A0A087YPM6_POEFO Loading...

Regulator of G-protein signaling 3

Down-regulates signaling from heterotrimeric G-proteins by increasing the GTPase activity of the alpha subunits, thereby driving them into their inactive GDP-bound form. Down-regulates G-protein-mediated release of inositol phosphates and activation of MAP kinases.

AlphaFold DB , UniProt , Accession A0A087YPM6, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 815 aa.

						>A0A087YPM6_POEFO|A0A087YPM6
MHTIHGLCHLCIGCRLPQQVTILRGKDGYGFTICSDSPVRVQAVDPGGPADQAGLQQLDTLLQLNGQPVEQWKCVDLAHAIRNSANEITVVVWRTGPSAKPSFEGLIHRPSYKPSTSNYDAPSPPTRRRAPDVGPSKAPPAVPPLPAHHRPTAARRLLVNGSETGNGVGGSRGTLAWGAHMGSAEEDNYIILAPINPGSQILRPVYTDNQGTLGRTCTASKGSSTSPTVGLANYQQQNANFANYQNCTIVRSHTPHANYGYVKVAPKILIFPIFVQPLDLCSRTLIISEEMILHESKHHSLKVTVFVYNDLLLITRENEPGRCNVLQSPLYLRHLRLQDDYTDGMRFYLIHMTEKCDCLLSLEAYSADQKRRVCQCLKDNIDKQLQLHRREPSVPHFEQILKTVRELPPTTSFENRCEDTCGSHPSTEVPYFSPSRTKAAGQKQSTAEQQPFSKETSEEEDKVVNSFVIPELRLDRSFSADALSSPNTDEEEYDEDEEEESEEDDEDDSDDAYLQRTDSKRRSMVEGATCEKHGGGRLSVQNSLRRRTHSEGSLLQEPRTPCFTSDNAINCLEAGGVHPKGGWTLPSPKTLKKELMKNGGSMHQLCMLFSGRKKLLSAGSPCSCEVSPNGTKKKKSKNLAKDMKNRLAFLRRRNESPGSNPAGKLDKSMKSVKPTPEEALKWGDSLDKLLAHKYGLAAFRAFLRTEFSEENLEFWLACEEYKKIKSQSKMASKAKKIFAEYIAIQSCKEVNLDSYTRDHTKDNLQNVTRSCFDLAQRRIYGLMEKDSYPRFLRSELYLDLINQKKPSATSTSSSS
					

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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	28.9	Very low	34.8	Very low	242 Å²	242	104.3 Å²	104.3	100%	1.192	58%	0.583	S	S	*	*				0	154.7	0	-73.3	176.2	170.2	0	0	107.9
2	H	26.4	Very low	35.5	Very low	183 Å²	183	101.5 Å²	101.5	85%	0.847	57%	0.565	S	S	*	*			trans	-77.7	147.6	-164.9	-66	-85.9	0	0	0	113.2	I4	H2-I4 PolarHBondContact O-N 2.8Å
3	T	32	Very low	35.5	Very low	143 Å²	143	99.2 Å²	99.2	88%	0.877	58%	0.577	S	S	*	*			trans	-65.6	122.7	171	42.2	0	0	0	0	110.4
4	I	34.5	Very low	36.1	Very low	111 Å²	111	98.9 Å²	98.9	57%	0.569	58%	0.582	S	S	*	*			trans	-125	149.1	159.1	-50	178.7	0	0	0	105.3	H2	H2-I4 PolarHBondContact O-N 2.8Å
5	H	36.7	Very low	37.2	Very low	72 Å²	72	99.1 Å²	99.1	33%	0.333	57%	0.569	S	S	.	*			trans	76.7	101.7	-178	-56.4	-63.3	0	0	0	115.4	L7 Q63 E70	H5-L7 HydrophobicContact CB-CB 4.31Å; H5-L7 HydrophobicContact CB-CD1 3.93Å; H5-L7 HydrophobicContact CB-CG 4.03Å; H5-L7 PolarHBondContact O-N 2.79Å; H5-Q63 PolarHBondContact NE2-NE2 2.76Å; H5-E70 IonicContact CE1-OE1 2.73Å; H5-E70 IonicContact ND1-OE1 2.66Å
6	G	38.5	Very low	38.2	Very low	95 Å²	95	100.7 Å²	100.7	98%	0.979	57%	0.574	S	S	*	*			trans	-73.1	41.7	162.8	0	0	0	0	0	113.1
7	L	37.8	Very low	39.9	Very low	52 Å²	52	97.4 Å²	97.4	27%	0.272	56%	0.557	S	S	.	*			trans	-97.5	121.4	-178.8	-65.8	172.2	0	0	0	109.7	H5 W93	H5-L7 HydrophobicContact CB-CB 4.31Å; H5-L7 HydrophobicContact CB-CD1 3.93Å; H5-L7 HydrophobicContact CB-CG 4.03Å; H5-L7 PolarHBondContact O-N 2.79Å; L7-W93 HydrophobicContact CD1-CH2 4.46Å; L7-W93 HydrophobicContact CD1-CZ3 3.66Å; L7-W93 HydrophobicContact CD2-CH2 4.23Å; L7-W93 HydrophobicContact CD2-CZ3 3.89Å; L7-W93 HydrophobicContact CG-CZ3 4.45Å
8	C	32.5	Very low	42	Very low	25 Å²	25	96.5 Å²	96.5	17%	0.169	55%	0.547	C	S	.	.			trans	-52.8	139.2	174.6	167.7	0	0	0	0	111.3	L10 C11 E295	C8-L10 PolarHBondContact O-N 3.04Å; C8-C11 WeakPolarHBondContact O-CB 2.95Å; C8-C11 PolarHBondContact O-N 3.06Å; C8-E295 PolarHBondContact SG-OE1 3.23Å
9	H	37.2	Very low	44.4	Very low	122 Å²	122	98.4 Å²	98.4	57%	0.565	55%	0.551	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.1	-8.1	-170.5	-150.2	-62.8	0	0	0	113.1	I12 E295	H9-I12 WeakPolarHBondContact O-CB 3.29Å; H9-E295 WeakPolarHBondContact CB-OE2 3.23Å; H9-E295 PolarHBondContact N-OE2 2.85Å
10	L	40.5	Very low	46.7	Very low	55 Å²	55	93.7 Å²	93.7	29%	0.288	53%	0.525	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70	-29.7	168.8	-86.4	71.8	0	0	0	113.2	C8 I12 G13 E295 L360	C8-L10 PolarHBondContact O-N 3.04Å; L10-I12 PolarHBondContact O-N 3.33Å; L10-G13 PolarHBondContact O-N 2.79Å; L10-E295 HydrophobicContact CD1-CB 4.19Å; L10-E295 HydrophobicContact CD1-CG 3.83Å; L10-L360 HydrophobicContact CD2-CD2 3.6Å
11	C	38.1	Very low	48.8	Very low	47 Å²	47	92.2 Å²	92.2	32%	0.318	52%	0.518	S	S	.	.	G	3₁₀ helix	trans	-65	-29.9	177.4	-67.6	0	0	0	0	112.1	C8 G13 C14	C8-C11 WeakPolarHBondContact O-CB 2.95Å; C8-C11 PolarHBondContact O-N 3.06Å; C11-G13 PolarHBondContact O-N 3.32Å; C11-C14 PolarHBondContact O-N 2.85Å
12	I	42.8	Very low	51.8	Low	71 Å²	71	80.7 Å²	80.7	36%	0.364	46%	0.462	S	S	.	.	G	3₁₀ helix	trans	-65.1	-22.5	-176.3	-66.6	176.7	0	0	0	112.2	H9 L10 C14 L16	H9-I12 WeakPolarHBondContact O-CB 3.29Å; L10-I12 PolarHBondContact O-N 3.33Å; I12-C14 PolarHBondContact O-N 2.93Å; I12-L16 HydrophobicContact CG2-CD2 3.87Å
13	G	36.1	Very low	54.9	Low	71 Å²	71	77.3 Å²	77.3	73%	0.732	45%	0.449	S	S	*	.	G	3₁₀ helix	trans	-73.1	-18.7	179.5	0	0	0	0	0	115.8	L10 C11	L10-G13 PolarHBondContact O-N 2.79Å; C11-G13 PolarHBondContact O-N 3.32Å
14	C	43.1	Very low	57.6	Low	95 Å²	95	76.2 Å²	76.2	64%	0.642	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.3	-26.9	-169.1	-78.5	0	0	0	0	116	C11 I12	C11-C14 PolarHBondContact O-N 2.85Å; I12-C14 PolarHBondContact O-N 2.93Å
15	R	52.8	Low	60.1	Low	103 Å²	103	72.1 Å²	72.1	39%	0.389	41%	0.414	S	S	.	.			trans	-160.3	124.1	157.5	-86.6	110.7	-167.2	-95.6	6.9	109.4	R94 G96	R15-R94 PolarHBondContact NH1-O 3.43Å; R15-G96 PolarHBondContact NH1-O 3.45Å; R15-G96 PolarHBondContact NH2-O 2.98Å
16	L	53.5	Low	62.2	Low	124 Å²	124	78.8 Å²	78.8	65%	0.649	44%	0.442	S	S	*	.	P	Polyproline II helix	trans	-67.9	147.3	162	-76.8	164.8	0	0	0	110.2	I12 Q18	I12-L16 HydrophobicContact CG2-CD2 3.87Å; L16-Q18 PolarHBondContact O-N 3.2Å
17	P	66.6	Low	64.2	Low	44 Å²	44	82.3 Å²	82.3	29%	0.286	44%	0.439	S	S	.	.	P	Polyproline II helix	trans	-56.2	124.6	162.9	-22.7	33.9	0	0	0	110	L62 V91 V92	P17-L62 HydrophobicContact CB-CD1 4.06Å; P17-L62 HydrophobicContact CG-CD1 4.25Å; P17-V91 HydrophobicContact CB-CG1 3.59Å; P17-V92 CarbonylContact C-O 3.56Å; P17-V92 WeakPolarHBondContact CA-O 3.35Å
18	Q	78.5	Confident	66.5	Low	82 Å²	82	80.7 Å²	80.7	38%	0.383	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	120.9	-177.2	-171.1	176.3	-2.5	0	0	109.4	L16 V20 V92	L16-Q18 PolarHBondContact O-N 3.2Å; Q18-V20 HydrophobicContact CG-CG2 4.02Å; Q18-V92 HydrophobicContact CB-CG2 4.19Å; Q18-V92 PolarHBondContact N-O 3.33Å; Q18-V92 VanDerWaalsContact O-CG2 3.31Å; Q18-V92 WeakPolarHBondContact O-CG2 3.27Å; Q18-V92 PolarHBondContact O-N 3Å
19	Q	86.5	Confident	69.3	Low	133 Å²	133	80.2 Å²	80.2	62%	0.621	43%	0.429	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.8	127.6	167.4	-174.7	177.5	-33.5	0	0	109.3	T89 V90 V91	Q19-T89 HydrophobicContact CG-CG2 3.61Å; Q19-T89 VanDerWaalsContact NE2-CG2 3.35Å; Q19-V90 WeakPolarHBondContact CA-O 3.49Å; Q19-V91 HydrophobicContact CB-CG2 4.47Å; Q19-V91 HydrophobicContact CG-CG2 4.47Å
20	V	90.4	Very high	71.8	Confident	3 Å²	3	75 Å²	75	2%	0.018	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	119.5	-177.2	172.8	0	0	0	0	107.9	Q18 I22 A53 L55 V90 V92	Q18-V20 HydrophobicContact CG-CG2 4.02Å; V20-I22 HydrophobicContact CG1-CD1 4.2Å; V20-I22 HydrophobicContact CG1-CG1 3.8Å; V20-A53 HydrophobicContact CG1-CB 3.72Å; V20-A53 WeakPolarHBondContact CG1-O 3.36Å; V20-L55 HydrophobicContact CG1-CB 4.27Å; V20-L55 HydrophobicContact CG1-CD1 4.41Å; V20-V90 HydrophobicContact CB-CG2 4Å; V20-V90 HydrophobicContact CG1-CG2 4.37Å; V20-V90 PolarHBondContact N-O 3.49Å; V20-V90 PolarHBondContact O-N 3.12Å; V20-V92 HydrophobicContact CG2-CG2 4Å
21	T	91.8	Very high	74.3	Confident	64 Å²	64	73.7 Å²	73.7	39%	0.393	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	118.5	178.7	-53.5	0	0	0	0	109.1	A53 I88 T89	T21-A53 WeakPolarHBondContact O-CB 3.48Å; T21-I88 CarbonylContact C-O 3.55Å; T21-I88 WeakPolarHBondContact CA-O 3.33Å; T21-T89 PolarHBondContact OG1-OG1 3.33Å
22	I	92.6	Very high	76.7	Confident	0 Å²	0	74.4 Å²	74.4	0%	0	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	115.3	-171.5	-44.3	179	0	0	0	108.8	V20 Y29 F31 P49 A50 A53 L55 E87 I88 V90	V20-I22 HydrophobicContact CG1-CD1 4.2Å; V20-I22 HydrophobicContact CG1-CG1 3.8Å; I22-Y29 HydrophobicContact CB-CD1 4.23Å; I22-Y29 HydrophobicContact CG2-CD1 3.98Å; I22-Y29 WeakPolarHBondContact O-CE1 3.36Å; I22-F31 HydrophobicContact CD1-CD1 4.33Å; I22-F31 HydrophobicContact CD1-CE1 3.94Å; I22-F31 HydrophobicContact CD1-CZ 4.49Å; I22-P49 HydrophobicContact CG2-CB 4.01Å; I22-A50 HydrophobicContact CD1-CB 4.01Å; I22-A50 HydrophobicContact CG2-CB 4.12Å; I22-A53 HydrophobicContact CB-CB 4.38Å; I22-A53 HydrophobicContact CG1-CB 3.89Å; I22-A53 HydrophobicContact CG2-CB 4.44Å; I22-L55 HydrophobicContact CD1-CB 4.42Å; I22-L55 HydrophobicContact CD1-CD2 3.95Å; I22-E87 CarbonylContact O-C 3.47Å; I22-E87 VanDerWaalsContact O-CA 3.29Å; I22-E87 WeakPolarHBondContact O-CA 3.24Å; I22-I88 HydrophobicContact CB-CG1 3.92Å; I22-I88 HydrophobicContact CD1-CD1 4.3Å; I22-I88 HydrophobicContact CD1-CG1 4.42Å; I22-I88 HydrophobicContact CG1-CG1 4.35Å; I22-I88 PolarHBondContact N-O 3.02Å; I22-I88 PolarHBondContact O-N 3Å; I22-V90 HydrophobicContact CD1-CG2 4.21Å
23	L	89.7	Confident	78.9	Confident	111 Å²	111	72.4 Å²	72.4	58%	0.581	39%	0.393	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.6	147.5	172.9	-59.2	-179.6	0	0	0	110.5	G25 P49 E87	L23-G25 PolarHBondContact O-N 2.83Å; L23-P49 WeakPolarHBondContact O-CB 3.16Å; L23-E87 HydrophobicContact CD2-CB 3.96Å
