A0A087XLH0_POEFO Loading...

Rho GTPase activating protein 9

AlphaFold DB , UniProt , Accession A0A087XLH0, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 899 aa.

						>A0A087XLH0_POEFO|A0A087XLH0
MLSGSWRRSVGPTQPAAAPVVNPSAMTVCGVPSGTVVLEAQYDYSYRGSDGRQVCIREGERFILLKKTNADWWQVRRIGAASKTKPLYVPATYVTEVPITPMPSPQRLVTSVSLHSNMLPRVSLSPSFTGTGRNEQSQVNKPMFRSMENLNTFNSAFQRSERNTVVGENHFPTLPLSGFTFTPSSSTSQSSHLMVPGSPAASMTQANSSNPRVVPTITRSQSSSNLPENLNENPYDEVGGSLGSRINYKVPKKSCSQWDVVGASGRNNRLQVPTEAYISQLSWQDSPIYAEMQPEKRLSQQEPPIPAVGQQPLQIMDLWEQYSDPGTGRCYYVNSITKERSWKPPRRARSRCTNQSPTQQGSPAQAQTLPRDTSHLSLPLSKTGNGTMHRLSPDYVFGSHQRNTDSSWQMKQNIERDVSSDTLSTPALTNTEEQCHNSGSQHGAKQQFSHTQSVILSENGKRRESSSNVTNIIVEPPSPESSPDSDGGTPELEKAGLLNKTKIAEGGRKLRKNWSPSWVVLVGNSLVFFKDPKSQTPSSWKPGNSRPESSVDLRGAKLNWANDLSSKKNVFKLRTITGNEFLLQSDTDSLIREWYNTIKNVIDRLDRENPLENVLQYSLRRAGSVEMLDHSGDEDDRRNSLPRSVSNLENTERKRVKTRLKKLILKRPPLQALQEKGLIKDQVFGCRLEMLCERERSTVPRFVRLCTEAVEKRGLDTDGIYRVSGNLAVIQKLRFLVDHERALTTDGRFMFPADLVQEEKLNLDESEWEDIHVVTGALKLFFRELPEPLVPYGFFTDIVETVKMSDHMDKVDRLKCLVLNMPPPNHDTLEFMCRHLRRVLERCDTNRMTTQNIGIVFGPTLMRPEFDNGNMAVNMIYQNQAVELILSEFDHIFRTRGLS
					

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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	29.6	Very low	25.9	Very low	249 Å²	249	147.6 Å²	147.6	100%	1.227	81%	0.811	S	S	*	*				0	160.3	0	-77	172.2	158.8	0	0	109.1
2	L	29.9	Very low	26.5	Very low	170 Å²	170	145.3 Å²	145.3	89%	0.89	81%	0.809	S	S	*	*			trans	-109.4	-177.5	-178.7	-78.9	167.9	0	0	0	111.3
3	S	24.9	Very low	26.5	Very low	128 Å²	128	143.8 Å²	143.8	90%	0.895	81%	0.805	S	S	*	*			trans	81.1	148.6	-179.2	79.3	0	0	0	0	115.7
4	G	21.8	Very low	26.5	Very low	74 Å²	74	146.3 Å²	146.3	76%	0.763	81%	0.808	S	S	*	*			cis	-143.2	-176	6.9	0	0	0	0	0	115.3
5	S	25.4	Very low	27	Very low	86 Å²	86	144.1 Å²	144.1	60%	0.601	80%	0.803	S	S	*	*			trans	-80.1	179.3	-176.8	60.3	0	0	0	0	112.8
6	W	23	Very low	26.9	Very low	229 Å²	229	141.8 Å²	141.8	87%	0.867	81%	0.808	S	S	*	*				-143.7	138.8	59.8	-71	79.5	0	0	0	110.5
7	R	24.6	Very low	26.8	Very low	185 Å²	185	139.5 Å²	139.5	70%	0.698	81%	0.81	S	S	*	*				58.8	138.7	72.6	-73.4	-141.4	-154.1	-67.6	10.1	115.2
8	R	26.7	Very low	26.9	Very low	195 Å²	195	137.2 Å²	137.2	74%	0.736	81%	0.81	S	S	*	*			cis	-174.1	163.7	-18.3	-162	-154.8	-94.3	-107.1	5	109.2
9	S	26.8	Very low	27.6	Very low	99 Å²	99	136.4 Å²	136.4	69%	0.692	81%	0.81	S	S	*	*			trans	77.5	154.5	147.2	-86.1	0	0	0	0	118.9
10	V	28.3	Very low	27.6	Very low	141 Å²	141	137 Å²	137	86%	0.855	81%	0.814	S	S	*	*			cis	-136.4	150.5	-0.5	-168.8	0	0	0	0	110.6
11	G	24.5	Very low	27.7	Very low	68 Å²	68	136.5 Å²	136.5	70%	0.701	81%	0.812	S	S	*	*			trans	179	128.6	161.4	0	0	0	0	0	112
12	P	32.1	Very low	27.6	Very low	120 Å²	120	132.2 Å²	132.2	78%	0.779	79%	0.794	S	S	*	*			trans	-103.7	133.6	-155.2	0.2	22.4	0	0	0	117.9
13	T	27.2	Very low	27.8	Very low	125 Å²	125	129.9 Å²	129.9	77%	0.767	79%	0.789	S	S	*	*			trans	2.2	137.6	136.5	59.1	0	0	0	0	118.8
14	Q	26.6	Very low	28.1	Very low	179 Å²	179	129.4 Å²	129.4	84%	0.836	79%	0.785	S	S	*	*				-172.1	-179.9	61.8	-104.7	-164.2	19.7	0	0	109.9
15	P	33.3	Very low	28.7	Very low	114 Å²	114	130.1 Å²	130.1	74%	0.74	78%	0.784	S	S	*	*			cis	-131.3	-161.1	-21.5	35.4	-14.3	0	0	0	113.4
16	A	25.2	Very low	29.1	Very low	106 Å²	106	134.8 Å²	134.8	88%	0.876	80%	0.799	S	S	*	*			trans	-47.2	155.9	-174.6	0	0	0	0	0	119.4
17	A	26.3	Very low	29.8	Very low	103 Å²	103	128.2 Å²	128.2	85%	0.851	78%	0.784	S	S	*	*			trans	-139.1	124.7	174.8	0	0	0	0	0	113.5
18	A	28.4	Very low	30.6	Very low	98 Å²	98	122.4 Å²	122.4	81%	0.81	77%	0.769	S	S	*	*			trans	-170.4	158.5	164.6	0	0	0	0	0	109.6
19	P	39.4	Very low	31.5	Very low	123 Å²	123	117.8 Å²	117.8	80%	0.799	77%	0.765	S	S	*	*			cis	-117.4	164	-32.5	38.5	-26.9	0	0	0	111.5
20	V	28.6	Very low	32.7	Very low	147 Å²	147	116.1 Å²	116.1	89%	0.891	76%	0.764	S	S	*	*			trans	-132.7	143.4	170.4	-177.7	0	0	0	0	110.5
21	V	28.3	Very low	33.9	Very low	128 Å²	128	110 Å²	110	78%	0.776	73%	0.727	S	S	*	*			trans	-80	137.5	-169.4	178.7	0	0	0	0	112.3	P23	V21-P23 WeakPolarHBondContact O-CD 3.38Å
22	N	29	Very low	35.3	Very low	159 Å²	159	110.9 Å²	110.9	85%	0.85	72%	0.72	S	S	*	*			trans	-90	114.3	167.4	-85.8	-25.2	0	0	0	111
23	P	32.5	Very low	35.9	Very low	121 Å²	121	111.1 Å²	111.1	79%	0.786	73%	0.725	S	S	*	*	P	Polyproline II helix	trans	-76.9	139.9	162.9	31.8	-32.2	0	0	0	110.6	V21	V21-P23 WeakPolarHBondContact O-CD 3.38Å
24	S	32.8	Very low	37.4	Very low	117 Å²	117	108.9 Å²	108.9	82%	0.818	73%	0.726	S	S	*	*	P	Polyproline II helix	trans	-79.6	146.6	-174.6	41.9	0	0	0	0	113.5	M26	S24-M26 PolarHBondContact O-N 2.76Å
25	A	33	Very low	39.6	Very low	90 Å²	90	101.9 Å²	101.9	74%	0.744	70%	0.696	S	S	*	*	P	Polyproline II helix	trans	-69.1	123.9	173.7	0	0	0	0	0	111.2	T27	A25-T27 PolarHBondContact O-N 3.42Å; A25-T27 PolarHBondContact O-OG1 3.1Å
26	M	34.9	Very low	42	Very low	184 Å²	184	99 Å²	99	91%	0.906	68%	0.677	S	S	*	*	P	Polyproline II helix	trans	-57.9	130.1	174.9	-78.3	-174.1	164.6	0	0	111.2	S24	S24-M26 PolarHBondContact O-N 2.76Å
27	T	38.4	Very low	45	Very low	91 Å²	91	94.5 Å²	94.5	56%	0.558	64%	0.638	S	S	*	*			trans	-123.2	110.9	179.7	-56.3	0	0	0	0	109.2	A25	A25-T27 PolarHBondContact O-N 3.42Å; A25-T27 PolarHBondContact O-OG1 3.1Å
28	V	39.9	Very low	48.1	Very low	62 Å²	62	89.6 Å²	89.6	38%	0.376	60%	0.597	S	S	.	*	B	Isolated β-bridge	trans	-90.3	130.9	175.1	-179.1	0	0	0	0	108.6	G30 V31 P101	V28-G30 PolarHBondContact O-N 3.26Å; V28-V31 PolarHBondContact O-N 2.75Å; V28-P101 HydrophobicContact CG1-CB 4.27Å
29	C	46.2	Very low	51.2	Low	98 Å²	98	87 Å²	87	66%	0.662	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	50.8	26.3	179.3	-61.9	0	0	0	0	116.1	V31	C29-V31 VanDerWaalsContact C-N 3.33Å
30	G	50.9	Low	53.7	Low	65 Å²	65	81.2 Å²	81.2	67%	0.67	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.5	15.6	-179.8	0	0	0	0	0	115.1	V28	V28-G30 PolarHBondContact O-N 3.26Å
31	V	54.3	Low	56.7	Low	13 Å²	13	78 Å²	78	8%	0.079	51%	0.506	C	S	.	.	B	Isolated β-bridge	trans	-117.9	131.4	-176.6	-175.5	0	0	0	0	110	V28 C29 T35 I63 I99	V28-V31 PolarHBondContact O-N 2.75Å; C29-V31 VanDerWaalsContact C-N 3.33Å; V31-T35 HydrophobicContact CG1-CG2 3.62Å; V31-T35 WeakPolarHBondContact CG1-OG1 3.44Å; V31-I63 HydrophobicContact CG2-CD1 4.16Å; V31-I99 HydrophobicContact CG1-CD1 4.43Å
32	P	53.6	Low	59.5	Low	85 Å²	85	78.3 Å²	78.3	55%	0.552	50%	0.495	S	S	*	.			trans	-72.8	146.7	177.3	29.1	-32.6	0	0	0	111.6	T35	P32-T35 WeakPolarHBondContact O-CB 3.2Å; P32-T35 PolarHBondContact O-N 2.78Å; P32-T35 PolarHBondContact O-OG1 3.23Å
33	S	45.3	Very low	62.3	Low	126 Å²	126	75.5 Å²	75.5	88%	0.881	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	139.5	178.5	-168.7	0	0	0	0	111.9
34	G	58.4	Low	64.8	Low	77 Å²	77	72.9 Å²	72.9	79%	0.794	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.1	3.4	-174	0	0	0	0	0	115.6
35	T	73.4	Confident	67.5	Low	32 Å²	32	70.3 Å²	70.3	20%	0.196	44%	0.436	C	S	.	.	P	Polyproline II helix	trans	-80.7	130.6	174.2	-54.8	0	0	0	0	111.6	V31 P32 I63 I99	V31-T35 HydrophobicContact CG1-CG2 3.62Å; V31-T35 WeakPolarHBondContact CG1-OG1 3.44Å; P32-T35 WeakPolarHBondContact O-CB 3.2Å; P32-T35 PolarHBondContact O-N 2.78Å; P32-T35 PolarHBondContact O-OG1 3.23Å; T35-I63 HydrophobicContact CG2-CB 4.36Å; T35-I63 HydrophobicContact CG2-CG1 4.2Å; T35-I63 HydrophobicContact CG2-CG2 3.55Å; T35-I99 WeakPolarHBondContact O-CD1 3.32Å
36	V	83	Confident	70.1	Confident	55 Å²	55	68.1 Å²	68.1	33%	0.333	41%	0.409	S	S	.	.	P	Polyproline II helix	trans	-79.4	123.3	172	176.3	0	0	0	0	110.4	L64 E96	V36-L64 HydrophobicContact CB-CB 4.14Å; V36-L64 HydrophobicContact CB-CD2 4.17Å; V36-L64 HydrophobicContact CG1-CB 4.2Å; V36-L64 HydrophobicContact CG1-CD2 3.98Å; V36-L64 PolarHBondContact O-N 3.37Å; V36-E96 HydrophobicContact CG1-CB 4.24Å; V36-E96 HydrophobicContact CG1-CG 3.61Å
37	V	89	Confident	72.6	Confident	10 Å²	10	67.6 Å²	67.6	6%	0.061	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	136.7	170.9	170.9	0	0	0	0	109.4	R61 F62 I78 E96 V97 I99	V37-R61 HydrophobicContact CG1-CB 4.35Å; V37-F62 WeakPolarHBondContact CA-O 3.21Å; V37-I78 HydrophobicContact CG1-CD1 3.94Å; V37-I78 HydrophobicContact CG2-CD1 4.09Å; V37-E96 WeakPolarHBondContact O-CA 3.16Å; V37-V97 PolarHBondContact O-N 2.77Å; V37-I99 HydrophobicContact CG2-CD1 3.97Å; V37-I99 HydrophobicContact CG2-CG1 3.94Å
38	L	91.8	Very high	74.5	Confident	0 Å²	0	64.1 Å²	64.1	0%	0	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	146.2	173.8	-68.8	167.3	0	0	0	109.7	R61 F62 L64 W73 V75 V94 T95 E96	L38-R61 CarbonylContact O-C 3.59Å; L38-R61 VanDerWaalsContact O-CA 3.24Å; L38-R61 WeakPolarHBondContact O-CA 3.48Å; L38-F62 HydrophobicContact CB-CB 4.47Å; L38-F62 PolarHBondContact N-O 3.46Å; L38-F62 PolarHBondContact O-N 2.77Å; L38-L64 HydrophobicContact CD1-CB 3.79Å; L38-L64 HydrophobicContact CD1-CD1 4.02Å; L38-L64 HydrophobicContact CD1-CG 4.34Å; L38-L64 HydrophobicContact CG-CB 4.22Å; L38-W73 HydrophobicContact CD1-CE3 3.98Å; L38-W73 HydrophobicContact CD2-CE3 4.04Å; L38-W73 HydrophobicContact CD2-CZ3 3.76Å; L38-V75 HydrophobicContact CD1-CG1 3.64Å; L38-V94 HydrophobicContact CB-CB 4.32Å; L38-V94 HydrophobicContact CD1-CG2 4.24Å; L38-V94 HydrophobicContact CD2-CB 4.26Å; L38-V94 HydrophobicContact CD2-CG2 4.05Å; L38-T95 CarbonylContact C-O 3.56Å; L38-T95 VanDerWaalsContact CA-O 3.29Å; L38-T95 WeakPolarHBondContact CA-O 3.27Å; L38-E96 HydrophobicContact CD2-CB 4.44Å; L38-E96 HydrophobicContact CD2-CG 3.52Å
39	E	92.3	Very high	76.1	Confident	43 Å²	43	68 Å²	68	20%	0.201	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	135	170.3	-170.5	164.8	157.5	0	0	109.6	E60 R61 V94 T95 V97	E39-E60 WeakPolarHBondContact CA-O 3.17Å; E39-R61 HydrophobicContact CB-CG 4.15Å; E39-R61 HydrophobicContact CG-CG 4.01Å; E39-R61 IonicContact OE1-NH2 2.83Å; E39-R61 IonicContact OE2-CZ 2.94Å; E39-R61 IonicContact OE2-NE 2.98Å; E39-R61 PolarHBondContact OE2-NE 2.73Å; E39-R61 IonicContact OE2-NH2 2.78Å; E39-R61 PolarHBondContact OE2-NH2 2.77Å; E39-V94 CarbonylContact O-C 3.45Å; E39-V94 VanDerWaalsContact O-CA 3.27Å; E39-V94 WeakPolarHBondContact O-CA 3.32Å; E39-T95 PolarHBondContact N-O 2.94Å; E39-T95 PolarHBondContact O-N 3.16Å; E39-V97 HydrophobicContact CB-CG2 3.59Å
40	A	92.1	Very high	77.6	Confident	2 Å²	2	67 Å²	67	2%	0.017	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	129.3	178.3	0	0	0	0	0	111.3	I56 R57 G59 E60 F62 Y93 V94	A40-I56 HydrophobicContact CB-CG2 3.56Å; A40-R57 WeakPolarHBondContact CB-O 3.3Å; A40-G59 PolarHBondContact O-N 3.48Å; A40-E60 PolarHBondContact N-O 2.71Å; A40-F62 HydrophobicContact CB-CE2 4.1Å; A40-Y93 WeakPolarHBondContact CA-O 3.45Å; A40-V94 HydrophobicContact CB-CG1 4.36Å
41	Q	91.9	Very high	78.7	Confident	80 Å²	80	65.8 Å²	65.8	37%	0.374	39%	0.385	S	S	.	.	S	Bend	trans	-89.5	-10.1	-177.8	-67.3	-64.8	-28.9	0	0	113.4	Y93 T95	Q41-Y93 PolarHBondContact N-O 3.16Å; Q41-T95 HydrophobicContact CG-CG2 3.75Å; Q41-T95 PolarHBondContact NE2-OG1 3.49Å
42	Y	87.2	Confident	80	Confident	135 Å²	135	72 Å²	72	53%	0.529	41%	0.407	S	S	.	.	S	Bend	trans	-149.1	148.1	-177.9	-53.8	-73.8	0	0	0	111.2	Y44 Y93	Y42-Y44 PolarHBondContact O-N 3.46Å; Y42-Y93 HydrophobicContact CD2-CD2 4.11Å; Y42-Y93 HydrophobicContact CD2-CE2 4.49Å; Y42-Y93 HydrophobicContact CD2-CG 4.17Å; Y42-Y93 HydrophobicContact CG-CD2 4.48Å
43	D	86.4	Confident	81.4	Confident	100 Å²	100	73.6 Å²	73.6	54%	0.535	41%	0.407	S	S	.	.			trans	-60.5	128.5	164.5	-92.8	28	0	0	0	109.9	R57 E58	D43-R57 WeakPolarHBondContact OD1-CA 3.32Å; D43-R57 WeakPolarHBondContact OD1-CB 3.2Å; D43-R57 IonicContact OD2-NH1 2.8Å; D43-E58 PolarHBondContact OD1-N 2.99Å
44	Y	86.4	Confident	83.5	Confident	65 Å²	65	69 Å²	69	26%	0.255	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	137.7	178.6	-177.6	-109.7	0	0	0	111.5	Y42 Y46 I56 W72 P90 Y93	Y42-Y44 PolarHBondContact O-N 3.46Å; Y44-Y46 HydrophobicContact CD1-CD1 4.13Å; Y44-Y46 AromaticContact CE1-CD1 3.6Å; Y44-Y46 HydrophobicContact CE1-CD1 3.6Å; Y44-Y46 HydrophobicContact CE1-CG 4.1Å; Y44-I56 HydrophobicContact CD1-CD1 4.19Å; Y44-I56 PolarHBondContact N-O 2.93Å; Y44-I56 PolarHBondContact O-N 3.11Å; Y44-I56 VanDerWaalsContact O-O 3.07Å; Y44-W72 HydrophobicContact CE1-CH2 4.09Å; Y44-W72 HydrophobicContact CE1-CZ3 4.28Å; Y44-P90 HydrophobicContact CD1-CG 4.02Å; Y44-P90 HydrophobicContact CE1-CG 3.89Å; Y44-Y93 HydrophobicContact CD2-CD2 4.38Å; Y44-Y93 AromaticContact CD2-CE2 3.92Å; Y44-Y93 HydrophobicContact CD2-CE2 3.92Å; Y44-Y93 HydrophobicContact CG-CD2 4.29Å; Y44-Y93 HydrophobicContact CG-CE2 4.28Å
45	S	88.3	Confident	84.9	Confident	63 Å²	63	68.3 Å²	68.3	44%	0.441	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	145.2	170.6	77.7	0	0	0	0	113.2	V54 C55	S45-V54 CarbonylContact C-O 3.53Å; S45-V54 WeakPolarHBondContact CA-O 3.45Å; S45-V54 WeakPolarHBondContact CB-O 3.5Å; S45-C55 VanDerWaalsContact CB-SG 3.6Å
46	Y	88.1	Confident	85.8	Confident	45 Å²	45	67.1 Å²	67.1	18%	0.176	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	159.3	178.5	74.1	-81.8	0	0	0	111	Y44 Q53 V54 I56 Y88	Y44-Y46 HydrophobicContact CD1-CD1 4.13Å; Y44-Y46 AromaticContact CE1-CD1 3.6Å; Y44-Y46 HydrophobicContact CE1-CD1 3.6Å; Y44-Y46 HydrophobicContact CE1-CG 4.1Å; Y46-Q53 WeakPolarHBondContact O-CA 3.47Å; Y46-V54 HydrophobicContact CD1-CB 3.98Å; Y46-V54 HydrophobicContact CD1-CG1 4.33Å; Y46-V54 HydrophobicContact CE1-CB 3.54Å; Y46-V54 HydrophobicContact CE1-CG1 3.64Å; Y46-V54 HydrophobicContact CE1-CG2 4.15Å; Y46-V54 HydrophobicContact CE2-CG2 4.48Å; Y46-V54 PolarHBondContact N-O 3.25Å; Y46-V54 PolarHBondContact O-N 3.37Å; Y46-I56 HydrophobicContact CE1-CD1 4.32Å; Y46-Y88 VanDerWaalsContact CE1-O 3.29Å; Y46-Y88 WeakPolarHBondContact CE1-O 3.48Å; Y46-Y88 PolarHBondContact OH-N 3.17Å; Y46-Y88 VanDerWaalsContact OH-N 3.13Å; Y46-Y88 PolarHBondContact OH-O 2.89Å
47	R	88.6	Confident	86	Confident	172 Å²	172	72.1 Å²	72.1	65%	0.649	36%	0.361	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.9	120	170.4	-168.3	178.4	-65.3	-86.6	3.6	109.2	G51 R52	R47-G51 WeakPolarHBondContact CG-O 3.14Å; R47-G51 PolarHBondContact NH1-O 3.23Å; R47-R52 CarbonylContact C-O 3.52Å; R47-R52 WeakPolarHBondContact CA-O 3.27Å
48	G	77.4	Confident	86	Confident	19 Å²	19	78 Å²	78	20%	0.196	39%	0.388	C	S	.	.			trans	-70.3	160.3	172.1	0	0	0	0	0	112	D50 G51 R52	G48-D50 PolarHBondContact O-N 3.11Å; G48-G51 WeakPolarHBondContact O-CA 3.47Å; G48-G51 PolarHBondContact O-N 3.46Å; G48-R52 PolarHBondContact N-O 3.3Å
49	S	73.7	Confident	85.6	Confident	143 Å²	143	79.8 Å²	79.8	100%	1	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	-11.8	177.4	51.4	0	0	0	0	114.2	G51	S49-G51 PolarHBondContact O-N 3.09Å
50	D	76.5	Confident	85.5	Confident	77 Å²	77	79.5 Å²	79.5	41%	0.412	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89	20.4	166.9	77	-21.5	0	0	0	113.1	G48 R52 K85	G48-D50 PolarHBondContact O-N 3.11Å; D50-R52 PolarHBondContact O-N 3.12Å; D50-R52 VanDerWaalsContact O-N 3.12Å; D50-R52 WeakPolarHBondContact OD1-CB 3.42Å; D50-R52 WeakPolarHBondContact OD1-CG 3.42Å; D50-R52 WeakPolarHBondContact OD2-CD 3.47Å; D50-R52 IonicContact OD2-CZ 2.84Å; D50-R52 IonicContact OD2-NE 2.87Å; D50-R52 PolarHBondContact OD2-NE 3.26Å; D50-R52 VanDerWaalsContact OD2-NE 3.14Å; D50-K85 IonicContact OD2-NZ 2.64Å; D50-K85 PolarHBondContact OD2-NZ 2.82Å
51	G	74.6	Confident	85.5	Confident	40 Å²	40	85.3 Å²	85.3	41%	0.412	43%	0.427	S	S	.	.	S	Bend	trans	76.2	-12.5	176.8	0	0	0	0	0	115	R47 G48 S49	R47-G51 WeakPolarHBondContact CG-O 3.14Å; R47-G51 PolarHBondContact NH1-O 3.23Å; G48-G51 WeakPolarHBondContact O-CA 3.47Å; G48-G51 PolarHBondContact O-N 3.46Å; S49-G51 PolarHBondContact O-N 3.09Å
52	R	81.4	Confident	85.5	Confident	143 Å²	143	81.5 Å²	81.5	54%	0.54	41%	0.409	S	S	.	.	P	Polyproline II helix	trans	-71	133	-174.6	-62.8	-179.3	-179	-148.8	-8.6	111.5	R47 G48 D50	R47-R52 CarbonylContact C-O 3.52Å; R47-R52 WeakPolarHBondContact CA-O 3.27Å; G48-R52 PolarHBondContact N-O 3.3Å; D50-R52 PolarHBondContact O-N 3.12Å; D50-R52 VanDerWaalsContact O-N 3.12Å; D50-R52 WeakPolarHBondContact OD1-CB 3.42Å; D50-R52 WeakPolarHBondContact OD1-CG 3.42Å; D50-R52 WeakPolarHBondContact OD2-CD 3.47Å; D50-R52 IonicContact OD2-CZ 2.84Å; D50-R52 IonicContact OD2-NE 2.87Å; D50-R52 PolarHBondContact OD2-NE 3.26Å; D50-R52 VanDerWaalsContact OD2-NE 3.14Å
53	Q	83.6	Confident	85.6	Confident	119 Å²	119	75.7 Å²	75.7	56%	0.556	39%	0.387	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.5	122	168.1	-168.4	169.5	-5.5	0	0	109.1	Y46	Y46-Q53 WeakPolarHBondContact O-CA 3.47Å
54	V	88.6	Confident	85.8	Confident	30 Å²	30	72.4 Å²	72.4	18%	0.182	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	119.1	172.1	177.4	0	0	0	0	106.6	S45 Y46 I56 L87	S45-V54 CarbonylContact C-O 3.53Å; S45-V54 WeakPolarHBondContact CA-O 3.45Å; S45-V54 WeakPolarHBondContact CB-O 3.5Å; Y46-V54 HydrophobicContact CD1-CB 3.98Å; Y46-V54 HydrophobicContact CD1-CG1 4.33Å; Y46-V54 HydrophobicContact CE1-CB 3.54Å; Y46-V54 HydrophobicContact CE1-CG1 3.64Å; Y46-V54 HydrophobicContact CE1-CG2 4.15Å; Y46-V54 HydrophobicContact CE2-CG2 4.48Å; Y46-V54 PolarHBondContact N-O 3.25Å; Y46-V54 PolarHBondContact O-N 3.37Å; V54-I56 HydrophobicContact CG1-CD1 4Å; V54-I56 HydrophobicContact CG1-CG1 4.28Å; V54-L87 HydrophobicContact CG1-CB 4.33Å; V54-L87 HydrophobicContact CG1-CD1 4.26Å
55	C	88.5	Confident	85.9	Confident	62 Å²	62	73.3 Å²	73.3	42%	0.419	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	122.4	170.9	-53.5	0	0	0	0	108	S45 R77	S45-C55 VanDerWaalsContact CB-SG 3.6Å; C55-R77 PolarHBondContact O-NH2 3.3Å
56	I	91.6	Very high	85.9	Confident	7 Å²	7	76.3 Å²	76.3	4%	0.036	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	139.7	172	-66.3	128.7	0	0	0	106.7	A40 Y44 Y46 V54 F62 L87 V89	A40-I56 HydrophobicContact CB-CG2 3.56Å; Y44-I56 HydrophobicContact CD1-CD1 4.19Å; Y44-I56 PolarHBondContact N-O 2.93Å; Y44-I56 PolarHBondContact O-N 3.11Å; Y44-I56 VanDerWaalsContact O-O 3.07Å; Y46-I56 HydrophobicContact CE1-CD1 4.32Å; V54-I56 HydrophobicContact CG1-CD1 4Å; V54-I56 HydrophobicContact CG1-CG1 4.28Å; I56-F62 HydrophobicContact CB-CZ 4.34Å; I56-F62 HydrophobicContact CG1-CE1 4.47Å; I56-F62 HydrophobicContact CG1-CZ 3.89Å; I56-F62 HydrophobicContact CG2-CE2 3.96Å; I56-F62 HydrophobicContact CG2-CZ 3.79Å; I56-L87 HydrophobicContact CD1-CD1 4.3Å; I56-L87 HydrophobicContact CG1-CD1 4.25Å; I56-V89 HydrophobicContact CD1-CG1 3.9Å; I56-V89 HydrophobicContact CG1-CG1 4.29Å
57	R	87.4	Confident	85.9	Confident	159 Å²	159	78.9 Å²	78.9	60%	0.6	40%	0.396	S	S	*	.			trans	-109.2	153.9	172.6	-64.4	175.3	175.2	-84.9	6.8	111.9	A40 D43 E60	A40-R57 WeakPolarHBondContact CB-O 3.3Å; D43-R57 WeakPolarHBondContact OD1-CA 3.32Å; D43-R57 WeakPolarHBondContact OD1-CB 3.2Å; D43-R57 IonicContact OD2-NH1 2.8Å; R57-E60 HydrophobicContact CB-CG 4.07Å; R57-E60 PolarHBondContact N-OE1 3.05Å; R57-E60 VanDerWaalsContact O-CB 3.28Å; R57-E60 WeakPolarHBondContact O-CB 3.3Å; R57-E60 PolarHBondContact O-N 2.85Å
58	E	89.1	Confident	85.6	Confident	133 Å²	133	73.7 Å²	73.7	62%	0.621	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.1	136.3	166.2	-170.9	179.2	142.4	0	0	110.4	D43 E60	D43-E58 PolarHBondContact OD1-N 2.99Å; E58-E60 VanDerWaalsContact C-N 3.26Å; E58-E60 PolarHBondContact O-N 3Å
59	G	84.4	Confident	86	Confident	38 Å²	38	76.7 Å²	76.7	39%	0.392	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	76	-3	-173.9	0	0	0	0	0	115.6	A40 R61	A40-G59 PolarHBondContact O-N 3.48Å; G59-R61 PolarHBondContact O-N 2.79Å
60	E	90.6	Very high	86.4	Confident	38 Å²	38	73.6 Å²	73.6	18%	0.178	38%	0.378	C	S	.	.			trans	-67.7	133	173	-81.5	-171.1	-154.7	0	0	111.8	E39 A40 R57 E58 F62 R77	E39-E60 WeakPolarHBondContact CA-O 3.17Å; A40-E60 PolarHBondContact N-O 2.71Å; R57-E60 HydrophobicContact CB-CG 4.07Å; R57-E60 PolarHBondContact N-OE1 3.05Å; R57-E60 VanDerWaalsContact O-CB 3.28Å; R57-E60 WeakPolarHBondContact O-CB 3.3Å; R57-E60 PolarHBondContact O-N 2.85Å; E58-E60 VanDerWaalsContact C-N 3.26Å; E58-E60 PolarHBondContact O-N 3Å; E60-F62 HydrophobicContact CB-CE2 3.59Å; E60-F62 HydrophobicContact CB-CZ 3.74Å; E60-F62 WeakPolarHBondContact O-CD2 3.46Å; E60-F62 VanDerWaalsContact O-CE2 3.26Å; E60-F62 WeakPolarHBondContact O-CE2 3.28Å; E60-F62 VanDerWaalsContact OE2-CZ 3.25Å; E60-F62 WeakPolarHBondContact OE2-CZ 3.48Å; E60-R77 IonicContact OE1-CZ 3.85Å; E60-R77 IonicContact OE1-NE 2.64Å; E60-R77 IonicContact OE1-NH2 3.14Å; E60-R77 PolarHBondContact OE1-NH2 2.84Å; E60-R77 IonicContact OE2-CZ 3.08Å; E60-R77 IonicContact OE2-NE 2.64Å; E60-R77 PolarHBondContact OE2-NE 3.5Å; E60-R77 IonicContact OE2-NH2 2.81Å; E60-R77 PolarHBondContact OE2-NH2 3.01Å
61	R	90.4	Very high	86.8	Confident	124 Å²	124	74.5 Å²	74.5	47%	0.468	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	135.2	179.9	-66.4	-176.8	173.5	174.5	-0.1	113.5	V37 L38 E39 G59 I78	V37-R61 HydrophobicContact CG1-CB 4.35Å; L38-R61 CarbonylContact O-C 3.59Å; L38-R61 VanDerWaalsContact O-CA 3.24Å; L38-R61 WeakPolarHBondContact O-CA 3.48Å; E39-R61 HydrophobicContact CB-CG 4.15Å; E39-R61 HydrophobicContact CG-CG 4.01Å; E39-R61 IonicContact OE1-NH2 2.83Å; E39-R61 IonicContact OE2-CZ 2.94Å; E39-R61 IonicContact OE2-NE 2.98Å; E39-R61 PolarHBondContact OE2-NE 2.73Å; E39-R61 IonicContact OE2-NH2 2.78Å; E39-R61 PolarHBondContact OE2-NH2 2.77Å; G59-R61 PolarHBondContact O-N 2.79Å; R61-I78 HydrophobicContact CB-CD1 3.67Å; R61-I78 HydrophobicContact CB-CG1 4.32Å; R61-I78 PolarHBondContact O-N 3.17Å; R61-I78 VanDerWaalsContact O-N 3.08Å
62	F	92.2	Very high	87.5	Confident	0 Å²	0	76.9 Å²	76.9	0%	0	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	148.5	-175.9	-53.4	-94.7	0	0	0	111.4	V37 L38 A40 I56 E60 V75 R76 R77 L87	V37-F62 WeakPolarHBondContact CA-O 3.21Å; L38-F62 HydrophobicContact CB-CB 4.47Å; L38-F62 PolarHBondContact N-O 3.46Å; L38-F62 PolarHBondContact O-N 2.77Å; A40-F62 HydrophobicContact CB-CE2 4.1Å; I56-F62 HydrophobicContact CB-CZ 4.34Å; I56-F62 HydrophobicContact CG1-CE1 4.47Å; I56-F62 HydrophobicContact CG1-CZ 3.89Å; I56-F62 HydrophobicContact CG2-CE2 3.96Å; I56-F62 HydrophobicContact CG2-CZ 3.79Å; E60-F62 HydrophobicContact CB-CE2 3.59Å; E60-F62 HydrophobicContact CB-CZ 3.74Å; E60-F62 WeakPolarHBondContact O-CD2 3.46Å; E60-F62 VanDerWaalsContact O-CE2 3.26Å; E60-F62 WeakPolarHBondContact O-CE2 3.28Å; E60-F62 VanDerWaalsContact OE2-CZ 3.25Å; E60-F62 WeakPolarHBondContact OE2-CZ 3.48Å; F62-V75 HydrophobicContact CB-CB 3.89Å; F62-V75 HydrophobicContact CB-CG2 3.87Å; F62-V75 HydrophobicContact CD1-CG2 3.67Å; F62-V75 HydrophobicContact CE1-CG2 4.45Å; F62-V75 HydrophobicContact CG-CB 4.45Å; F62-V75 HydrophobicContact CG-CG2 3.88Å; F62-R76 CarbonylContact C-O 3.36Å; F62-R76 WeakPolarHBondContact CA-O 3.46Å; F62-R77 HydrophobicContact CD1-CB 4.41Å; F62-R77 HydrophobicContact CD1-CG 3.76Å; F62-R77 HydrophobicContact CE1-CG 3.45Å; F62-R77 VanDerWaalsContact CE1-CG 3.45Å; F62-R77 HydrophobicContact CZ-CG 4.36Å; F62-L87 HydrophobicContact CD1-CD1 4.11Å; F62-L87 HydrophobicContact CD1-CD2 4.19Å; F62-L87 HydrophobicContact CE1-CD1 3.71Å; F62-L87 HydrophobicContact CE1-CD2 4.02Å; F62-L87 HydrophobicContact CE1-CG 4.43Å; F62-L87 HydrophobicContact CZ-CD1 4.5Å
63	I	90.9	Very high	88.1	Confident	13 Å²	13	71.8 Å²	71.8	7%	0.067	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	123.3	164	-68.7	165.3	0	0	0	107.9	V31 T35 L65 V75 R76 I78	V31-I63 HydrophobicContact CG2-CD1 4.16Å; T35-I63 HydrophobicContact CG2-CB 4.36Å; T35-I63 HydrophobicContact CG2-CG1 4.2Å; T35-I63 HydrophobicContact CG2-CG2 3.55Å; I63-L65 HydrophobicContact CG2-CD2 4.07Å; I63-L65 PolarHBondContact O-N 3Å; I63-V75 CarbonylContact O-C 3.54Å; I63-V75 VanDerWaalsContact O-CA 3.26Å; I63-V75 WeakPolarHBondContact O-CA 3.34Å; I63-V75 WeakPolarHBondContact O-CB 3.27Å; I63-R76 PolarHBondContact N-O 3.12Å; I63-R76 PolarHBondContact O-N 2.8Å; I63-I78 HydrophobicContact CG1-CG1 4.1Å
64	L	90.6	Very high	88.5	Confident	30 Å²	30	68 Å²	68	16%	0.157	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	124.8	168.9	176.1	57.8	0	0	0	109.6	V36 L38 K67 W73 V75	V36-L64 HydrophobicContact CB-CB 4.14Å; V36-L64 HydrophobicContact CB-CD2 4.17Å; V36-L64 HydrophobicContact CG1-CB 4.2Å; V36-L64 HydrophobicContact CG1-CD2 3.98Å; V36-L64 PolarHBondContact O-N 3.37Å; L38-L64 HydrophobicContact CD1-CB 3.79Å; L38-L64 HydrophobicContact CD1-CD1 4.02Å; L38-L64 HydrophobicContact CD1-CG 4.34Å; L38-L64 HydrophobicContact CG-CB 4.22Å; L64-K67 HydrophobicContact CD1-CG 4.05Å; L64-K67 HydrophobicContact CD2-CD 4.44Å; L64-K67 HydrophobicContact CD2-CG 3.99Å; L64-W73 HydrophobicContact CD1-CB 4.17Å; L64-V75 HydrophobicContact CD1-CG1 4.31Å
65	L	88.1	Confident	88.6	Confident	85 Å²	85	66.6 Å²	66.6	45%	0.445	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	-42.8	173.7	-59.4	175.7	0	0	0	111.3	I63 Q74 R76 P86	I63-L65 HydrophobicContact CG2-CD2 4.07Å; I63-L65 PolarHBondContact O-N 3Å; L65-Q74 WeakPolarHBondContact CA-O 2.94Å; L65-Q74 WeakPolarHBondContact CB-O 3.32Å; L65-Q74 PolarHBondContact N-O 3.23Å; L65-R76 HydrophobicContact CD1-CB 3.97Å; L65-R76 HydrophobicContact CG-CB 4.41Å; L65-P86 HydrophobicContact CD1-CB 3.74Å
66	K	87.3	Confident	88.8	Confident	126 Å²	126	66.5 Å²	66.5	55%	0.548	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.2	123.3	179.3	-175.5	179.6	177.8	-172.8	0	112.7	T68 Q74	K66-T68 PolarHBondContact O-N 2.97Å; K66-T68 VanDerWaalsContact O-N 3.15Å; K66-T68 PolarHBondContact O-OG1 2.92Å; K66-Q74 HydrophobicContact CB-CB 4.31Å; K66-Q74 PolarHBondContact N-O 2.88Å; K66-Q74 WeakPolarHBondContact O-CB 3.47Å; K66-Q74 PolarHBondContact O-N 3.34Å
67	K	88.8	Confident	88.7	Confident	99 Å²	99	71 Å²	71	43%	0.43	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	111.1	162.1	-57.7	-168.2	176.3	-173.1	0	107.6	L64 W73 E96	L64-K67 HydrophobicContact CD1-CG 4.05Å; L64-K67 HydrophobicContact CD2-CD 4.44Å; L64-K67 HydrophobicContact CD2-CG 3.99Å; K67-W73 HydrophobicContact CB-CD2 4.43Å; K67-W73 HydrophobicContact CB-CG 4.15Å; K67-W73 HydrophobicContact CD-CD2 4.06Å; K67-W73 HydrophobicContact CD-CE3 4.48Å; K67-W73 HydrophobicContact CD-CH2 4.19Å; K67-W73 HydrophobicContact CD-CZ2 3.71Å; K67-W73 HydrophobicContact CG-CD2 3.78Å; K67-W73 HydrophobicContact CG-CE3 4.38Å; K67-W73 HydrophobicContact CG-CG 3.94Å; K67-W73 HydrophobicContact CG-CZ2 4.35Å; K67-E96 VanDerWaalsContact CE-OE1 3.25Å; K67-E96 WeakPolarHBondContact CE-OE1 3.48Å; K67-E96 IonicContact NZ-OE1 2.67Å; K67-E96 PolarHBondContact NZ-OE1 3.34Å
68	T	81.9	Confident	88.5	Confident	62 Å²	62	66.4 Å²	66.4	38%	0.38	33%	0.328	S	S	.	.			trans	-93.5	-40	-165.9	-64.6	0	0	0	0	112	K66 W72 Y88	K66-T68 PolarHBondContact O-N 2.97Å; K66-T68 VanDerWaalsContact O-N 3.15Å; K66-T68 PolarHBondContact O-OG1 2.92Å; T68-W72 WeakPolarHBondContact CB-O 3.42Å; T68-W72 PolarHBondContact N-O 2.82Å; T68-Y88 HydrophobicContact CG2-CE1 4.43Å
69	N	85.8	Confident	87.7	Confident	82 Å²	82	63.9 Å²	63.9	44%	0.439	34%	0.337	S	S	.	.	S	Bend	trans	-146.6	-164.6	163	62	0	0	0	0	108.7	D71 W72 W73	N69-D71 VanDerWaalsContact C-N 3.33Å; N69-D71 PolarHBondContact OD1-N 3.21Å; N69-W72 PolarHBondContact N-O 2.77Å; N69-W72 WeakPolarHBondContact OD1-CA 3.35Å; N69-W72 WeakPolarHBondContact OD1-CB 3.4Å; N69-W72 PolarHBondContact OD1-N 3.24Å; N69-W72 PolarHBondContact OD1-O 2.64Å; N69-W73 PolarHBondContact O-NE1 2.86Å
70	A	82.4	Confident	87.4	Confident	79 Å²	79	63.3 Å²	63.3	65%	0.653	33%	0.329	S	S	*	.	S	Bend	trans	-63.8	-38	178	0	0	0	0	0	112.4	A91	A70-A91 WeakPolarHBondContact O-CB 3.42Å
71	D	85.8	Confident	86.5	Confident	95 Å²	95	64.7 Å²	64.7	51%	0.508	35%	0.347	S	S	.	.	S	Bend	trans	-98.1	-24.7	-166.1	-31.3	-77.9	0	0	0	113.7	N69 P90 A91	N69-D71 VanDerWaalsContact C-N 3.33Å; N69-D71 PolarHBondContact OD1-N 3.21Å; D71-P90 CarbonylContact O-C 3.58Å; D71-P90 VanDerWaalsContact O-CA 3.24Å; D71-P90 WeakPolarHBondContact O-CA 3.3Å; D71-A91 PolarHBondContact O-N 3.11Å
72	W	89.1	Confident	85.4	Confident	90 Å²	90	63.8 Å²	63.8	34%	0.341	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	123.3	-173	-65.3	93.2	0	0	0	112.6	Y44 T68 N69 V89 P90	Y44-W72 HydrophobicContact CE1-CH2 4.09Å; Y44-W72 HydrophobicContact CE1-CZ3 4.28Å; T68-W72 WeakPolarHBondContact CB-O 3.42Å; T68-W72 PolarHBondContact N-O 2.82Å; N69-W72 PolarHBondContact N-O 2.77Å; N69-W72 WeakPolarHBondContact OD1-CA 3.35Å; N69-W72 WeakPolarHBondContact OD1-CB 3.4Å; N69-W72 PolarHBondContact OD1-N 3.24Å; N69-W72 PolarHBondContact OD1-O 2.64Å; W72-V89 WeakPolarHBondContact CA-O 3.31Å; W72-P90 HydrophobicContact CE3-CG 4.45Å; W72-P90 HydrophobicContact CH2-CG 4.15Å; W72-P90 HydrophobicContact CZ3-CG 3.93Å
73	W	92.9	Very high	84.3	Confident	36 Å²	36	73.5 Å²	73.5	14%	0.136	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	141	176.5	-62.2	-5.6	0	0	0	110.7	L38 L64 K67 N69 V75 Y88 V89 A91 V94	L38-W73 HydrophobicContact CD1-CE3 3.98Å; L38-W73 HydrophobicContact CD2-CE3 4.04Å; L38-W73 HydrophobicContact CD2-CZ3 3.76Å; L64-W73 HydrophobicContact CD1-CB 4.17Å; K67-W73 HydrophobicContact CB-CD2 4.43Å; K67-W73 HydrophobicContact CB-CG 4.15Å; K67-W73 HydrophobicContact CD-CD2 4.06Å; K67-W73 HydrophobicContact CD-CE3 4.48Å; K67-W73 HydrophobicContact CD-CH2 4.19Å; K67-W73 HydrophobicContact CD-CZ2 3.71Å; K67-W73 HydrophobicContact CG-CD2 3.78Å; K67-W73 HydrophobicContact CG-CE3 4.38Å; K67-W73 HydrophobicContact CG-CG 3.94Å; K67-W73 HydrophobicContact CG-CZ2 4.35Å; N69-W73 PolarHBondContact O-NE1 2.86Å; W73-V75 HydrophobicContact CB-CG1 4.48Å; W73-Y88 WeakPolarHBondContact O-CA 3.48Å; W73-V89 HydrophobicContact CB-CG2 4.26Å; W73-V89 PolarHBondContact N-O 3.34Å; W73-V89 PolarHBondContact O-N 2.69Å; W73-A91 HydrophobicContact CD2-CB 3.96Å; W73-A91 VanDerWaalsContact CE2-CB 3.49Å; W73-A91 HydrophobicContact CG-CB 4.22Å; W73-A91 HydrophobicContact CZ2-CB 3.82Å; W73-V94 HydrophobicContact CE3-CG2 3.82Å; W73-V94 HydrophobicContact CZ3-CG2 3.99Å
74	Q	91.6	Very high	83.7	Confident	41 Å²	41	75.9 Å²	75.9	19%	0.192	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	125.6	179.7	-171.3	175.4	40.6	0	0	109.6	L65 K66 P86 Y88	L65-Q74 WeakPolarHBondContact CA-O 2.94Å; L65-Q74 WeakPolarHBondContact CB-O 3.32Å; L65-Q74 PolarHBondContact N-O 3.23Å; K66-Q74 HydrophobicContact CB-CB 4.31Å; K66-Q74 PolarHBondContact N-O 2.88Å; K66-Q74 WeakPolarHBondContact O-CB 3.47Å; K66-Q74 PolarHBondContact O-N 3.34Å; Q74-P86 HydrophobicContact CG-CB 3.83Å; Q74-P86 HydrophobicContact CG-CG 4.33Å; Q74-Y88 HydrophobicContact CB-CD1 4.05Å; Q74-Y88 HydrophobicContact CB-CE1 3.68Å; Q74-Y88 HydrophobicContact CG-CD1 4.47Å; Q74-Y88 HydrophobicContact CG-CE1 3.96Å; Q74-Y88 PolarHBondContact NE2-OH 2.98Å; Q74-Y88 VanDerWaalsContact NE2-OH 3.1Å
75	V	91.7	Very high	83.2	Confident	0 Å²	0	80.4 Å²	80.4	0%	0	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	171.7	-168.7	-50.8	0	0	0	0	112.2	L38 F62 I63 L64 W73 P86 L87 V89	L38-V75 HydrophobicContact CD1-CG1 3.64Å; F62-V75 HydrophobicContact CB-CB 3.89Å; F62-V75 HydrophobicContact CB-CG2 3.87Å; F62-V75 HydrophobicContact CD1-CG2 3.67Å; F62-V75 HydrophobicContact CE1-CG2 4.45Å; F62-V75 HydrophobicContact CG-CB 4.45Å; F62-V75 HydrophobicContact CG-CG2 3.88Å; I63-V75 CarbonylContact O-C 3.54Å; I63-V75 VanDerWaalsContact O-CA 3.26Å; I63-V75 WeakPolarHBondContact O-CA 3.34Å; I63-V75 WeakPolarHBondContact O-CB 3.27Å; L64-V75 HydrophobicContact CD1-CG1 4.31Å; W73-V75 HydrophobicContact CB-CG1 4.48Å; V75-P86 WeakPolarHBondContact O-CA 3.3Å; V75-L87 HydrophobicContact CG2-CD1 3.62Å; V75-L87 HydrophobicContact CG2-CG 3.77Å; V75-L87 PolarHBondContact N-O 3.12Å; V75-L87 PolarHBondContact O-N 3.28Å; V75-V89 HydrophobicContact CG1-CG2 3.66Å; V75-V89 HydrophobicContact CG2-CG1 3.73Å; V75-V89 HydrophobicContact CG2-CG2 4.03Å
76	R	91.5	Very high	83.2	Confident	60 Å²	60	79 Å²	79	23%	0.226	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	134.5	173.4	171.6	175.3	59.6	106.9	1.2	109.5	F62 I63 L65 A80	F62-R76 CarbonylContact C-O 3.36Å; F62-R76 WeakPolarHBondContact CA-O 3.46Å; I63-R76 PolarHBondContact N-O 3.12Å; I63-R76 PolarHBondContact O-N 2.8Å; L65-R76 HydrophobicContact CD1-CB 3.97Å; L65-R76 HydrophobicContact CG-CB 4.41Å; R76-A80 HydrophobicContact CG-CB 4.07Å; R76-A80 PolarHBondContact NH1-O 3.4Å
77	R	90.6	Very high	83.3	Confident	100 Å²	100	74.2 Å²	74.2	38%	0.377	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-54.1	140.9	176.1	-79.6	-178.2	168.4	141.9	-1	111.4	C55 E60 F62 A80 L87	C55-R77 PolarHBondContact O-NH2 3.3Å; E60-R77 IonicContact OE1-CZ 3.85Å; E60-R77 IonicContact OE1-NE 2.64Å; E60-R77 IonicContact OE1-NH2 3.14Å; E60-R77 PolarHBondContact OE1-NH2 2.84Å; E60-R77 IonicContact OE2-CZ 3.08Å; E60-R77 IonicContact OE2-NE 2.64Å; E60-R77 PolarHBondContact OE2-NE 3.5Å; E60-R77 IonicContact OE2-NH2 2.81Å; E60-R77 PolarHBondContact OE2-NH2 3.01Å; F62-R77 HydrophobicContact CD1-CB 4.41Å; F62-R77 HydrophobicContact CD1-CG 3.76Å; F62-R77 HydrophobicContact CE1-CG 3.45Å; F62-R77 VanDerWaalsContact CE1-CG 3.45Å; F62-R77 HydrophobicContact CZ-CG 4.36Å; R77-A80 HydrophobicContact CB-CB 4.07Å; R77-A80 VanDerWaalsContact O-CB 3.28Å; R77-A80 WeakPolarHBondContact O-CB 3.27Å; R77-A80 PolarHBondContact O-N 2.85Å; R77-A80 VanDerWaalsContact O-N 3.17Å; R77-L87 HydrophobicContact CG-CD2 4.35Å
78	I	82.4	Confident	83.4	Confident	63 Å²	63	73.4 Å²	73.4	32%	0.323	41%	0.407	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.7	142.9	169.5	-65.7	-178.8	0	0	0	109	V37 R61 I63 A80	V37-I78 HydrophobicContact CG1-CD1 3.94Å; V37-I78 HydrophobicContact CG2-CD1 4.09Å; R61-I78 HydrophobicContact CB-CD1 3.67Å; R61-I78 HydrophobicContact CB-CG1 4.32Å; R61-I78 PolarHBondContact O-N 3.17Å; R61-I78 VanDerWaalsContact O-N 3.08Å; I63-I78 HydrophobicContact CG1-CG1 4.1Å; I78-A80 PolarHBondContact O-N 3.32Å
79	G	72.9	Confident	83.8	Confident	80 Å²	80	70.5 Å²	70.5	83%	0.825	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.5	-15.7	-173.9	0	0	0	0	0	115.7	A81	G79-A81 PolarHBondContact O-N 3.19Å
80	A	77.3	Confident	84	Confident	27 Å²	27	67.2 Å²	67.2	22%	0.223	37%	0.372	C	S	.	.			trans	-70.9	126.1	177.6	0	0	0	0	0	111.5	R76 R77 I78 T84	R76-A80 HydrophobicContact CG-CB 4.07Å; R76-A80 PolarHBondContact NH1-O 3.4Å; R77-A80 HydrophobicContact CB-CB 4.07Å; R77-A80 VanDerWaalsContact O-CB 3.28Å; R77-A80 WeakPolarHBondContact O-CB 3.27Å; R77-A80 PolarHBondContact O-N 2.85Å; R77-A80 VanDerWaalsContact O-N 3.17Å; I78-A80 PolarHBondContact O-N 3.32Å; A80-T84 HydrophobicContact CB-CG2 4.37Å
81	A	71.6	Confident	84.4	Confident	67 Å²	67	64.1 Å²	64.1	55%	0.554	35%	0.346	S	S	*	.			trans	-52.3	144.9	-178.2	0	0	0	0	0	112.4	G79 K83 T84	G79-A81 PolarHBondContact O-N 3.19Å; A81-K83 PolarHBondContact O-N 2.94Å; A81-T84 HydrophobicContact CB-CG2 4.48Å; A81-T84 WeakPolarHBondContact O-CB 3.17Å; A81-T84 WeakPolarHBondContact O-CG2 3.35Å; A81-T84 PolarHBondContact O-N 2.91Å; A81-T84 PolarHBondContact O-OG1 3.1Å
82	S	67.3	Low	84.6	Confident	105 Å²	105	65.2 Å²	65.2	73%	0.734	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-15.5	-173.9	54.2	0	0	0	0	115.3
83	K	69.4	Low	84.6	Confident	203 Å²	203	65.1 Å²	65.1	88%	0.883	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.4	-3.4	175.5	-59.4	-179.5	-178.1	177.4	0	114.1	A81	A81-K83 PolarHBondContact O-N 2.94Å
84	T	78.4	Confident	84.4	Confident	63 Å²	63	63.9 Å²	63.9	39%	0.387	35%	0.353	S	S	.	.	S	Bend	trans	-69.4	145	176.8	52.8	0	0	0	0	111.1	A80 A81	A80-T84 HydrophobicContact CB-CG2 4.37Å; A81-T84 HydrophobicContact CB-CG2 4.48Å; A81-T84 WeakPolarHBondContact O-CB 3.17Å; A81-T84 WeakPolarHBondContact O-CG2 3.35Å; A81-T84 PolarHBondContact O-N 2.91Å; A81-T84 PolarHBondContact O-OG1 3.1Å
85	K	79.6	Confident	84.4	Confident	125 Å²	125	64.7 Å²	64.7	54%	0.543	36%	0.361	S	S	.	.	P	Polyproline II helix	trans	-61.2	135.7	173.3	-73.8	-163.9	-176.7	-171.3	0	109.2	D50	D50-K85 IonicContact OD2-NZ 2.64Å; D50-K85 PolarHBondContact OD2-NZ 2.82Å
86	P	88.1	Confident	84.3	Confident	56 Å²	56	69.5 Å²	69.5	36%	0.364	38%	0.383	S	S	.	.	P	Polyproline II helix	trans	-66.1	151.4	169.8	30.9	-35.7	0	0	0	110.5	L65 Q74 V75	L65-P86 HydrophobicContact CD1-CB 3.74Å; Q74-P86 HydrophobicContact CG-CB 3.83Å; Q74-P86 HydrophobicContact CG-CG 4.33Å; V75-P86 WeakPolarHBondContact O-CA 3.3Å
87	L	89.6	Confident	84.1	Confident	25 Å²	25	68.2 Å²	68.2	13%	0.131	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	171	175.1	65.6	114.9	0	0	0	110.2	V54 I56 F62 V75 R77 V89	V54-L87 HydrophobicContact CG1-CB 4.33Å; V54-L87 HydrophobicContact CG1-CD1 4.26Å; I56-L87 HydrophobicContact CD1-CD1 4.3Å; I56-L87 HydrophobicContact CG1-CD1 4.25Å; F62-L87 HydrophobicContact CD1-CD1 4.11Å; F62-L87 HydrophobicContact CD1-CD2 4.19Å; F62-L87 HydrophobicContact CE1-CD1 3.71Å; F62-L87 HydrophobicContact CE1-CD2 4.02Å; F62-L87 HydrophobicContact CE1-CG 4.43Å; F62-L87 HydrophobicContact CZ-CD1 4.5Å; V75-L87 HydrophobicContact CG2-CD1 3.62Å; V75-L87 HydrophobicContact CG2-CG 3.77Å; V75-L87 PolarHBondContact N-O 3.12Å; V75-L87 PolarHBondContact O-N 3.28Å; R77-L87 HydrophobicContact CG-CD2 4.35Å; L87-V89 HydrophobicContact CD1-CG1 3.86Å
88	Y	91.4	Very high	83.2	Confident	83 Å²	83	68.6 Å²	68.6	33%	0.325	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	142.8	177.1	-68.4	-93.5	0	0	0	110.2	Y46 T68 W73 Q74	Y46-Y88 VanDerWaalsContact CE1-O 3.29Å; Y46-Y88 WeakPolarHBondContact CE1-O 3.48Å; Y46-Y88 PolarHBondContact OH-N 3.17Å; Y46-Y88 VanDerWaalsContact OH-N 3.13Å; Y46-Y88 PolarHBondContact OH-O 2.89Å; T68-Y88 HydrophobicContact CG2-CE1 4.43Å; W73-Y88 WeakPolarHBondContact O-CA 3.48Å; Q74-Y88 HydrophobicContact CB-CD1 4.05Å; Q74-Y88 HydrophobicContact CB-CE1 3.68Å; Q74-Y88 HydrophobicContact CG-CD1 4.47Å; Q74-Y88 HydrophobicContact CG-CE1 3.96Å; Q74-Y88 PolarHBondContact NE2-OH 2.98Å; Q74-Y88 VanDerWaalsContact NE2-OH 3.1Å
89	V	90.6	Very high	82.3	Confident	1 Å²	1	69.3 Å²	69.3	1%	0.006	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	144.8	175.7	-66.7	0	0	0	0	109.3	I56 W72 W73 V75 L87 A91 V94	I56-V89 HydrophobicContact CD1-CG1 3.9Å; I56-V89 HydrophobicContact CG1-CG1 4.29Å; W72-V89 WeakPolarHBondContact CA-O 3.31Å; W73-V89 HydrophobicContact CB-CG2 4.26Å; W73-V89 PolarHBondContact N-O 3.34Å; W73-V89 PolarHBondContact O-N 2.69Å; V75-V89 HydrophobicContact CG1-CG2 3.66Å; V75-V89 HydrophobicContact CG2-CG1 3.73Å; V75-V89 HydrophobicContact CG2-CG2 4.03Å; L87-V89 HydrophobicContact CD1-CG1 3.86Å; V89-A91 PolarHBondContact O-N 3.19Å; V89-V94 HydrophobicContact CB-CG1 3.91Å; V89-V94 HydrophobicContact CG1-CG1 4.34Å; V89-V94 HydrophobicContact CG2-CG1 3.82Å; V89-V94 HydrophobicContact CG2-CG2 3.98Å
90	P	90.5	Very high	81	Confident	13 Å²	13	70.3 Å²	70.3	8%	0.084	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	132.7	169.7	-17.1	30.1	0	0	0	110.1	Y44 D71 W72 T92 Y93	Y44-P90 HydrophobicContact CD1-CG 4.02Å; Y44-P90 HydrophobicContact CE1-CG 3.89Å; D71-P90 CarbonylContact O-C 3.58Å; D71-P90 VanDerWaalsContact O-CA 3.24Å; D71-P90 WeakPolarHBondContact O-CA 3.3Å; W72-P90 HydrophobicContact CE3-CG 4.45Å; W72-P90 HydrophobicContact CH2-CG 4.15Å; W72-P90 HydrophobicContact CZ3-CG 3.93Å; P90-T92 PolarHBondContact O-N 2.99Å; P90-Y93 HydrophobicContact CB-CD1 3.82Å; P90-Y93 HydrophobicContact CB-CG 3.96Å; P90-Y93 HydrophobicContact CG-CD1 4.28Å; P90-Y93 HydrophobicContact CG-CD2 4.43Å; P90-Y93 HydrophobicContact CG-CG 4.07Å; P90-Y93 PolarHBondContact O-N 3.18Å
91	A	89.4	Confident	79.2	Confident	13 Å²	13	73.7 Å²	73.7	11%	0.107	41%	0.411	C	S	.	.	G	3₁₀ helix	trans	-62	-31.1	-177.7	0	0	0	0	0	113.1	A70 D71 W73 V89 Y93	A70-A91 WeakPolarHBondContact O-CB 3.42Å; D71-A91 PolarHBondContact O-N 3.11Å; W73-A91 HydrophobicContact CD2-CB 3.96Å; W73-A91 VanDerWaalsContact CE2-CB 3.49Å; W73-A91 HydrophobicContact CG-CB 4.22Å; W73-A91 HydrophobicContact CZ2-CB 3.82Å; V89-A91 PolarHBondContact O-N 3.19Å; A91-Y93 VanDerWaalsContact C-N 3.28Å; A91-Y93 PolarHBondContact O-N 3.11Å
92	T	90.6	Very high	77.3	Confident	118 Å²	118	77.7 Å²	77.7	72%	0.724	42%	0.42	S	S	*	.	G	3₁₀ helix	trans	-77.5	-9.2	176	45.6	0	0	0	0	113.9	P90	P90-T92 PolarHBondContact O-N 2.99Å
93	Y	88.9	Confident	75.6	Confident	89 Å²	89	78 Å²	78	35%	0.349	42%	0.419	S	S	.	.	G	3₁₀ helix	trans	-104.6	2.2	-177.6	-78.3	47.6	0	0	0	112.2	A40 Q41 Y42 Y44 P90 A91	A40-Y93 WeakPolarHBondContact CA-O 3.45Å; Q41-Y93 PolarHBondContact N-O 3.16Å; Y42-Y93 HydrophobicContact CD2-CD2 4.11Å; Y42-Y93 HydrophobicContact CD2-CE2 4.49Å; Y42-Y93 HydrophobicContact CD2-CG 4.17Å; Y42-Y93 HydrophobicContact CG-CD2 4.48Å; Y44-Y93 HydrophobicContact CD2-CD2 4.38Å; Y44-Y93 AromaticContact CD2-CE2 3.92Å; Y44-Y93 HydrophobicContact CD2-CE2 3.92Å; Y44-Y93 HydrophobicContact CG-CD2 4.29Å; Y44-Y93 HydrophobicContact CG-CE2 4.28Å; P90-Y93 HydrophobicContact CB-CD1 3.82Å; P90-Y93 HydrophobicContact CB-CG 3.96Å; P90-Y93 HydrophobicContact CG-CD1 4.28Å; P90-Y93 HydrophobicContact CG-CD2 4.43Å; P90-Y93 HydrophobicContact CG-CG 4.07Å; P90-Y93 PolarHBondContact O-N 3.18Å; A91-Y93 VanDerWaalsContact C-N 3.28Å; A91-Y93 PolarHBondContact O-N 3.11Å
94	V	89.9	Confident	73.6	Confident	10 Å²	10	73.3 Å²	73.3	6%	0.061	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	141.8	-177.9	-65.3	0	0	0	0	112.6	L38 E39 A40 W73 V89	L38-V94 HydrophobicContact CB-CB 4.32Å; L38-V94 HydrophobicContact CD1-CG2 4.24Å; L38-V94 HydrophobicContact CD2-CB 4.26Å; L38-V94 HydrophobicContact CD2-CG2 4.05Å; E39-V94 CarbonylContact O-C 3.45Å; E39-V94 VanDerWaalsContact O-CA 3.27Å; E39-V94 WeakPolarHBondContact O-CA 3.32Å; A40-V94 HydrophobicContact CB-CG1 4.36Å; W73-V94 HydrophobicContact CE3-CG2 3.82Å; W73-V94 HydrophobicContact CZ3-CG2 3.99Å; V89-V94 HydrophobicContact CB-CG1 3.91Å; V89-V94 HydrophobicContact CG1-CG1 4.34Å; V89-V94 HydrophobicContact CG2-CG1 3.82Å; V89-V94 HydrophobicContact CG2-CG2 3.98Å
95	T	90.9	Very high	71.5	Confident	58 Å²	58	76.3 Å²	76.3	36%	0.356	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	144.1	176.7	51.1	0	0	0	0	111	L38 E39 Q41	L38-T95 CarbonylContact C-O 3.56Å; L38-T95 VanDerWaalsContact CA-O 3.29Å; L38-T95 WeakPolarHBondContact CA-O 3.27Å; E39-T95 PolarHBondContact N-O 2.94Å; E39-T95 PolarHBondContact O-N 3.16Å; Q41-T95 HydrophobicContact CG-CG2 3.75Å; Q41-T95 PolarHBondContact NE2-OG1 3.49Å
96	E	90.3	Very high	69.1	Low	100 Å²	100	79.5 Å²	79.5	47%	0.467	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	128.9	173.1	-67.3	-179.2	-158.8	0	0	110.5	V36 V37 L38 K67	V36-E96 HydrophobicContact CG1-CB 4.24Å; V36-E96 HydrophobicContact CG1-CG 3.61Å; V37-E96 WeakPolarHBondContact O-CA 3.16Å; L38-E96 HydrophobicContact CD2-CB 4.44Å; L38-E96 HydrophobicContact CD2-CG 3.52Å; K67-E96 VanDerWaalsContact CE-OE1 3.25Å; K67-E96 WeakPolarHBondContact CE-OE1 3.48Å; K67-E96 IonicContact NZ-OE1 2.67Å; K67-E96 PolarHBondContact NZ-OE1 3.34Å
97	V	85.5	Confident	66.2	Low	34 Å²	34	87.2 Å²	87.2	21%	0.206	47%	0.472	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	129.2	-174.5	-179.8	0	0	0	0	110	V37 E39	V37-V97 PolarHBondContact O-N 2.77Å; E39-V97 HydrophobicContact CB-CG2 3.59Å
98	P	72.3	Confident	63.2	Low	107 Å²	107	94.4 Å²	94.4	70%	0.695	51%	0.509	S	S	*	.			trans	-67.9	143.5	180	27.8	-34.7	0	0	0	112.1	T100	P98-T100 PolarHBondContact O-N 2.83Å; P98-T100 VanDerWaalsContact O-N 3.12Å
99	I	63	Low	60	Low	79 Å²	79	94.7 Å²	94.7	41%	0.405	52%	0.519	S	S	.	.			trans	-82.2	89.6	179.1	-54.1	178.2	0	0	0	109.7	V31 T35 V37	V31-I99 HydrophobicContact CG1-CD1 4.43Å; T35-I99 WeakPolarHBondContact O-CD1 3.32Å; V37-I99 HydrophobicContact CG2-CD1 3.97Å; V37-I99 HydrophobicContact CG2-CG1 3.94Å
100	T	47.2	Very low	56.9	Low	101 Å²	101	101.2 Å²	101.2	62%	0.62	56%	0.56	S	S	*	*			trans	-83.3	133.9	164.5	44.9	0	0	0	0	110.6	P98 M102	P98-T100 PolarHBondContact O-N 2.83Å; P98-T100 VanDerWaalsContact O-N 3.12Å; T100-M102 PolarHBondContact O-N 3.15Å
101	P	39.5	Very low	53.8	Low	98 Å²	98	105.4 Å²	105.4	64%	0.636	59%	0.589	S	S	*	*			trans	-68.7	128.6	172.6	-17.6	31.4	0	0	0	111	V28	V28-P101 HydrophobicContact CG1-CB 4.27Å
102	M	31.1	Very low	50.7	Low	151 Å²	151	111.6 Å²	111.6	74%	0.744	63%	0.625	S	S	*	*			trans	-110.1	138.6	170.5	-78.9	-68.3	-69.2	0	0	110.3	T100	T100-M102 PolarHBondContact O-N 3.15Å
103	P	30.8	Very low	47.6	Very low	110 Å²	110	110.4 Å²	110.4	71%	0.714	62%	0.622	S	S	*	*	P	Polyproline II helix	trans	-70.2	145.2	175.8	29.8	-34.3	0	0	0	111.4
104	S	27.9	Very low	44.6	Very low	105 Å²	105	113 Å²	113	73%	0.734	64%	0.641	S	S	*	*	P	Polyproline II helix	trans	-83.1	126.6	-177.5	54.9	0	0	0	0	113
105	P	34.1	Very low	41.6	Very low	126 Å²	126	120.1 Å²	120.1	82%	0.818	67%	0.673	S	S	*	*	P	Polyproline II helix	trans	-62.1	144	160.5	-17.9	31.9	0	0	0	110.6
106	Q	29.7	Very low	38.5	Very low	192 Å²	192	122.3 Å²	122.3	90%	0.897	69%	0.691	S	S	*	*	P	Polyproline II helix	trans	-79.4	158.9	-178.2	-71.5	-177.6	-10.9	0	0	113.1
107	R	27.2	Very low	35.5	Very low	219 Å²	219	123.6 Å²	123.6	83%	0.826	70%	0.701	S	S	*	*	P	Polyproline II helix	trans	-84.4	119.5	-174.5	172.2	-174.5	-176.1	-176.2	1.9	111.2	V109	R107-V109 HydrophobicContact CG-CG2 3.85Å
108	L	25.6	Very low	32.7	Very low	176 Å²	176	129.4 Å²	129.4	92%	0.921	73%	0.728	S	S	*	*	P	Polyproline II helix	trans	-103.4	142.3	159.9	-82.7	166.9	0	0	0	110.1
109	V	25.6	Very low	30.5	Very low	88 Å²	88	132 Å²	132	53%	0.533	74%	0.735	S	S	.	*			trans	-141.5	138.5	-178.7	171.6	0	0	0	0	108	R107	R107-V109 HydrophobicContact CG-CG2 3.85Å
110	T	24.9	Very low	29.7	Very low	139 Å²	139	133.6 Å²	133.6	85%	0.853	75%	0.75	S	S	*	*			trans	62.6	152.9	179.2	42.7	0	0	0	0	115
111	S	24.7	Very low	28.8	Very low	101 Å²	101	139.6 Å²	139.6	71%	0.706	76%	0.762	S	S	*	*			cis	-147.8	154.3	17.1	42.4	0	0	0	0	113.7
112	V	25.5	Very low	28.3	Very low	142 Å²	142	141.1 Å²	141.1	86%	0.861	77%	0.769	S	S	*	*			trans	60.6	152.8	145.4	176.8	0	0	0	0	119.7
113	S	25.2	Very low	28	Very low	93 Å²	93	138.4 Å²	138.4	65%	0.65	77%	0.765	S	S	*	*			trans	-95.9	161.7	-177.8	48.9	0	0	0	0	113.8
