A0A087X937_POEFO Loading...

Gamma-aminobutyric acid type B receptor subunit 1

AlphaFold DB , UniProt , Accession A0A087X937, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 997 aa.

						>A0A087X937_POEFO|A0A087X937
MAPILFLIILCALPALVVPIHNSSAGGCAIIRPPRDGGIRYRGLTQEQIRSVRILPVDYEIEYICRENRQIAGPKVRKCLPNGTWTDMTQLSVCLLQCPKVWTSLENGRVTARPPGPPAEGTVLHYTCNSGFTLEGRNISHCTKLGKWDAPKPTCLYDRNYTGKKKLYIGALFPMSGGWPGGQACMPSAQMALDLVNNRSDILPDYELELIHYDSMCDPGEATKLLYDLLYTEPIKIVLMPGCSGVSTLVAEAARMWNLIVLSYGSSSPALSNRQRFPTFFRTHPSATLHNPTRVRLFKKWNWSRIATIQQTTEVFTSTLDDLEQRVKEAGIEISVRQSFLTDPAVAVKNLKRQDARIIVGLFYETEARKVFCEVFKEKLYGKKHVWFLIGWYADNWFKIKDPAINCTVENMTEAVEGHVTTEIVMLNPETVRGVSNMTSQEFLGALMSRLGGKNPEETGGFQEAPLAFDAVWALALALNKTVAPLKAKGRRLEDFNYNNHDITSEIYRALNTSSFEGVSGHVVFDAQGSRMAMTLIEQLQGGSYKKIGYYDSSQMNLSWFNNDVWIGGKPPADRTVVLEEYRLLSQKLFASVSVFAGLGILLGIVCLTFNIYNGNVRYIQNSQPYLNNMTAVGCMMALAAVFPLGIDRHHVNRPQFPVVCQFRLWLLGLGFSLAYGSMFTKIWWVHTLFTKKDEKKEKKKQPLEPWKLYATVGVLLAIDFLSLMIWQIVDPLHITVEKFTREAPKEDLDVLIQPLLEHCSSEKMNTWLGVVYGYKGLLLLLGIFLAYETKSVSTEKINDHRAVGMAIYNVAVLCLITAPVTMILSSQQDASFAFASLAIVFSAYITLVVLFVPKMRRLITRGEWQSEQQDTLKTGSSTNNNDEEKSRQLERENRELQKIIQEKEERVSALRNQLAERQAIRNRRQPTSGQNQNHNAPPPASQTDPKSLLPPPGYPNPTADNHSLPPSFSNSSSLYPADSKMSRNHCHNSQIPLLYK
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	32.2	Very low	34.1	Very low	231 Å²	231	139.7 Å²	139.7	100%	1.138	76%	0.764	S	S	*	*				0	102.1	0	-82.9	-169.6	-80.5	0	0	105.9
2	A	41.3	Very low	33.7	Very low	95 Å²	95	136.4 Å²	136.4	79%	0.785	77%	0.769	S	S	*	*			trans	51.1	-159.3	-145.1	0	0	0	0	0	108.8
3	P	50.2	Low	33.5	Very low	100 Å²	100	139.1 Å²	139.1	65%	0.649	78%	0.779	S	S	*	*			cis	-140.2	-168.5	-6.9	34.8	-11.3	0	0	0	114.6
4	I	33.5	Very low	34.9	Very low	140 Å²	140	137.1 Å²	137.1	72%	0.718	78%	0.775	S	S	*	*			trans	76	119.6	135.2	-86.1	167.6	0	0	0	121.4
5	L	32.4	Very low	34.6	Very low	133 Å²	133	133.9 Å²	133.9	70%	0.696	77%	0.772	S	S	*	*			trans	72.9	152.4	138.9	-94.2	60.8	0	0	0	124.8
6	F	26.7	Very low	34.1	Very low	157 Å²	157	136.1 Å²	136.1	69%	0.689	78%	0.779	S	S	*	*			trans	79.2	134.3	150.8	-85.9	-142.6	0	0	0	116.8
7	L	30.1	Very low	34.2	Very low	129 Å²	129	135 Å²	135	68%	0.675	78%	0.775	S	S	*	*				60.3	140.1	58.8	-71.2	78.8	0	0	0	109.9
8	I	30.8	Very low	34.3	Very low	124 Å²	124	133.8 Å²	133.8	64%	0.636	77%	0.771	S	S	*	*			cis	-163.2	159.6	25.5	-141.6	164.3	0	0	0	109.9
9	I	31.7	Very low	34.3	Very low	141 Å²	141	133.2 Å²	133.2	72%	0.723	77%	0.772	S	S	*	*			trans	56.9	115.8	159.2	-67.2	166.7	0	0	0	117.1
10	L	37.4	Very low	34.8	Very low	159 Å²	159	133.9 Å²	133.9	83%	0.832	77%	0.771	S	S	*	*				71.3	85.9	53.4	-158.7	166.7	0	0	0	114
11	C	29.3	Very low	34.8	Very low	128 Å²	128	136.7 Å²	136.7	87%	0.865	78%	0.777	S	S	*	*			trans	-160.6	165.2	161.1	-138.1	0	0	0	0	113.3
12	A	29.1	Very low	34.9	Very low	100 Å²	100	133.1 Å²	133.1	83%	0.826	76%	0.762	S	S	*	*			trans	66.4	92.7	171.4	0	0	0	0	0	119.4
13	L	31.2	Very low	35	Very low	171 Å²	171	134.8 Å²	134.8	90%	0.895	77%	0.768	S	S	*	*			trans	-104.9	168.5	143.8	-89.6	169	0	0	0	107.8
14	P	53.3	Low	34.9	Very low	112 Å²	112	135.2 Å²	135.2	73%	0.727	77%	0.774	S	S	*	*			cis	-133.1	-166.6	-6	39.3	-20.6	0	0	0	114.2
15	A	29.4	Very low	35.9	Very low	88 Å²	88	133.6 Å²	133.6	73%	0.727	78%	0.781	S	S	*	*			trans	76.1	150	158.9	0	0	0	0	0	117.8
16	L	27.5	Very low	37.2	Very low	169 Å²	169	129.3 Å²	129.3	89%	0.885	77%	0.769	S	S	*	*			cis	-125.3	158.5	6.9	-113.2	115.2	0	0	0	113.6
17	V	34.6	Very low	39.4	Very low	118 Å²	118	122.5 Å²	122.5	72%	0.715	74%	0.743	S	S	*	*			trans	-81.6	151.9	169.4	172	0	0	0	0	108.7
18	V	36.4	Very low	41.9	Very low	114 Å²	114	116.4 Å²	116.4	69%	0.691	71%	0.711	S	S	*	*				-171.5	137.3	97.3	162	0	0	0	0	110.2	I20	V18-I20 HydrophobicContact CG1-CG1 3.87Å
19	P	35	Very low	44.2	Very low	121 Å²	121	113.7 Å²	113.7	79%	0.786	71%	0.707	S	S	*	*			trans	-117.7	142	132.5	34.8	-31	0	0	0	111.6
20	I	44.3	Very low	46.3	Very low	147 Å²	147	109.8 Å²	109.8	75%	0.754	69%	0.687	S	S	*	*			trans	-82.8	136.3	178.7	-61.4	168	0	0	0	109.5	V18	V18-I20 HydrophobicContact CG1-CG1 3.87Å
21	H	34.7	Very low	48.1	Very low	193 Å²	193	103.8 Å²	103.8	89%	0.894	66%	0.656	S	S	*	*			trans	-139.3	148.5	164.8	-114.5	35.4	0	0	0	114
22	N	35	Very low	49.9	Very low	157 Å²	157	108.4 Å²	108.4	84%	0.84	66%	0.655	S	S	*	*			trans	-71	145	-162.1	-94.8	-28.4	0	0	0	114.5	S24	N22-S24 PolarHBondContact O-N 2.84Å
23	S	42.5	Very low	51.5	Low	130 Å²	130	107.4 Å²	107.4	91%	0.909	64%	0.64	S	S	*	*			trans	-63.6	111.3	164.7	-58.9	0	0	0	0	111.3
24	S	47.2	Very low	53	Low	109 Å²	109	101.4 Å²	101.4	76%	0.762	61%	0.611	S	S	*	*			trans	-127.4	153	149.7	59.1	0	0	0	0	107.7	N22 G26	N22-S24 PolarHBondContact O-N 2.84Å; S24-G26 PolarHBondContact O-N 3.34Å
25	A	56.2	Low	53.3	Low	105 Å²	105	107.6 Å²	107.6	87%	0.868	62%	0.62	S	S	*	*			trans	-69.3	88.6	-159	0	0	0	0	0	114
26	G	59.8	Low	55.1	Low	43 Å²	43	107.2 Å²	107.2	44%	0.443	61%	0.606	S	S	.	*			trans	-67.9	130	171.5	0	0	0	0	0	111.8	S24 V57	S24-G26 PolarHBondContact O-N 3.34Å; G26-V57 WeakPolarHBondContact O-CG2 3.48Å
27	G	72.3	Confident	57.2	Low	15 Å²	15	99.3 Å²	99.3	16%	0.155	57%	0.565	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-179.6	159.8	178.5	0	0	0	0	0	110.8	L55	G27-L55 CarbonylContact C-O 3.53Å; G27-L55 WeakPolarHBondContact CA-O 3.43Å
28	C	81.4	Confident	59.2	Low	0 Å²	0	94.6 Å²	94.6	0%	0	54%	0.54	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	136.5	-169.4	-56.4	0	0	0	0	112.2	L55 C79 T84 W85	C28-L55 PolarHBondContact N-O 2.92Å; C28-L55 PolarHBondContact O-N 3.34Å; C28-C79 HydrophobicContact CB-CB 3.8Å; C28-C79 WeakPolarHBondContact CB-SG 3.24Å; C28-C79 PolarHBondContact N-SG 3.14Å; C28-C79 WeakPolarHBondContact SG-CA 3.4Å; C28-C79 WeakPolarHBondContact SG-CB 3.26Å; C28-C79 CovalentContact SG-SG 2.03Å; C28-C79 PolarHBondContact SG-SG 3.03Å; C28-T84 PolarHBondContact SG-O 2.94Å; C28-W85 HydrophobicContact CB-CD2 4.11Å; C28-W85 VanDerWaalsContact CB-CE2 3.48Å; C28-W85 HydrophobicContact CB-CH2 4.32Å; C28-W85 HydrophobicContact CB-CZ2 3.6Å
29	A	80.3	Confident	61.3	Low	67 Å²	67	90.2 Å²	90.2	55%	0.554	51%	0.512	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-65.2	146.4	174.6	0	0	0	0	0	111.7	I31 W85	A29-I31 PolarHBondContact O-N 3.18Å; A29-W85 PolarHBondContact O-NE1 3.43Å
30	I	76.6	Confident	63.4	Low	59 Å²	59	91.7 Å²	91.7	30%	0.303	50%	0.502	S	S	.	.	P	Polyproline II helix	trans	-66.2	120.6	-178.8	-171.9	168.8	0	0	0	112.5	Y41 I49	I30-Y41 HydrophobicContact CD1-CE1 4.05Å; I30-Y41 HydrophobicContact CG1-CE1 3.8Å; I30-Y41 WeakPolarHBondContact CG1-OH 3.39Å; I30-I49 HydrophobicContact CD1-CG2 3.97Å
31	I	74.6	Confident	65.1	Low	33 Å²	33	85.4 Å²	85.4	17%	0.169	47%	0.469	C	S	.	.	P	Polyproline II helix	trans	-72.2	137.1	174	-48.2	-169.6	0	0	0	109.6	A29 I39 Y41 I61 W85	A29-I31 PolarHBondContact O-N 3.18Å; I31-I39 HydrophobicContact CB-CD1 3.87Å; I31-I39 HydrophobicContact CG2-CD1 3.8Å; I31-Y41 PolarHBondContact O-OH 3.11Å; I31-I61 HydrophobicContact CB-CD1 4.43Å; I31-I61 HydrophobicContact CD1-CD1 3.54Å; I31-I61 HydrophobicContact CG1-CD1 3.92Å; I31-W85 HydrophobicContact CD1-CB 4.44Å; I31-W85 HydrophobicContact CD1-CD2 4.13Å; I31-W85 HydrophobicContact CD1-CG 3.8Å; I31-W85 HydrophobicContact CG1-CD2 4.45Å; I31-W85 HydrophobicContact CG1-CG 4.32Å
32	R	66.3	Low	67	Low	226 Å²	226	82 Å²	82	85%	0.853	45%	0.448	S	S	*	.	P	Polyproline II helix	trans	-80.4	141.3	171.8	-64.9	-175.2	-179.3	-170.9	0.8	110.9
33	P	62.5	Low	68.7	Low	78 Å²	78	78.2 Å²	78.2	51%	0.506	45%	0.447	S	S	.	.	P	Polyproline II helix	trans	-65.2	145.5	-178.4	26.2	-34.8	0	0	0	112.7	I39	P33-I39 HydrophobicContact CB-CG1 4.37Å
34	P	62.3	Low	70.2	Confident	45 Å²	45	74.3 Å²	74.3	29%	0.292	42%	0.416	S	S	.	.	P	Polyproline II helix	trans	-69.2	153.6	174.7	30.3	-34.8	0	0	0	111.3	D36 G37 Y63	P34-D36 VanDerWaalsContact C-N 3.33Å; P34-D36 PolarHBondContact O-N 3.17Å; P34-G37 CarbonylContact O-C 3.46Å; P34-G37 PolarHBondContact O-N 2.72Å; P34-G37 VanDerWaalsContact O-N 3.12Å; P34-Y63 HydrophobicContact CG-CD1 4.3Å; P34-Y63 HydrophobicContact CG-CE1 4.44Å
35	R	61.1	Low	71.6	Confident	243 Å²	243	72.5 Å²	72.5	92%	0.917	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.1	-44.8	-175.1	-76.6	-174.6	172.4	-175	-2	113.2	G37	R35-G37 VanDerWaalsContact C-N 3.29Å; R35-G37 PolarHBondContact O-N 3.16Å
36	D	66.4	Low	72.1	Confident	80 Å²	80	74 Å²	74	43%	0.428	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.1	14.7	-176.4	-57.6	-98.8	0	0	0	114.1	P34 R66 R69 C94	P34-D36 VanDerWaalsContact C-N 3.33Å; P34-D36 PolarHBondContact O-N 3.17Å; D36-R66 PolarHBondContact O-N 2.93Å; D36-R69 IonicContact OD1-CZ 2.67Å; D36-R69 IonicContact OD1-NH1 3.55Å; D36-R69 PolarHBondContact OD1-NH1 3.26Å; D36-R69 IonicContact OD1-NH2 2.77Å; D36-C94 HydrophobicContact CB-CB 4.11Å
37	G	71.6	Confident	72.6	Confident	2 Å²	2	79.1 Å²	79.1	2%	0.021	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.6	-144.6	-172.6	0	0	0	0	0	115.1	P34 R35 I64 R66	P34-G37 CarbonylContact O-C 3.46Å; P34-G37 PolarHBondContact O-N 2.72Å; P34-G37 VanDerWaalsContact O-N 3.12Å; R35-G37 VanDerWaalsContact C-N 3.29Å; R35-G37 PolarHBondContact O-N 3.16Å; G37-I64 CarbonylContact C-O 3.49Å; G37-I64 VanDerWaalsContact CA-O 3.25Å; G37-I64 WeakPolarHBondContact CA-O 3.36Å; G37-R66 PolarHBondContact O-NE 3.32Å; G37-R66 VanDerWaalsContact O-NE 3.09Å; G37-R66 PolarHBondContact O-NH2 2.91Å
38	G	77.9	Confident	72.5	Confident	19 Å²	19	82.5 Å²	82.5	20%	0.196	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-168.6	169.3	-176.6	0	0	0	0	0	111	I64	G38-I64 PolarHBondContact N-O 3.38Å; G38-I64 PolarHBondContact O-N 2.75Å
39	I	79.3	Confident	72	Confident	22 Å²	22	84 Å²	84	11%	0.113	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	130.6	172.6	-61.7	174.5	0	0	0	107.2	I31 P33 Y41 I61 Y63	I31-I39 HydrophobicContact CB-CD1 3.87Å; I31-I39 HydrophobicContact CG2-CD1 3.8Å; P33-I39 HydrophobicContact CB-CG1 4.37Å; I39-Y41 HydrophobicContact CB-CE2 4.14Å; I39-Y41 HydrophobicContact CG2-CD2 4.49Å; I39-Y41 HydrophobicContact CG2-CE1 4.14Å; I39-Y41 HydrophobicContact CG2-CE2 3.89Å; I39-I61 HydrophobicContact CG2-CB 3.82Å; I39-I61 HydrophobicContact CG2-CD1 4.29Å; I39-I61 HydrophobicContact CG2-CG1 4.45Å; I39-I61 HydrophobicContact CG2-CG2 4.36Å; I39-Y63 HydrophobicContact CD1-CD1 4.24Å; I39-Y63 HydrophobicContact CD1-CE1 3.7Å; I39-Y63 HydrophobicContact CG1-CD1 3.8Å; I39-Y63 HydrophobicContact CG1-CE1 3.8Å; I39-Y63 HydrophobicContact CG1-CG 4.39Å
40	R	80	Confident	71.4	Confident	152 Å²	152	90.7 Å²	90.7	57%	0.574	43%	0.432	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.3	122.7	175.1	-177.7	178.2	-173.9	178.3	3.4	109.3	E62 I64	R40-E62 PolarHBondContact N-O 2.99Å; R40-E62 PolarHBondContact O-N 3.02Å; R40-I64 HydrophobicContact CB-CD1 3.66Å; R40-I64 HydrophobicContact CB-CG1 4.33Å; R40-I64 HydrophobicContact CG-CD1 4.4Å
41	Y	80.3	Confident	71	Confident	16 Å²	16	92.2 Å²	92.2	6%	0.063	45%	0.448	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	125.3	173.8	-54.7	-93.8	0	0	0	107.4	I30 I31 I39 G43 I49 L55 Y59 I61	I30-Y41 HydrophobicContact CD1-CE1 4.05Å; I30-Y41 HydrophobicContact CG1-CE1 3.8Å; I30-Y41 WeakPolarHBondContact CG1-OH 3.39Å; I31-Y41 PolarHBondContact O-OH 3.11Å; I39-Y41 HydrophobicContact CB-CE2 4.14Å; I39-Y41 HydrophobicContact CG2-CD2 4.49Å; I39-Y41 HydrophobicContact CG2-CE1 4.14Å; I39-Y41 HydrophobicContact CG2-CE2 3.89Å; Y41-G43 PolarHBondContact O-N 3.25Å; Y41-I49 HydrophobicContact CD2-CD1 3.47Å; Y41-I49 VanDerWaalsContact CD2-CD1 3.47Å; Y41-I49 HydrophobicContact CD2-CG1 3.8Å; Y41-I49 HydrophobicContact CD2-CG2 4.35Å; Y41-I49 HydrophobicContact CE2-CD1 4.26Å; Y41-I49 HydrophobicContact CE2-CG1 4.45Å; Y41-I49 HydrophobicContact CE2-CG2 4.18Å; Y41-I49 HydrophobicContact CG-CD1 4.12Å; Y41-I49 HydrophobicContact CG-CG1 4.15Å; Y41-L55 HydrophobicContact CD1-CD1 3.71Å; Y41-L55 HydrophobicContact CE1-CD1 3.87Å; Y41-Y59 WeakPolarHBondContact CB-OH 3.4Å; Y41-Y59 HydrophobicContact CD1-CE1 4.3Å; Y41-I61 HydrophobicContact CD1-CG2 3.48Å; Y41-I61 VanDerWaalsContact CD1-CG2 3.48Å; Y41-I61 HydrophobicContact CE1-CG2 3.66Å; Y41-I61 HydrophobicContact CG-CG2 4.39Å
42	R	73.7	Confident	70.9	Confident	120 Å²	120	92.8 Å²	92.8	45%	0.453	45%	0.452	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.6	109.8	-175	-70.2	-179.4	170.3	-168.5	-9.4	109.9	Y59 E60 E62	R42-Y59 PolarHBondContact N-OH 3.12Å; R42-Y59 PolarHBondContact O-OH 3.2Å; R42-E60 IonicContact CZ-OE2 2.81Å; R42-E60 IonicContact NE-OE2 3.89Å; R42-E60 IonicContact NH1-OE2 3.27Å; R42-E60 PolarHBondContact NH1-OE2 3.29Å; R42-E62 IonicContact CZ-OE2 3.47Å; R42-E62 IonicContact NE-OE2 2.7Å; R42-E62 IonicContact NH2-OE2 3.54Å; R42-E62 PolarHBondContact NH2-OE2 3.06Å
43	G	70.6	Confident	71	Confident	78 Å²	78	92.1 Å²	92.1	80%	0.804	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.5	13.7	176.7	0	0	0	0	0	116.7	Y41	Y41-G43 PolarHBondContact O-N 3.25Å
44	L	74.4	Confident	71.7	Confident	49 Å²	49	93.6 Å²	93.6	26%	0.257	45%	0.452	S	S	.	.			trans	-116.8	140.2	173.4	-65.4	174.4	0	0	0	111.7	Q48 I49 L55	L44-Q48 HydrophobicContact CB-CB 4.47Å; L44-Q48 HydrophobicContact CD2-CB 4.19Å; L44-I49 HydrophobicContact CB-CD1 4.34Å; L44-I49 HydrophobicContact CB-CG1 3.92Å; L44-L55 HydrophobicContact CD1-CD2 3.68Å
45	T	75.3	Confident	72.7	Confident	70 Å²	70	91.7 Å²	91.7	43%	0.429	44%	0.44	S	S	.	.			trans	-80.8	161	173.3	72.4	0	0	0	0	111.9	E47 Q48 I49	T45-E47 PolarHBondContact O-N 3.38Å; T45-Q48 PolarHBondContact O-N 2.65Å; T45-Q48 VanDerWaalsContact O-N 3.12Å; T45-Q48 WeakPolarHBondContact OG1-CG 3.38Å; T45-Q48 PolarHBondContact OG1-N 2.78Å; T45-Q48 PolarHBondContact OG1-OE1 2.96Å; T45-I49 WeakPolarHBondContact O-CB 3.47Å; T45-I49 WeakPolarHBondContact O-CD1 3.4Å; T45-I49 VanDerWaalsContact O-CG1 3.22Å; T45-I49 WeakPolarHBondContact O-CG1 3.36Å; T45-I49 PolarHBondContact O-N 3.34Å
46	Q	67.3	Low	73.8	Confident	138 Å²	138	83.9 Å²	83.9	65%	0.645	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-21	178.9	-158.9	69.5	0.2	0	0	113.7
47	E	71.1	Confident	74.4	Confident	149 Å²	149	82.3 Å²	82.3	70%	0.696	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.3	-44.1	177	-69.5	158.7	-175.1	0	0	111.4	T45 I49 R50	T45-E47 PolarHBondContact O-N 3.38Å; E47-I49 VanDerWaalsContact C-N 3.27Å; E47-I49 PolarHBondContact O-N 3.18Å; E47-R50 WeakPolarHBondContact O-CB 3.5Å; E47-R50 PolarHBondContact O-N 3.47Å
48	Q	70.6	Confident	74.9	Confident	87 Å²	87	86.8 Å²	86.8	41%	0.407	44%	0.437	S	S	.	.	H	α-helix	trans	-61.9	-36.6	172.6	-67.7	167.8	-30.9	0	0	111.7	L44 T45 R50 S51 V52	L44-Q48 HydrophobicContact CB-CB 4.47Å; L44-Q48 HydrophobicContact CD2-CB 4.19Å; T45-Q48 PolarHBondContact O-N 2.65Å; T45-Q48 VanDerWaalsContact O-N 3.12Å; T45-Q48 WeakPolarHBondContact OG1-CG 3.38Å; T45-Q48 PolarHBondContact OG1-N 2.78Å; T45-Q48 PolarHBondContact OG1-OE1 2.96Å; Q48-R50 PolarHBondContact O-N 3.07Å; Q48-R50 VanDerWaalsContact O-N 3.15Å; Q48-S51 PolarHBondContact O-N 3.48Å; Q48-S51 VanDerWaalsContact O-N 3.11Å; Q48-S51 PolarHBondContact O-OG 3.49Å; Q48-S51 VanDerWaalsContact O-OG 3.11Å; Q48-V52 WeakPolarHBondContact O-CG2 3.49Å; Q48-V52 PolarHBondContact O-N 3.05Å
49	I	70.2	Confident	75.2	Confident	31 Å²	31	87.7 Å²	87.7	16%	0.159	44%	0.435	C	S	.	.	H	α-helix	trans	-59.3	-22	173.6	-73.2	162.4	0	0	0	112.5	I30 Y41 L44 T45 E47	I30-I49 HydrophobicContact CD1-CG2 3.97Å; Y41-I49 HydrophobicContact CD2-CD1 3.47Å; Y41-I49 VanDerWaalsContact CD2-CD1 3.47Å; Y41-I49 HydrophobicContact CD2-CG1 3.8Å; Y41-I49 HydrophobicContact CD2-CG2 4.35Å; Y41-I49 HydrophobicContact CE2-CD1 4.26Å; Y41-I49 HydrophobicContact CE2-CG1 4.45Å; Y41-I49 HydrophobicContact CE2-CG2 4.18Å; Y41-I49 HydrophobicContact CG-CD1 4.12Å; Y41-I49 HydrophobicContact CG-CG1 4.15Å; L44-I49 HydrophobicContact CB-CD1 4.34Å; L44-I49 HydrophobicContact CB-CG1 3.92Å; T45-I49 WeakPolarHBondContact O-CB 3.47Å; T45-I49 WeakPolarHBondContact O-CD1 3.4Å; T45-I49 VanDerWaalsContact O-CG1 3.22Å; T45-I49 WeakPolarHBondContact O-CG1 3.36Å; T45-I49 PolarHBondContact O-N 3.34Å; E47-I49 VanDerWaalsContact C-N 3.27Å; E47-I49 PolarHBondContact O-N 3.18Å
50	R	68.1	Low	75.5	Confident	207 Å²	207	90 Å²	90	78%	0.781	45%	0.445	S	S	*	.	H	α-helix	trans	-88	-22.2	176.7	-69.7	170.3	170.3	170.3	-3.3	113.8	E47 Q48	E47-R50 WeakPolarHBondContact O-CB 3.5Å; E47-R50 PolarHBondContact O-N 3.47Å; Q48-R50 PolarHBondContact O-N 3.07Å; Q48-R50 VanDerWaalsContact O-N 3.15Å
51	S	67.9	Low	75.7	Confident	91 Å²	91	82.8 Å²	82.8	64%	0.636	42%	0.418	S	S	*	.	H	α-helix	trans	-96.7	-31.6	179	57.4	0	0	0	0	113.2	Q48 R53	Q48-S51 PolarHBondContact O-N 3.48Å; Q48-S51 VanDerWaalsContact O-N 3.11Å; Q48-S51 PolarHBondContact O-OG 3.49Å; Q48-S51 VanDerWaalsContact O-OG 3.11Å; S51-R53 PolarHBondContact O-N 3.35Å
52	V	71.1	Confident	75.9	Confident	45 Å²	45	83.3 Å²	83.3	27%	0.273	42%	0.421	S	S	.	.			trans	-75	120.1	178.5	175.4	0	0	0	0	111.2	Q48 I54 L55	Q48-V52 WeakPolarHBondContact O-CG2 3.49Å; Q48-V52 PolarHBondContact O-N 3.05Å; V52-I54 VanDerWaalsContact CG1-O 3.25Å; V52-I54 WeakPolarHBondContact CG1-O 3.48Å; V52-L55 HydrophobicContact CG1-CD2 3.85Å; V52-L55 HydrophobicContact CG1-CG 4.33Å
53	R	68.9	Low	76.3	Confident	212 Å²	212	78.5 Å²	78.5	80%	0.8	40%	0.403	S	S	*	.			trans	-97.2	-25.6	175.5	-65.9	-173.1	178.8	-169.2	0.6	114.3	S51	S51-R53 PolarHBondContact O-N 3.35Å
54	I	78.8	Confident	76.8	Confident	109 Å²	109	78.4 Å²	78.4	56%	0.559	38%	0.384	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-133.8	132.2	-174.5	-56.8	177.6	0	0	0	108.1	V52	V52-I54 VanDerWaalsContact CG1-O 3.25Å; V52-I54 WeakPolarHBondContact CG1-O 3.48Å
55	L	82.4	Confident	77	Confident	5 Å²	5	77.1 Å²	77.1	3%	0.026	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	145.7	175.7	-67.8	165.2	0	0	0	109.8	G27 C28 Y41 L44 V52 Y59 I61 W85	G27-L55 CarbonylContact C-O 3.53Å; G27-L55 WeakPolarHBondContact CA-O 3.43Å; C28-L55 PolarHBondContact N-O 2.92Å; C28-L55 PolarHBondContact O-N 3.34Å; Y41-L55 HydrophobicContact CD1-CD1 3.71Å; Y41-L55 HydrophobicContact CE1-CD1 3.87Å; L44-L55 HydrophobicContact CD1-CD2 3.68Å; V52-L55 HydrophobicContact CG1-CD2 3.85Å; V52-L55 HydrophobicContact CG1-CG 4.33Å; L55-Y59 HydrophobicContact CB-CD1 4.08Å; L55-Y59 HydrophobicContact CB-CG 4.25Å; L55-Y59 HydrophobicContact CD1-CD1 3.92Å; L55-Y59 HydrophobicContact CD1-CE1 3.97Å; L55-Y59 HydrophobicContact CD2-CD1 4.07Å; L55-Y59 HydrophobicContact CD2-CE1 3.89Å; L55-Y59 HydrophobicContact CD2-CG 4.45Å; L55-Y59 HydrophobicContact CG-CD1 4.24Å; L55-Y59 HydrophobicContact CG-CE1 4.41Å; L55-I61 HydrophobicContact CD1-CG2 4.37Å; L55-W85 HydrophobicContact CB-CH2 4.34Å; L55-W85 HydrophobicContact CD1-CH2 3.8Å; L55-W85 HydrophobicContact CD1-CZ2 3.91Å
56	P	83.3	Confident	77	Confident	79 Å²	79	81.7 Å²	81.7	51%	0.513	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	162	-175.1	26.5	-32.1	0	0	0	112.5	Y59 C79	P56-Y59 HydrophobicContact CG-CD2 4.16Å; P56-Y59 HydrophobicContact CG-CG 4.48Å; P56-Y59 WeakPolarHBondContact O-CB 3.5Å; P56-Y59 PolarHBondContact O-N 3.32Å; P56-C79 VanDerWaalsContact O-CB 3.3Å; P56-C79 WeakPolarHBondContact O-CB 3.39Å; P56-C79 PolarHBondContact O-SG 3.33Å; P56-C79 VanDerWaalsContact O-SG 3.4Å
57	V	80.3	Confident	77.3	Confident	48 Å²	48	82.4 Å²	82.4	29%	0.291	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.2	148.5	168.3	-176.1	0	0	0	0	110.1	G26 Y59 P81	G26-V57 WeakPolarHBondContact O-CG2 3.48Å; V57-Y59 PolarHBondContact O-N 3.16Å; V57-P81 HydrophobicContact CG1-CB 4.36Å; V57-P81 HydrophobicContact CG1-CG 3.86Å
58	D	81.4	Confident	77.1	Confident	95 Å²	95	82.5 Å²	82.5	51%	0.508	40%	0.396	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.8	-1.7	-175.2	-67.9	-57.8	0	0	0	116.2	K78 C79	D58-K78 WeakPolarHBondContact O-CE 3.37Å; D58-K78 WeakPolarHBondContact O-CG 3.35Å; D58-K78 VanDerWaalsContact OD1-CE 3.22Å; D58-K78 WeakPolarHBondContact OD1-CE 3.45Å; D58-K78 IonicContact OD1-NZ 3.54Å; D58-K78 PolarHBondContact OD1-NZ 3.48Å; D58-C79 WeakPolarHBondContact CA-O 3.47Å; D58-C79 PolarHBondContact N-O 3.38Å
59	Y	84.2	Confident	77.2	Confident	39 Å²	39	81.4 Å²	81.4	15%	0.153	39%	0.389	C	S	.	.			trans	-63.6	139.2	175.1	-166.5	-91.8	0	0	0	112.1	Y41 R42 L55 P56 V57 I61 K78 C79 W85	Y41-Y59 WeakPolarHBondContact CB-OH 3.4Å; Y41-Y59 HydrophobicContact CD1-CE1 4.3Å; R42-Y59 PolarHBondContact N-OH 3.12Å; R42-Y59 PolarHBondContact O-OH 3.2Å; L55-Y59 HydrophobicContact CB-CD1 4.08Å; L55-Y59 HydrophobicContact CB-CG 4.25Å; L55-Y59 HydrophobicContact CD1-CD1 3.92Å; L55-Y59 HydrophobicContact CD1-CE1 3.97Å; L55-Y59 HydrophobicContact CD2-CD1 4.07Å; L55-Y59 HydrophobicContact CD2-CE1 3.89Å; L55-Y59 HydrophobicContact CD2-CG 4.45Å; L55-Y59 HydrophobicContact CG-CD1 4.24Å; L55-Y59 HydrophobicContact CG-CE1 4.41Å; P56-Y59 HydrophobicContact CG-CD2 4.16Å; P56-Y59 HydrophobicContact CG-CG 4.48Å; P56-Y59 WeakPolarHBondContact O-CB 3.5Å; P56-Y59 PolarHBondContact O-N 3.32Å; V57-Y59 PolarHBondContact O-N 3.16Å; Y59-I61 HydrophobicContact CD1-CG2 4.19Å; Y59-I61 HydrophobicContact CE1-CG2 4.05Å; Y59-K78 CarbonylContact O-C 3.6Å; Y59-K78 WeakPolarHBondContact O-CA 3.4Å; Y59-C79 PolarHBondContact O-N 2.91Å; Y59-W85 HydrophobicContact CD1-CH2 4.32Å; Y59-W85 WeakPolarHBondContact O-CZ3 3.26Å
60	E	86.4	Confident	77.3	Confident	70 Å²	70	85 Å²	85	33%	0.327	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	137.2	-178.2	-69.7	-176	160.7	0	0	113	R42 V76 R77 K78	R42-E60 IonicContact CZ-OE2 2.81Å; R42-E60 IonicContact NE-OE2 3.89Å; R42-E60 IonicContact NH1-OE2 3.27Å; R42-E60 PolarHBondContact NH1-OE2 3.29Å; E60-V76 HydrophobicContact CB-CG1 4.24Å; E60-V76 HydrophobicContact CG-CG1 4.31Å; E60-R77 WeakPolarHBondContact CA-O 3.21Å; E60-K78 HydrophobicContact CG-CG 4.16Å
61	I	84.3	Confident	77.8	Confident	0 Å²	0	77.1 Å²	77.1	0%	0	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	140.4	168.8	60.8	176.8	0	0	0	110.5	I31 I39 Y41 L55 Y59 V76 R77 W85	I31-I61 HydrophobicContact CB-CD1 4.43Å; I31-I61 HydrophobicContact CD1-CD1 3.54Å; I31-I61 HydrophobicContact CG1-CD1 3.92Å; I39-I61 HydrophobicContact CG2-CB 3.82Å; I39-I61 HydrophobicContact CG2-CD1 4.29Å; I39-I61 HydrophobicContact CG2-CG1 4.45Å; I39-I61 HydrophobicContact CG2-CG2 4.36Å; Y41-I61 HydrophobicContact CD1-CG2 3.48Å; Y41-I61 VanDerWaalsContact CD1-CG2 3.48Å; Y41-I61 HydrophobicContact CE1-CG2 3.66Å; Y41-I61 HydrophobicContact CG-CG2 4.39Å; L55-I61 HydrophobicContact CD1-CG2 4.37Å; Y59-I61 HydrophobicContact CD1-CG2 4.19Å; Y59-I61 HydrophobicContact CE1-CG2 4.05Å; I61-V76 VanDerWaalsContact O-CA 3.3Å; I61-V76 WeakPolarHBondContact O-CA 3.37Å; I61-R77 HydrophobicContact CD1-CB 4.45Å; I61-R77 HydrophobicContact CG1-CB 4.08Å; I61-R77 PolarHBondContact N-O 2.85Å; I61-R77 PolarHBondContact O-N 3.22Å; I61-W85 HydrophobicContact CB-CH2 4.48Å; I61-W85 HydrophobicContact CB-CZ3 4.28Å; I61-W85 HydrophobicContact CD1-CD2 3.93Å; I61-W85 HydrophobicContact CD1-CE3 3.74Å; I61-W85 HydrophobicContact CD1-CH2 3.96Å; I61-W85 HydrophobicContact CD1-CZ2 4.11Å; I61-W85 HydrophobicContact CD1-CZ3 3.76Å; I61-W85 HydrophobicContact CG1-CE3 3.86Å; I61-W85 HydrophobicContact CG1-CH2 4.13Å; I61-W85 HydrophobicContact CG1-CZ3 3.63Å; I61-W85 HydrophobicContact CG2-CH2 3.63Å; I61-W85 HydrophobicContact CG2-CZ2 4.43Å; I61-W85 HydrophobicContact CG2-CZ3 3.85Å
62	E	83.9	Confident	78	Confident	28 Å²	28	74.8 Å²	74.8	13%	0.131	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	118.9	-178.5	-177.4	167.6	-176.4	0	0	109.7	R40 R42 K75 V76	R40-E62 PolarHBondContact N-O 2.99Å; R40-E62 PolarHBondContact O-N 3.02Å; R42-E62 IonicContact CZ-OE2 3.47Å; R42-E62 IonicContact NE-OE2 2.7Å; R42-E62 IonicContact NH2-OE2 3.54Å; R42-E62 PolarHBondContact NH2-OE2 3.06Å; E62-K75 WeakPolarHBondContact OE1-CE 3.49Å; E62-K75 IonicContact OE1-NZ 3.42Å; E62-K75 PolarHBondContact OE1-NZ 3.13Å; E62-V76 HydrophobicContact CB-CG2 4.34Å; E62-V76 HydrophobicContact CG-CG2 4.2Å
63	Y	81.8	Confident	78.2	Confident	18 Å²	18	74.6 Å²	74.6	7%	0.071	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	144.4	171.1	-74.9	-95.1	0	0	0	109.9	P34 I39 I71 K75 R77	P34-Y63 HydrophobicContact CG-CD1 4.3Å; P34-Y63 HydrophobicContact CG-CE1 4.44Å; I39-Y63 HydrophobicContact CD1-CD1 4.24Å; I39-Y63 HydrophobicContact CD1-CE1 3.7Å; I39-Y63 HydrophobicContact CG1-CD1 3.8Å; I39-Y63 HydrophobicContact CG1-CE1 3.8Å; I39-Y63 HydrophobicContact CG1-CG 4.39Å; Y63-I71 VanDerWaalsContact C-CD1 3.49Å; Y63-I71 WeakPolarHBondContact O-CD1 3.33Å; Y63-K75 PolarHBondContact N-O 3.41Å; Y63-R77 HydrophobicContact CE2-CG 4.28Å
64	I	80.6	Confident	78.7	Confident	77 Å²	77	65.4 Å²	65.4	40%	0.395	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	134	178.1	-60.9	-174.8	0	0	0	108.4	G37 G38 R40	G37-I64 CarbonylContact C-O 3.49Å; G37-I64 VanDerWaalsContact CA-O 3.25Å; G37-I64 WeakPolarHBondContact CA-O 3.36Å; G38-I64 PolarHBondContact N-O 3.38Å; G38-I64 PolarHBondContact O-N 2.75Å; R40-I64 HydrophobicContact CB-CD1 3.66Å; R40-I64 HydrophobicContact CB-CG1 4.33Å; R40-I64 HydrophobicContact CG-CD1 4.4Å
65	C	80	Confident	78.9	Confident	22 Å²	22	65.5 Å²	65.5	15%	0.149	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	156.4	171.5	-64.1	0	0	0	0	111.9	R69 I71 C94	C65-R69 HydrophobicContact CB-CB 3.89Å; C65-R69 WeakPolarHBondContact CB-O 3.46Å; C65-I71 WeakPolarHBondContact SG-CG1 3.33Å; C65-C94 WeakPolarHBondContact CA-SG 3.46Å; C65-C94 HydrophobicContact CB-CB 3.79Å; C65-C94 WeakPolarHBondContact CB-SG 3.44Å; C65-C94 WeakPolarHBondContact SG-CA 3.21Å; C65-C94 WeakPolarHBondContact SG-CB 3.44Å; C65-C94 CovalentContact SG-SG 2.03Å; C65-C94 PolarHBondContact SG-SG 3.35Å
66	R	74.6	Confident	79	Confident	165 Å²	165	67.6 Å²	67.6	62%	0.623	35%	0.348	S	S	*	.	S	Bend	trans	-91.3	151.8	169.4	-60.4	179.2	-171.3	-161.8	-1.1	109.6	D36 G37 R69	D36-R66 PolarHBondContact O-N 2.93Å; G37-R66 PolarHBondContact O-NE 3.32Å; G37-R66 VanDerWaalsContact O-NE 3.09Å; G37-R66 PolarHBondContact O-NH2 2.91Å; R66-R69 WeakPolarHBondContact O-CB 3.31Å
67	E	73.2	Confident	79.2	Confident	154 Å²	154	64.3 Å²	64.3	72%	0.72	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.1	-156.9	177.9	-49.8	171.2	157.4	0	0	112.8	R69	E67-R69 PolarHBondContact O-N 3.47Å; E67-R69 IonicContact OE2-NE 3.76Å
68	N	66.3	Low	79.5	Confident	150 Å²	150	65.7 Å²	65.7	80%	0.802	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.1	33.1	-176.5	-61.7	-15.6	0	0	0	113.4
69	R	73.5	Confident	79.8	Confident	65 Å²	65	61.1 Å²	61.1	25%	0.245	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	144.6	-177.8	-60.3	-177.2	-172.5	-152.3	11.8	111.2	D36 C65 R66 E67 C94 L95 L96	D36-R69 IonicContact OD1-CZ 2.67Å; D36-R69 IonicContact OD1-NH1 3.55Å; D36-R69 PolarHBondContact OD1-NH1 3.26Å; D36-R69 IonicContact OD1-NH2 2.77Å; C65-R69 HydrophobicContact CB-CB 3.89Å; C65-R69 WeakPolarHBondContact CB-O 3.46Å; R66-R69 WeakPolarHBondContact O-CB 3.31Å; E67-R69 PolarHBondContact O-N 3.47Å; E67-R69 IonicContact OE2-NE 3.76Å; R69-C94 HydrophobicContact CB-CB 4.24Å; R69-L95 CarbonylContact C-O 3.06Å; R69-L95 VanDerWaalsContact CA-O 3.22Å; R69-L95 WeakPolarHBondContact CA-O 3.21Å; R69-L95 WeakPolarHBondContact CB-O 3.33Å; R69-L96 HydrophobicContact CG-CD2 4.04Å; R69-L96 HydrophobicContact CG-CG 4.11Å
70	Q	72.8	Confident	79.8	Confident	105 Å²	105	62.1 Å²	62.1	49%	0.491	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	157.5	172.6	-75.5	-159.4	-8.9	0	0	112.2	C94 L95	Q70-C94 WeakPolarHBondContact O-CA 3.32Å; Q70-L95 PolarHBondContact N-O 3.1Å; Q70-L95 PolarHBondContact O-N 3.2Å
71	I	77.8	Confident	79.4	Confident	43 Å²	43	63.5 Å²	63.5	22%	0.221	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	120.1	179.7	-62.1	163.9	0	0	0	108.9	Y63 C65 K75 V93	Y63-I71 VanDerWaalsContact C-CD1 3.49Å; Y63-I71 WeakPolarHBondContact O-CD1 3.33Å; C65-I71 WeakPolarHBondContact SG-CG1 3.33Å; I71-K75 HydrophobicContact CD1-CG 3.9Å; I71-V93 WeakPolarHBondContact CA-O 3.45Å
72	A	73.6	Confident	79.3	Confident	42 Å²	42	68.9 Å²	68.9	35%	0.347	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	132.2	157.4	0	0	0	0	0	108.6	S92 V93 L95	A72-S92 CarbonylContact O-C 3.6Å; A72-S92 WeakPolarHBondContact O-CA 3.45Å; A72-V93 PolarHBondContact N-O 3.16Å; A72-V93 PolarHBondContact O-N 3.33Å; A72-L95 HydrophobicContact CB-CD1 3.76Å; A72-L95 HydrophobicContact CB-CG 4.18Å
73	G	74.4	Confident	79	Confident	41 Å²	41	68.8 Å²	68.8	42%	0.423	36%	0.361	S	S	.	.	S	Bend	trans	95.7	-173.2	-175	0	0	0	0	0	114.3	K75	G73-K75 PolarHBondContact O-N 2.85Å
74	P	80.1	Confident	79.1	Confident	18 Å²	18	71 Å²	71	12%	0.117	38%	0.376	C	S	.	.			trans	-60.8	115.5	-173.8	-23.4	32.8	0	0	0	112.7	R77 D87 Q90 S92	P74-R77 HydrophobicContact CB-CG 4.34Å; P74-D87 HydrophobicContact CB-CB 3.93Å; P74-D87 HydrophobicContact CG-CB 3.44Å; P74-D87 VanDerWaalsContact CG-CB 3.44Å; P74-Q90 HydrophobicContact CG-CB 3.95Å; P74-S92 WeakPolarHBondContact O-CB 3.27Å; P74-S92 PolarHBondContact O-OG 3.48Å
75	K	81.5	Confident	79.3	Confident	111 Å²	111	68 Å²	68	48%	0.483	36%	0.36	S	S	.	.	S	Bend	trans	-72.4	-42.3	179.2	-175	-176.3	-173	-136.1	0	112.5	E62 Y63 I71 G73	E62-K75 WeakPolarHBondContact OE1-CE 3.49Å; E62-K75 IonicContact OE1-NZ 3.42Å; E62-K75 PolarHBondContact OE1-NZ 3.13Å; Y63-K75 PolarHBondContact N-O 3.41Å; I71-K75 HydrophobicContact CD1-CG 3.9Å; G73-K75 PolarHBondContact O-N 2.85Å
76	V	85.7	Confident	79.5	Confident	49 Å²	49	68.6 Å²	68.6	30%	0.297	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	142.5	177.3	179.2	0	0	0	0	107.7	E60 I61 E62	E60-V76 HydrophobicContact CB-CG1 4.24Å; E60-V76 HydrophobicContact CG-CG1 4.31Å; I61-V76 VanDerWaalsContact O-CA 3.3Å; I61-V76 WeakPolarHBondContact O-CA 3.37Å; E62-V76 HydrophobicContact CB-CG2 4.34Å; E62-V76 HydrophobicContact CG-CG2 4.2Å
77	R	86.9	Confident	79.7	Confident	10 Å²	10	64.6 Å²	64.6	4%	0.038	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	144.4	168.9	-70	-175.3	175.9	-178.2	-6.7	110.1	E60 I61 Y63 P74 W85 T86 D87 M88 Q90	E60-R77 WeakPolarHBondContact CA-O 3.21Å; I61-R77 HydrophobicContact CD1-CB 4.45Å; I61-R77 HydrophobicContact CG1-CB 4.08Å; I61-R77 PolarHBondContact N-O 2.85Å; I61-R77 PolarHBondContact O-N 3.22Å; Y63-R77 HydrophobicContact CE2-CG 4.28Å; P74-R77 HydrophobicContact CB-CG 4.34Å; R77-W85 HydrophobicContact CB-CB 4.4Å; R77-W85 HydrophobicContact CB-CE3 4.19Å; R77-T86 WeakPolarHBondContact CA-OG1 3.43Å; R77-T86 WeakPolarHBondContact CD-O 3.47Å; R77-T86 WeakPolarHBondContact CG-O 3.26Å; R77-T86 PolarHBondContact NE-O 2.97Å; R77-D87 PolarHBondContact NH2-O 3.44Å; R77-M88 PolarHBondContact NH1-SD 3.43Å; R77-Q90 PolarHBondContact NH2-O 3.3Å
78	K	87.4	Confident	79.8	Confident	77 Å²	77	62.7 Å²	62.7	34%	0.335	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	146.6	179.8	-150.4	-173.1	-163.2	-160.1	0	110.8	D58 Y59 E60 W85 T86	D58-K78 WeakPolarHBondContact O-CE 3.37Å; D58-K78 WeakPolarHBondContact O-CG 3.35Å; D58-K78 VanDerWaalsContact OD1-CE 3.22Å; D58-K78 WeakPolarHBondContact OD1-CE 3.45Å; D58-K78 IonicContact OD1-NZ 3.54Å; D58-K78 PolarHBondContact OD1-NZ 3.48Å; Y59-K78 CarbonylContact O-C 3.6Å; Y59-K78 WeakPolarHBondContact O-CA 3.4Å; E60-K78 HydrophobicContact CG-CG 4.16Å; K78-W85 CarbonylContact O-C 3.55Å; K78-W85 WeakPolarHBondContact O-CA 3.23Å; K78-T86 HydrophobicContact CB-CG2 3.89Å; K78-T86 PolarHBondContact N-OG1 3.47Å; K78-T86 VanDerWaalsContact N-OG1 3.14Å; K78-T86 PolarHBondContact O-N 3.43Å
79	C	87.3	Confident	80.1	Confident	0 Å²	0	62.2 Å²	62.2	0%	0	35%	0.349	C	S	.	.	B	Isolated β-bridge	trans	-78.6	128.5	172.5	179.1	0	0	0	0	111.2	C28 P56 D58 Y59 W85	C28-C79 HydrophobicContact CB-CB 3.8Å; C28-C79 WeakPolarHBondContact CB-SG 3.24Å; C28-C79 PolarHBondContact N-SG 3.14Å; C28-C79 WeakPolarHBondContact SG-CA 3.4Å; C28-C79 WeakPolarHBondContact SG-CB 3.26Å; C28-C79 CovalentContact SG-SG 2.03Å; C28-C79 PolarHBondContact SG-SG 3.03Å; P56-C79 VanDerWaalsContact O-CB 3.3Å; P56-C79 WeakPolarHBondContact O-CB 3.39Å; P56-C79 PolarHBondContact O-SG 3.33Å; P56-C79 VanDerWaalsContact O-SG 3.4Å; D58-C79 WeakPolarHBondContact CA-O 3.47Å; D58-C79 PolarHBondContact N-O 3.38Å; Y59-C79 PolarHBondContact O-N 2.91Å; C79-W85 HydrophobicContact CB-CE3 4.27Å; C79-W85 HydrophobicContact CB-CH2 4.23Å; C79-W85 HydrophobicContact CB-CZ3 3.98Å
80	L	83.4	Confident	80.1	Confident	59 Å²	59	64.7 Å²	64.7	31%	0.309	36%	0.364	S	S	.	.			trans	-95.8	157.4	179.6	-64.8	170.4	0	0	0	112.1	N82 G83 T84 T86	L80-N82 VanDerWaalsContact CB-OD1 3.26Å; L80-N82 WeakPolarHBondContact CB-OD1 3.35Å; L80-N82 PolarHBondContact O-N 3.06Å; L80-G83 PolarHBondContact O-N 2.93Å; L80-T84 VanDerWaalsContact CB-O 3.3Å; L80-T84 WeakPolarHBondContact CB-O 3.41Å; L80-T84 PolarHBondContact N-O 2.81Å; L80-T86 HydrophobicContact CD1-CG2 4.2Å; L80-T86 HydrophobicContact CD2-CG2 3.9Å; L80-T86 HydrophobicContact CG-CG2 3.99Å
81	P	79.6	Confident	80.1	Confident	99 Å²	99	66.4 Å²	66.4	64%	0.643	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-21.4	179	-25	32.9	0	0	0	115.2	V57 G83	V57-P81 HydrophobicContact CG1-CB 4.36Å; V57-P81 HydrophobicContact CG1-CG 3.86Å; P81-G83 VanDerWaalsContact C-N 3.28Å; P81-G83 PolarHBondContact O-N 3.02Å
82	N	80.9	Confident	80.1	Confident	113 Å²	113	64.9 Å²	64.9	60%	0.604	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.6	4.2	177.1	71.8	-9.6	0	0	0	114.2	L80 T84	L80-N82 VanDerWaalsContact CB-OD1 3.26Å; L80-N82 WeakPolarHBondContact CB-OD1 3.35Å; L80-N82 PolarHBondContact O-N 3.06Å; N82-T84 VanDerWaalsContact C-N 3.33Å; N82-T84 VanDerWaalsContact CG-OG1 3.24Å; N82-T84 PolarHBondContact ND2-OG1 2.86Å; N82-T84 PolarHBondContact O-N 2.93Å; N82-T84 PolarHBondContact OD1-N 3.26Å; N82-T84 PolarHBondContact OD1-OG1 3.42Å
83	G	78.9	Confident	80.3	Confident	26 Å²	26	65.8 Å²	65.8	27%	0.268	37%	0.369	S	S	.	.	S	Bend	trans	79.8	5.6	-178.7	0	0	0	0	0	115.5	L80 P81	L80-G83 PolarHBondContact O-N 2.93Å; P81-G83 VanDerWaalsContact C-N 3.28Å; P81-G83 PolarHBondContact O-N 3.02Å
84	T	83.3	Confident	80.5	Confident	65 Å²	65	64.5 Å²	64.5	40%	0.399	35%	0.354	S	S	.	.	P	Polyproline II helix	trans	-103.6	158.8	175	69	0	0	0	0	112.2	C28 L80 N82	C28-T84 PolarHBondContact SG-O 2.94Å; L80-T84 VanDerWaalsContact CB-O 3.3Å; L80-T84 WeakPolarHBondContact CB-O 3.41Å; L80-T84 PolarHBondContact N-O 2.81Å; N82-T84 VanDerWaalsContact C-N 3.33Å; N82-T84 VanDerWaalsContact CG-OG1 3.24Å; N82-T84 PolarHBondContact ND2-OG1 2.86Å; N82-T84 PolarHBondContact O-N 2.93Å; N82-T84 PolarHBondContact OD1-N 3.26Å; N82-T84 PolarHBondContact OD1-OG1 3.42Å
85	W	84.9	Confident	80.4	Confident	15 Å²	15	65.3 Å²	65.3	6%	0.057	36%	0.357	C	S	.	.	B	Isolated β-bridge	trans	-85	152.8	172.9	-63	92.3	0	0	0	111.3	C28 A29 I31 L55 Y59 I61 R77 K78 C79 M88	C28-W85 HydrophobicContact CB-CD2 4.11Å; C28-W85 VanDerWaalsContact CB-CE2 3.48Å; C28-W85 HydrophobicContact CB-CH2 4.32Å; C28-W85 HydrophobicContact CB-CZ2 3.6Å; A29-W85 PolarHBondContact O-NE1 3.43Å; I31-W85 HydrophobicContact CD1-CB 4.44Å; I31-W85 HydrophobicContact CD1-CD2 4.13Å; I31-W85 HydrophobicContact CD1-CG 3.8Å; I31-W85 HydrophobicContact CG1-CD2 4.45Å; I31-W85 HydrophobicContact CG1-CG 4.32Å; L55-W85 HydrophobicContact CB-CH2 4.34Å; L55-W85 HydrophobicContact CD1-CH2 3.8Å; L55-W85 HydrophobicContact CD1-CZ2 3.91Å; Y59-W85 HydrophobicContact CD1-CH2 4.32Å; Y59-W85 WeakPolarHBondContact O-CZ3 3.26Å; I61-W85 HydrophobicContact CB-CH2 4.48Å; I61-W85 HydrophobicContact CB-CZ3 4.28Å; I61-W85 HydrophobicContact CD1-CD2 3.93Å; I61-W85 HydrophobicContact CD1-CE3 3.74Å; I61-W85 HydrophobicContact CD1-CH2 3.96Å; I61-W85 HydrophobicContact CD1-CZ2 4.11Å; I61-W85 HydrophobicContact CD1-CZ3 3.76Å; I61-W85 HydrophobicContact CG1-CE3 3.86Å; I61-W85 HydrophobicContact CG1-CH2 4.13Å; I61-W85 HydrophobicContact CG1-CZ3 3.63Å; I61-W85 HydrophobicContact CG2-CH2 3.63Å; I61-W85 HydrophobicContact CG2-CZ2 4.43Å; I61-W85 HydrophobicContact CG2-CZ3 3.85Å; R77-W85 HydrophobicContact CB-CB 4.4Å; R77-W85 HydrophobicContact CB-CE3 4.19Å; K78-W85 CarbonylContact O-C 3.55Å; K78-W85 WeakPolarHBondContact O-CA 3.23Å; C79-W85 HydrophobicContact CB-CE3 4.27Å; C79-W85 HydrophobicContact CB-CH2 4.23Å; C79-W85 HydrophobicContact CB-CZ3 3.98Å; W85-M88 HydrophobicContact CB-CG 3.99Å; W85-M88 HydrophobicContact CB-SD 4.05Å; W85-M88 WeakPolarHBondContact O-CG 3.39Å
86	T	83.8	Confident	80.2	Confident	33 Å²	33	62.1 Å²	62.1	20%	0.202	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59	152.7	168.4	65.3	0	0	0	0	111.3	R77 K78 L80 M88	R77-T86 WeakPolarHBondContact CA-OG1 3.43Å; R77-T86 WeakPolarHBondContact CD-O 3.47Å; R77-T86 WeakPolarHBondContact CG-O 3.26Å; R77-T86 PolarHBondContact NE-O 2.97Å; K78-T86 HydrophobicContact CB-CG2 3.89Å; K78-T86 PolarHBondContact N-OG1 3.47Å; K78-T86 VanDerWaalsContact N-OG1 3.14Å; K78-T86 PolarHBondContact O-N 3.43Å; L80-T86 HydrophobicContact CD1-CG2 4.2Å; L80-T86 HydrophobicContact CD2-CG2 3.9Å; L80-T86 HydrophobicContact CG-CG2 3.99Å; T86-M88 PolarHBondContact O-N 3Å
87	D	78.9	Confident	79.9	Confident	82 Å²	82	62.2 Å²	62.2	44%	0.439	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.6	25.8	166.7	-40.6	-62.2	0	0	0	115.3	P74 R77 T89 Q90	P74-D87 HydrophobicContact CB-CB 3.93Å; P74-D87 HydrophobicContact CG-CB 3.44Å; P74-D87 VanDerWaalsContact CG-CB 3.44Å; R77-D87 PolarHBondContact NH2-O 3.44Å; D87-T89 PolarHBondContact O-N 3.43Å; D87-Q90 PolarHBondContact O-N 2.85Å
88	M	74.4	Confident	79.8	Confident	113 Å²	113	62 Å²	62	56%	0.557	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	-22.1	178	-80	-73.2	-65.5	0	0	113.9	R77 W85 T86	R77-M88 PolarHBondContact NH1-SD 3.43Å; W85-M88 HydrophobicContact CB-CG 3.99Å; W85-M88 HydrophobicContact CB-SD 4.05Å; W85-M88 WeakPolarHBondContact O-CG 3.39Å; T86-M88 PolarHBondContact O-N 3Å
89	T	72.6	Confident	79.5	Confident	140 Å²	140	61.2 Å²	61.2	86%	0.859	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.5	-19.9	176.2	49.5	0	0	0	0	114.1	D87	D87-T89 PolarHBondContact O-N 3.43Å
90	Q	73.7	Confident	79.2	Confident	118 Å²	118	67.6 Å²	67.6	55%	0.551	37%	0.373	S	S	*	.	S	Bend	trans	-110.8	116.3	178.2	-65.6	-172.7	5.5	0	0	110.6	P74 R77 D87	P74-Q90 HydrophobicContact CG-CB 3.95Å; R77-Q90 PolarHBondContact NH2-O 3.3Å; D87-Q90 PolarHBondContact O-N 2.85Å
91	L	73.1	Confident	79.1	Confident	141 Å²	141	69.3 Å²	69.3	74%	0.738	39%	0.385	S	S	*	.			trans	-75.8	126.4	-178.4	-159	76.8	0	0	0	111.3	V93	L91-V93 HydrophobicContact CB-CG2 4.34Å; L91-V93 HydrophobicContact CD2-CG2 3.9Å; L91-V93 HydrophobicContact CG-CG2 4.12Å
92	S	77.6	Confident	79.3	Confident	11 Å²	11	67.6 Å²	67.6	8%	0.077	37%	0.366	C	S	.	.			trans	-83.2	115.6	176	-47.1	0	0	0	0	110.7	A72 P74	A72-S92 CarbonylContact O-C 3.6Å; A72-S92 WeakPolarHBondContact O-CA 3.45Å; P74-S92 WeakPolarHBondContact O-CB 3.27Å; P74-S92 PolarHBondContact O-OG 3.48Å
93	V	77.6	Confident	79.3	Confident	60 Å²	60	65.1 Å²	65.1	36%	0.364	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	144.6	-170.6	-175.1	0	0	0	0	111.7	I71 A72 L91 L95	I71-V93 WeakPolarHBondContact CA-O 3.45Å; A72-V93 PolarHBondContact N-O 3.16Å; A72-V93 PolarHBondContact O-N 3.33Å; L91-V93 HydrophobicContact CB-CG2 4.34Å; L91-V93 HydrophobicContact CD2-CG2 3.9Å; L91-V93 HydrophobicContact CG-CG2 4.12Å; V93-L95 HydrophobicContact CG1-CD2 3.88Å
94	C	78.6	Confident	79.3	Confident	14 Å²	14	65.7 Å²	65.7	10%	0.095	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	100.9	-177.4	-71.5	0	0	0	0	112.9	D36 C65 R69 Q70	D36-C94 HydrophobicContact CB-CB 4.11Å; C65-C94 WeakPolarHBondContact CA-SG 3.46Å; C65-C94 HydrophobicContact CB-CB 3.79Å; C65-C94 WeakPolarHBondContact CB-SG 3.44Å; C65-C94 WeakPolarHBondContact SG-CA 3.21Å; C65-C94 WeakPolarHBondContact SG-CB 3.44Å; C65-C94 CovalentContact SG-SG 2.03Å; C65-C94 PolarHBondContact SG-SG 3.35Å; R69-C94 HydrophobicContact CB-CB 4.24Å; Q70-C94 WeakPolarHBondContact O-CA 3.32Å
95	L	77.5	Confident	79.3	Confident	35 Å²	35	62.7 Å²	62.7	18%	0.183	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	147.2	-176.9	-54.4	-176	0	0	0	112.3	R69 Q70 A72 V93 A119 E120	R69-L95 CarbonylContact C-O 3.06Å; R69-L95 VanDerWaalsContact CA-O 3.22Å; R69-L95 WeakPolarHBondContact CA-O 3.21Å; R69-L95 WeakPolarHBondContact CB-O 3.33Å; Q70-L95 PolarHBondContact N-O 3.1Å; Q70-L95 PolarHBondContact O-N 3.2Å; A72-L95 HydrophobicContact CB-CD1 3.76Å; A72-L95 HydrophobicContact CB-CG 4.18Å; V93-L95 HydrophobicContact CG1-CD2 3.88Å; L95-A119 HydrophobicContact CB-CB 4.08Å; L95-A119 HydrophobicContact CD1-CB 4.15Å; L95-E120 HydrophobicContact CB-CB 4.26Å; L95-E120 HydrophobicContact CD1-CB 4.49Å; L95-E120 HydrophobicContact CD2-CB 4.28Å
96	L	78.3	Confident	78.7	Confident	45 Å²	45	67.7 Å²	67.7	24%	0.236	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	144.2	168.3	-80.5	159.9	0	0	0	110.7	R69 A119 E120 K144	R69-L96 HydrophobicContact CG-CD2 4.04Å; R69-L96 HydrophobicContact CG-CG 4.11Å; L96-A119 CarbonylContact O-C 3.56Å; L96-A119 VanDerWaalsContact O-CA 3.31Å; L96-A119 WeakPolarHBondContact O-CA 3.48Å; L96-E120 PolarHBondContact O-N 3.16Å; L96-K144 VanDerWaalsContact CD1-O 3.3Å; L96-K144 WeakPolarHBondContact CD1-O 3.41Å
97	Q	79.4	Confident	78.2	Confident	51 Å²	51	69.4 Å²	69.4	24%	0.238	37%	0.368	C	S	.	.	B	Isolated β-bridge	trans	-92.2	148.8	173.5	-71.3	-165.4	-12.4	0	0	112.3	P118 G146	Q97-P118 CarbonylContact C-O 3.38Å; Q97-P118 VanDerWaalsContact CA-O 3.23Å; Q97-P118 WeakPolarHBondContact CA-O 3.44Å; Q97-P118 WeakPolarHBondContact CB-O 3.17Å; Q97-G146 VanDerWaalsContact O-CA 3.24Å; Q97-G146 WeakPolarHBondContact O-CA 3.37Å
98	C	84.6	Confident	78.3	Confident	5 Å²	5	66 Å²	66	3%	0.034	35%	0.353	C	S	.	.	P	Polyproline II helix	trans	-97.5	156.9	169	-69.5	0	0	0	0	111.9	K100 P118 C142 K147 W148	C98-K100 PolarHBondContact O-N 2.85Å; C98-P118 PolarHBondContact N-O 2.74Å; C98-C142 HydrophobicContact CB-CB 3.87Å; C98-C142 WeakPolarHBondContact CB-SG 3.49Å; C98-C142 WeakPolarHBondContact SG-CA 3.31Å; C98-C142 WeakPolarHBondContact SG-CB 3.49Å; C98-C142 CovalentContact SG-SG 2.02Å; C98-C142 PolarHBondContact SG-SG 3.13Å; C98-K147 PolarHBondContact SG-N 3.43Å; C98-K147 PolarHBondContact SG-O 3.28Å; C98-W148 HydrophobicContact CB-CD2 3.92Å; C98-W148 HydrophobicContact CB-CG 4.32Å; C98-W148 HydrophobicContact CB-CH2 4.24Å; C98-W148 HydrophobicContact CB-CZ2 3.59Å
99	P	81.8	Confident	78.6	Confident	61 Å²	61	67.8 Å²	67.8	40%	0.396	35%	0.354	S	S	.	.	P	Polyproline II helix	trans	-57	124	-178	-27.6	35.4	0	0	0	113.6	V101 W102 W148	P99-V101 PolarHBondContact O-N 3.14Å; P99-V101 VanDerWaalsContact O-N 3.12Å; P99-W102 HydrophobicContact CB-CE3 4.12Å; P99-W102 HydrophobicContact CB-CZ3 4.24Å; P99-W102 PolarHBondContact O-N 3.22Å; P99-W148 PolarHBondContact O-NE1 3.45Å
100	K	81.1	Confident	79.3	Confident	134 Å²	134	62.7 Å²	62.7	58%	0.583	32%	0.322	S	S	*	.	G	3₁₀ helix	trans	-63.7	-15.3	-178.7	-64.4	-176.3	180	-178.5	0	114.7	C98 W102 T103 P118	C98-K100 PolarHBondContact O-N 2.85Å; K100-W102 PolarHBondContact O-N 3.23Å; K100-T103 PolarHBondContact O-N 3.4Å; K100-T103 PolarHBondContact O-OG1 2.81Å; K100-P118 HydrophobicContact CG-CG 4.11Å
101	V	79.7	Confident	79.9	Confident	94 Å²	94	60.7 Å²	60.7	57%	0.57	32%	0.318	S	S	*	.	G	3₁₀ helix	trans	-58.5	-22	177.9	170.4	0	0	0	0	112.9	P99 K152	P99-V101 PolarHBondContact O-N 3.14Å; P99-V101 VanDerWaalsContact O-N 3.12Å; V101-K152 HydrophobicContact CG1-CD 4.41Å; V101-K152 WeakPolarHBondContact O-CD 3.2Å; V101-K152 PolarHBondContact O-NZ 2.85Å
102	W	83.8	Confident	80.4	Confident	63 Å²	63	55.5 Å²	55.5	24%	0.239	30%	0.295	C	S	.	.	G	3₁₀ helix	trans	-83.9	-16.2	175.7	-81.3	-123.2	0	0	0	113.3	P99 K100 S104 L124 Y126 W148 A150 K152	P99-W102 HydrophobicContact CB-CE3 4.12Å; P99-W102 HydrophobicContact CB-CZ3 4.24Å; P99-W102 PolarHBondContact O-N 3.22Å; K100-W102 PolarHBondContact O-N 3.23Å; W102-S104 PolarHBondContact O-N 2.98Å; W102-S104 VanDerWaalsContact O-N 3.16Å; W102-L124 HydrophobicContact CB-CD1 3.9Å; W102-L124 WeakPolarHBondContact O-CD1 3.12Å; W102-Y126 WeakPolarHBondContact O-CE1 3.42Å; W102-Y126 PolarHBondContact O-OH 3.3Å; W102-W148 HydrophobicContact CB-CD2 4.23Å; W102-W148 HydrophobicContact CB-CG 4.28Å; W102-W148 HydrophobicContact CB-CZ2 4.23Å; W102-W148 AromaticContact CD1-CD1 3.48Å; W102-W148 VanDerWaalsContact CD1-CD1 3.48Å; W102-W148 AromaticContact CD1-CG 3.51Å; W102-W148 AromaticContact CD2-CD1 3.38Å; W102-W148 HydrophobicContact CD2-CG 4.16Å; W102-W148 AromaticContact CD2-NE1 3.85Å; W102-W148 AromaticContact CE2-CD1 3.75Å; W102-W148 AromaticContact CE3-CD1 3.93Å; W102-W148 HydrophobicContact CG-CB 4.49Å; W102-W148 AromaticContact CG-CD1 3.26Å; W102-W148 HydrophobicContact CG-CD2 4.2Å; W102-W148 AromaticContact CG-CG 3.76Å; W102-W148 HydrophobicContact CG-CG 3.76Å; W102-W148 AromaticContact CG-NE1 3.46Å; W102-W148 AromaticContact NE1-CD1 3.73Å; W102-W148 AromaticContact NE1-CG 3.78Å; W102-A150 PolarHBondContact NE1-O 2.88Å; W102-K152 HydrophobicContact CD2-CB 4.11Å; W102-K152 HydrophobicContact CG-CB 4.26Å; W102-K152 HydrophobicContact CZ2-CB 4.27Å
103	T	82.2	Confident	80.7	Confident	61 Å²	61	62.8 Å²	62.8	37%	0.374	32%	0.321	S	S	.	.	G	3₁₀ helix	trans	-80.9	13.6	178.6	65.9	0	0	0	0	113.3	K100 P118 L124	K100-T103 PolarHBondContact O-N 3.4Å; K100-T103 PolarHBondContact O-OG1 2.81Å; T103-P118 HydrophobicContact CG2-CB 4.12Å; T103-P118 HydrophobicContact CG2-CG 3.86Å; T103-L124 HydrophobicContact CG2-CD1 3.96Å; T103-L124 HydrophobicContact CG2-CD2 4.09Å
104	S	78.9	Confident	80.5	Confident	38 Å²	38	64 Å²	64	27%	0.266	33%	0.331	S	S	.	.			trans	-131.3	156.8	172	94.3	0	0	0	0	108.5	W102 V110 K152 E233	W102-S104 PolarHBondContact O-N 2.98Å; W102-S104 VanDerWaalsContact O-N 3.16Å; S104-V110 VanDerWaalsContact C-CG2 3.44Å; S104-K152 WeakPolarHBondContact O-CE 3.18Å; S104-K152 PolarHBondContact O-NZ 3.2Å; S104-K152 PolarHBondContact OG-NZ 2.97Å; S104-E233 WeakPolarHBondContact CA-OE2 3.43Å; S104-E233 VanDerWaalsContact CB-CD 3.41Å; S104-E233 VanDerWaalsContact CB-OE1 3.25Å; S104-E233 WeakPolarHBondContact CB-OE1 3.45Å; S104-E233 WeakPolarHBondContact CB-OE2 3.36Å; S104-E233 VanDerWaalsContact OG-CD 3.25Å; S104-E233 PolarHBondContact OG-OE1 2.87Å; S104-E233 PolarHBondContact OG-OE2 2.94Å
105	L	82.1	Confident	80.1	Confident	2 Å²	2	69.1 Å²	69.1	1%	0.01	36%	0.364	C	S	.	.			trans	-147.7	107.3	175.1	175.1	63.6	0	0	0	109.3	N107 G108 V110 Y126 L134 P153 E233	L105-N107 PolarHBondContact O-N 3.49Å; L105-G108 CarbonylContact O-C 3.55Å; L105-G108 WeakPolarHBondContact O-CA 3.48Å; L105-G108 PolarHBondContact O-N 3.21Å; L105-V110 HydrophobicContact CB-CG2 3.58Å; L105-Y126 HydrophobicContact CB-CD1 4.26Å; L105-Y126 HydrophobicContact CD2-CD1 4.06Å; L105-Y126 HydrophobicContact CD2-CG 4.49Å; L105-L134 HydrophobicContact CD1-CD1 4.43Å; L105-L134 HydrophobicContact CD2-CD1 3.82Å; L105-P153 HydrophobicContact CD1-CG 4.29Å; L105-P153 VanDerWaalsContact CD1-O 3.23Å; L105-P153 WeakPolarHBondContact CD1-O 3.26Å; L105-E233 WeakPolarHBondContact CA-OE2 3.3Å; L105-E233 PolarHBondContact N-OE2 3.01Å
106	E	73.1	Confident	79.8	Confident	120 Å²	120	69.9 Å²	69.9	56%	0.561	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.2	132.9	175	-173.5	173	-164	0	0	110.7	G108 C155 E233	E106-G108 PolarHBondContact O-N 3.47Å; E106-C155 WeakPolarHBondContact O-CB 3.27Å; E106-E233 PolarHBondContact N-OE1 3.35Å
107	N	73	Confident	79.5	Confident	69 Å²	69	71 Å²	71	37%	0.369	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.9	25.1	-171	-59.1	-51.7	0	0	0	115.3	L105 N129 F132 C155	L105-N107 PolarHBondContact O-N 3.49Å; N107-N129 VanDerWaalsContact C-ND2 3.31Å; N107-N129 WeakPolarHBondContact O-CB 3.47Å; N107-N129 PolarHBondContact O-N 3.18Å; N107-N129 PolarHBondContact O-ND2 3.48Å; N107-F132 HydrophobicContact CB-CD1 3.53Å; N107-F132 HydrophobicContact CB-CD2 4.04Å; N107-F132 HydrophobicContact CB-CE1 3.5Å; N107-F132 HydrophobicContact CB-CE2 4.02Å; N107-F132 HydrophobicContact CB-CG 3.81Å; N107-F132 HydrophobicContact CB-CZ 3.76Å; N107-F132 VanDerWaalsContact CG-CZ 3.44Å; N107-F132 WeakPolarHBondContact ND2-CE1 3.24Å; N107-C155 HydrophobicContact CB-CB 3.88Å
108	G	80.8	Confident	79.5	Confident	11 Å²	11	68.8 Å²	68.8	11%	0.113	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	-155	174.1	0	0	0	0	0	114.5	L105 E106 T127 N129	L105-G108 CarbonylContact O-C 3.55Å; L105-G108 WeakPolarHBondContact O-CA 3.48Å; L105-G108 PolarHBondContact O-N 3.21Å; E106-G108 PolarHBondContact O-N 3.47Å; G108-T127 CarbonylContact C-O 3.54Å; G108-T127 VanDerWaalsContact CA-O 3.26Å; G108-T127 WeakPolarHBondContact CA-O 3.28Å; G108-N129 WeakPolarHBondContact CA-ND2 3.38Å; G108-N129 PolarHBondContact N-ND2 2.95Å; G108-N129 PolarHBondContact O-ND2 3.3Å
109	R	81.9	Confident	79.4	Confident	151 Å²	151	69.4 Å²	69.4	57%	0.57	39%	0.385	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-144	152	176.2	-58.9	-174.4	-174.8	-137.8	-4.1	109.3	T127 N129	R109-T127 PolarHBondContact N-O 3.01Å; R109-T127 PolarHBondContact O-N 3.22Å; R109-N129 PolarHBondContact NE-OD1 3.34Å
110	V	85.9	Confident	79.4	Confident	33 Å²	33	69.3 Å²	69.3	20%	0.2	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	135	175.1	-168.4	0	0	0	0	109.3	S104 L105 L124 H125 Y126	S104-V110 VanDerWaalsContact C-CG2 3.44Å; L105-V110 HydrophobicContact CB-CG2 3.58Å; V110-L124 HydrophobicContact CG1-CB 3.81Å; V110-L124 HydrophobicContact CG1-CD1 4.23Å; V110-L124 HydrophobicContact CG1-CD2 4.06Å; V110-L124 HydrophobicContact CG1-CG 4.24Å; V110-H125 CarbonylContact C-O 3.58Å; V110-H125 WeakPolarHBondContact CA-O 3.28Å; V110-Y126 HydrophobicContact CG1-CD1 4.17Å; V110-Y126 HydrophobicContact CG1-CE1 4.04Å; V110-Y126 HydrophobicContact CG2-CD1 3.72Å; V110-Y126 HydrophobicContact CG2-CE1 3.89Å
111	T	85.9	Confident	79.5	Confident	75 Å²	75	65.3 Å²	65.3	46%	0.46	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	125.3	172.6	59.4	0	0	0	0	110.8	L124 H125	T111-L124 WeakPolarHBondContact O-CA 3.32Å; T111-H125 PolarHBondContact N-O 2.9Å; T111-H125 PolarHBondContact O-N 3.48Å
112	A	84.8	Confident	79.8	Confident	32 Å²	32	61.2 Å²	61.2	26%	0.264	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	135.3	-178.4	0	0	0	0	0	111.8	P114 T122 V123 L124	A112-P114 CarbonylContact C-O 3.49Å; A112-P114 CarbonylContact O-C 3.58Å; A112-T122 HydrophobicContact CB-CG2 4.27Å; A112-V123 CarbonylContact C-O 3.53Å; A112-V123 WeakPolarHBondContact CA-O 3.27Å; A112-L124 HydrophobicContact CB-CD2 3.64Å
113	R	82.9	Confident	80	Confident	164 Å²	164	59.5 Å²	59.5	62%	0.619	35%	0.347	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-130.2	119.8	176.4	-63.1	-173.4	-179.5	-132.9	-0.9	109.8	T122 V123	R113-T122 WeakPolarHBondContact O-CA 3.37Å; R113-V123 PolarHBondContact N-O 2.98Å; R113-V123 PolarHBondContact O-N 2.95Å
114	P	73.4	Confident	80.4	Confident	87 Å²	87	56.6 Å²	56.6	57%	0.565	33%	0.33	S	S	*	.	S	Bend	cis	-63.1	159.8	-12.1	30.1	-36.2	0	0	0	112.1	A112	A112-P114 CarbonylContact C-O 3.49Å; A112-P114 CarbonylContact O-C 3.58Å
115	P	71	Confident	80.9	Confident	121 Å²	121	57.6 Å²	57.6	79%	0.786	33%	0.33	S	S	*	.	S	Bend	trans	-65.2	133.3	173.7	-18.7	32.3	0	0	0	111.3
116	G	70.3	Confident	81.2	Confident	50 Å²	50	57.8 Å²	57.8	52%	0.515	33%	0.331	S	S	.	.	S	Bend	trans	151.6	-171.6	-179.3	0	0	0	0	0	112.7
117	P	72.4	Confident	81.9	Confident	69 Å²	69	55.9 Å²	55.9	45%	0.448	33%	0.328	S	S	.	.	S	Bend	trans	-64.1	142.1	170.4	28.8	-34.3	0	0	0	110.6	A119	P117-A119 PolarHBondContact O-N 2.99Å; P117-A119 VanDerWaalsContact O-N 3.1Å
118	P	81.1	Confident	82.4	Confident	5 Å²	5	54 Å²	54	3%	0.032	32%	0.32	C	S	.	.			trans	-68.6	110.1	-176.1	27.3	-34.9	0	0	0	111.3	Q97 C98 K100 T103 W148	Q97-P118 CarbonylContact C-O 3.38Å; Q97-P118 VanDerWaalsContact CA-O 3.23Å; Q97-P118 WeakPolarHBondContact CA-O 3.44Å; Q97-P118 WeakPolarHBondContact CB-O 3.17Å; C98-P118 PolarHBondContact N-O 2.74Å; K100-P118 HydrophobicContact CG-CG 4.11Å; T103-P118 HydrophobicContact CG2-CB 4.12Å; T103-P118 HydrophobicContact CG2-CG 3.86Å; P118-W148 HydrophobicContact CB-CH2 3.69Å; P118-W148 HydrophobicContact CB-CZ2 3.5Å; P118-W148 VanDerWaalsContact CB-CZ2 3.5Å; P118-W148 HydrophobicContact CG-CZ2 4.3Å
119	A	82.4	Confident	82.1	Confident	17 Å²	17	55.4 Å²	55.4	14%	0.14	32%	0.324	C	S	.	.	B	Isolated β-bridge	trans	-127.7	171.5	-179.6	0	0	0	0	0	110.8	L95 L96 P117 G121 T122 C142	L95-A119 HydrophobicContact CB-CB 4.08Å; L95-A119 HydrophobicContact CD1-CB 4.15Å; L96-A119 CarbonylContact O-C 3.56Å; L96-A119 VanDerWaalsContact O-CA 3.31Å; L96-A119 WeakPolarHBondContact O-CA 3.48Å; P117-A119 PolarHBondContact O-N 2.99Å; P117-A119 VanDerWaalsContact O-N 3.1Å; A119-G121 PolarHBondContact O-N 3.01Å; A119-G121 VanDerWaalsContact O-N 3.14Å; A119-T122 PolarHBondContact N-OG1 3.39Å; A119-T122 VanDerWaalsContact O-CB 3.28Å; A119-T122 WeakPolarHBondContact O-CB 3.49Å; A119-T122 PolarHBondContact O-N 3.44Å; A119-T122 PolarHBondContact O-OG1 2.84Å; A119-T122 VanDerWaalsContact O-OG1 3.05Å; A119-C142 WeakPolarHBondContact O-CB 3.46Å; A119-C142 PolarHBondContact O-SG 3.19Å
120	E	81.5	Confident	81.5	Confident	60 Å²	60	52.5 Å²	52.5	28%	0.28	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-43.8	121	176.6	-179	-176.5	146.9	0	0	112.1	L95 L96 K144	L95-E120 HydrophobicContact CB-CB 4.26Å; L95-E120 HydrophobicContact CD1-CB 4.49Å; L95-E120 HydrophobicContact CD2-CB 4.28Å; L96-E120 PolarHBondContact O-N 3.16Å; E120-K144 HydrophobicContact CG-CB 4.44Å; E120-K144 HydrophobicContact CG-CG 4.08Å; E120-K144 WeakPolarHBondContact OE1-CG 3.45Å; E120-K144 IonicContact OE1-NZ 3.52Å; E120-K144 PolarHBondContact OE1-NZ 3.27Å
121	G	81.6	Confident	80.7	Confident	50 Å²	50	51.4 Å²	51.4	52%	0.515	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	91.1	-9.3	-177.4	0	0	0	0	0	115.8	A119 V123 C142	A119-G121 PolarHBondContact O-N 3.01Å; A119-G121 VanDerWaalsContact O-N 3.14Å; G121-V123 PolarHBondContact O-N 3.29Å; G121-C142 PolarHBondContact N-O 3.49Å
122	T	86.3	Confident	80.2	Confident	7 Å²	7	50.3 Å²	50.3	4%	0.043	31%	0.311	C	S	.	.			trans	-62.4	129.4	169.4	-59.6	0	0	0	0	110.4	A112 R113 A119 L124 C142 W148	A112-T122 HydrophobicContact CB-CG2 4.27Å; R113-T122 WeakPolarHBondContact O-CA 3.37Å; A119-T122 PolarHBondContact N-OG1 3.39Å; A119-T122 VanDerWaalsContact O-CB 3.28Å; A119-T122 WeakPolarHBondContact O-CB 3.49Å; A119-T122 PolarHBondContact O-N 3.44Å; A119-T122 PolarHBondContact O-OG1 2.84Å; A119-T122 VanDerWaalsContact O-OG1 3.05Å; T122-L124 HydrophobicContact CG2-CD2 4.11Å; T122-C142 PolarHBondContact O-N 3.24Å; T122-W148 HydrophobicContact CG2-CH2 4.41Å
123	V	89.7	Confident	80	Confident	27 Å²	27	52.5 Å²	52.5	16%	0.164	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	129.9	172.2	-170.5	0	0	0	0	108.6	A112 R113 G121 I139 H141	A112-V123 CarbonylContact C-O 3.53Å; A112-V123 WeakPolarHBondContact CA-O 3.27Å; R113-V123 PolarHBondContact N-O 2.98Å; R113-V123 PolarHBondContact O-N 2.95Å; G121-V123 PolarHBondContact O-N 3.29Å; V123-I139 HydrophobicContact CG1-CG2 3.5Å; V123-I139 VanDerWaalsContact CG1-CG2 3.5Å; V123-H141 WeakPolarHBondContact CG2-ND1 3.47Å
124	L	89.3	Confident	80.2	Confident	1 Å²	1	47.3 Å²	47.3	1%	0.005	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	129.6	170.6	-58.7	-178.6	0	0	0	109.1	W102 T103 V110 T111 A112 T122 Y126 I139 S140 W148	W102-L124 HydrophobicContact CB-CD1 3.9Å; W102-L124 WeakPolarHBondContact O-CD1 3.12Å; T103-L124 HydrophobicContact CG2-CD1 3.96Å; T103-L124 HydrophobicContact CG2-CD2 4.09Å; V110-L124 HydrophobicContact CG1-CB 3.81Å; V110-L124 HydrophobicContact CG1-CD1 4.23Å; V110-L124 HydrophobicContact CG1-CD2 4.06Å; V110-L124 HydrophobicContact CG1-CG 4.24Å; T111-L124 WeakPolarHBondContact O-CA 3.32Å; A112-L124 HydrophobicContact CB-CD2 3.64Å; T122-L124 HydrophobicContact CG2-CD2 4.11Å; L124-Y126 HydrophobicContact CB-CE2 4.04Å; L124-Y126 WeakPolarHBondContact CD1-OH 3.34Å; L124-I139 VanDerWaalsContact O-CA 3.27Å; L124-I139 WeakPolarHBondContact O-CA 3.47Å; L124-S140 PolarHBondContact N-O 2.77Å; L124-S140 PolarHBondContact O-N 3.46Å; L124-W148 HydrophobicContact CD1-CE3 4.35Å; L124-W148 HydrophobicContact CD1-CH2 3.31Å; L124-W148 HydrophobicContact CD1-CZ2 3.51Å; L124-W148 HydrophobicContact CD1-CZ3 3.75Å; L124-W148 HydrophobicContact CD2-CH2 4.12Å; L124-W148 HydrophobicContact CG-CH2 3.44Å; L124-W148 VanDerWaalsContact CG-CH2 3.44Å; L124-W148 HydrophobicContact CG-CZ2 4.17Å; L124-W148 HydrophobicContact CG-CZ3 3.68Å
125	H	89.9	Confident	80.9	Confident	58 Å²	58	48.6 Å²	48.6	27%	0.269	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	130.7	168.7	-59.1	-96.5	0	0	0	109.7	V110 T111 N138	V110-H125 CarbonylContact C-O 3.58Å; V110-H125 WeakPolarHBondContact CA-O 3.28Å; T111-H125 PolarHBondContact N-O 2.9Å; T111-H125 PolarHBondContact O-N 3.48Å; H125-N138 WeakPolarHBondContact CA-O 3.1Å
126	Y	88.8	Confident	81.6	Confident	6 Å²	6	45.6 Å²	45.6	2%	0.024	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	131.9	-176.1	-60.8	-85.6	0	0	0	110.7	W102 L105 V110 L124 N138 S140 P153	W102-Y126 WeakPolarHBondContact O-CE1 3.42Å; W102-Y126 PolarHBondContact O-OH 3.3Å; L105-Y126 HydrophobicContact CB-CD1 4.26Å; L105-Y126 HydrophobicContact CD2-CD1 4.06Å; L105-Y126 HydrophobicContact CD2-CG 4.49Å; V110-Y126 HydrophobicContact CG1-CD1 4.17Å; V110-Y126 HydrophobicContact CG1-CE1 4.04Å; V110-Y126 HydrophobicContact CG2-CD1 3.72Å; V110-Y126 HydrophobicContact CG2-CE1 3.89Å; L124-Y126 HydrophobicContact CB-CE2 4.04Å; L124-Y126 WeakPolarHBondContact CD1-OH 3.34Å; Y126-N138 PolarHBondContact N-O 3.33Å; Y126-S140 WeakPolarHBondContact CE2-OG 3.3Å; Y126-S140 PolarHBondContact OH-OG 3.47Å; Y126-P153 HydrophobicContact CD1-CG 3.61Å; Y126-P153 HydrophobicContact CD2-CG 3.81Å; Y126-P153 HydrophobicContact CE1-CG 4.01Å; Y126-P153 HydrophobicContact CE2-CG 4.2Å; Y126-P153 HydrophobicContact CG-CG 3.51Å
127	T	86.4	Confident	82.4	Confident	81 Å²	81	50.1 Å²	50.1	50%	0.497	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	127.7	174.2	50.6	0	0	0	0	109.7	G108 R109	G108-T127 CarbonylContact C-O 3.54Å; G108-T127 VanDerWaalsContact CA-O 3.26Å; G108-T127 WeakPolarHBondContact CA-O 3.28Å; R109-T127 PolarHBondContact N-O 3.01Å; R109-T127 PolarHBondContact O-N 3.22Å
128	C	83.8	Confident	83.2	Confident	30 Å²	30	51.7 Å²	51.7	20%	0.203	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	157.4	173.9	-64.1	0	0	0	0	112.3	F132 T133 L134 C155	C128-F132 HydrophobicContact CB-CB 3.92Å; C128-F132 VanDerWaalsContact CB-O 3.29Å; C128-F132 WeakPolarHBondContact CB-O 3.44Å; C128-T133 VanDerWaalsContact SG-C 3.59Å; C128-L134 WeakPolarHBondContact SG-CA 3.49Å; C128-L134 VanDerWaalsContact SG-CB 3.59Å; C128-L134 WeakPolarHBondContact SG-CD1 3.43Å; C128-L134 PolarHBondContact SG-N 3.1Å; C128-C155 WeakPolarHBondContact CA-SG 3.25Å; C128-C155 HydrophobicContact CB-CB 3.92Å; C128-C155 WeakPolarHBondContact CB-SG 3.33Å; C128-C155 VanDerWaalsContact SG-CA 3.52Å; C128-C155 WeakPolarHBondContact SG-CB 3.5Å; C128-C155 CovalentContact SG-SG 2.04Å; C128-C155 PolarHBondContact SG-SG 3.37Å
129	N	74.4	Confident	83.6	Confident	39 Å²	39	53.9 Å²	53.9	21%	0.209	31%	0.313	C	S	.	.	P	Polyproline II helix	trans	-77	164.3	171.5	-67	-44.2	0	0	0	110.3	N107 G108 R109 G131 F132	N107-N129 VanDerWaalsContact C-ND2 3.31Å; N107-N129 WeakPolarHBondContact O-CB 3.47Å; N107-N129 PolarHBondContact O-N 3.18Å; N107-N129 PolarHBondContact O-ND2 3.48Å; G108-N129 WeakPolarHBondContact CA-ND2 3.38Å; G108-N129 PolarHBondContact N-ND2 2.95Å; G108-N129 PolarHBondContact O-ND2 3.3Å; R109-N129 PolarHBondContact NE-OD1 3.34Å; N129-G131 PolarHBondContact O-N 3.4Å; N129-F132 PolarHBondContact O-N 2.74Å; N129-F132 VanDerWaalsContact O-N 3.07Å
130	S	70	Confident	84.1	Confident	90 Å²	90	53 Å²	53	63%	0.629	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.3	129.9	179.5	-47.4	0	0	0	0	112.1	Y161	S130-Y161 WeakPolarHBondContact CB-OH 3.48Å
131	G	68.8	Low	84.5	Confident	10 Å²	10	54.4 Å²	54.4	10%	0.103	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	85.3	7.8	-177	0	0	0	0	0	115.6	N129 D158	N129-G131 PolarHBondContact O-N 3.4Å; G131-D158 PolarHBondContact O-N 2.9Å
132	F	75.9	Confident	84.8	Confident	52 Å²	52	52.2 Å²	52.2	23%	0.228	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	142.4	173.4	-64.2	-101.9	0	0	0	112	N107 C128 N129 C155 L156 Y157	N107-F132 HydrophobicContact CB-CD1 3.53Å; N107-F132 HydrophobicContact CB-CD2 4.04Å; N107-F132 HydrophobicContact CB-CE1 3.5Å; N107-F132 HydrophobicContact CB-CE2 4.02Å; N107-F132 HydrophobicContact CB-CG 3.81Å; N107-F132 HydrophobicContact CB-CZ 3.76Å; N107-F132 VanDerWaalsContact CG-CZ 3.44Å; N107-F132 WeakPolarHBondContact ND2-CE1 3.24Å; C128-F132 HydrophobicContact CB-CB 3.92Å; C128-F132 VanDerWaalsContact CB-O 3.29Å; C128-F132 WeakPolarHBondContact CB-O 3.44Å; N129-F132 PolarHBondContact O-N 2.74Å; N129-F132 VanDerWaalsContact O-N 3.07Å; F132-C155 HydrophobicContact CB-CB 3.96Å; F132-C155 HydrophobicContact CD1-CB 4.35Å; F132-C155 HydrophobicContact CG-CB 4.46Å; F132-L156 CarbonylContact C-O 3.4Å; F132-L156 WeakPolarHBondContact CA-O 3.46Å; F132-Y157 HydrophobicContact CD1-CD2 4.43Å; F132-Y157 AromaticContact CE1-CD2 3.99Å; F132-Y157 HydrophobicContact CE1-CD2 3.99Å; F132-Y157 HydrophobicContact CE1-CG 4.4Å; F132-Y157 HydrophobicContact CE2-CD2 4.16Å; F132-Y157 AromaticContact CZ-CD2 3.85Å; F132-Y157 HydrophobicContact CZ-CD2 3.85Å
133	T	80.8	Confident	84.8	Confident	79 Å²	79	54.2 Å²	54.2	49%	0.485	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	141.7	176.8	52.1	0	0	0	0	110.7	C128 C155 L156	C128-T133 VanDerWaalsContact SG-C 3.59Å; T133-C155 CarbonylContact O-C 3.46Å; T133-C155 WeakPolarHBondContact O-CA 3.23Å; T133-L156 PolarHBondContact N-O 3.49Å; T133-L156 PolarHBondContact O-N 3.06Å; T133-L156 PolarHBondContact OG1-O 2.92Å
134	L	86.3	Confident	84.3	Confident	55 Å²	55	59.9 Å²	59.9	29%	0.288	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	117.7	-177.9	-168.4	79	0	0	0	110.9	L105 C128 N138 P153	L105-L134 HydrophobicContact CD1-CD1 4.43Å; L105-L134 HydrophobicContact CD2-CD1 3.82Å; C128-L134 WeakPolarHBondContact SG-CA 3.49Å; C128-L134 VanDerWaalsContact SG-CB 3.59Å; C128-L134 WeakPolarHBondContact SG-CD1 3.43Å; C128-L134 PolarHBondContact SG-N 3.1Å; L134-N138 HydrophobicContact CD2-CB 3.68Å; L134-P153 HydrophobicContact CD1-CB 3.85Å; L134-P153 HydrophobicContact CD1-CG 4.07Å; L134-P153 HydrophobicContact CD2-CB 4.45Å; L134-P153 HydrophobicContact CG-CB 4.14Å
135	E	87.7	Confident	83.9	Confident	113 Å²	113	66.5 Å²	66.5	53%	0.528	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	121.1	169.2	-173.8	172.8	-123	0	0	109.8	P153 T154 L156	E135-P153 CarbonylContact O-C 3.58Å; E135-P153 VanDerWaalsContact O-CA 3.28Å; E135-P153 WeakPolarHBondContact O-CA 3.45Å; E135-P153 VanDerWaalsContact O-CB 3.22Å; E135-P153 WeakPolarHBondContact O-CB 3.41Å; E135-T154 PolarHBondContact N-O 3.39Å; E135-T154 PolarHBondContact O-N 3.01Å; E135-L156 HydrophobicContact CB-CD1 4.29Å; E135-L156 HydrophobicContact CB-CG 4.33Å
136	G	85.8	Confident	83.3	Confident	59 Å²	59	64.3 Å²	64.3	61%	0.608	35%	0.351	S	S	*	.	S	Bend	trans	111.3	-163.5	-175.3	0	0	0	0	0	113.4
137	R	88.1	Confident	83.1	Confident	145 Å²	145	70.8 Å²	70.8	55%	0.547	38%	0.38	S	S	.	.			trans	-81.8	136.2	178.6	-70.3	-171.7	-177.8	167.5	2.1	111.1	I139 D149 A150 P153	R137-I139 WeakPolarHBondContact CB-O 3.45Å; R137-I139 PolarHBondContact O-N 3.28Å; R137-D149 IonicContact NH1-OD2 2.73Å; R137-A150 HydrophobicContact CB-CB 4.49Å; R137-P153 WeakPolarHBondContact O-CG 3.02Å
138	N	88.6	Confident	83.2	Confident	101 Å²	101	68.2 Å²	68.2	54%	0.54	36%	0.361	S	S	.	.	S	Bend	trans	-76.1	-2	172.2	67	-17.4	0	0	0	114.3	H125 Y126 L134	H125-N138 WeakPolarHBondContact CA-O 3.1Å; Y126-N138 PolarHBondContact N-O 3.33Å; L134-N138 HydrophobicContact CD2-CB 3.68Å
139	I	90.3	Very high	83.5	Confident	51 Å²	51	70 Å²	70	26%	0.262	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	141.4	177.8	-57.7	-179.6	0	0	0	110.3	V123 L124 R137 H141	V123-I139 HydrophobicContact CG1-CG2 3.5Å; V123-I139 VanDerWaalsContact CG1-CG2 3.5Å; L124-I139 VanDerWaalsContact O-CA 3.27Å; L124-I139 WeakPolarHBondContact O-CA 3.47Å; R137-I139 WeakPolarHBondContact CB-O 3.45Å; R137-I139 PolarHBondContact O-N 3.28Å; I139-H141 WeakPolarHBondContact CG2-NE2 3.45Å
140	S	91.4	Very high	84	Confident	0 Å²	0	68.5 Å²	68.5	0%	0	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	139	164	68.1	0	0	0	0	112	L124 Y126 D149	L124-S140 PolarHBondContact N-O 2.77Å; L124-S140 PolarHBondContact O-N 3.46Å; Y126-S140 WeakPolarHBondContact CE2-OG 3.3Å; Y126-S140 PolarHBondContact OH-OG 3.47Å; S140-D149 WeakPolarHBondContact CA-OD1 3.41Å
141	H	90.8	Very high	84.8	Confident	88 Å²	88	69.1 Å²	69.1	41%	0.407	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	134.7	-178.5	-60.2	-94.7	0	0	0	111.2	V123 I139 T143 W148 D149	V123-H141 WeakPolarHBondContact CG2-ND1 3.47Å; I139-H141 WeakPolarHBondContact CG2-NE2 3.45Å; H141-T143 PolarHBondContact O-N 3.29Å; H141-W148 VanDerWaalsContact C-CE3 3.44Å; H141-D149 IonicContact CD2-OD2 3.59Å; H141-D149 PolarHBondContact N-OD1 3.3Å; H141-D149 PolarHBondContact O-N 2.97Å; H141-D149 VanDerWaalsContact O-N 3.14Å
142	C	88.7	Confident	85.5	Confident	5 Å²	5	71.6 Å²	71.6	3%	0.034	37%	0.371	C	S	.	.	B	Isolated β-bridge	trans	-80.9	112.7	173.6	-179.1	0	0	0	0	110.4	C98 A119 G121 T122 W148	C98-C142 HydrophobicContact CB-CB 3.87Å; C98-C142 WeakPolarHBondContact CB-SG 3.49Å; C98-C142 WeakPolarHBondContact SG-CA 3.31Å; C98-C142 WeakPolarHBondContact SG-CB 3.49Å; C98-C142 CovalentContact SG-SG 2.02Å; C98-C142 PolarHBondContact SG-SG 3.13Å; A119-C142 WeakPolarHBondContact O-CB 3.46Å; A119-C142 PolarHBondContact O-SG 3.19Å; G121-C142 PolarHBondContact N-O 3.49Å; T122-C142 PolarHBondContact O-N 3.24Å; C142-W148 HydrophobicContact CB-CE3 4.03Å; C142-W148 HydrophobicContact CB-CH2 3.89Å; C142-W148 HydrophobicContact CB-CZ3 3.6Å
143	T	85.8	Confident	86.1	Confident	48 Å²	48	69.3 Å²	69.3	29%	0.294	36%	0.362	S	S	.	.			trans	-78.8	163.4	-176.4	67.4	0	0	0	0	112.8	H141 L145 G146 K147 D149	H141-T143 PolarHBondContact O-N 3.29Å; T143-L145 PolarHBondContact O-N 2.88Å; T143-G146 PolarHBondContact O-N 2.97Å; T143-K147 WeakPolarHBondContact CB-O 3.47Å; T143-K147 WeakPolarHBondContact CG2-O 3.33Å; T143-K147 PolarHBondContact N-O 3.32Å; T143-K147 PolarHBondContact OG1-O 2.69Å; T143-D149 HydrophobicContact CG2-CB 4.16Å
144	K	78.6	Confident	86.3	Confident	147 Å²	147	68.9 Å²	68.9	64%	0.639	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-11.1	173.8	-52.2	-165.6	167.7	-80.9	0	114.9	L96 E120	L96-K144 VanDerWaalsContact CD1-O 3.3Å; L96-K144 WeakPolarHBondContact CD1-O 3.41Å; E120-K144 HydrophobicContact CG-CB 4.44Å; E120-K144 HydrophobicContact CG-CG 4.08Å; E120-K144 WeakPolarHBondContact OE1-CG 3.45Å; E120-K144 IonicContact OE1-NZ 3.52Å; E120-K144 PolarHBondContact OE1-NZ 3.27Å
145	L	80.1	Confident	86.2	Confident	139 Å²	139	66.9 Å²	66.9	73%	0.728	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98	7.4	179.5	-61.4	176.7	0	0	0	113.2	T143 K147	T143-L145 PolarHBondContact O-N 2.88Å; L145-K147 VanDerWaalsContact C-N 3.3Å; L145-K147 PolarHBondContact O-N 2.93Å
146	G	77.8	Confident	85.7	Confident	12 Å²	12	65.4 Å²	65.4	12%	0.124	35%	0.345	C	S	.	.	S	Bend	trans	67.7	29.5	-175.8	0	0	0	0	0	113.2	Q97 T143	Q97-G146 VanDerWaalsContact O-CA 3.24Å; Q97-G146 WeakPolarHBondContact O-CA 3.37Å; T143-G146 PolarHBondContact O-N 2.97Å
147	K	85.3	Confident	84.8	Confident	143 Å²	143	66.5 Å²	66.5	62%	0.622	33%	0.331	S	S	*	.			trans	-129.5	147.2	178.2	-64.8	-175.6	-179.1	-177.9	0	111.1	C98 T143 L145	C98-K147 PolarHBondContact SG-N 3.43Å; C98-K147 PolarHBondContact SG-O 3.28Å; T143-K147 WeakPolarHBondContact CB-O 3.47Å; T143-K147 WeakPolarHBondContact CG2-O 3.33Å; T143-K147 PolarHBondContact N-O 3.32Å; T143-K147 PolarHBondContact OG1-O 2.69Å; L145-K147 VanDerWaalsContact C-N 3.3Å; L145-K147 PolarHBondContact O-N 2.93Å
148	W	87.9	Confident	83.9	Confident	26 Å²	26	62.6 Å²	62.6	10%	0.098	32%	0.321	C	S	.	.	B	Isolated β-bridge	trans	-71.5	143.7	168.6	-60.6	108.3	0	0	0	110.5	C98 P99 W102 P118 T122 L124 H141 C142 A150	C98-W148 HydrophobicContact CB-CD2 3.92Å; C98-W148 HydrophobicContact CB-CG 4.32Å; C98-W148 HydrophobicContact CB-CH2 4.24Å; C98-W148 HydrophobicContact CB-CZ2 3.59Å; P99-W148 PolarHBondContact O-NE1 3.45Å; W102-W148 HydrophobicContact CB-CD2 4.23Å; W102-W148 HydrophobicContact CB-CG 4.28Å; W102-W148 HydrophobicContact CB-CZ2 4.23Å; W102-W148 AromaticContact CD1-CD1 3.48Å; W102-W148 VanDerWaalsContact CD1-CD1 3.48Å; W102-W148 AromaticContact CD1-CG 3.51Å; W102-W148 AromaticContact CD2-CD1 3.38Å; W102-W148 HydrophobicContact CD2-CG 4.16Å; W102-W148 AromaticContact CD2-NE1 3.85Å; W102-W148 AromaticContact CE2-CD1 3.75Å; W102-W148 AromaticContact CE3-CD1 3.93Å; W102-W148 HydrophobicContact CG-CB 4.49Å; W102-W148 AromaticContact CG-CD1 3.26Å; W102-W148 HydrophobicContact CG-CD2 4.2Å; W102-W148 AromaticContact CG-CG 3.76Å; W102-W148 HydrophobicContact CG-CG 3.76Å; W102-W148 AromaticContact CG-NE1 3.46Å; W102-W148 AromaticContact NE1-CD1 3.73Å; W102-W148 AromaticContact NE1-CG 3.78Å; P118-W148 HydrophobicContact CB-CH2 3.69Å; P118-W148 HydrophobicContact CB-CZ2 3.5Å; P118-W148 VanDerWaalsContact CB-CZ2 3.5Å; P118-W148 HydrophobicContact CG-CZ2 4.3Å; T122-W148 HydrophobicContact CG2-CH2 4.41Å; L124-W148 HydrophobicContact CD1-CE3 4.35Å; L124-W148 HydrophobicContact CD1-CH2 3.31Å; L124-W148 HydrophobicContact CD1-CZ2 3.51Å; L124-W148 HydrophobicContact CD1-CZ3 3.75Å; L124-W148 HydrophobicContact CD2-CH2 4.12Å; L124-W148 HydrophobicContact CG-CH2 3.44Å; L124-W148 VanDerWaalsContact CG-CH2 3.44Å; L124-W148 HydrophobicContact CG-CZ2 4.17Å; L124-W148 HydrophobicContact CG-CZ3 3.68Å; H141-W148 VanDerWaalsContact C-CE3 3.44Å; C142-W148 HydrophobicContact CB-CE3 4.03Å; C142-W148 HydrophobicContact CB-CH2 3.89Å; C142-W148 HydrophobicContact CB-CZ3 3.6Å; W148-A150 VanDerWaalsContact C-N 3.26Å
149	D	89.6	Confident	82.6	Confident	68 Å²	68	68.8 Å²	68.8	36%	0.364	34%	0.337	S	S	.	.	S	Bend	trans	-76.2	-12.6	176.2	75.1	-41.5	0	0	0	113.8	R137 S140 H141 T143	R137-D149 IonicContact NH1-OD2 2.73Å; S140-D149 WeakPolarHBondContact CA-OD1 3.41Å; H141-D149 IonicContact CD2-OD2 3.59Å; H141-D149 PolarHBondContact N-OD1 3.3Å; H141-D149 PolarHBondContact O-N 2.97Å; H141-D149 VanDerWaalsContact O-N 3.14Å; T143-D149 HydrophobicContact CG2-CB 4.16Å
150	A	85.3	Confident	81.2	Confident	7 Å²	7	73 Å²	73	6%	0.058	36%	0.36	C	S	.	.	S	Bend	trans	-135.4	148.2	-175	0	0	0	0	0	111.7	W102 R137 W148	W102-A150 PolarHBondContact NE1-O 2.88Å; R137-A150 HydrophobicContact CB-CB 4.49Å; W148-A150 VanDerWaalsContact C-N 3.26Å
151	P	86.4	Confident	79.9	Confident	103 Å²	103	76.7 Å²	76.7	67%	0.669	37%	0.374	S	S	*	.	P	Polyproline II helix	trans	-62.8	153.4	168	29.7	-35.2	0	0	0	110.6
152	K	84.3	Confident	78.6	Confident	62 Å²	62	79.6 Å²	79.6	27%	0.27	40%	0.398	S	S	.	.	P	Polyproline II helix	trans	-62.7	126.2	174.6	179.3	174.6	178.1	163.9	0	108.9	V101 W102 S104	V101-K152 HydrophobicContact CG1-CD 4.41Å; V101-K152 WeakPolarHBondContact O-CD 3.2Å; V101-K152 PolarHBondContact O-NZ 2.85Å; W102-K152 HydrophobicContact CD2-CB 4.11Å; W102-K152 HydrophobicContact CG-CB 4.26Å; W102-K152 HydrophobicContact CZ2-CB 4.27Å; S104-K152 WeakPolarHBondContact O-CE 3.18Å; S104-K152 PolarHBondContact O-NZ 3.2Å; S104-K152 PolarHBondContact OG-NZ 2.97Å
153	P	87.9	Confident	77.7	Confident	5 Å²	5	80.6 Å²	80.6	3%	0.032	41%	0.409	C	S	.	.	P	Polyproline II helix	trans	-73.7	167.9	175.8	33.1	-36.6	0	0	0	111.2	L105 Y126 L134 E135 R137	L105-P153 HydrophobicContact CD1-CG 4.29Å; L105-P153 VanDerWaalsContact CD1-O 3.23Å; L105-P153 WeakPolarHBondContact CD1-O 3.26Å; Y126-P153 HydrophobicContact CD1-CG 3.61Å; Y126-P153 HydrophobicContact CD2-CG 3.81Å; Y126-P153 HydrophobicContact CE1-CG 4.01Å; Y126-P153 HydrophobicContact CE2-CG 4.2Å; Y126-P153 HydrophobicContact CG-CG 3.51Å; L134-P153 HydrophobicContact CD1-CB 3.85Å; L134-P153 HydrophobicContact CD1-CG 4.07Å; L134-P153 HydrophobicContact CD2-CB 4.45Å; L134-P153 HydrophobicContact CG-CB 4.14Å; E135-P153 CarbonylContact O-C 3.58Å; E135-P153 VanDerWaalsContact O-CA 3.28Å; E135-P153 WeakPolarHBondContact O-CA 3.45Å; E135-P153 VanDerWaalsContact O-CB 3.22Å; E135-P153 WeakPolarHBondContact O-CB 3.41Å; R137-P153 WeakPolarHBondContact O-CG 3.02Å
154	T	86.3	Confident	77.5	Confident	70 Å²	70	81.4 Å²	81.4	43%	0.429	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	151.1	178.3	48.6	0	0	0	0	110.9	E135	E135-T154 PolarHBondContact N-O 3.39Å; E135-T154 PolarHBondContact O-N 3.01Å