24	R	90	Very high	80.8	Confident	120 Å²	120	70.9 Å²	70.9	45%	0.453	37%	0.371	S	S	.	.			trans	-77.1	114.4	178.5	-169.8	175.7	-176	149.5	5.2	110.8	Y29 S84 A85 N86	R24-Y29 HydrophobicContact CB-CD1 4.24Å; R24-Y29 HydrophobicContact CB-CE1 3.64Å; R24-Y29 HydrophobicContact CG-CE1 4.23Å; R24-Y29 HydrophobicContact CG-CE2 4.38Å; R24-S84 PolarHBondContact NH1-O 3.37Å; R24-A85 WeakPolarHBondContact CD-O 3.31Å; R24-A85 PolarHBondContact NH1-O 2.77Å; R24-N86 VanDerWaalsContact CB-O 3.23Å; R24-N86 WeakPolarHBondContact CB-O 3.44Å; R24-N86 PolarHBondContact N-O 3.24Å
25	G	87.5	Confident	82.2	Confident	26 Å²	26	69.3 Å²	69.3	27%	0.268	36%	0.361	S	S	.	.	B	Isolated β-bridge	trans	-78	177.8	169.7	0	0	0	0	0	112.9	L23 D27 G28	L23-G25 PolarHBondContact O-N 2.83Å; G25-D27 PolarHBondContact O-N 3.35Å; G25-G28 CarbonylContact C-O 3.55Å; G25-G28 VanDerWaalsContact CA-O 3.27Å; G25-G28 WeakPolarHBondContact CA-O 3.36Å; G25-G28 PolarHBondContact N-O 3.2Å; G25-G28 PolarHBondContact O-N 2.97Å
26	K	79.9	Confident	83.3	Confident	212 Å²	212	68.6 Å²	68.6	92%	0.922	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.1	-39.3	-177.9	-64.1	178.1	-178.6	176.3	0	112.8
27	D	79.6	Confident	84	Confident	169 Å²	169	65.6 Å²	65.6	90%	0.904	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.8	12.6	-177.3	-53.5	-81.7	0	0	0	112.7	G25	G25-D27 PolarHBondContact O-N 3.35Å
28	G	87.9	Confident	84.4	Confident	17 Å²	17	65.7 Å²	65.7	18%	0.175	36%	0.355	C	S	.	.	B	Isolated β-bridge	trans	104.1	-151.9	-173.6	0	0	0	0	0	112.7	G25	G25-G28 CarbonylContact C-O 3.55Å; G25-G28 VanDerWaalsContact CA-O 3.27Å; G25-G28 WeakPolarHBondContact CA-O 3.36Å; G25-G28 PolarHBondContact N-O 3.2Å; G25-G28 PolarHBondContact O-N 2.97Å
29	Y	91	Very high	84.4	Confident	15 Å²	15	61.8 Å²	61.8	6%	0.059	34%	0.337	C	S	.	.	S	Bend	trans	-87.4	-10.4	-171	-63.4	-77.3	0	0	0	114.9	I22 R24 A50 I81 S84 E87 I88	I22-Y29 HydrophobicContact CB-CD1 4.23Å; I22-Y29 HydrophobicContact CG2-CD1 3.98Å; I22-Y29 WeakPolarHBondContact O-CE1 3.36Å; R24-Y29 HydrophobicContact CB-CD1 4.24Å; R24-Y29 HydrophobicContact CB-CE1 3.64Å; R24-Y29 HydrophobicContact CG-CE1 4.23Å; R24-Y29 HydrophobicContact CG-CE2 4.38Å; Y29-A50 VanDerWaalsContact O-CB 3.25Å; Y29-A50 WeakPolarHBondContact O-CB 3.36Å; Y29-A50 PolarHBondContact O-N 2.97Å; Y29-I81 HydrophobicContact CD2-CG2 3.69Å; Y29-I81 HydrophobicContact CE2-CG2 4.01Å; Y29-I81 WeakPolarHBondContact CE2-O 3.23Å; Y29-S84 PolarHBondContact OH-O 3.07Å; Y29-E87 PolarHBondContact OH-O 3.27Å; Y29-I88 HydrophobicContact CD1-CD1 4.13Å; Y29-I88 HydrophobicContact CD1-CG1 3.89Å; Y29-I88 HydrophobicContact CD2-CD1 4.27Å; Y29-I88 HydrophobicContact CE1-CB 4.41Å; Y29-I88 HydrophobicContact CE1-CD1 4.44Å; Y29-I88 HydrophobicContact CE1-CG1 3.89Å; Y29-I88 HydrophobicContact CE1-CG2 4.16Å; Y29-I88 HydrophobicContact CE2-CG2 4.16Å; Y29-I88 HydrophobicContact CG-CD1 4.03Å; Y29-I88 HydrophobicContact CG-CG1 4.31Å
30	G	89.5	Confident	84.4	Confident	13 Å²	13	59.2 Å²	59.2	13%	0.134	32%	0.322	C	S	.	.	S	Bend	trans	77.7	35.2	172.8	0	0	0	0	0	116	D45	G30-D45 WeakPolarHBondContact CA-OD2 3.25Å; G30-D45 PolarHBondContact O-N 3.3Å
31	F	93.3	Very high	84.3	Confident	28 Å²	28	59.1 Å²	59.1	12%	0.123	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.1	161.7	172.7	71.9	-76.5	0	0	0	111.5	I22 I33 V41 A43 V44 A50 L55 I81 I88	I22-F31 HydrophobicContact CD1-CD1 4.33Å; I22-F31 HydrophobicContact CD1-CE1 3.94Å; I22-F31 HydrophobicContact CD1-CZ 4.49Å; F31-I33 HydrophobicContact CD2-CG2 3.96Å; F31-I33 HydrophobicContact CE2-CG2 3.66Å; F31-V41 HydrophobicContact CD2-CG1 4.35Å; F31-V41 HydrophobicContact CD2-CG2 4.41Å; F31-A43 WeakPolarHBondContact CA-O 3.42Å; F31-A43 WeakPolarHBondContact CB-O 3.21Å; F31-V44 HydrophobicContact CB-CG1 4.47Å; F31-V44 HydrophobicContact CB-CG2 4.28Å; F31-A50 HydrophobicContact CB-CB 3.91Å; F31-A50 HydrophobicContact CD1-CB 3.77Å; F31-A50 HydrophobicContact CG-CB 4.17Å; F31-L55 HydrophobicContact CB-CD2 3.9Å; F31-L55 HydrophobicContact CD1-CD2 3.97Å; F31-L55 HydrophobicContact CD2-CD2 3.61Å; F31-L55 HydrophobicContact CE1-CD2 4.36Å; F31-L55 HydrophobicContact CE2-CD2 4.03Å; F31-L55 HydrophobicContact CG-CD2 3.57Å; F31-L55 HydrophobicContact CZ-CD2 4.39Å; F31-I81 HydrophobicContact CE2-CD1 4.41Å; F31-I81 HydrophobicContact CZ-CD1 3.98Å; F31-I88 HydrophobicContact CE1-CD1 3.85Å; F31-I88 HydrophobicContact CZ-CD1 3.92Å
32	T	87.1	Confident	83.9	Confident	61 Å²	61	61 Å²	61	37%	0.374	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	157.8	173.1	61.9	0	0	0	0	111.5	Q42 A43	T32-Q42 PolarHBondContact O-N 3.1Å; T32-A43 PolarHBondContact N-O 2.94Å; T32-A43 PolarHBondContact OG1-N 3.45Å
33	I	90.5	Very high	83.5	Confident	29 Å²	29	62.7 Å²	62.7	15%	0.149	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	148.9	-177.2	47.8	166.1	0	0	0	112.2	F31 V39 R40 L61 L77 A78 I81	F31-I33 HydrophobicContact CD2-CG2 3.96Å; F31-I33 HydrophobicContact CE2-CG2 3.66Å; I33-V39 HydrophobicContact CB-CG1 3.76Å; I33-V39 HydrophobicContact CD1-CG1 3.98Å; I33-V39 HydrophobicContact CG1-CG1 4.4Å; I33-V39 HydrophobicContact CG2-CG1 4.17Å; I33-R40 CarbonylContact C-O 3.57Å; I33-R40 VanDerWaalsContact CA-O 3.24Å; I33-R40 WeakPolarHBondContact CA-O 3.42Å; I33-L61 HydrophobicContact CG2-CD1 3.62Å; I33-L77 HydrophobicContact CD1-CB 4.35Å; I33-L77 HydrophobicContact CD1-CD2 4.46Å; I33-L77 HydrophobicContact CD1-CG 4.49Å; I33-A78 HydrophobicContact CD1-CB 4.15Å; I33-I81 HydrophobicContact CD1-CD1 4.36Å
34	C	75.9	Confident	83.6	Confident	39 Å²	39	58.5 Å²	58.5	26%	0.264	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	173.6	177.2	66.9	0	0	0	0	110.7	R40 Q42	C34-R40 PolarHBondContact N-O 2.87Å; C34-R40 PolarHBondContact O-N 3.2Å; C34-Q42 HydrophobicContact CB-CB 3.84Å; C34-Q42 HydrophobicContact CB-CG 3.98Å
35	S	71.7	Confident	83.5	Confident	63 Å²	63	57 Å²	57	44%	0.441	32%	0.319	S	S	.	.			trans	65.1	145.2	-171.4	-56.6	0	0	0	0	113.5	P38 V39 C74	S35-P38 WeakPolarHBondContact CB-O 3.46Å; S35-V39 WeakPolarHBondContact O-CA 3.4Å; S35-C74 WeakPolarHBondContact O-CB 3.28Å
36	D	75.8	Confident	83.4	Confident	87 Å²	87	61.5 Å²	61.5	47%	0.465	34%	0.344	S	S	.	.	S	Bend	trans	-105.4	142.2	167.2	-71.3	-11.2	0	0	0	107.4	K73 C74	D36-K73 HydrophobicContact CB-CB 4.25Å; D36-K73 HydrophobicContact CB-CG 4.18Å; D36-K73 WeakPolarHBondContact OD1-CA 3.34Å; D36-C74 WeakPolarHBondContact OD1-CB 3.35Å; D36-C74 PolarHBondContact OD1-N 2.86Å
37	S	68.9	Low	83.6	Confident	62 Å²	62	53.8 Å²	53.8	43%	0.434	32%	0.324	S	S	.	.	S	Bend	trans	50.1	64.2	165.2	-45.3	0	0	0	0	116.1	E70 Q71 W72	S37-E70 CarbonylContact C-O 3.54Å; S37-E70 WeakPolarHBondContact CA-O 3.38Å; S37-Q71 PolarHBondContact OG-O 2.83Å; S37-W72 PolarHBondContact N-O 2.76Å
38	P	74.3	Confident	84.1	Confident	46 Å²	46	46.4 Å²	46.4	30%	0.299	29%	0.288	S	S	.	.	S	Bend	cis	-100	153.6	11.1	37.3	-35.1	0	0	0	114.2	S35 T60 E70	S35-P38 WeakPolarHBondContact CB-O 3.46Å; P38-T60 HydrophobicContact CB-CG2 3.69Å; P38-T60 HydrophobicContact CG-CG2 3.58Å; P38-E70 WeakPolarHBondContact CA-O 3.43Å; P38-E70 WeakPolarHBondContact CB-O 3.23Å
39	V	78.4	Confident	84.3	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	29%	0.289	C	S	.	.			trans	-75.6	143	176.5	-168	0	0	0	0	111.1	I33 S35 L61 W72 C74 L77	I33-V39 HydrophobicContact CB-CG1 3.76Å; I33-V39 HydrophobicContact CD1-CG1 3.98Å; I33-V39 HydrophobicContact CG1-CG1 4.4Å; I33-V39 HydrophobicContact CG2-CG1 4.17Å; S35-V39 WeakPolarHBondContact O-CA 3.4Å; V39-L61 HydrophobicContact CG1-CD1 4.31Å; V39-L61 PolarHBondContact O-N 3.38Å; V39-W72 VanDerWaalsContact CG2-O 3.27Å; V39-W72 WeakPolarHBondContact CG2-O 3.49Å; V39-C74 HydrophobicContact CG1-CB 4.22Å; V39-L77 HydrophobicContact CB-CD2 3.65Å; V39-L77 HydrophobicContact CG1-CD2 3.77Å; V39-L77 HydrophobicContact CG2-CB 4.3Å; V39-L77 HydrophobicContact CG2-CD2 3.86Å
40	R	86.3	Confident	84.3	Confident	79 Å²	79	46.4 Å²	46.4	30%	0.298	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	152.7	-174.8	-56	-177.1	65.2	-153.2	-1.4	112	I33 C34 Q42 L58 D59 T60	I33-R40 CarbonylContact C-O 3.57Å; I33-R40 VanDerWaalsContact CA-O 3.24Å; I33-R40 WeakPolarHBondContact CA-O 3.42Å; C34-R40 PolarHBondContact N-O 2.87Å; C34-R40 PolarHBondContact O-N 3.2Å; R40-Q42 PolarHBondContact O-N 3.25Å; R40-L58 PolarHBondContact NH2-O 3.04Å; R40-D59 CarbonylContact C-O 3.55Å; R40-D59 WeakPolarHBondContact CA-O 3.15Å; R40-T60 HydrophobicContact CG-CG2 4.3Å; R40-T60 PolarHBondContact NE-OG1 3.13Å
41	V	89.1	Confident	84.3	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	113	176	-178.3	0	0	0	0	109.7	F31 V44 L55 Q56 L58 D59 L61	F31-V41 HydrophobicContact CD2-CG1 4.35Å; F31-V41 HydrophobicContact CD2-CG2 4.41Å; V41-V44 HydrophobicContact CG1-CG2 3.52Å; V41-L55 HydrophobicContact CG1-CD2 4.06Å; V41-L55 HydrophobicContact CG1-CG 4.38Å; V41-L55 HydrophobicContact CG2-CD1 4.01Å; V41-L55 HydrophobicContact CG2-CD2 3.82Å; V41-L55 HydrophobicContact CG2-CG 3.97Å; V41-Q56 WeakPolarHBondContact CB-O 3.46Å; V41-Q56 WeakPolarHBondContact CG1-O 3.38Å; V41-L58 PolarHBondContact O-N 2.89Å; V41-D59 HydrophobicContact CB-CB 4.3Å; V41-D59 HydrophobicContact CG2-CB 3.96Å; V41-D59 PolarHBondContact N-O 3.46Å; V41-L61 HydrophobicContact CG2-CD1 4.33Å; V41-L61 HydrophobicContact CG2-CG 4.37Å
