OE1 3.3Å; I1230-E1244 WeakPolarHBondContact CD1-OE2 3.21Å
1231	E	88.2	Confident	86.5	Confident	26 Å²	26	59.9 Å²	59.9	12%	0.121	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	146.8	-174.3	-82.8	159.5	-140	0	0	110.7	V1223 L1238 G1243 E1244 F1245	V1223-E1231 HydrophobicContact CB-CB 4.19Å; V1223-E1231 HydrophobicContact CG2-CB 4.32Å; V1223-E1231 PolarHBondContact N-O 3.37Å; E1231-L1238 HydrophobicContact CB-CD2 3.93Å; E1231-G1243 WeakPolarHBondContact OE1-CA 3.36Å; E1231-E1244 PolarHBondContact OE1-N 3.18Å; E1231-E1244 PolarHBondContact OE2-N 3.49Å; E1231-F1245 WeakPolarHBondContact OE2-CB 3.21Å; E1231-F1245 PolarHBondContact OE2-N 3.25Å; E1231-F1245 VanDerWaalsContact OE2-N 3.11Å
1232	Y	88.5	Confident	86	Confident	129 Å²	129	67.1 Å²	67.1	51%	0.506	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	148.4	168.7	74.4	-83.9	0	0	0	109.5	Y1032 I1221 I1229	Y1032-Y1232 HydrophobicContact CE2-CD2 4.32Å; Y1032-Y1232 HydrophobicContact CE2-CG 4.35Å; I1221-Y1232 WeakPolarHBondContact O-CA 3.29Å; I1229-Y1232 HydrophobicContact CG2-CD1 4.45Å
1233	G	88.5	Confident	85.6	Confident	2 Å²	2	67.8 Å²	67.8	2%	0.021	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	164.7	-177	180	0	0	0	0	0	112.9	I1221	I1221-G1233 PolarHBondContact N-O 3.3Å; I1221-G1233 PolarHBondContact O-N 3.42Å; I1221-G1233 VanDerWaalsContact O-N 3.13Å
1234	K	88.4	Confident	85.2	Confident	120 Å²	120	70 Å²	70	52%	0.522	33%	0.325	S	S	.	.			trans	-73.1	155.8	169	-66.3	-175.3	176.9	-178.9	0	109.9	Y1220 N1236 E1237 L1238	Y1220-K1234 HydrophobicContact CD1-CG 4.48Å; Y1220-K1234 HydrophobicContact CE1-CG 4.31Å; K1234-N1236 PolarHBondContact O-N 2.89Å; K1234-E1237 HydrophobicContact CB-CB 4.38Å; K1234-E1237 WeakPolarHBondContact O-CB 3.34Å; K1234-E1237 PolarHBondContact O-N 3.34Å; K1234-L1238 PolarHBondContact O-N 3.04Å
1235	L	84.7	Confident	84.9	Confident	31 Å²	31	70.1 Å²	70.1	16%	0.162	33%	0.325	C	S	.	.	H	α-helix	trans	-49.5	-53.9	-179.8	179.8	64.3	0	0	0	112.7	I1221 E1237 L1238 I1239 F1245	I1221-L1235 HydrophobicContact CD1-CB 3.94Å; I1221-L1235 HydrophobicContact CD1-CD1 3.65Å; I1221-L1235 HydrophobicContact CD1-CG 4.42Å; L1235-E1237 VanDerWaalsContact C-N 3.27Å; L1235-E1237 PolarHBondContact O-N 3.48Å; L1235-L1238 PolarHBondContact O-N 3.33Å; L1235-I1239 HydrophobicContact CD1-CD1 3.88Å; L1235-I1239 HydrophobicContact CD1-CG1 4.38Å; L1235-I1239 HydrophobicContact CG-CD1 3.88Å; L1235-I1239 WeakPolarHBondContact O-CG1 3.39Å; L1235-I1239 PolarHBondContact O-N 3.07Å; L1235-F1245 HydrophobicContact CD1-CE1 3.77Å; L1235-F1245 HydrophobicContact CD1-CZ 3.81Å