155	C	83.3	Confident	77.8	Confident	12 Å²	12	76.4 Å²	76.4	8%	0.081	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	108.5	176.4	-71.8	0	0	0	0	109.7	E106 N107 C128 F132 T133	E106-C155 WeakPolarHBondContact O-CB 3.27Å; N107-C155 HydrophobicContact CB-CB 3.88Å; C128-C155 WeakPolarHBondContact CA-SG 3.25Å; C128-C155 HydrophobicContact CB-CB 3.92Å; C128-C155 WeakPolarHBondContact CB-SG 3.33Å; C128-C155 VanDerWaalsContact SG-CA 3.52Å; C128-C155 WeakPolarHBondContact SG-CB 3.5Å; C128-C155 CovalentContact SG-SG 2.04Å; C128-C155 PolarHBondContact SG-SG 3.37Å; F132-C155 HydrophobicContact CB-CB 3.96Å; F132-C155 HydrophobicContact CD1-CB 4.35Å; F132-C155 HydrophobicContact CG-CB 4.46Å; T133-C155 CarbonylContact O-C 3.46Å; T133-C155 WeakPolarHBondContact O-CA 3.23Å
156	L	78.1	Confident	78.2	Confident	83 Å²	83	73.8 Å²	73.8	44%	0.435	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	140.2	178.3	-62.4	-175.3	0	0	0	110.7	F132 T133 E135 D158	F132-L156 CarbonylContact C-O 3.4Å; F132-L156 WeakPolarHBondContact CA-O 3.46Å; T133-L156 PolarHBondContact N-O 3.49Å; T133-L156 PolarHBondContact O-N 3.06Å; T133-L156 PolarHBondContact OG1-O 2.92Å; E135-L156 HydrophobicContact CB-CD1 4.29Å; E135-L156 HydrophobicContact CB-CG 4.33Å; L156-D158 PolarHBondContact O-N 3.44Å
157	Y	67	Low	79	Confident	82 Å²	82	73.8 Å²	73.8	32%	0.322	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	125	-180	-180	-102.8	0	0	0	111.8	F132 R159 K165	F132-Y157 HydrophobicContact CD1-CD2 4.43Å; F132-Y157 AromaticContact CE1-CD2 3.99Å; F132-Y157 HydrophobicContact CE1-CD2 3.99Å; F132-Y157 HydrophobicContact CE1-CG 4.4Å; F132-Y157 HydrophobicContact CE2-CD2 4.16Å; F132-Y157 AromaticContact CZ-CD2 3.85Å; F132-Y157 HydrophobicContact CZ-CD2 3.85Å; Y157-R159 PolarHBondContact O-N 3.39Å; Y157-K165 HydrophobicContact CE2-CD 4.49Å; Y157-K165 VanDerWaalsContact CE2-CE 3.44Å; Y157-K165 VanDerWaalsContact CZ-CE 3.44Å; Y157-K165 WeakPolarHBondContact OH-CE 3.43Å
158	D	68	Low	79.4	Confident	62 Å²	62	68.1 Å²	68.1	33%	0.332	34%	0.342	S	S	.	.			trans	-74.1	113.8	172	-176.9	-1.8	0	0	0	109.9	G131 L156 N160 Y161	G131-D158 PolarHBondContact O-N 2.9Å; L156-D158 PolarHBondContact O-N 3.44Å; D158-N160 PolarHBondContact O-N 3.4Å; D158-N160 VanDerWaalsContact O-N 3.14Å; D158-N160 WeakPolarHBondContact OD1-CB 3.33Å; D158-N160 PolarHBondContact OD1-N 2.97Å; D158-Y161 WeakPolarHBondContact O-CB 3.49Å; D158-Y161 PolarHBondContact O-N 2.98Å; D158-Y161 VanDerWaalsContact O-N 3.08Å
159	R	61.5	Low	79.8	Confident	232 Å²	232	67 Å²	67	88%	0.875	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-16.2	-179.8	-65.1	-175.5	177.9	-171.7	-0.7	113.6	Y157	Y157-R159 PolarHBondContact O-N 3.39Å
160	N	62	Low	80.1	Confident	138 Å²	138	63.8 Å²	63.8	74%	0.738	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.9	0.5	177.2	-63.7	-26.2	0	0	0	113.4	D158 T162	D158-N160 PolarHBondContact O-N 3.4Å; D158-N160 VanDerWaalsContact O-N 3.14Å; D158-N160 WeakPolarHBondContact OD1-CB 3.33Å; D158-N160 PolarHBondContact OD1-N 2.97Å; N160-T162 PolarHBondContact O-N 3.06Å
161	Y	62.4	Low	80.7	Confident	79 Å²	79	63.4 Å²	63.4	31%	0.31	32%	0.318	S	S	.	.			trans	-71.1	118.6	-179.7	-171.5	-111.6	0	0	0	112.1	S130 D158 G163	S130-Y161 WeakPolarHBondContact CB-OH 3.48Å; D158-Y161 WeakPolarHBondContact O-CB 3.49Å; D158-Y161 PolarHBondContact O-N 2.98Å; D158-Y161 VanDerWaalsContact O-N 3.08Å; Y161-G163 VanDerWaalsContact CE1-CA 3.43Å; Y161-G163 WeakPolarHBondContact CE1-O 3.34Å
162	T	63.6	Low	81.2	Confident	148 Å²	148	58.8 Å²	58.8	91%	0.908	29%	0.287	S	S	*	.			trans	-97.5	6.1	-177.9	52.8	0	0	0	0	114.2	N160	N160-T162 PolarHBondContact O-N 3.06Å
163	G	70.3	Confident	81.8	Confident	26 Å²	26	55.8 Å²	55.8	27%	0.268	27%	0.274	S	S	.	.	S	Bend	trans	-85.5	156.5	177.4	0	0	0	0	0	113.4	Y161	Y161-G163 VanDerWaalsContact CE1-CA 3.43Å; Y161-G163 WeakPolarHBondContact CE1-O 3.34Å
164	K	82	Confident	82.1	Confident	65 Å²	65	55.6 Å²	55.6	28%	0.283	27%	0.273	S	S	.	.	P	Polyproline II helix	trans	-57.8	140.1	173.8	-75.9	-176.9	161.3	-148.8	0	111.5	N197 L203 P204 D205 Y206 E207	K164-N197 PolarHBondContact NZ-O 3.32Å; K164-L203 WeakPolarHBondContact CE-O 3.43Å; K164-L203 PolarHBondContact NZ-O 3.37Å; K164-P204 VanDerWaalsContact CE-O 3.31Å; K164-P204 WeakPolarHBondContact CE-O 3.47Å; K164-P204 WeakPolarHBondContact CG-O 3.4Å; K164-D205 WeakPolarHBondContact CA-O 3.27Å; K164-Y206 WeakPolarHBondContact CD-O 3.26Å; K164-Y206 PolarHBondContact NZ-O 2.88Å; K164-E207 HydrophobicContact CB-CB 4.04Å; K164-E207 HydrophobicContact CD-CB 4.27Å
165	K	85.6	Confident	82.4	Confident	43 Å²	43	54.7 Å²	54.7	19%	0.187	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	130.8	174.4	-62.9	-169	-179.8	-163.1	0	111.2	Y157 D205 Y206 E207 E494	Y157-K165 HydrophobicContact CE2-CD 4.49Å; Y157-K165 VanDerWaalsContact CE2-CE 3.44Å; Y157-K165 VanDerWaalsContact CZ-CE 3.44Å; Y157-K165 WeakPolarHBondContact OH-CE 3.43Å; K165-D205 PolarHBondContact N-O 3.36Å; K165-Y206 HydrophobicContact CB-CD1 3.93Å; K165-Y206 HydrophobicContact CB-CE1 4.38Å; K165-Y206 CarbonylContact O-C 3.58Å; K165-Y206 VanDerWaalsContact O-CA 3.22Å; K165-Y206 WeakPolarHBondContact O-CA 3.5Å; K165-E207 PolarHBondContact O-N 2.8Å; K165-E494 HydrophobicContact CD-CB 4.41Å; K165-E494 HydrophobicContact CD-CG 4.2Å; K165-E494 WeakPolarHBondContact CD-OE1 3.38Å; K165-E494 WeakPolarHBondContact CE-OE1 3.3Å; K165-E494 IonicContact NZ-OE1 3.65Å; K165-E494 PolarHBondContact NZ-OE1 3.01Å
166	K	88.6	Confident	82.5	Confident	84 Å²	84	56.3 Å²	56.3	37%	0.365	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	126	-179.3	-72	175.7	171.1	-66.4	0	111.8	Y168 E207 E209	K166-Y168 HydrophobicContact CB-CE2 3.76Å; K166-Y168 WeakPolarHBondContact CD-OH 3.48Å; K166-E207 CarbonylContact C-O 3.55Å; K166-E207 WeakPolarHBondContact CA-O 3.35Å; K166-E207 VanDerWaalsContact CE-OE2 3.25Å; K166-E207 WeakPolarHBondContact CE-OE2 3.16Å; K166-E207 WeakPolarHBondContact CG-OE2 3.49Å; K166-E207 VanDerWaalsContact NZ-CD 3.33Å; K166-E207 IonicContact NZ-OE1 3.41Å; K166-E207 IonicContact NZ-OE2 3.41Å; K166-E207 PolarHBondContact NZ-OE2 3.24Å; K166-E209 VanDerWaalsContact CD-OE2 3.32Å; K166-E209 WeakPolarHBondContact CD-OE2 3.38Å; K166-E209 WeakPolarHBondContact CE-OE2 3.49Å; K166-E209 IonicContact NZ-OE2 2.93Å; K166-E209 PolarHBondContact NZ-OE2 2.73Å
167	L	92.9	Very high	82.6	Confident	11 Å²	11	54.8 Å²	54.8	6%	0.058	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	127.8	170.8	-59.1	177.9	0	0	0	108.7	Y206 E207 L208 E209 L493	L167-Y206 HydrophobicContact CD1-CD1 3.72Å; L167-Y206 HydrophobicContact CD1-CE1 4.38Å; L167-Y206 HydrophobicContact CD1-CG 3.93Å; L167-Y206 HydrophobicContact CD2-CD1 4.05Å; L167-Y206 HydrophobicContact CD2-CE1 4.4Å; L167-Y206 HydrophobicContact CG-CD1 3.83Å; L167-Y206 HydrophobicContact CG-CG 4.37Å; L167-E207 PolarHBondContact N-O 3.3Å; L167-L208 HydrophobicContact CB-CD2 4.07Å; L167-L208 HydrophobicContact CD1-CD2 4.37Å; L167-L208 WeakPolarHBondContact O-CA 3.35Å; L167-E209 PolarHBondContact O-N 3.35Å; L167-L493 HydrophobicContact CD1-CB 4.05Å; L167-L493 HydrophobicContact CD1-CD1 3.97Å; L167-L493 HydrophobicContact CD2-CB 4.18Å
168	Y	94.1	Very high	82.8	Confident	25 Å²	25	54.1 Å²	54.1	10%	0.098	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	135.1	-169.8	-64.2	-89.1	0	0	0	112.7	K166 E209 I211 P234 K236 I237	K166-Y168 HydrophobicContact CB-CE2 3.76Å; K166-Y168 WeakPolarHBondContact CD-OH 3.48Å; Y168-E209 CarbonylContact C-O 3.12Å; Y168-E209 WeakPolarHBondContact CA-O 3.18Å; Y168-E209 HydrophobicContact CD1-CB 3.83Å; Y168-E209 HydrophobicContact CD1-CG 4.12Å; Y168-E209 HydrophobicContact CE1-CB 3.83Å; Y168-E209 VanDerWaalsContact CE1-CD 3.47Å; Y168-E209 HydrophobicContact CE1-CG 3.89Å; Y168-E209 WeakPolarHBondContact CE1-OE1 3.47Å; Y168-I211 HydrophobicContact CD1-CD1 3.69Å; Y168-I211 HydrophobicContact CD1-CG1 4.15Å; Y168-I211 HydrophobicContact CE1-CD1 4.43Å; Y168-I211 HydrophobicContact CG-CD1 4.25Å; Y168-P234 HydrophobicContact CD1-CB 4.45Å; Y168-P234 HydrophobicContact CD1-CG 3.5Å; Y168-P234 HydrophobicContact CD2-CB 3.45Å; Y168-P234 VanDerWaalsContact CD2-CB 3.45Å; Y168-P234 HydrophobicContact CD2-CG 3.42Å; Y168-P234 VanDerWaalsContact CD2-CG 3.42Å; Y168-P234 HydrophobicContact CE1-CG 3.65Å; Y168-P234 HydrophobicContact CE2-CB 3.55Å; Y168-P234 HydrophobicContact CE2-CG 3.59Å; Y168-P234 HydrophobicContact CG-CB 3.93Å; Y168-P234 HydrophobicContact CG-CG 3.37Å; Y168-K236 CarbonylContact O-C 3.53Å; Y168-K236 VanDerWaalsContact O-CA 3.27Å; Y168-K236 WeakPolarHBondContact O-CA 3.38Å; Y168-I237 PolarHBondContact O-N 3.21Å
169	I	96.6	Very high	83.6	Confident	1 Å²	1	52.9 Å²	52.9	1%	0.005	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	128.9	177	-58	162.6	0	0	0	108	L193 L208 E209 L210 I211 M240 L475	I169-L193 HydrophobicContact CD1-CD2 4.15Å; I169-L208 HydrophobicContact CD1-CB 4.26Å; I169-L208 HydrophobicContact CD1-CD1 4.39Å; I169-E209 PolarHBondContact N-O 2.7Å; I169-L210 HydrophobicContact CB-CD1 4Å; I169-L210 HydrophobicContact CG2-CD1 3.9Å; I169-I211 PolarHBondContact O-N 3.23Å; I169-M240 HydrophobicContact CG2-CG 3.92Å; I169-M240 HydrophobicContact CG2-SD 3.78Å; I169-L475 HydrophobicContact CD1-CD2 3.62Å; I169-L475 HydrophobicContact CG1-CD2 3.98Å
170	G	96.5	Very high	84.8	Confident	1 Å²	1	44 Å²	44	1%	0.01	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	127.8	174.8	0	0	0	0	0	110.9	I211 V238 L239 M240	G170-I211 CarbonylContact C-O 3.57Å; G170-I211 WeakPolarHBondContact CA-O 3.3Å; G170-V238 PolarHBondContact N-O 3.48Å; G170-L239 CarbonylContact O-C 3.56Å; G170-L239 VanDerWaalsContact O-CA 3.27Å; G170-L239 WeakPolarHBondContact O-CA 3.46Å; G170-M240 PolarHBondContact O-N 3.23Å
171	A	97.1	Very high	86	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	149	-177.3	0	0	0	0	0	113.8	F173 L210 I211 H212 Y213 M240	A171-F173 HydrophobicContact CB-CD2 4.02Å; A171-F173 HydrophobicContact CB-CE2 3.48Å; A171-F173 VanDerWaalsContact CB-CE2 3.48Å; A171-F173 HydrophobicContact CB-CZ 4.08Å; A171-L210 HydrophobicContact CB-CD1 3.72Å; A171-L210 HydrophobicContact CB-CG 4.47Å; A171-I211 PolarHBondContact N-O 3.35Å; A171-H212 HydrophobicContact CB-CB 4.13Å; A171-H212 VanDerWaalsContact O-CA 3.32Å; A171-H212 WeakPolarHBondContact O-CA 3.47Å; A171-Y213 PolarHBondContact O-N 3.01Å; A171-Y213 VanDerWaalsContact O-N 3.08Å; A171-M240 WeakPolarHBondContact CA-O 3.31Å; A171-M240 HydrophobicContact CB-CB 4.11Å
172	L	97.3	Very high	87.5	Confident	5 Å²	5	33.6 Å²	33.6	3%	0.026	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	87.1	-178.8	-68.4	178.4	0	0	0	109.5	A222 L225 L229 M240 G242 V246 V250	L172-A222 HydrophobicContact CD1-CB 4.41Å; L172-L225 HydrophobicContact CD2-CB 3.91Å; L172-L225 HydrophobicContact CD2-CD1 4.46Å; L172-L229 HydrophobicContact CD2-CD1 3.96Å; L172-L229 HydrophobicContact CG-CD1 4.14Å; L172-M240 PolarHBondContact N-O 3.31Å; L172-G242 PolarHBondContact O-N 2.74Å; L172-G242 VanDerWaalsContact O-N 3.14Å; L172-V246 HydrophobicContact CB-CG1 4.36Å; L172-V246 HydrophobicContact CD1-CG1 3.82Å; L172-V250 HydrophobicContact CD1-CG2 3.99Å
173	F	96.9	Very high	88.8	Confident	0 Å²	0	29.8 Å²	29.8	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	120.8	-179.7	-65.8	-80.7	0	0	0	110.1	A171 M175 C185 M186 A189 L210 H212 Y213 D214 S215 Y264	A171-F173 HydrophobicContact CB-CD2 4.02Å; A171-F173 HydrophobicContact CB-CE2 3.48Å; A171-F173 VanDerWaalsContact CB-CE2 3.48Å; A171-F173 HydrophobicContact CB-CZ 4.08Å; F173-M175 HydrophobicContact CB-CE 4.01Å; F173-M175 PolarHBondContact O-N 3.22Å; F173-C185 HydrophobicContact CD1-CB 4.15Å; F173-C185 HydrophobicContact CE1-CB 4.21Å; F173-M186 HydrophobicContact CB-CB 4.29Å; F173-M186 HydrophobicContact CD1-CB 3.81Å; F173-M186 HydrophobicContact CD2-CB 3.87Å; F173-M186 HydrophobicContact CD2-CG 3.89Å; F173-M186 HydrophobicContact CE1-CB 4.07Å; F173-M186 HydrophobicContact CE2-CB 4.11Å; F173-M186 HydrophobicContact CE2-CG 4Å; F173-M186 HydrophobicContact CG-CB 3.74Å; F173-M186 HydrophobicContact CG-CG 4.26Å; F173-M186 HydrophobicContact CZ-CB 4.22Å; F173-M186 HydrophobicContact CZ-CG 4.48Å; F173-A189 HydrophobicContact CE1-CB 4.27Å; F173-A189 HydrophobicContact CZ-CB 3.83Å; F173-L210 HydrophobicContact CE2-CD2 4.05Å; F173-L210 HydrophobicContact CZ-CD2 4.29Å; F173-H212 HydrophobicContact CD2-CB 3.8Å; F173-H212 HydrophobicContact CE2-CB 3.92Å; F173-Y213 PolarHBondContact N-O 2.79Å; F173-Y213 VanDerWaalsContact N-O 3.14Å; F173-D214 VanDerWaalsContact O-CA 3.3Å; F173-D214 WeakPolarHBondContact O-CA 3.45Å; F173-S215 PolarHBondContact O-N 3.38Å; F173-Y264 AromaticContact CD1-CE1 3.81Å; F173-Y264 HydrophobicContact CD1-CE1 3.81Å; F173-Y264 HydrophobicContact CD1-CE2 4.3Å; F173-Y264 AromaticContact CD1-CZ 3.51Å; F173-Y264 WeakPolarHBondContact CD1-OH 3.43Å; F173-Y264 HydrophobicContact CE1-CD1 4.38Å; F173-Y264 AromaticContact CE1-CE1 3.74Å; F173-Y264 HydrophobicContact CE1-CE1 3.74Å; F173-Y264 HydrophobicContact CE1-CE2 4.44Å; F173-Y264 AromaticContact CE1-CZ 3.8Å
174	P	94.8	Very high	89.9	Confident	0 Å²	0	28.5 Å²	28.5	0%	0	17%	0.17	C	C	.	.			trans	-80.9	104.7	178.3	31.4	-30.6	0	0	0	109.7	S176 W179 P180 G181 G182 C217 Y264	P174-S176 VanDerWaalsContact C-N 3.27Å; P174-W179 HydrophobicContact CG-CE3 3.49Å; P174-W179 VanDerWaalsContact CG-CE3 3.49Å; P174-W179 HydrophobicContact CG-CZ3 3.62Å; P174-W179 WeakPolarHBondContact CG-O 3.23Å; P174-P180 CarbonylContact O-C 3.54Å; P174-P180 VanDerWaalsContact O-CA 3.31Å; P174-P180 WeakPolarHBondContact O-CA 3.31Å; P174-G181 PolarHBondContact O-N 2.83Å; P174-G182 WeakPolarHBondContact O-CA 3.25Å; P174-G182 PolarHBondContact O-N 2.99Å; P174-C217 HydrophobicContact CB-CB 4.01Å; P174-Y264 VanDerWaalsContact CD-OH 3.23Å; P174-Y264 WeakPolarHBondContact CD-OH 3.35Å
175	M	91.6	Very high	90.5	Very high	51 Å²	51	25.4 Å²	25.4	25%	0.251	16%	0.157	S	C	.	.	S	Bend	trans	-79.4	-16.8	177.4	-57.1	-62.9	-179.6	0	0	112.3	F173 P180 G182 Q183 M186 D214	F173-M175 HydrophobicContact CB-CE 4.01Å; F173-M175 PolarHBondContact O-N 3.22Å; M175-P180 WeakPolarHBondContact O-CB 3.49Å; M175-G182 VanDerWaalsContact SD-C 3.52Å; M175-Q183 PolarHBondContact O-NE2 3.47Å; M175-M186 HydrophobicContact CE-CB 3.88Å; M175-M186 HydrophobicContact CE-CE 3.81Å; M175-M186 HydrophobicContact CE-CG 4.02Å; M175-D214 HydrophobicContact CB-CB 4.49Å; M175-D214 HydrophobicContact CG-CB 4.08Å; M175-D214 PolarHBondContact N-OD1 3.04Å
176	S	85.1	Confident	91	Very high	46 Å²	46	25 Å²	25	32%	0.322	16%	0.156	S	C	.	.	S	Bend	trans	-145	-178.7	-177.6	63.6	0	0	0	0	110.7	P174 M216	P174-S176 VanDerWaalsContact C-N 3.27Å; S176-M216 CarbonylContact O-C 3.58Å; S176-M216 WeakPolarHBondContact O-CA 3.3Å; S176-M216 WeakPolarHBondContact OG-CG 3.22Å
177	G	81.5	Confident	91.3	Very high	52 Å²	52	21.8 Å²	21.8	54%	0.536	14%	0.143	S	C	.	.	S	Bend	trans	92.6	-160.2	-179.3	0	0	0	0	0	113.7	W179 M216	G177-W179 PolarHBondContact O-N 3.44Å; G177-M216 WeakPolarHBondContact CA-O 3.38Å
178	G	70.8	Confident	91.5	Very high	67 Å²	67	21.2 Å²	21.2	69%	0.691	14%	0.141	S	C	*	.	S	Bend	trans	-66.4	-14.6	-173.5	0	0	0	0	0	115.8
179	W	84.2	Confident	91.6	Very high	36 Å²	36	20 Å²	20	14%	0.136	14%	0.136	C	C	.	.			trans	-149.6	101.7	168.4	174.6	80.5	0	0	0	108.4	P174 G177 G181 Y264 E464	P174-W179 HydrophobicContact CG-CE3 3.49Å; P174-W179 VanDerWaalsContact CG-CE3 3.49Å; P174-W179 HydrophobicContact CG-CZ3 3.62Å; P174-W179 WeakPolarHBondContact CG-O 3.23Å; G177-W179 PolarHBondContact O-N 3.44Å; W179-G181 PolarHBondContact O-N 3.45Å; W179-Y264 AromaticContact CH2-CE2 3.83Å; W179-Y264 HydrophobicContact CH2-CE2 3.83Å; W179-Y264 HydrophobicContact CZ3-CE2 4.27Å; W179-E464 HydrophobicContact CZ2-CB 4.07Å; W179-E464 HydrophobicContact CZ2-CG 3.84Å; W179-E464 WeakPolarHBondContact CZ2-OE1 3.31Å; W179-E464 PolarHBondContact NE1-OE1 2.67Å
180	P	87.1	Confident	91.6	Very high	45 Å²	45	23.3 Å²	23.3	29%	0.292	15%	0.151	S	C	.	.			trans	-80	38.6	-176	33.7	-36.5	0	0	0	112.8	P174 M175 G182 Q183 G460	P174-P180 CarbonylContact O-C 3.54Å; P174-P180 VanDerWaalsContact O-CA 3.31Å; P174-P180 WeakPolarHBondContact O-CA 3.31Å; M175-P180 WeakPolarHBondContact O-CB 3.49Å; P180-G182 PolarHBondContact O-N 2.88Å; P180-G182 VanDerWaalsContact O-N 3.08Å; P180-Q183 WeakPolarHBondContact O-CG 3.49Å; P180-Q183 PolarHBondContact O-N 2.63Å; P180-G460 CarbonylContact O-C 3.53Å
181	G	88	Confident	91.5	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-11.7	-168.6	0	0	0	0	0	116.1	P174 W179 Q183 C185	P174-G181 PolarHBondContact O-N 2.83Å; W179-G181 PolarHBondContact O-N 3.45Å; G181-Q183 PolarHBondContact O-N 3.19Å; G181-C185 WeakPolarHBondContact O-CB 3.2Å; G181-C185 PolarHBondContact O-N 2.57Å; G181-C185 PolarHBondContact O-SG 3.03Å
182	G	92.3	Very high	91.5	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-61.6	-25.4	175.2	0	0	0	0	0	114	P174 M175 P180 A184 M186	P174-G182 WeakPolarHBondContact O-CA 3.25Å; P174-G182 PolarHBondContact O-N 2.99Å; M175-G182 VanDerWaalsContact SD-C 3.52Å; P180-G182 PolarHBondContact O-N 2.88Å; P180-G182 VanDerWaalsContact O-N 3.08Å; G182-A184 PolarHBondContact O-N 2.87Å; G182-M186 WeakPolarHBondContact O-CB 3.28Å; G182-M186 PolarHBondContact O-N 2.85Å
183	Q	91.1	Very high	91.4	Very high	67 Å²	67	23.8 Å²	23.8	31%	0.313	15%	0.153	S	C	.	.	H	α-helix	trans	-62.3	-42.7	-172.8	-61.9	176.4	9.3	0	0	112.8	M175 P180 G181 P187 T459 G460	M175-Q183 PolarHBondContact O-NE2 3.47Å; P180-Q183 WeakPolarHBondContact O-CG 3.49Å; P180-Q183 PolarHBondContact O-N 2.63Å; G181-Q183 PolarHBondContact O-N 3.19Å; Q183-P187 VanDerWaalsContact O-CD 3.27Å; Q183-P187 WeakPolarHBondContact O-CD 3.42Å; Q183-P187 WeakPolarHBondContact O-CG 3.41Å; Q183-T459 HydrophobicContact CB-CG2 4.17Å; Q183-G460 VanDerWaalsContact OE1-N 3.11Å
184	A	93	Very high	91.3	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-96	-32.3	171.7	0	0	0	0	0	113.7	G182 M186 P187 S188 L451 T459 G460 F462 A465	G182-A184 PolarHBondContact O-N 2.87Å; A184-M186 PolarHBondContact O-N 3.3Å; A184-P187 WeakPolarHBondContact O-CD 3.44Å; A184-S188 VanDerWaalsContact O-CB 3.3Å; A184-S188 WeakPolarHBondContact O-CB 3.46Å; A184-S188 PolarHBondContact O-N 3.06Å; A184-L451 HydrophobicContact CB-CD1 4.48Å; A184-T459 HydrophobicContact CB-CG2 4.03Å; A184-G460 PolarHBondContact N-O 3.34Å; A184-F462 HydrophobicContact CB-CB 4.31Å; A184-F462 HydrophobicContact CB-CD2 4.33Å; A184-A465 HydrophobicContact CB-CB 4.08Å
185	C	95.6	Very high	91.3	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-68.2	-32.8	-177.4	-71.2	0	0	0	0	113.7	F173 G181 A189 Y264 A468	F173-C185 HydrophobicContact CD1-CB 4.15Å; F173-C185 HydrophobicContact CE1-CB 4.21Å; G181-C185 WeakPolarHBondContact O-CB 3.2Å; G181-C185 PolarHBondContact O-N 2.57Å; G181-C185 PolarHBondContact O-SG 3.03Å; C185-A189 WeakPolarHBondContact O-CB 3.38Å; C185-A189 PolarHBondContact O-N 3.47Å; C185-Y264 HydrophobicContact CB-CD2 3.91Å; C185-Y264 HydrophobicContact CB-CE2 3.41Å; C185-Y264 VanDerWaalsContact CB-CE2 3.41Å; C185-Y264 VanDerWaalsContact SG-CE2 3.56Å; C185-A468 HydrophobicContact CB-CB 3.84Å
186	M	95.8	Very high	91.5	Very high	35 Å²	35	27.5 Å²	27.5	17%	0.172	17%	0.174	C	C	.	.	H	α-helix	trans	-70	-50.2	179.7	178.2	-80.8	-70	0	0	112.5	F173 M175 G182 A184 S188 A189 Q190	F173-M186 HydrophobicContact CB-CB 4.29Å; F173-M186 HydrophobicContact CD1-CB 3.81Å; F173-M186 HydrophobicContact CD2-CB 3.87Å; F173-M186 HydrophobicContact CD2-CG 3.89Å; F173-M186 HydrophobicContact CE1-CB 4.07Å; F173-M186 HydrophobicContact CE2-CB 4.11Å; F173-M186 HydrophobicContact CE2-CG 4Å; F173-M186 HydrophobicContact CG-CB 3.74Å; F173-M186 HydrophobicContact CG-CG 4.26Å; F173-M186 HydrophobicContact CZ-CB 4.22Å; F173-M186 HydrophobicContact CZ-CG 4.48Å; M175-M186 HydrophobicContact CE-CB 3.88Å; M175-M186 HydrophobicContact CE-CE 3.81Å; M175-M186 HydrophobicContact CE-CG 4.02Å; G182-M186 WeakPolarHBondContact O-CB 3.28Å; G182-M186 PolarHBondContact O-N 2.85Å; A184-M186 PolarHBondContact O-N 3.3Å; M186-S188 PolarHBondContact O-N 3.34Å; M186-A189 PolarHBondContact O-N 3.48Å; M186-Q190 WeakPolarHBondContact O-CG 3.34Å; M186-Q190 PolarHBondContact O-N 3Å; M186-Q190 HydrophobicContact SD-CG 4.25Å; M186-Q190 PolarHBondContact SD-NE2 3.28Å
187	P	95.4	Very high	92	Very high	15 Å²	15	26.8 Å²	26.8	10%	0.097	17%	0.166	C	C	.	.	H	α-helix	trans	-59.7	-33.2	172.5	-26	35.8	0	0	0	113.4	Q183 A184 M191 L447 R450 L451	Q183-P187 VanDerWaalsContact O-CD 3.27Å; Q183-P187 WeakPolarHBondContact O-CD 3.42Å; Q183-P187 WeakPolarHBondContact O-CG 3.41Å; A184-P187 WeakPolarHBondContact O-CD 3.44Å; P187-M191 WeakPolarHBondContact O-CB 3.48Å; P187-M191 PolarHBondContact O-N 2.98Å; P187-L447 HydrophobicContact CB-CD1 4.36Å; P187-R450 HydrophobicContact CB-CB 4.43Å; P187-L451 HydrophobicContact CG-CD2 4.23Å
188	S	96.2	Very high	92.6	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-66.9	-46.5	176.3	-170.4	0	0	0	0	112.5	A184 M186 Q190 M191 A192 F443 A465	A184-S188 VanDerWaalsContact O-CB 3.3Å; A184-S188 WeakPolarHBondContact O-CB 3.46Å; A184-S188 PolarHBondContact O-N 3.06Å; M186-S188 PolarHBondContact O-N 3.34Å; S188-Q190 PolarHBondContact O-N 2.89Å; S188-M191 WeakPolarHBondContact O-CB 3.46Å; S188-M191 PolarHBondContact O-N 3.24Å; S188-A192 PolarHBondContact O-N 3.03Å; S188-F443 WeakPolarHBondContact OG-CZ 3.42Å; S188-A465 WeakPolarHBondContact CB-O 3.27Å; S188-A465 PolarHBondContact OG-O 3.13Å
189	A	96.6	Very high	93.6	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-63.7	-40.2	175.3	0	0	0	0	0	112.1	F173 C185 M186 A192 L193 L210 V472	F173-A189 HydrophobicContact CE1-CB 4.27Å; F173-A189 HydrophobicContact CZ-CB 3.83Å; C185-A189 WeakPolarHBondContact O-CB 3.38Å; C185-A189 PolarHBondContact O-N 3.47Å; M186-A189 PolarHBondContact O-N 3.48Å; A189-A192 PolarHBondContact O-N 2.71Å; A189-L193 WeakPolarHBondContact O-CG 3.33Å; A189-L193 PolarHBondContact O-N 2.92Å; A189-L193 VanDerWaalsContact O-N 3.11Å; A189-L210 HydrophobicContact CB-CD2 4.46Å; A189-V472 HydrophobicContact CB-CG2 4.13Å
190	Q	95.8	Very high	93.8	Very high	70 Å²	70	34.3 Å²	34.3	33%	0.327	18%	0.183	S	C	.	.	H	α-helix	trans	-60.4	-44.2	172.4	-72.6	178.7	-13.3	0	0	111.8	M186 S188 A192 L193 D194 L210	M186-Q190 WeakPolarHBondContact O-CG 3.34Å; M186-Q190 PolarHBondContact O-N 3Å; M186-Q190 HydrophobicContact SD-CG 4.25Å; M186-Q190 PolarHBondContact SD-NE2 3.28Å; S188-Q190 PolarHBondContact O-N 2.89Å; Q190-A192 VanDerWaalsContact C-N 3.3Å; Q190-A192 PolarHBondContact O-N 2.84Å; Q190-L193 WeakPolarHBondContact O-CB 3.45Å; Q190-L193 PolarHBondContact O-N 3.5Å; Q190-L193 VanDerWaalsContact O-N 3.12Å; Q190-D194 VanDerWaalsContact O-CG 3.3Å; Q190-D194 PolarHBondContact O-N 3.16Å; Q190-L210 HydrophobicContact CG-CD2 4.36Å
191	M	95.5	Very high	94	Very high	6 Å²	6	36.3 Å²	36.3	3%	0.03	19%	0.191	C	C	.	.	H	α-helix	trans	-61.4	-36.1	177.1	-173.1	168.7	66.5	0	0	113	P187 S188 L195 F443 A446 L447 F469	P187-M191 WeakPolarHBondContact O-CB 3.48Å; P187-M191 PolarHBondContact O-N 2.98Å; S188-M191 WeakPolarHBondContact O-CB 3.46Å; S188-M191 PolarHBondContact O-N 3.24Å; M191-L195 HydrophobicContact CG-CD1 4.47Å; M191-L195 WeakPolarHBondContact O-CD1 3.25Å; M191-L195 VanDerWaalsContact O-CG 3.3Å; M191-L195 WeakPolarHBondContact O-CG 3.47Å; M191-L195 PolarHBondContact O-N 2.8Å; M191-F443 HydrophobicContact CE-CD2 3.46Å; M191-F443 VanDerWaalsContact CE-CD2 3.46Å; M191-F443 HydrophobicContact CE-CE2 3.45Å; M191-F443 VanDerWaalsContact CE-CE2 3.45Å; M191-F443 HydrophobicContact CE-CG 4.44Å; M191-F443 HydrophobicContact CE-CZ 4.42Å; M191-A446 HydrophobicContact CE-CB 4.32Å; M191-A446 HydrophobicContact SD-CB 3.63Å; M191-L447 HydrophobicContact CE-CB 4.38Å; M191-F469 HydrophobicContact CE-CD2 4.15Å; M191-F469 HydrophobicContact CE-CE2 4.08Å; M191-F469 HydrophobicContact CG-CE2 4.33Å
192	A	96.6	Very high	94.2	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-66.5	-41.2	173.2	0	0	0	0	0	112.3	S188 A189 Q190 L195 V196 F469 V472	S188-A192 PolarHBondContact O-N 3.03Å; A189-A192 PolarHBondContact O-N 2.71Å; Q190-A192 VanDerWaalsContact C-N 3.3Å; Q190-A192 PolarHBondContact O-N 2.84Å; A192-L195 PolarHBondContact O-N 2.73Å; A192-V196 WeakPolarHBondContact O-CB 3.35Å; A192-V196 WeakPolarHBondContact O-CG2 3.26Å; A192-V196 PolarHBondContact O-N 3Å; A192-F469 HydrophobicContact CB-CD2 3.6Å; A192-F469 HydrophobicContact CB-CE2 3.93Å; A192-F469 HydrophobicContact CB-CG 4.03Å; A192-V472 HydrophobicContact CB-CB 3.59Å; A192-V472 HydrophobicContact CB-CG1 3.66Å; A192-V472 HydrophobicContact CB-CG2 4.17Å
193	L	95.9	Very high	94.2	Very high	9 Å²	9	36.7 Å²	36.7	5%	0.047	19%	0.193	C	C	.	.	H	α-helix	trans	-63.7	-42.9	178.3	-69.7	163.7	0	0	0	112.2	I169 A189 Q190 L195 V196 N197 L208 L210 V472	I169-L193 HydrophobicContact CD1-CD2 4.15Å; A189-L193 WeakPolarHBondContact O-CG 3.33Å; A189-L193 PolarHBondContact O-N 2.92Å; A189-L193 VanDerWaalsContact O-N 3.11Å; Q190-L193 WeakPolarHBondContact O-CB 3.45Å; Q190-L193 PolarHBondContact O-N 3.5Å; Q190-L193 VanDerWaalsContact O-N 3.12Å; L193-L195 VanDerWaalsContact C-N 3.29Å; L193-L195 PolarHBondContact O-N 2.96Å; L193-V196 PolarHBondContact O-N 3.04Å; L193-N197 VanDerWaalsContact O-CB 3.31Å; L193-N197 WeakPolarHBondContact O-CB 3.32Å; L193-N197 VanDerWaalsContact O-CG 3.32Å; L193-N197 PolarHBondContact O-N 3.27Å; L193-N197 PolarHBondContact O-ND2 2.96Å; L193-L208 HydrophobicContact CD2-CB 3.53Å; L193-L208 HydrophobicContact CD2-CD1 4.1Å; L193-L208 HydrophobicContact CD2-CG 4.47Å; L193-L210 HydrophobicContact CD1-CB 3.56Å; L193-L210 HydrophobicContact CD1-CD2 3.81Å; L193-L210 HydrophobicContact CD1-CG 4.16Å; L193-V472 HydrophobicContact CD2-CG1 3.65Å; L193-V472 HydrophobicContact CG-CG1 3.82Å; L193-V472 HydrophobicContact CG-CG2 4.43Å
194	D	94.6	Very high	94.1	Very high	83 Å²	83	37 Å²	37	44%	0.444	20%	0.201	S	C	.	.	H	α-helix	trans	-56.6	-44.6	176.1	-63	-31.2	0	0	0	111.4	Q190 N198 R450	Q190-D194 VanDerWaalsContact O-CG 3.3Å; Q190-D194 PolarHBondContact O-N 3.16Å; D194-N198 VanDerWaalsContact O-CB 3.29Å; D194-N198 WeakPolarHBondContact O-CB 3.43Å; D194-N198 PolarHBondContact O-N 3.49Å; D194-R450 IonicContact OD2-CZ 3.41Å; D194-R450 IonicContact OD2-NH1 2.74Å; D194-R450 PolarHBondContact OD2-NH1 3.48Å; D194-R450 IonicContact OD2-NH2 3.18Å; D194-R450 PolarHBondContact OD2-NH2 3.26Å
195	L	95.1	Very high	93.9	Very high	46 Å²	46	41.2 Å²	41.2	24%	0.241	22%	0.224	C	C	.	.	H	α-helix	trans	-71.6	-36.8	-179.8	-65.7	168.6	0	0	0	113	M191 A192 L193 M438 F469 W473	M191-L195 HydrophobicContact CG-CD1 4.47Å; M191-L195 WeakPolarHBondContact O-CD1 3.25Å; M191-L195 VanDerWaalsContact O-CG 3.3Å; M191-L195 WeakPolarHBondContact O-CG 3.47Å; M191-L195 PolarHBondContact O-N 2.8Å; A192-L195 PolarHBondContact O-N 2.73Å; L193-L195 VanDerWaalsContact C-N 3.29Å; L193-L195 PolarHBondContact O-N 2.96Å; L195-M438 HydrophobicContact CD1-CE 3.59Å; L195-M438 HydrophobicContact CD1-SD 3.93Å; L195-M438 HydrophobicContact CD2-CE 3.74Å; L195-M438 HydrophobicContact CG-CE 4.31Å; L195-F469 HydrophobicContact CD1-CE2 3.81Å; L195-F469 HydrophobicContact CD1-CZ 3.73Å; L195-W473 HydrophobicContact CB-CZ2 3.89Å
196	V	95.8	Very high	93.7	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-69.5	-46.6	176.2	165.6	0	0	0	0	111	A192 L193 N198 R199 I202 L208 W473 A476	A192-V196 WeakPolarHBondContact O-CB 3.35Å; A192-V196 WeakPolarHBondContact O-CG2 3.26Å; A192-V196 PolarHBondContact O-N 3Å; L193-V196 PolarHBondContact O-N 3.04Å; V196-N198 VanDerWaalsContact C-N 3.33Å; V196-N198 PolarHBondContact O-N 2.98Å; V196-R199 PolarHBondContact O-N 3.32Å; V196-R199 VanDerWaalsContact O-N 3.15Å; V196-I202 HydrophobicContact CG1-CG2 4.3Å; V196-L208 HydrophobicContact CG1-CD1 4Å; V196-W473 HydrophobicContact CG2-CD2 3.9Å; V196-W473 HydrophobicContact CG2-CE3 3.9Å; V196-W473 HydrophobicContact CG2-CH2 3.96Å; V196-W473 HydrophobicContact CG2-CZ2 3.96Å; V196-W473 HydrophobicContact CG2-CZ3 3.93Å; V196-A476 HydrophobicContact CB-CB 4.44Å; V196-A476 HydrophobicContact CG1-CB 3.61Å; V196-A476 HydrophobicContact CG2-CB 3.92Å
197	N	94.8	Very high	93.5	Very high	31 Å²	31	42.8 Å²	42.8	17%	0.166	23%	0.23	C	C	.	.	H	α-helix	trans	-67.7	-33.4	-175.7	-74.7	-23.4	0	0	0	112.8	K164 L193 R199 E207 L208	K164-N197 PolarHBondContact NZ-O 3.32Å; L193-N197 VanDerWaalsContact O-CB 3.31Å; L193-N197 WeakPolarHBondContact O-CB 3.32Å; L193-N197 VanDerWaalsContact O-CG 3.32Å; L193-N197 PolarHBondContact O-N 3.27Å; L193-N197 PolarHBondContact O-ND2 2.96Å; N197-R199 VanDerWaalsContact C-N 3.25Å; N197-R199 PolarHBondContact O-N 3.39Å; N197-E207 HydrophobicContact CB-CG 4.37Å; N197-L208 PolarHBondContact ND2-O 2.83Å; N197-L208 PolarHBondContact OD1-N 2.75Å
198	N	93.8	Very high	93.5	Very high	143 Å²	143	42.2 Å²	42.2	77%	0.765	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.4	-15.1	175.5	-168.1	39.3	0	0	0	113.4	D194 V196	D194-N198 VanDerWaalsContact O-CB 3.29Å; D194-N198 WeakPolarHBondContact O-CB 3.43Å; D194-N198 PolarHBondContact O-N 3.49Å; V196-N198 VanDerWaalsContact C-N 3.33Å; V196-N198 PolarHBondContact O-N 2.98Å
199	R	92.7	Very high	93.4	Very high	75 Å²	75	45 Å²	45	28%	0.283	24%	0.24	S	C	.	.			trans	-89.4	127.1	177	-83.6	178.9	75.3	162.2	-2	112	V196 N197 D201 I202 V435	V196-R199 PolarHBondContact O-N 3.32Å; V196-R199 VanDerWaalsContact O-N 3.15Å; N197-R199 VanDerWaalsContact C-N 3.25Å; N197-R199 PolarHBondContact O-N 3.39Å; R199-D201 WeakPolarHBondContact CB-OD1 3.28Å; R199-D201 IonicContact CZ-OD1 3.18Å; R199-D201 IonicContact CZ-OD2 2.71Å; R199-D201 IonicContact NE-OD1 2.69Å; R199-D201 PolarHBondContact NE-OD1 3.16Å; R199-D201 IonicContact NE-OD2 2.65Å; R199-D201 PolarHBondContact NE-OD2 3.05Å; R199-D201 IonicContact NH2-OD1 2.74Å; R199-D201 IonicContact NH2-OD2 3.55Å; R199-D201 PolarHBondContact NH2-OD2 3.41Å; R199-I202 HydrophobicContact CB-CG1 4.02Å; R199-V435 PolarHBondContact NH1-O 2.91Å
200	S	88.3	Confident	93.3	Very high	95 Å²	95	46.3 Å²	46.3	66%	0.664	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81	-18.8	175.9	50.5	0	0	0	0	113.6	P204	S200-P204 WeakPolarHBondContact O-CB 3.39Å
201	D	91.8	Very high	93.3	Very high	88 Å²	88	44.6 Å²	44.6	47%	0.471	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.4	-16.4	-177	68	-59	0	0	0	114.3	R199 N480	R199-D201 WeakPolarHBondContact CB-OD1 3.28Å; R199-D201 IonicContact CZ-OD1 3.18Å; R199-D201 IonicContact CZ-OD2 2.71Å; R199-D201 IonicContact NE-OD1 2.69Å; R199-D201 PolarHBondContact NE-OD1 3.16Å; R199-D201 IonicContact NE-OD2 2.65Å; R199-D201 PolarHBondContact NE-OD2 3.05Å; R199-D201 IonicContact NH2-OD1 2.74Å; R199-D201 IonicContact NH2-OD2 3.55Å; R199-D201 PolarHBondContact NH2-OD2 3.41Å; D201-N480 PolarHBondContact O-ND2 2.84Å
202	I	92	Very high	93.3	Very high	6 Å²	6	47.6 Å²	47.6	3%	0.031	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.6	-54.2	-178.5	-52.9	-59.1	0	0	0	111.6	V196 R199 W473 A476 L477 N480	V196-I202 HydrophobicContact CG1-CG2 4.3Å; R199-I202 HydrophobicContact CB-CG1 4.02Å; I202-W473 HydrophobicContact CG1-CZ3 4.4Å; I202-A476 HydrophobicContact CG2-CB 3.97Å; I202-L477 HydrophobicContact CD1-CD2 4.15Å; I202-N480 VanDerWaalsContact O-CB 3.26Å; I202-N480 WeakPolarHBondContact O-CB 3.35Å; I202-N480 PolarHBondContact O-ND2 3.05Å; I202-N480 VanDerWaalsContact O-ND2 3.11Å
203	L	92	Very high	93.2	Very high	1 Å²	1	51.4 Å²	51.4	1%	0.005	27%	0.268	C	S	.	.			trans	-139.6	89.9	176.2	-72.6	174.3	0	0	0	108.8	K164 Y206 L208 L479	K164-L203 WeakPolarHBondContact CE-O 3.43Å; K164-L203 PolarHBondContact NZ-O 3.37Å; L203-Y206 HydrophobicContact CD2-CD2 4.15Å; L203-Y206 VanDerWaalsContact O-O 3.09Å; L203-L208 HydrophobicContact CD1-CD1 4.14Å; L203-L208 HydrophobicContact CD1-CD2 3.8Å; L203-L208 HydrophobicContact CD1-CG 3.88Å; L203-L479 HydrophobicContact CD2-CB 4.39Å
204	P	89.1	Confident	93.2	Very high	74 Å²	74	53.3 Å²	53.3	48%	0.481	28%	0.278	S	S	.	.	S	Bend	trans	-69.8	-43.6	179	24.4	-31.9	0	0	0	112.1	K164 S200	K164-P204 VanDerWaalsContact CE-O 3.31Å; K164-P204 WeakPolarHBondContact CE-O 3.47Å; K164-P204 WeakPolarHBondContact CG-O 3.4Å; S200-P204 WeakPolarHBondContact O-CB 3.39Å
205	D	88.9	Confident	93.1	Very high	89 Å²	89	49.3 Å²	49.3	48%	0.476	26%	0.257	S	S	.	.	S	Bend	trans	-84.6	-10.9	-175.2	-62.4	-22.4	0	0	0	113.5	K164 K165	K164-D205 WeakPolarHBondContact CA-O 3.27Å; K165-D205 PolarHBondContact N-O 3.36Å
206	Y	90.9	Very high	93	Very high	6 Å²	6	51.7 Å²	51.7	2%	0.024	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	157	-168.8	-51.8	-89.1	0	0	0	113.8	K164 K165 L167 L203 V483 L493 E494	K164-Y206 WeakPolarHBondContact CD-O 3.26Å; K164-Y206 PolarHBondContact NZ-O 2.88Å; K165-Y206 HydrophobicContact CB-CD1 3.93Å; K165-Y206 HydrophobicContact CB-CE1 4.38Å; K165-Y206 CarbonylContact O-C 3.58Å; K165-Y206 VanDerWaalsContact O-CA 3.22Å; K165-Y206 WeakPolarHBondContact O-CA 3.5Å; L167-Y206 HydrophobicContact CD1-CD1 3.72Å; L167-Y206 HydrophobicContact CD1-CE1 4.38Å; L167-Y206 HydrophobicContact CD1-CG 3.93Å; L167-Y206 HydrophobicContact CD2-CD1 4.05Å; L167-Y206 HydrophobicContact CD2-CE1 4.4Å; L167-Y206 HydrophobicContact CG-CD1 3.83Å; L167-Y206 HydrophobicContact CG-CG 4.37Å; L203-Y206 HydrophobicContact CD2-CD2 4.15Å; L203-Y206 VanDerWaalsContact O-O 3.09Å; Y206-V483 HydrophobicContact CE2-CG2 4.31Å; Y206-L493 HydrophobicContact CD2-CD1 4.43Å; Y206-L493 HydrophobicContact CE1-CB 3.88Å; Y206-L493 HydrophobicContact CE2-CD1 4.09Å; Y206-E494 WeakPolarHBondContact CE1-OE2 3.39Å; Y206-E494 PolarHBondContact OH-OE2 3.01Å; Y206-E494 VanDerWaalsContact OH-OE2 3.12Å
207	E	92.3	Very high	92.7	Very high	61 Å²	61	53.2 Å²	53.2	29%	0.285	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	135.1	174.6	-174.9	-170.7	-159.2	0	0	108.8	K164 K165 K166 L167 N197	K164-E207 HydrophobicContact CB-CB 4.04Å; K164-E207 HydrophobicContact CD-CB 4.27Å; K165-E207 PolarHBondContact O-N 2.8Å; K166-E207 CarbonylContact C-O 3.55Å; K166-E207 WeakPolarHBondContact CA-O 3.35Å; K166-E207 VanDerWaalsContact CE-OE2 3.25Å; K166-E207 WeakPolarHBondContact CE-OE2 3.16Å; K166-E207 WeakPolarHBondContact CG-OE2 3.49Å; K166-E207 VanDerWaalsContact NZ-CD 3.33Å; K166-E207 IonicContact NZ-OE1 3.41Å; K166-E207 IonicContact NZ-OE2 3.41Å; K166-E207 PolarHBondContact NZ-OE2 3.24Å; L167-E207 PolarHBondContact N-O 3.3Å; N197-E207 HydrophobicContact CB-CG 4.37Å
208	L	95.1	Very high	92.6	Very high	4 Å²	4	55.4 Å²	55.4	2%	0.021	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	126.2	177.7	-57.7	-176.7	0	0	0	110.5	L167 I169 L193 V196 N197 L203 A476 L479	L167-L208 HydrophobicContact CB-CD2 4.07Å; L167-L208 HydrophobicContact CD1-CD2 4.37Å; L167-L208 WeakPolarHBondContact O-CA 3.35Å; I169-L208 HydrophobicContact CD1-CB 4.26Å; I169-L208 HydrophobicContact CD1-CD1 4.39Å; L193-L208 HydrophobicContact CD2-CB 3.53Å; L193-L208 HydrophobicContact CD2-CD1 4.1Å; L193-L208 HydrophobicContact CD2-CG 4.47Å; V196-L208 HydrophobicContact CG1-CD1 4Å; N197-L208 PolarHBondContact ND2-O 2.83Å; N197-L208 PolarHBondContact OD1-N 2.75Å; L203-L208 HydrophobicContact CD1-CD1 4.14Å; L203-L208 HydrophobicContact CD1-CD2 3.8Å; L203-L208 HydrophobicContact CD1-CG 3.88Å; L208-A476 HydrophobicContact CD1-CB 4.14Å; L208-L479 HydrophobicContact CD2-CD1 3.89Å
209	E	94.3	Very high	92.4	Very high	58 Å²	58	51.3 Å²	51.3	27%	0.271	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	138.1	177.7	-169.9	171.6	137.9	0	0	111.1	K166 L167 Y168 I169	K166-E209 VanDerWaalsContact CD-OE2 3.32Å; K166-E209 WeakPolarHBondContact CD-OE2 3.38Å; K166-E209 WeakPolarHBondContact CE-OE2 3.49Å; K166-E209 IonicContact NZ-OE2 2.93Å; K166-E209 PolarHBondContact NZ-OE2 2.73Å; L167-E209 PolarHBondContact O-N 3.35Å; Y168-E209 CarbonylContact C-O 3.12Å; Y168-E209 WeakPolarHBondContact CA-O 3.18Å; Y168-E209 HydrophobicContact CD1-CB 3.83Å; Y168-E209 HydrophobicContact CD1-CG 4.12Å; Y168-E209 HydrophobicContact CE1-CB 3.83Å; Y168-E209 VanDerWaalsContact CE1-CD 3.47Å; Y168-E209 HydrophobicContact CE1-CG 3.89Å; Y168-E209 WeakPolarHBondContact CE1-OE1 3.47Å; I169-E209 PolarHBondContact N-O 2.7Å
210	L	94.9	Very high	92.4	Very high	28 Å²	28	50 Å²	50	15%	0.147	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	116.7	-170.3	-173.3	66.9	0	0	0	111.6	I169 A171 F173 A189 Q190 L193	I169-L210 HydrophobicContact CB-CD1 4Å; I169-L210 HydrophobicContact CG2-CD1 3.9Å; A171-L210 HydrophobicContact CB-CD1 3.72Å; A171-L210 HydrophobicContact CB-CG 4.47Å; F173-L210 HydrophobicContact CE2-CD2 4.05Å; F173-L210 HydrophobicContact CZ-CD2 4.29Å; A189-L210 HydrophobicContact CB-CD2 4.46Å; Q190-L210 HydrophobicContact CG-CD2 4.36Å; L193-L210 HydrophobicContact CD1-CB 3.56Å; L193-L210 HydrophobicContact CD1-CD2 3.81Å; L193-L210 HydrophobicContact CD1-CG 4.16Å
211	I	95.2	Very high	92.6	Very high	33 Å²	33	48.1 Å²	48.1	17%	0.169	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	114.1	174	-61.4	172	0	0	0	107.5	Y168 I169 G170 A171 Y213 L229 P234	Y168-I211 HydrophobicContact CD1-CD1 3.69Å; Y168-I211 HydrophobicContact CD1-CG1 4.15Å; Y168-I211 HydrophobicContact CE1-CD1 4.43Å; Y168-I211 HydrophobicContact CG-CD1 4.25Å; I169-I211 PolarHBondContact O-N 3.23Å; G170-I211 CarbonylContact C-O 3.57Å; G170-I211 WeakPolarHBondContact CA-O 3.3Å; A171-I211 PolarHBondContact N-O 3.35Å; I211-Y213 HydrophobicContact CG2-CE2 4.36Å; I211-L229 HydrophobicContact CB-CD2 4.42Å; I211-L229 HydrophobicContact CG2-CD2 3.83Å; I211-P234 HydrophobicContact CD1-CG 3.68Å
212	H	94.6	Very high	92.7	Very high	69 Å²	69	44 Å²	44	32%	0.319	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	146.8	-172	66.2	65.4	0	0	0	114.7	A171 F173	A171-H212 HydrophobicContact CB-CB 4.13Å; A171-H212 VanDerWaalsContact O-CA 3.32Å; A171-H212 WeakPolarHBondContact O-CA 3.47Å; F173-H212 HydrophobicContact CD2-CB 3.8Å; F173-H212 HydrophobicContact CE2-CB 3.92Å
213	Y	95.5	Very high	92.8	Very high	81 Å²	81	47 Å²	47	32%	0.318	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	156.2	172.6	-61	-71.4	0	0	0	111.9	A171 F173 I211 S215 L225 L229	A171-Y213 PolarHBondContact O-N 3.01Å; A171-Y213 VanDerWaalsContact O-N 3.08Å; F173-Y213 PolarHBondContact N-O 2.79Å; F173-Y213 VanDerWaalsContact N-O 3.14Å; I211-Y213 HydrophobicContact CG2-CE2 4.36Å; Y213-S215 PolarHBondContact O-N 2.91Å; Y213-L225 HydrophobicContact CD1-CD2 4.21Å; Y213-L225 HydrophobicContact CD2-CB 4.49Å; Y213-L225 HydrophobicContact CD2-CD2 4.45Å; Y213-L225 HydrophobicContact CG-CD2 3.96Å; Y213-L229 HydrophobicContact CD2-CD1 4.28Å; Y213-L229 HydrophobicContact CD2-CD2 3.95Å; Y213-L229 HydrophobicContact CD2-CG 3.83Å; Y213-L229 HydrophobicContact CE2-CD2 3.65Å; Y213-L229 HydrophobicContact CE2-CG 3.76Å
214	D	95.7	Very high	92.9	Very high	48 Å²	48	52.3 Å²	52.3	26%	0.257	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	114.7	170.2	-178.4	14.6	0	0	0	110.1	F173 M175 M216 L225	F173-D214 VanDerWaalsContact O-CA 3.3Å; F173-D214 WeakPolarHBondContact O-CA 3.45Å; M175-D214 HydrophobicContact CB-CB 4.49Å; M175-D214 HydrophobicContact CG-CB 4.08Å; M175-D214 PolarHBondContact N-OD1 3.04Å; D214-M216 PolarHBondContact OD1-N 2.81Å; D214-L225 WeakPolarHBondContact O-CD1 3.33Å
215	S	93.5	Very high	93.1	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	26%	0.261	C	S	.	.			trans	-85.9	-8.4	177.6	57.4	0	0	0	0	114.2	F173 Y213 C217 D218	F173-S215 PolarHBondContact O-N 3.38Å; Y213-S215 PolarHBondContact O-N 2.91Å; S215-C217 PolarHBondContact O-N 2.97Å; S215-D218 PolarHBondContact O-N 3.29Å
216	M	92.3	Very high	93.3	Very high	96 Å²	96	45.8 Å²	45.8	47%	0.473	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.6	20.3	-176	-50.1	-173	-177.6	0	0	114.1	S176 G177 D214 D218	S176-M216 CarbonylContact O-C 3.58Å; S176-M216 WeakPolarHBondContact O-CA 3.3Å; S176-M216 WeakPolarHBondContact OG-CG 3.22Å; G177-M216 WeakPolarHBondContact CA-O 3.38Å; D214-M216 PolarHBondContact OD1-N 2.81Å; M216-D218 PolarHBondContact O-N 2.85Å; M216-D218 VanDerWaalsContact O-N 3.13Å
217	C	90.1	Very high	93.4	Very high	32 Å²	32	52.1 Å²	52.1	22%	0.216	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	60.2	6.8	-169.4	-155.7	0	0	0	0	115.3	P174 S215 C243	P174-C217 HydrophobicContact CB-CB 4.01Å; S215-C217 PolarHBondContact O-N 2.97Å; C217-C243 HydrophobicContact CB-CB 4.04Å; C217-C243 WeakPolarHBondContact CB-SG 3.43Å; C217-C243 WeakPolarHBondContact SG-CB 3.45Å; C217-C243 CovalentContact SG-SG 2.03Å; C217-C243 PolarHBondContact SG-SG 3.26Å
218	D	91.4	Very high	93.3	Very high	77 Å²	77	52.2 Å²	52.2	41%	0.412	27%	0.269	S	S	.	.			trans	-95.7	126.8	-172.7	179.7	-106.2	0	0	0	112.8	S215 M216 G220 E221 A222	S215-D218 PolarHBondContact O-N 3.29Å; M216-D218 PolarHBondContact O-N 2.85Å; M216-D218 VanDerWaalsContact O-N 3.13Å; D218-G220 VanDerWaalsContact C-N 3.31Å; D218-G220 PolarHBondContact O-N 3.43Å; D218-G220 WeakPolarHBondContact OD1-CA 3.33Å; D218-G220 PolarHBondContact OD1-N 2.98Å; D218-E221 PolarHBondContact OD1-N 2.91Å; D218-A222 WeakPolarHBondContact O-CB 3.39Å; D218-A222 PolarHBondContact O-N 3.37Å
219	P	91.1	Very high	93.1	Very high	57 Å²	57	52.1 Å²	52.1	37%	0.37	27%	0.269	S	S	.	.	H	α-helix	trans	-64.4	-28	176.8	-23.3	34.7	0	0	0	114.8	T223 L249	P219-T223 PolarHBondContact O-N 3.4Å; P219-T223 PolarHBondContact O-OG1 3.13Å; P219-L249 HydrophobicContact CB-CD2 4.35Å; P219-L249 VanDerWaalsContact O-CD2 3.3Å; P219-L249 WeakPolarHBondContact O-CD2 3.38Å
220	G	90.9	Very high	93	Very high	46 Å²	46	49.9 Å²	49.9	47%	0.474	26%	0.259	S	S	.	.	H	α-helix	trans	-69.9	-56.1	-178.6	0	0	0	0	0	112	D218 A222 T223	D218-G220 VanDerWaalsContact C-N 3.31Å; D218-G220 PolarHBondContact O-N 3.43Å; D218-G220 WeakPolarHBondContact OD1-CA 3.33Å; D218-G220 PolarHBondContact OD1-N 2.98Å; G220-A222 VanDerWaalsContact C-N 3.33Å; G220-A222 PolarHBondContact O-N 2.94Å; G220-T223 WeakPolarHBondContact O-CB 3.46Å; G220-T223 PolarHBondContact O-N 3.08Å
221	E	92.8	Very high	92.7	Very high	57 Å²	57	55 Å²	55	27%	0.266	28%	0.277	S	S	.	.	H	α-helix	trans	-65.4	-37.2	175.2	-178.2	57.2	-156.2	0	0	111.1	D218 T223 K224 L225	D218-E221 PolarHBondContact OD1-N 2.91Å; E221-T223 VanDerWaalsContact C-N 3.28Å; E221-T223 PolarHBondContact O-N 3.36Å; E221-K224 WeakPolarHBondContact O-CB 3.3Å; E221-K224 PolarHBondContact O-N 2.9Å; E221-K224 VanDerWaalsContact O-N 3.13Å; E221-K224 IonicContact OE1-NZ 3.49Å; E221-K224 PolarHBondContact OE1-NZ 3.35Å; E221-K224 IonicContact OE2-NZ 3.45Å; E221-K224 PolarHBondContact OE2-NZ 3.14Å; E221-L225 HydrophobicContact CG-CD1 3.99Å; E221-L225 HydrophobicContact CG-CG 4.42Å; E221-L225 WeakPolarHBondContact O-CG 3.34Å; E221-L225 PolarHBondContact O-N 3.32Å
222	A	94.5	Very high	92	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-62.1	-29.9	172.8	0	0	0	0	0	113.8	L172 D218 G220 K224 L226 V246 L249	L172-A222 HydrophobicContact CD1-CB 4.41Å; D218-A222 WeakPolarHBondContact O-CB 3.39Å; D218-A222 PolarHBondContact O-N 3.37Å; G220-A222 VanDerWaalsContact C-N 3.33Å; G220-A222 PolarHBondContact O-N 2.94Å; A222-K224 VanDerWaalsContact C-N 3.34Å; A222-L226 WeakPolarHBondContact O-CB 3.47Å; A222-L226 PolarHBondContact O-N 3.43Å; A222-V246 HydrophobicContact CB-CB 4.3Å; A222-V246 HydrophobicContact CB-CG1 3.73Å; A222-V246 HydrophobicContact CB-CG2 3.75Å; A222-L249 HydrophobicContact CB-CD2 4.49Å
223	T	94.1	Very high	91.2	Very high	71 Å²	71	56.3 Å²	56.3	44%	0.436	29%	0.287	S	S	.	.	H	α-helix	trans	-62.4	-43	173.6	-59.6	0	0	0	0	111	P219 G220 E221 Y227 L249	P219-T223 PolarHBondContact O-N 3.4Å; P219-T223 PolarHBondContact O-OG1 3.13Å; G220-T223 WeakPolarHBondContact O-CB 3.46Å; G220-T223 PolarHBondContact O-N 3.08Å; E221-T223 VanDerWaalsContact C-N 3.28Å; E221-T223 PolarHBondContact O-N 3.36Å; T223-Y227 PolarHBondContact O-N 3.5Å; T223-Y227 VanDerWaalsContact O-N 3.09Å; T223-L249 VanDerWaalsContact OG1-CD2 3.26Å; T223-L249 WeakPolarHBondContact OG1-CD2 3.22Å
224	K	92.9	Very high	90.8	Very high	111 Å²	111	54.4 Å²	54.4	48%	0.483	28%	0.284	S	S	.	.	H	α-helix	trans	-67.1	-47	177.4	159.4	168.9	157.4	-95.5	0	111.6	E221 A222 L226 Y227 D228	E221-K224 WeakPolarHBondContact O-CB 3.3Å; E221-K224 PolarHBondContact O-N 2.9Å; E221-K224 VanDerWaalsContact O-N 3.13Å; E221-K224 IonicContact OE1-NZ 3.49Å; E221-K224 PolarHBondContact OE1-NZ 3.35Å; E221-K224 IonicContact OE2-NZ 3.45Å; E221-K224 PolarHBondContact OE2-NZ 3.14Å; A222-K224 VanDerWaalsContact C-N 3.34Å; K224-L226 VanDerWaalsContact C-N 3.31Å; K224-L226 PolarHBondContact O-N 2.96Å; K224-Y227 WeakPolarHBondContact O-CB 3.46Å; K224-Y227 PolarHBondContact O-N 3.18Å; K224-Y227 VanDerWaalsContact O-N 3.13Å; K224-D228 PolarHBondContact O-N 3.42Å
225	L	93.9	Very high	90.4	Very high	14 Å²	14	55.2 Å²	55.2	7%	0.073	29%	0.288	C	S	.	.	H	α-helix	trans	-66.9	-31.2	178	-62.3	169.7	0	0	0	112.8	L172 Y213 D214 E221 D228 L229	L172-L225 HydrophobicContact CD2-CB 3.91Å; L172-L225 HydrophobicContact CD2-CD1 4.46Å; Y213-L225 HydrophobicContact CD1-CD2 4.21Å; Y213-L225 HydrophobicContact CD2-CB 4.49Å; Y213-L225 HydrophobicContact CD2-CD2 4.45Å; Y213-L225 HydrophobicContact CG-CD2 3.96Å; D214-L225 WeakPolarHBondContact O-CD1 3.33Å; E221-L225 HydrophobicContact CG-CD1 3.99Å; E221-L225 HydrophobicContact CG-CG 4.42Å; E221-L225 WeakPolarHBondContact O-CG 3.34Å; E221-L225 PolarHBondContact O-N 3.32Å; L225-D228 PolarHBondContact O-N 2.81Å; L225-L229 WeakPolarHBondContact O-CB 3.27Å; L225-L229 WeakPolarHBondContact O-CG 3.46Å; L225-L229 PolarHBondContact O-N 2.9Å
226	L	94.4	Very high	90.5	Very high	13 Å²	13	55.2 Å²	55.2	7%	0.068	29%	0.288	C	S	.	.	H	α-helix	trans	-66.1	-41.2	170.5	178.4	63.8	0	0	0	111.5	A222 K224 L229 L230 L239 V250 A253	A222-L226 WeakPolarHBondContact O-CB 3.47Å; A222-L226 PolarHBondContact O-N 3.43Å; K224-L226 VanDerWaalsContact C-N 3.31Å; K224-L226 PolarHBondContact O-N 2.96Å; L226-L229 PolarHBondContact O-N 2.95Å; L226-L230 HydrophobicContact CD1-CD1 3.86Å; L226-L230 HydrophobicContact CD1-CG 4.05Å; L226-L230 HydrophobicContact CG-CD1 3.85Å; L226-L230 HydrophobicContact CG-CG 4.41Å; L226-L230 WeakPolarHBondContact O-CB 3.4Å; L226-L230 VanDerWaalsContact O-CG 3.29Å; L226-L230 WeakPolarHBondContact O-CG 3.41Å; L226-L230 PolarHBondContact O-N 2.75Å; L226-L239 HydrophobicContact CD1-CD1 3.7Å; L226-V250 HydrophobicContact CD1-CG1 4.45Å; L226-V250 HydrophobicContact CD1-CG2 4.37Å; L226-V250 HydrophobicContact CD2-CG2 4.15Å; L226-A253 HydrophobicContact CD2-CB 4.1Å
227	Y	92.4	Very high	90.6	Very high	138 Å²	138	51 Å²	51	54%	0.541	27%	0.267	S	S	.	.	H	α-helix	trans	-60.8	-46.6	174	-171.2	-80.6	0	0	0	110.9	T223 K224 L229 L230 Y231	T223-Y227 PolarHBondContact O-N 3.5Å; T223-Y227 VanDerWaalsContact O-N 3.09Å; K224-Y227 WeakPolarHBondContact O-CB 3.46Å; K224-Y227 PolarHBondContact O-N 3.18Å; K224-Y227 VanDerWaalsContact O-N 3.13Å; Y227-L229 PolarHBondContact O-N 3.23Å; Y227-L230 PolarHBondContact O-N 2.65Å; Y227-Y231 AromaticContact CD1-CD2 3.9Å; Y227-Y231 HydrophobicContact CD1-CD2 3.9Å; Y227-Y231 HydrophobicContact CD1-CG 4.4Å; Y227-Y231 AromaticContact CD2-CD2 3.57Å; Y227-Y231 HydrophobicContact CD2-CD2 3.57Å; Y227-Y231 AromaticContact CD2-CE2 3.59Å; Y227-Y231 HydrophobicContact CD2-CE2 3.59Å; Y227-Y231 AromaticContact CE1-CD2 3.77Å; Y227-Y231 HydrophobicContact CE1-CD2 3.77Å; Y227-Y231 AromaticContact CE1-CG 3.94Å; Y227-Y231 HydrophobicContact CE1-CG 3.94Å; Y227-Y231 AromaticContact CE2-CD2 3.44Å; Y227-Y231 HydrophobicContact CE2-CD2 3.44Å; Y227-Y231 VanDerWaalsContact CE2-CD2 3.44Å; Y227-Y231 AromaticContact CE2-CE2 3.36Å; Y227-Y231 HydrophobicContact CE2-CE2 3.36Å; Y227-Y231 HydrophobicContact CE2-CG 4.18Å; Y227-Y231 AromaticContact CG-CD2 3.79Å; Y227-Y231 HydrophobicContact CG-CD2 3.79Å; Y227-Y231 HydrophobicContact CG-CE2 4.27Å; Y227-Y231 AromaticContact CZ-CD2 3.53Å; Y227-Y231 AromaticContact CZ-CE2 3.87Å; Y227-Y231 AromaticContact CZ-CG 3.81Å; Y227-Y231 WeakPolarHBondContact O-CB 3.4Å; Y227-Y231 WeakPolarHBondContact O-CD2 3.3Å; Y227-Y231 PolarHBondContact O-N 3.38Å
228	D	88.9	Confident	90.8	Very high	64 Å²	64	49.5 Å²	49.5	34%	0.342	26%	0.257	S	S	.	.	H	α-helix	trans	-61.6	-41.9	175.9	-70.9	-28.8	0	0	0	111.6	K224 L225 L230 T232	K224-D228 PolarHBondContact O-N 3.42Å; L225-D228 PolarHBondContact O-N 2.81Å; D228-L230 PolarHBondContact O-N 3.19Å; D228-T232 VanDerWaalsContact O-CB 3.28Å; D228-T232 WeakPolarHBondContact O-CB 3.42Å; D228-T232 VanDerWaalsContact O-CG2 3.24Å; D228-T232 WeakPolarHBondContact O-CG2 3.3Å; D228-T232 PolarHBondContact O-N 2.79Å; D228-T232 VanDerWaalsContact O-N 3.13Å; D228-T232 PolarHBondContact O-OG1 3.28Å
229	L	91.8	Very high	91.1	Very high	2 Å²	2	46 Å²	46	1%	0.01	24%	0.238	C	C	.	.	H	α-helix	trans	-60.8	-41.5	173.8	-80	172	0	0	0	113.2	L172 I211 Y213 L225 L226 Y227 K236	L172-L229 HydrophobicContact CD2-CD1 3.96Å; L172-L229 HydrophobicContact CG-CD1 4.14Å; I211-L229 HydrophobicContact CB-CD2 4.42Å; I211-L229 HydrophobicContact CG2-CD2 3.83Å; Y213-L229 HydrophobicContact CD2-CD1 4.28Å; Y213-L229 HydrophobicContact CD2-CD2 3.95Å; Y213-L229 HydrophobicContact CD2-CG 3.83Å; Y213-L229 HydrophobicContact CE2-CD2 3.65Å; Y213-L229 HydrophobicContact CE2-CG 3.76Å; L225-L229 WeakPolarHBondContact O-CB 3.27Å; L225-L229 WeakPolarHBondContact O-CG 3.46Å; L225-L229 PolarHBondContact O-N 2.9Å; L226-L229 PolarHBondContact O-N 2.95Å; Y227-L229 PolarHBondContact O-N 3.23Å; L229-K236 WeakPolarHBondContact O-CD 3.32Å; L229-K236 WeakPolarHBondContact O-CE 3.33Å; L229-K236 PolarHBondContact O-NZ 3.35Å
230	L	91.9	Very high	91.5	Very high	11 Å²	11	43.4 Å²	43.4	6%	0.058	22%	0.221	C	C	.	.	H	α-helix	trans	-79.4	-40.3	-175.2	-70	171.6	0	0	0	113.2	L226 Y227 D228 W257 L259 Y498	L226-L230 HydrophobicContact CD1-CD1 3.86Å; L226-L230 HydrophobicContact CD1-CG 4.05Å; L226-L230 HydrophobicContact CG-CD1 3.85Å; L226-L230 HydrophobicContact CG-CG 4.41Å; L226-L230 WeakPolarHBondContact O-CB 3.4Å; L226-L230 VanDerWaalsContact O-CG 3.29Å; L226-L230 WeakPolarHBondContact O-CG 3.41Å; L226-L230 PolarHBondContact O-N 2.75Å; Y227-L230 PolarHBondContact O-N 2.65Å; D228-L230 PolarHBondContact O-N 3.19Å; L230-W257 HydrophobicContact CD1-CD2 3.87Å; L230-W257 HydrophobicContact CD1-CE3 3.96Å; L230-W257 HydrophobicContact CD1-CG 4.47Å; L230-W257 HydrophobicContact CD1-CH2 4.15Å; L230-W257 HydrophobicContact CD1-CZ2 4.03Å; L230-W257 HydrophobicContact CD1-CZ3 4.12Å; L230-W257 HydrophobicContact CD2-CD2 4.45Å; L230-W257 HydrophobicContact CD2-CG 4.23Å; L230-L259 HydrophobicContact CD2-CD1 3.43Å; L230-L259 VanDerWaalsContact CD2-CD1 3.43Å; L230-Y498 HydrophobicContact CD2-CE1 4.41Å; L230-Y498 WeakPolarHBondContact O-CE2 3.38Å; L230-Y498 PolarHBondContact O-OH 3.32Å
231	Y	88.7	Confident	91.8	Very high	136 Å²	136	41.3 Å²	41.3	53%	0.533	20%	0.199	S	C	.	.	H	α-helix	trans	-98.2	-3.1	-172.5	-70.5	-85.4	0	0	0	114.7	Y227 W257	Y227-Y231 AromaticContact CD1-CD2 3.9Å; Y227-Y231 HydrophobicContact CD1-CD2 3.9Å; Y227-Y231 HydrophobicContact CD1-CG 4.4Å; Y227-Y231 AromaticContact CD2-CD2 3.57Å; Y227-Y231 HydrophobicContact CD2-CD2 3.57Å; Y227-Y231 AromaticContact CD2-CE2 3.59Å; Y227-Y231 HydrophobicContact CD2-CE2 3.59Å; Y227-Y231 AromaticContact CE1-CD2 3.77Å; Y227-Y231 HydrophobicContact CE1-CD2 3.77Å; Y227-Y231 AromaticContact CE1-CG 3.94Å; Y227-Y231 HydrophobicContact CE1-CG 3.94Å; Y227-Y231 AromaticContact CE2-CD2 3.44Å; Y227-Y231 HydrophobicContact CE2-CD2 3.44Å; Y227-Y231 VanDerWaalsContact CE2-CD2 3.44Å; Y227-Y231 AromaticContact CE2-CE2 3.36Å; Y227-Y231 HydrophobicContact CE2-CE2 3.36Å; Y227-Y231 HydrophobicContact CE2-CG 4.18Å; Y227-Y231 AromaticContact CG-CD2 3.79Å; Y227-Y231 HydrophobicContact CG-CD2 3.79Å; Y227-Y231 HydrophobicContact CG-CE2 4.27Å; Y227-Y231 AromaticContact CZ-CD2 3.53Å; Y227-Y231 AromaticContact CZ-CE2 3.87Å; Y227-Y231 AromaticContact CZ-CG 3.81Å; Y227-Y231 WeakPolarHBondContact O-CB 3.4Å; Y227-Y231 WeakPolarHBondContact O-CD2 3.3Å; Y227-Y231 PolarHBondContact O-N 3.38Å; Y231-W257 HydrophobicContact CE2-CZ2 4.12Å
232	T	81.8	Confident	91.8	Very high	60 Å²	60	38.6 Å²	38.6	37%	0.368	19%	0.186	S	C	.	.	S	Bend	trans	-94	142.4	164.7	61.9	0	0	0	0	111.4	D228 P234 K236	D228-T232 VanDerWaalsContact O-CB 3.28Å; D228-T232 WeakPolarHBondContact O-CB 3.42Å; D228-T232 VanDerWaalsContact O-CG2 3.24Å; D228-T232 WeakPolarHBondContact O-CG2 3.3Å; D228-T232 PolarHBondContact O-N 2.79Å; D228-T232 VanDerWaalsContact O-N 3.13Å; D228-T232 PolarHBondContact O-OG1 3.28Å; T232-P234 VanDerWaalsContact O-O 3.1Å; T232-K236 PolarHBondContact O-NZ 3.42Å; T232-K236 PolarHBondContact OG1-NZ 3.36Å
233	E	77	Confident	91.6	Very high	69 Å²	69	38.8 Å²	38.8	32%	0.322	19%	0.188	S	C	.	.	S	Bend	trans	-69	154.2	161.7	-67.8	151.4	-172.3	0	0	110.1	S104 L105 E106	S104-E233 WeakPolarHBondContact CA-OE2 3.43Å; S104-E233 VanDerWaalsContact CB-CD 3.41Å; S104-E233 VanDerWaalsContact CB-OE1 3.25Å; S104-E233 WeakPolarHBondContact CB-OE1 3.45Å; S104-E233 WeakPolarHBondContact CB-OE2 3.36Å; S104-E233 VanDerWaalsContact OG-CD 3.25Å; S104-E233 PolarHBondContact OG-OE1 2.87Å; S104-E233 PolarHBondContact OG-OE2 2.94Å; L105-E233 WeakPolarHBondContact CA-OE2 3.3Å; L105-E233 PolarHBondContact N-OE2 3.01Å; E106-E233 PolarHBondContact N-OE1 3.35Å
234	P	86.6	Confident	91.5	Very high	41 Å²	41	36.2 Å²	36.2	27%	0.266	17%	0.172	S	C	.	.	S	Bend	cis	-72.4	169.1	-5.1	32	-36.5	0	0	0	112.2	Y168 I211 T232 K236	Y168-P234 HydrophobicContact CD1-CB 4.45Å; Y168-P234 HydrophobicContact CD1-CG 3.5Å; Y168-P234 HydrophobicContact CD2-CB 3.45Å; Y168-P234 VanDerWaalsContact CD2-CB 3.45Å; Y168-P234 HydrophobicContact CD2-CG 3.42Å; Y168-P234 VanDerWaalsContact CD2-CG 3.42Å; Y168-P234 HydrophobicContact CE1-CG 3.65Å; Y168-P234 HydrophobicContact CE2-CB 3.55Å; Y168-P234 HydrophobicContact CE2-CG 3.59Å; Y168-P234 HydrophobicContact CG-CB 3.93Å; Y168-P234 HydrophobicContact CG-CG 3.37Å; I211-P234 HydrophobicContact CD1-CG 3.68Å; T232-P234 VanDerWaalsContact O-O 3.1Å; P234-K236 WeakPolarHBondContact O-CD 3.35Å; P234-K236 WeakPolarHBondContact O-CE 3.29Å; P234-K236 PolarHBondContact O-NZ 2.91Å
235	I	88.4	Confident	91.3	Very high	64 Å²	64	32.6 Å²	32.6	33%	0.328	17%	0.167	S	C	.	.	P	Polyproline II helix	trans	-69.9	135.9	174.8	-61.7	176.3	0	0	0	109.5	F496 Y498	I235-F496 HydrophobicContact CG2-CD1 3.78Å; I235-F496 HydrophobicContact CG2-CE1 3.96Å; I235-Y498 HydrophobicContact CG2-CD1 4.43Å; I235-Y498 HydrophobicContact CG2-CE1 3.82Å; I235-Y498 HydrophobicContact CG2-CE2 4.47Å
236	K	93.9	Very high	91.3	Very high	1 Å²	1	31.9 Å²	31.9	0%	0.004	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	134.6	178.4	-70.8	59	165.2	-168.5	0	109	Y168 L229 T232 P234 L239 L259 F496 Y498	Y168-K236 CarbonylContact O-C 3.53Å; Y168-K236 VanDerWaalsContact O-CA 3.27Å; Y168-K236 WeakPolarHBondContact O-CA 3.38Å; L229-K236 WeakPolarHBondContact O-CD 3.32Å; L229-K236 WeakPolarHBondContact O-CE 3.33Å; L229-K236 PolarHBondContact O-NZ 3.35Å; T232-K236 PolarHBondContact O-NZ 3.42Å; T232-K236 PolarHBondContact OG1-NZ 3.36Å; P234-K236 WeakPolarHBondContact O-CD 3.35Å; P234-K236 WeakPolarHBondContact O-CE 3.29Å; P234-K236 PolarHBondContact O-NZ 2.91Å; K236-L239 HydrophobicContact CB-CD2 4.47Å; K236-L259 WeakPolarHBondContact O-CD2 3.38Å; K236-F496 WeakPolarHBondContact O-CE1 3.43Å; K236-Y498 PolarHBondContact N-OH 3.09Å
237	I	94.2	Very high	91.4	Very high	7 Å²	7	31.3 Å²	31.3	4%	0.036	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	-29.6	-178.5	-164.9	168.2	0	0	0	113.2	Y168 L259 L479 L493 F496 I507	Y168-I237 PolarHBondContact O-N 3.21Å; I237-L259 WeakPolarHBondContact O-CD2 3.39Å; I237-L479 HydrophobicContact CD1-CD2 3.95Å; I237-L493 HydrophobicContact CD1-CD2 4.16Å; I237-F496 HydrophobicContact CG1-CD1 4.33Å; I237-F496 HydrophobicContact CG1-CG 4.3Å; I237-I507 HydrophobicContact CD1-CD1 4.04Å; I237-I507 HydrophobicContact CG1-CD1 4.07Å
238	V	96.1	Very high	91.5	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	149.5	178.8	173.8	0	0	0	0	109.7	G170 I260 L262 L475	G170-V238 PolarHBondContact N-O 3.48Å; V238-I260 HydrophobicContact CG2-CB 4.16Å; V238-L262 HydrophobicContact CG1-CB 4.15Å; V238-L475 HydrophobicContact CB-CD1 4.34Å; V238-L475 HydrophobicContact CB-CD2 4.13Å; V238-L475 HydrophobicContact CG1-CD2 4.21Å; V238-L475 HydrophobicContact CG2-CD1 3.63Å; V238-L475 HydrophobicContact CG2-CD2 4.3Å
239	L	97.8	Very high	91.8	Very high	5 Å²	5	24.7 Å²	24.7	3%	0.026	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	135.8	172.3	-60.6	178.4	0	0	0	111.9	G170 L226 K236 P241 V250 L259 I260 V261 L262	G170-L239 CarbonylContact O-C 3.56Å; G170-L239 VanDerWaalsContact O-CA 3.27Å; G170-L239 WeakPolarHBondContact O-CA 3.46Å; L226-L239 HydrophobicContact CD1-CD1 3.7Å; K236-L239 HydrophobicContact CB-CD2 4.47Å; L239-P241 WeakPolarHBondContact O-CD 3.49Å; L239-V250 HydrophobicContact CB-CG1 4.09Å; L239-V250 HydrophobicContact CD1-CG1 3.78Å; L239-L259 HydrophobicContact CD1-CD1 3.92Å; L239-L259 HydrophobicContact CG-CD1 4.13Å; L239-I260 PolarHBondContact N-O 2.8Å; L239-V261 HydrophobicContact CB-CG2 4.42Å; L239-V261 CarbonylContact O-C 3.56Å; L239-V261 WeakPolarHBondContact O-CA 3.33Å; L239-L262 PolarHBondContact O-N 3.47Å
240	M	97.7	Very high	92	Very high	2 Å²	2	24.7 Å²	24.7	1%	0.01	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	85.5	-179.4	-66.6	-174.2	66.9	0	0	112.2	I169 G170 A171 L172 L262 Y264 A471 V472	I169-M240 HydrophobicContact CG2-CG 3.92Å; I169-M240 HydrophobicContact CG2-SD 3.78Å; G170-M240 PolarHBondContact O-N 3.23Å; A171-M240 WeakPolarHBondContact CA-O 3.31Å; A171-M240 HydrophobicContact CB-CB 4.11Å; L172-M240 PolarHBondContact N-O 3.31Å; M240-L262 WeakPolarHBondContact CA-O 3.42Å; M240-Y264 HydrophobicContact CE-CD1 4.49Å; M240-A471 HydrophobicContact CE-CB 3.64Å; M240-V472 HydrophobicContact CE-CG2 4.3Å
241	P	97.1	Very high	92.2	Very high	1 Å²	1	24.2 Å²	24.2	1%	0.006	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	141.1	175	33.4	-33.8	0	0	0	112.7	L239 V246 S247 V250 V261 S263	L239-P241 WeakPolarHBondContact O-CD 3.49Å; P241-V246 HydrophobicContact CB-CG1 4.08Å; P241-S247 WeakPolarHBondContact CG-OG 3.49Å; P241-S247 PolarHBondContact O-OG 3.39Å; P241-V250 HydrophobicContact CB-CB 4.37Å; P241-V250 HydrophobicContact CB-CG2 4.32Å; P241-V250 HydrophobicContact CG-CB 4.25Å; P241-V250 HydrophobicContact CG-CG1 4.17Å; P241-V261 HydrophobicContact CG-CG1 3.57Å; P241-S263 WeakPolarHBondContact O-CA 3.33Å; P241-S263 WeakPolarHBondContact O-CB 3.3Å; P241-S263 PolarHBondContact O-OG 2.82Å
242	G	93.3	Very high	92.4	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	12%	0.124	C	C	.	.			trans	-81.5	-84.5	174.6	0	0	0	0	0	113.8	L172 S247 S263 Y264 G265 S266	L172-G242 PolarHBondContact O-N 2.74Å; L172-G242 VanDerWaalsContact O-N 3.14Å; G242-S247 PolarHBondContact O-OG 3.49Å; G242-S263 PolarHBondContact O-OG 2.89Å; G242-Y264 VanDerWaalsContact CA-CE1 3.49Å; G242-Y264 VanDerWaalsContact CA-OH 3.3Å; G242-Y264 WeakPolarHBondContact CA-OH 3.27Å; G242-G265 CarbonylContact O-C 3.01Å; G242-S266 PolarHBondContact O-N 3Å
243	C	91.1	Very high	93	Very high	5 Å²	5	19.7 Å²	19.7	3%	0.034	12%	0.116	C	C	.	.	S	Bend	trans	-55.3	150.3	-173.2	-86.5	0	0	0	0	114.1	C217 V246 S247	C217-C243 HydrophobicContact CB-CB 4.04Å; C217-C243 WeakPolarHBondContact CB-SG 3.43Å; C217-C243 WeakPolarHBondContact SG-CB 3.45Å; C217-C243 CovalentContact SG-SG 2.03Å; C217-C243 PolarHBondContact SG-SG 3.26Å; C243-V246 HydrophobicContact CB-CB 4.39Å; C243-V246 HydrophobicContact CB-CG2 4.25Å; C243-V246 PolarHBondContact O-N 3.47Å; C243-S247 WeakPolarHBondContact O-CB 3.3Å; C243-S247 PolarHBondContact O-N 3.17Å; C243-S247 PolarHBondContact O-OG 2.96Å
244	S	91.7	Very high	93.9	Very high	16 Å²	16	16.5 Å²	16.5	11%	0.112	10%	0.101	C	C	.	.	H	α-helix	trans	-62	-47.2	-178.8	-70.5	0	0	0	0	114.6	V246 S247 T248 S266 S267 S268	S244-V246 VanDerWaalsContact C-N 3.32Å; S244-V246 PolarHBondContact O-N 2.91Å; S244-S247 PolarHBondContact O-N 3.42Å; S244-S247 VanDerWaalsContact O-N 3.11Å; S244-T248 PolarHBondContact O-N 3.08Å; S244-T248 PolarHBondContact O-OG1 3Å; S244-S266 VanDerWaalsContact CA-OG 3.27Å; S244-S266 WeakPolarHBondContact CA-OG 3.24Å; S244-S266 WeakPolarHBondContact CB-OG 3.29Å; S244-S266 PolarHBondContact OG-OG 2.88Å; S244-S267 PolarHBondContact OG-N 3.31Å; S244-S268 PolarHBondContact OG-N 2.8Å
245	G	89.3	Confident	94	Very high	35 Å²	35	20.7 Å²	20.7	36%	0.361	11%	0.111	S	C	.	.	H	α-helix	trans	-61.1	-40.4	178.4	0	0	0	0	0	113	L249	G245-L249 PolarHBondContact O-N 3.39Å
246	V	94.1	Very high	94.2	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-65.7	-40.9	173.4	177	0	0	0	0	111.3	L172 A222 P241 C243 S244 L249 V250	L172-V246 HydrophobicContact CB-CG1 4.36Å; L172-V246 HydrophobicContact CD1-CG1 3.82Å; A222-V246 HydrophobicContact CB-CB 4.3Å; A222-V246 HydrophobicContact CB-CG1 3.73Å; A222-V246 HydrophobicContact CB-CG2 3.75Å; P241-V246 HydrophobicContact CB-CG1 4.08Å; C243-V246 HydrophobicContact CB-CB 4.39Å; C243-V246 HydrophobicContact CB-CG2 4.25Å; C243-V246 PolarHBondContact O-N 3.47Å; S244-V246 VanDerWaalsContact C-N 3.32Å; S244-V246 PolarHBondContact O-N 2.91Å; V246-L249 PolarHBondContact O-N 3.03Å; V246-V250 HydrophobicContact CG1-CG2 4.14Å; V246-V250 WeakPolarHBondContact O-CB 3.45Å; V246-V250 WeakPolarHBondContact O-CG2 3.44Å; V246-V250 PolarHBondContact O-N 3.35Å
247	S	95.6	Very high	94.3	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-67.5	-40.5	179.6	-60.9	0	0	0	0	112.5	P241 G242 C243 S244 V250 A251 S263	P241-S247 WeakPolarHBondContact CG-OG 3.49Å; P241-S247 PolarHBondContact O-OG 3.39Å; G242-S247 PolarHBondContact O-OG 3.49Å; C243-S247 WeakPolarHBondContact O-CB 3.3Å; C243-S247 PolarHBondContact O-N 3.17Å; C243-S247 PolarHBondContact O-OG 2.96Å; S244-S247 PolarHBondContact O-N 3.42Å; S244-S247 VanDerWaalsContact O-N 3.11Å; S247-V250 PolarHBondContact O-N 3.14Å; S247-A251 WeakPolarHBondContact O-CB 3.44Å; S247-A251 PolarHBondContact O-N 3.32Å; S247-S263 PolarHBondContact OG-OG 2.98Å
248	T	94.2	Very high	94.3	Very high	13 Å²	13	27.6 Å²	27.6	8%	0.08	14%	0.142	C	C	.	.	H	α-helix	trans	-56	-51.9	171.7	-62.2	0	0	0	0	111	S244 E252 F277	S244-T248 PolarHBondContact O-N 3.08Å; S244-T248 PolarHBondContact O-OG1 3Å; T248-E252 WeakPolarHBondContact O-CB 3.2Å; T248-E252 PolarHBondContact O-N 3.15Å; T248-F277 HydrophobicContact CG2-CE1 4.37Å; T248-F277 HydrophobicContact CG2-CZ 4.03Å
249	L	95.1	Very high	94.3	Very high	50 Å²	50	27.6 Å²	27.6	26%	0.262	14%	0.142	S	C	.	.	H	α-helix	trans	-58.4	-52.1	177.4	171.6	70.4	0	0	0	112.3	P219 A222 T223 G245 V246 A251 E252 A253	P219-L249 HydrophobicContact CB-CD2 4.35Å; P219-L249 VanDerWaalsContact O-CD2 3.3Å; P219-L249 WeakPolarHBondContact O-CD2 3.38Å; A222-L249 HydrophobicContact CB-CD2 4.49Å; T223-L249 VanDerWaalsContact OG1-CD2 3.26Å; T223-L249 WeakPolarHBondContact OG1-CD2 3.22Å; G245-L249 PolarHBondContact O-N 3.39Å; V246-L249 PolarHBondContact O-N 3.03Å; L249-A251 PolarHBondContact O-N 3.26Å; L249-E252 PolarHBondContact O-N 2.86Å; L249-A253 WeakPolarHBondContact O-CB 3.42Å; L249-A253 PolarHBondContact O-N 3.06Å; L249-A253 VanDerWaalsContact O-N 3.09Å
250	V	96.3	Very high	94.2	Very high	2 Å²	2	27.4 Å²	27.4	1%	0.012	14%	0.141	C	C	.	.	H	α-helix	trans	-65.1	-41.1	-176.5	172.1	0	0	0	0	111.1	L172 L226 L239 P241 V246 S247 A253 A254 V261	L172-V250 HydrophobicContact CD1-CG2 3.99Å; L226-V250 HydrophobicContact CD1-CG1 4.45Å; L226-V250 HydrophobicContact CD1-CG2 4.37Å; L226-V250 HydrophobicContact CD2-CG2 4.15Å; L239-V250 HydrophobicContact CB-CG1 4.09Å; L239-V250 HydrophobicContact CD1-CG1 3.78Å; P241-V250 HydrophobicContact CB-CB 4.37Å; P241-V250 HydrophobicContact CB-CG2 4.32Å; P241-V250 HydrophobicContact CG-CB 4.25Å; P241-V250 HydrophobicContact CG-CG1 4.17Å; V246-V250 HydrophobicContact CG1-CG2 4.14Å; V246-V250 WeakPolarHBondContact O-CB 3.45Å; V246-V250 WeakPolarHBondContact O-CG2 3.44Å; V246-V250 PolarHBondContact O-N 3.35Å; S247-V250 PolarHBondContact O-N 3.14Å; V250-A253 PolarHBondContact O-N 3.35Å; V250-A254 WeakPolarHBondContact O-CB 3.25Å; V250-A254 PolarHBondContact O-N 3.43Å; V250-V261 HydrophobicContact CG1-CG1 3.98Å; V250-V261 HydrophobicContact CG1-CG2 4.05Å
251	A	95.8	Very high	94.2	Very high	1 Å²	1	27.3 Å²	27.3	1%	0.008	14%	0.141	C	C	.	.	H	α-helix	trans	-68.4	-37.5	178.9	0	0	0	0	0	113.1	S247 L249 V261 L271 F277 F280	S247-A251 WeakPolarHBondContact O-CB 3.44Å; S247-A251 PolarHBondContact O-N 3.32Å; L249-A251 PolarHBondContact O-N 3.26Å; A251-V261 HydrophobicContact CB-CG1 4.47Å; A251-L271 HydrophobicContact CB-CD2 3.95Å; A251-F277 HydrophobicContact CB-CD1 3.51Å; A251-F277 HydrophobicContact CB-CE1 4.08Å; A251-F277 HydrophobicContact CB-CG 4.35Å; A251-F280 HydrophobicContact CB-CB 4.29Å; A251-F280 HydrophobicContact CB-CD2 3.72Å; A251-F280 HydrophobicContact CB-CE2 4.46Å; A251-F280 HydrophobicContact CB-CG 4.28Å
252	E	94.4	Very high	94.3	Very high	77 Å²	77	27.3 Å²	27.3	36%	0.36	14%	0.141	S	C	.	.	H	α-helix	trans	-69.9	-33.8	176.6	-172.8	149.3	-125.8	0	0	112.5	T248 L249 R255 R276 F277	T248-E252 WeakPolarHBondContact O-CB 3.2Å; T248-E252 PolarHBondContact O-N 3.15Å; L249-E252 PolarHBondContact O-N 2.86Å; E252-R255 WeakPolarHBondContact O-CG 3.4Å; E252-R255 PolarHBondContact O-NE 2.93Å; E252-R276 IonicContact OE1-CZ 3.88Å; E252-R276 IonicContact OE1-NE 2.75Å; E252-R276 PolarHBondContact OE1-NE 3.17Å; E252-R276 IonicContact OE1-NH2 2.75Å; E252-R276 PolarHBondContact OE1-NH2 3.05Å; E252-R276 IonicContact OE2-CZ 3.81Å; E252-R276 IonicContact OE2-NE 3.81Å; E252-R276 IonicContact OE2-NH2 2.7Å; E252-R276 PolarHBondContact OE2-NH2 2.86Å; E252-F277 HydrophobicContact CB-CE1 4.01Å
253	A	94.4	Very high	94.5	Very high	24 Å²	24	27.3 Å²	27.3	20%	0.198	14%	0.141	C	C	.	.	H	α-helix	trans	-76.6	-45.7	176.1	0	0	0	0	0	112.9	L226 L249 V250 R255 M256 W257	L226-A253 HydrophobicContact CD2-CB 4.1Å; L249-A253 WeakPolarHBondContact O-CB 3.42Å; L249-A253 PolarHBondContact O-N 3.06Å; L249-A253 VanDerWaalsContact O-N 3.09Å; V250-A253 PolarHBondContact O-N 3.35Å; A253-R255 PolarHBondContact O-N 2.62Å; A253-M256 WeakPolarHBondContact O-CB 3.42Å; A253-M256 PolarHBondContact O-N 3.32Å; A253-W257 HydrophobicContact CB-CZ3 4.15Å; A253-W257 VanDerWaalsContact O-CE3 3.3Å; A253-W257 WeakPolarHBondContact O-CZ3 3.21Å
254	A	93.9	Very high	94.7	Very high	2 Å²	2	27 Å²	27	2%	0.017	14%	0.139	C	C	.	.	H	α-helix	trans	-56.1	-29.3	-168.3	0	0	0	0	0	115.1	V250 M256 W257 N258 L259 V261	V250-A254 WeakPolarHBondContact O-CB 3.25Å; V250-A254 PolarHBondContact O-N 3.43Å; A254-M256 PolarHBondContact O-N 3Å; A254-M256 VanDerWaalsContact O-N 3.16Å; A254-W257 CarbonylContact O-C 3.57Å; A254-W257 PolarHBondContact O-N 3.33Å; A254-N258 PolarHBondContact O-N 3.43Å; A254-L259 HydrophobicContact CB-CB 3.98Å; A254-L259 PolarHBondContact O-N 3.49Å; A254-V261 HydrophobicContact CB-CG2 3.28Å
255	R	90.3	Very high	94.7	Very high	129 Å²	129	26.7 Å²	26.7	49%	0.487	14%	0.138	S	C	.	.	G	3₁₀ helix	trans	-57.4	-25.9	174.5	71.3	-176.7	-176.9	77.8	3.9	113.5	E252 A253 W257 P278	E252-R255 WeakPolarHBondContact O-CG 3.4Å; E252-R255 PolarHBondContact O-NE 2.93Å; A253-R255 PolarHBondContact O-N 2.62Å; R255-W257 VanDerWaalsContact C-N 3.31Å; R255-P278 HydrophobicContact CB-CG 4.27Å
256	M	92.6	Very high	94.9	Very high	119 Å²	119	25 Å²	25	59%	0.586	12%	0.121	S	C	*	.	G	3₁₀ helix	trans	-76.8	-17.3	178.1	-59.6	-60.2	-60.7	0	0	113.2	A253 A254	A253-M256 WeakPolarHBondContact O-CB 3.42Å; A253-M256 PolarHBondContact O-N 3.32Å; A254-M256 PolarHBondContact O-N 3Å; A254-M256 VanDerWaalsContact O-N 3.16Å
257	W	94.6	Very high	94.8	Very high	62 Å²	62	25.9 Å²	25.9	24%	0.235	13%	0.127	C	C	.	.	G	3₁₀ helix	trans	-113.3	15.5	176.8	-70.2	-92.3	0	0	0	112.2	L230 Y231 A253 A254 R255 L259 Y498	L230-W257 HydrophobicContact CD1-CD2 3.87Å; L230-W257 HydrophobicContact CD1-CE3 3.96Å; L230-W257 HydrophobicContact CD1-CG 4.47Å; L230-W257 HydrophobicContact CD1-CH2 4.15Å; L230-W257 HydrophobicContact CD1-CZ2 4.03Å; L230-W257 HydrophobicContact CD1-CZ3 4.12Å; L230-W257 HydrophobicContact CD2-CD2 4.45Å; L230-W257 HydrophobicContact CD2-CG 4.23Å; Y231-W257 HydrophobicContact CE2-CZ2 4.12Å; A253-W257 HydrophobicContact CB-CZ3 4.15Å; A253-W257 VanDerWaalsContact O-CE3 3.3Å; A253-W257 WeakPolarHBondContact O-CZ3 3.21Å; A254-W257 CarbonylContact O-C 3.57Å; A254-W257 PolarHBondContact O-N 3.33Å; R255-W257 VanDerWaalsContact C-N 3.31Å; W257-L259 HydrophobicContact CB-CD1 3.91Å; W257-L259 HydrophobicContact CB-CG 4.18Å; W257-L259 PolarHBondContact O-N 3.01Å; W257-L259 VanDerWaalsContact O-N 3.15Å; W257-Y498 CarbonylContact C-O 3.47Å; W257-Y498 HydrophobicContact CB-CD1 4.11Å; W257-Y498 HydrophobicContact CB-CG 4.07Å; W257-Y498 AromaticContact CD1-CD2 3.79Å; W257-Y498 AromaticContact CD1-CG 3.78Å; W257-Y498 HydrophobicContact CG-CG 4.34Å; W257-Y498 CarbonylContact O-C 3.58Å; W257-Y498 VanDerWaalsContact O-CA 3.28Å; W257-Y498 WeakPolarHBondContact O-CA 3.42Å; W257-Y498 WeakPolarHBondContact O-CB 3.28Å; W257-Y498 VanDerWaalsContact O-O 3.06Å
258	N	94.9	Very high	94.6	Very high	36 Å²	36	25.9 Å²	25.9	19%	0.193	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	49.4	36.2	-174.3	-63.1	-81	0	0	0	113.3	A254 Y498 H501 T504	A254-N258 PolarHBondContact O-N 3.43Å; N258-Y498 PolarHBondContact ND2-O 3.42Å; N258-H501 PolarHBondContact OD1-CD2 3.02Å; N258-T504 WeakPolarHBondContact O-CB 3.31Å; N258-T504 WeakPolarHBondContact O-CG2 3.44Å; N258-T504 PolarHBondContact O-OG1 2.75Å
259	L	95.8	Very high	94.5	Very high	0 Å²	0	26 Å²	26	0%	0	13%	0.128	C	C	.	.			trans	-94.8	141.4	-176.8	-79.5	167.5	0	0	0	112.8	L230 K236 I237 L239 A254 W257 T279 F496 Y498	L230-L259 HydrophobicContact CD2-CD1 3.43Å; L230-L259 VanDerWaalsContact CD2-CD1 3.43Å; K236-L259 WeakPolarHBondContact O-CD2 3.38Å; I237-L259 WeakPolarHBondContact O-CD2 3.39Å; L239-L259 HydrophobicContact CD1-CD1 3.92Å; L239-L259 HydrophobicContact CG-CD1 4.13Å; A254-L259 HydrophobicContact CB-CB 3.98Å; A254-L259 PolarHBondContact O-N 3.49Å; W257-L259 HydrophobicContact CB-CD1 3.91Å; W257-L259 HydrophobicContact CB-CG 4.18Å; W257-L259 PolarHBondContact O-N 3.01Å; W257-L259 VanDerWaalsContact O-N 3.15Å; L259-T279 WeakPolarHBondContact O-CB 3.2Å; L259-T279 PolarHBondContact O-OG1 3.25Å; L259-F496 HydrophobicContact CD2-CE1 4.01Å; L259-F496 HydrophobicContact CD2-CZ 3.81Å; L259-Y498 HydrophobicContact CD1-CD1 4.04Å; L259-Y498 HydrophobicContact CD1-CE1 3.84Å; L259-Y498 HydrophobicContact CD2-CD1 4.25Å; L259-Y498 HydrophobicContact CD2-CE1 4.11Å; L259-Y498 HydrophobicContact CG-CD1 4.1Å; L259-Y498 HydrophobicContact CG-CE1 4.22Å
260	I	96.7	Very high	94.2	Very high	2 Å²	2	24.9 Å²	24.9	1%	0.01	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	139	164	-55.8	-58.9	0	0	0	108.9	V238 L239 T279 F281 T504 I507 Y508 L511	V238-I260 HydrophobicContact CG2-CB 4.16Å; L239-I260 PolarHBondContact N-O 2.8Å; I260-T279 HydrophobicContact CD1-CG2 4.2Å; I260-F281 HydrophobicContact CG2-CD2 4.3Å; I260-T504 HydrophobicContact CD1-CG2 3.56Å; I260-T504 HydrophobicContact CG1-CG2 4.02Å; I260-I507 HydrophobicContact CG1-CB 4.31Å; I260-I507 HydrophobicContact CG1-CG2 3.92Å; I260-Y508 HydrophobicContact CD1-CD2 4.42Å; I260-L511 HydrophobicContact CG2-CD1 3.68Å
261	V	97.9	Very high	94.1	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	117.9	175.2	-177.4	0	0	0	0	108.7	L239 P241 V250 A251 A254 T279 F280 F281	L239-V261 HydrophobicContact CB-CG2 4.42Å; L239-V261 CarbonylContact O-C 3.56Å; L239-V261 WeakPolarHBondContact O-CA 3.33Å; P241-V261 HydrophobicContact CG-CG1 3.57Å; V250-V261 HydrophobicContact CG1-CG1 3.98Å; V250-V261 HydrophobicContact CG1-CG2 4.05Å; A251-V261 HydrophobicContact CB-CG1 4.47Å; A254-V261 HydrophobicContact CB-CG2 3.28Å; V261-T279 PolarHBondContact N-O 3.39Å; V261-F280 HydrophobicContact CB-CD2 4.09Å; V261-F280 HydrophobicContact CG1-CD2 3.88Å; V261-F280 HydrophobicContact CG1-CE2 4.2Å; V261-F280 CarbonylContact O-C 3.4Å; V261-F280 WeakPolarHBondContact O-CA 3.21Å; V261-F281 PolarHBondContact O-N 3.21Å
262	L	97.6	Very high	93.9	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	92.8	-180	-179	58.8	0	0	0	109.7	V238 L239 M240 F281 A471 L475 F525	V238-L262 HydrophobicContact CG1-CB 4.15Å; L239-L262 PolarHBondContact O-N 3.47Å; M240-L262 WeakPolarHBondContact CA-O 3.42Å; L262-F281 CarbonylContact C-O 3.55Å; L262-F281 WeakPolarHBondContact CA-O 3.38Å; L262-F281 HydrophobicContact CD1-CB 3.75Å; L262-A471 HydrophobicContact CD2-CB 4.11Å; L262-A471 VanDerWaalsContact CD2-O 3.28Å; L262-A471 WeakPolarHBondContact CD2-O 3.33Å; L262-A471 HydrophobicContact CG-CB 4.24Å; L262-L475 HydrophobicContact CD2-CB 4.09Å; L262-F525 HydrophobicContact CD1-CE1 4.46Å; L262-F525 HydrophobicContact CD1-CZ 4.22Å