114	L	26.1	Very low	27.8	Very low	145 Å²	145	141.3 Å²	141.3	76%	0.759	77%	0.773	S	S	*	*				172.8	142	116.8	-84.7	161.8	0	0	0	113.2
115	H	25.7	Very low	27.6	Very low	159 Å²	159	141.1 Å²	141.1	74%	0.736	77%	0.772	S	S	*	*			trans	32	124.6	158.3	-67.1	-69.3	0	0	0	126.1
116	S	25.9	Very low	27.9	Very low	103 Å²	103	141 Å²	141	72%	0.72	77%	0.771	S	S	*	*				77.6	160.1	128.7	83.3	0	0	0	0	119.5
117	N	29.1	Very low	27.7	Very low	127 Å²	127	136.5 Å²	136.5	68%	0.679	76%	0.761	S	S	*	*			cis	-159.6	158.6	4.9	-137.1	-2.4	0	0	0	114.9
118	M	26	Very low	27.7	Very low	157 Å²	157	135.2 Å²	135.2	77%	0.773	76%	0.762	S	S	*	*			trans	75.5	162.9	151.9	-64.6	-59.1	159.3	0	0	125
119	L	26.5	Very low	27.8	Very low	161 Å²	161	132.9 Å²	132.9	84%	0.843	76%	0.755	S	S	*	*			trans	-112.7	-155.1	-170.6	-62.1	166.7	0	0	0	109.8
120	P	45.1	Very low	27.8	Very low	112 Å²	112	132.5 Å²	132.5	73%	0.727	77%	0.769	S	S	*	*			cis	-149.3	149.2	-1.5	40.3	-17.4	0	0	0	121.4
121	R	28.1	Very low	27.9	Very low	228 Å²	228	133.1 Å²	133.1	86%	0.86	77%	0.772	S	S	*	*				67.7	155.1	125.6	-152.8	-171.4	-168.1	173	4	124
122	V	28.8	Very low	28.1	Very low	129 Å²	129	131.8 Å²	131.8	78%	0.782	77%	0.774	S	S	*	*			trans	67.8	154.2	162.7	-90.7	0	0	0	0	119.6
123	S	25	Very low	28.1	Very low	95 Å²	95	136.3 Å²	136.3	66%	0.664	78%	0.776	S	S	*	*			cis	-167.5	157.9	-1.3	37	0	0	0	0	115.5
124	L	26.8	Very low	28.2	Very low	171 Å²	171	137.3 Å²	137.3	90%	0.895	77%	0.774	S	S	*	*			trans	80	166.2	144.1	-76.5	164.4	0	0	0	123.8
125	S	23.3	Very low	28.3	Very low	101 Å²	101	137.1 Å²	137.1	71%	0.706	77%	0.77	S	S	*	*			trans	-118.8	-168.5	-170.5	59.6	0	0	0	0	110.6
126	P	41.7	Very low	28.4	Very low	123 Å²	123	137.4 Å²	137.4	80%	0.799	77%	0.771	S	S	*	*			cis	-140.2	-146.5	11.9	45.1	-22.3	0	0	0	116.1
127	S	25.9	Very low	28.4	Very low	97 Å²	97	138.8 Å²	138.8	68%	0.678	78%	0.781	S	S	*	*			trans	-88.3	164.6	-168.2	54.4	0	0	0	0	117.5
128	F	26	Very low	28.2	Very low	193 Å²	193	141.2 Å²	141.2	85%	0.846	79%	0.788	S	S	*	*				-167.8	-179	126.3	-120.1	-90.4	0	0	0	113.9
129	T	27.1	Very low	28.1	Very low	127 Å²	127	139.2 Å²	139.2	78%	0.779	79%	0.785	S	S	*	*			trans	-64.8	156.8	-168.3	51.2	0	0	0	0	118.8
130	G	27.2	Very low	27.9	Very low	80 Å²	80	138.5 Å²	138.5	83%	0.825	78%	0.781	S	S	*	*			trans	-176.5	142	159.3	0	0	0	0	0	115.2
131	T	27.1	Very low	27.2	Very low	151 Å²	151	142.4 Å²	142.4	93%	0.926	79%	0.787	S	S	*	*			trans	-99.9	143.4	179.1	49.6	0	0	0	0	113.2
132	G	27.2	Very low	27.5	Very low	73 Å²	73	136.8 Å²	136.8	75%	0.753	78%	0.78	S	S	*	*			trans	133.1	106	145	0	0	0	0	0	119.6
133	R	25.7	Very low	27.3	Very low	237 Å²	237	138.2 Å²	138.2	89%	0.894	78%	0.78	S	S	*	*				60.1	123.1	129.3	-158.1	174.1	-171.9	-172.1	3.2	122
134	N	28.5	Very low	27.3	Very low	114 Å²	114	140.8 Å²	140.8	61%	0.61	78%	0.78	S	S	*	*			trans	64.9	111.4	155	-76.6	59.2	0	0	0	122
135	E	27.5	Very low	27.3	Very low	142 Å²	142	142.2 Å²	142.2	66%	0.664	77%	0.773	S	S	*	*				75.7	136.9	123.5	-71.6	-167.5	89.1	0	0	124.5
136	Q	27.2	Very low	27.4	Very low	165 Å²	165	141.4 Å²	141.4	77%	0.771	77%	0.767	S	S	*	*			trans	58.7	103.9	149.4	-64.1	175.7	42.1	0	0	119.6
137	S	26.1	Very low	26.6	Very low	132 Å²	132	142.2 Å²	142.2	92%	0.923	76%	0.762	S	S	*	*				-174.2	178	120.5	44.4	0	0	0	0	113.1
138	Q	25.8	Very low	26.8	Very low	178 Å²	178	145.3 Å²	145.3	83%	0.832	77%	0.766	S	S	*	*			trans	-89.2	161.3	-160.1	-68	-178.8	-16.3	0	0	116.5
139	V	23.8	Very low	27	Very low	115 Å²	115	141.9 Å²	141.9	70%	0.697	76%	0.757	S	S	*	*			trans	87.1	140.6	131.9	152.2	0	0	0	0	121.8
140	N	23.1	Very low	27	Very low	145 Å²	145	142.2 Å²	142.2	78%	0.775	75%	0.753	S	S	*	*			trans	72.4	106.6	161	-76.3	-14.2	0	0	0	123.5
141	K	29.4	Very low	26.9	Very low	194 Å²	194	145 Å²	145	84%	0.843	75%	0.749	S	S	*	*			trans	-31.3	150.3	137.1	-59.1	170.7	174.3	174.6	0	113.7
142	P	34.5	Very low	26.9	Very low	111 Å²	111	144 Å²	144	72%	0.721	74%	0.743	S	S	*	*				-139	140.5	90.9	39.1	-25.9	0	0	0	113.4
143	M	24.8	Very low	26.9	Very low	158 Å²	158	149.3 Å²	149.3	78%	0.778	75%	0.745	S	S	*	*				68.4	152.1	99	-61.9	-161.4	-174.9	0	0	116.2
144	F	23.9	Very low	27	Very low	150 Å²	150	144.5 Å²	144.5	66%	0.658	74%	0.738	S	S	*	*			cis	-167.3	154.3	-14.2	-122.4	-157.5	0	0	0	109
145	R	26.6	Very low	26.9	Very low	201 Å²	201	144.5 Å²	144.5	76%	0.758	75%	0.746	S	S	*	*			trans	60.8	169.5	149.9	-70.8	-178.2	-174.9	-148.2	-1.7	117.2
146	S	26.9	Very low	26.9	Very low	83 Å²	83	141.9 Å²	141.9	58%	0.58	75%	0.749	S	S	*	*			cis	-138.6	138.8	-11.5	-118.3	0	0	0	0	106.6
147	M	24.5	Very low	26.7	Very low	140 Å²	140	143.1 Å²	143.1	69%	0.69	75%	0.752	S	S	*	*				73.7	138.1	75	-158.3	-169.4	-67.4	0	0	113.1
148	E	30.2	Very low	26.7	Very low	162 Å²	162	144.7 Å²	144.7	76%	0.757	75%	0.745	S	S	*	*			trans	76.9	140.4	175	-52.5	-158.5	-144.2	0	0	115.9
149	N	29.3	Very low	26.6	Very low	122 Å²	122	147.4 Å²	147.4	65%	0.652	75%	0.748	S	S	*	*			cis	-161.4	169.2	-13	-124.3	-44.2	0	0	0	112.3
150	L	27	Very low	26.8	Very low	133 Å²	133	146.5 Å²	146.5	70%	0.696	75%	0.746	S	S	*	*			trans	65.7	113.1	153.8	-68.8	162.5	0	0	0	122.7
151	N	26.6	Very low	27.1	Very low	140 Å²	140	148.1 Å²	148.1	75%	0.749	75%	0.749	S	S	*	*				63.1	135.2	121.8	-70.6	0.4	0	0	0	125.2
152	T	26.4	Very low	27	Very low	130 Å²	130	149.5 Å²	149.5	80%	0.798	75%	0.749	S	S	*	*			trans	95.8	126.1	141.3	-57.9	0	0	0	0	120.9
153	F	28	Very low	26.7	Very low	183 Å²	183	150.3 Å²	150.3	80%	0.803	75%	0.748	S	S	*	*			trans	-15.8	141.5	163.9	-82	-97	0	0	0	122.2
154	N	26.4	Very low	26.9	Very low	137 Å²	137	148.4 Å²	148.4	73%	0.733	75%	0.745	S	S	*	*			trans	70.5	116	139.1	-76.2	1.8	0	0	0	122.5
155	S	26.7	Very low	27.1	Very low	113 Å²	113	147.2 Å²	147.2	79%	0.79	75%	0.75	S	S	*	*				103	130.1	124	74.3	0	0	0	0	120.9
156	A	27	Very low	27.2	Very low	88 Å²	88	144.5 Å²	144.5	73%	0.727	76%	0.755	S	S	*	*			trans	57.5	101	145	0	0	0	0	0	120.9
157	F	24.3	Very low	27.2	Very low	191 Å²	191	144.2 Å²	144.2	84%	0.838	77%	0.765	S	S	*	*			trans	-153.1	146.4	140.9	-88.3	-46.3	0	0	0	109.6
158	Q	26.7	Very low	27.3	Very low	165 Å²	165	145.5 Å²	145.5	77%	0.771	77%	0.77	S	S	*	*			cis	-150.4	152.8	-16.8	-162.4	162.3	10.5	0	0	110.5
159	R	23.6	Very low	27.1	Very low	235 Å²	235	143 Å²	143	89%	0.887	76%	0.762	S	S	*	*			trans	-76.8	138.1	169.7	-178	178.2	179.5	163.9	0.7	110
160	S	27.4	Very low	27	Very low	96 Å²	96	145.3 Å²	145.3	67%	0.671	77%	0.768	S	S	*	*			trans	-67.6	137.1	170.1	-172.1	0	0	0	0	110.9
161	E	28.6	Very low	26.9	Very low	179 Å²	179	148.2 Å²	148.2	84%	0.836	78%	0.775	S	S	*	*				172.3	161.3	112.8	-95.9	173.4	-152.6	0	0	114.7
162	R	26.8	Very low	28.3	Very low	222 Å²	222	146.6 Å²	146.6	84%	0.838	77%	0.773	S	S	*	*			trans	-148.8	144.6	162.7	-89.1	-172.2	-83.7	155.8	-6.5	105
163	N	29.1	Very low	28.3	Very low	129 Å²	129	146.7 Å²	146.7	69%	0.69	77%	0.773	S	S	*	*			cis	-163.8	166.5	10.3	-130.9	9.8	0	0	0	111.8
164	T	28	Very low	28.5	Very low	118 Å²	118	145.3 Å²	145.3	72%	0.724	77%	0.773	S	S	*	*			trans	69.9	127.7	146.2	43.8	0	0	0	0	124.6
165	V	28.3	Very low	29.7	Very low	125 Å²	125	143.8 Å²	143.8	76%	0.758	77%	0.771	S	S	*	*			trans	96.7	104.3	135.8	171.9	0	0	0	0	121.4
166	V	28.8	Very low	29.9	Very low	143 Å²	143	146 Å²	146	87%	0.867	77%	0.773	S	S	*	*			trans	22.3	127.4	133.6	-164.9	0	0	0	0	120.1
167	G	27.5	Very low	29.9	Very low	77 Å²	77	147.2 Å²	147.2	79%	0.794	78%	0.776	S	S	*	*			trans	-173.8	124.9	164.1	0	0	0	0	0	114.1
168	E	25.8	Very low	30.1	Very low	168 Å²	168	141 Å²	141	79%	0.785	77%	0.766	S	S	*	*			trans	-76.3	167.9	-174.3	-90.6	179.4	85.8	0	0	117.9
169	N	27.2	Very low	30.2	Very low	110 Å²	110	142.6 Å²	142.6	59%	0.588	77%	0.771	S	S	*	*			trans	76.5	115.1	141.4	-69	-29.6	0	0	0	124.2
170	H	27.7	Very low	30.4	Very low	170 Å²	170	136.7 Å²	136.7	79%	0.787	76%	0.761	S	S	*	*				67.3	154.1	129.3	-63.7	99.2	0	0	0	124.5
171	F	23.8	Very low	30.4	Very low	193 Å²	193	141.9 Å²	141.9	85%	0.846	77%	0.772	S	S	*	*			trans	-68.3	-179.5	173.9	-76.2	-84.8	0	0	0	114.5
172	P	56.8	Low	30.5	Very low	107 Å²	107	139.2 Å²	139.2	70%	0.695	77%	0.768	S	S	*	*			cis	-137.9	-162.6	-24.9	28.9	-5.1	0	0	0	114.2
173	T	25	Very low	31.4	Very low	131 Å²	131	134.2 Å²	134.2	80%	0.804	77%	0.765	S	S	*	*			trans	103.7	144.1	144.5	-14.3	0	0	0	0	120.6
174	L	34.1	Very low	31.4	Very low	154 Å²	154	132.6 Å²	132.6	81%	0.806	76%	0.763	S	S	*	*			trans	-87.1	-174.9	166.8	-64.1	170.7	0	0	0	109.6
175	P	51.2	Low	31.5	Very low	106 Å²	106	131.8 Å²	131.8	69%	0.688	76%	0.762	S	S	*	*			cis	-152.8	-173.4	16.5	44.8	-22.4	0	0	0	120.3
176	L	29.9	Very low	31.7	Very low	158 Å²	158	130.3 Å²	130.3	83%	0.827	76%	0.757	S	S	*	*			trans	87.2	147.9	140.3	-92.4	168.6	0	0	0	124.9
177	S	27.7	Very low	31.8	Very low	115 Å²	115	130.1 Å²	130.1	80%	0.804	76%	0.757	S	S	*	*			trans	89.2	133.1	164.4	-43.4	0	0	0	0	118.4
178	G	27.4	Very low	31.9	Very low	61 Å²	61	131.8 Å²	131.8	63%	0.629	76%	0.756	S	S	*	*			cis	168.4	158.6	-12.3	0	0	0	0	0	115.2
179	F	30.3	Very low	32	Very low	197 Å²	197	132.2 Å²	132.2	86%	0.864	76%	0.758	S	S	*	*			trans	64.2	160.1	160	-58.1	-76.8	0	0	0	120.2
180	T	28.1	Very low	32.1	Very low	112 Å²	112	131.9 Å²	131.9	69%	0.687	76%	0.764	S	S	*	*				-175.2	147.2	-58.3	33	0	0	0	0	109.8
181	F	26	Very low	32.1	Very low	205 Å²	205	128.1 Å²	128.1	90%	0.899	76%	0.757	S	S	*	*			trans	-168.5	159.5	139.6	-110.3	-71.6	0	0	0	112.8
182	T	31.2	Very low	32.3	Very low	123 Å²	123	127 Å²	127	76%	0.755	75%	0.754	S	S	*	*			trans	-145.1	-178	-167.4	50.6	0	0	0	0	109.7
183	P	46.6	Very low	31	Very low	117 Å²	117	128.6 Å²	128.6	76%	0.76	76%	0.756	S	S	*	*			cis	-118.4	-156.7	12.4	30.3	-4.3	0	0	0	112.2
184	S	28.3	Very low	31.1	Very low	94 Å²	94	131.2 Å²	131.2	66%	0.657	76%	0.762	S	S	*	*			cis	-147.6	168.9	15.4	-56.1	0	0	0	0	110.1
185	S	31	Very low	31	Very low	101 Å²	101	130.3 Å²	130.3	71%	0.706	76%	0.763	S	S	*	*			cis	77.2	148.8	22.8	113.9	0	0	0	0	114.7
186	S	31.9	Very low	30.6	Very low	94 Å²	94	131.3 Å²	131.3	66%	0.657	77%	0.769	S	S	*	*			cis	-177.6	153.1	-6.2	34.7	0	0	0	0	110.4
187	T	31.6	Very low	30.4	Very low	139 Å²	139	127.3 Å²	127.3	85%	0.853	77%	0.766	S	S	*	*			cis	-172	147.2	-15.9	27.8	0	0	0	0	109.5
188	S	28.8	Very low	30.6	Very low	112 Å²	112	127.6 Å²	127.6	78%	0.783	77%	0.768	S	S	*	*			trans	-165.2	163.3	172.5	50.9	0	0	0	0	110.3
189	Q	28.1	Very low	31.4	Very low	178 Å²	178	130.5 Å²	130.5	83%	0.832	78%	0.775	S	S	*	*			cis	-150.8	140.5	-26.5	-104.8	-179.1	20.9	0	0	105.9
190	S	27.8	Very low	31.2	Very low	102 Å²	102	125.4 Å²	125.4	71%	0.713	77%	0.77	S	S	*	*				63.3	124.3	78.9	-158.1	0	0	0	0	115.7
191	S	29.3	Very low	31.3	Very low	91 Å²	91	124.8 Å²	124.8	64%	0.636	78%	0.776	S	S	*	*			cis	-171.7	178.4	-18.3	44.4	0	0	0	0	111
192	H	28.1	Very low	31.4	Very low	169 Å²	169	120.2 Å²	120.2	78%	0.782	77%	0.769	S	S	*	*			trans	71.8	158.1	172.4	-75.1	-105.4	0	0	0	119.4
193	L	28.4	Very low	31.4	Very low	141 Å²	141	123.5 Å²	123.5	74%	0.738	78%	0.779	S	S	*	*			cis	-179.8	129.5	-48.4	-121.5	170.5	0	0	0	110.3
194	M	26.6	Very low	30.7	Very low	186 Å²	186	123.6 Å²	123.6	92%	0.916	78%	0.777	S	S	*	*			trans	-175.3	143.6	142.1	-112.8	-175	177.6	0	0	116.1
195	V	33	Very low	31.1	Very low	136 Å²	136	127.5 Å²	127.5	82%	0.824	79%	0.785	S	S	*	*			trans	-158.6	144.8	172.8	-175.9	0	0	0	0	103.5
196	P	43.3	Very low	31	Very low	126 Å²	126	126.2 Å²	126.2	82%	0.818	78%	0.78	S	S	*	*			cis	-141.3	-171.6	36.9	43.7	-24.7	0	0	0	116.3
197	G	25.6	Very low	30.9	Very low	74 Å²	74	128.5 Å²	128.5	76%	0.763	79%	0.786	S	S	*	*			trans	159	106.2	154.4	0	0	0	0	0	118
198	S	31	Very low	30.8	Very low	121 Å²	121	126 Å²	126	85%	0.846	77%	0.774	S	S	*	*			trans	-139.3	150.3	155.7	-58.2	0	0	0	0	107.7
199	P	43.7	Very low	30.8	Very low	122 Å²	122	126.4 Å²	126.4	79%	0.792	78%	0.776	S	S	*	*				-155.8	177.6	101.6	40.8	-23.2	0	0	0	116.1
200	A	27.6	Very low	31	Very low	91 Å²	91	125.1 Å²	125.1	75%	0.752	78%	0.775	S	S	*	*			trans	62.8	121.4	154.4	0	0	0	0	0	118.7
201	A	29.5	Very low	31.9	Very low	99 Å²	99	125.1 Å²	125.1	82%	0.818	77%	0.773	S	S	*	*				78	140.7	59.9	0	0	0	0	0	113.2
202	S	28.1	Very low	31.9	Very low	108 Å²	108	131.7 Å²	131.7	76%	0.755	78%	0.784	S	S	*	*			cis	-157.2	161.4	0.1	45.1	0	0	0	0	112.1
203	M	31.1	Very low	32	Very low	193 Å²	193	129.8 Å²	129.8	95%	0.951	78%	0.783	S	S	*	*			trans	-119.8	146.3	157.2	-87.4	-163.6	157.9	0	0	110.7
204	T	31.5	Very low	32.1	Very low	118 Å²	118	128.4 Å²	128.4	72%	0.724	78%	0.781	S	S	*	*			trans	-149.6	154.5	173.5	50.1	0	0	0	0	107.7
205	Q	36.1	Very low	32.9	Very low	176 Å²	176	125.6 Å²	125.6	82%	0.822	78%	0.776	S	S	*	*			cis	-153.3	171	0.3	-129.1	-173.4	108.2	0	0	107.2
206	A	30.3	Very low	32.6	Very low	74 Å²	74	124.7 Å²	124.7	61%	0.612	77%	0.771	S	S	*	*			cis	-145	-149.4	5	0	0	0	0	0	107.8
207	N	28.9	Very low	31.9	Very low	143 Å²	143	125.7 Å²	125.7	77%	0.765	77%	0.768	S	S	*	*			cis	-158.8	-175.7	4.7	-153.7	-5.1	0	0	0	111.8
208	S	30.9	Very low	32	Very low	87 Å²	87	128.5 Å²	128.5	61%	0.608	77%	0.771	S	S	*	*			trans	0.2	139	152.7	59.1	0	0	0	0	120.4
209	S	28.9	Very low	31.7	Very low	119 Å²	119	133.8 Å²	133.8	83%	0.832	77%	0.772	S	S	*	*			cis	-168.5	149	-4.3	45.2	0	0	0	0	114.2
210	N	32.1	Very low	30.9	Very low	151 Å²	151	132.5 Å²	132.5	81%	0.807	77%	0.766	S	S	*	*			trans	-30.7	172.3	162.5	-103.4	-27.6	0	0	0	119.9
211	P	46.1	Very low	30.8	Very low	102 Å²	102	136.6 Å²	136.6	66%	0.662	77%	0.77	S	S	*	*			cis	-145.2	163.7	-6.3	37.3	-16.9	0	0	0	119.3
212	R	29.9	Very low	30.5	Very low	230 Å²	230	136.1 Å²	136.1	87%	0.868	76%	0.761	S	S	*	*			trans	57.6	155.6	136.9	-76.5	-170.2	165.6	163.1	-3.2	123.5
213	V	29	Very low	30.4	Very low	128 Å²	128	136.1 Å²	136.1	78%	0.776	76%	0.76	S	S	*	*			cis	-165.4	167.1	-29.6	104.1	0	0	0	0	111.3
214	V	31.1	Very low	30.1	Very low	112 Å²	112	131.6 Å²	131.6	68%	0.679	75%	0.748	S	S	*	*			trans	-79.8	173	-179.3	-142.1	0	0	0	0	113.8
215	P	42.7	Very low	29.8	Very low	127 Å²	127	133 Å²	133	83%	0.825	75%	0.751	S	S	*	*				-146.5	-170.8	106.7	40.3	-24.4	0	0	0	115.6
216	T	26.4	Very low	29.5	Very low	118 Å²	118	132.2 Å²	132.2	72%	0.724	75%	0.752	S	S	*	*			trans	-141.6	160.8	-153.9	-15.6	0	0	0	0	114.3
217	I	29.5	Very low	30.1	Very low	147 Å²	147	133.6 Å²	133.6	75%	0.754	75%	0.754	S	S	*	*			trans	72.2	120.9	158.4	-57.2	154.1	0	0	0	118.5
218	T	27.1	Very low	29.9	Very low	133 Å²	133	133.9 Å²	133.9	82%	0.816	75%	0.751	S	S	*	*				-174.5	129.3	117.5	31.7	0	0	0	0	115.4
219	R	25.8	Very low	29.7	Very low	231 Å²	231	136.1 Å²	136.1	87%	0.872	76%	0.756	S	S	*	*			trans	31.9	134.5	133.5	-138.1	-170	-178.8	165.4	-1.3	123.7
220	S	25.7	Very low	29.6	Very low	96 Å²	96	138.2 Å²	138.2	67%	0.671	76%	0.757	S	S	*	*			trans	73.7	121.3	138.1	47.7	0	0	0	0	124.8
221	Q	25.3	Very low	29.3	Very low	177 Å²	177	137.7 Å²	137.7	83%	0.827	75%	0.754	S	S	*	*				69.8	124.8	129.6	-71.2	-141	26	0	0	123.8
222	S	24.6	Very low	28.4	Very low	89 Å²	89	142.2 Å²	142.2	62%	0.622	77%	0.766	S	S	*	*				76.3	108.7	128.1	-58.4	0	0	0	0	122.5
223	S	25.4	Very low	28.5	Very low	107 Å²	107	137.9 Å²	137.9	75%	0.748	76%	0.761	S	S	*	*				77.2	132.5	124.7	-55.4	0	0	0	0	123.5
224	S	25.1	Very low	29.4	Very low	98 Å²	98	137 Å²	137	69%	0.685	76%	0.758	S	S	*	*			trans	67.5	117.9	139.6	55.3	0	0	0	0	123.2
225	N	25.9	Very low	29.3	Very low	147 Å²	147	141.4 Å²	141.4	79%	0.786	76%	0.764	S	S	*	*				53.1	120.9	127.3	-54.2	-26.4	0	0	0	122.3
226	L	29.4	Very low	28.7	Very low	161 Å²	161	141.6 Å²	141.6	84%	0.843	76%	0.758	S	S	*	*				46.9	158.9	123.6	-71.3	168	0	0	0	121.1
227	P	41.3	Very low	29.1	Very low	102 Å²	102	143 Å²	143	66%	0.662	76%	0.756	S	S	*	*			cis	-119.4	-144.2	16.3	30.4	-5.6	0	0	0	111.4
228	E	26.2	Very low	29.2	Very low	150 Å²	150	142 Å²	142	70%	0.701	76%	0.756	S	S	*	*			cis	-152	-135.1	5.7	-163.7	39.6	-87.2	0	0	111.8
229	N	26.8	Very low	29.2	Very low	133 Å²	133	138.9 Å²	138.9	71%	0.711	75%	0.751	S	S	*	*			trans	-140.2	161.5	-166.1	-85.5	-79.6	0	0	0	114.2
230	L	25.6	Very low	29.2	Very low	164 Å²	164	131.2 Å²	131.2	86%	0.859	74%	0.743	S	S	*	*			trans	153.1	125	141.7	-82.2	164.9	0	0	0	108.6
231	N	27.3	Very low	29.3	Very low	140 Å²	140	132.9 Å²	132.9	75%	0.749	76%	0.755	S	S	*	*			cis	109.8	102.3	13.3	-177.4	95.4	0	0	0	113.6
232	E	26.4	Very low	29.5	Very low	196 Å²	196	132.6 Å²	132.6	92%	0.916	76%	0.759	S	S	*	*			trans	-165.8	153.3	153.5	-124.5	171.6	-150.4	0	0	113.4
233	N	31.2	Very low	29.6	Very low	140 Å²	140	131.6 Å²	131.6	75%	0.749	76%	0.762	S	S	*	*			trans	-172.1	125.1	-177.1	179.9	97.8	0	0	0	114.2
234	P	49.1	Very low	29.7	Very low	110 Å²	110	131.1 Å²	131.1	71%	0.714	76%	0.759	S	S	*	*			trans	-121.5	137.6	162.3	12.6	10.3	0	0	0	113.4
235	Y	28.8	Very low	29.8	Very low	204 Å²	204	136.8 Å²	136.8	80%	0.8	77%	0.765	S	S	*	*				76	145	73.9	-79.3	-54.8	0	0	0	115.2
236	D	30.7	Very low	30	Very low	131 Å²	131	137 Å²	137	70%	0.701	77%	0.765	S	S	*	*			cis	-163.4	-179.2	-12.6	-138.9	9.3	0	0	0	107.8
237	E	33.7	Very low	29.8	Very low	146 Å²	146	135.7 Å²	135.7	68%	0.682	76%	0.758	S	S	*	*			cis	-160.4	-163.3	-8.9	-146	-78.5	91.3	0	0	106.6
238	V	31	Very low	29.2	Very low	126 Å²	126	141.1 Å²	141.1	76%	0.764	77%	0.767	S	S	*	*			trans	80.9	118.8	165.4	-164.6	0	0	0	0	115.1
239	G	28.2	Very low	29.2	Very low	68 Å²	68	143 Å²	143	70%	0.701	77%	0.773	S	S	*	*			cis	133.3	137.4	-0.8	0	0	0	0	0	111.4
240	G	26.7	Very low	29.6	Very low	70 Å²	70	143 Å²	143	72%	0.722	78%	0.778	S	S	*	*			cis	-179.2	-168	-1.7	0	0	0	0	0	112
241	S	27.7	Very low	29.9	Very low	131 Å²	131	141.1 Å²	141.1	92%	0.916	78%	0.775	S	S	*	*			trans	73.3	145.1	-174.2	-55.9	0	0	0	0	116.2
242	L	28.9	Very low	30.1	Very low	172 Å²	172	143.9 Å²	143.9	90%	0.901	78%	0.781	S	S	*	*			cis	-127.7	145.7	10	-177.8	67.4	0	0	0	111.4
243	G	26.8	Very low	30.1	Very low	68 Å²	68	144.9 Å²	144.9	70%	0.701	78%	0.782	S	S	*	*			trans	-96.9	-168.9	-175.7	0	0	0	0	0	116
244	S	27.8	Very low	29.9	Very low	96 Å²	96	144 Å²	144	67%	0.671	79%	0.786	S	S	*	*			cis	-161.1	162.9	4.9	72.3	0	0	0	0	114.2
245	R	26.6	Very low	28.8	Very low	218 Å²	218	144.5 Å²	144.5	82%	0.823	79%	0.791	S	S	*	*			trans	76.9	139.7	160	-59.3	166.4	-161.9	-118.8	1.1	117.6
246	I	29.8	Very low	28.8	Very low	151 Å²	151	140 Å²	140	77%	0.774	79%	0.79	S	S	*	*			cis	-144.2	149.3	-11.4	-104.6	155	0	0	0	107.4
247	N	26.1	Very low	28.6	Very low	133 Å²	133	141.1 Å²	141.1	71%	0.711	79%	0.791	S	S	*	*			trans	-108.1	152.1	177.2	-149.7	-16.9	0	0	0	109.6
248	Y	27.1	Very low	28.3	Very low	216 Å²	216	146.1 Å²	146.1	85%	0.847	80%	0.804	S	S	*	*			trans	170.3	161.6	135.4	-87.5	-50.8	0	0	0	115.5
249	K	26.5	Very low	28.2	Very low	190 Å²	190	146.1 Å²	146.1	83%	0.826	80%	0.799	S	S	*	*			trans	-65	153.3	-156	-69.6	166.6	172.7	172.9	0	118.5
250	V	35.7	Very low	28.5	Very low	134 Å²	134	149.1 Å²	149.1	81%	0.812	80%	0.804	S	S	*	*			trans	-45.3	156.1	161.7	-147.4	0	0	0	0	114.4
251	P	31	Very low	28.6	Very low	123 Å²	123	153 Å²	153	80%	0.799	81%	0.813	S	S	*	*				-132.9	163.8	121.6	38.2	-30.7	0	0	0	115.4
252	K	33	Very low	28.7	Very low	199 Å²	199	149.7 Å²	149.7	87%	0.865	80%	0.8	S	S	*	*			trans	-65.3	147.1	-173.6	-55.5	170	-179	174.8	0	113.9
253	K	25.7	Very low	28.6	Very low	216 Å²	216	146.6 Å²	146.6	94%	0.939	80%	0.799	S	S	*	*			trans	-166.8	157.4	136.7	-108.7	159.3	-171.7	177.2	0	112.2
254	S	27.2	Very low	28.7	Very low	121 Å²	121	149.4 Å²	149.4	85%	0.846	81%	0.808	S	S	*	*			trans	-107.3	132.6	174.1	177.1	0	0	0	0	110.1
255	C	25.2	Very low	28.7	Very low	121 Å²	121	148.2 Å²	148.2	82%	0.818	81%	0.811	S	S	*	*			trans	-167.9	158.6	143	-157.3	0	0	0	0	110.2
256	S	29.8	Very low	28.8	Very low	109 Å²	109	149.7 Å²	149.7	76%	0.762	82%	0.816	S	S	*	*			trans	-83	132.8	170.4	53.9	0	0	0	0	111.8
257	Q	25.9	Very low	28.9	Very low	156 Å²	156	149.8 Å²	149.8	73%	0.729	82%	0.819	S	S	*	*			trans	-140.9	126	169.6	-174.8	171.2	-9.2	0	0	110.2	D259	Q257-D259 PolarHBondContact NE2-OD2 3.17Å
258	W	28.6	Very low	28.9	Very low	251 Å²	251	151.1 Å²	151.1	95%	0.951	83%	0.826	S	S	*	*			trans	-119.4	121.2	164.5	-80.6	110.6	0	0	0	107.4
259	D	27.3	Very low	28.8	Very low	126 Å²	126	150.7 Å²	150.7	67%	0.674	82%	0.823	S	S	*	*			trans	-113.6	151.2	-179.8	-117.3	-55.1	0	0	0	111.9	Q257	Q257-D259 PolarHBondContact NE2-OD2 3.17Å
260	V	34.7	Very low	28.7	Very low	130 Å²	130	147.9 Å²	147.9	79%	0.788	82%	0.816	S	S	*	*			trans	-138.4	109.5	-168	179.4	0	0	0	0	111.8
261	V	29.9	Very low	28.2	Very low	151 Å²	151	149 Å²	149	92%	0.915	81%	0.812	S	S	*	*			trans	-146.5	137.7	166	-170.5	0	0	0	0	108.7
262	G	29.3	Very low	28	Very low	62 Å²	62	149.1 Å²	149.1	64%	0.639	81%	0.811	S	S	*	*			cis	160.8	-174.3	-6.7	0	0	0	0	0	112.8
263	A	27.7	Very low	28.2	Very low	107 Å²	107	145 Å²	145	88%	0.884	80%	0.804	S	S	*	*			trans	68.1	154.9	171.5	0	0	0	0	0	118.4
264	S	28	Very low	28.3	Very low	127 Å²	127	141.7 Å²	141.7	89%	0.888	80%	0.802	S	S	*	*			cis	-169.4	138.7	-29.9	-176.5	0	0	0	0	109.5
265	G	27.3	Very low	28.4	Very low	72 Å²	72	144.7 Å²	144.7	74%	0.742	80%	0.803	S	S	*	*			trans	-178.4	117.8	177.6	0	0	0	0	0	116.5
266	R	29.3	Very low	28.5	Very low	248 Å²	248	143.3 Å²	143.3	94%	0.936	80%	0.8	S	S	*	*			trans	-67.3	140.6	-178.1	-60.4	166	-170.9	172.4	2	111.5
267	N	31.8	Very low	28.3	Very low	153 Å²	153	147.8 Å²	147.8	82%	0.818	80%	0.802	S	S	*	*			cis	87.4	100.6	48.7	-86.1	-1.9	0	0	0	116.6
268	N	26.7	Very low	28.2	Very low	161 Å²	161	148.2 Å²	148.2	86%	0.861	81%	0.807	S	S	*	*			trans	-179.9	149.7	152.5	-98.9	-27.2	0	0	0	107.9
269	R	24.5	Very low	28.1	Very low	207 Å²	207	140.4 Å²	140.4	78%	0.781	79%	0.791	S	S	*	*			cis	-166.1	163.3	-20.6	-167.4	-174.2	165.7	170.5	-4.7	106.8
270	L	25	Very low	28	Very low	132 Å²	132	143.5 Å²	143.5	69%	0.691	80%	0.801	S	S	*	*			trans	76.3	149.2	164.8	-47.6	170.8	0	0	0	118.5
271	Q	24.6	Very low	27.7	Very low	156 Å²	156	145.7 Å²	145.7	73%	0.729	81%	0.808	S	S	*	*			cis	-167.4	123.3	-33.6	-159.9	165	-13.7	0	0	111.9
272	V	26.7	Very low	27.5	Very low	127 Å²	127	142.8 Å²	142.8	77%	0.77	79%	0.794	S	S	*	*			trans	58.4	164.5	140.3	176.7	0	0	0	0	120.1
273	P	37.6	Very low	27.3	Very low	111 Å²	111	151.6 Å²	151.6	72%	0.721	81%	0.808	S	S	*	*			cis	-114.4	168.2	-23	29.6	-13.9	0	0	0	114.2
274	T	26.8	Very low	27.2	Very low	147 Å²	147	154.5 Å²	154.5	90%	0.902	80%	0.803	S	S	*	*			trans	-162.5	122.2	136.9	-64.4	0	0	0	0	109.4
275	E	29.1	Very low	27.2	Very low	185 Å²	185	154.8 Å²	154.8	86%	0.864	80%	0.795	S	S	*	*			trans	-103.7	162.2	164.9	-74.8	-179.4	169.4	0	0	108.9
276	A	27.5	Very low	27.1	Very low	91 Å²	91	155.6 Å²	155.6	75%	0.752	79%	0.789	S	S	*	*			cis	-169.4	-171.1	-20.9	0	0	0	0	0	108.6
277	Y	26.3	Very low	28.3	Very low	203 Å²	203	149.3 Å²	149.3	80%	0.796	78%	0.78	S	S	*	*			trans	91	100.7	152.9	-142.6	-80.8	0	0	0	120.9
278	I	23.6	Very low	28	Very low	166 Å²	166	150.2 Å²	150.2	85%	0.851	78%	0.784	S	S	*	*			trans	-154.1	144.8	150.2	-56.2	-176.4	0	0	0	105.5
279	S	26.2	Very low	28	Very low	87 Å²	87	152.7 Å²	152.7	61%	0.608	78%	0.782	S	S	*	*			cis	-168.1	156.7	-35.3	-84.2	0	0	0	0	106.7
280	Q	26.4	Very low	28.1	Very low	191 Å²	191	147.2 Å²	147.2	89%	0.893	78%	0.781	S	S	*	*			trans	-143.6	136.4	175.1	-76.3	-170.5	-40.4	0	0	115
281	L	26.8	Very low	28.4	Very low	176 Å²	176	149.2 Å²	149.2	92%	0.921	79%	0.787	S	S	*	*			trans	-120.9	158.5	147.2	-76	158.5	0	0	0	104
282	S	25.6	Very low	28.5	Very low	89 Å²	89	150.6 Å²	150.6	62%	0.622	80%	0.796	S	S	*	*			cis	-170.8	169.1	34.7	176.1	0	0	0	0	107.1
283	W	25.2	Very low	28.5	Very low	247 Å²	247	152.9 Å²	152.9	94%	0.936	80%	0.798	S	S	*	*			trans	-172.4	154.7	149.5	-89.7	121.4	0	0	0	112.8
284	Q	26.1	Very low	28.7	Very low	168 Å²	168	152.5 Å²	152.5	79%	0.785	80%	0.796	S	S	*	*			trans	-145	173.3	169.6	-65.9	172.4	118.4	0	0	106.4
285	D	28.3	Very low	28.6	Very low	134 Å²	134	153.4 Å²	153.4	72%	0.717	79%	0.79	S	S	*	*			cis	-156.4	176.7	17.1	-160.5	15.5	0	0	0	114.1
286	S	25.1	Very low	28.6	Very low	89 Å²	89	153 Å²	153	62%	0.622	79%	0.785	S	S	*	*			trans	-26.9	-179.3	155.1	-55.5	0	0	0	0	120.2
287	P	53.8	Low	28.6	Very low	115 Å²	115	160.4 Å²	160.4	75%	0.747	79%	0.794	S	S	*	*			cis	-142.5	162.3	-47.6	38.3	-22.8	0	0	0	115.3
288	I	26.6	Very low	28.7	Very low	173 Å²	173	159.2 Å²	159.2	89%	0.887	80%	0.8	S	S	*	*			trans	-149.1	151.6	150.8	-70.4	-162.7	0	0	0	110.5
289	Y	26	Very low	29.3	Very low	212 Å²	212	156.5 Å²	156.5	83%	0.831	80%	0.796	S	S	*	*			trans	-57.2	170.4	175.6	-95.8	-113.1	0	0	0	115.5
290	A	26.3	Very low	30.2	Very low	92 Å²	92	161 Å²	161	76%	0.76	81%	0.807	S	S	*	*			cis	-145.6	-174.6	21.2	0	0	0	0	0	114.5
291	E	32.6	Very low	31.6	Very low	174 Å²	174	160.2 Å²	160.2	81%	0.813	80%	0.803	S	S	*	*			trans	-82.7	139.1	-170.6	-60.2	166.9	100.7	0	0	115.8
292	M	24.9	Very low	33.4	Very low	186 Å²	186	157.7 Å²	157.7	92%	0.916	79%	0.787	S	S	*	*			trans	-160.4	142.4	130.1	-98.9	-166.7	81.9	0	0	109.4
293	Q	27.4	Very low	36	Very low	174 Å²	174	153.8 Å²	153.8	81%	0.813	76%	0.759	S	S	*	*			trans	-104.8	167	174.7	-88.7	-159.4	52.3	0	0	110.9
294	P	43.1	Very low	38.6	Very low	103 Å²	103	144.1 Å²	144.1	67%	0.669	73%	0.729	S	S	*	*			cis	-138	151.3	-34.6	35.4	-20.2	0	0	0	112.8
295	E	24.6	Very low	41	Very low	167 Å²	167	142.3 Å²	142.3	78%	0.78	72%	0.723	S	S	*	*			trans	-150.7	154.8	149.5	-122.5	-170.9	161.9	0	0	116.6
296	K	28.3	Very low	43.5	Very low	175 Å²	175	137.3 Å²	137.3	76%	0.761	70%	0.698	S	S	*	*			trans	-45.1	122.1	-162.2	-61.1	139	-172.5	142.9	0	116.2
297	R	27.5	Very low	45.9	Very low	248 Å²	248	136 Å²	136	94%	0.936	69%	0.692	S	S	*	*	P	Polyproline II helix	trans	-70.7	135.4	147.3	-78.3	-172.7	178.2	-178.8	1.4	109.3	S299	R297-S299 PolarHBondContact O-N 3.16Å
298	L	29.4	Very low	46.3	Very low	178 Å²	178	138.1 Å²	138.1	93%	0.932	70%	0.703	S	S	*	*	P	Polyproline II helix	trans	-71.3	116.8	165.5	-81.6	160.9	0	0	0	109.6
299	S	35.7	Very low	48.2	Very low	109 Å²	109	133.5 Å²	133.5	76%	0.762	70%	0.698	S	S	*	*	P	Polyproline II helix	trans	-70.1	149.2	172.2	-169.5	0	0	0	0	110.8	R297	R297-S299 PolarHBondContact O-N 3.16Å
300	Q	45	Very low	50.6	Low	182 Å²	182	125.9 Å²	125.9	85%	0.85	67%	0.67	S	S	*	*	P	Polyproline II helix	trans	-65	134.8	154.9	-65.2	-175.9	1.8	0	0	108
301	Q	54.7	Low	52.9	Low	173 Å²	173	129.4 Å²	129.4	81%	0.808	67%	0.671	S	S	*	*	P	Polyproline II helix	trans	-79.3	126.8	178.6	-81.9	-179.9	-39.8	0	0	111.3	W342	Q301-W342 PolarHBondContact O-NE1 2.84Å
302	E	66.1	Low	55.3	Low	123 Å²	123	123.1 Å²	123.1	58%	0.575	65%	0.645	S	S	*	*	P	Polyproline II helix	trans	-59.8	146.4	165.4	-168.8	-175.9	-154.8	0	0	110.1	R340	E302-R340 VanDerWaalsContact CD-NH1 3.3Å; E302-R340 IonicContact OE1-CZ 2.71Å; E302-R340 IonicContact OE1-NH1 2.64Å; E302-R340 IonicContact OE1-NH2 2.73Å; E302-R340 PolarHBondContact OE1-NH2 2.81Å; E302-R340 IonicContact OE2-CZ 2.82Å; E302-R340 IonicContact OE2-NH1 3.14Å; E302-R340 PolarHBondContact OE2-NH1 2.92Å; E302-R340 IonicContact OE2-NH2 3.88Å; E302-R340 PolarHBondContact OE2-NH2 3.16Å
303	P	80.2	Confident	58	Low	7 Å²	7	119.2 Å²	119.2	5%	0.045	63%	0.627	C	S	.	*	P	Polyproline II helix	trans	-59.7	147.9	179.2	-16	24.2	0	0	0	112.7	Y331 R340 W342	P303-Y331 HydrophobicContact CB-CD2 3.97Å; P303-Y331 HydrophobicContact CB-CG 4.01Å; P303-R340 HydrophobicContact CB-CB 4.21Å; P303-R340 HydrophobicContact CG-CB 4.11Å; P303-R340 PolarHBondContact O-NH1 3.02Å; P303-W342 HydrophobicContact CB-CD2 4.13Å; P303-W342 HydrophobicContact CB-CZ2 4.08Å; P303-W342 HydrophobicContact CG-CD2 3.92Å; P303-W342 HydrophobicContact CG-CG 3.83Å
304	P	78.6	Confident	60.4	Low	45 Å²	45	115.3 Å²	115.3	29%	0.292	61%	0.609	S	S	.	*	P	Polyproline II helix	trans	-63.4	164.3	178.5	27.2	-34	0	0	0	112.3	D324 Y331	P304-D324 HydrophobicContact CG-CB 4.04Å; P304-Y331 HydrophobicContact CG-CD1 4.24Å; P304-Y331 HydrophobicContact CG-CE1 3.77Å; P304-Y331 WeakPolarHBondContact O-CE2 3.46Å
305	I	77.6	Confident	62.4	Low	129 Å²	129	115.5 Å²	115.5	66%	0.662	60%	0.603	S	S	*	*	P	Polyproline II helix	trans	-83.9	137.2	170.7	-56.7	175.9	0	0	0	107.7
306	P	79.4	Confident	64.8	Low	30 Å²	30	108.5 Å²	108.5	20%	0.195	57%	0.571	C	S	.	*	P	Polyproline II helix	trans	-55.7	139.7	174.1	-25.8	35.1	0	0	0	112.1	Y322 Y331 V333	P306-Y322 HydrophobicContact CB-CD1 3.97Å; P306-Y322 HydrophobicContact CB-CD2 4.33Å; P306-Y322 HydrophobicContact CB-CE1 3.79Å; P306-Y322 HydrophobicContact CB-CE2 4.16Å; P306-Y322 HydrophobicContact CB-CG 4.22Å; P306-Y322 HydrophobicContact CG-CD1 4.18Å; P306-Y322 HydrophobicContact CG-CD2 3.66Å; P306-Y322 HydrophobicContact CG-CE1 4.15Å; P306-Y322 HydrophobicContact CG-CE2 3.62Å; P306-Y322 HydrophobicContact CG-CG 3.93Å; P306-Y331 WeakPolarHBondContact CA-OH 3.28Å; P306-Y331 HydrophobicContact CG-CE2 4.09Å; P306-V333 HydrophobicContact CG-CG2 3.83Å
307	A	75.7	Confident	67.4	Low	61 Å²	61	106.3 Å²	106.3	50%	0.504	57%	0.567	S	S	.	*	P	Polyproline II helix	trans	-66.4	146.6	178.3	0	0	0	0	0	110.8	G309 Q310	A307-G309 PolarHBondContact O-N 3.25Å; A307-Q310 HydrophobicContact CB-CB 4.28Å; A307-Q310 VanDerWaalsContact N-OE1 3.15Å; A307-Q310 VanDerWaalsContact O-CB 3.25Å; A307-Q310 WeakPolarHBondContact O-CB 3.3Å; A307-Q310 PolarHBondContact O-N 2.99Å
308	V	63.6	Low	70	Confident	160 Å²	160	98.8 Å²	98.8	97%	0.97	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	112.9	-179.3	-177.9	0	0	0	0	109.6
309	G	66.5	Low	72.7	Confident	76 Å²	76	92.5 Å²	92.5	78%	0.784	51%	0.509	S	S	*	.	T	Hydrogen-bonded Turn	trans	97.2	-2.9	-175.4	0	0	0	0	0	115.7	A307 Q311	A307-G309 PolarHBondContact O-N 3.25Å; G309-Q311 PolarHBondContact O-N 2.63Å
310	Q	75.7	Confident	75.2	Confident	51 Å²	51	89.5 Å²	89.5	24%	0.238	48%	0.483	C	S	.	.	P	Polyproline II helix	trans	-68	123.1	173.9	-169.3	177.5	2.6	0	0	110.4	A307 Y322 S323	A307-Q310 HydrophobicContact CB-CB 4.28Å; A307-Q310 VanDerWaalsContact N-OE1 3.15Å; A307-Q310 VanDerWaalsContact O-CB 3.25Å; A307-Q310 WeakPolarHBondContact O-CB 3.3Å; A307-Q310 PolarHBondContact O-N 2.99Å; Q310-Y322 HydrophobicContact CB-CE1 4.28Å; Q310-Y322 HydrophobicContact CG-CD1 3.91Å; Q310-Y322 HydrophobicContact CG-CE1 4.06Å; Q310-Y322 WeakPolarHBondContact O-CE1 3.42Å; Q310-S323 PolarHBondContact NE2-O 3.31Å; Q310-S323 VanDerWaalsContact NE2-O 3.15Å
311	Q	73.9	Confident	77.3	Confident	167 Å²	167	82.4 Å²	82.4	78%	0.78	45%	0.45	S	S	*	.	P	Polyproline II helix	trans	-80.8	144.6	173	-67.7	-170.5	-2.3	0	0	111.2	G309	G309-Q311 PolarHBondContact O-N 2.63Å
312	P	83.4	Confident	78.8	Confident	41 Å²	41	75 Å²	75	27%	0.266	42%	0.415	S	S	.	.	P	Polyproline II helix	trans	-72.1	140.3	177.1	29.9	-34.6	0	0	0	111.7	Q314 I315 E320 Q321 Y322	P312-Q314 VanDerWaalsContact C-N 3.33Å; P312-I315 HydrophobicContact CB-CG1 4.27Å; P312-I315 HydrophobicContact CG-CD1 3.91Å; P312-I315 HydrophobicContact CG-CG1 3.8Å; P312-E320 HydrophobicContact CB-CB 3.97Å; P312-E320 HydrophobicContact CB-CG 4.39Å; P312-Q321 CarbonylContact C-O 3.58Å; P312-Q321 WeakPolarHBondContact CA-O 3.22Å; P312-Y322 HydrophobicContact CB-CE1 4.13Å; P312-Y322 HydrophobicContact CB-CE2 4.22Å
313	L	81.4	Confident	79.7	Confident	105 Å²	105	71 Å²	71	55%	0.55	40%	0.4	S	S	.	.	S	Bend	trans	-70.9	-29.2	178.6	-61.4	176.6	0	0	0	112.7	Q321	L313-Q321 PolarHBondContact N-O 3.03Å
314	Q	78.9	Confident	79.7	Confident	91 Å²	91	71.9 Å²	71.9	43%	0.425	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.2	142.9	173.7	-173.9	163.2	116	0	0	109.4	P312 M316 Q321	P312-Q314 VanDerWaalsContact C-N 3.33Å; Q314-M316 HydrophobicContact CG-CG 4.2Å; Q314-Q321 HydrophobicContact CB-CB 4.22Å; Q314-Q321 WeakPolarHBondContact O-CB 3.37Å; Q314-Q321 PolarHBondContact O-N 3.48Å
315	I	83.9	Confident	79.4	Confident	107 Å²	107	75.1 Å²	75.1	55%	0.549	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	133.4	171.3	-52.4	-178.4	0	0	0	108.2	P312 E320	P312-I315 HydrophobicContact CB-CG1 4.27Å; P312-I315 HydrophobicContact CG-CD1 3.91Å; P312-I315 HydrophobicContact CG-CG1 3.8Å; I315-E320 HydrophobicContact CG1-CG 4.38Å; I315-E320 HydrophobicContact CG2-CG 4.45Å
316	M	75.9	Confident	79.2	Confident	21 Å²	21	72.2 Å²	72.2	10%	0.103	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	91.6	-176.7	-74.7	177.3	43.8	0	0	108.9	Q314 L318 W319 P345 R347	Q314-M316 HydrophobicContact CG-CG 4.2Å; M316-L318 PolarHBondContact O-N 2.81Å; M316-W319 PolarHBondContact N-O 3.31Å; M316-W319 PolarHBondContact O-N 3.05Å; M316-P345 HydrophobicContact CE-CG 4.36Å; M316-R347 HydrophobicContact CE-CG 4.08Å
317	D	81.2	Confident	79.1	Confident	129 Å²	129	75 Å²	75	69%	0.69	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.7	-106.5	-174.5	-48.5	-45.9	0	0	0	111.3
318	L	83.1	Confident	79	Confident	90 Å²	90	75 Å²	75	47%	0.471	45%	0.449	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.1	13.5	178.5	-59.9	179.7	0	0	0	114	M316 N334 S335 I336	M316-L318 PolarHBondContact O-N 2.81Å; L318-N334 CarbonylContact O-C 3.53Å; L318-N334 WeakPolarHBondContact O-CA 3.49Å; L318-N334 PolarHBondContact O-OD1 3.49Å; L318-S335 PolarHBondContact O-N 2.9Å; L318-S335 PolarHBondContact O-OG 3.42Å; L318-I336 HydrophobicContact CD1-CD1 4.1Å; L318-I336 HydrophobicContact CD2-CD1 3.73Å; L318-I336 HydrophobicContact CD2-CG1 4.29Å; L318-I336 HydrophobicContact CG-CD1 4.48Å
319	W	85.3	Confident	79.9	Confident	46 Å²	46	75.3 Å²	75.3	17%	0.174	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	136.5	-174.3	-70.4	84.1	0	0	0	112.6	M316 V333 N334 E339 P345	M316-W319 PolarHBondContact N-O 3.31Å; M316-W319 PolarHBondContact O-N 3.05Å; W319-V333 CarbonylContact C-O 3.52Å; W319-V333 WeakPolarHBondContact CA-O 3.21Å; W319-V333 VanDerWaalsContact CE3-C 3.47Å; W319-N334 HydrophobicContact CD2-CB 3.94Å; W319-N334 HydrophobicContact CE3-CB 3.94Å; W319-N334 HydrophobicContact CH2-CB 3.95Å; W319-N334 HydrophobicContact CZ2-CB 3.94Å; W319-N334 HydrophobicContact CZ3-CB 3.94Å; W319-N334 PolarHBondContact NE1-ND2 3.24Å; W319-E339 HydrophobicContact CH2-CB 4.05Å; W319-E339 HydrophobicContact CH2-CG 4.03Å; W319-P345 HydrophobicContact CB-CB 4.3Å; W319-P345 HydrophobicContact CB-CG 3.34Å; W319-P345 HydrophobicContact CD2-CB 4.25Å; W319-P345 HydrophobicContact CD2-CG 3.68Å; W319-P345 HydrophobicContact CE3-CG 4.25Å; W319-P345 HydrophobicContact CG-CB 3.86Å; W319-P345 HydrophobicContact CG-CG 3.27Å
320	E	89.3	Confident	80.8	Confident	45 Å²	45	74.1 Å²	74.1	21%	0.21	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	123.5	-174.5	-68.8	166.6	164.3	0	0	109	P312 I315 Y322 Y332 V333 S335	P312-E320 HydrophobicContact CB-CB 3.97Å; P312-E320 HydrophobicContact CB-CG 4.39Å; I315-E320 HydrophobicContact CG1-CG 4.38Å; I315-E320 HydrophobicContact CG2-CG 4.45Å; E320-Y322 HydrophobicContact CB-CD2 4.28Å; E320-Y322 HydrophobicContact CB-CE2 3.59Å; E320-Y332 CarbonylContact O-C 3.5Å; E320-Y332 WeakPolarHBondContact O-CA 3.25Å; E320-V333 PolarHBondContact N-O 3.37Å; E320-V333 PolarHBondContact O-N 2.91Å; E320-S335 WeakPolarHBondContact OE1-CB 3.12Å
321	Q	88.8	Confident	81.4	Confident	33 Å²	33	71.8 Å²	71.8	15%	0.154	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	129.1	179	-176.5	178.7	-21.6	0	0	110.7	P312 L313 Q314 C330 Y331 Y332	P312-Q321 CarbonylContact C-O 3.58Å; P312-Q321 WeakPolarHBondContact CA-O 3.22Å; L313-Q321 PolarHBondContact N-O 3.03Å; Q314-Q321 HydrophobicContact CB-CB 4.22Å; Q314-Q321 WeakPolarHBondContact O-CB 3.37Å; Q314-Q321 PolarHBondContact O-N 3.48Å; Q321-C330 HydrophobicContact CG-CB 4.3Å; Q321-C330 PolarHBondContact NE2-SG 3.33Å; Q321-Y331 WeakPolarHBondContact CA-O 3.49Å; Q321-Y332 HydrophobicContact CB-CD1 3.84Å; Q321-Y332 HydrophobicContact CB-CE1 3.72Å; Q321-Y332 HydrophobicContact CG-CD1 4.03Å; Q321-Y332 HydrophobicContact CG-CE1 3.57Å
322	Y	86.3	Confident	82.2	Confident	19 Å²	19	65.1 Å²	65.1	8%	0.075	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	153	178	-71.2	-83.3	0	0	0	110.7	P306 Q310 P312 E320 C330 Y331 V333	P306-Y322 HydrophobicContact CB-CD1 3.97Å; P306-Y322 HydrophobicContact CB-CD2 4.33Å; P306-Y322 HydrophobicContact CB-CE1 3.79Å; P306-Y322 HydrophobicContact CB-CE2 4.16Å; P306-Y322 HydrophobicContact CB-CG 4.22Å; P306-Y322 HydrophobicContact CG-CD1 4.18Å; P306-Y322 HydrophobicContact CG-CD2 3.66Å; P306-Y322 HydrophobicContact CG-CE1 4.15Å; P306-Y322 HydrophobicContact CG-CE2 3.62Å; P306-Y322 HydrophobicContact CG-CG 3.93Å; Q310-Y322 HydrophobicContact CB-CE1 4.28Å; Q310-Y322 HydrophobicContact CG-CD1 3.91Å; Q310-Y322 HydrophobicContact CG-CE1 4.06Å; Q310-Y322 WeakPolarHBondContact O-CE1 3.42Å; P312-Y322 HydrophobicContact CB-CE1 4.13Å; P312-Y322 HydrophobicContact CB-CE2 4.22Å; E320-Y322 HydrophobicContact CB-CD2 4.28Å; E320-Y322 HydrophobicContact CB-CE2 3.59Å; Y322-C330 CarbonylContact O-C 3.56Å; Y322-C330 VanDerWaalsContact O-CA 3.23Å; Y322-C330 WeakPolarHBondContact O-CA 3.41Å; Y322-Y331 VanDerWaalsContact CB-CZ 3.45Å; Y322-Y331 HydrophobicContact CD2-CE2 4.46Å; Y322-Y331 HydrophobicContact CG-CE2 4.4Å; Y322-Y331 PolarHBondContact N-O 3.02Å; Y322-Y331 PolarHBondContact O-N 2.86Å; Y322-V333 HydrophobicContact CD2-CB 4.38Å; Y322-V333 HydrophobicContact CD2-CG2 3.9Å; Y322-V333 HydrophobicContact CE2-CB 4.36Å; Y322-V333 HydrophobicContact CE2-CG2 4.26Å
323	S	84.9	Confident	82.3	Confident	38 Å²	38	63.7 Å²	63.7	27%	0.266	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	136.9	164.1	50.6	0	0	0	0	110	Q310 P325	Q310-S323 PolarHBondContact NE2-O 3.31Å; Q310-S323 VanDerWaalsContact NE2-O 3.15Å; S323-P325 WeakPolarHBondContact O-CD 3.41Å
324	D	81.1	Confident	82.5	Confident	25 Å²	25	59.3 Å²	59.3	13%	0.134	34%	0.337	C	S	.	.			trans	-74.3	120.8	167.2	166.3	31.7	0	0	0	109.7	P304 G326 T327 G328 R329 Y331 W342	P304-D324 HydrophobicContact CG-CB 4.04Å; D324-G326 PolarHBondContact O-N 2.75Å; D324-G326 PolarHBondContact OD1-N 3.44Å; D324-T327 VanDerWaalsContact OD2-CB 3.24Å; D324-T327 WeakPolarHBondContact OD2-CB 3.33Å; D324-T327 WeakPolarHBondContact OD2-CG2 3.28Å; D324-T327 PolarHBondContact OD2-N 2.85Å; D324-T327 PolarHBondContact OD2-OG1 2.79Å; D324-G328 VanDerWaalsContact O-CA 3.28Å; D324-G328 WeakPolarHBondContact O-CA 3.15Å; D324-G328 PolarHBondContact O-N 3.32Å; D324-R329 PolarHBondContact N-O 3.44Å; D324-Y331 HydrophobicContact CB-CD1 4.21Å; D324-Y331 HydrophobicContact CB-CE1 4.11Å; D324-W342 HydrophobicContact CB-CH2 4.32Å
325	P	72.3	Confident	82.6	Confident	113 Å²	113	56.6 Å²	56.6	73%	0.734	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-24.2	176.2	-22.2	34.5	0	0	0	114.1	S323	S323-P325 WeakPolarHBondContact O-CD 3.41Å
326	G	72.1	Confident	82.3	Confident	68 Å²	68	57 Å²	57	70%	0.701	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.4	-39.7	-177.2	0	0	0	0	0	114.4	D324	D324-G326 PolarHBondContact O-N 2.75Å; D324-G326 PolarHBondContact OD1-N 3.44Å
327	T	76.9	Confident	82.5	Confident	90 Å²	90	60.2 Å²	60.2	55%	0.552	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.3	-6.1	-176.5	68.6	0	0	0	0	114.8	D324 R329	D324-T327 VanDerWaalsContact OD2-CB 3.24Å; D324-T327 WeakPolarHBondContact OD2-CB 3.33Å; D324-T327 WeakPolarHBondContact OD2-CG2 3.28Å; D324-T327 PolarHBondContact OD2-N 2.85Å; D324-T327 PolarHBondContact OD2-OG1 2.79Å; T327-R329 PolarHBondContact O-N 2.92Å; T327-R329 VanDerWaalsContact O-N 3.12Å; T327-R329 PolarHBondContact OG1-N 3.45Å
328	G	74.6	Confident	82.5	Confident	59 Å²	59	60.5 Å²	60.5	61%	0.608	35%	0.346	S	S	*	.			trans	68.1	1.6	-174.7	0	0	0	0	0	114.7	D324	D324-G328 VanDerWaalsContact O-CA 3.28Å; D324-G328 WeakPolarHBondContact O-CA 3.15Å; D324-G328 PolarHBondContact O-N 3.32Å
329	R	82.3	Confident	82.3	Confident	168 Å²	168	61.6 Å²	61.6	63%	0.634	35%	0.348	S	S	*	.			trans	-73.6	142.2	179.1	-76.6	-176.6	164.3	-177.8	-2.2	111.5	D324 T327 W342	D324-R329 PolarHBondContact N-O 3.44Å; T327-R329 PolarHBondContact O-N 2.92Å; T327-R329 VanDerWaalsContact O-N 3.12Å; T327-R329 PolarHBondContact OG1-N 3.45Å; R329-W342 HydrophobicContact CB-CE3 4.16Å; R329-W342 HydrophobicContact CB-CH2 4.34Å; R329-W342 HydrophobicContact CB-CZ3 3.55Å
330	C	85.4	Confident	82.4	Confident	50 Å²	50	62.7 Å²	62.7	34%	0.338	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	136.5	169.4	-67.3	0	0	0	0	111.1	Q321 Y322	Q321-C330 HydrophobicContact CG-CB 4.3Å; Q321-C330 PolarHBondContact NE2-SG 3.33Å; Y322-C330 CarbonylContact O-C 3.56Å; Y322-C330 VanDerWaalsContact O-CA 3.23Å; Y322-C330 WeakPolarHBondContact O-CA 3.41Å
331	Y	88.3	Confident	82.1	Confident	2 Å²	2	61.9 Å²	61.9	1%	0.008	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	166.4	169	65.8	-82.3	0	0	0	109.9	P303 P304 P306 Q321 Y322 D324 V333 S341 W342	P303-Y331 HydrophobicContact CB-CD2 3.97Å; P303-Y331 HydrophobicContact CB-CG 4.01Å; P304-Y331 HydrophobicContact CG-CD1 4.24Å; P304-Y331 HydrophobicContact CG-CE1 3.77Å; P304-Y331 WeakPolarHBondContact O-CE2 3.46Å; P306-Y331 WeakPolarHBondContact CA-OH 3.28Å; P306-Y331 HydrophobicContact CG-CE2 4.09Å; Q321-Y331 WeakPolarHBondContact CA-O 3.49Å; Y322-Y331 VanDerWaalsContact CB-CZ 3.45Å; Y322-Y331 HydrophobicContact CD2-CE2 4.46Å; Y322-Y331 HydrophobicContact CG-CE2 4.4Å; Y322-Y331 PolarHBondContact N-O 3.02Å; Y322-Y331 PolarHBondContact O-N 2.86Å; D324-Y331 HydrophobicContact CB-CD1 4.21Å; D324-Y331 HydrophobicContact CB-CE1 4.11Å; Y331-V333 HydrophobicContact CD2-CG2 3.78Å; Y331-V333 HydrophobicContact CE2-CG2 3.61Å; Y331-S341 WeakPolarHBondContact CA-O 3.08Å; Y331-W342 HydrophobicContact CD1-CZ3 4.28Å; Y331-W342 HydrophobicContact CG-CZ3 4.47Å
332	Y	90.3	Very high	81.9	Confident	28 Å²	28	64.6 Å²	64.6	11%	0.11	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	133.7	-173.1	-56.9	-92.8	0	0	0	108.9	E320 Q321 R340 S341 K343 P344 P345	E320-Y332 CarbonylContact O-C 3.5Å; E320-Y332 WeakPolarHBondContact O-CA 3.25Å; Q321-Y332 HydrophobicContact CB-CD1 3.84Å; Q321-Y332 HydrophobicContact CB-CE1 3.72Å; Q321-Y332 HydrophobicContact CG-CD1 4.03Å; Q321-Y332 HydrophobicContact CG-CE1 3.57Å; Y332-R340 WeakPolarHBondContact O-CA 3.38Å; Y332-S341 PolarHBondContact N-O 3.45Å; Y332-S341 PolarHBondContact O-N 2.88Å; Y332-K343 WeakPolarHBondContact CD2-O 3.48Å; Y332-P344 HydrophobicContact CD2-CB 4.47Å; Y332-P344 HydrophobicContact CE1-CB 4.04Å; Y332-P344 HydrophobicContact CE2-CB 3.9Å; Y332-P345 HydrophobicContact CD1-CG 4.48Å
333	V	86.4	Confident	81.7	Confident	11 Å²	11	71.5 Å²	71.5	7%	0.067	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	131.8	179.4	-172	0	0	0	0	108.8	P306 W319 E320 Y322 Y331 S335 E339 R340	P306-V333 HydrophobicContact CG-CG2 3.83Å; W319-V333 CarbonylContact C-O 3.52Å; W319-V333 WeakPolarHBondContact CA-O 3.21Å; W319-V333 VanDerWaalsContact CE3-C 3.47Å; E320-V333 PolarHBondContact N-O 3.37Å; E320-V333 PolarHBondContact O-N 2.91Å; Y322-V333 HydrophobicContact CD2-CB 4.38Å; Y322-V333 HydrophobicContact CD2-CG2 3.9Å; Y322-V333 HydrophobicContact CE2-CB 4.36Å; Y322-V333 HydrophobicContact CE2-CG2 4.26Å; Y331-V333 HydrophobicContact CD2-CG2 3.78Å; Y331-V333 HydrophobicContact CE2-CG2 3.61Å; V333-S335 PolarHBondContact O-N 3.03Å; V333-E339 CarbonylContact C-O 3.56Å; V333-E339 WeakPolarHBondContact CA-O 3.29Å; V333-R340 HydrophobicContact CG1-CG 4.32Å; V333-R340 HydrophobicContact CG2-CG 4.18Å
334	N	85.3	Confident	81.3	Confident	13 Å²	13	73.4 Å²	73.4	7%	0.07	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	123.7	174.6	-170.6	-55.4	0	0	0	109.4	L318 W319 I336 T337 K338 E339	L318-N334 CarbonylContact O-C 3.53Å; L318-N334 WeakPolarHBondContact O-CA 3.49Å; L318-N334 PolarHBondContact O-OD1 3.49Å; W319-N334 HydrophobicContact CD2-CB 3.94Å; W319-N334 HydrophobicContact CE3-CB 3.94Å; W319-N334 HydrophobicContact CH2-CB 3.95Å; W319-N334 HydrophobicContact CZ2-CB 3.94Å; W319-N334 HydrophobicContact CZ3-CB 3.94Å; W319-N334 PolarHBondContact NE1-ND2 3.24Å; N334-I336 PolarHBondContact O-N 3.04Å; N334-I336 PolarHBondContact OD1-N 3.39Å; N334-T337 WeakPolarHBondContact CB-OG1 3.38Å; N334-T337 PolarHBondContact ND2-OG1 2.94Å; N334-T337 PolarHBondContact OD1-N 3.24Å; N334-T337 PolarHBondContact OD1-OG1 3.36Å; N334-K338 VanDerWaalsContact O-CA 3.24Å; N334-K338 WeakPolarHBondContact O-CA 3.45Å; N334-K338 PolarHBondContact O-N 2.91Å; N334-E339 HydrophobicContact CB-CB 4.21Å; N334-E339 PolarHBondContact N-O 3.31Å
335	S	80.8	Confident	81	Confident	33 Å²	33	73.7 Å²	73.7	23%	0.231	41%	0.406	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-24.5	-175.4	64.2	0	0	0	0	112.7	L318 E320 V333 K338	L318-S335 PolarHBondContact O-N 2.9Å; L318-S335 PolarHBondContact O-OG 3.42Å; E320-S335 WeakPolarHBondContact OE1-CB 3.12Å; V333-S335 PolarHBondContact O-N 3.03Å; S335-K338 WeakPolarHBondContact O-CE 3.28Å; S335-K338 PolarHBondContact O-NZ 3.45Å
336	I	77.2	Confident	80.5	Confident	117 Å²	117	80.1 Å²	80.1	60%	0.6	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.6	-60.2	176.2	-58.8	-174.4	0	0	0	111.2	L318 N334 K338	L318-I336 HydrophobicContact CD1-CD1 4.1Å; L318-I336 HydrophobicContact CD2-CD1 3.73Å; L318-I336 HydrophobicContact CD2-CG1 4.29Å; L318-I336 HydrophobicContact CG-CD1 4.48Å; N334-I336 PolarHBondContact O-N 3.04Å; N334-I336 PolarHBondContact OD1-N 3.39Å; I336-K338 VanDerWaalsContact C-N 3.32Å; I336-K338 PolarHBondContact O-N 2.98Å
337	T	80.9	Confident	79.2	Confident	88 Å²	88	84.6 Å²	84.6	54%	0.54	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80	-10.8	-171.4	68.9	0	0	0	0	114.1	N334 E339	N334-T337 WeakPolarHBondContact CB-OG1 3.38Å; N334-T337 PolarHBondContact ND2-OG1 2.94Å; N334-T337 PolarHBondContact OD1-N 3.24Å; N334-T337 PolarHBondContact OD1-OG1 3.36Å; T337-E339 PolarHBondContact O-N 3.43Å; T337-E339 WeakPolarHBondContact OG1-CB 3.18Å; T337-E339 PolarHBondContact OG1-N 3.47Å
338	K	80.8	Confident	77.2	Confident	135 Å²	135	84.6 Å²	84.6	59%	0.587	42%	0.42	S	S	*	.			trans	57	13.3	-173.4	-50.8	-50.6	-172.1	-170.1	0	115.1	N334 S335 I336	N334-K338 VanDerWaalsContact O-CA 3.24Å; N334-K338 WeakPolarHBondContact O-CA 3.45Å; N334-K338 PolarHBondContact O-N 2.91Å; S335-K338 WeakPolarHBondContact O-CE 3.28Å; S335-K338 PolarHBondContact O-NZ 3.45Å; I336-K338 VanDerWaalsContact C-N 3.32Å; I336-K338 PolarHBondContact O-N 2.98Å