42	Q	83.6	Confident	84.1	Confident	103 Å²	103	55.4 Å²	55.4	48%	0.481	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	-38.6	-176.8	-170.8	-173.3	36.2	0	0	112.2	T32 C34 R40 Q57	T32-Q42 PolarHBondContact O-N 3.1Å; C34-Q42 HydrophobicContact CB-CB 3.84Å; C34-Q42 HydrophobicContact CB-CG 3.98Å; R40-Q42 PolarHBondContact O-N 3.25Å; Q42-Q57 VanDerWaalsContact O-CG 3.31Å; Q42-Q57 WeakPolarHBondContact O-CG 3.38Å; Q42-Q57 PolarHBondContact O-NE2 3.5Å
43	A	83.6	Confident	84.2	Confident	37 Å²	37	53.9 Å²	53.9	31%	0.306	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.7	159.1	175.2	0	0	0	0	0	109.7	F31 T32	F31-A43 WeakPolarHBondContact CA-O 3.42Å; F31-A43 WeakPolarHBondContact CB-O 3.21Å; T32-A43 PolarHBondContact N-O 2.94Å; T32-A43 PolarHBondContact OG1-N 3.45Å
44	V	91	Very high	84.1	Confident	23 Å²	23	53.8 Å²	53.8	14%	0.139	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	136.4	174.4	-172.3	0	0	0	0	107.3	F31 V41 P46 A50 D51 L55	F31-V44 HydrophobicContact CB-CG1 4.47Å; F31-V44 HydrophobicContact CB-CG2 4.28Å; V41-V44 HydrophobicContact CG1-CG2 3.52Å; V44-P46 WeakPolarHBondContact O-CD 3.29Å; V44-A50 HydrophobicContact CG1-CB 3.76Å; V44-D51 HydrophobicContact CG1-CB 3.85Å; V44-L55 HydrophobicContact CG2-CD2 4.35Å; V44-L55 HydrophobicContact CG2-CG 4.43Å
45	D	88.2	Confident	84.8	Confident	88 Å²	88	52 Å²	52	47%	0.471	32%	0.316	S	S	.	.			trans	-77.2	117.5	-178.3	-66.7	-47.1	0	0	0	109.9	G30 G47 G48 D51	G30-D45 WeakPolarHBondContact CA-OD2 3.25Å; G30-D45 PolarHBondContact O-N 3.3Å; D45-G47 PolarHBondContact O-N 3.19Å; D45-G48 WeakPolarHBondContact O-CA 3.45Å; D45-G48 PolarHBondContact O-N 2.89Å; D45-D51 WeakPolarHBondContact O-CB 3.41Å
46	P	85.9	Confident	85.5	Confident	121 Å²	121	52.5 Å²	52.5	79%	0.786	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	128.8	-174.9	-25.1	35.7	0	0	0	112.8	V44 G48	V44-P46 WeakPolarHBondContact O-CD 3.29Å; P46-G48 PolarHBondContact O-N 3.45Å
47	G	84.6	Confident	86	Confident	49 Å²	49	54.2 Å²	54.2	51%	0.505	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.6	1.8	-171.1	0	0	0	0	0	114.8	D45 D51 Q52	D45-G47 PolarHBondContact O-N 3.19Å; G47-D51 PolarHBondContact N-OD2 2.89Å; G47-Q52 PolarHBondContact O-NE2 3Å
48	G	89.5	Confident	86.6	Confident	14 Å²	14	56 Å²	56	14%	0.144	32%	0.321	C	S	.	.	S	Bend	trans	-77.4	174	174.6	0	0	0	0	0	113.2	D45 P46 A50 D51 Q52	D45-G48 WeakPolarHBondContact O-CA 3.45Å; D45-G48 PolarHBondContact O-N 2.89Å; P46-G48 PolarHBondContact O-N 3.45Å; G48-A50 PolarHBondContact O-N 3.44Å; G48-D51 PolarHBondContact O-N 2.86Å; G48-Q52 WeakPolarHBondContact O-CG 3.49Å; G48-Q52 PolarHBondContact O-N 2.89Å
49	P	92.1	Very high	87.2	Confident	32 Å²	32	53.9 Å²	53.9	21%	0.208	31%	0.307	C	S	.	.	H	α-helix	trans	-61.6	-38.3	-173.1	-22.5	32.7	0	0	0	114.1	I22 L23 A53	I22-P49 HydrophobicContact CG2-CB 4.01Å; L23-P49 WeakPolarHBondContact O-CB 3.16Å; P49-A53 WeakPolarHBondContact O-CB 3.36Å; P49-A53 PolarHBondContact O-N 2.81Å
50	A	91.9	Very high	87.5	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-68.5	-36.7	176.4	0	0	0	0	0	113.4	I22 Y29 F31 V44 G48 A53 G54 L55	I22-A50 HydrophobicContact CD1-CB 4.01Å; I22-A50 HydrophobicContact CG2-CB 4.12Å; Y29-A50 VanDerWaalsContact O-CB 3.25Å; Y29-A50 WeakPolarHBondContact O-CB 3.36Å; Y29-A50 PolarHBondContact O-N 2.97Å; F31-A50 HydrophobicContact CB-CB 3.91Å; F31-A50 HydrophobicContact CD1-CB 3.77Å; F31-A50 HydrophobicContact CG-CB 4.17Å; V44-A50 HydrophobicContact CG1-CB 3.76Å; G48-A50 PolarHBondContact O-N 3.44Å; A50-A53 PolarHBondContact O-N 2.73Å; A50-G54 PolarHBondContact O-N 3Å; A50-L55 HydrophobicContact CB-CB 4.09Å; A50-L55 HydrophobicContact CB-CD2 3.89Å; A50-L55 VanDerWaalsContact O-CB 3.29Å; A50-L55 WeakPolarHBondContact O-CB 3.32Å; A50-L55 PolarHBondContact O-N 3.45Å
51	D	89.3	Confident	87.6	Confident	75 Å²	75	51.1 Å²	51.1	40%	0.401	30%	0.299	S	S	.	.	H	α-helix	trans	-66.3	-45.7	174.6	-170	46.7	0	0	0	110.5	V44 D45 G47 G48 A53 G54	V44-D51 HydrophobicContact CG1-CB 3.85Å; D45-D51 WeakPolarHBondContact O-CB 3.41Å; G47-D51 PolarHBondContact N-OD2 2.89Å; G48-D51 PolarHBondContact O-N 2.86Å; D51-A53 PolarHBondContact O-N 2.83Å; D51-G54 PolarHBondContact O-N 2.89Å
52	Q	88.9	Confident	87.4	Confident	155 Å²	155	51.7 Å²	51.7	72%	0.724	30%	0.302	S	S	*	.	H	α-helix	trans	-60.8	-29.8	173.4	-67.6	176.9	30.6	0	0	113.2	G47 G48 G54	G47-Q52 PolarHBondContact O-NE2 3Å; G48-Q52 WeakPolarHBondContact O-CG 3.49Å; G48-Q52 PolarHBondContact O-N 2.89Å; Q52-G54 VanDerWaalsContact C-N 3.33Å
53	A	89.4	Confident	87.7	Confident	30 Å²	30	48 Å²	48	25%	0.248	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.2	-8.7	174.8	0	0	0	0	0	113.7	V20 T21 I22 P49 A50 D51	V20-A53 HydrophobicContact CG1-CB 3.72Å; V20-A53 WeakPolarHBondContact CG1-O 3.36Å; T21-A53 WeakPolarHBondContact O-CB 3.48Å; I22-A53 HydrophobicContact CB-CB 4.38Å; I22-A53 HydrophobicContact CG1-CB 3.89Å; I22-A53 HydrophobicContact CG2-CB 4.44Å; P49-A53 WeakPolarHBondContact O-CB 3.36Å; P49-A53 PolarHBondContact O-N 2.81Å; A50-A53 PolarHBondContact O-N 2.73Å; D51-A53 PolarHBondContact O-N 2.83Å
54	G	87.6	Confident	88.1	Confident	27 Å²	27	46.7 Å²	46.7	28%	0.278	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	82	20	-179.3	0	0	0	0	0	115.1	A50 D51 Q52 R94	A50-G54 PolarHBondContact O-N 3Å; D51-G54 PolarHBondContact O-N 2.89Å; Q52-G54 VanDerWaalsContact C-N 3.33Å; G54-R94 PolarHBondContact O-NH2 3.03Å
55	L	90.3	Very high	88	Confident	1 Å²	1	49.2 Å²	49.2	1%	0.005	29%	0.285	C	S	.	.			trans	-69.5	137.6	166.2	-164.5	74.1	0	0	0	109.1	V20 I22 F31 V41 V44 A50 V90 V92	V20-L55 HydrophobicContact CG1-CB 4.27Å; V20-L55 HydrophobicContact CG1-CD1 4.41Å; I22-L55 HydrophobicContact CD1-CB 4.42Å; I22-L55 HydrophobicContact CD1-CD2 3.95Å; F31-L55 HydrophobicContact CB-CD2 3.9Å; F31-L55 HydrophobicContact CD1-CD2 3.97Å; F31-L55 HydrophobicContact CD2-CD2 3.61Å; F31-L55 HydrophobicContact CE1-CD2 4.36Å; F31-L55 HydrophobicContact CE2-CD2 4.03Å; F31-L55 HydrophobicContact CG-CD2 3.57Å; F31-L55 HydrophobicContact CZ-CD2 4.39Å; V41-L55 HydrophobicContact CG1-CD2 4.06Å; V41-L55 HydrophobicContact CG1-CG 4.38Å; V41-L55 HydrophobicContact CG2-CD1 4.01Å; V41-L55 HydrophobicContact CG2-CD2 3.82Å; V41-L55 HydrophobicContact CG2-CG 3.97Å; V44-L55 HydrophobicContact CG2-CD2 4.35Å; V44-L55 HydrophobicContact CG2-CG 4.43Å; A50-L55 HydrophobicContact CB-CB 4.09Å; A50-L55 HydrophobicContact CB-CD2 3.89Å; A50-L55 VanDerWaalsContact O-CB 3.29Å; A50-L55 WeakPolarHBondContact O-CB 3.32Å; A50-L55 PolarHBondContact O-N 3.45Å; L55-V90 HydrophobicContact CD1-CG2 4.05Å; L55-V92 HydrophobicContact CD1-CG1 3.83Å; L55-V92 HydrophobicContact CD1-CG2 4.48Å
56	Q	87.4	Confident	87.7	Confident	73 Å²	73	47.3 Å²	47.3	34%	0.341	29%	0.286	S	S	.	.			trans	-122.4	157.5	-179.1	-65.8	-176.2	3.7	0	0	111.7	V41 D59 R94	V41-Q56 WeakPolarHBondContact CB-O 3.46Å; V41-Q56 WeakPolarHBondContact CG1-O 3.38Å; Q56-D59 PolarHBondContact N-OD2 3.39Å; Q56-D59 WeakPolarHBondContact O-CB 3.38Å; Q56-D59 VanDerWaalsContact O-CG 3.31Å; Q56-D59 PolarHBondContact O-N 2.93Å; Q56-R94 VanDerWaalsContact CD-CZ 3.49Å; Q56-R94 VanDerWaalsContact OE1-CD 3.3Å
57	Q	85.6	Confident	87.5	Confident	124 Å²	124	47.1 Å²	47.1	58%	0.579	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	145.7	170.4	-161.6	-178.7	24.2	0	0	110.1	Q42 D59	Q42-Q57 VanDerWaalsContact O-CG 3.31Å; Q42-Q57 WeakPolarHBondContact O-CG 3.38Å; Q42-Q57 PolarHBondContact O-NE2 3.5Å; Q57-D59 PolarHBondContact O-N 3.23Å
58	L	81.3	Confident	87.5	Confident	100 Å²	100	48.2 Å²	48.2	52%	0.524	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.7	-2.8	-179.6	-52.1	-177	0	0	0	116.2	R40 V41 T60	R40-L58 PolarHBondContact NH2-O 3.04Å; V41-L58 PolarHBondContact O-N 2.89Å; L58-T60 PolarHBondContact O-N 3.29Å
59	D	86.9	Confident	87.3	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	27%	0.266	C	S	.	.			trans	-56.6	132.9	169.2	-77.9	-14.1	0	0	0	110.9	R40 V41 Q56 Q57 V92 R94	R40-D59 CarbonylContact C-O 3.55Å; R40-D59 WeakPolarHBondContact CA-O 3.15Å; V41-D59 HydrophobicContact CB-CB 4.3Å; V41-D59 HydrophobicContact CG2-CB 3.96Å; V41-D59 PolarHBondContact N-O 3.46Å; Q56-D59 PolarHBondContact N-OD2 3.39Å; Q56-D59 WeakPolarHBondContact O-CB 3.38Å; Q56-D59 VanDerWaalsContact O-CG 3.31Å; Q56-D59 PolarHBondContact O-N 2.93Å; Q57-D59 PolarHBondContact O-N 3.23Å; D59-V92 HydrophobicContact CB-CB 4.02Å; D59-V92 HydrophobicContact CB-CG1 4.06Å; D59-R94 WeakPolarHBondContact OD1-CB 3.31Å; D59-R94 VanDerWaalsContact OD1-CG 3.28Å; D59-R94 WeakPolarHBondContact OD1-CG 3.48Å; D59-R94 IonicContact OD1-CZ 2.61Å; D59-R94 IonicContact OD1-NE 2.67Å; D59-R94 PolarHBondContact OD1-NE 3.1Å; D59-R94 IonicContact OD1-NH2 3.52Å; D59-R94 IonicContact OD2-CZ 3.91Å; D59-R94 IonicContact OD2-NE 3.62Å; D59-R94 IonicContact OD2-NH2 2.71Å; D59-R94 PolarHBondContact OD2-NH2 2.85Å
60	T	86	Confident	86.5	Confident	20 Å²	20	49.7 Å²	49.7	12%	0.123	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	128.7	175.9	-59.8	0	0	0	0	109.9	P38 R40 L58 L62 V92 W93	P38-T60 HydrophobicContact CB-CG2 3.69Å; P38-T60 HydrophobicContact CG-CG2 3.58Å; R40-T60 HydrophobicContact CG-CG2 4.3Å; R40-T60 PolarHBondContact NE-OG1 3.13Å; L58-T60 PolarHBondContact O-N 3.29Å; T60-L62 HydrophobicContact CG2-CD2 4.39Å; T60-V92 CarbonylContact O-C 3.52Å; T60-V92 VanDerWaalsContact O-CA 3.23Å; T60-V92 WeakPolarHBondContact O-CA 3.41Å; T60-W93 PolarHBondContact N-O 3.16Å; T60-W93 PolarHBondContact O-N 2.92Å