263	S	97.7	Very high	93.7	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	133.5	178.6	-178.7	0	0	0	0	111.5	P241 G242 S247 G265 S266 F281 R282 T283	P241-S263 WeakPolarHBondContact O-CA 3.33Å; P241-S263 WeakPolarHBondContact O-CB 3.3Å; P241-S263 PolarHBondContact O-OG 2.82Å; G242-S263 PolarHBondContact O-OG 2.89Å; S247-S263 PolarHBondContact OG-OG 2.98Å; S263-G265 PolarHBondContact OG-N 3.33Å; S263-S266 VanDerWaalsContact OG-CB 3.24Å; S263-S266 WeakPolarHBondContact OG-CB 3.48Å; S263-S266 PolarHBondContact OG-N 3.41Å; S263-S266 VanDerWaalsContact OG-N 3.09Å; S263-F281 PolarHBondContact N-O 2.81Å; S263-R282 WeakPolarHBondContact O-CA 3.38Å; S263-R282 VanDerWaalsContact O-CB 3.31Å; S263-R282 WeakPolarHBondContact O-CB 3.45Å; S263-T283 PolarHBondContact O-N 3.42Å; S263-T283 VanDerWaalsContact O-N 3.13Å
264	Y	95.4	Very high	93.6	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	13%	0.132	C	C	.	.	S	Bend	trans	-94.8	-12	176.1	66.6	-90.4	0	0	0	113.3	F173 P174 W179 C185 M240 G242 L467 A468	F173-Y264 AromaticContact CD1-CE1 3.81Å; F173-Y264 HydrophobicContact CD1-CE1 3.81Å; F173-Y264 HydrophobicContact CD1-CE2 4.3Å; F173-Y264 AromaticContact CD1-CZ 3.51Å; F173-Y264 WeakPolarHBondContact CD1-OH 3.43Å; F173-Y264 HydrophobicContact CE1-CD1 4.38Å; F173-Y264 AromaticContact CE1-CE1 3.74Å; F173-Y264 HydrophobicContact CE1-CE1 3.74Å; F173-Y264 HydrophobicContact CE1-CE2 4.44Å; F173-Y264 AromaticContact CE1-CZ 3.8Å; P174-Y264 VanDerWaalsContact CD-OH 3.23Å; P174-Y264 WeakPolarHBondContact CD-OH 3.35Å; W179-Y264 AromaticContact CH2-CE2 3.83Å; W179-Y264 HydrophobicContact CH2-CE2 3.83Å; W179-Y264 HydrophobicContact CZ3-CE2 4.27Å; C185-Y264 HydrophobicContact CB-CD2 3.91Å; C185-Y264 HydrophobicContact CB-CE2 3.41Å; C185-Y264 VanDerWaalsContact CB-CE2 3.41Å; C185-Y264 VanDerWaalsContact SG-CE2 3.56Å; M240-Y264 HydrophobicContact CE-CD1 4.49Å; G242-Y264 VanDerWaalsContact CA-CE1 3.49Å; G242-Y264 VanDerWaalsContact CA-OH 3.3Å; G242-Y264 WeakPolarHBondContact CA-OH 3.27Å; Y264-L467 WeakPolarHBondContact O-CB 3.22Å; Y264-A468 HydrophobicContact CD2-CB 3.86Å; Y264-A468 HydrophobicContact CG-CB 4.02Å
265	G	92.6	Very high	93.5	Very high	9 Å²	9	35.7 Å²	35.7	9%	0.093	17%	0.173	C	C	.	.	S	Bend	trans	-135.1	-1	-169	0	0	0	0	0	116.3	G242 S263	G242-G265 CarbonylContact O-C 3.01Å; S263-G265 PolarHBondContact OG-N 3.33Å
266	S	93.4	Very high	93.6	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	17%	0.165	C	C	.	.			trans	-91.1	112.3	-175.2	-175.8	0	0	0	0	114.5	G242 S244 S263 L271 R282	G242-S266 PolarHBondContact O-N 3Å; S244-S266 VanDerWaalsContact CA-OG 3.27Å; S244-S266 WeakPolarHBondContact CA-OG 3.24Å; S244-S266 WeakPolarHBondContact CB-OG 3.29Å; S244-S266 PolarHBondContact OG-OG 2.88Å; S263-S266 VanDerWaalsContact OG-CB 3.24Å; S263-S266 WeakPolarHBondContact OG-CB 3.48Å; S263-S266 PolarHBondContact OG-N 3.41Å; S263-S266 VanDerWaalsContact OG-N 3.09Å; S266-L271 WeakPolarHBondContact OG-CD1 3.44Å; S266-R282 WeakPolarHBondContact O-CD 3.39Å; S266-R282 PolarHBondContact O-NH1 3.45Å
267	S	91.9	Very high	93.7	Very high	18 Å²	18	27.9 Å²	27.9	13%	0.126	14%	0.138	C	C	.	.			trans	-85.5	-8.2	176.4	59	0	0	0	0	115.9	S244 P269 R282 A287	S244-S267 PolarHBondContact OG-N 3.31Å; S267-P269 WeakPolarHBondContact O-CD 3.31Å; S267-R282 VanDerWaalsContact C-NH1 3.3Å; S267-A287 WeakPolarHBondContact O-CB 3.4Å; S267-A287 PolarHBondContact O-N 2.95Å
268	S	91.4	Very high	93.7	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	14%	0.143	C	C	.	.			trans	-59.5	124.4	-168.4	-171.6	0	0	0	0	113.4	S244 A270 L271 R282	S244-S268 PolarHBondContact OG-N 2.8Å; S268-A270 VanDerWaalsContact C-N 3.25Å; S268-A270 PolarHBondContact O-N 3.32Å; S268-L271 PolarHBondContact O-N 3.44Å; S268-R282 PolarHBondContact O-NH1 3.1Å; S268-R282 PolarHBondContact O-NH2 2.89Å; S268-R282 VanDerWaalsContact O-NH2 3.13Å
269	P	91.6	Very high	93.7	Very high	16 Å²	16	26.7 Å²	26.7	10%	0.104	14%	0.139	C	C	.	.	G	3₁₀ helix	trans	-58.3	-34.2	175.3	-28.2	36.4	0	0	0	114	S267 L271 S272 A287 T288 S318 T319	S267-P269 WeakPolarHBondContact O-CD 3.31Å; P269-L271 PolarHBondContact O-N 2.92Å; P269-L271 VanDerWaalsContact O-N 3.13Å; P269-S272 WeakPolarHBondContact O-CB 3.01Å; P269-S272 PolarHBondContact O-N 3.4Å; P269-A287 HydrophobicContact CG-CB 4.23Å; P269-T288 HydrophobicContact CB-CG2 3.74Å; P269-T288 HydrophobicContact CG-CG2 3.81Å; P269-S318 WeakPolarHBondContact CB-OG 3.21Å; P269-S318 WeakPolarHBondContact CD-OG 3.46Å; P269-S318 WeakPolarHBondContact CG-OG 3.31Å; P269-T319 WeakPolarHBondContact CG-OG1 3.37Å
270	A	89.8	Confident	93.8	Very high	25 Å²	25	26.7 Å²	26.7	21%	0.207	14%	0.139	C	C	.	.	G	3₁₀ helix	trans	-56.6	-32.3	-178	0	0	0	0	0	113.3	S268 S272 N273 F277 E314	S268-A270 VanDerWaalsContact C-N 3.25Å; S268-A270 PolarHBondContact O-N 3.32Å; A270-S272 PolarHBondContact O-N 2.95Å; A270-N273 WeakPolarHBondContact O-CB 3.04Å; A270-N273 PolarHBondContact O-N 3.31Å; A270-N273 VanDerWaalsContact O-N 3.17Å; A270-F277 VanDerWaalsContact O-CE2 3.29Å; A270-F277 WeakPolarHBondContact O-CE2 3.45Å; A270-E314 HydrophobicContact CB-CG 4.33Å
271	L	92.4	Very high	93.8	Very high	1 Å²	1	26.6 Å²	26.6	1%	0.005	14%	0.139	C	C	.	.	G	3₁₀ helix	trans	-67.1	-15.7	179.3	-81	163.4	0	0	0	114.4	A251 S266 S268 P269 N273 F277 F280	A251-L271 HydrophobicContact CB-CD2 3.95Å; S266-L271 WeakPolarHBondContact OG-CD1 3.44Å; S268-L271 PolarHBondContact O-N 3.44Å; P269-L271 PolarHBondContact O-N 2.92Å; P269-L271 VanDerWaalsContact O-N 3.13Å; L271-N273 PolarHBondContact O-N 3.06Å; L271-F277 HydrophobicContact CD2-CD1 3.92Å; L271-F277 HydrophobicContact CD2-CD2 4.09Å; L271-F277 HydrophobicContact CD2-CE1 3.91Å; L271-F277 HydrophobicContact CD2-CE2 4.11Å; L271-F277 HydrophobicContact CD2-CG 3.98Å; L271-F277 HydrophobicContact CD2-CZ 4Å; L271-F280 HydrophobicContact CB-CD1 4.15Å; L271-F280 HydrophobicContact CB-CE1 3.71Å; L271-F280 HydrophobicContact CB-CZ 4.12Å; L271-F280 HydrophobicContact CD1-CE1 4.24Å; L271-F280 HydrophobicContact CD1-CE2 4.27Å; L271-F280 HydrophobicContact CD1-CZ 3.77Å; L271-F280 HydrophobicContact CD2-CD1 4.29Å; L271-F280 HydrophobicContact CD2-CD2 4.14Å; L271-F280 HydrophobicContact CD2-CE1 4.18Å; L271-F280 HydrophobicContact CD2-CE2 4.01Å; L271-F280 HydrophobicContact CD2-CG 4.28Å; L271-F280 HydrophobicContact CD2-CZ 4.04Å; L271-F280 HydrophobicContact CG-CE1 4.27Å; L271-F280 HydrophobicContact CG-CZ 4.21Å
272	S	91.6	Very high	93.7	Very high	16 Å²	16	26.6 Å²	26.6	11%	0.112	14%	0.139	C	C	.	.	G	3₁₀ helix	trans	-69.6	-10.4	171.8	-80.7	0	0	0	0	113.8	P269 A270 R274 R282 Q528 S530	P269-S272 WeakPolarHBondContact O-CB 3.01Å; P269-S272 PolarHBondContact O-N 3.4Å; A270-S272 PolarHBondContact O-N 2.95Å; S272-R274 PolarHBondContact O-N 2.97Å; S272-R282 PolarHBondContact OG-NH2 3.28Å; S272-Q528 PolarHBondContact OG-OE1 3.03Å; S272-S530 PolarHBondContact OG-OG 2.97Å
273	N	91.7	Very high	93.6	Very high	77 Å²	77	26.6 Å²	26.6	41%	0.412	14%	0.139	S	C	.	.			trans	-74.4	92	179.2	-174.8	-13.1	0	0	0	111.8	A270 L271 Q275 R276 F277	A270-N273 WeakPolarHBondContact O-CB 3.04Å; A270-N273 PolarHBondContact O-N 3.31Å; A270-N273 VanDerWaalsContact O-N 3.17Å; L271-N273 PolarHBondContact O-N 3.06Å; N273-Q275 PolarHBondContact O-N 3.13Å; N273-Q275 VanDerWaalsContact O-N 3.09Å; N273-Q275 WeakPolarHBondContact OD1-CB 3.42Å; N273-Q275 PolarHBondContact OD1-N 3.49Å; N273-R276 HydrophobicContact CB-CB 4.46Å; N273-R276 PolarHBondContact O-N 3.02Å; N273-F277 HydrophobicContact CB-CD2 4.39Å; N273-F277 WeakPolarHBondContact O-CD2 3.37Å; N273-F277 PolarHBondContact O-N 3.27Å
274	R	91.1	Very high	93.3	Very high	51 Å²	51	27.3 Å²	27.3	19%	0.192	14%	0.142	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.6	-22.9	176.5	-70.2	-57.9	-153.1	-178.3	1	115.6	S272 P278 F280 Y508 A527 Q528 G529	S272-R274 PolarHBondContact O-N 2.97Å; R274-P278 WeakPolarHBondContact O-CA 3.38Å; R274-F280 PolarHBondContact NH1-O 2.98Å; R274-Y508 PolarHBondContact NH2-OH 3.39Å; R274-A527 PolarHBondContact NE-O 3.12Å; R274-Q528 VanDerWaalsContact CZ-C 3.48Å; R274-Q528 VanDerWaalsContact NE-C 3.3Å; R274-Q528 PolarHBondContact NE-O 3.2Å; R274-G529 VanDerWaalsContact NH2-N 3.17Å
275	Q	91.7	Very high	93.2	Very high	188 Å²	188	27.4 Å²	27.4	88%	0.879	14%	0.142	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.9	-33.6	176.5	-60.8	-178.2	-7.7	0	0	112	N273	N273-Q275 PolarHBondContact O-N 3.13Å; N273-Q275 VanDerWaalsContact O-N 3.09Å; N273-Q275 WeakPolarHBondContact OD1-CB 3.42Å; N273-Q275 PolarHBondContact OD1-N 3.49Å
276	R	93.3	Very high	93.1	Very high	84 Å²	84	27.3 Å²	27.3	32%	0.317	14%	0.141	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.7	-34.8	176	-171.9	175.3	175.2	-148.8	-5.6	111.8	E252 N273 P278	E252-R276 IonicContact OE1-CZ 3.88Å; E252-R276 IonicContact OE1-NE 2.75Å; E252-R276 PolarHBondContact OE1-NE 3.17Å; E252-R276 IonicContact OE1-NH2 2.75Å; E252-R276 PolarHBondContact OE1-NH2 3.05Å; E252-R276 IonicContact OE2-CZ 3.81Å; E252-R276 IonicContact OE2-NE 3.81Å; E252-R276 IonicContact OE2-NH2 2.7Å; E252-R276 PolarHBondContact OE2-NH2 2.86Å; N273-R276 HydrophobicContact CB-CB 4.46Å; N273-R276 PolarHBondContact O-N 3.02Å; R276-P278 VanDerWaalsContact C-CD 3.47Å; R276-P278 WeakPolarHBondContact O-CD 3.48Å
277	F	95.2	Very high	93.1	Very high	1 Å²	1	27.8 Å²	27.8	0%	0.004	15%	0.145	C	C	.	.			trans	-124.1	67.2	-173.5	-50.8	-69.2	0	0	0	112	T248 A251 E252 A270 L271 N273 T279 F280	T248-F277 HydrophobicContact CG2-CE1 4.37Å; T248-F277 HydrophobicContact CG2-CZ 4.03Å; A251-F277 HydrophobicContact CB-CD1 3.51Å; A251-F277 HydrophobicContact CB-CE1 4.08Å; A251-F277 HydrophobicContact CB-CG 4.35Å; E252-F277 HydrophobicContact CB-CE1 4.01Å; A270-F277 VanDerWaalsContact O-CE2 3.29Å; A270-F277 WeakPolarHBondContact O-CE2 3.45Å; L271-F277 HydrophobicContact CD2-CD1 3.92Å; L271-F277 HydrophobicContact CD2-CD2 4.09Å; L271-F277 HydrophobicContact CD2-CE1 3.91Å; L271-F277 HydrophobicContact CD2-CE2 4.11Å; L271-F277 HydrophobicContact CD2-CG 3.98Å; L271-F277 HydrophobicContact CD2-CZ 4Å; N273-F277 HydrophobicContact CB-CD2 4.39Å; N273-F277 WeakPolarHBondContact O-CD2 3.37Å; N273-F277 PolarHBondContact O-N 3.27Å; F277-T279 PolarHBondContact O-N 2.99Å; F277-F280 HydrophobicContact CB-CB 3.87Å
278	P	94.4	Very high	93	Very high	53 Å²	53	28 Å²	28	34%	0.344	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-32.9	-172.2	26.4	-35.3	0	0	0	113.6	R255 R274 R276 Y508	R255-P278 HydrophobicContact CB-CG 4.27Å; R274-P278 WeakPolarHBondContact O-CA 3.38Å; R276-P278 VanDerWaalsContact C-CD 3.47Å; R276-P278 WeakPolarHBondContact O-CD 3.48Å; P278-Y508 WeakPolarHBondContact O-CE2 3.48Å
279	T	94.9	Very high	93	Very high	19 Å²	19	28.8 Å²	28.8	12%	0.117	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105	15.3	-174.8	55	0	0	0	0	114.2	L259 I260 V261 F277 T504	L259-T279 WeakPolarHBondContact O-CB 3.2Å; L259-T279 PolarHBondContact O-OG1 3.25Å; I260-T279 HydrophobicContact CD1-CG2 4.2Å; V261-T279 PolarHBondContact N-O 3.39Å; F277-T279 PolarHBondContact O-N 2.99Å; T279-T504 HydrophobicContact CG2-CG2 4.31Å
280	F	96.9	Very high	93.1	Very high	1 Å²	1	28.7 Å²	28.7	0%	0.004	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	142	-178	-177.6	-101.9	0	0	0	112.9	A251 V261 L271 R274 F277 R282	A251-F280 HydrophobicContact CB-CB 4.29Å; A251-F280 HydrophobicContact CB-CD2 3.72Å; A251-F280 HydrophobicContact CB-CE2 4.46Å; A251-F280 HydrophobicContact CB-CG 4.28Å; V261-F280 HydrophobicContact CB-CD2 4.09Å; V261-F280 HydrophobicContact CG1-CD2 3.88Å; V261-F280 HydrophobicContact CG1-CE2 4.2Å; V261-F280 CarbonylContact O-C 3.4Å; V261-F280 WeakPolarHBondContact O-CA 3.21Å; L271-F280 HydrophobicContact CB-CD1 4.15Å; L271-F280 HydrophobicContact CB-CE1 3.71Å; L271-F280 HydrophobicContact CB-CZ 4.12Å; L271-F280 HydrophobicContact CD1-CE1 4.24Å; L271-F280 HydrophobicContact CD1-CE2 4.27Å; L271-F280 HydrophobicContact CD1-CZ 3.77Å; L271-F280 HydrophobicContact CD2-CD1 4.29Å; L271-F280 HydrophobicContact CD2-CD2 4.14Å; L271-F280 HydrophobicContact CD2-CE1 4.18Å; L271-F280 HydrophobicContact CD2-CE2 4.01Å; L271-F280 HydrophobicContact CD2-CG 4.28Å; L271-F280 HydrophobicContact CD2-CZ 4.04Å; L271-F280 HydrophobicContact CG-CE1 4.27Å; L271-F280 HydrophobicContact CG-CZ 4.21Å; R274-F280 PolarHBondContact NH1-O 2.98Å; F277-F280 HydrophobicContact CB-CB 3.87Å; F280-R282 HydrophobicContact CE1-CB 3.97Å; F280-R282 HydrophobicContact CE1-CG 3.75Å; F280-R282 HydrophobicContact CZ-CB 3.9Å; F280-R282 HydrophobicContact CZ-CG 4.15Å
281	F	96.9	Very high	93.3	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	159.2	166.8	-71.3	-87.3	0	0	0	109.4	I260 V261 L262 S263 Y508 L511 N512 F525 G529	I260-F281 HydrophobicContact CG2-CD2 4.3Å; V261-F281 PolarHBondContact O-N 3.21Å; L262-F281 CarbonylContact C-O 3.55Å; L262-F281 WeakPolarHBondContact CA-O 3.38Å; L262-F281 HydrophobicContact CD1-CB 3.75Å; S263-F281 PolarHBondContact N-O 2.81Å; F281-Y508 AromaticContact CE2-CD2 3.46Å; F281-Y508 HydrophobicContact CE2-CD2 3.46Å; F281-Y508 VanDerWaalsContact CE2-CD2 3.46Å; F281-Y508 AromaticContact CE2-CE2 3.59Å; F281-Y508 HydrophobicContact CE2-CE2 3.59Å; F281-Y508 HydrophobicContact CE2-CG 4.24Å; F281-Y508 AromaticContact CZ-CD2 3.76Å; F281-Y508 HydrophobicContact CZ-CD2 3.76Å; F281-Y508 AromaticContact CZ-CE2 3.55Å; F281-Y508 HydrophobicContact CZ-CE2 3.55Å; F281-Y508 HydrophobicContact CZ-CG 4.33Å; F281-Y508 AromaticContact CZ-CZ 3.98Å; F281-L511 HydrophobicContact CD2-CB 4.25Å; F281-L511 HydrophobicContact CD2-CD1 3.89Å; F281-L511 HydrophobicContact CE1-CB 4.26Å; F281-L511 HydrophobicContact CE2-CB 3.95Å; F281-L511 HydrophobicContact CE2-CD1 4.08Å; F281-L511 HydrophobicContact CZ-CB 3.96Å; F281-N512 HydrophobicContact CE1-CB 4.31Å; F281-N512 HydrophobicContact CZ-CB 4.12Å; F281-F525 HydrophobicContact CD1-CB 4.07Å; F281-F525 HydrophobicContact CD1-CD1 4.33Å; F281-F525 HydrophobicContact CD1-CD2 4.12Å; F281-F525 AromaticContact CD1-CG 3.91Å; F281-F525 HydrophobicContact CD1-CG 3.91Å; F281-F525 HydrophobicContact CE1-CB 4.34Å; F281-G529 CarbonylContact C-O 3.57Å; F281-G529 WeakPolarHBondContact CA-O 3.44Å
282	R	96.1	Very high	93.5	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	135.2	173.9	54.2	176.7	169.5	-166.7	-8.3	113.9	S263 S266 S267 S268 S272 F280 H284 F525 G529 S530 R531	S263-R282 WeakPolarHBondContact O-CA 3.38Å; S263-R282 VanDerWaalsContact O-CB 3.31Å; S263-R282 WeakPolarHBondContact O-CB 3.45Å; S266-R282 WeakPolarHBondContact O-CD 3.39Å; S266-R282 PolarHBondContact O-NH1 3.45Å; S267-R282 VanDerWaalsContact C-NH1 3.3Å; S268-R282 PolarHBondContact O-NH1 3.1Å; S268-R282 PolarHBondContact O-NH2 2.89Å; S268-R282 VanDerWaalsContact O-NH2 3.13Å; S272-R282 PolarHBondContact OG-NH2 3.28Å; F280-R282 HydrophobicContact CE1-CB 3.97Å; F280-R282 HydrophobicContact CE1-CG 3.75Å; F280-R282 HydrophobicContact CZ-CB 3.9Å; F280-R282 HydrophobicContact CZ-CG 4.15Å; R282-H284 WeakPolarHBondContact CD-O 3.16Å; R282-H284 VanDerWaalsContact CG-O 3.22Å; R282-H284 WeakPolarHBondContact CG-O 3.45Å; R282-F525 WeakPolarHBondContact O-CD1 3.45Å; R282-F525 VanDerWaalsContact O-CE1 3.3Å; R282-F525 WeakPolarHBondContact O-CE1 3.28Å; R282-G529 PolarHBondContact N-O 3.4Å; R282-S530 PolarHBondContact NE-OG 3.11Å; R282-S530 PolarHBondContact NH2-OG 3.11Å; R282-R531 PolarHBondContact O-N 2.85Å; R282-R531 VanDerWaalsContact O-N 3.15Å
283	T	94.6	Very high	93.6	Very high	0 Å²	0	28 Å²	28	0%	0	14%	0.14	C	C	.	.	S	Bend	trans	-78.2	-22.9	168.7	48.8	0	0	0	0	112	S263 P285 L467 A471 F525 R531	S263-T283 PolarHBondContact O-N 3.42Å; S263-T283 VanDerWaalsContact O-N 3.13Å; T283-P285 WeakPolarHBondContact O-CD 3.42Å; T283-L467 WeakPolarHBondContact CB-O 3.42Å; T283-L467 PolarHBondContact OG1-O 2.8Å; T283-A471 HydrophobicContact CG2-CB 3.85Å; T283-F525 HydrophobicContact CG2-CE1 4.1Å; T283-F525 HydrophobicContact CG2-CZ 4.13Å; T283-R531 VanDerWaalsContact O-CB 3.27Å; T283-R531 WeakPolarHBondContact O-CB 3.13Å; T283-R531 WeakPolarHBondContact O-CD 3.14Å
284	H	93.3	Very high	93.9	Very high	15 Å²	15	24.3 Å²	24.3	7%	0.069	12%	0.121	C	C	.	.	S	Bend	trans	-69.2	127.2	166.6	-161.5	-63.9	0	0	0	110.3	R282 M426 L467	R282-H284 WeakPolarHBondContact CD-O 3.16Å; R282-H284 VanDerWaalsContact CG-O 3.22Å; R282-H284 WeakPolarHBondContact CG-O 3.45Å; H284-M426 WeakPolarHBondContact NE2-CE 3.32Å; H284-L467 HydrophobicContact CB-CD1 4.14Å
285	P	91.8	Very high	94.1	Very high	1 Å²	1	22.7 Å²	22.7	1%	0.006	12%	0.117	C	C	.	.	P	Polyproline II helix	trans	-68.9	160.7	174.7	-24.5	38.9	0	0	0	112.9	T283 L289 I424 R531 A533	T283-P285 WeakPolarHBondContact O-CD 3.42Å; P285-L289 HydrophobicContact CB-CD2 3.72Å; P285-I424 HydrophobicContact CB-CD1 4.34Å; P285-I424 HydrophobicContact CB-CG2 4.1Å; P285-I424 HydrophobicContact CG-CG2 3.79Å; P285-R531 VanDerWaalsContact CB-O 3.32Å; P285-R531 WeakPolarHBondContact CB-O 3.27Å; P285-R531 HydrophobicContact CG-CB 4.21Å; P285-R531 HydrophobicContact CG-CG 4.37Å; P285-A533 HydrophobicContact CB-CB 4.5Å; P285-A533 HydrophobicContact CG-CB 3.81Å
286	S	92	Very high	94.3	Very high	8 Å²	8	18.7 Å²	18.7	6%	0.056	9%	0.093	C	C	.	.	P	Polyproline II helix	trans	-72.1	143.7	178.4	179.2	0	0	0	0	112.1	T288 L289	S286-T288 WeakPolarHBondContact CB-OG1 3.28Å; S286-T288 PolarHBondContact O-N 3.08Å; S286-T288 VanDerWaalsContact O-N 3.13Å; S286-T288 PolarHBondContact OG-N 3.39Å; S286-T288 PolarHBondContact OG-OG1 3.31Å; S286-L289 WeakPolarHBondContact O-CB 3.26Å; S286-L289 PolarHBondContact O-N 3.35Å
287	A	91.5	Very high	94.5	Very high	10 Å²	10	14.7 Å²	14.7	8%	0.083	8%	0.078	C	C	.	.	G	3₁₀ helix	trans	-61	-19.4	173.2	0	0	0	0	0	113.7	S267 P269 L289 H290 V315 T319	S267-A287 WeakPolarHBondContact O-CB 3.4Å; S267-A287 PolarHBondContact O-N 2.95Å; P269-A287 HydrophobicContact CG-CB 4.23Å; A287-L289 PolarHBondContact O-N 3.29Å; A287-H290 PolarHBondContact O-CD2 3.47Å; A287-H290 PolarHBondContact O-N 3.16Å; A287-V315 HydrophobicContact CB-CG1 4.44Å; A287-T319 HydrophobicContact CB-CG2 4.42Å; A287-T319 WeakPolarHBondContact CB-OG1 3.46Å
288	T	91.6	Very high	94.6	Very high	23 Å²	23	14.6 Å²	14.6	14%	0.141	8%	0.078	C	C	.	.	G	3₁₀ helix	trans	-62.8	-21.3	170.8	53.4	0	0	0	0	113.2	P269 S286 H290 N291 P292 D322	P269-T288 HydrophobicContact CB-CG2 3.74Å; P269-T288 HydrophobicContact CG-CG2 3.81Å; S286-T288 WeakPolarHBondContact CB-OG1 3.28Å; S286-T288 PolarHBondContact O-N 3.08Å; S286-T288 VanDerWaalsContact O-N 3.13Å; S286-T288 PolarHBondContact OG-N 3.39Å; S286-T288 PolarHBondContact OG-OG1 3.31Å; T288-H290 PolarHBondContact O-N 2.83Å; T288-N291 WeakPolarHBondContact O-CB 3.29Å; T288-N291 PolarHBondContact O-N 3.24Å; T288-P292 WeakPolarHBondContact O-CD 3.3Å; T288-D322 HydrophobicContact CG2-CB 3.66Å; T288-D322 VanDerWaalsContact CG2-CG 3.42Å
289	L	90.9	Very high	94.6	Very high	15 Å²	15	17.5 Å²	17.5	8%	0.079	9%	0.085	C	C	.	.	G	3₁₀ helix	trans	-62.6	-24.7	-179.1	-169.6	60.8	0	0	0	112.8	P285 S286 A287 N291 I424 A533 T535 S553	P285-L289 HydrophobicContact CB-CD2 3.72Å; S286-L289 WeakPolarHBondContact O-CB 3.26Å; S286-L289 PolarHBondContact O-N 3.35Å; A287-L289 PolarHBondContact O-N 3.29Å; L289-N291 VanDerWaalsContact C-N 3.32Å; L289-N291 PolarHBondContact O-N 3.06Å; L289-I424 HydrophobicContact CB-CD1 4.4Å; L289-I424 HydrophobicContact CD2-CD1 4.4Å; L289-I424 HydrophobicContact CD2-CG1 4.19Å; L289-I424 HydrophobicContact CD2-CG2 4.02Å; L289-A533 HydrophobicContact CD2-CB 4.12Å; L289-T535 HydrophobicContact CD2-CG2 4.49Å; L289-T535 HydrophobicContact CG-CG2 3.95Å; L289-S553 WeakPolarHBondContact CD1-OG 3.4Å
290	H	93.4	Very high	94.6	Very high	14 Å²	14	20.2 Å²	20.2	7%	0.065	10%	0.095	C	C	.	.	H	α-helix	trans	-69.8	-25.2	172.5	-55.2	-64.9	0	0	0	113.6	A287 T288 T293 R294 T422 I424	A287-H290 PolarHBondContact O-CD2 3.47Å; A287-H290 PolarHBondContact O-N 3.16Å; T288-H290 PolarHBondContact O-N 2.83Å; H290-T293 WeakPolarHBondContact O-CB 3.48Å; H290-T293 PolarHBondContact O-N 3.5Å; H290-R294 VanDerWaalsContact O-CG 3.32Å; H290-R294 WeakPolarHBondContact O-CG 3.38Å; H290-R294 PolarHBondContact O-N 3.22Å; H290-T422 PolarHBondContact CE1-O 3Å; H290-T422 VanDerWaalsContact CE1-O 3.29Å; H290-T422 PolarHBondContact ND1-O 3.03Å; H290-I424 VanDerWaalsContact CE1-CD1 3.5Å; H290-I424 WeakPolarHBondContact CE1-CD1 3.32Å
291	N	95	Very high	94.5	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-73.8	-42.2	-169.7	-66.7	-23.3	0	0	0	113.7	T288 L289 T293 R294 V295 T319 D322 L323	T288-N291 WeakPolarHBondContact O-CB 3.29Å; T288-N291 PolarHBondContact O-N 3.24Å; L289-N291 VanDerWaalsContact C-N 3.32Å; L289-N291 PolarHBondContact O-N 3.06Å; N291-T293 PolarHBondContact O-N 3.45Å; N291-R294 PolarHBondContact O-N 2.92Å; N291-R294 PolarHBondContact OD1-NH1 3.48Å; N291-V295 WeakPolarHBondContact O-CG2 3.48Å; N291-V295 PolarHBondContact O-N 3.33Å; N291-T319 PolarHBondContact ND2-O 3.22Å; N291-D322 WeakPolarHBondContact CB-OD2 3.38Å; N291-D322 PolarHBondContact ND2-OD2 3.22Å; N291-L323 HydrophobicContact CB-CB 4.42Å; N291-L323 HydrophobicContact CB-CD1 3.92Å; N291-L323 PolarHBondContact ND2-N 2.94Å
292	P	94.7	Very high	94.4	Very high	27 Å²	27	28.3 Å²	28.3	18%	0.175	14%	0.136	C	C	.	.	H	α-helix	trans	-51.3	-42.6	166.2	-30	37	0	0	0	113.1	T288 V295 R296 Y551	T288-P292 WeakPolarHBondContact O-CD 3.3Å; P292-V295 PolarHBondContact O-N 3.3Å; P292-R296 WeakPolarHBondContact O-CB 3.46Å; P292-R296 PolarHBondContact O-N 2.94Å; P292-Y551 HydrophobicContact CB-CE1 3.93Å
293	T	95.5	Very high	94.3	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-64.2	-48.8	178.3	-44	0	0	0	0	111.7	H290 N291 V295 R296 L297 T422 T535 I537 Y551	H290-T293 WeakPolarHBondContact O-CB 3.48Å; H290-T293 PolarHBondContact O-N 3.5Å; N291-T293 PolarHBondContact O-N 3.45Å; T293-V295 PolarHBondContact O-N 3.39Å; T293-R296 PolarHBondContact O-N 3.26Å; T293-L297 HydrophobicContact CG2-CD1 4.5Å; T293-L297 WeakPolarHBondContact O-CG 3.32Å; T293-L297 PolarHBondContact O-N 3.06Å; T293-T422 HydrophobicContact CG2-CG2 4.29Å; T293-T535 WeakPolarHBondContact CG2-OG1 3.3Å; T293-T535 WeakPolarHBondContact OG1-CG2 3.31Å; T293-T535 PolarHBondContact OG1-OG1 3.39Å; T293-I537 HydrophobicContact CG2-CD1 3.62Å; T293-I537 HydrophobicContact CG2-CG1 3.72Å; T293-Y551 HydrophobicContact CG2-CD1 4.23Å; T293-Y551 HydrophobicContact CG2-CG 4.3Å; T293-Y551 WeakPolarHBondContact OG1-CD1 3.09Å
294	R	96.4	Very high	94.4	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-56.6	-48.7	175.4	-70.2	163.4	-175.6	160.8	-4.7	111.4	H290 N291 R296 L297 F298 L323 T422	H290-R294 VanDerWaalsContact O-CG 3.32Å; H290-R294 WeakPolarHBondContact O-CG 3.38Å; H290-R294 PolarHBondContact O-N 3.22Å; N291-R294 PolarHBondContact O-N 2.92Å; N291-R294 PolarHBondContact OD1-NH1 3.48Å; R294-R296 PolarHBondContact O-N 3.16Å; R294-L297 WeakPolarHBondContact O-CB 3.39Å; R294-L297 PolarHBondContact O-N 2.88Å; R294-F298 HydrophobicContact CB-CE1 4.43Å; R294-F298 HydrophobicContact CB-CE2 4.08Å; R294-F298 HydrophobicContact CB-CZ 3.88Å; R294-F298 VanDerWaalsContact O-CD1 3.24Å; R294-F298 WeakPolarHBondContact O-CD1 3.3Å; R294-F298 WeakPolarHBondContact O-CD2 3.42Å; R294-F298 WeakPolarHBondContact O-CG 3.24Å; R294-F298 PolarHBondContact O-N 3.1Å; R294-L323 HydrophobicContact CB-CD1 4.45Å; R294-T422 HydrophobicContact CG-CG2 4.25Å; R294-T422 PolarHBondContact NE-OG1 2.92Å; R294-T422 PolarHBondContact NH2-OG1 3.3Å
295	V	96.8	Very high	94.5	Very high	18 Å²	18	34 Å²	34	11%	0.109	16%	0.164	C	C	.	.	H	α-helix	trans	-62.1	-40.3	177.1	171.3	0	0	0	0	112	N291 P292 T293 L297 F298 K299 L323 R326 V327 A330	N291-V295 WeakPolarHBondContact O-CG2 3.48Å; N291-V295 PolarHBondContact O-N 3.33Å; P292-V295 PolarHBondContact O-N 3.3Å; T293-V295 PolarHBondContact O-N 3.39Å; V295-L297 VanDerWaalsContact C-N 3.34Å; V295-L297 PolarHBondContact O-N 2.87Å; V295-F298 PolarHBondContact O-N 2.97Å; V295-K299 WeakPolarHBondContact O-CG 3.11Å; V295-K299 PolarHBondContact O-N 3.42Å; V295-K299 VanDerWaalsContact O-N 3.08Å; V295-L323 HydrophobicContact CG2-CD1 4.24Å; V295-R326 HydrophobicContact CG2-CB 4.04Å; V295-V327 HydrophobicContact CG2-CG1 3.86Å; V295-A330 HydrophobicContact CG1-CB 3.55Å
296	R	96.1	Very high	94.7	Very high	103 Å²	103	34.1 Å²	34.1	39%	0.389	17%	0.165	S	C	.	.	H	α-helix	trans	-63.9	-38.9	176.1	-174.6	63.8	175.3	113.2	-8.2	112.1	P292 T293 R294 K300 Y551 L558	P292-R296 WeakPolarHBondContact O-CB 3.46Å; P292-R296 PolarHBondContact O-N 2.94Å; T293-R296 PolarHBondContact O-N 3.26Å; R294-R296 PolarHBondContact O-N 3.16Å; R296-K300 PolarHBondContact O-N 3.49Å; R296-Y551 HydrophobicContact CB-CE2 4.12Å; R296-Y551 HydrophobicContact CG-CD2 4.09Å; R296-Y551 HydrophobicContact CG-CE2 3.72Å; R296-L558 HydrophobicContact CG-CD2 4.31Å
297	L	96.1	Very high	95	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-67.9	-45.4	175.7	-73.6	177.8	0	0	0	112.5	T293 R294 V295 K299 K300 W301 F388 I537 W560	T293-L297 HydrophobicContact CG2-CD1 4.5Å; T293-L297 WeakPolarHBondContact O-CG 3.32Å; T293-L297 PolarHBondContact O-N 3.06Å; R294-L297 WeakPolarHBondContact O-CB 3.39Å; R294-L297 PolarHBondContact O-N 2.88Å; V295-L297 VanDerWaalsContact C-N 3.34Å; V295-L297 PolarHBondContact O-N 2.87Å; L297-K299 VanDerWaalsContact C-N 3.28Å; L297-K299 PolarHBondContact O-N 3.42Å; L297-K300 WeakPolarHBondContact O-CA 3.19Å; L297-K300 WeakPolarHBondContact O-CB 3.26Å; L297-K300 PolarHBondContact O-N 2.97Å; L297-W301 HydrophobicContact CB-CE3 4Å; L297-W301 HydrophobicContact CB-CZ3 3.69Å; L297-W301 HydrophobicContact CD1-CH2 4.45Å; L297-W301 HydrophobicContact CD1-CZ3 4.13Å; L297-W301 HydrophobicContact CD2-CH2 3.88Å; L297-W301 HydrophobicContact CD2-CZ3 3.84Å; L297-W301 HydrophobicContact CG-CZ3 4.1Å; L297-W301 PolarHBondContact O-N 2.87Å; L297-F388 HydrophobicContact CD1-CE1 4.04Å; L297-I537 HydrophobicContact CD1-CD1 4.26Å; L297-I537 HydrophobicContact CD1-CG2 3.88Å; L297-I537 HydrophobicContact CD2-CD1 4.21Å; L297-I537 HydrophobicContact CG-CD1 4.43Å; L297-W560 HydrophobicContact CD2-CH2 3.76Å; L297-W560 HydrophobicContact CD2-CZ3 3.63Å
298	F	96.9	Very high	95.3	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-58.5	-42.2	175.8	-55.4	-21.7	0	0	0	111.1	R294 V295 K300 W301 N302 W303 I306 V327 I332 I358 V360 F388	R294-F298 HydrophobicContact CB-CE1 4.43Å; R294-F298 HydrophobicContact CB-CE2 4.08Å; R294-F298 HydrophobicContact CB-CZ 3.88Å; R294-F298 VanDerWaalsContact O-CD1 3.24Å; R294-F298 WeakPolarHBondContact O-CD1 3.3Å; R294-F298 WeakPolarHBondContact O-CD2 3.42Å; R294-F298 WeakPolarHBondContact O-CG 3.24Å; R294-F298 PolarHBondContact O-N 3.1Å; V295-F298 PolarHBondContact O-N 2.97Å; F298-K300 PolarHBondContact O-N 3.34Å; F298-W301 PolarHBondContact O-N 3.29Å; F298-N302 PolarHBondContact O-N 2.92Å; F298-N302 VanDerWaalsContact O-N 3.08Å; F298-W303 AromaticContact CD1-CE3 3.73Å; F298-W303 HydrophobicContact CD1-CE3 3.73Å; F298-W303 HydrophobicContact CD1-CZ3 4.06Å; F298-W303 HydrophobicContact CE1-CE3 4.46Å; F298-W303 PolarHBondContact O-N 2.94Å; F298-I306 HydrophobicContact CD2-CD1 4.3Å; F298-I306 HydrophobicContact CD2-CG2 4.12Å; F298-I306 HydrophobicContact CE1-CG2 4.49Å; F298-I306 HydrophobicContact CE2-CD1 3.6Å; F298-I306 HydrophobicContact CE2-CG2 4.04Å; F298-I306 HydrophobicContact CG-CG2 4.4Å; F298-I306 HydrophobicContact CZ-CD1 4.18Å; F298-I306 HydrophobicContact CZ-CG2 4.22Å; F298-V327 HydrophobicContact CD2-CG1 4.48Å; F298-V327 HydrophobicContact CE2-CG1 4.37Å; F298-I332 HydrophobicContact CB-CD1 3.7Å; F298-I332 HydrophobicContact CD2-CD1 4.24Å; F298-I358 HydrophobicContact CE1-CG2 4.33Å; F298-V360 HydrophobicContact CZ-CG2 3.92Å; F298-F388 HydrophobicContact CE1-CD1 4.45Å; F298-F388 HydrophobicContact CE1-CD2 4.12Å; F298-F388 HydrophobicContact CE1-CE1 4.36Å; F298-F388 HydrophobicContact CE1-CE2 4.05Å; F298-F388 HydrophobicContact CE1-CG 4.35Å; F298-F388 HydrophobicContact CE1-CZ 4.19Å
299	K	95.4	Very high	95.6	Very high	113 Å²	113	32.3 Å²	32.3	49%	0.491	15%	0.152	S	C	.	.	H	α-helix	trans	-66.1	-31.2	172.1	-70.1	-168.7	-177.9	-169.2	0	113.8	V295 L297 A330 I332	V295-K299 WeakPolarHBondContact O-CG 3.11Å; V295-K299 PolarHBondContact O-N 3.42Å; V295-K299 VanDerWaalsContact O-N 3.08Å; L297-K299 VanDerWaalsContact C-N 3.28Å; L297-K299 PolarHBondContact O-N 3.42Å; K299-A330 VanDerWaalsContact CE-CB 3.4Å; K299-A330 WeakPolarHBondContact CE-O 3.23Å; K299-I332 HydrophobicContact CG-CD1 4.3Å
300	K	94.3	Very high	95.8	Very high	76 Å²	76	32 Å²	32	33%	0.33	15%	0.151	S	C	.	.	H	α-helix	trans	-67.7	-42.1	176	179.6	-177.1	172.9	-174.8	0	111.7	R296 L297 F298 N302 L558 W560	R296-K300 PolarHBondContact O-N 3.49Å; L297-K300 WeakPolarHBondContact O-CA 3.19Å; L297-K300 WeakPolarHBondContact O-CB 3.26Å; L297-K300 PolarHBondContact O-N 2.97Å; F298-K300 PolarHBondContact O-N 3.34Å; K300-N302 VanDerWaalsContact C-N 3.33Å; K300-L558 HydrophobicContact CD-CD2 4.15Å; K300-W560 VanDerWaalsContact NZ-CG 3.29Å
301	W	94.5	Very high	95.9	Very high	29 Å²	29	32.6 Å²	32.6	11%	0.11	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.6	8.1	-179.6	-64.7	-52.2	0	0	0	113.9	L297 F298 W303 F388 V420 W560 W566 P571	L297-W301 HydrophobicContact CB-CE3 4Å; L297-W301 HydrophobicContact CB-CZ3 3.69Å; L297-W301 HydrophobicContact CD1-CH2 4.45Å; L297-W301 HydrophobicContact CD1-CZ3 4.13Å; L297-W301 HydrophobicContact CD2-CH2 3.88Å; L297-W301 HydrophobicContact CD2-CZ3 3.84Å; L297-W301 HydrophobicContact CG-CZ3 4.1Å; L297-W301 PolarHBondContact O-N 2.87Å; F298-W301 PolarHBondContact O-N 3.29Å; W301-W303 VanDerWaalsContact C-N 3.28Å; W301-W303 HydrophobicContact CB-CD2 3.9Å; W301-W303 HydrophobicContact CB-CE3 4.3Å; W301-W303 HydrophobicContact CB-CG 4.38Å; W301-W303 HydrophobicContact CB-CH2 4.25Å; W301-W303 HydrophobicContact CB-CZ2 3.87Å; W301-W303 HydrophobicContact CB-CZ3 4.46Å; W301-W303 AromaticContact CD2-CH2 3.91Å; W301-W303 HydrophobicContact CD2-CH2 3.91Å; W301-W303 HydrophobicContact CD2-CZ2 4.25Å; W301-W303 HydrophobicContact CD2-CZ3 4.27Å; W301-W303 HydrophobicContact CE3-CE3 4.19Å; W301-W303 AromaticContact CE3-CH2 3.4Å; W301-W303 HydrophobicContact CE3-CH2 3.4Å; W301-W303 HydrophobicContact CE3-CZ2 4.17Å; W301-W303 AromaticContact CE3-CZ3 3.42Å; W301-W303 HydrophobicContact CE3-CZ3 3.42Å; W301-W303 VanDerWaalsContact CE3-CZ3 3.42Å; W301-W303 HydrophobicContact CG-CH2 4.32Å; W301-W303 HydrophobicContact CG-CZ2 4.2Å; W301-W303 AromaticContact CZ3-CH2 3.98Å; W301-W303 HydrophobicContact CZ3-CH2 3.98Å; W301-W303 HydrophobicContact CZ3-CZ3 4.02Å; W301-W303 PolarHBondContact O-N 3.35Å; W301-F388 HydrophobicContact CE3-CZ 4.41Å; W301-F388 HydrophobicContact CZ3-CE1 4.16Å; W301-F388 AromaticContact CZ3-CZ 3.75Å; W301-F388 HydrophobicContact CZ3-CZ 3.75Å; W301-V420 HydrophobicContact CH2-CG2 4.47Å; W301-W560 HydrophobicContact CH2-CH2 4.01Å; W301-W560 HydrophobicContact CH2-CZ2 4.46Å; W301-W560 AromaticContact CZ2-CH2 3.9Å; W301-W560 HydrophobicContact CZ2-CH2 3.9Å; W301-W560 AromaticContact CZ2-CZ2 3.91Å; W301-W560 HydrophobicContact CZ2-CZ2 3.91Å; W301-W566 HydrophobicContact CH2-CZ2 4.03Å; W301-W566 AromaticContact CZ2-CZ2 3.65Å; W301-W566 HydrophobicContact CZ2-CZ2 3.65Å; W301-P571 HydrophobicContact CB-CG 4.47Å; W301-P571 HydrophobicContact CG-CB 4.2Å; W301-P571 HydrophobicContact CG-CG 4.22Å
302	N	94.9	Very high	95.8	Very high	142 Å²	142	36 Å²	36	76%	0.759	17%	0.174	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.4	37.5	179.3	-164.2	48.3	0	0	0	113.9	F298 K300	F298-N302 PolarHBondContact O-N 2.92Å; F298-N302 VanDerWaalsContact O-N 3.08Å; K300-N302 VanDerWaalsContact C-N 3.33Å
303	W	95.8	Very high	95.3	Very high	10 Å²	10	36.8 Å²	36.8	4%	0.038	18%	0.179	C	C	.	.			trans	-88.3	134.5	173.6	-58.8	-31.3	0	0	0	110.8	F298 W301 I358 V386 F388 P571 P572 D574	F298-W303 AromaticContact CD1-CE3 3.73Å; F298-W303 HydrophobicContact CD1-CE3 3.73Å; F298-W303 HydrophobicContact CD1-CZ3 4.06Å; F298-W303 HydrophobicContact CE1-CE3 4.46Å; F298-W303 PolarHBondContact O-N 2.94Å; W301-W303 VanDerWaalsContact C-N 3.28Å; W301-W303 HydrophobicContact CB-CD2 3.9Å; W301-W303 HydrophobicContact CB-CE3 4.3Å; W301-W303 HydrophobicContact CB-CG 4.38Å; W301-W303 HydrophobicContact CB-CH2 4.25Å; W301-W303 HydrophobicContact CB-CZ2 3.87Å; W301-W303 HydrophobicContact CB-CZ3 4.46Å; W301-W303 AromaticContact CD2-CH2 3.91Å; W301-W303 HydrophobicContact CD2-CH2 3.91Å; W301-W303 HydrophobicContact CD2-CZ2 4.25Å; W301-W303 HydrophobicContact CD2-CZ3 4.27Å; W301-W303 HydrophobicContact CE3-CE3 4.19Å; W301-W303 AromaticContact CE3-CH2 3.4Å; W301-W303 HydrophobicContact CE3-CH2 3.4Å; W301-W303 HydrophobicContact CE3-CZ2 4.17Å; W301-W303 AromaticContact CE3-CZ3 3.42Å; W301-W303 HydrophobicContact CE3-CZ3 3.42Å; W301-W303 VanDerWaalsContact CE3-CZ3 3.42Å; W301-W303 HydrophobicContact CG-CH2 4.32Å; W301-W303 HydrophobicContact CG-CZ2 4.2Å; W301-W303 AromaticContact CZ3-CH2 3.98Å; W301-W303 HydrophobicContact CZ3-CH2 3.98Å; W301-W303 HydrophobicContact CZ3-CZ3 4.02Å; W301-W303 PolarHBondContact O-N 3.35Å; W303-I358 HydrophobicContact CD2-CD1 3.73Å; W303-I358 HydrophobicContact CD2-CG1 3.77Å; W303-I358 HydrophobicContact CD2-CG2 4.3Å; W303-I358 VanDerWaalsContact CE2-CD1 3.48Å; W303-I358 HydrophobicContact CE3-CB 4.48Å; W303-I358 HydrophobicContact CE3-CD1 4.04Å; W303-I358 HydrophobicContact CE3-CG1 4.01Å; W303-I358 HydrophobicContact CE3-CG2 3.66Å; W303-I358 HydrophobicContact CG-CD1 4.31Å; W303-I358 HydrophobicContact CG-CG1 4.01Å; W303-I358 HydrophobicContact CH2-CD1 3.97Å; W303-I358 HydrophobicContact CZ2-CD1 3.61Å; W303-I358 HydrophobicContact CZ3-CD1 4.16Å; W303-I358 HydrophobicContact CZ3-CG2 3.84Å; W303-V386 HydrophobicContact CH2-CB 4.33Å; W303-V386 HydrophobicContact CH2-CG1 4.13Å; W303-V386 HydrophobicContact CH2-CG2 4.14Å; W303-V386 HydrophobicContact CZ2-CG2 4.13Å; W303-F388 HydrophobicContact CH2-CE2 4.01Å; W303-F388 HydrophobicContact CH2-CZ 4Å; W303-F388 AromaticContact CZ3-CE2 3.52Å; W303-F388 HydrophobicContact CZ3-CE2 3.52Å; W303-F388 AromaticContact CZ3-CZ 3.55Å; W303-F388 HydrophobicContact CZ3-CZ 3.55Å; W303-P571 HydrophobicContact CZ2-CB 4.04Å; W303-P572 PolarHBondContact NE1-O 2.82Å; W303-D574 HydrophobicContact CB-CB 4.1Å; W303-D574 HydrophobicContact CG-CB 4.24Å
304	S	94.8	Very high	94.8	Very high	45 Å²	45	40.7 Å²	40.7	32%	0.315	20%	0.197	S	C	.	.			trans	-120.9	-10.3	-176.1	62.8	0	0	0	0	113.5	I332 E333 D574 R575	S304-I332 WeakPolarHBondContact O-CA 3.24Å; S304-E333 PolarHBondContact O-N 2.82Å; S304-D574 WeakPolarHBondContact CA-OD2 3.3Å; S304-D574 PolarHBondContact N-OD2 3.23Å; S304-D574 PolarHBondContact OG-OD2 3.11Å; S304-R575 PolarHBondContact OG-NH2 2.7Å
305	R	95.3	Very high	94.4	Very high	81 Å²	81	41.1 Å²	41.1	31%	0.306	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	132.5	173.9	-61.7	179.1	84	-135.9	6.8	110.7	E333 D574 R575	R305-E333 WeakPolarHBondContact CA-O 3.48Å; R305-E333 HydrophobicContact CG-CB 4.38Å; R305-E333 IonicContact CZ-OE2 3.78Å; R305-E333 IonicContact NE-OE2 3.63Å; R305-E333 PolarHBondContact NE-OE2 3.36Å; R305-E333 IonicContact NH2-OE2 2.82Å; R305-E333 PolarHBondContact NH2-OE2 3Å; R305-D574 PolarHBondContact N-OD2 2.72Å; R305-R575 VanDerWaalsContact CD-CZ 3.47Å; R305-R575 VanDerWaalsContact CD-NH2 3.3Å
306	I	97.1	Very high	94.1	Very high	2 Å²	2	40.5 Å²	40.5	1%	0.01	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	158.4	176.3	67.6	176.5	0	0	0	110.7	F298 V327 I332 E333 I334 S335 I358 V360	F298-I306 HydrophobicContact CD2-CD1 4.3Å; F298-I306 HydrophobicContact CD2-CG2 4.12Å; F298-I306 HydrophobicContact CE1-CG2 4.49Å; F298-I306 HydrophobicContact CE2-CD1 3.6Å; F298-I306 HydrophobicContact CE2-CG2 4.04Å; F298-I306 HydrophobicContact CG-CG2 4.4Å; F298-I306 HydrophobicContact CZ-CD1 4.18Å; F298-I306 HydrophobicContact CZ-CG2 4.22Å; I306-V327 HydrophobicContact CD1-CG1 3.91Å; I306-I332 HydrophobicContact CG2-CG2 4.26Å; I306-E333 PolarHBondContact N-O 3.29Å; I306-I334 HydrophobicContact CD1-CG1 4.25Å; I306-I334 HydrophobicContact CG1-CG1 4.07Å; I306-I334 CarbonylContact O-C 3.56Å; I306-I334 WeakPolarHBondContact O-CA 3.44Å; I306-S335 PolarHBondContact O-N 3.06Å; I306-S335 PolarHBondContact O-OG 3.09Å; I306-I358 CarbonylContact C-O 3.48Å; I306-I358 HydrophobicContact CG2-CB 4.21Å; I306-I358 HydrophobicContact CG2-CG2 3.91Å; I306-V360 HydrophobicContact CD1-CG2 4.44Å
307	A	97.8	Very high	93.9	Very high	1 Å²	1	37.5 Å²	37.5	1%	0.008	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	154.8	168.2	0	0	0	0	0	110.5	V336 L351 A356 I358 I359 V360	A307-V336 CarbonylContact C-O 3.59Å; A307-V336 VanDerWaalsContact CA-O 3.31Å; A307-V336 WeakPolarHBondContact CA-O 3.44Å; A307-V336 HydrophobicContact CB-CB 4.07Å; A307-L351 HydrophobicContact CB-CD2 3.77Å; A307-A356 HydrophobicContact CB-CB 3.7Å; A307-I358 PolarHBondContact N-O 3.39Å; A307-I359 CarbonylContact O-C 3.57Å; A307-I359 WeakPolarHBondContact O-CA 3.43Å; A307-V360 PolarHBondContact O-N 3.41Å
308	T	97.9	Very high	93.7	Very high	2 Å²	2	38.8 Å²	38.8	1%	0.012	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	138.8	-178.1	64.2	0	0	0	0	111.1	L320 I334 V336 Q338 V360	T308-L320 HydrophobicContact CG2-CD1 3.68Å; T308-I334 HydrophobicContact CG2-CD1 4.17Å; T308-I334 HydrophobicContact CG2-CG2 4.14Å; T308-V336 PolarHBondContact N-O 3.38Å; T308-Q338 PolarHBondContact O-N 3.08Å; T308-V360 WeakPolarHBondContact CA-O 3.45Å; T308-V360 HydrophobicContact CG2-CB 4.19Å; T308-V360 HydrophobicContact CG2-CG2 4.44Å
309	I	97.9	Very high	93.5	Very high	1 Å²	1	39 Å²	39	1%	0.005	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	120.3	176.5	177.1	170.8	0	0	0	109.4	Q338 F340 A347 V348 L351 I359 V360 G361 L362 F363 W387	I309-Q338 WeakPolarHBondContact CA-O 3.35Å; I309-Q338 HydrophobicContact CB-CB 4.36Å; I309-Q338 HydrophobicContact CG1-CB 4.39Å; I309-F340 HydrophobicContact CD1-CD1 4.32Å; I309-F340 HydrophobicContact CD1-CE1 4.35Å; I309-F340 HydrophobicContact CG1-CD1 4.1Å; I309-F340 HydrophobicContact CG1-CE1 4.09Å; I309-A347 HydrophobicContact CD1-CB 3.7Å; I309-A347 HydrophobicContact CG1-CB 4.37Å; I309-V348 HydrophobicContact CD1-CG2 4.31Å; I309-L351 HydrophobicContact CB-CD1 4.11Å; I309-L351 HydrophobicContact CD1-CD1 4.08Å; I309-L351 HydrophobicContact CG2-CD1 3.98Å; I309-I359 HydrophobicContact CG2-CG2 3.78Å; I309-V360 PolarHBondContact N-O 2.9Å; I309-G361 WeakPolarHBondContact O-CA 3.41Å; I309-L362 PolarHBondContact O-N 2.98Å; I309-F363 HydrophobicContact CG2-CE1 4.28Å; I309-W387 HydrophobicContact CG2-CH2 4.25Å; I309-W387 HydrophobicContact CG2-CZ3 3.83Å
310	Q	96.3	Very high	93.5	Very high	9 Å²	9	33.6 Å²	33.6	4%	0.042	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	153.3	-177.7	67.6	166.8	38.3	0	0	113.8	F316 T317 L320 Q338 S339 F340 L362	Q310-F316 HydrophobicContact CB-CB 4.4Å; Q310-F316 PolarHBondContact OE1-O 2.98Å; Q310-T317 PolarHBondContact NE2-OG1 3.31Å; Q310-L320 HydrophobicContact CG-CD2 4.17Å; Q310-Q338 PolarHBondContact N-O 3.06Å; Q310-Q338 VanDerWaalsContact N-O 3.07Å; Q310-S339 CarbonylContact O-C 3.55Å; Q310-S339 VanDerWaalsContact O-CA 3.24Å; Q310-S339 WeakPolarHBondContact O-CA 3.43Å; Q310-F340 VanDerWaalsContact O-CD1 3.27Å; Q310-F340 WeakPolarHBondContact O-CD1 3.41Å; Q310-F340 PolarHBondContact O-N 3.27Å; Q310-L362 CarbonylContact C-O 3.58Å; Q310-L362 VanDerWaalsContact CA-O 3.23Å; Q310-L362 WeakPolarHBondContact CA-O 3.38Å; Q310-L362 HydrophobicContact CB-CB 4.06Å
311	Q	94.4	Very high	93.4	Very high	26 Å²	26	33.5 Å²	33.5	12%	0.121	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	140.5	159	-178.9	176.9	7.1	0	0	109.5	T313 F316 F340 L362 F363 Y364	Q311-T313 VanDerWaalsContact C-N 3.31Å; Q311-T313 PolarHBondContact O-N 3.37Å; Q311-F316 HydrophobicContact CB-CD2 3.99Å; Q311-F316 HydrophobicContact CB-CE2 4.21Å; Q311-F340 CarbonylContact C-O 3.53Å; Q311-F340 WeakPolarHBondContact CA-O 3.33Å; Q311-F340 HydrophobicContact CB-CE2 4.49Å; Q311-F340 HydrophobicContact CB-CZ 4.2Å; Q311-L362 PolarHBondContact N-O 3.1Å; Q311-F363 HydrophobicContact CB-CB 3.77Å; Q311-Y364 VanDerWaalsContact OE1-N 3.12Å
312	T	92.2	Very high	93.4	Very high	72 Å²	72	33.6 Å²	33.6	44%	0.442	18%	0.181	S	C	.	.	S	Bend	trans	-74.2	80.8	-178.6	-54.2	0	0	0	0	111.3	F340	T312-F340 PolarHBondContact N-O 2.94Å; T312-F340 PolarHBondContact OG1-O 2.03Å
313	T	85.4	Confident	93.5	Very high	43 Å²	43	26.8 Å²	26.8	26%	0.264	15%	0.145	S	C	.	.			trans	-135.3	148.6	176.8	-49.6	0	0	0	0	109.6	Q311 V315 F316 T317 Y364	Q311-T313 VanDerWaalsContact C-N 3.31Å; Q311-T313 PolarHBondContact O-N 3.37Å; T313-V315 VanDerWaalsContact C-N 3.3Å; T313-V315 PolarHBondContact O-N 2.93Å; T313-F316 PolarHBondContact O-N 3.06Å; T313-T317 WeakPolarHBondContact O-CB 3.38Å; T313-T317 PolarHBondContact O-N 2.92Å; T313-T317 PolarHBondContact O-OG1 3.4Å; T313-Y364 HydrophobicContact CG2-CE2 4.46Å
314	E	84.3	Confident	93.5	Very high	82 Å²	82	30.2 Å²	30.2	38%	0.383	16%	0.161	S	C	.	.	H	α-helix	trans	-52.7	-45.6	-177.6	-174.7	-173.4	-146.4	0	0	112.1	A270 T317 S318	A270-E314 HydrophobicContact CB-CG 4.33Å; E314-T317 PolarHBondContact O-N 3.01Å; E314-S318 WeakPolarHBondContact O-CB 3.4Å; E314-S318 PolarHBondContact O-N 3.41Å; E314-S318 PolarHBondContact O-OG 3.04Å
315	V	87.6	Confident	93.5	Very high	9 Å²	9	33.7 Å²	33.7	6%	0.055	17%	0.172	C	C	.	.	H	α-helix	trans	-59.5	-51.5	-179.1	-177.5	0	0	0	0	111.5	A287 T313 S318 T319	A287-V315 HydrophobicContact CB-CG1 4.44Å; T313-V315 VanDerWaalsContact C-N 3.3Å; T313-V315 PolarHBondContact O-N 2.93Å; V315-S318 PolarHBondContact O-OG 3.44Å; V315-T319 VanDerWaalsContact O-CB 3.3Å; V315-T319 WeakPolarHBondContact O-CB 3.39Å; V315-T319 PolarHBondContact O-N 3.27Å; V315-T319 PolarHBondContact O-OG1 2.87Å
316	F	91.6	Very high	93.5	Very high	4 Å²	4	33.9 Å²	33.9	2%	0.018	17%	0.173	C	C	.	.	H	α-helix	trans	-70.5	-40.2	-178.1	-56.1	-46	0	0	0	112	Q310 Q311 T313 T319 L320 L362 Y364 I390 W392	Q310-F316 HydrophobicContact CB-CB 4.4Å; Q310-F316 PolarHBondContact OE1-O 2.98Å; Q311-F316 HydrophobicContact CB-CD2 3.99Å; Q311-F316 HydrophobicContact CB-CE2 4.21Å; T313-F316 PolarHBondContact O-N 3.06Å; F316-T319 PolarHBondContact O-N 3.39Å; F316-L320 WeakPolarHBondContact O-CB 3.49Å; F316-L320 PolarHBondContact O-N 3.21Å; F316-L362 HydrophobicContact CB-CB 3.95Å; F316-L362 HydrophobicContact CD1-CB 4.02Å; F316-L362 WeakPolarHBondContact CD2-O 3.19Å; F316-L362 HydrophobicContact CG-CB 4.13Å; F316-L362 WeakPolarHBondContact CG-O 3.27Å; F316-Y364 AromaticContact CE2-CD2 3.56Å; F316-Y364 HydrophobicContact CE2-CD2 3.56Å; F316-Y364 AromaticContact CE2-CE2 3.57Å; F316-Y364 HydrophobicContact CE2-CE2 3.57Å; F316-Y364 HydrophobicContact CE2-CG 4.32Å; F316-Y364 HydrophobicContact CZ-CD1 4.47Å; F316-Y364 AromaticContact CZ-CD2 3.75Å; F316-Y364 HydrophobicContact CZ-CD2 3.75Å; F316-Y364 AromaticContact CZ-CE2 3.74Å; F316-Y364 HydrophobicContact CZ-CE2 3.74Å; F316-Y364 HydrophobicContact CZ-CG 4.11Å; F316-I390 HydrophobicContact CD1-CD1 4.2Å; F316-I390 HydrophobicContact CE1-CD1 3.71Å; F316-W392 HydrophobicContact CE1-CZ2 4.18Å; F316-W392 HydrophobicContact CZ-CZ2 4.12Å
317	T	91.7	Very high	93.5	Very high	40 Å²	40	33.9 Å²	33.9	25%	0.245	17%	0.173	C	C	.	.	H	α-helix	trans	-61.8	-52	179.8	-52.1	0	0	0	0	111.1	Q310 T313 E314 T319 L320 D321	Q310-T317 PolarHBondContact NE2-OG1 3.31Å; T313-T317 WeakPolarHBondContact O-CB 3.38Å; T313-T317 PolarHBondContact O-N 2.92Å; T313-T317 PolarHBondContact O-OG1 3.4Å; E314-T317 PolarHBondContact O-N 3.01Å; T317-T319 VanDerWaalsContact C-N 3.28Å; T317-T319 PolarHBondContact O-N 3.38Å; T317-L320 PolarHBondContact O-N 3.4Å; T317-L320 VanDerWaalsContact O-N 3.08Å; T317-D321 VanDerWaalsContact O-CG 3.26Å; T317-D321 PolarHBondContact O-N 3.24Å
318	S	91.1	Very high	93.3	Very high	28 Å²	28	42 Å²	42	20%	0.196	21%	0.208	C	C	.	.	H	α-helix	trans	-68.3	-25	177	57.5	0	0	0	0	113.6	P269 E314 V315 D322	P269-S318 WeakPolarHBondContact CB-OG 3.21Å; P269-S318 WeakPolarHBondContact CD-OG 3.46Å; P269-S318 WeakPolarHBondContact CG-OG 3.31Å; E314-S318 WeakPolarHBondContact O-CB 3.4Å; E314-S318 PolarHBondContact O-N 3.41Å; E314-S318 PolarHBondContact O-OG 3.04Å; V315-S318 PolarHBondContact O-OG 3.44Å; S318-D322 PolarHBondContact O-N 3.06Å
319	T	93.1	Very high	93.3	Very high	4 Å²	4	48.1 Å²	48.1	3%	0.025	24%	0.237	C	C	.	.	H	α-helix	trans	-71.2	-36.1	169.9	-58.3	0	0	0	0	111.7	P269 A287 N291 V315 F316 T317 L323 L362	P269-T319 WeakPolarHBondContact CG-OG1 3.37Å; A287-T319 HydrophobicContact CB-CG2 4.42Å; A287-T319 WeakPolarHBondContact CB-OG1 3.46Å; N291-T319 PolarHBondContact ND2-O 3.22Å; V315-T319 VanDerWaalsContact O-CB 3.3Å; V315-T319 WeakPolarHBondContact O-CB 3.39Å; V315-T319 PolarHBondContact O-N 3.27Å; V315-T319 PolarHBondContact O-OG1 2.87Å; F316-T319 PolarHBondContact O-N 3.39Å; T317-T319 VanDerWaalsContact C-N 3.28Å; T317-T319 PolarHBondContact O-N 3.38Å; T319-L323 WeakPolarHBondContact O-CB 3.46Å; T319-L323 PolarHBondContact O-N 3.5Å; T319-L323 VanDerWaalsContact O-N 3.11Å; T319-L362 HydrophobicContact CG2-CD1 4.38Å; T319-L362 HydrophobicContact CG2-CD2 4.5Å
320	L	95.3	Very high	93.1	Very high	0 Å²	0	49 Å²	49	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-73.1	-37.3	176.8	179.8	54.7	0	0	0	111.9	T308 Q310 F316 T317 L323 E324 I334 R337 L362	T308-L320 HydrophobicContact CG2-CD1 3.68Å; Q310-L320 HydrophobicContact CG-CD2 4.17Å; F316-L320 WeakPolarHBondContact O-CB 3.49Å; F316-L320 PolarHBondContact O-N 3.21Å; T317-L320 PolarHBondContact O-N 3.4Å; T317-L320 VanDerWaalsContact O-N 3.08Å; L320-L323 HydrophobicContact CD1-CD2 4.32Å; L320-L323 CarbonylContact O-C 3.21Å; L320-L323 WeakPolarHBondContact O-CB 3.31Å; L320-L323 PolarHBondContact O-N 3.5Å; L320-E324 WeakPolarHBondContact O-CB 3.42Å; L320-E324 PolarHBondContact O-N 3.24Å; L320-I334 HydrophobicContact CD1-CD1 4.38Å; L320-R337 HydrophobicContact CD2-CG 4.06Å; L320-L362 HydrophobicContact CB-CD1 3.99Å
321	D	93.7	Very high	93.1	Very high	74 Å²	74	51.6 Å²	51.6	40%	0.396	27%	0.273	S	S	.	.	H	α-helix	trans	-68.5	-37.7	179	-61.2	-32.6	0	0	0	111.8	T317 E324 Q325 R337	T317-D321 VanDerWaalsContact O-CG 3.26Å; T317-D321 PolarHBondContact O-N 3.24Å; D321-E324 PolarHBondContact O-N 2.9Å; D321-Q325 PolarHBondContact O-N 3Å; D321-Q325 VanDerWaalsContact O-N 3.15Å; D321-R337 IonicContact OD1-CZ 2.7Å; D321-R337 VanDerWaalsContact OD1-CZ 3.27Å; D321-R337 IonicContact OD1-NH1 2.65Å; D321-R337 PolarHBondContact OD1-NH1 3.31Å; D321-R337 IonicContact OD1-NH2 3.1Å; D321-R337 PolarHBondContact OD1-NH2 3.28Å
322	D	94.5	Very high	93.2	Very high	30 Å²	30	50.9 Å²	50.9	16%	0.16	27%	0.27	C	S	.	.	H	α-helix	trans	-64.2	-38.8	168.3	171.9	96.9	0	0	0	112.1	T288 N291 S318 R326	T288-D322 HydrophobicContact CG2-CB 3.66Å; T288-D322 VanDerWaalsContact CG2-CG 3.42Å; N291-D322 WeakPolarHBondContact CB-OD2 3.38Å; N291-D322 PolarHBondContact ND2-OD2 3.22Å; S318-D322 PolarHBondContact O-N 3.06Å; D322-R326 VanDerWaalsContact CG-NE 3.27Å; D322-R326 VanDerWaalsContact O-CG 3.32Å; D322-R326 WeakPolarHBondContact O-CG 3.42Å; D322-R326 PolarHBondContact O-N 3Å; D322-R326 VanDerWaalsContact O-N 3.12Å; D322-R326 IonicContact OD1-CZ 2.67Å; D322-R326 VanDerWaalsContact OD1-CZ 3.31Å; D322-R326 IonicContact OD1-NE 3.64Å; D322-R326 PolarHBondContact OD1-NE 3.48Å; D322-R326 VanDerWaalsContact OD1-NE 3.09Å; D322-R326 IonicContact OD1-NH2 2.65Å; D322-R326 PolarHBondContact OD1-NH2 3.19Å; D322-R326 WeakPolarHBondContact OD2-CD 3.34Å; D322-R326 IonicContact OD2-CZ 3.83Å; D322-R326 IonicContact OD2-NE 3.62Å; D322-R326 PolarHBondContact OD2-NE 3.45Å; D322-R326 IonicContact OD2-NH2 2.62Å
323	L	95.9	Very high	93.3	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-64.3	-43.3	174.8	-177.1	62	0	0	0	111.2	N291 R294 V295 T319 L320 Q325 R326 V327 V360	N291-L323 HydrophobicContact CB-CB 4.42Å; N291-L323 HydrophobicContact CB-CD1 3.92Å; N291-L323 PolarHBondContact ND2-N 2.94Å; R294-L323 HydrophobicContact CB-CD1 4.45Å; V295-L323 HydrophobicContact CG2-CD1 4.24Å; T319-L323 WeakPolarHBondContact O-CB 3.46Å; T319-L323 PolarHBondContact O-N 3.5Å; T319-L323 VanDerWaalsContact O-N 3.11Å; L320-L323 HydrophobicContact CD1-CD2 4.32Å; L320-L323 CarbonylContact O-C 3.21Å; L320-L323 WeakPolarHBondContact O-CB 3.31Å; L320-L323 PolarHBondContact O-N 3.5Å; L323-Q325 VanDerWaalsContact C-N 3.35Å; L323-Q325 PolarHBondContact O-N 3.47Å; L323-R326 PolarHBondContact O-N 3.47Å; L323-R326 VanDerWaalsContact O-N 3.17Å; L323-V327 HydrophobicContact CD1-CG1 3.87Å; L323-V327 HydrophobicContact CG-CG1 4.17Å; L323-V327 WeakPolarHBondContact O-CG1 3.49Å; L323-V327 WeakPolarHBondContact O-CG2 3.31Å; L323-V327 PolarHBondContact O-N 3.11Å; L323-V360 HydrophobicContact CD2-CG1 4.26Å; L323-V360 HydrophobicContact CD2-CG2 4.44Å
324	E	95.5	Very high	93.8	Very high	82 Å²	82	52.1 Å²	52.1	38%	0.383	27%	0.269	S	S	.	.	H	α-helix	trans	-60.9	-41.2	179.8	-172.3	171.6	142.9	0	0	111.7	L320 D321 V327 K328 I334 R337	L320-E324 WeakPolarHBondContact O-CB 3.42Å; L320-E324 PolarHBondContact O-N 3.24Å; D321-E324 PolarHBondContact O-N 2.9Å; E324-V327 WeakPolarHBondContact O-CG2 3.25Å; E324-K328 VanDerWaalsContact O-CB 3.29Å; E324-K328 WeakPolarHBondContact O-CB 3.23Å; E324-K328 PolarHBondContact O-N 2.91Å; E324-I334 HydrophobicContact CB-CD1 3.94Å; E324-I334 HydrophobicContact CG-CD1 3.95Å; E324-R337 IonicContact OE2-CZ 2.75Å; E324-R337 IonicContact OE2-NH1 3.52Å; E324-R337 PolarHBondContact OE2-NH1 2.99Å
325	Q	95.4	Very high	94.1	Very high	117 Å²	117	50.1 Å²	50.1	55%	0.547	26%	0.264	S	S	.	.	H	α-helix	trans	-61.1	-51	171.1	-179.9	176.3	-19.2	0	0	111.5	D321 L323 V327 K328 E329	D321-Q325 PolarHBondContact O-N 3Å; D321-Q325 VanDerWaalsContact O-N 3.15Å; L323-Q325 VanDerWaalsContact C-N 3.35Å; L323-Q325 PolarHBondContact O-N 3.47Å; Q325-V327 PolarHBondContact O-N 3.34Å; Q325-K328 WeakPolarHBondContact O-CB 3.46Å; Q325-K328 PolarHBondContact O-N 2.98Å; Q325-E329 HydrophobicContact CG-CG 4.49Å; Q325-E329 VanDerWaalsContact CG-OE1 3.3Å; Q325-E329 WeakPolarHBondContact CG-OE1 3.48Å; Q325-E329 PolarHBondContact NE2-OE1 3.15Å; Q325-E329 WeakPolarHBondContact O-CG 3.34Å; Q325-E329 PolarHBondContact O-N 3.21Å
326	R	95.5	Very high	94.5	Very high	85 Å²	85	50.5 Å²	50.5	32%	0.321	27%	0.266	S	S	.	.	H	α-helix	trans	-68.1	-34.8	-174.6	-67.4	175.6	-165.2	-70.6	-10.1	113.8	V295 D322 L323 A330	V295-R326 HydrophobicContact CG2-CB 4.04Å; D322-R326 VanDerWaalsContact CG-NE 3.27Å; D322-R326 VanDerWaalsContact O-CG 3.32Å; D322-R326 WeakPolarHBondContact O-CG 3.42Å; D322-R326 PolarHBondContact O-N 3Å; D322-R326 VanDerWaalsContact O-N 3.12Å; D322-R326 IonicContact OD1-CZ 2.67Å; D322-R326 VanDerWaalsContact OD1-CZ 3.31Å; D322-R326 IonicContact OD1-NE 3.64Å; D322-R326 PolarHBondContact OD1-NE 3.48Å; D322-R326 VanDerWaalsContact OD1-NE 3.09Å; D322-R326 IonicContact OD1-NH2 2.65Å; D322-R326 PolarHBondContact OD1-NH2 3.19Å; D322-R326 WeakPolarHBondContact OD2-CD 3.34Å; D322-R326 IonicContact OD2-CZ 3.83Å; D322-R326 IonicContact OD2-NE 3.62Å; D322-R326 PolarHBondContact OD2-NE 3.45Å; D322-R326 IonicContact OD2-NH2 2.62Å; L323-R326 PolarHBondContact O-N 3.47Å; L323-R326 VanDerWaalsContact O-N 3.17Å; R326-A330 WeakPolarHBondContact O-CB 3.48Å; R326-A330 PolarHBondContact O-N 2.99Å
327	V	96.5	Very high	94.7	Very high	2 Å²	2	55 Å²	55	1%	0.012	28%	0.283	C	S	.	.	H	α-helix	trans	-69.5	-37.9	175.1	-62.9	0	0	0	0	110.9	V295 F298 I306 L323 E324 Q325 A330 G331 I332 I334	V295-V327 HydrophobicContact CG2-CG1 3.86Å; F298-V327 HydrophobicContact CD2-CG1 4.48Å; F298-V327 HydrophobicContact CE2-CG1 4.37Å; I306-V327 HydrophobicContact CD1-CG1 3.91Å; L323-V327 HydrophobicContact CD1-CG1 3.87Å; L323-V327 HydrophobicContact CG-CG1 4.17Å; L323-V327 WeakPolarHBondContact O-CG1 3.49Å; L323-V327 WeakPolarHBondContact O-CG2 3.31Å; L323-V327 PolarHBondContact O-N 3.11Å; E324-V327 WeakPolarHBondContact O-CG2 3.25Å; Q325-V327 PolarHBondContact O-N 3.34Å; V327-A330 CarbonylContact O-C 3.57Å; V327-A330 WeakPolarHBondContact O-CA 3.21Å; V327-A330 WeakPolarHBondContact O-CB 3.34Å; V327-A330 PolarHBondContact O-N 3.5Å; V327-G331 PolarHBondContact O-N 3.35Å; V327-G331 VanDerWaalsContact O-N 3.07Å; V327-I332 CarbonylContact C-O 3.57Å; V327-I332 VanDerWaalsContact C-O 3.3Å; V327-I332 HydrophobicContact CB-CB 3.97Å; V327-I332 HydrophobicContact CB-CG2 4.15Å; V327-I332 HydrophobicContact CG1-CG2 4.42Å; V327-I332 PolarHBondContact O-N 3.43Å; V327-I332 VanDerWaalsContact O-O 3.12Å; V327-I334 HydrophobicContact CG2-CD1 4.08Å; V327-I334 HydrophobicContact CG2-CG1 3.82Å
328	K	94.7	Very high	94.9	Very high	172 Å²	172	55 Å²	55	75%	0.748	28%	0.28	S	S	*	.	H	α-helix	trans	-63.7	-45.4	174.7	-174.9	177.7	-178.5	177.4	0	112.2	E324 Q325 A330 G331	E324-K328 VanDerWaalsContact O-CB 3.29Å; E324-K328 WeakPolarHBondContact O-CB 3.23Å; E324-K328 PolarHBondContact O-N 2.91Å; Q325-K328 WeakPolarHBondContact O-CB 3.46Å; Q325-K328 PolarHBondContact O-N 2.98Å; K328-A330 PolarHBondContact O-N 2.98Å; K328-G331 PolarHBondContact O-N 3.36Å
329	E	96	Very high	95.2	Very high	130 Å²	130	57.3 Å²	57.3	61%	0.607	30%	0.296	S	S	*	.	H	α-helix	trans	-61.2	-28.8	170.7	-71.2	170.2	-176.3	0	0	112.6	Q325	Q325-E329 HydrophobicContact CG-CG 4.49Å; Q325-E329 VanDerWaalsContact CG-OE1 3.3Å; Q325-E329 WeakPolarHBondContact CG-OE1 3.48Å; Q325-E329 PolarHBondContact NE2-OE1 3.15Å; Q325-E329 WeakPolarHBondContact O-CG 3.34Å; Q325-E329 PolarHBondContact O-N 3.21Å
330	A	95.5	Very high	95.3	Very high	20 Å²	20	57.6 Å²	57.6	17%	0.165	30%	0.297	C	S	.	.	H	α-helix	trans	-83.1	-9.8	178.4	0	0	0	0	0	115.3	V295 K299 R326 V327 K328 I332	V295-A330 HydrophobicContact CG1-CB 3.55Å; K299-A330 VanDerWaalsContact CE-CB 3.4Å; K299-A330 WeakPolarHBondContact CE-O 3.23Å; R326-A330 WeakPolarHBondContact O-CB 3.48Å; R326-A330 PolarHBondContact O-N 2.99Å; V327-A330 CarbonylContact O-C 3.57Å; V327-A330 WeakPolarHBondContact O-CA 3.21Å; V327-A330 WeakPolarHBondContact O-CB 3.34Å; V327-A330 PolarHBondContact O-N 3.5Å; K328-A330 PolarHBondContact O-N 2.98Å; A330-I332 HydrophobicContact CB-CD1 4.03Å; A330-I332 HydrophobicContact CB-CG1 4.23Å
331	G	95.1	Very high	95.1	Very high	63 Å²	63	63.1 Å²	63.1	65%	0.649	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.2	24.3	-173.3	0	0	0	0	0	114.5	V327 K328	V327-G331 PolarHBondContact O-N 3.35Å; V327-G331 VanDerWaalsContact O-N 3.07Å; K328-G331 PolarHBondContact O-N 3.36Å
332	I	96.8	Very high	94.9	Very high	11 Å²	11	64.3 Å²	64.3	6%	0.056	34%	0.336	C	S	.	.			trans	-114.1	131.2	-176.5	-60.4	170.9	0	0	0	109.1	F298 K299 S304 I306 V327 A330	F298-I332 HydrophobicContact CB-CD1 3.7Å; F298-I332 HydrophobicContact CD2-CD1 4.24Å; K299-I332 HydrophobicContact CG-CD1 4.3Å; S304-I332 WeakPolarHBondContact O-CA 3.24Å; I306-I332 HydrophobicContact CG2-CG2 4.26Å; V327-I332 CarbonylContact C-O 3.57Å; V327-I332 VanDerWaalsContact C-O 3.3Å; V327-I332 HydrophobicContact CB-CB 3.97Å; V327-I332 HydrophobicContact CB-CG2 4.15Å; V327-I332 HydrophobicContact CG1-CG2 4.42Å; V327-I332 PolarHBondContact O-N 3.43Å; V327-I332 VanDerWaalsContact O-O 3.12Å; A330-I332 HydrophobicContact CB-CD1 4.03Å; A330-I332 HydrophobicContact CB-CG1 4.23Å
333	E	94.4	Very high	94.9	Very high	105 Å²	105	67.3 Å²	67.3	49%	0.491	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	136.2	-177.6	-178.2	-172	-124.7	0	0	111.7	S304 R305 I306 S335	S304-E333 PolarHBondContact O-N 2.82Å; R305-E333 WeakPolarHBondContact CA-O 3.48Å; R305-E333 HydrophobicContact CG-CB 4.38Å; R305-E333 IonicContact CZ-OE2 3.78Å; R305-E333 IonicContact NE-OE2 3.63Å; R305-E333 PolarHBondContact NE-OE2 3.36Å; R305-E333 IonicContact NH2-OE2 2.82Å; R305-E333 PolarHBondContact NH2-OE2 3Å; I306-E333 PolarHBondContact N-O 3.29Å; E333-S335 PolarHBondContact O-N 2.82Å
334	I	95.5	Very high	94.9	Very high	36 Å²	36	67.4 Å²	67.4	19%	0.185	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	105.3	161.6	-56.4	-175.1	0	0	0	107.9	I306 T308 L320 E324 V327 R337	I306-I334 HydrophobicContact CD1-CG1 4.25Å; I306-I334 HydrophobicContact CG1-CG1 4.07Å; I306-I334 CarbonylContact O-C 3.56Å; I306-I334 WeakPolarHBondContact O-CA 3.44Å; T308-I334 HydrophobicContact CG2-CD1 4.17Å; T308-I334 HydrophobicContact CG2-CG2 4.14Å; L320-I334 HydrophobicContact CD1-CD1 4.38Å; E324-I334 HydrophobicContact CB-CD1 3.94Å; E324-I334 HydrophobicContact CG-CD1 3.95Å; V327-I334 HydrophobicContact CG2-CD1 4.08Å; V327-I334 HydrophobicContact CG2-CG1 3.82Å; I334-R337 HydrophobicContact CG2-CB 4.44Å
335	S	91.9	Very high	94.9	Very high	40 Å²	40	64 Å²	64	28%	0.28	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	-29.9	-177.8	62.7	0	0	0	0	113.1	I306 E333	I306-S335 PolarHBondContact O-N 3.06Å; I306-S335 PolarHBondContact O-OG 3.09Å; E333-S335 PolarHBondContact O-N 2.82Å
336	V	94.1	Very high	94.9	Very high	18 Å²	18	62.8 Å²	62.8	11%	0.109	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	123.6	179	-170	0	0	0	0	109.7	A307 T308 Q338 L351 Q354	A307-V336 CarbonylContact C-O 3.59Å; A307-V336 VanDerWaalsContact CA-O 3.31Å; A307-V336 WeakPolarHBondContact CA-O 3.44Å; A307-V336 HydrophobicContact CB-CB 4.07Å; T308-V336 PolarHBondContact N-O 3.38Å; V336-Q338 HydrophobicContact CG1-CG 4Å; V336-L351 HydrophobicContact CB-CD2 4.43Å; V336-L351 HydrophobicContact CG1-CD2 4.22Å; V336-Q354 HydrophobicContact CG2-CB 3.6Å; V336-Q354 HydrophobicContact CG2-CG 3.88Å
337	R	95.8	Very high	95	Very high	97 Å²	97	59 Å²	59	37%	0.366	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	127.5	167.3	-174.9	166.5	177.3	163.8	0.3	108.4	L320 D321 E324 I334	L320-R337 HydrophobicContact CD2-CG 4.06Å; D321-R337 IonicContact OD1-CZ 2.7Å; D321-R337 VanDerWaalsContact OD1-CZ 3.27Å; D321-R337 IonicContact OD1-NH1 2.65Å; D321-R337 PolarHBondContact OD1-NH1 3.31Å; D321-R337 IonicContact OD1-NH2 3.1Å; D321-R337 PolarHBondContact OD1-NH2 3.28Å; E324-R337 IonicContact OE2-CZ 2.75Å; E324-R337 IonicContact OE2-NH1 3.52Å; E324-R337 PolarHBondContact OE2-NH1 2.99Å; I334-R337 HydrophobicContact CG2-CB 4.44Å
338	Q	97.1	Very high	95	Very high	41 Å²	41	59 Å²	59	19%	0.192	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	151.5	174.3	-67.8	-63.7	-87.1	0	0	110.8	T308 I309 Q310 V336 A347 N350 L351	T308-Q338 PolarHBondContact O-N 3.08Å; I309-Q338 WeakPolarHBondContact CA-O 3.35Å; I309-Q338 HydrophobicContact CB-CB 4.36Å; I309-Q338 HydrophobicContact CG1-CB 4.39Å; Q310-Q338 PolarHBondContact N-O 3.06Å; Q310-Q338 VanDerWaalsContact N-O 3.07Å; V336-Q338 HydrophobicContact CG1-CG 4Å; Q338-A347 HydrophobicContact CB-CB 4.01Å; Q338-A347 HydrophobicContact CG-CB 4.38Å; Q338-N350 HydrophobicContact CG-CB 4.46Å; Q338-N350 PolarHBondContact OE1-ND2 3.1Å; Q338-L351 HydrophobicContact CG-CD2 4.25Å; Q338-L351 HydrophobicContact CG-CG 4.36Å
339	S	96.1	Very high	95.1	Very high	76 Å²	76	55.4 Å²	55.4	53%	0.531	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	143.5	176.1	55.8	0	0	0	0	111.4	Q310	Q310-S339 CarbonylContact O-C 3.55Å; Q310-S339 VanDerWaalsContact O-CA 3.24Å; Q310-S339 WeakPolarHBondContact O-CA 3.43Å
340	F	96.4	Very high	95.1	Very high	10 Å²	10	51.9 Å²	51.9	4%	0.044	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	157.8	175.6	68.6	-81.3	0	0	0	111.6	I309 Q310 Q311 T312 D343 P344 F363 E367 V371	I309-F340 HydrophobicContact CD1-CD1 4.32Å; I309-F340 HydrophobicContact CD1-CE1 4.35Å; I309-F340 HydrophobicContact CG1-CD1 4.1Å; I309-F340 HydrophobicContact CG1-CE1 4.09Å; Q310-F340 VanDerWaalsContact O-CD1 3.27Å; Q310-F340 WeakPolarHBondContact O-CD1 3.41Å; Q310-F340 PolarHBondContact O-N 3.27Å; Q311-F340 CarbonylContact C-O 3.53Å; Q311-F340 WeakPolarHBondContact CA-O 3.33Å; Q311-F340 HydrophobicContact CB-CE2 4.49Å; Q311-F340 HydrophobicContact CB-CZ 4.2Å; T312-F340 PolarHBondContact N-O 2.94Å; T312-F340 PolarHBondContact OG1-O 2.03Å; F340-D343 WeakPolarHBondContact CB-O 3.39Å; F340-P344 HydrophobicContact CD1-CB 4.21Å; F340-P344 HydrophobicContact CD2-CB 4.07Å; F340-P344 HydrophobicContact CE1-CB 4.26Å; F340-P344 HydrophobicContact CE2-CB 4.13Å; F340-P344 HydrophobicContact CG-CB 4.12Å; F340-P344 HydrophobicContact CZ-CB 4.23Å; F340-F363 AromaticContact CE1-CD1 3.97Å; F340-F363 HydrophobicContact CE1-CD1 3.97Å; F340-F363 HydrophobicContact CZ-CB 4.1Å; F340-F363 HydrophobicContact CZ-CD1 4.13Å; F340-F363 HydrophobicContact CZ-CG 4.31Å; F340-E367 HydrophobicContact CE2-CB 3.98Å; F340-E367 HydrophobicContact CE2-CG 4.24Å; F340-E367 HydrophobicContact CZ-CB 4.01Å; F340-V371 HydrophobicContact CE1-CG2 3.91Å; F340-V371 HydrophobicContact CE2-CG2 4.44Å; F340-V371 HydrophobicContact CZ-CG2 3.63Å
341	L	91.8	Very high	95.1	Very high	117 Å²	117	50.9 Å²	50.9	61%	0.613	29%	0.288	S	S	*	.	S	Bend	trans	-100.7	-44.4	176.1	-170.8	68.4	0	0	0	112.1
342	T	88.5	Confident	95	Very high	98 Å²	98	52.4 Å²	52.4	60%	0.601	28%	0.276	S	S	*	.	S	Bend	trans	-145.1	-31.4	-174.2	49.4	0	0	0	0	114.7
343	D	94	Very high	94.7	Very high	93 Å²	93	61.7 Å²	61.7	50%	0.497	31%	0.311	S	S	.	.			trans	-113.2	115.9	175.5	173.4	23.1	0	0	0	110.8	F340 A345	F340-D343 WeakPolarHBondContact CB-O 3.39Å; D343-A345 WeakPolarHBondContact OD1-CB 3.49Å; D343-A345 PolarHBondContact OD1-N 3.24Å
344	P	96	Very high	94.5	Very high	3 Å²	3	62.6 Å²	62.6	2%	0.019	32%	0.315	C	S	.	.			trans	-86	-8.2	177.1	34.4	-34.7	0	0	0	114.6	F340 V346 A347 V348 K370 V371 E374	F340-P344 HydrophobicContact CD1-CB 4.21Å; F340-P344 HydrophobicContact CD2-CB 4.07Å; F340-P344 HydrophobicContact CE1-CB 4.26Å; F340-P344 HydrophobicContact CE2-CB 4.13Å; F340-P344 HydrophobicContact CG-CB 4.12Å; F340-P344 HydrophobicContact CZ-CB 4.23Å; P344-V346 VanDerWaalsContact C-N 3.34Å; P344-V346 PolarHBondContact O-N 3.09Å; P344-A347 WeakPolarHBondContact O-CB 3.21Å; P344-A347 PolarHBondContact O-N 3.17Å; P344-V348 PolarHBondContact O-N 3.47Å; P344-K370 HydrophobicContact CG-CB 4.01Å; P344-V371 HydrophobicContact CB-CB 4.43Å; P344-V371 HydrophobicContact CB-CG2 3.57Å; P344-V371 HydrophobicContact CG-CG2 3.9Å; P344-E374 HydrophobicContact CG-CG 4.46Å
345	A	95.8	Very high	94.2	Very high	11 Å²	11	63.6 Å²	63.6	9%	0.091	32%	0.321	C	S	.	.	H	α-helix	trans	-59.9	-39.4	-166.4	0	0	0	0	0	113.7	D343 K349 E374	D343-A345 WeakPolarHBondContact OD1-CB 3.49Å; D343-A345 PolarHBondContact OD1-N 3.24Å; A345-K349 WeakPolarHBondContact O-CB 3.04Å; A345-K349 WeakPolarHBondContact O-CD 3.49Å; A345-K349 WeakPolarHBondContact O-CG 3.32Å; A345-K349 PolarHBondContact O-N 3.36Å; A345-K349 VanDerWaalsContact O-N 3.14Å; A345-E374 HydrophobicContact CB-CG 3.92Å
346	V	96.2	Very high	94.3	Very high	91 Å²	91	61.8 Å²	61.8	55%	0.552	31%	0.308	S	S	*	.	H	α-helix	trans	-67.9	-39.2	176.1	-179.4	0	0	0	0	111.4	P344 K349 N350	P344-V346 VanDerWaalsContact C-N 3.34Å; P344-V346 PolarHBondContact O-N 3.09Å; V346-K349 PolarHBondContact O-N 3.24Å; V346-N350 VanDerWaalsContact O-CG 3.31Å; V346-N350 PolarHBondContact O-N 3.34Å; V346-N350 PolarHBondContact O-ND2 2.9Å
347	A	96.8	Very high	94.3	Very high	6 Å²	6	61.1 Å²	61.1	5%	0.05	30%	0.304	C	S	.	.	H	α-helix	trans	-65.7	-44.4	178.8	0	0	0	0	0	111.8	I309 Q338 P344 N350 L351	I309-A347 HydrophobicContact CD1-CB 3.7Å; I309-A347 HydrophobicContact CG1-CB 4.37Å; Q338-A347 HydrophobicContact CB-CB 4.01Å; Q338-A347 HydrophobicContact CG-CB 4.38Å; P344-A347 WeakPolarHBondContact O-CB 3.21Å; P344-A347 PolarHBondContact O-N 3.17Å; A347-N350 PolarHBondContact O-N 3.26Å; A347-L351 WeakPolarHBondContact O-CG 3.36Å; A347-L351 PolarHBondContact O-N 2.93Å
348	V	97.1	Very high	94.3	Very high	0 Å²	0	56.5 Å²	56.5	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-63.1	-42.2	176.5	176.2	0	0	0	0	111.4	I309 P344 N350 L351 K352 V371 E374 V375 E378 L380	I309-V348 HydrophobicContact CD1-CG2 4.31Å; P344-V348 PolarHBondContact O-N 3.47Å; V348-N350 VanDerWaalsContact C-N 3.32Å; V348-N350 PolarHBondContact O-N 3.45Å; V348-L351 PolarHBondContact O-N 3.01Å; V348-K352 PolarHBondContact O-N 3.38Å; V348-K352 VanDerWaalsContact O-N 3.11Å; V348-V371 HydrophobicContact CG2-CG1 4.34Å; V348-E374 HydrophobicContact CB-CB 4.28Å; V348-E374 HydrophobicContact CG1-CB 4.34Å; V348-E374 HydrophobicContact CG2-CB 4.17Å; V348-V375 HydrophobicContact CG1-CG2 3.9Å; V348-V375 HydrophobicContact CG2-CG2 4.15Å; V348-E378 HydrophobicContact CG1-CB 4.17Å; V348-E378 HydrophobicContact CG1-CG 4.23Å; V348-L380 HydrophobicContact CG1-CD2 4.1Å
349	K	95.8	Very high	94.4	Very high	97 Å²	97	54.6 Å²	54.6	42%	0.422	28%	0.278	S	S	.	.	H	α-helix	trans	-61.1	-38.3	174.4	-77.7	164.4	-178.8	154.6	0	112.7	A345 V346 R353 E378	A345-K349 WeakPolarHBondContact O-CB 3.04Å; A345-K349 WeakPolarHBondContact O-CD 3.49Å; A345-K349 WeakPolarHBondContact O-CG 3.32Å; A345-K349 PolarHBondContact O-N 3.36Å; A345-K349 VanDerWaalsContact O-N 3.14Å; V346-K349 PolarHBondContact O-N 3.24Å; K349-R353 WeakPolarHBondContact O-CB 3.36Å; K349-R353 PolarHBondContact O-N 3.44Å; K349-E378 WeakPolarHBondContact CE-OE1 3.39Å; K349-E378 HydrophobicContact CG-CG 3.98Å; K349-E378 WeakPolarHBondContact CG-OE1 3.32Å
350	N	95.8	Very high	94.5	Very high	56 Å²	56	51 Å²	51	30%	0.299	25%	0.252	S	S	.	.	H	α-helix	trans	-68.7	-40.7	175.7	-74.7	-22.9	0	0	0	112.8	Q338 V346 A347 V348 R353 Q354	Q338-N350 HydrophobicContact CG-CB 4.46Å; Q338-N350 PolarHBondContact OE1-ND2 3.1Å; V346-N350 VanDerWaalsContact O-CG 3.31Å; V346-N350 PolarHBondContact O-N 3.34Å; V346-N350 PolarHBondContact O-ND2 2.9Å; A347-N350 PolarHBondContact O-N 3.26Å; V348-N350 VanDerWaalsContact C-N 3.32Å; V348-N350 PolarHBondContact O-N 3.45Å; N350-R353 PolarHBondContact O-N 3.14Å; N350-Q354 VanDerWaalsContact O-CG 3.31Å; N350-Q354 WeakPolarHBondContact O-CG 3.39Å; N350-Q354 PolarHBondContact O-N 3.37Å
351	L	95.7	Very high	94.5	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-57.2	-50.3	174.1	-69.6	172.8	0	0	0	111	A307 I309 V336 Q338 A347 V348 R353 Q354 A356 I359 L380 W387	A307-L351 HydrophobicContact CB-CD2 3.77Å; I309-L351 HydrophobicContact CB-CD1 4.11Å; I309-L351 HydrophobicContact CD1-CD1 4.08Å; I309-L351 HydrophobicContact CG2-CD1 3.98Å; V336-L351 HydrophobicContact CB-CD2 4.43Å; V336-L351 HydrophobicContact CG1-CD2 4.22Å; Q338-L351 HydrophobicContact CG-CD2 4.25Å; Q338-L351 HydrophobicContact CG-CG 4.36Å; A347-L351 WeakPolarHBondContact O-CG 3.36Å; A347-L351 PolarHBondContact O-N 2.93Å; V348-L351 PolarHBondContact O-N 3.01Å; L351-R353 VanDerWaalsContact C-N 3.34Å; L351-R353 PolarHBondContact O-N 3.28Å; L351-Q354 PolarHBondContact O-N 3.18Å; L351-Q354 VanDerWaalsContact O-N 3.13Å; L351-A356 HydrophobicContact CB-CB 4.04Å; L351-A356 HydrophobicContact CD2-CB 4.03Å; L351-A356 VanDerWaalsContact O-CB 3.25Å; L351-A356 WeakPolarHBondContact O-CB 3.22Å; L351-A356 PolarHBondContact O-N 3.23Å; L351-I359 HydrophobicContact CD1-CD1 4.47Å; L351-I359 HydrophobicContact CD1-CG2 4.09Å; L351-L380 HydrophobicContact CB-CD2 3.74Å; L351-L380 HydrophobicContact CD1-CD2 4.26Å; L351-W387 HydrophobicContact CD1-CH2 4.25Å
352	K	92.8	Very high	94.7	Very high	94 Å²	94	45 Å²	45	41%	0.409	22%	0.221	S	C	.	.	H	α-helix	trans	-58.2	-42.4	176.1	176	172.9	170.5	179.4	0	112.9	V348 Q354 D355 E378 L380	V348-K352 PolarHBondContact O-N 3.38Å; V348-K352 VanDerWaalsContact O-N 3.11Å; K352-Q354 PolarHBondContact O-N 2.95Å; K352-Q354 VanDerWaalsContact O-N 3.14Å; K352-D355 PolarHBondContact O-N 2.9Å; K352-E378 HydrophobicContact CD-CB 3.89Å; K352-E378 HydrophobicContact CD-CG 4.48Å; K352-E378 VanDerWaalsContact CD-O 3.3Å; K352-E378 WeakPolarHBondContact CD-O 3.41Å; K352-E378 VanDerWaalsContact CD-OE2 3.28Å; K352-E378 WeakPolarHBondContact CD-OE2 3.34Å; K352-E378 VanDerWaalsContact CE-O 3.31Å; K352-E378 WeakPolarHBondContact CE-O 3.36Å; K352-E378 WeakPolarHBondContact CE-OE2 3.45Å; K352-E378 PolarHBondContact NZ-O 2.87Å; K352-E378 IonicContact NZ-OE2 2.64Å; K352-E378 PolarHBondContact NZ-OE2 3.49Å; K352-L380 HydrophobicContact CB-CD1 4.06Å
353	R	91.6	Very high	95	Very high	206 Å²	206	40.3 Å²	40.3	78%	0.777	19%	0.193	S	C	*	.	H	α-helix	trans	-62.5	-18	179.4	-174.1	173.5	178.7	-176.1	0.7	113.4	K349 N350 L351	K349-R353 WeakPolarHBondContact O-CB 3.36Å; K349-R353 PolarHBondContact O-N 3.44Å; N350-R353 PolarHBondContact O-N 3.14Å; L351-R353 VanDerWaalsContact C-N 3.34Å; L351-R353 PolarHBondContact O-N 3.28Å
354	Q	90.4	Very high	94.7	Very high	124 Å²	124	39.4 Å²	39.4	58%	0.579	18%	0.183	S	C	*	.	T	Hydrogen-bonded Turn	trans	-109.2	11.2	-175.7	-61.3	-70.6	-1	0	0	114.2	V336 N350 L351 K352 A356	V336-Q354 HydrophobicContact CG2-CB 3.6Å; V336-Q354 HydrophobicContact CG2-CG 3.88Å; N350-Q354 VanDerWaalsContact O-CG 3.31Å; N350-Q354 WeakPolarHBondContact O-CG 3.39Å; N350-Q354 PolarHBondContact O-N 3.37Å; L351-Q354 PolarHBondContact O-N 3.18Å; L351-Q354 VanDerWaalsContact O-N 3.13Å; K352-Q354 PolarHBondContact O-N 2.95Å; K352-Q354 VanDerWaalsContact O-N 3.14Å; Q354-A356 PolarHBondContact O-N 3.46Å
355	D	89.1	Confident	94.2	Very high	58 Å²	58	41.4 Å²	41.4	31%	0.31	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.8	40.1	-172.7	-167.2	35.8	0	0	0	112.2	K352 R357 T576	K352-D355 PolarHBondContact O-N 2.9Å; D355-R357 PolarHBondContact O-N 3.31Å; D355-R357 IonicContact OD1-NE 2.74Å; D355-R357 PolarHBondContact OD1-NE 3.31Å; D355-R357 IonicContact OD2-NE 3.95Å; D355-R357 PolarHBondContact OD2-NE 3.42Å; D355-T576 WeakPolarHBondContact OD2-CG2 3.5Å; D355-T576 PolarHBondContact OD2-N 2.87Å; D355-T576 PolarHBondContact OD2-OG1 2.86Å
356	A	93.5	Very high	93.7	Very high	2 Å²	2	44.1 Å²	44.1	2%	0.017	21%	0.207	C	C	.	.			trans	-70.7	108.8	178.5	0	0	0	0	0	111	A307 L351 Q354 I359	A307-A356 HydrophobicContact CB-CB 3.7Å; L351-A356 HydrophobicContact CB-CB 4.04Å; L351-A356 HydrophobicContact CD2-CB 4.03Å; L351-A356 VanDerWaalsContact O-CB 3.25Å; L351-A356 WeakPolarHBondContact O-CB 3.22Å; L351-A356 PolarHBondContact O-N 3.23Å; Q354-A356 PolarHBondContact O-N 3.46Å; A356-I359 HydrophobicContact CB-CG1 4.45Å
357	R	93.3	Very high	93.5	Very high	3 Å²	3	40.7 Å²	40.7	1%	0.011	19%	0.185	C	C	.	.			trans	-99.5	-49.6	-173.5	-74.2	157	161.8	-92.6	-2.5	114.1	D355 K384 H385 V386 A573 D750	D355-R357 PolarHBondContact O-N 3.31Å; D355-R357 IonicContact OD1-NE 2.74Å; D355-R357 PolarHBondContact OD1-NE 3.31Å; D355-R357 IonicContact OD2-NE 3.95Å; D355-R357 PolarHBondContact OD2-NE 3.42Å; R357-K384 WeakPolarHBondContact CB-O 3.24Å; R357-K384 WeakPolarHBondContact CG-O 3.4Å; R357-H385 CarbonylContact O-C 3.59Å; R357-H385 VanDerWaalsContact O-CA 3.31Å; R357-H385 WeakPolarHBondContact O-CA 3.23Å; R357-V386 PolarHBondContact O-N 3.1Å; R357-A573 WeakPolarHBondContact CD-O 3.3Å; R357-A573 PolarHBondContact NH1-O 3.41Å; R357-D750 IonicContact CZ-OD1 2.58Å; R357-D750 VanDerWaalsContact CZ-OD1 3.3Å; R357-D750 IonicContact NH1-OD1 3.47Å; R357-D750 PolarHBondContact NH1-OD1 2.73Å; R357-D750 IonicContact NH2-OD1 3.62Å; R357-D750 PolarHBondContact NH2-OD1 2.77Å
358	I	97.1	Very high	93.4	Very high	1 Å²	1	40.4 Å²	40.4	1%	0.005	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	112.4	176.6	-49.2	-54	0	0	0	107.9	F298 W303 I306 A307 V386 F388 D574	F298-I358 HydrophobicContact CE1-CG2 4.33Å; W303-I358 HydrophobicContact CD2-CD1 3.73Å; W303-I358 HydrophobicContact CD2-CG1 3.77Å; W303-I358 HydrophobicContact CD2-CG2 4.3Å; W303-I358 VanDerWaalsContact CE2-CD1 3.48Å; W303-I358 HydrophobicContact CE3-CB 4.48Å; W303-I358 HydrophobicContact CE3-CD1 4.04Å; W303-I358 HydrophobicContact CE3-CG1 4.01Å; W303-I358 HydrophobicContact CE3-CG2 3.66Å; W303-I358 HydrophobicContact CG-CD1 4.31Å; W303-I358 HydrophobicContact CG-CG1 4.01Å; W303-I358 HydrophobicContact CH2-CD1 3.97Å; W303-I358 HydrophobicContact CZ2-CD1 3.61Å; W303-I358 HydrophobicContact CZ3-CD1 4.16Å; W303-I358 HydrophobicContact CZ3-CG2 3.84Å; I306-I358 CarbonylContact C-O 3.48Å; I306-I358 HydrophobicContact CG2-CB 4.21Å; I306-I358 HydrophobicContact CG2-CG2 3.91Å; A307-I358 PolarHBondContact N-O 3.39Å; I358-V386 HydrophobicContact CD1-CB 3.95Å; I358-V386 HydrophobicContact CD1-CG2 3.77Å; I358-F388 HydrophobicContact CG2-CD2 4.24Å; I358-F388 HydrophobicContact CG2-CE2 4Å; I358-D574 HydrophobicContact CG1-CB 4.35Å
359	I	98.2	Very high	93.2	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	126.3	-168	-53.4	168.9	0	0	0	110.3	A307 I309 L351 A356 L380 V386 W387 F388	A307-I359 CarbonylContact O-C 3.57Å; A307-I359 WeakPolarHBondContact O-CA 3.43Å; I309-I359 HydrophobicContact CG2-CG2 3.78Å; L351-I359 HydrophobicContact CD1-CD1 4.47Å; L351-I359 HydrophobicContact CD1-CG2 4.09Å; A356-I359 HydrophobicContact CB-CG1 4.45Å; I359-L380 HydrophobicContact CD1-CD2 3.91Å; I359-L380 HydrophobicContact CD1-CG 4Å; I359-V386 PolarHBondContact N-O 2.96Å; I359-W387 HydrophobicContact CB-CD2 4.16Å; I359-W387 HydrophobicContact CB-CE3 4.13Å; I359-W387 HydrophobicContact CB-CH2 4.47Å; I359-W387 HydrophobicContact CB-CZ2 4.47Å; I359-W387 HydrophobicContact CB-CZ3 4.31Å; I359-W387 HydrophobicContact CD1-CD2 4.41Å; I359-W387 HydrophobicContact CD1-CH2 4.12Å; I359-W387 HydrophobicContact CD1-CZ2 3.54Å; I359-W387 HydrophobicContact CG2-CD2 4.25Å; I359-W387 HydrophobicContact CG2-CE3 3.77Å; I359-W387 HydrophobicContact CG2-CH2 3.73Å; I359-W387 HydrophobicContact CG2-CZ2 4.18Å; I359-W387 HydrophobicContact CG2-CZ3 3.51Å; I359-W387 CarbonylContact O-C 3.5Å; I359-W387 WeakPolarHBondContact O-CA 3.27Å; I359-F388 PolarHBondContact O-N 3Å