339	E	79.3	Confident	75	Confident	112 Å²	112	93.8 Å²	93.8	52%	0.523	44%	0.437	S	S	.	.			trans	-59.7	137.9	171.1	-171.2	-171.5	163.9	0	0	110.7	W319 V333 N334 T337	W319-E339 HydrophobicContact CH2-CB 4.05Å; W319-E339 HydrophobicContact CH2-CG 4.03Å; V333-E339 CarbonylContact C-O 3.56Å; V333-E339 WeakPolarHBondContact CA-O 3.29Å; N334-E339 HydrophobicContact CB-CB 4.21Å; N334-E339 PolarHBondContact N-O 3.31Å; T337-E339 PolarHBondContact O-N 3.43Å; T337-E339 WeakPolarHBondContact OG1-CB 3.18Å; T337-E339 PolarHBondContact OG1-N 3.47Å
340	R	86.9	Confident	72.4	Confident	69 Å²	69	91.2 Å²	91.2	26%	0.26	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	127.6	-175.7	-70.3	173.2	-76.6	139.5	0.5	110.5	E302 P303 Y332 V333	E302-R340 VanDerWaalsContact CD-NH1 3.3Å; E302-R340 IonicContact OE1-CZ 2.71Å; E302-R340 IonicContact OE1-NH1 2.64Å; E302-R340 IonicContact OE1-NH2 2.73Å; E302-R340 PolarHBondContact OE1-NH2 2.81Å; E302-R340 IonicContact OE2-CZ 2.82Å; E302-R340 IonicContact OE2-NH1 3.14Å; E302-R340 PolarHBondContact OE2-NH1 2.92Å; E302-R340 IonicContact OE2-NH2 3.88Å; E302-R340 PolarHBondContact OE2-NH2 3.16Å; P303-R340 HydrophobicContact CB-CB 4.21Å; P303-R340 HydrophobicContact CG-CB 4.11Å; P303-R340 PolarHBondContact O-NH1 3.02Å; Y332-R340 WeakPolarHBondContact O-CA 3.38Å; V333-R340 HydrophobicContact CG1-CG 4.32Å; V333-R340 HydrophobicContact CG2-CG 4.18Å
341	S	83.5	Confident	69.6	Low	29 Å²	29	99.9 Å²	99.9	20%	0.203	47%	0.47	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	135.5	-176.1	172	0	0	0	0	112.9	Y331 Y332 K343	Y331-S341 WeakPolarHBondContact CA-O 3.08Å; Y332-S341 PolarHBondContact N-O 3.45Å; Y332-S341 PolarHBondContact O-N 2.88Å; S341-K343 PolarHBondContact O-N 3.49Å; S341-K343 PolarHBondContact OG-N 3.41Å; S341-K343 PolarHBondContact OG-O 2.84Å
342	W	84.6	Confident	66.5	Low	90 Å²	90	105.5 Å²	105.5	34%	0.341	51%	0.508	S	S	.	.	S	Bend	trans	-75	-0.8	167.2	-69	116.7	0	0	0	113.4	Q301 P303 D324 R329 Y331	Q301-W342 PolarHBondContact O-NE1 2.84Å; P303-W342 HydrophobicContact CB-CD2 4.13Å; P303-W342 HydrophobicContact CB-CZ2 4.08Å; P303-W342 HydrophobicContact CG-CD2 3.92Å; P303-W342 HydrophobicContact CG-CG 3.83Å; D324-W342 HydrophobicContact CB-CH2 4.32Å; R329-W342 HydrophobicContact CB-CE3 4.16Å; R329-W342 HydrophobicContact CB-CH2 4.34Å; R329-W342 HydrophobicContact CB-CZ3 3.55Å; Y331-W342 HydrophobicContact CD1-CZ3 4.28Å; Y331-W342 HydrophobicContact CG-CZ3 4.47Å
343	K	81	Confident	63.5	Low	163 Å²	163	110.5 Å²	110.5	71%	0.709	54%	0.542	S	S	*	.	S	Bend	trans	-119.2	137.8	-176.1	-64.3	173.4	-177.6	168.8	0	111	Y332 S341	Y332-K343 WeakPolarHBondContact CD2-O 3.48Å; S341-K343 PolarHBondContact O-N 3.49Å; S341-K343 PolarHBondContact OG-N 3.41Å; S341-K343 PolarHBondContact OG-O 2.84Å
344	P	77.5	Confident	60.7	Low	78 Å²	78	117.4 Å²	117.4	51%	0.506	58%	0.579	S	S	.	*			trans	-65.9	148.4	-178.4	25.3	-33.8	0	0	0	113	Y332	Y332-P344 HydrophobicContact CD2-CB 4.47Å; Y332-P344 HydrophobicContact CE1-CB 4.04Å; Y332-P344 HydrophobicContact CE2-CB 3.9Å
345	P	74.2	Confident	58	Low	31 Å²	31	126.1 Å²	126.1	20%	0.201	62%	0.619	C	S	.	*			trans	-67.8	141.5	174.8	-7.8	20.1	0	0	0	111.7	M316 W319 Y332 R347	M316-P345 HydrophobicContact CE-CG 4.36Å; W319-P345 HydrophobicContact CB-CB 4.3Å; W319-P345 HydrophobicContact CB-CG 3.34Å; W319-P345 HydrophobicContact CD2-CB 4.25Å; W319-P345 HydrophobicContact CD2-CG 3.68Å; W319-P345 HydrophobicContact CE3-CG 4.25Å; W319-P345 HydrophobicContact CG-CB 3.86Å; W319-P345 HydrophobicContact CG-CG 3.27Å; Y332-P345 HydrophobicContact CD1-CG 4.48Å; P345-R347 PolarHBondContact O-N 2.96Å
346	R	62.4	Low	55.5	Low	248 Å²	248	129.9 Å²	129.9	94%	0.936	65%	0.645	S	S	*	*			trans	-81	100.4	176.6	-68.6	-176.8	-70.6	-141.7	-1.6	110.2	A348	R346-A348 PolarHBondContact O-N 2.88Å
347	R	44.6	Very low	53.5	Low	162 Å²	162	130.2 Å²	130.2	61%	0.611	66%	0.655	S	S	*	*			trans	-54.3	121.5	175.4	-65.3	-172.9	-169.5	166.5	6.6	111.2	M316 P345	M316-R347 HydrophobicContact CE-CG 4.08Å; P345-R347 PolarHBondContact O-N 2.96Å
348	A	34.4	Very low	50.9	Low	90 Å²	90	133 Å²	133	74%	0.744	67%	0.672	S	S	*	*			trans	-73.8	126	168.5	0	0	0	0	0	109.4	R346 S350	R346-A348 PolarHBondContact O-N 2.88Å; A348-S350 PolarHBondContact O-N 2.73Å
349	R	28.9	Very low	48.6	Very low	252 Å²	252	134.9 Å²	134.9	95%	0.951	68%	0.683	S	S	*	*			trans	-82.2	87.2	-177.9	-164.6	177.7	-165.1	164.8	6.3	110.5
350	S	27.3	Very low	46.2	Very low	114 Å²	114	138.9 Å²	138.9	80%	0.797	70%	0.701	S	S	*	*			trans	-60.3	157.3	179.7	-163.1	0	0	0	0	113	A348	A348-S350 PolarHBondContact O-N 2.73Å
351	R	26.2	Very low	43.3	Very low	233 Å²	233	138.9 Å²	138.9	88%	0.879	72%	0.723	S	S	*	*			trans	-104.9	85.8	-156.7	-173.9	-176.4	-173.9	178.9	1	111.2	T353	R351-T353 PolarHBondContact O-N 2.87Å; R351-T353 VanDerWaalsContact O-N 3.12Å
352	C	25.1	Very low	40.6	Very low	120 Å²	120	143.4 Å²	143.4	81%	0.811	76%	0.755	S	S	*	*			trans	-61.3	114.7	177.8	-57	0	0	0	0	112
353	T	27.2	Very low	38.1	Very low	133 Å²	133	145.2 Å²	145.2	82%	0.816	78%	0.778	S	S	*	*			trans	-70.1	128.9	158.6	46.2	0	0	0	0	109.4	R351	R351-T353 PolarHBondContact O-N 2.87Å; R351-T353 VanDerWaalsContact O-N 3.12Å
354	N	27	Very low	35.5	Very low	156 Å²	156	141.7 Å²	141.7	83%	0.834	78%	0.78	S	S	*	*			trans	-128.1	134.9	166.6	-93.3	0.9	0	0	0	109.8
355	Q	28.7	Very low	33.2	Very low	195 Å²	195	147.2 Å²	147.2	91%	0.911	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-76.5	168.3	170.1	-66.2	173.3	-7.3	0	0	110.6
356	S	27	Very low	30.9	Very low	112 Å²	112	149.9 Å²	149.9	78%	0.783	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-76.4	145	-175.4	45.9	0	0	0	0	113.6
357	P	35.3	Very low	29	Very low	124 Å²	124	147 Å²	147	81%	0.805	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-88.9	152.2	178.8	35.7	-35.1	0	0	0	113.5
358	T	27.2	Very low	28	Very low	147 Å²	147	146.4 Å²	146.4	90%	0.902	84%	0.835	S	S	*	*			trans	-114.2	163.6	165.2	-34.3	0	0	0	0	109.4
359	Q	33.1	Very low	27.5	Very low	175 Å²	175	149.9 Å²	149.9	82%	0.818	84%	0.84	S	S	*	*			trans	-102	-179.4	-156	-56.4	-177.7	17.4	0	0	115.6
360	Q	27.8	Very low	28.2	Very low	195 Å²	195	142.8 Å²	142.8	91%	0.911	83%	0.827	S	S	*	*			trans	85.4	148.1	171.1	-54	178.4	2.1	0	0	115
361	G	26.2	Very low	28.1	Very low	69 Å²	69	147.5 Å²	147.5	71%	0.711	83%	0.827	S	S	*	*			cis	160.4	124.6	-6.1	0	0	0	0	0	110.7
362	S	26.8	Very low	27.9	Very low	125 Å²	125	141.6 Å²	141.6	87%	0.874	81%	0.813	S	S	*	*			trans	-71.7	148.6	-175.7	-52.2	0	0	0	0	112.9
363	P	32.6	Very low	27.9	Very low	127 Å²	127	142.4 Å²	142.4	83%	0.825	81%	0.814	S	S	*	*				-129.9	-177.1	119.4	38.1	-31.2	0	0	0	112.6
364	A	26.6	Very low	27.9	Very low	90 Å²	90	140.2 Å²	140.2	74%	0.744	81%	0.805	S	S	*	*			trans	-134.7	177.2	177.1	0	0	0	0	0	110.2
365	Q	28.5	Very low	27.8	Very low	193 Å²	193	140.1 Å²	140.1	90%	0.902	80%	0.799	S	S	*	*			trans	71.4	150.6	175	-69.9	-179.3	-12.8	0	0	115.4
366	A	25.7	Very low	27.7	Very low	88 Å²	88	138.2 Å²	138.2	73%	0.727	79%	0.794	S	S	*	*			cis	-156.6	-177.2	-10.3	0	0	0	0	0	110.9
367	Q	23.6	Very low	27.5	Very low	187 Å²	187	137.6 Å²	137.6	87%	0.874	79%	0.79	S	S	*	*			trans	-69.6	120.9	167.4	-63.2	171.1	-7.4	0	0	111.3
368	T	23.5	Very low	27	Very low	149 Å²	149	139.7 Å²	139.7	91%	0.914	79%	0.794	S	S	*	*			trans	-164.3	161.9	132.2	18.5	0	0	0	0	111.4
369	L	22.5	Very low	27.2	Very low	163 Å²	163	138.8 Å²	138.8	85%	0.853	79%	0.79	S	S	*	*			trans	-116.3	173.8	-173.1	-83.4	164	0	0	0	109.3
370	P	44.4	Very low	26.8	Very low	104 Å²	104	138.4 Å²	138.4	68%	0.675	79%	0.793	S	S	*	*			cis	-140.5	-179.8	-19.9	32.4	-11.5	0	0	0	115.7
371	R	24.2	Very low	26.9	Very low	212 Å²	212	133.7 Å²	133.7	80%	0.8	78%	0.781	S	S	*	*			trans	90.6	142.1	132.1	-104.6	-171.3	138.4	131.4	3.2	124.2
372	D	22.8	Very low	27	Very low	110 Å²	110	139.2 Å²	139.2	59%	0.588	79%	0.786	S	S	*	*			trans	69.8	125.4	148.5	-60.2	-24.5	0	0	0	122.7
373	T	24.7	Very low	27.2	Very low	136 Å²	136	139.6 Å²	139.6	83%	0.834	78%	0.783	S	S	*	*			trans	64.6	143.8	156.1	54.6	0	0	0	0	120.5
374	S	26.8	Very low	26.9	Very low	87 Å²	87	136.4 Å²	136.4	61%	0.608	77%	0.773	S	S	*	*			cis	-169.5	166.3	-16.8	52.4	0	0	0	0	112.7
375	H	26	Very low	27	Very low	155 Å²	155	140.8 Å²	140.8	72%	0.718	78%	0.784	S	S	*	*			trans	71.3	119.3	152.3	-65.8	-50.5	0	0	0	123.7
376	L	25.5	Very low	27	Very low	154 Å²	154	135 Å²	135	81%	0.806	78%	0.776	S	S	*	*			trans	65.8	147.4	135.4	-52.9	169.6	0	0	0	119.3
377	S	23.5	Very low	27.1	Very low	100 Å²	100	137 Å²	137	70%	0.699	78%	0.779	S	S	*	*			cis	-168.7	146.8	-17.8	-102.2	0	0	0	0	111
378	L	24.6	Very low	27.2	Very low	168 Å²	168	135.8 Å²	135.8	88%	0.88	78%	0.776	S	S	*	*			trans	-143.2	136.5	152.5	-84	-179.9	0	0	0	109.7
379	P	30.8	Very low	27.3	Very low	128 Å²	128	136.4 Å²	136.4	83%	0.831	77%	0.768	S	S	*	*			trans	-81.2	153.5	-179.5	32.4	-34.6	0	0	0	113.5
380	L	26.2	Very low	27.4	Very low	167 Å²	167	138.5 Å²	138.5	87%	0.874	77%	0.765	S	S	*	*			trans	-116.4	-174	-172.5	-150.4	91.9	0	0	0	113.3
381	S	29	Very low	26.5	Very low	96 Å²	96	140.3 Å²	140.3	67%	0.671	77%	0.768	S	S	*	*			trans	93.5	153	164.6	84	0	0	0	0	115.3
382	K	29.2	Very low	26.4	Very low	185 Å²	185	135.2 Å²	135.2	80%	0.804	76%	0.764	S	S	*	*			cis	-167.5	167.2	-1.7	-117.4	161.5	-175.6	175.6	0	106.3
383	T	29.8	Very low	27.5	Very low	132 Å²	132	135.1 Å²	135.1	81%	0.81	77%	0.77	S	S	*	*			cis	-174.7	161.2	-28.7	27.6	0	0	0	0	106.1
384	G	26.2	Very low	27.6	Very low	61 Å²	61	135 Å²	135	63%	0.629	76%	0.764	S	S	*	*			cis	151.7	145.9	-1.7	0	0	0	0	0	111.7
385	N	29.9	Very low	27.7	Very low	182 Å²	182	141 Å²	141	97%	0.973	78%	0.775	S	S	*	*			trans	70.7	155.9	177.9	-54.3	-14.7	0	0	0	117.2
386	G	27.4	Very low	27.7	Very low	70 Å²	70	138.9 Å²	138.9	72%	0.722	77%	0.773	S	S	*	*			trans	168.8	5.9	174.1	0	0	0	0	0	123.5
387	T	27.9	Very low	27.7	Very low	130 Å²	130	141.1 Å²	141.1	80%	0.798	78%	0.777	S	S	*	*			trans	25.3	128	157.5	45	0	0	0	0	123.5
388	M	27.1	Very low	27.7	Very low	163 Å²	163	139.2 Å²	139.2	80%	0.803	77%	0.773	S	S	*	*			trans	71.8	152.6	132.6	-62.9	-99.9	-80	0	0	119.7
389	H	25.7	Very low	27.7	Very low	162 Å²	162	136 Å²	136	75%	0.75	76%	0.764	S	S	*	*			cis	-170.5	169.2	-29.8	-139.8	-89.7	0	0	0	109.9
390	R	23.4	Very low	27.6	Very low	207 Å²	207	137.6 Å²	137.6	78%	0.781	76%	0.76	S	S	*	*			trans	75.9	120.3	154.1	-79.7	-169.6	158.1	-149.6	-4.3	122.9
391	L	24.9	Very low	27.5	Very low	141 Å²	141	136.3 Å²	136.3	74%	0.738	75%	0.75	S	S	*	*				83.8	133	126.1	-64.4	173.7	0	0	0	123.5
392	S	22.1	Very low	27.3	Very low	105 Å²	105	141.7 Å²	141.7	73%	0.734	76%	0.755	S	S	*	*			trans	-75.6	-168	158.7	-20.7	0	0	0	0	111.5
393	P	47.2	Very low	27.1	Very low	108 Å²	108	138.8 Å²	138.8	70%	0.701	75%	0.748	S	S	*	*			cis	-140.2	170.6	10.3	40	-19.3	0	0	0	118.7
394	D	27.2	Very low	26.8	Very low	135 Å²	135	137.8 Å²	137.8	72%	0.722	74%	0.742	S	S	*	*			trans	33.9	151	139.6	-43.5	-18.4	0	0	0	126.1
395	Y	27.5	Very low	26.7	Very low	211 Å²	211	141.2 Å²	141.2	83%	0.827	75%	0.746	S	S	*	*				105.2	143	129.5	-102.3	-60.8	0	0	0	122.9
396	V	27.3	Very low	26.6	Very low	111 Å²	111	137.1 Å²	137.1	67%	0.673	73%	0.732	S	S	*	*			trans	90.4	115.9	152.7	167.6	0	0	0	0	120
397	F	24.6	Very low	26.4	Very low	202 Å²	202	138.3 Å²	138.3	89%	0.886	73%	0.729	S	S	*	*			trans	45.6	146.3	147.5	-73.8	-123	0	0	0	121.1
398	G	22.7	Very low	26.2	Very low	60 Å²	60	144.1 Å²	144.1	62%	0.619	74%	0.737	S	S	*	*			cis	151.1	170.5	-7.5	0	0	0	0	0	114.7
399	S	25.1	Very low	26.1	Very low	100 Å²	100	144.3 Å²	144.3	70%	0.699	74%	0.736	S	S	*	*			trans	77.5	146.3	162.8	77.9	0	0	0	0	121.1
400	H	28.3	Very low	26.1	Very low	162 Å²	162	144.8 Å²	144.8	75%	0.75	74%	0.74	S	S	*	*			trans	64.8	155	163.3	-55.6	-65.9	0	0	0	121.1
401	Q	25.4	Very low	26.1	Very low	140 Å²	140	142.6 Å²	142.6	65%	0.654	74%	0.736	S	S	*	*			cis	-164.2	140.7	-42	-168.1	134.1	14	0	0	111.2
402	R	24.8	Very low	26.2	Very low	209 Å²	209	143.1 Å²	143.1	79%	0.789	74%	0.735	S	S	*	*			trans	71.7	146	153.7	-93.8	-177.8	-164.7	176.6	5.8	121
403	N	23.9	Very low	26.3	Very low	123 Å²	123	143.6 Å²	143.6	66%	0.658	73%	0.729	S	S	*	*			trans	84.6	119.9	139.2	-85.9	46	0	0	0	121.6
404	T	24.9	Very low	25.3	Very low	111 Å²	111	144.8 Å²	144.8	68%	0.681	73%	0.728	S	S	*	*				46.9	136.1	126.3	63.5	0	0	0	0	119.7
405	D	23.8	Very low	25.3	Very low	134 Å²	134	144.7 Å²	144.7	72%	0.717	72%	0.724	S	S	*	*			cis	-161.9	173.9	13.2	-139.1	-59.2	0	0	0	112.8
406	S	27.4	Very low	25.3	Very low	95 Å²	95	143.7 Å²	143.7	66%	0.664	72%	0.718	S	S	*	*			trans	36.5	103.3	145.7	-68.4	0	0	0	0	120.8
407	S	23.3	Very low	25.3	Very low	95 Å²	95	145 Å²	145	66%	0.664	72%	0.721	S	S	*	*				21.3	125.6	126	170	0	0	0	0	120.2
408	W	24.1	Very low	25.4	Very low	253 Å²	253	140.7 Å²	140.7	96%	0.958	71%	0.712	S	S	*	*			trans	-148.7	162.5	133	-89	112.1	0	0	0	112.1
409	Q	24.7	Very low	26	Very low	167 Å²	167	142.3 Å²	142.3	78%	0.78	71%	0.713	S	S	*	*			trans	-109.1	150.7	-174.8	-63.4	178.6	-17.1	0	0	112.7
410	M	25.1	Very low	26.4	Very low	172 Å²	172	142.5 Å²	142.5	85%	0.847	72%	0.715	S	S	*	*			trans	65.1	152.9	153.5	-119.3	71.4	171.2	0	0	116.2
411	K	23.6	Very low	26.7	Very low	160 Å²	160	139.9 Å²	139.9	70%	0.696	71%	0.706	S	S	*	*			cis	-169	144.3	17	-163.6	170.9	-177.4	-178.8	0	110.8
412	Q	26.7	Very low	26.9	Very low	153 Å²	153	139 Å²	139	72%	0.715	71%	0.711	S	S	*	*			trans	64.9	163.1	158.5	-82.1	169.9	-57.8	0	0	117.3
413	N	25.1	Very low	27.2	Very low	115 Å²	115	135.4 Å²	135.4	62%	0.615	71%	0.706	S	S	*	*			cis	-156.9	172.4	16.2	-140.8	6.3	0	0	0	113.6
414	I	25.6	Very low	27.4	Very low	133 Å²	133	134.1 Å²	134.1	68%	0.682	71%	0.707	S	S	*	*			trans	69.9	134.9	150.6	-78.6	163.1	0	0	0	116.8
415	E	26.9	Very low	27.4	Very low	133 Å²	133	135 Å²	135	62%	0.621	71%	0.712	S	S	*	*			cis	-158.2	176.5	2.5	-116.6	178.9	114.9	0	0	107.5
416	R	27.7	Very low	28.9	Very low	190 Å²	190	134.4 Å²	134.4	72%	0.717	72%	0.716	S	S	*	*			cis	-144.9	179.2	9.6	-107.5	154.9	-157.4	149.7	20.2	107.9
417	D	27.2	Very low	28.8	Very low	137 Å²	137	135 Å²	135	73%	0.733	73%	0.726	S	S	*	*			cis	72.7	144.9	41.1	-128.5	16.5	0	0	0	114.3
418	V	27.6	Very low	29.1	Very low	113 Å²	113	138.2 Å²	138.2	69%	0.685	74%	0.735	S	S	*	*			cis	-138.6	135.4	21.8	171.2	0	0	0	0	113.8
419	S	34.3	Very low	29.3	Very low	94 Å²	94	132.4 Å²	132.4	66%	0.657	73%	0.728	S	S	*	*			trans	41	162.6	149.8	-47.8	0	0	0	0	123.3
420	S	34.8	Very low	29.5	Very low	104 Å²	104	131.5 Å²	131.5	73%	0.727	73%	0.728	S	S	*	*			cis	-154.5	168.2	21.8	-100.5	0	0	0	0	109.4
421	D	34.4	Very low	29.9	Very low	106 Å²	106	128.4 Å²	128.4	57%	0.567	72%	0.719	S	S	*	*			cis	-168.7	177.1	-13.9	-116.7	-89.5	0	0	0	106.3	L423	D421-L423 VanDerWaalsContact OD1-CD1 3.3Å; D421-L423 WeakPolarHBondContact OD1-CD1 3.42Å
422	T	28.8	Very low	30.2	Very low	122 Å²	122	128.6 Å²	128.6	75%	0.748	72%	0.722	S	S	*	*			cis	-122.3	178.9	4.2	56.6	0	0	0	0	109.9
423	L	31.6	Very low	30.4	Very low	134 Å²	134	128.4 Å²	128.4	70%	0.702	72%	0.722	S	S	*	*			cis	74	135.7	27.9	-43.4	176.3	0	0	0	115	D421	D421-L423 VanDerWaalsContact OD1-CD1 3.3Å; D421-L423 WeakPolarHBondContact OD1-CD1 3.42Å
424	S	27.7	Very low	30.6	Very low	95 Å²	95	130.2 Å²	130.2	66%	0.664	73%	0.726	S	S	*	*			cis	-164.5	165.2	-13.8	-90.2	0	0	0	0	110.2
425	T	25.5	Very low	30.6	Very low	129 Å²	129	127.8 Å²	127.8	79%	0.791	72%	0.72	S	S	*	*				178.2	152.1	69	-52.9	0	0	0	0	111.5
426	P	54.8	Low	30.6	Very low	123 Å²	123	129.7 Å²	129.7	80%	0.799	73%	0.729	S	S	*	*			trans	-121.7	172.3	-176.9	42.9	-32.6	0	0	0	117
427	A	24.6	Very low	30.5	Very low	106 Å²	106	127.2 Å²	127.2	88%	0.876	73%	0.73	S	S	*	*			trans	-165.4	178.6	162.4	0	0	0	0	0	114.3
428	L	30.3	Very low	30.5	Very low	163 Å²	163	125.3 Å²	125.3	85%	0.853	73%	0.727	S	S	*	*			trans	-131.4	-175.8	-171	-87.5	168.8	0	0	0	114.1
429	T	28.1	Very low	30.3	Very low	131 Å²	131	123.7 Å²	123.7	80%	0.804	73%	0.734	S	S	*	*			trans	89.4	142.2	-178.7	69.5	0	0	0	0	115.4
430	N	28.4	Very low	29.8	Very low	149 Å²	149	124.2 Å²	124.2	80%	0.797	74%	0.737	S	S	*	*			cis	-146.2	-175.8	4.4	-124.1	13.2	0	0	0	113.1
431	T	33.3	Very low	29.4	Very low	106 Å²	106	126.7 Å²	126.7	65%	0.65	74%	0.737	S	S	*	*			trans	-67	173.1	175.7	45.4	0	0	0	0	113.8
432	E	31.6	Very low	29	Very low	164 Å²	164	130.4 Å²	130.4	77%	0.766	75%	0.751	S	S	*	*			cis	-127.2	177.1	3.1	-76.3	86.5	-130.7	0	0	109
433	E	31.1	Very low	28.7	Very low	149 Å²	149	128.4 Å²	128.4	70%	0.696	76%	0.755	S	S	*	*			cis	-166.9	-166	-14.5	-104.5	-102.1	78.9	0	0	105.4
434	Q	28.9	Very low	28.5	Very low	154 Å²	154	126.8 Å²	126.8	72%	0.72	76%	0.76	S	S	*	*			cis	-154.7	170.3	6.3	-153.9	150.2	72.5	0	0	112.7
435	C	25.3	Very low	28.9	Very low	82 Å²	82	131.8 Å²	131.8	55%	0.554	77%	0.77	S	S	*	*			trans	-2.8	127.4	161.2	-71.6	0	0	0	0	124.7
436	H	26.8	Very low	29	Very low	172 Å²	172	133.8 Å²	133.8	80%	0.796	77%	0.77	S	S	*	*				71.6	149.6	127	-59.8	-27.7	0	0	0	121.4
437	N	26.4	Very low	27.8	Very low	139 Å²	139	135.7 Å²	135.7	74%	0.743	77%	0.768	S	S	*	*			cis	-165.2	163.2	-22.5	-167.7	14.3	0	0	0	110.5
438	S	27	Very low	27.7	Very low	96 Å²	96	139.6 Å²	139.6	67%	0.671	77%	0.766	S	S	*	*			trans	39.7	107.7	150.7	62.4	0	0	0	0	122.9
439	G	22.9	Very low	27.6	Very low	80 Å²	80	136.3 Å²	136.3	83%	0.825	76%	0.757	S	S	*	*				60	155.6	107.5	0	0	0	0	0	125
440	S	24.2	Very low	27.5	Very low	104 Å²	104	138 Å²	138	73%	0.727	76%	0.755	S	S	*	*			trans	99.2	122.7	152.9	-147.5	0	0	0	0	121.6
441	Q	24.9	Very low	27.5	Very low	157 Å²	157	135.4 Å²	135.4	73%	0.734	75%	0.745	S	S	*	*			trans	46.3	145.2	136.7	-68.5	-177	-6.3	0	0	125.6
442	H	26.8	Very low	27.3	Very low	184 Å²	184	138.8 Å²	138.8	85%	0.852	75%	0.753	S	S	*	*			trans	66.7	155.1	147.1	-74.4	-56.9	0	0	0	120.4
443	G	23.6	Very low	27	Very low	80 Å²	80	135.2 Å²	135.2	83%	0.825	75%	0.746	S	S	*	*			trans	145.4	106.5	164.4	0	0	0	0	0	114.2
444	A	27.2	Very low	26.8	Very low	99 Å²	99	134 Å²	134	82%	0.818	75%	0.749	S	S	*	*			trans	-96.2	151.8	-179.9	0	0	0	0	0	113.7
445	K	35.2	Very low	26.8	Very low	201 Å²	201	133.2 Å²	133.2	87%	0.874	75%	0.748	S	S	*	*			trans	16.2	123.7	152.6	-64.6	-179.9	176	-179.7	0	119.8
446	Q	27.6	Very low	26.7	Very low	171 Å²	171	136.4 Å²	136.4	80%	0.799	76%	0.759	S	S	*	*				-155.1	129.6	122.1	-98.7	161.5	35.3	0	0	105.9
447	Q	29.7	Very low	26.6	Very low	162 Å²	162	132.9 Å²	132.9	76%	0.757	75%	0.754	S	S	*	*				70.8	113.5	56.4	-172.6	-177.9	9.7	0	0	112.9
448	F	23.7	Very low	26.5	Very low	189 Å²	189	134 Å²	134	83%	0.829	76%	0.755	S	S	*	*			trans	-164.8	171.4	133.2	-104.6	-66.6	0	0	0	110.6
449	S	27.1	Very low	26.4	Very low	93 Å²	93	136.5 Å²	136.5	65%	0.65	76%	0.76	S	S	*	*			trans	-137	167.3	-168.4	57.5	0	0	0	0	111.1
450	H	26.2	Very low	26.5	Very low	167 Å²	167	136.6 Å²	136.6	77%	0.773	76%	0.761	S	S	*	*			trans	156.6	151.4	155.3	-93.6	55.9	0	0	0	109.3
451	T	27.2	Very low	26.5	Very low	94 Å²	94	141.1 Å²	141.1	58%	0.577	77%	0.768	S	S	*	*			cis	-167.5	152.4	-15.1	15.7	0	0	0	0	110.2
452	Q	30.2	Very low	26.4	Very low	178 Å²	178	143.3 Å²	143.3	83%	0.832	77%	0.769	S	S	*	*			trans	48.3	155.5	137.6	-69.6	178.5	-7.4	0	0	121.4
453	S	25.2	Very low	26.3	Very low	89 Å²	89	142.5 Å²	142.5	62%	0.622	76%	0.759	S	S	*	*			cis	-169.7	168.9	6.3	-122.8	0	0	0	0	112.6
454	V	27.7	Very low	26.2	Very low	124 Å²	124	145.2 Å²	145.2	75%	0.752	75%	0.75	S	S	*	*			trans	68.8	138.4	142	161.2	0	0	0	0	118.9
455	I	27.7	Very low	26	Very low	137 Å²	137	145.2 Å²	145.2	70%	0.703	74%	0.744	S	S	*	*			cis	-167	163.5	-16.3	-122.1	174.3	0	0	0	110.2
456	L	24	Very low	25.4	Very low	148 Å²	148	140.6 Å²	140.6	78%	0.775	74%	0.737	S	S	*	*			trans	5.7	157.1	155.4	-50.4	171.6	0	0	0	121.6
457	S	24.5	Very low	25.1	Very low	99 Å²	99	137.1 Å²	137.1	69%	0.692	73%	0.731	S	S	*	*			cis	-170.6	179.4	6.8	-126.9	0	0	0	0	114.6
458	E	23.9	Very low	24.9	Very low	163 Å²	163	136.3 Å²	136.3	76%	0.762	73%	0.733	S	S	*	*			trans	89.4	125.4	144.5	-93.1	-158.2	94.6	0	0	125.6
459	N	25.1	Very low	24.9	Very low	147 Å²	147	133 Å²	133	79%	0.786	73%	0.727	S	S	*	*			trans	36.8	129.6	132.1	-73.7	-31.6	0	0	0	123.3
460	G	25.2	Very low	24.7	Very low	82 Å²	82	134 Å²	134	85%	0.845	73%	0.729	S	S	*	*			trans	-179.7	123	158	0	0	0	0	0	115.8
461	K	24.2	Very low	24.7	Very low	199 Å²	199	134.1 Å²	134.1	87%	0.865	74%	0.736	S	S	*	*			trans	-95.1	143.4	-176.7	-71.4	167.6	177.6	163.1	0	114
462	R	22.7	Very low	24.5	Very low	203 Å²	203	136.6 Å²	136.6	77%	0.766	74%	0.744	S	S	*	*			trans	69.8	131.9	138.3	-84.3	-174.9	165.2	-157.6	0.1	122.7
463	R	24.1	Very low	24.2	Very low	168 Å²	168	135.4 Å²	135.4	63%	0.634	74%	0.742	S	S	*	*				76.7	135.7	129.7	-78.6	-178.4	162.5	-133.8	0.6	122.1
464	E	22	Very low	24.2	Very low	136 Å²	136	136.7 Å²	136.7	64%	0.636	75%	0.746	S	S	*	*			trans	61.3	146	137.4	-67.4	148.9	-148.1	0	0	118.5
465	S	22.6	Very low	23.9	Very low	99 Å²	99	139.1 Å²	139.1	69%	0.692	75%	0.749	S	S	*	*			cis	-166	149.1	-16.6	-96.8	0	0	0	0	111.1
466	S	22.3	Very low	24.5	Very low	105 Å²	105	138 Å²	138	73%	0.734	75%	0.75	S	S	*	*			trans	50.2	124.8	149	63.1	0	0	0	0	123.5
467	S	22.8	Very low	24.7	Very low	97 Å²	97	136.6 Å²	136.6	68%	0.678	75%	0.751	S	S	*	*				105.1	143.7	126.4	78.5	0	0	0	0	122.2
468	N	24.4	Very low	24.7	Very low	146 Å²	146	137.2 Å²	137.2	78%	0.781	76%	0.755	S	S	*	*			trans	75.5	145.3	156	-56.1	-25	0	0	0	120.6
469	V	23	Very low	25.8	Very low	118 Å²	118	135 Å²	135	72%	0.715	75%	0.754	S	S	*	*			cis	-162.9	142.7	-40.8	112.7	0	0	0	0	109.9
470	T	24	Very low	25.6	Very low	114 Å²	114	136.8 Å²	136.8	70%	0.699	76%	0.758	S	S	*	*			trans	40.5	128.4	165.9	59.8	0	0	0	0	122.4
471	N	25.2	Very low	25.6	Very low	170 Å²	170	138.9 Å²	138.9	91%	0.909	76%	0.76	S	S	*	*				-148.8	169.9	128.7	-111.4	-35.3	0	0	0	110.4
472	I	24.1	Very low	25.8	Very low	147 Å²	147	134.3 Å²	134.3	75%	0.754	75%	0.753	S	S	*	*			trans	-125.8	147.9	-154.4	-42.5	176.2	0	0	0	112.3
473	I	23.8	Very low	26.5	Very low	152 Å²	152	130.3 Å²	130.3	78%	0.779	75%	0.753	S	S	*	*			trans	147.2	106.9	136.4	-74.5	168.5	0	0	0	114.3
474	V	25.2	Very low	26.8	Very low	116 Å²	116	129.3 Å²	129.3	70%	0.703	76%	0.76	S	S	*	*			trans	51.9	114.4	134.6	-174	0	0	0	0	122.7
475	E	22.2	Very low	27.2	Very low	176 Å²	176	128.6 Å²	128.6	82%	0.822	77%	0.77	S	S	*	*			trans	43.2	160.3	142.3	-67.3	-172.4	104.3	0	0	123.2
476	P	38.4	Very low	27.5	Very low	112 Å²	112	131.3 Å²	131.3	73%	0.727	78%	0.777	S	S	*	*			cis	-117	-147	-11.9	42.6	-27.1	0	0	0	109.5
477	P	30	Very low	28	Very low	120 Å²	120	129.3 Å²	129.3	78%	0.779	77%	0.773	S	S	*	*			cis	-130	-148.6	-17.3	43.3	-24.8	0	0	0	112.9
478	S	24.2	Very low	28.3	Very low	111 Å²	111	128.2 Å²	128.2	78%	0.776	78%	0.777	S	S	*	*			trans	-137.5	-179.1	171.1	-16.2	0	0	0	0	109.7
479	P	45.4	Very low	28.8	Very low	116 Å²	116	126.8 Å²	126.8	75%	0.753	77%	0.774	S	S	*	*			cis	-129.4	170.1	-26.2	39.9	-26.1	0	0	0	113.1
480	E	22.6	Very low	29.9	Very low	186 Å²	186	125.9 Å²	125.9	87%	0.869	77%	0.771	S	S	*	*			trans	171.2	174.9	135.8	-104.5	-173.2	-172.5	0	0	115
481	S	25.4	Very low	31.6	Very low	126 Å²	126	127.8 Å²	127.8	88%	0.881	77%	0.772	S	S	*	*			trans	83.1	139.5	169.5	73.2	0	0	0	0	119.3
482	S	27.7	Very low	34	Very low	103 Å²	103	124.5 Å²	124.5	72%	0.72	75%	0.753	S	S	*	*			trans	-106.2	-175.3	-175.9	54	0	0	0	0	112.1
483	P	36.9	Very low	36.7	Very low	118 Å²	118	120.2 Å²	120.2	77%	0.766	73%	0.73	S	S	*	*				-143.8	176.2	99.7	39.6	-25.5	0	0	0	115
484	D	30.8	Very low	39.6	Very low	147 Å²	147	114.5 Å²	114.5	79%	0.786	70%	0.699	S	S	*	*			trans	-70.7	141.1	-175.8	-50.4	-90.9	0	0	0	114.9
485	S	31.2	Very low	42.6	Very low	122 Å²	122	110.8 Å²	110.8	85%	0.853	68%	0.681	S	S	*	*			trans	160.4	109.9	131.2	-73.5	0	0	0	0	111.8
486	D	27.9	Very low	45.7	Very low	155 Å²	155	102.9 Å²	102.9	83%	0.829	65%	0.647	S	S	*	*				-161.2	146.5	124.2	-147.3	-13.8	0	0	0	112.6	G488	D486-G488 PolarHBondContact O-N 2.93Å
487	G	32.3	Very low	48.1	Very low	64 Å²	64	101.6 Å²	101.6	66%	0.66	63%	0.634	S	S	*	*			trans	-87.3	85.6	169.5	0	0	0	0	0	109.7	T489	G487-T489 PolarHBondContact O-N 2.86Å
488	G	29.1	Very low	51	Low	73 Å²	73	96 Å²	96	75%	0.753	60%	0.597	S	S	*	*			trans	-51.6	90.6	-167.1	0	0	0	0	0	116	D486	D486-G488 PolarHBondContact O-N 2.93Å
489	T	35.8	Very low	54.2	Low	116 Å²	116	92.4 Å²	92.4	71%	0.712	57%	0.569	S	S	*	*			trans	-57.6	142.4	158.4	59	0	0	0	0	108.7	G487 E491	G487-T489 PolarHBondContact O-N 2.86Å; T489-E491 PolarHBondContact O-N 3.14Å
490	P	45.8	Very low	56.4	Low	100 Å²	100	87.3 Å²	87.3	65%	0.649	54%	0.535	S	S	*	.			trans	-60	115.4	-173.7	25.3	-35.4	0	0	0	110.3	L492 V522	P490-L492 PolarHBondContact O-N 3.37Å; P490-V522 HydrophobicContact CB-CG1 3.8Å; P490-V522 HydrophobicContact CG-CG1 4.21Å
491	E	59.1	Low	59.7	Low	154 Å²	154	78.5 Å²	78.5	72%	0.72	49%	0.494	S	S	*	.			trans	-59.8	129.5	-161.7	-165.4	175.4	-174.5	0	0	112.1	T489 E493	T489-E491 PolarHBondContact O-N 3.14Å; E491-E493 VanDerWaalsContact C-N 3.33Å; E491-E493 PolarHBondContact O-N 2.94Å
492	L	75.9	Confident	62.9	Low	101 Å²	101	75 Å²	75	53%	0.529	46%	0.463	S	S	.	.			trans	-83.9	77.7	-176	-179.8	53.4	0	0	0	110.6	P490 K494 A495 V520 V522	P490-L492 PolarHBondContact O-N 3.37Å; L492-K494 VanDerWaalsContact C-N 3.26Å; L492-K494 PolarHBondContact O-N 3.17Å; L492-A495 HydrophobicContact CD1-CB 4.26Å; L492-A495 HydrophobicContact CD2-CB 4.38Å; L492-V520 HydrophobicContact CD1-CG1 3.4Å; L492-V522 HydrophobicContact CD1-CG2 4.13Å
493	E	80.5	Confident	65.8	Low	56 Å²	56	71 Å²	71	26%	0.262	43%	0.433	S	S	.	.			trans	-46.6	-46	176.7	-68	-87.7	-169.8	0	0	112.9	E491 L521 V601 R604	E491-E493 VanDerWaalsContact C-N 3.33Å; E491-E493 PolarHBondContact O-N 2.94Å; E493-L521 HydrophobicContact CB-CB 4.21Å; E493-L521 HydrophobicContact CB-CD2 3.89Å; E493-L521 HydrophobicContact CB-CG 3.75Å; E493-L521 HydrophobicContact CG-CG 4.4Å; E493-L521 PolarHBondContact N-O 2.96Å; E493-V601 HydrophobicContact CG-CG2 4.32Å; E493-R604 IonicContact OE1-CZ 2.8Å; E493-R604 IonicContact OE1-NH1 3.77Å; E493-R604 PolarHBondContact OE1-NH1 3.15Å; E493-R604 IonicContact OE1-NH2 2.63Å; E493-R604 PolarHBondContact OE1-NH2 2.62Å
494	K	86.1	Confident	68.2	Low	32 Å²	32	65.6 Å²	65.6	14%	0.139	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-164.2	144.1	173.7	-154.7	162.9	175.7	63.8	0	113.9	L492 V520 L521 E593 W594 T597	L492-K494 VanDerWaalsContact C-N 3.26Å; L492-K494 PolarHBondContact O-N 3.17Å; K494-V520 CarbonylContact O-C 3.36Å; K494-V520 WeakPolarHBondContact O-CA 3.17Å; K494-L521 HydrophobicContact CB-CB 4.32Å; K494-L521 PolarHBondContact N-O 3.2Å; K494-L521 PolarHBondContact O-N 3.23Å; K494-E593 VanDerWaalsContact CE-CD 3.49Å; K494-E593 VanDerWaalsContact CE-OE2 3.27Å; K494-E593 WeakPolarHBondContact CE-OE2 3.33Å; K494-E593 IonicContact NZ-OE1 3.49Å; K494-E593 PolarHBondContact NZ-OE1 3.3Å; K494-E593 IonicContact NZ-OE2 3.23Å; K494-E593 PolarHBondContact NZ-OE2 3.41Å; K494-W594 HydrophobicContact CB-CE3 4.43Å; K494-W594 HydrophobicContact CB-CH2 3.83Å; K494-W594 HydrophobicContact CB-CZ2 4.36Å; K494-W594 HydrophobicContact CB-CZ3 3.87Å; K494-W594 HydrophobicContact CD-CD2 3.77Å; K494-W594 HydrophobicContact CD-CE3 3.91Å; K494-W594 HydrophobicContact CD-CG 4.3Å; K494-W594 HydrophobicContact CD-CH2 4.26Å; K494-W594 HydrophobicContact CD-CZ2 4.12Å; K494-W594 HydrophobicContact CD-CZ3 4.16Å; K494-W594 HydrophobicContact CG-CD2 4.37Å; K494-W594 HydrophobicContact CG-CE3 4.35Å; K494-W594 HydrophobicContact CG-CH2 3.81Å; K494-W594 HydrophobicContact CG-CZ2 3.82Å; K494-W594 HydrophobicContact CG-CZ3 4.09Å; K494-T597 HydrophobicContact CB-CG2 4.47Å; K494-T597 HydrophobicContact CD-CG2 4.5Å
495	A	87.3	Confident	70.7	Confident	39 Å²	39	63.5 Å²	63.5	32%	0.322	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	152	166.1	0	0	0	0	0	111.8	L492 W518 V519 V520	L492-A495 HydrophobicContact CD1-CB 4.26Å; L492-A495 HydrophobicContact CD2-CB 4.38Å; A495-W518 HydrophobicContact CB-CZ2 4.1Å; A495-V519 CarbonylContact C-O 3.58Å; A495-V519 WeakPolarHBondContact CA-O 3.41Å; A495-V520 HydrophobicContact CB-CG1 4.38Å; A495-V520 HydrophobicContact CB-CG2 4.48Å
496	G	87.1	Confident	72.6	Confident	10 Å²	10	60.5 Å²	60.5	10%	0.103	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	162.9	169.6	174.4	0	0	0	0	0	114.7	V519	G496-V519 PolarHBondContact N-O 3.3Å; G496-V519 PolarHBondContact O-N 2.95Å
497	L	88.4	Confident	74.5	Confident	85 Å²	85	56 Å²	56	45%	0.445	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	129.5	179.8	-166.2	74	0	0	0	111.3	P516 W518	L497-P516 HydrophobicContact CD1-CB 4.36Å; L497-W518 HydrophobicContact CB-CE3 4.12Å; L497-W518 HydrophobicContact CB-CZ3 4.34Å; L497-W518 HydrophobicContact CD1-CE3 4.44Å
498	L	91.9	Very high	76.6	Confident	3 Å²	3	58.7 Å²	58.7	2%	0.016	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	151.8	169.2	-66.3	175.4	0	0	0	110.8	S517 V519 L583 I591 W594	L498-S517 PolarHBondContact N-O 3.14Å; L498-S517 PolarHBondContact O-N 3.49Å; L498-S517 VanDerWaalsContact O-O 3.09Å; L498-V519 HydrophobicContact CB-CG2 3.79Å; L498-V519 HydrophobicContact CD1-CB 4.34Å; L498-V519 HydrophobicContact CD1-CG2 4.04Å; L498-V519 HydrophobicContact CG-CG2 4.16Å; L498-L583 HydrophobicContact CD1-CB 4.48Å; L498-L583 HydrophobicContact CD1-CD1 4.38Å; L498-I591 HydrophobicContact CD2-CD1 4.1Å; L498-W594 HydrophobicContact CD1-CD2 3.85Å; L498-W594 HydrophobicContact CD1-CE3 4.35Å; L498-W594 HydrophobicContact CD1-CG 3.95Å; L498-W594 HydrophobicContact CD2-CG 4.4Å
499	N	90.5	Very high	79.3	Confident	34 Å²	34	64.9 Å²	64.9	18%	0.182	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	125.9	165.3	-75.6	-47.7	0	0	0	108.9	W514 K567 L583 Q584	N499-W514 HydrophobicContact CB-CE3 4.13Å; N499-W514 HydrophobicContact CB-CZ3 4.39Å; N499-K567 PolarHBondContact ND2-NZ 3.05Å; N499-L583 WeakPolarHBondContact O-CA 3.4Å; N499-Q584 HydrophobicContact CB-CB 4.14Å; N499-Q584 VanDerWaalsContact CB-OE1 3.27Å; N499-Q584 PolarHBondContact N-O 3.14Å; N499-Q584 PolarHBondContact ND2-OE1 3.01Å; N499-Q584 PolarHBondContact O-N 3.3Å
500	K	92.3	Very high	81.6	Confident	9 Å²	9	62.8 Å²	62.8	4%	0.039	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	154.8	176.4	73.6	-178.8	179.8	-161.5	0	111.9	W514 S515 S517 F528 E548 L582 L583	K500-W514 VanDerWaalsContact C-CE3 3.49Å; K500-W514 WeakPolarHBondContact O-CA 3.45Å; K500-S515 PolarHBondContact N-O 2.93Å; K500-S515 PolarHBondContact O-N 2.82Å; K500-S517 WeakPolarHBondContact CE-OG 3.46Å; K500-S517 PolarHBondContact NZ-OG 3.29Å; K500-F528 HydrophobicContact CD-CB 4.41Å; K500-F528 HydrophobicContact CD-CD1 3.78Å; K500-F528 HydrophobicContact CD-CE1 4.33Å; K500-F528 HydrophobicContact CD-CG 4.18Å; K500-E548 WeakPolarHBondContact CE-OE1 3.33Å; K500-E548 IonicContact NZ-OE1 2.77Å; K500-E548 PolarHBondContact NZ-OE1 3.32Å; K500-E548 IonicContact NZ-OE2 3.83Å; K500-E548 PolarHBondContact NZ-OE2 2.98Å; K500-L582 CarbonylContact C-O 3.55Å; K500-L582 WeakPolarHBondContact CA-O 3.07Å; K500-L583 HydrophobicContact CB-CD2 3.55Å
501	T	92.1	Very high	83.4	Confident	1 Å²	1	69.5 Å²	69.5	1%	0.006	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	135.4	155.4	175.7	0	0	0	0	109.7	I503 K512 N513 W514 F581 L582	T501-I503 HydrophobicContact CG2-CG2 3.98Å; T501-K512 WeakPolarHBondContact OG1-CA 3.38Å; T501-N513 VanDerWaalsContact CB-O 3.31Å; T501-N513 WeakPolarHBondContact CB-O 3.37Å; T501-N513 PolarHBondContact OG1-N 2.77Å; T501-N513 PolarHBondContact OG1-O 2.85Å; T501-W514 HydrophobicContact CG2-CD2 3.72Å; T501-W514 HydrophobicContact CG2-CE3 3.82Å; T501-W514 HydrophobicContact CG2-CG 4.45Å; T501-W514 HydrophobicContact CG2-CH2 3.81Å; T501-W514 HydrophobicContact CG2-CZ2 3.69Å; T501-W514 HydrophobicContact CG2-CZ3 3.86Å; T501-F581 WeakPolarHBondContact O-CA 3.36Å; T501-L582 HydrophobicContact CG2-CB 3.83Å; T501-L582 HydrophobicContact CG2-CD1 4.13Å; T501-L582 HydrophobicContact CG2-CG 4.27Å; T501-L582 PolarHBondContact N-O 3.32Å; T501-L582 PolarHBondContact O-N 3.18Å
502	K	91.7	Very high	84.8	Confident	53 Å²	53	67.3 Å²	67.3	23%	0.23	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	129.6	167.2	-159.4	174.6	-172.8	174.3	0	108.5	A504 E505 L510 N579 F581	K502-A504 VanDerWaalsContact CE-O 3.27Å; K502-A504 WeakPolarHBondContact CE-O 3.44Å; K502-E505 IonicContact NZ-OE1 3.15Å; K502-E505 PolarHBondContact NZ-OE1 3.04Å; K502-L510 HydrophobicContact CB-CD1 4.24Å; K502-L510 HydrophobicContact CD-CD1 3.99Å; K502-L510 HydrophobicContact CG-CD1 3.94Å; K502-N579 WeakPolarHBondContact CE-OD1 3.42Å; K502-N579 PolarHBondContact NZ-OD1 2.76Å; K502-F581 HydrophobicContact CB-CD1 4.03Å; K502-F581 HydrophobicContact CB-CE1 4.08Å; K502-F581 HydrophobicContact CD-CE1 3.84Å; K502-F581 HydrophobicContact CD-CZ 4.14Å; K502-F581 HydrophobicContact CG-CD1 3.9Å; K502-F581 HydrophobicContact CG-CE1 3.7Å; K502-F581 HydrophobicContact CG-CZ 4.22Å
503	I	89.9	Confident	85.4	Confident	20 Å²	20	68.6 Å²	68.6	10%	0.103	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	-15.2	-178.6	66.7	166	0	0	0	113.1	T501 K509 L510 K512 K572 E580 L582	T501-I503 HydrophobicContact CG2-CG2 3.98Å; I503-K509 WeakPolarHBondContact O-CA 3.43Å; I503-L510 PolarHBondContact O-N 2.78Å; I503-K512 HydrophobicContact CG2-CG 4Å; I503-K572 HydrophobicContact CD1-CD 4.34Å; I503-E580 HydrophobicContact CD1-CB 4.25Å; I503-E580 HydrophobicContact CG1-CB 3.65Å; I503-E580 PolarHBondContact N-O 3.33Å; I503-L582 HydrophobicContact CD1-CD1 4.36Å; I503-L582 HydrophobicContact CD1-CD2 3.87Å; I503-L582 HydrophobicContact CD1-CG 3.92Å; I503-L582 HydrophobicContact CG1-CG 4.41Å; I503-L582 HydrophobicContact CG2-CD1 3.93Å; I503-L582 HydrophobicContact CG2-CG 3.88Å
504	A	86.3	Confident	85.8	Confident	4 Å²	4	69.3 Å²	69.3	3%	0.033	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	153	164.4	0	0	0	0	0	112.7	K502 R508 N579 E580	K502-A504 VanDerWaalsContact CE-O 3.27Å; K502-A504 WeakPolarHBondContact CE-O 3.44Å; A504-R508 CarbonylContact C-O 3.58Å; A504-R508 WeakPolarHBondContact CA-O 3.44Å; A504-R508 WeakPolarHBondContact CB-O 3.41Å; A504-N579 WeakPolarHBondContact O-CA 3.44Å; A504-E580 HydrophobicContact CB-CB 3.81Å; A504-E580 HydrophobicContact CB-CG 3.92Å; A504-E580 PolarHBondContact N-O 2.84Å; A504-E580 PolarHBondContact O-N 2.76Å
505	E	83.6	Confident	86	Confident	103 Å²	103	69.4 Å²	69.4	48%	0.481	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	119.4	173	177.3	158.6	-106.5	0	0	109.9	K502 G507 R508 L510 N579	K502-E505 IonicContact NZ-OE1 3.15Å; K502-E505 PolarHBondContact NZ-OE1 3.04Å; E505-G507 PolarHBondContact O-N 3.07Å; E505-G507 VanDerWaalsContact O-N 3.12Å; E505-R508 PolarHBondContact N-O 3.23Å; E505-R508 WeakPolarHBondContact O-CB 3.41Å; E505-R508 PolarHBondContact O-N 2.8Å; E505-L510 HydrophobicContact CB-CD1 3.9Å; E505-L510 HydrophobicContact CB-CG 4.46Å; E505-N579 WeakPolarHBondContact CA-OD1 3.02Å
506	G	71.1	Confident	86.1	Confident	58 Å²	58	70.3 Å²	70.3	60%	0.598	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.7	30.7	-175	0	0	0	0	0	114.1	G578	G506-G578 PolarHBondContact N-O 3.28Å
507	G	68.5	Low	86.2	Confident	60 Å²	60	69.8 Å²	69.8	62%	0.619	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.9	-3.9	-174.3	0	0	0	0	0	116	E505 G578	E505-G507 PolarHBondContact O-N 3.07Å; E505-G507 VanDerWaalsContact O-N 3.12Å; G507-G578 PolarHBondContact N-O 3.31Å
508	R	76.2	Confident	86.1	Confident	122 Å²	122	66.9 Å²	66.9	46%	0.46	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	123.5	173	-56.4	-176	-173.1	-159.2	2	109.6	A504 E505 E652	A504-R508 CarbonylContact C-O 3.58Å; A504-R508 WeakPolarHBondContact CA-O 3.44Å; A504-R508 WeakPolarHBondContact CB-O 3.41Å; E505-R508 PolarHBondContact N-O 3.23Å; E505-R508 WeakPolarHBondContact O-CB 3.41Å; E505-R508 PolarHBondContact O-N 2.8Å; R508-E652 IonicContact CZ-OE2 3.58Å; R508-E652 IonicContact NH2-OE1 3.13Å; R508-E652 PolarHBondContact NH2-OE1 2.91Å; R508-E652 IonicContact NH2-OE2 2.68Å; R508-E652 PolarHBondContact NH2-OE2 3.17Å
509	K	86.1	Confident	86.1	Confident	202 Å²	202	66.8 Å²	66.8	88%	0.878	34%	0.335	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64	132.8	175.4	-67.1	-176.4	178.8	-179.5	0	110.5	I503	I503-K509 WeakPolarHBondContact O-CA 3.43Å
510	L	83.8	Confident	86	Confident	73 Å²	73	65.4 Å²	65.4	38%	0.382	33%	0.329	S	S	.	.			trans	-108.2	153.3	176.1	-66.4	175.6	0	0	0	110.7	K502 I503 E505 K512	K502-L510 HydrophobicContact CB-CD1 4.24Å; K502-L510 HydrophobicContact CD-CD1 3.99Å; K502-L510 HydrophobicContact CG-CD1 3.94Å; I503-L510 PolarHBondContact O-N 2.78Å; E505-L510 HydrophobicContact CB-CD1 3.9Å; E505-L510 HydrophobicContact CB-CG 4.46Å; L510-K512 PolarHBondContact O-N 2.75Å
511	R	83.4	Confident	85.8	Confident	240 Å²	240	65 Å²	65	91%	0.906	33%	0.327	S	S	*	.			trans	-68.3	130.1	169.7	-179	-179.8	176.3	-173.9	-0.1	108.8	N513	R511-N513 PolarHBondContact O-N 3.43Å
512	K	88.7	Confident	85.4	Confident	109 Å²	109	67 Å²	67	47%	0.474	34%	0.339	S	S	.	.			trans	-56.2	125.4	174.1	-59.5	174	-168.2	174	0	109.7	T501 I503 L510 L564	T501-K512 WeakPolarHBondContact OG1-CA 3.38Å; I503-K512 HydrophobicContact CG2-CG 4Å; L510-K512 PolarHBondContact O-N 2.75Å; K512-L564 WeakPolarHBondContact CE-O 3.47Å; K512-L564 PolarHBondContact NZ-O 2.96Å
513	N	87.7	Confident	84.9	Confident	127 Å²	127	65.4 Å²	65.4	68%	0.679	34%	0.338	S	S	*	.			trans	-138.9	104	174.5	-174.6	41.8	0	0	0	107.6	T501 R511	T501-N513 VanDerWaalsContact CB-O 3.31Å; T501-N513 WeakPolarHBondContact CB-O 3.37Å; T501-N513 PolarHBondContact OG1-N 2.77Å; T501-N513 PolarHBondContact OG1-O 2.85Å; R511-N513 PolarHBondContact O-N 3.43Å
514	W	90.3	Very high	84.5	Confident	71 Å²	71	67.2 Å²	67.2	27%	0.269	35%	0.347	S	S	.	.			trans	-80.4	127.8	-176.3	-71.9	104	0	0	0	110.8	N499 K500 T501 K567 V570 L582 Q584	N499-W514 HydrophobicContact CB-CE3 4.13Å; N499-W514 HydrophobicContact CB-CZ3 4.39Å; K500-W514 VanDerWaalsContact C-CE3 3.49Å; K500-W514 WeakPolarHBondContact O-CA 3.45Å; T501-W514 HydrophobicContact CG2-CD2 3.72Å; T501-W514 HydrophobicContact CG2-CE3 3.82Å; T501-W514 HydrophobicContact CG2-CG 4.45Å; T501-W514 HydrophobicContact CG2-CH2 3.81Å; T501-W514 HydrophobicContact CG2-CZ2 3.69Å; T501-W514 HydrophobicContact CG2-CZ3 3.86Å; W514-K567 HydrophobicContact CD2-CD 4.22Å; W514-K567 HydrophobicContact CH2-CD 4.45Å; W514-K567 HydrophobicContact CZ2-CD 4.1Å; W514-V570 HydrophobicContact CH2-CG1 4.21Å; W514-V570 HydrophobicContact CH2-CG2 4.37Å; W514-L582 HydrophobicContact CH2-CB 3.75Å; W514-L582 HydrophobicContact CH2-CD1 4.48Å; W514-L582 HydrophobicContact CZ2-CB 4.38Å; W514-L582 HydrophobicContact CZ2-CD1 4.32Å; W514-L582 HydrophobicContact CZ3-CB 4.38Å; W514-Q584 HydrophobicContact CH2-CB 3.87Å; W514-Q584 HydrophobicContact CZ3-CB 3.68Å
515	S	88.8	Confident	84.5	Confident	35 Å²	35	69 Å²	69	25%	0.245	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	145.5	169.1	57.3	0	0	0	0	111.3	K500	K500-S515 PolarHBondContact N-O 2.93Å; K500-S515 PolarHBondContact O-N 2.82Å
516	P	89.2	Confident	84.8	Confident	57 Å²	57	64 Å²	64	37%	0.37	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	140.9	163.4	30.5	-33.9	0	0	0	108.9	L497	L497-P516 HydrophobicContact CD1-CB 4.36Å
517	S	89.3	Confident	85.6	Confident	0 Å²	0	62.3 Å²	62.3	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	137.4	178.7	-165.4	0	0	0	0	109.3	L498 K500 V519 F529	L498-S517 PolarHBondContact N-O 3.14Å; L498-S517 PolarHBondContact O-N 3.49Å; L498-S517 VanDerWaalsContact O-O 3.09Å; K500-S517 WeakPolarHBondContact CE-OG 3.46Å; K500-S517 PolarHBondContact NZ-OG 3.29Å; S517-V519 PolarHBondContact O-N 3.2Å; S517-F529 WeakPolarHBondContact CA-O 3.47Å; S517-F529 PolarHBondContact OG-O 3.18Å
518	W	87.9	Confident	86.6	Confident	24 Å²	24	59.5 Å²	59.5	9%	0.091	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	115.6	169.9	-173	-101.2	0	0	0	107.9	A495 L497 F529 P537 W540	A495-W518 HydrophobicContact CB-CZ2 4.1Å; L497-W518 HydrophobicContact CB-CE3 4.12Å; L497-W518 HydrophobicContact CB-CZ3 4.34Å; L497-W518 HydrophobicContact CD1-CE3 4.44Å; W518-F529 HydrophobicContact CB-CB 4.22Å; W518-F529 PolarHBondContact N-O 3.39Å; W518-F529 PolarHBondContact O-N 3.13Å; W518-P537 HydrophobicContact CH2-CB 3.95Å; W518-P537 HydrophobicContact CH2-CG 4.5Å; W518-W540 AromaticContact CD1-CD2 3.9Å; W518-W540 AromaticContact CD1-CE2 3.75Å; W518-W540 AromaticContact CD1-CZ2 3.83Å; W518-W540 AromaticContact NE1-CD2 3.44Å; W518-W540 AromaticContact NE1-CE2 3.81Å; W518-W540 AromaticContact NE1-CE3 3.39Å; W518-W540 AromaticContact NE1-CZ3 3.72Å
519	V	90.8	Very high	86.9	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	134.3	-174.7	-170.3	0	0	0	0	108.7	A495 G496 L498 S517 L526 V527 F528 W594	A495-V519 CarbonylContact C-O 3.58Å; A495-V519 WeakPolarHBondContact CA-O 3.41Å; G496-V519 PolarHBondContact N-O 3.3Å; G496-V519 PolarHBondContact O-N 2.95Å; L498-V519 HydrophobicContact CB-CG2 3.79Å; L498-V519 HydrophobicContact CD1-CB 4.34Å; L498-V519 HydrophobicContact CD1-CG2 4.04Å; L498-V519 HydrophobicContact CG-CG2 4.16Å; S517-V519 PolarHBondContact O-N 3.2Å; V519-L526 HydrophobicContact CG1-CD1 3.53Å; V519-L526 HydrophobicContact CG1-CD2 4.44Å; V519-L526 HydrophobicContact CG1-CG 3.94Å; V519-V527 WeakPolarHBondContact CA-O 3.35Å; V519-F528 HydrophobicContact CG1-CD1 4.17Å; V519-F528 HydrophobicContact CG1-CE1 3.92Å; V519-F528 HydrophobicContact CG2-CD1 3.83Å; V519-F528 HydrophobicContact CG2-CE1 3.95Å; V519-W594 HydrophobicContact CB-CH2 4.07Å; V519-W594 HydrophobicContact CB-CZ2 4.42Å; V519-W594 HydrophobicContact CG1-CH2 4.06Å; V519-W594 HydrophobicContact CG1-CZ3 4.11Å
520	V	88.9	Confident	86.7	Confident	6 Å²	6	52.5 Å²	52.5	4%	0.036	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	119.6	-177.2	-165.5	0	0	0	0	108	L492 K494 A495 V522 V527 F529 W540	L492-V520 HydrophobicContact CD1-CG1 3.4Å; K494-V520 CarbonylContact O-C 3.36Å; K494-V520 WeakPolarHBondContact O-CA 3.17Å; A495-V520 HydrophobicContact CB-CG1 4.38Å; A495-V520 HydrophobicContact CB-CG2 4.48Å; V520-V522 HydrophobicContact CG1-CG2 3.6Å; V520-V527 PolarHBondContact N-O 3.45Å; V520-V527 PolarHBondContact O-N 2.92Å; V520-F529 HydrophobicContact CB-CD2 4.49Å; V520-F529 HydrophobicContact CB-CE2 4.04Å; V520-F529 HydrophobicContact CG2-CD2 3.69Å; V520-F529 HydrophobicContact CG2-CE2 3.58Å; V520-W540 HydrophobicContact CG2-CH2 3.84Å; V520-W540 HydrophobicContact CG2-CZ3 3.94Å
521	L	87.3	Confident	85.9	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	118.6	174.2	179.8	61.4	0	0	0	107.5	E493 K494 L526 L553 W594 T597 I598 V601	E493-L521 HydrophobicContact CB-CB 4.21Å; E493-L521 HydrophobicContact CB-CD2 3.89Å; E493-L521 HydrophobicContact CB-CG 3.75Å; E493-L521 HydrophobicContact CG-CG 4.4Å; E493-L521 PolarHBondContact N-O 2.96Å; K494-L521 HydrophobicContact CB-CB 4.32Å; K494-L521 PolarHBondContact N-O 3.2Å; K494-L521 PolarHBondContact O-N 3.23Å; L521-L526 HydrophobicContact CB-CD1 4.02Å; L521-L526 HydrophobicContact CD1-CD1 4.07Å; L521-L553 HydrophobicContact CD1-CD1 3.45Å; L521-L553 VanDerWaalsContact CD1-CD1 3.45Å; L521-W594 HydrophobicContact CB-CZ3 4.21Å; L521-T597 HydrophobicContact CD2-CG2 3.74Å; L521-I598 HydrophobicContact CD2-CG1 4.09Å; L521-V601 HydrophobicContact CD1-CG1 4.45Å; L521-V601 HydrophobicContact CD2-CG2 4.05Å
522	V	83.6	Confident	84.7	Confident	42 Å²	42	42.3 Å²	42.3	26%	0.255	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	112.4	-176.8	-173.6	0	0	0	0	108.3	P490 L492 V520 N524 S525	P490-V522 HydrophobicContact CB-CG1 3.8Å; P490-V522 HydrophobicContact CG-CG1 4.21Å; L492-V522 HydrophobicContact CD1-CG2 4.13Å; V520-V522 HydrophobicContact CG1-CG2 3.6Å; V522-N524 PolarHBondContact O-N 2.83Å; V522-S525 PolarHBondContact N-O 3.13Å; V522-S525 PolarHBondContact O-N 3.35Å
523	G	81.2	Confident	83	Confident	21 Å²	21	46.5 Å²	46.5	22%	0.216	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	47.2	-111.3	-175	0	0	0	0	0	112.5	V601	G523-V601 WeakPolarHBondContact O-CG1 3.3Å
524	N	82.7	Confident	81.4	Confident	57 Å²	57	45.2 Å²	45.2	31%	0.305	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.7	-4.9	-174.2	-55.1	39.2	0	0	0	114.2	V522 L553 R554 L605	V522-N524 PolarHBondContact O-N 2.83Å; N524-L553 PolarHBondContact O-N 3.03Å; N524-R554 PolarHBondContact ND2-NH1 3.03Å; N524-L605 HydrophobicContact CB-CD1 4.37Å; N524-L605 HydrophobicContact CB-CD2 4.18Å; N524-L605 WeakPolarHBondContact ND2-CD2 3.43Å
525	S	85.3	Confident	79.5	Confident	41 Å²	41	46.5 Å²	46.5	29%	0.287	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	135.6	-167.4	-68.1	0	0	0	0	113.8	V522 V551	V522-S525 PolarHBondContact N-O 3.13Å; V522-S525 PolarHBondContact O-N 3.35Å; S525-V551 CarbonylContact C-O 3.54Å; S525-V551 WeakPolarHBondContact CA-O 3.49Å
526	L	90.5	Very high	77.7	Confident	0 Å²	0	49 Å²	49	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	115.6	165.1	-166.7	69.3	0	0	0	109	V519 L521 F528 V551 L553 L573 L583 W594 I598	V519-L526 HydrophobicContact CG1-CD1 3.53Å; V519-L526 HydrophobicContact CG1-CD2 4.44Å; V519-L526 HydrophobicContact CG1-CG 3.94Å; L521-L526 HydrophobicContact CB-CD1 4.02Å; L521-L526 HydrophobicContact CD1-CD1 4.07Å; L526-F528 HydrophobicContact CD2-CE1 4.28Å; L526-F528 HydrophobicContact CD2-CE2 4.31Å; L526-F528 HydrophobicContact CD2-CZ 3.64Å; L526-F528 HydrophobicContact CG-CE1 4.49Å; L526-F528 HydrophobicContact CG-CE2 4.39Å; L526-F528 HydrophobicContact CG-CZ 4.01Å; L526-V551 PolarHBondContact N-O 3.38Å; L526-V551 PolarHBondContact O-N 3.04Å; L526-L553 HydrophobicContact CB-CD1 4.33Å; L526-L553 HydrophobicContact CB-CD2 4.1Å; L526-L553 HydrophobicContact CB-CG 4.29Å; L526-L573 HydrophobicContact CD2-CD2 3.66Å; L526-L583 HydrophobicContact CD2-CD1 4.04Å; L526-W594 HydrophobicContact CD1-CZ3 4.3Å; L526-I598 HydrophobicContact CD1-CD1 4.02Å; L526-I598 HydrophobicContact CD1-CG1 4.36Å; L526-I598 HydrophobicContact CD2-CD1 4Å
527	V	87.9	Confident	76	Confident	22 Å²	22	51.1 Å²	51.1	13%	0.133	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	134.9	-174.9	-169.3	0	0	0	0	110.1	V519 V520 F529 P547	V519-V527 WeakPolarHBondContact CA-O 3.35Å; V520-V527 PolarHBondContact N-O 3.45Å; V520-V527 PolarHBondContact O-N 2.92Å; V527-F529 HydrophobicContact CB-CE2 3.92Å; V527-F529 HydrophobicContact CG1-CD2 4.11Å; V527-F529 HydrophobicContact CG1-CE2 3.42Å; V527-F529 VanDerWaalsContact CG1-CE2 3.42Å; V527-F529 HydrophobicContact CG1-CZ 3.71Å; V527-P547 HydrophobicContact CG1-CB 3.64Å