61	L	86.6	Confident	85.7	Confident	1 Å²	1	55.4 Å²	55.4	1%	0.005	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	113.1	-177.5	-68.2	157	0	0	0	110	I33 V39 V41 V69 L77 V90 V92	I33-L61 HydrophobicContact CG2-CD1 3.62Å; V39-L61 HydrophobicContact CG1-CD1 4.31Å; V39-L61 PolarHBondContact O-N 3.38Å; V41-L61 HydrophobicContact CG2-CD1 4.33Å; V41-L61 HydrophobicContact CG2-CG 4.37Å; L61-V69 HydrophobicContact CB-CG2 4.31Å; L61-L77 HydrophobicContact CB-CD2 4.27Å; L61-L77 HydrophobicContact CD1-CD2 3.78Å; L61-V90 HydrophobicContact CD2-CB 3.7Å; L61-V90 HydrophobicContact CD2-CG1 3.83Å; L61-V90 HydrophobicContact CD2-CG2 4.04Å; L61-V92 HydrophobicContact CD2-CG1 3.61Å; L61-V92 HydrophobicContact CG-CG1 4.28Å
62	L	85.4	Confident	85.2	Confident	13 Å²	13	55.9 Å²	55.9	7%	0.068	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	-40.3	178.4	-54.6	-176.4	0	0	0	111.8	P17 T60 V69 E70 V91 W93	P17-L62 HydrophobicContact CB-CD1 4.06Å; P17-L62 HydrophobicContact CG-CD1 4.25Å; T60-L62 HydrophobicContact CG2-CD2 4.39Å; L62-V69 PolarHBondContact O-N 3.14Å; L62-E70 HydrophobicContact CB-CG 4.18Å; L62-E70 HydrophobicContact CD2-CG 3.96Å; L62-V91 HydrophobicContact CB-CG1 4.5Å; L62-V91 HydrophobicContact CD1-CG1 4.44Å; L62-V91 PolarHBondContact N-O 3.42Å; L62-W93 HydrophobicContact CD1-CB 4.26Å; L62-W93 HydrophobicContact CD1-CE3 4.24Å; L62-W93 HydrophobicContact CD2-CB 4.35Å; L62-W93 HydrophobicContact CG-CB 4.37Å
63	Q	90.8	Very high	84.8	Confident	26 Å²	26	53.9 Å²	53.9	12%	0.121	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	152	-179	-53.3	-174.7	-10.3	0	0	112.1	H5 Q67 V90 V91	H5-Q63 PolarHBondContact NE2-NE2 2.76Å; Q63-Q67 CarbonylContact C-O 3.58Å; Q63-Q67 WeakPolarHBondContact CA-O 3.39Å; Q63-Q67 VanDerWaalsContact CB-O 3.31Å; Q63-Q67 WeakPolarHBondContact CB-O 3.36Å; Q63-V90 VanDerWaalsContact O-CA 3.26Å; Q63-V90 WeakPolarHBondContact O-CA 3.09Å; Q63-V91 HydrophobicContact CB-CB 3.9Å; Q63-V91 HydrophobicContact CB-CG2 3.95Å; Q63-V91 HydrophobicContact CG-CB 4.17Å; Q63-V91 HydrophobicContact CG-CG2 4.32Å; Q63-V91 PolarHBondContact N-O 2.91Å; Q63-V91 PolarHBondContact O-N 3.13Å
64	L	90.9	Very high	84.4	Confident	8 Å²	8	53.9 Å²	53.9	4%	0.042	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	123.1	168.8	175.9	68.5	0	0	0	109	G66 Q67 V69 L77 A80 I81 I88 T89 V90	L64-G66 PolarHBondContact O-N 3.3Å; L64-G66 VanDerWaalsContact O-N 3.13Å; L64-Q67 PolarHBondContact N-O 2.89Å; L64-Q67 WeakPolarHBondContact O-CB 3.26Å; L64-Q67 PolarHBondContact O-N 2.82Å; L64-V69 HydrophobicContact CB-CG1 3.83Å; L64-L77 HydrophobicContact CB-CD1 3.99Å; L64-L77 HydrophobicContact CD2-CD1 3.63Å; L64-L77 HydrophobicContact CG-CD1 4.42Å; L64-A80 HydrophobicContact CD2-CB 3.65Å; L64-I81 HydrophobicContact CD1-CG1 4.12Å; L64-I81 HydrophobicContact CD2-CG1 3.79Å; L64-I88 HydrophobicContact CD1-CB 3.83Å; L64-I88 HydrophobicContact CD1-CD1 4.34Å; L64-I88 HydrophobicContact CD1-CG2 3.95Å; L64-T89 CarbonylContact C-O 3.34Å; L64-V90 HydrophobicContact CD1-CG1 3.66Å
65	N	89.1	Confident	84.2	Confident	77 Å²	77	56.8 Å²	56.8	41%	0.412	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.7	36	179.6	-57.1	-19	0	0	0	113.1	Q67 S84 I88 T89	N65-Q67 VanDerWaalsContact C-N 3.3Å; N65-Q67 PolarHBondContact O-N 3.28Å; N65-S84 PolarHBondContact ND2-OG 3.47Å; N65-I88 WeakPolarHBondContact OD1-CA 3.43Å; N65-T89 PolarHBondContact N-O 3.02Å; N65-T89 PolarHBondContact OD1-N 2.9Å
66	G	82.1	Confident	84	Confident	47 Å²	47	60.7 Å²	60.7	49%	0.485	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.9	-2	-177.4	0	0	0	0	0	115.8	L64	L64-G66 PolarHBondContact O-N 3.3Å; L64-G66 VanDerWaalsContact O-N 3.13Å
67	Q	82.1	Confident	84.1	Confident	118 Å²	118	57.3 Å²	57.3	55%	0.551	30%	0.3	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.9	137.2	169.7	-61.3	-59.6	-58.4	0	0	110.2	Q63 L64 N65 W72	Q63-Q67 CarbonylContact C-O 3.58Å; Q63-Q67 WeakPolarHBondContact CA-O 3.39Å; Q63-Q67 VanDerWaalsContact CB-O 3.31Å; Q63-Q67 WeakPolarHBondContact CB-O 3.36Å; L64-Q67 PolarHBondContact N-O 2.89Å; L64-Q67 WeakPolarHBondContact O-CB 3.26Å; L64-Q67 PolarHBondContact O-N 2.82Å; N65-Q67 VanDerWaalsContact C-N 3.3Å; N65-Q67 PolarHBondContact O-N 3.28Å; Q67-W72 HydrophobicContact CB-CZ2 4.38Å
68	P	83.8	Confident	84.2	Confident	72 Å²	72	52.4 Å²	52.4	47%	0.468	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	131.5	171.2	30.1	-33.3	0	0	0	110.5	W72	P68-W72 PolarHBondContact O-NE1 2.83Å
69	V	85.4	Confident	84.5	Confident	1 Å²	1	52.2 Å²	52.2	1%	0.006	28%	0.277	C	S	.	.			trans	-124.4	8.8	-176.8	-51.9	0	0	0	0	113.7	L61 L62 L64 Q71 W72 L77	L61-V69 HydrophobicContact CB-CG2 4.31Å; L62-V69 PolarHBondContact O-N 3.14Å; L64-V69 HydrophobicContact CB-CG1 3.83Å; V69-Q71 PolarHBondContact O-N 3.42Å; V69-W72 HydrophobicContact CB-CB 4.19Å; V69-W72 HydrophobicContact CB-CD2 3.84Å; V69-W72 HydrophobicContact CB-CE3 4.18Å; V69-W72 HydrophobicContact CB-CG 3.86Å; V69-W72 HydrophobicContact CG1-CD2 3.68Å; V69-W72 HydrophobicContact CG1-CE3 3.79Å; V69-W72 HydrophobicContact CG1-CG 4.24Å; V69-W72 HydrophobicContact CG1-CH2 4.08Å; V69-W72 HydrophobicContact CG1-CZ2 3.98Å; V69-W72 HydrophobicContact CG1-CZ3 3.98Å; V69-W72 WeakPolarHBondContact O-CB 3.31Å; V69-W72 PolarHBondContact O-N 2.71Å; V69-L77 HydrophobicContact CB-CD1 3.82Å; V69-L77 HydrophobicContact CG1-CD1 3.68Å; V69-L77 HydrophobicContact CG2-CD1 3.9Å; V69-L77 HydrophobicContact CG2-CD2 4.2Å
70	E	76.1	Confident	84.6	Confident	76 Å²	76	53.4 Å²	53.4	36%	0.355	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.1	-32.5	-178.9	-68.6	161.6	-163.7	0	0	113.4	H5 S37 P38 L62	H5-E70 IonicContact CE1-OE1 2.73Å; H5-E70 IonicContact ND1-OE1 2.66Å; S37-E70 CarbonylContact C-O 3.54Å; S37-E70 WeakPolarHBondContact CA-O 3.38Å; P38-E70 WeakPolarHBondContact CA-O 3.43Å; P38-E70 WeakPolarHBondContact CB-O 3.23Å; L62-E70 HydrophobicContact CB-CG 4.18Å; L62-E70 HydrophobicContact CD2-CG 3.96Å
71	Q	74.5	Confident	84.9	Confident	119 Å²	119	53.3 Å²	53.3	56%	0.556	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.3	-7.9	176.6	-62	-173.4	-7	0	0	113.6	S37 V69	S37-Q71 PolarHBondContact OG-O 2.83Å; V69-Q71 PolarHBondContact O-N 3.42Å
72	W	79.9	Confident	84.8	Confident	86 Å²	86	61.4 Å²	61.4	33%	0.326	32%	0.316	S	S	.	.			trans	-73.2	154.5	-172.7	-67.8	23.4	0	0	0	111.8	S37 V39 Q67 P68 V69 L77 A80	S37-W72 PolarHBondContact N-O 2.76Å; V39-W72 VanDerWaalsContact CG2-O 3.27Å; V39-W72 WeakPolarHBondContact CG2-O 3.49Å; Q67-W72 HydrophobicContact CB-CZ2 4.38Å; P68-W72 PolarHBondContact O-NE1 2.83Å; V69-W72 HydrophobicContact CB-CB 4.19Å; V69-W72 HydrophobicContact CB-CD2 3.84Å; V69-W72 HydrophobicContact CB-CE3 4.18Å; V69-W72 HydrophobicContact CB-CG 3.86Å; V69-W72 HydrophobicContact CG1-CD2 3.68Å; V69-W72 HydrophobicContact CG1-CE3 3.79Å; V69-W72 HydrophobicContact CG1-CG 4.24Å; V69-W72 HydrophobicContact CG1-CH2 4.08Å; V69-W72 HydrophobicContact CG1-CZ2 3.98Å; V69-W72 HydrophobicContact CG1-CZ3 3.98Å; V69-W72 WeakPolarHBondContact O-CB 3.31Å; V69-W72 PolarHBondContact O-N 2.71Å; W72-L77 HydrophobicContact CE3-CB 4.29Å; W72-L77 HydrophobicContact CE3-CD1 3.8Å; W72-L77 HydrophobicContact CZ3-CD1 4.09Å; W72-A80 HydrophobicContact CH2-CB 4.43Å; W72-A80 HydrophobicContact CZ3-CB 3.75Å
73	K	80.2	Confident	84.8	Confident	113 Å²	113	67.1 Å²	67.1	49%	0.491	35%	0.346	S	S	.	.			trans	-84.5	152.6	170.7	-56.5	-179.6	-178.5	176.7	0	110	D36 V75 D76 L77	D36-K73 HydrophobicContact CB-CB 4.25Å; D36-K73 HydrophobicContact CB-CG 4.18Å; D36-K73 WeakPolarHBondContact OD1-CA 3.34Å; K73-V75 PolarHBondContact O-N 3.29Å; K73-V75 VanDerWaalsContact O-N 3.16Å; K73-D76 WeakPolarHBondContact CB-OD2 3.4Å; K73-D76 PolarHBondContact O-N 3.46Å; K73-L77 PolarHBondContact O-N 2.83Å
74	C	80.4	Confident	84.6	Confident	29 Å²	29	66.5 Å²	66.5	20%	0.196	35%	0.345	C	S	.	.	H	α-helix	trans	-53	-35.7	175.2	177.9	0	0	0	0	111.7	S35 D36 V39 A78	S35-C74 WeakPolarHBondContact O-CB 3.28Å; D36-C74 WeakPolarHBondContact OD1-CB 3.35Å; D36-C74 PolarHBondContact OD1-N 2.86Å; V39-C74 HydrophobicContact CG1-CB 4.22Å; C74-A78 WeakPolarHBondContact O-CB 3.48Å; C74-A78 PolarHBondContact O-N 3.43Å
75	V	83.2	Confident	83.8	Confident	89 Å²	89	69.1 Å²	69.1	54%	0.539	37%	0.368	S	S	.	.	H	α-helix	trans	-62.2	-49.1	175.9	-178.8	0	0	0	0	111.8	K73 A78 H79	K73-V75 PolarHBondContact O-N 3.29Å; K73-V75 VanDerWaalsContact O-N 3.16Å; V75-A78 PolarHBondContact O-N 3.12Å; V75-H79 PolarHBondContact O-N 3.15Å; V75-H79 PolarHBondContact O-ND1 3.46Å
76	D	86.6	Confident	83.5	Confident	83 Å²	83	71.8 Å²	71.8	44%	0.444	38%	0.382	S	S	.	.	H	α-helix	trans	-71	-41.4	-175.6	-54.7	-49	0	0	0	110.7	K73 A78 H79 A80	K73-D76 WeakPolarHBondContact CB-OD2 3.4Å; K73-D76 PolarHBondContact O-N 3.46Å; D76-A78 PolarHBondContact O-N 3.27Å; D76-H79 PolarHBondContact O-N 3.33Å; D76-H79 VanDerWaalsContact O-N 3.16Å; D76-A80 PolarHBondContact O-N 3.15Å