360	V	98.4	Very high	93.2	Very high	0 Å²	0	39 Å²	39	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	118.6	173.2	-169.9	0	0	0	0	109.9	F298 I306 A307 T308 I309 L323 L362 F388	F298-V360 HydrophobicContact CZ-CG2 3.92Å; I306-V360 HydrophobicContact CD1-CG2 4.44Å; A307-V360 PolarHBondContact O-N 3.41Å; T308-V360 WeakPolarHBondContact CA-O 3.45Å; T308-V360 HydrophobicContact CG2-CB 4.19Å; T308-V360 HydrophobicContact CG2-CG2 4.44Å; I309-V360 PolarHBondContact N-O 2.9Å; L323-V360 HydrophobicContact CD2-CG1 4.26Å; L323-V360 HydrophobicContact CD2-CG2 4.44Å; V360-L362 HydrophobicContact CG1-CD2 4.38Å; V360-L362 HydrophobicContact CG1-CG 4.33Å; V360-F388 HydrophobicContact CB-CB 4.48Å; V360-F388 HydrophobicContact CG1-CB 4.32Å; V360-F388 HydrophobicContact CG2-CB 4.27Å
361	G	97.3	Very high	93.3	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	123.6	177.8	0	0	0	0	0	112.3	I309 F388	I309-G361 WeakPolarHBondContact O-CA 3.41Å; G361-F388 PolarHBondContact N-O 2.67Å
362	L	96.2	Very high	93.4	Very high	2 Å²	2	36.3 Å²	36.3	1%	0.01	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	88.8	179.7	-60.9	175.7	0	0	0	110.5	I309 Q310 Q311 F316 T319 L320 V360 I390	I309-L362 PolarHBondContact O-N 2.98Å; Q310-L362 CarbonylContact C-O 3.58Å; Q310-L362 VanDerWaalsContact CA-O 3.23Å; Q310-L362 WeakPolarHBondContact CA-O 3.38Å; Q310-L362 HydrophobicContact CB-CB 4.06Å; Q311-L362 PolarHBondContact N-O 3.1Å; F316-L362 HydrophobicContact CB-CB 3.95Å; F316-L362 HydrophobicContact CD1-CB 4.02Å; F316-L362 WeakPolarHBondContact CD2-O 3.19Å; F316-L362 HydrophobicContact CG-CB 4.13Å; F316-L362 WeakPolarHBondContact CG-O 3.27Å; T319-L362 HydrophobicContact CG2-CD1 4.38Å; T319-L362 HydrophobicContact CG2-CD2 4.5Å; L320-L362 HydrophobicContact CB-CD1 3.99Å; V360-L362 HydrophobicContact CG1-CD2 4.38Å; V360-L362 HydrophobicContact CG1-CG 4.33Å; L362-I390 HydrophobicContact CD2-CD1 4.16Å; L362-I390 HydrophobicContact CD2-CG1 4.19Å
363	F	93.7	Very high	93.6	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	14%	0.143	C	C	.	.	S	Bend	trans	-154.4	172.2	-175.7	35.7	-106.1	0	0	0	110.9	I309 Q311 F340 E367 A368 V371 F372 L389 Y393	I309-F363 HydrophobicContact CG2-CE1 4.28Å; Q311-F363 HydrophobicContact CB-CB 3.77Å; F340-F363 AromaticContact CE1-CD1 3.97Å; F340-F363 HydrophobicContact CE1-CD1 3.97Å; F340-F363 HydrophobicContact CZ-CB 4.1Å; F340-F363 HydrophobicContact CZ-CD1 4.13Å; F340-F363 HydrophobicContact CZ-CG 4.31Å; F363-E367 HydrophobicContact CB-CB 4.16Å; F363-A368 HydrophobicContact CD2-CB 3.71Å; F363-A368 HydrophobicContact CE2-CB 3.53Å; F363-V371 HydrophobicContact CD1-CG2 4.25Å; F363-V371 HydrophobicContact CE1-CB 4.45Å; F363-V371 HydrophobicContact CE1-CG1 4.1Å; F363-V371 HydrophobicContact CE1-CG2 4.02Å; F363-V371 HydrophobicContact CZ-CB 4.18Å; F363-V371 HydrophobicContact CZ-CG1 3.89Å; F363-V371 HydrophobicContact CZ-CG2 4.18Å; F363-F372 HydrophobicContact CZ-CE2 4.41Å; F363-L389 HydrophobicContact CE2-CD2 4.17Å; F363-L389 HydrophobicContact CZ-CD2 3.97Å; F363-Y393 WeakPolarHBondContact CD2-OH 3.15Å; F363-Y393 PolarHBondContact O-OH 2.74Å
364	Y	87.8	Confident	93.8	Very high	74 Å²	74	23.6 Å²	23.6	29%	0.29	11%	0.113	S	C	.	.			trans	-80.8	161.1	171.5	-74.2	-81.2	0	0	0	112.2	Q311 T313 F316 T366 E367 A368 W392	Q311-Y364 VanDerWaalsContact OE1-N 3.12Å; T313-Y364 HydrophobicContact CG2-CE2 4.46Å; F316-Y364 AromaticContact CE2-CD2 3.56Å; F316-Y364 HydrophobicContact CE2-CD2 3.56Å; F316-Y364 AromaticContact CE2-CE2 3.57Å; F316-Y364 HydrophobicContact CE2-CE2 3.57Å; F316-Y364 HydrophobicContact CE2-CG 4.32Å; F316-Y364 HydrophobicContact CZ-CD1 4.47Å; F316-Y364 AromaticContact CZ-CD2 3.75Å; F316-Y364 HydrophobicContact CZ-CD2 3.75Å; F316-Y364 AromaticContact CZ-CE2 3.74Å; F316-Y364 HydrophobicContact CZ-CE2 3.74Å; F316-Y364 HydrophobicContact CZ-CG 4.11Å; Y364-T366 VanDerWaalsContact C-N 3.31Å; Y364-T366 PolarHBondContact O-N 3.46Å; Y364-E367 CarbonylContact O-C 3.3Å; Y364-E367 PolarHBondContact O-N 2.93Å; Y364-A368 PolarHBondContact O-N 3.13Å; Y364-W392 AromaticContact CD1-CH2 3.79Å; Y364-W392 HydrophobicContact CD1-CH2 3.79Å; Y364-W392 AromaticContact CD1-CZ2 3.82Å; Y364-W392 HydrophobicContact CD1-CZ2 3.82Å; Y364-W392 AromaticContact CE1-CH2 3.37Å; Y364-W392 HydrophobicContact CE1-CH2 3.37Å; Y364-W392 AromaticContact CE1-CZ2 3.89Å; Y364-W392 HydrophobicContact CE1-CZ2 3.89Å; Y364-W392 HydrophobicContact CE1-CZ3 4.28Å
365	E	85.6	Confident	94.1	Very high	45 Å²	45	17.7 Å²	17.7	21%	0.21	9%	0.085	C	C	.	.	H	α-helix	trans	-55.3	-39.8	-177.9	-165.4	-158.5	90.7	0	0	113.7	E367 A368 R369 Y393 A394 W397	E365-E367 VanDerWaalsContact C-N 3.3Å; E365-E367 PolarHBondContact O-N 3.42Å; E365-A368 VanDerWaalsContact O-CB 3.32Å; E365-A368 WeakPolarHBondContact O-CB 3.23Å; E365-A368 PolarHBondContact O-N 2.9Å; E365-R369 PolarHBondContact O-N 3.29Å; E365-R369 VanDerWaalsContact O-N 3.13Å; E365-R369 IonicContact OE1-CZ 2.84Å; E365-R369 IonicContact OE1-NH1 2.71Å; E365-R369 PolarHBondContact OE1-NH1 2.92Å; E365-R369 IonicContact OE1-NH2 2.67Å; E365-R369 PolarHBondContact OE1-NH2 3.5Å; E365-Y393 HydrophobicContact CB-CD1 3.66Å; E365-Y393 HydrophobicContact CB-CE1 3.91Å; E365-Y393 HydrophobicContact CB-CG 4.32Å; E365-Y393 HydrophobicContact CG-CD1 3.95Å; E365-Y393 HydrophobicContact CG-CG 4.1Å; E365-A394 PolarHBondContact OE2-N 3.43Å; E365-W397 HydrophobicContact CG-CB 3.6Å; E365-W397 HydrophobicContact CG-CD2 4.46Å; E365-W397 HydrophobicContact CG-CE3 4.4Å; E365-W397 HydrophobicContact CG-CG 4.18Å
366	T	86.1	Confident	94.5	Very high	67 Å²	67	16.9 Å²	16.9	41%	0.411	8%	0.079	S	C	.	.	H	α-helix	trans	-62.3	-36.8	176.6	53.3	0	0	0	0	112.5	Y364	Y364-T366 VanDerWaalsContact C-N 3.31Å; Y364-T366 PolarHBondContact O-N 3.46Å
367	E	91.9	Very high	94.6	Very high	19 Å²	19	21.4 Å²	21.4	9%	0.089	10%	0.099	C	C	.	.	H	α-helix	trans	-80.8	-30.4	175.5	-58	-47.5	126.9	0	0	111.4	F340 F363 Y364 E365 R369 K370 V371	F340-E367 HydrophobicContact CE2-CB 3.98Å; F340-E367 HydrophobicContact CE2-CG 4.24Å; F340-E367 HydrophobicContact CZ-CB 4.01Å; F363-E367 HydrophobicContact CB-CB 4.16Å; Y364-E367 CarbonylContact O-C 3.3Å; Y364-E367 PolarHBondContact O-N 2.93Å; E365-E367 VanDerWaalsContact C-N 3.3Å; E365-E367 PolarHBondContact O-N 3.42Å; E367-R369 VanDerWaalsContact C-N 3.3Å; E367-R369 PolarHBondContact O-N 3.06Å; E367-K370 PolarHBondContact O-N 3.49Å; E367-K370 VanDerWaalsContact O-N 3.11Å; E367-K370 WeakPolarHBondContact OE1-CE 3.44Å; E367-K370 IonicContact OE1-NZ 2.81Å; E367-K370 PolarHBondContact OE1-NZ 2.92Å; E367-K370 WeakPolarHBondContact OE2-CD 3.28Å; E367-K370 WeakPolarHBondContact OE2-CE 3.3Å; E367-K370 IonicContact OE2-NZ 2.78Å; E367-K370 PolarHBondContact OE2-NZ 3.4Å; E367-V371 VanDerWaalsContact O-CG2 3.31Å; E367-V371 WeakPolarHBondContact O-CG2 3.33Å; E367-V371 PolarHBondContact O-N 3.47Å
368	A	94.2	Very high	94.7	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-56.5	-44	172.8	0	0	0	0	0	111.3	F363 Y364 E365 K370 V371 F372 Y393 W397	F363-A368 HydrophobicContact CD2-CB 3.71Å; F363-A368 HydrophobicContact CE2-CB 3.53Å; Y364-A368 PolarHBondContact O-N 3.13Å; E365-A368 VanDerWaalsContact O-CB 3.32Å; E365-A368 WeakPolarHBondContact O-CB 3.23Å; E365-A368 PolarHBondContact O-N 2.9Å; A368-K370 VanDerWaalsContact C-N 3.34Å; A368-K370 PolarHBondContact O-N 3.3Å; A368-V371 PolarHBondContact O-N 3Å; A368-F372 WeakPolarHBondContact O-CB 3.31Å; A368-F372 WeakPolarHBondContact O-CD2 3.3Å; A368-F372 PolarHBondContact O-N 3.27Å; A368-Y393 HydrophobicContact CB-CE2 3.98Å; A368-W397 HydrophobicContact CB-CE3 4.22Å; A368-W397 HydrophobicContact CB-CH2 4Å; A368-W397 HydrophobicContact CB-CZ3 3.69Å
369	R	93.8	Very high	94.6	Very high	16 Å²	16	30.4 Å²	30.4	6%	0.06	14%	0.138	C	C	.	.	H	α-helix	trans	-58	-42	174.6	-81	-169.8	-72.5	-82.8	-3.6	112.9	E365 E367 C373 W397 D402 I405 M412	E365-R369 PolarHBondContact O-N 3.29Å; E365-R369 VanDerWaalsContact O-N 3.13Å; E365-R369 IonicContact OE1-CZ 2.84Å; E365-R369 IonicContact OE1-NH1 2.71Å; E365-R369 PolarHBondContact OE1-NH1 2.92Å; E365-R369 IonicContact OE1-NH2 2.67Å; E365-R369 PolarHBondContact OE1-NH2 3.5Å; E367-R369 VanDerWaalsContact C-N 3.3Å; E367-R369 PolarHBondContact O-N 3.06Å; R369-C373 WeakPolarHBondContact O-CB 3.37Å; R369-C373 PolarHBondContact O-N 3.22Å; R369-C373 VanDerWaalsContact O-N 3.12Å; R369-W397 WeakPolarHBondContact CD-O 3.07Å; R369-W397 HydrophobicContact CG-CE3 3.91Å; R369-W397 HydrophobicContact CG-CZ3 3.99Å; R369-W397 PolarHBondContact NH1-O 3.46Å; R369-D402 IonicContact CZ-OD2 2.73Å; R369-D402 IonicContact NE-OD2 3.09Å; R369-D402 PolarHBondContact NE-OD2 3.43Å; R369-D402 IonicContact NH2-OD2 3.31Å; R369-I405 HydrophobicContact CB-CD1 4.36Å; R369-I405 HydrophobicContact CB-CG2 4.44Å; R369-M412 HydrophobicContact CB-CE 4.48Å; R369-M412 HydrophobicContact CG-CE 4.44Å; R369-M412 WeakPolarHBondContact O-CE 3.46Å
370	K	95.3	Very high	94.5	Very high	51 Å²	51	30.5 Å²	30.5	22%	0.222	14%	0.139	C	C	.	.	H	α-helix	trans	-68.2	-47.4	176.4	-56.6	-178.8	-150.5	158.5	0	111.8	P344 E367 A368 F372 C373 E374 I405	P344-K370 HydrophobicContact CG-CB 4.01Å; E367-K370 PolarHBondContact O-N 3.49Å; E367-K370 VanDerWaalsContact O-N 3.11Å; E367-K370 WeakPolarHBondContact OE1-CE 3.44Å; E367-K370 IonicContact OE1-NZ 2.81Å; E367-K370 PolarHBondContact OE1-NZ 2.92Å; E367-K370 WeakPolarHBondContact OE2-CD 3.28Å; E367-K370 WeakPolarHBondContact OE2-CE 3.3Å; E367-K370 IonicContact OE2-NZ 2.78Å; E367-K370 PolarHBondContact OE2-NZ 3.4Å; A368-K370 VanDerWaalsContact C-N 3.34Å; A368-K370 PolarHBondContact O-N 3.3Å; K370-F372 PolarHBondContact O-N 3.06Å; K370-C373 PolarHBondContact O-N 3.5Å; K370-E374 PolarHBondContact O-N 3.36Å; K370-E374 VanDerWaalsContact O-N 3.12Å; K370-I405 HydrophobicContact CG-CG2 4.07Å
371	V	97.1	Very high	94.3	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-55.8	-51.5	177.5	171.6	0	0	0	0	110	F340 P344 V348 F363 E367 A368 C373 E374 V375 W387	F340-V371 HydrophobicContact CE1-CG2 3.91Å; F340-V371 HydrophobicContact CE2-CG2 4.44Å; F340-V371 HydrophobicContact CZ-CG2 3.63Å; P344-V371 HydrophobicContact CB-CB 4.43Å; P344-V371 HydrophobicContact CB-CG2 3.57Å; P344-V371 HydrophobicContact CG-CG2 3.9Å; V348-V371 HydrophobicContact CG2-CG1 4.34Å; F363-V371 HydrophobicContact CD1-CG2 4.25Å; F363-V371 HydrophobicContact CE1-CB 4.45Å; F363-V371 HydrophobicContact CE1-CG1 4.1Å; F363-V371 HydrophobicContact CE1-CG2 4.02Å; F363-V371 HydrophobicContact CZ-CB 4.18Å; F363-V371 HydrophobicContact CZ-CG1 3.89Å; F363-V371 HydrophobicContact CZ-CG2 4.18Å; E367-V371 VanDerWaalsContact O-CG2 3.31Å; E367-V371 WeakPolarHBondContact O-CG2 3.33Å; E367-V371 PolarHBondContact O-N 3.47Å; A368-V371 PolarHBondContact O-N 3Å; V371-C373 VanDerWaalsContact C-N 3.34Å; V371-C373 PolarHBondContact O-N 3.28Å; V371-E374 PolarHBondContact O-N 3.1Å; V371-E374 VanDerWaalsContact O-N 3.15Å; V371-V375 HydrophobicContact CG1-CG2 4.21Å; V371-V375 VanDerWaalsContact O-CG2 3.31Å; V371-V375 WeakPolarHBondContact O-CG2 3.36Å; V371-V375 PolarHBondContact O-N 3.39Å; V371-W387 HydrophobicContact CG1-CH2 4.22Å; V371-W387 HydrophobicContact CG1-CZ3 4.25Å
372	F	97.3	Very high	94	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-69.7	-28.6	-176.8	-83.9	-83.8	0	0	0	113.6	F363 A368 K370 V375 F376 W387 L389 W397 M412 A415 V416	F363-F372 HydrophobicContact CZ-CE2 4.41Å; A368-F372 WeakPolarHBondContact O-CB 3.31Å; A368-F372 WeakPolarHBondContact O-CD2 3.3Å; A368-F372 PolarHBondContact O-N 3.27Å; K370-F372 PolarHBondContact O-N 3.06Å; F372-V375 HydrophobicContact CD1-CB 4.39Å; F372-V375 HydrophobicContact CD1-CG1 4.21Å; F372-V375 PolarHBondContact O-N 2.92Å; F372-F376 PolarHBondContact O-N 3.25Å; F372-W387 HydrophobicContact CE1-CD2 4.04Å; F372-W387 HydrophobicContact CE1-CG 4.01Å; F372-W387 HydrophobicContact CE2-CE3 4.4Å; F372-W387 HydrophobicContact CZ-CB 4.07Å; F372-W387 AromaticContact CZ-CD2 3.72Å; F372-W387 HydrophobicContact CZ-CD2 3.72Å; F372-W387 AromaticContact CZ-CE3 3.84Å; F372-W387 HydrophobicContact CZ-CE3 3.84Å; F372-W387 AromaticContact CZ-CG 3.82Å; F372-W387 HydrophobicContact CZ-CG 3.82Å; F372-L389 HydrophobicContact CE2-CD1 3.64Å; F372-L389 HydrophobicContact CE2-CD2 3.95Å; F372-L389 HydrophobicContact CE2-CG 4.4Å; F372-L389 HydrophobicContact CZ-CD1 3.85Å; F372-L389 HydrophobicContact CZ-CD2 4.18Å; F372-L389 HydrophobicContact CZ-CG 4.45Å; F372-W397 HydrophobicContact CB-CH2 4.49Å; F372-W397 AromaticContact CD2-CH2 3.72Å; F372-W397 HydrophobicContact CD2-CH2 3.72Å; F372-W397 HydrophobicContact CE2-CH2 4.25Å; F372-W397 HydrophobicContact CG-CH2 4.21Å; F372-M412 HydrophobicContact CB-CE 3.65Å; F372-M412 HydrophobicContact CB-SD 4.45Å; F372-A415 HydrophobicContact CD1-CB 4.34Å; F372-A415 WeakPolarHBondContact CD1-O 3.28Å; F372-A415 WeakPolarHBondContact CE1-O 3.31Å; F372-V416 HydrophobicContact CB-CG1 4.16Å; F372-V416 HydrophobicContact CD1-CB 4.48Å; F372-V416 HydrophobicContact CD1-CG1 3.57Å; F372-V416 HydrophobicContact CD2-CG1 4.27Å; F372-V416 HydrophobicContact CE1-CG1 4Å; F372-V416 HydrophobicContact CG-CG1 3.72Å
373	C	96.9	Very high	93.7	Very high	2 Å²	2	37.3 Å²	37.3	1%	0.014	18%	0.175	C	C	.	.	H	α-helix	trans	-66.5	-36.6	170.2	-177.7	0	0	0	0	112.6	R369 K370 V371 K377 I405 C407 M412	R369-C373 WeakPolarHBondContact O-CB 3.37Å; R369-C373 PolarHBondContact O-N 3.22Å; R369-C373 VanDerWaalsContact O-N 3.12Å; K370-C373 PolarHBondContact O-N 3.5Å; V371-C373 VanDerWaalsContact C-N 3.34Å; V371-C373 PolarHBondContact O-N 3.28Å; C373-K377 VanDerWaalsContact O-CG 3.31Å; C373-K377 WeakPolarHBondContact O-CG 3.4Å; C373-K377 PolarHBondContact O-N 2.9Å; C373-K377 VanDerWaalsContact SG-CE 3.6Å; C373-I405 HydrophobicContact CB-CB 4.24Å; C373-I405 HydrophobicContact CB-CG2 4.32Å; C373-C407 WeakPolarHBondContact CA-SG 3.42Å; C373-C407 HydrophobicContact CB-CB 3.79Å; C373-C407 WeakPolarHBondContact CB-SG 3.25Å; C373-C407 PolarHBondContact O-SG 2.98Å; C373-C407 VanDerWaalsContact O-SG 3.42Å; C373-C407 WeakPolarHBondContact SG-CB 3.37Å; C373-C407 CovalentContact SG-SG 2.04Å; C373-C407 PolarHBondContact SG-SG 3.16Å; C373-M412 HydrophobicContact CB-SD 3.85Å
374	E	96.7	Very high	93.5	Very high	31 Å²	31	40.1 Å²	40.1	15%	0.145	19%	0.187	C	C	.	.	H	α-helix	trans	-73.3	-35.9	171.6	-64.9	-56.6	123.1	0	0	112.4	P344 A345 V348 K370 V371 F376 K377 E378	P344-E374 HydrophobicContact CG-CG 4.46Å; A345-E374 HydrophobicContact CB-CG 3.92Å; V348-E374 HydrophobicContact CB-CB 4.28Å; V348-E374 HydrophobicContact CG1-CB 4.34Å; V348-E374 HydrophobicContact CG2-CB 4.17Å; K370-E374 PolarHBondContact O-N 3.36Å; K370-E374 VanDerWaalsContact O-N 3.12Å; V371-E374 PolarHBondContact O-N 3.1Å; V371-E374 VanDerWaalsContact O-N 3.15Å; E374-F376 VanDerWaalsContact C-N 3.32Å; E374-F376 PolarHBondContact O-N 3.25Å; E374-K377 PolarHBondContact O-N 3.03Å; E374-K377 WeakPolarHBondContact OE1-CD 3.29Å; E374-K377 IonicContact OE1-NZ 2.65Å; E374-K377 PolarHBondContact OE1-NZ 2.92Å; E374-E378 WeakPolarHBondContact O-CB 3.46Å; E374-E378 PolarHBondContact O-N 2.87Å
375	V	97.4	Very high	93.8	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-60.6	-39.5	173.6	163.7	0	0	0	0	111.7	V348 V371 F372 K379 L380 Y381 W387	V348-V375 HydrophobicContact CG1-CG2 3.9Å; V348-V375 HydrophobicContact CG2-CG2 4.15Å; V371-V375 HydrophobicContact CG1-CG2 4.21Å; V371-V375 VanDerWaalsContact O-CG2 3.31Å; V371-V375 WeakPolarHBondContact O-CG2 3.36Å; V371-V375 PolarHBondContact O-N 3.39Å; F372-V375 HydrophobicContact CD1-CB 4.39Å; F372-V375 HydrophobicContact CD1-CG1 4.21Å; F372-V375 PolarHBondContact O-N 2.92Å; V375-K379 WeakPolarHBondContact O-CA 3.35Å; V375-K379 PolarHBondContact O-N 3.02Å; V375-L380 HydrophobicContact CG1-CB 4.1Å; V375-L380 WeakPolarHBondContact CG1-O 3.48Å; V375-L380 PolarHBondContact O-N 3.12Å; V375-Y381 HydrophobicContact CG1-CD1 4.47Å; V375-W387 HydrophobicContact CB-CZ2 4.42Å; V375-W387 HydrophobicContact CG1-CZ2 4.16Å; V375-W387 HydrophobicContact CG2-CH2 3.67Å; V375-W387 HydrophobicContact CG2-CZ2 3.34Å
376	F	97.1	Very high	94.3	Very high	41 Å²	41	36.2 Å²	36.2	18%	0.18	17%	0.172	C	C	.	.	H	α-helix	trans	-61.1	-53.7	172.5	-178.2	-100.6	0	0	0	111.4	F372 E374 E378 K379 Y381 N411 A415	F372-F376 PolarHBondContact O-N 3.25Å; E374-F376 VanDerWaalsContact C-N 3.32Å; E374-F376 PolarHBondContact O-N 3.25Å; F376-E378 VanDerWaalsContact C-N 3.26Å; F376-E378 PolarHBondContact O-N 3.49Å; F376-K379 PolarHBondContact O-N 3.3Å; F376-Y381 AromaticContact CD2-CE1 3.92Å; F376-Y381 HydrophobicContact CD2-CE1 3.92Å; F376-N411 HydrophobicContact CD1-CB 3.85Å; F376-N411 HydrophobicContact CD2-CB 3.96Å; F376-N411 WeakPolarHBondContact CD2-O 3.45Å; F376-N411 HydrophobicContact CE1-CB 3.66Å; F376-N411 VanDerWaalsContact CE1-CG 3.43Å; F376-N411 WeakPolarHBondContact CE1-ND2 3.43Å; F376-N411 HydrophobicContact CE2-CB 3.76Å; F376-N411 HydrophobicContact CG-CB 4Å; F376-N411 HydrophobicContact CZ-CB 3.6Å; F376-N411 WeakPolarHBondContact CZ-OD1 3.41Å; F376-A415 HydrophobicContact CB-CB 3.92Å; F376-A415 HydrophobicContact CD2-CB 4.24Å
377	K	95.9	Very high	94.8	Very high	97 Å²	97	33.3 Å²	33.3	42%	0.422	15%	0.153	S	C	.	.	H	α-helix	trans	-56.5	-40.6	179.5	-68.2	167	-167.4	172	0	112.2	C373 E374	C373-K377 VanDerWaalsContact O-CG 3.31Å; C373-K377 WeakPolarHBondContact O-CG 3.4Å; C373-K377 PolarHBondContact O-N 2.9Å; C373-K377 VanDerWaalsContact SG-CE 3.6Å; E374-K377 PolarHBondContact O-N 3.03Å; E374-K377 WeakPolarHBondContact OE1-CD 3.29Å; E374-K377 IonicContact OE1-NZ 2.65Å; E374-K377 PolarHBondContact OE1-NZ 2.92Å
378	E	95.8	Very high	95.1	Very high	39 Å²	39	32.4 Å²	32.4	18%	0.182	15%	0.149	C	C	.	.	H	α-helix	trans	-84.7	-8.3	179	-70.8	-60.5	160.8	0	0	114	V348 K349 K352 E374 F376	V348-E378 HydrophobicContact CG1-CB 4.17Å; V348-E378 HydrophobicContact CG1-CG 4.23Å; K349-E378 WeakPolarHBondContact CE-OE1 3.39Å; K349-E378 HydrophobicContact CG-CG 3.98Å; K349-E378 WeakPolarHBondContact CG-OE1 3.32Å; K352-E378 HydrophobicContact CD-CB 3.89Å; K352-E378 HydrophobicContact CD-CG 4.48Å; K352-E378 VanDerWaalsContact CD-O 3.3Å; K352-E378 WeakPolarHBondContact CD-O 3.41Å; K352-E378 VanDerWaalsContact CD-OE2 3.28Å; K352-E378 WeakPolarHBondContact CD-OE2 3.34Å; K352-E378 VanDerWaalsContact CE-O 3.31Å; K352-E378 WeakPolarHBondContact CE-O 3.36Å; K352-E378 WeakPolarHBondContact CE-OE2 3.45Å; K352-E378 PolarHBondContact NZ-O 2.87Å; K352-E378 IonicContact NZ-OE2 2.64Å; K352-E378 PolarHBondContact NZ-OE2 3.49Å; E374-E378 WeakPolarHBondContact O-CB 3.46Å; E374-E378 PolarHBondContact O-N 2.87Å; F376-E378 VanDerWaalsContact C-N 3.26Å; F376-E378 PolarHBondContact O-N 3.49Å
379	K	94.8	Very high	95.2	Very high	154 Å²	154	32.4 Å²	32.4	67%	0.67	15%	0.149	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.9	40.6	-176.6	-53.6	-168.9	176.8	-165.8	0	114.4	V375 F376 Y381	V375-K379 WeakPolarHBondContact O-CA 3.35Å; V375-K379 PolarHBondContact O-N 3.02Å; F376-K379 PolarHBondContact O-N 3.3Å; K379-Y381 VanDerWaalsContact C-N 3.26Å; K379-Y381 HydrophobicContact CB-CE1 4.27Å; K379-Y381 HydrophobicContact CG-CE1 4.39Å; K379-Y381 PolarHBondContact O-N 2.93Å
380	L	95.3	Very high	95.1	Very high	3 Å²	3	32.4 Å²	32.4	2%	0.016	15%	0.15	C	C	.	.			trans	-91.6	41.4	179.8	-164	67.2	0	0	0	112.2	V348 L351 K352 I359 V375 W387	V348-L380 HydrophobicContact CG1-CD2 4.1Å; L351-L380 HydrophobicContact CB-CD2 3.74Å; L351-L380 HydrophobicContact CD1-CD2 4.26Å; K352-L380 HydrophobicContact CB-CD1 4.06Å; I359-L380 HydrophobicContact CD1-CD2 3.91Å; I359-L380 HydrophobicContact CD1-CG 4Å; V375-L380 HydrophobicContact CG1-CB 4.1Å; V375-L380 WeakPolarHBondContact CG1-O 3.48Å; V375-L380 PolarHBondContact O-N 3.12Å; L380-W387 HydrophobicContact CD2-CZ2 4.06Å; L380-W387 HydrophobicContact CG-CZ2 4.39Å; L380-W387 PolarHBondContact O-NE1 3.4Å
381	Y	94.2	Very high	94.7	Very high	41 Å²	41	30.5 Å²	30.5	16%	0.161	15%	0.145	C	C	.	.			trans	-139.5	-175.7	-176.6	67.9	-89.3	0	0	0	111.4	V375 F376 K379 H385 E414 A415	V375-Y381 HydrophobicContact CG1-CD1 4.47Å; F376-Y381 AromaticContact CD2-CE1 3.92Å; F376-Y381 HydrophobicContact CD2-CE1 3.92Å; K379-Y381 VanDerWaalsContact C-N 3.26Å; K379-Y381 HydrophobicContact CB-CE1 4.27Å; K379-Y381 HydrophobicContact CG-CE1 4.39Å; K379-Y381 PolarHBondContact O-N 2.93Å; Y381-H385 PolarHBondContact N-ND1 3.35Å; Y381-H385 VanDerWaalsContact N-ND1 3.19Å; Y381-H385 PolarHBondContact O-ND1 2.97Å; Y381-E414 WeakPolarHBondContact CD2-O 3.32Å; Y381-E414 HydrophobicContact CE2-CG 3.74Å; Y381-E414 WeakPolarHBondContact CE2-OE1 3.33Å; Y381-E414 VanDerWaalsContact CZ-OE1 3.26Å; Y381-E414 PolarHBondContact OH-OE1 3.13Å; Y381-A415 HydrophobicContact CD1-CB 4.4Å; Y381-A415 HydrophobicContact CG-CB 4.5Å
382	G	90.9	Very high	94	Very high	26 Å²	26	34 Å²	34	27%	0.268	16%	0.158	S	C	.	.	G	3₁₀ helix	trans	74.3	-162.7	178.1	0	0	0	0	0	114.6	K384 H385	G382-K384 PolarHBondContact O-N 2.9Å; G382-H385 PolarHBondContact O-N 3.46Å
383	K	89.8	Confident	93.3	Very high	78 Å²	78	34.3 Å²	34.3	34%	0.339	16%	0.159	S	C	.	.	G	3₁₀ helix	trans	-45.2	-30.2	-166.4	-178.7	175.5	-177.9	-91.7	0	116.1	I567 P572 D748 D750	K383-I567 HydrophobicContact CB-CB 4.27Å; K383-I567 HydrophobicContact CB-CG2 3.99Å; K383-I567 HydrophobicContact CG-CG2 4.37Å; K383-P572 WeakPolarHBondContact O-CB 3.43Å; K383-P572 WeakPolarHBondContact O-CG 3.19Å; K383-D748 IonicContact NZ-OD1 3.57Å; K383-D748 PolarHBondContact NZ-OD1 2.97Å; K383-D750 IonicContact NZ-OD2 3.32Å; K383-D750 PolarHBondContact NZ-OD2 3.04Å
384	K	89.5	Confident	92.5	Very high	59 Å²	59	35.8 Å²	35.8	26%	0.257	17%	0.172	S	C	.	.	G	3₁₀ helix	trans	-86.4	-20.2	-176.5	-63.8	-167.3	171.9	-165	0	115	R357 G382 L749	R357-K384 WeakPolarHBondContact CB-O 3.24Å; R357-K384 WeakPolarHBondContact CG-O 3.4Å; G382-K384 PolarHBondContact O-N 2.9Å; K384-L749 WeakPolarHBondContact CE-O 3.31Å; K384-L749 PolarHBondContact NZ-O 3.38Å
385	H	93.9	Very high	91.9	Very high	34 Å²	34	39.1 Å²	39.1	16%	0.157	19%	0.19	C	C	.	.			trans	-123.1	137.7	-161.4	-49.5	107.6	0	0	0	111	R357 Y381 G382	R357-H385 CarbonylContact O-C 3.59Å; R357-H385 VanDerWaalsContact O-CA 3.31Å; R357-H385 WeakPolarHBondContact O-CA 3.23Å; Y381-H385 PolarHBondContact N-ND1 3.35Å; Y381-H385 VanDerWaalsContact N-ND1 3.19Å; Y381-H385 PolarHBondContact O-ND1 2.97Å; G382-H385 PolarHBondContact O-N 3.46Å
386	V	96.1	Very high	91.2	Very high	2 Å²	2	41.7 Å²	41.7	1%	0.012	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	124.8	174	-169.6	0	0	0	0	109.2	W303 R357 I358 I359 F388 V420 W566 P572	W303-V386 HydrophobicContact CH2-CB 4.33Å; W303-V386 HydrophobicContact CH2-CG1 4.13Å; W303-V386 HydrophobicContact CH2-CG2 4.14Å; W303-V386 HydrophobicContact CZ2-CG2 4.13Å; R357-V386 PolarHBondContact O-N 3.1Å; I358-V386 HydrophobicContact CD1-CB 3.95Å; I358-V386 HydrophobicContact CD1-CG2 3.77Å; I359-V386 PolarHBondContact N-O 2.96Å; V386-F388 HydrophobicContact CB-CE2 4.27Å; V386-F388 HydrophobicContact CG1-CD2 4.26Å; V386-F388 HydrophobicContact CG1-CE2 3.55Å; V386-F388 HydrophobicContact CG1-CZ 4.1Å; V386-V420 HydrophobicContact CG1-CG2 4.43Å; V386-W566 HydrophobicContact CG1-CH2 3.89Å; V386-W566 HydrophobicContact CG1-CZ3 3.93Å; V386-W566 HydrophobicContact CG2-CH2 4.36Å; V386-W566 HydrophobicContact CG2-CZ3 3.81Å; V386-P572 HydrophobicContact CG2-CB 4.22Å; V386-P572 HydrophobicContact CG2-CG 3.58Å
387	W	97.9	Very high	90.7	Very high	7 Å²	7	39.8 Å²	39.8	3%	0.027	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	131.6	176.3	-73.9	84.7	0	0	0	110.8	I309 L351 I359 V371 F372 V375 L380 L389 H419 V420	I309-W387 HydrophobicContact CG2-CH2 4.25Å; I309-W387 HydrophobicContact CG2-CZ3 3.83Å; L351-W387 HydrophobicContact CD1-CH2 4.25Å; I359-W387 HydrophobicContact CB-CD2 4.16Å; I359-W387 HydrophobicContact CB-CE3 4.13Å; I359-W387 HydrophobicContact CB-CH2 4.47Å; I359-W387 HydrophobicContact CB-CZ2 4.47Å; I359-W387 HydrophobicContact CB-CZ3 4.31Å; I359-W387 HydrophobicContact CD1-CD2 4.41Å; I359-W387 HydrophobicContact CD1-CH2 4.12Å; I359-W387 HydrophobicContact CD1-CZ2 3.54Å; I359-W387 HydrophobicContact CG2-CD2 4.25Å; I359-W387 HydrophobicContact CG2-CE3 3.77Å; I359-W387 HydrophobicContact CG2-CH2 3.73Å; I359-W387 HydrophobicContact CG2-CZ2 4.18Å; I359-W387 HydrophobicContact CG2-CZ3 3.51Å; I359-W387 CarbonylContact O-C 3.5Å; I359-W387 WeakPolarHBondContact O-CA 3.27Å; V371-W387 HydrophobicContact CG1-CH2 4.22Å; V371-W387 HydrophobicContact CG1-CZ3 4.25Å; F372-W387 HydrophobicContact CE1-CD2 4.04Å; F372-W387 HydrophobicContact CE1-CG 4.01Å; F372-W387 HydrophobicContact CE2-CE3 4.4Å; F372-W387 HydrophobicContact CZ-CB 4.07Å; F372-W387 AromaticContact CZ-CD2 3.72Å; F372-W387 HydrophobicContact CZ-CD2 3.72Å; F372-W387 AromaticContact CZ-CE3 3.84Å; F372-W387 HydrophobicContact CZ-CE3 3.84Å; F372-W387 AromaticContact CZ-CG 3.82Å; F372-W387 HydrophobicContact CZ-CG 3.82Å; V375-W387 HydrophobicContact CB-CZ2 4.42Å; V375-W387 HydrophobicContact CG1-CZ2 4.16Å; V375-W387 HydrophobicContact CG2-CH2 3.67Å; V375-W387 HydrophobicContact CG2-CZ2 3.34Å; L380-W387 HydrophobicContact CD2-CZ2 4.06Å; L380-W387 HydrophobicContact CG-CZ2 4.39Å; L380-W387 PolarHBondContact O-NE1 3.4Å; W387-L389 HydrophobicContact CE3-CD2 4.38Å; W387-H419 HydrophobicContact CB-CB 3.9Å; W387-V420 PolarHBondContact O-N 2.93Å
388	F	97.9	Very high	90.5	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	113.8	171	-76.2	-92.1	0	0	0	109.4	L297 F298 W301 W303 I358 I359 V360 G361 V386 V420	L297-F388 HydrophobicContact CD1-CE1 4.04Å; F298-F388 HydrophobicContact CE1-CD1 4.45Å; F298-F388 HydrophobicContact CE1-CD2 4.12Å; F298-F388 HydrophobicContact CE1-CE1 4.36Å; F298-F388 HydrophobicContact CE1-CE2 4.05Å; F298-F388 HydrophobicContact CE1-CG 4.35Å; F298-F388 HydrophobicContact CE1-CZ 4.19Å; W301-F388 HydrophobicContact CE3-CZ 4.41Å; W301-F388 HydrophobicContact CZ3-CE1 4.16Å; W301-F388 AromaticContact CZ3-CZ 3.75Å; W301-F388 HydrophobicContact CZ3-CZ 3.75Å; W303-F388 HydrophobicContact CH2-CE2 4.01Å; W303-F388 HydrophobicContact CH2-CZ 4Å; W303-F388 AromaticContact CZ3-CE2 3.52Å; W303-F388 HydrophobicContact CZ3-CE2 3.52Å; W303-F388 AromaticContact CZ3-CZ 3.55Å; W303-F388 HydrophobicContact CZ3-CZ 3.55Å; I358-F388 HydrophobicContact CG2-CD2 4.24Å; I358-F388 HydrophobicContact CG2-CE2 4Å; I359-F388 PolarHBondContact O-N 3Å; V360-F388 HydrophobicContact CB-CB 4.48Å; V360-F388 HydrophobicContact CG1-CB 4.32Å; V360-F388 HydrophobicContact CG2-CB 4.27Å; G361-F388 PolarHBondContact N-O 2.67Å; V386-F388 HydrophobicContact CB-CE2 4.27Å; V386-F388 HydrophobicContact CG1-CD2 4.26Å; V386-F388 HydrophobicContact CG1-CE2 3.55Å; V386-F388 HydrophobicContact CG1-CZ 4.1Å; F388-V420 WeakPolarHBondContact CA-O 3.43Å; F388-V420 HydrophobicContact CD1-CB 4.01Å; F388-V420 HydrophobicContact CD1-CG1 4.04Å; F388-V420 HydrophobicContact CE1-CB 3.7Å; F388-V420 HydrophobicContact CE1-CG1 3.63Å; F388-V420 HydrophobicContact CE1-CG2 4.24Å; F388-V420 HydrophobicContact CZ-CB 4.12Å; F388-V420 HydrophobicContact CZ-CG1 4.4Å; F388-V420 HydrophobicContact CZ-CG2 4.22Å
389	L	96.5	Very high	90.2	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	174.2	-180	-55.4	-175.9	0	0	0	111.5	F363 F372 W387 Y393 W397 V420 T421 T422	F363-L389 HydrophobicContact CE2-CD2 4.17Å; F363-L389 HydrophobicContact CZ-CD2 3.97Å; F372-L389 HydrophobicContact CE2-CD1 3.64Å; F372-L389 HydrophobicContact CE2-CD2 3.95Å; F372-L389 HydrophobicContact CE2-CG 4.4Å; F372-L389 HydrophobicContact CZ-CD1 3.85Å; F372-L389 HydrophobicContact CZ-CD2 4.18Å; F372-L389 HydrophobicContact CZ-CG 4.45Å; W387-L389 HydrophobicContact CE3-CD2 4.38Å; L389-Y393 HydrophobicContact CB-CE2 4.43Å; L389-Y393 HydrophobicContact CD1-CE2 4.24Å; L389-W397 HydrophobicContact CD1-CZ2 4.24Å; L389-V420 PolarHBondContact N-O 3.17Å; L389-T421 HydrophobicContact CB-CG2 4.35Å; L389-T422 PolarHBondContact O-N 2.93Å; L389-T422 VanDerWaalsContact O-N 3.15Å
390	I	91.7	Very high	89.8	Confident	15 Å²	15	34 Å²	34	8%	0.077	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	130.7	173	-47.7	171	0	0	0	107.3	F316 L362 W392	F316-I390 HydrophobicContact CD1-CD1 4.2Å; F316-I390 HydrophobicContact CE1-CD1 3.71Å; L362-I390 HydrophobicContact CD2-CD1 4.16Å; L362-I390 HydrophobicContact CD2-CG1 4.19Å; I390-W392 VanDerWaalsContact C-N 3.3Å; I390-W392 HydrophobicContact CB-CG 4.42Å; I390-W392 HydrophobicContact CD1-CZ2 4.44Å; I390-W392 HydrophobicContact CG2-CB 4.38Å; I390-W392 HydrophobicContact CG2-CD2 4.2Å; I390-W392 HydrophobicContact CG2-CG 3.74Å; I390-W392 PolarHBondContact O-N 3.48Å
391	G	86.4	Confident	89.3	Confident	11 Å²	11	43.5 Å²	43.5	11%	0.113	21%	0.214	C	C	.	.	S	Bend	trans	-75.8	-6.5	-172.6	0	0	0	0	0	116.7	Y393 T422	G391-Y393 PolarHBondContact O-N 3.45Å; G391-T422 PolarHBondContact N-O 2.96Å; G391-T422 VanDerWaalsContact N-O 3.1Å
392	W	82.3	Confident	88.8	Confident	73 Å²	73	42.9 Å²	42.9	28%	0.277	21%	0.214	S	C	.	.			trans	-68.4	11.1	-179.5	71	-18.6	0	0	0	116.8	F316 Y364 I390	F316-W392 HydrophobicContact CE1-CZ2 4.18Å; F316-W392 HydrophobicContact CZ-CZ2 4.12Å; Y364-W392 AromaticContact CD1-CH2 3.79Å; Y364-W392 HydrophobicContact CD1-CH2 3.79Å; Y364-W392 AromaticContact CD1-CZ2 3.82Å; Y364-W392 HydrophobicContact CD1-CZ2 3.82Å; Y364-W392 AromaticContact CE1-CH2 3.37Å; Y364-W392 HydrophobicContact CE1-CH2 3.37Å; Y364-W392 AromaticContact CE1-CZ2 3.89Å; Y364-W392 HydrophobicContact CE1-CZ2 3.89Å; Y364-W392 HydrophobicContact CE1-CZ3 4.28Å; I390-W392 VanDerWaalsContact C-N 3.3Å; I390-W392 HydrophobicContact CB-CG 4.42Å; I390-W392 HydrophobicContact CD1-CZ2 4.44Å; I390-W392 HydrophobicContact CG2-CB 4.38Å; I390-W392 HydrophobicContact CG2-CD2 4.2Å; I390-W392 HydrophobicContact CG2-CG 3.74Å; I390-W392 PolarHBondContact O-N 3.48Å
393	Y	83.3	Confident	88.8	Confident	7 Å²	7	48 Å²	48	3%	0.027	24%	0.242	C	C	.	.	S	Bend	trans	-84.9	153.5	175.8	-58.3	-29	0	0	0	109.8	F363 E365 A368 L389 G391 W397	F363-Y393 WeakPolarHBondContact CD2-OH 3.15Å; F363-Y393 PolarHBondContact O-OH 2.74Å; E365-Y393 HydrophobicContact CB-CD1 3.66Å; E365-Y393 HydrophobicContact CB-CE1 3.91Å; E365-Y393 HydrophobicContact CB-CG 4.32Å; E365-Y393 HydrophobicContact CG-CD1 3.95Å; E365-Y393 HydrophobicContact CG-CG 4.1Å; A368-Y393 HydrophobicContact CB-CE2 3.98Å; L389-Y393 HydrophobicContact CB-CE2 4.43Å; L389-Y393 HydrophobicContact CD1-CE2 4.24Å; G391-Y393 PolarHBondContact O-N 3.45Å; Y393-W397 AromaticContact CD2-CD1 3.96Å; Y393-W397 HydrophobicContact CD2-CD2 4.17Å; Y393-W397 AromaticContact CD2-CE2 3.88Å; Y393-W397 HydrophobicContact CD2-CG 4.26Å; Y393-W397 HydrophobicContact CD2-CZ2 4.42Å; Y393-W397 AromaticContact CD2-NE1 3.73Å; Y393-W397 HydrophobicContact CG-CG 4.38Å
394	A	79.5	Confident	88.7	Confident	34 Å²	34	47.2 Å²	47.2	28%	0.281	25%	0.25	S	S	.	.			trans	-62.3	139.2	171.2	0	0	0	0	0	110.7	E365 N396 W397	E365-A394 PolarHBondContact OE2-N 3.43Å; A394-N396 PolarHBondContact O-N 3.25Å; A394-W397 VanDerWaalsContact O-CB 3.29Å; A394-W397 WeakPolarHBondContact O-CB 3.49Å; A394-W397 PolarHBondContact O-N 3.13Å
395	D	82.9	Confident	88.8	Confident	100 Å²	100	45.7 Å²	45.7	54%	0.535	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-48.3	-25.5	-178.2	-74.9	51.9	0	0	0	115.1	Y545	D395-Y545 HydrophobicContact CB-CD2 4.38Å
396	N	84.5	Confident	88.7	Confident	55 Å²	55	51 Å²	51	29%	0.294	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.6	11.5	-177.4	63	26.3	0	0	0	114.2	A394 F398 K399 I400	A394-N396 PolarHBondContact O-N 3.25Å; N396-F398 PolarHBondContact O-N 3.26Å; N396-K399 HydrophobicContact CB-CD 4.37Å; N396-K399 WeakPolarHBondContact O-CA 3.31Å; N396-K399 WeakPolarHBondContact O-CB 3.33Å; N396-K399 PolarHBondContact O-N 3.42Å; N396-I400 PolarHBondContact O-N 3.02Å
397	W	86.2	Confident	88.5	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.9	-30.9	-169.4	69.3	-94.3	0	0	0	115.9	E365 A368 R369 F372 L389 Y393 A394 V416 Y545	E365-W397 HydrophobicContact CG-CB 3.6Å; E365-W397 HydrophobicContact CG-CD2 4.46Å; E365-W397 HydrophobicContact CG-CE3 4.4Å; E365-W397 HydrophobicContact CG-CG 4.18Å; A368-W397 HydrophobicContact CB-CE3 4.22Å; A368-W397 HydrophobicContact CB-CH2 4Å; A368-W397 HydrophobicContact CB-CZ3 3.69Å; R369-W397 WeakPolarHBondContact CD-O 3.07Å; R369-W397 HydrophobicContact CG-CE3 3.91Å; R369-W397 HydrophobicContact CG-CZ3 3.99Å; R369-W397 PolarHBondContact NH1-O 3.46Å; F372-W397 HydrophobicContact CB-CH2 4.49Å; F372-W397 AromaticContact CD2-CH2 3.72Å; F372-W397 HydrophobicContact CD2-CH2 3.72Å; F372-W397 HydrophobicContact CE2-CH2 4.25Å; F372-W397 HydrophobicContact CG-CH2 4.21Å; L389-W397 HydrophobicContact CD1-CZ2 4.24Å; Y393-W397 AromaticContact CD2-CD1 3.96Å; Y393-W397 HydrophobicContact CD2-CD2 4.17Å; Y393-W397 AromaticContact CD2-CE2 3.88Å; Y393-W397 HydrophobicContact CD2-CG 4.26Å; Y393-W397 HydrophobicContact CD2-CZ2 4.42Å; Y393-W397 AromaticContact CD2-NE1 3.73Å; Y393-W397 HydrophobicContact CG-CG 4.38Å; A394-W397 VanDerWaalsContact O-CB 3.29Å; A394-W397 WeakPolarHBondContact O-CB 3.49Å; A394-W397 PolarHBondContact O-N 3.13Å; W397-V416 HydrophobicContact CH2-CG1 3.63Å; W397-V416 HydrophobicContact CZ2-CG1 3.72Å; W397-Y545 PolarHBondContact NE1-OH 3.45Å
398	F	91.3	Very high	88.4	Confident	3 Å²	3	54.7 Å²	54.7	1%	0.013	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87	-8.3	180	58.5	-84.7	0	0	0	113.9	N396 T413 V416 L540	N396-F398 PolarHBondContact O-N 3.26Å; F398-T413 HydrophobicContact CE2-CG2 4.06Å; F398-V416 HydrophobicContact CB-CG1 4.45Å; F398-V416 HydrophobicContact CB-CG2 4.39Å; F398-V416 HydrophobicContact CD1-CG2 4.22Å; F398-V416 HydrophobicContact CD2-CG2 3.83Å; F398-V416 HydrophobicContact CE1-CG2 4.47Å; F398-V416 HydrophobicContact CE2-CG2 4.08Å; F398-V416 HydrophobicContact CG-CG2 3.89Å; F398-V416 HydrophobicContact CZ-CG2 4.4Å; F398-L540 HydrophobicContact CE1-CD1 4Å; F398-L540 HydrophobicContact CE1-CD2 4.12Å; F398-L540 HydrophobicContact CZ-CD1 4.03Å; F398-L540 HydrophobicContact CZ-CD2 3.95Å
399	K	89.8	Confident	88.2	Confident	94 Å²	94	57.3 Å²	57.3	41%	0.409	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.9	-13.6	175.5	-54.7	171.9	-173.2	162.1	0	112.1	N396 V409 G543	N396-K399 HydrophobicContact CB-CD 4.37Å; N396-K399 WeakPolarHBondContact O-CA 3.31Å; N396-K399 WeakPolarHBondContact O-CB 3.33Å; N396-K399 PolarHBondContact O-N 3.42Å; K399-V409 HydrophobicContact CB-CG1 4.05Å; K399-V409 HydrophobicContact CG-CG1 3.97Å; K399-G543 PolarHBondContact NZ-O 2.97Å
400	I	86.4	Confident	88.1	Confident	73 Å²	73	63.5 Å²	63.5	37%	0.374	34%	0.343	S	S	.	.	S	Bend	trans	-67.8	129.2	176.6	-57.9	177.4	0	0	0	109.7	N396 D402	N396-I400 PolarHBondContact O-N 3.02Å; I400-D402 PolarHBondContact O-N 2.88Å
401	K	84.6	Confident	88.2	Confident	201 Å²	201	65 Å²	65	87%	0.874	35%	0.351	S	S	*	.			trans	-74	105.9	178.6	-175.9	179.3	179.8	178.7	0	110.9
402	D	84.4	Confident	88.6	Confident	29 Å²	29	64.6 Å²	64.6	16%	0.155	35%	0.346	C	S	.	.			trans	-104.6	123.3	179.8	-167.2	-41.3	0	0	0	110.8	R369 I400 A404 I405	R369-D402 IonicContact CZ-OD2 2.73Å; R369-D402 IonicContact NE-OD2 3.09Å; R369-D402 PolarHBondContact NE-OD2 3.43Å; R369-D402 IonicContact NH2-OD2 3.31Å; I400-D402 PolarHBondContact O-N 2.88Å; D402-A404 PolarHBondContact O-N 3.14Å; D402-A404 VanDerWaalsContact OD1-CB 3.3Å; D402-A404 WeakPolarHBondContact OD1-CB 3.4Å; D402-A404 PolarHBondContact OD1-N 3.12Å; D402-I405 HydrophobicContact CB-CD1 4.37Å; D402-I405 HydrophobicContact CB-CG1 4.2Å
403	P	89.1	Confident	89.2	Confident	132 Å²	132	62.9 Å²	62.9	86%	0.857	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74	-7.2	-179.2	32	-36.3	0	0	0	114
404	A	87.6	Confident	89.8	Confident	63 Å²	63	67.4 Å²	67.4	52%	0.521	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.1	-1	177.9	0	0	0	0	0	114	D402	D402-A404 PolarHBondContact O-N 3.14Å; D402-A404 VanDerWaalsContact OD1-CB 3.3Å; D402-A404 WeakPolarHBondContact OD1-CB 3.4Å; D402-A404 PolarHBondContact OD1-N 3.12Å
405	I	92.4	Very high	90.6	Very high	26 Å²	26	66 Å²	66	13%	0.133	35%	0.353	C	S	.	.			trans	-123.1	147.8	179.6	69.3	174.7	0	0	0	112.6	R369 K370 C373 D402 M412	R369-I405 HydrophobicContact CB-CD1 4.36Å; R369-I405 HydrophobicContact CB-CG2 4.44Å; K370-I405 HydrophobicContact CG-CG2 4.07Å; C373-I405 HydrophobicContact CB-CB 4.24Å; C373-I405 HydrophobicContact CB-CG2 4.32Å; D402-I405 HydrophobicContact CB-CD1 4.37Å; D402-I405 HydrophobicContact CB-CG1 4.2Å; I405-M412 HydrophobicContact CD1-CG 4.3Å; I405-M412 HydrophobicContact CD1-SD 4.17Å
406	N	91.4	Very high	91.2	Very high	147 Å²	147	61.2 Å²	61.2	79%	0.786	33%	0.328	S	S	*	.			trans	-100.6	17.3	178.3	-65	3.1	0	0	0	112.7
407	C	93.4	Very high	91.8	Very high	18 Å²	18	62.4 Å²	62.4	12%	0.122	33%	0.332	C	S	.	.			trans	-104.6	144.3	-178.6	-65	0	0	0	0	110.9	C373 N411 M412	C373-C407 WeakPolarHBondContact CA-SG 3.42Å; C373-C407 HydrophobicContact CB-CB 3.79Å; C373-C407 WeakPolarHBondContact CB-SG 3.25Å; C373-C407 PolarHBondContact O-SG 2.98Å; C373-C407 VanDerWaalsContact O-SG 3.42Å; C373-C407 WeakPolarHBondContact SG-CB 3.37Å; C373-C407 CovalentContact SG-SG 2.04Å; C373-C407 PolarHBondContact SG-SG 3.16Å; C407-N411 HydrophobicContact CB-CB 4.43Å; C407-M412 HydrophobicContact CB-CG 4.02Å; C407-M412 HydrophobicContact CB-SD 3.88Å
408	T	95.1	Very high	92.2	Very high	67 Å²	67	63.4 Å²	63.4	41%	0.411	34%	0.342	S	S	.	.			trans	-83	167.5	174.5	75.2	0	0	0	0	111.2	E410 N411 M412	T408-E410 WeakPolarHBondContact CB-OE2 3.24Å; T408-E410 PolarHBondContact O-N 3.31Å; T408-E410 PolarHBondContact OG1-OE2 3.18Å; T408-N411 PolarHBondContact O-N 3.49Å; T408-N411 PolarHBondContact OG1-N 2.98Å; T408-N411 PolarHBondContact OG1-OD1 3.31Å; T408-M412 VanDerWaalsContact O-CG 3.3Å; T408-M412 WeakPolarHBondContact O-CG 3.33Å; T408-M412 PolarHBondContact O-N 3.03Å
409	V	93.8	Very high	92.5	Very high	55 Å²	55	63.5 Å²	63.5	33%	0.333	34%	0.343	S	S	.	.	H	α-helix	trans	-64.7	-31.9	-178.9	174.3	0	0	0	0	111.6	K399 T413	K399-V409 HydrophobicContact CB-CG1 4.05Å; K399-V409 HydrophobicContact CG-CG1 3.97Å; V409-T413 VanDerWaalsContact O-CB 3.31Å; V409-T413 WeakPolarHBondContact O-CB 3.41Å; V409-T413 PolarHBondContact O-N 3.42Å; V409-T413 PolarHBondContact O-OG1 3.21Å
410	E	93.2	Very high	92.8	Very high	130 Å²	130	59 Å²	59	61%	0.607	32%	0.323	S	S	*	.	H	α-helix	trans	-66.1	-51.5	176.7	-53.5	71	-151.9	0	0	110.2	T408 M412 T413 E414	T408-E410 WeakPolarHBondContact CB-OE2 3.24Å; T408-E410 PolarHBondContact O-N 3.31Å; T408-E410 PolarHBondContact OG1-OE2 3.18Å; E410-M412 VanDerWaalsContact C-N 3.3Å; E410-M412 PolarHBondContact O-N 3.25Å; E410-T413 PolarHBondContact O-N 2.95Å; E410-E414 PolarHBondContact O-N 3.41Å
411	N	94.6	Very high	93.3	Very high	48 Å²	48	55.6 Å²	55.6	26%	0.257	31%	0.306	S	S	.	.	H	α-helix	trans	-57.4	-42.8	175.8	-64.3	-1.7	0	0	0	111.8	F376 C407 T408 A415	F376-N411 HydrophobicContact CD1-CB 3.85Å; F376-N411 HydrophobicContact CD2-CB 3.96Å; F376-N411 WeakPolarHBondContact CD2-O 3.45Å; F376-N411 HydrophobicContact CE1-CB 3.66Å; F376-N411 VanDerWaalsContact CE1-CG 3.43Å; F376-N411 WeakPolarHBondContact CE1-ND2 3.43Å; F376-N411 HydrophobicContact CE2-CB 3.76Å; F376-N411 HydrophobicContact CG-CB 4Å; F376-N411 HydrophobicContact CZ-CB 3.6Å; F376-N411 WeakPolarHBondContact CZ-OD1 3.41Å; C407-N411 HydrophobicContact CB-CB 4.43Å; T408-N411 PolarHBondContact O-N 3.49Å; T408-N411 PolarHBondContact OG1-N 2.98Å; T408-N411 PolarHBondContact OG1-OD1 3.31Å; N411-A415 WeakPolarHBondContact O-CB 3.44Å; N411-A415 PolarHBondContact O-N 3Å; N411-A415 VanDerWaalsContact O-N 3.14Å
412	M	95.3	Very high	93.8	Very high	2 Å²	2	46 Å²	46	1%	0.01	26%	0.264	C	S	.	.	H	α-helix	trans	-65.2	-44.3	177.2	-71.3	-61.8	-63.7	0	0	111.5	R369 F372 C373 I405 C407 T408 E410 A415 V416	R369-M412 HydrophobicContact CB-CE 4.48Å; R369-M412 HydrophobicContact CG-CE 4.44Å; R369-M412 WeakPolarHBondContact O-CE 3.46Å; F372-M412 HydrophobicContact CB-CE 3.65Å; F372-M412 HydrophobicContact CB-SD 4.45Å; C373-M412 HydrophobicContact CB-SD 3.85Å; I405-M412 HydrophobicContact CD1-CG 4.3Å; I405-M412 HydrophobicContact CD1-SD 4.17Å; C407-M412 HydrophobicContact CB-CG 4.02Å; C407-M412 HydrophobicContact CB-SD 3.88Å; T408-M412 VanDerWaalsContact O-CG 3.3Å; T408-M412 WeakPolarHBondContact O-CG 3.33Å; T408-M412 PolarHBondContact O-N 3.03Å; E410-M412 VanDerWaalsContact C-N 3.3Å; E410-M412 PolarHBondContact O-N 3.25Å; M412-A415 PolarHBondContact O-N 2.96Å; M412-V416 WeakPolarHBondContact O-CG2 3.3Å; M412-V416 PolarHBondContact O-N 3.43Å; M412-V416 VanDerWaalsContact O-N 3.09Å
413	T	95.3	Very high	94	Very high	37 Å²	37	46.1 Å²	46.1	23%	0.227	26%	0.264	C	S	.	.	H	α-helix	trans	-61.8	-43.3	178.4	-57.9	0	0	0	0	111.3	F398 V409 E410 A415 V416 E417	F398-T413 HydrophobicContact CE2-CG2 4.06Å; V409-T413 VanDerWaalsContact O-CB 3.31Å; V409-T413 WeakPolarHBondContact O-CB 3.41Å; V409-T413 PolarHBondContact O-N 3.42Å; V409-T413 PolarHBondContact O-OG1 3.21Å; E410-T413 PolarHBondContact O-N 2.95Å; T413-A415 VanDerWaalsContact C-N 3.31Å; T413-A415 PolarHBondContact O-N 3.48Å; T413-V416 PolarHBondContact O-N 2.88Å; T413-E417 PolarHBondContact O-N 2.67Å
414	E	94.8	Very high	94	Very high	102 Å²	102	40.2 Å²	40.2	48%	0.477	23%	0.225	S	C	.	.	H	α-helix	trans	-61.7	-38.3	175.2	-161.7	-166.8	145	0	0	112	Y381 E410	Y381-E414 WeakPolarHBondContact CD2-O 3.32Å; Y381-E414 HydrophobicContact CE2-CG 3.74Å; Y381-E414 WeakPolarHBondContact CE2-OE1 3.33Å; Y381-E414 VanDerWaalsContact CZ-OE1 3.26Å; Y381-E414 PolarHBondContact OH-OE1 3.13Å; E410-E414 PolarHBondContact O-N 3.41Å
415	A	96.1	Very high	93.9	Very high	3 Å²	3	38 Å²	38	3%	0.025	21%	0.205	C	C	.	.	H	α-helix	trans	-75.1	-26	-178.2	0	0	0	0	0	114.6	F372 F376 Y381 N411 M412 T413	F372-A415 HydrophobicContact CD1-CB 4.34Å; F372-A415 WeakPolarHBondContact CD1-O 3.28Å; F372-A415 WeakPolarHBondContact CE1-O 3.31Å; F376-A415 HydrophobicContact CB-CB 3.92Å; F376-A415 HydrophobicContact CD2-CB 4.24Å; Y381-A415 HydrophobicContact CD1-CB 4.4Å; Y381-A415 HydrophobicContact CG-CB 4.5Å; N411-A415 WeakPolarHBondContact O-CB 3.44Å; N411-A415 PolarHBondContact O-N 3Å; N411-A415 VanDerWaalsContact O-N 3.14Å; M412-A415 PolarHBondContact O-N 2.96Å; T413-A415 VanDerWaalsContact C-N 3.31Å; T413-A415 PolarHBondContact O-N 3.48Å
416	V	96.6	Very high	93.7	Very high	1 Å²	1	38 Å²	38	1%	0.006	21%	0.205	C	C	.	.	H	α-helix	trans	-94.5	-11.7	178	-61.5	0	0	0	0	113.9	F372 W397 F398 M412 T413 G418 H419 L540	F372-V416 HydrophobicContact CB-CG1 4.16Å; F372-V416 HydrophobicContact CD1-CB 4.48Å; F372-V416 HydrophobicContact CD1-CG1 3.57Å; F372-V416 HydrophobicContact CD2-CG1 4.27Å; F372-V416 HydrophobicContact CE1-CG1 4Å; F372-V416 HydrophobicContact CG-CG1 3.72Å; W397-V416 HydrophobicContact CH2-CG1 3.63Å; W397-V416 HydrophobicContact CZ2-CG1 3.72Å; F398-V416 HydrophobicContact CB-CG1 4.45Å; F398-V416 HydrophobicContact CB-CG2 4.39Å; F398-V416 HydrophobicContact CD1-CG2 4.22Å; F398-V416 HydrophobicContact CD2-CG2 3.83Å; F398-V416 HydrophobicContact CE1-CG2 4.47Å; F398-V416 HydrophobicContact CE2-CG2 4.08Å; F398-V416 HydrophobicContact CG-CG2 3.89Å; F398-V416 HydrophobicContact CZ-CG2 4.4Å; M412-V416 WeakPolarHBondContact O-CG2 3.3Å; M412-V416 PolarHBondContact O-N 3.43Å; M412-V416 VanDerWaalsContact O-N 3.09Å; T413-V416 PolarHBondContact O-N 2.88Å; V416-G418 PolarHBondContact O-N 3.49Å; V416-H419 PolarHBondContact O-N 3.3Å; V416-H419 PolarHBondContact O-ND1 3.4Å; V416-L540 HydrophobicContact CB-CD2 4.04Å; V416-L540 HydrophobicContact CG2-CD2 3.38Å
417	E	95.9	Very high	93.5	Very high	80 Å²	80	33.3 Å²	33.3	37%	0.374	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.6	135.3	-172.2	-175.8	60.6	-165.7	0	0	112.8	T413 H419 G542 G543	T413-E417 PolarHBondContact O-N 2.67Å; E417-H419 VanDerWaalsContact C-N 3.31Å; E417-H419 PolarHBondContact O-N 2.93Å; E417-G542 PolarHBondContact OE1-N 2.91Å; E417-G542 PolarHBondContact OE2-N 3.49Å; E417-G543 PolarHBondContact OE2-N 3.35Å; E417-G543 VanDerWaalsContact OE2-N 3.16Å
418	G	94.8	Very high	93.1	Very high	21 Å²	21	33.4 Å²	33.4	22%	0.216	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	79	-1.1	178.9	0	0	0	0	0	116.2	V416 Q539 L540	V416-G418 PolarHBondContact O-N 3.49Å; G418-Q539 PolarHBondContact O-NE2 3.45Å; G418-Q539 VanDerWaalsContact O-NE2 3.08Å; G418-L540 VanDerWaalsContact CA-O 3.28Å; G418-L540 WeakPolarHBondContact CA-O 3.4Å; G418-L540 PolarHBondContact N-O 3.46Å
419	H	97.1	Very high	92.2	Very high	4 Å²	4	33.6 Å²	33.6	2%	0.019	18%	0.181	C	C	.	.			trans	-63.4	152.1	176.4	81.8	-92	0	0	0	112.5	W387 V416 E417 Q539 L540 Y545	W387-H419 HydrophobicContact CB-CB 3.9Å; V416-H419 PolarHBondContact O-N 3.3Å; V416-H419 PolarHBondContact O-ND1 3.4Å; E417-H419 VanDerWaalsContact C-N 3.31Å; E417-H419 PolarHBondContact O-N 2.93Å; H419-Q539 WeakPolarHBondContact O-CA 3.36Å; H419-Q539 WeakPolarHBondContact O-CG 3.21Å; H419-L540 PolarHBondContact O-N 3.17Å; H419-Y545 AromaticContact CE1-CE1 3.74Å; H419-Y545 AromaticContact CE1-CZ 3.76Å; H419-Y545 PolarHBondContact CE1-OH 2.9Å; H419-Y545 AromaticContact NE2-CE1 3.48Å; H419-Y545 WeakPolarHBondContact NE2-CE1 3.44Å; H419-Y545 AromaticContact NE2-CZ 3.66Å; H419-Y545 PolarHBondContact NE2-OH 3.01Å
420	V	97.4	Very high	91.5	Very high	0 Å²	0	37 Å²	37	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	132	179.2	-179.5	0	0	0	0	109.4	W301 V386 W387 F388 L389 I537 E538 W566	W301-V420 HydrophobicContact CH2-CG2 4.47Å; V386-V420 HydrophobicContact CG1-CG2 4.43Å; W387-V420 PolarHBondContact O-N 2.93Å; F388-V420 WeakPolarHBondContact CA-O 3.43Å; F388-V420 HydrophobicContact CD1-CB 4.01Å; F388-V420 HydrophobicContact CD1-CG1 4.04Å; F388-V420 HydrophobicContact CE1-CB 3.7Å; F388-V420 HydrophobicContact CE1-CG1 3.63Å; F388-V420 HydrophobicContact CE1-CG2 4.24Å; F388-V420 HydrophobicContact CZ-CB 4.12Å; F388-V420 HydrophobicContact CZ-CG1 4.4Å; F388-V420 HydrophobicContact CZ-CG2 4.22Å; L389-V420 PolarHBondContact N-O 3.17Å; V420-I537 HydrophobicContact CG1-CG2 3.92Å; V420-E538 WeakPolarHBondContact CA-O 2.83Å; V420-E538 WeakPolarHBondContact CG1-O 3.41Å; V420-W566 HydrophobicContact CG2-CH2 4.03Å
421	T	96.3	Very high	90.9	Very high	1 Å²	1	36.5 Å²	36.5	1%	0.006	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	147.3	170.5	48.8	0	0	0	0	110.6	L389 E538 Y545	L389-T421 HydrophobicContact CB-CG2 4.35Å; T421-E538 PolarHBondContact N-O 3.38Å; T421-E538 PolarHBondContact O-N 3.21Å; T421-E538 VanDerWaalsContact O-N 3.15Å; T421-E538 WeakPolarHBondContact OG1-CB 3.49Å; T421-Y545 HydrophobicContact CG2-CE1 3.7Å
422	T	94.7	Very high	90.5	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	119.6	163.2	56.1	0	0	0	0	108.7	H290 T293 R294 L389 G391	H290-T422 PolarHBondContact CE1-O 3Å; H290-T422 VanDerWaalsContact CE1-O 3.29Å; H290-T422 PolarHBondContact ND1-O 3.03Å; T293-T422 HydrophobicContact CG2-CG2 4.29Å; R294-T422 HydrophobicContact CG-CG2 4.25Å; R294-T422 PolarHBondContact NE-OG1 2.92Å; R294-T422 PolarHBondContact NH2-OG1 3.3Å; L389-T422 PolarHBondContact O-N 2.93Å; L389-T422 VanDerWaalsContact O-N 3.15Å; G391-T422 PolarHBondContact N-O 2.96Å; G391-T422 VanDerWaalsContact N-O 3.1Å
423	E	89.8	Confident	90.3	Very high	32 Å²	32	42.8 Å²	42.8	15%	0.15	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	-177.8	171.7	70	171.2	160.8	0	0	111	T535 L536 K547	E423-T535 WeakPolarHBondContact O-CA 3.14Å; E423-T535 VanDerWaalsContact O-CB 3.31Å; E423-T535 WeakPolarHBondContact O-CB 3.33Å; E423-L536 HydrophobicContact CG-CB 3.74Å; E423-L536 HydrophobicContact CG-CD2 4.47Å; E423-L536 HydrophobicContact CG-CG 4.09Å; E423-L536 PolarHBondContact N-O 2.94Å; E423-L536 PolarHBondContact O-N 3.28Å; E423-L536 VanDerWaalsContact O-N 3.12Å; E423-L536 WeakPolarHBondContact OE1-CD2 3.27Å; E423-L536 WeakPolarHBondContact OE1-CG 3.4Å; E423-K547 IonicContact OE1-NZ 2.7Å; E423-K547 PolarHBondContact OE1-NZ 2.96Å
424	I	88.8	Confident	89.9	Confident	7 Å²	7	41.6 Å²	41.6	4%	0.036	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	134.8	177.3	-62.2	152.4	0	0	0	107.5	P285 L289 H290 M426 A533 T535	P285-I424 HydrophobicContact CB-CD1 4.34Å; P285-I424 HydrophobicContact CB-CG2 4.1Å; P285-I424 HydrophobicContact CG-CG2 3.79Å; L289-I424 HydrophobicContact CB-CD1 4.4Å; L289-I424 HydrophobicContact CD2-CD1 4.4Å; L289-I424 HydrophobicContact CD2-CG1 4.19Å; L289-I424 HydrophobicContact CD2-CG2 4.02Å; H290-I424 VanDerWaalsContact CE1-CD1 3.5Å; H290-I424 WeakPolarHBondContact CE1-CD1 3.32Å; I424-M426 WeakPolarHBondContact O-CG 3.39Å; I424-M426 PolarHBondContact O-N 3Å; I424-A533 HydrophobicContact CG2-CB 3.68Å; I424-T535 HydrophobicContact CG1-CG2 4.18Å
425	V	85.4	Confident	89.8	Confident	17 Å²	17	38.5 Å²	38.5	10%	0.103	21%	0.208	C	C	.	.			trans	-70.8	104.3	-175.7	-179.6	0	0	0	0	110	L427 M534 L536 Y550	V425-L427 WeakPolarHBondContact CG1-O 3.17Å; V425-M534 HydrophobicContact CG2-CB 4.28Å; V425-M534 PolarHBondContact N-O 3.46Å; V425-L536 HydrophobicContact CG2-CB 3.89Å; V425-Y550 HydrophobicContact CG2-CD1 3.84Å; V425-Y550 HydrophobicContact CG2-CE1 3.73Å
426	M	86.9	Confident	89.6	Confident	27 Å²	27	38.9 Å²	38.9	13%	0.133	21%	0.211	C	C	.	.			trans	-93.6	-9.7	-178.8	-56.8	-165.9	-172.4	0	0	114.3	H284 I424 Q463 E464 P466 L467 S520	H284-M426 WeakPolarHBondContact NE2-CE 3.32Å; I424-M426 WeakPolarHBondContact O-CG 3.39Å; I424-M426 PolarHBondContact O-N 3Å; M426-Q463 WeakPolarHBondContact CB-O 3.38Å; M426-Q463 HydrophobicContact SD-CB 4.46Å; M426-E464 HydrophobicContact CE-CG 4.33Å; M426-E464 HydrophobicContact SD-CB 4.37Å; M426-E464 HydrophobicContact SD-CG 3.81Å; M426-P466 WeakPolarHBondContact O-CB 3.39Å; M426-L467 HydrophobicContact CB-CD2 4.41Å; M426-L467 HydrophobicContact CB-CG 4.49Å; M426-L467 HydrophobicContact CG-CD1 4.23Å; M426-L467 HydrophobicContact SD-CD1 3.67Å; M426-L467 HydrophobicContact SD-CG 4.45Å; M426-S520 VanDerWaalsContact O-CA 3.29Å; M426-S520 WeakPolarHBondContact O-CA 3.16Å; M426-S520 WeakPolarHBondContact O-CB 3.22Å
427	L	87.8	Confident	89.4	Confident	47 Å²	47	44.1 Å²	44.1	25%	0.246	24%	0.239	C	C	.	.	S	Bend	trans	-132.2	134.5	178.6	-174.9	70.6	0	0	0	108.6	V425 P429 L444 P466 V519	V425-L427 WeakPolarHBondContact CG1-O 3.17Å; L427-P429 VanDerWaalsContact O-CD 3.31Å; L427-P429 WeakPolarHBondContact O-CD 3.44Å; L427-L444 HydrophobicContact CD2-CD1 3.75Å; L427-L444 HydrophobicContact CD2-CD2 4.49Å; L427-L444 HydrophobicContact CD2-CG 4.22Å; L427-P466 HydrophobicContact CD1-CB 4.45Å; L427-P466 HydrophobicContact CD1-CG 3.86Å; L427-V519 HydrophobicContact CD1-CG1 3.76Å
428	N	84.4	Confident	89.1	Confident	21 Å²	21	42.4 Å²	42.4	11%	0.112	23%	0.231	C	C	.	.			trans	-66.8	121.6	178.1	-168.3	-8.6	0	0	0	110.3	E430 S440 V519	N428-E430 VanDerWaalsContact C-N 3.25Å; N428-E430 PolarHBondContact O-N 2.85Å; N428-E430 WeakPolarHBondContact OD1-CB 3.44Å; N428-E430 PolarHBondContact OD1-N 3.13Å; N428-S440 WeakPolarHBondContact O-CB 3.39Å; N428-S440 PolarHBondContact O-OG 3.02Å; N428-V519 PolarHBondContact N-O 2.96Å
429	P	77.1	Confident	89	Confident	70 Å²	70	42.2 Å²	42.2	46%	0.455	23%	0.226	S	C	.	.	S	Bend	trans	-70.7	-20.9	175.1	29.6	-36.2	0	0	0	112.9	L427	L427-P429 VanDerWaalsContact O-CD 3.31Å; L427-P429 WeakPolarHBondContact O-CD 3.44Å
430	E	78.4	Confident	88.7	Confident	127 Å²	127	42.2 Å²	42.2	59%	0.593	23%	0.226	S	C	*	.	S	Bend	trans	-81.1	144.4	179.1	-57.5	-173.3	172.1	0	0	111.8	N428 V432	N428-E430 VanDerWaalsContact C-N 3.25Å; N428-E430 PolarHBondContact O-N 2.85Å; N428-E430 WeakPolarHBondContact OD1-CB 3.44Å; N428-E430 PolarHBondContact OD1-N 3.13Å; E430-V432 HydrophobicContact CB-CG2 3.96Å; E430-V432 PolarHBondContact O-N 2.94Å
431	T	80.6	Confident	88.3	Confident	119 Å²	119	47.2 Å²	47.2	73%	0.73	25%	0.25	S	C	*	.			trans	-81.8	47	179.9	57.6	0	0	0	0	112.7
432	V	87.2	Confident	88.1	Confident	61 Å²	61	51 Å²	51	37%	0.37	27%	0.268	S	S	.	.			trans	-84.9	144.5	176.5	-178.9	0	0	0	0	109.7	E430	E430-V432 HydrophobicContact CB-CG2 3.96Å; E430-V432 PolarHBondContact O-N 2.94Å
433	R	90.3	Very high	88.1	Confident	122 Å²	122	51 Å²	51	46%	0.46	27%	0.268	S	S	.	.			trans	-89	117.8	170.1	-71.4	-173.5	-177.6	-74.9	-12.6	109.7	N437 M438 T439 E442	R433-N437 WeakPolarHBondContact CD-O 3.38Å; R433-N437 WeakPolarHBondContact CD-OD1 3.39Å; R433-N437 PolarHBondContact NH1-O 3.31Å; R433-M438 WeakPolarHBondContact CA-O 3.44Å; R433-T439 HydrophobicContact CG-CG2 3.7Å; R433-E442 IonicContact CZ-OE1 2.67Å; R433-E442 IonicContact CZ-OE2 3.37Å; R433-E442 VanDerWaalsContact NH1-CD 3.31Å; R433-E442 IonicContact NH1-OE1 2.72Å; R433-E442 PolarHBondContact NH1-OE1 3.37Å; R433-E442 VanDerWaalsContact NH1-OE1 3.08Å; R433-E442 IonicContact NH1-OE2 3.08Å; R433-E442 PolarHBondContact NH1-OE2 3.19Å; R433-E442 IonicContact NH2-OE1 3.27Å; R433-E442 PolarHBondContact NH2-OE1 3.3Å; R433-E442 IonicContact NH2-OE2 2.73Å; R433-E442 PolarHBondContact NH2-OE2 2.62Å
434	G	88	Confident	88.2	Confident	11 Å²	11	51 Å²	51	11%	0.113	27%	0.268	C	S	.	.			trans	-77.8	-169.9	176.7	0	0	0	0	0	113.3	S436 N437 M438 E517	G434-S436 PolarHBondContact O-N 3.23Å; G434-S436 VanDerWaalsContact O-N 3.09Å; G434-N437 WeakPolarHBondContact O-CA 3.46Å; G434-N437 PolarHBondContact O-N 2.83Å; G434-M438 PolarHBondContact N-O 3.38Å; G434-M438 VanDerWaalsContact N-O 3.14Å; G434-E517 CarbonylContact C-O 3.59Å; G434-E517 VanDerWaalsContact CA-O 3.27Å; G434-E517 WeakPolarHBondContact CA-O 3.25Å
435	V	92.2	Very high	88.3	Confident	37 Å²	37	52.3 Å²	52.3	22%	0.224	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-26.6	-178.9	67.7	0	0	0	0	113.9	R199 N437 W473 L477 F516 E517	R199-V435 PolarHBondContact NH1-O 2.91Å; V435-N437 PolarHBondContact O-N 3.31Å; V435-W473 HydrophobicContact CG1-CB 4.25Å; V435-W473 HydrophobicContact CG1-CD2 3.86Å; V435-W473 HydrophobicContact CG1-CE3 3.73Å; V435-W473 HydrophobicContact CG1-CG 4.09Å; V435-W473 HydrophobicContact CG1-CZ3 4.4Å; V435-W473 HydrophobicContact CG2-CE3 4.15Å; V435-W473 HydrophobicContact CG2-CZ3 4.24Å; V435-L477 HydrophobicContact CG1-CD1 4.41Å; V435-L477 HydrophobicContact CG2-CD1 4.17Å; V435-L477 HydrophobicContact CG2-CD2 4.24Å; V435-F516 HydrophobicContact CB-CD2 4.22Å; V435-F516 HydrophobicContact CG1-CD2 3.58Å; V435-F516 HydrophobicContact CG1-CE2 3.96Å; V435-E517 PolarHBondContact N-O 2.87Å
436	S	91.9	Very high	88.6	Confident	12 Å²	12	53.1 Å²	53.1	8%	0.084	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.9	-4.8	174	58.3	0	0	0	0	114.5	G434 M438	G434-S436 PolarHBondContact O-N 3.23Å; G434-S436 VanDerWaalsContact O-N 3.09Å; S436-M438 PolarHBondContact O-N 3.03Å; S436-M438 PolarHBondContact OG-N 2.85Å
437	N	91.8	Very high	88.9	Confident	110 Å²	110	51.8 Å²	51.8	59%	0.588	29%	0.286	S	S	*	.	S	Bend	trans	59.6	18.3	-167.7	-162.7	33.4	0	0	0	114.4	R433 G434 V435	R433-N437 WeakPolarHBondContact CD-O 3.38Å; R433-N437 WeakPolarHBondContact CD-OD1 3.39Å; R433-N437 PolarHBondContact NH1-O 3.31Å; G434-N437 WeakPolarHBondContact O-CA 3.46Å; G434-N437 PolarHBondContact O-N 2.83Å; V435-N437 PolarHBondContact O-N 3.31Å
438	M	89.9	Confident	89.1	Confident	44 Å²	44	53.2 Å²	53.2	22%	0.217	29%	0.292	C	S	.	.			trans	-107.8	149.7	175.6	-62.5	179.9	173.5	0	0	111.1	L195 R433 G434 S436	L195-M438 HydrophobicContact CD1-CE 3.59Å; L195-M438 HydrophobicContact CD1-SD 3.93Å; L195-M438 HydrophobicContact CD2-CE 3.74Å; L195-M438 HydrophobicContact CG-CE 4.31Å; R433-M438 WeakPolarHBondContact CA-O 3.44Å; G434-M438 PolarHBondContact N-O 3.38Å; G434-M438 VanDerWaalsContact N-O 3.14Å; S436-M438 PolarHBondContact O-N 3.03Å; S436-M438 PolarHBondContact OG-N 2.85Å
439	T	92.6	Very high	89.3	Confident	18 Å²	18	56.8 Å²	56.8	11%	0.11	32%	0.319	C	S	.	.			trans	-88.4	162.4	164.8	62.5	0	0	0	0	111.1	R433 Q441 E442 F443	R433-T439 HydrophobicContact CG-CG2 3.7Å; T439-Q441 PolarHBondContact O-N 3.25Å; T439-E442 WeakPolarHBondContact CB-OE2 3.46Å; T439-E442 WeakPolarHBondContact CG2-OE2 3.44Å; T439-E442 PolarHBondContact N-OE2 3.28Å; T439-E442 PolarHBondContact O-N 2.74Å; T439-E442 VanDerWaalsContact OG1-CD 3.25Å; T439-E442 WeakPolarHBondContact OG1-CG 3.47Å; T439-E442 PolarHBondContact OG1-N 3.16Å; T439-E442 PolarHBondContact OG1-OE2 2.74Å; T439-F443 PolarHBondContact O-N 2.94Å
440	S	90.8	Very high	90	Very high	3 Å²	3	58.7 Å²	58.7	2%	0.021	32%	0.317	C	S	.	.	H	α-helix	trans	-48.8	-41.3	175.1	-52.7	0	0	0	0	113.9	N428 L444	N428-S440 WeakPolarHBondContact O-CB 3.39Å; N428-S440 PolarHBondContact O-OG 3.02Å; S440-L444 WeakPolarHBondContact O-CG 3.48Å; S440-L444 PolarHBondContact O-N 3.15Å; S440-L444 VanDerWaalsContact O-N 3.09Å
441	Q	89.9	Confident	90.4	Very high	105 Å²	105	53.7 Å²	53.7	49%	0.491	29%	0.294	S	S	.	.	H	α-helix	trans	-80.9	-34.1	-173.3	-44	-52.5	-15	0	0	112.3	T439 L444 G445	T439-Q441 PolarHBondContact O-N 3.25Å; Q441-L444 PolarHBondContact O-N 3.41Å; Q441-G445 PolarHBondContact O-N 3.07Å
442	E	92.6	Very high	90.4	Very high	82 Å²	82	51.2 Å²	51.2	38%	0.383	29%	0.293	S	S	.	.	H	α-helix	trans	-65.9	-39.7	170.9	-68.5	161.9	140.5	0	0	111.2	R433 T439 G445 A446	R433-E442 IonicContact CZ-OE1 2.67Å; R433-E442 IonicContact CZ-OE2 3.37Å; R433-E442 VanDerWaalsContact NH1-CD 3.31Å; R433-E442 IonicContact NH1-OE1 2.72Å; R433-E442 PolarHBondContact NH1-OE1 3.37Å; R433-E442 VanDerWaalsContact NH1-OE1 3.08Å; R433-E442 IonicContact NH1-OE2 3.08Å; R433-E442 PolarHBondContact NH1-OE2 3.19Å; R433-E442 IonicContact NH2-OE1 3.27Å; R433-E442 PolarHBondContact NH2-OE1 3.3Å; R433-E442 IonicContact NH2-OE2 2.73Å; R433-E442 PolarHBondContact NH2-OE2 2.62Å; T439-E442 WeakPolarHBondContact CB-OE2 3.46Å; T439-E442 WeakPolarHBondContact CG2-OE2 3.44Å; T439-E442 PolarHBondContact N-OE2 3.28Å; T439-E442 PolarHBondContact O-N 2.74Å; T439-E442 VanDerWaalsContact OG1-CD 3.25Å; T439-E442 WeakPolarHBondContact OG1-CG 3.47Å; T439-E442 PolarHBondContact OG1-N 3.16Å; T439-E442 PolarHBondContact OG1-OE2 2.74Å; E442-G445 PolarHBondContact O-N 3.43Å; E442-A446 WeakPolarHBondContact O-CB 3.4Å; E442-A446 PolarHBondContact O-N 2.92Å
443	F	94.2	Very high	89.3	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-58.9	-48	172.4	165.2	-90.3	0	0	0	111.7	S188 M191 T439 G445 A446 L447 A465 P466 F469 V519	S188-F443 WeakPolarHBondContact OG-CZ 3.42Å; M191-F443 HydrophobicContact CE-CD2 3.46Å; M191-F443 VanDerWaalsContact CE-CD2 3.46Å; M191-F443 HydrophobicContact CE-CE2 3.45Å; M191-F443 VanDerWaalsContact CE-CE2 3.45Å; M191-F443 HydrophobicContact CE-CG 4.44Å; M191-F443 HydrophobicContact CE-CZ 4.42Å; T439-F443 PolarHBondContact O-N 2.94Å; F443-G445 PolarHBondContact O-N 3.24Å; F443-A446 PolarHBondContact O-N 2.91Å; F443-L447 HydrophobicContact CE1-CD2 3.99Å; F443-L447 HydrophobicContact CZ-CD2 3.97Å; F443-L447 WeakPolarHBondContact O-CB 3.43Å; F443-L447 PolarHBondContact O-N 3.32Å; F443-A465 HydrophobicContact CZ-CB 4.43Å; F443-P466 HydrophobicContact CE1-CB 4.4Å; F443-P466 HydrophobicContact CE1-CG 3.81Å; F443-P466 HydrophobicContact CZ-CG 4.28Å; F443-F469 HydrophobicContact CD2-CD1 4.49Å; F443-F469 AromaticContact CD2-CD2 3.94Å; F443-F469 HydrophobicContact CD2-CD2 3.94Å; F443-F469 HydrophobicContact CD2-CE2 4.13Å; F443-F469 HydrophobicContact CD2-CG 4.13Å; F443-F469 HydrophobicContact CD2-CZ 4.48Å; F443-F469 HydrophobicContact CE2-CB 3.79Å; F443-F469 HydrophobicContact CE2-CD1 4.43Å; F443-F469 AromaticContact CE2-CD2 3.59Å; F443-F469 HydrophobicContact CE2-CD2 3.59Å; F443-F469 HydrophobicContact CE2-CE2 4.24Å; F443-F469 AromaticContact CE2-CG 3.71Å; F443-F469 HydrophobicContact CE2-CG 3.71Å; F443-F469 HydrophobicContact CZ-CB 4.37Å; F443-V519 HydrophobicContact CB-CG1 3.81Å; F443-V519 HydrophobicContact CB-CG2 4.25Å; F443-V519 HydrophobicContact CD1-CG1 3.59Å; F443-V519 HydrophobicContact CD2-CG1 4.01Å; F443-V519 HydrophobicContact CD2-CG2 4.17Å; F443-V519 HydrophobicContact CE1-CG1 4.17Å; F443-V519 HydrophobicContact CG-CB 4.47Å; F443-V519 HydrophobicContact CG-CG1 3.51Å; F443-V519 HydrophobicContact CG-CG2 4.26Å
444	L	91.4	Very high	88.6	Confident	30 Å²	30	52.1 Å²	52.1	16%	0.157	31%	0.314	C	S	.	.	H	α-helix	trans	-61.5	-43.8	178.4	-72.3	-176.2	0	0	0	111.8	L427 S440 Q441 A446 L447 M448 F462	L427-L444 HydrophobicContact CD2-CD1 3.75Å; L427-L444 HydrophobicContact CD2-CD2 4.49Å; L427-L444 HydrophobicContact CD2-CG 4.22Å; S440-L444 WeakPolarHBondContact O-CG 3.48Å; S440-L444 PolarHBondContact O-N 3.15Å; S440-L444 VanDerWaalsContact O-N 3.09Å; Q441-L444 PolarHBondContact O-N 3.41Å; L444-A446 VanDerWaalsContact C-N 3.35Å; L444-A446 PolarHBondContact O-N 2.88Å; L444-L447 PolarHBondContact O-N 3.42Å; L444-M448 WeakPolarHBondContact O-CB 3.47Å; L444-M448 VanDerWaalsContact O-CG 3.3Å; L444-M448 WeakPolarHBondContact O-CG 3.47Å; L444-M448 PolarHBondContact O-N 3.38Å; L444-F462 HydrophobicContact CD2-CE1 3.83Å; L444-F462 HydrophobicContact CD2-CZ 3.84Å
445	G	91.1	Very high	88.1	Confident	36 Å²	36	55.8 Å²	55.8	37%	0.371	33%	0.331	S	S	.	.	H	α-helix	trans	-61.2	-40.7	175.8	0	0	0	0	0	113.1	Q441 E442 F443 S449	Q441-G445 PolarHBondContact O-N 3.07Å; E442-G445 PolarHBondContact O-N 3.43Å; F443-G445 PolarHBondContact O-N 3.24Å; G445-S449 WeakPolarHBondContact O-CB 3.04Å; G445-S449 PolarHBondContact O-N 3.25Å; G445-S449 VanDerWaalsContact O-N 3.09Å; G445-S449 PolarHBondContact O-OG 2.94Å
446	A	92.4	Very high	87.4	Confident	33 Å²	33	56.2 Å²	56.2	27%	0.273	33%	0.334	S	S	.	.	H	α-helix	trans	-67.7	-40.2	175.8	0	0	0	0	0	112.4	M191 E442 F443 L444 S449 R450	M191-A446 HydrophobicContact CE-CB 4.32Å; M191-A446 HydrophobicContact SD-CB 3.63Å; E442-A446 WeakPolarHBondContact O-CB 3.4Å; E442-A446 PolarHBondContact O-N 2.92Å; F443-A446 PolarHBondContact O-N 2.91Å; L444-A446 VanDerWaalsContact C-N 3.35Å; L444-A446 PolarHBondContact O-N 2.88Å; A446-S449 WeakPolarHBondContact O-CB 3.23Å; A446-S449 PolarHBondContact O-N 3.34Å; A446-R450 PolarHBondContact O-N 3.09Å; A446-R450 VanDerWaalsContact O-N 3.09Å
447	L	93.2	Very high	86.4	Confident	0 Å²	0	63.3 Å²	63.3	0%	0	37%	0.366	C	S	.	.	H	α-helix	trans	-66.3	-47.4	176.9	-179	62.2	0	0	0	111.8	P187 M191 F443 L444 S449 R450 L451 F462 A465	P187-L447 HydrophobicContact CB-CD1 4.36Å; M191-L447 HydrophobicContact CE-CB 4.38Å; F443-L447 HydrophobicContact CE1-CD2 3.99Å; F443-L447 HydrophobicContact CZ-CD2 3.97Å; F443-L447 WeakPolarHBondContact O-CB 3.43Å; F443-L447 PolarHBondContact O-N 3.32Å; L444-L447 PolarHBondContact O-N 3.42Å; L447-S449 PolarHBondContact O-N 3.29Å; L447-R450 PolarHBondContact O-N 3.02Å; L447-R450 VanDerWaalsContact O-N 3.09Å; L447-L451 HydrophobicContact CD1-CD1 4.3Å; L447-L451 HydrophobicContact CD1-CG 4.44Å; L447-L451 HydrophobicContact CG-CD1 3.98Å; L447-L451 WeakPolarHBondContact O-CG 3.42Å; L447-L451 PolarHBondContact O-N 3Å; L447-F462 HydrophobicContact CD2-CD2 4.27Å; L447-F462 HydrophobicContact CD2-CE2 3.93Å; L447-F462 HydrophobicContact CD2-CZ 4.44Å; L447-F462 HydrophobicContact CG-CE2 4.33Å; L447-A465 HydrophobicContact CD2-CB 3.56Å
448	M	90.5	Very high	85.6	Confident	76 Å²	76	65 Å²	65	37%	0.374	37%	0.37	S	S	.	.	H	α-helix	trans	-58.6	-37.9	175.1	-70.3	-179.5	-168	0	0	111.9	L444 L451 G452 P456 F462	L444-M448 WeakPolarHBondContact O-CB 3.47Å; L444-M448 VanDerWaalsContact O-CG 3.3Å; L444-M448 WeakPolarHBondContact O-CG 3.47Å; L444-M448 PolarHBondContact O-N 3.38Å; M448-L451 PolarHBondContact O-N 2.81Å; M448-G452 PolarHBondContact O-N 3.1Å; M448-P456 HydrophobicContact CE-CG 3.75Å; M448-P456 HydrophobicContact SD-CG 4.4Å; M448-F462 HydrophobicContact CE-CE1 4.37Å; M448-F462 HydrophobicContact CE-CZ 3.71Å; M448-F462 HydrophobicContact CG-CE2 4.25Å; M448-F462 HydrophobicContact CG-CZ 4.16Å
449	S	90.3	Very high	85.3	Confident	97 Å²	97	63.3 Å²	63.3	68%	0.678	36%	0.363	S	S	*	.	H	α-helix	trans	-63.1	-40.9	174.6	-58.9	0	0	0	0	112.2	G445 A446 L447 G452	G445-S449 WeakPolarHBondContact O-CB 3.04Å; G445-S449 PolarHBondContact O-N 3.25Å; G445-S449 VanDerWaalsContact O-N 3.09Å; G445-S449 PolarHBondContact O-OG 2.94Å; A446-S449 WeakPolarHBondContact O-CB 3.23Å; A446-S449 PolarHBondContact O-N 3.34Å; L447-S449 PolarHBondContact O-N 3.29Å; S449-G452 PolarHBondContact O-N 2.78Å
450	R	89.9	Confident	84.7	Confident	109 Å²	109	63 Å²	63	41%	0.411	36%	0.364	S	S	.	.	H	α-helix	trans	-71	-27.8	174.3	-71.3	-172.1	-179.2	-134.7	-1.3	113.6	P187 D194 A446 L447 G452	P187-R450 HydrophobicContact CB-CB 4.43Å; D194-R450 IonicContact OD2-CZ 3.41Å; D194-R450 IonicContact OD2-NH1 2.74Å; D194-R450 PolarHBondContact OD2-NH1 3.48Å; D194-R450 IonicContact OD2-NH2 3.18Å; D194-R450 PolarHBondContact OD2-NH2 3.26Å; A446-R450 PolarHBondContact O-N 3.09Å; A446-R450 VanDerWaalsContact O-N 3.09Å; L447-R450 PolarHBondContact O-N 3.02Å; L447-R450 VanDerWaalsContact O-N 3.09Å; R450-G452 PolarHBondContact O-N 3.39Å
451	L	87.5	Confident	84.4	Confident	22 Å²	22	63.3 Å²	63.3	12%	0.115	37%	0.366	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78	-2.4	176.8	-71.5	169.2	0	0	0	113.8	A184 P187 L447 M448 G453 T459 F462	A184-L451 HydrophobicContact CB-CD1 4.48Å; P187-L451 HydrophobicContact CG-CD2 4.23Å; L447-L451 HydrophobicContact CD1-CD1 4.3Å; L447-L451 HydrophobicContact CD1-CG 4.44Å; L447-L451 HydrophobicContact CG-CD1 3.98Å; L447-L451 WeakPolarHBondContact O-CG 3.42Å; L447-L451 PolarHBondContact O-N 3Å; M448-L451 PolarHBondContact O-N 2.81Å; L451-G453 PolarHBondContact O-N 3.4Å; L451-T459 HydrophobicContact CD1-CG2 4.15Å; L451-T459 HydrophobicContact CD2-CG2 4.05Å; L451-F462 HydrophobicContact CD1-CD2 3.9Å; L451-F462 HydrophobicContact CD1-CE2 3.86Å
452	G	80.4	Confident	84.3	Confident	68 Å²	68	59.8 Å²	59.8	70%	0.701	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.8	27.8	173.4	0	0	0	0	0	114.4	M448 S449 R450	M448-G452 PolarHBondContact O-N 3.1Å; S449-G452 PolarHBondContact O-N 2.78Å; R450-G452 PolarHBondContact O-N 3.39Å
453	G	65.3	Low	84	Confident	67 Å²	67	59.8 Å²	59.8	69%	0.691	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.3	17.2	177.3	0	0	0	0	0	115.4	L451	L451-G453 PolarHBondContact O-N 3.4Å
454	K	75.1	Confident	83.9	Confident	134 Å²	134	60.6 Å²	60.6	58%	0.583	35%	0.353	S	S	*	.			trans	-63.4	147.3	167.4	-70.9	-176.8	176	-173.1	0	111.4
455	N	77.1	Confident	84	Confident	89 Å²	89	59.1 Å²	59.1	48%	0.476	35%	0.346	S	S	.	.			trans	-61.3	129.7	173.2	-72.4	-22.6	0	0	0	110.5	E457 E458 T459	N455-E457 VanDerWaalsContact C-N 3.27Å; N455-E457 PolarHBondContact O-N 2.96Å; N455-E458 HydrophobicContact CB-CB 4.15Å; N455-E458 HydrophobicContact CB-CG 4.02Å; N455-E458 PolarHBondContact ND2-OE1 2.97Å; N455-E458 PolarHBondContact O-N 3.11Å; N455-E458 VanDerWaalsContact O-N 3.15Å; N455-T459 PolarHBondContact O-N 3.48Å; N455-T459 PolarHBondContact O-OG1 2.96Å
456	P	78.1	Confident	84.2	Confident	46 Å²	46	57.5 Å²	57.5	30%	0.299	33%	0.329	S	S	.	.	G	3₁₀ helix	trans	-58.2	-39.1	175.2	-27	36.1	0	0	0	112.8	M448 E458 T459 F462	M448-P456 HydrophobicContact CE-CG 3.75Å; M448-P456 HydrophobicContact SD-CG 4.4Å; P456-E458 PolarHBondContact O-N 3.01Å; P456-T459 PolarHBondContact O-N 2.85Å; P456-T459 VanDerWaalsContact O-N 3.12Å; P456-F462 HydrophobicContact CB-CD1 3.93Å; P456-F462 HydrophobicContact CB-CD2 4.15Å; P456-F462 HydrophobicContact CB-CE1 3.86Å; P456-F462 HydrophobicContact CB-CE2 4.08Å; P456-F462 HydrophobicContact CB-CG 4.08Å; P456-F462 HydrophobicContact CB-CZ 3.95Å; P456-F462 HydrophobicContact CG-CE1 4.48Å; P456-F462 HydrophobicContact CG-CE2 4.36Å; P456-F462 HydrophobicContact CG-CZ 4.18Å
457	E	70.3	Confident	84.3	Confident	160 Å²	160	56 Å²	56	75%	0.748	32%	0.316	S	S	*	.	G	3₁₀ helix	trans	-61.6	-25.6	177.9	-63.6	176.3	-147	0	0	113.5	N455	N455-E457 VanDerWaalsContact C-N 3.27Å; N455-E457 PolarHBondContact O-N 2.96Å
458	E	74.8	Confident	84.5	Confident	145 Å²	145	56 Å²	56	68%	0.678	32%	0.316	S	S	*	.	G	3₁₀ helix	trans	-97	-6.3	178.9	-66.5	171.3	-145.9	0	0	112.9	N455 P456	N455-E458 HydrophobicContact CB-CB 4.15Å; N455-E458 HydrophobicContact CB-CG 4.02Å; N455-E458 PolarHBondContact ND2-OE1 2.97Å; N455-E458 PolarHBondContact O-N 3.11Å; N455-E458 VanDerWaalsContact O-N 3.15Å; P456-E458 PolarHBondContact O-N 3.01Å
459	T	83.1	Confident	84.8	Confident	10 Å²	10	52.3 Å²	52.3	6%	0.061	30%	0.298	C	S	.	.	S	Bend	trans	-100.2	115.3	-171.3	-57.6	0	0	0	0	111.4	Q183 A184 L451 N455 P456 G461 F462	Q183-T459 HydrophobicContact CB-CG2 4.17Å; A184-T459 HydrophobicContact CB-CG2 4.03Å; L451-T459 HydrophobicContact CD1-CG2 4.15Å; L451-T459 HydrophobicContact CD2-CG2 4.05Å; N455-T459 PolarHBondContact O-N 3.48Å; N455-T459 PolarHBondContact O-OG1 2.96Å; P456-T459 PolarHBondContact O-N 2.85Å; P456-T459 VanDerWaalsContact O-N 3.12Å; T459-G461 PolarHBondContact O-N 2.88Å; T459-F462 PolarHBondContact O-N 3.08Å
460	G	80.5	Confident	85.1	Confident	12 Å²	12	47.7 Å²	47.7	12%	0.124	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.7	127.8	-179.1	0	0	0	0	0	113.7	P180 Q183 A184	P180-G460 CarbonylContact O-C 3.53Å; Q183-G460 VanDerWaalsContact OE1-N 3.11Å; A184-G460 PolarHBondContact N-O 3.34Å
461	G	83.9	Confident	85.4	Confident	8 Å²	8	42.5 Å²	42.5	8%	0.082	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	81.5	18.3	174.1	0	0	0	0	0	115.4	T459 E464 A465	T459-G461 PolarHBondContact O-N 2.88Å; G461-E464 WeakPolarHBondContact CA-OE2 3.02Å; G461-E464 PolarHBondContact O-N 3.23Å; G461-A465 PolarHBondContact O-N 3.48Å
462	F	88.6	Confident	85.9	Confident	31 Å²	31	41.5 Å²	41.5	14%	0.136	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-35.3	-175.3	-169.4	-90	0	0	0	113	A184 L444 L447 M448 L451 P456 T459 E464 A465	A184-F462 HydrophobicContact CB-CB 4.31Å; A184-F462 HydrophobicContact CB-CD2 4.33Å; L444-F462 HydrophobicContact CD2-CE1 3.83Å; L444-F462 HydrophobicContact CD2-CZ 3.84Å; L447-F462 HydrophobicContact CD2-CD2 4.27Å; L447-F462 HydrophobicContact CD2-CE2 3.93Å; L447-F462 HydrophobicContact CD2-CZ 4.44Å; L447-F462 HydrophobicContact CG-CE2 4.33Å; M448-F462 HydrophobicContact CE-CE1 4.37Å; M448-F462 HydrophobicContact CE-CZ 3.71Å; M448-F462 HydrophobicContact CG-CE2 4.25Å; M448-F462 HydrophobicContact CG-CZ 4.16Å; L451-F462 HydrophobicContact CD1-CD2 3.9Å; L451-F462 HydrophobicContact CD1-CE2 3.86Å; P456-F462 HydrophobicContact CB-CD1 3.93Å; P456-F462 HydrophobicContact CB-CD2 4.15Å; P456-F462 HydrophobicContact CB-CE1 3.86Å; P456-F462 HydrophobicContact CB-CE2 4.08Å; P456-F462 HydrophobicContact CB-CG 4.08Å; P456-F462 HydrophobicContact CB-CZ 3.95Å; P456-F462 HydrophobicContact CG-CE1 4.48Å; P456-F462 HydrophobicContact CG-CE2 4.36Å; P456-F462 HydrophobicContact CG-CZ 4.18Å; T459-F462 PolarHBondContact O-N 3.08Å; F462-E464 VanDerWaalsContact C-N 3.34Å; F462-A465 WeakPolarHBondContact O-CB 3.35Å
463	Q	86.8	Confident	86.7	Confident	82 Å²	82	38.3 Å²	38.3	38%	0.383	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-33.7	176.8	-66.1	-178.5	-12.8	0	0	111.9	M426 P466	M426-Q463 WeakPolarHBondContact CB-O 3.38Å; M426-Q463 HydrophobicContact SD-CB 4.46Å; Q463-P466 VanDerWaalsContact O-CD 3.26Å; Q463-P466 WeakPolarHBondContact O-CD 3.21Å
464	E	91.3	Very high	88.2	Confident	17 Å²	17	35.1 Å²	35.1	8%	0.079	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.7	-11.9	-177.4	-54.3	92.4	139	0	0	113	W179 M426 G461 F462 P466 L467 A468	W179-E464 HydrophobicContact CZ2-CB 4.07Å; W179-E464 HydrophobicContact CZ2-CG 3.84Å; W179-E464 WeakPolarHBondContact CZ2-OE1 3.31Å; W179-E464 PolarHBondContact NE1-OE1 2.67Å; M426-E464 HydrophobicContact CE-CG 4.33Å; M426-E464 HydrophobicContact SD-CB 4.37Å; M426-E464 HydrophobicContact SD-CG 3.81Å; G461-E464 WeakPolarHBondContact CA-OE2 3.02Å; G461-E464 PolarHBondContact O-N 3.23Å; F462-E464 VanDerWaalsContact C-N 3.34Å; E464-P466 VanDerWaalsContact C-N 3.35Å; E464-L467 HydrophobicContact CB-CD1 4.24Å; E464-L467 WeakPolarHBondContact O-CA 3.38Å; E464-L467 VanDerWaalsContact O-CB 3.23Å; E464-L467 WeakPolarHBondContact O-CB 3.42Å; E464-L467 PolarHBondContact O-N 3.17Å; E464-A468 PolarHBondContact O-N 2.92Å
465	A	94.1	Very high	89.2	Confident	0 Å²	0	28.8 Å²	28.8	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-54.4	-36.5	-179.8	0	0	0	0	0	115	A184 S188 F443 L447 G461 F462 L467 A468 F469	A184-A465 HydrophobicContact CB-CB 4.08Å; S188-A465 WeakPolarHBondContact CB-O 3.27Å; S188-A465 PolarHBondContact OG-O 3.13Å; F443-A465 HydrophobicContact CZ-CB 4.43Å; L447-A465 HydrophobicContact CD2-CB 3.56Å; G461-A465 PolarHBondContact O-N 3.48Å; F462-A465 WeakPolarHBondContact O-CB 3.35Å; A465-L467 VanDerWaalsContact C-N 3.28Å; A465-L467 PolarHBondContact O-N 2.77Å; A465-A468 PolarHBondContact O-N 2.87Å; A465-F469 PolarHBondContact O-N 3.39Å; A465-F469 VanDerWaalsContact O-N 3.15Å