528	F	89	Confident	74.1	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	120.7	-178.5	-60.5	-78.1	0	0	0	110.3	K500 V519 L526 E548 S549 V551 F581 L583	K500-F528 HydrophobicContact CD-CB 4.41Å; K500-F528 HydrophobicContact CD-CD1 3.78Å; K500-F528 HydrophobicContact CD-CE1 4.33Å; K500-F528 HydrophobicContact CD-CG 4.18Å; V519-F528 HydrophobicContact CG1-CD1 4.17Å; V519-F528 HydrophobicContact CG1-CE1 3.92Å; V519-F528 HydrophobicContact CG2-CD1 3.83Å; V519-F528 HydrophobicContact CG2-CE1 3.95Å; L526-F528 HydrophobicContact CD2-CE1 4.28Å; L526-F528 HydrophobicContact CD2-CE2 4.31Å; L526-F528 HydrophobicContact CD2-CZ 3.64Å; L526-F528 HydrophobicContact CG-CE1 4.49Å; L526-F528 HydrophobicContact CG-CE2 4.39Å; L526-F528 HydrophobicContact CG-CZ 4.01Å; F528-E548 WeakPolarHBondContact O-CB 3.41Å; F528-E548 PolarHBondContact O-N 2.87Å; F528-S549 PolarHBondContact N-O 3.41Å; F528-S549 PolarHBondContact O-N 3.17Å; F528-V551 HydrophobicContact CE2-CG2 3.95Å; F528-F581 HydrophobicContact CE2-CE1 4.44Å; F528-L583 HydrophobicContact CE1-CD1 4.37Å; F528-L583 HydrophobicContact CE1-CD2 3.76Å; F528-L583 HydrophobicContact CZ-CD1 4.44Å; F528-L583 HydrophobicContact CZ-CD2 4.2Å
529	F	83.1	Confident	72.3	Confident	17 Å²	17	58.2 Å²	58.2	8%	0.075	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	152.1	173.9	-61.1	-99	0	0	0	110.6	S517 W518 V520 V527 W540 S545 P547	S517-F529 WeakPolarHBondContact CA-O 3.47Å; S517-F529 PolarHBondContact OG-O 3.18Å; W518-F529 HydrophobicContact CB-CB 4.22Å; W518-F529 PolarHBondContact N-O 3.39Å; W518-F529 PolarHBondContact O-N 3.13Å; V520-F529 HydrophobicContact CB-CD2 4.49Å; V520-F529 HydrophobicContact CB-CE2 4.04Å; V520-F529 HydrophobicContact CG2-CD2 3.69Å; V520-F529 HydrophobicContact CG2-CE2 3.58Å; V527-F529 HydrophobicContact CB-CE2 3.92Å; V527-F529 HydrophobicContact CG1-CD2 4.11Å; V527-F529 HydrophobicContact CG1-CE2 3.42Å; V527-F529 VanDerWaalsContact CG1-CE2 3.42Å; V527-F529 HydrophobicContact CG1-CZ 3.71Å; F529-W540 HydrophobicContact CD1-CH2 4.39Å; F529-W540 AromaticContact CD1-CZ2 3.88Å; F529-W540 HydrophobicContact CD1-CZ2 3.88Å; F529-W540 AromaticContact CD2-CH2 4Å; F529-W540 HydrophobicContact CD2-CH2 4Å; F529-W540 HydrophobicContact CD2-CZ2 4Å; F529-W540 HydrophobicContact CE1-CH2 4.15Å; F529-W540 HydrophobicContact CE1-CZ2 4.01Å; F529-W540 AromaticContact CE2-CH2 3.74Å; F529-W540 HydrophobicContact CE2-CH2 3.74Å; F529-W540 HydrophobicContact CE2-CZ2 4.13Å; F529-W540 HydrophobicContact CG-CH2 4.32Å; F529-W540 AromaticContact CG-CZ2 3.88Å; F529-W540 HydrophobicContact CG-CZ2 3.88Å; F529-W540 AromaticContact CZ-CH2 3.82Å; F529-W540 HydrophobicContact CZ-CH2 3.82Å; F529-W540 HydrophobicContact CZ-CZ2 4.14Å; F529-S545 WeakPolarHBondContact CD1-O 3.41Å; F529-S545 WeakPolarHBondContact CD1-OG 3.39Å; F529-S545 VanDerWaalsContact CE1-O 3.31Å; F529-S545 WeakPolarHBondContact CE1-O 3.45Å; F529-P547 HydrophobicContact CD1-CB 4.11Å; F529-P547 HydrophobicContact CE1-CB 3.83Å; F529-P547 HydrophobicContact CE1-CG 4.42Å; F529-P547 HydrophobicContact CZ-CB 4.16Å
530	K	80.9	Confident	70.7	Confident	160 Å²	160	59.8 Å²	59.8	70%	0.696	34%	0.339	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.5	137.7	173.8	-174.1	176.4	-179.1	179.6	0	109.6	P532	K530-P532 WeakPolarHBondContact O-CD 3.25Å
531	D	68.1	Low	69.1	Low	65 Å²	65	66.9 Å²	66.9	35%	0.348	37%	0.369	S	S	.	.			trans	-45.8	114.4	-178.3	177.7	35.3	0	0	0	114	K533	D531-K533 PolarHBondContact O-N 3.46Å
532	P	58.1	Low	67.4	Low	35 Å²	35	71.1 Å²	71.1	23%	0.227	40%	0.397	C	S	.	.			trans	-80.8	93.4	176.6	32.5	-31.9	0	0	0	110.1	K530 S534	K530-P532 WeakPolarHBondContact O-CD 3.25Å; P532-S534 PolarHBondContact O-N 2.87Å
533	K	53.6	Low	65.9	Low	196 Å²	196	72.8 Å²	72.8	85%	0.852	42%	0.422	S	S	*	.	S	Bend	trans	-50.6	-2.2	-172.3	-71.4	-166.8	168.8	-164.3	0	118.9	D531	D531-K533 PolarHBondContact O-N 3.46Å
534	S	52.7	Low	64.7	Low	100 Å²	100	78 Å²	78	70%	0.699	45%	0.445	S	S	*	.	S	Bend	trans	-160.6	73.7	177.5	59.3	0	0	0	0	112.2	P532	P532-S534 PolarHBondContact O-N 2.87Å
535	Q	51.1	Low	63.6	Low	99 Å²	99	76.8 Å²	76.8	46%	0.463	44%	0.441	S	S	.	.			trans	-156.6	145.3	165.4	-115.1	132.2	93.6	0	0	111	S539	Q535-S539 WeakPolarHBondContact CG-OG 3.47Å
536	T	50.8	Low	62.8	Low	88 Å²	88	85.9 Å²	85.9	54%	0.54	47%	0.469	S	S	.	.			trans	-79.4	150.2	174	46.3	0	0	0	0	110.9	S538 S539	T536-S538 PolarHBondContact O-N 2.77Å; T536-S539 PolarHBondContact N-OG 3.5Å; T536-S539 PolarHBondContact O-N 2.7Å; T536-S539 PolarHBondContact O-OG 2.92Å; T536-S539 PolarHBondContact OG1-OG 3.02Å; T536-S539 VanDerWaalsContact OG1-OG 3.12Å
537	P	53	Low	62.1	Low	101 Å²	101	89.4 Å²	89.4	66%	0.656	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.1	-33.5	-177.4	-33.3	38.2	0	0	0	115.9	W518 S539	W518-P537 HydrophobicContact CH2-CB 3.95Å; W518-P537 HydrophobicContact CH2-CG 4.5Å; P537-S539 VanDerWaalsContact C-N 3.32Å; P537-S539 PolarHBondContact O-N 2.74Å
538	S	50.6	Low	61.7	Low	119 Å²	119	93.3 Å²	93.3	83%	0.832	51%	0.509	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.1	-3.7	-179.5	50.1	0	0	0	0	115.2	T536	T536-S538 PolarHBondContact O-N 2.77Å
539	S	50	Low	61.2	Low	53 Å²	53	95.2 Å²	95.2	37%	0.371	52%	0.522	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.8	-6.1	-173	64.3	0	0	0	0	114.8	Q535 T536 P537	Q535-S539 WeakPolarHBondContact CG-OG 3.47Å; T536-S539 PolarHBondContact N-OG 3.5Å; T536-S539 PolarHBondContact O-N 2.7Å; T536-S539 PolarHBondContact O-OG 2.92Å; T536-S539 PolarHBondContact OG1-OG 3.02Å; T536-S539 VanDerWaalsContact OG1-OG 3.12Å; P537-S539 VanDerWaalsContact C-N 3.32Å; P537-S539 PolarHBondContact O-N 2.74Å
540	W	56.3	Low	61.2	Low	34 Å²	34	98.5 Å²	98.5	13%	0.129	55%	0.547	C	S	.	.			trans	-75.3	128.3	-176.7	-175.6	85.4	0	0	0	112	W518 V520 F529 P542 S545	W518-W540 AromaticContact CD1-CD2 3.9Å; W518-W540 AromaticContact CD1-CE2 3.75Å; W518-W540 AromaticContact CD1-CZ2 3.83Å; W518-W540 AromaticContact NE1-CD2 3.44Å; W518-W540 AromaticContact NE1-CE2 3.81Å; W518-W540 AromaticContact NE1-CE3 3.39Å; W518-W540 AromaticContact NE1-CZ3 3.72Å; V520-W540 HydrophobicContact CG2-CH2 3.84Å; V520-W540 HydrophobicContact CG2-CZ3 3.94Å; F529-W540 HydrophobicContact CD1-CH2 4.39Å; F529-W540 AromaticContact CD1-CZ2 3.88Å; F529-W540 HydrophobicContact CD1-CZ2 3.88Å; F529-W540 AromaticContact CD2-CH2 4Å; F529-W540 HydrophobicContact CD2-CH2 4Å; F529-W540 HydrophobicContact CD2-CZ2 4Å; F529-W540 HydrophobicContact CE1-CH2 4.15Å; F529-W540 HydrophobicContact CE1-CZ2 4.01Å; F529-W540 AromaticContact CE2-CH2 3.74Å; F529-W540 HydrophobicContact CE2-CH2 3.74Å; F529-W540 HydrophobicContact CE2-CZ2 4.13Å; F529-W540 HydrophobicContact CG-CH2 4.32Å; F529-W540 AromaticContact CG-CZ2 3.88Å; F529-W540 HydrophobicContact CG-CZ2 3.88Å; F529-W540 AromaticContact CZ-CH2 3.82Å; F529-W540 HydrophobicContact CZ-CH2 3.82Å; F529-W540 HydrophobicContact CZ-CZ2 4.14Å; W540-P542 HydrophobicContact CH2-CB 4.25Å; W540-P542 HydrophobicContact CH2-CG 4.19Å; W540-P542 HydrophobicContact CZ3-CB 4.43Å; W540-P542 HydrophobicContact CZ3-CG 3.88Å; W540-S545 WeakPolarHBondContact CZ2-OG 3.3Å; W540-S545 PolarHBondContact NE1-OG 3.32Å
541	K	56.4	Low	61.4	Low	154 Å²	154	91.3 Å²	91.3	67%	0.67	52%	0.517	S	S	*	.			trans	-118.3	137.9	173.9	-68	-168	176.7	-170.9	0	111.1	G543 N544	K541-G543 PolarHBondContact O-N 3.47Å; K541-G543 VanDerWaalsContact O-N 3.08Å; K541-N544 PolarHBondContact O-N 3.09Å
542	P	51.5	Low	62.2	Low	89 Å²	89	91.4 Å²	91.4	58%	0.578	52%	0.518	S	S	*	.	G	3₁₀ helix	trans	-54.5	-31.3	-175.9	-29.2	34.9	0	0	0	116	W540 N544	W540-P542 HydrophobicContact CH2-CB 4.25Å; W540-P542 HydrophobicContact CH2-CG 4.19Å; W540-P542 HydrophobicContact CZ3-CB 4.43Å; W540-P542 HydrophobicContact CZ3-CG 3.88Å; P542-N544 PolarHBondContact O-N 3.09Å
543	G	52.1	Low	63.5	Low	77 Å²	77	89.8 Å²	89.8	79%	0.794	51%	0.507	S	S	*	.	G	3₁₀ helix	trans	-64	-20.7	-176.6	0	0	0	0	0	115.6	K541	K541-G543 PolarHBondContact O-N 3.47Å; K541-G543 VanDerWaalsContact O-N 3.08Å
544	N	54.2	Low	64.9	Low	131 Å²	131	84.5 Å²	84.5	70%	0.701	48%	0.481	S	S	*	.	G	3₁₀ helix	trans	-90.5	-4.6	-171.4	-74	3.6	0	0	0	114.7	K541 P542	K541-N544 PolarHBondContact O-N 3.09Å; P542-N544 PolarHBondContact O-N 3.09Å
545	S	60.8	Low	65.9	Low	31 Å²	31	80.6 Å²	80.6	22%	0.217	46%	0.457	C	S	.	.	S	Bend	trans	-146.8	130.4	-177.9	58.8	0	0	0	0	112.9	F529 W540	F529-S545 WeakPolarHBondContact CD1-O 3.41Å; F529-S545 WeakPolarHBondContact CD1-OG 3.39Å; F529-S545 VanDerWaalsContact CE1-O 3.31Å; F529-S545 WeakPolarHBondContact CE1-O 3.45Å; W540-S545 WeakPolarHBondContact CZ2-OG 3.3Å; W540-S545 PolarHBondContact NE1-OG 3.32Å
546	R	68.3	Low	67.6	Low	233 Å²	233	76.1 Å²	76.1	88%	0.879	44%	0.437	S	S	*	.			trans	-70.1	138.4	173.1	-66.3	-176.9	178.8	-178.1	-0.9	110.6
547	P	76.6	Confident	69.3	Low	74 Å²	74	78.6 Å²	78.6	48%	0.481	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.2	144.6	173.7	28.6	-34.6	0	0	0	110.9	V527 F529	V527-P547 HydrophobicContact CG1-CB 3.64Å; F529-P547 HydrophobicContact CD1-CB 4.11Å; F529-P547 HydrophobicContact CE1-CB 3.83Å; F529-P547 HydrophobicContact CE1-CG 4.42Å; F529-P547 HydrophobicContact CZ-CB 4.16Å
548	E	77.8	Confident	71.2	Confident	103 Å²	103	74.7 Å²	74.7	48%	0.481	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	-36.7	175.1	-169.7	-161.5	122	0	0	110.9	K500 F528	K500-E548 WeakPolarHBondContact CE-OE1 3.33Å; K500-E548 IonicContact NZ-OE1 2.77Å; K500-E548 PolarHBondContact NZ-OE1 3.32Å; K500-E548 IonicContact NZ-OE2 3.83Å; K500-E548 PolarHBondContact NZ-OE2 2.98Å; F528-E548 WeakPolarHBondContact O-CB 3.41Å; F528-E548 PolarHBondContact O-N 2.87Å
549	S	78.9	Confident	73.1	Confident	40 Å²	40	73.3 Å²	73.3	28%	0.28	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-162	154.5	171.5	49.1	0	0	0	0	111.1	F528	F528-S549 PolarHBondContact N-O 3.41Å; F528-S549 PolarHBondContact O-N 3.17Å
550	S	84.3	Confident	75	Confident	86 Å²	86	75.6 Å²	75.6	60%	0.601	40%	0.398	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-126.2	154.2	170.6	55.9	0	0	0	0	110.7
551	V	84.9	Confident	76.4	Confident	10 Å²	10	74 Å²	74	6%	0.061	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	120.2	-174	170.2	0	0	0	0	109.8	S525 L526 F528 L573 T575 F581	S525-V551 CarbonylContact C-O 3.54Å; S525-V551 WeakPolarHBondContact CA-O 3.49Å; L526-V551 PolarHBondContact N-O 3.38Å; L526-V551 PolarHBondContact O-N 3.04Å; F528-V551 HydrophobicContact CE2-CG2 3.95Å; V551-L573 HydrophobicContact CG1-CD2 4.3Å; V551-T575 HydrophobicContact CG1-CG2 3.36Å; V551-F581 HydrophobicContact CG2-CD2 4.48Å; V551-F581 HydrophobicContact CG2-CE2 3.54Å; V551-F581 HydrophobicContact CG2-CZ 3.65Å
552	D	84	Confident	77.3	Confident	67 Å²	67	71.4 Å²	71.4	36%	0.358	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	133.9	167.3	-165.4	-34.4	0	0	0	109.9	R554	D552-R554 WeakPolarHBondContact OD1-CB 3.46Å; D552-R554 WeakPolarHBondContact OD1-CG 3.32Å; D552-R554 IonicContact OD1-CZ 3.96Å; D552-R554 PolarHBondContact OD1-N 3.47Å; D552-R554 IonicContact OD1-NE 2.88Å; D552-R554 PolarHBondContact OD1-NE 3.16Å; D552-R554 IonicContact OD1-NH2 3.51Å; D552-R554 IonicContact OD2-CZ 3.5Å; D552-R554 VanDerWaalsContact OD2-CZ 3.26Å; D552-R554 IonicContact OD2-NE 3.27Å; D552-R554 PolarHBondContact OD2-NE 3Å; D552-R554 IonicContact OD2-NH2 2.76Å; D552-R554 PolarHBondContact OD2-NH2 2.89Å
553	L	86.6	Confident	78.5	Confident	0 Å²	0	73.4 Å²	73.4	0%	0	39%	0.391	C	S	.	.			trans	-92.5	-9.5	-177.8	-67.3	179.3	0	0	0	114.3	L521 N524 L526 G555 A556 L573 I598 V601 I602 L605	L521-L553 HydrophobicContact CD1-CD1 3.45Å; L521-L553 VanDerWaalsContact CD1-CD1 3.45Å; N524-L553 PolarHBondContact O-N 3.03Å; L526-L553 HydrophobicContact CB-CD1 4.33Å; L526-L553 HydrophobicContact CB-CD2 4.1Å; L526-L553 HydrophobicContact CB-CG 4.29Å; L553-G555 PolarHBondContact O-N 2.99Å; L553-A556 WeakPolarHBondContact O-CB 3.35Å; L553-A556 PolarHBondContact O-N 3.08Å; L553-L573 HydrophobicContact CD2-CD1 3.91Å; L553-L573 HydrophobicContact CD2-CD2 3.98Å; L553-I598 HydrophobicContact CD1-CG2 4.28Å; L553-I598 HydrophobicContact CD2-CG2 4.29Å; L553-V601 HydrophobicContact CD1-CG1 3.99Å; L553-I602 HydrophobicContact CB-CG1 4.05Å; L553-L605 HydrophobicContact CB-CD1 4.08Å
554	R	81.1	Confident	79.6	Confident	85 Å²	85	72.4 Å²	72.4	32%	0.321	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.5	123.7	-178.9	-74.3	176.1	-84.2	-153	-1.8	112	N524 D552 A556 L605 L611	N524-R554 PolarHBondContact ND2-NH1 3.03Å; D552-R554 WeakPolarHBondContact OD1-CB 3.46Å; D552-R554 WeakPolarHBondContact OD1-CG 3.32Å; D552-R554 IonicContact OD1-CZ 3.96Å; D552-R554 PolarHBondContact OD1-N 3.47Å; D552-R554 IonicContact OD1-NE 2.88Å; D552-R554 PolarHBondContact OD1-NE 3.16Å; D552-R554 IonicContact OD1-NH2 3.51Å; D552-R554 IonicContact OD2-CZ 3.5Å; D552-R554 VanDerWaalsContact OD2-CZ 3.26Å; D552-R554 IonicContact OD2-NE 3.27Å; D552-R554 PolarHBondContact OD2-NE 3Å; D552-R554 IonicContact OD2-NH2 2.76Å; D552-R554 PolarHBondContact OD2-NH2 2.89Å; R554-A556 PolarHBondContact O-N 3.15Å; R554-L605 HydrophobicContact CG-CB 4.13Å; R554-L605 HydrophobicContact CG-CD1 4.08Å; R554-L605 HydrophobicContact CG-CD2 4.17Å; R554-L605 HydrophobicContact CG-CG 4.37Å; R554-L611 HydrophobicContact CB-CD1 4.34Å
555	G	75.6	Confident	80.9	Confident	18 Å²	18	66.7 Å²	66.7	19%	0.186	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	61.3	16.8	-174.5	0	0	0	0	0	115.5	L553 I576 D606	L553-G555 PolarHBondContact O-N 2.99Å; G555-I576 VanDerWaalsContact O-CG2 3.24Å; G555-I576 WeakPolarHBondContact O-CG2 3.41Å; G555-D606 WeakPolarHBondContact CA-OD1 3.19Å; G555-D606 PolarHBondContact N-OD1 3.11Å
556	A	85.9	Confident	81.8	Confident	5 Å²	5	71.6 Å²	71.6	4%	0.041	37%	0.372	C	S	.	.			trans	-72.3	152.6	175.2	0	0	0	0	0	111.2	L553 R554 L573 R574 I602	L553-A556 WeakPolarHBondContact O-CB 3.35Å; L553-A556 PolarHBondContact O-N 3.08Å; R554-A556 PolarHBondContact O-N 3.15Å; A556-L573 HydrophobicContact CB-CD1 3.91Å; A556-R574 CarbonylContact C-O 3.59Å; A556-R574 VanDerWaalsContact CA-O 3.26Å; A556-R574 WeakPolarHBondContact CA-O 3.3Å; A556-R574 WeakPolarHBondContact CB-O 3.34Å; A556-I602 HydrophobicContact CB-CD1 4.08Å; A556-I602 HydrophobicContact CB-CG1 4.45Å; A556-I602 WeakPolarHBondContact O-CG2 3.26Å
557	K	86.6	Confident	82.6	Confident	140 Å²	140	63.5 Å²	63.5	61%	0.609	34%	0.343	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.8	135.4	176.5	-61.1	-159	174.5	-161.3	0	111	R574	K557-R574 PolarHBondContact N-O 3.42Å; K557-R574 PolarHBondContact O-N 2.72Å
558	L	92.9	Very high	83	Confident	19 Å²	19	68.1 Å²	68.1	10%	0.099	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	123.9	-177.9	-152.5	73.1	0	0	0	109.3	F571 K572 L573 Y595 I598 K599 I602	L558-F571 HydrophobicContact CD1-CD2 3.65Å; L558-F571 HydrophobicContact CD1-CE2 3.72Å; L558-F571 HydrophobicContact CG-CD2 4.16Å; L558-F571 HydrophobicContact CG-CE2 4.48Å; L558-K572 WeakPolarHBondContact CA-O 3.44Å; L558-L573 HydrophobicContact CD1-CB 4.04Å; L558-L573 HydrophobicContact CD1-CD1 3.81Å; L558-Y595 HydrophobicContact CB-CE2 4.28Å; L558-Y595 HydrophobicContact CD2-CD1 4.36Å; L558-Y595 HydrophobicContact CD2-CD2 3.5Å; L558-Y595 VanDerWaalsContact CD2-CD2 3.5Å; L558-Y595 HydrophobicContact CD2-CE1 4.47Å; L558-Y595 HydrophobicContact CD2-CE2 3.66Å; L558-Y595 HydrophobicContact CD2-CG 3.88Å; L558-Y595 VanDerWaalsContact CD2-O 3.25Å; L558-Y595 WeakPolarHBondContact CD2-O 3.08Å; L558-Y595 HydrophobicContact CG-CD2 3.81Å; L558-Y595 HydrophobicContact CG-CE2 3.65Å; L558-I598 HydrophobicContact CD1-CG2 3.97Å; L558-I598 HydrophobicContact CD2-CB 4.27Å; L558-I598 HydrophobicContact CD2-CG2 4.09Å; L558-K599 HydrophobicContact CD2-CB 4.04Å; L558-I602 HydrophobicContact CB-CD1 4.43Å
559	N	91	Very high	83.6	Confident	91 Å²	91	64.8 Å²	64.8	49%	0.487	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	140.4	-177.5	-68.7	93.8	0	0	0	109.9	F571 K572	N559-F571 CarbonylContact O-C 3.55Å; N559-F571 WeakPolarHBondContact O-CA 3.3Å; N559-F571 WeakPolarHBondContact O-CB 3.46Å; N559-K572 PolarHBondContact N-O 2.84Å; N559-K572 PolarHBondContact O-N 3.24Å
560	W	89.9	Confident	84.2	Confident	101 Å²	101	62.9 Å²	62.9	38%	0.383	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.7	143.3	165.9	-67.4	102.3	0	0	0	110.4	F571 I591 R592 Y595	W560-F571 HydrophobicContact CD2-CB 4.42Å; W560-F571 HydrophobicContact CE3-CB 3.99Å; W560-F571 HydrophobicContact CH2-CD1 4.33Å; W560-F571 HydrophobicContact CZ3-CB 4.21Å; W560-F571 HydrophobicContact CZ3-CD1 4.19Å; W560-I591 HydrophobicContact CH2-CG2 4.02Å; W560-I591 HydrophobicContact CZ3-CG1 4.35Å; W560-I591 HydrophobicContact CZ3-CG2 4.01Å; W560-R592 HydrophobicContact CH2-CG 4.07Å; W560-R592 HydrophobicContact CZ2-CG 4.25Å; W560-Y595 AromaticContact CD1-CZ 3.93Å; W560-Y595 HydrophobicContact CD2-CD2 4.28Å; W560-Y595 HydrophobicContact CD2-CE2 4.26Å; W560-Y595 AromaticContact CE2-CD2 3.72Å; W560-Y595 AromaticContact CE2-CE2 3.82Å; W560-Y595 AromaticContact CE2-CG 3.87Å; W560-Y595 HydrophobicContact CG-CE2 4.36Å; W560-Y595 HydrophobicContact CH2-CD2 4.2Å; W560-Y595 HydrophobicContact CH2-CG 4.07Å; W560-Y595 AromaticContact CZ2-CD1 3.82Å; W560-Y595 HydrophobicContact CZ2-CD1 3.82Å; W560-Y595 AromaticContact CZ2-CD2 3.69Å; W560-Y595 HydrophobicContact CZ2-CD2 3.69Å; W560-Y595 HydrophobicContact CZ2-CE1 4.38Å; W560-Y595 HydrophobicContact CZ2-CE2 4.25Å; W560-Y595 AromaticContact CZ2-CG 3.44Å; W560-Y595 HydrophobicContact CZ2-CG 3.44Å; W560-Y595 VanDerWaalsContact CZ2-CG 3.44Å; W560-Y595 AromaticContact NE1-CE1 3.69Å; W560-Y595 AromaticContact NE1-CE2 3.66Å; W560-Y595 AromaticContact NE1-CZ 3.5Å
561	A	85	Confident	84.7	Confident	1 Å²	1	58.8 Å²	58.8	1%	0.008	30%	0.299	C	S	.	.			trans	-140.2	40.6	-163.4	0	0	0	0	0	112.2	D563 L564 V570 K572 L582	A561-D563 WeakPolarHBondContact CA-OD1 3.3Å; A561-D563 PolarHBondContact O-N 3.25Å; A561-L564 HydrophobicContact CB-CB 4.28Å; A561-L564 HydrophobicContact CB-CD1 4.28Å; A561-L564 PolarHBondContact O-N 3.45Å; A561-V570 HydrophobicContact CB-CG1 4.28Å; A561-V570 PolarHBondContact N-O 2.67Å; A561-K572 HydrophobicContact CB-CB 3.7Å; A561-L582 HydrophobicContact CB-CD2 3.9Å
562	N	75.4	Confident	85.1	Confident	98 Å²	98	60 Å²	60	52%	0.524	30%	0.304	S	S	.	.	S	Bend	trans	-70.4	-15.9	-178.3	-59.9	-35.2	0	0	0	113
563	D	76.9	Confident	85.6	Confident	131 Å²	131	56.9 Å²	56.9	70%	0.701	29%	0.287	S	S	*	.	S	Bend	trans	-81.7	-37.4	170.3	65.1	-48.4	0	0	0	111.9	A561 S565	A561-D563 WeakPolarHBondContact CA-OD1 3.3Å; A561-D563 PolarHBondContact O-N 3.25Å; D563-S565 PolarHBondContact O-N 2.79Å
564	L	74.9	Confident	85.7	Confident	57 Å²	57	63.4 Å²	63.4	30%	0.298	31%	0.311	S	S	.	.	S	Bend	trans	-79.6	1.3	-177.4	-60.8	-178.2	0	0	0	113.2	K512 A561 K572 L582	K512-L564 WeakPolarHBondContact CE-O 3.47Å; K512-L564 PolarHBondContact NZ-O 2.96Å; A561-L564 HydrophobicContact CB-CB 4.28Å; A561-L564 HydrophobicContact CB-CD1 4.28Å; A561-L564 PolarHBondContact O-N 3.45Å; L564-K572 HydrophobicContact CD1-CD 3.67Å; L564-L582 HydrophobicContact CB-CD1 4.41Å; L564-L582 HydrophobicContact CB-CD2 4.47Å; L564-L582 HydrophobicContact CD1-CD2 4.48Å
565	S	80.3	Confident	85.9	Confident	10 Å²	10	59.6 Å²	59.6	7%	0.07	30%	0.298	C	S	.	.			trans	-152.1	139.2	-177.6	-178.4	0	0	0	0	112.2	D563 K567	D563-S565 PolarHBondContact O-N 2.79Å; S565-K567 VanDerWaalsContact C-N 3.25Å; S565-K567 WeakPolarHBondContact OG-CB 3.39Å; S565-K567 PolarHBondContact OG-N 3.18Å; S565-K567 PolarHBondContact OG-O 3.26Å
566	S	80.3	Confident	86	Confident	134 Å²	134	62.4 Å²	62.4	94%	0.937	31%	0.308	S	S	*	.	S	Bend	trans	-76.3	-12.3	168.5	52.9	0	0	0	0	113.3
567	K	84.9	Confident	85.4	Confident	63 Å²	63	66.6 Å²	66.6	27%	0.274	33%	0.333	S	S	.	.	S	Bend	trans	-74.9	136.2	166.5	-64.2	-171.2	160.1	-160.9	0	109.6	N499 W514 S565 V570 Q584	N499-K567 PolarHBondContact ND2-NZ 3.05Å; W514-K567 HydrophobicContact CD2-CD 4.22Å; W514-K567 HydrophobicContact CH2-CD 4.45Å; W514-K567 HydrophobicContact CZ2-CD 4.1Å; S565-K567 VanDerWaalsContact C-N 3.25Å; S565-K567 WeakPolarHBondContact OG-CB 3.39Å; S565-K567 PolarHBondContact OG-N 3.18Å; S565-K567 PolarHBondContact OG-O 3.26Å; K567-V570 HydrophobicContact CB-CG2 4Å; K567-V570 VanDerWaalsContact O-CG2 3.23Å; K567-V570 WeakPolarHBondContact O-CG2 3.33Å; K567-Q584 HydrophobicContact CB-CG 4.17Å; K567-Q584 HydrophobicContact CD-CG 3.95Å; K567-Q584 VanDerWaalsContact CD-OE1 3.32Å
568	K	85.9	Confident	84.8	Confident	171 Å²	171	60.8 Å²	60.8	74%	0.743	31%	0.313	S	S	*	.	S	Bend	trans	-66.5	167.9	165.2	-61.2	-178.3	180	-178.8	0	110.3	V570 Q584	K568-V570 WeakPolarHBondContact O-CG2 3.44Å; K568-Q584 WeakPolarHBondContact O-CG 3.19Å
569	N	89.4	Confident	84.4	Confident	33 Å²	33	61.3 Å²	61.3	18%	0.176	32%	0.316	C	S	.	.	S	Bend	trans	60.8	52.9	169.8	-58.7	-2.4	0	0	0	112.4	Q584 S585 D586 D588 I591	N569-Q584 WeakPolarHBondContact O-CA 3.12Å; N569-Q584 WeakPolarHBondContact O-CG 3.19Å; N569-S585 WeakPolarHBondContact CB-O 3.42Å; N569-S585 PolarHBondContact ND2-O 3.33Å; N569-D586 PolarHBondContact ND2-O 3.47Å; N569-D588 WeakPolarHBondContact ND2-CA 3.5Å; N569-D588 PolarHBondContact ND2-N 3.3Å; N569-I591 HydrophobicContact CB-CB 4.49Å; N569-I591 HydrophobicContact CB-CG2 3.76Å
570	V	92.1	Very high	84.5	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	130.2	-175.6	-174.4	0	0	0	0	111.9	W514 A561 K567 K568 L582 L583 Q584	W514-V570 HydrophobicContact CH2-CG1 4.21Å; W514-V570 HydrophobicContact CH2-CG2 4.37Å; A561-V570 HydrophobicContact CB-CG1 4.28Å; A561-V570 PolarHBondContact N-O 2.67Å; K567-V570 HydrophobicContact CB-CG2 4Å; K567-V570 VanDerWaalsContact O-CG2 3.23Å; K567-V570 WeakPolarHBondContact O-CG2 3.33Å; K568-V570 WeakPolarHBondContact O-CG2 3.44Å; V570-L582 HydrophobicContact CG1-CB 3.86Å; V570-L582 HydrophobicContact CG1-CD1 4.4Å; V570-L582 HydrophobicContact CG1-CD2 4.22Å; V570-L582 HydrophobicContact CG1-CG 4.38Å; V570-L583 WeakPolarHBondContact CA-O 3.4Å; V570-Q584 HydrophobicContact CG2-CB 3.97Å; V570-Q584 HydrophobicContact CG2-CG 3.72Å
571	F	94.6	Very high	84.6	Confident	0 Å²	0	54 Å²	54	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	156	163.5	66.5	-105	0	0	0	112.1	L558 N559 W560 L582 L583 I591 W594 Y595 I598	L558-F571 HydrophobicContact CD1-CD2 3.65Å; L558-F571 HydrophobicContact CD1-CE2 3.72Å; L558-F571 HydrophobicContact CG-CD2 4.16Å; L558-F571 HydrophobicContact CG-CE2 4.48Å; N559-F571 CarbonylContact O-C 3.55Å; N559-F571 WeakPolarHBondContact O-CA 3.3Å; N559-F571 WeakPolarHBondContact O-CB 3.46Å; W560-F571 HydrophobicContact CD2-CB 4.42Å; W560-F571 HydrophobicContact CE3-CB 3.99Å; W560-F571 HydrophobicContact CH2-CD1 4.33Å; W560-F571 HydrophobicContact CZ3-CB 4.21Å; W560-F571 HydrophobicContact CZ3-CD1 4.19Å; F571-L582 WeakPolarHBondContact O-CA 3.31Å; F571-L583 HydrophobicContact CD2-CB 4.38Å; F571-L583 HydrophobicContact CE1-CB 4.47Å; F571-L583 HydrophobicContact CE2-CB 3.9Å; F571-L583 HydrophobicContact CE2-CD1 3.8Å; F571-L583 HydrophobicContact CE2-CG 4.21Å; F571-L583 HydrophobicContact CZ-CB 3.94Å; F571-L583 HydrophobicContact CZ-CD1 3.98Å; F571-L583 PolarHBondContact N-O 2.93Å; F571-L583 VanDerWaalsContact N-O 3.13Å; F571-L583 PolarHBondContact O-N 2.89Å; F571-I591 HydrophobicContact CD1-CD1 3.85Å; F571-I591 HydrophobicContact CD1-CG1 3.69Å; F571-I591 HydrophobicContact CE1-CD1 3.44Å; F571-I591 VanDerWaalsContact CE1-CD1 3.44Å; F571-I591 HydrophobicContact CE1-CG1 3.72Å; F571-I591 HydrophobicContact CZ-CD1 4.36Å; F571-W594 HydrophobicContact CE1-CB 4.27Å; F571-W594 HydrophobicContact CZ-CB 4.43Å; F571-Y595 HydrophobicContact CB-CD2 3.71Å; F571-Y595 HydrophobicContact CB-CE2 4.13Å; F571-Y595 AromaticContact CD1-CD2 3.83Å; F571-Y595 HydrophobicContact CD1-CD2 3.83Å; F571-Y595 HydrophobicContact CD1-CG 4.37Å; F571-Y595 HydrophobicContact CD2-CD2 4.33Å; F571-Y595 HydrophobicContact CE1-CD2 4.5Å; F571-Y595 AromaticContact CG-CD2 3.74Å; F571-Y595 HydrophobicContact CG-CD2 3.74Å; F571-I598 HydrophobicContact CE2-CD1 4.3Å; F571-I598 HydrophobicContact CZ-CD1 4Å
572	K	93.9	Very high	85.1	Confident	37 Å²	37	54 Å²	54	16%	0.161	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	126	177.2	174.3	171.5	168	169.1	0	109.9	I503 L558 N559 A561 L564 E580 F581 L582	I503-K572 HydrophobicContact CD1-CD 4.34Å; L558-K572 WeakPolarHBondContact CA-O 3.44Å; N559-K572 PolarHBondContact N-O 2.84Å; N559-K572 PolarHBondContact O-N 3.24Å; A561-K572 HydrophobicContact CB-CB 3.7Å; L564-K572 HydrophobicContact CD1-CD 3.67Å; K572-E580 WeakPolarHBondContact CE-OE1 3.34Å; K572-E580 VanDerWaalsContact CE-OE2 3.29Å; K572-E580 WeakPolarHBondContact CE-OE2 3.43Å; K572-E580 IonicContact NZ-OE1 2.76Å; K572-E580 PolarHBondContact NZ-OE1 3.27Å; K572-E580 IonicContact NZ-OE2 2.76Å; K572-E580 PolarHBondContact NZ-OE2 3.1Å; K572-F581 CarbonylContact C-O 3.57Å; K572-F581 VanDerWaalsContact CA-O 3.31Å; K572-F581 WeakPolarHBondContact CA-O 3.38Å; K572-L582 HydrophobicContact CB-CD2 3.69Å; K572-L582 HydrophobicContact CG-CD2 4.15Å
573	L	93.5	Very high	86	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	123.2	166.7	175.5	66.1	0	0	0	108.8	L526 V551 L553 A556 L558 E580 F581 I602	L526-L573 HydrophobicContact CD2-CD2 3.66Å; V551-L573 HydrophobicContact CG1-CD2 4.3Å; L553-L573 HydrophobicContact CD2-CD1 3.91Å; L553-L573 HydrophobicContact CD2-CD2 3.98Å; A556-L573 HydrophobicContact CB-CD1 3.91Å; L558-L573 HydrophobicContact CD1-CB 4.04Å; L558-L573 HydrophobicContact CD1-CD1 3.81Å; L573-E580 WeakPolarHBondContact O-CA 3.12Å; L573-F581 PolarHBondContact N-O 3.2Å; L573-F581 PolarHBondContact O-N 3.31Å; L573-I602 HydrophobicContact CD1-CD1 4.41Å
574	R	89.8	Confident	86.8	Confident	137 Å²	137	43.2 Å²	43.2	52%	0.517	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	123.1	175.1	174.2	177.5	177.3	175.1	-2.1	110.3	A556 K557 E580	A556-R574 CarbonylContact C-O 3.59Å; A556-R574 VanDerWaalsContact CA-O 3.26Å; A556-R574 WeakPolarHBondContact CA-O 3.3Å; A556-R574 WeakPolarHBondContact CB-O 3.34Å; K557-R574 PolarHBondContact N-O 3.42Å; K557-R574 PolarHBondContact O-N 2.72Å; R574-E580 HydrophobicContact CB-CG 4.17Å; R574-E580 WeakPolarHBondContact CD-OE1 3.49Å; R574-E580 HydrophobicContact CG-CG 4Å; R574-E580 IonicContact NE-OE1 3.24Å
575	T	85.3	Confident	87.6	Confident	6 Å²	6	41.1 Å²	41.1	4%	0.037	22%	0.215	C	C	.	.			trans	-89.5	158.1	-179.6	61.7	0	0	0	0	112.5	V551 T577 G578 N579	V551-T575 HydrophobicContact CG1-CG2 3.36Å; T575-T577 PolarHBondContact O-N 2.95Å; T575-T577 PolarHBondContact OG1-OG1 3.11Å; T575-G578 PolarHBondContact O-N 3.37Å; T575-G578 PolarHBondContact OG1-N 3.45Å; T575-N579 HydrophobicContact CG2-CB 4.27Å; T575-N579 PolarHBondContact N-O 3.41Å; T575-N579 WeakPolarHBondContact OG1-CA 3.34Å; T575-N579 WeakPolarHBondContact OG1-CB 3.44Å; T575-N579 PolarHBondContact OG1-N 3.32Å; T575-N579 PolarHBondContact OG1-O 3.03Å
576	I	76.8	Confident	88	Confident	77 Å²	77	46.7 Å²	46.7	40%	0.395	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-24	168.6	62.4	173.3	0	0	0	113	G555 G578	G555-I576 VanDerWaalsContact O-CG2 3.24Å; G555-I576 WeakPolarHBondContact O-CG2 3.41Å; I576-G578 PolarHBondContact O-N 3.28Å
577	T	73.4	Confident	88.4	Confident	92 Å²	92	43.9 Å²	43.9	56%	0.564	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.7	-0.3	176.2	52.7	0	0	0	0	113.6	T575 N579	T575-T577 PolarHBondContact O-N 2.95Å; T575-T577 PolarHBondContact OG1-OG1 3.11Å; T577-N579 VanDerWaalsContact C-N 3.3Å; T577-N579 PolarHBondContact O-N 2.89Å; T577-N579 PolarHBondContact OG1-ND2 2.93Å
578	G	75	Confident	88.7	Confident	19 Å²	19	43.8 Å²	43.8	20%	0.196	22%	0.224	C	C	.	.	S	Bend	trans	76.1	15.7	178.9	0	0	0	0	0	114.1	G506 G507 T575 I576	G506-G578 PolarHBondContact N-O 3.28Å; G507-G578 PolarHBondContact N-O 3.31Å; T575-G578 PolarHBondContact O-N 3.37Å; T575-G578 PolarHBondContact OG1-N 3.45Å; I576-G578 PolarHBondContact O-N 3.28Å
579	N	85	Confident	88.9	Confident	30 Å²	30	39.6 Å²	39.6	16%	0.16	22%	0.216	C	C	.	.			trans	-79.5	138.4	162.4	-61.3	-64	0	0	0	109.7	K502 A504 E505 T575 T577 F581	K502-N579 WeakPolarHBondContact CE-OD1 3.42Å; K502-N579 PolarHBondContact NZ-OD1 2.76Å; A504-N579 WeakPolarHBondContact O-CA 3.44Å; E505-N579 WeakPolarHBondContact CA-OD1 3.02Å; T575-N579 HydrophobicContact CG2-CB 4.27Å; T575-N579 PolarHBondContact N-O 3.41Å; T575-N579 WeakPolarHBondContact OG1-CA 3.34Å; T575-N579 WeakPolarHBondContact OG1-CB 3.44Å; T575-N579 PolarHBondContact OG1-N 3.32Å; T575-N579 PolarHBondContact OG1-O 3.03Å; T577-N579 VanDerWaalsContact C-N 3.3Å; T577-N579 PolarHBondContact O-N 2.89Å; T577-N579 PolarHBondContact OG1-ND2 2.93Å; N579-F581 HydrophobicContact CB-CD2 4.48Å; N579-F581 HydrophobicContact CB-CE2 3.67Å; N579-F581 HydrophobicContact CB-CZ 4.21Å
580	E	92.1	Very high	89	Confident	31 Å²	31	40.6 Å²	40.6	15%	0.145	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	132.9	173.9	-62.3	-170.2	149.8	0	0	110.1	I503 A504 K572 L573 R574	I503-E580 HydrophobicContact CD1-CB 4.25Å; I503-E580 HydrophobicContact CG1-CB 3.65Å; I503-E580 PolarHBondContact N-O 3.33Å; A504-E580 HydrophobicContact CB-CB 3.81Å; A504-E580 HydrophobicContact CB-CG 3.92Å; A504-E580 PolarHBondContact N-O 2.84Å; A504-E580 PolarHBondContact O-N 2.76Å; K572-E580 WeakPolarHBondContact CE-OE1 3.34Å; K572-E580 VanDerWaalsContact CE-OE2 3.29Å; K572-E580 WeakPolarHBondContact CE-OE2 3.43Å; K572-E580 IonicContact NZ-OE1 2.76Å; K572-E580 PolarHBondContact NZ-OE1 3.27Å; K572-E580 IonicContact NZ-OE2 2.76Å; K572-E580 PolarHBondContact NZ-OE2 3.1Å; L573-E580 WeakPolarHBondContact O-CA 3.12Å; R574-E580 HydrophobicContact CB-CG 4.17Å; R574-E580 WeakPolarHBondContact CD-OE1 3.49Å; R574-E580 HydrophobicContact CG-CG 4Å; R574-E580 IonicContact NE-OE1 3.24Å
581	F	93.3	Very high	89	Confident	7 Å²	7	40.6 Å²	40.6	3%	0.031	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	145.2	179.5	-57.3	-95.6	0	0	0	109.7	T501 K502 F528 V551 K572 L573 N579	T501-F581 WeakPolarHBondContact O-CA 3.36Å; K502-F581 HydrophobicContact CB-CD1 4.03Å; K502-F581 HydrophobicContact CB-CE1 4.08Å; K502-F581 HydrophobicContact CD-CE1 3.84Å; K502-F581 HydrophobicContact CD-CZ 4.14Å; K502-F581 HydrophobicContact CG-CD1 3.9Å; K502-F581 HydrophobicContact CG-CE1 3.7Å; K502-F581 HydrophobicContact CG-CZ 4.22Å; F528-F581 HydrophobicContact CE2-CE1 4.44Å; V551-F581 HydrophobicContact CG2-CD2 4.48Å; V551-F581 HydrophobicContact CG2-CE2 3.54Å; V551-F581 HydrophobicContact CG2-CZ 3.65Å; K572-F581 CarbonylContact C-O 3.57Å; K572-F581 VanDerWaalsContact CA-O 3.31Å; K572-F581 WeakPolarHBondContact CA-O 3.38Å; L573-F581 PolarHBondContact N-O 3.2Å; L573-F581 PolarHBondContact O-N 3.31Å; N579-F581 HydrophobicContact CB-CD2 4.48Å; N579-F581 HydrophobicContact CB-CE2 3.67Å; N579-F581 HydrophobicContact CB-CZ 4.21Å
582	L	93.8	Very high	88.9	Confident	0 Å²	0	47 Å²	47	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	132.3	161.9	-57.5	179.3	0	0	0	108.3	K500 T501 I503 W514 A561 L564 V570 F571 K572	K500-L582 CarbonylContact C-O 3.55Å; K500-L582 WeakPolarHBondContact CA-O 3.07Å; T501-L582 HydrophobicContact CG2-CB 3.83Å; T501-L582 HydrophobicContact CG2-CD1 4.13Å; T501-L582 HydrophobicContact CG2-CG 4.27Å; T501-L582 PolarHBondContact N-O 3.32Å; T501-L582 PolarHBondContact O-N 3.18Å; I503-L582 HydrophobicContact CD1-CD1 4.36Å; I503-L582 HydrophobicContact CD1-CD2 3.87Å; I503-L582 HydrophobicContact CD1-CG 3.92Å; I503-L582 HydrophobicContact CG1-CG 4.41Å; I503-L582 HydrophobicContact CG2-CD1 3.93Å; I503-L582 HydrophobicContact CG2-CG 3.88Å; W514-L582 HydrophobicContact CH2-CB 3.75Å; W514-L582 HydrophobicContact CH2-CD1 4.48Å; W514-L582 HydrophobicContact CZ2-CB 4.38Å; W514-L582 HydrophobicContact CZ2-CD1 4.32Å; W514-L582 HydrophobicContact CZ3-CB 4.38Å; A561-L582 HydrophobicContact CB-CD2 3.9Å; L564-L582 HydrophobicContact CB-CD1 4.41Å; L564-L582 HydrophobicContact CB-CD2 4.47Å; L564-L582 HydrophobicContact CD1-CD2 4.48Å; V570-L582 HydrophobicContact CG1-CB 3.86Å; V570-L582 HydrophobicContact CG1-CD1 4.4Å; V570-L582 HydrophobicContact CG1-CD2 4.22Å; V570-L582 HydrophobicContact CG1-CG 4.38Å; F571-L582 WeakPolarHBondContact O-CA 3.31Å; K572-L582 HydrophobicContact CB-CD2 3.69Å; K572-L582 HydrophobicContact CG-CD2 4.15Å
583	L	94.3	Very high	88.8	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	140.3	174.6	-60.8	-177.3	0	0	0	109.6	L498 N499 K500 L526 F528 V570 F571 I598	L498-L583 HydrophobicContact CD1-CB 4.48Å; L498-L583 HydrophobicContact CD1-CD1 4.38Å; N499-L583 WeakPolarHBondContact O-CA 3.4Å; K500-L583 HydrophobicContact CB-CD2 3.55Å; L526-L583 HydrophobicContact CD2-CD1 4.04Å; F528-L583 HydrophobicContact CE1-CD1 4.37Å; F528-L583 HydrophobicContact CE1-CD2 3.76Å; F528-L583 HydrophobicContact CZ-CD1 4.44Å; F528-L583 HydrophobicContact CZ-CD2 4.2Å; V570-L583 WeakPolarHBondContact CA-O 3.4Å; F571-L583 HydrophobicContact CD2-CB 4.38Å; F571-L583 HydrophobicContact CE1-CB 4.47Å; F571-L583 HydrophobicContact CE2-CB 3.9Å; F571-L583 HydrophobicContact CE2-CD1 3.8Å; F571-L583 HydrophobicContact CE2-CG 4.21Å; F571-L583 HydrophobicContact CZ-CB 3.94Å; F571-L583 HydrophobicContact CZ-CD1 3.98Å; F571-L583 PolarHBondContact N-O 2.93Å; F571-L583 VanDerWaalsContact N-O 3.13Å; F571-L583 PolarHBondContact O-N 2.89Å; L583-I598 HydrophobicContact CD1-CD1 4.5Å
584	Q	94.4	Very high	88.9	Confident	4 Å²	4	49.7 Å²	49.7	2%	0.019	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	143	-171.4	-173.9	-97.2	-40.6	0	0	111.3	N499 W514 K567 K568 N569 V570 D586	N499-Q584 HydrophobicContact CB-CB 4.14Å; N499-Q584 VanDerWaalsContact CB-OE1 3.27Å; N499-Q584 PolarHBondContact N-O 3.14Å; N499-Q584 PolarHBondContact ND2-OE1 3.01Å; N499-Q584 PolarHBondContact O-N 3.3Å; W514-Q584 HydrophobicContact CH2-CB 3.87Å; W514-Q584 HydrophobicContact CZ3-CB 3.68Å; K567-Q584 HydrophobicContact CB-CG 4.17Å; K567-Q584 HydrophobicContact CD-CG 3.95Å; K567-Q584 VanDerWaalsContact CD-OE1 3.32Å; K568-Q584 WeakPolarHBondContact O-CG 3.19Å; N569-Q584 WeakPolarHBondContact O-CA 3.12Å; N569-Q584 WeakPolarHBondContact O-CG 3.19Å; V570-Q584 HydrophobicContact CG2-CB 3.97Å; V570-Q584 HydrophobicContact CG2-CG 3.72Å; Q584-D586 PolarHBondContact NE2-OD1 3.12Å
585	S	92.1	Very high	89	Confident	13 Å²	13	44.7 Å²	44.7	9%	0.091	24%	0.239	C	C	.	.			trans	-133.3	148.8	165.7	-170.5	0	0	0	0	108.9	N569 T587	N569-S585 WeakPolarHBondContact CB-O 3.42Å; N569-S585 PolarHBondContact ND2-O 3.33Å; S585-T587 PolarHBondContact O-N 3.01Å
586	D	88.1	Confident	89.4	Confident	126 Å²	126	48.5 Å²	48.5	67%	0.674	26%	0.26	S	S	*	.	S	Bend	trans	-73.5	-21.5	177.9	-54.4	-54.7	0	0	0	110.9	N569 Q584	N569-D586 PolarHBondContact ND2-O 3.47Å; Q584-D586 PolarHBondContact NE2-OD1 3.12Å
587	T	89.9	Confident	90.2	Very high	75 Å²	75	46.1 Å²	46.1	46%	0.46	25%	0.249	S	C	.	.	S	Bend	trans	-91.1	122.4	174	-57	0	0	0	0	111.5	S585 S589 L590 I591	S585-T587 PolarHBondContact O-N 3.01Å; T587-S589 WeakPolarHBondContact CG2-OG 3.39Å; T587-L590 HydrophobicContact CG2-CB 3.95Å; T587-I591 PolarHBondContact O-N 2.97Å; T587-I591 VanDerWaalsContact O-N 3.17Å
588	D	90	Very high	91.1	Very high	62 Å²	62	41.8 Å²	41.8	33%	0.332	22%	0.222	S	C	.	.	H	α-helix	trans	-66.3	-45.5	-177.7	166.9	81.8	0	0	0	113.3	N569 L590 I591 R592	N569-D588 WeakPolarHBondContact ND2-CA 3.5Å; N569-D588 PolarHBondContact ND2-N 3.3Å; D588-L590 VanDerWaalsContact C-N 3.33Å; D588-L590 PolarHBondContact O-N 2.81Å; D588-I591 WeakPolarHBondContact O-CG2 3.29Å; D588-I591 PolarHBondContact O-N 3.09Å; D588-R592 WeakPolarHBondContact O-CG 3.41Å; D588-R592 PolarHBondContact O-N 3.31Å; D588-R592 IonicContact OD1-CZ 3.18Å; D588-R592 IonicContact OD1-NE 3.69Å; D588-R592 PolarHBondContact OD1-NE 3.16Å; D588-R592 IonicContact OD1-NH2 3.99Å; D588-R592 PolarHBondContact OD1-NH2 3.31Å; D588-R592 IonicContact OD2-CZ 2.59Å; D588-R592 IonicContact OD2-NE 3.47Å; D588-R592 PolarHBondContact OD2-NE 3.23Å; D588-R592 IonicContact OD2-NH1 3.96Å; D588-R592 IonicContact OD2-NH2 2.66Å; D588-R592 PolarHBondContact OD2-NH2 2.8Å
589	S	90.3	Very high	91.9	Very high	82 Å²	82	44.7 Å²	44.7	57%	0.573	23%	0.229	S	C	*	.	H	α-helix	trans	-59.6	-43.8	176.9	52.2	0	0	0	0	112	T587 I591 R592 E593	T587-S589 WeakPolarHBondContact CG2-OG 3.39Å; S589-I591 PolarHBondContact O-N 2.96Å; S589-R592 PolarHBondContact O-N 2.71Å; S589-E593 WeakPolarHBondContact O-CB 3.45Å; S589-E593 PolarHBondContact O-N 3.22Å
590	L	91.1	Very high	92.1	Very high	55 Å²	55	48.3 Å²	48.3	29%	0.288	25%	0.249	S	C	.	.	H	α-helix	trans	-63.4	-40.7	178.4	-178.7	56.8	0	0	0	112.4	T587 D588 E593 W594	T587-L590 HydrophobicContact CG2-CB 3.95Å; D588-L590 VanDerWaalsContact C-N 3.33Å; D588-L590 PolarHBondContact O-N 2.81Å; L590-E593 PolarHBondContact O-N 3.33Å; L590-W594 VanDerWaalsContact O-CD1 3.27Å; L590-W594 PolarHBondContact O-N 3.16Å
591	I	92.9	Very high	91.8	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-71.5	-33.9	177.4	-157.8	65.6	0	0	0	112.3	L498 W560 N569 F571 T587 D588 S589 Y595	L498-I591 HydrophobicContact CD2-CD1 4.1Å; W560-I591 HydrophobicContact CH2-CG2 4.02Å; W560-I591 HydrophobicContact CZ3-CG1 4.35Å; W560-I591 HydrophobicContact CZ3-CG2 4.01Å; N569-I591 HydrophobicContact CB-CB 4.49Å; N569-I591 HydrophobicContact CB-CG2 3.76Å; F571-I591 HydrophobicContact CD1-CD1 3.85Å; F571-I591 HydrophobicContact CD1-CG1 3.69Å; F571-I591 HydrophobicContact CE1-CD1 3.44Å; F571-I591 VanDerWaalsContact CE1-CD1 3.44Å; F571-I591 HydrophobicContact CE1-CG1 3.72Å; F571-I591 HydrophobicContact CZ-CD1 4.36Å; T587-I591 PolarHBondContact O-N 2.97Å; T587-I591 VanDerWaalsContact O-N 3.17Å; D588-I591 WeakPolarHBondContact O-CG2 3.29Å; D588-I591 PolarHBondContact O-N 3.09Å; S589-I591 PolarHBondContact O-N 2.96Å; I591-Y595 WeakPolarHBondContact O-CB 3.46Å; I591-Y595 PolarHBondContact O-N 3.22Å
592	R	91.2	Very high	91.5	Very high	135 Å²	135	47 Å²	47	51%	0.509	24%	0.243	S	C	.	.	H	α-helix	trans	-67.3	-39.7	174.6	-68.9	177	-166.3	-167	9.9	111.5	W560 D588 S589 Y595 N596	W560-R592 HydrophobicContact CH2-CG 4.07Å; W560-R592 HydrophobicContact CZ2-CG 4.25Å; D588-R592 WeakPolarHBondContact O-CG 3.41Å; D588-R592 PolarHBondContact O-N 3.31Å; D588-R592 IonicContact OD1-CZ 3.18Å; D588-R592 IonicContact OD1-NE 3.69Å; D588-R592 PolarHBondContact OD1-NE 3.16Å; D588-R592 IonicContact OD1-NH2 3.99Å; D588-R592 PolarHBondContact OD1-NH2 3.31Å; D588-R592 IonicContact OD2-CZ 2.59Å; D588-R592 IonicContact OD2-NE 3.47Å; D588-R592 PolarHBondContact OD2-NE 3.23Å; D588-R592 IonicContact OD2-NH1 3.96Å; D588-R592 IonicContact OD2-NH2 2.66Å; D588-R592 PolarHBondContact OD2-NH2 2.8Å; S589-R592 PolarHBondContact O-N 2.71Å; R592-Y595 PolarHBondContact O-N 3.43Å; R592-N596 WeakPolarHBondContact O-CB 3.38Å; R592-N596 PolarHBondContact O-N 3.38Å; R592-N596 PolarHBondContact O-ND2 2.74Å
593	E	92.7	Very high	91.1	Very high	90 Å²	90	50 Å²	50	42%	0.421	26%	0.259	S	S	.	.	H	α-helix	trans	-59.1	-54.6	172.8	-165.1	-158.4	177	0	0	110.5	K494 S589 L590 Y595 N596 T597	K494-E593 VanDerWaalsContact CE-CD 3.49Å; K494-E593 VanDerWaalsContact CE-OE2 3.27Å; K494-E593 WeakPolarHBondContact CE-OE2 3.33Å; K494-E593 IonicContact NZ-OE1 3.49Å; K494-E593 PolarHBondContact NZ-OE1 3.3Å; K494-E593 IonicContact NZ-OE2 3.23Å; K494-E593 PolarHBondContact NZ-OE2 3.41Å; S589-E593 WeakPolarHBondContact O-CB 3.45Å; S589-E593 PolarHBondContact O-N 3.22Å; L590-E593 PolarHBondContact O-N 3.33Å; E593-Y595 VanDerWaalsContact C-N 3.31Å; E593-Y595 PolarHBondContact O-N 3.48Å; E593-N596 PolarHBondContact O-N 3.39Å; E593-N596 VanDerWaalsContact O-N 3.09Å; E593-T597 PolarHBondContact O-N 3.04Å; E593-T597 PolarHBondContact O-OG1 2.82Å; E593-T597 VanDerWaalsContact O-OG1 3.07Å
594	W	94.4	Very high	90.6	Very high	3 Å²	3	54.5 Å²	54.5	1%	0.011	28%	0.276	C	S	.	.	H	α-helix	trans	-57.3	-39.7	176	-88.5	106.6	0	0	0	113.6	K494 L498 V519 L521 L526 F571 L590 I598	K494-W594 HydrophobicContact CB-CE3 4.43Å; K494-W594 HydrophobicContact CB-CH2 3.83Å; K494-W594 HydrophobicContact CB-CZ2 4.36Å; K494-W594 HydrophobicContact CB-CZ3 3.87Å; K494-W594 HydrophobicContact CD-CD2 3.77Å; K494-W594 HydrophobicContact CD-CE3 3.91Å; K494-W594 HydrophobicContact CD-CG 4.3Å; K494-W594 HydrophobicContact CD-CH2 4.26Å; K494-W594 HydrophobicContact CD-CZ2 4.12Å; K494-W594 HydrophobicContact CD-CZ3 4.16Å; K494-W594 HydrophobicContact CG-CD2 4.37Å; K494-W594 HydrophobicContact CG-CE3 4.35Å; K494-W594 HydrophobicContact CG-CH2 3.81Å; K494-W594 HydrophobicContact CG-CZ2 3.82Å; K494-W594 HydrophobicContact CG-CZ3 4.09Å; L498-W594 HydrophobicContact CD1-CD2 3.85Å; L498-W594 HydrophobicContact CD1-CE3 4.35Å; L498-W594 HydrophobicContact CD1-CG 3.95Å; L498-W594 HydrophobicContact CD2-CG 4.4Å; V519-W594 HydrophobicContact CB-CH2 4.07Å; V519-W594 HydrophobicContact CB-CZ2 4.42Å; V519-W594 HydrophobicContact CG1-CH2 4.06Å; V519-W594 HydrophobicContact CG1-CZ3 4.11Å; L521-W594 HydrophobicContact CB-CZ3 4.21Å; L526-W594 HydrophobicContact CD1-CZ3 4.3Å; F571-W594 HydrophobicContact CE1-CB 4.27Å; F571-W594 HydrophobicContact CZ-CB 4.43Å; L590-W594 VanDerWaalsContact O-CD1 3.27Å; L590-W594 PolarHBondContact O-N 3.16Å; W594-I598 HydrophobicContact CE3-CD1 3.95Å; W594-I598 HydrophobicContact CE3-CG1 4.3Å; W594-I598 WeakPolarHBondContact O-CB 3.3Å; W594-I598 VanDerWaalsContact O-CG1 3.3Å; W594-I598 WeakPolarHBondContact O-CG1 3.48Å; W594-I598 PolarHBondContact O-N 2.94Å
595	Y	93.9	Very high	89.9	Confident	31 Å²	31	54.5 Å²	54.5	12%	0.122	28%	0.276	C	S	.	.	H	α-helix	trans	-61	-46.9	174.7	-179.4	-87.7	0	0	0	111	L558 W560 F571 I591 R592 E593 K599	L558-Y595 HydrophobicContact CB-CE2 4.28Å; L558-Y595 HydrophobicContact CD2-CD1 4.36Å; L558-Y595 HydrophobicContact CD2-CD2 3.5Å; L558-Y595 VanDerWaalsContact CD2-CD2 3.5Å; L558-Y595 HydrophobicContact CD2-CE1 4.47Å; L558-Y595 HydrophobicContact CD2-CE2 3.66Å; L558-Y595 HydrophobicContact CD2-CG 3.88Å; L558-Y595 VanDerWaalsContact CD2-O 3.25Å; L558-Y595 WeakPolarHBondContact CD2-O 3.08Å; L558-Y595 HydrophobicContact CG-CD2 3.81Å; L558-Y595 HydrophobicContact CG-CE2 3.65Å; W560-Y595 AromaticContact CD1-CZ 3.93Å; W560-Y595 HydrophobicContact CD2-CD2 4.28Å; W560-Y595 HydrophobicContact CD2-CE2 4.26Å; W560-Y595 AromaticContact CE2-CD2 3.72Å; W560-Y595 AromaticContact CE2-CE2 3.82Å; W560-Y595 AromaticContact CE2-CG 3.87Å; W560-Y595 HydrophobicContact CG-CE2 4.36Å; W560-Y595 HydrophobicContact CH2-CD2 4.2Å; W560-Y595 HydrophobicContact CH2-CG 4.07Å; W560-Y595 AromaticContact CZ2-CD1 3.82Å; W560-Y595 HydrophobicContact CZ2-CD1 3.82Å; W560-Y595 AromaticContact CZ2-CD2 3.69Å; W560-Y595 HydrophobicContact CZ2-CD2 3.69Å; W560-Y595 HydrophobicContact CZ2-CE1 4.38Å; W560-Y595 HydrophobicContact CZ2-CE2 4.25Å; W560-Y595 AromaticContact CZ2-CG 3.44Å; W560-Y595 HydrophobicContact CZ2-CG 3.44Å; W560-Y595 VanDerWaalsContact CZ2-CG 3.44Å; W560-Y595 AromaticContact NE1-CE1 3.69Å; W560-Y595 AromaticContact NE1-CE2 3.66Å; W560-Y595 AromaticContact NE1-CZ 3.5Å; F571-Y595 HydrophobicContact CB-CD2 3.71Å; F571-Y595 HydrophobicContact CB-CE2 4.13Å; F571-Y595 AromaticContact CD1-CD2 3.83Å; F571-Y595 HydrophobicContact CD1-CD2 3.83Å; F571-Y595 HydrophobicContact CD1-CG 4.37Å; F571-Y595 HydrophobicContact CD2-CD2 4.33Å; F571-Y595 HydrophobicContact CE1-CD2 4.5Å; F571-Y595 AromaticContact CG-CD2 3.74Å; F571-Y595 HydrophobicContact CG-CD2 3.74Å; I591-Y595 WeakPolarHBondContact O-CB 3.46Å; I591-Y595 PolarHBondContact O-N 3.22Å; R592-Y595 PolarHBondContact O-N 3.43Å; E593-Y595 VanDerWaalsContact C-N 3.31Å; E593-Y595 PolarHBondContact O-N 3.48Å; Y595-K599 HydrophobicContact CE1-CD 4.22Å; Y595-K599 VanDerWaalsContact O-CB 3.24Å; Y595-K599 WeakPolarHBondContact O-CB 3.45Å; Y595-K599 PolarHBondContact O-N 3.08Å
596	N	93.5	Very high	89	Confident	86 Å²	86	57 Å²	57	46%	0.46	29%	0.288	S	S	.	.	H	α-helix	trans	-67.3	-44.9	-179.8	-70.1	-14.1	0	0	0	112.1	R592 E593 K599 N600	R592-N596 WeakPolarHBondContact O-CB 3.38Å; R592-N596 PolarHBondContact O-N 3.38Å; R592-N596 PolarHBondContact O-ND2 2.74Å; E593-N596 PolarHBondContact O-N 3.39Å; E593-N596 VanDerWaalsContact O-N 3.09Å; N596-K599 PolarHBondContact O-N 3.43Å; N596-N600 WeakPolarHBondContact O-CB 3.49Å; N596-N600 PolarHBondContact O-N 3.19Å; N596-N600 PolarHBondContact O-OD1 3.33Å
597	T	92.5	Very high	88.2	Confident	28 Å²	28	61.2 Å²	61.2	17%	0.172	30%	0.295	C	S	.	.	H	α-helix	trans	-62	-47.4	177.8	-44.3	0	0	0	0	111.3	K494 L521 E593 K599 N600 V601	K494-T597 HydrophobicContact CB-CG2 4.47Å; K494-T597 HydrophobicContact CD-CG2 4.5Å; L521-T597 HydrophobicContact CD2-CG2 3.74Å; E593-T597 PolarHBondContact O-N 3.04Å; E593-T597 PolarHBondContact O-OG1 2.82Å; E593-T597 VanDerWaalsContact O-OG1 3.07Å; T597-K599 VanDerWaalsContact C-N 3.33Å; T597-K599 PolarHBondContact O-N 3.11Å; T597-N600 PolarHBondContact O-N 3.13Å; T597-V601 PolarHBondContact O-N 2.93Å
598	I	92.4	Very high	87.2	Confident	0 Å²	0	63.2 Å²	63.2	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-63.9	-39.3	177.8	-67.9	169.1	0	0	0	110.9	L521 L526 L553 L558 F571 L583 W594 V601 I602	L521-I598 HydrophobicContact CD2-CG1 4.09Å; L526-I598 HydrophobicContact CD1-CD1 4.02Å; L526-I598 HydrophobicContact CD1-CG1 4.36Å; L526-I598 HydrophobicContact CD2-CD1 4Å; L553-I598 HydrophobicContact CD1-CG2 4.28Å; L553-I598 HydrophobicContact CD2-CG2 4.29Å; L558-I598 HydrophobicContact CD1-CG2 3.97Å; L558-I598 HydrophobicContact CD2-CB 4.27Å; L558-I598 HydrophobicContact CD2-CG2 4.09Å; F571-I598 HydrophobicContact CE2-CD1 4.3Å; F571-I598 HydrophobicContact CZ-CD1 4Å; L583-I598 HydrophobicContact CD1-CD1 4.5Å; W594-I598 HydrophobicContact CE3-CD1 3.95Å; W594-I598 HydrophobicContact CE3-CG1 4.3Å; W594-I598 WeakPolarHBondContact O-CB 3.3Å; W594-I598 VanDerWaalsContact O-CG1 3.3Å; W594-I598 WeakPolarHBondContact O-CG1 3.48Å; W594-I598 PolarHBondContact O-N 2.94Å; I598-V601 PolarHBondContact O-N 3.45Å; I598-I602 HydrophobicContact CG2-CD1 3.91Å; I598-I602 VanDerWaalsContact O-CG1 3.3Å; I598-I602 WeakPolarHBondContact O-CG1 3.38Å; I598-I602 PolarHBondContact O-N 3.26Å