77	L	88.6	Confident	83.9	Confident	2 Å²	2	74.4 Å²	74.4	1%	0.01	38%	0.382	C	S	.	.	H	α-helix	trans	-63.5	-39.6	174.8	-165.7	63.8	0	0	0	112.1	I33 V39 L61 L64 V69 W72 K73 H79 A80 I81	I33-L77 HydrophobicContact CD1-CB 4.35Å; I33-L77 HydrophobicContact CD1-CD2 4.46Å; I33-L77 HydrophobicContact CD1-CG 4.49Å; V39-L77 HydrophobicContact CB-CD2 3.65Å; V39-L77 HydrophobicContact CG1-CD2 3.77Å; V39-L77 HydrophobicContact CG2-CB 4.3Å; V39-L77 HydrophobicContact CG2-CD2 3.86Å; L61-L77 HydrophobicContact CB-CD2 4.27Å; L61-L77 HydrophobicContact CD1-CD2 3.78Å; L64-L77 HydrophobicContact CB-CD1 3.99Å; L64-L77 HydrophobicContact CD2-CD1 3.63Å; L64-L77 HydrophobicContact CG-CD1 4.42Å; V69-L77 HydrophobicContact CB-CD1 3.82Å; V69-L77 HydrophobicContact CG1-CD1 3.68Å; V69-L77 HydrophobicContact CG2-CD1 3.9Å; V69-L77 HydrophobicContact CG2-CD2 4.2Å; W72-L77 HydrophobicContact CE3-CB 4.29Å; W72-L77 HydrophobicContact CE3-CD1 3.8Å; W72-L77 HydrophobicContact CZ3-CD1 4.09Å; K73-L77 PolarHBondContact O-N 2.83Å; L77-H79 VanDerWaalsContact C-N 3.29Å; L77-H79 PolarHBondContact O-N 3.01Å; L77-A80 PolarHBondContact O-N 3.32Å; L77-I81 HydrophobicContact CG-CD1 4Å; L77-I81 WeakPolarHBondContact O-CB 3.49Å; L77-I81 VanDerWaalsContact O-CG1 3.31Å; L77-I81 WeakPolarHBondContact O-CG1 3.31Å; L77-I81 PolarHBondContact O-N 3.28Å
78	A	89.2	Confident	84.5	Confident	20 Å²	20	68.8 Å²	68.8	17%	0.165	36%	0.356	C	S	.	.	H	α-helix	trans	-61.7	-35.2	174.3	0	0	0	0	0	112.6	I33 C74 V75 D76 R82	I33-A78 HydrophobicContact CD1-CB 4.15Å; C74-A78 WeakPolarHBondContact O-CB 3.48Å; C74-A78 PolarHBondContact O-N 3.43Å; V75-A78 PolarHBondContact O-N 3.12Å; D76-A78 PolarHBondContact O-N 3.27Å; A78-R82 WeakPolarHBondContact O-CB 3.4Å; A78-R82 VanDerWaalsContact O-CD 3.32Å; A78-R82 WeakPolarHBondContact O-CD 3.31Å; A78-R82 WeakPolarHBondContact O-CG 3.16Å; A78-R82 PolarHBondContact O-N 3.12Å; A78-R82 VanDerWaalsContact O-N 3.1Å
79	H	87.7	Confident	84.9	Confident	96 Å²	96	67 Å²	67	44%	0.444	34%	0.343	S	S	.	.	H	α-helix	trans	-70.2	-44.6	174.8	-72.6	96.3	0	0	0	111.6	V75 D76 L77 I81 R82 N83	V75-H79 PolarHBondContact O-N 3.15Å; V75-H79 PolarHBondContact O-ND1 3.46Å; D76-H79 PolarHBondContact O-N 3.33Å; D76-H79 VanDerWaalsContact O-N 3.16Å; L77-H79 VanDerWaalsContact C-N 3.29Å; L77-H79 PolarHBondContact O-N 3.01Å; H79-I81 PolarHBondContact O-N 2.75Å; H79-R82 PolarHBondContact O-N 3.16Å; H79-N83 WeakPolarHBondContact O-CB 3.13Å; H79-N83 PolarHBondContact O-N 3.16Å; H79-N83 PolarHBondContact O-ND2 2.91Å; H79-N83 PolarHBondContact O-OD1 3.02Å
80	A	89.1	Confident	85.2	Confident	26 Å²	26	67 Å²	67	22%	0.215	34%	0.343	C	S	.	.	H	α-helix	trans	-62.7	-40.6	177	0	0	0	0	0	113	L64 W72 D76 L77 N83 S84	L64-A80 HydrophobicContact CD2-CB 3.65Å; W72-A80 HydrophobicContact CH2-CB 4.43Å; W72-A80 HydrophobicContact CZ3-CB 3.75Å; D76-A80 PolarHBondContact O-N 3.15Å; L77-A80 PolarHBondContact O-N 3.32Å; A80-N83 PolarHBondContact O-N 3.18Å; A80-S84 PolarHBondContact O-N 3.06Å; A80-S84 VanDerWaalsContact O-N 3.13Å; A80-S84 PolarHBondContact O-OG 3.3Å
81	I	90.4	Very high	85.8	Confident	18 Å²	18	64.2 Å²	64.2	9%	0.092	33%	0.332	C	S	.	.	H	α-helix	trans	-62.4	-44.8	173.4	-69.4	166.2	0	0	0	110.8	Y29 F31 I33 L64 L77 H79 N83 S84 I88	Y29-I81 HydrophobicContact CD2-CG2 3.69Å; Y29-I81 HydrophobicContact CE2-CG2 4.01Å; Y29-I81 WeakPolarHBondContact CE2-O 3.23Å; F31-I81 HydrophobicContact CE2-CD1 4.41Å; F31-I81 HydrophobicContact CZ-CD1 3.98Å; I33-I81 HydrophobicContact CD1-CD1 4.36Å; L64-I81 HydrophobicContact CD1-CG1 4.12Å; L64-I81 HydrophobicContact CD2-CG1 3.79Å; L77-I81 HydrophobicContact CG-CD1 4Å; L77-I81 WeakPolarHBondContact O-CB 3.49Å; L77-I81 VanDerWaalsContact O-CG1 3.31Å; L77-I81 WeakPolarHBondContact O-CG1 3.31Å; L77-I81 PolarHBondContact O-N 3.28Å; H79-I81 PolarHBondContact O-N 2.75Å; I81-N83 VanDerWaalsContact C-N 3.34Å; I81-N83 PolarHBondContact O-N 3.41Å; I81-S84 WeakPolarHBondContact O-CB 3.47Å; I81-S84 PolarHBondContact O-N 2.92Å; I81-I88 HydrophobicContact CG1-CD1 4.31Å; I81-I88 HydrophobicContact CG2-CD1 4.15Å
82	R	85.9	Confident	86.5	Confident	170 Å²	170	58.6 Å²	58.6	64%	0.642	31%	0.305	S	S	*	.	H	α-helix	trans	-66.5	-34	179.6	-75.2	168.1	-178.4	173.9	2.3	113.6	A78 H79 S84	A78-R82 WeakPolarHBondContact O-CB 3.4Å; A78-R82 VanDerWaalsContact O-CD 3.32Å; A78-R82 WeakPolarHBondContact O-CD 3.31Å; A78-R82 WeakPolarHBondContact O-CG 3.16Å; A78-R82 PolarHBondContact O-N 3.12Å; A78-R82 VanDerWaalsContact O-N 3.1Å; H79-R82 PolarHBondContact O-N 3.16Å; R82-S84 VanDerWaalsContact C-N 3.3Å
83	N	85.6	Confident	86.6	Confident	133 Å²	133	57.7 Å²	57.7	71%	0.711	30%	0.302	S	S	*	.	H	α-helix	trans	-77.9	-15	177.9	-67.5	-9.9	0	0	0	112.8	H79 A80 I81	H79-N83 WeakPolarHBondContact O-CB 3.13Å; H79-N83 PolarHBondContact O-N 3.16Å; H79-N83 PolarHBondContact O-ND2 2.91Å; H79-N83 PolarHBondContact O-OD1 3.02Å; A80-N83 PolarHBondContact O-N 3.18Å; I81-N83 VanDerWaalsContact C-N 3.34Å; I81-N83 PolarHBondContact O-N 3.41Å
84	S	85.5	Confident	86.6	Confident	14 Å²	14	54.3 Å²	54.3	10%	0.098	29%	0.286	C	S	.	.			trans	-70.2	130.1	172.2	-60.8	0	0	0	0	109.9	R24 Y29 N65 A80 I81 R82 I88	R24-S84 PolarHBondContact NH1-O 3.37Å; Y29-S84 PolarHBondContact OH-O 3.07Å; N65-S84 PolarHBondContact ND2-OG 3.47Å; A80-S84 PolarHBondContact O-N 3.06Å; A80-S84 VanDerWaalsContact O-N 3.13Å; A80-S84 PolarHBondContact O-OG 3.3Å; I81-S84 WeakPolarHBondContact O-CB 3.47Å; I81-S84 PolarHBondContact O-N 2.92Å; R82-S84 VanDerWaalsContact C-N 3.3Å; S84-I88 WeakPolarHBondContact OG-CG2 3.31Å
85	A	73.6	Confident	85.2	Confident	63 Å²	63	57.7 Å²	57.7	52%	0.521	31%	0.306	S	S	.	.			trans	-79.7	-60.8	-166.5	0	0	0	0	0	113.1	R24	R24-A85 WeakPolarHBondContact CD-O 3.31Å; R24-A85 PolarHBondContact NH1-O 2.77Å
86	N	83.5	Confident	83.5	Confident	132 Å²	132	55 Å²	55	71%	0.706	30%	0.297	S	S	*	.	S	Bend	trans	-116	-33.5	-165.1	-61.9	-15.3	0	0	0	113.6	R24	R24-N86 VanDerWaalsContact CB-O 3.23Å; R24-N86 WeakPolarHBondContact CB-O 3.44Å; R24-N86 PolarHBondContact N-O 3.24Å
87	E	91.6	Very high	81.1	Confident	103 Å²	103	57.1 Å²	57.1	48%	0.481	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	164.2	-178.9	65.7	-174.2	-178.5	0	0	109.8	I22 L23 Y29	I22-E87 CarbonylContact O-C 3.47Å; I22-E87 VanDerWaalsContact O-CA 3.29Å; I22-E87 WeakPolarHBondContact O-CA 3.24Å; L23-E87 HydrophobicContact CD2-CB 3.96Å; Y29-E87 PolarHBondContact OH-O 3.27Å
88	I	93.1	Very high	78.5	Confident	0 Å²	0	60 Å²	60	0%	0	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	145	162.8	56.2	177.3	0	0	0	109.6	T21 I22 Y29 F31 L64 N65 I81 S84 V90	T21-I88 CarbonylContact C-O 3.55Å; T21-I88 WeakPolarHBondContact CA-O 3.33Å; I22-I88 HydrophobicContact CB-CG1 3.92Å; I22-I88 HydrophobicContact CD1-CD1 4.3Å; I22-I88 HydrophobicContact CD1-CG1 4.42Å; I22-I88 HydrophobicContact CG1-CG1 4.35Å; I22-I88 PolarHBondContact N-O 3.02Å; I22-I88 PolarHBondContact O-N 3Å; Y29-I88 HydrophobicContact CD1-CD1 4.13Å; Y29-I88 HydrophobicContact CD1-CG1 3.89Å; Y29-I88 HydrophobicContact CD2-CD1 4.27Å; Y29-I88 HydrophobicContact CE1-CB 4.41Å; Y29-I88 HydrophobicContact CE1-CD1 4.44Å; Y29-I88 HydrophobicContact CE1-CG1 3.89Å; Y29-I88 HydrophobicContact CE1-CG2 4.16Å; Y29-I88 HydrophobicContact CE2-CG2 4.16Å; Y29-I88 HydrophobicContact CG-CD1 4.03Å; Y29-I88 HydrophobicContact CG-CG1 4.31Å; F31-I88 HydrophobicContact CE1-CD1 3.85Å; F31-I88 HydrophobicContact CZ-CD1 3.92Å; L64-I88 HydrophobicContact CD1-CB 3.83Å; L64-I88 HydrophobicContact CD1-CD1 4.34Å; L64-I88 HydrophobicContact CD1-CG2 3.95Å; N65-I88 WeakPolarHBondContact OD1-CA 3.43Å; I81-I88 HydrophobicContact CG1-CD1 4.31Å; I81-I88 HydrophobicContact CG2-CD1 4.15Å; S84-I88 WeakPolarHBondContact OG-CG2 3.31Å; I88-V90 HydrophobicContact CD1-CG1 4.21Å
89	T	92	Very high	75.8	Confident	33 Å²	33	63.2 Å²	63.2	20%	0.202	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	112.4	170.8	-64.9	0	0	0	0	108.2	Q19 T21 L64 N65	Q19-T89 HydrophobicContact CG-CG2 3.61Å; Q19-T89 VanDerWaalsContact NE2-CG2 3.35Å; T21-T89 PolarHBondContact OG1-OG1 3.33Å; L64-T89 CarbonylContact C-O 3.34Å; N65-T89 PolarHBondContact N-O 3.02Å; N65-T89 PolarHBondContact OD1-N 2.9Å
90	V	92.4	Very high	73	Confident	1 Å²	1	67.3 Å²	67.3	1%	0.006	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	143.6	176	-63.8	0	0	0	0	110.7	Q19 V20 I22 L55 L61 Q63 L64 I88 V92	Q19-V90 WeakPolarHBondContact CA-O 3.49Å; V20-V90 HydrophobicContact CB-CG2 4Å; V20-V90 HydrophobicContact CG1-CG2 4.37Å; V20-V90 PolarHBondContact N-O 3.49Å; V20-V90 PolarHBondContact O-N 3.12Å; I22-V90 HydrophobicContact CD1-CG2 4.21Å; L55-V90 HydrophobicContact CD1-CG2 4.05Å; L61-V90 HydrophobicContact CD2-CB 3.7Å; L61-V90 HydrophobicContact CD2-CG1 3.83Å; L61-V90 HydrophobicContact CD2-CG2 4.04Å; Q63-V90 VanDerWaalsContact O-CA 3.26Å; Q63-V90 WeakPolarHBondContact O-CA 3.09Å; L64-V90 HydrophobicContact CD1-CG1 3.66Å; I88-V90 HydrophobicContact CD1-CG1 4.21Å; V90-V92 HydrophobicContact CG2-CG1 4.25Å
91	V	88.9	Confident	70.3	Confident	19 Å²	19	72.2 Å²	72.2	12%	0.115	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	123.5	168.5	-179.3	0	0	0	0	107.5	P17 Q19 L62 Q63	P17-V91 HydrophobicContact CB-CG1 3.59Å; Q19-V91 HydrophobicContact CB-CG2 4.47Å; Q19-V91 HydrophobicContact CG-CG2 4.47Å; L62-V91 HydrophobicContact CB-CG1 4.5Å; L62-V91 HydrophobicContact CD1-CG1 4.44Å; L62-V91 PolarHBondContact N-O 3.42Å; Q63-V91 HydrophobicContact CB-CB 3.9Å; Q63-V91 HydrophobicContact CB-CG2 3.95Å; Q63-V91 HydrophobicContact CG-CB 4.17Å; Q63-V91 HydrophobicContact CG-CG2 4.32Å; Q63-V91 PolarHBondContact N-O 2.91Å; Q63-V91 PolarHBondContact O-N 3.13Å