466	P	95	Very high	90.1	Very high	2 Å²	2	24.6 Å²	24.6	1%	0.013	13%	0.125	C	C	.	.	H	α-helix	trans	-60.8	-33.2	170.9	-23.5	34.9	0	0	0	113.5	M426 L427 F443 Q463 E464 A468 F469 D470 V519	M426-P466 WeakPolarHBondContact O-CB 3.39Å; L427-P466 HydrophobicContact CD1-CB 4.45Å; L427-P466 HydrophobicContact CD1-CG 3.86Å; F443-P466 HydrophobicContact CE1-CB 4.4Å; F443-P466 HydrophobicContact CE1-CG 3.81Å; F443-P466 HydrophobicContact CZ-CG 4.28Å; Q463-P466 VanDerWaalsContact O-CD 3.26Å; Q463-P466 WeakPolarHBondContact O-CD 3.21Å; E464-P466 VanDerWaalsContact C-N 3.35Å; P466-A468 VanDerWaalsContact C-N 3.33Å; P466-A468 PolarHBondContact O-N 3.42Å; P466-F469 WeakPolarHBondContact O-CB 3.43Å; P466-F469 PolarHBondContact O-N 2.95Å; P466-D470 WeakPolarHBondContact O-CB 3.38Å; P466-D470 PolarHBondContact O-N 3.13Å; P466-V519 HydrophobicContact CB-CG1 4.08Å
467	L	95.4	Very high	91	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-69.6	-33.1	180	-50.3	174.7	0	0	0	111.4	Y264 T283 H284 M426 E464 A465 A471	Y264-L467 WeakPolarHBondContact O-CB 3.22Å; T283-L467 WeakPolarHBondContact CB-O 3.42Å; T283-L467 PolarHBondContact OG1-O 2.8Å; H284-L467 HydrophobicContact CB-CD1 4.14Å; M426-L467 HydrophobicContact CB-CD2 4.41Å; M426-L467 HydrophobicContact CB-CG 4.49Å; M426-L467 HydrophobicContact CG-CD1 4.23Å; M426-L467 HydrophobicContact SD-CD1 3.67Å; M426-L467 HydrophobicContact SD-CG 4.45Å; E464-L467 HydrophobicContact CB-CD1 4.24Å; E464-L467 WeakPolarHBondContact O-CA 3.38Å; E464-L467 VanDerWaalsContact O-CB 3.23Å; E464-L467 WeakPolarHBondContact O-CB 3.42Å; E464-L467 PolarHBondContact O-N 3.17Å; A465-L467 VanDerWaalsContact C-N 3.28Å; A465-L467 PolarHBondContact O-N 2.77Å; L467-A471 VanDerWaalsContact O-CB 3.27Å; L467-A471 WeakPolarHBondContact O-CB 3.28Å; L467-A471 PolarHBondContact O-N 2.83Å
468	A	96.7	Very high	92.2	Very high	0 Å²	0	16.2 Å²	16.2	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-71.4	-37.8	172.4	0	0	0	0	0	112.5	C185 Y264 E464 A465 P466 V472	C185-A468 HydrophobicContact CB-CB 3.84Å; Y264-A468 HydrophobicContact CD2-CB 3.86Å; Y264-A468 HydrophobicContact CG-CB 4.02Å; E464-A468 PolarHBondContact O-N 2.92Å; A465-A468 PolarHBondContact O-N 2.87Å; P466-A468 VanDerWaalsContact C-N 3.33Å; P466-A468 PolarHBondContact O-N 3.42Å; A468-V472 PolarHBondContact O-N 3Å
469	F	96.8	Very high	93.2	Very high	0 Å²	0	9.3 Å²	9.3	0%	0	5%	0.05	C	C	.	.	H	α-helix	trans	-62.4	-53.5	173.4	-172.8	-93.5	0	0	0	111	M191 A192 L195 F443 A465 P466 A471 V472 W473 V519	M191-F469 HydrophobicContact CE-CD2 4.15Å; M191-F469 HydrophobicContact CE-CE2 4.08Å; M191-F469 HydrophobicContact CG-CE2 4.33Å; A192-F469 HydrophobicContact CB-CD2 3.6Å; A192-F469 HydrophobicContact CB-CE2 3.93Å; A192-F469 HydrophobicContact CB-CG 4.03Å; L195-F469 HydrophobicContact CD1-CE2 3.81Å; L195-F469 HydrophobicContact CD1-CZ 3.73Å; F443-F469 HydrophobicContact CD2-CD1 4.49Å; F443-F469 AromaticContact CD2-CD2 3.94Å; F443-F469 HydrophobicContact CD2-CD2 3.94Å; F443-F469 HydrophobicContact CD2-CE2 4.13Å; F443-F469 HydrophobicContact CD2-CG 4.13Å; F443-F469 HydrophobicContact CD2-CZ 4.48Å; F443-F469 HydrophobicContact CE2-CB 3.79Å; F443-F469 HydrophobicContact CE2-CD1 4.43Å; F443-F469 AromaticContact CE2-CD2 3.59Å; F443-F469 HydrophobicContact CE2-CD2 3.59Å; F443-F469 HydrophobicContact CE2-CE2 4.24Å; F443-F469 AromaticContact CE2-CG 3.71Å; F443-F469 HydrophobicContact CE2-CG 3.71Å; F443-F469 HydrophobicContact CZ-CB 4.37Å; A465-F469 PolarHBondContact O-N 3.39Å; A465-F469 VanDerWaalsContact O-N 3.15Å; P466-F469 WeakPolarHBondContact O-CB 3.43Å; P466-F469 PolarHBondContact O-N 2.95Å; F469-A471 VanDerWaalsContact C-N 3.28Å; F469-A471 PolarHBondContact O-N 2.78Å; F469-V472 PolarHBondContact O-N 3.33Å; F469-W473 AromaticContact CD1-CD1 3.59Å; F469-W473 AromaticContact CD1-NE1 3.79Å; F469-W473 AromaticContact CE1-CD1 3.41Å; F469-W473 VanDerWaalsContact CE1-CD1 3.41Å; F469-W473 AromaticContact CE1-NE1 3.15Å; F469-W473 AromaticContact CZ-NE1 3.32Å; F469-W473 VanDerWaalsContact CZ-NE1 3.32Å; F469-W473 PolarHBondContact O-N 3.06Å; F469-V519 HydrophobicContact CD1-CB 4.22Å; F469-V519 HydrophobicContact CD1-CG2 3.61Å; F469-V519 HydrophobicContact CE1-CG2 3.48Å; F469-V519 VanDerWaalsContact CE1-CG2 3.48Å; F469-V519 HydrophobicContact CZ-CG2 4.35Å
470	D	96.5	Very high	93.7	Very high	0 Å²	0	11.6 Å²	11.6	0%	0	6%	0.062	C	C	.	.	H	α-helix	trans	-69.6	-23.1	-178	-70.6	-24.3	0	0	0	112.9	P466 W473 A474 G518 V519 S520 V523	P466-D470 WeakPolarHBondContact O-CB 3.38Å; P466-D470 PolarHBondContact O-N 3.13Å; D470-W473 PolarHBondContact O-N 2.96Å; D470-A474 VanDerWaalsContact O-CB 3.31Å; D470-A474 WeakPolarHBondContact O-CB 3.49Å; D470-A474 PolarHBondContact O-N 3.24Å; D470-G518 WeakPolarHBondContact OD1-CA 3.11Å; D470-G518 WeakPolarHBondContact OD2-CA 3.43Å; D470-V519 PolarHBondContact OD1-N 3.2Å; D470-V519 PolarHBondContact OD2-N 2.88Å; D470-S520 WeakPolarHBondContact OD2-CB 3.37Å; D470-S520 PolarHBondContact OD2-N 3.35Å; D470-S520 PolarHBondContact OD2-OG 3.14Å; D470-V523 HydrophobicContact CB-CG2 4.14Å
471	A	96.9	Very high	94.4	Very high	0 Å²	0	15.9 Å²	15.9	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-64.7	-41.7	171.6	0	0	0	0	0	112	M240 L262 T283 L467 F469 A474 L475	M240-A471 HydrophobicContact CE-CB 3.64Å; L262-A471 HydrophobicContact CD2-CB 4.11Å; L262-A471 VanDerWaalsContact CD2-O 3.28Å; L262-A471 WeakPolarHBondContact CD2-O 3.33Å; L262-A471 HydrophobicContact CG-CB 4.24Å; T283-A471 HydrophobicContact CG2-CB 3.85Å; L467-A471 VanDerWaalsContact O-CB 3.27Å; L467-A471 WeakPolarHBondContact O-CB 3.28Å; L467-A471 PolarHBondContact O-N 2.83Å; F469-A471 VanDerWaalsContact C-N 3.28Å; F469-A471 PolarHBondContact O-N 2.78Å; A471-A474 PolarHBondContact O-N 3.27Å; A471-L475 WeakPolarHBondContact O-CB 3.09Å; A471-L475 PolarHBondContact O-N 3.24Å
472	V	97.2	Very high	94.9	Very high	1 Å²	1	15.6 Å²	15.6	1%	0.006	7%	0.074	C	C	.	.	H	α-helix	trans	-65.7	-40.8	174.9	173	0	0	0	0	110.8	A189 A192 L193 M240 A468 F469 L475 A476	A189-V472 HydrophobicContact CB-CG2 4.13Å; A192-V472 HydrophobicContact CB-CB 3.59Å; A192-V472 HydrophobicContact CB-CG1 3.66Å; A192-V472 HydrophobicContact CB-CG2 4.17Å; L193-V472 HydrophobicContact CD2-CG1 3.65Å; L193-V472 HydrophobicContact CG-CG1 3.82Å; L193-V472 HydrophobicContact CG-CG2 4.43Å; M240-V472 HydrophobicContact CE-CG2 4.3Å; A468-V472 PolarHBondContact O-N 3Å; F469-V472 PolarHBondContact O-N 3.33Å; V472-L475 PolarHBondContact O-N 3.47Å; V472-A476 WeakPolarHBondContact O-CB 3.37Å; V472-A476 PolarHBondContact O-N 3.07Å
473	W	96.9	Very high	95.1	Very high	1 Å²	1	16 Å²	16	0%	0.004	8%	0.079	C	C	.	.	H	α-helix	trans	-64.9	-44.2	174.7	-78.7	98.7	0	0	0	112.8	L195 V196 I202 V435 F469 D470 L475 A476 L477 F516	L195-W473 HydrophobicContact CB-CZ2 3.89Å; V196-W473 HydrophobicContact CG2-CD2 3.9Å; V196-W473 HydrophobicContact CG2-CE3 3.9Å; V196-W473 HydrophobicContact CG2-CH2 3.96Å; V196-W473 HydrophobicContact CG2-CZ2 3.96Å; V196-W473 HydrophobicContact CG2-CZ3 3.93Å; I202-W473 HydrophobicContact CG1-CZ3 4.4Å; V435-W473 HydrophobicContact CG1-CB 4.25Å; V435-W473 HydrophobicContact CG1-CD2 3.86Å; V435-W473 HydrophobicContact CG1-CE3 3.73Å; V435-W473 HydrophobicContact CG1-CG 4.09Å; V435-W473 HydrophobicContact CG1-CZ3 4.4Å; V435-W473 HydrophobicContact CG2-CE3 4.15Å; V435-W473 HydrophobicContact CG2-CZ3 4.24Å; F469-W473 AromaticContact CD1-CD1 3.59Å; F469-W473 AromaticContact CD1-NE1 3.79Å; F469-W473 AromaticContact CE1-CD1 3.41Å; F469-W473 VanDerWaalsContact CE1-CD1 3.41Å; F469-W473 AromaticContact CE1-NE1 3.15Å; F469-W473 AromaticContact CZ-NE1 3.32Å; F469-W473 VanDerWaalsContact CZ-NE1 3.32Å; F469-W473 PolarHBondContact O-N 3.06Å; D470-W473 PolarHBondContact O-N 2.96Å; W473-L475 VanDerWaalsContact C-N 3.29Å; W473-L475 PolarHBondContact O-N 2.84Å; W473-A476 PolarHBondContact O-N 2.74Å; W473-L477 WeakPolarHBondContact O-CB 3.47Å; W473-L477 WeakPolarHBondContact O-CG 3.38Å; W473-L477 PolarHBondContact O-N 2.67Å; W473-F516 HydrophobicContact CB-CE2 4Å; W473-F516 HydrophobicContact CB-CZ 4.17Å
474	A	96.5	Very high	95.2	Very high	0 Å²	0	15.4 Å²	15.4	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-57.6	-43.7	175.4	0	0	0	0	0	111.4	D470 A471 A478 F516 F525	D470-A474 VanDerWaalsContact O-CB 3.31Å; D470-A474 WeakPolarHBondContact O-CB 3.49Å; D470-A474 PolarHBondContact O-N 3.24Å; A471-A474 PolarHBondContact O-N 3.27Å; A474-A478 VanDerWaalsContact O-CB 3.23Å; A474-A478 WeakPolarHBondContact O-CB 3.49Å; A474-A478 PolarHBondContact O-N 3.46Å; A474-F516 HydrophobicContact CB-CE1 3.75Å; A474-F516 HydrophobicContact CB-CZ 3.88Å; A474-F525 HydrophobicContact CB-CE2 4.26Å; A474-F525 HydrophobicContact CB-CZ 4.09Å
475	L	96.7	Very high	95.2	Very high	1 Å²	1	17 Å²	17	1%	0.005	10%	0.1	C	C	.	.	H	α-helix	trans	-64.3	-48	175.4	178	56.4	0	0	0	112.3	I169 V238 L262 A471 V472 W473 L477 A478 L479	I169-L475 HydrophobicContact CD1-CD2 3.62Å; I169-L475 HydrophobicContact CG1-CD2 3.98Å; V238-L475 HydrophobicContact CB-CD1 4.34Å; V238-L475 HydrophobicContact CB-CD2 4.13Å; V238-L475 HydrophobicContact CG1-CD2 4.21Å; V238-L475 HydrophobicContact CG2-CD1 3.63Å; V238-L475 HydrophobicContact CG2-CD2 4.3Å; L262-L475 HydrophobicContact CD2-CB 4.09Å; A471-L475 WeakPolarHBondContact O-CB 3.09Å; A471-L475 PolarHBondContact O-N 3.24Å; V472-L475 PolarHBondContact O-N 3.47Å; W473-L475 VanDerWaalsContact C-N 3.29Å; W473-L475 PolarHBondContact O-N 2.84Å; L475-L477 PolarHBondContact O-N 3.15Å; L475-A478 PolarHBondContact O-N 3.4Å; L475-L479 HydrophobicContact CD1-CD1 3.9Å; L475-L479 HydrophobicContact CD1-CG 3.95Å; L475-L479 HydrophobicContact CG-CD1 4Å; L475-L479 HydrophobicContact CG-CG 4.45Å; L475-L479 WeakPolarHBondContact O-CB 3.37Å; L475-L479 WeakPolarHBondContact O-CG 3.29Å; L475-L479 PolarHBondContact O-N 2.99Å
476	A	96.5	Very high	95.1	Very high	0 Å²	0	17 Å²	17	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-62.4	-43.1	-179.8	0	0	0	0	0	112.5	V196 I202 L208 V472 W473 L479 N480	V196-A476 HydrophobicContact CB-CB 4.44Å; V196-A476 HydrophobicContact CG1-CB 3.61Å; V196-A476 HydrophobicContact CG2-CB 3.92Å; I202-A476 HydrophobicContact CG2-CB 3.97Å; L208-A476 HydrophobicContact CD1-CB 4.14Å; V472-A476 WeakPolarHBondContact O-CB 3.37Å; V472-A476 PolarHBondContact O-N 3.07Å; W473-A476 PolarHBondContact O-N 2.74Å; A476-L479 PolarHBondContact O-N 2.8Å; A476-N480 WeakPolarHBondContact O-CB 3.4Å; A476-N480 PolarHBondContact O-N 2.72Å
477	L	96.1	Very high	94.8	Very high	30 Å²	30	24.6 Å²	24.6	16%	0.157	13%	0.133	C	C	.	.	H	α-helix	trans	-66.8	-38.2	176.1	-67.1	169	0	0	0	111.9	I202 V435 W473 L475 K481 F516	I202-L477 HydrophobicContact CD1-CD2 4.15Å; V435-L477 HydrophobicContact CG1-CD1 4.41Å; V435-L477 HydrophobicContact CG2-CD1 4.17Å; V435-L477 HydrophobicContact CG2-CD2 4.24Å; W473-L477 WeakPolarHBondContact O-CB 3.47Å; W473-L477 WeakPolarHBondContact O-CG 3.38Å; W473-L477 PolarHBondContact O-N 2.67Å; L475-L477 PolarHBondContact O-N 3.15Å; L477-K481 WeakPolarHBondContact O-CG 3.49Å; L477-K481 PolarHBondContact O-N 2.73Å; L477-K481 VanDerWaalsContact O-N 3.12Å; L477-F516 HydrophobicContact CD1-CB 4.12Å; L477-F516 HydrophobicContact CD1-CD1 3.75Å; L477-F516 HydrophobicContact CD1-CD2 4.02Å; L477-F516 HydrophobicContact CD1-CE1 4.13Å; L477-F516 HydrophobicContact CD1-CE2 4.37Å; L477-F516 HydrophobicContact CD1-CG 3.69Å; L477-F516 HydrophobicContact CD1-CZ 4.42Å
478	A	96	Very high	94.6	Very high	0 Å²	0	29 Å²	29	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-66.6	-45.9	174.1	0	0	0	0	0	111.7	A474 L475 N480 K481 T482 A510 L511	A474-A478 VanDerWaalsContact O-CB 3.23Å; A474-A478 WeakPolarHBondContact O-CB 3.49Å; A474-A478 PolarHBondContact O-N 3.46Å; L475-A478 PolarHBondContact O-N 3.4Å; A478-N480 PolarHBondContact O-N 3.47Å; A478-K481 WeakPolarHBondContact O-CB 3.35Å; A478-K481 PolarHBondContact O-N 2.93Å; A478-T482 WeakPolarHBondContact O-CG2 3.44Å; A478-T482 PolarHBondContact O-N 2.86Å; A478-A510 HydrophobicContact CB-CB 3.88Å; A478-A510 WeakPolarHBondContact O-CB 3.47Å; A478-L511 HydrophobicContact CB-CD2 3.64Å; A478-L511 HydrophobicContact CB-CG 3.71Å
479	L	95.3	Very high	94.2	Very high	0 Å²	0	34 Å²	34	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-59	-45.9	176.8	-72.4	172.1	0	0	0	111.3	L203 L208 I237 L475 A476 K481 T482 V483 L493 I507	L203-L479 HydrophobicContact CD2-CB 4.39Å; L208-L479 HydrophobicContact CD2-CD1 3.89Å; I237-L479 HydrophobicContact CD1-CD2 3.95Å; L475-L479 HydrophobicContact CD1-CD1 3.9Å; L475-L479 HydrophobicContact CD1-CG 3.95Å; L475-L479 HydrophobicContact CG-CD1 4Å; L475-L479 HydrophobicContact CG-CG 4.45Å; L475-L479 WeakPolarHBondContact O-CB 3.37Å; L475-L479 WeakPolarHBondContact O-CG 3.29Å; L475-L479 PolarHBondContact O-N 2.99Å; A476-L479 PolarHBondContact O-N 2.8Å; L479-K481 PolarHBondContact O-N 2.8Å; L479-T482 PolarHBondContact O-N 3.16Å; L479-T482 PolarHBondContact O-OG1 3.39Å; L479-V483 PolarHBondContact O-N 3.11Å; L479-L493 HydrophobicContact CB-CD1 4.43Å; L479-L493 HydrophobicContact CD2-CD1 4.23Å; L479-L493 HydrophobicContact CD2-CD2 4.01Å; L479-I507 HydrophobicContact CD2-CD1 4.03Å; L479-I507 HydrophobicContact CD2-CG1 4.2Å
480	N	94.9	Very high	93.7	Very high	59 Å²	59	37.2 Å²	37.2	32%	0.316	22%	0.224	S	C	.	.	H	α-helix	trans	-52.9	-52.1	172.9	-171.8	-4.5	0	0	0	111.5	D201 I202 A476 A478 T482 V483	D201-N480 PolarHBondContact O-ND2 2.84Å; I202-N480 VanDerWaalsContact O-CB 3.26Å; I202-N480 WeakPolarHBondContact O-CB 3.35Å; I202-N480 PolarHBondContact O-ND2 3.05Å; I202-N480 VanDerWaalsContact O-ND2 3.11Å; A476-N480 WeakPolarHBondContact O-CB 3.4Å; A476-N480 PolarHBondContact O-N 2.72Å; A478-N480 PolarHBondContact O-N 3.47Å; N480-T482 PolarHBondContact O-N 3.25Å; N480-T482 VanDerWaalsContact O-N 3.13Å; N480-V483 PolarHBondContact O-N 2.74Å; N480-V483 VanDerWaalsContact O-N 3.09Å
481	K	94.1	Very high	93.3	Very high	102 Å²	102	41.3 Å²	41.3	44%	0.443	24%	0.24	S	C	.	.	H	α-helix	trans	-56.4	-28.8	176.1	-74.9	-179.8	179.9	-172	0	113.9	L477 A478 L479 P485 A510 T513	L477-K481 WeakPolarHBondContact O-CG 3.49Å; L477-K481 PolarHBondContact O-N 2.73Å; L477-K481 VanDerWaalsContact O-N 3.12Å; A478-K481 WeakPolarHBondContact O-CB 3.35Å; A478-K481 PolarHBondContact O-N 2.93Å; L479-K481 PolarHBondContact O-N 2.8Å; K481-P485 WeakPolarHBondContact O-CD 3.4Å; K481-A510 HydrophobicContact CB-CB 4.01Å; K481-T513 PolarHBondContact NZ-O 3.28Å
482	T	94.8	Very high	92.8	Very high	1 Å²	1	47.4 Å²	47.4	1%	0.006	26%	0.263	C	S	.	.	H	α-helix	trans	-79.2	-21.2	177.7	63.6	0	0	0	0	115.2	A478 L479 N480 A484 P485 L486 E506 I507 A510	A478-T482 WeakPolarHBondContact O-CG2 3.44Å; A478-T482 PolarHBondContact O-N 2.86Å; L479-T482 PolarHBondContact O-N 3.16Å; L479-T482 PolarHBondContact O-OG1 3.39Å; N480-T482 PolarHBondContact O-N 3.25Å; N480-T482 VanDerWaalsContact O-N 3.13Å; T482-A484 PolarHBondContact O-N 3.35Å; T482-P485 WeakPolarHBondContact O-CD 3.09Å; T482-L486 WeakPolarHBondContact O-CB 3.32Å; T482-L486 VanDerWaalsContact O-CG 3.29Å; T482-L486 WeakPolarHBondContact O-CG 3.47Å; T482-L486 PolarHBondContact O-N 2.84Å; T482-E506 VanDerWaalsContact CG2-C 3.5Å; T482-E506 HydrophobicContact CG2-CB 4Å; T482-E506 WeakPolarHBondContact CG2-O 3.37Å; T482-I507 HydrophobicContact CG2-CB 4.42Å; T482-I507 HydrophobicContact CG2-CG1 3.95Å; T482-A510 HydrophobicContact CG2-CB 3.71Å
483	V	91.9	Very high	92.5	Very high	39 Å²	39	47.5 Å²	47.5	24%	0.236	26%	0.263	C	S	.	.	H	α-helix	trans	-60	-44.5	-172.6	179	0	0	0	0	111.7	Y206 L479 N480 K487 L493	Y206-V483 HydrophobicContact CE2-CG2 4.31Å; L479-V483 PolarHBondContact O-N 3.11Å; N480-V483 PolarHBondContact O-N 2.74Å; N480-V483 VanDerWaalsContact O-N 3.09Å; V483-K487 WeakPolarHBondContact O-CB 3.24Å; V483-K487 PolarHBondContact O-N 2.83Å; V483-L493 HydrophobicContact CG2-CD1 4.08Å
484	A	89.9	Confident	91.9	Very high	71 Å²	71	50.4 Å²	50.4	59%	0.587	28%	0.277	S	S	*	.	H	α-helix	trans	-69.9	-48.7	-180	0	0	0	0	0	113.5	T482 L486 K487 A488	T482-A484 PolarHBondContact O-N 3.35Å; A484-L486 PolarHBondContact O-N 3.28Å; A484-K487 PolarHBondContact O-N 2.86Å; A484-A488 PolarHBondContact O-N 3.24Å
485	P	91.8	Very high	91.4	Very high	49 Å²	49	53.9 Å²	53.9	32%	0.318	30%	0.295	S	S	.	.	H	α-helix	trans	-55.8	-41.7	171.6	-28.7	35.2	0	0	0	114.5	K481 T482 A488 K489	K481-P485 WeakPolarHBondContact O-CD 3.4Å; T482-P485 WeakPolarHBondContact O-CD 3.09Å; P485-A488 PolarHBondContact O-N 3.2Å; P485-K489 PolarHBondContact O-N 3.23Å
486	L	90.9	Very high	91.1	Very high	2 Å²	2	54.6 Å²	54.6	1%	0.01	30%	0.298	C	S	.	.	H	α-helix	trans	-68.1	-44.1	178.4	-69.7	174.2	0	0	0	111.6	T482 A484 A488 K489 G490 R491 L493 I503 E506	T482-L486 WeakPolarHBondContact O-CB 3.32Å; T482-L486 VanDerWaalsContact O-CG 3.29Å; T482-L486 WeakPolarHBondContact O-CG 3.47Å; T482-L486 PolarHBondContact O-N 2.84Å; A484-L486 PolarHBondContact O-N 3.28Å; L486-A488 VanDerWaalsContact C-N 3.27Å; L486-A488 PolarHBondContact O-N 3.36Å; L486-K489 CarbonylContact O-C 3.59Å; L486-K489 WeakPolarHBondContact O-CA 3.38Å; L486-K489 PolarHBondContact O-N 3.01Å; L486-G490 PolarHBondContact O-N 3.01Å; L486-G490 VanDerWaalsContact O-N 3.17Å; L486-R491 CarbonylContact C-O 3.58Å; L486-R491 PolarHBondContact O-N 3.07Å; L486-L493 HydrophobicContact CD1-CD2 3.58Å; L486-L493 HydrophobicContact CD1-CG 4.19Å; L486-I503 HydrophobicContact CD1-CG2 4.31Å; L486-I503 HydrophobicContact CD2-CG1 4.02Å; L486-E506 HydrophobicContact CD2-CB 4.19Å; L486-E506 HydrophobicContact CD2-CG 3.86Å; L486-E506 HydrophobicContact CG-CB 4.46Å; L486-E506 HydrophobicContact CG-CG 4.44Å
487	K	89.2	Confident	90.7	Very high	161 Å²	161	57.5 Å²	57.5	70%	0.7	31%	0.314	S	S	*	.	H	α-helix	trans	-60	-36.7	175.8	-172.8	175	-178.2	177.2	0	112	V483 A484 K489 G490 R491	V483-K487 WeakPolarHBondContact O-CB 3.24Å; V483-K487 PolarHBondContact O-N 2.83Å; A484-K487 PolarHBondContact O-N 2.86Å; K487-K489 VanDerWaalsContact C-N 3.29Å; K487-K489 PolarHBondContact O-N 3.4Å; K487-G490 PolarHBondContact O-N 3.11Å; K487-G490 VanDerWaalsContact O-N 3.08Å; K487-R491 PolarHBondContact N-O 3.33Å
488	A	90.7	Very high	90.5	Very high	91 Å²	91	57.6 Å²	57.6	75%	0.752	31%	0.312	S	S	*	.	H	α-helix	trans	-66.6	-27.3	173.4	0	0	0	0	0	113.5	A484 P485 L486 G490	A484-A488 PolarHBondContact O-N 3.24Å; P485-A488 PolarHBondContact O-N 3.2Å; L486-A488 VanDerWaalsContact C-N 3.27Å; L486-A488 PolarHBondContact O-N 3.36Å; A488-G490 VanDerWaalsContact C-N 3.32Å
489	K	88.6	Confident	90.1	Very high	105 Å²	105	64.5 Å²	64.5	46%	0.457	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.6	6.6	170.4	-62	-176.5	-169.2	-179.7	0	113.6	P485 L486 K487 R491 E506	P485-K489 PolarHBondContact O-N 3.23Å; L486-K489 CarbonylContact O-C 3.59Å; L486-K489 WeakPolarHBondContact O-CA 3.38Å; L486-K489 PolarHBondContact O-N 3.01Å; K487-K489 VanDerWaalsContact C-N 3.29Å; K487-K489 PolarHBondContact O-N 3.4Å; K489-R491 VanDerWaalsContact C-N 3.32Å; K489-R491 PolarHBondContact O-N 3.28Å; K489-E506 WeakPolarHBondContact CE-OE1 3.31Å; K489-E506 IonicContact NZ-OE1 3.57Å; K489-E506 PolarHBondContact NZ-OE1 3.23Å
490	G	86.9	Confident	89.5	Confident	69 Å²	69	65.4 Å²	65.4	71%	0.711	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.8	20.6	-178.5	0	0	0	0	0	115.1	L486 K487 A488	L486-G490 PolarHBondContact O-N 3.01Å; L486-G490 VanDerWaalsContact O-N 3.17Å; K487-G490 PolarHBondContact O-N 3.11Å; K487-G490 VanDerWaalsContact O-N 3.08Å; A488-G490 VanDerWaalsContact C-N 3.32Å
491	R	87	Confident	89.2	Confident	85 Å²	85	67.9 Å²	67.9	32%	0.321	36%	0.364	S	S	.	.			trans	-121.6	166.3	178.4	-57.9	-166.4	-166.5	168.6	13.1	112	L486 K487 K489 D495 N500 D502	L486-R491 CarbonylContact C-O 3.58Å; L486-R491 PolarHBondContact O-N 3.07Å; K487-R491 PolarHBondContact N-O 3.33Å; K489-R491 VanDerWaalsContact C-N 3.32Å; K489-R491 PolarHBondContact O-N 3.28Å; R491-D495 WeakPolarHBondContact CA-OD2 3.44Å; R491-N500 PolarHBondContact NH1-OD1 3.29Å; R491-D502 IonicContact CZ-OD2 2.63Å; R491-D502 IonicContact NH1-OD2 2.68Å; R491-D502 PolarHBondContact NH1-OD2 2.8Å; R491-D502 IonicContact NH2-OD2 2.7Å; R491-D502 PolarHBondContact NH2-OD2 3.37Å
492	R	88	Confident	89	Confident	129 Å²	129	66.1 Å²	66.1	49%	0.487	36%	0.359	S	S	.	.			trans	-131.9	179	179.2	-52.3	-179.2	167.7	-115.9	0.9	111.2	E494 D495	R492-E494 HydrophobicContact CB-CG 4.42Å; R492-E494 WeakPolarHBondContact CB-OE2 3.41Å; R492-E494 WeakPolarHBondContact CD-OE1 3.47Å; R492-D495 PolarHBondContact N-OD2 3.42Å
493	L	88.9	Confident	88.9	Confident	2 Å²	2	66 Å²	66	1%	0.01	36%	0.359	C	S	.	.	S	Bend	trans	-79.6	-27.7	-179.6	-70.1	171.3	0	0	0	112.3	L167 Y206 I237 L479 V483 L486 D495 F496 I503	L167-L493 HydrophobicContact CD1-CB 4.05Å; L167-L493 HydrophobicContact CD1-CD1 3.97Å; L167-L493 HydrophobicContact CD2-CB 4.18Å; Y206-L493 HydrophobicContact CD2-CD1 4.43Å; Y206-L493 HydrophobicContact CE1-CB 3.88Å; Y206-L493 HydrophobicContact CE2-CD1 4.09Å; I237-L493 HydrophobicContact CD1-CD2 4.16Å; L479-L493 HydrophobicContact CB-CD1 4.43Å; L479-L493 HydrophobicContact CD2-CD1 4.23Å; L479-L493 HydrophobicContact CD2-CD2 4.01Å; V483-L493 HydrophobicContact CG2-CD1 4.08Å; L486-L493 HydrophobicContact CD1-CD2 3.58Å; L486-L493 HydrophobicContact CD1-CG 4.19Å; L493-D495 PolarHBondContact O-N 3.44Å; L493-F496 WeakPolarHBondContact O-CB 3.15Å; L493-F496 PolarHBondContact O-N 3.14Å; L493-I503 HydrophobicContact CD2-CG2 4.42Å
494	E	85.1	Confident	89	Confident	63 Å²	63	64.4 Å²	64.4	29%	0.294	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-14	173	68.1	-91.4	-139.5	0	0	113.9	K165 Y206 R492 F496	K165-E494 HydrophobicContact CD-CB 4.41Å; K165-E494 HydrophobicContact CD-CG 4.2Å; K165-E494 WeakPolarHBondContact CD-OE1 3.38Å; K165-E494 WeakPolarHBondContact CE-OE1 3.3Å; K165-E494 IonicContact NZ-OE1 3.65Å; K165-E494 PolarHBondContact NZ-OE1 3.01Å; Y206-E494 WeakPolarHBondContact CE1-OE2 3.39Å; Y206-E494 PolarHBondContact OH-OE2 3.01Å; Y206-E494 VanDerWaalsContact OH-OE2 3.12Å; R492-E494 HydrophobicContact CB-CG 4.42Å; R492-E494 WeakPolarHBondContact CB-OE2 3.41Å; R492-E494 WeakPolarHBondContact CD-OE1 3.47Å; E494-F496 PolarHBondContact O-N 2.67Å
495	D	86.4	Confident	89.1	Confident	73 Å²	73	62.3 Å²	62.3	39%	0.39	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80	6.1	175.1	-53.2	-34.8	0	0	0	112.6	R491 R492 L493 N497 N500 I503	R491-D495 WeakPolarHBondContact CA-OD2 3.44Å; R492-D495 PolarHBondContact N-OD2 3.42Å; L493-D495 PolarHBondContact O-N 3.44Å; D495-N497 PolarHBondContact O-ND2 3.24Å; D495-N500 PolarHBondContact O-ND2 2.87Å; D495-I503 HydrophobicContact CB-CD1 4.34Å
496	F	89.8	Confident	89.2	Confident	15 Å²	15	60.5 Å²	60.5	7%	0.066	32%	0.317	C	S	.	.			trans	-71.1	131.6	-178	-180	-98.9	0	0	0	112.5	I235 K236 I237 L259 L493 E494 Y498 I503	I235-F496 HydrophobicContact CG2-CD1 3.78Å; I235-F496 HydrophobicContact CG2-CE1 3.96Å; K236-F496 WeakPolarHBondContact O-CE1 3.43Å; I237-F496 HydrophobicContact CG1-CD1 4.33Å; I237-F496 HydrophobicContact CG1-CG 4.3Å; L259-F496 HydrophobicContact CD2-CE1 4.01Å; L259-F496 HydrophobicContact CD2-CZ 3.81Å; L493-F496 WeakPolarHBondContact O-CB 3.15Å; L493-F496 PolarHBondContact O-N 3.14Å; E494-F496 PolarHBondContact O-N 2.67Å; F496-Y498 AromaticContact CE1-CD1 3.95Å; F496-Y498 HydrophobicContact CE1-CD1 3.95Å; F496-Y498 HydrophobicContact CE1-CE1 4.13Å; F496-Y498 HydrophobicContact CZ-CD1 4.24Å; F496-I503 HydrophobicContact CB-CD1 4.18Å; F496-I503 HydrophobicContact CD2-CB 4.12Å; F496-I503 HydrophobicContact CD2-CD1 4.49Å; F496-I503 HydrophobicContact CD2-CG2 3.88Å
497	N	87.8	Confident	89.4	Confident	61 Å²	61	60.5 Å²	60.5	33%	0.326	32%	0.317	S	S	.	.			trans	-146.7	156.7	170.6	65	82.9	0	0	0	109.2	D495 N499 N500	D495-N497 PolarHBondContact O-ND2 3.24Å; N497-N499 PolarHBondContact O-N 3Å; N497-N499 WeakPolarHBondContact OD1-CB 3.5Å; N497-N499 PolarHBondContact OD1-N 2.71Å; N497-N500 VanDerWaalsContact O-CB 3.31Å; N497-N500 WeakPolarHBondContact O-CB 3.42Å; N497-N500 PolarHBondContact O-N 3.09Å
498	Y	92.2	Very high	89.7	Confident	33 Å²	33	56.1 Å²	56.1	13%	0.129	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-9.2	-172.4	-55.7	-47.5	0	0	0	115.5	L230 I235 K236 W257 N258 L259 F496	L230-Y498 HydrophobicContact CD2-CE1 4.41Å; L230-Y498 WeakPolarHBondContact O-CE2 3.38Å; L230-Y498 PolarHBondContact O-OH 3.32Å; I235-Y498 HydrophobicContact CG2-CD1 4.43Å; I235-Y498 HydrophobicContact CG2-CE1 3.82Å; I235-Y498 HydrophobicContact CG2-CE2 4.47Å; K236-Y498 PolarHBondContact N-OH 3.09Å; W257-Y498 CarbonylContact C-O 3.47Å; W257-Y498 HydrophobicContact CB-CD1 4.11Å; W257-Y498 HydrophobicContact CB-CG 4.07Å; W257-Y498 AromaticContact CD1-CD2 3.79Å; W257-Y498 AromaticContact CD1-CG 3.78Å; W257-Y498 HydrophobicContact CG-CG 4.34Å; W257-Y498 CarbonylContact O-C 3.58Å; W257-Y498 VanDerWaalsContact O-CA 3.28Å; W257-Y498 WeakPolarHBondContact O-CA 3.42Å; W257-Y498 WeakPolarHBondContact O-CB 3.28Å; W257-Y498 VanDerWaalsContact O-O 3.06Å; N258-Y498 PolarHBondContact ND2-O 3.42Å; L259-Y498 HydrophobicContact CD1-CD1 4.04Å; L259-Y498 HydrophobicContact CD1-CE1 3.84Å; L259-Y498 HydrophobicContact CD2-CD1 4.25Å; L259-Y498 HydrophobicContact CD2-CE1 4.11Å; L259-Y498 HydrophobicContact CG-CD1 4.1Å; L259-Y498 HydrophobicContact CG-CE1 4.22Å; F496-Y498 AromaticContact CE1-CD1 3.95Å; F496-Y498 HydrophobicContact CE1-CD1 3.95Å; F496-Y498 HydrophobicContact CE1-CE1 4.13Å; F496-Y498 HydrophobicContact CZ-CD1 4.24Å
499	N	88.4	Confident	89.9	Confident	144 Å²	144	58 Å²	58	77%	0.77	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.2	-7.2	174.9	-55.7	-40.9	0	0	0	112.8	N497 H501	N497-N499 PolarHBondContact O-N 3Å; N497-N499 WeakPolarHBondContact OD1-CB 3.5Å; N497-N499 PolarHBondContact OD1-N 2.71Å; N499-H501 PolarHBondContact O-N 3.17Å
500	N	82.9	Confident	90.2	Very high	20 Å²	20	53.3 Å²	53.3	11%	0.107	27%	0.265	C	S	.	.			trans	-101	84.4	-165.8	-172.6	-8.6	0	0	0	112.6	R491 D495 N497 D502 I503	R491-N500 PolarHBondContact NH1-OD1 3.29Å; D495-N500 PolarHBondContact O-ND2 2.87Å; N497-N500 VanDerWaalsContact O-CB 3.31Å; N497-N500 WeakPolarHBondContact O-CB 3.42Å; N497-N500 PolarHBondContact O-N 3.09Å; N500-D502 VanDerWaalsContact C-N 3.26Å; N500-D502 PolarHBondContact O-N 3.38Å; N500-D502 PolarHBondContact OD1-N 3.19Å; N500-I503 WeakPolarHBondContact ND2-CD1 3.42Å
501	H	88.1	Confident	90.5	Very high	111 Å²	111	50.1 Å²	50.1	51%	0.514	23%	0.231	S	C	.	.	H	α-helix	trans	-60.4	-27.3	-179.9	-178.3	-93.6	0	0	0	114.5	N258 N499 I503 T504 S505	N258-H501 PolarHBondContact OD1-CD2 3.02Å; N499-H501 PolarHBondContact O-N 3.17Å; H501-I503 PolarHBondContact O-N 3.12Å; H501-T504 WeakPolarHBondContact O-CB 3.26Å; H501-T504 PolarHBondContact O-N 3.35Å; H501-S505 WeakPolarHBondContact O-CB 3.49Å; H501-S505 PolarHBondContact O-N 2.95Å
502	D	89.9	Confident	90.8	Very high	64 Å²	64	49.3 Å²	49.3	34%	0.342	23%	0.233	S	C	.	.	H	α-helix	trans	-63.3	-43.1	-172.8	-65.1	-55.2	0	0	0	112.6	R491 N500 S505 E506	R491-D502 IonicContact CZ-OD2 2.63Å; R491-D502 IonicContact NH1-OD2 2.68Å; R491-D502 PolarHBondContact NH1-OD2 2.8Å; R491-D502 IonicContact NH2-OD2 2.7Å; R491-D502 PolarHBondContact NH2-OD2 3.37Å; N500-D502 VanDerWaalsContact C-N 3.26Å; N500-D502 PolarHBondContact O-N 3.38Å; N500-D502 PolarHBondContact OD1-N 3.19Å; D502-S505 PolarHBondContact O-N 3.11Å; D502-S505 PolarHBondContact O-OG 2.7Å; D502-E506 PolarHBondContact O-N 3.29Å
503	I	92.4	Very high	91.1	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-66.3	-46.1	179.3	-65.9	171	0	0	0	109.5	L486 L493 D495 F496 N500 H501 S505 E506 I507	L486-I503 HydrophobicContact CD1-CG2 4.31Å; L486-I503 HydrophobicContact CD2-CG1 4.02Å; L493-I503 HydrophobicContact CD2-CG2 4.42Å; D495-I503 HydrophobicContact CB-CD1 4.34Å; F496-I503 HydrophobicContact CB-CD1 4.18Å; F496-I503 HydrophobicContact CD2-CB 4.12Å; F496-I503 HydrophobicContact CD2-CD1 4.49Å; F496-I503 HydrophobicContact CD2-CG2 3.88Å; N500-I503 WeakPolarHBondContact ND2-CD1 3.42Å; H501-I503 PolarHBondContact O-N 3.12Å; I503-S505 VanDerWaalsContact C-N 3.26Å; I503-S505 PolarHBondContact O-N 3.45Å; I503-E506 PolarHBondContact O-N 3Å; I503-E506 VanDerWaalsContact O-N 3.14Å; I503-I507 HydrophobicContact CG2-CD1 3.88Å; I503-I507 HydrophobicContact CG2-CG1 4.48Å; I503-I507 WeakPolarHBondContact O-CG1 3.36Å; I503-I507 PolarHBondContact O-N 3.39Å
504	T	93.4	Very high	91.2	Very high	4 Å²	4	47.3 Å²	47.3	3%	0.025	24%	0.236	C	C	.	.	H	α-helix	trans	-54.3	-41.3	173.6	-48.7	0	0	0	0	112.1	N258 I260 T279 H501 E506 I507 Y508	N258-T504 WeakPolarHBondContact O-CB 3.31Å; N258-T504 WeakPolarHBondContact O-CG2 3.44Å; N258-T504 PolarHBondContact O-OG1 2.75Å; I260-T504 HydrophobicContact CD1-CG2 3.56Å; I260-T504 HydrophobicContact CG1-CG2 4.02Å; T279-T504 HydrophobicContact CG2-CG2 4.31Å; H501-T504 WeakPolarHBondContact O-CB 3.26Å; H501-T504 PolarHBondContact O-N 3.35Å; T504-E506 VanDerWaalsContact C-N 3.35Å; T504-E506 PolarHBondContact O-N 2.94Å; T504-I507 PolarHBondContact O-N 2.87Å; T504-Y508 WeakPolarHBondContact O-CB 3.32Å; T504-Y508 PolarHBondContact O-N 2.8Å
505	S	93.1	Very high	91.6	Very high	28 Å²	28	47.6 Å²	47.6	20%	0.196	25%	0.245	C	C	.	.	H	α-helix	trans	-67.3	-32.4	-179.8	80.4	0	0	0	0	113.6	H501 D502 I503 R509	H501-S505 WeakPolarHBondContact O-CB 3.49Å; H501-S505 PolarHBondContact O-N 2.95Å; D502-S505 PolarHBondContact O-N 3.11Å; D502-S505 PolarHBondContact O-OG 2.7Å; I503-S505 VanDerWaalsContact C-N 3.26Å; I503-S505 PolarHBondContact O-N 3.45Å; S505-R509 PolarHBondContact O-N 3.39Å
506	E	94.2	Very high	91.9	Very high	11 Å²	11	45.1 Å²	45.1	5%	0.051	23%	0.231	C	C	.	.	H	α-helix	trans	-74.6	-42.6	173.7	-64.3	-55.6	138.9	0	0	111.2	T482 L486 K489 D502 I503 T504 Y508 R509 A510	T482-E506 VanDerWaalsContact CG2-C 3.5Å; T482-E506 HydrophobicContact CG2-CB 4Å; T482-E506 WeakPolarHBondContact CG2-O 3.37Å; L486-E506 HydrophobicContact CD2-CB 4.19Å; L486-E506 HydrophobicContact CD2-CG 3.86Å; L486-E506 HydrophobicContact CG-CB 4.46Å; L486-E506 HydrophobicContact CG-CG 4.44Å; K489-E506 WeakPolarHBondContact CE-OE1 3.31Å; K489-E506 IonicContact NZ-OE1 3.57Å; K489-E506 PolarHBondContact NZ-OE1 3.23Å; D502-E506 PolarHBondContact O-N 3.29Å; I503-E506 PolarHBondContact O-N 3Å; I503-E506 VanDerWaalsContact O-N 3.14Å; T504-E506 VanDerWaalsContact C-N 3.35Å; T504-E506 PolarHBondContact O-N 2.94Å; E506-Y508 VanDerWaalsContact C-N 3.34Å; E506-Y508 PolarHBondContact O-N 3.08Å; E506-R509 PolarHBondContact O-N 2.85Å; E506-R509 IonicContact OE1-CZ 3.62Å; E506-R509 IonicContact OE1-NH1 3.49Å; E506-R509 PolarHBondContact OE1-NH1 3.05Å; E506-R509 IonicContact OE1-NH2 3.82Å; E506-R509 IonicContact OE2-CZ 3.8Å; E506-R509 IonicContact OE2-NH1 2.72Å; E506-R509 PolarHBondContact OE2-NH1 3.41Å; E506-A510 WeakPolarHBondContact O-CB 3.48Å; E506-A510 PolarHBondContact O-N 3.35Å
507	I	94.8	Very high	92.1	Very high	2 Å²	2	47.8 Å²	47.8	1%	0.01	24%	0.244	C	C	.	.	H	α-helix	trans	-61.8	-43.1	175.9	-61	169.5	0	0	0	110.5	I237 I260 L479 T482 I503 T504 R509 A510 L511	I237-I507 HydrophobicContact CD1-CD1 4.04Å; I237-I507 HydrophobicContact CG1-CD1 4.07Å; I260-I507 HydrophobicContact CG1-CB 4.31Å; I260-I507 HydrophobicContact CG1-CG2 3.92Å; L479-I507 HydrophobicContact CD2-CD1 4.03Å; L479-I507 HydrophobicContact CD2-CG1 4.2Å; T482-I507 HydrophobicContact CG2-CB 4.42Å; T482-I507 HydrophobicContact CG2-CG1 3.95Å; I503-I507 HydrophobicContact CG2-CD1 3.88Å; I503-I507 HydrophobicContact CG2-CG1 4.48Å; I503-I507 WeakPolarHBondContact O-CG1 3.36Å; I503-I507 PolarHBondContact O-N 3.39Å; T504-I507 PolarHBondContact O-N 2.87Å; I507-R509 PolarHBondContact O-N 2.73Å; I507-A510 PolarHBondContact O-N 3.18Å; I507-L511 HydrophobicContact CG2-CD1 4.09Å; I507-L511 PolarHBondContact O-N 3.01Å
508	Y	94.9	Very high	92.3	Very high	68 Å²	68	45.1 Å²	45.1	27%	0.267	23%	0.23	S	C	.	.	H	α-helix	trans	-56.6	-47.6	173.7	-178.3	-86	0	0	0	111.6	I260 R274 P278 F281 T504 E506 A510 L511 N512	I260-Y508 HydrophobicContact CD1-CD2 4.42Å; R274-Y508 PolarHBondContact NH2-OH 3.39Å; P278-Y508 WeakPolarHBondContact O-CE2 3.48Å; F281-Y508 AromaticContact CE2-CD2 3.46Å; F281-Y508 HydrophobicContact CE2-CD2 3.46Å; F281-Y508 VanDerWaalsContact CE2-CD2 3.46Å; F281-Y508 AromaticContact CE2-CE2 3.59Å; F281-Y508 HydrophobicContact CE2-CE2 3.59Å; F281-Y508 HydrophobicContact CE2-CG 4.24Å; F281-Y508 AromaticContact CZ-CD2 3.76Å; F281-Y508 HydrophobicContact CZ-CD2 3.76Å; F281-Y508 AromaticContact CZ-CE2 3.55Å; F281-Y508 HydrophobicContact CZ-CE2 3.55Å; F281-Y508 HydrophobicContact CZ-CG 4.33Å; F281-Y508 AromaticContact CZ-CZ 3.98Å; T504-Y508 WeakPolarHBondContact O-CB 3.32Å; T504-Y508 PolarHBondContact O-N 2.8Å; E506-Y508 VanDerWaalsContact C-N 3.34Å; E506-Y508 PolarHBondContact O-N 3.08Å; Y508-A510 PolarHBondContact O-N 2.67Å; Y508-L511 PolarHBondContact O-N 2.86Å; Y508-N512 HydrophobicContact CE1-CB 4.35Å; Y508-N512 VanDerWaalsContact O-CB 3.28Å; Y508-N512 WeakPolarHBondContact O-CB 3.43Å; Y508-N512 PolarHBondContact O-N 2.8Å
509	R	94.6	Very high	92.3	Very high	132 Å²	132	43.7 Å²	43.7	50%	0.498	23%	0.225	S	C	.	.	H	α-helix	trans	-65.4	-38	179	-167.1	-178.4	-57.8	121	9.2	112.2	S505 E506 I507 T513	S505-R509 PolarHBondContact O-N 3.39Å; E506-R509 PolarHBondContact O-N 2.85Å; E506-R509 IonicContact OE1-CZ 3.62Å; E506-R509 IonicContact OE1-NH1 3.49Å; E506-R509 PolarHBondContact OE1-NH1 3.05Å; E506-R509 IonicContact OE1-NH2 3.82Å; E506-R509 IonicContact OE2-CZ 3.8Å; E506-R509 IonicContact OE2-NH1 2.72Å; E506-R509 PolarHBondContact OE2-NH1 3.41Å; I507-R509 PolarHBondContact O-N 2.73Å; R509-T513 WeakPolarHBondContact O-CB 3.49Å; R509-T513 WeakPolarHBondContact O-CG2 3.25Å; R509-T513 PolarHBondContact O-N 2.93Å; R509-T513 VanDerWaalsContact O-N 3.12Å; R509-T513 PolarHBondContact O-OG1 3.28Å
510	A	95.1	Very high	92.4	Very high	6 Å²	6	37 Å²	37	5%	0.05	19%	0.189	C	C	.	.	H	α-helix	trans	-68.4	-38.4	178.5	0	0	0	0	0	112.8	A478 K481 T482 E506 I507 Y508 T513 S514	A478-A510 HydrophobicContact CB-CB 3.88Å; A478-A510 WeakPolarHBondContact O-CB 3.47Å; K481-A510 HydrophobicContact CB-CB 4.01Å; T482-A510 HydrophobicContact CG2-CB 3.71Å; E506-A510 WeakPolarHBondContact O-CB 3.48Å; E506-A510 PolarHBondContact O-N 3.35Å; I507-A510 PolarHBondContact O-N 3.18Å; Y508-A510 PolarHBondContact O-N 2.67Å; A510-T513 CarbonylContact O-C 3.53Å; A510-T513 PolarHBondContact O-N 3.04Å; A510-T513 PolarHBondContact O-OG1 2.95Å; A510-S514 PolarHBondContact O-N 3.4Å; A510-S514 VanDerWaalsContact O-N 3.15Å
511	L	94.3	Very high	92.7	Very high	1 Å²	1	36.3 Å²	36.3	1%	0.005	19%	0.187	C	C	.	.	H	α-helix	trans	-68.4	-47.3	171.3	-74.3	167.8	0	0	0	111.7	I260 F281 A478 I507 Y508 T513 S514 F525	I260-L511 HydrophobicContact CG2-CD1 3.68Å; F281-L511 HydrophobicContact CD2-CB 4.25Å; F281-L511 HydrophobicContact CD2-CD1 3.89Å; F281-L511 HydrophobicContact CE1-CB 4.26Å; F281-L511 HydrophobicContact CE2-CB 3.95Å; F281-L511 HydrophobicContact CE2-CD1 4.08Å; F281-L511 HydrophobicContact CZ-CB 3.96Å; A478-L511 HydrophobicContact CB-CD2 3.64Å; A478-L511 HydrophobicContact CB-CG 3.71Å; I507-L511 HydrophobicContact CG2-CD1 4.09Å; I507-L511 PolarHBondContact O-N 3.01Å; Y508-L511 PolarHBondContact O-N 2.86Å; L511-T513 PolarHBondContact O-N 3.49Å; L511-S514 WeakPolarHBondContact O-CB 3.31Å; L511-S514 PolarHBondContact O-N 3.27Å; L511-S514 PolarHBondContact O-OG 2.72Å; L511-F525 HydrophobicContact CD2-CE2 4.33Å; L511-F525 WeakPolarHBondContact O-CD2 3.07Å
512	N	93.3	Very high	92.7	Very high	68 Å²	68	35.1 Å²	35.1	36%	0.364	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-8.8	177.4	-161.6	93.7	0	0	0	113.5	F281 Y508	F281-N512 HydrophobicContact CE1-CB 4.31Å; F281-N512 HydrophobicContact CZ-CB 4.12Å; Y508-N512 HydrophobicContact CE1-CB 4.35Å; Y508-N512 VanDerWaalsContact O-CB 3.28Å; Y508-N512 WeakPolarHBondContact O-CB 3.43Å; Y508-N512 PolarHBondContact O-N 2.8Å
513	T	93	Very high	92.8	Very high	83 Å²	83	32 Å²	32	51%	0.509	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-121.1	19.9	173.3	58.2	0	0	0	0	112.3	K481 R509 A510 L511	K481-T513 PolarHBondContact NZ-O 3.28Å; R509-T513 WeakPolarHBondContact O-CB 3.49Å; R509-T513 WeakPolarHBondContact O-CG2 3.25Å; R509-T513 PolarHBondContact O-N 2.93Å; R509-T513 VanDerWaalsContact O-N 3.12Å; R509-T513 PolarHBondContact O-OG1 3.28Å; A510-T513 CarbonylContact O-C 3.53Å; A510-T513 PolarHBondContact O-N 3.04Å; A510-T513 PolarHBondContact O-OG1 2.95Å; L511-T513 PolarHBondContact O-N 3.49Å
514	S	91.6	Very high	92.7	Very high	7 Å²	7	34.2 Å²	34.2	5%	0.049	18%	0.179	C	C	.	.			trans	-83.7	129.7	170.7	72.2	0	0	0	0	111	A510 L511 F525	A510-S514 PolarHBondContact O-N 3.4Å; A510-S514 VanDerWaalsContact O-N 3.15Å; L511-S514 WeakPolarHBondContact O-CB 3.31Å; L511-S514 PolarHBondContact O-N 3.27Å; L511-S514 PolarHBondContact O-OG 2.72Å; S514-F525 WeakPolarHBondContact OG-CD2 3.48Å; S514-F525 VanDerWaalsContact OG-CE2 3.25Å; S514-F525 WeakPolarHBondContact OG-CE2 3.34Å
515	S	93.3	Very high	92.6	Very high	69 Å²	69	34.6 Å²	34.6	48%	0.483	18%	0.18	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	126.9	170.5	169.7	0	0	0	0	105.9	H522 V523	S515-H522 PolarHBondContact OG-CE1 2.96Å; S515-H522 PolarHBondContact OG-NE2 2.91Å; S515-V523 WeakPolarHBondContact CA-O 3.49Å
516	F	93.5	Very high	92.3	Very high	20 Å²	20	35.1 Å²	35.1	9%	0.088	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.8	160.3	178.1	65	-81.3	0	0	0	110.8	V435 W473 A474 L477 V523	V435-F516 HydrophobicContact CB-CD2 4.22Å; V435-F516 HydrophobicContact CG1-CD2 3.58Å; V435-F516 HydrophobicContact CG1-CE2 3.96Å; W473-F516 HydrophobicContact CB-CE2 4Å; W473-F516 HydrophobicContact CB-CZ 4.17Å; A474-F516 HydrophobicContact CB-CE1 3.75Å; A474-F516 HydrophobicContact CB-CZ 3.88Å; L477-F516 HydrophobicContact CD1-CB 4.12Å; L477-F516 HydrophobicContact CD1-CD1 3.75Å; L477-F516 HydrophobicContact CD1-CD2 4.02Å; L477-F516 HydrophobicContact CD1-CE1 4.13Å; L477-F516 HydrophobicContact CD1-CE2 4.37Å; L477-F516 HydrophobicContact CD1-CG 3.69Å; L477-F516 HydrophobicContact CD1-CZ 4.42Å; F516-V523 HydrophobicContact CD1-CB 4.13Å; F516-V523 HydrophobicContact CE1-CB 3.71Å; F516-V523 HydrophobicContact CE1-CG1 3.73Å; F516-V523 HydrophobicContact CE1-CG2 4.39Å; F516-V523 HydrophobicContact CE2-CB 4.16Å; F516-V523 HydrophobicContact CE2-CG2 3.99Å; F516-V523 HydrophobicContact CZ-CB 3.73Å; F516-V523 HydrophobicContact CZ-CG1 3.83Å; F516-V523 HydrophobicContact CZ-CG2 3.89Å; F516-V523 PolarHBondContact N-O 3.01Å; F516-V523 PolarHBondContact O-N 3.29Å
517	E	92.3	Very high	91.9	Very high	71 Å²	71	38.5 Å²	38.5	33%	0.332	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	114.2	167.3	-67.2	-52.4	141.8	0	0	110.4	G434 V435 H522	G434-E517 CarbonylContact C-O 3.59Å; G434-E517 VanDerWaalsContact CA-O 3.27Å; G434-E517 WeakPolarHBondContact CA-O 3.25Å; V435-E517 PolarHBondContact N-O 2.87Å; E517-H522 IonicContact OE1-CE1 2.75Å; E517-H522 IonicContact OE1-CG 3.53Å; E517-H522 IonicContact OE1-ND1 3.3Å; E517-H522 PolarHBondContact OE1-ND1 3.45Å; E517-H522 WeakPolarHBondContact OE2-CA 3.36Å; E517-H522 PolarHBondContact OE2-N 2.72Å; E517-H522 VanDerWaalsContact OE2-N 3.11Å
518	G	92.3	Very high	91.5	Very high	5 Å²	5	42.5 Å²	42.5	5%	0.052	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	-179.2	171.4	0	0	0	0	0	112.5	D470 S520 G521	D470-G518 WeakPolarHBondContact OD1-CA 3.11Å; D470-G518 WeakPolarHBondContact OD2-CA 3.43Å; G518-S520 PolarHBondContact O-N 2.86Å; G518-G521 WeakPolarHBondContact CA-O 3.02Å; G518-G521 PolarHBondContact N-O 3.44Å; G518-G521 PolarHBondContact O-N 2.99Å; G518-G521 VanDerWaalsContact O-N 3.14Å
519	V	92.6	Very high	90.9	Very high	3 Å²	3	39.3 Å²	39.3	2%	0.018	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-31.7	172.4	173	0	0	0	0	111	L427 N428 F443 P466 F469 D470 G521	L427-V519 HydrophobicContact CD1-CG1 3.76Å; N428-V519 PolarHBondContact N-O 2.96Å; F443-V519 HydrophobicContact CB-CG1 3.81Å; F443-V519 HydrophobicContact CB-CG2 4.25Å; F443-V519 HydrophobicContact CD1-CG1 3.59Å; F443-V519 HydrophobicContact CD2-CG1 4.01Å; F443-V519 HydrophobicContact CD2-CG2 4.17Å; F443-V519 HydrophobicContact CE1-CG1 4.17Å; F443-V519 HydrophobicContact CG-CB 4.47Å; F443-V519 HydrophobicContact CG-CG1 3.51Å; F443-V519 HydrophobicContact CG-CG2 4.26Å; P466-V519 HydrophobicContact CB-CG1 4.08Å; F469-V519 HydrophobicContact CD1-CB 4.22Å; F469-V519 HydrophobicContact CD1-CG2 3.61Å; F469-V519 HydrophobicContact CE1-CG2 3.48Å; F469-V519 VanDerWaalsContact CE1-CG2 3.48Å; F469-V519 HydrophobicContact CZ-CG2 4.35Å; D470-V519 PolarHBondContact OD1-N 3.2Å; D470-V519 PolarHBondContact OD2-N 2.88Å; V519-G521 PolarHBondContact O-N 2.87Å
520	S	90.3	Very high	90.6	Very high	3 Å²	3	33.1 Å²	33.1	2%	0.021	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.2	4.9	173.2	68.2	0	0	0	0	114.1	M426 D470 G518 R531	M426-S520 VanDerWaalsContact O-CA 3.29Å; M426-S520 WeakPolarHBondContact O-CA 3.16Å; M426-S520 WeakPolarHBondContact O-CB 3.22Å; D470-S520 WeakPolarHBondContact OD2-CB 3.37Å; D470-S520 PolarHBondContact OD2-N 3.35Å; D470-S520 PolarHBondContact OD2-OG 3.14Å; G518-S520 PolarHBondContact O-N 2.86Å; S520-R531 VanDerWaalsContact CB-NH1 3.32Å; S520-R531 PolarHBondContact O-NH1 3.29Å; S520-R531 PolarHBondContact O-NH2 2.81Å; S520-R531 VanDerWaalsContact OG-CZ 3.26Å; S520-R531 PolarHBondContact OG-NH1 2.84Å
521	G	88.9	Confident	90.2	Very high	6 Å²	6	33.3 Å²	33.3	6%	0.062	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	93.3	-158.9	-173.5	0	0	0	0	0	112.1	G518 V519 V523	G518-G521 WeakPolarHBondContact CA-O 3.02Å; G518-G521 PolarHBondContact N-O 3.44Å; G518-G521 PolarHBondContact O-N 2.99Å; G518-G521 VanDerWaalsContact O-N 3.14Å; V519-G521 PolarHBondContact O-N 2.87Å; G521-V523 WeakPolarHBondContact O-CG2 3.39Å; G521-V523 PolarHBondContact O-N 2.91Å
522	H	89.1	Confident	89.6	Confident	86 Å²	86	36.8 Å²	36.8	40%	0.398	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.7	127.8	-179	-159.5	78.6	0	0	0	111.6	S515 E517 V524 R531	S515-H522 PolarHBondContact OG-CE1 2.96Å; S515-H522 PolarHBondContact OG-NE2 2.91Å; E517-H522 IonicContact OE1-CE1 2.75Å; E517-H522 IonicContact OE1-CG 3.53Å; E517-H522 IonicContact OE1-ND1 3.3Å; E517-H522 PolarHBondContact OE1-ND1 3.45Å; E517-H522 WeakPolarHBondContact OE2-CA 3.36Å; E517-H522 PolarHBondContact OE2-N 2.72Å; E517-H522 VanDerWaalsContact OE2-N 3.11Å; H522-V524 VanDerWaalsContact CD2-CG2 3.49Å; H522-V524 WeakPolarHBondContact CD2-CG2 3.43Å; H522-V524 VanDerWaalsContact NE2-CG2 3.25Å; H522-V524 WeakPolarHBondContact NE2-CG2 3.35Å; H522-R531 PolarHBondContact O-NE 2.97Å; H522-R531 PolarHBondContact O-NH2 2.88Å
523	V	91.2	Very high	89.3	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	104	-179.7	-175.5	0	0	0	0	109.4	D470 S515 F516 G521 F525	D470-V523 HydrophobicContact CB-CG2 4.14Å; S515-V523 WeakPolarHBondContact CA-O 3.49Å; F516-V523 HydrophobicContact CD1-CB 4.13Å; F516-V523 HydrophobicContact CE1-CB 3.71Å; F516-V523 HydrophobicContact CE1-CG1 3.73Å; F516-V523 HydrophobicContact CE1-CG2 4.39Å; F516-V523 HydrophobicContact CE2-CB 4.16Å; F516-V523 HydrophobicContact CE2-CG2 3.99Å; F516-V523 HydrophobicContact CZ-CB 3.73Å; F516-V523 HydrophobicContact CZ-CG1 3.83Å; F516-V523 HydrophobicContact CZ-CG2 3.89Å; F516-V523 PolarHBondContact N-O 3.01Å; F516-V523 PolarHBondContact O-N 3.29Å; G521-V523 WeakPolarHBondContact O-CG2 3.39Å; G521-V523 PolarHBondContact O-N 2.91Å; V523-F525 HydrophobicContact CG1-CZ 4.4Å
524	V	91.3	Very high	89	Confident	46 Å²	46	34.1 Å²	34.1	28%	0.279	19%	0.193	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	135.3	170.9	164.9	0	0	0	0	108.9	H522 R531 M532	H522-V524 VanDerWaalsContact CD2-CG2 3.49Å; H522-V524 WeakPolarHBondContact CD2-CG2 3.43Å; H522-V524 VanDerWaalsContact NE2-CG2 3.25Å; H522-V524 WeakPolarHBondContact NE2-CG2 3.35Å; V524-R531 WeakPolarHBondContact O-CA 3.08Å; V524-M532 PolarHBondContact O-N 2.9Å; V524-M532 VanDerWaalsContact O-N 3.14Å
525	F	91.6	Very high	89	Confident	12 Å²	12	33.9 Å²	33.9	5%	0.053	19%	0.192	C	C	.	.	B	Isolated β-bridge	trans	-90.6	137.3	171.7	-53.8	-68.1	0	0	0	110.3	L262 F281 R282 T283 A474 L511 S514 V523 S530	L262-F525 HydrophobicContact CD1-CE1 4.46Å; L262-F525 HydrophobicContact CD1-CZ 4.22Å; F281-F525 HydrophobicContact CD1-CB 4.07Å; F281-F525 HydrophobicContact CD1-CD1 4.33Å; F281-F525 HydrophobicContact CD1-CD2 4.12Å; F281-F525 AromaticContact CD1-CG 3.91Å; F281-F525 HydrophobicContact CD1-CG 3.91Å; F281-F525 HydrophobicContact CE1-CB 4.34Å; R282-F525 WeakPolarHBondContact O-CD1 3.45Å; R282-F525 VanDerWaalsContact O-CE1 3.3Å; R282-F525 WeakPolarHBondContact O-CE1 3.28Å; T283-F525 HydrophobicContact CG2-CE1 4.1Å; T283-F525 HydrophobicContact CG2-CZ 4.13Å; A474-F525 HydrophobicContact CB-CE2 4.26Å; A474-F525 HydrophobicContact CB-CZ 4.09Å; L511-F525 HydrophobicContact CD2-CE2 4.33Å; L511-F525 WeakPolarHBondContact O-CD2 3.07Å; S514-F525 WeakPolarHBondContact OG-CD2 3.48Å; S514-F525 VanDerWaalsContact OG-CE2 3.25Å; S514-F525 WeakPolarHBondContact OG-CE2 3.34Å; V523-F525 HydrophobicContact CG1-CZ 4.4Å; F525-S530 CarbonylContact C-O 3.5Å; F525-S530 WeakPolarHBondContact CA-O 3.17Å
526	D	86.9	Confident	88.9	Confident	39 Å²	39	31 Å²	31	21%	0.209	17%	0.171	C	C	.	.			trans	-75.2	177.3	171.3	73.3	4.9	0	0	0	112	Q528 G529 S530 M532	D526-Q528 PolarHBondContact O-N 3.28Å; D526-Q528 VanDerWaalsContact O-N 3.11Å; D526-Q528 VanDerWaalsContact OD1-C 3.25Å; D526-Q528 WeakPolarHBondContact OD1-CA 3.47Å; D526-Q528 VanDerWaalsContact OD1-CB 3.28Å; D526-Q528 WeakPolarHBondContact OD1-CB 3.21Å; D526-Q528 PolarHBondContact OD1-N 3.04Å; D526-G529 PolarHBondContact O-N 2.9Å; D526-G529 PolarHBondContact OD1-N 3.15Å; D526-S530 PolarHBondContact N-O 2.75Å; D526-S530 PolarHBondContact OD1-N 2.99Å; D526-M532 HydrophobicContact CB-CG 4.31Å; D526-M532 HydrophobicContact CB-SD 4.29Å
527	A	85.4	Confident	89.1	Confident	82 Å²	82	30 Å²	30	68%	0.678	17%	0.166	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-18.1	176	0	0	0	0	0	113.7	R274	R274-A527 PolarHBondContact NE-O 3.12Å
528	Q	87.1	Confident	89.2	Confident	86 Å²	86	27.6 Å²	27.6	40%	0.402	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.6	-9.1	176.6	-53.1	179	-0.3	0	0	112.4	S272 R274 D526	S272-Q528 PolarHBondContact OG-OE1 3.03Å; R274-Q528 VanDerWaalsContact CZ-C 3.48Å; R274-Q528 VanDerWaalsContact NE-C 3.3Å; R274-Q528 PolarHBondContact NE-O 3.2Å; D526-Q528 PolarHBondContact O-N 3.28Å; D526-Q528 VanDerWaalsContact O-N 3.11Å; D526-Q528 VanDerWaalsContact OD1-C 3.25Å; D526-Q528 WeakPolarHBondContact OD1-CA 3.47Å; D526-Q528 VanDerWaalsContact OD1-CB 3.28Å; D526-Q528 WeakPolarHBondContact OD1-CB 3.21Å; D526-Q528 PolarHBondContact OD1-N 3.04Å
529	G	81.8	Confident	89.4	Confident	0 Å²	0	27.4 Å²	27.4	0%	0	15%	0.153	C	C	.	.	S	Bend	trans	87.8	8.5	-177.6	0	0	0	0	0	114.1	R274 F281 R282 D526	R274-G529 VanDerWaalsContact NH2-N 3.17Å; F281-G529 CarbonylContact C-O 3.57Å; F281-G529 WeakPolarHBondContact CA-O 3.44Å; R282-G529 PolarHBondContact N-O 3.4Å; D526-G529 PolarHBondContact O-N 2.9Å; D526-G529 PolarHBondContact OD1-N 3.15Å
530	S	87.5	Confident	89.6	Confident	3 Å²	3	27.2 Å²	27.2	2%	0.021	15%	0.152	C	C	.	.	B	Isolated β-bridge	trans	-92.9	143.3	178.4	-57.2	0	0	0	0	111.2	S272 R282 F525 D526	S272-S530 PolarHBondContact OG-OG 2.97Å; R282-S530 PolarHBondContact NE-OG 3.11Å; R282-S530 PolarHBondContact NH2-OG 3.11Å; F525-S530 CarbonylContact C-O 3.5Å; F525-S530 WeakPolarHBondContact CA-O 3.17Å; D526-S530 PolarHBondContact N-O 2.75Å; D526-S530 PolarHBondContact OD1-N 2.99Å
531	R	86.5	Confident	89.8	Confident	10 Å²	10	29 Å²	29	4%	0.038	16%	0.159	C	C	.	.	B	Isolated β-bridge	trans	-68.6	136.5	172.6	179.7	177.5	178	-130.4	-4.3	111.6	R282 T283 P285 S520 H522 V524	R282-R531 PolarHBondContact O-N 2.85Å; R282-R531 VanDerWaalsContact O-N 3.15Å; T283-R531 VanDerWaalsContact O-CB 3.27Å; T283-R531 WeakPolarHBondContact O-CB 3.13Å; T283-R531 WeakPolarHBondContact O-CD 3.14Å; P285-R531 VanDerWaalsContact CB-O 3.32Å; P285-R531 WeakPolarHBondContact CB-O 3.27Å; P285-R531 HydrophobicContact CG-CB 4.21Å; P285-R531 HydrophobicContact CG-CG 4.37Å; S520-R531 VanDerWaalsContact CB-NH1 3.32Å; S520-R531 PolarHBondContact O-NH1 3.29Å; S520-R531 PolarHBondContact O-NH2 2.81Å; S520-R531 VanDerWaalsContact OG-CZ 3.26Å; S520-R531 PolarHBondContact OG-NH1 2.84Å; H522-R531 PolarHBondContact O-NE 2.97Å; H522-R531 PolarHBondContact O-NH2 2.88Å; V524-R531 WeakPolarHBondContact O-CA 3.08Å
532	M	83.1	Confident	89.9	Confident	73 Å²	73	32.1 Å²	32.1	36%	0.36	19%	0.192	S	C	.	.	P	Polyproline II helix	trans	-83.6	139.1	166.6	-66.1	-61.1	-67.7	0	0	111.2	V524 D526	V524-M532 PolarHBondContact O-N 2.9Å; V524-M532 VanDerWaalsContact O-N 3.14Å; D526-M532 HydrophobicContact CB-CG 4.31Å; D526-M532 HydrophobicContact CB-SD 4.29Å
533	A	85.4	Confident	90	Very high	14 Å²	14	28.3 Å²	28.3	12%	0.116	18%	0.176	C	C	.	.			trans	-153.4	166.1	-179.9	0	0	0	0	0	112.1	P285 L289 I424	P285-A533 HydrophobicContact CB-CB 4.5Å; P285-A533 HydrophobicContact CG-CB 3.81Å; L289-A533 HydrophobicContact CD2-CB 4.12Å; I424-A533 HydrophobicContact CG2-CB 3.68Å
534	M	87.5	Confident	90	Very high	82 Å²	82	30.9 Å²	30.9	40%	0.404	19%	0.194	S	C	.	.			trans	-79	147.2	167.4	-66.3	-172.8	-71.9	0	0	110.8	V425 D552	V425-M534 HydrophobicContact CG2-CB 4.28Å; V425-M534 PolarHBondContact N-O 3.46Å; M534-D552 HydrophobicContact CG-CB 4.26Å
535	T	91.9	Very high	90	Very high	2 Å²	2	29.7 Å²	29.7	1%	0.012	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	143.5	167.8	57.3	0	0	0	0	110.7	L289 T293 E423 I424 Y550 Y551	L289-T535 HydrophobicContact CD2-CG2 4.49Å; L289-T535 HydrophobicContact CG-CG2 3.95Å; T293-T535 WeakPolarHBondContact CG2-OG1 3.3Å; T293-T535 WeakPolarHBondContact OG1-CG2 3.31Å; T293-T535 PolarHBondContact OG1-OG1 3.39Å; E423-T535 WeakPolarHBondContact O-CA 3.14Å; E423-T535 VanDerWaalsContact O-CB 3.31Å; E423-T535 WeakPolarHBondContact O-CB 3.33Å; I424-T535 HydrophobicContact CG1-CG2 4.18Å; T535-Y550 CarbonylContact O-C 3.59Å; T535-Y550 VanDerWaalsContact O-CA 3.32Å; T535-Y550 WeakPolarHBondContact O-CA 3.06Å; T535-Y551 PolarHBondContact N-O 3.2Å; T535-Y551 PolarHBondContact O-N 3.32Å; T535-Y551 PolarHBondContact OG1-O 3.25Å; T535-Y551 VanDerWaalsContact OG1-O 3.06Å
536	L	91.8	Very high	90.2	Very high	8 Å²	8	33 Å²	33	4%	0.042	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	142	173	170.7	51.6	0	0	0	108.8	E423 V425 E538 K547 G549 Y550	E423-L536 HydrophobicContact CG-CB 3.74Å; E423-L536 HydrophobicContact CG-CD2 4.47Å; E423-L536 HydrophobicContact CG-CG 4.09Å; E423-L536 PolarHBondContact N-O 2.94Å; E423-L536 PolarHBondContact O-N 3.28Å; E423-L536 VanDerWaalsContact O-N 3.12Å; E423-L536 WeakPolarHBondContact OE1-CD2 3.27Å; E423-L536 WeakPolarHBondContact OE1-CG 3.4Å; V425-L536 HydrophobicContact CG2-CB 3.89Å; L536-E538 HydrophobicContact CG-CG 4.28Å; L536-K547 HydrophobicContact CD1-CB 4.01Å; L536-K547 HydrophobicContact CD1-CD 4.22Å; L536-K547 HydrophobicContact CD1-CG 3.94Å; L536-K547 HydrophobicContact CD2-CD 3.77Å; L536-K547 HydrophobicContact CD2-CG 4.17Å; L536-K547 HydrophobicContact CG-CG 4.43Å; L536-G549 VanDerWaalsContact CD1-O 3.24Å; L536-G549 WeakPolarHBondContact CD1-O 3.3Å; L536-Y550 HydrophobicContact CB-CD1 3.79Å; L536-Y550 HydrophobicContact CB-CE1 3.79Å; L536-Y550 HydrophobicContact CD1-CD1 3.86Å; L536-Y550 HydrophobicContact CD1-CD2 4.27Å; L536-Y550 HydrophobicContact CD1-CE1 3.61Å; L536-Y550 HydrophobicContact CD1-CE2 4.03Å; L536-Y550 HydrophobicContact CD1-CG 4.19Å; L536-Y550 HydrophobicContact CD2-CD1 4.44Å; L536-Y550 HydrophobicContact CD2-CE1 3.62Å; L536-Y550 HydrophobicContact CG-CD1 4.24Å; L536-Y550 HydrophobicContact CG-CE1 3.89Å
537	I	95.8	Very high	90.4	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	125.2	-173.2	-46.5	168.1	0	0	0	106.9	T293 L297 V420 I548 G549 L558 W560	T293-I537 HydrophobicContact CG2-CD1 3.62Å; T293-I537 HydrophobicContact CG2-CG1 3.72Å; L297-I537 HydrophobicContact CD1-CD1 4.26Å; L297-I537 HydrophobicContact CD1-CG2 3.88Å; L297-I537 HydrophobicContact CD2-CD1 4.21Å; L297-I537 HydrophobicContact CG-CD1 4.43Å; V420-I537 HydrophobicContact CG1-CG2 3.92Å; I537-I548 HydrophobicContact CB-CG1 4.11Å; I537-I548 HydrophobicContact CG2-CD1 3.87Å; I537-I548 HydrophobicContact CG2-CG1 3.76Å; I537-I548 WeakPolarHBondContact O-CG1 3.24Å; I537-I548 PolarHBondContact O-N 3.49Å; I537-G549 WeakPolarHBondContact CB-O 3.34Å; I537-G549 PolarHBondContact N-O 3.25Å; I537-G549 PolarHBondContact O-N 2.93Å; I537-L558 HydrophobicContact CD1-CD1 3.78Å; I537-W560 HydrophobicContact CD1-CZ3 3.9Å; I537-W560 HydrophobicContact CG2-CH2 4.42Å; I537-W560 HydrophobicContact CG2-CZ3 4.27Å
538	E	95	Very high	90.9	Very high	19 Å²	19	31.7 Å²	31.7	9%	0.089	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	166.2	178.4	-39.9	-170.7	114.6	0	0	111.6	V420 T421 L536 K546 K547	V420-E538 WeakPolarHBondContact CA-O 2.83Å; V420-E538 WeakPolarHBondContact CG1-O 3.41Å; T421-E538 PolarHBondContact N-O 3.38Å; T421-E538 PolarHBondContact O-N 3.21Å; T421-E538 VanDerWaalsContact O-N 3.15Å; T421-E538 WeakPolarHBondContact OG1-CB 3.49Å; L536-E538 HydrophobicContact CG-CG 4.28Å; E538-K546 CarbonylContact C-O 3.59Å; E538-K546 VanDerWaalsContact CA-O 3.23Å; E538-K546 WeakPolarHBondContact CA-O 3.47Å; E538-K546 WeakPolarHBondContact CB-O 3.36Å; E538-K547 HydrophobicContact CG-CG 4.01Å; E538-K547 WeakPolarHBondContact OE1-CE 3.48Å; E538-K547 WeakPolarHBondContact OE1-CG 3.38Å; E538-K547 IonicContact OE1-NZ 2.85Å; E538-K547 PolarHBondContact OE1-NZ 3.2Å
539	Q	96.7	Very high	91.2	Very high	1 Å²	1	27.6 Å²	27.6	1%	0.005	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	142	171.9	-163.5	-176.1	21	0	0	109.9	G418 H419 Q541 K546 I548 V565	G418-Q539 PolarHBondContact O-NE2 3.45Å; G418-Q539 VanDerWaalsContact O-NE2 3.08Å; H419-Q539 WeakPolarHBondContact O-CA 3.36Å; H419-Q539 WeakPolarHBondContact O-CG 3.21Å; Q539-Q541 HydrophobicContact CB-CG 4.27Å; Q539-Q541 HydrophobicContact CG-CG 4.26Å; Q539-Q541 PolarHBondContact O-N 3.08Å; Q539-K546 PolarHBondContact N-O 3.43Å; Q539-K546 PolarHBondContact O-N 3.39Å; Q539-I548 HydrophobicContact CB-CD1 4.34Å; Q539-I548 HydrophobicContact CB-CG2 4.1Å; Q539-V565 PolarHBondContact NE2-O 3.43Å; Q539-V565 PolarHBondContact OE1-O 3.06Å
540	L	96.1	Very high	91.8	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	120	166.8	-168.7	77.6	0	0	0	109.4	F398 V416 G418 H419 Y545	F398-L540 HydrophobicContact CE1-CD1 4Å; F398-L540 HydrophobicContact CE1-CD2 4.12Å; F398-L540 HydrophobicContact CZ-CD1 4.03Å; F398-L540 HydrophobicContact CZ-CD2 3.95Å; V416-L540 HydrophobicContact CB-CD2 4.04Å; V416-L540 HydrophobicContact CG2-CD2 3.38Å; G418-L540 VanDerWaalsContact CA-O 3.28Å; G418-L540 WeakPolarHBondContact CA-O 3.4Å; G418-L540 PolarHBondContact N-O 3.46Å; H419-L540 PolarHBondContact O-N 3.17Å; L540-Y545 HydrophobicContact CB-CD1 4.25Å; L540-Y545 HydrophobicContact CB-CE1 4.01Å; L540-Y545 HydrophobicContact CD1-CD1 4.1Å; L540-Y545 HydrophobicContact CD1-CD2 3.98Å; L540-Y545 HydrophobicContact CD1-CE1 3.99Å; L540-Y545 HydrophobicContact CD1-CE2 3.86Å; L540-Y545 HydrophobicContact CD1-CG 4.09Å
541	Q	95.5	Very high	92	Very high	39 Å²	39	30.5 Å²	30.5	18%	0.182	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	118.1	-180	-61.3	179.4	-0.3	0	0	109.6	Q539 G543 S544 K546 N563 V565	Q539-Q541 HydrophobicContact CB-CG 4.27Å; Q539-Q541 HydrophobicContact CG-CG 4.26Å; Q539-Q541 PolarHBondContact O-N 3.08Å; Q541-G543 VanDerWaalsContact C-N 3.26Å; Q541-G543 PolarHBondContact O-N 3.46Å; Q541-S544 PolarHBondContact N-O 3.08Å; Q541-S544 PolarHBondContact O-N 3Å; Q541-K546 HydrophobicContact CB-CG 4.09Å; Q541-K546 HydrophobicContact CG-CB 4.47Å; Q541-K546 HydrophobicContact CG-CG 4.32Å; Q541-N563 PolarHBondContact NE2-O 3.09Å; Q541-V565 HydrophobicContact CG-CB 4.48Å
542	G	91.3	Very high	92.1	Very high	72 Å²	72	31 Å²	31	74%	0.742	17%	0.171	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.9	34.6	-176.2	0	0	0	0	0	113.1	E417 S544	E417-G542 PolarHBondContact OE1-N 2.91Å; E417-G542 PolarHBondContact OE2-N 3.49Å; G542-S544 VanDerWaalsContact C-N 3.3Å; G542-S544 PolarHBondContact O-N 3.35Å
543	G	90	Very high	92.2	Very high	7 Å²	7	29 Å²	29	7%	0.072	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	67.1	24.5	-175.9	0	0	0	0	0	115.4	K399 E417 Q541	K399-G543 PolarHBondContact NZ-O 2.97Å; E417-G543 PolarHBondContact OE2-N 3.35Å; E417-G543 VanDerWaalsContact OE2-N 3.16Å; Q541-G543 VanDerWaalsContact C-N 3.26Å; Q541-G543 PolarHBondContact O-N 3.46Å
544	S	92.4	Very high	92.1	Very high	53 Å²	53	32.3 Å²	32.3	37%	0.371	19%	0.187	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	136.9	173.4	178.6	0	0	0	0	110.5	Q541 G542 K546	Q541-S544 PolarHBondContact N-O 3.08Å; Q541-S544 PolarHBondContact O-N 3Å; G542-S544 VanDerWaalsContact C-N 3.3Å; G542-S544 PolarHBondContact O-N 3.35Å; S544-K546 PolarHBondContact OG-NZ 2.87Å
545	Y	91.3	Very high	92	Very high	21 Å²	21	35 Å²	35	8%	0.082	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	145	178.5	-73.2	-76	0	0	0	112.3	D395 W397 H419 T421 L540	D395-Y545 HydrophobicContact CB-CD2 4.38Å; W397-Y545 PolarHBondContact NE1-OH 3.45Å; H419-Y545 AromaticContact CE1-CE1 3.74Å; H419-Y545 AromaticContact CE1-CZ 3.76Å; H419-Y545 PolarHBondContact CE1-OH 2.9Å; H419-Y545 AromaticContact NE2-CE1 3.48Å; H419-Y545 WeakPolarHBondContact NE2-CE1 3.44Å; H419-Y545 AromaticContact NE2-CZ 3.66Å; H419-Y545 PolarHBondContact NE2-OH 3.01Å; T421-Y545 HydrophobicContact CG2-CE1 3.7Å; L540-Y545 HydrophobicContact CB-CD1 4.25Å; L540-Y545 HydrophobicContact CB-CE1 4.01Å; L540-Y545 HydrophobicContact CD1-CD1 4.1Å; L540-Y545 HydrophobicContact CD1-CD2 3.98Å; L540-Y545 HydrophobicContact CD1-CE1 3.99Å; L540-Y545 HydrophobicContact CD1-CE2 3.86Å; L540-Y545 HydrophobicContact CD1-CG 4.09Å
546	K	94.3	Very high	91.7	Very high	83 Å²	83	41.5 Å²	41.5	36%	0.361	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	122.4	179.6	-63.6	-72.1	162	-87.2	0	109.7	E538 Q539 Q541 S544 I548	E538-K546 CarbonylContact C-O 3.59Å; E538-K546 VanDerWaalsContact CA-O 3.23Å; E538-K546 WeakPolarHBondContact CA-O 3.47Å; E538-K546 WeakPolarHBondContact CB-O 3.36Å; Q539-K546 PolarHBondContact N-O 3.43Å; Q539-K546 PolarHBondContact O-N 3.39Å; Q541-K546 HydrophobicContact CB-CG 4.09Å; Q541-K546 HydrophobicContact CG-CB 4.47Å; Q541-K546 HydrophobicContact CG-CG 4.32Å; S544-K546 PolarHBondContact OG-NZ 2.87Å; K546-I548 PolarHBondContact O-N 3.17Å
547	K	92.8	Very high	91.8	Very high	93 Å²	93	45.7 Å²	45.7	40%	0.404	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	120.3	177.8	-64.5	177.8	-168	-54.8	0	109.7	E423 L536 E538 N563	E423-K547 IonicContact OE1-NZ 2.7Å; E423-K547 PolarHBondContact OE1-NZ 2.96Å; L536-K547 HydrophobicContact CD1-CB 4.01Å; L536-K547 HydrophobicContact CD1-CD 4.22Å; L536-K547 HydrophobicContact CD1-CG 3.94Å; L536-K547 HydrophobicContact CD2-CD 3.77Å; L536-K547 HydrophobicContact CD2-CG 4.17Å; L536-K547 HydrophobicContact CG-CG 4.43Å; E538-K547 HydrophobicContact CG-CG 4.01Å; E538-K547 WeakPolarHBondContact OE1-CE 3.48Å; E538-K547 WeakPolarHBondContact OE1-CG 3.38Å; E538-K547 IonicContact OE1-NZ 2.85Å; E538-K547 PolarHBondContact OE1-NZ 3.2Å; K547-N563 PolarHBondContact O-ND2 3.29Å
548	I	95.4	Very high	91.7	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	-18.9	-177	65.1	178.3	0	0	0	114	I537 Q539 K546 W560 F561 N563 D564	I537-I548 HydrophobicContact CB-CG1 4.11Å; I537-I548 HydrophobicContact CG2-CD1 3.87Å; I537-I548 HydrophobicContact CG2-CG1 3.76Å; I537-I548 WeakPolarHBondContact O-CG1 3.24Å; I537-I548 PolarHBondContact O-N 3.49Å; Q539-I548 HydrophobicContact CB-CD1 4.34Å; Q539-I548 HydrophobicContact CB-CG2 4.1Å; K546-I548 PolarHBondContact O-N 3.17Å; I548-W560 HydrophobicContact CB-CH2 4.28Å; I548-W560 HydrophobicContact CB-CZ2 4.11Å; I548-W560 HydrophobicContact CD1-CH2 3.34Å; I548-W560 HydrophobicContact CD1-CZ2 3.63Å; I548-W560 HydrophobicContact CD1-CZ3 4.21Å; I548-W560 HydrophobicContact CG1-CH2 3.61Å; I548-W560 HydrophobicContact CG1-CZ2 3.92Å; I548-W560 HydrophobicContact CG1-CZ3 4.03Å; I548-W560 VanDerWaalsContact O-CD2 3.29Å; I548-F561 PolarHBondContact O-N 3.04Å; I548-N563 WeakPolarHBondContact CA-OD1 3.17Å; I548-D564 HydrophobicContact CB-CB 4.48Å; I548-D564 HydrophobicContact CD1-CB 4.26Å; I548-D564 HydrophobicContact CG2-CB 4.18Å
549	G	94.1	Very high	91.6	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	176.1	175.1	172.3	0	0	0	0	0	114.1	L536 I537 S559	L536-G549 VanDerWaalsContact CD1-O 3.24Å; L536-G549 WeakPolarHBondContact CD1-O 3.3Å; I537-G549 WeakPolarHBondContact CB-O 3.34Å; I537-G549 PolarHBondContact N-O 3.25Å; I537-G549 PolarHBondContact O-N 2.93Å; G549-S559 CarbonylContact C-O 3.58Å; G549-S559 WeakPolarHBondContact CA-O 3.2Å
550	Y	92.4	Very high	91.5	Very high	47 Å²	47	50.6 Å²	50.6	18%	0.184	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	150.2	170.7	-61.6	-100.2	0	0	0	110.1	V425 T535 L536 S559 F561	V425-Y550 HydrophobicContact CG2-CD1 3.84Å; V425-Y550 HydrophobicContact CG2-CE1 3.73Å; T535-Y550 CarbonylContact O-C 3.59Å; T535-Y550 VanDerWaalsContact O-CA 3.32Å; T535-Y550 WeakPolarHBondContact O-CA 3.06Å; L536-Y550 HydrophobicContact CB-CD1 3.79Å; L536-Y550 HydrophobicContact CB-CE1 3.79Å; L536-Y550 HydrophobicContact CD1-CD1 3.86Å; L536-Y550 HydrophobicContact CD1-CD2 4.27Å; L536-Y550 HydrophobicContact CD1-CE1 3.61Å; L536-Y550 HydrophobicContact CD1-CE2 4.03Å; L536-Y550 HydrophobicContact CD1-CG 4.19Å; L536-Y550 HydrophobicContact CD2-CD1 4.44Å; L536-Y550 HydrophobicContact CD2-CE1 3.62Å; L536-Y550 HydrophobicContact CG-CD1 4.24Å; L536-Y550 HydrophobicContact CG-CE1 3.89Å; Y550-S559 WeakPolarHBondContact CB-OG 3.42Å; Y550-S559 PolarHBondContact N-O 2.98Å; Y550-S559 PolarHBondContact N-OG 2.8Å; Y550-S559 PolarHBondContact O-N 2.86Å; Y550-S559 PolarHBondContact O-OG 3.16Å; Y550-F561 AromaticContact CD2-CE2 3.9Å; Y550-F561 HydrophobicContact CD2-CE2 3.9Å; Y550-F561 AromaticContact CD2-CZ 3.8Å; Y550-F561 HydrophobicContact CD2-CZ 3.8Å; Y550-F561 AromaticContact CE2-CE2 3.74Å; Y550-F561 HydrophobicContact CE2-CE2 3.74Å; Y550-F561 AromaticContact CE2-CZ 3.71Å; Y550-F561 HydrophobicContact CE2-CZ 3.71Å
551	Y	92.5	Very high	91.3	Very high	17 Å²	17	55.6 Å²	55.6	7%	0.067	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	124.6	173.8	-179.5	-106.6	0	0	0	111.3	P292 T293 R296 T535 N557 L558	P292-Y551 HydrophobicContact CB-CE1 3.93Å; T293-Y551 HydrophobicContact CG2-CD1 4.23Å; T293-Y551 HydrophobicContact CG2-CG 4.3Å; T293-Y551 WeakPolarHBondContact OG1-CD1 3.09Å; R296-Y551 HydrophobicContact CB-CE2 4.12Å; R296-Y551 HydrophobicContact CG-CD2 4.09Å; R296-Y551 HydrophobicContact CG-CE2 3.72Å; T535-Y551 PolarHBondContact N-O 3.2Å; T535-Y551 PolarHBondContact O-N 3.32Å; T535-Y551 PolarHBondContact OG1-O 3.25Å; T535-Y551 VanDerWaalsContact OG1-O 3.06Å; Y551-N557 WeakPolarHBondContact CA-O 3.46Å; Y551-N557 WeakPolarHBondContact CD2-O 3.32Å; Y551-L558 HydrophobicContact CD2-CB 3.95Å; Y551-L558 HydrophobicContact CD2-CD1 4.05Å; Y551-L558 HydrophobicContact CG-CD1 4.41Å
552	D	89.5	Confident	91	Very high	20 Å²	20	60.2 Å²	60.2	11%	0.107	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	115.3	169.3	-180	1.3	0	0	0	109.3	M534 S554 Q555 M556 N557	M534-D552 HydrophobicContact CG-CB 4.26Å; D552-S554 VanDerWaalsContact C-N 3.3Å; D552-S554 VanDerWaalsContact CG-OG 3.27Å; D552-S554 PolarHBondContact O-N 3.13Å; D552-S554 WeakPolarHBondContact OD1-CB 3.47Å; D552-S554 PolarHBondContact OD1-N 2.8Å; D552-S554 PolarHBondContact OD1-OG 2.77Å; D552-S554 PolarHBondContact OD2-OG 2.83Å; D552-S554 VanDerWaalsContact OD2-OG 3.1Å; D552-Q555 HydrophobicContact CB-CB 4.47Å; D552-Q555 WeakPolarHBondContact OD2-CB 3.46Å; D552-Q555 VanDerWaalsContact OD2-CG 3.26Å; D552-Q555 WeakPolarHBondContact OD2-CG 3.4Å; D552-Q555 PolarHBondContact OD2-NE2 2.95Å; D552-M556 CarbonylContact O-C 3.57Å; D552-M556 VanDerWaalsContact O-CA 3.25Å; D552-M556 WeakPolarHBondContact O-CA 3.14Å; D552-M556 PolarHBondContact O-N 3.32Å; D552-N557 PolarHBondContact N-O 3.04Å; D552-N557 PolarHBondContact O-N 3.13Å
553	S	84.6	Confident	91.1	Very high	30 Å²	30	59.7 Å²	59.7	21%	0.21	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-23	178.4	64.4	0	0	0	0	113.8	L289	L289-S553 WeakPolarHBondContact CD1-OG 3.4Å
554	S	82.4	Confident	91.3	Very high	84 Å²	84	61.1 Å²	61.1	59%	0.587	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.8	-42.4	-178.5	71.9	0	0	0	0	112.3	D552	D552-S554 VanDerWaalsContact C-N 3.3Å; D552-S554 VanDerWaalsContact CG-OG 3.27Å; D552-S554 PolarHBondContact O-N 3.13Å; D552-S554 WeakPolarHBondContact OD1-CB 3.47Å; D552-S554 PolarHBondContact OD1-N 2.8Å; D552-S554 PolarHBondContact OD1-OG 2.77Å; D552-S554 PolarHBondContact OD2-OG 2.83Å; D552-S554 VanDerWaalsContact OD2-OG 3.1Å
555	Q	85.8	Confident	91.3	Very high	140 Å²	140	62.9 Å²	62.9	65%	0.654	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.7	-5.9	174.7	-65.9	177.8	73	0	0	113.2	D552 N557	D552-Q555 HydrophobicContact CB-CB 4.47Å; D552-Q555 WeakPolarHBondContact OD2-CB 3.46Å; D552-Q555 VanDerWaalsContact OD2-CG 3.26Å; D552-Q555 WeakPolarHBondContact OD2-CG 3.4Å; D552-Q555 PolarHBondContact OD2-NE2 2.95Å; Q555-N557 HydrophobicContact CB-CB 4.08Å; Q555-N557 PolarHBondContact O-N 3.19Å; Q555-N557 VanDerWaalsContact O-N 3.13Å
556	M	87	Confident	91.4	Very high	138 Å²	138	63.4 Å²	63.4	68%	0.68	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.9	21.6	-170.2	-59.6	-178.6	-76.2	0	0	114.2	D552	D552-M556 CarbonylContact O-C 3.57Å; D552-M556 VanDerWaalsContact O-CA 3.25Å; D552-M556 WeakPolarHBondContact O-CA 3.14Å; D552-M556 PolarHBondContact O-N 3.32Å
557	N	92.2	Very high	91	Very high	95 Å²	95	64.7 Å²	64.7	51%	0.508	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	135.7	-172	-168.7	8.3	0	0	0	111.3	Y551 D552 Q555	Y551-N557 WeakPolarHBondContact CA-O 3.46Å; Y551-N557 WeakPolarHBondContact CD2-O 3.32Å; D552-N557 PolarHBondContact N-O 3.04Å; D552-N557 PolarHBondContact O-N 3.13Å; Q555-N557 HydrophobicContact CB-CB 4.08Å; Q555-N557 PolarHBondContact O-N 3.19Å; Q555-N557 VanDerWaalsContact O-N 3.13Å
558	L	93.8	Very high	90.5	Very high	35 Å²	35	63.6 Å²	63.6	18%	0.183	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	104.8	179.7	-179.8	70.6	0	0	0	109.1	R296 K300 I537 Y551 W560	R296-L558 HydrophobicContact CG-CD2 4.31Å; K300-L558 HydrophobicContact CD-CD2 4.15Å; I537-L558 HydrophobicContact CD1-CD1 3.78Å; Y551-L558 HydrophobicContact CD2-CB 3.95Å; Y551-L558 HydrophobicContact CD2-CD1 4.05Å; Y551-L558 HydrophobicContact CG-CD1 4.41Å; L558-W560 HydrophobicContact CD1-CE3 4.21Å; L558-W560 HydrophobicContact CD1-CZ3 4.49Å; L558-W560 HydrophobicContact CD2-CE3 4.5Å; L558-W560 HydrophobicContact CG-CE3 4.43Å
559	S	93.3	Very high	90.1	Very high	52 Å²	52	66.7 Å²	66.7	36%	0.364	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	140	167.1	64.1	0	0	0	0	109.5	G549 Y550	G549-S559 CarbonylContact C-O 3.58Å; G549-S559 WeakPolarHBondContact CA-O 3.2Å; Y550-S559 WeakPolarHBondContact CB-OG 3.42Å; Y550-S559 PolarHBondContact N-O 2.98Å; Y550-S559 PolarHBondContact N-OG 2.8Å; Y550-S559 PolarHBondContact O-N 2.86Å; Y550-S559 PolarHBondContact O-OG 3.16Å
560	W	94.1	Very high	89.8	Confident	36 Å²	36	74.3 Å²	74.3	14%	0.136	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	136.7	-174.9	-160.5	-100.3	0	0	0	111.3	L297 K300 W301 I537 I548 L558 D564	L297-W560 HydrophobicContact CD2-CH2 3.76Å; L297-W560 HydrophobicContact CD2-CZ3 3.63Å; K300-W560 VanDerWaalsContact NZ-CG 3.29Å; W301-W560 HydrophobicContact CH2-CH2 4.01Å; W301-W560 HydrophobicContact CH2-CZ2 4.46Å; W301-W560 AromaticContact CZ2-CH2 3.9Å; W301-W560 HydrophobicContact CZ2-CH2 3.9Å; W301-W560 AromaticContact CZ2-CZ2 3.91Å; W301-W560 HydrophobicContact CZ2-CZ2 3.91Å; I537-W560 HydrophobicContact CD1-CZ3 3.9Å; I537-W560 HydrophobicContact CG2-CH2 4.42Å; I537-W560 HydrophobicContact CG2-CZ3 4.27Å; I548-W560 HydrophobicContact CB-CH2 4.28Å; I548-W560 HydrophobicContact CB-CZ2 4.11Å; I548-W560 HydrophobicContact CD1-CH2 3.34Å; I548-W560 HydrophobicContact CD1-CZ2 3.63Å; I548-W560 HydrophobicContact CD1-CZ3 4.21Å; I548-W560 HydrophobicContact CG1-CH2 3.61Å; I548-W560 HydrophobicContact CG1-CZ2 3.92Å; I548-W560 HydrophobicContact CG1-CZ3 4.03Å; I548-W560 VanDerWaalsContact O-CD2 3.29Å; L558-W560 HydrophobicContact CD1-CE3 4.21Å; L558-W560 HydrophobicContact CD1-CZ3 4.49Å; L558-W560 HydrophobicContact CD2-CE3 4.5Å; L558-W560 HydrophobicContact CG-CE3 4.43Å; W560-D564 HydrophobicContact CZ2-CB 4.04Å; W560-D564 PolarHBondContact NE1-OD1 2.93Å
561	F	93.3	Very high	89.7	Confident	105 Å²	105	74.3 Å²	74.3	46%	0.461	42%	0.42	S	S	.	.			trans	-96.6	-4.5	-174	-57	-52.2	0	0	0	114	I548 Y550 N563	I548-F561 PolarHBondContact O-N 3.04Å; Y550-F561 AromaticContact CD2-CE2 3.9Å; Y550-F561 HydrophobicContact CD2-CE2 3.9Å; Y550-F561 AromaticContact CD2-CZ 3.8Å; Y550-F561 HydrophobicContact CD2-CZ 3.8Å; Y550-F561 AromaticContact CE2-CE2 3.74Å; Y550-F561 HydrophobicContact CE2-CE2 3.74Å; Y550-F561 AromaticContact CE2-CZ 3.71Å; Y550-F561 HydrophobicContact CE2-CZ 3.71Å; F561-N563 WeakPolarHBondContact CB-OD1 3.39Å; F561-N563 PolarHBondContact O-N 3.45Å
562	N	89.4	Confident	89.7	Confident	137 Å²	137	74.2 Å²	74.2	73%	0.733	42%	0.422	S	S	*	.	S	Bend	trans	56.5	30.8	177.8	-55.6	-65.9	0	0	0	114.1
563	N	92.8	Very high	89.6	Confident	61 Å²	61	75 Å²	75	33%	0.326	43%	0.432	S	S	.	.			trans	-110.8	16.8	177.4	62.5	-24.1	0	0	0	112.2	Q541 K547 I548 F561	Q541-N563 PolarHBondContact NE2-O 3.09Å; K547-N563 PolarHBondContact O-ND2 3.29Å; I548-N563 WeakPolarHBondContact CA-OD1 3.17Å; F561-N563 WeakPolarHBondContact CB-OD1 3.39Å; F561-N563 PolarHBondContact O-N 3.45Å
564	D	93	Very high	89.8	Confident	37 Å²	37	74.6 Å²	74.6	20%	0.198	43%	0.427	C	S	.	.			trans	-74.6	127	172.3	56.4	-62.3	0	0	0	111.2	I548 W560 W566	I548-D564 HydrophobicContact CB-CB 4.48Å; I548-D564 HydrophobicContact CD1-CB 4.26Å; I548-D564 HydrophobicContact CG2-CB 4.18Å; W560-D564 HydrophobicContact CZ2-CB 4.04Å; W560-D564 PolarHBondContact NE1-OD1 2.93Å; D564-W566 PolarHBondContact OD2-NE1 3.35Å
565	V	93.4	Very high	90	Very high	90 Å²	90	75.3 Å²	75.3	55%	0.545	42%	0.417	S	S	.	.			trans	-111	129.4	-171.9	177.8	0	0	0	0	109.5	Q539 Q541	Q539-V565 PolarHBondContact NE2-O 3.43Å; Q539-V565 PolarHBondContact OE1-O 3.06Å; Q541-V565 HydrophobicContact CG-CB 4.48Å
566	W	92.9	Very high	89.8	Confident	32 Å²	32	70.3 Å²	70.3	12%	0.121	40%	0.396	C	S	.	.			trans	-130.6	143.4	-177	-59.9	98.1	0	0	0	111.5	W301 V386 V420 D564 G568 G569 K570 P571	W301-W566 HydrophobicContact CH2-CZ2 4.03Å; W301-W566 AromaticContact CZ2-CZ2 3.65Å; W301-W566 HydrophobicContact CZ2-CZ2 3.65Å; V386-W566 HydrophobicContact CG1-CH2 3.89Å; V386-W566 HydrophobicContact CG1-CZ3 3.93Å; V386-W566 HydrophobicContact CG2-CH2 4.36Å; V386-W566 HydrophobicContact CG2-CZ3 3.81Å; V420-W566 HydrophobicContact CG2-CH2 4.03Å; D564-W566 PolarHBondContact OD2-NE1 3.35Å; W566-G568 PolarHBondContact O-N 3.29Å; W566-G569 PolarHBondContact O-N 2.65Å; W566-K570 VanDerWaalsContact CB-O 3.27Å; W566-K570 WeakPolarHBondContact CB-O 3.48Å; W566-P571 HydrophobicContact CD2-CB 4.24Å
567	I	87.3	Confident	89.4	Confident	110 Å²	110	67 Å²	67	56%	0.564	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.7	106.4	179.3	-58.2	172.8	0	0	0	109.1	K383	K383-I567 HydrophobicContact CB-CB 4.27Å; K383-I567 HydrophobicContact CB-CG2 3.99Å; K383-I567 HydrophobicContact CG-CG2 4.37Å
568	G	81.5	Confident	89	Confident	70 Å²	70	64.9 Å²	64.9	72%	0.722	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	93.3	11.9	-171.8	0	0	0	0	0	114.8	W566 K570	W566-G568 PolarHBondContact O-N 3.29Å; G568-K570 VanDerWaalsContact C-N 3.28Å; G568-K570 PolarHBondContact O-N 3.47Å
569	G	85.8	Confident	88.4	Confident	65 Å²	65	67.2 Å²	67.2	67%	0.67	39%	0.386	S	S	*	.	S	Bend	trans	74.1	8.9	170.6	0	0	0	0	0	115.8	W566	W566-G569 PolarHBondContact O-N 2.65Å
570	K	88.4	Confident	88	Confident	160 Å²	160	69.3 Å²	69.3	70%	0.696	39%	0.39	S	S	*	.	S	Bend	trans	-142.1	148.2	176	-67.7	-177	-178	175.6	0	110.6	W566 G568	W566-K570 VanDerWaalsContact CB-O 3.27Å; W566-K570 WeakPolarHBondContact CB-O 3.48Å; G568-K570 VanDerWaalsContact C-N 3.28Å; G568-K570 PolarHBondContact O-N 3.47Å