1236	N	84.6	Confident	84.8	Confident	115 Å²	115	71.9 Å²	71.9	62%	0.615	33%	0.331	S	S	*	.	H	α-helix	trans	-60.5	-38.9	-179.8	-65.9	-11.2	0	0	0	111.7	K1234 I1239 H1240	K1234-N1236 PolarHBondContact O-N 2.89Å; N1236-I1239 PolarHBondContact O-N 3.46Å; N1236-H1240 PolarHBondContact O-N 3.49Å; N1236-H1240 PolarHBondContact O-ND1 3.26Å
1237	E	86.4	Confident	84.6	Confident	86 Å²	86	69.7 Å²	69.7	40%	0.402	32%	0.319	S	S	.	.	H	α-helix	trans	-66.1	-43.2	-179.8	-170.6	-177.9	179.9	0	0	112.1	K1234 L1235 H1240 R1241	K1234-E1237 HydrophobicContact CB-CB 4.38Å; K1234-E1237 WeakPolarHBondContact O-CB 3.34Å; K1234-E1237 PolarHBondContact O-N 3.34Å; L1235-E1237 VanDerWaalsContact C-N 3.27Å; L1235-E1237 PolarHBondContact O-N 3.48Å; E1237-H1240 PolarHBondContact O-N 3.14Å; E1237-R1241 WeakPolarHBondContact O-CG 3.4Å; E1237-R1241 PolarHBondContact O-N 3.28Å; E1237-R1241 IonicContact OE1-CZ 3.46Å; E1237-R1241 IonicContact OE1-NE 3.59Å; E1237-R1241 IonicContact OE1-NH2 2.67Å; E1237-R1241 PolarHBondContact OE1-NH2 3.41Å
1238	L	84.8	Confident	84.3	Confident	0 Å²	0	71.3 Å²	71.3	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-67.9	-36.7	177.8	-67.6	-178.8	0	0	0	112.3	I1221 E1231 K1234 L1235 H1240 R1241 F1245	I1221-L1238 HydrophobicContact CB-CD1 3.61Å; I1221-L1238 HydrophobicContact CD1-CD1 4.22Å; I1221-L1238 HydrophobicContact CG1-CD1 4.48Å; I1221-L1238 HydrophobicContact CG2-CD1 3.88Å; E1231-L1238 HydrophobicContact CB-CD2 3.93Å; K1234-L1238 PolarHBondContact O-N 3.04Å; L1235-L1238 PolarHBondContact O-N 3.33Å; L1238-H1240 VanDerWaalsContact C-N 3.35Å; L1238-R1241 PolarHBondContact O-N 2.9Å; L1238-F1245 HydrophobicContact CB-CB 4.07Å; L1238-F1245 HydrophobicContact CB-CD1 3.45Å; L1238-F1245 VanDerWaalsContact CB-CD1 3.45Å; L1238-F1245 HydrophobicContact CB-CE1 4.15Å; L1238-F1245 HydrophobicContact CB-CG 3.9Å; L1238-F1245 HydrophobicContact CD1-CB 4.18Å; L1238-F1245 HydrophobicContact CD1-CD1 4.09Å; L1238-F1245 HydrophobicContact CD1-CD2 4.22Å; L1238-F1245 HydrophobicContact CD1-CG 3.86Å; L1238-F1245 HydrophobicContact CG-CD1 4.43Å; L1238-F1245 HydrophobicContact CG-CG 4.49Å