92	V	88.6	Confident	67.3	Low	1 Å²	1	76.8 Å²	76.8	1%	0.006	44%	0.441	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	145.4	-174.8	-72.4	0	0	0	0	114.1	P17 Q18 V20 L55 D59 T60 L61 V90	P17-V92 CarbonylContact C-O 3.56Å; P17-V92 WeakPolarHBondContact CA-O 3.35Å; Q18-V92 HydrophobicContact CB-CG2 4.19Å; Q18-V92 PolarHBondContact N-O 3.33Å; Q18-V92 VanDerWaalsContact O-CG2 3.31Å; Q18-V92 WeakPolarHBondContact O-CG2 3.27Å; Q18-V92 PolarHBondContact O-N 3Å; V20-V92 HydrophobicContact CG2-CG2 4Å; L55-V92 HydrophobicContact CD1-CG1 3.83Å; L55-V92 HydrophobicContact CD1-CG2 4.48Å; D59-V92 HydrophobicContact CB-CB 4.02Å; D59-V92 HydrophobicContact CB-CG1 4.06Å; T60-V92 CarbonylContact O-C 3.52Å; T60-V92 VanDerWaalsContact O-CA 3.23Å; T60-V92 WeakPolarHBondContact O-CA 3.41Å; L61-V92 HydrophobicContact CD2-CG1 3.61Å; L61-V92 HydrophobicContact CG-CG1 4.28Å; V90-V92 HydrophobicContact CG2-CG1 4.25Å
93	W	81.6	Confident	64.6	Low	67 Å²	67	76.9 Å²	76.9	25%	0.254	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	127.4	168.2	-168.6	-56.1	0	0	0	110.1	L7 T60 L62 T95	L7-W93 HydrophobicContact CD1-CH2 4.46Å; L7-W93 HydrophobicContact CD1-CZ3 3.66Å; L7-W93 HydrophobicContact CD2-CH2 4.23Å; L7-W93 HydrophobicContact CD2-CZ3 3.89Å; L7-W93 HydrophobicContact CG-CZ3 4.45Å; T60-W93 PolarHBondContact N-O 3.16Å; T60-W93 PolarHBondContact O-N 2.92Å; L62-W93 HydrophobicContact CD1-CB 4.26Å; L62-W93 HydrophobicContact CD1-CE3 4.24Å; L62-W93 HydrophobicContact CD2-CB 4.35Å; L62-W93 HydrophobicContact CG-CB 4.37Å; W93-T95 PolarHBondContact NE1-OG1 3.23Å
94	R	80.3	Confident	62.1	Low	41 Å²	41	79.9 Å²	79.9	16%	0.155	46%	0.457	C	S	.	.			trans	-109.9	98.8	-178.3	-171.1	168.2	-65.1	143.9	-0.4	112.9	R15 G54 Q56 D59 G96	R15-R94 PolarHBondContact NH1-O 3.43Å; G54-R94 PolarHBondContact O-NH2 3.03Å; Q56-R94 VanDerWaalsContact CD-CZ 3.49Å; Q56-R94 VanDerWaalsContact OE1-CD 3.3Å; D59-R94 WeakPolarHBondContact OD1-CB 3.31Å; D59-R94 VanDerWaalsContact OD1-CG 3.28Å; D59-R94 WeakPolarHBondContact OD1-CG 3.48Å; D59-R94 IonicContact OD1-CZ 2.61Å; D59-R94 IonicContact OD1-NE 2.67Å; D59-R94 PolarHBondContact OD1-NE 3.1Å; D59-R94 IonicContact OD1-NH2 3.52Å; D59-R94 IonicContact OD2-CZ 3.91Å; D59-R94 IonicContact OD2-NE 3.62Å; D59-R94 IonicContact OD2-NH2 2.71Å; D59-R94 PolarHBondContact OD2-NH2 2.85Å; R94-G96 PolarHBondContact O-N 3.36Å
95	T	51.6	Low	59.5	Low	101 Å²	101	81.9 Å²	81.9	62%	0.62	48%	0.479	S	S	*	.			trans	-94.7	88.6	-176.2	-50.7	0	0	0	0	111.9	W93	W93-T95 PolarHBondContact NE1-OG1 3.23Å
96	G	47.1	Very low	57.5	Low	33 Å²	33	86.5 Å²	86.5	34%	0.34	49%	0.494	S	S	.	.	S	Bend	trans	156.1	159.9	174.5	0	0	0	0	0	113.8	R15 R94 S98	R15-G96 PolarHBondContact NH1-O 3.45Å; R15-G96 PolarHBondContact NH2-O 2.98Å; R94-G96 PolarHBondContact O-N 3.36Å; G96-S98 PolarHBondContact O-N 3.39Å
97	P	36.8	Very low	55.3	Low	126 Å²	126	86.8 Å²	86.8	82%	0.818	49%	0.494	S	S	*	.			trans	-53.7	130.9	176.7	-24.4	34.6	0	0	0	111.5	A99	P97-A99 PolarHBondContact O-N 3.46Å
98	S	34.8	Very low	52.3	Low	63 Å²	63	91 Å²	91	44%	0.441	51%	0.513	S	S	.	.			trans	-71.7	118.5	176.2	-178.3	0	0	0	0	108.9	G96 K100	G96-S98 PolarHBondContact O-N 3.39Å; S98-K100 PolarHBondContact O-N 3.35Å
99	A	32.3	Very low	49.2	Very low	88 Å²	88	100.9 Å²	100.9	73%	0.727	55%	0.551	S	S	*	*			trans	-66.8	99.1	164.4	0	0	0	0	0	107.5	P97	P97-A99 PolarHBondContact O-N 3.46Å
100	K	28.5	Very low	46.1	Very low	182 Å²	182	105.8 Å²	105.8	79%	0.791	58%	0.583	S	S	*	*			trans	-56	132.6	178.3	-72.1	-173.5	176.7	-176.6	0	109.2	S98 S102	S98-K100 PolarHBondContact O-N 3.35Å; K100-S102 VanDerWaalsContact C-N 3.35Å; K100-S102 PolarHBondContact O-N 3.34Å
101	P	33.2	Very low	42.9	Very low	128 Å²	128	109.9 Å²	109.9	83%	0.831	61%	0.612	S	S	*	*			trans	-69.1	92.8	174.4	28.4	-33.7	0	0	0	109.6	F103	P101-F103 PolarHBondContact O-N 3.23Å; P101-F103 VanDerWaalsContact O-N 3.1Å
102	S	26.6	Very low	39.9	Very low	115 Å²	115	120.2 Å²	120.2	80%	0.804	65%	0.65	S	S	*	*			trans	-77.5	90.5	173.6	58.1	0	0	0	0	109.9	K100	K100-S102 VanDerWaalsContact C-N 3.35Å; K100-S102 PolarHBondContact O-N 3.34Å
103	F	29	Very low	36.8	Very low	172 Å²	172	128.9 Å²	128.9	75%	0.754	69%	0.688	S	S	*	*				176.1	110.7	114.7	-154.9	-101.5	0	0	0	110.5	P101	P101-F103 PolarHBondContact O-N 3.23Å; P101-F103 VanDerWaalsContact O-N 3.1Å
104	E	33.8	Very low	34.9	Very low	196 Å²	196	131.2 Å²	131.2	92%	0.916	71%	0.711	S	S	*	*			trans	-116.9	127.5	164.7	-175.4	170.7	-141.9	0	0	108.5
105	G	29.5	Very low	32.3	Very low	55 Å²	55	133.5 Å²	133.5	57%	0.567	73%	0.734	S	S	*	*			trans	74.7	94.5	169.9	0	0	0	0	0	116.8
106	L	33.2	Very low	31.1	Very low	160 Å²	160	135.2 Å²	135.2	84%	0.838	75%	0.745	S	S	*	*				-154.9	148.4	117.4	-107.5	171	0	0	0	110.1
107	I	36.6	Very low	30.2	Very low	139 Å²	139	138.5 Å²	138.5	71%	0.713	76%	0.762	S	S	*	*			trans	-120.9	139	-158.9	-63.6	165.9	0	0	0	109.6
108	H	29	Very low	29.8	Very low	190 Å²	190	138.1 Å²	138.1	88%	0.88	75%	0.753	S	S	*	*			trans	-151.6	125.2	140.6	-113.3	-74.1	0	0	0	113.4
109	R	28.6	Very low	29.6	Very low	209 Å²	209	144.2 Å²	144.2	79%	0.789	77%	0.768	S	S	*	*			trans	-77.2	148.7	165.5	-84.2	178.5	169.4	147	-4.3	110.4
110	P	26.2	Very low	29.4	Very low	135 Å²	135	146.4 Å²	146.4	88%	0.877	77%	0.767	S	S	*	*				-86.7	137.3	129.8	-15	31.3	0	0	0	109.4
111	S	25.3	Very low	29.3	Very low	87 Å²	87	140.9 Å²	140.9	61%	0.608	76%	0.756	S	S	*	*			trans	-129.1	122.5	179.5	174.1	0	0	0	0	110.1
112	Y	24.9	Very low	29.3	Very low	236 Å²	236	141 Å²	141	93%	0.925	76%	0.757	S	S	*	*			trans	-140.2	128.7	159.7	-101.9	-79.8	0	0	0	112.1
113	K	24.3	Very low	29.4	Very low	184 Å²	184	140.7 Å²	140.7	80%	0.8	76%	0.755	S	S	*	*			trans	-149.9	173.4	168.5	-88.7	-165.5	175.9	-169.7	0	104.3
114	P	42	Very low	30.8	Very low	115 Å²	115	138 Å²	138	75%	0.747	75%	0.754	S	S	*	*			cis	-112.8	-147.7	-4.6	18.5	8.4	0	0	0	109.4
115	S	24.9	Very low	31.1	Very low	90 Å²	90	133.8 Å²	133.8	63%	0.629	74%	0.744	S	S	*	*			cis	-165.8	178.6	31.1	-67.5	0	0	0	0	113.6
116	T	27.1	Very low	31.1	Very low	137 Å²	137	136.8 Å²	136.8	84%	0.84	75%	0.751	S	S	*	*			trans	75.3	117.1	175.5	65.1	0	0	0	0	114.4
117	S	28.8	Very low	30.8	Very low	101 Å²	101	138.7 Å²	138.7	71%	0.706	75%	0.747	S	S	*	*			cis	95.1	132.3	47.6	172.9	0	0	0	0	110.3
118	N	28.2	Very low	30.6	Very low	118 Å²	118	142 Å²	142	63%	0.631	75%	0.751	S	S	*	*			cis	-158.1	-165.8	-7.2	-110.5	16.3	0	0	0	106.4
119	Y	30.2	Very low	30.5	Very low	191 Å²	191	145 Å²	145	75%	0.749	76%	0.755	S	S	*	*			cis	-163.5	168.7	1.7	-119	-35.2	0	0	0	105.4
120	D	27.2	Very low	30.7	Very low	134 Å²	134	139.1 Å²	139.1	72%	0.717	75%	0.75	S	S	*	*			cis	-153.9	-169.5	-14.6	-156.8	-7.1	0	0	0	108.5
121	A	27.6	Very low	31.7	Very low	67 Å²	67	137.6 Å²	137.6	55%	0.554	74%	0.741	S	S	*	*			trans	-94.3	179.8	174.2	0	0	0	0	0	113.5
122	P	33.3	Very low	32	Very low	131 Å²	131	140.5 Å²	140.5	85%	0.851	75%	0.749	S	S	*	*				-134.5	173.2	75.7	38.6	-25	0	0	0	115
123	S	27.5	Very low	32.2	Very low	108 Å²	108	136 Å²	136	76%	0.755	75%	0.746	S	S	*	*			trans	-112	-151.6	-168.9	-46.6	0	0	0	0	112.9
124	P	59.3	Low	32.5	Very low	115 Å²	115	130.1 Å²	130.1	75%	0.747	74%	0.738	S	S	*	*			trans	-99.8	-158.8	-145.3	37.4	-19.1	0	0	0	113.2
125	P	39.7	Very low	32.7	Very low	108 Å²	108	130.5 Å²	130.5	70%	0.701	74%	0.74	S	S	*	*				-152.6	150.6	104.6	41.1	-24.2	0	0	0	119.1
126	T	29.9	Very low	32.8	Very low	118 Å²	118	131.3 Å²	131.3	72%	0.724	75%	0.746	S	S	*	*			trans	54.7	122.2	136.5	61.2	0	0	0	0	125.6
127	R	27.2	Very low	32.9	Very low	199 Å²	199	134.7 Å²	134.7	75%	0.751	75%	0.749	S	S	*	*				46.3	129.8	119.4	-66.3	-175.7	169.5	-165.8	-1.7	122.6
128	R	30.7	Very low	33	Very low	208 Å²	208	134 Å²	134	79%	0.785	75%	0.749	S	S	*	*			trans	58.1	112.5	134.7	-63.5	175.5	175.8	-175.8	-4	119.4
129	R	26.8	Very low	34.6	Very low	254 Å²	254	133.7 Å²	133.7	96%	0.958	75%	0.754	S	S	*	*				178.2	153.7	112.7	-103.2	176	178.9	170.8	-0.6	114.1
130	A	32.8	Very low	35.7	Very low	85 Å²	85	130.9 Å²	130.9	70%	0.702	76%	0.759	S	S	*	*			trans	-107.3	173.6	148.1	0	0	0	0	0	106.8
131	P	47.7	Very low	35.8	Very low	104 Å²	104	128.5 Å²	128.5	68%	0.675	76%	0.758	S	S	*	*			cis	-141.5	-169.2	18.9	45	-25.6	0	0	0	116.6
132	D	31.5	Very low	36	Very low	147 Å²	147	132 Å²	132	79%	0.786	77%	0.773	S	S	*	*			trans	55.9	132.7	152.1	-64.9	-43.3	0	0	0	123.3
133	V	29.9	Very low	37.1	Very low	141 Å²	141	131.2 Å²	131.2	86%	0.855	77%	0.767	S	S	*	*				177	137.2	107.2	152.5	0	0	0	0	110.7
134	G	30.7	Very low	38.5	Very low	62 Å²	62	131.4 Å²	131.4	64%	0.639	77%	0.766	S	S	*	*			trans	-91.1	-169.5	172.2	0	0	0	0	0	113.5
135	P	45.6	Very low	37.2	Very low	122 Å²	122	133.8 Å²	133.8	79%	0.792	77%	0.771	S	S	*	*				-155.5	-161.4	58.4	43	-20.9	0	0	0	116.6
136	S	28	Very low	37.7	Very low	108 Å²	108	134.6 Å²	134.6	76%	0.755	78%	0.777	S	S	*	*			trans	69.7	131.1	173.5	65.6	0	0	0	0	117
137	K	28.4	Very low	37.9	Very low	208 Å²	208	133 Å²	133	90%	0.904	78%	0.775	S	S	*	*			cis	79.5	135.5	25.1	-68.1	-166.5	173.8	-178.5	0	116.3
138	A	31.3	Very low	38.1	Very low	85 Å²	85	131.5 Å²	131.5	70%	0.702	78%	0.777	S	S	*	*			cis	-162.5	-141.4	-12.8	0	0	0	0	0	112.5
139	P	60.4	Low	37.9	Very low	113 Å²	113	129 Å²	129	73%	0.734	77%	0.774	S	S	*	*				-124.1	161.9	-113.2	40.1	-22	0	0	0	116.6
140	P	55	Low	38	Very low	131 Å²	131	126.8 Å²	126.8	85%	0.851	77%	0.765	S	S	*	*				-140	-159.2	104.1	40.1	-24.9	0	0	0	110.9
141	A	28	Very low	38.3	Very low	84 Å²	84	128.7 Å²	128.7	69%	0.694	77%	0.77	S	S	*	*			cis	-151.3	169.3	3.9	0	0	0	0	0	111.5
142	V	32.8	Very low	37.3	Very low	142 Å²	142	129.9 Å²	129.9	86%	0.861	78%	0.776	S	S	*	*			trans	-166.7	-178.8	-176.7	-111.8	0	0	0	0	109.6