599	K	91.5	Very high	85.7	Confident	81 Å²	81	64.1 Å²	64.1	35%	0.352	30%	0.304	S	S	.	.	H	α-helix	trans	-64.4	-45.1	175.6	-170.8	-179.1	178	-76.2	0	111.9	L558 Y595 N596 T597 V601 I602 D603	L558-K599 HydrophobicContact CD2-CB 4.04Å; Y595-K599 HydrophobicContact CE1-CD 4.22Å; Y595-K599 VanDerWaalsContact O-CB 3.24Å; Y595-K599 WeakPolarHBondContact O-CB 3.45Å; Y595-K599 PolarHBondContact O-N 3.08Å; N596-K599 PolarHBondContact O-N 3.43Å; T597-K599 VanDerWaalsContact C-N 3.33Å; T597-K599 PolarHBondContact O-N 3.11Å; K599-V601 VanDerWaalsContact C-N 3.3Å; K599-V601 PolarHBondContact O-N 3.25Å; K599-I602 PolarHBondContact O-N 3.32Å; K599-I602 VanDerWaalsContact O-N 3.14Å; K599-D603 IonicContact NZ-OD1 3.2Å; K599-D603 IonicContact NZ-OD2 3.01Å; K599-D603 PolarHBondContact NZ-OD2 3.19Å; K599-D603 WeakPolarHBondContact O-CB 3.36Å; K599-D603 PolarHBondContact O-N 3.26Å
600	N	89.1	Confident	84.1	Confident	106 Å²	106	64.8 Å²	64.8	57%	0.567	31%	0.306	S	S	*	.	H	α-helix	trans	-61	-39.8	178.9	-70.7	-1.7	0	0	0	111.5	N596 T597 D603 R604	N596-N600 WeakPolarHBondContact O-CB 3.49Å; N596-N600 PolarHBondContact O-N 3.19Å; N596-N600 PolarHBondContact O-OD1 3.33Å; T597-N600 PolarHBondContact O-N 3.13Å; N600-D603 PolarHBondContact O-N 3.41Å; N600-R604 VanDerWaalsContact O-CB 3.26Å; N600-R604 WeakPolarHBondContact O-CB 3.46Å; N600-R604 PolarHBondContact O-N 3.48Å
601	V	86.2	Confident	82.5	Confident	1 Å²	1	63.6 Å²	63.6	1%	0.006	30%	0.3	C	S	.	.	H	α-helix	trans	-65	-42.5	173.7	170.2	0	0	0	0	111.6	E493 L521 G523 L553 T597 I598 K599 R604 L605	E493-V601 HydrophobicContact CG-CG2 4.32Å; L521-V601 HydrophobicContact CD1-CG1 4.45Å; L521-V601 HydrophobicContact CD2-CG2 4.05Å; G523-V601 WeakPolarHBondContact O-CG1 3.3Å; L553-V601 HydrophobicContact CD1-CG1 3.99Å; T597-V601 PolarHBondContact O-N 2.93Å; I598-V601 PolarHBondContact O-N 3.45Å; K599-V601 VanDerWaalsContact C-N 3.3Å; K599-V601 PolarHBondContact O-N 3.25Å; V601-R604 PolarHBondContact O-N 3.16Å; V601-L605 HydrophobicContact CG1-CD1 3.74Å; V601-L605 HydrophobicContact CG1-CG 4.34Å; V601-L605 WeakPolarHBondContact O-CB 3.44Å; V601-L605 WeakPolarHBondContact O-CD1 3.29Å; V601-L605 WeakPolarHBondContact O-CG 3.44Å; V601-L605 PolarHBondContact O-N 3.39Å
602	I	86.9	Confident	80.4	Confident	9 Å²	9	71.7 Å²	71.7	5%	0.046	34%	0.338	C	S	.	.	H	α-helix	trans	-61.7	-50	174.3	-67.9	164.2	0	0	0	110.9	L553 A556 L558 L573 I598 K599 R604 L605 D606	L553-I602 HydrophobicContact CB-CG1 4.05Å; A556-I602 HydrophobicContact CB-CD1 4.08Å; A556-I602 HydrophobicContact CB-CG1 4.45Å; A556-I602 WeakPolarHBondContact O-CG2 3.26Å; L558-I602 HydrophobicContact CB-CD1 4.43Å; L573-I602 HydrophobicContact CD1-CD1 4.41Å; I598-I602 HydrophobicContact CG2-CD1 3.91Å; I598-I602 VanDerWaalsContact O-CG1 3.3Å; I598-I602 WeakPolarHBondContact O-CG1 3.38Å; I598-I602 PolarHBondContact O-N 3.26Å; K599-I602 PolarHBondContact O-N 3.32Å; K599-I602 VanDerWaalsContact O-N 3.14Å; I602-R604 VanDerWaalsContact C-N 3.26Å; I602-R604 PolarHBondContact O-N 2.88Å; I602-L605 PolarHBondContact O-N 2.81Å; I602-D606 PolarHBondContact O-N 2.8Å
603	D	85.5	Confident	78.1	Confident	64 Å²	64	72.4 Å²	72.4	34%	0.342	35%	0.352	S	S	.	.	H	α-helix	trans	-63.2	-31.3	-179.3	-70.6	-11.6	0	0	0	111.8	K599 N600 R607	K599-D603 IonicContact NZ-OD1 3.2Å; K599-D603 IonicContact NZ-OD2 3.01Å; K599-D603 PolarHBondContact NZ-OD2 3.19Å; K599-D603 WeakPolarHBondContact O-CB 3.36Å; K599-D603 PolarHBondContact O-N 3.26Å; N600-D603 PolarHBondContact O-N 3.41Å; D603-R607 WeakPolarHBondContact O-CD 3.34Å; D603-R607 VanDerWaalsContact O-CG 3.23Å; D603-R607 WeakPolarHBondContact O-CG 3.39Å; D603-R607 PolarHBondContact O-N 2.9Å
604	R	84.1	Confident	75.8	Confident	93 Å²	93	71.6 Å²	71.6	35%	0.351	35%	0.353	S	S	.	.	H	α-helix	trans	-69.7	-49.8	171.7	-177.1	175.8	75.2	-146	-3	111.3	E493 N600 V601 I602 D606 R607 E608	E493-R604 IonicContact OE1-CZ 2.8Å; E493-R604 IonicContact OE1-NH1 3.77Å; E493-R604 PolarHBondContact OE1-NH1 3.15Å; E493-R604 IonicContact OE1-NH2 2.63Å; E493-R604 PolarHBondContact OE1-NH2 2.62Å; N600-R604 VanDerWaalsContact O-CB 3.26Å; N600-R604 WeakPolarHBondContact O-CB 3.46Å; N600-R604 PolarHBondContact O-N 3.48Å; V601-R604 PolarHBondContact O-N 3.16Å; I602-R604 VanDerWaalsContact C-N 3.26Å; I602-R604 PolarHBondContact O-N 2.88Å; R604-D606 PolarHBondContact O-N 2.8Å; R604-R607 WeakPolarHBondContact O-CB 3.44Å; R604-R607 PolarHBondContact O-N 3.04Å; R604-R607 VanDerWaalsContact O-N 3.14Å; R604-E608 WeakPolarHBondContact CD-OE1 3.39Å; R604-E608 HydrophobicContact CG-CG 4.39Å; R604-E608 WeakPolarHBondContact CG-OE1 3.15Å; R604-E608 IonicContact NE-OE1 3.69Å; R604-E608 WeakPolarHBondContact O-CG 3.05Å; R604-E608 PolarHBondContact O-N 3.11Å
605	L	78.8	Confident	73.5	Confident	5 Å²	5	74.9 Å²	74.9	3%	0.026	37%	0.37	C	S	.	.	H	α-helix	trans	-62.1	-40.1	-179.8	-71.9	168.1	0	0	0	113.2	N524 L553 R554 V601 I602 R607 E608 N609	N524-L605 HydrophobicContact CB-CD1 4.37Å; N524-L605 HydrophobicContact CB-CD2 4.18Å; N524-L605 WeakPolarHBondContact ND2-CD2 3.43Å; L553-L605 HydrophobicContact CB-CD1 4.08Å; R554-L605 HydrophobicContact CG-CB 4.13Å; R554-L605 HydrophobicContact CG-CD1 4.08Å; R554-L605 HydrophobicContact CG-CD2 4.17Å; R554-L605 HydrophobicContact CG-CG 4.37Å; V601-L605 HydrophobicContact CG1-CD1 3.74Å; V601-L605 HydrophobicContact CG1-CG 4.34Å; V601-L605 WeakPolarHBondContact O-CB 3.44Å; V601-L605 WeakPolarHBondContact O-CD1 3.29Å; V601-L605 WeakPolarHBondContact O-CG 3.44Å; V601-L605 PolarHBondContact O-N 3.39Å; I602-L605 PolarHBondContact O-N 2.81Å; L605-R607 VanDerWaalsContact C-N 3.28Å; L605-R607 PolarHBondContact O-N 3.48Å; L605-E608 PolarHBondContact O-N 3.07Å; L605-N609 PolarHBondContact O-N 3.16Å
606	D	74.3	Confident	70.9	Confident	64 Å²	64	80.5 Å²	80.5	34%	0.342	40%	0.397	S	S	.	.	H	α-helix	trans	-72.9	-20.2	178.2	-78.1	7.1	0	0	0	112.1	G555 I602 R604	G555-D606 WeakPolarHBondContact CA-OD1 3.19Å; G555-D606 PolarHBondContact N-OD1 3.11Å; I602-D606 PolarHBondContact O-N 2.8Å; R604-D606 PolarHBondContact O-N 2.8Å
607	R	71.9	Confident	68.2	Low	216 Å²	216	85.2 Å²	85.2	82%	0.815	41%	0.41	S	S	*	.	H	α-helix	trans	-82.3	-42.8	169.8	-74.9	171.2	-178	-89.5	1.5	112.9	D603 R604 L605 N609	D603-R607 WeakPolarHBondContact O-CD 3.34Å; D603-R607 VanDerWaalsContact O-CG 3.23Å; D603-R607 WeakPolarHBondContact O-CG 3.39Å; D603-R607 PolarHBondContact O-N 2.9Å; R604-R607 WeakPolarHBondContact O-CB 3.44Å; R604-R607 PolarHBondContact O-N 3.04Å; R604-R607 VanDerWaalsContact O-N 3.14Å; L605-R607 VanDerWaalsContact C-N 3.28Å; L605-R607 PolarHBondContact O-N 3.48Å; R607-N609 VanDerWaalsContact C-N 3.31Å
608	E	67	Low	65.7	Low	116 Å²	116	85.6 Å²	85.6	54%	0.542	41%	0.414	S	S	.	.	H	α-helix	trans	-70.9	-25	179.1	-72.8	174.9	-165.4	0	0	113	R604 L605	R604-E608 WeakPolarHBondContact CD-OE1 3.39Å; R604-E608 HydrophobicContact CG-CG 4.39Å; R604-E608 WeakPolarHBondContact CG-OE1 3.15Å; R604-E608 IonicContact NE-OE1 3.69Å; R604-E608 WeakPolarHBondContact O-CG 3.05Å; R604-E608 PolarHBondContact O-N 3.11Å; L605-E608 PolarHBondContact O-N 3.07Å
609	N	59.3	Low	63.4	Low	82 Å²	82	91 Å²	91	44%	0.439	44%	0.442	S	S	.	.	S	Bend	trans	-150.8	72.6	-176.8	-165.4	-15.3	0	0	0	112.2	L605 R607 L611	L605-N609 PolarHBondContact O-N 3.16Å; R607-N609 VanDerWaalsContact C-N 3.31Å; N609-L611 PolarHBondContact O-N 2.91Å; N609-L611 VanDerWaalsContact O-N 3.16Å
610	P	57.6	Low	61.1	Low	96 Å²	96	98 Å²	98	62%	0.623	47%	0.466	S	S	*	.			trans	-61.2	116	-179.6	23.3	-33.3	0	0	0	112	E612	P610-E612 PolarHBondContact O-N 3.38Å
611	L	57.6	Low	59	Low	29 Å²	29	100.6 Å²	100.6	15%	0.152	47%	0.468	C	S	.	.			trans	-76.2	33.7	-166.5	-71.4	175.3	0	0	0	116.3	R554 N609 N613 V614 L615	R554-L611 HydrophobicContact CB-CD1 4.34Å; N609-L611 PolarHBondContact O-N 2.91Å; N609-L611 VanDerWaalsContact O-N 3.16Å; L611-N613 VanDerWaalsContact C-N 3.29Å; L611-N613 PolarHBondContact O-N 3.32Å; L611-V614 HydrophobicContact CD2-CB 4.29Å; L611-V614 HydrophobicContact CD2-CG2 4.15Å; L611-V614 PolarHBondContact O-N 3.16Å; L611-L615 HydrophobicContact CB-CD1 4.4Å; L611-L615 HydrophobicContact CB-CG 4.27Å; L611-L615 PolarHBondContact O-N 2.89Å
612	E	47.7	Very low	56.9	Low	170 Å²	170	104.3 Å²	104.3	79%	0.794	50%	0.499	S	S	*	.	H	α-helix	trans	-59.8	-35.8	-172.2	-164.8	157.7	-134.3	0	0	113.2	P610	P610-E612 PolarHBondContact O-N 3.38Å
613	N	43.6	Very low	54.6	Low	151 Å²	151	107.3 Å²	107.3	81%	0.807	53%	0.532	S	S	*	.	H	α-helix	trans	-86.5	-13.9	-179.2	-78.8	-69	0	0	0	115.4	L611	L611-N613 VanDerWaalsContact C-N 3.29Å; L611-N613 PolarHBondContact O-N 3.32Å
614	V	44.9	Very low	52.7	Low	72 Å²	72	108.4 Å²	108.4	44%	0.436	55%	0.545	S	S	.	.	H	α-helix	trans	-97.5	-32	-174.1	-178.4	0	0	0	0	112.3	L611 Q616 Y617 S618	L611-V614 HydrophobicContact CD2-CB 4.29Å; L611-V614 HydrophobicContact CD2-CG2 4.15Å; L611-V614 PolarHBondContact O-N 3.16Å; V614-Q616 PolarHBondContact O-N 3.36Å; V614-Y617 PolarHBondContact O-N 2.91Å; V614-S618 PolarHBondContact O-N 3.11Å; V614-S618 PolarHBondContact O-OG 2.97Å
615	L	45.4	Very low	50.5	Low	72 Å²	72	110.2 Å²	110.2	38%	0.377	57%	0.566	S	S	.	*	H	α-helix	trans	-67.7	-35.4	-176.8	-67.1	175.6	0	0	0	112.5	L611 Y617 S618 L619	L611-L615 HydrophobicContact CB-CD1 4.4Å; L611-L615 HydrophobicContact CB-CG 4.27Å; L611-L615 PolarHBondContact O-N 2.89Å; L615-Y617 VanDerWaalsContact C-N 3.25Å; L615-Y617 PolarHBondContact O-N 3.44Å; L615-S618 PolarHBondContact O-N 3.38Å; L615-L619 HydrophobicContact CB-CD1 4.03Å; L615-L619 HydrophobicContact CD2-CD1 4.33Å; L615-L619 VanDerWaalsContact O-CD1 3.32Å; L615-L619 WeakPolarHBondContact O-CD1 3.3Å; L615-L619 PolarHBondContact O-N 3.21Å
616	Q	38.9	Very low	48.6	Very low	149 Å²	149	118.4 Å²	118.4	70%	0.696	60%	0.604	S	S	*	*	H	α-helix	trans	-57.1	-35.8	178.6	-153.2	72.3	-34.2	0	0	113.2	V614	V614-Q616 PolarHBondContact O-N 3.36Å
617	Y	37.5	Very low	47	Very low	185 Å²	185	122.8 Å²	122.8	73%	0.725	62%	0.624	S	S	*	*	H	α-helix	trans	-84.7	-15.7	175.9	-109.1	-84.3	0	0	0	114	V614 L615	V614-Y617 PolarHBondContact O-N 2.91Å; L615-Y617 VanDerWaalsContact C-N 3.25Å; L615-Y617 PolarHBondContact O-N 3.44Å
618	S	40.4	Very low	45.5	Very low	36 Å²	36	120.5 Å²	120.5	25%	0.252	63%	0.628	S	S	.	*	H	α-helix	trans	-95.6	-44.3	-174.4	-58.8	0	0	0	0	111.8	V614 L615 R621 A622	V614-S618 PolarHBondContact O-N 3.11Å; V614-S618 PolarHBondContact O-OG 2.97Å; L615-S618 PolarHBondContact O-N 3.38Å; S618-R621 WeakPolarHBondContact O-CB 3.43Å; S618-R621 PolarHBondContact O-N 3.06Å; S618-A622 PolarHBondContact O-N 3.27Å
619	L	44	Very low	44	Very low	114 Å²	114	121.6 Å²	121.6	60%	0.597	64%	0.637	S	S	*	*	H	α-helix	trans	-63.7	-44	174.7	-82.9	77.6	0	0	0	111.3	L615 R621 A622 G623	L615-L619 HydrophobicContact CB-CD1 4.03Å; L615-L619 HydrophobicContact CD2-CD1 4.33Å; L615-L619 VanDerWaalsContact O-CD1 3.32Å; L615-L619 WeakPolarHBondContact O-CD1 3.3Å; L615-L619 PolarHBondContact O-N 3.21Å; L619-R621 PolarHBondContact O-N 3.24Å; L619-R621 VanDerWaalsContact O-N 3.08Å; L619-A622 PolarHBondContact O-N 3.12Å; L619-A622 VanDerWaalsContact O-N 3.11Å; L619-G623 PolarHBondContact O-N 3.33Å
620	R	42.7	Very low	42.8	Very low	227 Å²	227	126.3 Å²	126.3	86%	0.857	66%	0.656	S	S	*	*	H	α-helix	trans	-61.7	-14.4	171.8	-79.2	-160	-175	-112.4	9.3	114.1
621	R	44.9	Very low	42.1	Very low	161 Å²	161	128 Å²	128	61%	0.608	67%	0.67	S	S	*	*	H	α-helix	trans	-82.7	-27.6	176.6	-166.1	-179.2	-66.8	-156	0.4	112.6	S618 L619 R659	S618-R621 WeakPolarHBondContact O-CB 3.43Å; S618-R621 PolarHBondContact O-N 3.06Å; L619-R621 PolarHBondContact O-N 3.24Å; L619-R621 VanDerWaalsContact O-N 3.08Å; R621-R659 PolarHBondContact O-NH2 2.81Å; R621-R659 VanDerWaalsContact O-NH2 3.08Å
622	A	42.8	Very low	40.9	Very low	79 Å²	79	129.9 Å²	129.9	65%	0.653	70%	0.697	S	S	*	*	H	α-helix	trans	-93.6	-28.2	-172.2	0	0	0	0	0	114.4	S618 L619	S618-A622 PolarHBondContact O-N 3.27Å; L619-A622 PolarHBondContact O-N 3.12Å; L619-A622 VanDerWaalsContact O-N 3.11Å
623	G	38	Very low	40.6	Very low	72 Å²	72	129.5 Å²	129.5	74%	0.742	70%	0.7	S	S	*	*			trans	68.9	31.8	175.5	0	0	0	0	0	114.5	L619	L619-G623 PolarHBondContact O-N 3.33Å
624	S	46.1	Very low	40.6	Very low	87 Å²	87	130.9 Å²	130.9	61%	0.608	70%	0.702	S	S	*	*			trans	-120.1	89.7	175.2	-169.9	0	0	0	0	109
625	V	36.8	Very low	40.5	Very low	131 Å²	131	134.5 Å²	134.5	79%	0.794	72%	0.719	S	S	*	*			trans	-137.3	10.8	174.3	79.8	0	0	0	0	111.7
626	E	39	Very low	40.2	Very low	178 Å²	178	135.8 Å²	135.8	83%	0.832	73%	0.726	S	S	*	*	S	Bend	trans	-128.1	36	-176.5	-65.4	173	-178.9	0	0	110.2
627	M	40.1	Very low	40.4	Very low	155 Å²	155	137.8 Å²	137.8	76%	0.764	73%	0.727	S	S	*	*	S	Bend	trans	-137.8	25.1	175.6	-79.2	-61.2	-39.3	0	0	111.4
628	L	40.7	Very low	40.5	Very low	168 Å²	168	140.1 Å²	140.1	88%	0.88	74%	0.735	S	S	*	*	S	Bend	trans	-130.2	49.1	174.2	-87.5	169.7	0	0	0	109.7
629	D	36.8	Very low	40.5	Very low	140 Å²	140	146.1 Å²	146.1	75%	0.749	76%	0.764	S	S	*	*			trans	-158.4	169.2	154.8	-114.1	-35.2	0	0	0	108.5
630	H	32.4	Very low	40	Very low	180 Å²	180	146.5 Å²	146.5	83%	0.833	78%	0.776	S	S	*	*			trans	73.2	61.1	-168.8	-45.9	83.9	0	0	0	113.9
631	S	43.5	Very low	39.8	Very low	132 Å²	132	143.3 Å²	143.3	92%	0.923	78%	0.775	S	S	*	*			trans	-69.3	113	140.6	168.6	0	0	0	0	108.1
632	G	33	Very low	39.6	Very low	68 Å²	68	141.6 Å²	141.6	70%	0.701	79%	0.785	S	S	*	*			trans	164.3	93.3	177.6	0	0	0	0	0	114.1
633	D	42.3	Very low	39.6	Very low	163 Å²	163	149.2 Å²	149.2	87%	0.872	80%	0.797	S	S	*	*			trans	32.2	175	143.7	-123.7	-30.9	0	0	0	124.3
634	E	41.8	Very low	39.7	Very low	180 Å²	180	149.6 Å²	149.6	84%	0.841	79%	0.788	S	S	*	*			trans	75.5	157.9	171.5	-70.6	-68.9	152.6	0	0	118.3
635	D	42.7	Very low	39.8	Very low	148 Å²	148	151.3 Å²	151.3	79%	0.791	79%	0.794	S	S	*	*			trans	-127	174.1	-148.6	-158.1	-0.8	0	0	0	114.6
636	D	40.2	Very low	40.4	Very low	98 Å²	98	148.6 Å²	148.6	52%	0.524	78%	0.781	S	S	.	*			trans	82.4	126.7	150.2	-140.5	3.3	0	0	0	122.1
637	R	43.3	Very low	41	Very low	191 Å²	191	144.8 Å²	144.8	72%	0.721	77%	0.767	S	S	*	*			trans	46.8	102.9	151.9	-86.4	172.2	-95	-159.3	-1.3	121.5
638	R	38.9	Very low	41.4	Very low	235 Å²	235	141.1 Å²	141.1	89%	0.887	75%	0.75	S	S	*	*				-175.1	161.9	95	-107.5	159	-73.2	-164.8	-4.3	118.3
639	N	40.2	Very low	41.7	Very low	161 Å²	161	138 Å²	138	86%	0.861	73%	0.731	S	S	*	*			trans	-34.4	136.1	177.2	-56.9	-2.5	0	0	0	117.2
640	S	33.5	Very low	42.7	Very low	122 Å²	122	135.6 Å²	135.6	85%	0.853	72%	0.718	S	S	*	*			trans	-138.5	139.3	145.7	64.5	0	0	0	0	111.3
641	L	38.6	Very low	44.4	Very low	161 Å²	161	129.7 Å²	129.7	84%	0.843	69%	0.694	S	S	*	*			trans	-79.7	150	-176.6	-73.4	161.3	0	0	0	111.6	R643	L641-R643 PolarHBondContact O-N 2.64Å
642	P	41.9	Very low	45.5	Very low	125 Å²	125	127.2 Å²	127.2	81%	0.812	67%	0.668	S	S	*	*			trans	-63.9	109.9	179	26.2	-34.2	0	0	0	111.3	S644	P642-S644 PolarHBondContact O-N 2.67Å
643	R	41	Very low	47.4	Very low	238 Å²	238	131.5 Å²	131.5	90%	0.898	66%	0.663	S	S	*	*			trans	-74.7	120.6	-175	-155.4	170.5	-167	145.5	3	110.7	L641	L641-R643 PolarHBondContact O-N 2.64Å
644	S	41.4	Very low	49.3	Very low	80 Å²	80	130.5 Å²	130.5	56%	0.559	65%	0.651	S	S	*	*			trans	-56.4	135.2	-165.6	-173.1	0	0	0	0	115.3	P642 S646 N647	P642-S644 PolarHBondContact O-N 2.67Å; S644-S646 PolarHBondContact O-N 2.97Å; S644-S646 VanDerWaalsContact O-N 3.13Å; S644-N647 PolarHBondContact O-N 3.16Å
645	V	48.4	Very low	51.1	Low	123 Å²	123	129.1 Å²	129.1	75%	0.745	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.5	-31.6	-170.2	-170.5	0	0	0	0	113.2	N647 L648	V645-N647 PolarHBondContact O-N 2.92Å; V645-N647 VanDerWaalsContact O-N 3.11Å; V645-L648 PolarHBondContact O-N 2.59Å
646	S	48.9	Very low	53.2	Low	74 Å²	74	126.2 Å²	126.2	52%	0.517	63%	0.626	S	S	.	*	H	α-helix	trans	-60.5	-21.9	-177.8	58.4	0	0	0	0	114.7	S644 N650	S644-S646 PolarHBondContact O-N 2.97Å; S644-S646 VanDerWaalsContact O-N 3.13Å; S646-N650 PolarHBondContact O-N 2.98Å
647	N	50.5	Low	55.3	Low	98 Å²	98	129.3 Å²	129.3	52%	0.524	64%	0.635	S	S	.	*	H	α-helix	trans	-77	-27.3	175.2	-83.3	-74.4	0	0	0	113.4	S644 V645 T651	S644-N647 PolarHBondContact O-N 3.16Å; V645-N647 PolarHBondContact O-N 2.92Å; V645-N647 VanDerWaalsContact O-N 3.11Å; N647-T651 WeakPolarHBondContact O-CB 3.47Å; N647-T651 WeakPolarHBondContact O-CG2 3.44Å; N647-T651 PolarHBondContact O-N 3.1Å; N647-T651 PolarHBondContact O-OG1 3.17Å
648	L	48.9	Very low	57.4	Low	79 Å²	79	124.1 Å²	124.1	41%	0.414	62%	0.624	S	S	.	*	H	α-helix	trans	-68.2	-46.7	178.7	-177.7	58.6	0	0	0	110.5	V645 N650 T651 E652	V645-L648 PolarHBondContact O-N 2.59Å; L648-N650 PolarHBondContact O-N 2.93Å; L648-T651 PolarHBondContact O-N 3.37Å; L648-T651 PolarHBondContact O-OG1 2.87Å; L648-E652 VanDerWaalsContact O-CB 3.31Å; L648-E652 WeakPolarHBondContact O-CB 3.48Å; L648-E652 PolarHBondContact O-N 2.98Å
649	E	48	Very low	59.6	Low	102 Å²	102	119.9 Å²	119.9	48%	0.477	61%	0.608	S	S	.	*	H	α-helix	trans	-66.1	-38.8	179.7	-150.8	-158.1	151.1	0	0	112.1	E652 R653	E649-E652 PolarHBondContact O-N 2.89Å; E649-R653 WeakPolarHBondContact O-CB 3.41Å; E649-R653 VanDerWaalsContact O-CG 3.28Å; E649-R653 WeakPolarHBondContact O-CG 3.46Å; E649-R653 PolarHBondContact O-N 3.13Å; E649-R653 IonicContact OE1-CZ 3.35Å; E649-R653 IonicContact OE1-NE 3.77Å; E649-R653 PolarHBondContact OE1-NE 3.4Å; E649-R653 IonicContact OE1-NH2 2.68Å; E649-R653 PolarHBondContact OE1-NH2 2.88Å
650	N	58.1	Low	61.5	Low	90 Å²	90	116.7 Å²	116.7	48%	0.481	59%	0.591	S	S	.	*	H	α-helix	trans	-68.5	-34.8	176	-109.1	-34.6	0	0	0	113	S646 L648 K654	S646-N650 PolarHBondContact O-N 2.98Å; L648-N650 PolarHBondContact O-N 2.93Å; N650-K654 WeakPolarHBondContact O-CB 3.33Å; N650-K654 VanDerWaalsContact O-CG 3.23Å; N650-K654 WeakPolarHBondContact O-CG 3.44Å; N650-K654 PolarHBondContact O-N 3.29Å; N650-K654 VanDerWaalsContact O-N 3.12Å
651	T	67.8	Low	64	Low	55 Å²	55	117.8 Å²	117.8	34%	0.337	58%	0.58	S	S	.	*	H	α-helix	trans	-73.6	-34.2	173	51.5	0	0	0	0	111.8	N647 L648 K654 R655	N647-T651 WeakPolarHBondContact O-CB 3.47Å; N647-T651 WeakPolarHBondContact O-CG2 3.44Å; N647-T651 PolarHBondContact O-N 3.1Å; N647-T651 PolarHBondContact O-OG1 3.17Å; L648-T651 PolarHBondContact O-N 3.37Å; L648-T651 PolarHBondContact O-OG1 2.87Å; T651-K654 PolarHBondContact O-N 3.27Å; T651-R655 WeakPolarHBondContact O-CB 3.21Å; T651-R655 WeakPolarHBondContact O-CD 3.47Å; T651-R655 WeakPolarHBondContact O-CG 3.41Å; T651-R655 PolarHBondContact O-N 3.44Å
652	E	67.1	Low	66.5	Low	80 Å²	80	117.4 Å²	117.4	37%	0.374	57%	0.571	S	S	.	*	H	α-helix	trans	-65.8	-49.5	172.8	-172.9	153.2	-118.7	0	0	112.1	R508 L648 E649 K654 R655 V656	R508-E652 IonicContact CZ-OE2 3.58Å; R508-E652 IonicContact NH2-OE1 3.13Å; R508-E652 PolarHBondContact NH2-OE1 2.91Å; R508-E652 IonicContact NH2-OE2 2.68Å; R508-E652 PolarHBondContact NH2-OE2 3.17Å; L648-E652 VanDerWaalsContact O-CB 3.31Å; L648-E652 WeakPolarHBondContact O-CB 3.48Å; L648-E652 PolarHBondContact O-N 2.98Å; E649-E652 PolarHBondContact O-N 2.89Å; E652-K654 VanDerWaalsContact C-N 3.27Å; E652-K654 PolarHBondContact O-N 3.37Å; E652-R655 CarbonylContact O-C 3.55Å; E652-R655 WeakPolarHBondContact O-CA 3.27Å; E652-R655 WeakPolarHBondContact O-CB 3.36Å; E652-R655 PolarHBondContact O-N 3.28Å; E652-V656 WeakPolarHBondContact O-CG2 3.39Å; E652-V656 PolarHBondContact O-N 2.94Å
653	R	71.9	Confident	68.5	Low	158 Å²	158	116.6 Å²	116.6	60%	0.596	56%	0.56	S	S	*	*	H	α-helix	trans	-55.9	-39.7	172.5	-70.7	173.2	-178.6	-146.4	5.7	111.8	E649 K657	E649-R653 WeakPolarHBondContact O-CB 3.41Å; E649-R653 VanDerWaalsContact O-CG 3.28Å; E649-R653 WeakPolarHBondContact O-CG 3.46Å; E649-R653 PolarHBondContact O-N 3.13Å; E649-R653 IonicContact OE1-CZ 3.35Å; E649-R653 IonicContact OE1-NE 3.77Å; E649-R653 PolarHBondContact OE1-NE 3.4Å; E649-R653 IonicContact OE1-NH2 2.68Å; E649-R653 PolarHBondContact OE1-NH2 2.88Å; R653-K657 VanDerWaalsContact O-CB 3.31Å; R653-K657 WeakPolarHBondContact O-CB 3.29Å; R653-K657 PolarHBondContact O-N 2.91Å
654	K	81.4	Confident	70.7	Confident	142 Å²	142	110.7 Å²	110.7	62%	0.617	55%	0.545	S	S	*	.	H	α-helix	trans	-67.4	-39.5	173.3	-74.8	172.2	-178	-179.6	0	113	N650 T651 E652 T658	N650-K654 WeakPolarHBondContact O-CB 3.33Å; N650-K654 VanDerWaalsContact O-CG 3.23Å; N650-K654 WeakPolarHBondContact O-CG 3.44Å; N650-K654 PolarHBondContact O-N 3.29Å; N650-K654 VanDerWaalsContact O-N 3.12Å; T651-K654 PolarHBondContact O-N 3.27Å; E652-K654 VanDerWaalsContact C-N 3.27Å; E652-K654 PolarHBondContact O-N 3.37Å; K654-T658 PolarHBondContact O-N 3.42Å; K654-T658 PolarHBondContact O-OG1 3.46Å
655	R	80.7	Confident	72.7	Confident	151 Å²	151	113.1 Å²	113.1	57%	0.57	55%	0.551	S	S	*	*	H	α-helix	trans	-66.6	-41.5	174.7	-75.2	163.2	174.2	170.1	-4	111.9	T651 E652 T658 R659	T651-R655 WeakPolarHBondContact O-CB 3.21Å; T651-R655 WeakPolarHBondContact O-CD 3.47Å; T651-R655 WeakPolarHBondContact O-CG 3.41Å; T651-R655 PolarHBondContact O-N 3.44Å; E652-R655 CarbonylContact O-C 3.55Å; E652-R655 WeakPolarHBondContact O-CA 3.27Å; E652-R655 WeakPolarHBondContact O-CB 3.36Å; E652-R655 PolarHBondContact O-N 3.28Å; R655-T658 WeakPolarHBondContact CA-OG1 3.38Å; R655-T658 PolarHBondContact O-N 3.48Å; R655-T658 PolarHBondContact O-OG1 3.09Å; R655-T658 VanDerWaalsContact O-OG1 3.12Å; R655-R659 VanDerWaalsContact O-CB 3.31Å; R655-R659 WeakPolarHBondContact O-CB 3.27Å; R655-R659 WeakPolarHBondContact O-CG 3.48Å; R655-R659 PolarHBondContact O-N 3.15Å
656	V	86.7	Confident	74.6	Confident	87 Å²	87	115.8 Å²	115.8	53%	0.527	55%	0.553	S	S	.	*	H	α-helix	trans	-64.2	-48.7	173.3	172.2	0	0	0	0	110.3	E652 T658 R659 L660	E652-V656 WeakPolarHBondContact O-CG2 3.39Å; E652-V656 PolarHBondContact O-N 2.94Å; V656-T658 VanDerWaalsContact C-N 3.31Å; V656-T658 PolarHBondContact O-N 3.36Å; V656-R659 PolarHBondContact O-N 2.8Å; V656-L660 VanDerWaalsContact O-CB 3.31Å; V656-L660 WeakPolarHBondContact O-CB 3.41Å; V656-L660 PolarHBondContact O-N 2.81Å
657	K	84.3	Confident	75.7	Confident	164 Å²	164	121 Å²	121	71%	0.713	56%	0.561	S	S	*	*	H	α-helix	trans	-59.3	-38.3	177.5	-173.1	170.3	-177.1	172.8	0	112.8	R653 K661	R653-K657 VanDerWaalsContact O-CB 3.31Å; R653-K657 WeakPolarHBondContact O-CB 3.29Å; R653-K657 PolarHBondContact O-N 2.91Å; K657-K661 VanDerWaalsContact O-CB 3.32Å; K657-K661 WeakPolarHBondContact O-CB 3.41Å; K657-K661 PolarHBondContact O-N 3.04Å
658	T	87.6	Confident	77	Confident	82 Å²	82	119.2 Å²	119.2	50%	0.503	56%	0.555	S	S	.	*	H	α-helix	trans	-77.4	-35.9	176.6	46.1	0	0	0	0	113.4	K654 R655 V656 K662	K654-T658 PolarHBondContact O-N 3.42Å; K654-T658 PolarHBondContact O-OG1 3.46Å; R655-T658 WeakPolarHBondContact CA-OG1 3.38Å; R655-T658 PolarHBondContact O-N 3.48Å; R655-T658 PolarHBondContact O-OG1 3.09Å; R655-T658 VanDerWaalsContact O-OG1 3.12Å; V656-T658 VanDerWaalsContact C-N 3.31Å; V656-T658 PolarHBondContact O-N 3.36Å; T658-K662 WeakPolarHBondContact O-CB 3.43Å; T658-K662 WeakPolarHBondContact O-CG 3.39Å; T658-K662 PolarHBondContact O-N 3.04Å
659	R	84.5	Confident	78.2	Confident	146 Å²	146	119.7 Å²	119.7	55%	0.551	56%	0.562	S	S	*	*	H	α-helix	trans	-63.2	-45.6	170.1	-78.2	-180	173.9	178.8	-1.2	111.1	R621 R655 V656 K662 L663	R621-R659 PolarHBondContact O-NH2 2.81Å; R621-R659 VanDerWaalsContact O-NH2 3.08Å; R655-R659 VanDerWaalsContact O-CB 3.31Å; R655-R659 WeakPolarHBondContact O-CB 3.27Å; R655-R659 WeakPolarHBondContact O-CG 3.48Å; R655-R659 PolarHBondContact O-N 3.15Å; V656-R659 PolarHBondContact O-N 2.8Å; R659-K662 PolarHBondContact O-N 3.32Å; R659-L663 WeakPolarHBondContact O-CB 3.17Å; R659-L663 PolarHBondContact O-N 3.47Å
660	L	81.1	Confident	79	Confident	94 Å²	94	119.7 Å²	119.7	49%	0.492	57%	0.565	S	S	.	*	H	α-helix	trans	-65.7	-43.5	177.5	-172.4	65.9	0	0	0	112	V656 K662 L663 I664	V656-L660 VanDerWaalsContact O-CB 3.31Å; V656-L660 WeakPolarHBondContact O-CB 3.41Å; V656-L660 PolarHBondContact O-N 2.81Å; L660-K662 VanDerWaalsContact C-N 3.31Å; L660-K662 PolarHBondContact O-N 2.96Å; L660-L663 PolarHBondContact O-N 2.89Å; L660-L663 VanDerWaalsContact O-N 3.14Å; L660-I664 HydrophobicContact CD1-CD1 4.36Å; L660-I664 HydrophobicContact CG-CD1 3.98Å; L660-I664 WeakPolarHBondContact O-CG1 3.45Å; L660-I664 PolarHBondContact O-N 3.41Å
661	K	85.7	Confident	79.5	Confident	144 Å²	144	121.4 Å²	121.4	63%	0.626	57%	0.57	S	S	*	*	H	α-helix	trans	-59.9	-40.4	173.2	-173.8	172.8	-178.4	177.5	0	111.7	K657 L665	K657-K661 VanDerWaalsContact O-CB 3.32Å; K657-K661 WeakPolarHBondContact O-CB 3.41Å; K657-K661 PolarHBondContact O-N 3.04Å; K661-L665 HydrophobicContact CG-CD1 3.95Å; K661-L665 WeakPolarHBondContact O-CB 3.4Å; K661-L665 WeakPolarHBondContact O-CD1 3.44Å; K661-L665 VanDerWaalsContact O-CG 3.23Å; K661-L665 WeakPolarHBondContact O-CG 3.45Å; K661-L665 PolarHBondContact O-N 3.39Å; K661-L665 VanDerWaalsContact O-N 3.1Å
662	K	89.8	Confident	79.6	Confident	153 Å²	153	119.8 Å²	119.8	67%	0.665	56%	0.562	S	S	*	*	H	α-helix	trans	-67.9	-35.9	173.8	-76.3	-177.9	177.1	-174.4	0	112.8	T658 R659 L660 K666	T658-K662 WeakPolarHBondContact O-CB 3.43Å; T658-K662 WeakPolarHBondContact O-CG 3.39Å; T658-K662 PolarHBondContact O-N 3.04Å; R659-K662 PolarHBondContact O-N 3.32Å; L660-K662 VanDerWaalsContact C-N 3.31Å; L660-K662 PolarHBondContact O-N 2.96Å; K662-K666 VanDerWaalsContact O-CB 3.31Å; K662-K666 WeakPolarHBondContact O-CB 3.26Å; K662-K666 PolarHBondContact O-N 2.84Å
663	L	85.4	Confident	79.6	Confident	109 Å²	109	117.4 Å²	117.4	57%	0.571	55%	0.552	S	S	*	*	H	α-helix	trans	-67.9	-45.7	177.3	-173.7	154	0	0	0	111.2	R659 L660 K666 R667	R659-L663 WeakPolarHBondContact O-CB 3.17Å; R659-L663 PolarHBondContact O-N 3.47Å; L660-L663 PolarHBondContact O-N 2.89Å; L660-L663 VanDerWaalsContact O-N 3.14Å; L663-K666 CarbonylContact O-C 3.58Å; L663-K666 PolarHBondContact O-N 3.08Å; L663-R667 WeakPolarHBondContact O-CA 3.11Å; L663-R667 WeakPolarHBondContact O-CB 3.42Å; L663-R667 PolarHBondContact O-N 3.29Å
664	I	86.4	Confident	79.2	Confident	113 Å²	113	113.8 Å²	113.8	58%	0.579	54%	0.542	S	S	*	.	H	α-helix	trans	-62.1	-46.4	176.3	-66.5	166.3	0	0	0	110.4	L660 K666 R667	L660-I664 HydrophobicContact CD1-CD1 4.36Å; L660-I664 HydrophobicContact CG-CD1 3.98Å; L660-I664 WeakPolarHBondContact O-CG1 3.45Å; L660-I664 PolarHBondContact O-N 3.41Å; I664-K666 PolarHBondContact O-N 3.13Å; I664-R667 PolarHBondContact O-N 3.21Å
665	L	84.6	Confident	78.3	Confident	132 Å²	132	113 Å²	113	69%	0.691	54%	0.54	S	S	*	.	H	α-helix	trans	-70.1	-13	178.1	-70	171.7	0	0	0	114.7	K661	K661-L665 HydrophobicContact CG-CD1 3.95Å; K661-L665 WeakPolarHBondContact O-CB 3.4Å; K661-L665 WeakPolarHBondContact O-CD1 3.44Å; K661-L665 VanDerWaalsContact O-CG 3.23Å; K661-L665 WeakPolarHBondContact O-CG 3.45Å; K661-L665 PolarHBondContact O-N 3.39Å; K661-L665 VanDerWaalsContact O-N 3.1Å
666	K	86.3	Confident	77.4	Confident	179 Å²	179	113.1 Å²	113.1	78%	0.778	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	-121.4	16.6	176.2	-66.9	-162.1	169	-155	0	112.8	K662 L663 I664 P668	K662-K666 VanDerWaalsContact O-CB 3.31Å; K662-K666 WeakPolarHBondContact O-CB 3.26Å; K662-K666 PolarHBondContact O-N 2.84Å; L663-K666 CarbonylContact O-C 3.58Å; L663-K666 PolarHBondContact O-N 3.08Å; I664-K666 PolarHBondContact O-N 3.13Å; K666-P668 WeakPolarHBondContact O-CD 3.36Å
667	R	74	Confident	75.9	Confident	183 Å²	183	110 Å²	110	69%	0.691	53%	0.53	S	S	*	.	P	Polyproline II helix	trans	-67.1	124.4	178.6	-172.5	-177.3	175.7	177.3	-0	107.7	L663 I664	L663-R667 WeakPolarHBondContact O-CA 3.11Å; L663-R667 WeakPolarHBondContact O-CB 3.42Å; L663-R667 PolarHBondContact O-N 3.29Å; I664-R667 PolarHBondContact O-N 3.21Å
668	P	76.1	Confident	74.7	Confident	61 Å²	61	107.8 Å²	107.8	40%	0.396	53%	0.526	S	S	.	.	P	Polyproline II helix	trans	-58.9	143.5	170.7	-21	33.1	0	0	0	109.8	K666 A672 L673	K666-P668 WeakPolarHBondContact O-CD 3.36Å; P668-A672 HydrophobicContact CB-CB 4.37Å; P668-L673 HydrophobicContact CB-CD2 3.93Å; P668-L673 HydrophobicContact CB-CG 4.12Å; P668-L673 HydrophobicContact CG-CD2 4.05Å
669	P	74.3	Confident	73.3	Confident	88 Å²	88	106.6 Å²	106.6	57%	0.571	52%	0.516	S	S	*	.	P	Polyproline II helix	trans	-60.4	155.9	170.8	27.7	-34.2	0	0	0	110	Q671 A672 L673	P669-Q671 PolarHBondContact O-N 3.21Å; P669-A672 HydrophobicContact CG-CB 3.73Å; P669-A672 PolarHBondContact O-N 3.34Å; P669-L673 PolarHBondContact O-N 2.66Å
670	L	66.4	Low	72	Confident	103 Å²	103	104.3 Å²	104.3	54%	0.539	51%	0.51	S	S	.	.	H	α-helix	trans	-52	-45.3	-179.3	-179.5	60.7	0	0	0	111.4	A672 L673 Q674 I679	L670-A672 PolarHBondContact O-N 3.45Å; L670-L673 WeakPolarHBondContact O-CA 3.15Å; L670-L673 WeakPolarHBondContact O-CB 3.43Å; L670-L673 PolarHBondContact O-N 3.26Å; L670-Q674 HydrophobicContact CG-CG 4.46Å; L670-Q674 WeakPolarHBondContact O-CG 3.27Å; L670-Q674 PolarHBondContact O-N 2.73Å; L670-I679 HydrophobicContact CD1-CD1 3.74Å
671	Q	67.3	Low	71.1	Confident	126 Å²	126	101.5 Å²	101.5	59%	0.589	50%	0.495	S	S	*	.	H	α-helix	trans	-53	-46	175.5	-167.6	-179.6	-13.4	0	0	113.1	P669 L673 Q674 E675	P669-Q671 PolarHBondContact O-N 3.21Å; Q671-L673 PolarHBondContact O-N 3.43Å; Q671-Q674 WeakPolarHBondContact O-CB 3.49Å; Q671-Q674 PolarHBondContact O-N 3.47Å; Q671-Q674 VanDerWaalsContact O-N 3.08Å; Q671-E675 WeakPolarHBondContact CG-OE1 3.47Å; Q671-E675 PolarHBondContact NE2-OE1 3.04Å; Q671-E675 WeakPolarHBondContact O-CB 3.46Å; Q671-E675 VanDerWaalsContact O-CG 3.28Å; Q671-E675 WeakPolarHBondContact O-CG 3.34Å; Q671-E675 PolarHBondContact O-N 3.17Å
672	A	70.8	Confident	70.6	Confident	20 Å²	20	99 Å²	99	17%	0.165	49%	0.485	C	S	.	.	H	α-helix	trans	-74.6	-5.4	178.5	0	0	0	0	0	114.4	P668 P669 L670 E675 K676	P668-A672 HydrophobicContact CB-CB 4.37Å; P669-A672 HydrophobicContact CG-CB 3.73Å; P669-A672 PolarHBondContact O-N 3.34Å; L670-A672 PolarHBondContact O-N 3.45Å; A672-E675 WeakPolarHBondContact CA-OE2 3.5Å; A672-K676 VanDerWaalsContact O-CD 3.3Å; A672-K676 WeakPolarHBondContact O-CD 3.35Å; A672-K676 VanDerWaalsContact O-CG 3.25Å; A672-K676 WeakPolarHBondContact O-CG 3.44Å
673	L	67	Low	70.5	Confident	31 Å²	31	92.4 Å²	92.4	16%	0.162	46%	0.458	C	S	.	.	H	α-helix	trans	-93.5	-33.9	166.4	-60.6	173.2	0	0	0	110.8	P668 P669 L670 Q671 G677 L678 I679	P668-L673 HydrophobicContact CB-CD2 3.93Å; P668-L673 HydrophobicContact CB-CG 4.12Å; P668-L673 HydrophobicContact CG-CD2 4.05Å; P669-L673 PolarHBondContact O-N 2.66Å; L670-L673 WeakPolarHBondContact O-CA 3.15Å; L670-L673 WeakPolarHBondContact O-CB 3.43Å; L670-L673 PolarHBondContact O-N 3.26Å; Q671-L673 PolarHBondContact O-N 3.43Å; L673-G677 PolarHBondContact O-N 3.46Å; L673-L678 HydrophobicContact CD2-CD1 4.05Å; L673-L678 PolarHBondContact O-N 3.24Å; L673-I679 HydrophobicContact CB-CB 4.45Å; L673-I679 HydrophobicContact CB-CD1 3.77Å; L673-I679 HydrophobicContact CB-CG1 3.99Å; L673-I679 HydrophobicContact CD1-CD1 3.77Å; L673-I679 HydrophobicContact CG-CD1 4.42Å; L673-I679 PolarHBondContact O-N 3.23Å
674	Q	62.1	Low	70.7	Confident	82 Å²	82	87.2 Å²	87.2	38%	0.383	43%	0.431	S	S	.	.	H	α-helix	trans	-68.2	-50.2	174.5	-65.9	168	-61.8	0	0	111.8	L670 Q671 K676 G677 I679 K680	L670-Q674 HydrophobicContact CG-CG 4.46Å; L670-Q674 WeakPolarHBondContact O-CG 3.27Å; L670-Q674 PolarHBondContact O-N 2.73Å; Q671-Q674 WeakPolarHBondContact O-CB 3.49Å; Q671-Q674 PolarHBondContact O-N 3.47Å; Q671-Q674 VanDerWaalsContact O-N 3.08Å; Q674-K676 VanDerWaalsContact C-N 3.25Å; Q674-K676 PolarHBondContact O-N 3Å; Q674-G677 PolarHBondContact O-N 2.95Å; Q674-I679 VanDerWaalsContact CA-O 3.29Å; Q674-I679 WeakPolarHBondContact CA-O 3.33Å; Q674-I679 HydrophobicContact CG-CB 4.2Å; Q674-I679 HydrophobicContact CG-CG2 4.25Å; Q674-I679 WeakPolarHBondContact CG-O 3.15Å; Q674-K680 WeakPolarHBondContact O-CE 3.34Å
675	E	62.7	Low	70.9	Confident	124 Å²	124	83.5 Å²	83.5	58%	0.579	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.8	-46.8	173.4	-72.8	163.2	-178.8	0	0	111.4	Q671 A672 G677	Q671-E675 WeakPolarHBondContact CG-OE1 3.47Å; Q671-E675 PolarHBondContact NE2-OE1 3.04Å; Q671-E675 WeakPolarHBondContact O-CB 3.46Å; Q671-E675 VanDerWaalsContact O-CG 3.28Å; Q671-E675 WeakPolarHBondContact O-CG 3.34Å; Q671-E675 PolarHBondContact O-N 3.17Å; A672-E675 WeakPolarHBondContact CA-OE2 3.5Å; E675-G677 PolarHBondContact O-N 2.99Å
676	K	61.9	Low	71	Confident	154 Å²	154	78.2 Å²	78.2	67%	0.67	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.2	0.4	-178.5	-68.2	-173.6	-176.5	-167.6	0	115.2	A672 Q674 L678	A672-K676 VanDerWaalsContact O-CD 3.3Å; A672-K676 WeakPolarHBondContact O-CD 3.35Å; A672-K676 VanDerWaalsContact O-CG 3.25Å; A672-K676 WeakPolarHBondContact O-CG 3.44Å; Q674-K676 VanDerWaalsContact C-N 3.25Å; Q674-K676 PolarHBondContact O-N 3Å; K676-L678 HydrophobicContact CB-CD1 4.27Å; K676-L678 HydrophobicContact CB-CG 4.13Å; K676-L678 PolarHBondContact O-N 2.87Å
677	G	56.8	Low	71.2	Confident	21 Å²	21	74.5 Å²	74.5	22%	0.216	38%	0.376	C	S	.	.	T	Hydrogen-bonded Turn	trans	72.6	7	-177.7	0	0	0	0	0	115.2	L673 Q674 E675 I679	L673-G677 PolarHBondContact O-N 3.46Å; Q674-G677 PolarHBondContact O-N 2.95Å; E675-G677 PolarHBondContact O-N 2.99Å; G677-I679 VanDerWaalsContact C-N 3.34Å
678	L	57.5	Low	72.1	Confident	118 Å²	118	66.4 Å²	66.4	62%	0.618	35%	0.346	S	S	*	.	S	Bend	trans	-80.9	-18.3	179.1	-59.4	176.2	0	0	0	112.5	L673 K676	L673-L678 HydrophobicContact CD2-CD1 4.05Å; L673-L678 PolarHBondContact O-N 3.24Å; K676-L678 HydrophobicContact CB-CD1 4.27Å; K676-L678 HydrophobicContact CB-CG 4.13Å; K676-L678 PolarHBondContact O-N 2.87Å
679	I	58.9	Low	72.8	Confident	57 Å²	57	66.8 Å²	66.8	29%	0.292	34%	0.343	S	S	.	.	S	Bend	trans	-138.4	86.2	170.7	-58.9	177.8	0	0	0	106.7	L670 L673 Q674 G677	L670-I679 HydrophobicContact CD1-CD1 3.74Å; L673-I679 HydrophobicContact CB-CB 4.45Å; L673-I679 HydrophobicContact CB-CD1 3.77Å; L673-I679 HydrophobicContact CB-CG1 3.99Å; L673-I679 HydrophobicContact CD1-CD1 3.77Å; L673-I679 HydrophobicContact CG-CD1 4.42Å; L673-I679 PolarHBondContact O-N 3.23Å; Q674-I679 VanDerWaalsContact CA-O 3.29Å; Q674-I679 WeakPolarHBondContact CA-O 3.33Å; Q674-I679 HydrophobicContact CG-CB 4.2Å; Q674-I679 HydrophobicContact CG-CG2 4.25Å; Q674-I679 WeakPolarHBondContact CG-O 3.15Å; G677-I679 VanDerWaalsContact C-N 3.34Å
680	K	57.9	Low	73.5	Confident	99 Å²	99	67 Å²	67	43%	0.43	34%	0.337	S	S	.	.			trans	-118.5	150.1	171.5	-82.6	-177	-176.3	177.3	0	110.8	Q674	Q674-K680 WeakPolarHBondContact O-CE 3.34Å
681	D	60.7	Low	74.5	Confident	34 Å²	34	62.1 Å²	62.1	18%	0.182	31%	0.311	C	S	.	.			trans	65.3	44.2	158.2	-48.9	-17.5	0	0	0	118.3	R694 F751	D681-R694 IonicContact OD1-CZ 2.88Å; D681-R694 IonicContact OD1-NE 3.85Å; D681-R694 PolarHBondContact OD1-NE 3.16Å; D681-R694 IonicContact OD1-NH1 2.67Å; D681-R694 IonicContact OD1-NH2 3.8Å; D681-R694 PolarHBondContact OD1-NH2 2.68Å; D681-F751 WeakPolarHBondContact OD2-CE1 3.49Å
682	Q	75.3	Confident	75.6	Confident	91 Å²	91	56.3 Å²	56.3	43%	0.425	29%	0.285	S	S	.	.			trans	-70.4	154.8	149.6	-64.1	168.5	124.9	0	0	110.4	R694 D738	Q682-R694 PolarHBondContact O-NH1 2.81Å; Q682-D738 HydrophobicContact CG-CB 4.5Å
683	V	87.8	Confident	76.4	Confident	16 Å²	16	61.9 Å²	61.9	10%	0.097	31%	0.307	C	S	.	.	S	Bend	trans	-99	-48	171.9	174.4	0	0	0	0	109.4	C686 L691 F702 V737 D738 F781	V683-C686 WeakPolarHBondContact O-CB 3.33Å; V683-C686 PolarHBondContact O-N 3.2Å; V683-L691 HydrophobicContact CG1-CD1 4.26Å; V683-L691 HydrophobicContact CG1-CD2 3.96Å; V683-L691 HydrophobicContact CG2-CD1 4.39Å; V683-F702 HydrophobicContact CG1-CB 4.44Å; V683-V737 HydrophobicContact CB-CG1 3.92Å; V683-V737 HydrophobicContact CG1-CG1 3.86Å; V683-V737 HydrophobicContact CG2-CG1 4.11Å; V683-V737 WeakPolarHBondContact CG2-O 3.42Å; V683-D738 PolarHBondContact N-OD1 2.75Å; V683-F781 HydrophobicContact CG1-CD2 4.42Å; V683-F781 HydrophobicContact CG1-CE2 4.02Å
684	F	91.1	Very high	77.2	Confident	0 Å²	0	64.5 Å²	64.5	0%	0	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.6	140	172	-73.9	-106.7	0	0	0	110.3	C686 F702 R734 V737 D738 L780 F781	F684-C686 PolarHBondContact O-N 3.29Å; F684-F702 HydrophobicContact CE1-CE1 4.42Å; F684-F702 HydrophobicContact CE2-CD1 4.29Å; F684-F702 AromaticContact CE2-CE1 3.97Å; F684-F702 HydrophobicContact CE2-CE1 3.97Å; F684-F702 HydrophobicContact CE2-CZ 4.17Å; F684-F702 HydrophobicContact CZ-CD1 4.21Å; F684-F702 AromaticContact CZ-CE1 3.5Å; F684-F702 HydrophobicContact CZ-CE1 3.5Å; F684-F702 AromaticContact CZ-CZ 3.77Å; F684-F702 HydrophobicContact CZ-CZ 3.77Å; F684-R734 HydrophobicContact CB-CG 4.23Å; F684-R734 HydrophobicContact CD1-CG 3.77Å; F684-R734 HydrophobicContact CD2-CB 4.49Å; F684-R734 HydrophobicContact CD2-CG 3.74Å; F684-R734 HydrophobicContact CE1-CB 4.46Å; F684-R734 HydrophobicContact CE1-CG 3.97Å; F684-R734 HydrophobicContact CE2-CB 4.25Å; F684-R734 HydrophobicContact CE2-CG 3.96Å; F684-R734 HydrophobicContact CG-CG 3.65Å; F684-R734 HydrophobicContact CZ-CB 4.23Å; F684-R734 HydrophobicContact CZ-CG 4.07Å; F684-V737 HydrophobicContact CD2-CG1 4.33Å; F684-V737 HydrophobicContact CE2-CB 4Å; F684-V737 HydrophobicContact CE2-CG1 3.92Å; F684-D738 PolarHBondContact N-OD1 2.73Å; F684-L780 HydrophobicContact CD1-CG 4.35Å; F684-L780 HydrophobicContact CE1-CB 4.14Å; F684-L780 HydrophobicContact CE1-CD2 4.17Å; F684-L780 HydrophobicContact CE1-CG 4.05Å; F684-F781 HydrophobicContact CD1-CB 4.2Å; F684-F781 HydrophobicContact CE1-CB 3.75Å; F684-F781 HydrophobicContact CZ-CB 4.14Å
685	G	88.8	Confident	78.4	Confident	35 Å²	35	62.2 Å²	62.2	36%	0.361	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.3	5.9	-175.6	0	0	0	0	0	115.3	E784 P786	G685-E784 WeakPolarHBondContact CA-O 3.18Å; G685-P786 WeakPolarHBondContact O-CG 3.36Å
686	C	87.3	Confident	79.7	Confident	21 Å²	21	67.8 Å²	67.8	14%	0.142	32%	0.32	C	S	.	.	S	Bend	trans	-77.7	151.5	170.1	-154.9	0	0	0	0	110.8	V683 F684 L691 L785 P786	V683-C686 WeakPolarHBondContact O-CB 3.33Å; V683-C686 PolarHBondContact O-N 3.2Å; F684-C686 PolarHBondContact O-N 3.29Å; C686-L691 HydrophobicContact CB-CB 4.33Å; C686-L785 WeakPolarHBondContact O-CD2 3.11Å; C686-P786 WeakPolarHBondContact O-CD 3.38Å
687	R	89.9	Confident	81.1	Confident	101 Å²	101	62.2 Å²	62.2	38%	0.381	30%	0.301	S	S	.	.			trans	-70.6	134.1	168	-69.5	-171.4	74.4	-114.1	-8	108.2	E689 M690 L691 P786 E787	R687-E689 VanDerWaalsContact C-N 3.3Å; R687-E689 IonicContact CZ-OE2 3.04Å; R687-E689 IonicContact NH1-OE2 2.73Å; R687-E689 PolarHBondContact NH1-OE2 3.17Å; R687-E689 IonicContact NH2-OE2 3.22Å; R687-E689 PolarHBondContact NH2-OE2 3.11Å; R687-E689 PolarHBondContact O-N 3Å; R687-M690 HydrophobicContact CB-CG 4.12Å; R687-M690 PolarHBondContact O-N 3.15Å; R687-L691 PolarHBondContact O-N 3.01Å; R687-L691 VanDerWaalsContact O-N 3.11Å; R687-P786 HydrophobicContact CG-CB 4.33Å; R687-P786 HydrophobicContact CG-CG 4.04Å; R687-E787 IonicContact NH2-OE2 3.98Å
688	L	93.5	Very high	82.9	Confident	12 Å²	12	63.9 Å²	63.9	6%	0.063	31%	0.306	C	S	.	.	H	α-helix	trans	-53.7	-46.8	-173.5	-175.7	61.9	0	0	0	112	M690 L691 C692 P700 L789 P824 N825	L688-M690 PolarHBondContact O-N 3.08Å; L688-L691 PolarHBondContact O-N 3.12Å; L688-C692 WeakPolarHBondContact O-CB 3.31Å; L688-C692 PolarHBondContact O-N 3.18Å; L688-C692 PolarHBondContact O-SG 2.97Å; L688-P700 HydrophobicContact CD1-CG 3.55Å; L688-L789 HydrophobicContact CD2-CD1 3.61Å; L688-P824 HydrophobicContact CD2-CB 4.39Å; L688-P824 HydrophobicContact CG-CB 4.14Å; L688-N825 HydrophobicContact CD2-CB 4.48Å
689	E	91.1	Very high	84.8	Confident	70 Å²	70	58.9 Å²	58.9	33%	0.327	28%	0.281	S	S	.	.	H	α-helix	trans	-50.3	-51.9	174.9	-59.6	171	148.7	0	0	112.6	R687 L691 C692 E693	R687-E689 VanDerWaalsContact C-N 3.3Å; R687-E689 IonicContact CZ-OE2 3.04Å; R687-E689 IonicContact NH1-OE2 2.73Å; R687-E689 PolarHBondContact NH1-OE2 3.17Å; R687-E689 IonicContact NH2-OE2 3.22Å; R687-E689 PolarHBondContact NH2-OE2 3.11Å; R687-E689 PolarHBondContact O-N 3Å; E689-L691 VanDerWaalsContact C-N 3.34Å; E689-L691 PolarHBondContact O-N 3.07Å; E689-C692 PolarHBondContact O-N 3.27Å; E689-E693 WeakPolarHBondContact O-CB 3.32Å; E689-E693 PolarHBondContact O-N 2.98Å
690	M	88.1	Confident	86.6	Confident	91 Å²	91	56.1 Å²	56.1	45%	0.448	27%	0.267	S	S	.	.	H	α-helix	trans	-68.1	-32.5	-177.3	-58.4	-58.1	-40	0	0	112.8	R687 L688 E693 R694	R687-M690 HydrophobicContact CB-CG 4.12Å; R687-M690 PolarHBondContact O-N 3.15Å; L688-M690 PolarHBondContact O-N 3.08Å; M690-E693 VanDerWaalsContact CE-OE2 3.29Å; M690-E693 WeakPolarHBondContact CE-OE2 3.33Å; M690-R694 VanDerWaalsContact O-CB 3.27Å; M690-R694 WeakPolarHBondContact O-CB 3.29Å; M690-R694 PolarHBondContact O-N 3.38Å; M690-R694 VanDerWaalsContact O-N 3.16Å
691	L	88.4	Confident	88.2	Confident	1 Å²	1	53.3 Å²	53.3	1%	0.005	25%	0.254	C	S	.	.	H	α-helix	trans	-71.6	-45.7	176.1	179.9	62.4	0	0	0	110.5	V683 C686 R687 L688 E689 R694 E695 P700 F781	V683-L691 HydrophobicContact CG1-CD1 4.26Å; V683-L691 HydrophobicContact CG1-CD2 3.96Å; V683-L691 HydrophobicContact CG2-CD1 4.39Å; C686-L691 HydrophobicContact CB-CB 4.33Å; R687-L691 PolarHBondContact O-N 3.01Å; R687-L691 VanDerWaalsContact O-N 3.11Å; L688-L691 PolarHBondContact O-N 3.12Å; E689-L691 VanDerWaalsContact C-N 3.34Å; E689-L691 PolarHBondContact O-N 3.07Å; L691-R694 PolarHBondContact O-N 3.33Å; L691-E695 HydrophobicContact CD1-CG 4.33Å; L691-E695 WeakPolarHBondContact O-CB 3.42Å; L691-E695 WeakPolarHBondContact O-CG 3.39Å; L691-E695 PolarHBondContact O-N 3.35Å; L691-P700 HydrophobicContact CD2-CB 3.98Å; L691-P700 HydrophobicContact CD2-CG 4.02Å; L691-F781 HydrophobicContact CD2-CE2 3.74Å; L691-F781 HydrophobicContact CD2-CZ 3.73Å
692	C	90.9	Very high	89.8	Confident	5 Å²	5	52 Å²	52	3%	0.034	25%	0.246	C	C	.	.	H	α-helix	trans	-63.7	-42.4	177.9	-71.8	0	0	0	0	112.3	L688 E689 E695 R696 S697 T698 P824	L688-C692 WeakPolarHBondContact O-CB 3.31Å; L688-C692 PolarHBondContact O-N 3.18Å; L688-C692 PolarHBondContact O-SG 2.97Å; E689-C692 PolarHBondContact O-N 3.27Å; C692-E695 CarbonylContact O-C 3.58Å; C692-E695 PolarHBondContact O-N 2.96Å; C692-R696 PolarHBondContact O-N 3.01Å; C692-S697 CarbonylContact C-O 3.57Å; C692-S697 WeakPolarHBondContact CA-O 3.48Å; C692-S697 WeakPolarHBondContact CB-O 3.28Å; C692-S697 PolarHBondContact O-N 3.26Å; C692-T698 PolarHBondContact SG-O 3.08Å; C692-P824 HydrophobicContact CB-CB 4.05Å; C692-P824 HydrophobicContact CB-CG 4.26Å
693	E	87.6	Confident	90.9	Very high	136 Å²	136	47.6 Å²	47.6	64%	0.636	23%	0.226	S	C	*	.	H	α-helix	trans	-58.7	-49.7	171.8	-177.2	-176.9	-149.5	0	0	111.5	E689 M690 E695 R696	E689-E693 WeakPolarHBondContact O-CB 3.32Å; E689-E693 PolarHBondContact O-N 2.98Å; M690-E693 VanDerWaalsContact CE-OE2 3.29Å; M690-E693 WeakPolarHBondContact CE-OE2 3.33Å; E693-E695 VanDerWaalsContact C-N 3.32Å; E693-E695 PolarHBondContact O-N 3.22Å; E693-R696 PolarHBondContact O-N 3.44Å; E693-R696 VanDerWaalsContact O-N 3.11Å
694	R	84.1	Confident	91.4	Very high	86 Å²	86	51.1 Å²	51.1	33%	0.325	24%	0.237	S	C	.	.	H	α-helix	trans	-60.9	-37.6	177.9	-176.8	-164	-69.7	153	-5.3	112.7	D681 Q682 M690 L691 R696	D681-R694 IonicContact OD1-CZ 2.88Å; D681-R694 IonicContact OD1-NE 3.85Å; D681-R694 PolarHBondContact OD1-NE 3.16Å; D681-R694 IonicContact OD1-NH1 2.67Å; D681-R694 IonicContact OD1-NH2 3.8Å; D681-R694 PolarHBondContact OD1-NH2 2.68Å; Q682-R694 PolarHBondContact O-NH1 2.81Å; M690-R694 VanDerWaalsContact O-CB 3.27Å; M690-R694 WeakPolarHBondContact O-CB 3.29Å; M690-R694 PolarHBondContact O-N 3.38Å; M690-R694 VanDerWaalsContact O-N 3.16Å; L691-R694 PolarHBondContact O-N 3.33Å; R694-R696 VanDerWaalsContact C-N 3.33Å
695	E	87.2	Confident	91.5	Very high	35 Å²	35	52.1 Å²	52.1	16%	0.164	24%	0.242	C	C	.	.	H	α-helix	trans	-85.9	-3	178.3	-69.2	-173.8	176.4	0	0	113.7	L691 C692 E693 S697 P700 R701	L691-E695 HydrophobicContact CD1-CG 4.33Å; L691-E695 WeakPolarHBondContact O-CB 3.42Å; L691-E695 WeakPolarHBondContact O-CG 3.39Å; L691-E695 PolarHBondContact O-N 3.35Å; C692-E695 CarbonylContact O-C 3.58Å; C692-E695 PolarHBondContact O-N 2.96Å; E693-E695 VanDerWaalsContact C-N 3.32Å; E693-E695 PolarHBondContact O-N 3.22Å; E695-S697 PolarHBondContact O-N 2.83Å; E695-P700 WeakPolarHBondContact OE2-CA 3.47Å; E695-R701 WeakPolarHBondContact OE2-CB 3.47Å; E695-R701 PolarHBondContact OE2-N 3.12Å
696	R	88.9	Confident	92	Very high	241 Å²	241	50.5 Å²	50.5	91%	0.909	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.9	41	-175.5	-57.4	-179.4	179.8	171.1	0.3	112.5	C692 E693 R694	C692-R696 PolarHBondContact O-N 3.01Å; E693-R696 PolarHBondContact O-N 3.44Å; E693-R696 VanDerWaalsContact O-N 3.11Å; R694-R696 VanDerWaalsContact C-N 3.33Å
697	S	92.3	Very high	92.5	Very high	37 Å²	37	49.6 Å²	49.6	26%	0.259	22%	0.219	S	C	.	.	S	Bend	trans	-151.7	141.4	-175.7	-172.8	0	0	0	0	110.2	C692 E695 V699 R704	C692-S697 CarbonylContact C-O 3.57Å; C692-S697 WeakPolarHBondContact CA-O 3.48Å; C692-S697 WeakPolarHBondContact CB-O 3.28Å; C692-S697 PolarHBondContact O-N 3.26Å; E695-S697 PolarHBondContact O-N 2.83Å; S697-V699 VanDerWaalsContact C-N 3.29Å; S697-V699 PolarHBondContact O-N 3.24Å; S697-V699 PolarHBondContact OG-O 3.35Å; S697-R704 PolarHBondContact OG-NH2 3.02Å; S697-R704 VanDerWaalsContact OG-NH2 3.15Å
698	T	94.3	Very high	92.8	Very high	55 Å²	55	50.5 Å²	50.5	34%	0.337	23%	0.228	S	C	.	.	S	Bend	trans	-74.9	-16.7	177.9	50.3	0	0	0	0	113.8	C692 P824 D827 T828	C692-T698 PolarHBondContact SG-O 3.08Å; T698-P824 WeakPolarHBondContact O-CA 3.42Å; T698-D827 WeakPolarHBondContact CB-OD2 3.47Å; T698-D827 WeakPolarHBondContact CG2-OD2 3.38Å; T698-D827 PolarHBondContact OG1-OD2 3.22Å; T698-T828 PolarHBondContact O-OG1 2.91Å