1239	I	84.1	Confident	83.7	Confident	39 Å²	39	66.5 Å²	66.5	20%	0.2	31%	0.31	C	S	.	.	H	α-helix	trans	-63.2	-42	173.5	-66.8	169.8	0	0	0	110.6	L1235 N1236 K1242 F1245 F1246 Y1249	L1235-I1239 HydrophobicContact CD1-CD1 3.88Å; L1235-I1239 HydrophobicContact CD1-CG1 4.38Å; L1235-I1239 HydrophobicContact CG-CD1 3.88Å; L1235-I1239 WeakPolarHBondContact O-CG1 3.39Å; L1235-I1239 PolarHBondContact O-N 3.07Å; N1236-I1239 PolarHBondContact O-N 3.46Å; I1239-K1242 PolarHBondContact O-N 3.27Å; I1239-F1245 HydrophobicContact CG1-CE1 4.23Å; I1239-F1246 HydrophobicContact CG2-CD2 4.23Å; I1239-F1246 HydrophobicContact CG2-CE2 4.33Å; I1239-Y1249 HydrophobicContact CD1-CE1 4.13Å; I1239-Y1249 HydrophobicContact CD1-CE2 4.17Å; I1239-Y1249 HydrophobicContact CG1-CD1 4.41Å; I1239-Y1249 HydrophobicContact CG1-CE1 4.43Å
1240	H	84	Confident	83	Confident	155 Å²	155	67.8 Å²	67.8	72%	0.718	31%	0.314	S	S	*	.	H	α-helix	trans	-69.8	-31.4	179	-75.7	67.5	0	0	0	113	N1236 E1237 L1238 K1242	N1236-H1240 PolarHBondContact O-N 3.49Å; N1236-H1240 PolarHBondContact O-ND1 3.26Å; E1237-H1240 PolarHBondContact O-N 3.14Å; L1238-H1240 VanDerWaalsContact C-N 3.35Å; H1240-K1242 PolarHBondContact O-N 3.3Å
1241	R	83.6	Confident	81.8	Confident	129 Å²	129	66.2 Å²	66.2	49%	0.487	31%	0.306	S	S	.	.	H	α-helix	trans	-69.3	-18.2	178.7	-76.6	-179.9	-174.2	-165.4	5	113.8	E1237 L1238 G1243	E1237-R1241 WeakPolarHBondContact O-CG 3.4Å; E1237-R1241 PolarHBondContact O-N 3.28Å; E1237-R1241 IonicContact OE1-CZ 3.46Å; E1237-R1241 IonicContact OE1-NE 3.59Å; E1237-R1241 IonicContact OE1-NH2 2.67Å; E1237-R1241 PolarHBondContact OE1-NH2 3.41Å; L1238-R1241 PolarHBondContact O-N 2.9Å; R1241-G1243 PolarHBondContact O-N 3.49Å
1242	K	80.7	Confident	80.5	Confident	153 Å²	153	66.8 Å²	66.8	67%	0.665	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.8	39.1	-178.2	-64.4	-172.7	176.2	-175.1	0	113.9	I1239 H1240 F1246	I1239-K1242 PolarHBondContact O-N 3.27Å; H1240-K1242 PolarHBondContact O-N 3.3Å; K1242-F1246 HydrophobicContact CB-CD1 4.2Å; K1242-F1246 HydrophobicContact CB-CG 4.35Å; K1242-F1246 HydrophobicContact CG-CD1 4.26Å; K1242-F1246 HydrophobicContact CG-CE1 4.38Å; K1242-F1246 HydrophobicContact CG-CG 4.34Å
1243	G	82.3	Confident	78.9	Confident	15 Å²	15	65 Å²	65	16%	0.155	31%	0.309	C	S	.	.	S	Bend	trans	-91.8	-157	-179.2	0	0	0	0	0	114.4	E1231 R1241 F1245 F1246 N1247	E1231-G1243 WeakPolarHBondContact OE1-CA 3.36Å; R1241-G1243 PolarHBondContact O-N 3.49Å; G1243-F1245 PolarHBondContact O-N 3.23Å; G1243-F1246 WeakPolarHBondContact O-CB 3.47Å; G1243-F1246 PolarHBondContact O-N 2.99Å; G1243-N1247 PolarHBondContact O-N 2.97Å