143	P	56.7	Low	37	Very low	114 Å²	114	127.3 Å²	127.3	74%	0.74	78%	0.775	S	S	*	*			cis	-118.6	-138.6	-5.1	42	-23.5	0	0	0	110.1
144	P	57.1	Low	36.8	Very low	111 Å²	111	125 Å²	125	72%	0.721	77%	0.77	S	S	*	*			cis	-131.1	-172.3	-23.4	40.1	-22	0	0	0	114.8
145	L	31.7	Very low	36.6	Very low	166 Å²	166	133.6 Å²	133.6	87%	0.869	78%	0.784	S	S	*	*			trans	-148.6	142.8	166	-73.3	179.3	0	0	0	112.7
146	P	50.3	Low	35.7	Very low	125 Å²	125	137.5 Å²	137.5	81%	0.812	78%	0.783	S	S	*	*				-138.2	-161	113.9	41.6	-28.8	0	0	0	110.4
147	A	33.6	Very low	35.5	Very low	84 Å²	84	138.4 Å²	138.4	69%	0.694	78%	0.778	S	S	*	*			cis	-158	-163.7	3.7	0	0	0	0	0	106.8
148	H	30.2	Very low	35.3	Very low	168 Å²	168	135.8 Å²	135.8	78%	0.778	77%	0.773	S	S	*	*			cis	-170.6	-179.1	-19.1	-126.8	24.9	0	0	0	107.2
149	H	28.4	Very low	35	Very low	156 Å²	156	137.8 Å²	137.8	72%	0.722	78%	0.777	S	S	*	*			cis	-155.7	-169.5	-0.3	-162.8	64.4	0	0	0	109.3
150	R	27.8	Very low	33.3	Very low	207 Å²	207	139.9 Å²	139.9	78%	0.781	78%	0.781	S	S	*	*			trans	-158.8	150	173.5	-170	-175.1	-176.2	178.3	4.1	111.6
151	P	39.3	Very low	31.8	Very low	124 Å²	124	137 Å²	137	81%	0.805	78%	0.775	S	S	*	*				-148.4	-158.5	129.8	38.7	-20.6	0	0	0	114.9
152	T	25.7	Very low	31.7	Very low	129 Å²	129	137.7 Å²	137.7	79%	0.791	78%	0.775	S	S	*	*			trans	-140.2	136.3	-156.7	-37	0	0	0	0	114.8
153	A	26.2	Very low	31.4	Very low	93 Å²	93	139.2 Å²	139.2	77%	0.769	77%	0.773	S	S	*	*			trans	-166.5	147	155	0	0	0	0	0	108.7
154	A	25.6	Very low	29.9	Very low	92 Å²	92	140.2 Å²	140.2	76%	0.76	78%	0.777	S	S	*	*			cis	100.5	129.7	15.4	0	0	0	0	0	115.7
155	R	26.8	Very low	28.4	Very low	244 Å²	244	138.5 Å²	138.5	92%	0.921	78%	0.78	S	S	*	*			trans	70.6	162.4	178.8	-69.3	-174.8	166.5	-161	-1.2	117.4
156	R	26.3	Very low	28.1	Very low	204 Å²	204	139 Å²	139	77%	0.77	78%	0.783	S	S	*	*			cis	-179.9	160.7	-35.8	-156.6	-174.9	-163.1	-141.4	6.5	108.1
157	L	23.9	Very low	26.9	Very low	127 Å²	127	136.8 Å²	136.8	67%	0.665	78%	0.783	S	S	*	*			trans	75	136.8	168.3	-52.7	173.6	0	0	0	114
158	L	24.8	Very low	26.5	Very low	152 Å²	152	140.4 Å²	140.4	80%	0.796	80%	0.796	S	S	*	*			cis	92.8	159.1	37.5	-82.6	179.2	0	0	0	114.5
159	V	24.9	Very low	26.3	Very low	128 Å²	128	136.1 Å²	136.1	78%	0.776	80%	0.797	S	S	*	*			trans	83	103.2	-175.2	-174.6	0	0	0	0	111.3
160	N	23.9	Very low	26.1	Very low	156 Å²	156	132.2 Å²	132.2	83%	0.834	80%	0.8	S	S	*	*				70.7	133.4	57.3	-72.5	7.5	0	0	0	114.6
161	G	24.1	Very low	25.9	Very low	70 Å²	70	128 Å²	128	72%	0.722	80%	0.801	S	S	*	*			trans	139.7	133.6	162.3	0	0	0	0	0	113.1
162	S	25.4	Very low	25.2	Very low	99 Å²	99	133.6 Å²	133.6	69%	0.692	81%	0.807	S	S	*	*			cis	170.7	137.5	-31.6	37	0	0	0	0	106.9
163	E	25.7	Very low	25.4	Very low	175 Å²	175	130.9 Å²	130.9	82%	0.818	80%	0.804	S	S	*	*			trans	65.6	162.2	157.9	-63.7	174.7	127.9	0	0	115.8
164	T	26.1	Very low	25.6	Very low	134 Å²	134	133 Å²	133	82%	0.822	81%	0.808	S	S	*	*			cis	-153.8	169.4	-16.9	18.2	0	0	0	0	108.1
165	G	25.4	Very low	25.5	Very low	75 Å²	75	136 Å²	136	77%	0.773	81%	0.81	S	S	*	*			trans	150	104.6	159.5	0	0	0	0	0	116.3
166	N	25.2	Very low	25.4	Very low	178 Å²	178	128.4 Å²	128.4	95%	0.952	80%	0.8	S	S	*	*			trans	-69.9	150.4	175.9	-71.5	-26.5	0	0	0	113.6
167	G	25.9	Very low	25.2	Very low	78 Å²	78	131 Å²	131	80%	0.804	81%	0.81	S	S	*	*			trans	-162.9	125.7	162.3	0	0	0	0	0	111.1
168	V	25.5	Very low	25.3	Very low	159 Å²	159	128.8 Å²	128.8	96%	0.964	82%	0.818	S	S	*	*			trans	-102.7	131.9	-170.9	175.4	0	0	0	0	112
169	G	25.8	Very low	25.3	Very low	78 Å²	78	126.7 Å²	126.7	80%	0.804	82%	0.822	S	S	*	*			trans	-166.6	136.2	168.5	0	0	0	0	0	109.7
170	G	23.9	Very low	25.2	Very low	75 Å²	75	129.6 Å²	129.6	77%	0.773	83%	0.827	S	S	*	*			trans	-123.2	179.5	-165	0	0	0	0	0	116.5
171	S	23.7	Very low	25.3	Very low	117 Å²	117	131.1 Å²	131.1	82%	0.818	83%	0.832	S	S	*	*			trans	89.2	113.3	171.9	-59.7	0	0	0	0	119.7
172	R	25.1	Very low	25.1	Very low	242 Å²	242	131.4 Å²	131.4	91%	0.913	84%	0.835	S	S	*	*			trans	60.5	68.5	133.8	-68.1	172.4	55.1	167.5	-4	120
173	G	28.3	Very low	25.4	Very low	72 Å²	72	133.1 Å²	133.1	74%	0.742	85%	0.846	S	S	*	*				78.1	172.9	123.1	0	0	0	0	0	119.9
174	T	30.5	Very low	25.4	Very low	138 Å²	138	128.7 Å²	128.7	85%	0.847	84%	0.84	S	S	*	*			trans	77.7	88.1	-177.5	-35.9	0	0	0	0	116
175	L	24.6	Very low	25.7	Very low	155 Å²	155	131 Å²	131	81%	0.812	84%	0.841	S	S	*	*			trans	-133.7	126.3	144.3	-66.9	175.2	0	0	0	105.5
176	A	24.7	Very low	25.8	Very low	85 Å²	85	136 Å²	136	70%	0.702	85%	0.845	S	S	*	*			cis	70.2	81.3	37.8	0	0	0	0	0	112.2
177	W	22.6	Very low	26.1	Very low	257 Å²	257	131.9 Å²	131.9	97%	0.973	82%	0.823	S	S	*	*			trans	-116.1	121.4	169.3	-89.9	36.2	0	0	0	109.4
178	G	25.6	Very low	26.4	Very low	82 Å²	82	133.2 Å²	133.2	85%	0.845	81%	0.811	S	S	*	*			trans	-157.7	108.4	172.6	0	0	0	0	0	109.4
179	A	23.7	Very low	27	Very low	107 Å²	107	129 Å²	129	88%	0.884	78%	0.779	S	S	*	*			trans	-153.3	141.7	172.2	0	0	0	0	0	108.1
180	H	24.1	Very low	27.5	Very low	190 Å²	190	129.4 Å²	129.4	88%	0.88	76%	0.762	S	S	*	*			trans	-98.6	160.2	-167.6	-104.7	-68.1	0	0	0	114.5
181	M	24.6	Very low	28.2	Very low	188 Å²	188	131.7 Å²	131.7	93%	0.926	76%	0.755	S	S	*	*			trans	82.3	119	152.4	-82	-173.7	164.9	0	0	120.5
182	G	22	Very low	29	Very low	76 Å²	76	128.9 Å²	128.9	78%	0.784	73%	0.73	S	S	*	*			trans	-173	102.4	162.2	0	0	0	0	0	108	A184	G182-A184 PolarHBondContact O-N 3.24Å
183	S	29.8	Very low	29.4	Very low	134 Å²	134	120.9 Å²	120.9	94%	0.937	72%	0.716	S	S	*	*			trans	-78.1	115.6	-166.3	164.6	0	0	0	0	114
184	A	27.4	Very low	29.8	Very low	83 Å²	83	121.4 Å²	121.4	69%	0.686	71%	0.706	S	S	*	*			trans	-157.8	132.2	153.5	0	0	0	0	0	111.7	G182	G182-A184 PolarHBondContact O-N 3.24Å
185	E	30.8	Very low	30.5	Very low	182 Å²	182	116.4 Å²	116.4	85%	0.85	67%	0.674	S	S	*	*			trans	44.7	75.2	158	-60.7	-177.9	160	0	0	118	D187	E185-D187 VanDerWaalsContact C-N 3.34Å; E185-D187 PolarHBondContact O-N 3.34Å
186	E	27.8	Very low	31.2	Very low	180 Å²	180	115.6 Å²	115.6	84%	0.841	67%	0.67	S	S	*	*			trans	-75.7	79.2	165.9	-69.2	-174	167.3	0	0	111.9
187	D	32.7	Very low	31.9	Very low	91 Å²	91	114.6 Å²	114.6	49%	0.487	66%	0.657	S	S	.	*			trans	-74.6	136.9	168.4	-86.1	-22.9	0	0	0	112.2	E185 Y189	E185-D187 VanDerWaalsContact C-N 3.34Å; E185-D187 PolarHBondContact O-N 3.34Å; D187-Y189 HydrophobicContact CB-CD2 3.64Å; D187-Y189 HydrophobicContact CB-CE1 4.38Å; D187-Y189 HydrophobicContact CB-CE2 3.08Å; D187-Y189 WeakPolarHBondContact OD2-CE2 3.46Å; D187-Y189 VanDerWaalsContact OD2-CZ 3.31Å; D187-Y189 PolarHBondContact OD2-OH 2.87Å
188	N	30.6	Very low	32.3	Very low	107 Å²	107	105.4 Å²	105.4	57%	0.572	64%	0.642	S	S	*	*			trans	-85.6	114.5	178.5	-73.6	-89.7	0	0	0	111.2	I273	N188-I273 HydrophobicContact CB-CD1 4.17Å
189	Y	38.1	Very low	32.7	Very low	71 Å²	71	106.5 Å²	106.5	28%	0.278	64%	0.637	S	S	.	*			trans	-136	141.5	-174.7	-66.4	-60.1	0	0	0	113.5	D187 I270	D187-Y189 HydrophobicContact CB-CD2 3.64Å; D187-Y189 HydrophobicContact CB-CE1 4.38Å; D187-Y189 HydrophobicContact CB-CE2 3.08Å; D187-Y189 WeakPolarHBondContact OD2-CE2 3.46Å; D187-Y189 VanDerWaalsContact OD2-CZ 3.31Å; D187-Y189 PolarHBondContact OD2-OH 2.87Å; Y189-I270 HydrophobicContact CD1-CG2 3.07Å; Y189-I270 HydrophobicContact CD2-CD1 4.14Å; Y189-I270 HydrophobicContact CD2-CG2 4.32Å; Y189-I270 HydrophobicContact CE1-CG2 3.5Å; Y189-I270 VanDerWaalsContact CE1-CG2 3.5Å; Y189-I270 HydrophobicContact CG-CD1 4.08Å; Y189-I270 HydrophobicContact CG-CG2 3.51Å
190	I	37.5	Very low	33.4	Very low	86 Å²	86	110 Å²	110	44%	0.441	64%	0.635	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-87	117.9	170.6	-59.9	175	0	0	0	108.8	P277	I190-P277 HydrophobicContact CD1-CG 4.01Å
191	I	38.3	Very low	33.9	Very low	122 Å²	122	105.9 Å²	105.9	63%	0.626	62%	0.618	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-88.9	115.9	176.8	-64.7	173.8	0	0	0	108.8	I268	I191-I268 HydrophobicContact CG2-CD1 4.48Å; I191-I268 HydrophobicContact CG2-CG2 3.88Å
192	L	40.6	Very low	34.1	Very low	58 Å²	58	102 Å²	102	30%	0.304	60%	0.601	S	S	.	*	P	Polyproline II helix	trans	-93.9	154.5	166.2	-70.2	179.2	0	0	0	111.4	F271	L192-F271 HydrophobicContact CD1-CD2 4.07Å; L192-F271 HydrophobicContact CD1-CE2 3.89Å
193	A	32.8	Very low	34.6	Very low	74 Å²	74	104.9 Å²	104.9	61%	0.612	59%	0.588	S	S	*	*	P	Polyproline II helix	trans	-56.1	151.3	-173.1	0	0	0	0	0	113.2	I195	A193-I195 PolarHBondContact O-N 2.82Å
194	P	37.5	Very low	34.6	Very low	83 Å²	83	102.5 Å²	102.5	54%	0.539	57%	0.569	S	S	.	*	P	Polyproline II helix	trans	-52.9	124.2	-174.7	19.1	-34.3	0	0	0	113.5	N196 P266	P194-N196 PolarHBondContact O-N 2.81Å; P194-N196 VanDerWaalsContact O-N 3.08Å; P194-P266 HydrophobicContact CB-CB 3.39Å; P194-P266 HydrophobicContact CB-CG 3.98Å
195	I	45.7	Very low	34.6	Very low	34 Å²	34	103.5 Å²	103.5	17%	0.174	57%	0.566	C	S	.	*	B	Isolated β-bridge	trans	-62.9	115.8	165.7	-62.4	-179.7	0	0	0	107.4	A193 P197 P266 K267 L269 L285 F306	A193-I195 PolarHBondContact O-N 2.82Å; I195-P197 WeakPolarHBondContact O-CD 3.35Å; I195-P266 WeakPolarHBondContact O-CB 3.37Å; I195-K267 PolarHBondContact N-O 2.71Å; I195-L269 HydrophobicContact CD1-CD1 3.7Å; I195-L269 HydrophobicContact CD1-CG 3.8Å; I195-L285 HydrophobicContact CG2-CD2 4.13Å; I195-F306 HydrophobicContact CD1-CD1 4.48Å; I195-F306 HydrophobicContact CD1-CE1 4.07Å; I195-F306 HydrophobicContact CD1-CZ 4.47Å