571	P	91.6	Very high	87.6	Confident	46 Å²	46	72.3 Å²	72.3	30%	0.299	41%	0.405	S	S	.	.	P	Polyproline II helix	trans	-61.1	148.3	172	28.7	-37.6	0	0	0	111	W301 W303 W566	W301-P571 HydrophobicContact CB-CG 4.47Å; W301-P571 HydrophobicContact CG-CB 4.2Å; W301-P571 HydrophobicContact CG-CG 4.22Å; W303-P571 HydrophobicContact CZ2-CB 4.04Å; W566-P571 HydrophobicContact CD2-CB 4.24Å
572	P	91	Very high	87.3	Confident	16 Å²	16	71 Å²	71	10%	0.104	40%	0.398	C	S	.	.	P	Polyproline II helix	trans	-64.1	156.1	178.2	-23	36	0	0	0	113.3	W303 K383 V386	W303-P572 PolarHBondContact NE1-O 2.82Å; K383-P572 WeakPolarHBondContact O-CB 3.43Å; K383-P572 WeakPolarHBondContact O-CG 3.19Å; V386-P572 HydrophobicContact CG2-CB 4.22Å; V386-P572 HydrophobicContact CG2-CG 3.58Å
573	A	88.4	Confident	87.1	Confident	37 Å²	37	69.2 Å²	69.2	31%	0.306	38%	0.381	S	S	.	.	P	Polyproline II helix	trans	-77.7	149.2	173.4	0	0	0	0	0	112.1	R357 R575	R357-A573 WeakPolarHBondContact CD-O 3.3Å; R357-A573 PolarHBondContact NH1-O 3.41Å; A573-R575 PolarHBondContact O-N 3.15Å
574	D	87.8	Confident	86.9	Confident	21 Å²	21	70 Å²	70	11%	0.112	39%	0.385	C	S	.	.	S	Bend	trans	-70.9	-13.4	-176.5	81.3	-6.8	0	0	0	114.8	W303 S304 R305 I358	W303-D574 HydrophobicContact CB-CB 4.1Å; W303-D574 HydrophobicContact CG-CB 4.24Å; S304-D574 WeakPolarHBondContact CA-OD2 3.3Å; S304-D574 PolarHBondContact N-OD2 3.23Å; S304-D574 PolarHBondContact OG-OD2 3.11Å; R305-D574 PolarHBondContact N-OD2 2.72Å; I358-D574 HydrophobicContact CG1-CB 4.35Å
575	R	86.4	Confident	86.7	Confident	99 Å²	99	68.9 Å²	68.9	37%	0.374	38%	0.379	S	S	.	.	S	Bend	trans	-154.5	162.4	-179.6	71.2	-168	74.2	-171	4.6	110.5	S304 R305 A573 V577	S304-R575 PolarHBondContact OG-NH2 2.7Å; R305-R575 VanDerWaalsContact CD-CZ 3.47Å; R305-R575 VanDerWaalsContact CD-NH2 3.3Å; A573-R575 PolarHBondContact O-N 3.15Å; R575-V577 PolarHBondContact O-N 3.01Å
576	T	81.8	Confident	86.6	Confident	34 Å²	34	66.9 Å²	66.9	21%	0.209	37%	0.369	C	S	.	.			trans	-60.9	123.6	160.3	30.6	0	0	0	0	111.1	D355 D750 L752	D355-T576 WeakPolarHBondContact OD2-CG2 3.5Å; D355-T576 PolarHBondContact OD2-N 2.87Å; D355-T576 PolarHBondContact OD2-OG1 2.86Å; T576-D750 WeakPolarHBondContact CA-O 3.06Å; T576-L752 HydrophobicContact CG2-CD1 4.18Å; T576-L752 HydrophobicContact CG2-CG 4.13Å
577	V	79.6	Confident	86.5	Confident	68 Å²	68	68.6 Å²	68.6	41%	0.412	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	126.7	176	178.2	0	0	0	0	109	R575 L579 D750 V751 L752	R575-V577 PolarHBondContact O-N 3.01Å; V577-L579 HydrophobicContact CG1-CD2 4.11Å; V577-D750 PolarHBondContact N-O 2.84Å; V577-D750 VanDerWaalsContact N-O 3.11Å; V577-V751 CarbonylContact O-C 3.38Å; V577-V751 WeakPolarHBondContact O-CA 3.41Å; V577-L752 PolarHBondContact O-N 2.74Å
578	V	82.6	Confident	86.8	Confident	51 Å²	51	72.1 Å²	72.1	31%	0.309	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	114.4	176.7	-175.6	0	0	0	0	109.3	L752 Q754	V578-L752 CarbonylContact C-O 3.58Å; V578-L752 VanDerWaalsContact CA-O 3.3Å; V578-L752 WeakPolarHBondContact CA-O 3.41Å; V578-Q754 HydrophobicContact CG1-CB 3.65Å
579	L	82.1	Confident	87.4	Confident	84 Å²	84	71 Å²	71	44%	0.44	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	132.1	171.8	-64	-174	0	0	0	109.9	V577 V751 L752 Q754	V577-L579 HydrophobicContact CG1-CD2 4.11Å; L579-V751 HydrophobicContact CB-CG1 4.16Å; L579-V751 HydrophobicContact CD1-CG1 3.82Å; L579-V751 HydrophobicContact CD1-CG2 4.22Å; L579-V751 HydrophobicContact CG-CG1 3.78Å; L579-V751 HydrophobicContact CG-CG2 4.46Å; L579-L752 PolarHBondContact N-O 3.19Å; L579-Q754 PolarHBondContact O-N 2.95Å
580	E	85.6	Confident	87.8	Confident	96 Å²	96	69 Å²	69	45%	0.449	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	111.1	175.3	-66.2	-160.7	137.9	0	0	110.4	K739 L756	E580-K739 IonicContact OE1-NZ 2.83Å; E580-K739 PolarHBondContact OE1-NZ 3.34Å; E580-L756 HydrophobicContact CB-CD1 3.83Å; E580-L756 HydrophobicContact CB-CG 4.37Å; E580-L756 HydrophobicContact CG-CD1 4.31Å
581	E	85.3	Confident	88	Confident	100 Å²	100	64 Å²	64	47%	0.467	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	140.7	177.8	-68.7	-171	171.5	0	0	110.8	I753 Q754 P755 L756	E581-I753 HydrophobicContact CB-CG2 3.92Å; E581-I753 HydrophobicContact CG-CG2 3.92Å; E581-Q754 PolarHBondContact N-O 2.82Å; E581-Q754 VanDerWaalsContact N-O 3.17Å; E581-P755 CarbonylContact O-C 3.56Å; E581-P755 WeakPolarHBondContact O-CA 3.49Å; E581-L756 PolarHBondContact O-N 2.7Å
582	Y	85.9	Confident	88.1	Confident	78 Å²	78	64.7 Å²	64.7	31%	0.306	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	127.2	-179.6	-67.7	-100.4	0	0	0	109.9	R649 L756 E758	Y582-R649 PolarHBondContact OH-NH1 2.87Å; Y582-R649 VanDerWaalsContact OH-NH1 3.15Å; Y582-L756 HydrophobicContact CD1-CB 3.96Å; Y582-L756 HydrophobicContact CD1-CD1 4.36Å; Y582-L756 HydrophobicContact CE1-CB 4.08Å; Y582-L756 HydrophobicContact CE1-CD1 3.77Å; Y582-L756 HydrophobicContact CE2-CD1 3.91Å; Y582-L756 HydrophobicContact CG-CB 4.37Å; Y582-E758 HydrophobicContact CD1-CG 4.04Å; Y582-E758 HydrophobicContact CE1-CG 3.96Å
583	R	86.5	Confident	88.3	Confident	98 Å²	98	64.3 Å²	64.3	37%	0.37	33%	0.331	S	S	.	.			trans	-71.8	132	166.4	-66.6	-178.9	179.2	172	-1.1	108.2	F740 E743 P755 L756 L757 Q829	R583-F740 VanDerWaalsContact NH1-CD2 3.28Å; R583-E743 IonicContact CZ-OE1 2.78Å; R583-E743 IonicContact NH2-OE1 2.72Å; R583-E743 PolarHBondContact NH2-OE1 3.44Å; R583-P755 HydrophobicContact CG-CB 4.36Å; R583-L756 PolarHBondContact N-O 3.05Å; R583-L757 HydrophobicContact CB-CD1 3.78Å; R583-Q829 PolarHBondContact O-OE1 2.96Å
584	L	87.6	Confident	88.6	Confident	79 Å²	79	63.4 Å²	63.4	41%	0.414	32%	0.323	S	S	.	.			trans	-125.3	161.1	-174.1	-65.9	175	0	0	0	109.9	R649 H650	L584-R649 HydrophobicContact CD2-CB 4.49Å; L584-H650 HydrophobicContact CD1-CB 4.35Å; L584-H650 HydrophobicContact CD2-CB 4.5Å
585	L	89.6	Confident	89	Confident	13 Å²	13	66.8 Å²	66.8	7%	0.068	34%	0.344	C	S	.	.			trans	-73.5	142	179.2	-169.5	69.5	0	0	0	110.8	Q587 F590 G646 D648 D830 F833	L585-Q587 PolarHBondContact O-N 2.7Å; L585-Q587 PolarHBondContact O-NE2 3.11Å; L585-Q587 VanDerWaalsContact O-NE2 3.11Å; L585-F590 HydrophobicContact CD2-CB 3.91Å; L585-F590 HydrophobicContact CD2-CD2 4.22Å; L585-F590 HydrophobicContact CD2-CG 4.24Å; L585-G646 WeakPolarHBondContact CD2-O 3.33Å; L585-D648 PolarHBondContact N-OD2 3.33Å; L585-D830 WeakPolarHBondContact CD1-OD1 3.42Å; L585-F833 HydrophobicContact CD1-CB 3.8Å; L585-F833 HydrophobicContact CD1-CD1 4.05Å; L585-F833 HydrophobicContact CD1-CG 3.99Å; L585-F833 HydrophobicContact CD2-CD1 3.97Å; L585-F833 HydrophobicContact CD2-CD2 4.21Å; L585-F833 HydrophobicContact CD2-CE1 4.2Å; L585-F833 HydrophobicContact CD2-CE2 4.44Å; L585-F833 HydrophobicContact CD2-CG 3.98Å; L585-F833 HydrophobicContact CD2-CZ 4.43Å
586	S	91.9	Very high	89.5	Confident	47 Å²	47	67.1 Å²	67.1	33%	0.329	35%	0.348	S	S	.	.			trans	-63.5	107.9	175.8	-179.9	0	0	0	0	110.8	K588 L589 F590 D830	S586-K588 PolarHBondContact O-N 3.39Å; S586-K588 VanDerWaalsContact O-N 3.08Å; S586-L589 WeakPolarHBondContact O-CA 3.22Å; S586-L589 WeakPolarHBondContact O-CB 3.36Å; S586-L589 PolarHBondContact O-N 2.85Å; S586-F590 PolarHBondContact O-N 2.86Å; S586-D830 WeakPolarHBondContact CB-OD1 3.22Å; S586-D830 PolarHBondContact N-OD1 2.8Å
587	Q	90.8	Very high	90.1	Very high	68 Å²	68	65.5 Å²	65.5	32%	0.318	34%	0.338	S	S	.	.	H	α-helix	trans	-58	-29.1	-176.3	-59.3	-57	-37.7	0	0	112.9	L585 A591 H651	L585-Q587 PolarHBondContact O-N 2.7Å; L585-Q587 PolarHBondContact O-NE2 3.11Å; L585-Q587 VanDerWaalsContact O-NE2 3.11Å; Q587-A591 VanDerWaalsContact O-CB 3.27Å; Q587-A591 WeakPolarHBondContact O-CB 3.03Å; Q587-A591 PolarHBondContact O-N 2.7Å; Q587-H651 PolarHBondContact OE1-CE1 2.82Å
588	K	92.9	Very high	91	Very high	184 Å²	184	63.3 Å²	63.3	80%	0.8	33%	0.33	S	S	*	.	H	α-helix	trans	-67.2	-39.6	173.7	-64	179.4	-179.2	177.4	0	112.3	S586 S592	S586-K588 PolarHBondContact O-N 3.39Å; S586-K588 VanDerWaalsContact O-N 3.08Å; K588-S592 VanDerWaalsContact O-CB 3.28Å; K588-S592 WeakPolarHBondContact O-CB 3.25Å; K588-S592 PolarHBondContact O-N 3.15Å
589	L	93.3	Very high	91.6	Very high	47 Å²	47	65 Å²	65	25%	0.246	34%	0.337	C	S	.	.	H	α-helix	trans	-69.4	-48.5	175.4	176.9	63.4	0	0	0	110.4	S586 A591 S592 V593 D830 F833 A834	S586-L589 WeakPolarHBondContact O-CA 3.22Å; S586-L589 WeakPolarHBondContact O-CB 3.36Å; S586-L589 PolarHBondContact O-N 2.85Å; L589-A591 PolarHBondContact O-N 2.87Å; L589-S592 PolarHBondContact O-N 3.46Å; L589-V593 HydrophobicContact CD1-CG2 4.04Å; L589-V593 WeakPolarHBondContact O-CB 3.11Å; L589-V593 WeakPolarHBondContact O-CG2 3.3Å; L589-V593 PolarHBondContact O-N 3.41Å; L589-D830 HydrophobicContact CD2-CB 4.12Å; L589-F833 HydrophobicContact CD2-CD1 4.02Å; L589-F833 HydrophobicContact CG-CD1 4.08Å; L589-F833 HydrophobicContact CG-CE1 4.22Å; L589-A834 HydrophobicContact CD1-CB 4.47Å; L589-A834 HydrophobicContact CD2-CB 4.3Å
590	F	94.2	Very high	92.2	Very high	23 Å²	23	61 Å²	61	10%	0.101	32%	0.316	C	S	.	.	H	α-helix	trans	-58.7	-48.1	179.4	179.4	-127.5	0	0	0	112.6	L585 S586 S594 I647 H651 F833	L585-F590 HydrophobicContact CD2-CB 3.91Å; L585-F590 HydrophobicContact CD2-CD2 4.22Å; L585-F590 HydrophobicContact CD2-CG 4.24Å; S586-F590 PolarHBondContact O-N 2.86Å; F590-S594 WeakPolarHBondContact CE2-OG 3.37Å; F590-S594 WeakPolarHBondContact O-CB 2.96Å; F590-S594 PolarHBondContact O-N 3.33Å; F590-S594 PolarHBondContact O-OG 2.92Å; F590-I647 HydrophobicContact CZ-CG1 4.36Å; F590-H651 AromaticContact CD1-CE1 3.74Å; F590-H651 AromaticContact CD1-NE2 3.85Å; F590-H651 AromaticContact CE1-CE1 3.68Å; F590-H651 AromaticContact CE1-NE2 3.52Å; F590-F833 HydrophobicContact CD2-CE1 4.49Å; F590-F833 HydrophobicContact CD2-CE2 4.46Å; F590-F833 AromaticContact CD2-CZ 3.89Å; F590-F833 HydrophobicContact CD2-CZ 3.89Å
591	A	93.1	Very high	92.8	Very high	55 Å²	55	58.2 Å²	58.2	46%	0.455	30%	0.303	S	S	.	.	H	α-helix	trans	-63.4	-46	178.4	0	0	0	0	0	112.3	Q587 L589 S594 V595	Q587-A591 VanDerWaalsContact O-CB 3.27Å; Q587-A591 WeakPolarHBondContact O-CB 3.03Å; Q587-A591 PolarHBondContact O-N 2.7Å; L589-A591 PolarHBondContact O-N 2.87Å; A591-S594 PolarHBondContact O-N 3.12Å; A591-V595 WeakPolarHBondContact O-CG2 3.43Å; A591-V595 PolarHBondContact O-N 3.36Å; A591-V595 VanDerWaalsContact O-N 3.07Å
592	S	94.4	Very high	93.3	Very high	61 Å²	61	58.4 Å²	58.4	43%	0.427	31%	0.307	S	S	.	.	H	α-helix	trans	-58	-52.3	178.3	-179.5	0	0	0	0	111.7	K588 L589 S594 V595 F596	K588-S592 VanDerWaalsContact O-CB 3.28Å; K588-S592 WeakPolarHBondContact O-CB 3.25Å; K588-S592 PolarHBondContact O-N 3.15Å; L589-S592 PolarHBondContact O-N 3.46Å; S592-S594 VanDerWaalsContact C-N 3.33Å; S592-S594 PolarHBondContact O-N 3.31Å; S592-V595 PolarHBondContact O-N 3.12Å; S592-F596 WeakPolarHBondContact O-CD2 3.35Å; S592-F596 PolarHBondContact O-N 2.04Å
593	V	95.2	Very high	93.7	Very high	8 Å²	8	57.2 Å²	57.2	5%	0.048	31%	0.306	C	S	.	.	H	α-helix	trans	-61.7	-40	178.6	166.2	0	0	0	0	111.9	L589 V595 F596 A597 V642 F833 S837	L589-V593 HydrophobicContact CD1-CG2 4.04Å; L589-V593 WeakPolarHBondContact O-CB 3.11Å; L589-V593 WeakPolarHBondContact O-CG2 3.3Å; L589-V593 PolarHBondContact O-N 3.41Å; V593-V595 VanDerWaalsContact C-N 3.33Å; V593-V595 PolarHBondContact O-N 2.62Å; V593-F596 PolarHBondContact O-N 3.42Å; V593-A597 PolarHBondContact O-N 3.29Å; V593-V642 HydrophobicContact CG1-CG1 3.45Å; V593-V642 VanDerWaalsContact CG1-CG1 3.45Å; V593-F833 HydrophobicContact CB-CE1 4Å; V593-F833 HydrophobicContact CB-CZ 4.16Å; V593-F833 HydrophobicContact CG1-CE1 3.94Å; V593-F833 HydrophobicContact CG1-CZ 3.7Å; V593-F833 HydrophobicContact CG2-CE1 4.09Å; V593-S837 VanDerWaalsContact CG1-CB 3.47Å; V593-S837 WeakPolarHBondContact CG1-OG 3.45Å
594	S	94.7	Very high	94.1	Very high	18 Å²	18	52.6 Å²	52.6	13%	0.126	29%	0.288	C	S	.	.	H	α-helix	trans	-63.1	-36.3	177.8	-66.5	0	0	0	0	112.9	F590 A591 S592 A597 G598	F590-S594 WeakPolarHBondContact CE2-OG 3.37Å; F590-S594 WeakPolarHBondContact O-CB 2.96Å; F590-S594 PolarHBondContact O-N 3.33Å; F590-S594 PolarHBondContact O-OG 2.92Å; A591-S594 PolarHBondContact O-N 3.12Å; S592-S594 VanDerWaalsContact C-N 3.33Å; S592-S594 PolarHBondContact O-N 3.31Å; S594-A597 PolarHBondContact O-N 3.09Å; S594-G598 PolarHBondContact O-N 2.98Å
595	V	96.1	Very high	94.5	Very high	92 Å²	92	52.6 Å²	52.6	56%	0.558	29%	0.288	S	S	*	.	H	α-helix	trans	-65.4	-44.1	174.1	170.9	0	0	0	0	111.1	A591 S592 V593 A597 G598 L599	A591-V595 WeakPolarHBondContact O-CG2 3.43Å; A591-V595 PolarHBondContact O-N 3.36Å; A591-V595 VanDerWaalsContact O-N 3.07Å; S592-V595 PolarHBondContact O-N 3.12Å; V593-V595 VanDerWaalsContact C-N 3.33Å; V593-V595 PolarHBondContact O-N 2.62Å; V595-A597 PolarHBondContact O-N 3.48Å; V595-G598 PolarHBondContact O-N 2.79Å; V595-L599 HydrophobicContact CG1-CD1 4.03Å; V595-L599 HydrophobicContact CG1-CG 4.46Å; V595-L599 WeakPolarHBondContact O-CG 3.44Å; V595-L599 PolarHBondContact O-N 2.72Å
596	F	95.6	Very high	94.7	Very high	105 Å²	105	56 Å²	56	46%	0.461	31%	0.309	S	S	.	.	H	α-helix	trans	-64.2	-38.1	175.2	-72.6	-69.6	0	0	0	112.7	S592 V593 G600 V841 Y845	S592-F596 WeakPolarHBondContact O-CD2 3.35Å; S592-F596 PolarHBondContact O-N 2.04Å; V593-F596 PolarHBondContact O-N 3.42Å; F596-G600 PolarHBondContact O-N 3.46Å; F596-V841 HydrophobicContact CB-CG1 4.3Å; F596-Y845 PolarHBondContact O-OH 2.76Å
597	A	96.3	Very high	94.8	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-62.4	-44.9	173.8	0	0	0	0	0	111.9	V593 S594 V595 G600 I601 V642 F643	V593-A597 PolarHBondContact O-N 3.29Å; S594-A597 PolarHBondContact O-N 3.09Å; V595-A597 PolarHBondContact O-N 3.48Å; A597-G600 PolarHBondContact O-N 2.83Å; A597-I601 WeakPolarHBondContact O-CG1 3.43Å; A597-I601 PolarHBondContact O-N 3.45Å; A597-V642 HydrophobicContact CB-CB 4.04Å; A597-V642 HydrophobicContact CB-CG1 4.14Å; A597-V642 HydrophobicContact CB-CG2 4.37Å; A597-F643 HydrophobicContact CB-CZ 4.11Å
598	G	96.5	Very high	94.9	Very high	23 Å²	23	52 Å²	52	24%	0.237	29%	0.286	C	S	.	.	H	α-helix	trans	-62.1	-45	176.3	0	0	0	0	0	113.5	S594 V595 G600 I601 L602	S594-G598 PolarHBondContact O-N 2.98Å; V595-G598 PolarHBondContact O-N 2.79Å; G598-G600 VanDerWaalsContact C-N 3.29Å; G598-G600 PolarHBondContact O-N 2.98Å; G598-I601 PolarHBondContact O-N 2.71Å; G598-L602 WeakPolarHBondContact O-CG 3.22Å; G598-L602 PolarHBondContact O-N 2.8Å
599	L	96.3	Very high	94.9	Very high	86 Å²	86	47 Å²	47	45%	0.45	27%	0.271	S	S	.	.	H	α-helix	trans	-61.6	-36.6	174.3	-71.3	171.2	0	0	0	112.1	V595 L602 L603 Y845	V595-L599 HydrophobicContact CG1-CD1 4.03Å; V595-L599 HydrophobicContact CG1-CG 4.46Å; V595-L599 WeakPolarHBondContact O-CG 3.44Å; V595-L599 PolarHBondContact O-N 2.72Å; L599-L602 PolarHBondContact O-N 3.47Å; L599-L603 PolarHBondContact O-N 3.06Å; L599-Y845 VanDerWaalsContact CB-OH 3.32Å; L599-Y845 WeakPolarHBondContact CB-OH 3.3Å
600	G	95.5	Very high	94.8	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-65.4	-38.6	174.3	0	0	0	0	0	113.2	F596 A597 G598 L603 G604 L639 Y845	F596-G600 PolarHBondContact O-N 3.46Å; A597-G600 PolarHBondContact O-N 2.83Å; G598-G600 VanDerWaalsContact C-N 3.29Å; G598-G600 PolarHBondContact O-N 2.98Å; G600-L603 PolarHBondContact O-N 2.78Å; G600-G604 PolarHBondContact O-N 2.72Å; G600-L639 VanDerWaalsContact C-CD1 3.47Å; G600-Y845 PolarHBondContact N-OH 3.13Å; G600-Y845 VanDerWaalsContact N-OH 3.13Å
601	I	96.9	Very high	94.7	Very high	37 Å²	37	45.2 Å²	45.2	19%	0.19	26%	0.262	C	S	.	.	H	α-helix	trans	-66.2	-43.9	175.4	-68.1	162.8	0	0	0	110.2	A597 G598 L603 G604 I605 M636 L639 A640 F643	A597-I601 WeakPolarHBondContact O-CG1 3.43Å; A597-I601 PolarHBondContact O-N 3.45Å; G598-I601 PolarHBondContact O-N 2.71Å; I601-L603 PolarHBondContact O-N 3.27Å; I601-G604 WeakPolarHBondContact O-CA 3.46Å; I601-G604 PolarHBondContact O-N 3.11Å; I601-G604 VanDerWaalsContact O-N 3.1Å; I601-I605 HydrophobicContact CG2-CD1 4.17Å; I601-I605 WeakPolarHBondContact O-CG1 3.5Å; I601-I605 PolarHBondContact O-N 2.98Å; I601-M636 HydrophobicContact CG2-CG 4.45Å; I601-M636 HydrophobicContact CG2-SD 4.45Å; I601-L639 HydrophobicContact CD1-CB 4.16Å; I601-L639 HydrophobicContact CG1-CB 3.74Å; I601-L639 HydrophobicContact CG1-CD1 4.23Å; I601-A640 HydrophobicContact CD1-CB 4.3Å; I601-F643 HydrophobicContact CD1-CE2 3.95Å
602	L	96.1	Very high	94.6	Very high	104 Å²	104	47.5 Å²	47.5	55%	0.545	27%	0.265	S	S	.	.	H	α-helix	trans	-59.7	-43.4	174.5	-69.2	171	0	0	0	112	G598 L599 G604 I605 V606	G598-L602 WeakPolarHBondContact O-CG 3.22Å; G598-L602 PolarHBondContact O-N 2.8Å; L599-L602 PolarHBondContact O-N 3.47Å; L602-G604 VanDerWaalsContact C-N 3.32Å; L602-G604 PolarHBondContact O-N 3.25Å; L602-I605 PolarHBondContact O-N 3.46Å; L602-V606 WeakPolarHBondContact O-CG2 3.44Å; L602-V606 PolarHBondContact O-N 2.89Å
603	L	94.6	Very high	94.4	Very high	54 Å²	54	54 Å²	54	28%	0.283	28%	0.282	S	S	.	.	H	α-helix	trans	-60.9	-40.7	172.9	178.8	61.8	0	0	0	111.6	L599 G600 I601 V606 C607 Y845	L599-L603 PolarHBondContact O-N 3.06Å; G600-L603 PolarHBondContact O-N 2.78Å; I601-L603 PolarHBondContact O-N 3.27Å; L603-V606 PolarHBondContact O-N 2.82Å; L603-C607 WeakPolarHBondContact O-CB 3.47Å; L603-C607 PolarHBondContact O-N 3.46Å; L603-C607 PolarHBondContact O-SG 3.36Å; L603-Y845 HydrophobicContact CD2-CD1 4.11Å; L603-Y845 HydrophobicContact CD2-CE1 4.15Å
604	G	95	Very high	94	Very high	0 Å²	0	55.1 Å²	55.1	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-59.9	-44.3	174.3	0	0	0	0	0	112.9	G600 I601 L602 C607 L608	G600-G604 PolarHBondContact O-N 2.72Å; I601-G604 WeakPolarHBondContact O-CA 3.46Å; I601-G604 PolarHBondContact O-N 3.11Å; I601-G604 VanDerWaalsContact O-N 3.1Å; L602-G604 VanDerWaalsContact C-N 3.32Å; L602-G604 PolarHBondContact O-N 3.25Å; G604-C607 PolarHBondContact O-N 3.49Å; G604-L608 VanDerWaalsContact O-CB 3.3Å; G604-L608 WeakPolarHBondContact O-CB 3.12Å; G604-L608 PolarHBondContact O-N 2.69Å
605	I	95.5	Very high	93.5	Very high	80 Å²	80	55 Å²	55	41%	0.41	29%	0.289	S	S	.	.	H	α-helix	trans	-61.5	-48.1	175.8	-66.4	167.8	0	0	0	110.5	I601 L602 C607 L608 T609 M636	I601-I605 HydrophobicContact CG2-CD1 4.17Å; I601-I605 WeakPolarHBondContact O-CG1 3.5Å; I601-I605 PolarHBondContact O-N 2.98Å; L602-I605 PolarHBondContact O-N 3.46Å; I605-C607 VanDerWaalsContact C-N 3.34Å; I605-C607 PolarHBondContact O-N 3.34Å; I605-L608 PolarHBondContact O-N 2.8Å; I605-T609 HydrophobicContact CG2-CG2 4.34Å; I605-T609 WeakPolarHBondContact O-CG2 3.1Å; I605-T609 PolarHBondContact O-N 2.84Å; I605-T609 PolarHBondContact O-OG1 3.41Å; I605-M636 HydrophobicContact CG1-SD 3.66Å
606	V	94.3	Very high	92.8	Very high	84 Å²	84	57.6 Å²	57.6	51%	0.509	30%	0.3	S	S	.	.	H	α-helix	trans	-61.5	-41	178.1	171.6	0	0	0	0	111.8	L602 L603 T609 F610	L602-V606 WeakPolarHBondContact O-CG2 3.44Å; L602-V606 PolarHBondContact O-N 2.89Å; L603-V606 PolarHBondContact O-N 2.82Å; V606-T609 PolarHBondContact O-OG1 2.72Å; V606-F610 VanDerWaalsContact O-CB 3.3Å; V606-F610 WeakPolarHBondContact O-CB 3.49Å; V606-F610 PolarHBondContact O-N 3.32Å
607	C	93.1	Very high	92.3	Very high	1 Å²	1	55.1 Å²	55.1	1%	0.007	29%	0.293	C	S	.	.	H	α-helix	trans	-66.1	-38.6	176.7	-66.8	0	0	0	0	111.9	L603 G604 I605 N611 F852	L603-C607 WeakPolarHBondContact O-CB 3.47Å; L603-C607 PolarHBondContact O-N 3.46Å; L603-C607 PolarHBondContact O-SG 3.36Å; G604-C607 PolarHBondContact O-N 3.49Å; I605-C607 VanDerWaalsContact C-N 3.34Å; I605-C607 PolarHBondContact O-N 3.34Å; C607-N611 WeakPolarHBondContact O-CB 3.46Å; C607-N611 PolarHBondContact O-N 2.94Å; C607-N611 VanDerWaalsContact O-N 3.16Å; C607-F852 HydrophobicContact CB-CB 4.04Å; C607-F852 HydrophobicContact CB-CD1 4.13Å; C607-F852 HydrophobicContact CB-CD2 3.73Å; C607-F852 HydrophobicContact CB-CE2 4.18Å; C607-F852 HydrophobicContact CB-CG 3.7Å
608	L	94	Very high	91.4	Very high	31 Å²	31	63.3 Å²	63.3	16%	0.162	32%	0.324	C	S	.	.	H	α-helix	trans	-68.7	-48.1	178	-179.6	61.3	0	0	0	111.8	G604 I605 N611 I612 N629 A632 V633 M636	G604-L608 VanDerWaalsContact O-CB 3.3Å; G604-L608 WeakPolarHBondContact O-CB 3.12Å; G604-L608 PolarHBondContact O-N 2.69Å; I605-L608 PolarHBondContact O-N 2.8Å; L608-N611 PolarHBondContact O-N 3.2Å; L608-I612 HydrophobicContact CD1-CD1 3.83Å; L608-I612 HydrophobicContact CD1-CG1 4.31Å; L608-I612 HydrophobicContact CG-CD1 3.9Å; L608-I612 WeakPolarHBondContact O-CG1 3.48Å; L608-I612 PolarHBondContact O-N 3.26Å; L608-N629 HydrophobicContact CD1-CB 3.64Å; L608-N629 WeakPolarHBondContact CD1-OD1 3.43Å; L608-A632 HydrophobicContact CB-CB 4.42Å; L608-V633 HydrophobicContact CD2-CG2 4.12Å; L608-M636 HydrophobicContact CD2-CE 3.83Å
609	T	92.7	Very high	90.6	Very high	79 Å²	79	65.2 Å²	65.2	49%	0.485	33%	0.325	S	S	.	.	H	α-helix	trans	-64.4	-41.4	178.6	54.9	0	0	0	0	111.6	I605 V606 N611 I612 Y613	I605-T609 HydrophobicContact CG2-CG2 4.34Å; I605-T609 WeakPolarHBondContact O-CG2 3.1Å; I605-T609 PolarHBondContact O-N 2.84Å; I605-T609 PolarHBondContact O-OG1 3.41Å; V606-T609 PolarHBondContact O-OG1 2.72Å; T609-N611 VanDerWaalsContact C-N 3.35Å; T609-N611 PolarHBondContact O-N 2.96Å; T609-I612 PolarHBondContact O-N 3.15Å; T609-Y613 VanDerWaalsContact O-CB 3.27Å; T609-Y613 WeakPolarHBondContact O-CB 3.3Å; T609-Y613 PolarHBondContact O-N 3.49Å
610	F	91.6	Very high	90	Very high	31 Å²	31	61.2 Å²	61.2	14%	0.136	30%	0.304	C	S	.	.	H	α-helix	trans	-56.8	-46	172.9	173	-90.4	0	0	0	112.4	V606 N614 I620 K855 M856 L859	V606-F610 VanDerWaalsContact O-CB 3.3Å; V606-F610 WeakPolarHBondContact O-CB 3.49Å; V606-F610 PolarHBondContact O-N 3.32Å; F610-N614 VanDerWaalsContact CD2-ND2 3.33Å; F610-N614 WeakPolarHBondContact CD2-ND2 3.47Å; F610-N614 VanDerWaalsContact CE2-ND2 3.32Å; F610-N614 WeakPolarHBondContact CE2-ND2 3.41Å; F610-N614 WeakPolarHBondContact O-CB 3.49Å; F610-N614 PolarHBondContact O-N 3.04Å; F610-N614 VanDerWaalsContact O-N 3.1Å; F610-N614 PolarHBondContact O-ND2 3.05Å; F610-I620 HydrophobicContact CE1-CD1 4.1Å; F610-I620 HydrophobicContact CZ-CD1 4.35Å; F610-K855 HydrophobicContact CE1-CB 4.41Å; F610-M856 HydrophobicContact CB-SD 4.48Å; F610-M856 HydrophobicContact CD1-CG 3.54Å; F610-M856 HydrophobicContact CD1-SD 4.34Å; F610-M856 HydrophobicContact CD2-CG 3.86Å; F610-M856 HydrophobicContact CD2-SD 4.4Å; F610-M856 HydrophobicContact CE1-CB 4.38Å; F610-M856 HydrophobicContact CE1-CG 3.52Å; F610-M856 HydrophobicContact CE2-CB 4.39Å; F610-M856 HydrophobicContact CE2-CG 3.83Å; F610-M856 HydrophobicContact CG-CG 3.73Å; F610-M856 HydrophobicContact CG-SD 4.13Å; F610-M856 HydrophobicContact CZ-CB 4.19Å; F610-M856 HydrophobicContact CZ-CG 3.68Å; F610-L859 HydrophobicContact CE2-CD2 3.95Å; F610-L859 HydrophobicContact CZ-CB 4.28Å; F610-L859 HydrophobicContact CZ-CD2 3.65Å
611	N	90.8	Very high	89.4	Confident	1 Å²	1	65.8 Å²	65.8	1%	0.005	33%	0.325	C	S	.	.	H	α-helix	trans	-75.9	-25.4	-175.8	-170.9	73.1	0	0	0	113.2	C607 L608 T609 G615 P625 N629 F852	C607-N611 WeakPolarHBondContact O-CB 3.46Å; C607-N611 PolarHBondContact O-N 2.94Å; C607-N611 VanDerWaalsContact O-N 3.16Å; L608-N611 PolarHBondContact O-N 3.2Å; T609-N611 VanDerWaalsContact C-N 3.35Å; T609-N611 PolarHBondContact O-N 2.96Å; N611-G615 PolarHBondContact O-N 2.83Å; N611-P625 PolarHBondContact ND2-O 3.15Å; N611-P625 VanDerWaalsContact ND2-O 3.14Å; N611-N629 PolarHBondContact ND2-OD1 3.17Å; N611-F852 HydrophobicContact CB-CD1 4.16Å; N611-F852 HydrophobicContact CB-CE1 3.69Å
612	I	91.1	Very high	88.6	Confident	103 Å²	103	66 Å²	66	53%	0.528	33%	0.326	S	S	.	.	H	α-helix	trans	-74.8	-53.2	169.9	-68.7	168.8	0	0	0	110.5	L608 T609 N614 G615	L608-I612 HydrophobicContact CD1-CD1 3.83Å; L608-I612 HydrophobicContact CD1-CG1 4.31Å; L608-I612 HydrophobicContact CG-CD1 3.9Å; L608-I612 WeakPolarHBondContact O-CG1 3.48Å; L608-I612 PolarHBondContact O-N 3.26Å; T609-I612 PolarHBondContact O-N 3.15Å; I612-N614 VanDerWaalsContact C-N 3.34Å; I612-N614 PolarHBondContact O-N 2.77Å; I612-G615 PolarHBondContact O-N 2.91Å
613	Y	90.9	Very high	87.8	Confident	198 Å²	198	61 Å²	61	78%	0.776	30%	0.3	S	S	*	.	H	α-helix	trans	-58	-44.8	-176.6	-178	-94	0	0	0	112.2	T609 G615	T609-Y613 VanDerWaalsContact O-CB 3.27Å; T609-Y613 WeakPolarHBondContact O-CB 3.3Å; T609-Y613 PolarHBondContact O-N 3.49Å; Y613-G615 VanDerWaalsContact C-N 3.27Å; Y613-G615 PolarHBondContact O-N 3.13Å
614	N	87.5	Confident	87.4	Confident	31 Å²	31	60.2 Å²	60.2	17%	0.166	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.5	13.7	178.8	-58.4	-79.5	0	0	0	113.2	F610 I612 N616 V617 I620 L859	F610-N614 VanDerWaalsContact CD2-ND2 3.33Å; F610-N614 WeakPolarHBondContact CD2-ND2 3.47Å; F610-N614 VanDerWaalsContact CE2-ND2 3.32Å; F610-N614 WeakPolarHBondContact CE2-ND2 3.41Å; F610-N614 WeakPolarHBondContact O-CB 3.49Å; F610-N614 PolarHBondContact O-N 3.04Å; F610-N614 VanDerWaalsContact O-N 3.1Å; F610-N614 PolarHBondContact O-ND2 3.05Å; I612-N614 VanDerWaalsContact C-N 3.34Å; I612-N614 PolarHBondContact O-N 2.77Å; N614-N616 PolarHBondContact O-N 2.85Å; N614-N616 VanDerWaalsContact O-N 3.08Å; N614-V617 HydrophobicContact CB-CG2 4.35Å; N614-V617 WeakPolarHBondContact O-CB 3.26Å; N614-V617 WeakPolarHBondContact O-CG2 3.46Å; N614-V617 PolarHBondContact O-N 3.07Å; N614-I620 HydrophobicContact CB-CD1 3.44Å; N614-I620 VanDerWaalsContact CB-CD1 3.44Å; N614-L859 HydrophobicContact CB-CD2 3.92Å; N614-L859 WeakPolarHBondContact OD1-CD2 3.28Å
615	G	82.5	Confident	87	Confident	16 Å²	16	61 Å²	61	17%	0.165	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-17.5	-174.6	0	0	0	0	0	115.3	N611 I612 Y613 Q621	N611-G615 PolarHBondContact O-N 2.83Å; I612-G615 PolarHBondContact O-N 2.91Å; Y613-G615 VanDerWaalsContact C-N 3.27Å; Y613-G615 PolarHBondContact O-N 3.13Å; G615-Q621 WeakPolarHBondContact O-CG 3.31Å; G615-Q621 PolarHBondContact O-NE2 3.31Å
616	N	81.8	Confident	86.7	Confident	145 Å²	145	64.4 Å²	64.4	78%	0.775	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.9	-12.5	176.1	-68.3	-22.2	0	0	0	113.8	N614 R618 Q621	N614-N616 PolarHBondContact O-N 2.85Å; N614-N616 VanDerWaalsContact O-N 3.08Å; N616-R618 PolarHBondContact O-N 2.76Å; N616-Q621 PolarHBondContact O-NE2 2.88Å
617	V	84.7	Confident	86.4	Confident	54 Å²	54	60.5 Å²	60.5	33%	0.327	29%	0.285	S	S	.	.	S	Bend	trans	-74.7	125.1	-179.6	-179	0	0	0	0	109.9	N614 Y619 I620 Q621 L859	N614-V617 HydrophobicContact CB-CG2 4.35Å; N614-V617 WeakPolarHBondContact O-CB 3.26Å; N614-V617 WeakPolarHBondContact O-CG2 3.46Å; N614-V617 PolarHBondContact O-N 3.07Å; V617-Y619 PolarHBondContact O-N 2.94Å; V617-I620 WeakPolarHBondContact O-CA 3.39Å; V617-I620 PolarHBondContact O-N 3.44Å; V617-Q621 PolarHBondContact O-N 3.17Å; V617-L859 HydrophobicContact CG1-CD1 4.12Å; V617-L859 HydrophobicContact CG2-CD1 4.45Å
618	R	78	Confident	86.3	Confident	171 Å²	171	60.6 Å²	60.6	65%	0.645	29%	0.286	S	S	*	.	H	α-helix	trans	-49.5	-36.6	-178.1	-177.1	172.2	167.4	179.2	-7.2	113.8	N616 I620 N622 E796	N616-R618 PolarHBondContact O-N 2.76Å; R618-I620 PolarHBondContact O-N 3.26Å; R618-N622 WeakPolarHBondContact O-CB 3.47Å; R618-N622 VanDerWaalsContact O-CG 3.26Å; R618-N622 PolarHBondContact O-N 3.27Å; R618-N622 PolarHBondContact O-OD1 2.86Å; R618-N622 VanDerWaalsContact O-OD1 3.13Å; R618-E796 IonicContact NH2-OE1 2.7Å
619	Y	80.6	Confident	86.3	Confident	64 Å²	64	60.2 Å²	60.2	25%	0.251	28%	0.284	S	S	.	.	H	α-helix	trans	-64.7	-35.7	175.1	-174.2	-98.1	0	0	0	113.6	V617 N799 K855 R858	V617-Y619 PolarHBondContact O-N 2.94Å; Y619-N799 VanDerWaalsContact CD2-ND2 3.33Å; Y619-N799 WeakPolarHBondContact CD2-ND2 3.05Å; Y619-N799 HydrophobicContact CE2-CB 4.39Å; Y619-N799 WeakPolarHBondContact CE2-ND2 3.39Å; Y619-N799 PolarHBondContact O-ND2 2.68Å; Y619-K855 HydrophobicContact CE1-CG 4.49Å; Y619-R858 VanDerWaalsContact CE2-NH1 3.29Å; Y619-R858 VanDerWaalsContact CZ-CD 3.45Å; Y619-R858 WeakPolarHBondContact OH-CD 3.48Å; Y619-R858 PolarHBondContact OH-NH1 2.97Å
620	I	83.3	Confident	86.4	Confident	2 Å²	2	59 Å²	59	1%	0.01	27%	0.273	C	S	.	.	H	α-helix	trans	-81.1	-37.5	178.4	-72.9	171.3	0	0	0	110.5	F610 N614 V617 R618 N622 S623 P625 L859	F610-I620 HydrophobicContact CE1-CD1 4.1Å; F610-I620 HydrophobicContact CZ-CD1 4.35Å; N614-I620 HydrophobicContact CB-CD1 3.44Å; N614-I620 VanDerWaalsContact CB-CD1 3.44Å; V617-I620 WeakPolarHBondContact O-CA 3.39Å; V617-I620 PolarHBondContact O-N 3.44Å; R618-I620 PolarHBondContact O-N 3.26Å; I620-N622 PolarHBondContact O-N 3.01Å; I620-S623 WeakPolarHBondContact O-CA 3.41Å; I620-S623 WeakPolarHBondContact O-CB 3.42Å; I620-S623 PolarHBondContact O-N 3.49Å; I620-S623 PolarHBondContact O-OG 2.81Å; I620-P625 HydrophobicContact CG2-CB 4.09Å; I620-P625 WeakPolarHBondContact O-CD 3.32Å; I620-L859 HydrophobicContact CD1-CD2 4.26Å
621	Q	81.6	Confident	86.5	Confident	96 Å²	96	57.7 Å²	57.7	45%	0.449	27%	0.268	S	S	.	.	H	α-helix	trans	-57.8	-47	171.2	-67.2	-177.6	-16.7	0	0	112	G615 N616 V617 S623 Q624	G615-Q621 WeakPolarHBondContact O-CG 3.31Å; G615-Q621 PolarHBondContact O-NE2 3.31Å; N616-Q621 PolarHBondContact O-NE2 2.88Å; V617-Q621 PolarHBondContact O-N 3.17Å; Q621-S623 PolarHBondContact O-N 2.89Å; Q621-Q624 PolarHBondContact O-N 3.34Å
622	N	80.3	Confident	86.7	Confident	41 Å²	41	57.6 Å²	57.6	22%	0.219	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-0.3	172.4	-70.3	23.1	0	0	0	113.7	R618 I620 E796 K797 I798 N799	R618-N622 WeakPolarHBondContact O-CB 3.47Å; R618-N622 VanDerWaalsContact O-CG 3.26Å; R618-N622 PolarHBondContact O-N 3.27Å; R618-N622 PolarHBondContact O-OD1 2.86Å; R618-N622 VanDerWaalsContact O-OD1 3.13Å; I620-N622 PolarHBondContact O-N 3.01Å; N622-E796 PolarHBondContact ND2-O 2.93Å; N622-K797 VanDerWaalsContact O-O 3.13Å; N622-I798 VanDerWaalsContact O-CA 3.26Å; N622-I798 WeakPolarHBondContact O-CA 3.35Å; N622-N799 PolarHBondContact O-N 2.8Å; N622-N799 PolarHBondContact O-OD1 2.9Å
623	S	81	Confident	87	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.9	7.6	171.1	87.7	0	0	0	0	113.1	I620 Q621 N628 K682 N799 K855	I620-S623 WeakPolarHBondContact O-CA 3.41Å; I620-S623 WeakPolarHBondContact O-CB 3.42Å; I620-S623 PolarHBondContact O-N 3.49Å; I620-S623 PolarHBondContact O-OG 2.81Å; Q621-S623 PolarHBondContact O-N 2.89Å; S623-N628 PolarHBondContact O-ND2 3.47Å; S623-N628 PolarHBondContact OG-ND2 3.37Å; S623-K682 PolarHBondContact O-NZ 3.49Å; S623-N799 WeakPolarHBondContact CA-OD1 3.38Å; S623-N799 VanDerWaalsContact CB-OD1 3.27Å; S623-N799 WeakPolarHBondContact CB-OD1 3.42Å; S623-K855 PolarHBondContact OG-NZ 3.29Å
624	Q	85	Confident	87.2	Confident	37 Å²	37	45.9 Å²	45.9	17%	0.173	22%	0.221	C	C	.	.			trans	52.3	71.5	-175.1	-66.2	-177	-26	0	0	112.4	Q621 Y626 L627 N628 I798	Q621-Q624 PolarHBondContact O-N 3.34Å; Q624-Y626 VanDerWaalsContact C-N 3.32Å; Q624-Y626 PolarHBondContact O-N 3.05Å; Q624-L627 HydrophobicContact CB-CD1 4.49Å; Q624-L627 PolarHBondContact O-N 3.11Å; Q624-L627 VanDerWaalsContact O-N 3.16Å; Q624-N628 PolarHBondContact O-N 2.8Å; Q624-N628 PolarHBondContact O-ND2 2.94Å; Q624-I798 VanDerWaalsContact CD-CD1 3.46Å; Q624-I798 HydrophobicContact CG-CD1 4.24Å; Q624-I798 HydrophobicContact CG-CG1 4.3Å
625	P	86.6	Confident	87.6	Confident	17 Å²	17	44.6 Å²	44.6	11%	0.11	22%	0.215	C	C	.	.	H	α-helix	trans	-60.7	-37.3	-164.2	22.1	-31.9	0	0	0	113.4	N611 I620 L627 N628 N629	N611-P625 PolarHBondContact ND2-O 3.15Å; N611-P625 VanDerWaalsContact ND2-O 3.14Å; I620-P625 HydrophobicContact CG2-CB 4.09Å; I620-P625 WeakPolarHBondContact O-CD 3.32Å; P625-L627 PolarHBondContact O-N 2.9Å; P625-N628 PolarHBondContact O-N 3.08Å; P625-N628 VanDerWaalsContact O-N 3.17Å; P625-N629 PolarHBondContact O-N 2.87Å; P625-N629 PolarHBondContact O-OD1 2.86Å
626	Y	88.6	Confident	88.3	Confident	151 Å²	151	45.2 Å²	45.2	59%	0.592	21%	0.214	S	C	*	.	H	α-helix	trans	-61	-38.7	178.7	-63.7	-77.9	0	0	0	113.7	Q624 N629 M630 Y710	Q624-Y626 VanDerWaalsContact C-N 3.32Å; Q624-Y626 PolarHBondContact O-N 3.05Å; Y626-N629 WeakPolarHBondContact O-CB 3.27Å; Y626-N629 PolarHBondContact O-N 2.91Å; Y626-M630 WeakPolarHBondContact O-CG 3.3Å; Y626-M630 PolarHBondContact O-N 2.88Å; Y626-Y710 WeakPolarHBondContact CB-OH 3.01Å; Y626-Y710 VanDerWaalsContact CD2-OH 3.27Å; Y626-Y710 WeakPolarHBondContact CD2-OH 3.31Å
627	L	89.4	Confident	88.9	Confident	2 Å²	2	41.2 Å²	41.2	1%	0.01	19%	0.191	C	C	.	.	H	α-helix	trans	-68.1	-38	175.7	-71.3	179.4	0	0	0	111.2	Q624 P625 N629 M630 T631 K682 L709 Y710 V713	Q624-L627 HydrophobicContact CB-CD1 4.49Å; Q624-L627 PolarHBondContact O-N 3.11Å; Q624-L627 VanDerWaalsContact O-N 3.16Å; P625-L627 PolarHBondContact O-N 2.9Å; L627-N629 VanDerWaalsContact C-N 3.32Å; L627-N629 PolarHBondContact O-N 2.83Å; L627-M630 HydrophobicContact CD2-SD 4.17Å; L627-M630 WeakPolarHBondContact O-CB 3.34Å; L627-M630 PolarHBondContact O-N 3.03Å; L627-T631 PolarHBondContact O-N 3.38Å; L627-T631 PolarHBondContact O-OG1 3.4Å; L627-K682 HydrophobicContact CD1-CB 4.17Å; L627-L709 HydrophobicContact CD1-CB 4.32Å; L627-L709 HydrophobicContact CD1-CD2 3.83Å; L627-Y710 HydrophobicContact CD2-CD1 4.06Å; L627-Y710 HydrophobicContact CD2-CE1 4.15Å; L627-Y710 HydrophobicContact CG-CE1 4.34Å; L627-V713 HydrophobicContact CD2-CG2 3.88Å
628	N	91	Very high	89.4	Confident	2 Å²	2	39.3 Å²	39.3	1%	0.011	18%	0.181	C	C	.	.	H	α-helix	trans	-66.5	-35.6	174.9	-46.9	-45.3	0	0	0	111.4	S623 Q624 P625 T631 A632 K682 F852 K855	S623-N628 PolarHBondContact O-ND2 3.47Å; S623-N628 PolarHBondContact OG-ND2 3.37Å; Q624-N628 PolarHBondContact O-N 2.8Å; Q624-N628 PolarHBondContact O-ND2 2.94Å; P625-N628 PolarHBondContact O-N 3.08Å; P625-N628 VanDerWaalsContact O-N 3.17Å; N628-T631 WeakPolarHBondContact O-CB 3.47Å; N628-T631 PolarHBondContact O-N 3Å; N628-A632 PolarHBondContact O-N 3.32Å; N628-K682 PolarHBondContact OD1-NZ 3.09Å; N628-F852 HydrophobicContact CB-CE1 4.08Å; N628-F852 HydrophobicContact CB-CZ 3.88Å; N628-K855 PolarHBondContact ND2-NZ 3.39Å
629	N	93.6	Very high	90.3	Very high	24 Å²	24	31.1 Å²	31.1	13%	0.128	15%	0.15	C	C	.	.	H	α-helix	trans	-61.2	-44.7	172.4	-69.1	-8.2	0	0	0	110.8	L608 N611 P625 Y626 L627 T631 A632 V633	L608-N629 HydrophobicContact CD1-CB 3.64Å; L608-N629 WeakPolarHBondContact CD1-OD1 3.43Å; N611-N629 PolarHBondContact ND2-OD1 3.17Å; P625-N629 PolarHBondContact O-N 2.87Å; P625-N629 PolarHBondContact O-OD1 2.86Å; Y626-N629 WeakPolarHBondContact O-CB 3.27Å; Y626-N629 PolarHBondContact O-N 2.91Å; L627-N629 VanDerWaalsContact C-N 3.32Å; L627-N629 PolarHBondContact O-N 2.83Å; N629-T631 VanDerWaalsContact C-N 3.33Å; N629-T631 PolarHBondContact O-N 3.13Å; N629-A632 PolarHBondContact O-N 2.98Å; N629-V633 WeakPolarHBondContact O-CG2 3.42Å; N629-V633 PolarHBondContact O-N 3.3Å
630	M	93.9	Very high	91	Very high	53 Å²	53	29.4 Å²	29.4	26%	0.261	15%	0.148	S	C	.	.	H	α-helix	trans	-60.2	-41.8	172.7	-65.8	175.4	90.6	0	0	111.2	Y626 L627 A632 V633 G634 L674 Y710 V713	Y626-M630 WeakPolarHBondContact O-CG 3.3Å; Y626-M630 PolarHBondContact O-N 2.88Å; L627-M630 HydrophobicContact CD2-SD 4.17Å; L627-M630 WeakPolarHBondContact O-CB 3.34Å; L627-M630 PolarHBondContact O-N 3.03Å; M630-A632 PolarHBondContact O-N 3.37Å; M630-V633 PolarHBondContact O-N 3.02Å; M630-G634 PolarHBondContact O-N 3.13Å; M630-L674 HydrophobicContact CB-CD1 3.93Å; M630-L674 HydrophobicContact CE-CD1 3.77Å; M630-L674 HydrophobicContact CG-CD1 4.32Å; M630-L674 WeakPolarHBondContact O-CG 3.38Å; M630-Y710 HydrophobicContact SD-CD1 4.39Å; M630-V713 HydrophobicContact CE-CB 4.24Å; M630-V713 HydrophobicContact CE-CG1 3.65Å; M630-V713 HydrophobicContact SD-CG1 4.48Å
631	T	94.3	Very high	91.6	Very high	3 Å²	3	29.3 Å²	29.3	2%	0.018	15%	0.148	C	C	.	.	H	α-helix	trans	-58.4	-47.8	174.2	-44.8	0	0	0	0	111.9	L627 N628 N629 V633 G634 C635 S678 M679 T847 L851	L627-T631 PolarHBondContact O-N 3.38Å; L627-T631 PolarHBondContact O-OG1 3.4Å; N628-T631 WeakPolarHBondContact O-CB 3.47Å; N628-T631 PolarHBondContact O-N 3Å; N629-T631 VanDerWaalsContact C-N 3.33Å; N629-T631 PolarHBondContact O-N 3.13Å; T631-V633 PolarHBondContact O-N 3.27Å; T631-G634 PolarHBondContact O-N 3.49Å; T631-C635 PolarHBondContact O-N 2.84Å; T631-C635 PolarHBondContact O-SG 2.86Å; T631-C635 VanDerWaalsContact O-SG 3.35Å; T631-S678 WeakPolarHBondContact CA-OG 3.3Å; T631-S678 PolarHBondContact N-OG 3.12Å; T631-S678 PolarHBondContact OG1-OG 3.15Å; T631-M679 HydrophobicContact CG2-CE 4.17Å; T631-M679 HydrophobicContact CG2-CG 3.76Å; T631-M679 HydrophobicContact CG2-SD 3.92Å; T631-T847 HydrophobicContact CG2-CG2 3.81Å; T631-L851 HydrophobicContact CG2-CD1 3.8Å
632	A	95.2	Very high	92.3	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-62.6	-43.1	179.4	0	0	0	0	0	112.5	L608 N628 N629 M630 C635 M636 L848 F852	L608-A632 HydrophobicContact CB-CB 4.42Å; N628-A632 PolarHBondContact O-N 3.32Å; N629-A632 PolarHBondContact O-N 2.98Å; M630-A632 PolarHBondContact O-N 3.37Å; A632-C635 PolarHBondContact O-N 2.91Å; A632-M636 WeakPolarHBondContact O-CG 3.32Å; A632-M636 PolarHBondContact O-N 3.13Å; A632-L848 HydrophobicContact CB-CD2 4.17Å; A632-F852 HydrophobicContact CB-CE2 4.13Å; A632-F852 HydrophobicContact CB-CZ 4.07Å
633	V	96.4	Very high	92.9	Very high	54 Å²	54	26.2 Å²	26.2	33%	0.327	13%	0.131	S	C	.	.	H	α-helix	trans	-63.6	-42.7	175.8	175.3	0	0	0	0	111.2	L608 N629 M630 T631 C635 M636 M637 L674	L608-V633 HydrophobicContact CD2-CG2 4.12Å; N629-V633 WeakPolarHBondContact O-CG2 3.42Å; N629-V633 PolarHBondContact O-N 3.3Å; M630-V633 PolarHBondContact O-N 3.02Å; T631-V633 PolarHBondContact O-N 3.27Å; V633-C635 PolarHBondContact O-N 3.09Å; V633-M636 HydrophobicContact CB-CE 4.46Å; V633-M636 HydrophobicContact CG2-CE 4.04Å; V633-M636 PolarHBondContact O-N 3.44Å; V633-M637 HydrophobicContact CG1-SD 4.26Å; V633-M637 WeakPolarHBondContact O-CG 3.32Å; V633-M637 PolarHBondContact O-N 3.13Å; V633-L674 HydrophobicContact CB-CD2 4.08Å; V633-L674 HydrophobicContact CG1-CD2 3.73Å
634	G	95.8	Very high	93.5	Very high	0 Å²	0	27 Å²	27	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-61	-42.6	174.8	0	0	0	0	0	113	M630 T631 M636 M637 A638 G671	M630-G634 PolarHBondContact O-N 3.13Å; T631-G634 PolarHBondContact O-N 3.49Å; G634-M636 PolarHBondContact O-N 2.85Å; G634-M637 PolarHBondContact O-N 3.39Å; G634-A638 WeakPolarHBondContact O-CB 3.15Å; G634-A638 PolarHBondContact O-N 2.6Å; G634-G671 CarbonylContact C-O 3.43Å; G634-G671 WeakPolarHBondContact CA-O 3.05Å; G634-G671 CarbonylContact O-C 3.35Å
635	C	96	Very high	93.7	Very high	5 Å²	5	27.4 Å²	27.4	3%	0.034	14%	0.139	C	C	.	.	H	α-helix	trans	-61.6	-41.5	173.5	-69.9	0	0	0	0	112.4	T631 A632 V633 A638 L639 A844 L848	T631-C635 PolarHBondContact O-N 2.84Å; T631-C635 PolarHBondContact O-SG 2.86Å; T631-C635 VanDerWaalsContact O-SG 3.35Å; A632-C635 PolarHBondContact O-N 2.91Å; V633-C635 PolarHBondContact O-N 3.09Å; C635-A638 PolarHBondContact O-N 2.9Å; C635-L639 WeakPolarHBondContact O-CB 3.37Å; C635-L639 VanDerWaalsContact O-CG 3.28Å; C635-L639 WeakPolarHBondContact O-CG 3.34Å; C635-L639 PolarHBondContact O-N 2.92Å; C635-A844 HydrophobicContact CB-CB 4.2Å; C635-L848 HydrophobicContact CB-CD1 4.46Å; C635-L848 HydrophobicContact CB-CD2 4.32Å; C635-L848 HydrophobicContact CB-CG 4.3Å
636	M	96.4	Very high	93.9	Very high	29 Å²	29	26.7 Å²	26.7	14%	0.143	14%	0.135	C	C	.	.	H	α-helix	trans	-66.2	-39.6	176.1	-69.3	-174.7	-64	0	0	112.4	I601 I605 L608 A632 V633 G634 L639 A640	I601-M636 HydrophobicContact CG2-CG 4.45Å; I601-M636 HydrophobicContact CG2-SD 4.45Å; I605-M636 HydrophobicContact CG1-SD 3.66Å; L608-M636 HydrophobicContact CD2-CE 3.83Å; A632-M636 WeakPolarHBondContact O-CG 3.32Å; A632-M636 PolarHBondContact O-N 3.13Å; V633-M636 HydrophobicContact CB-CE 4.46Å; V633-M636 HydrophobicContact CG2-CE 4.04Å; V633-M636 PolarHBondContact O-N 3.44Å; G634-M636 PolarHBondContact O-N 2.85Å; M636-L639 PolarHBondContact O-N 3.19Å; M636-A640 WeakPolarHBondContact O-CB 3.22Å; M636-A640 PolarHBondContact O-N 3.4Å
637	M	95.6	Very high	93.9	Very high	61 Å²	61	21.4 Å²	21.4	30%	0.3	12%	0.117	S	C	.	.	H	α-helix	trans	-63.7	-42.6	173.9	-72.2	176.1	66.9	0	0	112.3	V633 G634 A640 A641 L670 L674	V633-M637 HydrophobicContact CG1-SD 4.26Å; V633-M637 WeakPolarHBondContact O-CG 3.32Å; V633-M637 PolarHBondContact O-N 3.13Å; G634-M637 PolarHBondContact O-N 3.39Å; M637-A640 PolarHBondContact O-N 3.14Å; M637-A641 PolarHBondContact O-N 3.2Å; M637-A641 VanDerWaalsContact O-N 3.17Å; M637-L670 HydrophobicContact CE-CB 3.89Å; M637-L674 HydrophobicContact SD-CD2 3.96Å
638	A	95.3	Very high	93.8	Very high	13 Å²	13	21.9 Å²	21.9	11%	0.107	12%	0.12	C	C	.	.	H	α-helix	trans	-64.1	-44.3	176.6	0	0	0	0	0	111.6	G634 C635 A640 A641 I840	G634-A638 WeakPolarHBondContact O-CB 3.15Å; G634-A638 PolarHBondContact O-N 2.6Å; C635-A638 PolarHBondContact O-N 2.9Å; A638-A640 VanDerWaalsContact C-N 3.3Å; A638-A640 PolarHBondContact O-N 3.49Å; A638-A641 VanDerWaalsContact O-CB 3.26Å; A638-A641 WeakPolarHBondContact O-CB 3.38Å; A638-A641 PolarHBondContact O-N 2.82Å; A638-A641 VanDerWaalsContact O-N 3.1Å; A638-I840 HydrophobicContact CB-CG2 4.36Å; A638-I840 VanDerWaalsContact O-CG2 3.29Å; A638-I840 WeakPolarHBondContact O-CG2 3.38Å
639	L	96.2	Very high	93.4	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-61	-38.1	173.3	-72.5	165.6	0	0	0	112.1	G600 I601 C635 M636 A641 V642 V841 A844	G600-L639 VanDerWaalsContact C-CD1 3.47Å; I601-L639 HydrophobicContact CD1-CB 4.16Å; I601-L639 HydrophobicContact CG1-CB 3.74Å; I601-L639 HydrophobicContact CG1-CD1 4.23Å; C635-L639 WeakPolarHBondContact O-CB 3.37Å; C635-L639 VanDerWaalsContact O-CG 3.28Å; C635-L639 WeakPolarHBondContact O-CG 3.34Å; C635-L639 PolarHBondContact O-N 2.92Å; M636-L639 PolarHBondContact O-N 3.19Å; L639-A641 PolarHBondContact O-N 2.94Å; L639-V642 VanDerWaalsContact O-CB 3.31Å; L639-V642 WeakPolarHBondContact O-CB 3.31Å; L639-V642 WeakPolarHBondContact O-CG2 3.33Å; L639-V642 PolarHBondContact O-N 2.03Å; L639-V841 HydrophobicContact CD2-CB 4.45Å; L639-V841 HydrophobicContact CD2-CG2 4.01Å; L639-A844 HydrophobicContact CD1-CB 3.92Å; L639-A844 HydrophobicContact CD2-CB 3.93Å; L639-A844 HydrophobicContact CG-CB 3.76Å
640	A	95.8	Very high	93	Very high	27 Å²	27	31.3 Å²	31.3	22%	0.223	16%	0.158	C	C	.	.	H	α-helix	trans	-66.6	-20.8	175.6	0	0	0	0	0	113.6	I601 M636 M637 A638 V642 F643 P644 L667	I601-A640 HydrophobicContact CD1-CB 4.3Å; M636-A640 WeakPolarHBondContact O-CB 3.22Å; M636-A640 PolarHBondContact O-N 3.4Å; M637-A640 PolarHBondContact O-N 3.14Å; A638-A640 VanDerWaalsContact C-N 3.3Å; A638-A640 PolarHBondContact O-N 3.49Å; A640-V642 PolarHBondContact O-N 3.32Å; A640-F643 WeakPolarHBondContact O-CD2 3.31Å; A640-P644 WeakPolarHBondContact O-CD 3.11Å; A640-L667 HydrophobicContact CB-CD2 4.08Å
641	A	95.5	Very high	92.5	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-18.5	174	0	0	0	0	0	113.3	M637 A638 L639 F643 P644 L645 L667 L668	M637-A641 PolarHBondContact O-N 3.2Å; M637-A641 VanDerWaalsContact O-N 3.17Å; A638-A641 VanDerWaalsContact O-CB 3.26Å; A638-A641 WeakPolarHBondContact O-CB 3.38Å; A638-A641 PolarHBondContact O-N 2.82Å; A638-A641 VanDerWaalsContact O-N 3.1Å; L639-A641 PolarHBondContact O-N 2.94Å; A641-F643 VanDerWaalsContact C-N 3.34Å; A641-F643 PolarHBondContact O-N 2.64Å; A641-P644 VanDerWaalsContact O-CD 3.31Å; A641-P644 WeakPolarHBondContact O-CD 3.34Å; A641-P644 WeakPolarHBondContact O-CG 3.34Å; A641-L645 WeakPolarHBondContact O-CB 3.5Å; A641-L645 WeakPolarHBondContact O-CD1 3.27Å; A641-L645 WeakPolarHBondContact O-CG 3.44Å; A641-L645 PolarHBondContact O-N 3.28Å; A641-L667 HydrophobicContact CB-CB 3.8Å; A641-L668 HydrophobicContact CB-CB 3.95Å
642	V	95.5	Very high	92.2	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-65.5	-35.4	-179.7	178.5	0	0	0	0	112.1	V593 A597 L639 A640 L645 G646 F833 I840	V593-V642 HydrophobicContact CG1-CG1 3.45Å; V593-V642 VanDerWaalsContact CG1-CG1 3.45Å; A597-V642 HydrophobicContact CB-CB 4.04Å; A597-V642 HydrophobicContact CB-CG1 4.14Å; A597-V642 HydrophobicContact CB-CG2 4.37Å; L639-V642 VanDerWaalsContact O-CB 3.31Å; L639-V642 WeakPolarHBondContact O-CB 3.31Å; L639-V642 WeakPolarHBondContact O-CG2 3.33Å; L639-V642 PolarHBondContact O-N 2.03Å; A640-V642 PolarHBondContact O-N 3.32Å; V642-L645 PolarHBondContact O-N 2.67Å; V642-G646 PolarHBondContact O-N 2.76Å; V642-F833 HydrophobicContact CG1-CZ 4.42Å; V642-I840 HydrophobicContact CG2-CB 4.24Å; V642-I840 HydrophobicContact CG2-CD1 4.36Å; V642-I840 HydrophobicContact CG2-CG2 3.81Å
643	F	93.8	Very high	91.6	Very high	72 Å²	72	39.6 Å²	39.6	32%	0.316	20%	0.201	S	C	.	.	H	α-helix	trans	-64.1	-57.7	178.4	-52.9	-74.4	0	0	0	112.6	A597 I601 A640 A641 L645 G646 I647	A597-F643 HydrophobicContact CB-CZ 4.11Å; I601-F643 HydrophobicContact CD1-CE2 3.95Å; A640-F643 WeakPolarHBondContact O-CD2 3.31Å; A641-F643 VanDerWaalsContact C-N 3.34Å; A641-F643 PolarHBondContact O-N 2.64Å; F643-L645 PolarHBondContact O-N 3.12Å; F643-G646 PolarHBondContact O-N 3.39Å; F643-G646 VanDerWaalsContact O-N 3.13Å; F643-I647 WeakPolarHBondContact O-CG1 3.36Å; F643-I647 PolarHBondContact O-N 2.79Å
644	P	92.8	Very high	90.8	Very high	17 Å²	17	43.6 Å²	43.6	11%	0.11	21%	0.211	C	C	.	.	H	α-helix	trans	-64.3	-26.8	178.3	27.1	-35.4	0	0	0	112.8	A640 A641 G646 I647 V660 F663 R664	A640-P644 WeakPolarHBondContact O-CD 3.11Å; A641-P644 VanDerWaalsContact O-CD 3.31Å; A641-P644 WeakPolarHBondContact O-CD 3.34Å; A641-P644 WeakPolarHBondContact O-CG 3.34Å; P644-G646 VanDerWaalsContact C-N 3.31Å; P644-G646 PolarHBondContact O-N 2.94Å; P644-I647 PolarHBondContact O-N 2.85Å; P644-V660 HydrophobicContact CB-CG1 3.94Å; P644-V660 WeakPolarHBondContact O-CG1 3.05Å; P644-F663 HydrophobicContact CB-CB 4.43Å; P644-R664 HydrophobicContact CB-CG 4.06Å; P644-R664 HydrophobicContact CG-CG 4.49Å; P644-R664 VanDerWaalsContact O-CZ 3.27Å; P644-R664 PolarHBondContact O-NE 2.96Å; P644-R664 PolarHBondContact O-NH2 2.92Å
645	L	91.1	Very high	90.3	Very high	45 Å²	45	49 Å²	49	24%	0.236	25%	0.245	C	C	.	.	H	α-helix	trans	-59.7	-37.7	173.1	-86.6	167.7	0	0	0	112.9	A641 V642 F643 R664 F833 I840	A641-L645 WeakPolarHBondContact O-CB 3.5Å; A641-L645 WeakPolarHBondContact O-CD1 3.27Å; A641-L645 WeakPolarHBondContact O-CG 3.44Å; A641-L645 PolarHBondContact O-N 3.28Å; V642-L645 PolarHBondContact O-N 2.67Å; F643-L645 PolarHBondContact O-N 3.12Å; L645-R664 HydrophobicContact CD2-CB 4.44Å; L645-R664 HydrophobicContact CD2-CG 4.22Å; L645-R664 HydrophobicContact CG-CG 4.25Å; L645-F833 HydrophobicContact CB-CD2 4.37Å; L645-F833 HydrophobicContact CB-CE2 4.24Å; L645-I840 HydrophobicContact CD1-CD1 3.87Å
646	G	89.3	Confident	89.7	Confident	2 Å²	2	54.1 Å²	54.1	2%	0.021	27%	0.269	C	S	.	.	H	α-helix	trans	-92.2	-10.5	-179.2	0	0	0	0	0	115.6	L585 V642 F643 P644 D648 F833	L585-G646 WeakPolarHBondContact CD2-O 3.33Å; V642-G646 PolarHBondContact O-N 2.76Å; F643-G646 PolarHBondContact O-N 3.39Å; F643-G646 VanDerWaalsContact O-N 3.13Å; P644-G646 VanDerWaalsContact C-N 3.31Å; P644-G646 PolarHBondContact O-N 2.94Å; G646-D648 PolarHBondContact O-N 2.97Å; G646-F833 VanDerWaalsContact CA-CE2 3.45Å
647	I	90.2	Very high	89.2	Confident	40 Å²	40	53 Å²	53	21%	0.205	26%	0.263	C	S	.	.			trans	-65.9	114.3	175	-75.3	174.3	0	0	0	110.2	F590 F643 P644 H651 V652 V660 R664	F590-I647 HydrophobicContact CZ-CG1 4.36Å; F643-I647 WeakPolarHBondContact O-CG1 3.36Å; F643-I647 PolarHBondContact O-N 2.79Å; P644-I647 PolarHBondContact O-N 2.85Å; I647-H651 HydrophobicContact CG2-CB 4.17Å; I647-V652 HydrophobicContact CG2-CB 3.96Å; I647-V652 HydrophobicContact CG2-CG2 3.45Å; I647-V652 VanDerWaalsContact CG2-CG2 3.45Å; I647-V660 HydrophobicContact CB-CG1 4.05Å; I647-V660 HydrophobicContact CG2-CG1 3.9Å; I647-V660 HydrophobicContact CG2-CG2 4.24Å; I647-R664 PolarHBondContact O-NH2 2.95Å
648	D	86.7	Confident	88.8	Confident	13 Å²	13	51.9 Å²	51.9	7%	0.07	26%	0.261	C	S	.	.			trans	-111	-173.8	176	66.4	-6.8	0	0	0	111.7	L585 G646 H650 H651 V652	L585-D648 PolarHBondContact N-OD2 3.33Å; G646-D648 PolarHBondContact O-N 2.97Å; D648-H650 PolarHBondContact O-N 2.88Å; D648-H650 VanDerWaalsContact O-N 3.16Å; D648-H650 VanDerWaalsContact OD1-CB 3.23Å; D648-H650 WeakPolarHBondContact OD1-CB 3.33Å; D648-H650 PolarHBondContact OD1-N 3.4Å; D648-H651 PolarHBondContact O-N 3.06Å; D648-H651 IonicContact OD1-CE1 3.93Å; D648-H651 IonicContact OD1-CG 3.16Å; D648-H651 IonicContact OD1-ND1 3.67Å; D648-H651 PolarHBondContact OD1-ND1 3.24Å; D648-V652 PolarHBondContact O-N 2.65Å
649	R	82.4	Confident	88.4	Confident	100 Å²	100	54.5 Å²	54.5	38%	0.377	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-12.4	178.9	177.6	164.3	162.4	-177.3	-10	113.7	Y582 L584 H651 E758	Y582-R649 PolarHBondContact OH-NH1 2.87Å; Y582-R649 VanDerWaalsContact OH-NH1 3.15Å; L584-R649 HydrophobicContact CD2-CB 4.49Å; R649-H651 VanDerWaalsContact C-N 3.26Å; R649-E758 WeakPolarHBondContact CD-OE2 3.44Å; R649-E758 IonicContact CZ-OE1 3.56Å; R649-E758 IonicContact NH1-OE1 3.58Å; R649-E758 PolarHBondContact NH1-OE1 3.44Å; R649-E758 IonicContact NH1-OE2 3.64Å
650	H	84.1	Confident	88.1	Confident	124 Å²	124	55.3 Å²	55.3	57%	0.574	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.4	-30.8	170.1	-171.3	65.7	0	0	0	111.8	L584 D648	L584-H650 HydrophobicContact CD1-CB 4.35Å; L584-H650 HydrophobicContact CD2-CB 4.5Å; D648-H650 PolarHBondContact O-N 2.88Å; D648-H650 VanDerWaalsContact O-N 3.16Å; D648-H650 VanDerWaalsContact OD1-CB 3.23Å; D648-H650 WeakPolarHBondContact OD1-CB 3.33Å; D648-H650 PolarHBondContact OD1-N 3.4Å
651	H	85.4	Confident	87.8	Confident	84 Å²	84	54 Å²	54	39%	0.389	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.9	-31.8	-172.9	-65.1	92.2	0	0	0	114.1	Q587 F590 I647 D648 R649	Q587-H651 PolarHBondContact OE1-CE1 2.82Å; F590-H651 AromaticContact CD1-CE1 3.74Å; F590-H651 AromaticContact CD1-NE2 3.85Å; F590-H651 AromaticContact CE1-CE1 3.68Å; F590-H651 AromaticContact CE1-NE2 3.52Å; I647-H651 HydrophobicContact CG2-CB 4.17Å; D648-H651 PolarHBondContact O-N 3.06Å; D648-H651 IonicContact OD1-CE1 3.93Å; D648-H651 IonicContact OD1-CG 3.16Å; D648-H651 IonicContact OD1-ND1 3.67Å; D648-H651 PolarHBondContact OD1-ND1 3.24Å; R649-H651 VanDerWaalsContact C-N 3.26Å
652	V	86.6	Confident	87.4	Confident	25 Å²	25	57.1 Å²	57.1	15%	0.152	28%	0.284	C	S	.	.	S	Bend	trans	-134.2	132.9	-169.4	171.6	0	0	0	0	112	I647 D648 Q656 V660	I647-V652 HydrophobicContact CG2-CB 3.96Å; I647-V652 HydrophobicContact CG2-CG2 3.45Å; I647-V652 VanDerWaalsContact CG2-CG2 3.45Å; D648-V652 PolarHBondContact O-N 2.65Å; V652-Q656 HydrophobicContact CG1-CB 3.52Å; V652-V660 HydrophobicContact CG1-CG2 4.16Å; V652-V660 HydrophobicContact CG2-CG2 4.39Å
653	N	82.4	Confident	87.2	Confident	121 Å²	121	62.5 Å²	62.5	65%	0.647	31%	0.308	S	S	*	.			trans	-68.2	145.8	178.3	-76.6	-49.8	0	0	0	112.2	P655 Q656 F657	N653-P655 VanDerWaalsContact C-CD 3.43Å; N653-P655 WeakPolarHBondContact O-CD 3.48Å; N653-P655 VanDerWaalsContact O-N 3.09Å; N653-Q656 PolarHBondContact O-N 2.75Å; N653-F657 PolarHBondContact O-N 2.85Å
654	R	81.2	Confident	87	Confident	137 Å²	137	61.1 Å²	61.1	52%	0.517	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-43.4	-44.2	-175.3	-150.3	178.4	-162.8	-143.9	1	116.5	Q656 F657 P658 I735 E758	R654-Q656 VanDerWaalsContact C-N 3.31Å; R654-Q656 PolarHBondContact O-N 2.75Å; R654-F657 PolarHBondContact O-N 3.3Å; R654-P658 WeakPolarHBondContact O-CD 3.39Å; R654-I735 HydrophobicContact CG-CD1 3.75Å; R654-I735 WeakPolarHBondContact O-CD1 2.96Å; R654-E758 IonicContact NE-OE1 2.75Å
655	P	83.2	Confident	86.8	Confident	113 Å²	113	61.7 Å²	61.7	73%	0.734	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.8	-21	179.1	27.4	-36.5	0	0	0	114.8	N653	N653-P655 VanDerWaalsContact C-CD 3.43Å; N653-P655 WeakPolarHBondContact O-CD 3.48Å; N653-P655 VanDerWaalsContact O-N 3.09Å
656	Q	85.3	Confident	86.9	Confident	114 Å²	114	61.5 Å²	61.5	53%	0.533	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.5	-21.5	179.1	-71	168.8	-32.2	0	0	112.4	V652 N653 R654 P658 V659 V660	V652-Q656 HydrophobicContact CG1-CB 3.52Å; N653-Q656 PolarHBondContact O-N 2.75Å; R654-Q656 VanDerWaalsContact C-N 3.31Å; R654-Q656 PolarHBondContact O-N 2.75Å; Q656-P658 VanDerWaalsContact C-CD 3.48Å; Q656-V659 WeakPolarHBondContact O-CB 3.41Å; Q656-V659 PolarHBondContact O-N 2.89Å; Q656-V659 VanDerWaalsContact O-N 3.08Å; Q656-V660 PolarHBondContact O-N 3.17Å
657	F	85.4	Confident	87.1	Confident	5 Å²	5	63.7 Å²	63.7	2%	0.022	31%	0.309	C	S	.	.	H	α-helix	trans	-57.9	-38.4	-176.2	-161.2	-86.5	0	0	0	115	N653 R654 V659 V660 C661 I735	N653-F657 PolarHBondContact O-N 2.85Å; R654-F657 PolarHBondContact O-N 3.3Å; F657-V659 PolarHBondContact O-N 3.2Å; F657-V660 WeakPolarHBondContact O-CA 3.29Å; F657-V660 WeakPolarHBondContact O-CB 3.49Å; F657-V660 PolarHBondContact O-N 2.9Å; F657-C661 PolarHBondContact O-N 3.27Å; F657-C661 PolarHBondContact O-SG 3.36Å; F657-C661 VanDerWaalsContact O-SG 3.4Å; F657-I735 HydrophobicContact CB-CD1 3.86Å; F657-I735 HydrophobicContact CD1-CD1 4.09Å; F657-I735 HydrophobicContact CD1-CG1 3.97Å; F657-I735 HydrophobicContact CG-CD1 4.28Å
658	P	87	Confident	87.2	Confident	37 Å²	37	64.7 Å²	64.7	24%	0.24	32%	0.315	C	S	.	.	H	α-helix	trans	-61.5	-31.6	175.3	-23	34.8	0	0	0	113	R654 Q656 V660 C661 Q662 I735	R654-P658 WeakPolarHBondContact O-CD 3.39Å; Q656-P658 VanDerWaalsContact C-CD 3.48Å; P658-V660 VanDerWaalsContact C-N 3.34Å; P658-C661 VanDerWaalsContact O-CB 3.31Å; P658-C661 WeakPolarHBondContact O-CB 3.23Å; P658-C661 PolarHBondContact O-N 3.03Å; P658-Q662 WeakPolarHBondContact O-CG 3.45Å; P658-Q662 PolarHBondContact O-N 3.46Å; P658-I735 HydrophobicContact CG-CD1 4.3Å; P658-I735 HydrophobicContact CG-CG1 4.13Å
659	V	87.6	Confident	87.5	Confident	68 Å²	68	64.6 Å²	64.6	41%	0.412	32%	0.317	S	S	.	.	H	α-helix	trans	-69	-36.7	175.9	-164.4	0	0	0	0	110.4	Q656 F657 Q662 F663	Q656-V659 WeakPolarHBondContact O-CB 3.41Å; Q656-V659 PolarHBondContact O-N 2.89Å; Q656-V659 VanDerWaalsContact O-N 3.08Å; F657-V659 PolarHBondContact O-N 3.2Å; V659-Q662 PolarHBondContact O-N 3.46Å; V659-F663 HydrophobicContact CG1-CD2 4.01Å; V659-F663 HydrophobicContact CG1-CE2 3.67Å; V659-F663 WeakPolarHBondContact O-CD2 3.34Å; V659-F663 PolarHBondContact O-N 3.14Å
660	V	89.9	Confident	88.1	Confident	17 Å²	17	61.6 Å²	61.6	10%	0.103	31%	0.308	C	S	.	.	H	α-helix	trans	-64.2	-42.1	171.4	-175.2	0	0	0	0	111	P644 I647 V652 Q656 F657 P658 Q662 F663 R664	P644-V660 HydrophobicContact CB-CG1 3.94Å; P644-V660 WeakPolarHBondContact O-CG1 3.05Å; I647-V660 HydrophobicContact CB-CG1 4.05Å; I647-V660 HydrophobicContact CG2-CG1 3.9Å; I647-V660 HydrophobicContact CG2-CG2 4.24Å; V652-V660 HydrophobicContact CG1-CG2 4.16Å; V652-V660 HydrophobicContact CG2-CG2 4.39Å; Q656-V660 PolarHBondContact O-N 3.17Å; F657-V660 WeakPolarHBondContact O-CA 3.29Å; F657-V660 WeakPolarHBondContact O-CB 3.49Å; F657-V660 PolarHBondContact O-N 2.9Å; P658-V660 VanDerWaalsContact C-N 3.34Å; V660-Q662 VanDerWaalsContact C-N 3.28Å; V660-Q662 PolarHBondContact O-N 3.12Å; V660-F663 PolarHBondContact O-N 3.49Å; V660-R664 WeakPolarHBondContact O-CG 3.45Å; V660-R664 PolarHBondContact O-N 3.27Å; V660-R664 VanDerWaalsContact O-N 3.09Å
661	C	87.8	Confident	88.6	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-54.9	-44.1	173.7	-61.9	0	0	0	0	112	F657 P658 L733 C760	F657-C661 PolarHBondContact O-N 3.27Å; F657-C661 PolarHBondContact O-SG 3.36Å; F657-C661 VanDerWaalsContact O-SG 3.4Å; P658-C661 VanDerWaalsContact O-CB 3.31Å; P658-C661 WeakPolarHBondContact O-CB 3.23Å; P658-C661 PolarHBondContact O-N 3.03Å; C661-L733 HydrophobicContact CB-CB 4.16Å; C661-L733 HydrophobicContact CB-CD2 4.38Å; C661-C760 VanDerWaalsContact CA-SG 3.53Å; C661-C760 HydrophobicContact CB-CB 3.66Å; C661-C760 WeakPolarHBondContact CB-SG 3.14Å; C661-C760 WeakPolarHBondContact SG-CB 3.35Å; C661-C760 CovalentContact SG-SG 2.03Å; C661-C760 PolarHBondContact SG-SG 3.15Å
662	Q	88.6	Confident	89.1	Confident	65 Å²	65	53.4 Å²	53.4	30%	0.304	27%	0.27	S	S	.	.	H	α-helix	trans	-64.8	-47.9	176.8	-66.7	170.7	8.8	0	0	111.6	P658 V659 V660 R664 L665 W666	P658-Q662 WeakPolarHBondContact O-CG 3.45Å; P658-Q662 PolarHBondContact O-N 3.46Å; V659-Q662 PolarHBondContact O-N 3.46Å; V660-Q662 VanDerWaalsContact C-N 3.28Å; V660-Q662 PolarHBondContact O-N 3.12Å; Q662-R664 VanDerWaalsContact C-N 3.29Å; Q662-R664 PolarHBondContact O-N 3.45Å; Q662-L665 PolarHBondContact O-N 3.44Å; Q662-L665 VanDerWaalsContact O-N 3.16Å; Q662-W666 VanDerWaalsContact O-CD1 3.24Å; Q662-W666 PolarHBondContact O-N 2.99Å
663	F	90.1	Very high	89.5	Confident	114 Å²	114	52.7 Å²	52.7	50%	0.5	27%	0.266	S	S	.	.	H	α-helix	trans	-59.2	-35.8	179.7	-80.9	-58.2	0	0	0	113.4	P644 V659 V660 L665 L667	P644-F663 HydrophobicContact CB-CB 4.43Å; V659-F663 HydrophobicContact CG1-CD2 4.01Å; V659-F663 HydrophobicContact CG1-CE2 3.67Å; V659-F663 WeakPolarHBondContact O-CD2 3.34Å; V659-F663 PolarHBondContact O-N 3.14Å; V660-F663 PolarHBondContact O-N 3.49Å; F663-L665 PolarHBondContact O-N 2.84Å; F663-L667 HydrophobicContact CB-CD1 4.43Å; F663-L667 HydrophobicContact CD1-CD1 3.92Å; F663-L667 WeakPolarHBondContact O-CB 3.48Å; F663-L667 WeakPolarHBondContact O-CD1 3.3Å; F663-L667 PolarHBondContact O-N 2.69Å
664	R	90	Very high	90.1	Very high	42 Å²	42	48 Å²	48	16%	0.158	24%	0.241	C	C	.	.	H	α-helix	trans	-53.9	-52.3	173.5	-68.7	168.4	-174	-178.1	-1.2	111.8	P644 L645 I647 V660 Q662 L668 C760	P644-R664 HydrophobicContact CB-CG 4.06Å; P644-R664 HydrophobicContact CG-CG 4.49Å; P644-R664 VanDerWaalsContact O-CZ 3.27Å; P644-R664 PolarHBondContact O-NE 2.96Å; P644-R664 PolarHBondContact O-NH2 2.92Å; L645-R664 HydrophobicContact CD2-CB 4.44Å; L645-R664 HydrophobicContact CD2-CG 4.22Å; L645-R664 HydrophobicContact CG-CG 4.25Å; I647-R664 PolarHBondContact O-NH2 2.95Å; V660-R664 WeakPolarHBondContact O-CG 3.45Å; V660-R664 PolarHBondContact O-N 3.27Å; V660-R664 VanDerWaalsContact O-N 3.09Å; Q662-R664 VanDerWaalsContact C-N 3.29Å; Q662-R664 PolarHBondContact O-N 3.45Å; R664-L668 VanDerWaalsContact O-CB 3.3Å; R664-L668 WeakPolarHBondContact O-CB 3.47Å; R664-L668 PolarHBondContact O-N 3.47Å; R664-C760 PolarHBondContact NH1-SG 3.42Å
665	L	89.4	Confident	90.7	Very high	30 Å²	30	42 Å²	42	16%	0.157	22%	0.22	C	C	.	.	H	α-helix	trans	-66.8	-46.5	-175.3	-179.7	60.4	0	0	0	111	Q662 F663 G669 L724 W727 L733	Q662-L665 PolarHBondContact O-N 3.44Å; Q662-L665 VanDerWaalsContact O-N 3.16Å; F663-L665 PolarHBondContact O-N 2.84Å; L665-G669 PolarHBondContact O-N 3.1Å; L665-L724 HydrophobicContact CD1-CD2 3.8Å; L665-L724 HydrophobicContact CD2-CD2 4.19Å; L665-L724 HydrophobicContact CG-CD2 3.9Å; L665-W727 HydrophobicContact CD1-CE3 4.2Å; L665-W727 HydrophobicContact CD1-CH2 4.14Å; L665-W727 HydrophobicContact CD1-CZ3 3.57Å; L665-W727 HydrophobicContact CD2-CD2 4.19Å; L665-W727 HydrophobicContact CD2-CE3 3.77Å; L665-W727 HydrophobicContact CD2-CH2 4.22Å; L665-W727 HydrophobicContact CD2-CZ3 3.8Å; L665-W727 HydrophobicContact CG-CZ3 4.35Å; L665-L733 HydrophobicContact CD2-CD1 4.11Å
666	W	92.8	Very high	91.3	Very high	41 Å²	41	36.7 Å²	36.7	16%	0.155	19%	0.186	C	C	.	.	H	α-helix	trans	-66.8	-46.2	-177.4	-80.2	110.8	0	0	0	114	Q662 L670 F721 L724 M725	Q662-W666 VanDerWaalsContact O-CD1 3.24Å; Q662-W666 PolarHBondContact O-N 2.99Å; W666-L670 HydrophobicContact CE3-CD1 3.77Å; W666-L670 HydrophobicContact CE3-CG 4.07Å; W666-L670 HydrophobicContact CZ3-CD1 4.19Å; W666-L670 HydrophobicContact CZ3-CD2 4.44Å; W666-L670 HydrophobicContact CZ3-CG 4.43Å; W666-L670 WeakPolarHBondContact O-CB 3.24Å; W666-L670 WeakPolarHBondContact O-CG 3.04Å; W666-L670 PolarHBondContact O-N 3.18Å; W666-F721 AromaticContact CH2-CD2 3.98Å; W666-F721 HydrophobicContact CH2-CD2 3.98Å; W666-F721 HydrophobicContact CH2-CE2 4Å; W666-F721 HydrophobicContact CH2-CG 4.5Å; W666-F721 AromaticContact CZ3-CD2 3.55Å; W666-F721 HydrophobicContact CZ3-CD2 3.55Å; W666-F721 AromaticContact CZ3-CE2 3.86Å; W666-F721 HydrophobicContact CZ3-CE2 3.86Å; W666-F721 HydrophobicContact CZ3-CG 4.28Å; W666-L724 HydrophobicContact CD2-CD1 4.46Å; W666-L724 HydrophobicContact CE3-CB 4.18Å; W666-L724 HydrophobicContact CE3-CD1 3.87Å; W666-L724 HydrophobicContact CH2-CB 3.5Å; W666-L724 HydrophobicContact CZ2-CB 3.86Å; W666-L724 HydrophobicContact CZ3-CB 3.68Å; W666-L724 HydrophobicContact CZ3-CD1 3.97Å; W666-L724 HydrophobicContact CZ3-CG 4.46Å; W666-M725 HydrophobicContact CH2-CG 3.8Å; W666-M725 HydrophobicContact CH2-SD 3.63Å; W666-M725 HydrophobicContact CZ2-CG 4.24Å; W666-M725 HydrophobicContact CZ2-SD 3.59Å; W666-M725 VanDerWaalsContact CZ2-SD 3.59Å
667	L	93.3	Very high	91.7	Very high	47 Å²	47	31.4 Å²	31.4	25%	0.246	16%	0.161	C	C	.	.	H	α-helix	trans	-67.3	-42.8	-179.9	-88.4	66.2	0	0	0	111.5	A640 A641 F663 G671	A640-L667 HydrophobicContact CB-CD2 4.08Å; A641-L667 HydrophobicContact CB-CB 3.8Å; F663-L667 HydrophobicContact CB-CD1 4.43Å; F663-L667 HydrophobicContact CD1-CD1 3.92Å; F663-L667 WeakPolarHBondContact O-CB 3.48Å; F663-L667 WeakPolarHBondContact O-CD1 3.3Å; F663-L667 PolarHBondContact O-N 2.69Å; L667-G671 WeakPolarHBondContact O-CA 3.28Å; L667-G671 PolarHBondContact O-N 2.63Å
668	L	92.8	Very high	92	Very high	61 Å²	61	31.1 Å²	31.1	32%	0.319	16%	0.16	S	C	.	.	H	α-helix	trans	-69.6	-45.7	-178	-176.2	58.2	0	0	0	112.1	A641 R664 F672 I840	A641-L668 HydrophobicContact CB-CB 3.95Å; R664-L668 VanDerWaalsContact O-CB 3.3Å; R664-L668 WeakPolarHBondContact O-CB 3.47Å; R664-L668 PolarHBondContact O-N 3.47Å; L668-F672 VanDerWaalsContact O-CB 3.26Å; L668-F672 WeakPolarHBondContact O-CB 3.41Å; L668-F672 PolarHBondContact O-N 2.85Å; L668-I840 HydrophobicContact CD1-CD1 3.73Å; L668-I840 HydrophobicContact CD1-CG1 4Å; L668-I840 HydrophobicContact CD2-CD1 4.44Å
669	G	92.8	Very high	92.3	Very high	11 Å²	11	29.6 Å²	29.6	11%	0.113	15%	0.15	C	C	.	.	H	α-helix	trans	-61.4	-58.9	179.6	0	0	0	0	0	112.2	L665 G671 F672 S673 D720	L665-G669 PolarHBondContact O-N 3.1Å; G669-G671 PolarHBondContact O-N 3.29Å; G669-F672 PolarHBondContact O-N 3.15Å; G669-S673 WeakPolarHBondContact O-CB 3.4Å; G669-S673 PolarHBondContact O-N 3.14Å; G669-S673 PolarHBondContact O-OG 2.95Å; G669-D720 VanDerWaalsContact O-OD2 3.05Å
670	L	94	Very high	92.6	Very high	38 Å²	38	27 Å²	27	20%	0.199	13%	0.133	C	C	.	.	H	α-helix	trans	-65.4	-37.8	-177.9	-62.6	179.7	0	0	0	112.2	M637 W666 S673 L674 D720 F721	M637-L670 HydrophobicContact CE-CB 3.89Å; W666-L670 HydrophobicContact CE3-CD1 3.77Å; W666-L670 HydrophobicContact CE3-CG 4.07Å; W666-L670 HydrophobicContact CZ3-CD1 4.19Å; W666-L670 HydrophobicContact CZ3-CD2 4.44Å; W666-L670 HydrophobicContact CZ3-CG 4.43Å; W666-L670 WeakPolarHBondContact O-CB 3.24Å; W666-L670 WeakPolarHBondContact O-CG 3.04Å; W666-L670 PolarHBondContact O-N 3.18Å; L670-S673 PolarHBondContact O-N 2.93Å; L670-L674 VanDerWaalsContact O-CB 3.28Å; L670-L674 WeakPolarHBondContact O-CB 3.28Å; L670-L674 PolarHBondContact O-N 3.39Å; L670-D720 PolarHBondContact N-OD2 2.99Å; L670-F721 HydrophobicContact CD2-CB 4.22Å; L670-F721 HydrophobicContact CD2-CD2 4.41Å
671	G	95.5	Very high	92.6	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-61.8	-47.4	175.8	0	0	0	0	0	112.4	G634 L667 G669 L674 A675	G634-G671 CarbonylContact C-O 3.43Å; G634-G671 WeakPolarHBondContact CA-O 3.05Å; G634-G671 CarbonylContact O-C 3.35Å; L667-G671 WeakPolarHBondContact O-CA 3.28Å; L667-G671 PolarHBondContact O-N 2.63Å; G669-G671 PolarHBondContact O-N 3.29Å; G671-L674 PolarHBondContact O-N 2.92Å; G671-A675 WeakPolarHBondContact O-CB 3.47Å; G671-A675 PolarHBondContact O-N 3.06Å
672	F	95	Very high	92.7	Very high	36 Å²	36	26.4 Å²	26.4	16%	0.158	13%	0.129	C	C	.	.	H	α-helix	trans	-60	-47.4	173.4	178.1	-83.8	0	0	0	111.5	L668 G669 L674 A675 Y676 K776 L780 V811	L668-F672 VanDerWaalsContact O-CB 3.26Å; L668-F672 WeakPolarHBondContact O-CB 3.41Å; L668-F672 PolarHBondContact O-N 2.85Å; G669-F672 PolarHBondContact O-N 3.15Å; F672-L674 VanDerWaalsContact C-N 3.35Å; F672-L674 PolarHBondContact O-N 2.89Å; F672-A675 PolarHBondContact O-N 2.76Å; F672-Y676 HydrophobicContact CE1-CG 4.23Å; F672-Y676 HydrophobicContact CZ-CD2 4.31Å; F672-Y676 HydrophobicContact CZ-CG 4.11Å; F672-Y676 VanDerWaalsContact O-CB 3.28Å; F672-Y676 WeakPolarHBondContact O-CB 3.29Å; F672-Y676 PolarHBondContact O-N 2.86Å; F672-K776 HydrophobicContact CD1-CD 3.98Å; F672-K776 HydrophobicContact CE1-CD 3.84Å; F672-L780 HydrophobicContact CE2-CD2 4.43Å; F672-L780 HydrophobicContact CZ-CD1 4.49Å; F672-L780 HydrophobicContact CZ-CD2 3.79Å; F672-L780 HydrophobicContact CZ-CG 4.25Å; F672-V811 HydrophobicContact CE2-CG1 4.09Å
673	S	94.7	Very high	92.7	Very high	9 Å²	9	23.4 Å²	23.4	6%	0.063	12%	0.115	C	C	.	.	H	α-helix	trans	-64.5	-37.3	-177.5	-62.8	0	0	0	0	112.8	G669 L670 G677 D720 K776	G669-S673 WeakPolarHBondContact O-CB 3.4Å; G669-S673 PolarHBondContact O-N 3.14Å; G669-S673 PolarHBondContact O-OG 2.95Å; L670-S673 PolarHBondContact O-N 2.93Å; S673-G677 VanDerWaalsContact O-CA 3.31Å; S673-G677 WeakPolarHBondContact O-CA 3.48Å; S673-G677 PolarHBondContact O-N 3.06Å; S673-D720 VanDerWaalsContact CB-OD2 3.3Å; S673-D720 WeakPolarHBondContact CB-OD2 3.08Å; S673-D720 WeakPolarHBondContact OG-CB 3.25Å; S673-D720 PolarHBondContact OG-OD2 3.06Å; S673-K776 PolarHBondContact OG-NZ 3.39Å
674	L	94.9	Very high	92.5	Very high	23 Å²	23	23.1 Å²	23.1	12%	0.12	11%	0.111	C	C	.	.	H	α-helix	trans	-70.9	-41.5	176.1	-177.3	61.9	0	0	0	111.9	M630 V633 M637 L670 G671 F672 S678 L717	M630-L674 HydrophobicContact CB-CD1 3.93Å; M630-L674 HydrophobicContact CE-CD1 3.77Å; M630-L674 HydrophobicContact CG-CD1 4.32Å; M630-L674 WeakPolarHBondContact O-CG 3.38Å; V633-L674 HydrophobicContact CB-CD2 4.08Å; V633-L674 HydrophobicContact CG1-CD2 3.73Å; M637-L674 HydrophobicContact SD-CD2 3.96Å; L670-L674 VanDerWaalsContact O-CB 3.28Å; L670-L674 WeakPolarHBondContact O-CB 3.28Å; L670-L674 PolarHBondContact O-N 3.39Å; G671-L674 PolarHBondContact O-N 2.92Å; F672-L674 VanDerWaalsContact C-N 3.35Å; F672-L674 PolarHBondContact O-N 2.89Å; L674-S678 WeakPolarHBondContact O-CB 3.41Å; L674-S678 PolarHBondContact O-OG 3.31Å; L674-L717 HydrophobicContact CB-CD2 4.05Å; L674-L717 HydrophobicContact CD1-CD1 3.87Å
675	A	95.1	Very high	92.3	Very high	11 Å²	11	22.9 Å²	22.9	9%	0.091	11%	0.11	C	C	.	.	H	α-helix	trans	-68.4	-52.5	178.1	0	0	0	0	0	111.9	G671 F672 S678 M679	G671-A675 WeakPolarHBondContact O-CB 3.47Å; G671-A675 PolarHBondContact O-N 3.06Å; F672-A675 PolarHBondContact O-N 2.76Å; A675-S678 PolarHBondContact O-OG 2.85Å; A675-S678 VanDerWaalsContact O-OG 3.06Å; A675-M679 WeakPolarHBondContact O-CE 3.31Å
676	Y	95.1	Very high	92	Very high	2 Å²	2	21.5 Å²	21.5	1%	0.008	10%	0.103	C	C	.	.	H	α-helix	trans	-74.4	-41.4	-176.8	-166.5	-90.8	0	0	0	112.2	F672 S678 M679 F680 L779 L780 G783 I808 V811	F672-Y676 HydrophobicContact CE1-CG 4.23Å; F672-Y676 HydrophobicContact CZ-CD2 4.31Å; F672-Y676 HydrophobicContact CZ-CG 4.11Å; F672-Y676 VanDerWaalsContact O-CB 3.28Å; F672-Y676 WeakPolarHBondContact O-CB 3.29Å; F672-Y676 PolarHBondContact O-N 2.86Å; Y676-S678 VanDerWaalsContact C-N 3.32Å; Y676-S678 PolarHBondContact O-N 3.13Å; Y676-M679 PolarHBondContact O-N 2.86Å; Y676-F680 HydrophobicContact CD1-CB 4.1Å; Y676-F680 HydrophobicContact CE1-CB 3.87Å; Y676-F680 HydrophobicContact CE1-CD2 4.04Å; Y676-F680 HydrophobicContact CE1-CG 4.29Å; Y676-F680 VanDerWaalsContact O-CB 3.26Å; Y676-F680 WeakPolarHBondContact O-CB 3.24Å; Y676-F680 PolarHBondContact O-N 2.8Å; Y676-L779 HydrophobicContact CD1-CD2 3.96Å; Y676-L779 HydrophobicContact CD1-CG 4.29Å; Y676-L779 HydrophobicContact CE1-CD2 4.19Å; Y676-L779 HydrophobicContact CE1-CG 4Å; Y676-L779 PolarHBondContact OH-O 3.08Å; Y676-L780 HydrophobicContact CD2-CD2 3.8Å; Y676-L780 HydrophobicContact CE1-CD2 4.34Å; Y676-L780 HydrophobicContact CE2-CD2 3.37Å; Y676-L780 HydrophobicContact CG-CD2 4.44Å; Y676-L780 WeakPolarHBondContact OH-CA 3.41Å; Y676-L780 PolarHBondContact OH-O 3.28Å; Y676-G783 WeakPolarHBondContact OH-CA 3.35Å; Y676-I808 HydrophobicContact CE2-CB 4.38Å; Y676-I808 HydrophobicContact CE2-CG1 3.95Å; Y676-I808 HydrophobicContact CE2-CG2 4.07Å; Y676-V811 HydrophobicContact CD2-CG1 4.24Å
677	G	93.6	Very high	91.6	Very high	2 Å²	2	21.2 Å²	21.2	2%	0.021	10%	0.103	C	C	.	.	H	α-helix	trans	-61.9	-36.3	-178	0	0	0	0	0	113.5	S673 T681	S673-G677 VanDerWaalsContact O-CA 3.31Å; S673-G677 WeakPolarHBondContact O-CA 3.48Å; S673-G677 PolarHBondContact O-N 3.06Å; G677-T681 VanDerWaalsContact O-CB 3.26Å; G677-T681 WeakPolarHBondContact O-CB 3.43Å; G677-T681 PolarHBondContact O-N 2.9Å; G677-T681 PolarHBondContact O-OG1 3.33Å
678	S	92.9	Very high	91	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-69.5	-42.8	175.6	57.3	0	0	0	0	112.3	T631 L674 A675 Y676 K682	T631-S678 WeakPolarHBondContact CA-OG 3.3Å; T631-S678 PolarHBondContact N-OG 3.12Å; T631-S678 PolarHBondContact OG1-OG 3.15Å; L674-S678 WeakPolarHBondContact O-CB 3.41Å; L674-S678 PolarHBondContact O-OG 3.31Å; A675-S678 PolarHBondContact O-OG 2.85Å; A675-S678 VanDerWaalsContact O-OG 3.06Å; Y676-S678 VanDerWaalsContact C-N 3.32Å; Y676-S678 PolarHBondContact O-N 3.13Å; S678-K682 WeakPolarHBondContact O-CB 3.48Å; S678-K682 PolarHBondContact O-N 2.92Å
679	M	92.5	Very high	90.2	Very high	4 Å²	4	21.8 Å²	21.8	2%	0.02	11%	0.108	C	C	.	.	H	α-helix	trans	-64.9	-46.3	173.5	-69.2	-166.5	-73.7	0	0	112.5	T631 A675 Y676 K682 I683 V804 A807 I808 V811 T847 L851	T631-M679 HydrophobicContact CG2-CE 4.17Å; T631-M679 HydrophobicContact CG2-CG 3.76Å; T631-M679 HydrophobicContact CG2-SD 3.92Å; A675-M679 WeakPolarHBondContact O-CE 3.31Å; Y676-M679 PolarHBondContact O-N 2.86Å; M679-K682 WeakPolarHBondContact O-CB 3.02Å; M679-K682 PolarHBondContact O-N 3.42Å; M679-I683 PolarHBondContact O-N 3.09Å; M679-V804 HydrophobicContact CB-CG1 3.68Å; M679-V804 HydrophobicContact CG-CG1 4Å; M679-A807 HydrophobicContact SD-CB 3.85Å; M679-I808 HydrophobicContact CB-CD1 3.88Å; M679-I808 HydrophobicContact CB-CG1 3.95Å; M679-V811 HydrophobicContact CE-CG2 4.5Å; M679-T847 HydrophobicContact CE-CG2 3.89Å; M679-T847 HydrophobicContact SD-CG2 3.75Å; M679-L851 HydrophobicContact CG-CD1 4.49Å; M679-L851 HydrophobicContact SD-CD1 4.04Å
680	F	93.7	Very high	89.2	Confident	14 Å²	14	25.1 Å²	25.1	6%	0.061	12%	0.119	C	C	.	.	H	α-helix	trans	-59.6	-50.2	178.3	175.2	-89.8	0	0	0	111.6	Y676 K682 I683 W684 L716 L779 L782 L786	Y676-F680 HydrophobicContact CD1-CB 4.1Å; Y676-F680 HydrophobicContact CE1-CB 3.87Å; Y676-F680 HydrophobicContact CE1-CD2 4.04Å; Y676-F680 HydrophobicContact CE1-CG 4.29Å; Y676-F680 VanDerWaalsContact O-CB 3.26Å; Y676-F680 WeakPolarHBondContact O-CB 3.24Å; Y676-F680 PolarHBondContact O-N 2.8Å; F680-K682 PolarHBondContact O-N 2.78Å; F680-I683 PolarHBondContact O-N 3.4Å; F680-I683 VanDerWaalsContact O-N 3.14Å; F680-W684 HydrophobicContact CE1-CB 4.31Å; F680-W684 WeakPolarHBondContact O-CB 3.39Å; F680-W684 PolarHBondContact O-N 3.44Å; F680-L716 HydrophobicContact CD1-CD1 4.01Å; F680-L779 HydrophobicContact CD2-CD1 4.46Å; F680-L779 HydrophobicContact CE2-CD1 4.26Å; F680-L779 HydrophobicContact CZ-CD1 4.31Å; F680-L782 HydrophobicContact CE2-CB 4.36Å; F680-L782 HydrophobicContact CE2-CD2 3.93Å; F680-L782 HydrophobicContact CE2-CG 3.98Å; F680-L782 HydrophobicContact CZ-CD2 3.73Å; F680-L782 HydrophobicContact CZ-CG 4.21Å; F680-L786 HydrophobicContact CD2-CD1 4.5Å; F680-L786 HydrophobicContact CE2-CD1 3.64Å; F680-L786 HydrophobicContact CZ-CD1 3.87Å
681	T	90.8	Very high	88	Confident	2 Å²	2	26.9 Å²	26.9	1%	0.012	13%	0.132	C	C	.	.	H	α-helix	trans	-57.4	-37.8	179.4	-62.8	0	0	0	0	111.8	G677 W684 W685 L709 T712 V713	G677-T681 VanDerWaalsContact O-CB 3.26Å; G677-T681 WeakPolarHBondContact O-CB 3.43Å; G677-T681 PolarHBondContact O-N 2.9Å; G677-T681 PolarHBondContact O-OG1 3.33Å; T681-W684 PolarHBondContact O-N 3.35Å; T681-W685 WeakPolarHBondContact O-CB 3.47Å; T681-W685 PolarHBondContact O-N 2.92Å; T681-L709 HydrophobicContact CG2-CB 4.03Å; T681-L709 HydrophobicContact CG2-CG 4.44Å; T681-T712 HydrophobicContact CG2-CG2 4.01Å; T681-T712 WeakPolarHBondContact OG1-CG2 3.37Å; T681-V713 HydrophobicContact CG2-CG2 4.18Å; T681-V713 WeakPolarHBondContact OG1-CG2 3.29Å
682	K	88.3	Confident	86.4	Confident	2 Å²	2	34.8 Å²	34.8	1%	0.009	17%	0.166	C	C	.	.	H	α-helix	trans	-66.6	-40.9	179.1	-173.5	164.3	168.6	178.6	0	112.5	S623 L627 N628 S678 M679 F680 V686 I798 D800 V804	S623-K682 PolarHBondContact O-NZ 3.49Å; L627-K682 HydrophobicContact CD1-CB 4.17Å; N628-K682 PolarHBondContact OD1-NZ 3.09Å; S678-K682 WeakPolarHBondContact O-CB 3.48Å; S678-K682 PolarHBondContact O-N 2.92Å; M679-K682 WeakPolarHBondContact O-CB 3.02Å; M679-K682 PolarHBondContact O-N 3.42Å; F680-K682 PolarHBondContact O-N 2.78Å; K682-V686 WeakPolarHBondContact O-CG2 3.3Å; K682-V686 PolarHBondContact O-N 2.83Å; K682-I798 HydrophobicContact CG-CD1 4.15Å; K682-D800 WeakPolarHBondContact CE-OD1 3.31Å; K682-D800 IonicContact NZ-OD1 2.69Å; K682-D800 PolarHBondContact NZ-OD1 3.26Å; K682-D800 IonicContact NZ-OD2 3.88Å; K682-D800 PolarHBondContact NZ-OD2 3.45Å; K682-V804 HydrophobicContact CD-CG2 4.04Å