1244	E	80	Confident	76.5	Confident	48 Å²	48	65.4 Å²	65.4	22%	0.224	31%	0.311	C	S	.	.	H	α-helix	trans	-61.1	-33.6	178.4	-134.1	-150.4	-143.3	0	0	111.7	V1223 I1230 E1231 F1246 N1247 L1248	V1223-E1244 HydrophobicContact CG1-CB 4.44Å; I1230-E1244 HydrophobicContact CD1-CB 4.38Å; I1230-E1244 VanDerWaalsContact CD1-CD 3.42Å; I1230-E1244 HydrophobicContact CD1-CG 4.29Å; I1230-E1244 WeakPolarHBondContact CD1-OE1 3.3Å; I1230-E1244 WeakPolarHBondContact CD1-OE2 3.21Å; E1231-E1244 PolarHBondContact OE1-N 3.18Å; E1231-E1244 PolarHBondContact OE2-N 3.49Å; E1244-F1246 VanDerWaalsContact C-N 3.33Å; E1244-F1246 PolarHBondContact O-N 3.34Å; E1244-N1247 PolarHBondContact O-N 3.06Å; E1244-L1248 WeakPolarHBondContact O-CG 3.34Å; E1244-L1248 PolarHBondContact O-N 3.04Å
1245	F	82.6	Confident	74	Confident	2 Å²	2	67.3 Å²	67.3	1%	0.009	32%	0.319	C	S	.	.	H	α-helix	trans	-60.8	-43.9	171.5	-175.4	-105	0	0	0	111.7	V1043 I1221 V1223 E1231 L1235 L1238 I1239 G1243 N1247 L1248 Y1249	V1043-F1245 HydrophobicContact CG1-CD2 4.48Å; V1043-F1245 HydrophobicContact CG1-CE2 4.4Å; V1043-F1245 HydrophobicContact CG2-CE2 4.38Å; I1221-F1245 HydrophobicContact CD1-CE1 4.27Å; I1221-F1245 HydrophobicContact CD1-CE2 4.06Å; I1221-F1245 HydrophobicContact CD1-CZ 3.7Å; I1221-F1245 HydrophobicContact CG2-CD2 3.92Å; I1221-F1245 HydrophobicContact CG2-CE2 3.69Å; I1221-F1245 HydrophobicContact CG2-CZ 4.43Å; V1223-F1245 HydrophobicContact CG2-CB 3.65Å; V1223-F1245 HydrophobicContact CG2-CD2 3.64Å; V1223-F1245 HydrophobicContact CG2-CG 4.06Å; E1231-F1245 WeakPolarHBondContact OE2-CB 3.21Å; E1231-F1245 PolarHBondContact OE2-N 3.25Å; E1231-F1245 VanDerWaalsContact OE2-N 3.11Å; L1235-F1245 HydrophobicContact CD1-CE1 3.77Å; L1235-F1245 HydrophobicContact CD1-CZ 3.81Å; L1238-F1245 HydrophobicContact CB-CB 4.07Å; L1238-F1245 HydrophobicContact CB-CD1 3.45Å; L1238-F1245 VanDerWaalsContact CB-CD1 3.45Å; L1238-F1245 HydrophobicContact CB-CE1 4.15Å; L1238-F1245 HydrophobicContact CB-CG 3.9Å; L1238-F1245 HydrophobicContact CD1-CB 4.18Å; L1238-F1245 HydrophobicContact CD1-CD1 4.09Å; L1238-F1245 HydrophobicContact CD1-CD2 4.22Å; L1238-F1245 HydrophobicContact CD1-CG 3.86Å; L1238-F1245 HydrophobicContact CG-CD1 4.43Å; L1238-F1245 HydrophobicContact CG-CG 4.49Å; I1239-F1245 HydrophobicContact CG1-CE1 4.23Å; G1243-F1245 PolarHBondContact O-N 3.23Å; F1245-N1247 VanDerWaalsContact C-N 3.28Å; F1245-N1247 PolarHBondContact O-N 3.3Å; F1245-L1248 CarbonylContact O-C 3.58Å; F1245-L1248 PolarHBondContact O-N 3.45Å; F1245-Y1249 HydrophobicContact CE1-CD2 4.13Å; F1245-Y1249 HydrophobicContact CE1-CG 4.4Å; F1245-Y1249 HydrophobicContact CZ-CD2 4.29Å; F1245-Y1249 VanDerWaalsContact O-CB 3.25Å; F1245-Y1249 WeakPolarHBondContact O-CB 3.38Å; F1245-Y1249 PolarHBondContact O-N 3.44Å