699	V	97.4	Very high	93	Very high	13 Å²	13	50.2 Å²	50.2	8%	0.079	23%	0.227	C	C	.	.	S	Bend	trans	-120.2	123	177.4	-173.4	0	0	0	0	110.6	S697 V703 R704 D827 F831	S697-V699 VanDerWaalsContact C-N 3.29Å; S697-V699 PolarHBondContact O-N 3.24Å; S697-V699 PolarHBondContact OG-O 3.35Å; V699-V703 HydrophobicContact CG1-CB 4.44Å; V699-V703 HydrophobicContact CG1-CG1 4.18Å; V699-R704 HydrophobicContact CG1-CG 4Å; V699-R704 VanDerWaalsContact O-CZ 3.32Å; V699-R704 PolarHBondContact O-NE 2.98Å; V699-R704 PolarHBondContact O-NH2 2.74Å; V699-D827 HydrophobicContact CG2-CB 3.9Å; V699-F831 HydrophobicContact CG1-CB 4.18Å; V699-F831 HydrophobicContact CG1-CD1 3.79Å; V699-F831 HydrophobicContact CG1-CD2 4.48Å; V699-F831 HydrophobicContact CG1-CE1 4.32Å; V699-F831 HydrophobicContact CG1-CG 3.89Å; V699-F831 HydrophobicContact CG2-CB 4.15Å; V699-F831 HydrophobicContact CG2-CG 4.47Å
700	P	95.3	Very high	93.4	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	21%	0.212	C	C	.	.			trans	-56.6	140.7	-177.2	-27.3	34.7	0	0	0	114.6	L688 L691 E695 F702 V703 R704 F781 T828	L688-P700 HydrophobicContact CD1-CG 3.55Å; L691-P700 HydrophobicContact CD2-CB 3.98Å; L691-P700 HydrophobicContact CD2-CG 4.02Å; E695-P700 WeakPolarHBondContact OE2-CA 3.47Å; P700-F702 VanDerWaalsContact C-N 3.28Å; P700-F702 PolarHBondContact O-N 2.95Å; P700-V703 HydrophobicContact CB-CB 4.34Å; P700-V703 HydrophobicContact CB-CG2 4.03Å; P700-V703 HydrophobicContact CG-CG2 4.23Å; P700-V703 WeakPolarHBondContact O-CB 3.47Å; P700-V703 PolarHBondContact O-N 3.02Å; P700-V703 VanDerWaalsContact O-N 3.09Å; P700-R704 PolarHBondContact O-N 3.21Å; P700-R704 VanDerWaalsContact O-N 3.09Å; P700-F781 HydrophobicContact CB-CZ 4.18Å; P700-F781 HydrophobicContact CG-CE1 4.29Å; P700-F781 HydrophobicContact CG-CZ 3.94Å; P700-T828 WeakPolarHBondContact CD-OG1 3.31Å
701	R	92.8	Very high	93.8	Very high	40 Å²	40	45.2 Å²	45.2	15%	0.151	20%	0.203	C	C	.	.	H	α-helix	trans	-53.3	-43.7	175.9	179.5	180	178.6	-87.4	18.4	111.3	E695 V703 R704 L705 E740 E758	E695-R701 WeakPolarHBondContact OE2-CB 3.47Å; E695-R701 PolarHBondContact OE2-N 3.12Å; R701-V703 PolarHBondContact O-N 3.28Å; R701-R704 PolarHBondContact O-N 3.22Å; R701-L705 HydrophobicContact CG-CD1 4.06Å; R701-L705 WeakPolarHBondContact O-CG 3.24Å; R701-L705 PolarHBondContact O-N 2.69Å; R701-E740 IonicContact CZ-OE1 2.81Å; R701-E740 VanDerWaalsContact CZ-OE1 3.23Å; R701-E740 IonicContact CZ-OE2 2.63Å; R701-E740 IonicContact NH1-OE1 2.7Å; R701-E740 PolarHBondContact NH1-OE1 3.01Å; R701-E740 IonicContact NH1-OE2 3.9Å; R701-E740 PolarHBondContact NH1-OE2 2.7Å; R701-E740 IonicContact NH2-OE1 3.55Å; R701-E740 PolarHBondContact NH2-OE1 2.77Å; R701-E740 IonicContact NH2-OE2 3.82Å; R701-E758 IonicContact CZ-OE2 3.79Å; R701-E758 IonicContact NE-OE2 3.98Å; R701-E758 PolarHBondContact NE-OE2 3.28Å; R701-E758 IonicContact NH2-OE2 2.69Å; R701-E758 PolarHBondContact NH2-OE2 3.47Å
702	F	94.9	Very high	94.2	Very high	5 Å²	5	51.4 Å²	51.4	2%	0.022	23%	0.23	C	C	.	.	H	α-helix	trans	-63.6	-38.7	178	-179.2	-110.4	0	0	0	113.2	V683 F684 P700 C706 V737 A777 F781	V683-F702 HydrophobicContact CG1-CB 4.44Å; F684-F702 HydrophobicContact CE1-CE1 4.42Å; F684-F702 HydrophobicContact CE2-CD1 4.29Å; F684-F702 AromaticContact CE2-CE1 3.97Å; F684-F702 HydrophobicContact CE2-CE1 3.97Å; F684-F702 HydrophobicContact CE2-CZ 4.17Å; F684-F702 HydrophobicContact CZ-CD1 4.21Å; F684-F702 AromaticContact CZ-CE1 3.5Å; F684-F702 HydrophobicContact CZ-CE1 3.5Å; F684-F702 AromaticContact CZ-CZ 3.77Å; F684-F702 HydrophobicContact CZ-CZ 3.77Å; P700-F702 VanDerWaalsContact C-N 3.28Å; P700-F702 PolarHBondContact O-N 2.95Å; F702-C706 WeakPolarHBondContact CE2-SG 3.1Å; F702-C706 WeakPolarHBondContact CZ-SG 3.3Å; F702-C706 WeakPolarHBondContact O-CB 3.38Å; F702-C706 PolarHBondContact O-N 3.48Å; F702-C706 PolarHBondContact O-SG 3.01Å; F702-V737 HydrophobicContact CB-CG1 4.21Å; F702-V737 HydrophobicContact CD2-CB 4.32Å; F702-V737 HydrophobicContact CD2-CG1 3.75Å; F702-V737 HydrophobicContact CD2-CG2 3.56Å; F702-V737 HydrophobicContact CE2-CB 4.5Å; F702-V737 HydrophobicContact CE2-CG1 4.34Å; F702-V737 HydrophobicContact CE2-CG2 3.51Å; F702-V737 HydrophobicContact CG-CG1 3.95Å; F702-V737 HydrophobicContact CZ-CG2 4.43Å; F702-A777 HydrophobicContact CZ-CB 3.88Å; F702-F781 HydrophobicContact CD1-CB 4.12Å; F702-F781 HydrophobicContact CD1-CD2 4.13Å; F702-F781 HydrophobicContact CD1-CG 4.12Å; F702-F781 HydrophobicContact CE1-CB 3.94Å; F702-F781 HydrophobicContact CE1-CG 4.44Å
703	V	97.9	Very high	94.4	Very high	0 Å²	0	55 Å²	55	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-63.7	-47.4	176	171.8	0	0	0	0	109.7	V699 P700 R701 C706 T707 L778 F781 F782 F831 M832	V699-V703 HydrophobicContact CG1-CB 4.44Å; V699-V703 HydrophobicContact CG1-CG1 4.18Å; P700-V703 HydrophobicContact CB-CB 4.34Å; P700-V703 HydrophobicContact CB-CG2 4.03Å; P700-V703 HydrophobicContact CG-CG2 4.23Å; P700-V703 WeakPolarHBondContact O-CB 3.47Å; P700-V703 PolarHBondContact O-N 3.02Å; P700-V703 VanDerWaalsContact O-N 3.09Å; R701-V703 PolarHBondContact O-N 3.28Å; V703-C706 PolarHBondContact O-N 3.34Å; V703-T707 WeakPolarHBondContact O-CG2 3.25Å; V703-T707 PolarHBondContact O-N 3.46Å; V703-T707 PolarHBondContact O-OG1 3.49Å; V703-L778 HydrophobicContact CB-CD1 4.24Å; V703-L778 HydrophobicContact CG1-CD1 4.26Å; V703-L778 HydrophobicContact CG2-CD1 3.97Å; V703-F781 HydrophobicContact CG2-CD1 3.76Å; V703-F781 HydrophobicContact CG2-CE1 3.52Å; V703-F781 HydrophobicContact CG2-CZ 4.33Å; V703-F782 HydrophobicContact CG1-CZ 4.09Å; V703-F782 HydrophobicContact CG2-CE1 4.34Å; V703-F782 HydrophobicContact CG2-CE2 4.35Å; V703-F782 HydrophobicContact CG2-CZ 3.74Å; V703-F831 HydrophobicContact CG1-CD1 3.92Å; V703-F831 HydrophobicContact CG1-CE1 3.97Å; V703-M832 HydrophobicContact CG1-CG 4.28Å; V703-M832 HydrophobicContact CG1-SD 3.77Å
704	R	96.9	Very high	94.8	Very high	90 Å²	90	48.5 Å²	48.5	34%	0.34	21%	0.212	S	C	.	.	H	α-helix	trans	-58.9	-50.2	177	-72	-179.3	-85	134.3	-7.2	112.5	S697 V699 P700 R701 C706 T707 E708 F831	S697-R704 PolarHBondContact OG-NH2 3.02Å; S697-R704 VanDerWaalsContact OG-NH2 3.15Å; V699-R704 HydrophobicContact CG1-CG 4Å; V699-R704 VanDerWaalsContact O-CZ 3.32Å; V699-R704 PolarHBondContact O-NE 2.98Å; V699-R704 PolarHBondContact O-NH2 2.74Å; P700-R704 PolarHBondContact O-N 3.21Å; P700-R704 VanDerWaalsContact O-N 3.09Å; R701-R704 PolarHBondContact O-N 3.22Å; R704-C706 PolarHBondContact O-N 3.39Å; R704-T707 PolarHBondContact O-N 3.02Å; R704-T707 PolarHBondContact O-OG1 3.41Å; R704-E708 WeakPolarHBondContact O-CB 3.16Å; R704-E708 PolarHBondContact O-N 3.35Å; R704-F831 HydrophobicContact CB-CZ 4.28Å; R704-F831 HydrophobicContact CG-CE1 4.03Å; R704-F831 HydrophobicContact CG-CE2 4.13Å; R704-F831 HydrophobicContact CG-CZ 3.68Å
705	L	95.1	Very high	95.4	Very high	21 Å²	21	45.6 Å²	45.6	11%	0.11	20%	0.203	C	C	.	.	H	α-helix	trans	-58.6	-45	178	-71.1	170.4	0	0	0	112.2	R701 E708 A709 L761 L763	R701-L705 HydrophobicContact CG-CD1 4.06Å; R701-L705 WeakPolarHBondContact O-CG 3.24Å; R701-L705 PolarHBondContact O-N 2.69Å; L705-E708 PolarHBondContact O-N 3.06Å; L705-A709 WeakPolarHBondContact O-CB 3.44Å; L705-A709 PolarHBondContact O-N 2.98Å; L705-L761 HydrophobicContact CD1-CD2 4.25Å; L705-L763 HydrophobicContact CB-CD1 4.11Å
706	C	98	Very high	95.9	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-64.4	-44	179	-70.1	0	0	0	0	112.5	F702 V703 R704 A709 V710 V774 L778	F702-C706 WeakPolarHBondContact CE2-SG 3.1Å; F702-C706 WeakPolarHBondContact CZ-SG 3.3Å; F702-C706 WeakPolarHBondContact O-CB 3.38Å; F702-C706 PolarHBondContact O-N 3.48Å; F702-C706 PolarHBondContact O-SG 3.01Å; V703-C706 PolarHBondContact O-N 3.34Å; R704-C706 PolarHBondContact O-N 3.39Å; C706-A709 PolarHBondContact O-N 2.91Å; C706-V710 VanDerWaalsContact O-CG2 3.25Å; C706-V710 WeakPolarHBondContact O-CG2 3.5Å; C706-V710 PolarHBondContact O-N 2.71Å; C706-V774 HydrophobicContact CB-CG1 3.93Å; C706-L778 HydrophobicContact CB-CB 3.92Å; C706-L778 HydrophobicContact CB-CD1 4.01Å; C706-L778 HydrophobicContact CB-CD2 3.8Å; C706-L778 HydrophobicContact CB-CG 4.12Å
707	T	98.1	Very high	96.4	Very high	3 Å²	3	38.9 Å²	38.9	2%	0.018	19%	0.188	C	C	.	.	H	α-helix	trans	-67.8	-37.1	178.3	50.6	0	0	0	0	112.5	V703 R704 V710 E711 L778 F831 M832 H835	V703-T707 WeakPolarHBondContact O-CG2 3.25Å; V703-T707 PolarHBondContact O-N 3.46Å; V703-T707 PolarHBondContact O-OG1 3.49Å; R704-T707 PolarHBondContact O-N 3.02Å; R704-T707 PolarHBondContact O-OG1 3.41Å; T707-V710 PolarHBondContact O-N 3.45Å; T707-E711 WeakPolarHBondContact O-CB 3.34Å; T707-E711 PolarHBondContact O-N 2.74Å; T707-L778 HydrophobicContact CG2-CD2 3.93Å; T707-F831 HydrophobicContact CG2-CE1 3.9Å; T707-F831 WeakPolarHBondContact OG1-CE1 3.45Å; T707-F831 VanDerWaalsContact OG1-CZ 3.28Å; T707-F831 WeakPolarHBondContact OG1-CZ 3.37Å; T707-M832 HydrophobicContact CG2-SD 3.95Å; T707-H835 HydrophobicContact CG2-CB 3.93Å; T707-H835 PolarHBondContact O-CE1 2.9Å
708	E	97.3	Very high	96.6	Very high	120 Å²	120	40.2 Å²	40.2	56%	0.561	19%	0.192	S	C	*	.	H	α-helix	trans	-61.9	-46.9	175.2	-176.9	179.5	-179.7	0	0	110.8	R704 L705 V710 E711 K712	R704-E708 WeakPolarHBondContact O-CB 3.16Å; R704-E708 PolarHBondContact O-N 3.35Å; L705-E708 PolarHBondContact O-N 3.06Å; E708-V710 VanDerWaalsContact C-N 3.34Å; E708-V710 PolarHBondContact O-N 2.95Å; E708-E711 PolarHBondContact O-N 3.4Å; E708-K712 VanDerWaalsContact O-CB 3.22Å; E708-K712 WeakPolarHBondContact O-CB 3.45Å; E708-K712 PolarHBondContact O-N 2.8Å
709	A	97.1	Very high	96.8	Very high	6 Å²	6	37.6 Å²	37.6	5%	0.05	18%	0.176	C	C	.	.	H	α-helix	trans	-62.4	-38	175.6	0	0	0	0	0	112.8	L705 C706 K712 R713 L763 V774	L705-A709 WeakPolarHBondContact O-CB 3.44Å; L705-A709 PolarHBondContact O-N 2.98Å; C706-A709 PolarHBondContact O-N 2.91Å; A709-K712 PolarHBondContact O-N 2.79Å; A709-R713 VanDerWaalsContact O-CG 3.27Å; A709-R713 WeakPolarHBondContact O-CG 3.34Å; A709-R713 PolarHBondContact O-N 2.89Å; A709-R713 VanDerWaalsContact O-N 3.15Å; A709-L763 HydrophobicContact CB-CB 3.82Å; A709-L763 HydrophobicContact CB-CD1 4.07Å; A709-V774 HydrophobicContact CB-CG1 4.27Å
710	V	98.1	Very high	96.8	Very high	0 Å²	0	37 Å²	37	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-71.3	-37.8	176.6	175.3	0	0	0	0	111.8	C706 T707 E708 G714 L715 I720 Y721 I771 V774 T775	C706-V710 VanDerWaalsContact O-CG2 3.25Å; C706-V710 WeakPolarHBondContact O-CG2 3.5Å; C706-V710 PolarHBondContact O-N 2.71Å; T707-V710 PolarHBondContact O-N 3.45Å; E708-V710 VanDerWaalsContact C-N 3.34Å; E708-V710 PolarHBondContact O-N 2.95Å; V710-G714 CarbonylContact O-C 3.58Å; V710-G714 WeakPolarHBondContact O-CA 3.4Å; V710-G714 PolarHBondContact O-N 2.84Å; V710-L715 PolarHBondContact O-N 3.05Å; V710-L715 VanDerWaalsContact O-N 3.16Å; V710-I720 HydrophobicContact CG1-CD1 4.23Å; V710-I720 HydrophobicContact CG1-CG1 4.04Å; V710-Y721 HydrophobicContact CG1-CE2 3.95Å; V710-I771 HydrophobicContact CG2-CD1 3.88Å; V710-I771 HydrophobicContact CG2-CG1 4.13Å; V710-V774 HydrophobicContact CG2-CG1 4.19Å; V710-T775 HydrophobicContact CG1-CG2 4.35Å; V710-T775 HydrophobicContact CG2-CG2 3.5Å
711	E	97.4	Very high	96.9	Very high	56 Å²	56	37 Å²	37	26%	0.262	17%	0.172	S	C	.	.	H	α-helix	trans	-67.1	-36.6	173.7	-78.7	175.4	-147.2	0	0	112.4	T707 E708 L715 H835 R838	T707-E711 WeakPolarHBondContact O-CB 3.34Å; T707-E711 PolarHBondContact O-N 2.74Å; E708-E711 PolarHBondContact O-N 3.4Å; E711-L715 HydrophobicContact CG-CD1 4.5Å; E711-L715 HydrophobicContact CG-CD2 4.21Å; E711-L715 WeakPolarHBondContact O-CD1 3.27Å; E711-H835 IonicContact OE1-CE1 2.64Å; E711-H835 IonicContact OE1-CG 2.73Å; E711-H835 IonicContact OE1-ND1 3.21Å; E711-H835 PolarHBondContact OE1-ND1 2.65Å; E711-R838 VanDerWaalsContact OE1-CD 3.3Å; E711-R838 WeakPolarHBondContact OE1-CD 3.45Å; E711-R838 IonicContact OE1-CZ 3.73Å; E711-R838 IonicContact OE1-NE 3.93Å; E711-R838 IonicContact OE1-NH1 2.79Å; E711-R838 PolarHBondContact OE1-NH1 3.21Å; E711-R838 VanDerWaalsContact OE2-CD 3.3Å; E711-R838 WeakPolarHBondContact OE2-CD 3.4Å; E711-R838 IonicContact OE2-CZ 3.38Å; E711-R838 IonicContact OE2-NE 3.58Å; E711-R838 IonicContact OE2-NH1 2.84Å; E711-R838 PolarHBondContact OE2-NH1 2.75Å
712	K	96.1	Very high	97.2	Very high	131 Å²	131	39.9 Å²	39.9	57%	0.57	18%	0.183	S	C	*	.	H	α-helix	trans	-71.9	-38.2	-178.3	-176.6	178.4	179.5	-177.8	0	114.3	E708 A709 D764	E708-K712 VanDerWaalsContact O-CB 3.22Å; E708-K712 WeakPolarHBondContact O-CB 3.45Å; E708-K712 PolarHBondContact O-N 2.8Å; A709-K712 PolarHBondContact O-N 2.79Å; K712-D764 WeakPolarHBondContact CE-OD1 3.38Å; K712-D764 IonicContact NZ-OD1 2.65Å; K712-D764 PolarHBondContact NZ-OD1 3.4Å; K712-D764 IonicContact NZ-OD2 2.74Å; K712-D764 PolarHBondContact NZ-OD2 2.89Å
713	R	95.8	Very high	97.3	Very high	79 Å²	79	42.3 Å²	42.3	30%	0.298	20%	0.198	S	C	.	.	H	α-helix	trans	-144.4	6.8	-171.9	62.6	177.1	-178.5	92.7	-6.3	116.1	A709 L763 W768 E769 I771	A709-R713 VanDerWaalsContact O-CG 3.27Å; A709-R713 WeakPolarHBondContact O-CG 3.34Å; A709-R713 PolarHBondContact O-N 2.89Å; A709-R713 VanDerWaalsContact O-N 3.15Å; R713-L763 PolarHBondContact NH2-O 3.07Å; R713-W768 PolarHBondContact NH2-O 2.98Å; R713-E769 PolarHBondContact NH1-O 3.04Å; R713-I771 HydrophobicContact CG-CD1 4.25Å
714	G	96.2	Very high	97.3	Very high	0 Å²	0	47 Å²	47	0%	0	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-115.5	-17.4	-175	0	0	0	0	0	116.3	V710 D716 T717	V710-G714 CarbonylContact O-C 3.58Å; V710-G714 WeakPolarHBondContact O-CA 3.4Å; V710-G714 PolarHBondContact O-N 2.84Å; G714-D716 VanDerWaalsContact C-N 3.26Å; G714-D716 PolarHBondContact O-N 3.39Å; G714-T717 WeakPolarHBondContact O-CB 3.38Å; G714-T717 PolarHBondContact O-N 3.31Å; G714-T717 VanDerWaalsContact O-N 3.11Å; G714-T717 PolarHBondContact O-OG1 2.7Å
715	L	97.6	Very high	97.2	Very high	26 Å²	26	43.3 Å²	43.3	14%	0.136	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-29.5	-169.8	-63.5	-179	0	0	0	114.5	V710 E711 V839 R842 N846	V710-L715 PolarHBondContact O-N 3.05Å; V710-L715 VanDerWaalsContact O-N 3.16Å; E711-L715 HydrophobicContact CG-CD1 4.5Å; E711-L715 HydrophobicContact CG-CD2 4.21Å; E711-L715 WeakPolarHBondContact O-CD1 3.27Å; L715-V839 HydrophobicContact CD2-CG2 3.92Å; L715-R842 HydrophobicContact CB-CG 4.14Å; L715-R842 WeakPolarHBondContact O-CB 3.31Å; L715-N846 VanDerWaalsContact O-CB 3.3Å; L715-N846 WeakPolarHBondContact O-CB 3.43Å; L715-N846 PolarHBondContact O-ND2 2.91Å
716	D	97.5	Very high	97.2	Very high	95 Å²	95	46.7 Å²	46.7	51%	0.508	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.7	5.6	-178.7	-64.1	-56.1	0	0	0	113.6	G714 T845	G714-D716 VanDerWaalsContact C-N 3.26Å; G714-D716 PolarHBondContact O-N 3.39Å; D716-T845 HydrophobicContact CB-CG2 3.78Å; D716-T845 PolarHBondContact OD1-OG1 3.48Å
717	T	97.8	Very high	97	Very high	40 Å²	40	52 Å²	52	25%	0.245	27%	0.267	C	S	.	.	S	Bend	trans	-81.4	121	-178.1	-56.1	0	0	0	0	111.8	G714 G719 I720 I771 N846	G714-T717 WeakPolarHBondContact O-CB 3.38Å; G714-T717 PolarHBondContact O-N 3.31Å; G714-T717 VanDerWaalsContact O-N 3.11Å; G714-T717 PolarHBondContact O-OG1 2.7Å; T717-G719 PolarHBondContact O-N 3.44Å; T717-I720 WeakPolarHBondContact O-CB 3.42Å; T717-I720 PolarHBondContact O-N 3.03Å; T717-I771 HydrophobicContact CG2-CG2 4.1Å; T717-N846 VanDerWaalsContact O-CB 3.31Å; T717-N846 WeakPolarHBondContact O-CB 3.22Å
718	D	97.6	Very high	96.8	Very high	64 Å²	64	55.3 Å²	55.3	34%	0.342	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.2	121.9	177.5	-174.9	-5.8	0	0	0	111.7	I720 R722 N846 R847	D718-I720 VanDerWaalsContact C-N 3.34Å; D718-R722 IonicContact OD1-CZ 2.82Å; D718-R722 IonicContact OD1-NH2 3.32Å; D718-R722 PolarHBondContact OD1-NH2 2.95Å; D718-N846 WeakPolarHBondContact CA-O 3.37Å; D718-R847 WeakPolarHBondContact OD2-CD 3.33Å; D718-R847 IonicContact OD2-CZ 2.77Å; D718-R847 IonicContact OD2-NE 3.18Å; D718-R847 IonicContact OD2-NH1 3.59Å; D718-R847 PolarHBondContact OD2-NH1 3.12Å
719	G	97.2	Very high	96.6	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	70.5	27.7	-179.8	0	0	0	0	0	113.7	T717 Y721 R722 V723 N846	T717-G719 PolarHBondContact O-N 3.44Å; G719-Y721 PolarHBondContact O-N 3.36Å; G719-R722 WeakPolarHBondContact O-CA 3.37Å; G719-R722 WeakPolarHBondContact O-CB 3.34Å; G719-R722 PolarHBondContact O-N 3.02Å; G719-V723 WeakPolarHBondContact O-CG2 3.14Å; G719-V723 PolarHBondContact O-N 3.04Å; G719-N846 PolarHBondContact N-O 2.93Å
720	I	98.3	Very high	96.5	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-47	137.9	166.2	-167.1	65.8	0	0	0	110.2	V710 T717 D718 R722 I771 T775 V839 N846 M848	V710-I720 HydrophobicContact CG1-CD1 4.23Å; V710-I720 HydrophobicContact CG1-CG1 4.04Å; T717-I720 WeakPolarHBondContact O-CB 3.42Å; T717-I720 PolarHBondContact O-N 3.03Å; D718-I720 VanDerWaalsContact C-N 3.34Å; I720-R722 PolarHBondContact O-N 2.94Å; I720-I771 HydrophobicContact CD1-CG1 3.92Å; I720-I771 HydrophobicContact CD1-CG2 3.83Å; I720-T775 HydrophobicContact CD1-CG2 3.59Å; I720-T775 HydrophobicContact CG1-CG2 4.11Å; I720-V839 HydrophobicContact CG2-CG1 3.56Å; I720-N846 HydrophobicContact CG2-CB 4.04Å; I720-M848 HydrophobicContact CG2-CG 4Å; I720-M848 WeakPolarHBondContact O-CE 3.48Å; I720-M848 WeakPolarHBondContact O-CG 3.26Å
721	Y	98.4	Very high	96.2	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	59.3	-27.4	-165.9	-66	-74.6	0	0	0	118.2	V710 G719 T775 L778 K779 H835 L836 V839 F857	V710-Y721 HydrophobicContact CG1-CE2 3.95Å; G719-Y721 PolarHBondContact O-N 3.36Å; Y721-T775 HydrophobicContact CD1-CG2 3.67Å; Y721-T775 HydrophobicContact CD2-CG2 4.19Å; Y721-T775 HydrophobicContact CE1-CG2 3.45Å; Y721-T775 VanDerWaalsContact CE1-CG2 3.45Å; Y721-T775 HydrophobicContact CE2-CG2 4.01Å; Y721-T775 HydrophobicContact CG-CG2 4.03Å; Y721-L778 HydrophobicContact CE1-CD2 4.18Å; Y721-L778 WeakPolarHBondContact OH-CD2 3.44Å; Y721-K779 HydrophobicContact CD1-CD 4.31Å; Y721-K779 HydrophobicContact CD1-CG 4.29Å; Y721-K779 PolarHBondContact O-NZ 3.49Å; Y721-H835 AromaticContact CE2-NE2 3.41Å; Y721-H835 WeakPolarHBondContact CE2-NE2 3.4Å; Y721-H835 AromaticContact CZ-CD2 4Å; Y721-H835 AromaticContact CZ-NE2 3.48Å; Y721-H835 PolarHBondContact OH-CD2 2.9Å; Y721-H835 VanDerWaalsContact OH-CD2 3.3Å; Y721-H835 PolarHBondContact OH-NE2 2.8Å; Y721-L836 HydrophobicContact CD2-CD2 4.12Å; Y721-L836 HydrophobicContact CE2-CD2 4.04Å; Y721-V839 HydrophobicContact CD2-CG2 4.46Å; Y721-V839 HydrophobicContact CE2-CG2 4.13Å; Y721-F857 AromaticContact CD1-CE2 3.7Å; Y721-F857 HydrophobicContact CD1-CE2 3.7Å; Y721-F857 AromaticContact CD1-CZ 3.47Å; Y721-F857 HydrophobicContact CD1-CZ 3.47Å; Y721-F857 VanDerWaalsContact CD1-CZ 3.47Å; Y721-F857 HydrophobicContact CD2-CE2 4.3Å; Y721-F857 HydrophobicContact CE1-CE2 4.3Å; Y721-F857 AromaticContact CE1-CZ 3.7Å; Y721-F857 HydrophobicContact CE1-CZ 3.7Å; Y721-F857 AromaticContact CG-CE2 3.71Å; Y721-F857 HydrophobicContact CG-CE2 3.71Å; Y721-F857 AromaticContact CG-CZ 3.96Å; Y721-F857 HydrophobicContact CG-CZ 3.96Å
722	R	97.8	Very high	95.8	Very high	102 Å²	102	56.9 Å²	56.9	39%	0.385	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.5	-47.6	174.8	-179.2	179.9	70.2	-143.6	-3.6	112.1	D718 G719 I720 R847 M848	D718-R722 IonicContact OD1-CZ 2.82Å; D718-R722 IonicContact OD1-NH2 3.32Å; D718-R722 PolarHBondContact OD1-NH2 2.95Å; G719-R722 WeakPolarHBondContact O-CA 3.37Å; G719-R722 WeakPolarHBondContact O-CB 3.34Å; G719-R722 PolarHBondContact O-N 3.02Å; I720-R722 PolarHBondContact O-N 2.94Å; R722-R847 PolarHBondContact NH1-O 3.22Å; R722-M848 HydrophobicContact CB-CE 3.81Å; R722-M848 HydrophobicContact CB-SD 3.62Å
723	V	97.9	Very high	95.6	Very high	56 Å²	56	50.7 Å²	50.7	34%	0.339	28%	0.275	S	S	.	.	S	Bend	trans	-67.6	151.5	176.8	176.5	0	0	0	0	109.9	G719 H772 K779	G719-V723 WeakPolarHBondContact O-CG2 3.14Å; G719-V723 PolarHBondContact O-N 3.04Å; V723-H772 HydrophobicContact CG1-CB 4.27Å; V723-K779 PolarHBondContact O-NZ 3.18Å
724	S	96.3	Very high	95.3	Very high	98 Å²	98	48.9 Å²	48.9	69%	0.685	27%	0.269	S	S	*	.			trans	-113.8	120.3	179.8	-64.8	0	0	0	0	110.1
725	G	95.8	Very high	94.8	Very high	13 Å²	13	54.2 Å²	54.2	13%	0.134	29%	0.292	C	S	.	.			trans	-73.6	178.2	174.5	0	0	0	0	0	112.7	L727 D770 H772	G725-L727 PolarHBondContact O-N 3.14Å; G725-L727 VanDerWaalsContact O-N 3.1Å; G725-D770 WeakPolarHBondContact CA-OD2 3.13Å; G725-H772 VanDerWaalsContact CA-C 3.47Å; G725-H772 WeakPolarHBondContact CA-O 3.37Å; G725-H772 PolarHBondContact N-O 3.36Å; G725-H772 VanDerWaalsContact N-O 3.12Å
726	N	96.1	Very high	94.2	Very high	91 Å²	91	56.1 Å²	56.1	49%	0.487	30%	0.302	S	S	.	.			trans	-64.5	112.5	-175.5	-174.5	-22.5	0	0	0	112	A728 V729 I730	N726-A728 PolarHBondContact O-N 2.91Å; N726-A728 VanDerWaalsContact O-N 3.16Å; N726-A728 WeakPolarHBondContact OD1-CB 3.42Å; N726-A728 PolarHBondContact OD1-N 3.32Å; N726-V729 HydrophobicContact CB-CB 4.26Å; N726-V729 HydrophobicContact CB-CG2 3.89Å; N726-V729 PolarHBondContact O-N 3.44Å; N726-I730 WeakPolarHBondContact O-CG1 3.38Å; N726-I730 PolarHBondContact O-N 3.43Å
727	L	93.6	Very high	93.6	Very high	113 Å²	113	51.9 Å²	51.9	59%	0.592	28%	0.28	S	S	*	.	H	α-helix	trans	-57.1	-32	-177.4	-177.1	60.4	0	0	0	113.7	G725 Q731	G725-L727 PolarHBondContact O-N 3.14Å; G725-L727 VanDerWaalsContact O-N 3.1Å; L727-Q731 HydrophobicContact CD1-CG 4.36Å; L727-Q731 WeakPolarHBondContact O-CB 3.37Å; L727-Q731 VanDerWaalsContact O-CG 3.27Å; L727-Q731 WeakPolarHBondContact O-CG 3.23Å; L727-Q731 PolarHBondContact O-N 3.46Å
728	A	93	Very high	92.8	Very high	72 Å²	72	50.2 Å²	50.2	60%	0.595	27%	0.269	S	S	*	.	H	α-helix	trans	-68.9	-36.4	176.6	0	0	0	0	0	111.9	N726 Q731 K732	N726-A728 PolarHBondContact O-N 2.91Å; N726-A728 VanDerWaalsContact O-N 3.16Å; N726-A728 WeakPolarHBondContact OD1-CB 3.42Å; N726-A728 PolarHBondContact OD1-N 3.32Å; A728-Q731 PolarHBondContact O-N 3.42Å; A728-K732 PolarHBondContact O-N 3.16Å
729	V	93.1	Very high	91.4	Very high	41 Å²	41	50.3 Å²	50.3	25%	0.248	27%	0.267	C	S	.	.	H	α-helix	trans	-75.7	-37.3	176.7	-170.5	0	0	0	0	110.4	N726 Q731 K732 L733 W768 V773	N726-V729 HydrophobicContact CB-CB 4.26Å; N726-V729 HydrophobicContact CB-CG2 3.89Å; N726-V729 PolarHBondContact O-N 3.44Å; V729-Q731 VanDerWaalsContact C-N 3.29Å; V729-Q731 PolarHBondContact O-N 2.9Å; V729-K732 WeakPolarHBondContact O-CB 3.48Å; V729-K732 PolarHBondContact O-N 3Å; V729-K732 VanDerWaalsContact O-N 3.13Å; V729-L733 PolarHBondContact O-N 2.73Å; V729-W768 HydrophobicContact CG1-CE3 4.04Å; V729-W768 HydrophobicContact CG1-CZ3 3.75Å; V729-V773 HydrophobicContact CB-CG1 4.34Å; V729-V773 HydrophobicContact CB-CG2 3.92Å; V729-V773 HydrophobicContact CG1-CG1 3.94Å; V729-V773 HydrophobicContact CG1-CG2 3.95Å
730	I	94.8	Very high	89.5	Confident	10 Å²	10	53 Å²	53	5%	0.051	28%	0.28	C	S	.	.	H	α-helix	trans	-58.1	-42	169.9	-66.9	166.9	0	0	0	111	N726 L733 R734 V773 A777 L780	N726-I730 WeakPolarHBondContact O-CG1 3.38Å; N726-I730 PolarHBondContact O-N 3.43Å; I730-L733 PolarHBondContact O-N 2.99Å; I730-R734 WeakPolarHBondContact O-CB 3.43Å; I730-R734 PolarHBondContact O-N 3.48Å; I730-V773 HydrophobicContact CG1-CB 4.22Å; I730-V773 HydrophobicContact CG1-CG1 3.9Å; I730-V773 HydrophobicContact CG1-CG2 4.36Å; I730-A777 HydrophobicContact CG2-CB 4.12Å; I730-L780 HydrophobicContact CG2-CD2 3.77Å
731	Q	91.6	Very high	87.2	Confident	79 Å²	79	59 Å²	59	37%	0.369	30%	0.303	S	S	.	.	H	α-helix	trans	-71	-31	176.1	-71.9	-69.5	-32.8	0	0	112.7	L727 A728 V729 F735	L727-Q731 HydrophobicContact CD1-CG 4.36Å; L727-Q731 WeakPolarHBondContact O-CB 3.37Å; L727-Q731 VanDerWaalsContact O-CG 3.27Å; L727-Q731 WeakPolarHBondContact O-CG 3.23Å; L727-Q731 PolarHBondContact O-N 3.46Å; A728-Q731 PolarHBondContact O-N 3.42Å; V729-Q731 VanDerWaalsContact C-N 3.29Å; V729-Q731 PolarHBondContact O-N 2.9Å; Q731-F735 WeakPolarHBondContact O-CB 3.49Å; Q731-F735 PolarHBondContact O-N 3.3Å
732	K	89.7	Confident	84.6	Confident	85 Å²	85	60.2 Å²	60.2	37%	0.37	31%	0.313	S	S	.	.	H	α-helix	trans	-63.3	-46.8	168.6	-167.1	-164.4	179.4	-160.3	0	111.3	A728 V729 F735 L736 E767 W768	A728-K732 PolarHBondContact O-N 3.16Å; V729-K732 WeakPolarHBondContact O-CB 3.48Å; V729-K732 PolarHBondContact O-N 3Å; V729-K732 VanDerWaalsContact O-N 3.13Å; K732-F735 PolarHBondContact O-N 2.87Å; K732-L736 HydrophobicContact CG-CD1 4.38Å; K732-L736 WeakPolarHBondContact O-CG 3.43Å; K732-L736 PolarHBondContact O-N 2.86Å; K732-E767 IonicContact NZ-OE1 2.99Å; K732-E767 PolarHBondContact NZ-OE1 2.94Å; K732-E767 IonicContact NZ-OE2 3.38Å; K732-E767 PolarHBondContact NZ-OE2 3.07Å; K732-W768 HydrophobicContact CB-CH2 4.37Å; K732-W768 HydrophobicContact CD-CH2 3.9Å; K732-W768 HydrophobicContact CG-CH2 4.16Å
733	L	91.1	Very high	81.7	Confident	0 Å²	0	61.6 Å²	61.6	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-61.7	-48	178	-175.2	53.4	0	0	0	111.2	V729 I730 F735 L736 V737 L761 L763 W768 V773 A777	V729-L733 PolarHBondContact O-N 2.73Å; I730-L733 PolarHBondContact O-N 2.99Å; L733-F735 VanDerWaalsContact C-N 3.32Å; L733-F735 PolarHBondContact O-N 2.88Å; L733-L736 PolarHBondContact O-N 3.43Å; L733-L736 VanDerWaalsContact O-N 3.17Å; L733-V737 HydrophobicContact CD1-CG2 4.19Å; L733-V737 HydrophobicContact CG-CG2 4.46Å; L733-V737 VanDerWaalsContact O-CG2 3.27Å; L733-V737 WeakPolarHBondContact O-CG2 3.12Å; L733-V737 PolarHBondContact O-N 3.07Å; L733-L761 HydrophobicContact CD1-CD1 3.98Å; L733-L761 HydrophobicContact CD1-CD2 4.33Å; L733-L763 HydrophobicContact CD1-CD2 3.93Å; L733-L763 HydrophobicContact CD2-CD2 4.06Å; L733-W768 HydrophobicContact CB-CE3 4.08Å; L733-W768 HydrophobicContact CB-CH2 3.99Å; L733-W768 HydrophobicContact CB-CZ3 3.56Å; L733-W768 HydrophobicContact CD1-CD2 4.15Å; L733-W768 HydrophobicContact CD1-CE3 4.12Å; L733-W768 HydrophobicContact CD1-CH2 4.09Å; L733-W768 HydrophobicContact CD1-CZ2 4.13Å; L733-W768 HydrophobicContact CD1-CZ3 4.1Å; L733-W768 HydrophobicContact CD2-CE3 4.27Å; L733-W768 HydrophobicContact CG-CE3 4.39Å; L733-W768 HydrophobicContact CG-CZ3 4.28Å; L733-V773 HydrophobicContact CD2-CG1 4.18Å; L733-A777 HydrophobicContact CD2-CB 3.76Å; L733-A777 HydrophobicContact CG-CB 4.35Å
734	R	89.5	Confident	78.8	Confident	42 Å²	42	63 Å²	63	16%	0.158	34%	0.336	C	S	.	.	H	α-helix	trans	-51.9	-48.6	173.3	-175.3	-163.3	178.1	-61.8	-13.9	111.8	F684 I730 V737 D738 L780 E784	F684-R734 HydrophobicContact CB-CG 4.23Å; F684-R734 HydrophobicContact CD1-CG 3.77Å; F684-R734 HydrophobicContact CD2-CB 4.49Å; F684-R734 HydrophobicContact CD2-CG 3.74Å; F684-R734 HydrophobicContact CE1-CB 4.46Å; F684-R734 HydrophobicContact CE1-CG 3.97Å; F684-R734 HydrophobicContact CE2-CB 4.25Å; F684-R734 HydrophobicContact CE2-CG 3.96Å; F684-R734 HydrophobicContact CG-CG 3.65Å; F684-R734 HydrophobicContact CZ-CB 4.23Å; F684-R734 HydrophobicContact CZ-CG 4.07Å; I730-R734 WeakPolarHBondContact O-CB 3.43Å; I730-R734 PolarHBondContact O-N 3.48Å; R734-V737 PolarHBondContact O-N 2.95Å; R734-D738 IonicContact CZ-OD2 2.7Å; R734-D738 IonicContact NH1-OD2 2.69Å; R734-D738 PolarHBondContact NH1-OD2 2.81Å; R734-D738 IonicContact NH2-OD2 3.97Å; R734-D738 WeakPolarHBondContact O-CB 3.34Å; R734-D738 PolarHBondContact O-N 3.41Å; R734-L780 HydrophobicContact CG-CD2 4.43Å; R734-E784 IonicContact CZ-OE2 3.96Å; R734-E784 IonicContact NE-OE1 3.12Å; R734-E784 PolarHBondContact NE-OE1 2.86Å; R734-E784 IonicContact NE-OE2 2.74Å; R734-E784 PolarHBondContact NE-OE2 2.9Å; R734-E784 IonicContact NH2-OE2 2.77Å; R734-E784 PolarHBondContact NH2-OE2 3.12Å
735	F	85.6	Confident	76	Confident	111 Å²	111	65 Å²	65	49%	0.487	35%	0.345	S	S	.	.	H	α-helix	trans	-61.6	-44.4	178.1	179.8	-88	0	0	0	112	Q731 K732 L733 D738 H739	Q731-F735 WeakPolarHBondContact O-CB 3.49Å; Q731-F735 PolarHBondContact O-N 3.3Å; K732-F735 PolarHBondContact O-N 2.87Å; L733-F735 VanDerWaalsContact C-N 3.32Å; L733-F735 PolarHBondContact O-N 2.88Å; F735-D738 PolarHBondContact O-N 3.27Å; F735-H739 AromaticContact CD1-CD2 3.87Å; F735-H739 AromaticContact CD2-CD2 3.53Å; F735-H739 AromaticContact CD2-NE2 3.78Å; F735-H739 AromaticContact CE1-CD2 3.66Å; F735-H739 AromaticContact CE2-CD2 3.31Å; F735-H739 WeakPolarHBondContact CE2-CD2 3.38Å; F735-H739 AromaticContact CE2-NE2 3.32Å; F735-H739 VanDerWaalsContact CE2-NE2 3.32Å; F735-H739 WeakPolarHBondContact CE2-NE2 3.24Å; F735-H739 AromaticContact CG-CD2 3.8Å; F735-H739 AromaticContact CZ-CD2 3.38Å; F735-H739 WeakPolarHBondContact CZ-CD2 3.48Å; F735-H739 AromaticContact CZ-NE2 3.7Å; F735-H739 WeakPolarHBondContact O-CB 3.42Å; F735-H739 PolarHBondContact O-CD2 3.02Å; F735-H739 PolarHBondContact O-N 3.44Å
736	L	84.8	Confident	73.2	Confident	66 Å²	66	70 Å²	70	35%	0.346	37%	0.368	S	S	.	.	H	α-helix	trans	-65	-43	178	-70.8	168.5	0	0	0	112.1	K732 L733 D738 H739 E740 L761 W768	K732-L736 HydrophobicContact CG-CD1 4.38Å; K732-L736 WeakPolarHBondContact O-CG 3.43Å; K732-L736 PolarHBondContact O-N 2.86Å; L733-L736 PolarHBondContact O-N 3.43Å; L733-L736 VanDerWaalsContact O-N 3.17Å; L736-D738 VanDerWaalsContact C-N 3.35Å; L736-D738 PolarHBondContact O-N 3.49Å; L736-H739 CarbonylContact O-C 3.48Å; L736-H739 PolarHBondContact O-N 2.93Å; L736-E740 PolarHBondContact O-N 3.28Å; L736-L761 HydrophobicContact CB-CD1 4.24Å; L736-W768 HydrophobicContact CD1-CH2 3.7Å; L736-W768 HydrophobicContact CD1-CZ2 3.51Å
737	V	86.3	Confident	70.3	Confident	6 Å²	6	69 Å²	69	4%	0.036	38%	0.38	C	S	.	.	H	α-helix	trans	-64.4	-38	176.2	177.5	0	0	0	0	111.8	V683 F684 F702 L733 R734 H739 L761	V683-V737 HydrophobicContact CB-CG1 3.92Å; V683-V737 HydrophobicContact CG1-CG1 3.86Å; V683-V737 HydrophobicContact CG2-CG1 4.11Å; V683-V737 WeakPolarHBondContact CG2-O 3.42Å; F684-V737 HydrophobicContact CD2-CG1 4.33Å; F684-V737 HydrophobicContact CE2-CB 4Å; F684-V737 HydrophobicContact CE2-CG1 3.92Å; F702-V737 HydrophobicContact CB-CG1 4.21Å; F702-V737 HydrophobicContact CD2-CB 4.32Å; F702-V737 HydrophobicContact CD2-CG1 3.75Å; F702-V737 HydrophobicContact CD2-CG2 3.56Å; F702-V737 HydrophobicContact CE2-CB 4.5Å; F702-V737 HydrophobicContact CE2-CG1 4.34Å; F702-V737 HydrophobicContact CE2-CG2 3.51Å; F702-V737 HydrophobicContact CG-CG1 3.95Å; F702-V737 HydrophobicContact CZ-CG2 4.43Å; L733-V737 HydrophobicContact CD1-CG2 4.19Å; L733-V737 HydrophobicContact CG-CG2 4.46Å; L733-V737 VanDerWaalsContact O-CG2 3.27Å; L733-V737 WeakPolarHBondContact O-CG2 3.12Å; L733-V737 PolarHBondContact O-N 3.07Å; R734-V737 PolarHBondContact O-N 2.95Å; V737-H739 PolarHBondContact O-N 2.85Å; V737-L761 HydrophobicContact CG2-CD1 3.55Å; V737-L761 HydrophobicContact CG2-CD2 4.15Å
738	D	81.1	Confident	67.7	Low	6 Å²	6	72.2 Å²	72.2	3%	0.032	38%	0.384	C	S	.	.	H	α-helix	trans	-70.4	-16.7	172.9	-79.3	-21.3	0	0	0	113.4	Q682 V683 F684 R734 F735 L736	Q682-D738 HydrophobicContact CG-CB 4.5Å; V683-D738 PolarHBondContact N-OD1 2.75Å; F684-D738 PolarHBondContact N-OD1 2.73Å; R734-D738 IonicContact CZ-OD2 2.7Å; R734-D738 IonicContact NH1-OD2 2.69Å; R734-D738 PolarHBondContact NH1-OD2 2.81Å; R734-D738 IonicContact NH2-OD2 3.97Å; R734-D738 WeakPolarHBondContact O-CB 3.34Å; R734-D738 PolarHBondContact O-N 3.41Å; F735-D738 PolarHBondContact O-N 3.27Å; L736-D738 VanDerWaalsContact C-N 3.35Å; L736-D738 PolarHBondContact O-N 3.49Å
739	H	67.6	Low	65.1	Low	65 Å²	65	75.9 Å²	75.9	30%	0.301	39%	0.387	S	S	.	.	H	α-helix	trans	-116.6	-3.3	-176.1	-73.3	-62.7	0	0	0	115.7	F735 L736 V737 R741 A742	F735-H739 AromaticContact CD1-CD2 3.87Å; F735-H739 AromaticContact CD2-CD2 3.53Å; F735-H739 AromaticContact CD2-NE2 3.78Å; F735-H739 AromaticContact CE1-CD2 3.66Å; F735-H739 AromaticContact CE2-CD2 3.31Å; F735-H739 WeakPolarHBondContact CE2-CD2 3.38Å; F735-H739 AromaticContact CE2-NE2 3.32Å; F735-H739 VanDerWaalsContact CE2-NE2 3.32Å; F735-H739 WeakPolarHBondContact CE2-NE2 3.24Å; F735-H739 AromaticContact CG-CD2 3.8Å; F735-H739 AromaticContact CZ-CD2 3.38Å; F735-H739 WeakPolarHBondContact CZ-CD2 3.48Å; F735-H739 AromaticContact CZ-NE2 3.7Å; F735-H739 WeakPolarHBondContact O-CB 3.42Å; F735-H739 PolarHBondContact O-CD2 3.02Å; F735-H739 PolarHBondContact O-N 3.44Å; L736-H739 CarbonylContact O-C 3.48Å; L736-H739 PolarHBondContact O-N 2.93Å; V737-H739 PolarHBondContact O-N 2.85Å; H739-R741 PolarHBondContact O-N 3.18Å; H739-A742 PolarHBondContact O-N 3.49Å
740	E	56.4	Low	62.3	Low	57 Å²	57	81.4 Å²	81.4	27%	0.266	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-9.4	173.6	-158.4	-178.3	176	0	0	113.1	R701 L736 L761	R701-E740 IonicContact CZ-OE1 2.81Å; R701-E740 VanDerWaalsContact CZ-OE1 3.23Å; R701-E740 IonicContact CZ-OE2 2.63Å; R701-E740 IonicContact NH1-OE1 2.7Å; R701-E740 PolarHBondContact NH1-OE1 3.01Å; R701-E740 IonicContact NH1-OE2 3.9Å; R701-E740 PolarHBondContact NH1-OE2 2.7Å; R701-E740 IonicContact NH2-OE1 3.55Å; R701-E740 PolarHBondContact NH2-OE1 2.77Å; R701-E740 IonicContact NH2-OE2 3.82Å; L736-E740 PolarHBondContact O-N 3.28Å; E740-L761 WeakPolarHBondContact OE1-CB 3.41Å; E740-L761 PolarHBondContact OE1-N 3.49Å
741	R	51.3	Low	59.6	Low	126 Å²	126	87.7 Å²	87.7	48%	0.475	44%	0.439	S	S	.	.	T	Hydrogen-bonded Turn	trans	-127.3	8.8	175.5	-68.1	-172.5	166.7	-179.2	-5.3	115.2	H739 E758	H739-R741 PolarHBondContact O-N 3.18Å; R741-E758 IonicContact NH2-OE1 3.02Å; R741-E758 PolarHBondContact NH2-OE1 2.82Å; R741-E758 VanDerWaalsContact NH2-OE1 3.15Å
742	A	44.2	Very low	57.1	Low	26 Å²	26	89.2 Å²	89.2	22%	0.215	46%	0.455	C	S	.	.	T	Hydrogen-bonded Turn	trans	-133.7	7.7	-162	0	0	0	0	0	116.6	H739	H739-A742 PolarHBondContact O-N 3.49Å
743	L	35.5	Very low	54.7	Low	131 Å²	131	89.8 Å²	89.8	69%	0.686	48%	0.476	S	S	*	.			trans	-140.7	109.3	-175.5	-142	75.6	0	0	0	114.4
744	T	38.1	Very low	52.2	Low	86 Å²	86	95.8 Å²	95.8	53%	0.528	51%	0.508	S	S	.	.			trans	-94.4	159.9	139.2	60.2	0	0	0	0	108.5	D746	T744-D746 PolarHBondContact O-N 2.98Å
745	T	36	Very low	50	Low	140 Å²	140	102 Å²	102	86%	0.859	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-5.2	-175.6	38.1	0	0	0	0	115.4
746	D	38.2	Very low	47.8	Very low	117 Å²	117	102.9 Å²	102.9	63%	0.626	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.8	-8.2	-153.7	-44	-18.6	0	0	0	113	T744 R748	T744-D746 PolarHBondContact O-N 2.98Å; D746-R748 VanDerWaalsContact C-N 3.26Å; D746-R748 PolarHBondContact O-N 2.8Å
747	G	35.7	Very low	45.7	Very low	71 Å²	71	108 Å²	108	73%	0.732	58%	0.58	S	S	*	*	S	Bend	trans	71.9	11	-179.4	0	0	0	0	0	115.3
748	R	38.3	Very low	43.9	Very low	180 Å²	180	112.1 Å²	112.1	68%	0.679	60%	0.599	S	S	*	*			trans	-95.1	114.1	168.6	-61.5	-168.6	-168.9	-146.7	7.5	109.5	D746 M750	D746-R748 VanDerWaalsContact C-N 3.26Å; D746-R748 PolarHBondContact O-N 2.8Å; R748-M750 PolarHBondContact O-N 3.37Å; R748-M750 VanDerWaalsContact O-N 3.15Å
749	F	38.8	Very low	42.4	Very low	149 Å²	149	120.7 Å²	120.7	65%	0.654	64%	0.639	S	S	*	*			trans	-69.8	107.5	168.7	-81.2	-89.5	0	0	0	109.8
750	M	34	Very low	42.2	Very low	156 Å²	156	123.9 Å²	123.9	77%	0.768	65%	0.652	S	S	*	*			trans	-124.6	126.2	165.1	-70	-117.4	58.9	0	0	107.5	R748 P752	R748-M750 PolarHBondContact O-N 3.37Å; R748-M750 VanDerWaalsContact O-N 3.15Å; M750-P752 WeakPolarHBondContact O-CD 3.46Å
751	F	37.8	Very low	43.4	Very low	143 Å²	143	122.1 Å²	122.1	63%	0.627	64%	0.644	S	S	*	*			trans	-75.1	125.4	162.4	-71.9	-89	0	0	0	107.3	D681 A753	D681-F751 WeakPolarHBondContact OD2-CE1 3.49Å; F751-A753 PolarHBondContact O-N 2.81Å
752	P	39.8	Very low	45	Very low	110 Å²	110	119.2 Å²	119.2	71%	0.714	64%	0.638	S	S	*	*			trans	-60	126.3	161.5	-18.2	32.1	0	0	0	108.1	M750 D754	M750-P752 WeakPolarHBondContact O-CD 3.46Å; P752-D754 WeakPolarHBondContact CB-O 3.41Å
753	A	39.7	Very low	47.2	Very low	98 Å²	98	118.4 Å²	118.4	81%	0.81	63%	0.63	S	S	*	*	S	Bend	trans	-70.8	-26.8	171.8	0	0	0	0	0	111.4	F751	F751-A753 PolarHBondContact O-N 2.81Å
754	D	38.5	Very low	49.6	Very low	126 Å²	126	116 Å²	116	67%	0.674	62%	0.618	S	S	*	*	S	Bend	trans	-119.9	149.5	-173.4	-63.5	-71.7	0	0	0	112.3	P752 V756	P752-D754 WeakPolarHBondContact CB-O 3.41Å; D754-V756 VanDerWaalsContact C-N 3.27Å; D754-V756 PolarHBondContact O-N 2.84Å
755	L	41.6	Very low	51.8	Low	171 Å²	171	116.2 Å²	116.2	90%	0.895	61%	0.613	S	S	*	*			trans	-80	60.6	-168.4	-65.6	166.8	0	0	0	113.1	Q757	L755-Q757 PolarHBondContact O-N 3.26Å
756	V	39.3	Very low	54.1	Low	130 Å²	130	114 Å²	114	79%	0.788	60%	0.603	S	S	*	*			trans	-74.6	93.4	174.8	-175	0	0	0	0	109.9	D754	D754-V756 VanDerWaalsContact C-N 3.27Å; D754-V756 PolarHBondContact O-N 2.84Å
757	Q	41.3	Very low	56.2	Low	175 Å²	175	113.6 Å²	113.6	82%	0.818	60%	0.597	S	S	*	*			trans	45.3	82.7	163.6	-154.9	79.8	19.8	0	0	115.1	L755 E759	L755-Q757 PolarHBondContact O-N 3.26Å; Q757-E759 PolarHBondContact O-N 3.03Å; Q757-E759 VanDerWaalsContact O-N 3.16Å
758	E	48.2	Very low	58.8	Low	92 Å²	92	110.4 Å²	110.4	43%	0.43	56%	0.563	S	S	.	*			trans	-51.2	124.8	164.3	-71.6	-167.8	160	0	0	108.9	R701 R741 K760	R701-E758 IonicContact CZ-OE2 3.79Å; R701-E758 IonicContact NE-OE2 3.98Å; R701-E758 PolarHBondContact NE-OE2 3.28Å; R701-E758 IonicContact NH2-OE2 2.69Å; R701-E758 PolarHBondContact NH2-OE2 3.47Å; R741-E758 IonicContact NH2-OE1 3.02Å; R741-E758 PolarHBondContact NH2-OE1 2.82Å; R741-E758 VanDerWaalsContact NH2-OE1 3.15Å; E758-K760 PolarHBondContact O-N 2.78Å
759	E	50.9	Low	61.3	Low	185 Å²	185	108.6 Å²	108.6	86%	0.864	56%	0.562	S	S	*	*			trans	-72.4	71.2	167.2	-169.4	169.7	-126.6	0	0	107.9	Q757 L761	Q757-E759 PolarHBondContact O-N 3.03Å; Q757-E759 VanDerWaalsContact O-N 3.16Å; E759-L761 PolarHBondContact O-N 2.88Å
760	K	63.6	Low	63.9	Low	133 Å²	133	104.5 Å²	104.5	58%	0.578	55%	0.548	S	S	*	.			trans	-57.6	109.7	-164	-179.1	-165.9	174.8	-167.8	0	110.4	E758 N762	E758-K760 PolarHBondContact O-N 2.78Å; K760-N762 PolarHBondContact O-N 3.31Å
761	L	81.5	Confident	67	Low	19 Å²	19	97.6 Å²	97.6	10%	0.099	51%	0.513	C	S	.	.			trans	-46.5	110.9	-179.7	179.9	127	0	0	0	112	L705 L733 L736 V737 E740 E759 L763	L705-L761 HydrophobicContact CD1-CD2 4.25Å; L733-L761 HydrophobicContact CD1-CD1 3.98Å; L733-L761 HydrophobicContact CD1-CD2 4.33Å; L736-L761 HydrophobicContact CB-CD1 4.24Å; V737-L761 HydrophobicContact CG2-CD1 3.55Å; V737-L761 HydrophobicContact CG2-CD2 4.15Å; E740-L761 WeakPolarHBondContact OE1-CB 3.41Å; E740-L761 PolarHBondContact OE1-N 3.49Å; E759-L761 PolarHBondContact O-N 2.88Å; L761-L763 HydrophobicContact CD2-CD2 3.92Å; L761-L763 HydrophobicContact CD2-CG 4.07Å
762	N	84.8	Confident	69.8	Low	66 Å²	66	92.2 Å²	92.2	35%	0.353	49%	0.49	S	S	.	.			trans	-108.5	105.7	-169.5	-177.7	14	0	0	0	112	K760 D764 E765 W768	K760-N762 PolarHBondContact O-N 3.31Å; N762-D764 PolarHBondContact O-N 2.89Å; N762-D764 WeakPolarHBondContact OD1-CB 3.3Å; N762-D764 PolarHBondContact OD1-N 3.31Å; N762-D764 VanDerWaalsContact OD1-N 3.13Å; N762-E765 HydrophobicContact CB-CG 4.15Å; N762-E765 WeakPolarHBondContact O-CG 3.42Å; N762-E765 PolarHBondContact O-N 2.88Å; N762-W768 VanDerWaalsContact O-CD1 3.31Å
763	L	89.7	Confident	72.6	Confident	8 Å²	8	87.1 Å²	87.1	4%	0.042	46%	0.457	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.9	6.2	-179.2	-61.9	177.5	0	0	0	114.3	L705 A709 R713 L733 L761 W768 V774	L705-L763 HydrophobicContact CB-CD1 4.11Å; A709-L763 HydrophobicContact CB-CB 3.82Å; A709-L763 HydrophobicContact CB-CD1 4.07Å; R713-L763 PolarHBondContact NH2-O 3.07Å; L733-L763 HydrophobicContact CD1-CD2 3.93Å; L733-L763 HydrophobicContact CD2-CD2 4.06Å; L761-L763 HydrophobicContact CD2-CD2 3.92Å; L761-L763 HydrophobicContact CD2-CG 4.07Å; L763-W768 HydrophobicContact CD2-CB 4.46Å; L763-W768 HydrophobicContact CD2-CG 4.19Å; L763-V774 HydrophobicContact CD1-CG1 4.02Å; L763-V774 HydrophobicContact CD2-CG2 4.39Å
764	D	85.4	Confident	75.4	Confident	81 Å²	81	82.4 Å²	82.4	43%	0.433	42%	0.418	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.3	-9.5	167.7	-67.6	-50.4	0	0	0	113.5	K712 N762	K712-D764 WeakPolarHBondContact CE-OD1 3.38Å; K712-D764 IonicContact NZ-OD1 2.65Å; K712-D764 PolarHBondContact NZ-OD1 3.4Å; K712-D764 IonicContact NZ-OD2 2.74Å; K712-D764 PolarHBondContact NZ-OD2 2.89Å; N762-D764 PolarHBondContact O-N 2.89Å; N762-D764 WeakPolarHBondContact OD1-CB 3.3Å; N762-D764 PolarHBondContact OD1-N 3.31Å; N762-D764 VanDerWaalsContact OD1-N 3.13Å
765	E	85.8	Confident	78.3	Confident	91 Å²	91	76.4 Å²	76.4	43%	0.425	39%	0.386	S	S	.	.	S	Bend	trans	-68.3	149.2	-179.1	-66.8	169.6	-177.3	0	0	112.4	N762 E767 W768	N762-E765 HydrophobicContact CB-CG 4.15Å; N762-E765 WeakPolarHBondContact O-CG 3.42Å; N762-E765 PolarHBondContact O-N 2.88Å; E765-E767 PolarHBondContact O-N 3.44Å; E765-E767 VanDerWaalsContact O-N 3.1Å; E765-W768 PolarHBondContact O-N 2.84Å
766	S	84.1	Confident	81	Confident	94 Å²	94	68.7 Å²	68.7	66%	0.657	35%	0.348	S	S	*	.	G	3₁₀ helix	trans	-61.4	-21.1	-179.3	178	0	0	0	0	113.2	W768 E769	S766-W768 PolarHBondContact O-N 3.31Å; S766-E769 WeakPolarHBondContact O-CB 3.24Å; S766-E769 PolarHBondContact O-N 3.27Å; S766-E769 PolarHBondContact OG-OE2 3.09Å
767	E	81.1	Confident	83.8	Confident	108 Å²	108	62.5 Å²	62.5	51%	0.505	31%	0.311	S	S	.	.	G	3₁₀ helix	trans	-61.2	-23.4	171.1	-62.2	-148.3	124.7	0	0	113.5	K732 E765	K732-E767 IonicContact NZ-OE1 2.99Å; K732-E767 PolarHBondContact NZ-OE1 2.94Å; K732-E767 IonicContact NZ-OE2 3.38Å; K732-E767 PolarHBondContact NZ-OE2 3.07Å; E765-E767 PolarHBondContact O-N 3.44Å; E765-E767 VanDerWaalsContact O-N 3.1Å
768	W	90.6	Very high	86.5	Confident	4 Å²	4	54.2 Å²	54.2	2%	0.015	27%	0.272	C	S	.	.	G	3₁₀ helix	trans	-114.8	14.8	-176.4	-42	115.3	0	0	0	112.6	R713 V729 K732 L733 L736 N762 L763 E765 S766 D770 V773	R713-W768 PolarHBondContact NH2-O 2.98Å; V729-W768 HydrophobicContact CG1-CE3 4.04Å; V729-W768 HydrophobicContact CG1-CZ3 3.75Å; K732-W768 HydrophobicContact CB-CH2 4.37Å; K732-W768 HydrophobicContact CD-CH2 3.9Å; K732-W768 HydrophobicContact CG-CH2 4.16Å; L733-W768 HydrophobicContact CB-CE3 4.08Å; L733-W768 HydrophobicContact CB-CH2 3.99Å; L733-W768 HydrophobicContact CB-CZ3 3.56Å; L733-W768 HydrophobicContact CD1-CD2 4.15Å; L733-W768 HydrophobicContact CD1-CE3 4.12Å; L733-W768 HydrophobicContact CD1-CH2 4.09Å; L733-W768 HydrophobicContact CD1-CZ2 4.13Å; L733-W768 HydrophobicContact CD1-CZ3 4.1Å; L733-W768 HydrophobicContact CD2-CE3 4.27Å; L733-W768 HydrophobicContact CG-CE3 4.39Å; L733-W768 HydrophobicContact CG-CZ3 4.28Å; L736-W768 HydrophobicContact CD1-CH2 3.7Å; L736-W768 HydrophobicContact CD1-CZ2 3.51Å; N762-W768 VanDerWaalsContact O-CD1 3.31Å; L763-W768 HydrophobicContact CD2-CB 4.46Å; L763-W768 HydrophobicContact CD2-CG 4.19Å; E765-W768 PolarHBondContact O-N 2.84Å; S766-W768 PolarHBondContact O-N 3.31Å; W768-D770 VanDerWaalsContact C-N 3.26Å; W768-D770 PolarHBondContact O-N 2.92Å; W768-V773 HydrophobicContact CE3-CG1 4.22Å
769	E	89.9	Confident	88.9	Confident	141 Å²	141	50.8 Å²	50.8	66%	0.659	26%	0.255	S	S	*	.			trans	-53.3	-40.3	-175	-170.8	174.7	163.2	0	0	112.6	R713 S766 I771	R713-E769 PolarHBondContact NH1-O 3.04Å; S766-E769 WeakPolarHBondContact O-CB 3.24Å; S766-E769 PolarHBondContact O-N 3.27Å; S766-E769 PolarHBondContact OG-OE2 3.09Å; E769-I771 PolarHBondContact O-N 2.8Å
770	D	95.3	Very high	91.1	Very high	64 Å²	64	42.3 Å²	42.3	34%	0.342	22%	0.216	S	C	.	.			trans	-65.1	104.5	170.2	176.8	16	0	0	0	111.6	G725 W768 H772 V773	G725-D770 WeakPolarHBondContact CA-OD2 3.13Å; W768-D770 VanDerWaalsContact C-N 3.26Å; W768-D770 PolarHBondContact O-N 2.92Å; D770-H772 PolarHBondContact O-N 3.14Å; D770-H772 VanDerWaalsContact O-N 3.14Å; D770-H772 WeakPolarHBondContact OD1-CA 3.25Å; D770-H772 WeakPolarHBondContact OD1-CB 3.3Å; D770-H772 IonicContact OD1-CD2 3.91Å; D770-H772 PolarHBondContact OD1-CD2 2.67Å; D770-H772 VanDerWaalsContact OD1-CD2 3.27Å; D770-H772 IonicContact OD1-CG 3.26Å; D770-H772 PolarHBondContact OD1-N 3.27Å; D770-V773 HydrophobicContact CB-CG2 4.02Å; D770-V773 VanDerWaalsContact O-CB 3.29Å; D770-V773 WeakPolarHBondContact O-CB 3.43Å; D770-V773 PolarHBondContact O-N 2.94Å
771	I	97.6	Very high	92.7	Very high	10 Å²	10	36 Å²	36	5%	0.051	19%	0.189	C	C	.	.	H	α-helix	trans	-64.3	-17.7	177.4	-161.6	67.1	0	0	0	113.1	V710 R713 T717 I720 E769 V773 V774 T775	V710-I771 HydrophobicContact CG2-CD1 3.88Å; V710-I771 HydrophobicContact CG2-CG1 4.13Å; R713-I771 HydrophobicContact CG-CD1 4.25Å; T717-I771 HydrophobicContact CG2-CG2 4.1Å; I720-I771 HydrophobicContact CD1-CG1 3.92Å; I720-I771 HydrophobicContact CD1-CG2 3.83Å; E769-I771 PolarHBondContact O-N 2.8Å; I771-V773 VanDerWaalsContact C-N 3.26Å; I771-V773 PolarHBondContact O-N 3.28Å; I771-V774 HydrophobicContact CD1-CB 4.05Å; I771-V774 HydrophobicContact CD1-CG1 4.48Å; I771-V774 HydrophobicContact CD1-CG2 4.19Å; I771-V774 PolarHBondContact O-N 2.97Å; I771-T775 PolarHBondContact O-N 3.23Å; I771-T775 PolarHBondContact O-OG1 3.1Å
772	H	98.2	Very high	93.5	Very high	30 Å²	30	35.1 Å²	35.1	14%	0.139	18%	0.184	C	C	.	.	H	α-helix	trans	-74.1	-17.4	172.4	-51.3	-62.3	0	0	0	112.5	V723 G725 D770 T775 G776	V723-H772 HydrophobicContact CG1-CB 4.27Å; G725-H772 VanDerWaalsContact CA-C 3.47Å; G725-H772 WeakPolarHBondContact CA-O 3.37Å; G725-H772 PolarHBondContact N-O 3.36Å; G725-H772 VanDerWaalsContact N-O 3.12Å; D770-H772 PolarHBondContact O-N 3.14Å; D770-H772 VanDerWaalsContact O-N 3.14Å; D770-H772 WeakPolarHBondContact OD1-CA 3.25Å; D770-H772 WeakPolarHBondContact OD1-CB 3.3Å; D770-H772 IonicContact OD1-CD2 3.91Å; D770-H772 PolarHBondContact OD1-CD2 2.67Å; D770-H772 VanDerWaalsContact OD1-CD2 3.27Å; D770-H772 IonicContact OD1-CG 3.26Å; D770-H772 PolarHBondContact OD1-N 3.27Å; H772-T775 WeakPolarHBondContact CA-OG1 3.37Å; H772-G776 WeakPolarHBondContact O-CA 3.42Å; H772-G776 PolarHBondContact O-N 2.84Å