683	I	88.8	Confident	84.3	Confident	2 Å²	2	40.2 Å²	40.2	1%	0.01	19%	0.19	C	C	.	.	H	α-helix	trans	-72.5	-40.5	173.4	-64.3	-162.1	0	0	0	111.7	M679 F680 W685 V686 H687 L786 A787 T790 V804 I808	M679-I683 PolarHBondContact O-N 3.09Å; F680-I683 PolarHBondContact O-N 3.4Å; F680-I683 VanDerWaalsContact O-N 3.14Å; I683-W685 VanDerWaalsContact C-N 3.26Å; I683-W685 PolarHBondContact O-N 3.03Å; I683-V686 PolarHBondContact O-N 2.91Å; I683-V686 VanDerWaalsContact O-N 3.1Å; I683-H687 PolarHBondContact O-N 3.46Å; I683-L786 HydrophobicContact CG2-CB 3.77Å; I683-A787 HydrophobicContact CD1-CB 3.75Å; I683-T790 HydrophobicContact CG2-CG2 4.34Å; I683-V804 HydrophobicContact CD1-CB 4.38Å; I683-V804 HydrophobicContact CD1-CG1 4.08Å; I683-V804 HydrophobicContact CG1-CB 4.37Å; I683-V804 HydrophobicContact CG1-CG1 3.91Å; I683-I808 HydrophobicContact CD1-CD1 3.64Å; I683-I808 HydrophobicContact CG1-CD1 4.12Å
684	W	87.6	Confident	82.1	Confident	109 Å²	109	47 Å²	47	41%	0.413	23%	0.225	S	C	.	.	H	α-helix	trans	-56.8	-39.9	174.5	177.3	-105.2	0	0	0	112.3	F680 T681 H687 T688 L786	F680-W684 HydrophobicContact CE1-CB 4.31Å; F680-W684 WeakPolarHBondContact O-CB 3.39Å; F680-W684 PolarHBondContact O-N 3.44Å; T681-W684 PolarHBondContact O-N 3.35Å; W684-H687 PolarHBondContact O-N 3.1Å; W684-T688 HydrophobicContact CD2-CG2 4.07Å; W684-T688 HydrophobicContact CZ2-CG2 4.01Å; W684-T688 WeakPolarHBondContact O-CB 3.48Å; W684-T688 WeakPolarHBondContact O-CG2 3.22Å; W684-T688 PolarHBondContact O-N 2.92Å; W684-T688 PolarHBondContact O-OG1 2.93Å; W684-L786 HydrophobicContact CE3-CD1 3.71Å; W684-L786 HydrophobicContact CE3-CD2 3.98Å; W684-L786 HydrophobicContact CZ3-CD1 4.32Å; W684-L786 HydrophobicContact CZ3-CD2 4.21Å
685	W	85.1	Confident	79.8	Confident	37 Å²	37	53.7 Å²	53.7	14%	0.14	26%	0.256	C	S	.	.	H	α-helix	trans	-65.1	-42	174.2	-174.5	94.2	0	0	0	112.6	T681 I683 T688 L689 L709 K797 I798	T681-W685 WeakPolarHBondContact O-CB 3.47Å; T681-W685 PolarHBondContact O-N 2.92Å; I683-W685 VanDerWaalsContact C-N 3.26Å; I683-W685 PolarHBondContact O-N 3.03Å; W685-T688 PolarHBondContact O-OG1 2.77Å; W685-L689 HydrophobicContact CD2-CD1 3.75Å; W685-L689 HydrophobicContact CD2-CG 4.39Å; W685-L689 HydrophobicContact CE3-CD1 3.61Å; W685-L689 HydrophobicContact CH2-CD1 3.43Å; W685-L689 VanDerWaalsContact CH2-CD1 3.43Å; W685-L689 HydrophobicContact CZ2-CD1 3.54Å; W685-L689 HydrophobicContact CZ3-CD1 3.44Å; W685-L689 VanDerWaalsContact CZ3-CD1 3.44Å; W685-L689 WeakPolarHBondContact O-CB 3.44Å; W685-L689 WeakPolarHBondContact O-CG 3.49Å; W685-L689 PolarHBondContact O-N 3.37Å; W685-L689 VanDerWaalsContact O-N 3.16Å; W685-L709 HydrophobicContact CB-CD2 4.13Å; W685-L709 HydrophobicContact CD2-CD2 4.46Å; W685-L709 HydrophobicContact CG-CD2 3.88Å; W685-L709 HydrophobicContact CG-CG 4.42Å; W685-K797 HydrophobicContact CH2-CB 4.49Å; W685-I798 HydrophobicContact CD2-CD1 4.22Å; W685-I798 HydrophobicContact CE3-CD1 3.29Å; W685-I798 HydrophobicContact CE3-CG1 4.11Å; W685-I798 HydrophobicContact CH2-CD1 4.18Å; W685-I798 HydrophobicContact CH2-CG1 4.23Å; W685-I798 HydrophobicContact CZ3-CD1 3.28Å; W685-I798 HydrophobicContact CZ3-CG1 3.55Å
686	V	83.9	Confident	77.3	Confident	0 Å²	0	59.3 Å²	59.3	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-63.1	-49	173.9	175.5	0	0	0	0	110.4	K682 I683 T688 L689 F690 T790 I798 H801	K682-V686 WeakPolarHBondContact O-CG2 3.3Å; K682-V686 PolarHBondContact O-N 2.83Å; I683-V686 PolarHBondContact O-N 2.91Å; I683-V686 VanDerWaalsContact O-N 3.1Å; V686-T688 PolarHBondContact O-N 3.24Å; V686-L689 PolarHBondContact O-N 3.29Å; V686-F690 HydrophobicContact CG1-CD2 4.37Å; V686-F690 WeakPolarHBondContact O-CD2 3.34Å; V686-F690 PolarHBondContact O-N 2.99Å; V686-T790 HydrophobicContact CB-CG2 4.27Å; V686-T790 HydrophobicContact CG1-CG2 3.85Å; V686-I798 HydrophobicContact CG2-CB 4.37Å; V686-I798 HydrophobicContact CG2-CD1 3.97Å; V686-I798 HydrophobicContact CG2-CG2 4.49Å; V686-H801 HydrophobicContact CG2-CB 4.09Å
687	H	84.1	Confident	74.8	Confident	35 Å²	35	68.3 Å²	68.3	16%	0.162	32%	0.317	C	S	.	.	H	α-helix	trans	-56.1	-54.4	178.5	176.5	-108.5	0	0	0	111.5	I683 W684 L689 F690 T691 L786 T790	I683-H687 PolarHBondContact O-N 3.46Å; W684-H687 PolarHBondContact O-N 3.1Å; H687-L689 VanDerWaalsContact C-N 3.28Å; H687-L689 PolarHBondContact O-N 3.14Å; H687-F690 PolarHBondContact O-N 3.32Å; H687-F690 VanDerWaalsContact O-N 3.11Å; H687-T691 WeakPolarHBondContact NE2-CG2 3.37Å; H687-T691 PolarHBondContact O-N 2.95Å; H687-T691 PolarHBondContact O-OG1 3.04Å; H687-L786 HydrophobicContact CB-CD2 4.03Å; H687-L786 WeakPolarHBondContact ND1-CD2 3.46Å; H687-T790 HydrophobicContact CB-CG2 3.75Å
688	T	79.9	Confident	72.3	Confident	37 Å²	37	77 Å²	77	23%	0.227	36%	0.358	C	S	.	.	H	α-helix	trans	-67.5	-21.3	-175.4	52.2	0	0	0	0	114.7	W684 W685 V686 K692	W684-T688 HydrophobicContact CD2-CG2 4.07Å; W684-T688 HydrophobicContact CZ2-CG2 4.01Å; W684-T688 WeakPolarHBondContact O-CB 3.48Å; W684-T688 WeakPolarHBondContact O-CG2 3.22Å; W684-T688 PolarHBondContact O-N 2.92Å; W684-T688 PolarHBondContact O-OG1 2.93Å; W685-T688 PolarHBondContact O-OG1 2.77Å; V686-T688 PolarHBondContact O-N 3.24Å; T688-K692 WeakPolarHBondContact O-CG 3.22Å
689	L	75.4	Confident	69.6	Low	84 Å²	84	85.6 Å²	85.6	44%	0.44	40%	0.395	S	S	.	.	H	α-helix	trans	-78.3	-31	171.3	-80	-177.1	0	0	0	113.9	W685 V686 H687	W685-L689 HydrophobicContact CD2-CD1 3.75Å; W685-L689 HydrophobicContact CD2-CG 4.39Å; W685-L689 HydrophobicContact CE3-CD1 3.61Å; W685-L689 HydrophobicContact CH2-CD1 3.43Å; W685-L689 VanDerWaalsContact CH2-CD1 3.43Å; W685-L689 HydrophobicContact CZ2-CD1 3.54Å; W685-L689 HydrophobicContact CZ3-CD1 3.44Å; W685-L689 VanDerWaalsContact CZ3-CD1 3.44Å; W685-L689 WeakPolarHBondContact O-CB 3.44Å; W685-L689 WeakPolarHBondContact O-CG 3.49Å; W685-L689 PolarHBondContact O-N 3.37Å; W685-L689 VanDerWaalsContact O-N 3.16Å; V686-L689 PolarHBondContact O-N 3.29Å; H687-L689 VanDerWaalsContact C-N 3.28Å; H687-L689 PolarHBondContact O-N 3.14Å
690	F	72.5	Confident	67.1	Low	81 Å²	81	93.8 Å²	93.8	36%	0.355	43%	0.431	S	S	.	.	H	α-helix	trans	-97.4	-29.2	-172.7	-80.4	-95.2	0	0	0	113.7	V686 H687 V793 T795	V686-F690 HydrophobicContact CG1-CD2 4.37Å; V686-F690 WeakPolarHBondContact O-CD2 3.34Å; V686-F690 PolarHBondContact O-N 2.99Å; H687-F690 PolarHBondContact O-N 3.32Å; H687-F690 VanDerWaalsContact O-N 3.11Å; F690-V793 HydrophobicContact CD1-CG1 3.54Å; F690-V793 HydrophobicContact CD2-CG1 4Å; F690-V793 HydrophobicContact CE1-CG1 3.55Å; F690-V793 HydrophobicContact CE2-CG1 4.02Å; F690-V793 HydrophobicContact CG-CG1 3.77Å; F690-V793 HydrophobicContact CZ-CG1 3.8Å; F690-T795 HydrophobicContact CE2-CG2 3.54Å; F690-T795 HydrophobicContact CZ-CG2 3.53Å
691	T	68.2	Low	64.6	Low	75 Å²	75	102.7 Å²	102.7	46%	0.46	47%	0.469	S	S	.	.	H	α-helix	trans	-84.5	-25.6	178.3	55.2	0	0	0	0	114.3	H687 K693	H687-T691 WeakPolarHBondContact NE2-CG2 3.37Å; H687-T691 PolarHBondContact O-N 2.95Å; H687-T691 PolarHBondContact O-OG1 3.04Å; T691-K693 PolarHBondContact O-N 3.07Å
692	K	62.9	Low	62.2	Low	165 Å²	165	111.2 Å²	111.2	72%	0.717	51%	0.509	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.5	33.3	178.8	-67.8	-167.3	171.8	-170.4	0	114.4	T688	T688-K692 WeakPolarHBondContact O-CG 3.22Å
693	K	50.1	Low	60.2	Low	151 Å²	151	116.7 Å²	116.7	66%	0.657	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.6	-23.5	-167.2	-142.1	174.4	-176.9	-177.6	0	114.3	T691	T691-K693 PolarHBondContact O-N 3.07Å
694	D	49	Very low	58.5	Low	151 Å²	151	121 Å²	121	81%	0.807	57%	0.567	S	S	*	*	S	Bend	trans	-96.7	-26.4	-168.2	-60.1	-46.2	0	0	0	114.9
695	E	47.4	Very low	57.5	Low	164 Å²	164	120.2 Å²	120.2	77%	0.766	57%	0.568	S	S	*	*	S	Bend	trans	-79.7	-24.3	-174.7	-80.9	-157.1	154.9	0	0	116.1
696	K	42.1	Very low	56.7	Low	129 Å²	129	122.5 Å²	122.5	56%	0.561	59%	0.588	S	S	*	*			trans	-140.9	70.1	-168.2	-69	-174.5	178.6	56.3	0	114.3	E698	K696-E698 PolarHBondContact O-N 2.72Å
697	K	41.7	Very low	56.5	Low	190 Å²	190	129.4 Å²	129.4	83%	0.826	61%	0.614	S	S	*	*	S	Bend	trans	-63.9	-19.9	166.4	-87.7	178.4	176.5	169.3	0	114.3
698	E	41.5	Very low	56.3	Low	186 Å²	186	131.1 Å²	131.1	87%	0.869	62%	0.621	S	S	*	*	S	Bend	trans	-95.9	-27.1	-172.5	-62.6	-155.4	125.2	0	0	116.1	K696 K700	K696-E698 PolarHBondContact O-N 2.72Å; E698-K700 PolarHBondContact O-N 3.45Å
699	K	36.6	Very low	56.5	Low	180 Å²	180	129.9 Å²	129.9	78%	0.783	61%	0.613	S	S	*	*			trans	-79.9	64.8	175	-72.7	-157.8	172.6	-171.8	0	111.9
700	K	39.7	Very low	57	Low	176 Å²	176	130.2 Å²	130.2	77%	0.765	61%	0.609	S	S	*	*			trans	-57.2	135.1	170.4	-80.1	175.8	177.3	167.6	0	110.7	E698	E698-K700 PolarHBondContact O-N 3.45Å
701	K	41.5	Very low	57.8	Low	201 Å²	201	128.2 Å²	128.2	87%	0.874	61%	0.608	S	S	*	*			trans	52.4	74.2	160.2	-57.9	-178.5	179	-178.5	0	116.4
702	Q	41	Very low	58.7	Low	180 Å²	180	127 Å²	127	84%	0.841	60%	0.6	S	S	*	*			trans	-102	130.6	141.1	-80.1	-172.7	-29	0	0	109	L704	Q702-L704 PolarHBondContact O-N 3.02Å
703	P	45.9	Very low	60.1	Low	118 Å²	118	119.1 Å²	119.1	77%	0.766	57%	0.566	S	S	*	*			trans	-67.8	120.4	164.8	29	-31	0	0	0	108.1	E705	P703-E705 PolarHBondContact O-N 2.75Å; P703-E705 VanDerWaalsContact O-N 3.16Å
704	L	52.8	Low	62	Low	93 Å²	93	113.6 Å²	113.6	49%	0.487	55%	0.552	S	S	.	*			trans	-72.4	112.3	176	-162.8	82.6	0	0	0	108.7	Q702 K708	Q702-L704 PolarHBondContact O-N 3.02Å; L704-K708 HydrophobicContact CD1-CD 3.98Å; L704-K708 HydrophobicContact CG-CD 4.2Å
705	E	65.9	Low	64.1	Low	91 Å²	91	110.6 Å²	110.6	43%	0.425	54%	0.539	S	S	.	.			trans	-61.6	137.3	-172.2	-57.6	155.3	98	0	0	112	P703 W707 K708	P703-E705 PolarHBondContact O-N 2.75Å; P703-E705 VanDerWaalsContact O-N 3.16Å; E705-W707 HydrophobicContact CB-CG 4.32Å; E705-W707 PolarHBondContact O-N 3.13Å; E705-W707 PolarHBondContact OE1-NE1 3Å; E705-W707 PolarHBondContact OE2-NE1 3.46Å; E705-W707 VanDerWaalsContact OE2-NE1 3.17Å; E705-K708 PolarHBondContact O-N 3.32Å; E705-K708 VanDerWaalsContact OE2-CE 3.24Å; E705-K708 WeakPolarHBondContact OE2-CE 3.02Å; E705-K708 IonicContact OE2-NZ 2.72Å; E705-K708 PolarHBondContact OE2-NZ 2.98Å
706	P	68.8	Low	66.2	Low	86 Å²	86	104.5 Å²	104.5	56%	0.558	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	-28.8	-176.7	-28.6	35.6	0	0	0	114.9	K708 L709 Y710	P706-K708 PolarHBondContact O-N 2.9Å; P706-K708 VanDerWaalsContact O-N 3.12Å; P706-L709 PolarHBondContact O-N 2.03Å; P706-L709 VanDerWaalsContact O-N 3.16Å; P706-Y710 HydrophobicContact CB-CE2 4.1Å
707	W	78.4	Confident	68.6	Low	144 Å²	144	100.1 Å²	100.1	55%	0.545	49%	0.494	S	S	.	.	H	α-helix	trans	-57.1	-29.4	-178.5	75.4	-106.8	0	0	0	113.2	E705 L709 Y710 A711	E705-W707 HydrophobicContact CB-CG 4.32Å; E705-W707 PolarHBondContact O-N 3.13Å; E705-W707 PolarHBondContact OE1-NE1 3Å; E705-W707 PolarHBondContact OE2-NE1 3.46Å; E705-W707 VanDerWaalsContact OE2-NE1 3.17Å; W707-L709 VanDerWaalsContact C-N 3.27Å; W707-L709 PolarHBondContact O-N 2.94Å; W707-Y710 PolarHBondContact O-N 2.59Å; W707-A711 HydrophobicContact CE3-CB 3.97Å; W707-A711 HydrophobicContact CZ3-CB 4.06Å; W707-A711 WeakPolarHBondContact O-CB 3.4Å; W707-A711 PolarHBondContact O-N 3.49Å
708	K	81.6	Confident	71.1	Confident	72 Å²	72	93.3 Å²	93.3	31%	0.313	47%	0.473	S	S	.	.	H	α-helix	trans	-67.2	-27.3	-177.5	-67.5	175.1	-177	160.6	0	112.9	L704 E705 P706 T712	L704-K708 HydrophobicContact CD1-CD 3.98Å; L704-K708 HydrophobicContact CG-CD 4.2Å; E705-K708 PolarHBondContact O-N 3.32Å; E705-K708 VanDerWaalsContact OE2-CE 3.24Å; E705-K708 WeakPolarHBondContact OE2-CE 3.02Å; E705-K708 IonicContact OE2-NZ 2.72Å; E705-K708 PolarHBondContact OE2-NZ 2.98Å; P706-K708 PolarHBondContact O-N 2.9Å; P706-K708 VanDerWaalsContact O-N 3.12Å; K708-T712 PolarHBondContact O-N 3.42Å; K708-T712 PolarHBondContact O-OG1 3.41Å
709	L	82.9	Confident	73.5	Confident	10 Å²	10	88.6 Å²	88.6	5%	0.052	45%	0.453	C	S	.	.	H	α-helix	trans	-74.7	-48.3	172.6	-64.1	90.9	0	0	0	110.2	L627 T681 W685 P706 W707 A711 T712 V713	L627-L709 HydrophobicContact CD1-CB 4.32Å; L627-L709 HydrophobicContact CD1-CD2 3.83Å; T681-L709 HydrophobicContact CG2-CB 4.03Å; T681-L709 HydrophobicContact CG2-CG 4.44Å; W685-L709 HydrophobicContact CB-CD2 4.13Å; W685-L709 HydrophobicContact CD2-CD2 4.46Å; W685-L709 HydrophobicContact CG-CD2 3.88Å; W685-L709 HydrophobicContact CG-CG 4.42Å; P706-L709 PolarHBondContact O-N 2.03Å; P706-L709 VanDerWaalsContact O-N 3.16Å; W707-L709 VanDerWaalsContact C-N 3.27Å; W707-L709 PolarHBondContact O-N 2.94Å; L709-A711 VanDerWaalsContact C-N 3.28Å; L709-A711 PolarHBondContact O-N 3.41Å; L709-T712 WeakPolarHBondContact O-CB 3.16Å; L709-T712 PolarHBondContact O-N 3.12Å; L709-V713 PolarHBondContact O-N 2.88Å; L709-V713 VanDerWaalsContact O-N 3.16Å
710	Y	87.1	Confident	76.2	Confident	91 Å²	91	80 Å²	80	36%	0.357	42%	0.415	S	S	.	.	H	α-helix	trans	-61.3	-36.7	178	-49.9	-44.5	0	0	0	112.5	Y626 L627 M630 P706 W707 T712 V713 G714	Y626-Y710 WeakPolarHBondContact CB-OH 3.01Å; Y626-Y710 VanDerWaalsContact CD2-OH 3.27Å; Y626-Y710 WeakPolarHBondContact CD2-OH 3.31Å; L627-Y710 HydrophobicContact CD2-CD1 4.06Å; L627-Y710 HydrophobicContact CD2-CE1 4.15Å; L627-Y710 HydrophobicContact CG-CE1 4.34Å; M630-Y710 HydrophobicContact SD-CD1 4.39Å; P706-Y710 HydrophobicContact CB-CE2 4.1Å; W707-Y710 PolarHBondContact O-N 2.59Å; Y710-T712 VanDerWaalsContact C-N 3.34Å; Y710-T712 PolarHBondContact O-N 3.26Å; Y710-V713 PolarHBondContact O-N 3.18Å; Y710-G714 PolarHBondContact O-N 2.88Å
711	A	87.9	Confident	78.8	Confident	40 Å²	40	76.2 Å²	76.2	33%	0.331	40%	0.399	S	S	.	.	H	α-helix	trans	-61.8	-39	173.5	0	0	0	0	0	112.6	W707 L709 G714 V715	W707-A711 HydrophobicContact CE3-CB 3.97Å; W707-A711 HydrophobicContact CZ3-CB 4.06Å; W707-A711 WeakPolarHBondContact O-CB 3.4Å; W707-A711 PolarHBondContact O-N 3.49Å; L709-A711 VanDerWaalsContact C-N 3.28Å; L709-A711 PolarHBondContact O-N 3.41Å; A711-G714 PolarHBondContact O-N 3.16Å; A711-V715 WeakPolarHBondContact O-CG2 3.46Å; A711-V715 PolarHBondContact O-N 3.22Å
712	T	87.6	Confident	81.3	Confident	49 Å²	49	71.5 Å²	71.5	30%	0.301	38%	0.383	S	S	.	.	H	α-helix	trans	-65.6	-43	177.1	-54.1	0	0	0	0	111.2	T681 K708 L709 Y710 V715 L716	T681-T712 HydrophobicContact CG2-CG2 4.01Å; T681-T712 WeakPolarHBondContact OG1-CG2 3.37Å; K708-T712 PolarHBondContact O-N 3.42Å; K708-T712 PolarHBondContact O-OG1 3.41Å; L709-T712 WeakPolarHBondContact O-CB 3.16Å; L709-T712 PolarHBondContact O-N 3.12Å; Y710-T712 VanDerWaalsContact C-N 3.34Å; Y710-T712 PolarHBondContact O-N 3.26Å; T712-V715 PolarHBondContact O-N 2.7Å; T712-L716 WeakPolarHBondContact O-CG 3.44Å; T712-L716 PolarHBondContact O-N 2.97Å
713	V	91.9	Very high	83.7	Confident	0 Å²	0	64.3 Å²	64.3	0%	0	35%	0.353	C	S	.	.	H	α-helix	trans	-64.4	-41.8	174.3	-174.5	0	0	0	0	111.1	L627 M630 T681 L709 Y710 V715 L716 L717	L627-V713 HydrophobicContact CD2-CG2 3.88Å; M630-V713 HydrophobicContact CE-CB 4.24Å; M630-V713 HydrophobicContact CE-CG1 3.65Å; M630-V713 HydrophobicContact SD-CG1 4.48Å; T681-V713 HydrophobicContact CG2-CG2 4.18Å; T681-V713 WeakPolarHBondContact OG1-CG2 3.29Å; L709-V713 PolarHBondContact O-N 2.88Å; L709-V713 VanDerWaalsContact O-N 3.16Å; Y710-V713 PolarHBondContact O-N 3.18Å; V713-V715 PolarHBondContact O-N 2.88Å; V713-L716 PolarHBondContact O-N 2.58Å; V713-L717 HydrophobicContact CG1-CD1 3.94Å; V713-L717 WeakPolarHBondContact O-CG 3.46Å; V713-L717 PolarHBondContact O-N 2.91Å
714	G	91.3	Very high	85.9	Confident	35 Å²	35	58.8 Å²	58.8	36%	0.361	32%	0.317	S	S	.	.	H	α-helix	trans	-61.4	-39.7	176.9	0	0	0	0	0	113.4	Y710 A711 L717 A718	Y710-G714 PolarHBondContact O-N 2.88Å; A711-G714 PolarHBondContact O-N 3.16Å; G714-L717 PolarHBondContact O-N 3.32Å; G714-A718 WeakPolarHBondContact O-CB 3.35Å; G714-A718 PolarHBondContact O-N 2.69Å
715	V	92.2	Very high	87.7	Confident	88 Å²	88	57.6 Å²	57.6	53%	0.533	31%	0.309	S	S	.	.	H	α-helix	trans	-65	-44.3	174.7	168.1	0	0	0	0	111.5	A711 T712 V713 L717 A718 I719	A711-V715 WeakPolarHBondContact O-CG2 3.46Å; A711-V715 PolarHBondContact O-N 3.22Å; T712-V715 PolarHBondContact O-N 2.7Å; V713-V715 PolarHBondContact O-N 2.88Å; V715-L717 VanDerWaalsContact C-N 3.31Å; V715-L717 PolarHBondContact O-N 2.81Å; V715-A718 PolarHBondContact O-N 2.87Å; V715-I719 HydrophobicContact CG1-CD1 3.92Å; V715-I719 VanDerWaalsContact O-CG1 3.32Å; V715-I719 WeakPolarHBondContact O-CG1 3.37Å; V715-I719 PolarHBondContact O-N 2.97Å
716	L	91.6	Very high	89.1	Confident	36 Å²	36	57.6 Å²	57.6	19%	0.188	31%	0.311	C	S	.	.	H	α-helix	trans	-62.6	-38.3	177.1	-69	173	0	0	0	112.2	F680 T712 V713 D720 L779	F680-L716 HydrophobicContact CD1-CD1 4.01Å; T712-L716 WeakPolarHBondContact O-CG 3.44Å; T712-L716 PolarHBondContact O-N 2.97Å; V713-L716 PolarHBondContact O-N 2.58Å; L716-D720 PolarHBondContact O-N 3.36Å; L716-L779 HydrophobicContact CD2-CD1 4.15Å
717	L	93.6	Very high	90.2	Very high	37 Å²	37	53.6 Å²	53.6	19%	0.194	29%	0.285	C	S	.	.	H	α-helix	trans	-68.6	-40.6	173.9	-76.3	163.4	0	0	0	112.9	L674 V713 G714 V715 D720 F721	L674-L717 HydrophobicContact CB-CD2 4.05Å; L674-L717 HydrophobicContact CD1-CD1 3.87Å; V713-L717 HydrophobicContact CG1-CD1 3.94Å; V713-L717 WeakPolarHBondContact O-CG 3.46Å; V713-L717 PolarHBondContact O-N 2.91Å; G714-L717 PolarHBondContact O-N 3.32Å; V715-L717 VanDerWaalsContact C-N 3.31Å; V715-L717 PolarHBondContact O-N 2.81Å; L717-D720 PolarHBondContact O-N 2.94Å; L717-F721 WeakPolarHBondContact O-CB 3.37Å; L717-F721 PolarHBondContact O-N 3.33Å
718	A	93.5	Very high	90.8	Very high	47 Å²	47	48.1 Å²	48.1	39%	0.388	27%	0.266	S	S	.	.	H	α-helix	trans	-65	-40.3	178.5	0	0	0	0	0	111.9	G714 V715 L722	G714-A718 WeakPolarHBondContact O-CB 3.35Å; G714-A718 PolarHBondContact O-N 2.69Å; V715-A718 PolarHBondContact O-N 2.87Å; A718-L722 VanDerWaalsContact O-CB 3.31Å; A718-L722 WeakPolarHBondContact O-CB 3.48Å; A718-L722 WeakPolarHBondContact O-CG 3.23Å; A718-L722 PolarHBondContact O-N 3.17Å
719	I	92.6	Very high	91.2	Very high	86 Å²	86	50.6 Å²	50.6	44%	0.441	28%	0.281	S	S	.	.	H	α-helix	trans	-60.3	-46.7	174.6	-68.7	163.9	0	0	0	110.7	V715 S723 Y775	V715-I719 HydrophobicContact CG1-CD1 3.92Å; V715-I719 VanDerWaalsContact O-CG1 3.32Å; V715-I719 WeakPolarHBondContact O-CG1 3.37Å; V715-I719 PolarHBondContact O-N 2.97Å; I719-S723 WeakPolarHBondContact O-CB 3.25Å; I719-S723 PolarHBondContact O-N 2.78Å; I719-Y775 HydrophobicContact CG2-CE2 4.42Å
720	D	92.6	Very high	91.7	Very high	0 Å²	0	55 Å²	55	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-62.3	-53.3	177.5	-173	48.1	0	0	0	111.9	G669 L670 S673 L716 L717 L722 S723 L724 Y775 K776	G669-D720 VanDerWaalsContact O-OD2 3.05Å; L670-D720 PolarHBondContact N-OD2 2.99Å; S673-D720 VanDerWaalsContact CB-OD2 3.3Å; S673-D720 WeakPolarHBondContact CB-OD2 3.08Å; S673-D720 WeakPolarHBondContact OG-CB 3.25Å; S673-D720 PolarHBondContact OG-OD2 3.06Å; L716-D720 PolarHBondContact O-N 3.36Å; L717-D720 PolarHBondContact O-N 2.94Å; D720-L722 VanDerWaalsContact C-N 3.32Å; D720-L722 PolarHBondContact O-N 2.97Å; D720-S723 PolarHBondContact O-N 3.18Å; D720-S723 PolarHBondContact O-OG 3.46Å; D720-L724 WeakPolarHBondContact O-CG 3.49Å; D720-L724 PolarHBondContact O-N 3.35Å; D720-Y775 WeakPolarHBondContact CA-OH 3.43Å; D720-Y775 WeakPolarHBondContact CB-OH 3.3Å; D720-Y775 PolarHBondContact OD1-OH 3.48Å; D720-K776 IonicContact OD1-NZ 2.65Å; D720-K776 PolarHBondContact OD1-NZ 3.34Å; D720-K776 IonicContact OD2-NZ 3.75Å
721	F	94.1	Very high	92	Very high	97 Å²	97	51.1 Å²	51.1	43%	0.425	29%	0.293	S	S	.	.	H	α-helix	trans	-54.7	-45.9	178.1	-179.7	-89.1	0	0	0	112.1	W666 L670 L717 L724 M725	W666-F721 AromaticContact CH2-CD2 3.98Å; W666-F721 HydrophobicContact CH2-CD2 3.98Å; W666-F721 HydrophobicContact CH2-CE2 4Å; W666-F721 HydrophobicContact CH2-CG 4.5Å; W666-F721 AromaticContact CZ3-CD2 3.55Å; W666-F721 HydrophobicContact CZ3-CD2 3.55Å; W666-F721 AromaticContact CZ3-CE2 3.86Å; W666-F721 HydrophobicContact CZ3-CE2 3.86Å; W666-F721 HydrophobicContact CZ3-CG 4.28Å; L670-F721 HydrophobicContact CD2-CB 4.22Å; L670-F721 HydrophobicContact CD2-CD2 4.41Å; L717-F721 WeakPolarHBondContact O-CB 3.37Å; L717-F721 PolarHBondContact O-N 3.33Å; F721-L724 PolarHBondContact O-N 3.36Å; F721-M725 HydrophobicContact CD1-CG 3.97Å; F721-M725 HydrophobicContact CE1-CG 3.52Å; F721-M725 HydrophobicContact CE1-SD 4.25Å; F721-M725 HydrophobicContact CZ-CG 3.83Å; F721-M725 HydrophobicContact CZ-SD 3.95Å; F721-M725 WeakPolarHBondContact O-CB 3.31Å; F721-M725 WeakPolarHBondContact O-CG 3.13Å; F721-M725 PolarHBondContact O-N 2.61Å
722	L	93.7	Very high	92.1	Very high	101 Å²	101	52.2 Å²	52.2	53%	0.529	30%	0.297	S	S	.	.	H	α-helix	trans	-64.7	-41.1	176.8	-71.9	170.2	0	0	0	111.9	A718 D720 L724 M725 I726	A718-L722 VanDerWaalsContact O-CB 3.31Å; A718-L722 WeakPolarHBondContact O-CB 3.48Å; A718-L722 WeakPolarHBondContact O-CG 3.23Å; A718-L722 PolarHBondContact O-N 3.17Å; D720-L722 VanDerWaalsContact C-N 3.32Å; D720-L722 PolarHBondContact O-N 2.97Å; L722-L724 VanDerWaalsContact C-N 3.33Å; L722-L724 PolarHBondContact O-N 3.48Å; L722-M725 PolarHBondContact O-N 2.93Å; L722-I726 WeakPolarHBondContact O-CB 3.24Å; L722-I726 WeakPolarHBondContact O-CD1 3.45Å; L722-I726 WeakPolarHBondContact O-CG1 3.49Å; L722-I726 PolarHBondContact O-N 2.9Å
723	S	91.8	Very high	92.2	Very high	30 Å²	30	50.6 Å²	50.6	21%	0.21	29%	0.287	C	S	.	.	H	α-helix	trans	-62.3	-39.6	177.3	76.1	0	0	0	0	112.6	I719 D720 W727	I719-S723 WeakPolarHBondContact O-CB 3.25Å; I719-S723 PolarHBondContact O-N 2.78Å; D720-S723 PolarHBondContact O-N 3.18Å; D720-S723 PolarHBondContact O-OG 3.46Å; S723-W727 PolarHBondContact O-N 2.9Å
724	L	91.6	Very high	92	Very high	2 Å²	2	54.4 Å²	54.4	1%	0.01	30%	0.304	C	S	.	.	H	α-helix	trans	-73.6	-38.4	177.3	-63.1	-177.7	0	0	0	112.3	L665 W666 D720 F721 L722 W727 Q728	L665-L724 HydrophobicContact CD1-CD2 3.8Å; L665-L724 HydrophobicContact CD2-CD2 4.19Å; L665-L724 HydrophobicContact CG-CD2 3.9Å; W666-L724 HydrophobicContact CD2-CD1 4.46Å; W666-L724 HydrophobicContact CE3-CB 4.18Å; W666-L724 HydrophobicContact CE3-CD1 3.87Å; W666-L724 HydrophobicContact CH2-CB 3.5Å; W666-L724 HydrophobicContact CZ2-CB 3.86Å; W666-L724 HydrophobicContact CZ3-CB 3.68Å; W666-L724 HydrophobicContact CZ3-CD1 3.97Å; W666-L724 HydrophobicContact CZ3-CG 4.46Å; D720-L724 WeakPolarHBondContact O-CG 3.49Å; D720-L724 PolarHBondContact O-N 3.35Å; F721-L724 PolarHBondContact O-N 3.36Å; L722-L724 VanDerWaalsContact C-N 3.33Å; L722-L724 PolarHBondContact O-N 3.48Å; L724-W727 HydrophobicContact CD2-CE3 4.34Å; L724-Q728 WeakPolarHBondContact O-CB 3.36Å; L724-Q728 PolarHBondContact O-N 2.69Å
725	M	92.2	Very high	91.8	Very high	67 Å²	67	54.4 Å²	54.4	33%	0.33	30%	0.295	S	S	.	.	H	α-helix	trans	-59.8	-46	170.9	-76.6	-52.5	-59.5	0	0	111.5	W666 F721 L722 Q728 I729	W666-M725 HydrophobicContact CH2-CG 3.8Å; W666-M725 HydrophobicContact CH2-SD 3.63Å; W666-M725 HydrophobicContact CZ2-CG 4.24Å; W666-M725 HydrophobicContact CZ2-SD 3.59Å; W666-M725 VanDerWaalsContact CZ2-SD 3.59Å; F721-M725 HydrophobicContact CD1-CG 3.97Å; F721-M725 HydrophobicContact CE1-CG 3.52Å; F721-M725 HydrophobicContact CE1-SD 4.25Å; F721-M725 HydrophobicContact CZ-CG 3.83Å; F721-M725 HydrophobicContact CZ-SD 3.95Å; F721-M725 WeakPolarHBondContact O-CB 3.31Å; F721-M725 WeakPolarHBondContact O-CG 3.13Å; F721-M725 PolarHBondContact O-N 2.61Å; L722-M725 PolarHBondContact O-N 2.93Å; M725-Q728 PolarHBondContact O-N 3.03Å; M725-I729 HydrophobicContact CE-CD1 3.94Å; M725-I729 WeakPolarHBondContact O-CB 3.47Å; M725-I729 VanDerWaalsContact O-CG1 3.28Å; M725-I729 WeakPolarHBondContact O-CG1 3.27Å; M725-I729 PolarHBondContact O-N 3.03Å
726	I	93.6	Very high	91.6	Very high	91 Å²	91	51.9 Å²	51.9	47%	0.467	28%	0.281	S	S	.	.	H	α-helix	trans	-64	-47.7	-178.7	-70.5	164.5	0	0	0	110.5	L722 Q728 I729 V730 W768	L722-I726 WeakPolarHBondContact O-CB 3.24Å; L722-I726 WeakPolarHBondContact O-CD1 3.45Å; L722-I726 WeakPolarHBondContact O-CG1 3.49Å; L722-I726 PolarHBondContact O-N 2.9Å; I726-Q728 PolarHBondContact O-N 2.86Å; I726-I729 PolarHBondContact O-N 2.91Å; I726-V730 HydrophobicContact CG2-CG2 4.3Å; I726-V730 WeakPolarHBondContact O-CB 3.28Å; I726-V730 VanDerWaalsContact O-CG2 3.27Å; I726-V730 WeakPolarHBondContact O-CG2 3.49Å; I726-V730 PolarHBondContact O-N 2.94Å; I726-W768 HydrophobicContact CG2-CH2 3.92Å; I726-W768 HydrophobicContact CG2-CZ3 4.27Å
727	W	93.2	Very high	91.4	Very high	3 Å²	3	52.8 Å²	52.8	1%	0.011	29%	0.287	C	S	.	.	H	α-helix	trans	-57.3	-51	174.2	-179.8	7	0	0	0	110.8	L665 S723 L724 I729 V730 D731 L733 S762 M765 W768 L769 V772	L665-W727 HydrophobicContact CD1-CE3 4.2Å; L665-W727 HydrophobicContact CD1-CH2 4.14Å; L665-W727 HydrophobicContact CD1-CZ3 3.57Å; L665-W727 HydrophobicContact CD2-CD2 4.19Å; L665-W727 HydrophobicContact CD2-CE3 3.77Å; L665-W727 HydrophobicContact CD2-CH2 4.22Å; L665-W727 HydrophobicContact CD2-CZ3 3.8Å; L665-W727 HydrophobicContact CG-CZ3 4.35Å; S723-W727 PolarHBondContact O-N 2.9Å; L724-W727 HydrophobicContact CD2-CE3 4.34Å; W727-I729 PolarHBondContact O-N 2.65Å; W727-V730 PolarHBondContact O-N 2.99Å; W727-D731 VanDerWaalsContact CD1-O 3.32Å; W727-D731 PolarHBondContact NE1-O 2.88Å; W727-D731 CarbonylContact O-C 3.56Å; W727-D731 PolarHBondContact O-N 3.03Å; W727-L733 HydrophobicContact CZ2-CD1 3.91Å; W727-S762 PolarHBondContact NE1-OG 3.18Å; W727-M765 HydrophobicContact CH2-SD 4.01Å; W727-M765 HydrophobicContact CZ2-CE 3.99Å; W727-M765 HydrophobicContact CZ2-SD 3.66Å; W727-W768 HydrophobicContact CB-CD2 3.99Å; W727-W768 HydrophobicContact CB-CE3 3.81Å; W727-W768 HydrophobicContact CB-CG 4.49Å; W727-W768 HydrophobicContact CB-CZ3 4.14Å; W727-W768 AromaticContact CD1-CD1 3.49Å; W727-W768 VanDerWaalsContact CD1-CD1 3.49Å; W727-W768 AromaticContact CD1-CD2 3.69Å; W727-W768 AromaticContact CD1-CE2 3.87Å; W727-W768 AromaticContact CD1-CG 3.47Å; W727-W768 VanDerWaalsContact CD1-CG 3.47Å; W727-W768 AromaticContact CD1-NE1 3.73Å; W727-W768 HydrophobicContact CD2-CB 3.6Å; W727-W768 HydrophobicContact CD2-CD2 4.31Å; W727-W768 AromaticContact CD2-CG 3.9Å; W727-W768 HydrophobicContact CD2-CG 3.9Å; W727-W768 VanDerWaalsContact CE2-CB 3.46Å; W727-W768 AromaticContact CE2-CG 3.82Å; W727-W768 HydrophobicContact CE3-CB 4.03Å; W727-W768 HydrophobicContact CG-CB 3.99Å; W727-W768 AromaticContact CG-CD2 3.73Å; W727-W768 HydrophobicContact CG-CD2 3.73Å; W727-W768 HydrophobicContact CG-CE3 4.01Å; W727-W768 AromaticContact CG-CG 3.73Å; W727-W768 HydrophobicContact CG-CG 3.73Å; W727-W768 HydrophobicContact CH2-CB 4.25Å; W727-W768 HydrophobicContact CZ2-CB 3.83Å; W727-W768 HydrophobicContact CZ3-CB 4.33Å; W727-W768 AromaticContact NE1-CD1 3.45Å; W727-W768 AromaticContact NE1-CG 3.55Å; W727-L769 HydrophobicContact CH2-CD2 3.68Å; W727-L769 HydrophobicContact CH2-CG 4.05Å; W727-L769 HydrophobicContact CZ3-CD2 4.21Å; W727-V772 HydrophobicContact CE3-CG2 4.33Å; W727-V772 HydrophobicContact CZ3-CG2 4.4Å
728	Q	89.7	Confident	91.1	Very high	29 Å²	29	54.3 Å²	54.3	14%	0.136	29%	0.293	C	S	.	.	H	α-helix	trans	-65.3	-23.1	-175.7	-171.9	53.1	66.3	0	0	114.4	L724 M725 I726 P732	L724-Q728 WeakPolarHBondContact O-CB 3.36Å; L724-Q728 PolarHBondContact O-N 2.69Å; M725-Q728 PolarHBondContact O-N 3.03Å; I726-Q728 PolarHBondContact O-N 2.86Å; Q728-P732 VanDerWaalsContact NE2-CB 3.32Å
729	I	91.7	Very high	90.9	Very high	124 Å²	124	57.7 Å²	57.7	64%	0.636	30%	0.299	S	S	*	.	H	α-helix	trans	-87.6	-38.3	174.7	-69.1	168.2	0	0	0	111.8	M725 I726 W727	M725-I729 HydrophobicContact CE-CD1 3.94Å; M725-I729 WeakPolarHBondContact O-CB 3.47Å; M725-I729 VanDerWaalsContact O-CG1 3.28Å; M725-I729 WeakPolarHBondContact O-CG1 3.27Å; M725-I729 PolarHBondContact O-N 3.03Å; I726-I729 PolarHBondContact O-N 2.91Å; W727-I729 PolarHBondContact O-N 2.65Å
730	V	93.6	Very high	90.6	Very high	102 Å²	102	55.4 Å²	55.4	62%	0.618	29%	0.286	S	S	*	.	H	α-helix	trans	-88	-33.6	-172.4	175.8	0	0	0	0	113.1	I726 W727 W768	I726-V730 HydrophobicContact CG2-CG2 4.3Å; I726-V730 WeakPolarHBondContact O-CB 3.28Å; I726-V730 VanDerWaalsContact O-CG2 3.27Å; I726-V730 WeakPolarHBondContact O-CG2 3.49Å; I726-V730 PolarHBondContact O-N 2.94Å; W727-V730 PolarHBondContact O-N 2.99Å; V730-W768 HydrophobicContact CB-CZ2 4.08Å; V730-W768 HydrophobicContact CG1-CZ2 3.94Å
731	D	92.1	Very high	90.3	Very high	10 Å²	10	60.9 Å²	60.9	5%	0.053	32%	0.32	C	S	.	.	S	Bend	trans	-146.4	73.6	-178.3	-176.4	23	0	0	0	110	W727 S762 E763 K764 W768	W727-D731 VanDerWaalsContact CD1-O 3.32Å; W727-D731 PolarHBondContact NE1-O 2.88Å; W727-D731 CarbonylContact O-C 3.56Å; W727-D731 PolarHBondContact O-N 3.03Å; D731-S762 VanDerWaalsContact CG-OG 3.24Å; D731-S762 WeakPolarHBondContact O-CB 3.46Å; D731-S762 VanDerWaalsContact OD1-CB 3.25Å; D731-S762 WeakPolarHBondContact OD1-CB 3.17Å; D731-S762 VanDerWaalsContact OD2-CB 3.25Å; D731-S762 WeakPolarHBondContact OD2-CB 3.39Å; D731-S762 PolarHBondContact OD2-OG 3.24Å; D731-E763 PolarHBondContact OD1-N 2.03Å; D731-E763 PolarHBondContact OD2-N 3.25Å; D731-K764 WeakPolarHBondContact OD2-CA 3.11Å; D731-K764 PolarHBondContact OD2-N 3.37Å; D731-W768 VanDerWaalsContact CB-NE1 3.32Å; D731-W768 VanDerWaalsContact OD2-CD1 3.26Å; D731-W768 PolarHBondContact OD2-NE1 3.29Å
732	P	90.9	Very high	89.8	Confident	63 Å²	63	63.2 Å²	63.2	41%	0.409	33%	0.326	S	S	.	.			trans	-66	136	-173.1	25.9	-34.9	0	0	0	112.8	Q728 H734	Q728-P732 VanDerWaalsContact NE2-CB 3.32Å; P732-H734 PolarHBondContact O-N 2.86Å; P732-H734 PolarHBondContact O-ND1 3.18Å
733	L	88.9	Confident	89.2	Confident	15 Å²	15	62.5 Å²	62.5	8%	0.079	32%	0.32	C	S	.	.			trans	-62.9	125.3	174.7	-75.8	73.1	0	0	0	111	C661 L665 W727 C760 S761 M765	C661-L733 HydrophobicContact CB-CB 4.16Å; C661-L733 HydrophobicContact CB-CD2 4.38Å; L665-L733 HydrophobicContact CD2-CD1 4.11Å; W727-L733 HydrophobicContact CZ2-CD1 3.91Å; L733-C760 HydrophobicContact CD2-CB 4.36Å; L733-S761 CarbonylContact C-O 3.59Å; L733-S761 WeakPolarHBondContact CA-O 3.25Å; L733-M765 HydrophobicContact CD2-CE 4.07Å; L733-M765 HydrophobicContact CG-CE 4Å
734	H	87	Confident	88.3	Confident	79 Å²	79	65.1 Å²	65.1	37%	0.366	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	175.3	178.5	59.3	-90	0	0	0	110.8	P732 C760 S761	P732-H734 PolarHBondContact O-N 2.86Å; P732-H734 PolarHBondContact O-ND1 3.18Å; H734-C760 WeakPolarHBondContact O-CA 3.09Å; H734-S761 PolarHBondContact N-O 3.29Å; H734-S761 PolarHBondContact ND1-O 2.85Å; H734-S761 PolarHBondContact O-N 2.81Å
735	I	87.6	Confident	87.5	Confident	35 Å²	35	66.3 Å²	66.3	18%	0.179	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	118.8	-179.6	-40.8	178.3	0	0	0	109.4	R654 F657 P658 E758	R654-I735 HydrophobicContact CG-CD1 3.75Å; R654-I735 WeakPolarHBondContact O-CD1 2.96Å; F657-I735 HydrophobicContact CB-CD1 3.86Å; F657-I735 HydrophobicContact CD1-CD1 4.09Å; F657-I735 HydrophobicContact CD1-CG1 3.97Å; F657-I735 HydrophobicContact CG-CD1 4.28Å; P658-I735 HydrophobicContact CG-CD1 4.3Å; P658-I735 HydrophobicContact CG-CG1 4.13Å; I735-E758 HydrophobicContact CG2-CB 4.22Å; I735-E758 HydrophobicContact CG2-CG 4.31Å
736	T	87.4	Confident	86.4	Confident	36 Å²	36	73.3 Å²	73.3	22%	0.221	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	143.5	167.9	40.2	0	0	0	0	110.3	H759 S761	T736-H759 PolarHBondContact N-O 3.17Å; T736-H759 PolarHBondContact O-N 3.08Å; T736-H759 VanDerWaalsContact O-N 3.12Å; T736-H759 PolarHBondContact OG1-CD2 2.95Å; T736-H759 PolarHBondContact OG1-NE2 2.96Å; T736-H759 PolarHBondContact OG1-O 3.44Å; T736-S761 WeakPolarHBondContact OG1-CB 3.45Å
737	V	89.1	Confident	85.1	Confident	54 Å²	54	77.6 Å²	77.6	33%	0.327	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	107.8	176.6	-170.2	0	0	0	0	108.7	L756 L757 E758	V737-L756 HydrophobicContact CG1-CB 4.14Å; V737-L756 HydrophobicContact CG1-CD1 4.29Å; V737-L756 HydrophobicContact CG1-CD2 4.19Å; V737-L756 HydrophobicContact CG1-CG 4.46Å; V737-L757 CarbonylContact C-O 3.6Å; V737-L757 WeakPolarHBondContact CA-O 3.39Å; V737-E758 HydrophobicContact CG2-CG 4.28Å
738	E	86.6	Confident	83.6	Confident	70 Å²	70	81.1 Å²	81.1	33%	0.327	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	133	173.8	-163.5	176.9	165.7	0	0	109.2	L756 L757 H759	E738-L756 WeakPolarHBondContact O-CA 3.33Å; E738-L757 HydrophobicContact CB-CB 4.06Å; E738-L757 PolarHBondContact N-O 3.45Å; E738-L757 PolarHBondContact O-N 3.25Å; E738-H759 IonicContact OE2-CE1 2.63Å; E738-H759 IonicContact OE2-ND1 3.51Å
739	K	89.1	Confident	82.4	Confident	117 Å²	117	84.9 Å²	84.9	51%	0.509	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	115.4	179.9	-58.3	-143.5	174.2	-166.9	0	109.9	E580 L756	E580-K739 IonicContact OE1-NZ 2.83Å; E580-K739 PolarHBondContact OE1-NZ 3.34Å; K739-L756 HydrophobicContact CB-CD2 4.18Å; K739-L756 HydrophobicContact CD-CD2 3.68Å; K739-L756 HydrophobicContact CG-CD2 3.61Å
740	F	86.8	Confident	81.3	Confident	38 Å²	38	79.8 Å²	79.8	17%	0.167	41%	0.411	C	S	.	.	P	Polyproline II helix	trans	-79.3	168	175.1	-67.6	-67	0	0	0	112.2	R583 P755 L757	R583-F740 VanDerWaalsContact NH1-CD2 3.28Å; F740-P755 HydrophobicContact CB-CB 4.08Å; F740-P755 HydrophobicContact CB-CG 4.06Å; F740-P755 HydrophobicContact CD2-CB 4.13Å; F740-P755 PolarHBondContact N-O 2.99Å; F740-L757 HydrophobicContact CE2-CB 3.85Å; F740-L757 HydrophobicContact CE2-CD1 4.26Å; F740-L757 HydrophobicContact CE2-CD2 4.27Å; F740-L757 HydrophobicContact CE2-CG 4.36Å; F740-L757 HydrophobicContact CZ-CB 4.41Å; F740-L757 HydrophobicContact CZ-CD2 4.14Å
741	T	85.4	Confident	80.5	Confident	116 Å²	116	76.1 Å²	76.1	71%	0.712	39%	0.389	S	S	*	.	P	Polyproline II helix	trans	-55.4	142.9	168.3	46.8	0	0	0	0	111	P755	T741-P755 VanDerWaalsContact O-CD 3.27Å; T741-P755 WeakPolarHBondContact O-CD 3.36Å
742	R	83.7	Confident	80	Confident	146 Å²	146	77.9 Å²	77.9	55%	0.551	40%	0.398	S	S	*	.	P	Polyproline II helix	trans	-66.1	136.3	177.6	-66.9	179.7	-178	156.3	1.4	111.1	I753 Q754	R742-I753 CarbonylContact C-O 3.54Å; R742-I753 VanDerWaalsContact CA-O 3.23Å; R742-I753 WeakPolarHBondContact CA-O 3.38Å; R742-Q754 HydrophobicContact CG-CB 4.14Å; R742-Q754 HydrophobicContact CG-CG 4.4Å; R742-Q754 VanDerWaalsContact NH2-OE1 3.09Å
743	E	82.3	Confident	79.6	Confident	86 Å²	86	76.3 Å²	76.3	40%	0.402	39%	0.386	S	S	.	.	B	Isolated β-bridge	trans	-108.9	146.4	179.3	-65.7	179.4	-140.8	0	0	109.7	R583 I753 P755	R583-E743 IonicContact CZ-OE1 2.78Å; R583-E743 IonicContact NH2-OE1 2.72Å; R583-E743 PolarHBondContact NH2-OE1 3.44Å; E743-I753 PolarHBondContact N-O 2.69Å; E743-I753 PolarHBondContact O-N 2.74Å; E743-P755 HydrophobicContact CG-CG 4.05Å; E743-P755 WeakPolarHBondContact OE1-CG 3.46Å
744	A	71.7	Confident	79.6	Confident	84 Å²	84	77 Å²	77	69%	0.694	39%	0.389	S	S	*	.			trans	-79.2	129	171.2	0	0	0	0	0	109.2
745	P	74.8	Confident	79.7	Confident	28 Å²	28	73.4 Å²	73.4	18%	0.182	37%	0.372	C	S	.	.			trans	-63.6	155.8	174	29.5	-37.2	0	0	0	111.2	E747 D748 V751 I753	P745-E747 VanDerWaalsContact C-N 3.34Å; P745-D748 WeakPolarHBondContact CG-O 3.27Å; P745-V751 WeakPolarHBondContact CD-O 3.23Å; P745-V751 HydrophobicContact CG-CB 4.16Å; P745-V751 HydrophobicContact CG-CG1 4.4Å; P745-V751 VanDerWaalsContact CG-O 3.31Å; P745-V751 WeakPolarHBondContact CG-O 3.46Å; P745-I753 HydrophobicContact CB-CD1 3.86Å; P745-I753 HydrophobicContact CB-CG1 4.26Å
746	K	68.6	Low	79.7	Confident	213 Å²	213	71.8 Å²	71.8	93%	0.926	36%	0.364	S	S	*	.	S	Bend	trans	-79.5	-14.7	-177.8	-64.8	178.5	-178.3	173.6	0	114.2
747	E	66.8	Low	79.8	Confident	182 Å²	182	70.1 Å²	70.1	85%	0.85	35%	0.354	S	S	*	.	S	Bend	trans	-125.9	-64.8	-169.5	-64.5	179.2	-174.1	0	0	112.5	P745 L749	P745-E747 VanDerWaalsContact C-N 3.34Å; E747-L749 PolarHBondContact O-N 3.42Å
748	D	62.5	Low	79.7	Confident	76 Å²	76	68 Å²	68	41%	0.406	34%	0.341	S	S	.	.			trans	-91.6	105.9	-176.6	-168.8	12.3	0	0	0	113.9	K383 P745 D750 V751	K383-D748 IonicContact NZ-OD1 3.57Å; K383-D748 PolarHBondContact NZ-OD1 2.97Å; P745-D748 WeakPolarHBondContact CG-O 3.27Å; D748-D750 PolarHBondContact O-N 2.96Å; D748-D750 PolarHBondContact OD1-N 3.44Å; D748-V751 PolarHBondContact O-N 3.21Å
749	L	63.5	Low	79.7	Confident	109 Å²	109	67.5 Å²	67.5	57%	0.571	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-12.1	-177.6	-65.8	170.1	0	0	0	115.4	K384 E747	K384-L749 WeakPolarHBondContact CE-O 3.31Å; K384-L749 PolarHBondContact NZ-O 3.38Å; E747-L749 PolarHBondContact O-N 3.42Å
750	D	69.3	Low	79.7	Confident	17 Å²	17	63 Å²	63	9%	0.091	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.9	-5.6	-177.4	-70.1	-53.5	0	0	0	115.1	R357 K383 T576 V577 D748	R357-D750 IonicContact CZ-OD1 2.58Å; R357-D750 VanDerWaalsContact CZ-OD1 3.3Å; R357-D750 IonicContact NH1-OD1 3.47Å; R357-D750 PolarHBondContact NH1-OD1 2.73Å; R357-D750 IonicContact NH2-OD1 3.62Å; R357-D750 PolarHBondContact NH2-OD1 2.77Å; K383-D750 IonicContact NZ-OD2 3.32Å; K383-D750 PolarHBondContact NZ-OD2 3.04Å; T576-D750 WeakPolarHBondContact CA-O 3.06Å; V577-D750 PolarHBondContact N-O 2.84Å; V577-D750 VanDerWaalsContact N-O 3.11Å; D748-D750 PolarHBondContact O-N 2.96Å; D748-D750 PolarHBondContact OD1-N 3.44Å
751	V	77.1	Confident	79.8	Confident	24 Å²	24	62.4 Å²	62.4	15%	0.145	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	152.4	175.9	169.1	0	0	0	0	111.3	V577 L579 P745 D748 I753	V577-V751 CarbonylContact O-C 3.38Å; V577-V751 WeakPolarHBondContact O-CA 3.41Å; L579-V751 HydrophobicContact CB-CG1 4.16Å; L579-V751 HydrophobicContact CD1-CG1 3.82Å; L579-V751 HydrophobicContact CD1-CG2 4.22Å; L579-V751 HydrophobicContact CG-CG1 3.78Å; L579-V751 HydrophobicContact CG-CG2 4.46Å; P745-V751 WeakPolarHBondContact CD-O 3.23Å; P745-V751 HydrophobicContact CG-CB 4.16Å; P745-V751 HydrophobicContact CG-CG1 4.4Å; P745-V751 VanDerWaalsContact CG-O 3.31Å; P745-V751 WeakPolarHBondContact CG-O 3.46Å; D748-V751 PolarHBondContact O-N 3.21Å; V751-I753 HydrophobicContact CG1-CG1 4.41Å
752	L	80.3	Confident	80.1	Confident	48 Å²	48	57.1 Å²	57.1	25%	0.251	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	129.4	159	-70.8	174.1	0	0	0	108.7	T576 V577 V578 L579	T576-L752 HydrophobicContact CG2-CD1 4.18Å; T576-L752 HydrophobicContact CG2-CG 4.13Å; V577-L752 PolarHBondContact O-N 2.74Å; V578-L752 CarbonylContact C-O 3.58Å; V578-L752 VanDerWaalsContact CA-O 3.3Å; V578-L752 WeakPolarHBondContact CA-O 3.41Å; L579-L752 PolarHBondContact N-O 3.19Å
753	I	84.3	Confident	80.4	Confident	29 Å²	29	57.9 Å²	57.9	15%	0.149	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	131.1	176.2	-64.1	170.2	0	0	0	108	E581 R742 E743 P745 V751	E581-I753 HydrophobicContact CB-CG2 3.92Å; E581-I753 HydrophobicContact CG-CG2 3.92Å; R742-I753 CarbonylContact C-O 3.54Å; R742-I753 VanDerWaalsContact CA-O 3.23Å; R742-I753 WeakPolarHBondContact CA-O 3.38Å; E743-I753 PolarHBondContact N-O 2.69Å; E743-I753 PolarHBondContact O-N 2.74Å; P745-I753 HydrophobicContact CB-CD1 3.86Å; P745-I753 HydrophobicContact CB-CG1 4.26Å; V751-I753 HydrophobicContact CG1-CG1 4.41Å
754	Q	87.6	Confident	80.8	Confident	29 Å²	29	59.8 Å²	59.8	14%	0.136	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	102.3	168.9	-179	141.3	10	0	0	108.6	V578 L579 E581 R742 L756	V578-Q754 HydrophobicContact CG1-CB 3.65Å; L579-Q754 PolarHBondContact O-N 2.95Å; E581-Q754 PolarHBondContact N-O 2.82Å; E581-Q754 VanDerWaalsContact N-O 3.17Å; R742-Q754 HydrophobicContact CG-CB 4.14Å; R742-Q754 HydrophobicContact CG-CG 4.4Å; R742-Q754 VanDerWaalsContact NH2-OE1 3.09Å; Q754-L756 HydrophobicContact CG-CD2 4.49Å
755	P	88.6	Confident	81.6	Confident	4 Å²	4	57.1 Å²	57.1	3%	0.026	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	134	-177	-4.3	19	0	0	0	111	E581 R583 F740 T741 E743	E581-P755 CarbonylContact O-C 3.56Å; E581-P755 WeakPolarHBondContact O-CA 3.49Å; R583-P755 HydrophobicContact CG-CB 4.36Å; F740-P755 HydrophobicContact CB-CB 4.08Å; F740-P755 HydrophobicContact CB-CG 4.06Å; F740-P755 HydrophobicContact CD2-CB 4.13Å; F740-P755 PolarHBondContact N-O 2.99Å; T741-P755 VanDerWaalsContact O-CD 3.27Å; T741-P755 WeakPolarHBondContact O-CD 3.36Å; E743-P755 HydrophobicContact CG-CG 4.05Å; E743-P755 WeakPolarHBondContact OE1-CG 3.46Å
756	L	89.4	Confident	82.3	Confident	1 Å²	1	60.9 Å²	60.9	1%	0.005	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	144.4	178.7	-58.3	-176.7	0	0	0	110.8	E580 E581 Y582 R583 V737 E738 K739 Q754	E580-L756 HydrophobicContact CB-CD1 3.83Å; E580-L756 HydrophobicContact CB-CG 4.37Å; E580-L756 HydrophobicContact CG-CD1 4.31Å; E581-L756 PolarHBondContact O-N 2.7Å; Y582-L756 HydrophobicContact CD1-CB 3.96Å; Y582-L756 HydrophobicContact CD1-CD1 4.36Å; Y582-L756 HydrophobicContact CE1-CB 4.08Å; Y582-L756 HydrophobicContact CE1-CD1 3.77Å; Y582-L756 HydrophobicContact CE2-CD1 3.91Å; Y582-L756 HydrophobicContact CG-CB 4.37Å; R583-L756 PolarHBondContact N-O 3.05Å; V737-L756 HydrophobicContact CG1-CB 4.14Å; V737-L756 HydrophobicContact CG1-CD1 4.29Å; V737-L756 HydrophobicContact CG1-CD2 4.19Å; V737-L756 HydrophobicContact CG1-CG 4.46Å; E738-L756 WeakPolarHBondContact O-CA 3.33Å; K739-L756 HydrophobicContact CB-CD2 4.18Å; K739-L756 HydrophobicContact CD-CD2 3.68Å; K739-L756 HydrophobicContact CG-CD2 3.61Å; Q754-L756 HydrophobicContact CG-CD2 4.49Å
757	L	88.7	Confident	83.4	Confident	2 Å²	2	55.1 Å²	55.1	1%	0.01	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	123.3	170.3	-151.3	67.8	0	0	0	109.5	R583 V737 E738 F740 Q829	R583-L757 HydrophobicContact CB-CD1 3.78Å; V737-L757 CarbonylContact C-O 3.6Å; V737-L757 WeakPolarHBondContact CA-O 3.39Å; E738-L757 HydrophobicContact CB-CB 4.06Å; E738-L757 PolarHBondContact N-O 3.45Å; E738-L757 PolarHBondContact O-N 3.25Å; F740-L757 HydrophobicContact CE2-CB 3.85Å; F740-L757 HydrophobicContact CE2-CD1 4.26Å; F740-L757 HydrophobicContact CE2-CD2 4.27Å; F740-L757 HydrophobicContact CE2-CG 4.36Å; F740-L757 HydrophobicContact CZ-CB 4.41Å; F740-L757 HydrophobicContact CZ-CD2 4.14Å; L757-Q829 HydrophobicContact CD1-CG 3.85Å; L757-Q829 HydrophobicContact CD2-CG 4.41Å; L757-Q829 HydrophobicContact CG-CG 4.32Å
758	E	87.9	Confident	84.6	Confident	10 Å²	10	49 Å²	49	5%	0.047	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	126	165.4	-70.2	-169.9	167.5	0	0	109.4	Y582 R649 R654 I735 V737 Q829	Y582-E758 HydrophobicContact CD1-CG 4.04Å; Y582-E758 HydrophobicContact CE1-CG 3.96Å; R649-E758 WeakPolarHBondContact CD-OE2 3.44Å; R649-E758 IonicContact CZ-OE1 3.56Å; R649-E758 IonicContact NH1-OE1 3.58Å; R649-E758 PolarHBondContact NH1-OE1 3.44Å; R649-E758 IonicContact NH1-OE2 3.64Å; R654-E758 IonicContact NE-OE1 2.75Å; I735-E758 HydrophobicContact CG2-CB 4.22Å; I735-E758 HydrophobicContact CG2-CG 4.31Å; V737-E758 HydrophobicContact CG2-CG 4.28Å; E758-Q829 PolarHBondContact O-NE2 3.17Å; E758-Q829 VanDerWaalsContact O-NE2 3.14Å
759	H	86.3	Confident	85.9	Confident	58 Å²	58	46.8 Å²	46.8	27%	0.269	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	163	172.8	63.4	-109.2	0	0	0	111.3	T736 E738	T736-H759 PolarHBondContact N-O 3.17Å; T736-H759 PolarHBondContact O-N 3.08Å; T736-H759 VanDerWaalsContact O-N 3.12Å; T736-H759 PolarHBondContact OG1-CD2 2.95Å; T736-H759 PolarHBondContact OG1-NE2 2.96Å; T736-H759 PolarHBondContact OG1-O 3.44Å; E738-H759 IonicContact OE2-CE1 2.63Å; E738-H759 IonicContact OE2-ND1 3.51Å
760	C	88.6	Confident	87.2	Confident	23 Å²	23	43.7 Å²	43.7	16%	0.155	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	121.7	173.7	-55.4	0	0	0	0	108.6	C661 R664 L733 H734	C661-C760 VanDerWaalsContact CA-SG 3.53Å; C661-C760 HydrophobicContact CB-CB 3.66Å; C661-C760 WeakPolarHBondContact CB-SG 3.14Å; C661-C760 WeakPolarHBondContact SG-CB 3.35Å; C661-C760 CovalentContact SG-SG 2.03Å; C661-C760 PolarHBondContact SG-SG 3.15Å; R664-C760 PolarHBondContact NH1-SG 3.42Å; L733-C760 HydrophobicContact CD2-CB 4.36Å; H734-C760 WeakPolarHBondContact O-CA 3.09Å
761	S	88.6	Confident	88.3	Confident	25 Å²	25	47.2 Å²	47.2	18%	0.175	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	169.1	174.4	-159.7	0	0	0	0	111.7	L733 H734 T736	L733-S761 CarbonylContact C-O 3.59Å; L733-S761 WeakPolarHBondContact CA-O 3.25Å; H734-S761 PolarHBondContact N-O 3.29Å; H734-S761 PolarHBondContact ND1-O 2.85Å; H734-S761 PolarHBondContact O-N 2.81Å; T736-S761 WeakPolarHBondContact OG1-CB 3.45Å
762	S	91.1	Very high	88.9	Confident	5 Å²	5	46.9 Å²	46.9	4%	0.035	25%	0.252	C	S	.	.			trans	-139.4	157.2	173.1	84.4	0	0	0	0	107.5	W727 D731 K764 M765	W727-S762 PolarHBondContact NE1-OG 3.18Å; D731-S762 VanDerWaalsContact CG-OG 3.24Å; D731-S762 WeakPolarHBondContact O-CB 3.46Å; D731-S762 VanDerWaalsContact OD1-CB 3.25Å; D731-S762 WeakPolarHBondContact OD1-CB 3.17Å; D731-S762 VanDerWaalsContact OD2-CB 3.25Å; D731-S762 WeakPolarHBondContact OD2-CB 3.39Å; D731-S762 PolarHBondContact OD2-OG 3.24Å; S762-K764 PolarHBondContact O-N 3.35Å; S762-M765 WeakPolarHBondContact O-CB 3.32Å; S762-M765 PolarHBondContact O-N 2.76Å; S762-M765 VanDerWaalsContact O-N 3.15Å; S762-M765 WeakPolarHBondContact OG-CA 3.39Å; S762-M765 PolarHBondContact OG-N 3.21Å
763	E	89.8	Confident	89.5	Confident	163 Å²	163	49.1 Å²	49.1	76%	0.762	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	-31	-171.1	-67.4	-167.6	165.3	0	0	112.8	D731	D731-E763 PolarHBondContact OD1-N 2.03Å; D731-E763 PolarHBondContact OD2-N 3.25Å
764	K	91.8	Very high	89.9	Confident	125 Å²	125	49.9 Å²	49.9	54%	0.543	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-123.6	31.2	-177.5	-63.8	165.7	-169.7	158.4	0	111.5	D731 S762 N766 T767 W768	D731-K764 WeakPolarHBondContact OD2-CA 3.11Å; D731-K764 PolarHBondContact OD2-N 3.37Å; S762-K764 PolarHBondContact O-N 3.35Å; K764-N766 VanDerWaalsContact C-N 3.3Å; K764-N766 PolarHBondContact O-N 3.47Å; K764-N766 VanDerWaalsContact O-N 3.17Å; K764-T767 WeakPolarHBondContact O-CA 3.38Å; K764-T767 WeakPolarHBondContact O-CB 3.42Å; K764-T767 PolarHBondContact O-N 3.39Å; K764-W768 PolarHBondContact O-N 2.81Å
765	M	89.4	Confident	90.1	Very high	29 Å²	29	51.8 Å²	51.8	14%	0.143	28%	0.28	C	S	.	.	H	α-helix	trans	-42.3	-51.6	-179.6	174.6	58.6	74.2	0	0	113.2	W727 L733 S762 T767 W768 L769	W727-M765 HydrophobicContact CH2-SD 4.01Å; W727-M765 HydrophobicContact CZ2-CE 3.99Å; W727-M765 HydrophobicContact CZ2-SD 3.66Å; L733-M765 HydrophobicContact CD2-CE 4.07Å; L733-M765 HydrophobicContact CG-CE 4Å; S762-M765 WeakPolarHBondContact O-CB 3.32Å; S762-M765 PolarHBondContact O-N 2.76Å; S762-M765 VanDerWaalsContact O-N 3.15Å; S762-M765 WeakPolarHBondContact OG-CA 3.39Å; S762-M765 PolarHBondContact OG-N 3.21Å; M765-T767 VanDerWaalsContact C-N 3.29Å; M765-T767 PolarHBondContact O-N 2.92Å; M765-W768 PolarHBondContact O-N 3.25Å; M765-L769 HydrophobicContact CG-CD1 3.93Å; M765-L769 HydrophobicContact CG-CG 4.45Å; M765-L769 WeakPolarHBondContact O-CB 3.2Å; M765-L769 WeakPolarHBondContact O-CG 3.39Å; M765-L769 PolarHBondContact O-N 3.39Å; M765-L769 HydrophobicContact SD-CD1 3.51Å; M765-L769 VanDerWaalsContact SD-CD1 3.51Å; M765-L769 HydrophobicContact SD-CD2 4.35Å; M765-L769 HydrophobicContact SD-CG 3.67Å
766	N	89.3	Confident	90.4	Very high	106 Å²	106	52.6 Å²	52.6	57%	0.567	28%	0.283	S	S	*	.	H	α-helix	trans	-64.9	-30.4	-179.3	-68.1	-14.5	0	0	0	113.4	K764 G770 M823	K764-N766 VanDerWaalsContact C-N 3.3Å; K764-N766 PolarHBondContact O-N 3.47Å; K764-N766 VanDerWaalsContact O-N 3.17Å; N766-G770 PolarHBondContact O-N 2.74Å; N766-M823 HydrophobicContact CB-CE 4.1Å
767	T	91.3	Very high	90.6	Very high	92 Å²	92	53 Å²	53	56%	0.564	29%	0.287	S	S	*	.	H	α-helix	trans	-72.8	-46.6	175.8	-51	0	0	0	0	110.7	K764 M765 G770 V771	K764-T767 WeakPolarHBondContact O-CA 3.38Å; K764-T767 WeakPolarHBondContact O-CB 3.42Å; K764-T767 PolarHBondContact O-N 3.39Å; M765-T767 VanDerWaalsContact C-N 3.29Å; M765-T767 PolarHBondContact O-N 2.92Å; T767-G770 PolarHBondContact O-N 2.91Å; T767-V771 WeakPolarHBondContact O-CG2 3.14Å; T767-V771 PolarHBondContact O-N 3.04Å
768	W	92.4	Very high	90.8	Very high	55 Å²	55	59 Å²	59	21%	0.208	32%	0.318	C	S	.	.	H	α-helix	trans	-65.5	-46.8	178	-71.1	111.9	0	0	0	112.3	I726 W727 V730 D731 K764 M765 G770 V771 V772	I726-W768 HydrophobicContact CG2-CH2 3.92Å; I726-W768 HydrophobicContact CG2-CZ3 4.27Å; W727-W768 HydrophobicContact CB-CD2 3.99Å; W727-W768 HydrophobicContact CB-CE3 3.81Å; W727-W768 HydrophobicContact CB-CG 4.49Å; W727-W768 HydrophobicContact CB-CZ3 4.14Å; W727-W768 AromaticContact CD1-CD1 3.49Å; W727-W768 VanDerWaalsContact CD1-CD1 3.49Å; W727-W768 AromaticContact CD1-CD2 3.69Å; W727-W768 AromaticContact CD1-CE2 3.87Å; W727-W768 AromaticContact CD1-CG 3.47Å; W727-W768 VanDerWaalsContact CD1-CG 3.47Å; W727-W768 AromaticContact CD1-NE1 3.73Å; W727-W768 HydrophobicContact CD2-CB 3.6Å; W727-W768 HydrophobicContact CD2-CD2 4.31Å; W727-W768 AromaticContact CD2-CG 3.9Å; W727-W768 HydrophobicContact CD2-CG 3.9Å; W727-W768 VanDerWaalsContact CE2-CB 3.46Å; W727-W768 AromaticContact CE2-CG 3.82Å; W727-W768 HydrophobicContact CE3-CB 4.03Å; W727-W768 HydrophobicContact CG-CB 3.99Å; W727-W768 AromaticContact CG-CD2 3.73Å; W727-W768 HydrophobicContact CG-CD2 3.73Å; W727-W768 HydrophobicContact CG-CE3 4.01Å; W727-W768 AromaticContact CG-CG 3.73Å; W727-W768 HydrophobicContact CG-CG 3.73Å; W727-W768 HydrophobicContact CH2-CB 4.25Å; W727-W768 HydrophobicContact CZ2-CB 3.83Å; W727-W768 HydrophobicContact CZ3-CB 4.33Å; W727-W768 AromaticContact NE1-CD1 3.45Å; W727-W768 AromaticContact NE1-CG 3.55Å; V730-W768 HydrophobicContact CB-CZ2 4.08Å; V730-W768 HydrophobicContact CG1-CZ2 3.94Å; D731-W768 VanDerWaalsContact CB-NE1 3.32Å; D731-W768 VanDerWaalsContact OD2-CD1 3.26Å; D731-W768 PolarHBondContact OD2-NE1 3.29Å; K764-W768 PolarHBondContact O-N 2.81Å; M765-W768 PolarHBondContact O-N 3.25Å; W768-G770 VanDerWaalsContact C-N 3.3Å; W768-G770 PolarHBondContact O-N 3.03Å; W768-V771 PolarHBondContact O-N 3.04Å; W768-V772 WeakPolarHBondContact O-CG2 3.46Å; W768-V772 PolarHBondContact O-N 2.85Å
769	L	89.9	Confident	91.1	Very high	29 Å²	29	59.9 Å²	59.9	15%	0.152	32%	0.323	C	S	.	.	H	α-helix	trans	-58.9	-41.5	172.5	-72.1	178.4	0	0	0	111.8	W727 M765 V771 V772 Y773	W727-L769 HydrophobicContact CH2-CD2 3.68Å; W727-L769 HydrophobicContact CH2-CG 4.05Å; W727-L769 HydrophobicContact CZ3-CD2 4.21Å; M765-L769 HydrophobicContact CG-CD1 3.93Å; M765-L769 HydrophobicContact CG-CG 4.45Å; M765-L769 WeakPolarHBondContact O-CB 3.2Å; M765-L769 WeakPolarHBondContact O-CG 3.39Å; M765-L769 PolarHBondContact O-N 3.39Å; M765-L769 HydrophobicContact SD-CD1 3.51Å; M765-L769 VanDerWaalsContact SD-CD1 3.51Å; M765-L769 HydrophobicContact SD-CD2 4.35Å; M765-L769 HydrophobicContact SD-CG 3.67Å; L769-V771 PolarHBondContact O-N 3.39Å; L769-V772 PolarHBondContact O-N 2.84Å; L769-Y773 HydrophobicContact CB-CD2 4.28Å; L769-Y773 HydrophobicContact CB-CE2 4.14Å; L769-Y773 HydrophobicContact CD2-CE1 4.41Å; L769-Y773 HydrophobicContact CD2-CE2 4.07Å; L769-Y773 HydrophobicContact CG-CE2 4.5Å; L769-Y773 VanDerWaalsContact O-CB 3.27Å; L769-Y773 WeakPolarHBondContact O-CB 3.23Å; L769-Y773 WeakPolarHBondContact O-CD2 3.2Å; L769-Y773 VanDerWaalsContact O-CG 3.3Å; L769-Y773 PolarHBondContact O-N 2.79Å
770	G	89.9	Confident	91.4	Very high	43 Å²	43	57.4 Å²	57.4	44%	0.443	31%	0.312	S	S	.	.	H	α-helix	trans	-60.3	-43.5	176.4	0	0	0	0	0	113.2	N766 T767 W768 G774	N766-G770 PolarHBondContact O-N 2.74Å; T767-G770 PolarHBondContact O-N 2.91Å; W768-G770 VanDerWaalsContact C-N 3.3Å; W768-G770 PolarHBondContact O-N 3.03Å; G770-G774 WeakPolarHBondContact O-CA 2.98Å; G770-G774 PolarHBondContact O-N 3.37Å
771	V	91.5	Very high	91.7	Very high	92 Å²	92	61 Å²	61	56%	0.558	33%	0.329	S	S	*	.	H	α-helix	trans	-67.1	-46.2	176	171.3	0	0	0	0	111.4	T767 W768 L769 Y775	T767-V771 WeakPolarHBondContact O-CG2 3.14Å; T767-V771 PolarHBondContact O-N 3.04Å; W768-V771 PolarHBondContact O-N 3.04Å; L769-V771 PolarHBondContact O-N 3.39Å; V771-Y775 PolarHBondContact O-N 2.88Å; V771-Y775 VanDerWaalsContact O-N 3.16Å
772	V	90.9	Very high	92	Very high	16 Å²	16	63.3 Å²	63.3	10%	0.097	34%	0.339	C	S	.	.	H	α-helix	trans	-63.3	-55.6	179.5	173.3	0	0	0	0	110.6	W727 W768 L769 G774 Y775 K776	W727-V772 HydrophobicContact CE3-CG2 4.33Å; W727-V772 HydrophobicContact CZ3-CG2 4.4Å; W768-V772 WeakPolarHBondContact O-CG2 3.46Å; W768-V772 PolarHBondContact O-N 2.85Å; L769-V772 PolarHBondContact O-N 2.84Å; V772-G774 VanDerWaalsContact C-N 3.3Å; V772-G774 PolarHBondContact O-N 3.03Å; V772-Y775 HydrophobicContact CG1-CE1 4.44Å; V772-Y775 WeakPolarHBondContact O-CD1 3.44Å; V772-Y775 PolarHBondContact O-N 3.47Å; V772-K776 HydrophobicContact CG1-CG 4.35Å; V772-K776 WeakPolarHBondContact O-CG 3.39Å; V772-K776 PolarHBondContact O-N 2.66Å
773	Y	92.1	Very high	92	Very high	96 Å²	96	63.1 Å²	63.1	38%	0.376	34%	0.338	S	S	.	.	H	α-helix	trans	-64.2	-33.1	179.5	-63.7	-24.2	0	0	0	112.7	L769 G777 A819	L769-Y773 HydrophobicContact CB-CD2 4.28Å; L769-Y773 HydrophobicContact CB-CE2 4.14Å; L769-Y773 HydrophobicContact CD2-CE1 4.41Å; L769-Y773 HydrophobicContact CD2-CE2 4.07Å; L769-Y773 HydrophobicContact CG-CE2 4.5Å; L769-Y773 VanDerWaalsContact O-CB 3.27Å; L769-Y773 WeakPolarHBondContact O-CB 3.23Å; L769-Y773 WeakPolarHBondContact O-CD2 3.2Å; L769-Y773 VanDerWaalsContact O-CG 3.3Å; L769-Y773 PolarHBondContact O-N 2.79Å; Y773-G777 PolarHBondContact O-N 2.58Å; Y773-A819 HydrophobicContact CD2-CB 4.14Å; Y773-A819 HydrophobicContact CE1-CB 4.41Å; Y773-A819 HydrophobicContact CE2-CB 3.99Å; Y773-A819 HydrophobicContact CG-CB 4.41Å
774	G	92.4	Very high	92.2	Very high	45 Å²	45	57.5 Å²	57.5	46%	0.464	31%	0.313	S	S	.	.	H	α-helix	trans	-60.2	-50.4	175	0	0	0	0	0	112.7	G770 V772 G777 L778	G770-G774 WeakPolarHBondContact O-CA 2.98Å; G770-G774 PolarHBondContact O-N 3.37Å; V772-G774 VanDerWaalsContact C-N 3.3Å; V772-G774 PolarHBondContact O-N 3.03Å; G774-G777 PolarHBondContact O-N 2.81Å; G774-L778 PolarHBondContact O-N 2.8Å
775	Y	92.9	Very high	92.3	Very high	69 Å²	69	57 Å²	57	27%	0.271	31%	0.311	S	S	.	.	H	α-helix	trans	-71.7	-37.2	-179.9	103.7	-98.1	0	0	0	112.4	I719 D720 V771 V772 G777 L778 L779	I719-Y775 HydrophobicContact CG2-CE2 4.42Å; D720-Y775 WeakPolarHBondContact CA-OH 3.43Å; D720-Y775 WeakPolarHBondContact CB-OH 3.3Å; D720-Y775 PolarHBondContact OD1-OH 3.48Å; V771-Y775 PolarHBondContact O-N 2.88Å; V771-Y775 VanDerWaalsContact O-N 3.16Å; V772-Y775 HydrophobicContact CG1-CE1 4.44Å; V772-Y775 WeakPolarHBondContact O-CD1 3.44Å; V772-Y775 PolarHBondContact O-N 3.47Å; Y775-G777 VanDerWaalsContact C-N 3.34Å; Y775-L778 PolarHBondContact O-N 2.7Å; Y775-L779 PolarHBondContact O-N 2.87Å
776	K	93.3	Very high	92.3	Very high	21 Å²	21	55.8 Å²	55.8	9%	0.091	31%	0.305	C	S	.	.	H	α-helix	trans	-61.3	-43.2	172.2	-62.2	-71	-165	-158.6	0	110.7	F672 S673 D720 V772 L779 L780	F672-K776 HydrophobicContact CD1-CD 3.98Å; F672-K776 HydrophobicContact CE1-CD 3.84Å; S673-K776 PolarHBondContact OG-NZ 3.39Å; D720-K776 IonicContact OD1-NZ 2.65Å; D720-K776 PolarHBondContact OD1-NZ 3.34Å; D720-K776 IonicContact OD2-NZ 3.75Å; V772-K776 HydrophobicContact CG1-CG 4.35Å; V772-K776 WeakPolarHBondContact O-CG 3.39Å; V772-K776 PolarHBondContact O-N 2.66Å; K776-L779 WeakPolarHBondContact O-CB 3.31Å; K776-L779 PolarHBondContact O-N 2.86Å; K776-L780 WeakPolarHBondContact O-CG 3.45Å; K776-L780 PolarHBondContact O-N 3.27Å
777	G	94	Very high	92.4	Very high	10 Å²	10	51.5 Å²	51.5	10%	0.103	28%	0.284	C	S	.	.	H	α-helix	trans	-61.2	-43.3	177.5	0	0	0	0	0	112.7	Y773 G774 Y775 L779 L780 L781	Y773-G777 PolarHBondContact O-N 2.58Å; G774-G777 PolarHBondContact O-N 2.81Å; Y775-G777 VanDerWaalsContact C-N 3.34Å; G777-L779 VanDerWaalsContact C-N 3.35Å; G777-L779 PolarHBondContact O-N 3.01Å; G777-L780 WeakPolarHBondContact O-CB 3.48Å; G777-L780 PolarHBondContact O-N 3.2Å; G777-L781 WeakPolarHBondContact O-CG 3.4Å; G777-L781 PolarHBondContact O-N 2.9Å
778	L	93.9	Very high	92.3	Very high	126 Å²	126	53.8 Å²	53.8	66%	0.66	28%	0.283	S	S	*	.	H	α-helix	trans	-61.6	-42.1	173.5	-175.9	63	0	0	0	112	G774 Y775 L781 L782	G774-L778 PolarHBondContact O-N 2.8Å; Y775-L778 PolarHBondContact O-N 2.7Å; L778-L781 PolarHBondContact O-N 3.2Å; L778-L782 WeakPolarHBondContact O-CB 3.39Å; L778-L782 PolarHBondContact O-N 3.3Å
779	L	92.9	Very high	92.1	Very high	30 Å²	30	55.4 Å²	55.4	16%	0.157	29%	0.293	C	S	.	.	H	α-helix	trans	-64.4	-40.4	175.9	-169.1	73.4	0	0	0	112.1	Y676 F680 L716 Y775 K776 G777 L782 G783	Y676-L779 HydrophobicContact CD1-CD2 3.96Å; Y676-L779 HydrophobicContact CD1-CG 4.29Å; Y676-L779 HydrophobicContact CE1-CD2 4.19Å; Y676-L779 HydrophobicContact CE1-CG 4Å; Y676-L779 PolarHBondContact OH-O 3.08Å; F680-L779 HydrophobicContact CD2-CD1 4.46Å; F680-L779 HydrophobicContact CE2-CD1 4.26Å; F680-L779 HydrophobicContact CZ-CD1 4.31Å; L716-L779 HydrophobicContact CD2-CD1 4.15Å; Y775-L779 PolarHBondContact O-N 2.87Å; K776-L779 WeakPolarHBondContact O-CB 3.31Å; K776-L779 PolarHBondContact O-N 2.86Å; G777-L779 VanDerWaalsContact C-N 3.35Å; G777-L779 PolarHBondContact O-N 3.01Å; L779-L782 PolarHBondContact O-N 3.36Å; L779-G783 PolarHBondContact O-N 2.94Å
780	L	94.3	Very high	91.9	Very high	5 Å²	5	54.2 Å²	54.2	3%	0.026	29%	0.287	C	S	.	.	H	α-helix	trans	-61.1	-48.4	175.4	-75.5	177.5	0	0	0	111.8	F672 Y676 K776 G777 G783 I784 A812 C815 L816	F672-L780 HydrophobicContact CE2-CD2 4.43Å; F672-L780 HydrophobicContact CZ-CD1 4.49Å; F672-L780 HydrophobicContact CZ-CD2 3.79Å; F672-L780 HydrophobicContact CZ-CG 4.25Å; Y676-L780 HydrophobicContact CD2-CD2 3.8Å; Y676-L780 HydrophobicContact CE1-CD2 4.34Å; Y676-L780 HydrophobicContact CE2-CD2 3.37Å; Y676-L780 HydrophobicContact CG-CD2 4.44Å; Y676-L780 WeakPolarHBondContact OH-CA 3.41Å; Y676-L780 PolarHBondContact OH-O 3.28Å; K776-L780 WeakPolarHBondContact O-CG 3.45Å; K776-L780 PolarHBondContact O-N 3.27Å; G777-L780 WeakPolarHBondContact O-CB 3.48Å; G777-L780 PolarHBondContact O-N 3.2Å; L780-G783 PolarHBondContact O-N 2.91Å; L780-I784 WeakPolarHBondContact O-CG1 3.36Å; L780-I784 PolarHBondContact O-N 2.71Å; L780-A812 HydrophobicContact CB-CB 4.1Å; L780-A812 HydrophobicContact CD2-CB 3.85Å; L780-A812 HydrophobicContact CG-CB 4.37Å; L780-C815 HydrophobicContact CD1-CB 3.95Å; L780-L816 HydrophobicContact CD1-CD2 4.33Å; L780-L816 HydrophobicContact CD1-CG 4.11Å
781	L	94	Very high	91.7	Very high	98 Å²	98	57 Å²	57	51%	0.513	29%	0.287	S	S	.	.	H	α-helix	trans	-63.6	-43.1	178.2	-70	170.8	0	0	0	111.7	G777 L778 G783 I784 F785 L816	G777-L781 WeakPolarHBondContact O-CG 3.4Å; G777-L781 PolarHBondContact O-N 2.9Å; L778-L781 PolarHBondContact O-N 3.2Å; L781-G783 VanDerWaalsContact C-N 3.32Å; L781-G783 PolarHBondContact O-N 3.42Å; L781-I784 PolarHBondContact O-N 3.4Å; L781-F785 PolarHBondContact O-N 3.18Å; L781-L816 HydrophobicContact CD2-CD1 4.35Å
782	L	93.8	Very high	91.1	Very high	74 Å²	74	57 Å²	57	39%	0.387	29%	0.291	S	S	.	.	H	α-helix	trans	-60.1	-42.1	175.3	-175.5	66.8	0	0	0	111.5	F680 L778 L779 F785 L786	F680-L782 HydrophobicContact CE2-CB 4.36Å; F680-L782 HydrophobicContact CE2-CD2 3.93Å; F680-L782 HydrophobicContact CE2-CG 3.98Å; F680-L782 HydrophobicContact CZ-CD2 3.73Å; F680-L782 HydrophobicContact CZ-CG 4.21Å; L778-L782 WeakPolarHBondContact O-CB 3.39Å; L778-L782 PolarHBondContact O-N 3.3Å; L779-L782 PolarHBondContact O-N 3.36Å; L782-F785 PolarHBondContact O-N 2.95Å; L782-L786 HydrophobicContact CD1-CD1 4.46Å; L782-L786 HydrophobicContact CG-CD1 4.03Å; L782-L786 WeakPolarHBondContact O-CD1 3.23Å; L782-L786 VanDerWaalsContact O-CG 3.23Å; L782-L786 WeakPolarHBondContact O-CG 3.04Å; L782-L786 PolarHBondContact O-N 2.84Å
783	G	92.8	Very high	90.4	Very high	1 Å²	1	57.6 Å²	57.6	1%	0.01	30%	0.295	C	S	.	.	H	α-helix	trans	-68.8	-36.2	176.6	0	0	0	0	0	114	Y676 L779 L780 L781 A787	Y676-G783 WeakPolarHBondContact OH-CA 3.35Å; L779-G783 PolarHBondContact O-N 2.94Å; L780-G783 PolarHBondContact O-N 2.91Å; L781-G783 VanDerWaalsContact C-N 3.32Å; L781-G783 PolarHBondContact O-N 3.42Å; G783-A787 VanDerWaalsContact O-CB 3.26Å; G783-A787 WeakPolarHBondContact O-CB 3.02Å; G783-A787 PolarHBondContact O-N 3.07Å
784	I	93.3	Very high	89.4	Confident	45 Å²	45	57.6 Å²	57.6	23%	0.231	31%	0.309	C	S	.	.	H	α-helix	trans	-60.7	-47.8	170.7	-68.3	160.9	0	0	0	110.2	L780 L781 L786 A787 Y788 Y809 A812	L780-I784 WeakPolarHBondContact O-CG1 3.36Å; L780-I784 PolarHBondContact O-N 2.71Å; L781-I784 PolarHBondContact O-N 3.4Å; I784-L786 PolarHBondContact O-N 3.14Å; I784-A787 PolarHBondContact O-N 3.16Å; I784-Y788 PolarHBondContact O-N 3.49Å; I784-Y809 HydrophobicContact CG2-CD2 4.46Å; I784-A812 HydrophobicContact CD1-CB 3.52Å; I784-A812 HydrophobicContact CG1-CB 3.85Å
785	F	93.7	Very high	88.2	Confident	114 Å²	114	56.6 Å²	56.6	50%	0.5	29%	0.294	S	S	.	.	H	α-helix	trans	-58.1	-49.1	179.2	172.3	-102.9	0	0	0	111.8	L781 L782 A787 Y788 E789	L781-F785 PolarHBondContact O-N 3.18Å; L782-F785 PolarHBondContact O-N 2.95Å; F785-A787 VanDerWaalsContact C-N 3.32Å; F785-A787 PolarHBondContact O-N 3.08Å; F785-Y788 WeakPolarHBondContact O-CB 3.21Å; F785-Y788 PolarHBondContact O-N 3.24Å; F785-E789 HydrophobicContact CE1-CG 4.32Å; F785-E789 HydrophobicContact CE2-CG 4.16Å; F785-E789 HydrophobicContact CZ-CG 3.97Å; F785-E789 PolarHBondContact O-N 3.35Å
786	L	90.3	Very high	86.7	Confident	4 Å²	4	60 Å²	60	2%	0.021	31%	0.312	C	S	.	.	H	α-helix	trans	-64.8	-34.3	177.6	-65.1	162.7	0	0	0	112.7	F680 I683 W684 H687 L782 I784 T790	F680-L786 HydrophobicContact CD2-CD1 4.5Å; F680-L786 HydrophobicContact CE2-CD1 3.64Å; F680-L786 HydrophobicContact CZ-CD1 3.87Å; I683-L786 HydrophobicContact CG2-CB 3.77Å; W684-L786 HydrophobicContact CE3-CD1 3.71Å; W684-L786 HydrophobicContact CE3-CD2 3.98Å; W684-L786 HydrophobicContact CZ3-CD1 4.32Å; W684-L786 HydrophobicContact CZ3-CD2 4.21Å; H687-L786 HydrophobicContact CB-CD2 4.03Å; H687-L786 WeakPolarHBondContact ND1-CD2 3.46Å; L782-L786 HydrophobicContact CD1-CD1 4.46Å; L782-L786 HydrophobicContact CG-CD1 4.03Å; L782-L786 WeakPolarHBondContact O-CD1 3.23Å; L782-L786 VanDerWaalsContact O-CG 3.23Å; L782-L786 WeakPolarHBondContact O-CG 3.04Å; L782-L786 PolarHBondContact O-N 2.84Å; I784-L786 PolarHBondContact O-N 3.14Å; L786-T790 WeakPolarHBondContact O-CB 3.34Å; L786-T790 WeakPolarHBondContact O-CG2 3.4Å; L786-T790 PolarHBondContact O-N 3.34Å; L786-T790 VanDerWaalsContact O-N 3.1Å; L786-T790 PolarHBondContact O-OG1 3.27Å
787	A	90.4	Very high	85.3	Confident	16 Å²	16	66.6 Å²	66.6	13%	0.132	34%	0.341	C	S	.	.	H	α-helix	trans	-68.7	-35	174.5	0	0	0	0	0	112.2	I683 G783 I784 F785 K791	I683-A787 HydrophobicContact CD1-CB 3.75Å; G783-A787 VanDerWaalsContact O-CB 3.26Å; G783-A787 WeakPolarHBondContact O-CB 3.02Å; G783-A787 PolarHBondContact O-N 3.07Å; I784-A787 PolarHBondContact O-N 3.16Å; F785-A787 VanDerWaalsContact C-N 3.32Å; F785-A787 PolarHBondContact O-N 3.08Å; A787-K791 PolarHBondContact O-N 2.8Å
788	Y	90.1	Very high	84.2	Confident	140 Å²	140	66.1 Å²	66.1	55%	0.549	34%	0.336	S	S	.	.	H	α-helix	trans	-67.8	-47	174.7	-180	-87	0	0	0	111.7	I784 F785 T790 K791	I784-Y788 PolarHBondContact O-N 3.49Å; F785-Y788 WeakPolarHBondContact O-CB 3.21Å; F785-Y788 PolarHBondContact O-N 3.24Å; Y788-T790 VanDerWaalsContact C-N 3.35Å; Y788-T790 PolarHBondContact O-N 2.86Å; Y788-K791 HydrophobicContact CD2-CD 4.37Å; Y788-K791 WeakPolarHBondContact O-CB 3.2Å; Y788-K791 WeakPolarHBondContact O-CD 3.26Å; Y788-K791 WeakPolarHBondContact O-CE 3.2Å; Y788-K791 WeakPolarHBondContact O-CG 3.3Å; Y788-K791 PolarHBondContact O-N 3.14Å; Y788-K791 PolarHBondContact OH-NZ 3.34Å
789	E	88.6	Confident	83.2	Confident	89 Å²	89	62.3 Å²	62.3	42%	0.416	32%	0.316	S	S	.	.	H	α-helix	trans	-62.4	-40.1	177.8	-74.8	-57.4	121	0	0	112.3	F785 K791	F785-E789 HydrophobicContact CE1-CG 4.32Å; F785-E789 HydrophobicContact CE2-CG 4.16Å; F785-E789 HydrophobicContact CZ-CG 3.97Å; F785-E789 PolarHBondContact O-N 3.35Å; E789-K791 VanDerWaalsContact C-N 3.34Å; E789-K791 PolarHBondContact O-N 3.35Å
790	T	84.8	Confident	82.7	Confident	4 Å²	4	61.4 Å²	61.4	3%	0.025	31%	0.312	C	S	.	.	H	α-helix	trans	-81.7	-4.5	-177.3	54.6	0	0	0	0	114.8	I683 V686 H687 L786 Y788 S792 V793	I683-T790 HydrophobicContact CG2-CG2 4.34Å; V686-T790 HydrophobicContact CB-CG2 4.27Å; V686-T790 HydrophobicContact CG1-CG2 3.85Å; H687-T790 HydrophobicContact CB-CG2 3.75Å; L786-T790 WeakPolarHBondContact O-CB 3.34Å; L786-T790 WeakPolarHBondContact O-CG2 3.4Å; L786-T790 PolarHBondContact O-N 3.34Å; L786-T790 VanDerWaalsContact O-N 3.1Å; L786-T790 PolarHBondContact O-OG1 3.27Å; Y788-T790 VanDerWaalsContact C-N 3.35Å; Y788-T790 PolarHBondContact O-N 2.86Å; T790-S792 VanDerWaalsContact C-N 3.35Å; T790-S792 PolarHBondContact O-N 2.83Å; T790-V793 WeakPolarHBondContact O-CB 3.2Å; T790-V793 PolarHBondContact O-N 2.86Å
791	K	85.4	Confident	82.3	Confident	102 Å²	102	61.6 Å²	61.6	44%	0.443	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-36.5	-171.9	76.7	-167.6	167.5	-176.1	0	114.9	A787 Y788 E789 R802	A787-K791 PolarHBondContact O-N 2.8Å; Y788-K791 HydrophobicContact CD2-CD 4.37Å; Y788-K791 WeakPolarHBondContact O-CB 3.2Å; Y788-K791 WeakPolarHBondContact O-CD 3.26Å; Y788-K791 WeakPolarHBondContact O-CE 3.2Å; Y788-K791 WeakPolarHBondContact O-CG 3.3Å; Y788-K791 PolarHBondContact O-N 3.14Å; Y788-K791 PolarHBondContact OH-NZ 3.34Å; E789-K791 VanDerWaalsContact C-N 3.34Å; E789-K791 PolarHBondContact O-N 3.35Å; K791-R802 PolarHBondContact O-NE 2.84Å
792	S	78.9	Confident	82	Confident	92 Å²	92	63.1 Å²	63.1	64%	0.643	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.4	-22	-173.7	53.1	0	0	0	0	112.5	T790 R802	T790-S792 VanDerWaalsContact C-N 3.35Å; T790-S792 PolarHBondContact O-N 2.83Å; S792-R802 PolarHBondContact O-NH2 3.1Å
793	V	77.4	Confident	81.7	Confident	28 Å²	28	60.4 Å²	60.4	17%	0.17	30%	0.3	C	S	.	.			trans	-63.7	147.2	-179.8	-172.8	0	0	0	0	110.2	F690 T790 T795 H801 R802	F690-V793 HydrophobicContact CD1-CG1 3.54Å; F690-V793 HydrophobicContact CD2-CG1 4Å; F690-V793 HydrophobicContact CE1-CG1 3.55Å; F690-V793 HydrophobicContact CE2-CG1 4.02Å; F690-V793 HydrophobicContact CG-CG1 3.77Å; F690-V793 HydrophobicContact CZ-CG1 3.8Å; T790-V793 WeakPolarHBondContact O-CB 3.2Å; T790-V793 PolarHBondContact O-N 2.86Å; V793-T795 HydrophobicContact CG1-CG2 3.84Å; V793-H801 PolarHBondContact O-NE2 3.14Å; V793-R802 PolarHBondContact O-NE 2.9Å; V793-R802 PolarHBondContact O-NH2 2.63Å
794	S	70.3	Confident	81.6	Confident	96 Å²	96	60.4 Å²	60.4	67%	0.671	30%	0.299	S	S	*	.			trans	-126.6	137.4	167.8	58.6	0	0	0	0	109.2
795	T	67.7	Low	81.4	Confident	25 Å²	25	58.9 Å²	58.9	15%	0.153	29%	0.294	C	S	.	.			trans	-145.3	138.1	-177.5	105.3	0	0	0	0	109.6	F690 V793 K797 I798	F690-T795 HydrophobicContact CE2-CG2 3.54Å; F690-T795 HydrophobicContact CZ-CG2 3.53Å; V793-T795 HydrophobicContact CG1-CG2 3.84Å; T795-K797 PolarHBondContact OG1-N 2.81Å; T795-I798 PolarHBondContact OG1-N 2.99Å; T795-I798 PolarHBondContact OG1-O 3.48Å
796	E	61.5	Low	81.3	Confident	140 Å²	140	58.6 Å²	58.6	65%	0.654	30%	0.296	S	S	*	.	S	Bend	trans	-79.3	-22.7	171.5	-156	-171.2	162.9	0	0	111.9	R618 N622	R618-E796 IonicContact NH2-OE1 2.7Å; N622-E796 PolarHBondContact ND2-O 2.93Å
797	K	62.4	Low	81.4	Confident	160 Å²	160	58.4 Å²	58.4	70%	0.696	30%	0.295	S	S	*	.	S	Bend	trans	-79	-30.1	-175.5	-66.8	-172.6	177.6	-176.7	0	114.5	N622 W685 T795	N622-K797 VanDerWaalsContact O-O 3.13Å; W685-K797 HydrophobicContact CH2-CB 4.49Å; T795-K797 PolarHBondContact OG1-N 2.81Å
798	I	70.8	Confident	81.6	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	29%	0.289	C	S	.	.			trans	-129.9	108.3	163.9	-65.2	-174	0	0	0	108.3	N622 Q624 K682 W685 V686 T795 D800 H801	N622-I798 VanDerWaalsContact O-CA 3.26Å; N622-I798 WeakPolarHBondContact O-CA 3.35Å; Q624-I798 VanDerWaalsContact CD-CD1 3.46Å; Q624-I798 HydrophobicContact CG-CD1 4.24Å; Q624-I798 HydrophobicContact CG-CG1 4.3Å; K682-I798 HydrophobicContact CG-CD1 4.15Å; W685-I798 HydrophobicContact CD2-CD1 4.22Å; W685-I798 HydrophobicContact CE3-CD1 3.29Å; W685-I798 HydrophobicContact CE3-CG1 4.11Å; W685-I798 HydrophobicContact CH2-CD1 4.18Å; W685-I798 HydrophobicContact CH2-CG1 4.23Å; W685-I798 HydrophobicContact CZ3-CD1 3.28Å; W685-I798 HydrophobicContact CZ3-CG1 3.55Å; V686-I798 HydrophobicContact CG2-CB 4.37Å; V686-I798 HydrophobicContact CG2-CD1 3.97Å; V686-I798 HydrophobicContact CG2-CG2 4.49Å; T795-I798 PolarHBondContact OG1-N 2.99Å; T795-I798 PolarHBondContact OG1-O 3.48Å; I798-D800 WeakPolarHBondContact CG2-OD1 3.42Å; I798-H801 HydrophobicContact CG2-CB 3.88Å; I798-H801 PolarHBondContact O-ND1 2.97Å
799	N	73.5	Confident	81.7	Confident	45 Å²	45	57.3 Å²	57.3	24%	0.241	29%	0.288	C	S	.	.	S	Bend	trans	-89.1	-12.3	-173.9	59.7	11.1	0	0	0	114.8	Y619 N622 S623	Y619-N799 VanDerWaalsContact CD2-ND2 3.33Å; Y619-N799 WeakPolarHBondContact CD2-ND2 3.05Å; Y619-N799 HydrophobicContact CE2-CB 4.39Å; Y619-N799 WeakPolarHBondContact CE2-ND2 3.39Å; Y619-N799 PolarHBondContact O-ND2 2.68Å; N622-N799 PolarHBondContact O-N 2.8Å; N622-N799 PolarHBondContact O-OD1 2.9Å; S623-N799 WeakPolarHBondContact CA-OD1 3.38Å; S623-N799 VanDerWaalsContact CB-OD1 3.27Å; S623-N799 WeakPolarHBondContact CB-OD1 3.42Å
800	D	83	Confident	81.9	Confident	12 Å²	12	55.8 Å²	55.8	6%	0.064	28%	0.282	C	S	.	.			trans	-119.5	7.4	-170.9	67.6	-19.1	0	0	0	114.6	K682 I798 R802 A803 V804 K855	K682-D800 WeakPolarHBondContact CE-OD1 3.31Å; K682-D800 IonicContact NZ-OD1 2.69Å; K682-D800 PolarHBondContact NZ-OD1 3.26Å; K682-D800 IonicContact NZ-OD2 3.88Å; K682-D800 PolarHBondContact NZ-OD2 3.45Å; I798-D800 WeakPolarHBondContact CG2-OD1 3.42Å; D800-R802 PolarHBondContact O-N 3.05Å; D800-R802 VanDerWaalsContact O-N 3.08Å; D800-A803 WeakPolarHBondContact O-CA 3.12Å; D800-A803 WeakPolarHBondContact O-CB 3.44Å; D800-A803 PolarHBondContact O-N 3.44Å; D800-V804 PolarHBondContact O-N 3.41Å; D800-V804 VanDerWaalsContact O-N 3.13Å; D800-K855 VanDerWaalsContact OD2-CE 3.23Å; D800-K855 WeakPolarHBondContact OD2-CE 3.44Å; D800-K855 IonicContact OD2-NZ 2.7Å; D800-K855 PolarHBondContact OD2-NZ 2.02Å
801	H	86	Confident	82.4	Confident	9 Å²	9	56 Å²	56	4%	0.042	28%	0.284	C	S	.	.	H	α-helix	trans	-52.6	-33.8	-179.4	59.5	-86.1	0	0	0	113.7	V686 V793 I798 V804 G805	V686-H801 HydrophobicContact CG2-CB 4.09Å; V793-H801 PolarHBondContact O-NE2 3.14Å; I798-H801 HydrophobicContact CG2-CB 3.88Å; I798-H801 PolarHBondContact O-ND1 2.97Å; H801-V804 PolarHBondContact O-N 3.24Å; H801-G805 PolarHBondContact O-N 3.02Å
802	R	87.1	Confident	82.8	Confident	130 Å²	130	51.2 Å²	51.2	49%	0.491	26%	0.263	S	S	.	.	H	α-helix	trans	-67.4	-36	175.9	-57.5	-173.1	-179.3	-176.1	-5.5	112.8	K791 S792 V793 D800 G805 M806	K791-R802 PolarHBondContact O-NE 2.84Å; S792-R802 PolarHBondContact O-NH2 3.1Å; V793-R802 PolarHBondContact O-NE 2.9Å; V793-R802 PolarHBondContact O-NH2 2.63Å; D800-R802 PolarHBondContact O-N 3.05Å; D800-R802 VanDerWaalsContact O-N 3.08Å; R802-G805 PolarHBondContact O-N 3.45Å; R802-M806 WeakPolarHBondContact O-CG 3.32Å; R802-M806 PolarHBondContact O-N 3.06Å; R802-M806 VanDerWaalsContact O-N 3.14Å
803	A	88.8	Confident	83.5	Confident	17 Å²	17	49.3 Å²	49.3	14%	0.14	25%	0.247	C	C	.	.	H	α-helix	trans	-69.3	-40.6	174.3	0	0	0	0	0	111.1	D800 G805 M806 A807 V850 L851	D800-A803 WeakPolarHBondContact O-CA 3.12Å; D800-A803 WeakPolarHBondContact O-CB 3.44Å; D800-A803 PolarHBondContact O-N 3.44Å; A803-G805 VanDerWaalsContact C-N 3.3Å; A803-G805 PolarHBondContact O-N 3.14Å; A803-M806 PolarHBondContact O-N 2.72Å; A803-A807 PolarHBondContact O-N 3.01Å; A803-V850 HydrophobicContact CB-CG1 3.92Å; A803-V850 VanDerWaalsContact O-CG1 3.3Å; A803-V850 WeakPolarHBondContact O-CG1 3.46Å; A803-L851 HydrophobicContact CB-CD2 4.35Å
804	V	90.5	Very high	84.3	Confident	1 Å²	1	50.3 Å²	50.3	1%	0.006	25%	0.251	C	S	.	.	H	α-helix	trans	-59.7	-40.5	172.5	-175	0	0	0	0	111.3	M679 K682 I683 D800 H801 A807 I808 L851	M679-V804 HydrophobicContact CB-CG1 3.68Å; M679-V804 HydrophobicContact CG-CG1 4Å; K682-V804 HydrophobicContact CD-CG2 4.04Å; I683-V804 HydrophobicContact CD1-CB 4.38Å; I683-V804 HydrophobicContact CD1-CG1 4.08Å; I683-V804 HydrophobicContact CG1-CB 4.37Å; I683-V804 HydrophobicContact CG1-CG1 3.91Å; D800-V804 PolarHBondContact O-N 3.41Å; D800-V804 VanDerWaalsContact O-N 3.13Å; H801-V804 PolarHBondContact O-N 3.24Å; V804-A807 PolarHBondContact O-N 3.01Å; V804-I808 HydrophobicContact CG1-CD1 4.02Å; V804-I808 WeakPolarHBondContact O-CB 3.46Å; V804-I808 WeakPolarHBondContact O-CG1 3.5Å; V804-I808 PolarHBondContact O-N 3.07Å; V804-L851 HydrophobicContact CB-CD2 4.34Å; V804-L851 HydrophobicContact CG2-CD2 3.67Å