1246	F	82.1	Confident	73.4	Confident	55 Å²	55	69.1 Å²	69.1	24%	0.241	33%	0.327	C	S	.	.	H	α-helix	trans	-66.4	-34.5	-179.2	-179.6	-97.2	0	0	0	111.1	I1239 K1242 G1243 E1244 Y1249 K1250	I1239-F1246 HydrophobicContact CG2-CD2 4.23Å; I1239-F1246 HydrophobicContact CG2-CE2 4.33Å; K1242-F1246 HydrophobicContact CB-CD1 4.2Å; K1242-F1246 HydrophobicContact CB-CG 4.35Å; K1242-F1246 HydrophobicContact CG-CD1 4.26Å; K1242-F1246 HydrophobicContact CG-CE1 4.38Å; K1242-F1246 HydrophobicContact CG-CG 4.34Å; G1243-F1246 WeakPolarHBondContact O-CB 3.47Å; G1243-F1246 PolarHBondContact O-N 2.99Å; E1244-F1246 VanDerWaalsContact C-N 3.33Å; E1244-F1246 PolarHBondContact O-N 3.34Å; F1246-Y1249 PolarHBondContact O-N 2.94Å; F1246-K1250 VanDerWaalsContact O-CB 3.3Å; F1246-K1250 WeakPolarHBondContact O-CB 3.36Å; F1246-K1250 PolarHBondContact O-N 3Å
1247	N	78.5	Confident	72.9	Confident	83 Å²	83	66.7 Å²	66.7	44%	0.444	31%	0.312	S	S	.	.	H	α-helix	trans	-64.2	-44.9	172.8	-68	-13.3	0	0	0	111.2	G1243 E1244 F1245 Y1249 K1250 L1251	G1243-N1247 PolarHBondContact O-N 2.97Å; E1244-N1247 PolarHBondContact O-N 3.06Å; F1245-N1247 VanDerWaalsContact C-N 3.28Å; F1245-N1247 PolarHBondContact O-N 3.3Å; N1247-Y1249 VanDerWaalsContact C-N 3.32Å; N1247-Y1249 PolarHBondContact O-N 3.18Å; N1247-K1250 PolarHBondContact O-N 2.81Å; N1247-L1251 WeakPolarHBondContact O-CB 3.43Å; N1247-L1251 WeakPolarHBondContact O-CD1 3.42Å; N1247-L1251 WeakPolarHBondContact O-CG 3.45Å; N1247-L1251 PolarHBondContact O-N 2.98Å
1248	L	75.3	Confident	72.1	Confident	34 Å²	34	65.6 Å²	65.6	18%	0.178	31%	0.307	C	S	.	.	H	α-helix	trans	-63.8	-37.5	173.2	-67.2	172.1	0	0	0	112.3	V1043 V1223 E1244 F1245 L1251 D1252	V1043-L1248 HydrophobicContact CG1-CD1 3.94Å; V1223-L1248 HydrophobicContact CG1-CD1 4.15Å; E1244-L1248 WeakPolarHBondContact O-CG 3.34Å; E1244-L1248 PolarHBondContact O-N 3.04Å; F1245-L1248 CarbonylContact O-C 3.58Å; F1245-L1248 PolarHBondContact O-N 3.45Å; L1248-L1251 PolarHBondContact O-N 3.06Å; L1248-D1252 PolarHBondContact O-N 3.16Å; L1248-D1252 VanDerWaalsContact O-N 3.17Å