773	V	97.9	Very high	94.1	Very high	3 Å²	3	38.5 Å²	38.5	2%	0.018	19%	0.192	C	C	.	.	H	α-helix	trans	-70.3	-49.4	164.7	172.2	0	0	0	0	110.1	V729 I730 L733 W768 D770 I771 G776 A777	V729-V773 HydrophobicContact CB-CG1 4.34Å; V729-V773 HydrophobicContact CB-CG2 3.92Å; V729-V773 HydrophobicContact CG1-CG1 3.94Å; V729-V773 HydrophobicContact CG1-CG2 3.95Å; I730-V773 HydrophobicContact CG1-CB 4.22Å; I730-V773 HydrophobicContact CG1-CG1 3.9Å; I730-V773 HydrophobicContact CG1-CG2 4.36Å; L733-V773 HydrophobicContact CD2-CG1 4.18Å; W768-V773 HydrophobicContact CE3-CG1 4.22Å; D770-V773 HydrophobicContact CB-CG2 4.02Å; D770-V773 VanDerWaalsContact O-CB 3.29Å; D770-V773 WeakPolarHBondContact O-CB 3.43Å; D770-V773 PolarHBondContact O-N 2.94Å; I771-V773 VanDerWaalsContact C-N 3.26Å; I771-V773 PolarHBondContact O-N 3.28Å; V773-G776 CarbonylContact O-C 3.53Å; V773-G776 WeakPolarHBondContact O-CA 3.15Å; V773-G776 PolarHBondContact O-N 3.06Å; V773-G776 VanDerWaalsContact O-N 3.16Å; V773-A777 WeakPolarHBondContact O-CB 3.43Å; V773-A777 PolarHBondContact O-N 3.19Å
774	V	98.1	Very high	94.3	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-61.4	-52.6	-178.9	-180	0	0	0	0	111	C706 A709 V710 L763 I771 G776 A777 L778	C706-V774 HydrophobicContact CB-CG1 3.93Å; A709-V774 HydrophobicContact CB-CG1 4.27Å; V710-V774 HydrophobicContact CG2-CG1 4.19Å; L763-V774 HydrophobicContact CD1-CG1 4.02Å; L763-V774 HydrophobicContact CD2-CG2 4.39Å; I771-V774 HydrophobicContact CD1-CB 4.05Å; I771-V774 HydrophobicContact CD1-CG1 4.48Å; I771-V774 HydrophobicContact CD1-CG2 4.19Å; I771-V774 PolarHBondContact O-N 2.97Å; V774-G776 PolarHBondContact O-N 3.21Å; V774-A777 PolarHBondContact O-N 3.46Å; V774-L778 PolarHBondContact O-N 3.23Å
775	T	98.5	Very high	94.8	Very high	0 Å²	0	37 Å²	37	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-63.8	-31.3	175.1	55.2	0	0	0	0	112.5	V710 I720 Y721 I771 H772 K779	V710-T775 HydrophobicContact CG1-CG2 4.35Å; V710-T775 HydrophobicContact CG2-CG2 3.5Å; I720-T775 HydrophobicContact CD1-CG2 3.59Å; I720-T775 HydrophobicContact CG1-CG2 4.11Å; Y721-T775 HydrophobicContact CD1-CG2 3.67Å; Y721-T775 HydrophobicContact CD2-CG2 4.19Å; Y721-T775 HydrophobicContact CE1-CG2 3.45Å; Y721-T775 VanDerWaalsContact CE1-CG2 3.45Å; Y721-T775 HydrophobicContact CE2-CG2 4.01Å; Y721-T775 HydrophobicContact CG-CG2 4.03Å; I771-T775 PolarHBondContact O-N 3.23Å; I771-T775 PolarHBondContact O-OG1 3.1Å; H772-T775 WeakPolarHBondContact CA-OG1 3.37Å; T775-K779 WeakPolarHBondContact O-CB 3.4Å; T775-K779 WeakPolarHBondContact O-CE 3.48Å; T775-K779 VanDerWaalsContact O-CG 3.3Å; T775-K779 WeakPolarHBondContact O-CG 3.45Å; T775-K779 PolarHBondContact O-N 3.04Å; T775-K779 VanDerWaalsContact O-N 3.09Å
776	G	98.4	Very high	95.1	Very high	9 Å²	9	35.8 Å²	35.8	9%	0.093	18%	0.182	C	C	.	.	H	α-helix	trans	-63.8	-44.4	173.1	0	0	0	0	0	113.2	H772 V773 V774 L780	H772-G776 WeakPolarHBondContact O-CA 3.42Å; H772-G776 PolarHBondContact O-N 2.84Å; V773-G776 CarbonylContact O-C 3.53Å; V773-G776 WeakPolarHBondContact O-CA 3.15Å; V773-G776 PolarHBondContact O-N 3.06Å; V773-G776 VanDerWaalsContact O-N 3.16Å; V774-G776 PolarHBondContact O-N 3.21Å; G776-L780 WeakPolarHBondContact O-CB 3.39Å; G776-L780 PolarHBondContact O-N 3.39Å
777	A	97.9	Very high	95.6	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-71.8	-37.5	178.3	0	0	0	0	0	112.3	F702 I730 L733 V773 V774 L780 F781	F702-A777 HydrophobicContact CZ-CB 3.88Å; I730-A777 HydrophobicContact CG2-CB 4.12Å; L733-A777 HydrophobicContact CD2-CB 3.76Å; L733-A777 HydrophobicContact CG-CB 4.35Å; V773-A777 WeakPolarHBondContact O-CB 3.43Å; V773-A777 PolarHBondContact O-N 3.19Å; V774-A777 PolarHBondContact O-N 3.46Å; A777-L780 WeakPolarHBondContact O-CB 3.42Å; A777-L780 PolarHBondContact O-N 3.43Å; A777-L780 VanDerWaalsContact O-N 3.17Å; A777-F781 PolarHBondContact O-N 3.02Å
778	L	98.6	Very high	96.3	Very high	0 Å²	0	29 Å²	29	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-63.3	-44.6	173.5	-175.1	57.1	0	0	0	112.1	V703 C706 T707 Y721 V774 L780 F781 F782 M832	V703-L778 HydrophobicContact CB-CD1 4.24Å; V703-L778 HydrophobicContact CG1-CD1 4.26Å; V703-L778 HydrophobicContact CG2-CD1 3.97Å; C706-L778 HydrophobicContact CB-CB 3.92Å; C706-L778 HydrophobicContact CB-CD1 4.01Å; C706-L778 HydrophobicContact CB-CD2 3.8Å; C706-L778 HydrophobicContact CB-CG 4.12Å; T707-L778 HydrophobicContact CG2-CD2 3.93Å; Y721-L778 HydrophobicContact CE1-CD2 4.18Å; Y721-L778 WeakPolarHBondContact OH-CD2 3.44Å; V774-L778 PolarHBondContact O-N 3.23Å; L778-L780 VanDerWaalsContact C-N 3.29Å; L778-L780 PolarHBondContact O-N 2.83Å; L778-F781 PolarHBondContact O-N 2.92Å; L778-F782 HydrophobicContact CD1-CD2 4.36Å; L778-F782 HydrophobicContact CD1-CE2 3.65Å; L778-F782 HydrophobicContact CD1-CZ 4.39Å; L778-F782 HydrophobicContact CG-CE2 4.04Å; L778-F782 VanDerWaalsContact O-CD2 3.26Å; L778-F782 WeakPolarHBondContact O-CD2 3.25Å; L778-F782 PolarHBondContact O-N 3.35Å; L778-M832 HydrophobicContact CD2-CE 4.02Å; L778-M832 HydrophobicContact CD2-SD 4.1Å; L778-M832 HydrophobicContact CG-CE 4.5Å
779	K	98.4	Very high	96.7	Very high	20 Å²	20	28.9 Å²	28.9	9%	0.087	14%	0.139	C	C	.	.	H	α-helix	trans	-61.9	-36	171.4	-72.4	176.7	-67.7	176.5	0	112.2	Y721 V723 T775 R783 V856 F857 T860	Y721-K779 HydrophobicContact CD1-CD 4.31Å; Y721-K779 HydrophobicContact CD1-CG 4.29Å; Y721-K779 PolarHBondContact O-NZ 3.49Å; V723-K779 PolarHBondContact O-NZ 3.18Å; T775-K779 WeakPolarHBondContact O-CB 3.4Å; T775-K779 WeakPolarHBondContact O-CE 3.48Å; T775-K779 VanDerWaalsContact O-CG 3.3Å; T775-K779 WeakPolarHBondContact O-CG 3.45Å; T775-K779 PolarHBondContact O-N 3.04Å; T775-K779 VanDerWaalsContact O-N 3.09Å; K779-R783 WeakPolarHBondContact O-CB 3.43Å; K779-R783 PolarHBondContact O-N 2.81Å; K779-V856 HydrophobicContact CD-CG1 3.71Å; K779-F857 HydrophobicContact CG-CZ 4.35Å; K779-T860 HydrophobicContact CB-CG2 4.43Å
780	L	97.6	Very high	97	Very high	8 Å²	8	22.2 Å²	22.2	4%	0.042	11%	0.108	C	C	.	.	H	α-helix	trans	-66.6	-39.9	177.7	-175.3	66.9	0	0	0	111.8	F684 I730 R734 G776 A777 L778 R783 E784	F684-L780 HydrophobicContact CD1-CG 4.35Å; F684-L780 HydrophobicContact CE1-CB 4.14Å; F684-L780 HydrophobicContact CE1-CD2 4.17Å; F684-L780 HydrophobicContact CE1-CG 4.05Å; I730-L780 HydrophobicContact CG2-CD2 3.77Å; R734-L780 HydrophobicContact CG-CD2 4.43Å; G776-L780 WeakPolarHBondContact O-CB 3.39Å; G776-L780 PolarHBondContact O-N 3.39Å; A777-L780 WeakPolarHBondContact O-CB 3.42Å; A777-L780 PolarHBondContact O-N 3.43Å; A777-L780 VanDerWaalsContact O-N 3.17Å; L778-L780 VanDerWaalsContact C-N 3.29Å; L778-L780 PolarHBondContact O-N 2.83Å; L780-R783 PolarHBondContact O-N 2.84Å; L780-E784 HydrophobicContact CD1-CG 4.04Å; L780-E784 WeakPolarHBondContact CD1-OE1 3.28Å; L780-E784 HydrophobicContact CG-CG 4.27Å; L780-E784 WeakPolarHBondContact O-CB 3.39Å; L780-E784 PolarHBondContact O-N 2.78Å
781	F	98.1	Very high	97	Very high	0 Å²	0	19.6 Å²	19.6	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-56.3	-56.6	178.3	171.7	-98.2	0	0	0	111.5	V683 F684 L691 P700 F702 V703 A777 L778 R783 E784 L785	V683-F781 HydrophobicContact CG1-CD2 4.42Å; V683-F781 HydrophobicContact CG1-CE2 4.02Å; F684-F781 HydrophobicContact CD1-CB 4.2Å; F684-F781 HydrophobicContact CE1-CB 3.75Å; F684-F781 HydrophobicContact CZ-CB 4.14Å; L691-F781 HydrophobicContact CD2-CE2 3.74Å; L691-F781 HydrophobicContact CD2-CZ 3.73Å; P700-F781 HydrophobicContact CB-CZ 4.18Å; P700-F781 HydrophobicContact CG-CE1 4.29Å; P700-F781 HydrophobicContact CG-CZ 3.94Å; F702-F781 HydrophobicContact CD1-CB 4.12Å; F702-F781 HydrophobicContact CD1-CD2 4.13Å; F702-F781 HydrophobicContact CD1-CG 4.12Å; F702-F781 HydrophobicContact CE1-CB 3.94Å; F702-F781 HydrophobicContact CE1-CG 4.44Å; V703-F781 HydrophobicContact CG2-CD1 3.76Å; V703-F781 HydrophobicContact CG2-CE1 3.52Å; V703-F781 HydrophobicContact CG2-CZ 4.33Å; A777-F781 PolarHBondContact O-N 3.02Å; L778-F781 PolarHBondContact O-N 2.92Å; F781-R783 VanDerWaalsContact C-N 3.28Å; F781-R783 PolarHBondContact O-N 3.24Å; F781-E784 PolarHBondContact O-N 3.24Å; F781-E784 VanDerWaalsContact O-N 3.13Å; F781-L785 HydrophobicContact CE1-CD2 4.17Å; F781-L785 HydrophobicContact CE2-CD2 4.25Å; F781-L785 HydrophobicContact CZ-CD2 3.89Å; F781-L785 PolarHBondContact O-N 2.78Å; F781-L785 VanDerWaalsContact O-N 3.08Å
782	F	98.3	Very high	96.9	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-60.7	-35	178.7	-68.1	-64.7	0	0	0	113.4	V703 L778 L785 L789 T828 M832 T860 L861	V703-F782 HydrophobicContact CG1-CZ 4.09Å; V703-F782 HydrophobicContact CG2-CE1 4.34Å; V703-F782 HydrophobicContact CG2-CE2 4.35Å; V703-F782 HydrophobicContact CG2-CZ 3.74Å; L778-F782 HydrophobicContact CD1-CD2 4.36Å; L778-F782 HydrophobicContact CD1-CE2 3.65Å; L778-F782 HydrophobicContact CD1-CZ 4.39Å; L778-F782 HydrophobicContact CG-CE2 4.04Å; L778-F782 VanDerWaalsContact O-CD2 3.26Å; L778-F782 WeakPolarHBondContact O-CD2 3.25Å; L778-F782 PolarHBondContact O-N 3.35Å; F782-L785 HydrophobicContact CD1-CD1 3.99Å; F782-L789 HydrophobicContact CD1-CB 4.2Å; F782-L789 HydrophobicContact CD1-CD2 4.18Å; F782-L789 HydrophobicContact CE1-CD1 4.41Å; F782-L789 HydrophobicContact CE1-CD2 3.85Å; F782-T828 HydrophobicContact CE1-CG2 3.72Å; F782-T828 HydrophobicContact CZ-CG2 4Å; F782-M832 HydrophobicContact CE1-CG 4.45Å; F782-M832 HydrophobicContact CE2-CE 3.92Å; F782-M832 HydrophobicContact CE2-CG 3.89Å; F782-M832 HydrophobicContact CE2-SD 3.67Å; F782-M832 HydrophobicContact CZ-CG 3.52Å; F782-M832 HydrophobicContact CZ-SD 3.79Å; F782-T860 HydrophobicContact CB-CG2 3.87Å; F782-L861 HydrophobicContact CB-CD2 4.3Å; F782-L861 HydrophobicContact CD1-CD2 4.23Å; F782-L861 HydrophobicContact CD2-CD2 4.16Å; F782-L861 HydrophobicContact CG-CD2 3.97Å
783	R	96.7	Very high	96.7	Very high	137 Å²	137	23.7 Å²	23.7	52%	0.517	13%	0.13	S	C	.	.	H	α-helix	trans	-72.5	-31.9	176.8	-171.6	172.7	63.5	-134.4	0.4	113.2	K779 L780 F781	K779-R783 WeakPolarHBondContact O-CB 3.43Å; K779-R783 PolarHBondContact O-N 2.81Å; L780-R783 PolarHBondContact O-N 2.84Å; F781-R783 VanDerWaalsContact C-N 3.28Å; F781-R783 PolarHBondContact O-N 3.24Å
784	E	94.9	Very high	96.5	Very high	57 Å²	57	25.4 Å²	25.4	27%	0.266	14%	0.137	S	C	.	.	H	α-helix	trans	-85.2	-13.8	178.2	-74.6	-169.6	-164.3	0	0	114	G685 R734 L780 F781	G685-E784 WeakPolarHBondContact CA-O 3.18Å; R734-E784 IonicContact CZ-OE2 3.96Å; R734-E784 IonicContact NE-OE1 3.12Å; R734-E784 PolarHBondContact NE-OE1 2.86Å; R734-E784 IonicContact NE-OE2 2.74Å; R734-E784 PolarHBondContact NE-OE2 2.9Å; R734-E784 IonicContact NH2-OE2 2.77Å; R734-E784 PolarHBondContact NH2-OE2 3.12Å; L780-E784 HydrophobicContact CD1-CG 4.04Å; L780-E784 WeakPolarHBondContact CD1-OE1 3.28Å; L780-E784 HydrophobicContact CG-CG 4.27Å; L780-E784 WeakPolarHBondContact O-CB 3.39Å; L780-E784 PolarHBondContact O-N 2.78Å; F781-E784 PolarHBondContact O-N 3.24Å; F781-E784 VanDerWaalsContact O-N 3.13Å
785	L	94.8	Very high	96.3	Very high	2 Å²	2	26 Å²	26	1%	0.01	14%	0.14	C	C	.	.	S	Bend	trans	-50.9	134.9	170.3	-66.1	177.4	0	0	0	110.3	C686 F781 F782 E787 R863	C686-L785 WeakPolarHBondContact O-CD2 3.11Å; F781-L785 HydrophobicContact CE1-CD2 4.17Å; F781-L785 HydrophobicContact CE2-CD2 4.25Å; F781-L785 HydrophobicContact CZ-CD2 3.89Å; F781-L785 PolarHBondContact O-N 2.78Å; F781-L785 VanDerWaalsContact O-N 3.08Å; F782-L785 HydrophobicContact CD1-CD1 3.99Å; L785-E787 WeakPolarHBondContact CB-O 3.48Å; L785-E787 PolarHBondContact O-N 3Å; L785-R863 PolarHBondContact O-NH2 2.8Å
786	P	92.1	Very high	96	Very high	65 Å²	65	29.8 Å²	29.8	42%	0.422	16%	0.163	S	C	.	.	S	Bend	trans	-57.8	-34.6	-179.9	-26.8	35.6	0	0	0	113.5	G685 C686 R687 Y792 R863	G685-P786 WeakPolarHBondContact O-CG 3.36Å; C686-P786 WeakPolarHBondContact O-CD 3.38Å; R687-P786 HydrophobicContact CG-CB 4.33Å; R687-P786 HydrophobicContact CG-CG 4.04Å; P786-Y792 PolarHBondContact O-OH 2.96Å; P786-R863 PolarHBondContact O-NH2 3.29Å
787	E	94	Very high	95.8	Very high	59 Å²	59	32 Å²	32	28%	0.276	17%	0.173	S	C	.	.	S	Bend	trans	-120.7	138.3	173.9	177.6	161.7	-151.4	0	0	108.2	R687 L785 P791 Y792	R687-E787 IonicContact NH2-OE2 3.98Å; L785-E787 WeakPolarHBondContact CB-O 3.48Å; L785-E787 PolarHBondContact O-N 3Å; E787-P791 HydrophobicContact CG-CB 4.44Å; E787-P791 WeakPolarHBondContact OE1-CB 3.24Å; E787-Y792 HydrophobicContact CB-CD2 4.37Å; E787-Y792 HydrophobicContact CB-CE2 3.99Å; E787-Y792 HydrophobicContact CG-CD2 3.76Å; E787-Y792 HydrophobicContact CG-CE2 3.85Å; E787-Y792 PolarHBondContact OE1-N 3.04Å; E787-Y792 VanDerWaalsContact OE1-N 3.17Å
788	P	96.8	Very high	95.6	Very high	1 Å²	1	32.1 Å²	32.1	1%	0.006	17%	0.173	C	C	.	.			trans	-55.8	161.8	175.8	19.8	-32	0	0	0	113.6	V790 Y792 L861 R863	P788-V790 VanDerWaalsContact C-N 3.28Å; P788-V790 WeakPolarHBondContact CB-O 3.44Å; P788-V790 WeakPolarHBondContact CG-O 3.44Å; P788-V790 CarbonylContact O-C 3.44Å; P788-V790 PolarHBondContact O-N 2.76Å; P788-Y792 WeakPolarHBondContact CD-OH 3.29Å; P788-Y792 HydrophobicContact CG-CD1 3.9Å; P788-Y792 HydrophobicContact CG-CE1 3.7Å; P788-Y792 HydrophobicContact CG-CG 4.46Å; P788-L861 WeakPolarHBondContact CB-O 3.44Å; P788-R863 HydrophobicContact CB-CG 4.07Å; P788-R863 HydrophobicContact CG-CG 3.86Å
789	L	98	Very high	95.4	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	18%	0.175	C	C	.	.	S	Bend	trans	-60.7	-39.8	177.9	178.3	60.3	0	0	0	111.6	L688 F782 P791 N825 T828 L829 L861	L688-L789 HydrophobicContact CD2-CD1 3.61Å; F782-L789 HydrophobicContact CD1-CB 4.2Å; F782-L789 HydrophobicContact CD1-CD2 4.18Å; F782-L789 HydrophobicContact CE1-CD1 4.41Å; F782-L789 HydrophobicContact CE1-CD2 3.85Å; L789-P791 WeakPolarHBondContact O-CD 3.43Å; L789-N825 WeakPolarHBondContact O-CB 3.27Å; L789-N825 PolarHBondContact O-ND2 2.89Å; L789-T828 HydrophobicContact CD1-CG2 3.75Å; L789-T828 HydrophobicContact CD2-CG2 4.23Å; L789-L829 HydrophobicContact CD2-CB 4.04Å; L789-L829 HydrophobicContact CD2-CD1 3.95Å; L789-L829 HydrophobicContact CG-CB 4.28Å; L789-L829 HydrophobicContact CG-CD1 4.48Å; L789-L861 HydrophobicContact CB-CD2 4.42Å; L789-L861 HydrophobicContact CD2-CD2 3.85Å; L789-L861 PolarHBondContact N-O 2.57Å; L789-L861 VanDerWaalsContact N-O 3.11Å
790	V	97.3	Very high	95.1	Very high	1 Å²	1	36.7 Å²	36.7	1%	0.006	20%	0.195	C	C	.	.	S	Bend	trans	-84.6	111	163.4	172.2	0	0	0	0	107.5	P788 F794 I798 M821 L829 L861 M862	P788-V790 VanDerWaalsContact C-N 3.28Å; P788-V790 WeakPolarHBondContact CB-O 3.44Å; P788-V790 WeakPolarHBondContact CG-O 3.44Å; P788-V790 CarbonylContact O-C 3.44Å; P788-V790 PolarHBondContact O-N 2.76Å; V790-F794 HydrophobicContact CG1-CB 4.14Å; V790-I798 HydrophobicContact CG1-CD1 3.53Å; V790-M821 HydrophobicContact CB-CE 4.45Å; V790-M821 HydrophobicContact CG1-CE 3.91Å; V790-M821 HydrophobicContact CG2-CE 4.18Å; V790-L829 HydrophobicContact CG2-CD2 4.3Å; V790-L861 PolarHBondContact N-O 2.86Å; V790-M862 HydrophobicContact CB-CB 3.95Å; V790-M862 HydrophobicContact CG1-CB 4.36Å; V790-M862 HydrophobicContact CG2-CB 4.35Å; V790-M862 HydrophobicContact CG2-CE 4.18Å
791	P	95.9	Very high	95	Very high	9 Å²	9	36.5 Å²	36.5	6%	0.058	19%	0.194	C	C	.	.			trans	-63.1	155.7	-171.7	-16.9	27.9	0	0	0	112.6	E787 L789 G793 F794 N825	E787-P791 HydrophobicContact CG-CB 4.44Å; E787-P791 WeakPolarHBondContact OE1-CB 3.24Å; L789-P791 WeakPolarHBondContact O-CD 3.43Å; P791-G793 PolarHBondContact O-N 2.86Å; P791-G793 VanDerWaalsContact O-N 3.12Å; P791-F794 HydrophobicContact CB-CD2 3.92Å; P791-F794 HydrophobicContact CB-CE2 4.34Å; P791-F794 HydrophobicContact CG-CD2 3.87Å; P791-F794 HydrophobicContact CG-CE2 4.1Å; P791-F794 PolarHBondContact O-N 2.79Å; P791-N825 HydrophobicContact CG-CB 4.47Å
792	Y	94.1	Very high	94.9	Very high	59 Å²	59	37.3 Å²	37.3	23%	0.231	20%	0.2	C	C	.	.	H	α-helix	trans	-57.8	-35.7	-172.2	-66.6	-64.1	0	0	0	112.8	P786 E787 P788 F794 F795 R863 E865	P786-Y792 PolarHBondContact O-OH 2.96Å; E787-Y792 HydrophobicContact CB-CD2 4.37Å; E787-Y792 HydrophobicContact CB-CE2 3.99Å; E787-Y792 HydrophobicContact CG-CD2 3.76Å; E787-Y792 HydrophobicContact CG-CE2 3.85Å; E787-Y792 PolarHBondContact OE1-N 3.04Å; E787-Y792 VanDerWaalsContact OE1-N 3.17Å; P788-Y792 WeakPolarHBondContact CD-OH 3.29Å; P788-Y792 HydrophobicContact CG-CD1 3.9Å; P788-Y792 HydrophobicContact CG-CE1 3.7Å; P788-Y792 HydrophobicContact CG-CG 4.46Å; Y792-F794 PolarHBondContact O-N 3.34Å; Y792-F795 WeakPolarHBondContact O-CB 3.47Å; Y792-F795 PolarHBondContact O-N 3.05Å; Y792-F795 VanDerWaalsContact O-N 3.16Å; Y792-R863 WeakPolarHBondContact CD1-O 3.43Å; Y792-R863 HydrophobicContact CE1-CG 4.13Å; Y792-R863 PolarHBondContact OH-NH2 2.89Å; Y792-E865 HydrophobicContact CD1-CB 3.76Å; Y792-E865 HydrophobicContact CD1-CG 4.39Å; Y792-E865 HydrophobicContact CD2-CG 4.44Å; Y792-E865 HydrophobicContact CE1-CB 4.24Å; Y792-E865 HydrophobicContact CG-CB 3.96Å; Y792-E865 HydrophobicContact CG-CG 4.29Å
793	G	93.4	Very high	94.6	Very high	67 Å²	67	42.2 Å²	42.2	69%	0.691	22%	0.221	S	C	*	.	H	α-helix	trans	-64.3	-18.9	177.9	0	0	0	0	0	115.5	P791	P791-G793 PolarHBondContact O-N 2.86Å; P791-G793 VanDerWaalsContact O-N 3.12Å
794	F	94.9	Very high	94.5	Very high	40 Å²	40	38.9 Å²	38.9	18%	0.175	21%	0.212	C	C	.	.	H	α-helix	trans	-96.3	-11	176.9	-64.3	-97.2	0	0	0	112.7	V790 P791 Y792 T796 I798 L817 N820 M821	V790-F794 HydrophobicContact CG1-CB 4.14Å; P791-F794 HydrophobicContact CB-CD2 3.92Å; P791-F794 HydrophobicContact CB-CE2 4.34Å; P791-F794 HydrophobicContact CG-CD2 3.87Å; P791-F794 HydrophobicContact CG-CE2 4.1Å; P791-F794 PolarHBondContact O-N 2.79Å; Y792-F794 PolarHBondContact O-N 3.34Å; F794-T796 PolarHBondContact O-N 2.89Å; F794-I798 HydrophobicContact CB-CD1 4.04Å; F794-I798 WeakPolarHBondContact O-CB 3.29Å; F794-I798 VanDerWaalsContact O-CG1 3.3Å; F794-I798 WeakPolarHBondContact O-CG1 3.04Å; F794-I798 PolarHBondContact O-N 2.95Å; F794-L817 HydrophobicContact CD1-CD2 4.33Å; F794-L817 WeakPolarHBondContact CE1-O 3.25Å; F794-N820 HydrophobicContact CE1-CB 4.09Å; F794-N820 VanDerWaalsContact CZ-O 3.31Å; F794-N820 WeakPolarHBondContact CZ-O 3.49Å; F794-M821 HydrophobicContact CB-CE 4.17Å; F794-M821 HydrophobicContact CD1-CE 4.29Å; F794-M821 HydrophobicContact CD1-CG 4.08Å; F794-M821 HydrophobicContact CD2-CG 4.38Å; F794-M821 HydrophobicContact CE1-CG 4Å; F794-M821 HydrophobicContact CE2-CG 4.31Å; F794-M821 HydrophobicContact CG-CE 4.23Å; F794-M821 HydrophobicContact CG-CG 4.28Å; F794-M821 HydrophobicContact CZ-CG 4.14Å
795	F	92.9	Very high	94.4	Very high	12 Å²	12	41.8 Å²	41.8	5%	0.053	24%	0.239	C	C	.	.	H	α-helix	trans	-61.2	-49.1	-171.9	-177.4	-92.8	0	0	0	112.4	Y792 V799 M862 P864 N874 Q878	Y792-F795 WeakPolarHBondContact O-CB 3.47Å; Y792-F795 PolarHBondContact O-N 3.05Å; Y792-F795 VanDerWaalsContact O-N 3.16Å; F795-V799 HydrophobicContact CD1-CG2 4.4Å; F795-V799 HydrophobicContact CE1-CG2 3.89Å; F795-V799 HydrophobicContact CE2-CG2 4.25Å; F795-V799 HydrophobicContact CZ-CG2 3.8Å; F795-V799 WeakPolarHBondContact O-CB 3.49Å; F795-V799 WeakPolarHBondContact O-CG2 3.34Å; F795-V799 PolarHBondContact O-N 2.83Å; F795-V799 VanDerWaalsContact O-N 3.07Å; F795-M862 HydrophobicContact CD2-CB 4.29Å; F795-M862 HydrophobicContact CE2-CB 4.42Å; F795-P864 HydrophobicContact CD1-CB 3.97Å; F795-P864 HydrophobicContact CE1-CB 3.74Å; F795-P864 HydrophobicContact CE1-CG 4.38Å; F795-P864 HydrophobicContact CZ-CB 4.18Å; F795-P864 HydrophobicContact CZ-CG 4.4Å; F795-N874 HydrophobicContact CZ-CB 4.41Å; F795-Q878 HydrophobicContact CE2-CG 3.75Å; F795-Q878 HydrophobicContact CZ-CG 4.04Å
796	T	92.2	Very high	94.5	Very high	79 Å²	79	45.6 Å²	45.6	49%	0.485	26%	0.259	S	S	.	.	H	α-helix	trans	-64.2	-51	-178.5	-52.5	0	0	0	0	110.9	F794 I798 V799 E800	F794-T796 PolarHBondContact O-N 2.89Å; T796-I798 VanDerWaalsContact C-N 3.32Å; T796-I798 PolarHBondContact O-N 2.7Å; T796-V799 CarbonylContact O-C 3.59Å; T796-V799 PolarHBondContact O-N 3.48Å; T796-V799 VanDerWaalsContact O-N 3.11Å; T796-E800 HydrophobicContact CG2-CG 4.44Å; T796-E800 WeakPolarHBondContact O-CG 3.32Å; T796-E800 PolarHBondContact O-N 2.81Å
797	D	94.6	Very high	94.5	Very high	57 Å²	57	46.5 Å²	46.5	31%	0.305	26%	0.257	S	S	.	.	H	α-helix	trans	-56.5	-41	178.6	-79.4	55.4	0	0	0	113.3	E800 T801 R813 L817	D797-E800 PolarHBondContact O-N 2.95Å; D797-T801 WeakPolarHBondContact O-CB 3.33Å; D797-T801 PolarHBondContact O-N 2.94Å; D797-T801 PolarHBondContact O-OG1 2.81Å; D797-R813 IonicContact OD2-CZ 2.8Å; D797-R813 IonicContact OD2-NH2 2.7Å; D797-R813 PolarHBondContact OD2-NH2 2.93Å; D797-L817 HydrophobicContact CB-CD1 3.77Å; D797-L817 HydrophobicContact CB-CD2 3.61Å; D797-L817 HydrophobicContact CB-CG 4.36Å
798	I	95.2	Very high	94.5	Very high	1 Å²	1	48.6 Å²	48.6	1%	0.005	27%	0.268	C	S	.	.	H	α-helix	trans	-67.8	-43.9	176.7	-70.9	168.4	0	0	0	110.5	V790 F794 T796 E800 T801 V802 L814 L817 M821 A881	V790-I798 HydrophobicContact CG1-CD1 3.53Å; F794-I798 HydrophobicContact CB-CD1 4.04Å; F794-I798 WeakPolarHBondContact O-CB 3.29Å; F794-I798 VanDerWaalsContact O-CG1 3.3Å; F794-I798 WeakPolarHBondContact O-CG1 3.04Å; F794-I798 PolarHBondContact O-N 2.95Å; T796-I798 VanDerWaalsContact C-N 3.32Å; T796-I798 PolarHBondContact O-N 2.7Å; I798-E800 VanDerWaalsContact C-N 3.3Å; I798-E800 PolarHBondContact O-N 2.69Å; I798-T801 WeakPolarHBondContact O-CB 3.5Å; I798-T801 PolarHBondContact O-N 2.88Å; I798-V802 WeakPolarHBondContact O-CG2 3.26Å; I798-V802 PolarHBondContact O-N 3.28Å; I798-L814 HydrophobicContact CG1-CD1 4.01Å; I798-L814 HydrophobicContact CG2-CD1 4.14Å; I798-L817 HydrophobicContact CG1-CB 4.34Å; I798-L817 HydrophobicContact CG1-CD1 3.91Å; I798-M821 HydrophobicContact CD1-CE 3.67Å; I798-A881 HydrophobicContact CG2-CB 3.72Å
799	V	92.4	Very high	94.4	Very high	6 Å²	6	53.2 Å²	53.2	4%	0.036	29%	0.293	C	S	.	.	H	α-helix	trans	-67.1	-29	177.2	167.2	0	0	0	0	112.2	F795 T796 K803 Y877	F795-V799 HydrophobicContact CD1-CG2 4.4Å; F795-V799 HydrophobicContact CE1-CG2 3.89Å; F795-V799 HydrophobicContact CE2-CG2 4.25Å; F795-V799 HydrophobicContact CZ-CG2 3.8Å; F795-V799 WeakPolarHBondContact O-CB 3.49Å; F795-V799 WeakPolarHBondContact O-CG2 3.34Å; F795-V799 PolarHBondContact O-N 2.83Å; F795-V799 VanDerWaalsContact O-N 3.07Å; T796-V799 CarbonylContact O-C 3.59Å; T796-V799 PolarHBondContact O-N 3.48Å; T796-V799 VanDerWaalsContact O-N 3.11Å; V799-K803 WeakPolarHBondContact O-CD 3.36Å; V799-K803 WeakPolarHBondContact O-CE 3.49Å; V799-K803 VanDerWaalsContact O-CG 3.3Å; V799-K803 WeakPolarHBondContact O-CG 3.34Å; V799-Y877 HydrophobicContact CG1-CD2 3.74Å; V799-Y877 HydrophobicContact CG1-CG 4.04Å
800	E	93.2	Very high	94.2	Very high	111 Å²	111	55 Å²	55	52%	0.519	30%	0.301	S	S	.	.	H	α-helix	trans	-76.6	-38.5	171	-72	-174.4	175.4	0	0	112.3	T796 D797 I798 V802 K803	T796-E800 HydrophobicContact CG2-CG 4.44Å; T796-E800 WeakPolarHBondContact O-CG 3.32Å; T796-E800 PolarHBondContact O-N 2.81Å; D797-E800 PolarHBondContact O-N 2.95Å; I798-E800 VanDerWaalsContact C-N 3.3Å; I798-E800 PolarHBondContact O-N 2.69Å; E800-V802 PolarHBondContact O-N 3.46Å; E800-K803 WeakPolarHBondContact O-CB 3.31Å; E800-K803 PolarHBondContact O-N 3.46Å; E800-K803 VanDerWaalsContact O-N 3.16Å
801	T	95.7	Very high	94.2	Very high	3 Å²	3	55 Å²	55	2%	0.018	30%	0.301	C	S	.	.	H	α-helix	trans	-58.1	-49.6	174.3	-57.9	0	0	0	0	110.9	D797 I798 K803 M804 K810 R813 L814 L817	D797-T801 WeakPolarHBondContact O-CB 3.33Å; D797-T801 PolarHBondContact O-N 2.94Å; D797-T801 PolarHBondContact O-OG1 2.81Å; I798-T801 WeakPolarHBondContact O-CB 3.5Å; I798-T801 PolarHBondContact O-N 2.88Å; T801-K803 PolarHBondContact O-N 2.77Å; T801-K803 VanDerWaalsContact O-N 3.08Å; T801-M804 HydrophobicContact CG2-SD 4.19Å; T801-M804 VanDerWaalsContact O-CB 3.3Å; T801-M804 WeakPolarHBondContact O-CB 3.35Å; T801-M804 WeakPolarHBondContact O-CG 3.42Å; T801-M804 PolarHBondContact O-N 3.32Å; T801-K810 WeakPolarHBondContact CG2-O 3.23Å; T801-K810 VanDerWaalsContact O-CG 3.29Å; T801-K810 WeakPolarHBondContact O-CG 3.32Å; T801-R813 HydrophobicContact CG2-CB 3.84Å; T801-R813 HydrophobicContact CG2-CG 3.78Å; T801-R813 VanDerWaalsContact OG1-CG 3.3Å; T801-R813 WeakPolarHBondContact OG1-CG 3.45Å; T801-L814 HydrophobicContact CG2-CB 4.03Å; T801-L817 WeakPolarHBondContact OG1-CD1 3.47Å
802	V	94.6	Very high	94.1	Very high	18 Å²	18	58.8 Å²	58.8	11%	0.109	32%	0.32	C	S	.	.	H	α-helix	trans	-58	-26.9	179.1	171.5	0	0	0	0	113.3	I798 E800 Y877 Q880 A881	I798-V802 WeakPolarHBondContact O-CG2 3.26Å; I798-V802 PolarHBondContact O-N 3.28Å; E800-V802 PolarHBondContact O-N 3.46Å; V802-Y877 HydrophobicContact CG1-CD1 3.93Å; V802-Q880 HydrophobicContact CG1-CB 3.72Å; V802-A881 HydrophobicContact CG2-CB 3.9Å
803	K	93.5	Very high	94.2	Very high	102 Å²	102	61 Å²	61	44%	0.443	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.6	-14.1	177.5	-64.3	164.6	-162.3	155.3	0	114.3	V799 E800 T801 Y877	V799-K803 WeakPolarHBondContact O-CD 3.36Å; V799-K803 WeakPolarHBondContact O-CE 3.49Å; V799-K803 VanDerWaalsContact O-CG 3.3Å; V799-K803 WeakPolarHBondContact O-CG 3.34Å; E800-K803 WeakPolarHBondContact O-CB 3.31Å; E800-K803 PolarHBondContact O-N 3.46Å; E800-K803 VanDerWaalsContact O-N 3.16Å; T801-K803 PolarHBondContact O-N 2.77Å; T801-K803 VanDerWaalsContact O-N 3.08Å; K803-Y877 HydrophobicContact CD-CE2 4.34Å; K803-Y877 VanDerWaalsContact CE-CE2 3.46Å; K803-Y877 HydrophobicContact CG-CD1 4.32Å; K803-Y877 HydrophobicContact CG-CE1 3.71Å; K803-Y877 HydrophobicContact CG-CE2 4.21Å
804	M	94.4	Very high	94.3	Very high	67 Å²	67	57.9 Å²	57.9	33%	0.33	30%	0.296	S	S	.	.			trans	-60.8	152.3	179.7	-68.7	166.2	56.2	0	0	110.8	T801 D809 K810 R813	T801-M804 HydrophobicContact CG2-SD 4.19Å; T801-M804 VanDerWaalsContact O-CB 3.3Å; T801-M804 WeakPolarHBondContact O-CB 3.35Å; T801-M804 WeakPolarHBondContact O-CG 3.42Å; T801-M804 PolarHBondContact O-N 3.32Å; M804-D809 HydrophobicContact CE-CB 3.53Å; M804-K810 HydrophobicContact CB-CD 4.35Å; M804-K810 HydrophobicContact CB-CG 3.78Å; M804-K810 VanDerWaalsContact O-CD 3.28Å; M804-K810 WeakPolarHBondContact O-CD 3.45Å; M804-K810 WeakPolarHBondContact O-CE 3.23Å; M804-K810 PolarHBondContact O-NZ 3.17Å; M804-R813 HydrophobicContact SD-CB 4.45Å; M804-R813 HydrophobicContact SD-CG 4.41Å
805	S	93.4	Very high	94.4	Very high	119 Å²	119	57.6 Å²	57.6	83%	0.832	30%	0.295	S	S	*	.	S	Bend	trans	-76	-53.8	-177.6	-56.2	0	0	0	0	112.4	K810	S805-K810 WeakPolarHBondContact O-CE 3.33Å; S805-K810 PolarHBondContact O-NZ 3.3Å
806	D	95.6	Very high	94.5	Very high	81 Å²	81	60 Å²	60	43%	0.433	31%	0.312	S	S	.	.			trans	-73.2	135.9	-173.1	-172.8	-85.3	0	0	0	113.1	M808 D809 K810	D806-M808 WeakPolarHBondContact OD1-CA 3.35Å; D806-M808 PolarHBondContact OD1-N 3.4Å; D806-D809 HydrophobicContact CB-CB 4.16Å; D806-D809 PolarHBondContact OD1-N 2.85Å; D806-K810 VanDerWaalsContact C-CE 3.46Å; D806-K810 WeakPolarHBondContact O-CB 3.32Å; D806-K810 WeakPolarHBondContact O-CE 3.42Å; D806-K810 VanDerWaalsContact O-CG 3.32Å; D806-K810 WeakPolarHBondContact O-CG 3.24Å; D806-K810 PolarHBondContact O-N 2.9Å; D806-K810 VanDerWaalsContact O-N 3.17Å
807	H	93.3	Very high	94.7	Very high	85 Å²	85	56.7 Å²	56.7	39%	0.394	29%	0.291	S	S	.	.	H	α-helix	trans	-74.2	-36.8	-175.4	-171.5	75	0	0	0	113.8	K810 V811 E888	H807-K810 WeakPolarHBondContact O-CB 3.31Å; H807-K810 PolarHBondContact O-N 2.86Å; H807-V811 WeakPolarHBondContact O-CG2 3.43Å; H807-V811 PolarHBondContact O-N 2.8Å; H807-V811 VanDerWaalsContact O-N 3.12Å; H807-E888 IonicContact CD2-OE1 2.74Å; H807-E888 IonicContact CE1-OE1 2.69Å; H807-E888 IonicContact NE2-OE1 3.18Å; H807-E888 PolarHBondContact NE2-OE1 2.66Å
808	M	92.9	Very high	94.8	Very high	102 Å²	102	54 Å²	54	50%	0.502	28%	0.277	S	S	.	.	H	α-helix	trans	-74.3	-44.8	180	-65.8	-52.5	-50.4	0	0	110.8	D806 K810 V811 D812	D806-M808 WeakPolarHBondContact OD1-CA 3.35Å; D806-M808 PolarHBondContact OD1-N 3.4Å; M808-K810 PolarHBondContact O-N 3.35Å; M808-V811 PolarHBondContact O-N 3.5Å; M808-V811 VanDerWaalsContact O-N 3.1Å; M808-D812 PolarHBondContact O-N 3.06Å
809	D	94.3	Very high	94.7	Very high	98 Å²	98	57.8 Å²	57.8	52%	0.524	30%	0.297	S	S	.	.	H	α-helix	trans	-59.4	-36.2	174.4	-69.3	-25	0	0	0	111.3	M804 D806 R813	M804-D809 HydrophobicContact CE-CB 3.53Å; D806-D809 HydrophobicContact CB-CB 4.16Å; D806-D809 PolarHBondContact OD1-N 2.85Å; D809-R813 WeakPolarHBondContact O-CB 3.48Å; D809-R813 PolarHBondContact O-N 2.99Å
810	K	95.2	Very high	94.8	Very high	38 Å²	38	63.4 Å²	63.4	17%	0.165	33%	0.326	C	S	.	.	H	α-helix	trans	-58.4	-51.7	171.9	-93.2	-179.8	-75.4	-155.8	0	112.4	T801 M804 S805 D806 H807 M808 L814 L884	T801-K810 WeakPolarHBondContact CG2-O 3.23Å; T801-K810 VanDerWaalsContact O-CG 3.29Å; T801-K810 WeakPolarHBondContact O-CG 3.32Å; M804-K810 HydrophobicContact CB-CD 4.35Å; M804-K810 HydrophobicContact CB-CG 3.78Å; M804-K810 VanDerWaalsContact O-CD 3.28Å; M804-K810 WeakPolarHBondContact O-CD 3.45Å; M804-K810 WeakPolarHBondContact O-CE 3.23Å; M804-K810 PolarHBondContact O-NZ 3.17Å; S805-K810 WeakPolarHBondContact O-CE 3.33Å; S805-K810 PolarHBondContact O-NZ 3.3Å; D806-K810 VanDerWaalsContact C-CE 3.46Å; D806-K810 WeakPolarHBondContact O-CB 3.32Å; D806-K810 WeakPolarHBondContact O-CE 3.42Å; D806-K810 VanDerWaalsContact O-CG 3.32Å; D806-K810 WeakPolarHBondContact O-CG 3.24Å; D806-K810 PolarHBondContact O-N 2.9Å; D806-K810 VanDerWaalsContact O-N 3.17Å; H807-K810 WeakPolarHBondContact O-CB 3.31Å; H807-K810 PolarHBondContact O-N 2.86Å; M808-K810 PolarHBondContact O-N 3.35Å; K810-L814 WeakPolarHBondContact O-CB 3.44Å; K810-L814 PolarHBondContact O-N 3.4Å; K810-L884 HydrophobicContact CB-CD2 4.37Å
811	V	95.9	Very high	95	Very high	1 Å²	1	58.6 Å²	58.6	1%	0.006	30%	0.304	C	S	.	.	H	α-helix	trans	-67.1	-44.8	-176.8	172.4	0	0	0	0	111.1	H807 M808 L814 K815 L884 E888 H891 I892	H807-V811 WeakPolarHBondContact O-CG2 3.43Å; H807-V811 PolarHBondContact O-N 2.8Å; H807-V811 VanDerWaalsContact O-N 3.12Å; M808-V811 PolarHBondContact O-N 3.5Å; M808-V811 VanDerWaalsContact O-N 3.1Å; V811-L814 PolarHBondContact O-N 2.9Å; V811-K815 VanDerWaalsContact O-CB 3.27Å; V811-K815 WeakPolarHBondContact O-CB 3.47Å; V811-K815 PolarHBondContact O-N 2.63Å; V811-L884 HydrophobicContact CG2-CD1 4.1Å; V811-E888 HydrophobicContact CG1-CB 4.18Å; V811-E888 HydrophobicContact CG2-CB 3.96Å; V811-E888 HydrophobicContact CG2-CG 3.64Å; V811-H891 HydrophobicContact CG1-CB 3.74Å; V811-I892 HydrophobicContact CG1-CG1 4.25Å
812	D	95	Very high	95	Very high	88 Å²	88	60.3 Å²	60.3	47%	0.471	32%	0.315	S	S	.	.	H	α-helix	trans	-70.3	-37.1	-179.9	-81.8	-30.3	0	0	0	112.4	M808 C816	M808-D812 PolarHBondContact O-N 3.06Å; D812-C816 PolarHBondContact O-N 3.05Å; D812-C816 PolarHBondContact O-SG 3.23Å
813	R	95.7	Very high	95.1	Very high	107 Å²	107	63.3 Å²	63.3	40%	0.404	34%	0.335	S	S	.	.	H	α-helix	trans	-66.6	-42.3	172.5	178	61.2	-174.9	166.8	2.6	111.5	D797 T801 M804 D809 C816 L817	D797-R813 IonicContact OD2-CZ 2.8Å; D797-R813 IonicContact OD2-NH2 2.7Å; D797-R813 PolarHBondContact OD2-NH2 2.93Å; T801-R813 HydrophobicContact CG2-CB 3.84Å; T801-R813 HydrophobicContact CG2-CG 3.78Å; T801-R813 VanDerWaalsContact OG1-CG 3.3Å; T801-R813 WeakPolarHBondContact OG1-CG 3.45Å; M804-R813 HydrophobicContact SD-CB 4.45Å; M804-R813 HydrophobicContact SD-CG 4.41Å; D809-R813 WeakPolarHBondContact O-CB 3.48Å; D809-R813 PolarHBondContact O-N 2.99Å; R813-C816 WeakPolarHBondContact O-CB 3.48Å; R813-C816 PolarHBondContact O-N 3.36Å; R813-L817 HydrophobicContact CG-CD1 4.38Å; R813-L817 WeakPolarHBondContact O-CG 3.47Å; R813-L817 PolarHBondContact O-N 2.79Å
814	L	96.2	Very high	95.3	Very high	0 Å²	0	59.5 Å²	59.5	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-65.3	-40.1	178	-177.1	55.7	0	0	0	111.6	I798 T801 K810 V811 L817 V818 L884 I885 I892	I798-L814 HydrophobicContact CG1-CD1 4.01Å; I798-L814 HydrophobicContact CG2-CD1 4.14Å; T801-L814 HydrophobicContact CG2-CB 4.03Å; K810-L814 WeakPolarHBondContact O-CB 3.44Å; K810-L814 PolarHBondContact O-N 3.4Å; V811-L814 PolarHBondContact O-N 2.9Å; L814-L817 PolarHBondContact O-N 2.93Å; L814-V818 HydrophobicContact CD1-CG2 4.47Å; L814-V818 WeakPolarHBondContact O-CG2 3.26Å; L814-V818 PolarHBondContact O-N 2.86Å; L814-L884 HydrophobicContact CD2-CB 4.33Å; L814-L884 HydrophobicContact CD2-CD2 3.71Å; L814-L884 HydrophobicContact CD2-CG 3.86Å; L814-I885 HydrophobicContact CD2-CG1 3.88Å; L814-I885 HydrophobicContact CG-CG1 4.41Å; L814-I892 HydrophobicContact CD2-CD1 3.95Å; L814-I892 HydrophobicContact CG-CD1 4.25Å
815	K	95.7	Very high	95.5	Very high	35 Å²	35	56.8 Å²	56.8	15%	0.152	31%	0.308	C	S	.	.	H	α-helix	trans	-56.3	-48.7	169.8	176.9	170.9	-161.4	159.2	0	111.9	V811 L817 V818 L819 H891 I892 R894	V811-K815 VanDerWaalsContact O-CB 3.27Å; V811-K815 WeakPolarHBondContact O-CB 3.47Å; V811-K815 PolarHBondContact O-N 2.63Å; K815-L817 PolarHBondContact O-N 2.8Å; K815-V818 PolarHBondContact O-N 2.96Å; K815-L819 HydrophobicContact CD-CD1 4.4Å; K815-L819 HydrophobicContact CG-CD1 3.73Å; K815-L819 HydrophobicContact CG-CG 4.29Å; K815-L819 WeakPolarHBondContact O-CB 3.38Å; K815-L819 WeakPolarHBondContact O-CG 3.24Å; K815-L819 PolarHBondContact O-N 2.87Å; K815-H891 VanDerWaalsContact CD-O 3.32Å; K815-H891 WeakPolarHBondContact CD-O 3.28Å; K815-H891 WeakPolarHBondContact CE-O 3.43Å; K815-H891 PolarHBondContact NZ-O 2.85Å; K815-I892 VanDerWaalsContact CE-O 3.27Å; K815-I892 WeakPolarHBondContact CE-O 3.41Å; K815-I892 WeakPolarHBondContact CG-O 3.41Å; K815-R894 PolarHBondContact NZ-O 2.96Å
816	C	95.8	Very high	95.7	Very high	61 Å²	61	52.4 Å²	52.4	41%	0.412	27%	0.274	S	S	.	.	H	α-helix	trans	-57.8	-38.4	176.1	-68	0	0	0	0	112	D812 R813 N820	D812-C816 PolarHBondContact O-N 3.05Å; D812-C816 PolarHBondContact O-SG 3.23Å; R813-C816 WeakPolarHBondContact O-CB 3.48Å; R813-C816 PolarHBondContact O-N 3.36Å; C816-N820 PolarHBondContact O-N 3.14Å; C816-N820 PolarHBondContact O-ND2 3.06Å
817	L	96.4	Very high	95.8	Very high	11 Å²	11	50.8 Å²	50.8	6%	0.058	27%	0.265	C	S	.	.	H	α-helix	trans	-70	-44.4	178.1	-69.5	166.8	0	0	0	112.4	F794 D797 I798 T801 R813 L814 K815 N820	F794-L817 HydrophobicContact CD1-CD2 4.33Å; F794-L817 WeakPolarHBondContact CE1-O 3.25Å; D797-L817 HydrophobicContact CB-CD1 3.77Å; D797-L817 HydrophobicContact CB-CD2 3.61Å; D797-L817 HydrophobicContact CB-CG 4.36Å; I798-L817 HydrophobicContact CG1-CB 4.34Å; I798-L817 HydrophobicContact CG1-CD1 3.91Å; T801-L817 WeakPolarHBondContact OG1-CD1 3.47Å; R813-L817 HydrophobicContact CG-CD1 4.38Å; R813-L817 WeakPolarHBondContact O-CG 3.47Å; R813-L817 PolarHBondContact O-N 2.79Å; L814-L817 PolarHBondContact O-N 2.93Å; K815-L817 PolarHBondContact O-N 2.8Å; L817-N820 PolarHBondContact O-N 2.9Å
818	V	95.6	Very high	96	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-62.8	-44.9	177.8	169.5	0	0	0	0	111.7	L814 K815 N820 M821 L829 I892 F893	L814-V818 HydrophobicContact CD1-CG2 4.47Å; L814-V818 WeakPolarHBondContact O-CG2 3.26Å; L814-V818 PolarHBondContact O-N 2.86Å; K815-V818 PolarHBondContact O-N 2.96Å; V818-N820 PolarHBondContact O-N 2.92Å; V818-M821 HydrophobicContact CG2-CE 4.3Å; V818-M821 WeakPolarHBondContact O-CB 3.33Å; V818-M821 PolarHBondContact O-N 3.4Å; V818-M821 VanDerWaalsContact O-N 3.14Å; V818-L829 HydrophobicContact CG2-CD2 4.44Å; V818-I892 HydrophobicContact CB-CG2 4.17Å; V818-I892 HydrophobicContact CG1-CG2 4.14Å; V818-I892 HydrophobicContact CG2-CG2 4.14Å; V818-F893 HydrophobicContact CG1-CD1 4.01Å; V818-F893 HydrophobicContact CG1-CE1 3.46Å; V818-F893 VanDerWaalsContact CG1-CE1 3.46Å; V818-F893 HydrophobicContact CG1-CZ 4.08Å
819	L	93.1	Very high	96.3	Very high	81 Å²	81	42 Å²	42	42%	0.424	22%	0.223	S	C	.	.	H	α-helix	trans	-67.9	-15	179.2	-69.3	174.4	0	0	0	114.3	K815	K815-L819 HydrophobicContact CD-CD1 4.4Å; K815-L819 HydrophobicContact CG-CD1 3.73Å; K815-L819 HydrophobicContact CG-CG 4.29Å; K815-L819 WeakPolarHBondContact O-CB 3.38Å; K815-L819 WeakPolarHBondContact O-CG 3.24Å; K815-L819 PolarHBondContact O-N 2.87Å
820	N	95.8	Very high	96.5	Very high	123 Å²	123	39.2 Å²	39.2	66%	0.658	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	-96.1	-0.2	175	-81	-75.5	0	0	0	113.3	F794 C816 L817 V818	F794-N820 HydrophobicContact CE1-CB 4.09Å; F794-N820 VanDerWaalsContact CZ-O 3.31Å; F794-N820 WeakPolarHBondContact CZ-O 3.49Å; C816-N820 PolarHBondContact O-N 3.14Å; C816-N820 PolarHBondContact O-ND2 3.06Å; L817-N820 PolarHBondContact O-N 2.9Å; V818-N820 PolarHBondContact O-N 2.92Å
821	M	96.1	Very high	96.6	Very high	11 Å²	11	39.8 Å²	39.8	5%	0.054	21%	0.21	C	C	.	.	S	Bend	trans	-69.6	154.2	175.3	-64.9	-171.7	-174.4	0	0	111.7	V790 F794 I798 V818 N825 H826 L829	V790-M821 HydrophobicContact CB-CE 4.45Å; V790-M821 HydrophobicContact CG1-CE 3.91Å; V790-M821 HydrophobicContact CG2-CE 4.18Å; F794-M821 HydrophobicContact CB-CE 4.17Å; F794-M821 HydrophobicContact CD1-CE 4.29Å; F794-M821 HydrophobicContact CD1-CG 4.08Å; F794-M821 HydrophobicContact CD2-CG 4.38Å; F794-M821 HydrophobicContact CE1-CG 4Å; F794-M821 HydrophobicContact CE2-CG 4.31Å; F794-M821 HydrophobicContact CG-CE 4.23Å; F794-M821 HydrophobicContact CG-CG 4.28Å; F794-M821 HydrophobicContact CZ-CG 4.14Å; I798-M821 HydrophobicContact CD1-CE 3.67Å; V818-M821 HydrophobicContact CG2-CE 4.3Å; V818-M821 WeakPolarHBondContact O-CB 3.33Å; V818-M821 PolarHBondContact O-N 3.4Å; V818-M821 VanDerWaalsContact O-N 3.14Å; M821-N825 HydrophobicContact CB-CB 4.4Å; M821-H826 HydrophobicContact CB-CB 4.44Å; M821-L829 HydrophobicContact SD-CD2 4.21Å
822	P	96.6	Very high	96.7	Very high	38 Å²	38	39.7 Å²	39.7	25%	0.247	21%	0.209	C	C	.	.			trans	-55	141.8	172.3	-24.2	33.7	0	0	0	111.4	P824 N825 H826	P822-P824 VanDerWaalsContact C-CD 3.47Å; P822-N825 WeakPolarHBondContact O-CA 3.4Å; P822-N825 WeakPolarHBondContact O-CB 3.37Å; P822-N825 PolarHBondContact O-N 2.82Å; P822-H826 PolarHBondContact O-N 3Å
823	P	96.5	Very high	96.9	Very high	82 Å²	82	35.6 Å²	35.6	53%	0.532	19%	0.187	S	C	.	.	H	α-helix	trans	-53.2	-40.3	-174.3	-27	33.7	0	0	0	115.5	N825 H826 D827	P823-N825 VanDerWaalsContact C-N 3.26Å; P823-N825 PolarHBondContact O-N 3.28Å; P823-H826 PolarHBondContact O-N 3.4Å; P823-D827 WeakPolarHBondContact O-CB 3.39Å; P823-D827 VanDerWaalsContact O-CG 3.29Å; P823-D827 PolarHBondContact O-N 2.86Å
824	P	97.3	Very high	97	Very high	21 Å²	21	34.7 Å²	34.7	14%	0.136	18%	0.184	C	C	.	.	H	α-helix	trans	-60.7	-34.4	174.7	-24.9	36.4	0	0	0	113.7	L688 C692 T698 P822 T828	L688-P824 HydrophobicContact CD2-CB 4.39Å; L688-P824 HydrophobicContact CG-CB 4.14Å; C692-P824 HydrophobicContact CB-CB 4.05Å; C692-P824 HydrophobicContact CB-CG 4.26Å; T698-P824 WeakPolarHBondContact O-CA 3.42Å; P822-P824 VanDerWaalsContact C-CD 3.47Å; P824-T828 WeakPolarHBondContact O-CB 3.25Å; P824-T828 PolarHBondContact O-N 2.85Å; P824-T828 PolarHBondContact O-OG1 2.77Å
825	N	98.3	Very high	97.1	Very high	10 Å²	10	34.7 Å²	34.7	5%	0.053	18%	0.184	C	C	.	.	H	α-helix	trans	-77.1	-46.1	178.8	-65.6	71.8	0	0	0	111.1	L688 L789 P791 M821 P822 P823 L829	L688-N825 HydrophobicContact CD2-CB 4.48Å; L789-N825 WeakPolarHBondContact O-CB 3.27Å; L789-N825 PolarHBondContact O-ND2 2.89Å; P791-N825 HydrophobicContact CG-CB 4.47Å; M821-N825 HydrophobicContact CB-CB 4.4Å; P822-N825 WeakPolarHBondContact O-CA 3.4Å; P822-N825 WeakPolarHBondContact O-CB 3.37Å; P822-N825 PolarHBondContact O-N 2.82Å; P823-N825 VanDerWaalsContact C-N 3.26Å; P823-N825 PolarHBondContact O-N 3.28Å; N825-L829 WeakPolarHBondContact O-CB 3.35Å; N825-L829 PolarHBondContact O-N 2.82Å
826	H	97.8	Very high	97.3	Very high	27 Å²	27	33 Å²	33	13%	0.125	18%	0.177	C	C	.	.	H	α-helix	trans	-55.6	-58.8	174.7	172.6	-87	0	0	0	111.1	M821 P822 P823 T828 L829 E830 F893	M821-H826 HydrophobicContact CB-CB 4.44Å; P822-H826 PolarHBondContact O-N 3Å; P823-H826 PolarHBondContact O-N 3.4Å; H826-T828 VanDerWaalsContact C-N 3.34Å; H826-T828 PolarHBondContact O-N 2.9Å; H826-L829 PolarHBondContact O-N 3.21Å; H826-L829 VanDerWaalsContact O-N 3.14Å; H826-E830 IonicContact CE1-OE2 3.82Å; H826-E830 PolarHBondContact CE1-OE2 2.84Å; H826-E830 VanDerWaalsContact CE1-OE2 3.32Å; H826-E830 WeakPolarHBondContact O-CB 3.31Å; H826-E830 PolarHBondContact O-N 3.37Å; H826-F893 AromaticContact NE2-CD1 3.98Å
827	D	98.1	Very high	97.4	Very high	47 Å²	47	33.4 Å²	33.4	25%	0.251	17%	0.169	S	C	.	.	H	α-helix	trans	-66.6	-37.4	-172.4	-65.9	8.4	0	0	0	111.4	T698 V699 P823 F831	T698-D827 WeakPolarHBondContact CB-OD2 3.47Å; T698-D827 WeakPolarHBondContact CG2-OD2 3.38Å; T698-D827 PolarHBondContact OG1-OD2 3.22Å; V699-D827 HydrophobicContact CG2-CB 3.9Å; P823-D827 WeakPolarHBondContact O-CB 3.39Å; P823-D827 VanDerWaalsContact O-CG 3.29Å; P823-D827 PolarHBondContact O-N 2.86Å; D827-F831 WeakPolarHBondContact O-CB 3.36Å; D827-F831 PolarHBondContact O-N 2.73Å
828	T	98.6	Very high	97.4	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-69.9	-35.3	176.1	-61.5	0	0	0	0	111.7	T698 P700 F782 L789 P824 H826 M832	T698-T828 PolarHBondContact O-OG1 2.91Å; P700-T828 WeakPolarHBondContact CD-OG1 3.31Å; F782-T828 HydrophobicContact CE1-CG2 3.72Å; F782-T828 HydrophobicContact CZ-CG2 4Å; L789-T828 HydrophobicContact CD1-CG2 3.75Å; L789-T828 HydrophobicContact CD2-CG2 4.23Å; P824-T828 WeakPolarHBondContact O-CB 3.25Å; P824-T828 PolarHBondContact O-N 2.85Å; P824-T828 PolarHBondContact O-OG1 2.77Å; H826-T828 VanDerWaalsContact C-N 3.34Å; H826-T828 PolarHBondContact O-N 2.9Å; T828-M832 WeakPolarHBondContact O-CB 3.12Å; T828-M832 VanDerWaalsContact O-CG 3.32Å; T828-M832 WeakPolarHBondContact O-CG 3.4Å; T828-M832 PolarHBondContact O-N 3.27Å
829	L	98.4	Very high	97.5	Very high	2 Å²	2	37.1 Å²	37.1	1%	0.01	18%	0.183	C	C	.	.	H	α-helix	trans	-68.1	-47.2	174	-177.8	66.8	0	0	0	111.2	L789 V790 V818 M821 N825 H826 F831 M832 C833 L861 F893	L789-L829 HydrophobicContact CD2-CB 4.04Å; L789-L829 HydrophobicContact CD2-CD1 3.95Å; L789-L829 HydrophobicContact CG-CB 4.28Å; L789-L829 HydrophobicContact CG-CD1 4.48Å; V790-L829 HydrophobicContact CG2-CD2 4.3Å; V818-L829 HydrophobicContact CG2-CD2 4.44Å; M821-L829 HydrophobicContact SD-CD2 4.21Å; N825-L829 WeakPolarHBondContact O-CB 3.35Å; N825-L829 PolarHBondContact O-N 2.82Å; H826-L829 PolarHBondContact O-N 3.21Å; H826-L829 VanDerWaalsContact O-N 3.14Å; L829-F831 VanDerWaalsContact C-N 3.34Å; L829-F831 PolarHBondContact O-N 2.82Å; L829-M832 PolarHBondContact O-N 3.49Å; L829-C833 WeakPolarHBondContact O-CB 3.5Å; L829-C833 PolarHBondContact O-N 2.92Å; L829-C833 PolarHBondContact O-SG 3.18Å; L829-C833 VanDerWaalsContact O-SG 3.41Å; L829-L861 HydrophobicContact CD1-CD1 4.12Å; L829-F893 HydrophobicContact CD2-CZ 4.3Å; L829-F893 HydrophobicContact CG-CZ 4.13Å
830	E	98	Very high	97.8	Very high	40 Å²	40	34.7 Å²	34.7	19%	0.187	17%	0.17	C	C	.	.	H	α-helix	trans	-58.7	-45.4	175.7	-170.6	-161.5	139.2	0	0	111.3	H826 C833 R834 F889 F893	H826-E830 IonicContact CE1-OE2 3.82Å; H826-E830 PolarHBondContact CE1-OE2 2.84Å; H826-E830 VanDerWaalsContact CE1-OE2 3.32Å; H826-E830 WeakPolarHBondContact O-CB 3.31Å; H826-E830 PolarHBondContact O-N 3.37Å; E830-C833 PolarHBondContact O-N 3.12Å; E830-R834 WeakPolarHBondContact O-CB 3.41Å; E830-R834 PolarHBondContact O-N 2.71Å; E830-R834 IonicContact OE1-CZ 2.77Å; E830-R834 IonicContact OE1-NH1 3.86Å; E830-R834 PolarHBondContact OE1-NH1 3.33Å; E830-R834 IonicContact OE1-NH2 3.65Å; E830-R834 PolarHBondContact OE1-NH2 3.13Å; E830-F889 HydrophobicContact CG-CE2 4.38Å; E830-F889 HydrophobicContact CG-CZ 4.05Å; E830-F893 HydrophobicContact CB-CD1 3.59Å; E830-F893 HydrophobicContact CB-CE1 3.64Å; E830-F893 HydrophobicContact CB-CG 4.28Å; E830-F893 HydrophobicContact CB-CZ 4.39Å; E830-F893 HydrophobicContact CG-CB 3.94Å; E830-F893 HydrophobicContact CG-CD1 3.5Å; E830-F893 VanDerWaalsContact CG-CD1 3.5Å; E830-F893 HydrophobicContact CG-CD2 4.49Å; E830-F893 HydrophobicContact CG-CE1 4.05Å; E830-F893 HydrophobicContact CG-CG 3.74Å
831	F	98.5	Very high	97.8	Very high	50 Å²	50	34.4 Å²	34.4	22%	0.219	17%	0.165	C	C	.	.	H	α-helix	trans	-61.8	-46.4	177.3	-177.6	-92	0	0	0	111.9	V699 V703 R704 T707 D827 L829 R834 H835	V699-F831 HydrophobicContact CG1-CB 4.18Å; V699-F831 HydrophobicContact CG1-CD1 3.79Å; V699-F831 HydrophobicContact CG1-CD2 4.48Å; V699-F831 HydrophobicContact CG1-CE1 4.32Å; V699-F831 HydrophobicContact CG1-CG 3.89Å; V699-F831 HydrophobicContact CG2-CB 4.15Å; V699-F831 HydrophobicContact CG2-CG 4.47Å; V703-F831 HydrophobicContact CG1-CD1 3.92Å; V703-F831 HydrophobicContact CG1-CE1 3.97Å; R704-F831 HydrophobicContact CB-CZ 4.28Å; R704-F831 HydrophobicContact CG-CE1 4.03Å; R704-F831 HydrophobicContact CG-CE2 4.13Å; R704-F831 HydrophobicContact CG-CZ 3.68Å; T707-F831 HydrophobicContact CG2-CE1 3.9Å; T707-F831 WeakPolarHBondContact OG1-CE1 3.45Å; T707-F831 VanDerWaalsContact OG1-CZ 3.28Å; T707-F831 WeakPolarHBondContact OG1-CZ 3.37Å; D827-F831 WeakPolarHBondContact O-CB 3.36Å; D827-F831 PolarHBondContact O-N 2.73Å; L829-F831 VanDerWaalsContact C-N 3.34Å; L829-F831 PolarHBondContact O-N 2.82Å; F831-R834 PolarHBondContact O-N 2.73Å; F831-H835 PolarHBondContact O-N 2.97Å
832	M	98.5	Very high	97.9	Very high	0 Å²	0	39 Å²	39	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-64.9	-45.2	176.4	-78.9	-59.5	-55.6	0	0	112.7	V703 T707 L778 F782 T828 L829 R834 H835 L836 F857	V703-M832 HydrophobicContact CG1-CG 4.28Å; V703-M832 HydrophobicContact CG1-SD 3.77Å; T707-M832 HydrophobicContact CG2-SD 3.95Å; L778-M832 HydrophobicContact CD2-CE 4.02Å; L778-M832 HydrophobicContact CD2-SD 4.1Å; L778-M832 HydrophobicContact CG-CE 4.5Å; F782-M832 HydrophobicContact CE1-CG 4.45Å; F782-M832 HydrophobicContact CE2-CE 3.92Å; F782-M832 HydrophobicContact CE2-CG 3.89Å; F782-M832 HydrophobicContact CE2-SD 3.67Å; F782-M832 HydrophobicContact CZ-CG 3.52Å; F782-M832 HydrophobicContact CZ-SD 3.79Å; T828-M832 WeakPolarHBondContact O-CB 3.12Å; T828-M832 VanDerWaalsContact O-CG 3.32Å; T828-M832 WeakPolarHBondContact O-CG 3.4Å; T828-M832 PolarHBondContact O-N 3.27Å; L829-M832 PolarHBondContact O-N 3.49Å; M832-R834 VanDerWaalsContact C-N 3.33Å; M832-R834 PolarHBondContact O-N 2.82Å; M832-H835 WeakPolarHBondContact O-CB 3.38Å; M832-H835 PolarHBondContact O-N 2.82Å; M832-L836 VanDerWaalsContact O-CG 3.28Å; M832-L836 WeakPolarHBondContact O-CG 3.49Å; M832-L836 PolarHBondContact O-N 2.81Å; M832-F857 HydrophobicContact CE-CE1 3.77Å; M832-F857 HydrophobicContact CE-CZ 4.14Å