805	G	89.4	Confident	85.4	Confident	12 Å²	12	47.3 Å²	47.3	12%	0.124	23%	0.23	C	C	.	.	H	α-helix	trans	-63.8	-42.9	176.6	0	0	0	0	0	113.4	H801 R802 A803 I808 Y809	H801-G805 PolarHBondContact O-N 3.02Å; R802-G805 PolarHBondContact O-N 3.45Å; A803-G805 VanDerWaalsContact C-N 3.3Å; A803-G805 PolarHBondContact O-N 3.14Å; G805-I808 PolarHBondContact O-N 3.47Å; G805-Y809 PolarHBondContact O-N 3.47Å
806	M	90.4	Very high	86.5	Confident	109 Å²	109	49.6 Å²	49.6	54%	0.537	24%	0.241	S	C	.	.	H	α-helix	trans	-65.7	-38.8	174.9	-68.3	-176.4	-66.4	0	0	112.2	R802 A803 Y809 N810 V850	R802-M806 WeakPolarHBondContact O-CG 3.32Å; R802-M806 PolarHBondContact O-N 3.06Å; R802-M806 VanDerWaalsContact O-N 3.14Å; A803-M806 PolarHBondContact O-N 2.72Å; M806-Y809 PolarHBondContact O-N 3.29Å; M806-N810 VanDerWaalsContact O-CG 3.31Å; M806-N810 PolarHBondContact O-N 2.99Å; M806-N810 VanDerWaalsContact O-N 3.13Å; M806-N810 PolarHBondContact O-ND2 3.19Å; M806-V850 HydrophobicContact CB-CG1 4.4Å
807	A	92.9	Very high	88	Confident	0 Å²	0	48 Å²	48	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-63.7	-47.3	174.3	0	0	0	0	0	111.8	M679 A803 V804 Y809 N810 V811 T847	M679-A807 HydrophobicContact SD-CB 3.85Å; A803-A807 PolarHBondContact O-N 3.01Å; V804-A807 PolarHBondContact O-N 3.01Å; A807-Y809 VanDerWaalsContact C-N 3.34Å; A807-Y809 PolarHBondContact O-N 2.71Å; A807-N810 PolarHBondContact O-N 3.02Å; A807-V811 VanDerWaalsContact O-CG2 3.3Å; A807-V811 WeakPolarHBondContact O-CG2 3.41Å; A807-V811 PolarHBondContact O-N 2.98Å; A807-T847 HydrophobicContact CB-CG2 4.33Å
808	I	94.1	Very high	89.5	Confident	1 Å²	1	41.6 Å²	41.6	1%	0.005	21%	0.21	C	C	.	.	H	α-helix	trans	-56.7	-45.2	175.8	-81	167.3	0	0	0	111.7	Y676 M679 I683 V804 G805 A812	Y676-I808 HydrophobicContact CE2-CB 4.38Å; Y676-I808 HydrophobicContact CE2-CG1 3.95Å; Y676-I808 HydrophobicContact CE2-CG2 4.07Å; M679-I808 HydrophobicContact CB-CD1 3.88Å; M679-I808 HydrophobicContact CB-CG1 3.95Å; I683-I808 HydrophobicContact CD1-CD1 3.64Å; I683-I808 HydrophobicContact CG1-CD1 4.12Å; V804-I808 HydrophobicContact CG1-CD1 4.02Å; V804-I808 WeakPolarHBondContact O-CB 3.46Å; V804-I808 WeakPolarHBondContact O-CG1 3.5Å; V804-I808 PolarHBondContact O-N 3.07Å; G805-I808 PolarHBondContact O-N 3.47Å; I808-A812 WeakPolarHBondContact O-CB 3.22Å; I808-A812 PolarHBondContact O-N 3.33Å
809	Y	92.7	Very high	90.5	Very high	132 Å²	132	42.5 Å²	42.5	52%	0.518	22%	0.218	S	C	.	.	H	α-helix	trans	-60.4	-49	178.3	-178.8	-94.2	0	0	0	111.8	I784 G805 M806 A807 A812 V813	I784-Y809 HydrophobicContact CG2-CD2 4.46Å; G805-Y809 PolarHBondContact O-N 3.47Å; M806-Y809 PolarHBondContact O-N 3.29Å; A807-Y809 VanDerWaalsContact C-N 3.34Å; A807-Y809 PolarHBondContact O-N 2.71Å; Y809-A812 PolarHBondContact O-N 3.09Å; Y809-V813 HydrophobicContact CD1-CG2 4.36Å; Y809-V813 HydrophobicContact CE1-CG2 4Å; Y809-V813 HydrophobicContact CE2-CG2 4.17Å; Y809-V813 WeakPolarHBondContact O-CG2 3.31Å; Y809-V813 PolarHBondContact O-N 3.36Å
810	N	92.3	Very high	91.3	Very high	56 Å²	56	43.6 Å²	43.6	30%	0.299	23%	0.227	S	C	.	.	H	α-helix	trans	-64.9	-42.8	-178.7	-68.7	-23	0	0	0	112.3	M806 A807 L814 I846	M806-N810 VanDerWaalsContact O-CG 3.31Å; M806-N810 PolarHBondContact O-N 2.99Å; M806-N810 VanDerWaalsContact O-N 3.13Å; M806-N810 PolarHBondContact O-ND2 3.19Å; A807-N810 PolarHBondContact O-N 3.02Å; N810-L814 WeakPolarHBondContact O-CB 3.42Å; N810-L814 VanDerWaalsContact O-CG 3.3Å; N810-L814 WeakPolarHBondContact O-CG 3.22Å; N810-L814 PolarHBondContact O-N 3.13Å; N810-L814 VanDerWaalsContact O-N 3.15Å; N810-I846 HydrophobicContact CB-CG2 4.06Å; N810-I846 WeakPolarHBondContact ND2-CG2 3.38Å
811	V	94.8	Very high	91.8	Very high	10 Å²	10	45.2 Å²	45.2	6%	0.061	24%	0.237	C	C	.	.	H	α-helix	trans	-61.9	-46.6	174.7	172.8	0	0	0	0	110.6	F672 Y676 M679 A807 L814 C815 T847	F672-V811 HydrophobicContact CE2-CG1 4.09Å; Y676-V811 HydrophobicContact CD2-CG1 4.24Å; M679-V811 HydrophobicContact CE-CG2 4.5Å; A807-V811 VanDerWaalsContact O-CG2 3.3Å; A807-V811 WeakPolarHBondContact O-CG2 3.41Å; A807-V811 PolarHBondContact O-N 2.98Å; V811-L814 PolarHBondContact O-N 3.35Å; V811-C815 WeakPolarHBondContact O-CB 3.48Å; V811-C815 PolarHBondContact O-N 3.02Å; V811-C815 PolarHBondContact O-SG 3Å; V811-C815 VanDerWaalsContact O-SG 3.34Å; V811-T847 WeakPolarHBondContact CG2-OG1 3.48Å
812	A	94	Very high	92	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-62.9	-47.2	-177.7	0	0	0	0	0	112.6	L780 I784 I808 Y809 C815 L816	L780-A812 HydrophobicContact CB-CB 4.1Å; L780-A812 HydrophobicContact CD2-CB 3.85Å; L780-A812 HydrophobicContact CG-CB 4.37Å; I784-A812 HydrophobicContact CD1-CB 3.52Å; I784-A812 HydrophobicContact CG1-CB 3.85Å; I808-A812 WeakPolarHBondContact O-CB 3.22Å; I808-A812 PolarHBondContact O-N 3.33Å; Y809-A812 PolarHBondContact O-N 3.09Å; A812-C815 PolarHBondContact O-N 3.42Å; A812-L816 WeakPolarHBondContact O-CB 3.44Å; A812-L816 VanDerWaalsContact O-CG 3.22Å; A812-L816 WeakPolarHBondContact O-CG 3.01Å; A812-L816 PolarHBondContact O-N 2.7Å
813	V	93.3	Very high	92.1	Very high	53 Å²	53	43.8 Å²	43.8	32%	0.321	24%	0.239	S	C	.	.	H	α-helix	trans	-62.9	-44.9	178.6	172	0	0	0	0	111.2	Y809 I817	Y809-V813 HydrophobicContact CD1-CG2 4.36Å; Y809-V813 HydrophobicContact CE1-CG2 4Å; Y809-V813 HydrophobicContact CE2-CG2 4.17Å; Y809-V813 WeakPolarHBondContact O-CG2 3.31Å; Y809-V813 PolarHBondContact O-N 3.36Å; V813-I817 HydrophobicContact CG1-CD1 3.82Å; V813-I817 WeakPolarHBondContact O-CG1 3.36Å; V813-I817 PolarHBondContact O-N 3.11Å
814	L	94.1	Very high	92.2	Very high	48 Å²	48	49.3 Å²	49.3	25%	0.251	27%	0.265	S	S	.	.	H	α-helix	trans	-60.7	-50.3	177.8	-73.4	171.7	0	0	0	111.5	N810 V811 I817 T818 F842	N810-L814 WeakPolarHBondContact O-CB 3.42Å; N810-L814 VanDerWaalsContact O-CG 3.3Å; N810-L814 WeakPolarHBondContact O-CG 3.22Å; N810-L814 PolarHBondContact O-N 3.13Å; N810-L814 VanDerWaalsContact O-N 3.15Å; V811-L814 PolarHBondContact O-N 3.35Å; L814-I817 PolarHBondContact O-N 3.12Å; L814-T818 WeakPolarHBondContact O-CB 3.42Å; L814-T818 VanDerWaalsContact O-CG2 3.24Å; L814-T818 WeakPolarHBondContact O-CG2 3.37Å; L814-T818 PolarHBondContact O-N 2.68Å; L814-T818 PolarHBondContact O-OG1 2.85Å; L814-F842 HydrophobicContact CD1-CB 4.39Å
815	C	93.6	Very high	92.1	Very high	34 Å²	34	51.1 Å²	51.1	23%	0.23	27%	0.274	C	S	.	.	H	α-helix	trans	-66.1	-38.3	-178.3	-68.4	0	0	0	0	113.7	L780 V811 A812 I817 A819	L780-C815 HydrophobicContact CD1-CB 3.95Å; V811-C815 WeakPolarHBondContact O-CB 3.48Å; V811-C815 PolarHBondContact O-N 3.02Å; V811-C815 PolarHBondContact O-SG 3Å; V811-C815 VanDerWaalsContact O-SG 3.34Å; A812-C815 PolarHBondContact O-N 3.42Å; C815-I817 VanDerWaalsContact C-N 3.3Å; C815-I817 PolarHBondContact O-N 3.12Å; C815-A819 PolarHBondContact O-N 3.28Å
816	L	92.4	Very high	91.9	Very high	73 Å²	73	54.1 Å²	54.1	38%	0.382	29%	0.293	S	S	.	.	H	α-helix	trans	-68.4	-28.7	178.7	-72.7	170.3	0	0	0	112.7	L780 L781 A812 P820	L780-L816 HydrophobicContact CD1-CD2 4.33Å; L780-L816 HydrophobicContact CD1-CG 4.11Å; L781-L816 HydrophobicContact CD2-CD1 4.35Å; A812-L816 WeakPolarHBondContact O-CB 3.44Å; A812-L816 VanDerWaalsContact O-CG 3.22Å; A812-L816 WeakPolarHBondContact O-CG 3.01Å; A812-L816 PolarHBondContact O-N 2.7Å; L816-P820 WeakPolarHBondContact O-CD 3.43Å
817	I	92.9	Very high	91.6	Very high	106 Å²	106	51.2 Å²	51.2	54%	0.544	28%	0.283	S	S	.	.	H	α-helix	trans	-81.5	-43.5	174.9	-66.9	169.9	0	0	0	111.1	V813 L814 C815 V821	V813-I817 HydrophobicContact CG1-CD1 3.82Å; V813-I817 WeakPolarHBondContact O-CG1 3.36Å; V813-I817 PolarHBondContact O-N 3.11Å; L814-I817 PolarHBondContact O-N 3.12Å; C815-I817 VanDerWaalsContact C-N 3.3Å; C815-I817 PolarHBondContact O-N 3.12Å; I817-V821 WeakPolarHBondContact O-CG2 3.29Å
818	T	93.5	Very high	91.4	Very high	25 Å²	25	56.7 Å²	56.7	15%	0.153	31%	0.309	C	S	.	.	H	α-helix	trans	-81.5	-35.3	-166.6	60	0	0	0	0	113.7	L814 V821 T822 A839	L814-T818 WeakPolarHBondContact O-CB 3.42Å; L814-T818 VanDerWaalsContact O-CG2 3.24Å; L814-T818 WeakPolarHBondContact O-CG2 3.37Å; L814-T818 PolarHBondContact O-N 2.68Å; L814-T818 PolarHBondContact O-OG1 2.85Å; T818-V821 PolarHBondContact O-N 3.45Å; T818-V821 VanDerWaalsContact O-N 3.16Å; T818-T822 PolarHBondContact O-N 3.26Å; T818-T822 PolarHBondContact O-OG1 3.01Å; T818-T822 VanDerWaalsContact O-OG1 3.06Å; T818-A839 HydrophobicContact CG2-CB 3.54Å
819	A	90.9	Very high	91.1	Very high	20 Å²	20	58.9 Å²	58.9	17%	0.165	32%	0.319	C	S	.	.	H	α-helix	trans	-60.1	-45.8	-178.9	0	0	0	0	0	113.3	Y773 C815 V821 T822 M823	Y773-A819 HydrophobicContact CD2-CB 4.14Å; Y773-A819 HydrophobicContact CE1-CB 4.41Å; Y773-A819 HydrophobicContact CE2-CB 3.99Å; Y773-A819 HydrophobicContact CG-CB 4.41Å; C815-A819 PolarHBondContact O-N 3.28Å; A819-V821 PolarHBondContact O-N 2.96Å; A819-T822 PolarHBondContact O-N 3.47Å; A819-T822 PolarHBondContact O-OG1 2.9Å; A819-M823 PolarHBondContact O-N 2.9Å
820	P	91.6	Very high	91	Very high	68 Å²	68	56.1 Å²	56.1	44%	0.442	31%	0.313	S	S	.	.	H	α-helix	trans	-62.1	-40.6	172	-23.3	34.6	0	0	0	113.4	L816 M823 I824	L816-P820 WeakPolarHBondContact O-CD 3.43Å; P820-M823 PolarHBondContact O-N 3.38Å; P820-I824 WeakPolarHBondContact O-CG1 3.42Å; P820-I824 PolarHBondContact O-N 2.82Å; P820-I824 VanDerWaalsContact O-N 3.1Å
821	V	92.6	Very high	90.9	Very high	45 Å²	45	54.7 Å²	54.7	27%	0.273	31%	0.309	S	S	.	.	H	α-helix	trans	-63	-44.4	179.6	169.7	0	0	0	0	111.4	I817 T818 A819 M823 I824 L825 F835	I817-V821 WeakPolarHBondContact O-CG2 3.29Å; T818-V821 PolarHBondContact O-N 3.45Å; T818-V821 VanDerWaalsContact O-N 3.16Å; A819-V821 PolarHBondContact O-N 2.96Å; V821-M823 VanDerWaalsContact C-N 3.29Å; V821-M823 PolarHBondContact O-N 3.46Å; V821-I824 PolarHBondContact O-N 2.92Å; V821-L825 HydrophobicContact CG1-CD1 3.72Å; V821-L825 HydrophobicContact CG1-CG 4.44Å; V821-L825 WeakPolarHBondContact O-CB 3.28Å; V821-L825 WeakPolarHBondContact O-CG 3.26Å; V821-L825 PolarHBondContact O-N 3.14Å; V821-F835 HydrophobicContact CG1-CB 4.43Å; V821-F835 HydrophobicContact CG1-CD1 4.33Å; V821-F835 HydrophobicContact CG1-CD2 3.88Å; V821-F835 HydrophobicContact CG1-CE2 4.19Å; V821-F835 HydrophobicContact CG1-CG 3.96Å
822	T	90.9	Very high	90.8	Very high	22 Å²	22	55.3 Å²	55.3	14%	0.135	31%	0.314	C	S	.	.	H	α-helix	trans	-67	-28.4	178	48.6	0	0	0	0	113.4	T818 A819 S832 F835 A836	T818-T822 PolarHBondContact O-N 3.26Å; T818-T822 PolarHBondContact O-OG1 3.01Å; T818-T822 VanDerWaalsContact O-OG1 3.06Å; A819-T822 PolarHBondContact O-N 3.47Å; A819-T822 PolarHBondContact O-OG1 2.9Å; T822-S832 PolarHBondContact O-OG 3.41Å; T822-F835 HydrophobicContact CG2-CB 4.09Å; T822-A836 HydrophobicContact CG2-CB 3.94Å
823	M	88.5	Confident	90.8	Very high	88 Å²	88	56.1 Å²	56.1	43%	0.433	32%	0.318	S	S	.	.	H	α-helix	trans	-72.2	-38.4	174.7	-176.2	-179.6	176.3	0	0	112	N766 A819 P820 V821 S826	N766-M823 HydrophobicContact CB-CE 4.1Å; A819-M823 PolarHBondContact O-N 2.9Å; P820-M823 PolarHBondContact O-N 3.38Å; V821-M823 VanDerWaalsContact C-N 3.29Å; V821-M823 PolarHBondContact O-N 3.46Å; M823-S826 PolarHBondContact O-OG 2.98Å
824	I	89.8	Confident	90.8	Very high	132 Å²	132	54.6 Å²	54.6	68%	0.677	31%	0.311	S	S	*	.	H	α-helix	trans	-72.7	-37.5	177.6	-66.9	165.6	0	0	0	111.5	P820 V821 S826	P820-I824 WeakPolarHBondContact O-CG1 3.42Å; P820-I824 PolarHBondContact O-N 2.82Å; P820-I824 VanDerWaalsContact O-N 3.1Å; V821-I824 PolarHBondContact O-N 2.92Å; I824-S826 VanDerWaalsContact C-N 3.31Å; I824-S826 PolarHBondContact O-N 3.32Å
825	L	90.4	Very high	90.8	Very high	40 Å²	40	57.1 Å²	57.1	21%	0.209	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.5	18.2	-176.7	-62.9	177.2	0	0	0	114.2	V821 S827 Q828 A831 F835	V821-L825 HydrophobicContact CG1-CD1 3.72Å; V821-L825 HydrophobicContact CG1-CG 4.44Å; V821-L825 WeakPolarHBondContact O-CB 3.28Å; V821-L825 WeakPolarHBondContact O-CG 3.26Å; V821-L825 PolarHBondContact O-N 3.14Å; L825-S827 PolarHBondContact O-N 3.39Å; L825-S827 VanDerWaalsContact O-N 3.17Å; L825-Q828 PolarHBondContact O-N 3.24Å; L825-A831 HydrophobicContact CD1-CB 4.32Å; L825-F835 HydrophobicContact CD1-CD2 3.64Å; L825-F835 HydrophobicContact CD1-CE2 3.63Å
826	S	84.3	Confident	90.8	Very high	75 Å²	75	56.5 Å²	56.5	52%	0.524	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.3	-32.2	-175.1	53.1	0	0	0	0	114.7	M823 I824 Q828	M823-S826 PolarHBondContact O-OG 2.98Å; I824-S826 VanDerWaalsContact C-N 3.31Å; I824-S826 PolarHBondContact O-N 3.32Å; S826-Q828 VanDerWaalsContact C-N 3.29Å; S826-Q828 PolarHBondContact O-N 3.41Å
827	S	84.8	Confident	91	Very high	47 Å²	47	53 Å²	53	33%	0.329	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.4	-7.4	176.2	60.5	0	0	0	0	114.6	L825	L825-S827 PolarHBondContact O-N 3.39Å; L825-S827 VanDerWaalsContact O-N 3.17Å
828	Q	87.9	Confident	91	Very high	116 Å²	116	51.7 Å²	51.7	54%	0.542	29%	0.293	S	S	.	.			trans	-116.2	86.7	178.3	-64.2	-171.3	14.4	0	0	110.6	L825 S826 D830 A831 S832	L825-Q828 PolarHBondContact O-N 3.24Å; S826-Q828 VanDerWaalsContact C-N 3.29Å; S826-Q828 PolarHBondContact O-N 3.41Å; Q828-D830 PolarHBondContact O-N 3.2Å; Q828-A831 HydrophobicContact CB-CB 4.01Å; Q828-A831 PolarHBondContact O-N 3.46Å; Q828-A831 VanDerWaalsContact O-N 3.17Å; Q828-S832 PolarHBondContact O-N 2.89Å
829	Q	87	Confident	91.1	Very high	47 Å²	47	51 Å²	51	22%	0.22	29%	0.29	C	S	.	.	H	α-helix	trans	-50.9	-53.4	-175.4	-82.8	175.5	-16.1	0	0	113.9	R583 L757 E758 A831 S832 F833	R583-Q829 PolarHBondContact O-OE1 2.96Å; L757-Q829 HydrophobicContact CD1-CG 3.85Å; L757-Q829 HydrophobicContact CD2-CG 4.41Å; L757-Q829 HydrophobicContact CG-CG 4.32Å; E758-Q829 PolarHBondContact O-NE2 3.17Å; E758-Q829 VanDerWaalsContact O-NE2 3.14Å; Q829-A831 VanDerWaalsContact C-N 3.32Å; Q829-A831 PolarHBondContact O-N 3.34Å; Q829-S832 PolarHBondContact O-N 2.57Å; Q829-F833 VanDerWaalsContact O-CB 3.23Å; Q829-F833 WeakPolarHBondContact O-CB 3.39Å; Q829-F833 PolarHBondContact O-N 3.29Å
830	D	90.8	Very high	91.3	Very high	73 Å²	73	50.9 Å²	50.9	39%	0.39	29%	0.286	S	S	.	.	H	α-helix	trans	-56.8	-43.8	179.8	-83	-27.6	0	0	0	112.2	L585 S586 L589 Q828 A834	L585-D830 WeakPolarHBondContact CD1-OD1 3.42Å; S586-D830 WeakPolarHBondContact CB-OD1 3.22Å; S586-D830 PolarHBondContact N-OD1 2.8Å; L589-D830 HydrophobicContact CD2-CB 4.12Å; Q828-D830 PolarHBondContact O-N 3.2Å; D830-A834 VanDerWaalsContact O-CB 3.24Å; D830-A834 WeakPolarHBondContact O-CB 3.22Å; D830-A834 PolarHBondContact O-N 2.95Å
831	A	91.4	Very high	91.5	Very high	26 Å²	26	48.1 Å²	48.1	22%	0.215	27%	0.268	C	S	.	.	H	α-helix	trans	-70.2	-47.8	-178.5	0	0	0	0	0	111.8	L825 Q828 Q829 A834 F835	L825-A831 HydrophobicContact CD1-CB 4.32Å; Q828-A831 HydrophobicContact CB-CB 4.01Å; Q828-A831 PolarHBondContact O-N 3.46Å; Q828-A831 VanDerWaalsContact O-N 3.17Å; Q829-A831 VanDerWaalsContact C-N 3.32Å; Q829-A831 PolarHBondContact O-N 3.34Å; A831-A834 PolarHBondContact O-N 3.15Å; A831-F835 WeakPolarHBondContact O-CD2 3.23Å; A831-F835 PolarHBondContact O-N 3.32Å
832	S	91.8	Very high	91.7	Very high	24 Å²	24	51.4 Å²	51.4	17%	0.168	28%	0.279	C	S	.	.	H	α-helix	trans	-64.7	-41.6	179.4	-165.8	0	0	0	0	111.6	T822 Q828 Q829 A836	T822-S832 PolarHBondContact O-OG 3.41Å; Q828-S832 PolarHBondContact O-N 2.89Å; Q829-S832 PolarHBondContact O-N 2.57Å; S832-A836 VanDerWaalsContact O-CB 3.3Å; S832-A836 WeakPolarHBondContact O-CB 3.47Å; S832-A836 PolarHBondContact O-N 3.39Å
833	F	93.5	Very high	91.9	Very high	16 Å²	16	51.2 Å²	51.2	7%	0.07	28%	0.279	C	S	.	.	H	α-helix	trans	-61.3	-45.8	172.8	175.9	-101.6	0	0	0	112	L585 L589 F590 V593 V642 L645 G646 Q829 A836 S837	L585-F833 HydrophobicContact CD1-CB 3.8Å; L585-F833 HydrophobicContact CD1-CD1 4.05Å; L585-F833 HydrophobicContact CD1-CG 3.99Å; L585-F833 HydrophobicContact CD2-CD1 3.97Å; L585-F833 HydrophobicContact CD2-CD2 4.21Å; L585-F833 HydrophobicContact CD2-CE1 4.2Å; L585-F833 HydrophobicContact CD2-CE2 4.44Å; L585-F833 HydrophobicContact CD2-CG 3.98Å; L585-F833 HydrophobicContact CD2-CZ 4.43Å; L589-F833 HydrophobicContact CD2-CD1 4.02Å; L589-F833 HydrophobicContact CG-CD1 4.08Å; L589-F833 HydrophobicContact CG-CE1 4.22Å; F590-F833 HydrophobicContact CD2-CE1 4.49Å; F590-F833 HydrophobicContact CD2-CE2 4.46Å; F590-F833 AromaticContact CD2-CZ 3.89Å; F590-F833 HydrophobicContact CD2-CZ 3.89Å; V593-F833 HydrophobicContact CB-CE1 4Å; V593-F833 HydrophobicContact CB-CZ 4.16Å; V593-F833 HydrophobicContact CG1-CE1 3.94Å; V593-F833 HydrophobicContact CG1-CZ 3.7Å; V593-F833 HydrophobicContact CG2-CE1 4.09Å; V642-F833 HydrophobicContact CG1-CZ 4.42Å; L645-F833 HydrophobicContact CB-CD2 4.37Å; L645-F833 HydrophobicContact CB-CE2 4.24Å; G646-F833 VanDerWaalsContact CA-CE2 3.45Å; Q829-F833 VanDerWaalsContact O-CB 3.23Å; Q829-F833 WeakPolarHBondContact O-CB 3.39Å; Q829-F833 PolarHBondContact O-N 3.29Å; F833-A836 PolarHBondContact O-N 3.49Å; F833-S837 VanDerWaalsContact O-CB 3.25Å; F833-S837 WeakPolarHBondContact O-CB 3.44Å; F833-S837 PolarHBondContact O-N 3.06Å; F833-S837 PolarHBondContact O-OG 2.87Å
834	A	94	Very high	92.2	Very high	21 Å²	21	47.2 Å²	47.2	17%	0.174	26%	0.26	C	S	.	.	H	α-helix	trans	-60.6	-48.8	178.1	0	0	0	0	0	112	L589 D830 A831 S837 L838	L589-A834 HydrophobicContact CD1-CB 4.47Å; L589-A834 HydrophobicContact CD2-CB 4.3Å; D830-A834 VanDerWaalsContact O-CB 3.24Å; D830-A834 WeakPolarHBondContact O-CB 3.22Å; D830-A834 PolarHBondContact O-N 2.95Å; A831-A834 PolarHBondContact O-N 3.15Å; A834-S837 PolarHBondContact O-OG 2.89Å; A834-L838 VanDerWaalsContact O-CB 3.24Å; A834-L838 WeakPolarHBondContact O-CB 3.35Å; A834-L838 VanDerWaalsContact O-CG 3.23Å; A834-L838 WeakPolarHBondContact O-CG 3.33Å; A834-L838 PolarHBondContact O-N 3.06Å
835	F	95.1	Very high	92.5	Very high	101 Å²	101	43.7 Å²	43.7	44%	0.443	24%	0.238	S	C	.	.	H	α-helix	trans	-64.2	-43.1	179.1	-79.5	-65	0	0	0	112.7	V821 T822 L825 A831 A839	V821-F835 HydrophobicContact CG1-CB 4.43Å; V821-F835 HydrophobicContact CG1-CD1 4.33Å; V821-F835 HydrophobicContact CG1-CD2 3.88Å; V821-F835 HydrophobicContact CG1-CE2 4.19Å; V821-F835 HydrophobicContact CG1-CG 3.96Å; T822-F835 HydrophobicContact CG2-CB 4.09Å; L825-F835 HydrophobicContact CD1-CD2 3.64Å; L825-F835 HydrophobicContact CD1-CE2 3.63Å; A831-F835 WeakPolarHBondContact O-CD2 3.23Å; A831-F835 PolarHBondContact O-N 3.32Å; F835-A839 VanDerWaalsContact O-CB 3.26Å; F835-A839 WeakPolarHBondContact O-CB 3.34Å; F835-A839 PolarHBondContact O-N 2.92Å
836	A	93.3	Very high	92.7	Very high	22 Å²	22	44.6 Å²	44.6	18%	0.182	24%	0.242	C	C	.	.	H	α-helix	trans	-63.5	-51.7	177.6	0	0	0	0	0	112	T822 S832 F833 A839 I840	T822-A836 HydrophobicContact CG2-CB 3.94Å; S832-A836 VanDerWaalsContact O-CB 3.3Å; S832-A836 WeakPolarHBondContact O-CB 3.47Å; S832-A836 PolarHBondContact O-N 3.39Å; F833-A836 PolarHBondContact O-N 3.49Å; A836-A839 PolarHBondContact O-N 2.67Å; A836-I840 WeakPolarHBondContact O-CD1 3.49Å; A836-I840 WeakPolarHBondContact O-CG1 3.48Å; A836-I840 PolarHBondContact O-N 3.2Å; A836-I840 VanDerWaalsContact O-N 3.13Å
837	S	95.1	Very high	93.2	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-69.8	-42.2	-174	60.3	0	0	0	0	113.1	V593 F833 A834 A839 I840 V841	V593-S837 VanDerWaalsContact CG1-CB 3.47Å; V593-S837 WeakPolarHBondContact CG1-OG 3.45Å; F833-S837 VanDerWaalsContact O-CB 3.25Å; F833-S837 WeakPolarHBondContact O-CB 3.44Å; F833-S837 PolarHBondContact O-N 3.06Å; F833-S837 PolarHBondContact O-OG 2.87Å; A834-S837 PolarHBondContact O-OG 2.89Å; S837-A839 VanDerWaalsContact C-N 3.32Å; S837-A839 PolarHBondContact O-N 3.41Å; S837-I840 PolarHBondContact O-N 2.86Å; S837-V841 WeakPolarHBondContact O-CG2 3.5Å; S837-V841 PolarHBondContact O-N 3.29Å
838	L	94.1	Very high	93.6	Very high	77 Å²	77	38.9 Å²	38.9	40%	0.403	20%	0.203	S	C	.	.	H	α-helix	trans	-64.3	-37.8	176	-68.8	172.8	0	0	0	111.5	A834 V841 F842	A834-L838 VanDerWaalsContact O-CB 3.24Å; A834-L838 WeakPolarHBondContact O-CB 3.35Å; A834-L838 VanDerWaalsContact O-CG 3.23Å; A834-L838 WeakPolarHBondContact O-CG 3.33Å; A834-L838 PolarHBondContact O-N 3.06Å; L838-V841 PolarHBondContact O-N 3.39Å; L838-F842 HydrophobicContact CB-CD2 4.18Å; L838-F842 HydrophobicContact CB-CE2 4.07Å; L838-F842 HydrophobicContact CD2-CE2 4.12Å; L838-F842 WeakPolarHBondContact O-CB 3.28Å; L838-F842 WeakPolarHBondContact O-CD2 3.48Å; L838-F842 PolarHBondContact O-N 3.44Å
839	A	95.3	Very high	93.9	Very high	11 Å²	11	36.4 Å²	36.4	9%	0.091	20%	0.195	C	C	.	.	H	α-helix	trans	-62.2	-44.1	175.1	0	0	0	0	0	112.2	T818 F835 A836 S837 S843	T818-A839 HydrophobicContact CG2-CB 3.54Å; F835-A839 VanDerWaalsContact O-CB 3.26Å; F835-A839 WeakPolarHBondContact O-CB 3.34Å; F835-A839 PolarHBondContact O-N 2.92Å; A836-A839 PolarHBondContact O-N 2.67Å; S837-A839 VanDerWaalsContact C-N 3.32Å; S837-A839 PolarHBondContact O-N 3.41Å; A839-S843 WeakPolarHBondContact O-CB 3.26Å; A839-S843 PolarHBondContact O-N 3Å; A839-S843 PolarHBondContact O-OG 3.2Å
840	I	95.9	Very high	94.2	Very high	17 Å²	17	35.8 Å²	35.8	9%	0.087	19%	0.194	C	C	.	.	H	α-helix	trans	-62.3	-48.8	175.4	-68	163.3	0	0	0	110.6	A638 V642 L645 L668 A836 S837 S843 A844	A638-I840 HydrophobicContact CB-CG2 4.36Å; A638-I840 VanDerWaalsContact O-CG2 3.29Å; A638-I840 WeakPolarHBondContact O-CG2 3.38Å; V642-I840 HydrophobicContact CG2-CB 4.24Å; V642-I840 HydrophobicContact CG2-CD1 4.36Å; V642-I840 HydrophobicContact CG2-CG2 3.81Å; L645-I840 HydrophobicContact CD1-CD1 3.87Å; L668-I840 HydrophobicContact CD1-CD1 3.73Å; L668-I840 HydrophobicContact CD1-CG1 4Å; L668-I840 HydrophobicContact CD2-CD1 4.44Å; A836-I840 WeakPolarHBondContact O-CD1 3.49Å; A836-I840 WeakPolarHBondContact O-CG1 3.48Å; A836-I840 PolarHBondContact O-N 3.2Å; A836-I840 VanDerWaalsContact O-N 3.13Å; S837-I840 PolarHBondContact O-N 2.86Å; I840-S843 PolarHBondContact O-OG 3.46Å; I840-S843 VanDerWaalsContact O-OG 3.11Å; I840-A844 VanDerWaalsContact O-CB 3.3Å; I840-A844 WeakPolarHBondContact O-CB 3.49Å; I840-A844 PolarHBondContact O-N 2.79Å
841	V	96.1	Very high	94.2	Very high	11 Å²	11	32.4 Å²	32.4	7%	0.067	18%	0.176	C	C	.	.	H	α-helix	trans	-62.1	-53.4	-179.4	170.5	0	0	0	0	111.1	F596 L639 S837 L838 S843 A844 Y845	F596-V841 HydrophobicContact CB-CG1 4.3Å; L639-V841 HydrophobicContact CD2-CB 4.45Å; L639-V841 HydrophobicContact CD2-CG2 4.01Å; S837-V841 WeakPolarHBondContact O-CG2 3.5Å; S837-V841 PolarHBondContact O-N 3.29Å; L838-V841 PolarHBondContact O-N 3.39Å; V841-S843 PolarHBondContact O-N 3.22Å; V841-A844 PolarHBondContact O-N 3.43Å; V841-Y845 HydrophobicContact CG1-CD2 3.81Å; V841-Y845 HydrophobicContact CG1-CE2 3.88Å; V841-Y845 WeakPolarHBondContact O-CB 3.37Å; V841-Y845 VanDerWaalsContact O-CD2 3.31Å; V841-Y845 WeakPolarHBondContact O-CD2 3.45Å; V841-Y845 PolarHBondContact O-N 2.87Å
842	F	95.6	Very high	94.2	Very high	113 Å²	113	31.1 Å²	31.1	50%	0.496	17%	0.166	S	C	.	.	H	α-helix	trans	-64.4	-42.1	-178.4	-71.1	-54.5	0	0	0	112.7	L814 L838 A844 Y845 I846	L814-F842 HydrophobicContact CD1-CB 4.39Å; L838-F842 HydrophobicContact CB-CD2 4.18Å; L838-F842 HydrophobicContact CB-CE2 4.07Å; L838-F842 HydrophobicContact CD2-CE2 4.12Å; L838-F842 WeakPolarHBondContact O-CB 3.28Å; L838-F842 WeakPolarHBondContact O-CD2 3.48Å; L838-F842 PolarHBondContact O-N 3.44Å; F842-A844 PolarHBondContact O-N 3.05Å; F842-Y845 PolarHBondContact O-N 3.26Å; F842-I846 HydrophobicContact CB-CD1 4.49Å; F842-I846 VanDerWaalsContact O-CB 3.3Å; F842-I846 WeakPolarHBondContact O-CB 3.22Å; F842-I846 WeakPolarHBondContact O-CD1 3.49Å; F842-I846 WeakPolarHBondContact O-CG1 3.47Å; F842-I846 PolarHBondContact O-N 3.02Å
843	S	94.7	Very high	94.1	Very high	19 Å²	19	33 Å²	33	13%	0.133	18%	0.177	C	C	.	.	H	α-helix	trans	-64.3	-40.7	178.9	61.2	0	0	0	0	112.5	A839 I840 V841 T847	A839-S843 WeakPolarHBondContact O-CB 3.26Å; A839-S843 PolarHBondContact O-N 3Å; A839-S843 PolarHBondContact O-OG 3.2Å; I840-S843 PolarHBondContact O-OG 3.46Å; I840-S843 VanDerWaalsContact O-OG 3.11Å; V841-S843 PolarHBondContact O-N 3.22Å; S843-T847 VanDerWaalsContact O-CB 3.29Å; S843-T847 WeakPolarHBondContact O-CB 3.27Å; S843-T847 PolarHBondContact O-N 2.86Å; S843-T847 VanDerWaalsContact O-N 3.11Å; S843-T847 PolarHBondContact O-OG1 2.88Å
844	A	95.5	Very high	93.9	Very high	4 Å²	4	35.5 Å²	35.5	3%	0.033	19%	0.194	C	C	.	.	H	α-helix	trans	-67.4	-48.1	174.8	0	0	0	0	0	112.3	C635 L639 I840 V841 F842 I846 T847 L848	C635-A844 HydrophobicContact CB-CB 4.2Å; L639-A844 HydrophobicContact CD1-CB 3.92Å; L639-A844 HydrophobicContact CD2-CB 3.93Å; L639-A844 HydrophobicContact CG-CB 3.76Å; I840-A844 VanDerWaalsContact O-CB 3.3Å; I840-A844 WeakPolarHBondContact O-CB 3.49Å; I840-A844 PolarHBondContact O-N 2.79Å; V841-A844 PolarHBondContact O-N 3.43Å; F842-A844 PolarHBondContact O-N 3.05Å; A844-I846 PolarHBondContact O-N 3.12Å; A844-T847 PolarHBondContact O-N 3.31Å; A844-L848 WeakPolarHBondContact O-CG 3.34Å; A844-L848 PolarHBondContact O-N 2.83Å
845	Y	96	Very high	93.6	Very high	57 Å²	57	34.7 Å²	34.7	22%	0.224	19%	0.187	C	C	.	.	H	α-helix	trans	-59.3	-48.7	178.3	-95.8	-107	0	0	0	112	F596 L599 G600 L603 V841 F842 T847 L848 V849	F596-Y845 PolarHBondContact O-OH 2.76Å; L599-Y845 VanDerWaalsContact CB-OH 3.32Å; L599-Y845 WeakPolarHBondContact CB-OH 3.3Å; G600-Y845 PolarHBondContact N-OH 3.13Å; G600-Y845 VanDerWaalsContact N-OH 3.13Å; L603-Y845 HydrophobicContact CD2-CD1 4.11Å; L603-Y845 HydrophobicContact CD2-CE1 4.15Å; V841-Y845 HydrophobicContact CG1-CD2 3.81Å; V841-Y845 HydrophobicContact CG1-CE2 3.88Å; V841-Y845 WeakPolarHBondContact O-CB 3.37Å; V841-Y845 VanDerWaalsContact O-CD2 3.31Å; V841-Y845 WeakPolarHBondContact O-CD2 3.45Å; V841-Y845 PolarHBondContact O-N 2.87Å; F842-Y845 PolarHBondContact O-N 3.26Å; Y845-T847 VanDerWaalsContact C-N 3.32Å; Y845-T847 PolarHBondContact O-N 3.15Å; Y845-L848 PolarHBondContact O-N 3.39Å; Y845-V849 WeakPolarHBondContact O-CB 3.45Å; Y845-V849 VanDerWaalsContact O-CG2 3.3Å; Y845-V849 WeakPolarHBondContact O-CG2 3.22Å; Y845-V849 PolarHBondContact O-N 2.73Å
846	I	94.9	Very high	93.2	Very high	59 Å²	59	31.6 Å²	31.6	30%	0.303	17%	0.174	S	C	.	.	H	α-helix	trans	-61.6	-42.6	179.1	-68.8	167.3	0	0	0	110.2	N810 F842 A844 V849 V850	N810-I846 HydrophobicContact CB-CG2 4.06Å; N810-I846 WeakPolarHBondContact ND2-CG2 3.38Å; F842-I846 HydrophobicContact CB-CD1 4.49Å; F842-I846 VanDerWaalsContact O-CB 3.3Å; F842-I846 WeakPolarHBondContact O-CB 3.22Å; F842-I846 WeakPolarHBondContact O-CD1 3.49Å; F842-I846 WeakPolarHBondContact O-CG1 3.47Å; F842-I846 PolarHBondContact O-N 3.02Å; A844-I846 PolarHBondContact O-N 3.12Å; I846-V849 PolarHBondContact O-N 3.11Å; I846-V850 HydrophobicContact CG2-CG2 4.15Å; I846-V850 VanDerWaalsContact O-CB 3.25Å; I846-V850 WeakPolarHBondContact O-CB 3.49Å; I846-V850 WeakPolarHBondContact O-CG2 3.44Å; I846-V850 PolarHBondContact O-N 3.34Å
847	T	94.4	Very high	92.8	Very high	2 Å²	2	39.1 Å²	39.1	1%	0.012	20%	0.198	C	C	.	.	H	α-helix	trans	-62.1	-48.6	177.7	-60.9	0	0	0	0	111.9	T631 M679 A807 V811 S843 A844 Y845 L851	T631-T847 HydrophobicContact CG2-CG2 3.81Å; M679-T847 HydrophobicContact CE-CG2 3.89Å; M679-T847 HydrophobicContact SD-CG2 3.75Å; A807-T847 HydrophobicContact CB-CG2 4.33Å; V811-T847 WeakPolarHBondContact CG2-OG1 3.48Å; S843-T847 VanDerWaalsContact O-CB 3.29Å; S843-T847 WeakPolarHBondContact O-CB 3.27Å; S843-T847 PolarHBondContact O-N 2.86Å; S843-T847 VanDerWaalsContact O-N 3.11Å; S843-T847 PolarHBondContact O-OG1 2.88Å; A844-T847 PolarHBondContact O-N 3.31Å; Y845-T847 VanDerWaalsContact C-N 3.32Å; Y845-T847 PolarHBondContact O-N 3.15Å; T847-L851 HydrophobicContact CG2-CD1 3.79Å; T847-L851 WeakPolarHBondContact O-CB 3.36Å; T847-L851 VanDerWaalsContact O-CG 3.26Å; T847-L851 WeakPolarHBondContact O-CG 3.18Å; T847-L851 PolarHBondContact O-N 2.87Å; T847-L851 VanDerWaalsContact O-N 3.09Å
848	L	94.1	Very high	92.1	Very high	1 Å²	1	44.5 Å²	44.5	1%	0.005	22%	0.218	C	C	.	.	H	α-helix	trans	-61.9	-47.3	178	-70.3	172.1	0	0	0	111.6	A632 C635 A844 Y845 F852	A632-L848 HydrophobicContact CB-CD2 4.17Å; C635-L848 HydrophobicContact CB-CD1 4.46Å; C635-L848 HydrophobicContact CB-CD2 4.32Å; C635-L848 HydrophobicContact CB-CG 4.3Å; A844-L848 WeakPolarHBondContact O-CG 3.34Å; A844-L848 PolarHBondContact O-N 2.83Å; Y845-L848 PolarHBondContact O-N 3.39Å; L848-F852 HydrophobicContact CD2-CD2 4.16Å; L848-F852 HydrophobicContact CD2-CE2 3.98Å; L848-F852 WeakPolarHBondContact O-CB 3.4Å; L848-F852 WeakPolarHBondContact O-CD2 3.38Å; L848-F852 PolarHBondContact O-N 2.83Å
849	V	94.1	Very high	91.5	Very high	63 Å²	63	43.2 Å²	43.2	38%	0.382	21%	0.211	S	C	.	.	H	α-helix	trans	-62.2	-50.3	-180	168.4	0	0	0	0	111.3	Y845 I846 L851 V853 P854	Y845-V849 WeakPolarHBondContact O-CB 3.45Å; Y845-V849 VanDerWaalsContact O-CG2 3.3Å; Y845-V849 WeakPolarHBondContact O-CG2 3.22Å; Y845-V849 PolarHBondContact O-N 2.73Å; I846-V849 PolarHBondContact O-N 3.11Å; V849-L851 VanDerWaalsContact C-N 3.33Å; V849-L851 PolarHBondContact O-N 2.84Å; V849-V853 HydrophobicContact CB-CG2 4.4Å; V849-V853 HydrophobicContact CG1-CB 4.49Å; V849-V853 HydrophobicContact CG1-CG2 4.11Å; V849-V853 VanDerWaalsContact O-CB 3.28Å; V849-V853 WeakPolarHBondContact O-CB 3.34Å; V849-V853 PolarHBondContact O-N 3.49Å; V849-P854 WeakPolarHBondContact O-CD 3.38Å
850	V	93.3	Very high	90.7	Very high	34 Å²	34	48.9 Å²	48.9	21%	0.206	24%	0.239	C	C	.	.	H	α-helix	trans	-64.6	-35.3	-177.2	169.8	0	0	0	0	112.2	A803 M806 I846 P854	A803-V850 HydrophobicContact CB-CG1 3.92Å; A803-V850 VanDerWaalsContact O-CG1 3.3Å; A803-V850 WeakPolarHBondContact O-CG1 3.46Å; M806-V850 HydrophobicContact CB-CG1 4.4Å; I846-V850 HydrophobicContact CG2-CG2 4.15Å; I846-V850 VanDerWaalsContact O-CB 3.25Å; I846-V850 WeakPolarHBondContact O-CB 3.49Å; I846-V850 WeakPolarHBondContact O-CG2 3.44Å; I846-V850 PolarHBondContact O-N 3.34Å; V850-P854 WeakPolarHBondContact O-CD 3.49Å; V850-P854 WeakPolarHBondContact O-CG 3.36Å
851	L	90.6	Very high	89.7	Confident	2 Å²	2	52.9 Å²	52.9	1%	0.01	26%	0.264	C	S	.	.	H	α-helix	trans	-83.5	-38.1	-178.6	-66.3	179.1	0	0	0	114.1	T631 M679 A803 V804 T847 V849 K855	T631-L851 HydrophobicContact CG2-CD1 3.8Å; M679-L851 HydrophobicContact CG-CD1 4.49Å; M679-L851 HydrophobicContact SD-CD1 4.04Å; A803-L851 HydrophobicContact CB-CD2 4.35Å; V804-L851 HydrophobicContact CB-CD2 4.34Å; V804-L851 HydrophobicContact CG2-CD2 3.67Å; T847-L851 HydrophobicContact CG2-CD1 3.79Å; T847-L851 WeakPolarHBondContact O-CB 3.36Å; T847-L851 VanDerWaalsContact O-CG 3.26Å; T847-L851 WeakPolarHBondContact O-CG 3.18Å; T847-L851 PolarHBondContact O-N 2.87Å; T847-L851 VanDerWaalsContact O-N 3.09Å; V849-L851 VanDerWaalsContact C-N 3.33Å; V849-L851 PolarHBondContact O-N 2.84Å; L851-K855 WeakPolarHBondContact O-CD 3.43Å; L851-K855 WeakPolarHBondContact O-CE 3.3Å
852	F	91.8	Very high	88.2	Confident	0 Å²	0	60.4 Å²	60.4	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-104.1	-35.8	-170.5	-65.5	-80.8	0	0	0	114.3	C607 N611 N628 A632 L848 K855 M856	C607-F852 HydrophobicContact CB-CB 4.04Å; C607-F852 HydrophobicContact CB-CD1 4.13Å; C607-F852 HydrophobicContact CB-CD2 3.73Å; C607-F852 HydrophobicContact CB-CE2 4.18Å; C607-F852 HydrophobicContact CB-CG 3.7Å; N611-F852 HydrophobicContact CB-CD1 4.16Å; N611-F852 HydrophobicContact CB-CE1 3.69Å; N628-F852 HydrophobicContact CB-CE1 4.08Å; N628-F852 HydrophobicContact CB-CZ 3.88Å; A632-F852 HydrophobicContact CB-CE2 4.13Å; A632-F852 HydrophobicContact CB-CZ 4.07Å; L848-F852 HydrophobicContact CD2-CD2 4.16Å; L848-F852 HydrophobicContact CD2-CE2 3.98Å; L848-F852 WeakPolarHBondContact O-CB 3.4Å; L848-F852 WeakPolarHBondContact O-CD2 3.38Å; L848-F852 PolarHBondContact O-N 2.83Å; F852-K855 WeakPolarHBondContact O-CA 3.03Å; F852-K855 WeakPolarHBondContact O-CB 3.32Å; F852-K855 PolarHBondContact O-N 3.06Å; F852-M856 HydrophobicContact CB-CE 4.11Å; F852-M856 PolarHBondContact O-N 2.93Å
853	V	89.8	Confident	85.8	Confident	64 Å²	64	57.8 Å²	57.8	39%	0.388	30%	0.296	S	S	.	.	H	α-helix	trans	-62.3	-39.9	-177.6	177.1	0	0	0	0	113	V849 K855 M856 R857	V849-V853 HydrophobicContact CB-CG2 4.4Å; V849-V853 HydrophobicContact CG1-CB 4.49Å; V849-V853 HydrophobicContact CG1-CG2 4.11Å; V849-V853 VanDerWaalsContact O-CB 3.28Å; V849-V853 WeakPolarHBondContact O-CB 3.34Å; V849-V853 PolarHBondContact O-N 3.49Å; V853-K855 PolarHBondContact O-N 3.14Å; V853-M856 HydrophobicContact CB-CE 4.44Å; V853-M856 HydrophobicContact CG2-CE 3.82Å; V853-M856 PolarHBondContact O-N 3.31Å; V853-R857 VanDerWaalsContact O-CB 3.3Å; V853-R857 WeakPolarHBondContact O-CB 3.32Å; V853-R857 PolarHBondContact O-N 3.33Å
854	P	88.8	Confident	83.5	Confident	68 Å²	68	66.1 Å²	66.1	44%	0.442	33%	0.333	S	S	.	.	H	α-helix	trans	-62	-27.9	173	-25.4	36.2	0	0	0	113.9	V849 V850 R858	V849-P854 WeakPolarHBondContact O-CD 3.38Å; V850-P854 WeakPolarHBondContact O-CD 3.49Å; V850-P854 WeakPolarHBondContact O-CG 3.36Å; P854-R858 WeakPolarHBondContact O-CB 3.42Å; P854-R858 PolarHBondContact O-N 3.09Å
855	K	86.4	Confident	80.6	Confident	3 Å²	3	75.8 Å²	75.8	1%	0.013	37%	0.369	C	S	.	.	H	α-helix	trans	-78.7	-48.2	177.7	-58.4	178.8	-175.3	179.1	0	110.8	F610 Y619 S623 N628 D800 L851 F852 V853 R858 L859	F610-K855 HydrophobicContact CE1-CB 4.41Å; Y619-K855 HydrophobicContact CE1-CG 4.49Å; S623-K855 PolarHBondContact OG-NZ 3.29Å; N628-K855 PolarHBondContact ND2-NZ 3.39Å; D800-K855 VanDerWaalsContact OD2-CE 3.23Å; D800-K855 WeakPolarHBondContact OD2-CE 3.44Å; D800-K855 IonicContact OD2-NZ 2.7Å; D800-K855 PolarHBondContact OD2-NZ 2.02Å; L851-K855 WeakPolarHBondContact O-CD 3.43Å; L851-K855 WeakPolarHBondContact O-CE 3.3Å; F852-K855 WeakPolarHBondContact O-CA 3.03Å; F852-K855 WeakPolarHBondContact O-CB 3.32Å; F852-K855 PolarHBondContact O-N 3.06Å; V853-K855 PolarHBondContact O-N 3.14Å; K855-R858 PolarHBondContact O-N 2.92Å; K855-L859 WeakPolarHBondContact O-CB 3.48Å; K855-L859 PolarHBondContact O-N 3.46Å
856	M	86.7	Confident	77.8	Confident	36 Å²	36	80 Å²	80	18%	0.177	39%	0.391	C	S	.	.	H	α-helix	trans	-57	-53.8	174.5	-69.1	-173.1	-71.3	0	0	111.1	F610 F852 V853 R858 L859 I860	F610-M856 HydrophobicContact CB-SD 4.48Å; F610-M856 HydrophobicContact CD1-CG 3.54Å; F610-M856 HydrophobicContact CD1-SD 4.34Å; F610-M856 HydrophobicContact CD2-CG 3.86Å; F610-M856 HydrophobicContact CD2-SD 4.4Å; F610-M856 HydrophobicContact CE1-CB 4.38Å; F610-M856 HydrophobicContact CE1-CG 3.52Å; F610-M856 HydrophobicContact CE2-CB 4.39Å; F610-M856 HydrophobicContact CE2-CG 3.83Å; F610-M856 HydrophobicContact CG-CG 3.73Å; F610-M856 HydrophobicContact CG-SD 4.13Å; F610-M856 HydrophobicContact CZ-CB 4.19Å; F610-M856 HydrophobicContact CZ-CG 3.68Å; F852-M856 HydrophobicContact CB-CE 4.11Å; F852-M856 PolarHBondContact O-N 2.93Å; V853-M856 HydrophobicContact CB-CE 4.44Å; V853-M856 HydrophobicContact CG2-CE 3.82Å; V853-M856 PolarHBondContact O-N 3.31Å; M856-R858 PolarHBondContact O-N 2.89Å; M856-L859 PolarHBondContact O-N 2.83Å; M856-I860 WeakPolarHBondContact O-CB 3.05Å; M856-I860 WeakPolarHBondContact O-CD1 3.45Å; M856-I860 VanDerWaalsContact O-CG1 3.27Å; M856-I860 WeakPolarHBondContact O-CG1 3.42Å; M856-I860 PolarHBondContact O-N 2.83Å
857	R	85.3	Confident	75	Confident	181 Å²	181	82.6 Å²	82.6	68%	0.683	41%	0.414	S	S	*	.	H	α-helix	trans	-56.2	-50.3	178.8	-175.4	178.4	179.5	-177.8	1.2	111.7	V853 L859 I860 T861	V853-R857 VanDerWaalsContact O-CB 3.3Å; V853-R857 WeakPolarHBondContact O-CB 3.32Å; V853-R857 PolarHBondContact O-N 3.33Å; R857-L859 VanDerWaalsContact C-N 3.32Å; R857-L859 PolarHBondContact O-N 3.48Å; R857-I860 PolarHBondContact O-N 2.87Å; R857-T861 HydrophobicContact CG-CG2 4.28Å; R857-T861 WeakPolarHBondContact O-CG2 3.45Å; R857-T861 PolarHBondContact O-N 2.95Å; R857-T861 PolarHBondContact O-OG1 2.68Å; R857-T861 VanDerWaalsContact O-OG1 3.06Å
858	R	80.4	Confident	72.2	Confident	113 Å²	113	91 Å²	91	43%	0.426	45%	0.453	S	S	.	.	H	α-helix	trans	-68.1	-28.9	-175.6	-170.2	179.9	-176	159	5.4	113.4	Y619 P854 K855 M856 R862	Y619-R858 VanDerWaalsContact CE2-NH1 3.29Å; Y619-R858 VanDerWaalsContact CZ-CD 3.45Å; Y619-R858 WeakPolarHBondContact OH-CD 3.48Å; Y619-R858 PolarHBondContact OH-NH1 2.97Å; P854-R858 WeakPolarHBondContact O-CB 3.42Å; P854-R858 PolarHBondContact O-N 3.09Å; K855-R858 PolarHBondContact O-N 2.92Å; M856-R858 PolarHBondContact O-N 2.89Å; R858-R862 WeakPolarHBondContact O-CB 3.26Å
859	L	81.6	Confident	69.3	Low	50 Å²	50	98 Å²	98	26%	0.262	49%	0.486	S	S	.	.	H	α-helix	trans	-74.8	-48.1	174.4	-168.9	67	0	0	0	110.7	F610 N614 V617 I620 K855 M856 R857 R862 G863	F610-L859 HydrophobicContact CE2-CD2 3.95Å; F610-L859 HydrophobicContact CZ-CB 4.28Å; F610-L859 HydrophobicContact CZ-CD2 3.65Å; N614-L859 HydrophobicContact CB-CD2 3.92Å; N614-L859 WeakPolarHBondContact OD1-CD2 3.28Å; V617-L859 HydrophobicContact CG1-CD1 4.12Å; V617-L859 HydrophobicContact CG2-CD1 4.45Å; I620-L859 HydrophobicContact CD1-CD2 4.26Å; K855-L859 WeakPolarHBondContact O-CB 3.48Å; K855-L859 PolarHBondContact O-N 3.46Å; M856-L859 PolarHBondContact O-N 2.83Å; R857-L859 VanDerWaalsContact C-N 3.32Å; R857-L859 PolarHBondContact O-N 3.48Å; L859-R862 CarbonylContact O-C 3.55Å; L859-R862 PolarHBondContact O-N 2.85Å; L859-G863 PolarHBondContact O-N 2.91Å
860	I	79.2	Confident	66.5	Low	129 Å²	129	102.5 Å²	102.5	66%	0.662	50%	0.503	S	S	*	.	H	α-helix	trans	-65.4	-43.5	-178	-64.9	165.6	0	0	0	111.3	M856 R857 R862	M856-I860 WeakPolarHBondContact O-CB 3.05Å; M856-I860 WeakPolarHBondContact O-CD1 3.45Å; M856-I860 VanDerWaalsContact O-CG1 3.27Å; M856-I860 WeakPolarHBondContact O-CG1 3.42Å; M856-I860 PolarHBondContact O-N 2.83Å; R857-I860 PolarHBondContact O-N 2.87Å; I860-R862 PolarHBondContact O-N 3.12Å
861	T	74.3	Confident	63.8	Low	101 Å²	101	108.7 Å²	108.7	62%	0.62	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82	16.6	177.6	71.9	0	0	0	0	114	R857	R857-T861 HydrophobicContact CG-CG2 4.28Å; R857-T861 WeakPolarHBondContact O-CG2 3.45Å; R857-T861 PolarHBondContact O-N 2.95Å; R857-T861 PolarHBondContact O-OG1 2.68Å; R857-T861 VanDerWaalsContact O-OG1 3.06Å
862	R	63.9	Low	61.2	Low	169 Å²	169	114.3 Å²	114.3	64%	0.638	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	-138.1	25.5	172.2	-71.2	-170.5	163.5	-145.5	-6.6	112.5	R858 L859 I860 E864	R858-R862 WeakPolarHBondContact O-CB 3.26Å; L859-R862 CarbonylContact O-C 3.55Å; L859-R862 PolarHBondContact O-N 2.85Å; I860-R862 PolarHBondContact O-N 3.12Å; R862-E864 PolarHBondContact O-N 3.11Å
863	G	46.9	Very low	58.7	Low	59 Å²	59	121.8 Å²	121.8	61%	0.608	61%	0.608	S	S	*	*			trans	-57.4	136.1	159.6	0	0	0	0	0	109.5	L859	L859-G863 PolarHBondContact O-N 2.91Å
864	E	45.6	Very low	55.9	Low	193 Å²	193	127.7 Å²	127.7	90%	0.902	63%	0.629	S	S	*	*	S	Bend	trans	58	71.8	174.4	-58.8	-175.7	172.3	0	0	116.5	R862	R862-E864 PolarHBondContact O-N 3.11Å
865	W	35.7	Very low	53.2	Low	208 Å²	208	131.5 Å²	131.5	79%	0.788	65%	0.651	S	S	*	*	S	Bend		-166.5	147.5	129.7	-118.2	71.4	0	0	0	110.4
866	Q	36.8	Very low	50.5	Low	145 Å²	145	134.9 Å²	134.9	68%	0.678	69%	0.687	S	S	*	*			trans	78.9	51.7	-174	-50.3	-168.6	-66.2	0	0	117.7
867	S	36.1	Very low	47.8	Very low	114 Å²	114	138.4 Å²	138.4	80%	0.797	72%	0.715	S	S	*	*	S	Bend	trans	-96.9	-26.4	160.3	46.1	0	0	0	0	114.5
868	E	34.8	Very low	45.7	Very low	177 Å²	177	134.3 Å²	134.3	83%	0.827	71%	0.714	S	S	*	*	S	Bend	trans	-132.9	-9.4	-167.2	-67.5	-175.8	125.2	0	0	116.7
869	Q	34.4	Very low	44.1	Very low	149 Å²	149	135.1 Å²	135.1	70%	0.696	73%	0.732	S	S	*	*	S	Bend	trans	-107.3	34.5	-164	-146.4	179.1	37.7	0	0	116
870	Q	34.4	Very low	42.3	Very low	157 Å²	157	138 Å²	138	73%	0.734	75%	0.748	S	S	*	*	S	Bend	trans	-146.3	17.9	175.2	-147.9	159.1	2	0	0	117.7
871	D	35.6	Very low	40.9	Very low	165 Å²	165	138.9 Å²	138.9	88%	0.882	75%	0.754	S	S	*	*	S	Bend	trans	-94.7	1	169.6	-84.7	-43.4	0	0	0	114
872	T	37.5	Very low	39.9	Very low	119 Å²	119	140.3 Å²	140.3	73%	0.73	76%	0.757	S	S	*	*	S	Bend	trans	-129.5	41.5	-171	50.5	0	0	0	0	115.5
873	L	37.5	Very low	39.5	Very low	157 Å²	157	136.7 Å²	136.7	82%	0.822	75%	0.751	S	S	*	*	S	Bend	trans	-157.1	150	152.8	-139	71.3	0	0	0	114.5
874	K	32.8	Very low	40.1	Very low	188 Å²	188	139.6 Å²	139.6	82%	0.817	75%	0.748	S	S	*	*			trans	74.4	64	170.2	-57	-168.3	177.8	-172.6	0	117.9
875	T	31.1	Very low	40.8	Very low	148 Å²	148	137.3 Å²	137.3	91%	0.908	74%	0.738	S	S	*	*				-62.4	147	124	42.8	0	0	0	0	109.6
876	G	29.8	Very low	42.2	Very low	75 Å²	75	134.4 Å²	134.4	77%	0.773	73%	0.731	S	S	*	*			trans	118.4	89.9	167.7	0	0	0	0	0	117.4
877	S	29.9	Very low	43.4	Very low	109 Å²	109	130.6 Å²	130.6	76%	0.762	72%	0.72	S	S	*	*			trans	44.7	129.3	136.9	-155.7	0	0	0	0	123.6
878	S	41.5	Very low	45.1	Very low	95 Å²	95	132.1 Å²	132.1	66%	0.664	71%	0.708	S	S	*	*			trans	73.6	146	136.6	51.9	0	0	0	0	122.7
879	T	46.2	Very low	46.9	Very low	130 Å²	130	129 Å²	129	80%	0.798	69%	0.694	S	S	*	*			trans	52.2	108	164.8	52.1	0	0	0	0	118.2
880	N	44.8	Very low	48.8	Very low	112 Å²	112	126.8 Å²	126.8	60%	0.599	69%	0.686	S	S	*	*			trans	-154.4	55.6	157.1	-132.7	38.4	0	0	0	115.1	D883	N880-D883 PolarHBondContact ND2-OD2 3.36Å; N880-D883 PolarHBondContact OD1-OD2 3.31Å
881	N	49.9	Very low	50.7	Low	146 Å²	146	124.6 Å²	124.6	78%	0.781	68%	0.676	S	S	*	*	S	Bend	trans	-83.2	-27.5	171.6	-75.6	13.5	0	0	0	113.2
882	N	52.4	Low	52.8	Low	131 Å²	131	125.1 Å²	125.1	70%	0.701	67%	0.666	S	S	*	*	H	α-helix	trans	-72.3	-33.7	-172.5	-74.4	8.8	0	0	0	113.9	E884 E885 K886	N882-E884 PolarHBondContact O-N 3.23Å; N882-E885 PolarHBondContact O-N 3.5Å; N882-K886 WeakPolarHBondContact O-CB 3.47Å; N882-K886 PolarHBondContact O-N 3.04Å
883	D	56.4	Low	54.9	Low	94 Å²	94	123.4 Å²	123.4	50%	0.503	65%	0.649	S	S	.	*	H	α-helix	trans	-67.2	-37.8	-174.6	-76	-8.5	0	0	0	112.5	N880 S887	N880-D883 PolarHBondContact ND2-OD2 3.36Å; N880-D883 PolarHBondContact OD1-OD2 3.31Å; D883-S887 WeakPolarHBondContact O-CB 3.45Å; D883-S887 PolarHBondContact O-N 2.95Å
884	E	58	Low	56.7	Low	119 Å²	119	120.6 Å²	120.6	56%	0.556	64%	0.635	S	S	*	*	H	α-helix	trans	-70.7	-36.1	-178.7	-154.8	-172.8	159	0	0	111.7	N882 R888	N882-E884 PolarHBondContact O-N 3.23Å; E884-R888 WeakPolarHBondContact O-CD 3.47Å; E884-R888 WeakPolarHBondContact O-CG 3.27Å; E884-R888 PolarHBondContact O-N 2.95Å; E884-R888 VanDerWaalsContact O-N 3.13Å; E884-R888 IonicContact OE1-CZ 3.78Å; E884-R888 IonicContact OE1-NE 3.74Å; E884-R888 IonicContact OE1-NH2 2.81Å; E884-R888 PolarHBondContact OE1-NH2 3.01Å
885	E	60.3	Low	59	Low	146 Å²	146	118.2 Å²	118.2	68%	0.682	62%	0.621	S	S	*	*	H	α-helix	trans	-71.3	-41.8	176	-169.4	148.8	-125.3	0	0	111.7	N882 S887 R888 Q889	N882-E885 PolarHBondContact O-N 3.5Å; E885-S887 VanDerWaalsContact C-N 3.34Å; E885-S887 PolarHBondContact O-N 2.81Å; E885-R888 PolarHBondContact O-N 3Å; E885-Q889 PolarHBondContact O-N 3.28Å
886	K	64.8	Low	61.5	Low	147 Å²	147	117.3 Å²	117.3	64%	0.639	61%	0.606	S	S	*	*	H	α-helix	trans	-63.1	-38	175.6	-163.1	173.1	-173.2	178.1	0	112.5	N882 Q889 L890	N882-K886 WeakPolarHBondContact O-CB 3.47Å; N882-K886 PolarHBondContact O-N 3.04Å; K886-Q889 PolarHBondContact O-N 2.86Å; K886-L890 WeakPolarHBondContact O-CG 3.43Å; K886-L890 PolarHBondContact O-N 3.29Å; K886-L890 VanDerWaalsContact O-N 3.14Å
887	S	63.7	Low	63.9	Low	65 Å²	65	118.3 Å²	118.3	46%	0.455	59%	0.594	S	S	.	*	H	α-helix	trans	-63.3	-44	172.5	177.9	0	0	0	0	112.1	D883 E885 Q889 L890 E891	D883-S887 WeakPolarHBondContact O-CB 3.45Å; D883-S887 PolarHBondContact O-N 2.95Å; E885-S887 VanDerWaalsContact C-N 3.34Å; E885-S887 PolarHBondContact O-N 2.81Å; S887-Q889 VanDerWaalsContact C-N 3.33Å; S887-Q889 PolarHBondContact O-N 3.44Å; S887-L890 PolarHBondContact O-N 3.34Å; S887-E891 PolarHBondContact O-N 2.04Å
888	R	71	Confident	66.1	Low	145 Å²	145	118.6 Å²	118.6	55%	0.547	58%	0.583	S	S	.	*	H	α-helix	trans	-66.9	-29.8	177.4	-69.8	166	-177.6	-155.8	4.3	113.3	E884 E885 R892	E884-R888 WeakPolarHBondContact O-CD 3.47Å; E884-R888 WeakPolarHBondContact O-CG 3.27Å; E884-R888 PolarHBondContact O-N 2.95Å; E884-R888 VanDerWaalsContact O-N 3.13Å; E884-R888 IonicContact OE1-CZ 3.78Å; E884-R888 IonicContact OE1-NE 3.74Å; E884-R888 IonicContact OE1-NH2 2.81Å; E884-R888 PolarHBondContact OE1-NH2 3.01Å; E885-R888 PolarHBondContact O-N 3Å; R888-R892 PolarHBondContact O-N 3.47Å
889	Q	72.7	Confident	68.2	Low	112 Å²	112	121.7 Å²	121.7	52%	0.523	58%	0.584	S	S	.	*	H	α-helix	trans	-70	-48.7	173	-179.4	169.2	-18.7	0	0	111.5	E885 K886 S887 E891 R892 E893	E885-Q889 PolarHBondContact O-N 3.28Å; K886-Q889 PolarHBondContact O-N 2.86Å; S887-Q889 VanDerWaalsContact C-N 3.33Å; S887-Q889 PolarHBondContact O-N 3.44Å; Q889-E891 PolarHBondContact O-N 2.77Å; Q889-R892 WeakPolarHBondContact O-CB 3.27Å; Q889-R892 PolarHBondContact O-N 3.43Å; Q889-E893 WeakPolarHBondContact CG-OE1 3.37Å; Q889-E893 PolarHBondContact NE2-OE1 2.92Å; Q889-E893 PolarHBondContact O-N 3.3Å
890	L	75.2	Confident	70	Confident	103 Å²	103	119.5 Å²	119.5	54%	0.539	57%	0.567	S	S	.	*	H	α-helix	trans	-57.8	-36.5	175.4	-72.3	166.4	0	0	0	112.1	K886 S887 R892 N894	K886-L890 WeakPolarHBondContact O-CG 3.43Å; K886-L890 PolarHBondContact O-N 3.29Å; K886-L890 VanDerWaalsContact O-N 3.14Å; S887-L890 PolarHBondContact O-N 3.34Å; L890-R892 PolarHBondContact O-N 3.03Å; L890-N894 VanDerWaalsContact O-CB 3.24Å; L890-N894 WeakPolarHBondContact O-CB 3.45Å; L890-N894 PolarHBondContact O-N 2.91Å
891	E	73.3	Confident	71.8	Confident	110 Å²	110	118.7 Å²	118.7	51%	0.514	56%	0.562	S	S	.	*	H	α-helix	trans	-65.9	-18.9	173.8	-97.9	-160	-151.4	0	0	115.1	S887 Q889 R895	S887-E891 PolarHBondContact O-N 2.04Å; Q889-E891 PolarHBondContact O-N 2.77Å; E891-R895 PolarHBondContact O-NE 2.85Å; E891-R895 PolarHBondContact O-NH2 2.85Å; E891-R895 IonicContact OE2-CZ 3.53Å; E891-R895 IonicContact OE2-NH2 3.44Å; E891-R895 PolarHBondContact OE2-NH2 3.09Å
892	R	80.6	Confident	73.3	Confident	177 Å²	177	117.6 Å²	117.6	67%	0.668	55%	0.552	S	S	*	*	H	α-helix	trans	-88.1	-51	172.9	-68.8	176.4	-174.8	170.6	3	110.5	R888 Q889 L890 N894 R895 E896	R888-R892 PolarHBondContact O-N 3.47Å; Q889-R892 WeakPolarHBondContact O-CB 3.27Å; Q889-R892 PolarHBondContact O-N 3.43Å; L890-R892 PolarHBondContact O-N 3.03Å; R892-N894 VanDerWaalsContact C-N 3.26Å; R892-N894 PolarHBondContact O-N 2.83Å; R892-R895 WeakPolarHBondContact O-CA 3.44Å; R892-R895 PolarHBondContact O-N 3.49Å; R892-E896 PolarHBondContact O-N 3.36Å
893	E	81.6	Confident	74.9	Confident	83 Å²	83	115.1 Å²	115.1	39%	0.388	54%	0.536	S	S	.	.	H	α-helix	trans	-55.4	-42.5	178.5	-69.6	170.9	-171.3	0	0	111.2	Q889 R895 E896 L897	Q889-E893 WeakPolarHBondContact CG-OE1 3.37Å; Q889-E893 PolarHBondContact NE2-OE1 2.92Å; Q889-E893 PolarHBondContact O-N 3.3Å; E893-R895 VanDerWaalsContact C-N 3.35Å; E893-R895 PolarHBondContact O-N 2.7Å; E893-E896 PolarHBondContact O-N 2.89Å; E893-L897 WeakPolarHBondContact O-CB 3.48Å; E893-L897 VanDerWaalsContact O-CG 3.28Å; E893-L897 WeakPolarHBondContact O-CG 3.47Å; E893-L897 PolarHBondContact O-N 2.88Å
894	N	74.7	Confident	76.2	Confident	97 Å²	97	116 Å²	116	52%	0.519	54%	0.536	S	S	.	.	H	α-helix	trans	-67.1	-32.4	177.3	-155.3	-11.6	0	0	0	112.8	L890 R892 Q898	L890-N894 VanDerWaalsContact O-CB 3.24Å; L890-N894 WeakPolarHBondContact O-CB 3.45Å; L890-N894 PolarHBondContact O-N 2.91Å; R892-N894 VanDerWaalsContact C-N 3.26Å; R892-N894 PolarHBondContact O-N 2.83Å; N894-Q898 WeakPolarHBondContact O-CB 3.43Å; N894-Q898 VanDerWaalsContact O-CG 3.31Å; N894-Q898 WeakPolarHBondContact O-CG 3.5Å; N894-Q898 PolarHBondContact O-N 2.76Å
895	R	80.7	Confident	77.4	Confident	139 Å²	139	116.6 Å²	116.6	53%	0.525	54%	0.538	S	S	.	.	H	α-helix	trans	-74.8	-31.6	174.2	-90.2	-178.1	-85.1	-147.4	-11.3	113.2	E891 R892 E893 K899	E891-R895 PolarHBondContact O-NE 2.85Å; E891-R895 PolarHBondContact O-NH2 2.85Å; E891-R895 IonicContact OE2-CZ 3.53Å; E891-R895 IonicContact OE2-NH2 3.44Å; E891-R895 PolarHBondContact OE2-NH2 3.09Å; R892-R895 WeakPolarHBondContact O-CA 3.44Å; R892-R895 PolarHBondContact O-N 3.49Å; E893-R895 VanDerWaalsContact C-N 3.35Å; E893-R895 PolarHBondContact O-N 2.7Å; R895-K899 PolarHBondContact O-N 3.42Å
896	E	83.8	Confident	78.5	Confident	128 Å²	128	115.5 Å²	115.5	60%	0.598	53%	0.533	S	S	*	.	H	α-helix	trans	-73.7	-41.4	172	-68.1	-171.6	154.2	0	0	111.3	R892 E893 Q898 K899 I900	R892-E896 PolarHBondContact O-N 3.36Å; E893-E896 PolarHBondContact O-N 2.89Å; E896-Q898 VanDerWaalsContact C-N 3.34Å; E896-Q898 PolarHBondContact O-N 3.2Å; E896-K899 PolarHBondContact O-N 2.76Å; E896-I900 VanDerWaalsContact O-CG1 3.31Å; E896-I900 WeakPolarHBondContact O-CG1 3.47Å; E896-I900 PolarHBondContact O-N 3.14Å
897	L	81.3	Confident	79.3	Confident	97 Å²	97	115.3 Å²	115.3	51%	0.508	53%	0.528	S	S	.	.	H	α-helix	trans	-58.7	-42	171.3	-74.1	168.4	0	0	0	112	E893 K899 I900 I901	E893-L897 WeakPolarHBondContact O-CB 3.48Å; E893-L897 VanDerWaalsContact O-CG 3.28Å; E893-L897 WeakPolarHBondContact O-CG 3.47Å; E893-L897 PolarHBondContact O-N 2.88Å; L897-K899 PolarHBondContact O-N 3.38Å; L897-I900 PolarHBondContact O-N 2.8Å; L897-I901 WeakPolarHBondContact O-CB 3.44Å; L897-I901 WeakPolarHBondContact O-CD1 3.33Å; L897-I901 VanDerWaalsContact O-CG1 3.23Å; L897-I901 WeakPolarHBondContact O-CG1 3.31Å; L897-I901 PolarHBondContact O-N 2.93Å
898	Q	76.3	Confident	80.1	Confident	115 Å²	115	115.6 Å²	115.6	54%	0.537	53%	0.527	S	S	.	.	H	α-helix	trans	-61.1	-42.5	173.9	-79.9	177.7	-13	0	0	112.8	N894 E896 I901 Q902	N894-Q898 WeakPolarHBondContact O-CB 3.43Å; N894-Q898 VanDerWaalsContact O-CG 3.31Å; N894-Q898 WeakPolarHBondContact O-CG 3.5Å; N894-Q898 PolarHBondContact O-N 2.76Å; E896-Q898 VanDerWaalsContact C-N 3.34Å; E896-Q898 PolarHBondContact O-N 3.2Å; Q898-I901 PolarHBondContact O-N 3.15Å; Q898-Q902 PolarHBondContact O-N 3.43Å
899	K	84.2	Confident	80.4	Confident	160 Å²	160	111.5 Å²	111.5	70%	0.696	52%	0.521	S	S	*	.	H	α-helix	trans	-62.5	-43.6	173.7	-75.4	-179	175.8	-177.3	0	112.1	R895 E896 L897 Q902 E903	R895-K899 PolarHBondContact O-N 3.42Å; E896-K899 PolarHBondContact O-N 2.76Å; L897-K899 PolarHBondContact O-N 3.38Å; K899-Q902 PolarHBondContact O-N 3.3Å; K899-E903 WeakPolarHBondContact O-CB 3.4Å; K899-E903 PolarHBondContact O-N 2.8Å
900	I	85.4	Confident	80.7	Confident	84 Å²	84	108.5 Å²	108.5	43%	0.431	52%	0.515	S	S	.	.	H	α-helix	trans	-63.2	-44.2	177.7	-67.3	163.7	0	0	0	110	E896 L897 Q902 E903 K904	E896-I900 VanDerWaalsContact O-CG1 3.31Å; E896-I900 WeakPolarHBondContact O-CG1 3.47Å; E896-I900 PolarHBondContact O-N 3.14Å; L897-I900 PolarHBondContact O-N 2.8Å; I900-Q902 PolarHBondContact O-N 3.36Å; I900-E903 PolarHBondContact O-N 3.44Å; I900-K904 HydrophobicContact CG2-CG 4.31Å; I900-K904 VanDerWaalsContact O-CG 3.22Å; I900-K904 WeakPolarHBondContact O-CG 3.49Å; I900-K904 PolarHBondContact O-N 3.3Å
901	I	80.9	Confident	80.9	Confident	95 Å²	95	108.4 Å²	108.4	49%	0.487	52%	0.515	S	S	.	.	H	α-helix	trans	-57.4	-49.8	175.5	-71.8	162.6	0	0	0	110.2	L897 Q898 E903 K904 E905	L897-I901 WeakPolarHBondContact O-CB 3.44Å; L897-I901 WeakPolarHBondContact O-CD1 3.33Å; L897-I901 VanDerWaalsContact O-CG1 3.23Å; L897-I901 WeakPolarHBondContact O-CG1 3.31Å; L897-I901 PolarHBondContact O-N 2.93Å; Q898-I901 PolarHBondContact O-N 3.15Å; I901-E903 PolarHBondContact O-N 2.88Å; I901-K904 CarbonylContact O-C 3.49Å; I901-K904 PolarHBondContact O-N 3.4Å; I901-K904 VanDerWaalsContact O-N 3.1Å; I901-E905 HydrophobicContact CG2-CG 4.4Å; I901-E905 WeakPolarHBondContact O-CG 3.4Å; I901-E905 PolarHBondContact O-N 3.37Å
902	Q	82.3	Confident	81	Confident	122 Å²	122	111.6 Å²	111.6	57%	0.57	52%	0.522	S	S	*	.	H	α-helix	trans	-63.1	-40.5	-179.4	-168.5	168.2	-6.1	0	0	112.4	Q898 K899 I900 K904 E905 E906	Q898-Q902 PolarHBondContact O-N 3.43Å; K899-Q902 PolarHBondContact O-N 3.3Å; I900-Q902 PolarHBondContact O-N 3.36Å; Q902-K904 VanDerWaalsContact C-N 3.33Å; Q902-K904 PolarHBondContact O-N 3.37Å; Q902-E905 PolarHBondContact O-N 3.03Å; Q902-E906 PolarHBondContact O-N 2.8Å
903	E	86.4	Confident	80.8	Confident	80 Å²	80	108.2 Å²	108.2	37%	0.374	52%	0.517	S	S	.	.	H	α-helix	trans	-64.9	-35	173.9	-159.4	-143.6	142.2	0	0	112.3	K899 I900 I901 R907	K899-E903 WeakPolarHBondContact O-CB 3.4Å; K899-E903 PolarHBondContact O-N 2.8Å; I900-E903 PolarHBondContact O-N 3.44Å; I901-E903 PolarHBondContact O-N 2.88Å; E903-R907 VanDerWaalsContact O-CG 3.3Å; E903-R907 WeakPolarHBondContact O-CG 3.46Å; E903-R907 PolarHBondContact O-N 3.08Å; E903-R907 VanDerWaalsContact O-N 3.08Å; E903-R907 IonicContact OE1-CZ 3.91Å; E903-R907 IonicContact OE1-NE 2.62Å; E903-R907 PolarHBondContact OE1-NE 3.24Å; E903-R907 IonicContact OE1-NH2 2.83Å; E903-R907 PolarHBondContact OE1-NH2 2.86Å
904	K	83.9	Confident	80.5	Confident	113 Å²	113	109.5 Å²	109.5	49%	0.491	52%	0.523	S	S	.	.	H	α-helix	trans	-71.3	-36.9	173.3	-64.8	-61.8	176	-171.7	0	111.6	I900 I901 Q902 R907 V908	I900-K904 HydrophobicContact CG2-CG 4.31Å; I900-K904 VanDerWaalsContact O-CG 3.22Å; I900-K904 WeakPolarHBondContact O-CG 3.49Å; I900-K904 PolarHBondContact O-N 3.3Å; I901-K904 CarbonylContact O-C 3.49Å; I901-K904 PolarHBondContact O-N 3.4Å; I901-K904 VanDerWaalsContact O-N 3.1Å; Q902-K904 VanDerWaalsContact C-N 3.33Å; Q902-K904 PolarHBondContact O-N 3.37Å; K904-R907 PolarHBondContact O-N 3.07Å; K904-V908 WeakPolarHBondContact O-CB 3.3Å; K904-V908 VanDerWaalsContact O-CG2 3.24Å; K904-V908 WeakPolarHBondContact O-CG2 3.44Å; K904-V908 PolarHBondContact O-N 3.35Å
905	E	82.1	Confident	80.4	Confident	130 Å²	130	109.7 Å²	109.7	61%	0.607	52%	0.524	S	S	*	.	H	α-helix	trans	-66.4	-39.3	175.3	-73.8	-171.5	142.3	0	0	112.1	I901 Q902 V908 S909	I901-E905 HydrophobicContact CG2-CG 4.4Å; I901-E905 WeakPolarHBondContact O-CG 3.4Å; I901-E905 PolarHBondContact O-N 3.37Å; Q902-E905 PolarHBondContact O-N 3.03Å; E905-V908 PolarHBondContact O-N 2.65Å; E905-S909 WeakPolarHBondContact O-CB 3.31Å; E905-S909 PolarHBondContact O-N 2.69Å; E905-S909 PolarHBondContact O-OG 3.45Å
906	E	84.1	Confident	79.8	Confident	124 Å²	124	105.5 Å²	105.5	58%	0.579	52%	0.519	S	S	*	.	H	α-helix	trans	-63.1	-44.2	171	-73.6	-175.8	167.2	0	0	112	Q902 V908 S909 A910	Q902-E906 PolarHBondContact O-N 2.8Å; E906-V908 VanDerWaalsContact C-N 3.32Å; E906-V908 PolarHBondContact O-N 3.28Å; E906-S909 PolarHBondContact O-N 3.18Å; E906-S909 PolarHBondContact O-OG 3.47Å; E906-A910 WeakPolarHBondContact O-CB 3.29Å; E906-A910 PolarHBondContact O-N 3.49Å
907	R	81.5	Confident	79.2	Confident	142 Å²	142	105.7 Å²	105.7	54%	0.536	52%	0.52	S	S	.	.	H	α-helix	trans	-63.6	-36.3	173.6	-70.8	173.2	-175.8	-117.3	9.9	112.3	E903 K904 L911	E903-R907 VanDerWaalsContact O-CG 3.3Å; E903-R907 WeakPolarHBondContact O-CG 3.46Å; E903-R907 PolarHBondContact O-N 3.08Å; E903-R907 VanDerWaalsContact O-N 3.08Å; E903-R907 IonicContact OE1-CZ 3.91Å; E903-R907 IonicContact OE1-NE 2.62Å; E903-R907 PolarHBondContact OE1-NE 3.24Å; E903-R907 IonicContact OE1-NH2 2.83Å; E903-R907 PolarHBondContact OE1-NH2 2.86Å; K904-R907 PolarHBondContact O-N 3.07Å; R907-L911 WeakPolarHBondContact O-CB 3.36Å; R907-L911 VanDerWaalsContact O-CG 3.29Å; R907-L911 WeakPolarHBondContact O-CG 3.25Å; R907-L911 PolarHBondContact O-N 3.41Å
908	V	81.3	Confident	78.3	Confident	72 Å²	72	110.1 Å²	110.1	44%	0.436	53%	0.53	S	S	.	.	H	α-helix	trans	-71.6	-36.3	176.8	165	0	0	0	0	111.8	K904 E905 E906 R912	K904-V908 WeakPolarHBondContact O-CB 3.3Å; K904-V908 VanDerWaalsContact O-CG2 3.24Å; K904-V908 WeakPolarHBondContact O-CG2 3.44Å; K904-V908 PolarHBondContact O-N 3.35Å; E905-V908 PolarHBondContact O-N 2.65Å; E906-V908 VanDerWaalsContact C-N 3.32Å; E906-V908 PolarHBondContact O-N 3.28Å; V908-R912 WeakPolarHBondContact O-CB 3.33Å; V908-R912 WeakPolarHBondContact O-CG 3.38Å; V908-R912 PolarHBondContact O-N 2.71Å
909	S	76.3	Confident	77.6	Confident	59 Å²	59	110.5 Å²	110.5	41%	0.413	53%	0.531	S	S	.	.	H	α-helix	trans	-69.9	-41	175.2	74.3	0	0	0	0	111.4	E905 E906 L911 R912 N913	E905-S909 WeakPolarHBondContact O-CB 3.31Å; E905-S909 PolarHBondContact O-N 2.69Å; E905-S909 PolarHBondContact O-OG 3.45Å; E906-S909 PolarHBondContact O-N 3.18Å; E906-S909 PolarHBondContact O-OG 3.47Å; S909-L911 PolarHBondContact O-N 2.74Å; S909-R912 PolarHBondContact O-N 3.27Å; S909-N913 PolarHBondContact O-N 2.95Å
910	A	78.7	Confident	76.2	Confident	49 Å²	49	106.5 Å²	106.5	41%	0.405	53%	0.528	S	S	.	.	H	α-helix	trans	-59.6	-45.5	171.8	0	0	0	0	0	112.3	E906 N913 Q914	E906-A910 WeakPolarHBondContact O-CB 3.29Å; E906-A910 PolarHBondContact O-N 3.49Å; A910-N913 PolarHBondContact O-N 2.87Å; A910-Q914 PolarHBondContact O-N 3.4Å
911	L	78.9	Confident	74.9	Confident	100 Å²	100	109 Å²	109	52%	0.524	54%	0.541	S	S	.	.	H	α-helix	trans	-66.1	-36.2	175.5	-75.8	167.9	0	0	0	112.7	R907 S909 Q914 L915	R907-L911 WeakPolarHBondContact O-CB 3.36Å; R907-L911 VanDerWaalsContact O-CG 3.29Å; R907-L911 WeakPolarHBondContact O-CG 3.25Å; R907-L911 PolarHBondContact O-N 3.41Å; S909-L911 PolarHBondContact O-N 2.74Å; L911-Q914 PolarHBondContact O-N 3.33Å; L911-L915 WeakPolarHBondContact O-CB 3.29Å; L911-L915 WeakPolarHBondContact O-CG 3.33Å; L911-L915 PolarHBondContact O-N 3.03Å
912	R	76.7	Confident	73.5	Confident	178 Å²	178	114.4 Å²	114.4	67%	0.672	56%	0.555	S	S	*	*	H	α-helix	trans	-63.1	-41.1	172.2	-85.6	179.9	167.4	172.5	-2.5	111.9	V908 S909 L915 A916	V908-R912 WeakPolarHBondContact O-CB 3.33Å; V908-R912 WeakPolarHBondContact O-CG 3.38Å; V908-R912 PolarHBondContact O-N 2.71Å; S909-R912 PolarHBondContact O-N 3.27Å; R912-L915 PolarHBondContact O-N 3.4Å; R912-A916 WeakPolarHBondContact O-CB 3.37Å; R912-A916 PolarHBondContact O-N 2.89Å
913	N	75.3	Confident	71.9	Confident	106 Å²	106	115.5 Å²	115.5	57%	0.567	57%	0.565	S	S	*	*	H	α-helix	trans	-66.4	-43.9	177.3	-69	-10.5	0	0	0	111.4	S909 A910 L915 A916 E917	S909-N913 PolarHBondContact O-N 2.95Å; A910-N913 PolarHBondContact O-N 2.87Å; N913-L915 VanDerWaalsContact C-N 3.29Å; N913-L915 PolarHBondContact O-N 3.09Å; N913-A916 WeakPolarHBondContact O-CB 3.42Å; N913-A916 PolarHBondContact O-N 2.93Å; N913-A916 VanDerWaalsContact O-N 3.13Å; N913-E917 PolarHBondContact O-N 3.09Å
914	Q	76.5	Confident	70.1	Confident	110 Å²	110	122.7 Å²	122.7	51%	0.514	59%	0.589	S	S	.	*	H	α-helix	trans	-63.5	-32.6	173.5	-71	-176.9	-7.4	0	0	113.1	A910 L911 R918	A910-Q914 PolarHBondContact O-N 3.4Å; L911-Q914 PolarHBondContact O-N 3.33Å; Q914-R918 WeakPolarHBondContact O-CB 3.4Å; Q914-R918 VanDerWaalsContact O-CG 3.31Å; Q914-R918 WeakPolarHBondContact O-CG 3.39Å; Q914-R918 PolarHBondContact O-N 3.09Å; Q914-R918 VanDerWaalsContact O-N 3.12Å
915	L	72.1	Confident	67.9	Low	101 Å²	101	128 Å²	128	53%	0.529	61%	0.605	S	S	.	*	H	α-helix	trans	-69.7	-40	171.6	-81.4	164.4	0	0	0	111.9	L911 R912 N913 R918 Q919	L911-L915 WeakPolarHBondContact O-CB 3.29Å; L911-L915 WeakPolarHBondContact O-CG 3.33Å; L911-L915 PolarHBondContact O-N 3.03Å; R912-L915 PolarHBondContact O-N 3.4Å; N913-L915 VanDerWaalsContact C-N 3.29Å; N913-L915 PolarHBondContact O-N 3.09Å; L915-R918 CarbonylContact O-C 3.51Å; L915-R918 PolarHBondContact O-N 3.4Å; L915-Q919 WeakPolarHBondContact O-CB 3.47Å; L915-Q919 WeakPolarHBondContact O-CG 3.47Å; L915-Q919 PolarHBondContact O-N 3.36Å
916	A	68.3	Low	65.7	Low	51 Å²	51	130.5 Å²	130.5	42%	0.421	62%	0.617	S	S	.	*	H	α-helix	trans	-64.1	-44	176.6	0	0	0	0	0	111.9	R912 N913 Q919 A920	R912-A916 WeakPolarHBondContact O-CB 3.37Å; R912-A916 PolarHBondContact O-N 2.89Å; N913-A916 WeakPolarHBondContact O-CB 3.42Å; N913-A916 PolarHBondContact O-N 2.93Å; N913-A916 VanDerWaalsContact O-N 3.13Å; A916-Q919 PolarHBondContact O-N 3.43Å; A916-A920 WeakPolarHBondContact O-CB 3.3Å; A916-A920 PolarHBondContact O-N 3.3Å
917	E	70.3	Confident	63.8	Low	132 Å²	132	129.5 Å²	129.5	62%	0.617	62%	0.622	S	S	*	*	H	α-helix	trans	-60.1	-45.3	172.3	-70.9	-175.3	123.6	0	0	111.6	N913 Q919 A920 I921	N913-E917 PolarHBondContact O-N 3.09Å; E917-Q919 VanDerWaalsContact C-N 3.3Å; E917-Q919 PolarHBondContact O-N 3.3Å; E917-A920 PolarHBondContact O-N 2.74Å; E917-I921 WeakPolarHBondContact O-CG1 3.37Å; E917-I921 PolarHBondContact O-N 3.26Å
918	R	63.5	Low	61.5	Low	190 Å²	190	128.7 Å²	128.7	72%	0.717	63%	0.633	S	S	*	*	H	α-helix	trans	-65.7	-28.9	176.3	-75.7	178.8	172.1	-167.3	-1.9	113.3	Q914 L915 R922	Q914-R918 WeakPolarHBondContact O-CB 3.4Å; Q914-R918 VanDerWaalsContact O-CG 3.31Å; Q914-R918 WeakPolarHBondContact O-CG 3.39Å; Q914-R918 PolarHBondContact O-N 3.09Å; Q914-R918 VanDerWaalsContact O-N 3.12Å; L915-R918 CarbonylContact O-C 3.51Å; L915-R918 PolarHBondContact O-N 3.4Å; R918-R922 WeakPolarHBondContact O-CB 3.47Å; R918-R922 PolarHBondContact O-N 3.47Å
919	Q	60.3	Low	59.2	Low	123 Å²	123	131.3 Å²	131.3	58%	0.575	65%	0.654	S	S	*	*	H	α-helix	trans	-77.1	-39.5	173.3	-76.6	175.5	-41.3	0	0	112.2	L915 A916 E917 I921 R922 N923	L915-Q919 WeakPolarHBondContact O-CB 3.47Å; L915-Q919 WeakPolarHBondContact O-CG 3.47Å; L915-Q919 PolarHBondContact O-N 3.36Å; A916-Q919 PolarHBondContact O-N 3.43Å; E917-Q919 VanDerWaalsContact C-N 3.3Å; E917-Q919 PolarHBondContact O-N 3.3Å; Q919-I921 VanDerWaalsContact C-N 3.28Å; Q919-I921 PolarHBondContact O-N 3.41Å; Q919-R922 PolarHBondContact O-N 2.74Å; Q919-N923 PolarHBondContact O-N 2.71Å; Q919-N923 VanDerWaalsContact O-N 3.09Å
920	A	56.4	Low	57.2	Low	75 Å²	75	131.9 Å²	131.9	62%	0.62	67%	0.669	S	S	*	*	H	α-helix	trans	-60.3	-37.7	173.5	0	0	0	0	0	112.1	A916 E917 R922	A916-A920 WeakPolarHBondContact O-CB 3.3Å; A916-A920 PolarHBondContact O-N 3.3Å; E917-A920 PolarHBondContact O-N 2.74Å; A920-R922 VanDerWaalsContact C-N 3.34Å
921	I	57.4	Low	55.2	Low	136 Å²	136	138.2 Å²	138.2	70%	0.697	69%	0.69	S	S	*	*	H	α-helix	trans	-70.2	-29.4	173.6	-67.8	166.8	0	0	0	111.9	E917 Q919	E917-I921 WeakPolarHBondContact O-CG1 3.37Å; E917-I921 PolarHBondContact O-N 3.26Å; Q919-I921 VanDerWaalsContact C-N 3.28Å; Q919-I921 PolarHBondContact O-N 3.41Å
922	R	50.7	Low	53	Low	210 Å²	210	138.6 Å²	138.6	79%	0.792	69%	0.693	S	S	*	*	H	α-helix	trans	-83.3	-29.5	-175	-162.4	170.2	-172.9	170.4	1.5	114.2	R918 Q919 A920 R924	R918-R922 WeakPolarHBondContact O-CB 3.47Å; R918-R922 PolarHBondContact O-N 3.47Å; Q919-R922 PolarHBondContact O-N 2.74Å; A920-R922 VanDerWaalsContact C-N 3.34Å; R922-R924 PolarHBondContact O-N 2.73Å; R922-R924 VanDerWaalsContact O-N 3.13Å
923	N	49	Very low	51.3	Low	145 Å²	145	137.2 Å²	137.2	78%	0.775	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79	14.5	-176.9	-76	3.1	0	0	0	115	Q919 R925	Q919-N923 PolarHBondContact O-N 2.71Å; Q919-N923 VanDerWaalsContact O-N 3.09Å; N923-R925 PolarHBondContact O-N 3.08Å
924	R	48.2	Very low	49.5	Very low	231 Å²	231	138 Å²	138	87%	0.872	70%	0.698	S	S	*	*			trans	-96	29.6	-177	-140.1	173.9	-170	178.3	3.1	114.3	R922	R922-R924 PolarHBondContact O-N 2.73Å; R922-R924 VanDerWaalsContact O-N 3.13Å
925	R	38.6	Very low	47.7	Very low	223 Å²	223	140 Å²	140	84%	0.842	71%	0.708	S	S	*	*	S	Bend	trans	-140.9	107.9	177.7	-74	-171.3	175.2	-176	-1.9	114.7	N923	N923-R925 PolarHBondContact O-N 3.08Å
926	Q	35.7	Very low	45.8	Very low	184 Å²	184	141.9 Å²	141.9	86%	0.86	72%	0.718	S	S	*	*			trans	73.4	156	144.9	-78.8	178.1	-52.6	0	0	120.6
927	P	44.2	Very low	44.2	Very low	103 Å²	103	143 Å²	143	67%	0.669	73%	0.727	S	S	*	*			trans	-146.5	-171.4	-130.6	42.4	-20.2	0	0	0	119.4
928	T	34.2	Very low	43.1	Very low	125 Å²	125	142.9 Å²	142.9	77%	0.767	74%	0.738	S	S	*	*			trans	82.6	137.4	147.4	36.9	0	0	0	0	124.6
929	S	32	Very low	43.1	Very low	127 Å²	127	139.1 Å²	139.1	89%	0.888	74%	0.738	S	S	*	*			trans	70.1	147.2	156.9	67.1	0	0	0	0	120.6
930	G	34.1	Very low	42.9	Very low	71 Å²	71	138.6 Å²	138.6	73%	0.732	75%	0.745	S	S	*	*			cis	163.6	144.6	-15.1	0	0	0	0	0	116.1
931	Q	35.9	Very low	41.8	Very low	181 Å²	181	139.5 Å²	139.5	85%	0.846	75%	0.753	S	S	*	*			trans	64.7	162.5	162.5	-76.9	-177.7	-12.7	0	0	118.7
932	N	33.9	Very low	40.7	Very low	108 Å²	108	137.7 Å²	137.7	58%	0.578	75%	0.752	S	S	*	*			cis	-156.6	154.2	3.8	-128.3	-4	0	0	0	115.8
933	Q	40	Very low	40	Very low	149 Å²	149	135.8 Å²	135.8	70%	0.696	75%	0.752	S	S	*	*			trans	61.1	124.6	142.2	-74.2	173.4	4.2	0	0	126.5
934	N	37.6	Very low	39.3	Very low	122 Å²	122	134.3 Å²	134.3	65%	0.652	75%	0.749	S	S	*	*			trans	66.8	174.9	136.8	-63.9	26.4	0	0	0	117.9
935	H	39.3	Very low	38.8	Very low	154 Å²	154	130.4 Å²	130.4	71%	0.713	75%	0.745	S	S	*	*			cis	-153	170.6	-0.9	-123.2	-36.7	0	0	0	107.4
936	N	32.5	Very low	39.3	Very low	140 Å²	140	123.9 Å²	123.9	75%	0.749	73%	0.732	S	S	*	*			cis	-155.6	-179.1	-4.8	-162.4	22	0	0	0	110
937	A	35.2	Very low	39	Very low	74 Å²	74	124.4 Å²	124.4	61%	0.612	73%	0.731	S	S	*	*			trans	-145	158.7	173.1	0	0	0	0	0	113.1
938	P	46.2	Very low	38.3	Very low	129 Å²	129	124.1 Å²	124.1	84%	0.838	73%	0.731	S	S	*	*			trans	-132.4	-128.6	145.8	41.5	-24.7	0	0	0	112.1
939	P	63.6	Low	38.2	Very low	112 Å²	112	125 Å²	125	73%	0.727	73%	0.731	S	S	*	*			trans	-128.2	-156	-147.8	43.3	-19.3	0	0	0	112.7
940	P	56.5	Low	38.1	Very low	112 Å²	112	126 Å²	126	73%	0.727	73%	0.725	S	S	*	*			cis	-128.3	172	-14.9	41.1	-26.3	0	0	0	115.3
941	A	33.1	Very low	38.3	Very low	94 Å²	94	127.9 Å²	127.9	78%	0.777	72%	0.724	S	S	*	*			trans	61.8	179.8	160.1	0	0	0	0	0	115.3
942	S	33.5	Very low	39	Very low	97 Å²	97	125.1 Å²	125.1	68%	0.678	72%	0.722	S	S	*	*			cis	-156.2	158.3	-37.9	40	0	0	0	0	107.1
943	Q	37.1	Very low	39.8	Very low	170 Å²	170	126 Å²	126	79%	0.794	73%	0.734	S	S	*	*			cis	-162.2	162.4	-16	-104.1	170.8	-105	0	0	105.7
944	T	34.1	Very low	39.3	Very low	115 Å²	115	122.7 Å²	122.7	71%	0.706	74%	0.74	S	S	*	*			cis	-150.8	126.7	11.1	-13.6	0	0	0	0	110.5
945	D	37.2	Very low	38.9	Very low	149 Å²	149	127.7 Å²	127.7	80%	0.797	75%	0.751	S	S	*	*			trans	62.6	-163.2	141.9	-140.8	30.1	0	0	0	117.2
946	P	48.5	Very low	38.8	Very low	86 Å²	86	125.9 Å²	125.9	56%	0.558	75%	0.753	S	S	*	*				-140.5	156.1	-111.9	44	-26	0	0	0	119.5
947	K	30.8	Very low	38.5	Very low	194 Å²	194	126.1 Å²	126.1	84%	0.843	75%	0.754	S	S	*	*				-179.3	124.7	111.4	-99.1	169.9	-177.8	176.5	0	116.7
948	S	29.8	Very low	39	Very low	97 Å²	97	127.5 Å²	127.5	68%	0.678	76%	0.757	S	S	*	*			trans	-41.2	171	150.8	41.3	0	0	0	0	118
949	L	31.8	Very low	38.2	Very low	145 Å²	145	127.5 Å²	127.5	76%	0.759	76%	0.755	S	S	*	*			cis	-175.5	162.6	-11.5	-102.8	167.7	0	0	0	110.6
950	L	30.2	Very low	36.6	Very low	147 Å²	147	126.1 Å²	126.1	77%	0.77	75%	0.753	S	S	*	*			trans	65.9	177.8	150.5	-68.8	160.6	0	0	0	118.9
951	P	38.3	Very low	35.4	Very low	110 Å²	110	127.7 Å²	127.7	71%	0.714	76%	0.755	S	S	*	*				-129.2	-168.2	-56.2	39.3	-22.8	0	0	0	113.2
952	P	49.8	Very low	35.1	Very low	124 Å²	124	129.7 Å²	129.7	81%	0.805	75%	0.753	S	S	*	*			trans	-104.4	-121.3	-167.7	25.5	-5.9	0	0	0	118.9
953	P	51.6	Low	35	Very low	126 Å²	126	133.6 Å²	133.6	82%	0.818	76%	0.76	S	S	*	*				-121	168.7	-109.3	39.4	-25.6	0	0	0	117.4
954	G	28.2	Very low	34.6	Very low	79 Å²	79	131 Å²	131	81%	0.814	76%	0.761	S	S	*	*			trans	169.9	148.3	163.6	0	0	0	0	0	118.1
955	Y	29.3	Very low	34.9	Very low	228 Å²	228	133.2 Å²	133.2	89%	0.894	77%	0.767	S	S	*	*			trans	-103.5	162.2	161.2	-95.5	-85.7	0	0	0	108
956	P	37.8	Very low	34.7	Very low	116 Å²	116	132.1 Å²	132.1	75%	0.753	77%	0.768	S	S	*	*			cis	-150.9	-172.2	46.1	42.7	-20.1	0	0	0	118.8
957	N	25.5	Very low	34.3	Very low	144 Å²	144	133.5 Å²	133.5	77%	0.77	78%	0.777	S	S	*	*			trans	-25.3	169.3	160.5	-79.9	5.1	0	0	0	120.4
958	P	45.6	Very low	34.2	Very low	104 Å²	104	129.1 Å²	129.1	68%	0.675	77%	0.771	S	S	*	*			cis	-139.1	-169.3	-6.1	27.2	-1.4	0	0	0	115.8
959	T	29.9	Very low	34.1	Very low	128 Å²	128	133.8 Å²	133.8	79%	0.785	78%	0.779	S	S	*	*			trans	106.8	119.3	154.5	67.9	0	0	0	0	120.4
960	A	29.8	Very low	33.8	Very low	84 Å²	84	131.2 Å²	131.2	69%	0.694	77%	0.774	S	S	*	*			trans	28.8	146.8	140	0	0	0	0	0	122.6
961	D	30.8	Very low	33.6	Very low	145 Å²	145	131.2 Å²	131.2	78%	0.775	78%	0.775	S	S	*	*			cis	-167.9	141.4	-16.9	-106.6	-36.9	0	0	0	109.5
962	N	27.5	Very low	33.1	Very low	136 Å²	136	131.3 Å²	131.3	73%	0.727	78%	0.778	S	S	*	*				174.9	138.5	128.7	-99.6	-42.5	0	0	0	115.6
963	H	31	Very low	32.1	Very low	178 Å²	178	130.1 Å²	130.1	82%	0.824	77%	0.772	S	S	*	*			trans	50.5	118.2	158.1	-65	-60.5	0	0	0	121.3
964	S	29.5	Very low	30.9	Very low	116 Å²	116	129.2 Å²	129.2	81%	0.811	77%	0.769	S	S	*	*			trans	-110.7	162.4	-179.1	49.6	0	0	0	0	113.6
965	L	40.3	Very low	30.7	Very low	162 Å²	162	132.8 Å²	132.8	85%	0.848	77%	0.768	S	S	*	*			trans	-91.6	152.6	174.9	-53.5	98.5	0	0	0	112
966	P	33.7	Very low	30.6	Very low	126 Å²	126	132.3 Å²	132.3	82%	0.818	77%	0.767	S	S	*	*			trans	-98.1	131.6	171.3	34.9	-30.4	0	0	0	113.4
967	P	38.4	Very low	30.6	Very low	115 Å²	115	132.4 Å²	132.4	75%	0.747	77%	0.767	S	S	*	*			trans	-111.2	-174.3	166.9	38.9	-32.3	0	0	0	113.5
968	S	28.8	Very low	30.7	Very low	101 Å²	101	129.4 Å²	129.4	71%	0.706	76%	0.762	S	S	*	*			trans	84.6	117.7	153.3	73.2	0	0	0	0	122.5
969	F	28.1	Very low	29.8	Very low	195 Å²	195	131.7 Å²	131.7	86%	0.855	77%	0.769	S	S	*	*				66	100.9	124.7	-78.1	-90.7	0	0	0	124.1
970	S	26.3	Very low	29.6	Very low	92 Å²	92	131.5 Å²	131.5	64%	0.643	77%	0.773	S	S	*	*				73.6	135.5	118.4	68.6	0	0	0	0	125.3
971	N	26.1	Very low	29.4	Very low	147 Å²	147	136.5 Å²	136.5	79%	0.786	78%	0.779	S	S	*	*			trans	91.8	123.9	142.1	-77.9	-0.4	0	0	0	123.6
972	S	28	Very low	29.1	Very low	112 Å²	112	138.2 Å²	138.2	78%	0.783	78%	0.784	S	S	*	*			trans	63	147.6	145.2	49.9	0	0	0	0	120.8
973	S	27.5	Very low	29	Very low	99 Å²	99	136.7 Å²	136.7	69%	0.692	78%	0.784	S	S	*	*			cis	-174.7	162.8	-13.2	48.5	0	0	0	0	111.4
974	S	26.4	Very low	29	Very low	106 Å²	106	138.8 Å²	138.8	74%	0.741	79%	0.785	S	S	*	*			trans	63.2	145	166.3	58.6	0	0	0	0	117.1
975	L	25.5	Very low	28.9	Very low	154 Å²	154	140.8 Å²	140.8	81%	0.806	79%	0.787	S	S	*	*			cis	-143.9	164.8	46.3	-105.2	86.1	0	0	0	114.9
976	Y	26.5	Very low	28.4	Very low	219 Å²	219	141.3 Å²	141.3	86%	0.859	79%	0.785	S	S	*	*			trans	-122.9	152.3	156.8	-97.8	-76.8	0	0	0	107.1
977	P	37.1	Very low	28.1	Very low	118 Å²	118	141.4 Å²	141.4	77%	0.766	79%	0.787	S	S	*	*				-148.9	-160.5	73	35.6	-13.1	0	0	0	113.3
978	A	28	Very low	27.6	Very low	80 Å²	80	143.6 Å²	143.6	66%	0.661	79%	0.786	S	S	*	*				-169.1	163.9	-56.3	0	0	0	0	0	109.3
979	D	26.5	Very low	27.4	Very low	152 Å²	152	145.6 Å²	145.6	81%	0.813	79%	0.789	S	S	*	*			trans	51.8	128.1	161.1	-73.8	-35.2	0	0	0	123.5
980	S	25.9	Very low	27.4	Very low	125 Å²	125	142.1 Å²	142.1	87%	0.874	79%	0.789	S	S	*	*				-166.5	165	127.5	37.1	0	0	0	0	111.5
981	K	26.3	Very low	27.4	Very low	188 Å²	188	146.1 Å²	146.1	82%	0.817	80%	0.798	S	S	*	*			trans	-128.3	169.2	-170.3	-67.3	175.8	178.1	169.1	0	112.4
982	M	24.1	Very low	27.5	Very low	181 Å²	181	146.5 Å²	146.5	89%	0.892	80%	0.798	S	S	*	*			trans	74.9	156.5	168.1	-60.4	162.7	64.2	0	0	114.5
983	S	25.1	Very low	27.9	Very low	104 Å²	104	146.4 Å²	146.4	73%	0.727	80%	0.795	S	S	*	*			cis	-140.5	167.7	12.5	-170.2	0	0	0	0	114
984	R	30.7	Very low	28.3	Very low	222 Å²	222	149.2 Å²	149.2	84%	0.838	80%	0.801	S	S	*	*			trans	-72.6	149.9	157.1	-79	173.9	162.4	162.6	-8	111
985	N	27.3	Very low	28.4	Very low	158 Å²	158	151.4 Å²	151.4	85%	0.845	80%	0.804	S	S	*	*			trans	-179	134.2	135	-83.1	-17.8	0	0	0	106.2
986	H	30.8	Very low	28.5	Very low	174 Å²	174	154.2 Å²	154.2	81%	0.806	81%	0.805	S	S	*	*			cis	72	84.8	35.7	-92.5	53.3	0	0	0	116
987	C	27.1	Very low	28.8	Very low	127 Å²	127	156.8 Å²	156.8	86%	0.858	82%	0.821	S	S	*	*			trans	-159.9	105.9	144	-93.2	0	0	0	0	106.2
988	H	26.9	Very low	28.4	Very low	161 Å²	161	158.7 Å²	158.7	75%	0.745	82%	0.823	S	S	*	*				67.4	116.5	80.2	-102.3	-56.8	0	0	0	117.3
989	N	25.4	Very low	28.4	Very low	143 Å²	143	162.8 Å²	162.8	77%	0.765	83%	0.832	S	S	*	*			trans	33	118.7	148.6	-57.6	8.8	0	0	0	121.1
990	S	28	Very low	28.5	Very low	122 Å²	122	163.4 Å²	163.4	85%	0.853	83%	0.833	S	S	*	*				-144.9	126.3	125.3	52.7	0	0	0	0	111.5
991	Q	26.9	Very low	28.7	Very low	177 Å²	177	165.7 Å²	165.7	83%	0.827	83%	0.831	S	S	*	*			trans	-98	-170.3	160.4	-69.7	178.4	-44	0	0	108.3
992	I	27.6	Very low	28.8	Very low	154 Å²	154	164.3 Å²	164.3	79%	0.79	83%	0.832	S	S	*	*			trans	80.8	130.6	160.4	-54.3	160.8	0	0	0	114.3
993	P	37.4	Very low	29.1	Very low	110 Å²	110	163.2 Å²	163.2	71%	0.714	83%	0.828	S	S	*	*			cis	-140.2	-169.7	-26.7	39.8	-20.8	0	0	0	113.7
994	L	34.3	Very low	29.4	Very low	158 Å²	158	167.4 Å²	167.4	83%	0.827	84%	0.835	S	S	*	*			trans	-73.5	147.5	152.3	-62	98.9	0	0	0	110.6
995	L	28.1	Very low	29.3	Very low	152 Å²	152	163.2 Å²	163.2	80%	0.796	83%	0.834	S	S	*	*			trans	-173.6	116.7	137	-104	147.1	0	0	0	112.8
996	Y	29.1	Very low	29.5	Very low	214 Å²	214	163.7 Å²	163.7	84%	0.839	83%	0.834	S	S	*	*			trans	28.2	129.9	144.6	-78	-106.8	0	0	0	120.8
997	K	32.5	Very low	29.4	Very low	272 Å²	272	162.7 Å²	162.7	100%	1.183	84%	0.836	S	S	*	*				-153.3	0	90.3	-131.2	175.6	-175.9	176.8	0	113.6

Retrieved 997 of 997 residues in 1406.1 ms (Link to these results)

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