1249	Y	74.8	Confident	71.4	Confident	51 Å²	51	69.5 Å²	69.5	20%	0.2	33%	0.325	C	S	.	.	H	α-helix	trans	-69.1	-42	178.6	-175.7	-97	0	0	0	111.8	L1212 I1239 F1245 F1246 N1247 D1252 N1253	L1212-Y1249 HydrophobicContact CD1-CD2 3.8Å; L1212-Y1249 HydrophobicContact CD1-CE2 3.86Å; L1212-Y1249 HydrophobicContact CD1-CG 4.46Å; L1212-Y1249 HydrophobicContact CD2-CD2 3.5Å; L1212-Y1249 HydrophobicContact CD2-CE2 4.01Å; L1212-Y1249 HydrophobicContact CD2-CG 4.46Å; L1212-Y1249 HydrophobicContact CG-CD2 4.26Å; L1212-Y1249 HydrophobicContact CG-CE2 4.44Å; I1239-Y1249 HydrophobicContact CD1-CE1 4.13Å; I1239-Y1249 HydrophobicContact CD1-CE2 4.17Å; I1239-Y1249 HydrophobicContact CG1-CD1 4.41Å; I1239-Y1249 HydrophobicContact CG1-CE1 4.43Å; F1245-Y1249 HydrophobicContact CE1-CD2 4.13Å; F1245-Y1249 HydrophobicContact CE1-CG 4.4Å; F1245-Y1249 HydrophobicContact CZ-CD2 4.29Å; F1245-Y1249 VanDerWaalsContact O-CB 3.25Å; F1245-Y1249 WeakPolarHBondContact O-CB 3.38Å; F1245-Y1249 PolarHBondContact O-N 3.44Å; F1246-Y1249 PolarHBondContact O-N 2.94Å; N1247-Y1249 VanDerWaalsContact C-N 3.32Å; N1247-Y1249 PolarHBondContact O-N 3.18Å; Y1249-D1252 PolarHBondContact O-N 3.47Å; Y1249-N1253 WeakPolarHBondContact CE1-ND2 3.41Å; Y1249-N1253 WeakPolarHBondContact O-CB 3.43Å; Y1249-N1253 PolarHBondContact O-N 3.11Å; Y1249-N1253 PolarHBondContact OH-ND2 2.95Å
1250	K	72.8	Confident	70.6	Confident	70 Å²	70	71.4 Å²	71.4	30%	0.304	33%	0.333	S	S	.	.	H	α-helix	trans	-57.3	-57.7	171.8	-168.9	-179	178	-170.8	0	107.5	D609 F1246 N1247 D1252 N1253 T1254	D609-K1250 PolarHBondContact O-NZ 3.36Å; F1246-K1250 VanDerWaalsContact O-CB 3.3Å; F1246-K1250 WeakPolarHBondContact O-CB 3.36Å; F1246-K1250 PolarHBondContact O-N 3Å; N1247-K1250 PolarHBondContact O-N 2.81Å; K1250-D1252 PolarHBondContact O-N 2.82Å; K1250-N1253 PolarHBondContact O-N 3.25Å; K1250-T1254 HydrophobicContact CG-CG2 4.27Å; K1250-T1254 WeakPolarHBondContact O-CB 3.26Å; K1250-T1254 WeakPolarHBondContact O-CG2 3.27Å; K1250-T1254 PolarHBondContact O-N 3.3Å; K1250-T1254 PolarHBondContact O-OG1 2.61Å
1251	L	64.1	Low	69.7	Low	47 Å²	47	65.8 Å²	65.8	25%	0.246	31%	0.307	C	S	.	.	H	α-helix	trans	-54.1	-22	-179.8	-75.5	165.3	0	0	0	116.3	Q607 N1247 L1248 T1254 K1255	Q607-L1251 HydrophobicContact CG-CD2 4.43Å; N1247-L1251 WeakPolarHBondContact O-CB 3.43Å; N1247-L1251 WeakPolarHBondContact O-CD1 3.42Å; N1247-L1251 WeakPolarHBondContact O-CG 3.45Å; N1247-L1251 PolarHBondContact O-N 2.98Å; L1248-L1251 PolarHBondContact O-N 3.06Å; L1251-T1254 WeakPolarHBondContact CA-OG1 3.43Å; L1251-T1254 PolarHBondContact O-OG1 3.23Å; L1251-K1255 VanDerWaalsContact O-CE 3.3Å; L1251-K1255 WeakPolarHBondContact O-CE 3.48Å