833	C	98.2	Very high	97.8	Very high	1 Å²	1	39.6 Å²	39.6	1%	0.007	19%	0.186	C	C	.	.	H	α-helix	trans	-66.9	-34.6	179.2	-70.8	0	0	0	0	111.9	L829 E830 L836 R837 I885 L886 F889 F893	L829-C833 WeakPolarHBondContact O-CB 3.5Å; L829-C833 PolarHBondContact O-N 2.92Å; L829-C833 PolarHBondContact O-SG 3.18Å; L829-C833 VanDerWaalsContact O-SG 3.41Å; E830-C833 PolarHBondContact O-N 3.12Å; C833-L836 PolarHBondContact O-N 2.91Å; C833-R837 WeakPolarHBondContact O-CG 3.27Å; C833-R837 PolarHBondContact O-N 3.12Å; C833-I885 HydrophobicContact CB-CG2 4.33Å; C833-I885 VanDerWaalsContact SG-CG2 3.58Å; C833-L886 HydrophobicContact CB-CD2 3.95Å; C833-F889 HydrophobicContact CB-CD2 3.74Å; C833-F889 HydrophobicContact CB-CE2 3.73Å; C833-F893 HydrophobicContact CB-CE2 4.17Å
834	R	98.2	Very high	97.9	Very high	88 Å²	88	43 Å²	43	33%	0.332	20%	0.199	S	C	.	.	H	α-helix	trans	-61.3	-46	170.4	176.8	-175.6	-77.4	104.8	-9.3	112	E830 F831 M832 R837 R838 F889	E830-R834 WeakPolarHBondContact O-CB 3.41Å; E830-R834 PolarHBondContact O-N 2.71Å; E830-R834 IonicContact OE1-CZ 2.77Å; E830-R834 IonicContact OE1-NH1 3.86Å; E830-R834 PolarHBondContact OE1-NH1 3.33Å; E830-R834 IonicContact OE1-NH2 3.65Å; E830-R834 PolarHBondContact OE1-NH2 3.13Å; F831-R834 PolarHBondContact O-N 2.73Å; M832-R834 VanDerWaalsContact C-N 3.33Å; M832-R834 PolarHBondContact O-N 2.82Å; R834-R837 PolarHBondContact O-N 3.44Å; R834-R838 PolarHBondContact O-N 3.15Å; R834-F889 HydrophobicContact CB-CE2 4.08Å; R834-F889 HydrophobicContact CB-CZ 3.85Å
835	H	98.5	Very high	97.9	Very high	1 Å²	1	45.4 Å²	45.4	1%	0.005	21%	0.214	C	C	.	.	H	α-helix	trans	-60.2	-46	174.6	172.4	71.6	0	0	0	111.7	T707 E711 Y721 F831 M832 R837 R838 V839	T707-H835 HydrophobicContact CG2-CB 3.93Å; T707-H835 PolarHBondContact O-CE1 2.9Å; E711-H835 IonicContact OE1-CE1 2.64Å; E711-H835 IonicContact OE1-CG 2.73Å; E711-H835 IonicContact OE1-ND1 3.21Å; E711-H835 PolarHBondContact OE1-ND1 2.65Å; Y721-H835 AromaticContact CE2-NE2 3.41Å; Y721-H835 WeakPolarHBondContact CE2-NE2 3.4Å; Y721-H835 AromaticContact CZ-CD2 4Å; Y721-H835 AromaticContact CZ-NE2 3.48Å; Y721-H835 PolarHBondContact OH-CD2 2.9Å; Y721-H835 VanDerWaalsContact OH-CD2 3.3Å; Y721-H835 PolarHBondContact OH-NE2 2.8Å; F831-H835 PolarHBondContact O-N 2.97Å; M832-H835 WeakPolarHBondContact O-CB 3.38Å; M832-H835 PolarHBondContact O-N 2.82Å; H835-R837 VanDerWaalsContact C-N 3.29Å; H835-R837 PolarHBondContact O-N 2.96Å; H835-R838 WeakPolarHBondContact O-CB 3.17Å; H835-R838 PolarHBondContact O-N 2.64Å; H835-R838 VanDerWaalsContact O-N 3.11Å; H835-V839 PolarHBondContact O-N 2.9Å
836	L	98.4	Very high	97.8	Very high	0 Å²	0	45 Å²	45	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-65.8	-28.7	-179.6	-67.4	171.8	0	0	0	112.9	Y721 M832 C833 V839 L840 I853 F857 L886	Y721-L836 HydrophobicContact CD2-CD2 4.12Å; Y721-L836 HydrophobicContact CE2-CD2 4.04Å; M832-L836 VanDerWaalsContact O-CG 3.28Å; M832-L836 WeakPolarHBondContact O-CG 3.49Å; M832-L836 PolarHBondContact O-N 2.81Å; C833-L836 PolarHBondContact O-N 2.91Å; L836-V839 WeakPolarHBondContact O-CB 3.31Å; L836-V839 PolarHBondContact O-N 3.45Å; L836-L840 WeakPolarHBondContact O-CG 3.39Å; L836-L840 PolarHBondContact O-N 3.13Å; L836-I853 HydrophobicContact CB-CG2 4.37Å; L836-I853 HydrophobicContact CD1-CG2 3.99Å; L836-I853 HydrophobicContact CD2-CD1 4.3Å; L836-I853 HydrophobicContact CD2-CG2 4.12Å; L836-I853 HydrophobicContact CG-CG2 4.38Å; L836-F857 HydrophobicContact CD1-CD1 4.22Å; L836-F857 HydrophobicContact CD1-CD2 3.94Å; L836-F857 HydrophobicContact CD1-CE1 4.37Å; L836-F857 HydrophobicContact CD1-CE2 4.08Å; L836-F857 HydrophobicContact CD1-CG 3.98Å; L836-F857 HydrophobicContact CD1-CZ 4.29Å; L836-F857 HydrophobicContact CD2-CD2 4.06Å; L836-F857 HydrophobicContact CD2-CE2 3.51Å; L836-F857 HydrophobicContact CD2-CZ 3.86Å; L836-F857 HydrophobicContact CG-CE2 4.45Å; L836-L886 HydrophobicContact CB-CD2 3.78Å
837	R	97.9	Very high	97.8	Very high	68 Å²	68	51.2 Å²	51.2	26%	0.257	23%	0.234	S	C	.	.	H	α-helix	trans	-62.5	-41.3	169.8	-75	-178.4	72.6	-170.3	11.8	112.7	C833 R834 H835 V839 L840 E841 L886 D890	C833-R837 WeakPolarHBondContact O-CG 3.27Å; C833-R837 PolarHBondContact O-N 3.12Å; R834-R837 PolarHBondContact O-N 3.44Å; H835-R837 VanDerWaalsContact C-N 3.29Å; H835-R837 PolarHBondContact O-N 2.96Å; R837-V839 PolarHBondContact O-N 2.97Å; R837-L840 CarbonylContact O-C 3.58Å; R837-L840 WeakPolarHBondContact O-CA 3.38Å; R837-L840 WeakPolarHBondContact O-CB 3.37Å; R837-L840 PolarHBondContact O-N 2.93Å; R837-E841 WeakPolarHBondContact O-CG 3.4Å; R837-E841 PolarHBondContact O-N 2.88Å; R837-L886 HydrophobicContact CG-CD2 4.44Å; R837-D890 IonicContact CZ-OD2 3.21Å; R837-D890 IonicContact NH1-OD1 3.23Å; R837-D890 PolarHBondContact NH1-OD1 3.32Å; R837-D890 IonicContact NH1-OD2 2.78Å; R837-D890 PolarHBondContact NH1-OD2 3.23Å; R837-D890 IonicContact NH2-OD2 2.75Å; R837-D890 PolarHBondContact NH2-OD2 3.22Å
838	R	97.9	Very high	97.8	Very high	90 Å²	90	49 Å²	49	34%	0.34	22%	0.222	S	C	.	.	H	α-helix	trans	-63	-29.4	175.1	-63.5	168	178.4	150.8	-4	112.9	E711 R834 H835	E711-R838 VanDerWaalsContact OE1-CD 3.3Å; E711-R838 WeakPolarHBondContact OE1-CD 3.45Å; E711-R838 IonicContact OE1-CZ 3.73Å; E711-R838 IonicContact OE1-NE 3.93Å; E711-R838 IonicContact OE1-NH1 2.79Å; E711-R838 PolarHBondContact OE1-NH1 3.21Å; E711-R838 VanDerWaalsContact OE2-CD 3.3Å; E711-R838 WeakPolarHBondContact OE2-CD 3.4Å; E711-R838 IonicContact OE2-CZ 3.38Å; E711-R838 IonicContact OE2-NE 3.58Å; E711-R838 IonicContact OE2-NH1 2.84Å; E711-R838 PolarHBondContact OE2-NH1 2.75Å; R834-R838 PolarHBondContact O-N 3.15Å; H835-R838 WeakPolarHBondContact O-CB 3.17Å; H835-R838 PolarHBondContact O-N 2.64Å; H835-R838 VanDerWaalsContact O-N 3.11Å
839	V	98.1	Very high	97.8	Very high	0 Å²	0	52 Å²	52	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-69.3	-43.3	170.2	178	0	0	0	0	110.8	L715 I720 Y721 H835 L836 R837 E841 R842 N846 M848 I853	L715-V839 HydrophobicContact CD2-CG2 3.92Å; I720-V839 HydrophobicContact CG2-CG1 3.56Å; Y721-V839 HydrophobicContact CD2-CG2 4.46Å; Y721-V839 HydrophobicContact CE2-CG2 4.13Å; H835-V839 PolarHBondContact O-N 2.9Å; L836-V839 WeakPolarHBondContact O-CB 3.31Å; L836-V839 PolarHBondContact O-N 3.45Å; R837-V839 PolarHBondContact O-N 2.97Å; V839-E841 VanDerWaalsContact C-N 3.31Å; V839-E841 PolarHBondContact O-N 3.23Å; V839-R842 PolarHBondContact O-N 2.8Å; V839-R842 VanDerWaalsContact O-N 3.09Å; V839-N846 PolarHBondContact O-ND2 3.47Å; V839-M848 HydrophobicContact CG1-CB 4.33Å; V839-I853 HydrophobicContact CG1-CD1 4.28Å
840	L	97.6	Very high	97.8	Very high	30 Å²	30	54.4 Å²	54.4	16%	0.157	26%	0.256	C	S	.	.	H	α-helix	trans	-67.4	-29.1	176.5	-64.3	175.3	0	0	0	112.8	L836 R837 R842 C843 M848 T849 T850 I853 L886	L836-L840 WeakPolarHBondContact O-CG 3.39Å; L836-L840 PolarHBondContact O-N 3.13Å; R837-L840 CarbonylContact O-C 3.58Å; R837-L840 WeakPolarHBondContact O-CA 3.38Å; R837-L840 WeakPolarHBondContact O-CB 3.37Å; R837-L840 PolarHBondContact O-N 2.93Å; L840-R842 PolarHBondContact O-N 3.17Å; L840-R842 VanDerWaalsContact O-N 3.11Å; L840-C843 VanDerWaalsContact O-CB 3.27Å; L840-C843 WeakPolarHBondContact O-CB 3.38Å; L840-C843 PolarHBondContact O-N 2.92Å; L840-C843 VanDerWaalsContact O-N 3.12Å; L840-C843 PolarHBondContact O-SG 2.75Å; L840-M848 VanDerWaalsContact CD2-O 3.32Å; L840-M848 WeakPolarHBondContact CD2-O 3.28Å; L840-T849 VanDerWaalsContact CD2-C 3.41Å; L840-T850 HydrophobicContact CD1-CG2 4.09Å; L840-I853 HydrophobicContact CD2-CG1 3.83Å; L840-I853 HydrophobicContact CG-CG1 4.47Å; L840-L886 HydrophobicContact CD1-CB 4.41Å; L840-L886 HydrophobicContact CD1-CD1 4.41Å
841	E	97.1	Very high	97.7	Very high	116 Å²	116	58.1 Å²	58.1	54%	0.542	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-1.5	169.5	-70.4	164.6	-148.3	0	0	113.9	R837 V839	R837-E841 WeakPolarHBondContact O-CG 3.4Å; R837-E841 PolarHBondContact O-N 2.88Å; V839-E841 VanDerWaalsContact C-N 3.31Å; V839-E841 PolarHBondContact O-N 3.23Å
842	R	96.9	Very high	97.6	Very high	107 Å²	107	58 Å²	58	40%	0.404	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-126.7	22.2	172.2	-65.1	-63.8	-179.8	-76.7	-7.4	112.6	L715 V839 L840 D844 T845 N846	L715-R842 HydrophobicContact CB-CG 4.14Å; L715-R842 WeakPolarHBondContact O-CB 3.31Å; V839-R842 PolarHBondContact O-N 2.8Å; V839-R842 VanDerWaalsContact O-N 3.09Å; L840-R842 PolarHBondContact O-N 3.17Å; L840-R842 VanDerWaalsContact O-N 3.11Å; R842-D844 PolarHBondContact O-N 2.94Å; R842-T845 PolarHBondContact O-N 2.9Å; R842-N846 WeakPolarHBondContact CB-ND2 3.49Å; R842-N846 PolarHBondContact O-N 2.78Å; R842-N846 PolarHBondContact O-ND2 2.98Å; R842-N846 PolarHBondContact O-OD1 2.83Å
843	C	96.1	Very high	97.6	Very high	51 Å²	51	58 Å²	58	35%	0.345	28%	0.275	S	S	.	.	H	α-helix	trans	-58.7	-29.2	-175.6	63	0	0	0	0	114.2	L840 T845 N846 R847 M848	L840-C843 VanDerWaalsContact O-CB 3.27Å; L840-C843 WeakPolarHBondContact O-CB 3.38Å; L840-C843 PolarHBondContact O-N 2.92Å; L840-C843 VanDerWaalsContact O-N 3.12Å; L840-C843 PolarHBondContact O-SG 2.75Å; C843-T845 VanDerWaalsContact C-N 3.33Å; C843-T845 PolarHBondContact O-N 3Å; C843-N846 WeakPolarHBondContact CA-OD1 3.46Å; C843-R847 WeakPolarHBondContact O-CA 3.31Å; C843-R847 PolarHBondContact O-N 2.9Å; C843-M848 WeakPolarHBondContact CB-O 3.34Å
844	D	96.9	Very high	97.6	Very high	153 Å²	153	58 Å²	58	82%	0.818	28%	0.275	S	S	*	.	H	α-helix	trans	-61.8	-37.9	173.4	-63.2	-53.2	0	0	0	112.8	R842	R842-D844 PolarHBondContact O-N 2.94Å
845	T	97.5	Very high	97.5	Very high	73 Å²	73	58.6 Å²	58.6	45%	0.448	28%	0.283	S	S	.	.	H	α-helix	trans	-86.9	-50.5	-179.3	-37.3	0	0	0	0	111.3	D716 R842 C843	D716-T845 HydrophobicContact CB-CG2 3.78Å; D716-T845 PolarHBondContact OD1-OG1 3.48Å; R842-T845 PolarHBondContact O-N 2.9Å; C843-T845 VanDerWaalsContact C-N 3.33Å; C843-T845 PolarHBondContact O-N 3Å
846	N	97.7	Very high	97.5	Very high	0 Å²	0	59.8 Å²	59.8	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-89.7	-6.4	-172.1	70.4	35	0	0	0	114.6	L715 T717 D718 G719 I720 V839 R842 C843 M848	L715-N846 VanDerWaalsContact O-CB 3.3Å; L715-N846 WeakPolarHBondContact O-CB 3.43Å; L715-N846 PolarHBondContact O-ND2 2.91Å; T717-N846 VanDerWaalsContact O-CB 3.31Å; T717-N846 WeakPolarHBondContact O-CB 3.22Å; D718-N846 WeakPolarHBondContact CA-O 3.37Å; G719-N846 PolarHBondContact N-O 2.93Å; I720-N846 HydrophobicContact CG2-CB 4.04Å; V839-N846 PolarHBondContact O-ND2 3.47Å; R842-N846 WeakPolarHBondContact CB-ND2 3.49Å; R842-N846 PolarHBondContact O-N 2.78Å; R842-N846 PolarHBondContact O-ND2 2.98Å; R842-N846 PolarHBondContact O-OD1 2.83Å; C843-N846 WeakPolarHBondContact CA-OD1 3.46Å; N846-M848 PolarHBondContact O-N 3.49Å; N846-M848 VanDerWaalsContact O-N 3.16Å; N846-M848 VanDerWaalsContact OD1-CB 3.3Å; N846-M848 WeakPolarHBondContact OD1-CB 3.24Å; N846-M848 PolarHBondContact OD1-N 2.88Å
847	R	97.8	Very high	97.5	Very high	158 Å²	158	59.8 Å²	59.8	60%	0.596	29%	0.291	S	S	*	.			trans	57.9	26.9	176.6	-51.4	-179.1	178.6	153.6	-7.5	114.3	D718 R722 C843 N852	D718-R847 WeakPolarHBondContact OD2-CD 3.33Å; D718-R847 IonicContact OD2-CZ 2.77Å; D718-R847 IonicContact OD2-NE 3.18Å; D718-R847 IonicContact OD2-NH1 3.59Å; D718-R847 PolarHBondContact OD2-NH1 3.12Å; R722-R847 PolarHBondContact NH1-O 3.22Å; C843-R847 WeakPolarHBondContact O-CA 3.31Å; C843-R847 PolarHBondContact O-N 2.9Å; R847-N852 PolarHBondContact O-ND2 2.96Å; R847-N852 VanDerWaalsContact O-ND2 3.11Å
848	M	97.9	Very high	97.4	Very high	0 Å²	0	56.6 Å²	56.6	0%	0	28%	0.279	C	S	.	.			trans	-100.8	109.5	173.9	-65.9	-59.3	-69.1	0	0	110.6	I720 R722 V839 L840 C843 N846 N852 I853	I720-M848 HydrophobicContact CG2-CG 4Å; I720-M848 WeakPolarHBondContact O-CE 3.48Å; I720-M848 WeakPolarHBondContact O-CG 3.26Å; R722-M848 HydrophobicContact CB-CE 3.81Å; R722-M848 HydrophobicContact CB-SD 3.62Å; V839-M848 HydrophobicContact CG1-CB 4.33Å; L840-M848 VanDerWaalsContact CD2-O 3.32Å; L840-M848 WeakPolarHBondContact CD2-O 3.28Å; C843-M848 WeakPolarHBondContact CB-O 3.34Å; N846-M848 PolarHBondContact O-N 3.49Å; N846-M848 VanDerWaalsContact O-N 3.16Å; N846-M848 VanDerWaalsContact OD1-CB 3.3Å; N846-M848 WeakPolarHBondContact OD1-CB 3.24Å; N846-M848 PolarHBondContact OD1-N 2.88Å; M848-N852 HydrophobicContact CE-CB 3.62Å; M848-N852 HydrophobicContact SD-CB 3.95Å; M848-I853 HydrophobicContact CB-CD1 4.16Å; M848-I853 HydrophobicContact CB-CG1 4.33Å; M848-I853 HydrophobicContact CE-CD1 3.46Å; M848-I853 VanDerWaalsContact CE-CD1 3.46Å; M848-I853 HydrophobicContact CE-CG1 4.06Å; M848-I853 HydrophobicContact CG-CD1 4.49Å
849	T	97.8	Very high	97.3	Very high	65 Å²	65	54.8 Å²	54.8	40%	0.399	28%	0.279	S	S	.	.			trans	-86.1	166.1	170.3	61.2	0	0	0	0	110.8	L840 Q851 N852 I853	L840-T849 VanDerWaalsContact CD2-C 3.41Å; T849-Q851 PolarHBondContact O-N 2.77Å; T849-N852 WeakPolarHBondContact O-CB 3.42Å; T849-N852 PolarHBondContact O-N 2.91Å; T849-N852 VanDerWaalsContact OG1-CG 3.29Å; T849-N852 PolarHBondContact OG1-N 3.04Å; T849-N852 VanDerWaalsContact OG1-N 3.16Å; T849-I853 PolarHBondContact O-N 3.28Å
850	T	97.4	Very high	97.3	Very high	52 Å²	52	55.4 Å²	55.4	32%	0.319	28%	0.282	S	S	.	.	H	α-helix	trans	-54.7	-39.8	174.8	-36.9	0	0	0	0	111.6	L840 I853 G854 E883 L886	L840-T850 HydrophobicContact CD1-CG2 4.09Å; T850-I853 PolarHBondContact O-N 2.77Å; T850-G854 PolarHBondContact O-N 3.05Å; T850-E883 HydrophobicContact CG2-CB 4.28Å; T850-E883 HydrophobicContact CG2-CG 4.22Å; T850-L886 HydrophobicContact CG2-CB 3.93Å; T850-L886 HydrophobicContact CG2-CD1 4.34Å
851	Q	97	Very high	97.3	Very high	118 Å²	118	54 Å²	54	55%	0.551	28%	0.275	S	S	*	.	H	α-helix	trans	-62.8	-44.9	173.2	-73.6	170.1	-8.9	0	0	113	T849 I853 G854 I855 E883	T849-Q851 PolarHBondContact O-N 2.77Å; Q851-I853 VanDerWaalsContact C-N 3.26Å; Q851-I853 PolarHBondContact O-N 2.85Å; Q851-G854 PolarHBondContact O-N 3.31Å; Q851-I855 VanDerWaalsContact O-CG1 3.3Å; Q851-I855 WeakPolarHBondContact O-CG1 3.35Å; Q851-I855 PolarHBondContact O-N 2.99Å; Q851-E883 WeakPolarHBondContact CG-OE2 3.2Å
852	N	97.1	Very high	97.1	Very high	48 Å²	48	48.6 Å²	48.6	26%	0.257	25%	0.25	S	S	.	.	H	α-helix	trans	-62	-35.8	176.6	-71.9	-12.4	0	0	0	111.5	R847 M848 T849 V856	R847-N852 PolarHBondContact O-ND2 2.96Å; R847-N852 VanDerWaalsContact O-ND2 3.11Å; M848-N852 HydrophobicContact CE-CB 3.62Å; M848-N852 HydrophobicContact SD-CB 3.95Å; T849-N852 WeakPolarHBondContact O-CB 3.42Å; T849-N852 PolarHBondContact O-N 2.91Å; T849-N852 VanDerWaalsContact OG1-CG 3.29Å; T849-N852 PolarHBondContact OG1-N 3.04Å; T849-N852 VanDerWaalsContact OG1-N 3.16Å; N852-V856 WeakPolarHBondContact O-CG2 3.41Å; N852-V856 PolarHBondContact O-N 3.25Å
853	I	98.2	Very high	96.8	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-72.5	-42.7	173.9	-63.9	-66.5	0	0	0	110.9	L836 V839 L840 M848 T849 T850 Q851 I855 V856 F857 L886	L836-I853 HydrophobicContact CB-CG2 4.37Å; L836-I853 HydrophobicContact CD1-CG2 3.99Å; L836-I853 HydrophobicContact CD2-CD1 4.3Å; L836-I853 HydrophobicContact CD2-CG2 4.12Å; L836-I853 HydrophobicContact CG-CG2 4.38Å; V839-I853 HydrophobicContact CG1-CD1 4.28Å; L840-I853 HydrophobicContact CD2-CG1 3.83Å; L840-I853 HydrophobicContact CG-CG1 4.47Å; M848-I853 HydrophobicContact CB-CD1 4.16Å; M848-I853 HydrophobicContact CB-CG1 4.33Å; M848-I853 HydrophobicContact CE-CD1 3.46Å; M848-I853 VanDerWaalsContact CE-CD1 3.46Å; M848-I853 HydrophobicContact CE-CG1 4.06Å; M848-I853 HydrophobicContact CG-CD1 4.49Å; T849-I853 PolarHBondContact O-N 3.28Å; T850-I853 PolarHBondContact O-N 2.77Å; Q851-I853 VanDerWaalsContact C-N 3.26Å; Q851-I853 PolarHBondContact O-N 2.85Å; I853-I855 PolarHBondContact O-N 3.43Å; I853-V856 PolarHBondContact O-N 3.12Å; I853-V856 VanDerWaalsContact O-N 3.13Å; I853-F857 HydrophobicContact CG2-CD2 3.91Å; I853-F857 WeakPolarHBondContact O-CB 3.46Å; I853-F857 PolarHBondContact O-N 2.77Å; I853-L886 HydrophobicContact CB-CD1 4.28Å; I853-L886 HydrophobicContact CG2-CD1 3.51Å
854	G	97.5	Very high	96.5	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-55.7	-47.9	176	0	0	0	0	0	112.6	T850 Q851 V856 F857 G858 N879	T850-G854 PolarHBondContact O-N 3.05Å; Q851-G854 PolarHBondContact O-N 3.31Å; G854-V856 VanDerWaalsContact C-N 3.28Å; G854-V856 PolarHBondContact O-N 3.11Å; G854-F857 PolarHBondContact O-N 3.47Å; G854-G858 WeakPolarHBondContact O-CA 3.37Å; G854-G858 PolarHBondContact O-N 3.49Å; G854-N879 PolarHBondContact O-OD1 2.68Å
855	I	96.8	Very high	96	Very high	100 Å²	100	44.2 Å²	44.2	51%	0.513	23%	0.225	S	C	.	.	H	α-helix	trans	-60.6	-34	176.7	-67.6	163	0	0	0	112.6	Q851 I853	Q851-I855 VanDerWaalsContact O-CG1 3.3Å; Q851-I855 WeakPolarHBondContact O-CG1 3.35Å; Q851-I855 PolarHBondContact O-N 2.99Å; I853-I855 PolarHBondContact O-N 3.43Å
856	V	97.8	Very high	95.3	Very high	27 Å²	27	47 Å²	47	16%	0.164	23%	0.231	C	C	.	.	H	α-helix	trans	-81.5	-42.1	179.2	172.6	0	0	0	0	111.7	K779 N852 I853 G854 T860	K779-V856 HydrophobicContact CD-CG1 3.71Å; N852-V856 WeakPolarHBondContact O-CG2 3.41Å; N852-V856 PolarHBondContact O-N 3.25Å; I853-V856 PolarHBondContact O-N 3.12Å; I853-V856 VanDerWaalsContact O-N 3.13Å; G854-V856 VanDerWaalsContact C-N 3.28Å; G854-V856 PolarHBondContact O-N 3.11Å; V856-T860 WeakPolarHBondContact O-CB 3.26Å; V856-T860 PolarHBondContact O-OG1 3.08Å
857	F	98.3	Very high	94.1	Very high	0 Å²	0	52 Å²	52	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-96.3	-23.6	-169.8	-81.9	-83.6	0	0	0	114.8	Y721 K779 M832 L836 I853 G854 T860 L861 V882	Y721-F857 AromaticContact CD1-CE2 3.7Å; Y721-F857 HydrophobicContact CD1-CE2 3.7Å; Y721-F857 AromaticContact CD1-CZ 3.47Å; Y721-F857 HydrophobicContact CD1-CZ 3.47Å; Y721-F857 VanDerWaalsContact CD1-CZ 3.47Å; Y721-F857 HydrophobicContact CD2-CE2 4.3Å; Y721-F857 HydrophobicContact CE1-CE2 4.3Å; Y721-F857 AromaticContact CE1-CZ 3.7Å; Y721-F857 HydrophobicContact CE1-CZ 3.7Å; Y721-F857 AromaticContact CG-CE2 3.71Å; Y721-F857 HydrophobicContact CG-CE2 3.71Å; Y721-F857 AromaticContact CG-CZ 3.96Å; Y721-F857 HydrophobicContact CG-CZ 3.96Å; K779-F857 HydrophobicContact CG-CZ 4.35Å; M832-F857 HydrophobicContact CE-CE1 3.77Å; M832-F857 HydrophobicContact CE-CZ 4.14Å; L836-F857 HydrophobicContact CD1-CD1 4.22Å; L836-F857 HydrophobicContact CD1-CD2 3.94Å; L836-F857 HydrophobicContact CD1-CE1 4.37Å; L836-F857 HydrophobicContact CD1-CE2 4.08Å; L836-F857 HydrophobicContact CD1-CG 3.98Å; L836-F857 HydrophobicContact CD1-CZ 4.29Å; L836-F857 HydrophobicContact CD2-CD2 4.06Å; L836-F857 HydrophobicContact CD2-CE2 3.51Å; L836-F857 HydrophobicContact CD2-CZ 3.86Å; L836-F857 HydrophobicContact CG-CE2 4.45Å; I853-F857 HydrophobicContact CG2-CD2 3.91Å; I853-F857 WeakPolarHBondContact O-CB 3.46Å; I853-F857 PolarHBondContact O-N 2.77Å; G854-F857 PolarHBondContact O-N 3.47Å; F857-T860 HydrophobicContact CD1-CG2 4.39Å; F857-T860 PolarHBondContact O-N 3.12Å; F857-T860 VanDerWaalsContact O-N 3.11Å; F857-L861 HydrophobicContact CB-CD1 4.14Å; F857-L861 HydrophobicContact CB-CG 4.23Å; F857-L861 HydrophobicContact CD1-CD1 4.06Å; F857-L861 HydrophobicContact CD1-CD2 3.98Å; F857-L861 HydrophobicContact CD1-CG 3.9Å; F857-L861 WeakPolarHBondContact O-CB 3.4Å; F857-L861 WeakPolarHBondContact O-CG 3.48Å; F857-L861 PolarHBondContact O-N 3Å; F857-V882 HydrophobicContact CB-CG1 4.08Å
858	G	96.9	Very high	92.8	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-47.6	-68.7	172.1	0	0	0	0	0	112.2	G854 T860 L861 M862	G854-G858 WeakPolarHBondContact O-CA 3.37Å; G854-G858 PolarHBondContact O-N 3.49Å; G858-T860 PolarHBondContact O-N 2.89Å; G858-T860 VanDerWaalsContact O-N 3.13Å; G858-L861 PolarHBondContact O-N 3.08Å; G858-M862 WeakPolarHBondContact O-CG 3.46Å; G858-M862 PolarHBondContact O-N 3.46Å; G858-M862 VanDerWaalsContact O-N 3.08Å
859	P	95.1	Very high	91.1	Very high	53 Å²	53	53.9 Å²	53.9	34%	0.344	30%	0.296	S	S	.	.	H	α-helix	trans	-70.1	-6	178.3	29.3	-37	0	0	0	114.8
860	T	97.1	Very high	90	Very high	12 Å²	12	54.9 Å²	54.9	7%	0.074	30%	0.299	C	S	.	.	H	α-helix	trans	-91.8	-38.5	177.6	-61.4	0	0	0	0	111.9	K779 F782 V856 F857 G858	K779-T860 HydrophobicContact CB-CG2 4.43Å; F782-T860 HydrophobicContact CB-CG2 3.87Å; V856-T860 WeakPolarHBondContact O-CB 3.26Å; V856-T860 PolarHBondContact O-OG1 3.08Å; F857-T860 HydrophobicContact CD1-CG2 4.39Å; F857-T860 PolarHBondContact O-N 3.12Å; F857-T860 VanDerWaalsContact O-N 3.11Å; G858-T860 PolarHBondContact O-N 2.89Å; G858-T860 VanDerWaalsContact O-N 3.13Å
861	L	97.4	Very high	88.9	Confident	1 Å²	1	58 Å²	58	1%	0.005	31%	0.311	C	S	.	.	H	α-helix	trans	-95.1	-26	-176.7	-57.7	-175.8	0	0	0	113.1	F782 P788 L789 V790 L829 F857 G858	F782-L861 HydrophobicContact CB-CD2 4.3Å; F782-L861 HydrophobicContact CD1-CD2 4.23Å; F782-L861 HydrophobicContact CD2-CD2 4.16Å; F782-L861 HydrophobicContact CG-CD2 3.97Å; P788-L861 WeakPolarHBondContact CB-O 3.44Å; L789-L861 HydrophobicContact CB-CD2 4.42Å; L789-L861 HydrophobicContact CD2-CD2 3.85Å; L789-L861 PolarHBondContact N-O 2.57Å; L789-L861 VanDerWaalsContact N-O 3.11Å; V790-L861 PolarHBondContact N-O 2.86Å; L829-L861 HydrophobicContact CD1-CD1 4.12Å; F857-L861 HydrophobicContact CB-CD1 4.14Å; F857-L861 HydrophobicContact CB-CG 4.23Å; F857-L861 HydrophobicContact CD1-CD1 4.06Å; F857-L861 HydrophobicContact CD1-CD2 3.98Å; F857-L861 HydrophobicContact CD1-CG 3.9Å; F857-L861 WeakPolarHBondContact O-CB 3.4Å; F857-L861 WeakPolarHBondContact O-CG 3.48Å; F857-L861 PolarHBondContact O-N 3Å; G858-L861 PolarHBondContact O-N 3.08Å
862	M	94.6	Very high	88.1	Confident	3 Å²	3	55.5 Å²	55.5	2%	0.015	31%	0.311	C	S	.	.			trans	-140.8	142.4	-176.5	55.9	173.2	79.4	0	0	112	V790 F795 G858 Q878 A881 V882	V790-M862 HydrophobicContact CB-CB 3.95Å; V790-M862 HydrophobicContact CG1-CB 4.36Å; V790-M862 HydrophobicContact CG2-CB 4.35Å; V790-M862 HydrophobicContact CG2-CE 4.18Å; F795-M862 HydrophobicContact CD2-CB 4.29Å; F795-M862 HydrophobicContact CE2-CB 4.42Å; G858-M862 WeakPolarHBondContact O-CG 3.46Å; G858-M862 PolarHBondContact O-N 3.46Å; G858-M862 VanDerWaalsContact O-N 3.08Å; M862-Q878 HydrophobicContact CG-CB 4.08Å; M862-Q878 HydrophobicContact CG-CG 3.86Å; M862-Q878 HydrophobicContact SD-CB 3.95Å; M862-Q878 HydrophobicContact SD-CG 3.9Å; M862-A881 HydrophobicContact CE-CB 3.72Å; M862-A881 HydrophobicContact SD-CB 3.92Å; M862-V882 HydrophobicContact CE-CG2 3.99Å
863	R	90.6	Very high	87.5	Confident	56 Å²	56	55.5 Å²	55.5	21%	0.211	31%	0.313	C	S	.	.			trans	-159	147.2	178.4	61	-167.2	-176.2	-118	2.7	109.4	L785 P786 P788 Y792	L785-R863 PolarHBondContact O-NH2 2.8Å; P786-R863 PolarHBondContact O-NH2 3.29Å; P788-R863 HydrophobicContact CB-CG 4.07Å; P788-R863 HydrophobicContact CG-CG 3.86Å; Y792-R863 WeakPolarHBondContact CD1-O 3.43Å; Y792-R863 HydrophobicContact CE1-CG 4.13Å; Y792-R863 PolarHBondContact OH-NH2 2.89Å
864	P	89.1	Confident	86.8	Confident	38 Å²	38	56.9 Å²	56.9	25%	0.247	32%	0.32	C	S	.	.			trans	-68.7	155.7	175.4	31.8	-36.7	0	0	0	110.9	F795 F866	F795-P864 HydrophobicContact CD1-CB 3.97Å; F795-P864 HydrophobicContact CE1-CB 3.74Å; F795-P864 HydrophobicContact CE1-CG 4.38Å; F795-P864 HydrophobicContact CZ-CB 4.18Å; F795-P864 HydrophobicContact CZ-CG 4.4Å; P864-F866 VanDerWaalsContact C-N 3.34Å; P864-F866 WeakPolarHBondContact CB-O 3.42Å
865	E	86.6	Confident	86.3	Confident	124 Å²	124	61.3 Å²	61.3	58%	0.579	34%	0.342	S	S	*	.	S	Bend	trans	-69	-34.5	174.6	-168.7	-176.5	-176.7	0	0	111.9	Y792	Y792-E865 HydrophobicContact CD1-CB 3.76Å; Y792-E865 HydrophobicContact CD1-CG 4.39Å; Y792-E865 HydrophobicContact CD2-CG 4.44Å; Y792-E865 HydrophobicContact CE1-CB 4.24Å; Y792-E865 HydrophobicContact CG-CB 3.96Å; Y792-E865 HydrophobicContact CG-CG 4.29Å
866	F	81.8	Confident	86.1	Confident	131 Å²	131	60.9 Å²	60.9	58%	0.575	34%	0.339	S	S	*	.	S	Bend	trans	-124.3	150.1	-179.7	-55.7	-73.7	0	0	0	111.2	P864 N868	P864-F866 VanDerWaalsContact C-N 3.34Å; P864-F866 WeakPolarHBondContact CB-O 3.42Å; F866-N868 PolarHBondContact O-N 3.14Å; F866-N868 PolarHBondContact O-OD1 3.28Å; F866-N868 VanDerWaalsContact O-OD1 3.11Å
867	D	73.8	Confident	85.8	Confident	107 Å²	107	62.5 Å²	62.5	57%	0.572	34%	0.343	S	S	*	.			trans	-87	91.5	170.8	-175.2	6.2	0	0	0	109.9	G869 M871	D867-G869 PolarHBondContact O-N 2.64Å; D867-G869 VanDerWaalsContact O-N 3.07Å; D867-G869 PolarHBondContact OD1-N 3.15Å; D867-G869 VanDerWaalsContact OD1-N 3.12Å; D867-M871 WeakPolarHBondContact OD2-CE 3.42Å
868	N	70.5	Confident	85.6	Confident	127 Å²	127	63 Å²	63	68%	0.679	35%	0.346	S	S	*	.			trans	-73.2	14.2	178.4	-61.6	77.4	0	0	0	113.6	F866 N870	F866-N868 PolarHBondContact O-N 3.14Å; F866-N868 PolarHBondContact O-OD1 3.28Å; F866-N868 VanDerWaalsContact O-OD1 3.11Å; N868-N870 PolarHBondContact O-N 3.17Å
869	G	60.8	Low	85.5	Confident	69 Å²	69	64 Å²	64	71%	0.711	35%	0.351	S	S	*	.	S	Bend	trans	77.9	-5	176.2	0	0	0	0	0	115.2	D867	D867-G869 PolarHBondContact O-N 2.64Å; D867-G869 VanDerWaalsContact O-N 3.07Å; D867-G869 PolarHBondContact OD1-N 3.15Å; D867-G869 VanDerWaalsContact OD1-N 3.12Å
870	N	74.9	Confident	85.6	Confident	86 Å²	86	65.3 Å²	65.3	46%	0.46	35%	0.352	S	S	.	.			trans	-105.4	35.7	178.1	-153	7.4	0	0	0	112.4	N868 A872 V873 N874	N868-N870 PolarHBondContact O-N 3.17Å; N870-A872 VanDerWaalsContact C-N 3.31Å; N870-A872 PolarHBondContact O-N 2.76Å; N870-V873 PolarHBondContact O-N 2.99Å; N870-V873 VanDerWaalsContact O-N 3.15Å; N870-V873 WeakPolarHBondContact OD1-CB 3.45Å; N870-V873 WeakPolarHBondContact OD1-CG2 3.49Å; N870-N874 PolarHBondContact O-N 3.08Å; N870-N874 VanDerWaalsContact O-N 3.09Å
871	M	75.8	Confident	85.5	Confident	117 Å²	117	64.8 Å²	64.8	58%	0.576	35%	0.349	S	S	*	.	H	α-helix	trans	-54.3	-40.9	-171.2	-173.8	-175.9	-63.7	0	0	113.5	D867 V873 N874 M875	D867-M871 WeakPolarHBondContact OD2-CE 3.42Å; M871-V873 PolarHBondContact O-N 2.88Å; M871-N874 PolarHBondContact O-N 2.95Å; M871-M875 WeakPolarHBondContact O-CB 3.4Å; M871-M875 PolarHBondContact O-N 3.1Å
872	A	80.1	Confident	85.5	Confident	66 Å²	66	64.9 Å²	64.9	55%	0.545	35%	0.35	S	S	.	.	H	α-helix	trans	-62.8	-41.1	-179.6	0	0	0	0	0	112.6	N870 M875 I876	N870-A872 VanDerWaalsContact C-N 3.31Å; N870-A872 PolarHBondContact O-N 2.76Å; A872-M875 PolarHBondContact O-N 3.02Å; A872-I876 WeakPolarHBondContact O-CG1 3.45Å; A872-I876 PolarHBondContact O-N 3.42Å
873	V	83.5	Confident	85.7	Confident	49 Å²	49	66.8 Å²	66.8	30%	0.297	36%	0.359	S	S	.	.	H	α-helix	trans	-70.4	-42.2	177.6	171.5	0	0	0	0	110.8	N870 M871 M875 I876 Y877	N870-V873 PolarHBondContact O-N 2.99Å; N870-V873 VanDerWaalsContact O-N 3.15Å; N870-V873 WeakPolarHBondContact OD1-CB 3.45Å; N870-V873 WeakPolarHBondContact OD1-CG2 3.49Å; M871-V873 PolarHBondContact O-N 2.88Å; V873-M875 VanDerWaalsContact C-N 3.32Å; V873-M875 PolarHBondContact O-N 2.91Å; V873-I876 PolarHBondContact O-N 3.04Å; V873-Y877 HydrophobicContact CG1-CD2 3.81Å; V873-Y877 HydrophobicContact CG1-CE2 3.31Å; V873-Y877 VanDerWaalsContact O-CD2 3.26Å; V873-Y877 WeakPolarHBondContact O-CD2 3.23Å; V873-Y877 PolarHBondContact O-N 2.92Å
874	N	84.2	Confident	85.9	Confident	28 Å²	28	65.1 Å²	65.1	15%	0.15	35%	0.354	C	S	.	.	H	α-helix	trans	-60.8	-40.4	175	-73.7	-5	0	0	0	111.8	F795 N870 M871 I876 Y877 Q878	F795-N874 HydrophobicContact CZ-CB 4.41Å; N870-N874 PolarHBondContact O-N 3.08Å; N870-N874 VanDerWaalsContact O-N 3.09Å; M871-N874 PolarHBondContact O-N 2.95Å; N874-I876 VanDerWaalsContact C-N 3.34Å; N874-I876 PolarHBondContact O-N 3.29Å; N874-Y877 PolarHBondContact O-N 3.46Å; N874-Q878 WeakPolarHBondContact O-CG 3.28Å; N874-Q878 PolarHBondContact O-N 3.48Å
875	M	87.1	Confident	86.3	Confident	94 Å²	94	63.4 Å²	63.4	46%	0.463	34%	0.343	S	S	.	.	H	α-helix	trans	-63.4	-36.5	177.2	-171.4	178.3	71.1	0	0	112.7	M871 A872 V873 Q878 N879	M871-M875 WeakPolarHBondContact O-CB 3.4Å; M871-M875 PolarHBondContact O-N 3.1Å; A872-M875 PolarHBondContact O-N 3.02Å; V873-M875 VanDerWaalsContact C-N 3.32Å; V873-M875 PolarHBondContact O-N 2.91Å; M875-Q878 PolarHBondContact O-N 2.64Å; M875-N879 PolarHBondContact O-N 3.48Å; M875-N879 PolarHBondContact O-ND2 2.84Å; M875-N879 PolarHBondContact O-OD1 2.82Å
876	I	91.8	Very high	86.8	Confident	90 Å²	90	57.8 Å²	57.8	46%	0.462	32%	0.316	S	S	.	.	H	α-helix	trans	-63.9	-48.9	174.6	-66.8	164.4	0	0	0	110.4	A872 V873 N874 Q878 N879 Q880	A872-I876 WeakPolarHBondContact O-CG1 3.45Å; A872-I876 PolarHBondContact O-N 3.42Å; V873-I876 PolarHBondContact O-N 3.04Å; N874-I876 VanDerWaalsContact C-N 3.34Å; N874-I876 PolarHBondContact O-N 3.29Å; I876-Q878 VanDerWaalsContact C-N 3.32Å; I876-Q878 PolarHBondContact O-N 2.84Å; I876-N879 PolarHBondContact O-N 3.06Å; I876-Q880 HydrophobicContact CG2-CG 4.49Å; I876-Q880 WeakPolarHBondContact O-CG 3.16Å; I876-Q880 PolarHBondContact O-N 3.35Å
877	Y	92.6	Very high	87.5	Confident	61 Å²	61	54.9 Å²	54.9	24%	0.239	31%	0.312	C	S	.	.	H	α-helix	trans	-66.7	-30.9	179.4	-64.9	-51.9	0	0	0	113.2	V799 V802 K803 V873 N874 A881	V799-Y877 HydrophobicContact CG1-CD2 3.74Å; V799-Y877 HydrophobicContact CG1-CG 4.04Å; V802-Y877 HydrophobicContact CG1-CD1 3.93Å; K803-Y877 HydrophobicContact CD-CE2 4.34Å; K803-Y877 VanDerWaalsContact CE-CE2 3.46Å; K803-Y877 HydrophobicContact CG-CD1 4.32Å; K803-Y877 HydrophobicContact CG-CE1 3.71Å; K803-Y877 HydrophobicContact CG-CE2 4.21Å; V873-Y877 HydrophobicContact CG1-CD2 3.81Å; V873-Y877 HydrophobicContact CG1-CE2 3.31Å; V873-Y877 VanDerWaalsContact O-CD2 3.26Å; V873-Y877 WeakPolarHBondContact O-CD2 3.23Å; V873-Y877 PolarHBondContact O-N 2.92Å; N874-Y877 PolarHBondContact O-N 3.46Å; Y877-A881 VanDerWaalsContact O-CB 3.29Å; Y877-A881 WeakPolarHBondContact O-CB 3.29Å; Y877-A881 PolarHBondContact O-N 3.18Å
878	Q	93.6	Very high	88.5	Confident	12 Å²	12	51.7 Å²	51.7	6%	0.056	29%	0.294	C	S	.	.	H	α-helix	trans	-62.2	-45.1	172.3	-73.7	166	1.8	0	0	112.2	F795 M862 N874 M875 I876 A881 V882	F795-Q878 HydrophobicContact CE2-CG 3.75Å; F795-Q878 HydrophobicContact CZ-CG 4.04Å; M862-Q878 HydrophobicContact CG-CB 4.08Å; M862-Q878 HydrophobicContact CG-CG 3.86Å; M862-Q878 HydrophobicContact SD-CB 3.95Å; M862-Q878 HydrophobicContact SD-CG 3.9Å; N874-Q878 WeakPolarHBondContact O-CG 3.28Å; N874-Q878 PolarHBondContact O-N 3.48Å; M875-Q878 PolarHBondContact O-N 2.64Å; I876-Q878 VanDerWaalsContact C-N 3.32Å; I876-Q878 PolarHBondContact O-N 2.84Å; Q878-A881 PolarHBondContact O-N 3.36Å; Q878-V882 PolarHBondContact O-N 2.85Å
879	N	95.8	Very high	89.7	Confident	19 Å²	19	46.1 Å²	46.1	10%	0.102	26%	0.264	C	S	.	.	H	α-helix	trans	-65.5	-47.4	178.6	-60.6	-10.7	0	0	0	110.3	G854 M875 I876 A881 V882 E883	G854-N879 PolarHBondContact O-OD1 2.68Å; M875-N879 PolarHBondContact O-N 3.48Å; M875-N879 PolarHBondContact O-ND2 2.84Å; M875-N879 PolarHBondContact O-OD1 2.82Å; I876-N879 PolarHBondContact O-N 3.06Å; N879-A881 VanDerWaalsContact C-N 3.33Å; N879-A881 PolarHBondContact O-N 2.76Å; N879-V882 PolarHBondContact O-N 2.97Å; N879-E883 WeakPolarHBondContact O-CG 3.31Å; N879-E883 PolarHBondContact O-N 3.41Å
880	Q	95.9	Very high	91.3	Very high	82 Å²	82	45.1 Å²	45.1	38%	0.383	24%	0.242	S	C	.	.	H	α-helix	trans	-61.5	-36.3	177.1	-72.6	177	-22.6	0	0	113.1	V802 I876 E883 L884	V802-Q880 HydrophobicContact CG1-CB 3.72Å; I876-Q880 HydrophobicContact CG2-CG 4.49Å; I876-Q880 WeakPolarHBondContact O-CG 3.16Å; I876-Q880 PolarHBondContact O-N 3.35Å; Q880-E883 PolarHBondContact O-N 3.12Å; Q880-L884 WeakPolarHBondContact O-CB 3.49Å; Q880-L884 PolarHBondContact O-N 2.85Å
881	A	96.3	Very high	92.2	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-62.4	-47.3	173.6	0	0	0	0	0	111.2	I798 V802 M862 Y877 Q878 N879 L884 I885	I798-A881 HydrophobicContact CG2-CB 3.72Å; V802-A881 HydrophobicContact CG2-CB 3.9Å; M862-A881 HydrophobicContact CE-CB 3.72Å; M862-A881 HydrophobicContact SD-CB 3.92Å; Y877-A881 VanDerWaalsContact O-CB 3.29Å; Y877-A881 WeakPolarHBondContact O-CB 3.29Å; Y877-A881 PolarHBondContact O-N 3.18Å; Q878-A881 PolarHBondContact O-N 3.36Å; N879-A881 VanDerWaalsContact C-N 3.33Å; N879-A881 PolarHBondContact O-N 2.76Å; A881-L884 PolarHBondContact O-N 2.76Å; A881-I885 WeakPolarHBondContact O-CG1 3.42Å; A881-I885 PolarHBondContact O-N 2.69Å
882	V	97.3	Very high	93.1	Very high	3 Å²	3	40.5 Å²	40.5	2%	0.018	22%	0.216	C	C	.	.	H	α-helix	trans	-65.4	-38.4	176.5	173.4	0	0	0	0	111.7	F857 M862 Q878 N879 I885 L886	F857-V882 HydrophobicContact CB-CG1 4.08Å; M862-V882 HydrophobicContact CE-CG2 3.99Å; Q878-V882 PolarHBondContact O-N 2.85Å; N879-V882 PolarHBondContact O-N 2.97Å; V882-I885 PolarHBondContact O-N 3.29Å; V882-L886 HydrophobicContact CG1-CD1 3.8Å; V882-L886 HydrophobicContact CG1-CG 4.39Å; V882-L886 WeakPolarHBondContact O-CB 3.44Å; V882-L886 VanDerWaalsContact O-CG 3.25Å; V882-L886 WeakPolarHBondContact O-CG 3.19Å; V882-L886 PolarHBondContact O-N 3.17Å
883	E	97.1	Very high	93.8	Very high	44 Å²	44	38.1 Å²	38.1	21%	0.206	19%	0.193	C	C	.	.	H	α-helix	trans	-59.4	-47.3	174	-74.5	172	-130.2	0	0	111.8	T850 Q851 N879 Q880 L886 S887	T850-E883 HydrophobicContact CG2-CB 4.28Å; T850-E883 HydrophobicContact CG2-CG 4.22Å; Q851-E883 WeakPolarHBondContact CG-OE2 3.2Å; N879-E883 WeakPolarHBondContact O-CG 3.31Å; N879-E883 PolarHBondContact O-N 3.41Å; Q880-E883 PolarHBondContact O-N 3.12Å; E883-L886 PolarHBondContact O-N 3.39Å; E883-S887 PolarHBondContact O-N 3.04Å; E883-S887 PolarHBondContact O-OG 2.99Å
884	L	96.6	Very high	93.7	Very high	21 Å²	21	43.2 Å²	43.2	11%	0.11	21%	0.207	C	C	.	.	H	α-helix	trans	-65.8	-40.1	178.6	-175.1	58.7	0	0	0	112.4	K810 V811 L814 Q880 A881 L886 S887 E888	K810-L884 HydrophobicContact CB-CD2 4.37Å; V811-L884 HydrophobicContact CG2-CD1 4.1Å; L814-L884 HydrophobicContact CD2-CB 4.33Å; L814-L884 HydrophobicContact CD2-CD2 3.71Å; L814-L884 HydrophobicContact CD2-CG 3.86Å; Q880-L884 WeakPolarHBondContact O-CB 3.49Å; Q880-L884 PolarHBondContact O-N 2.85Å; A881-L884 PolarHBondContact O-N 2.76Å; L884-L886 VanDerWaalsContact C-N 3.27Å; L884-L886 PolarHBondContact O-N 2.78Å; L884-S887 PolarHBondContact O-OG 2.73Å; L884-E888 HydrophobicContact CD1-CB 4.48Å; L884-E888 HydrophobicContact CD1-CG 3.85Å; L884-E888 WeakPolarHBondContact O-CB 3.38Å; L884-E888 PolarHBondContact O-N 3.29Å
885	I	96.7	Very high	92.5	Very high	2 Å²	2	47 Å²	47	1%	0.01	23%	0.231	C	C	.	.	H	α-helix	trans	-62.7	-34.1	175	-66.8	167.8	0	0	0	111.5	L814 C833 A881 V882 F889 I892 F893	L814-I885 HydrophobicContact CD2-CG1 3.88Å; L814-I885 HydrophobicContact CG-CG1 4.41Å; C833-I885 HydrophobicContact CB-CG2 4.33Å; C833-I885 VanDerWaalsContact SG-CG2 3.58Å; A881-I885 WeakPolarHBondContact O-CG1 3.42Å; A881-I885 PolarHBondContact O-N 2.69Å; V882-I885 PolarHBondContact O-N 3.29Å; I885-F889 VanDerWaalsContact O-CA 3.28Å; I885-F889 WeakPolarHBondContact O-CA 3.42Å; I885-F889 WeakPolarHBondContact O-CB 3.39Å; I885-F889 PolarHBondContact O-N 3.02Å; I885-I892 HydrophobicContact CG1-CD1 4.41Å; I885-F893 HydrophobicContact CG2-CE2 3.63Å; I885-F893 HydrophobicContact CG2-CZ 3.94Å
886	L	97.1	Very high	90.5	Very high	5 Å²	5	54 Å²	54	3%	0.026	25%	0.253	C	S	.	.	H	α-helix	trans	-81.6	-38.3	179.8	-70.3	170.1	0	0	0	113	C833 L836 R837 L840 T850 I853 V882 E883 L884	C833-L886 HydrophobicContact CB-CD2 3.95Å; L836-L886 HydrophobicContact CB-CD2 3.78Å; R837-L886 HydrophobicContact CG-CD2 4.44Å; L840-L886 HydrophobicContact CD1-CB 4.41Å; L840-L886 HydrophobicContact CD1-CD1 4.41Å; T850-L886 HydrophobicContact CG2-CB 3.93Å; T850-L886 HydrophobicContact CG2-CD1 4.34Å; I853-L886 HydrophobicContact CB-CD1 4.28Å; I853-L886 HydrophobicContact CG2-CD1 3.51Å; V882-L886 HydrophobicContact CG1-CD1 3.8Å; V882-L886 HydrophobicContact CG1-CG 4.39Å; V882-L886 WeakPolarHBondContact O-CB 3.44Å; V882-L886 VanDerWaalsContact O-CG 3.25Å; V882-L886 WeakPolarHBondContact O-CG 3.19Å; V882-L886 PolarHBondContact O-N 3.17Å; E883-L886 PolarHBondContact O-N 3.39Å; L884-L886 VanDerWaalsContact C-N 3.27Å; L884-L886 PolarHBondContact O-N 2.78Å
887	S	95.7	Very high	87.8	Confident	70 Å²	70	53 Å²	53	49%	0.49	27%	0.265	S	S	.	.	H	α-helix	trans	-70.9	-41.9	176.8	59.5	0	0	0	0	112.1	E883 L884	E883-S887 PolarHBondContact O-N 3.04Å; E883-S887 PolarHBondContact O-OG 2.99Å; L884-S887 PolarHBondContact O-OG 2.73Å
888	E	95.8	Very high	85.2	Confident	40 Å²	40	58.6 Å²	58.6	19%	0.187	30%	0.298	C	S	.	.	S	Bend	trans	-103.5	21.8	-174.7	-60.8	-71	-176.8	0	0	112.6	H807 V811 L884 D890 H891 I892	H807-E888 IonicContact CD2-OE1 2.74Å; H807-E888 IonicContact CE1-OE1 2.69Å; H807-E888 IonicContact NE2-OE1 3.18Å; H807-E888 PolarHBondContact NE2-OE1 2.66Å; V811-E888 HydrophobicContact CG1-CB 4.18Å; V811-E888 HydrophobicContact CG2-CB 3.96Å; V811-E888 HydrophobicContact CG2-CG 3.64Å; L884-E888 HydrophobicContact CD1-CB 4.48Å; L884-E888 HydrophobicContact CD1-CG 3.85Å; L884-E888 WeakPolarHBondContact O-CB 3.38Å; L884-E888 PolarHBondContact O-N 3.29Å; E888-D890 VanDerWaalsContact C-N 3.26Å; E888-D890 PolarHBondContact O-N 3.13Å; E888-D890 VanDerWaalsContact O-N 3.16Å; E888-H891 WeakPolarHBondContact O-CA 3.23Å; E888-H891 PolarHBondContact O-N 3.45Å; E888-H891 IonicContact OE2-CE1 3.6Å; E888-H891 IonicContact OE2-CG 3.77Å; E888-H891 IonicContact OE2-ND1 2.73Å; E888-H891 PolarHBondContact OE2-ND1 2.99Å; E888-I892 HydrophobicContact CB-CD1 4.04Å; E888-I892 HydrophobicContact CB-CG1 4.46Å; E888-I892 WeakPolarHBondContact O-CG1 3.12Å; E888-I892 PolarHBondContact O-N 3.28Å
889	F	96.1	Very high	82.2	Confident	10 Å²	10	67 Å²	67	4%	0.044	36%	0.358	C	S	.	.	H	α-helix	trans	-48.1	-45.6	-178.4	179	-79.8	0	0	0	113	E830 C833 R834 I885 H891 I892 F893	E830-F889 HydrophobicContact CG-CE2 4.38Å; E830-F889 HydrophobicContact CG-CZ 4.05Å; C833-F889 HydrophobicContact CB-CD2 3.74Å; C833-F889 HydrophobicContact CB-CE2 3.73Å; R834-F889 HydrophobicContact CB-CE2 4.08Å; R834-F889 HydrophobicContact CB-CZ 3.85Å; I885-F889 VanDerWaalsContact O-CA 3.28Å; I885-F889 WeakPolarHBondContact O-CA 3.42Å; I885-F889 WeakPolarHBondContact O-CB 3.39Å; I885-F889 PolarHBondContact O-N 3.02Å; F889-H891 VanDerWaalsContact C-N 3.3Å; F889-H891 PolarHBondContact O-N 3.45Å; F889-I892 PolarHBondContact O-N 3.11Å; F889-F893 HydrophobicContact CB-CD2 4.47Å; F889-F893 HydrophobicContact CD1-CD2 4.31Å; F889-F893 AromaticContact CD2-CD2 3.35Å; F889-F893 HydrophobicContact CD2-CD2 3.35Å; F889-F893 AromaticContact CD2-CE2 3.61Å; F889-F893 HydrophobicContact CD2-CE2 3.61Å; F889-F893 HydrophobicContact CD2-CG 4.41Å; F889-F893 HydrophobicContact CE1-CB 4.28Å; F889-F893 HydrophobicContact CE1-CD2 4.37Å; F889-F893 AromaticContact CE2-CD2 3.42Å; F889-F893 HydrophobicContact CE2-CD2 3.42Å; F889-F893 VanDerWaalsContact CE2-CD2 3.42Å; F889-F893 AromaticContact CE2-CE2 3.76Å; F889-F893 HydrophobicContact CE2-CE2 3.76Å; F889-F893 HydrophobicContact CE2-CG 4.12Å; F889-F893 AromaticContact CG-CD2 3.82Å; F889-F893 HydrophobicContact CG-CD2 3.82Å; F889-F893 HydrophobicContact CG-CE2 4.41Å; F889-F893 HydrophobicContact CZ-CB 4.21Å; F889-F893 AromaticContact CZ-CD2 3.95Å; F889-F893 HydrophobicContact CZ-CD2 3.95Å; F889-F893 HydrophobicContact CZ-CG 4.27Å; F889-F893 PolarHBondContact O-N 3.26Å
890	D	94.4	Very high	81.5	Confident	48 Å²	48	69.4 Å²	69.4	26%	0.257	37%	0.371	S	S	.	.	H	α-helix	trans	-71.7	-25.4	-177.6	-73.7	-53	0	0	0	112.6	R837 E888 R894	R837-D890 IonicContact CZ-OD2 3.21Å; R837-D890 IonicContact NH1-OD1 3.23Å; R837-D890 PolarHBondContact NH1-OD1 3.32Å; R837-D890 IonicContact NH1-OD2 2.78Å; R837-D890 PolarHBondContact NH1-OD2 3.23Å; R837-D890 IonicContact NH2-OD2 2.75Å; R837-D890 PolarHBondContact NH2-OD2 3.22Å; E888-D890 VanDerWaalsContact C-N 3.26Å; E888-D890 PolarHBondContact O-N 3.13Å; E888-D890 VanDerWaalsContact O-N 3.16Å; D890-R894 WeakPolarHBondContact O-CB 3.46Å; D890-R894 WeakPolarHBondContact O-CD 3.36Å; D890-R894 WeakPolarHBondContact O-CG 3.37Å; D890-R894 IonicContact OD1-CZ 3.17Å; D890-R894 IonicContact OD1-NE 2.77Å; D890-R894 PolarHBondContact OD1-NE 3.37Å; D890-R894 IonicContact OD1-NH2 2.76Å; D890-R894 PolarHBondContact OD1-NH2 3.36Å; D890-R894 IonicContact OD2-NH2 3.56Å
891	H	93.6	Very high	80.8	Confident	107 Å²	107	68.7 Å²	68.7	50%	0.495	37%	0.37	S	S	.	.	H	α-helix	trans	-79.6	-38.8	170.7	-68.3	121.5	0	0	0	111.7	V811 K815 E888 F889	V811-H891 HydrophobicContact CG1-CB 3.74Å; K815-H891 VanDerWaalsContact CD-O 3.32Å; K815-H891 WeakPolarHBondContact CD-O 3.28Å; K815-H891 WeakPolarHBondContact CE-O 3.43Å; K815-H891 PolarHBondContact NZ-O 2.85Å; E888-H891 WeakPolarHBondContact O-CA 3.23Å; E888-H891 PolarHBondContact O-N 3.45Å; E888-H891 IonicContact OE2-CE1 3.6Å; E888-H891 IonicContact OE2-CG 3.77Å; E888-H891 IonicContact OE2-ND1 2.73Å; E888-H891 PolarHBondContact OE2-ND1 2.99Å; F889-H891 VanDerWaalsContact C-N 3.3Å; F889-H891 PolarHBondContact O-N 3.45Å
892	I	94.7	Very high	79.9	Confident	0 Å²	0	72.6 Å²	72.6	0%	0	39%	0.391	C	S	.	.	H	α-helix	trans	-73.3	-56.4	-177.2	-69.3	164.3	0	0	0	111.4	V811 L814 K815 V818 I885 E888 F889	V811-I892 HydrophobicContact CG1-CG1 4.25Å; L814-I892 HydrophobicContact CD2-CD1 3.95Å; L814-I892 HydrophobicContact CG-CD1 4.25Å; K815-I892 VanDerWaalsContact CE-O 3.27Å; K815-I892 WeakPolarHBondContact CE-O 3.41Å; K815-I892 WeakPolarHBondContact CG-O 3.41Å; V818-I892 HydrophobicContact CB-CG2 4.17Å; V818-I892 HydrophobicContact CG1-CG2 4.14Å; V818-I892 HydrophobicContact CG2-CG2 4.14Å; I885-I892 HydrophobicContact CG1-CD1 4.41Å; E888-I892 HydrophobicContact CB-CD1 4.04Å; E888-I892 HydrophobicContact CB-CG1 4.46Å; E888-I892 WeakPolarHBondContact O-CG1 3.12Å; E888-I892 PolarHBondContact O-N 3.28Å; F889-I892 PolarHBondContact O-N 3.11Å
893	F	93.2	Very high	78.9	Confident	15 Å²	15	76.6 Å²	76.6	7%	0.066	41%	0.413	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.1	-20.7	-170	-65	-78	0	0	0	114.9	V818 H826 L829 E830 C833 I885 F889 T895	V818-F893 HydrophobicContact CG1-CD1 4.01Å; V818-F893 HydrophobicContact CG1-CE1 3.46Å; V818-F893 VanDerWaalsContact CG1-CE1 3.46Å; V818-F893 HydrophobicContact CG1-CZ 4.08Å; H826-F893 AromaticContact NE2-CD1 3.98Å; L829-F893 HydrophobicContact CD2-CZ 4.3Å; L829-F893 HydrophobicContact CG-CZ 4.13Å; E830-F893 HydrophobicContact CB-CD1 3.59Å; E830-F893 HydrophobicContact CB-CE1 3.64Å; E830-F893 HydrophobicContact CB-CG 4.28Å; E830-F893 HydrophobicContact CB-CZ 4.39Å; E830-F893 HydrophobicContact CG-CB 3.94Å; E830-F893 HydrophobicContact CG-CD1 3.5Å; E830-F893 VanDerWaalsContact CG-CD1 3.5Å; E830-F893 HydrophobicContact CG-CD2 4.49Å; E830-F893 HydrophobicContact CG-CE1 4.05Å; E830-F893 HydrophobicContact CG-CG 3.74Å; C833-F893 HydrophobicContact CB-CE2 4.17Å; I885-F893 HydrophobicContact CG2-CE2 3.63Å; I885-F893 HydrophobicContact CG2-CZ 3.94Å; F889-F893 HydrophobicContact CB-CD2 4.47Å; F889-F893 HydrophobicContact CD1-CD2 4.31Å; F889-F893 AromaticContact CD2-CD2 3.35Å; F889-F893 HydrophobicContact CD2-CD2 3.35Å; F889-F893 AromaticContact CD2-CE2 3.61Å; F889-F893 HydrophobicContact CD2-CE2 3.61Å; F889-F893 HydrophobicContact CD2-CG 4.41Å; F889-F893 HydrophobicContact CE1-CB 4.28Å; F889-F893 HydrophobicContact CE1-CD2 4.37Å; F889-F893 AromaticContact CE2-CD2 3.42Å; F889-F893 HydrophobicContact CE2-CD2 3.42Å; F889-F893 VanDerWaalsContact CE2-CD2 3.42Å; F889-F893 AromaticContact CE2-CE2 3.76Å; F889-F893 HydrophobicContact CE2-CE2 3.76Å; F889-F893 HydrophobicContact CE2-CG 4.12Å; F889-F893 AromaticContact CG-CD2 3.82Å; F889-F893 HydrophobicContact CG-CD2 3.82Å; F889-F893 HydrophobicContact CG-CE2 4.41Å; F889-F893 HydrophobicContact CZ-CB 4.21Å; F889-F893 AromaticContact CZ-CD2 3.95Å; F889-F893 HydrophobicContact CZ-CD2 3.95Å; F889-F893 HydrophobicContact CZ-CG 4.27Å; F889-F893 PolarHBondContact O-N 3.26Å; F893-T895 PolarHBondContact O-N 2.91Å
894	R	81.6	Confident	77.7	Confident	156 Å²	156	78.7 Å²	78.7	59%	0.589	43%	0.425	S	S	*	.			trans	-73.2	115.4	170	-58.4	-177.7	-171	-166.3	6.5	109.1	K815 D890	K815-R894 PolarHBondContact NZ-O 2.96Å; D890-R894 WeakPolarHBondContact O-CB 3.46Å; D890-R894 WeakPolarHBondContact O-CD 3.36Å; D890-R894 WeakPolarHBondContact O-CG 3.37Å; D890-R894 IonicContact OD1-CZ 3.17Å; D890-R894 IonicContact OD1-NE 2.77Å; D890-R894 PolarHBondContact OD1-NE 3.37Å; D890-R894 IonicContact OD1-NH2 2.76Å; D890-R894 PolarHBondContact OD1-NH2 3.36Å; D890-R894 IonicContact OD2-NH2 3.56Å
895	T	59.1	Low	76.5	Confident	107 Å²	107	82.5 Å²	82.5	66%	0.656	45%	0.447	S	S	*	.	P	Polyproline II helix	trans	-53.2	139.7	148.5	42.4	0	0	0	0	108.3	F893 G897	F893-T895 PolarHBondContact O-N 2.91Å; T895-G897 PolarHBondContact O-N 3.4Å; T895-G897 VanDerWaalsContact O-N 3.1Å
896	R	45	Very low	75	Confident	242 Å²	242	88.3 Å²	88.3	91%	0.913	48%	0.478	S	S	*	.	P	Polyproline II helix	trans	-62.3	117.1	160.8	-80.4	-175.2	178	167	1.8	105.3	L898	R896-L898 PolarHBondContact O-N 3.38Å
897	G	36.3	Very low	73.3	Confident	69 Å²	69	94.7 Å²	94.7	71%	0.711	51%	0.512	S	S	*	.	P	Polyproline II helix	trans	-56.3	127.8	175.6	0	0	0	0	0	109.1	T895 S899	T895-G897 PolarHBondContact O-N 3.4Å; T895-G897 VanDerWaalsContact O-N 3.1Å; G897-S899 PolarHBondContact O-N 3.05Å
898	L	36.7	Very low	71.5	Confident	178 Å²	178	96.8 Å²	96.8	93%	0.932	51%	0.514	S	S	*	.	P	Polyproline II helix	trans	-66.1	125.4	158.8	-75.5	165.2	0	0	0	106.5	R896	R896-L898 PolarHBondContact O-N 3.38Å
899	S	31.2	Very low	69.3	Low	189 Å²	189	101.9 Å²	101.9	100%	1.322	54%	0.544	S	S	*	.			trans	-70	0	178.9	56.5	0	0	0	0	112.2	G897	G897-S899 PolarHBondContact O-N 3.05Å

Retrieved 899 of 899 residues in 264.5 ms (Link to these results)

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