1252	D	60.8	Low	68.7	Low	39 Å²	39	61.3 Å²	61.3	21%	0.209	29%	0.294	C	S	.	.	H	α-helix	trans	-106.3	-28.3	-179.8	-89.5	-5.4	0	0	0	114.2	L1212 L1248 Y1249 K1250 T1254 K1255	L1212-D1252 HydrophobicContact CD1-CB 3.44Å; L1212-D1252 VanDerWaalsContact CD1-CB 3.44Å; L1212-D1252 HydrophobicContact CD2-CB 4.36Å; L1212-D1252 HydrophobicContact CG-CB 3.65Å; L1248-D1252 PolarHBondContact O-N 3.16Å; L1248-D1252 VanDerWaalsContact O-N 3.17Å; Y1249-D1252 PolarHBondContact O-N 3.47Å; K1250-D1252 PolarHBondContact O-N 2.82Å; D1252-T1254 PolarHBondContact O-N 2.81Å; D1252-K1255 IonicContact OD1-NZ 3.61Å; D1252-K1255 PolarHBondContact OD1-NZ 2.87Å
1253	N	53	Low	67.7	Low	90 Å²	90	54.2 Å²	54.2	48%	0.481	27%	0.266	S	S	.	.	H	α-helix	trans	-69.3	-11.5	166.8	-93.5	-3.3	0	0	0	112.4	L1212 Y1249 K1250	L1212-N1253 HydrophobicContact CD1-CB 4.43Å; L1212-N1253 VanDerWaalsContact CD1-OD1 3.28Å; L1212-N1253 WeakPolarHBondContact CD1-OD1 3.36Å; Y1249-N1253 WeakPolarHBondContact CE1-ND2 3.41Å; Y1249-N1253 WeakPolarHBondContact O-CB 3.43Å; Y1249-N1253 PolarHBondContact O-N 3.11Å; Y1249-N1253 PolarHBondContact OH-ND2 2.95Å; K1250-N1253 PolarHBondContact O-N 3.25Å
1254	T	40	Very low	66.5	Low	12 Å²	12	57.5 Å²	57.5	7%	0.074	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.7	29.7	-178	67.4	0	0	0	0	113.7	E606 K1250 L1251 D1252	E606-T1254 HydrophobicContact CB-CG2 3.33Å; E606-T1254 WeakPolarHBondContact CB-OG1 3.48Å; E606-T1254 HydrophobicContact CG-CG2 3.34Å; E606-T1254 VanDerWaalsContact OE1-CA 3.31Å; E606-T1254 WeakPolarHBondContact OE1-CA 3.46Å; E606-T1254 WeakPolarHBondContact OE1-CB 3.43Å; E606-T1254 VanDerWaalsContact OE1-CG2 3.25Å; E606-T1254 WeakPolarHBondContact OE1-CG2 3.48Å; E606-T1254 WeakPolarHBondContact OE2-CA 3.21Å; E606-T1254 WeakPolarHBondContact OE2-CB 3.39Å; K1250-T1254 HydrophobicContact CG-CG2 4.27Å; K1250-T1254 WeakPolarHBondContact O-CB 3.26Å; K1250-T1254 WeakPolarHBondContact O-CG2 3.27Å; K1250-T1254 PolarHBondContact O-N 3.3Å; K1250-T1254 PolarHBondContact O-OG1 2.61Å; L1251-T1254 WeakPolarHBondContact CA-OG1 3.43Å; L1251-T1254 PolarHBondContact O-OG1 3.23Å; D1252-T1254 PolarHBondContact O-N 2.81Å
1255	K	34.6	Very low	65.3	Low	159 Å²	159	58.4 Å²	58.4	69%	0.691	28%	0.28	S	S	*	.			trans	-137.9	0	173.8	-73.3	177.1	-168.5	150.1	0	107.1	L1251 D1252	L1251-K1255 VanDerWaalsContact O-CE 3.3Å; L1251-K1255 WeakPolarHBondContact O-CE 3.48Å; D1252-K1255 IonicContact OD1-NZ 3.61Å; D1252-K1255 PolarHBondContact OD1-NZ 2.87Å

Retrieved 1,255 of 1,255 residues in 467.8 ms (Link to these results)

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