196	N	38.4	Very low	34.5	Very low	138 Å²	138	103.6 Å²	103.6	74%	0.738	56%	0.56	S	S	*	*			trans	-101.6	105.1	-177.7	-156.2	0.2	0	0	0	108.2	P194 G198	P194-N196 PolarHBondContact O-N 2.81Å; P194-N196 VanDerWaalsContact O-N 3.08Å; N196-G198 PolarHBondContact O-N 2.87Å
197	P	39.4	Very low	34.5	Very low	63 Å²	63	100.5 Å²	100.5	41%	0.409	55%	0.554	S	S	.	*			trans	-78.1	55.6	-172.3	32.8	-36.8	0	0	0	112.8	I195	I195-P197 WeakPolarHBondContact O-CD 3.35Å
198	G	31	Very low	34.2	Very low	64 Å²	64	103.6 Å²	103.6	66%	0.66	57%	0.57	S	S	*	*			trans	-89	115.9	161.2	0	0	0	0	0	108.8	N196	N196-G198 PolarHBondContact O-N 2.87Å
199	S	35.1	Very low	34	Very low	106 Å²	106	105.1 Å²	105.1	74%	0.741	58%	0.578	S	S	*	*	S	Bend	cis	-141.5	156.2	16.1	-58.6	0	0	0	0	112.9
200	Q	36.4	Very low	33.6	Very low	180 Å²	180	110.7 Å²	110.7	84%	0.841	61%	0.607	S	S	*	*			trans	58.7	84.6	168.1	-58.3	-169.9	57.2	0	0	116.7
201	I	36.3	Very low	33.1	Very low	103 Å²	103	109.5 Å²	109.5	53%	0.528	62%	0.616	S	S	.	*			trans	-112.8	104	153.9	-55.5	-179	0	0	0	108.3	R203	I201-R203 HydrophobicContact CG2-CG 4.02Å
202	L	27.1	Very low	32.5	Very low	108 Å²	108	110 Å²	110	57%	0.565	63%	0.625	S	S	*	*			trans	-74.9	121.2	166.2	-71.8	167	0	0	0	108.6	Y259	L202-Y259 HydrophobicContact CB-CE1 4.46Å; L202-Y259 HydrophobicContact CD2-CD1 3.83Å; L202-Y259 HydrophobicContact CD2-CE1 4.22Å; L202-Y259 HydrophobicContact CD2-CG 4.04Å
203	R	32.4	Very low	31.8	Very low	136 Å²	136	115.4 Å²	115.4	51%	0.513	65%	0.653	S	S	.	*			trans	-115	127.5	167.8	-71	-169.7	171	-168.7	-4.5	109.5	I201 S288	I201-R203 HydrophobicContact CG2-CG 4.02Å; R203-S288 PolarHBondContact NH2-O 3.09Å
204	P	30.7	Very low	31.5	Very low	83 Å²	83	115.8 Å²	115.8	54%	0.539	66%	0.664	S	S	.	*			trans	-62.3	133.9	164.1	-18.8	32	0	0	0	109.8	Y206	P204-Y206 HydrophobicContact CB-CE2 4.18Å; P204-Y206 PolarHBondContact O-N 2.88Å
205	V	27.7	Very low	31	Very low	105 Å²	105	123 Å²	123	64%	0.636	68%	0.681	S	S	*	*			trans	-81.9	102	168.7	179	0	0	0	0	107.6	T207	V205-T207 PolarHBondContact O-N 2.81Å
206	Y	28.2	Very low	30	Very low	184 Å²	184	126.6 Å²	126.6	72%	0.722	71%	0.705	S	S	*	*			trans	-71.8	106.8	165.8	-72.1	-87.9	0	0	0	108.3	P204 D208	P204-Y206 HydrophobicContact CB-CE2 4.18Å; P204-Y206 PolarHBondContact O-N 2.88Å; Y206-D208 PolarHBondContact O-N 3.27Å
207	T	27.4	Very low	29.2	Very low	114 Å²	114	125.1 Å²	125.1	70%	0.699	70%	0.704	S	S	*	*			trans	-70.7	106.1	167.9	49.5	0	0	0	0	108.4	V205 N209	V205-T207 PolarHBondContact O-N 2.81Å; T207-N209 PolarHBondContact O-N 2.86Å
208	D	26.7	Very low	28.5	Very low	156 Å²	156	129 Å²	129	83%	0.834	73%	0.726	S	S	*	*			trans	-63.7	127.5	173.5	-159.8	-3	0	0	0	109.3	Y206	Y206-D208 PolarHBondContact O-N 3.27Å
209	N	26.7	Very low	28.2	Very low	139 Å²	139	130.5 Å²	130.5	74%	0.743	73%	0.733	S	S	*	*			trans	-139.5	62.3	-159.9	-157	27.4	0	0	0	113.2	T207	T207-N209 PolarHBondContact O-N 2.86Å
210	Q	29.5	Very low	27.7	Very low	188 Å²	188	131.5 Å²	131.5	88%	0.879	74%	0.74	S	S	*	*			trans	-126	120.6	159.2	-56.4	179.3	49.3	0	0	106.9
211	G	26.4	Very low	27.2	Very low	61 Å²	61	132.9 Å²	132.9	63%	0.629	74%	0.743	S	S	*	*			cis	172.9	-171	-4.5	0	0	0	0	0	109
212	T	25.7	Very low	26.7	Very low	133 Å²	133	131.7 Å²	131.7	82%	0.816	76%	0.756	S	S	*	*			trans	99.5	113.6	170.8	-44.5	0	0	0	0	117.3
213	L	27.3	Very low	26.7	Very low	172 Å²	172	132.2 Å²	132.2	90%	0.901	77%	0.769	S	S	*	*			trans	30.6	127.9	157.1	-72.3	83.4	0	0	0	121.3
214	G	25.6	Very low	26.5	Very low	82 Å²	82	130.2 Å²	130.2	85%	0.845	78%	0.776	S	S	*	*			trans	-176	95.1	163.1	0	0	0	0	0	115.7
215	R	26.4	Very low	26.3	Very low	233 Å²	233	132.4 Å²	132.4	88%	0.879	79%	0.788	S	S	*	*			trans	-58.9	145.3	-177.5	-88.4	-175.2	168.3	-158.7	-1.2	116.6
216	T	25	Very low	26.2	Very low	111 Å²	111	132.6 Å²	132.6	68%	0.681	79%	0.794	S	S	*	*			trans	65.2	115.5	137	59	0	0	0	0	123.4
217	C	22.3	Very low	27.2	Very low	106 Å²	106	129 Å²	129	72%	0.716	79%	0.793	S	S	*	*				85.6	132.8	118.1	-64.9	0	0	0	0	124
218	T	25.7	Very low	27.3	Very low	144 Å²	144	129.9 Å²	129.9	88%	0.883	80%	0.798	S	S	*	*			trans	73.1	131.5	141.2	47.4	0	0	0	0	121.6
219	A	23.8	Very low	27.6	Very low	97 Å²	97	129.1 Å²	129.1	80%	0.802	80%	0.799	S	S	*	*			trans	-97.1	169.9	-177.6	0	0	0	0	0	113.8
220	S	24.6	Very low	27.7	Very low	126 Å²	126	125.6 Å²	125.6	88%	0.881	80%	0.796	S	S	*	*			trans	-165.5	-174.8	144.4	50.4	0	0	0	0	112.9
221	K	26.1	Very low	27.7	Very low	209 Å²	209	124.6 Å²	124.6	91%	0.909	80%	0.795	S	S	*	*			trans	-118.2	163.1	-150.7	-50.1	167.5	-179.3	173.2	0	114.8
222	G	25.9	Very low	27.8	Very low	78 Å²	78	126 Å²	126	80%	0.804	80%	0.801	S	S	*	*			trans	93.5	164.4	153.9	0	0	0	0	0	116.5
223	S	26.7	Very low	27.9	Very low	120 Å²	120	125.7 Å²	125.7	84%	0.839	79%	0.794	S	S	*	*			cis	-159.4	-178.2	-8.4	-161.2	0	0	0	0	111.8
224	S	28.5	Very low	27.8	Very low	94 Å²	94	126.4 Å²	126.4	66%	0.657	79%	0.787	S	S	*	*			trans	-50.1	173.7	-179.1	61.4	0	0	0	0	117.6
225	T	25.8	Very low	27.8	Very low	128 Å²	128	129.8 Å²	129.8	79%	0.785	78%	0.78	S	S	*	*			cis	-171.5	174.8	49.2	-23.4	0	0	0	0	113.6
226	S	25.9	Very low	27.9	Very low	110 Å²	110	125.2 Å²	125.2	77%	0.769	77%	0.769	S	S	*	*			trans	-111.6	-153.5	179.3	-44.2	0	0	0	0	111.2
227	P	48.5	Very low	28	Very low	107 Å²	107	126.7 Å²	126.7	70%	0.695	77%	0.768	S	S	*	*			cis	-146.8	-173.7	-0.1	39.4	-15.7	0	0	0	119.4
228	T	31.4	Very low	28	Very low	133 Å²	133	127.9 Å²	127.9	82%	0.816	77%	0.767	S	S	*	*			trans	65.7	146.1	151	38.3	0	0	0	0	121.2
229	V	32	Very low	28.4	Very low	141 Å²	141	124.1 Å²	124.1	86%	0.855	75%	0.751	S	S	*	*			cis	-154.3	-166.6	-6.5	77.7	0	0	0	0	107
230	G	29.1	Very low	28.6	Very low	65 Å²	65	125.3 Å²	125.3	67%	0.67	74%	0.744	S	S	*	*			cis	165.1	-172.1	9.5	0	0	0	0	0	108.9
231	L	28.3	Very low	28.8	Very low	166 Å²	166	127.8 Å²	127.8	87%	0.869	74%	0.739	S	S	*	*			cis	-172.6	158.4	-19	-175.1	60.3	0	0	0	110.1
232	A	29.7	Very low	28.8	Very low	90 Å²	90	121.7 Å²	121.7	74%	0.744	73%	0.727	S	S	*	*			trans	73.9	141	159.6	0	0	0	0	0	122.4
233	N	27.3	Very low	28.9	Very low	127 Å²	127	124.3 Å²	124.3	68%	0.679	72%	0.723	S	S	*	*			cis	-159.3	172.4	-26.6	-147.6	0.7	0	0	0	114.2
234	Y	24.5	Very low	28.9	Very low	188 Å²	188	129.4 Å²	129.4	74%	0.737	73%	0.725	S	S	*	*			trans	82.5	142.2	178.6	-48.7	-73.7	0	0	0	113.8
235	Q	26.5	Very low	28.9	Very low	152 Å²	152	133.1 Å²	133.1	71%	0.71	73%	0.732	S	S	*	*			cis	72.5	152.8	25.8	-131.1	173.4	-88.9	0	0	111.4
236	Q	28	Very low	28.9	Very low	137 Å²	137	134.8 Å²	134.8	64%	0.64	74%	0.736	S	S	*	*			cis	-146	150.2	11.5	-170.1	158.9	-33.3	0	0	109.2
237	Q	27.1	Very low	29	Very low	142 Å²	142	135.5 Å²	135.5	66%	0.664	74%	0.74	S	S	*	*			cis	-113.4	-127.4	5.5	-144	158.8	-101.7	0	0	109.8
238	N	22	Very low	27.9	Very low	131 Å²	131	136 Å²	136	70%	0.701	74%	0.741	S	S	*	*			cis	-137.4	-162.8	-3.4	-154.8	34.4	0	0	0	112.2
239	A	34	Very low	27.7	Very low	65 Å²	65	136.9 Å²	136.9	54%	0.537	74%	0.739	S	S	.	*			trans	-146.4	159.2	-148.1	0	0	0	0	0	112.9
240	N	29.1	Very low	27.3	Very low	122 Å²	122	137 Å²	137	65%	0.652	74%	0.74	S	S	*	*			cis	-171.8	172.5	-15.4	-101.1	-16	0	0	0	106.4
241	F	28.6	Very low	27.5	Very low	179 Å²	179	144.7 Å²	144.7	79%	0.785	75%	0.749	S	S	*	*			cis	-159.4	179.3	-5.6	-114.9	-27.8	0	0	0	105.3
242	A	26.9	Very low	27.2	Very low	80 Å²	80	142.5 Å²	142.5	66%	0.661	75%	0.747	S	S	*	*			cis	-155.1	154.5	-8.3	0	0	0	0	0	104.9
243	N	28.1	Very low	26.9	Very low	133 Å²	133	145.9 Å²	145.9	71%	0.711	75%	0.747	S	S	*	*			cis	69.1	108	49.3	-170.2	25.2	0	0	0	116.1
244	Y	25.1	Very low	26.7	Very low	227 Å²	227	146 Å²	146	89%	0.89	75%	0.753	S	S	*	*			trans	-160.6	136.9	135.3	-112.7	-71.9	0	0	0	111.8
245	Q	29.8	Very low	26.9	Very low	173 Å²	173	142.8 Å²	142.8	81%	0.808	76%	0.755	S	S	*	*			trans	-127	117.1	161.9	-84.5	-170.9	-17.8	0	0	109.2
246	N	25.9	Very low	26.9	Very low	162 Å²	162	144.7 Å²	144.7	87%	0.866	76%	0.764	S	S	*	*			trans	167.7	123.7	146.1	-96.7	-44.4	0	0	0	111.1
247	C	27.2	Very low	26.9	Very low	125 Å²	125	141.4 Å²	141.4	85%	0.845	76%	0.76	S	S	*	*			trans	177.3	98.8	142.4	-103.7	0	0	0	0	112.7
248	T	26.2	Very low	26.8	Very low	119 Å²	119	142.2 Å²	142.2	73%	0.73	77%	0.769	S	S	*	*				38.9	112.6	128.7	-48.1	0	0	0	0	121.2
249	I	25.7	Very low	27.2	Very low	150 Å²	150	141.8 Å²	141.8	77%	0.769	76%	0.759	S	S	*	*			trans	39.3	121	130.3	-55.1	174.2	0	0	0	116.8
250	V	24.6	Very low	27	Very low	144 Å²	144	141.2 Å²	141.2	87%	0.873	76%	0.758	S	S	*	*				-143	150.5	77.7	-155.7	0	0	0	0	114.2
251	R	32.5	Very low	27	Very low	226 Å²	226	145.9 Å²	145.9	85%	0.853	77%	0.769	S	S	*	*			trans	-95.7	155.2	171.6	-74.5	176.8	167.5	172.3	-5.1	112.5
252	S	21.8	Very low	27	Very low	120 Å²	120	143 Å²	143	84%	0.839	77%	0.766	S	S	*	*			trans	-132.7	78.9	159.5	44.9	0	0	0	0	113.3
253	H	23.2	Very low	27.3	Very low	161 Å²	161	148.8 Å²	148.8	75%	0.745	78%	0.776	S	S	*	*			trans	43.8	105.6	145.1	-63	-83.3	0	0	0	122.6
254	T	24.2	Very low	28	Very low	131 Å²	131	146 Å²	146	80%	0.804	76%	0.764	S	S	*	*			trans	66.2	154.5	138.4	39.7	0	0	0	0	121.8
255	P	27.9	Very low	28.8	Very low	120 Å²	120	138.6 Å²	138.6	78%	0.779	75%	0.749	S	S	*	*			cis	-113.1	163.2	-15.6	38.6	-27.6	0	0	0	112.9
256	H	27.6	Very low	30	Very low	191 Å²	191	133.8 Å²	133.8	88%	0.884	73%	0.733	S	S	*	*			trans	-82	121.3	175.7	-69.9	-75.1	0	0	0	112
257	A	27.1	Very low	31.7	Very low	68 Å²	68	128 Å²	128	56%	0.562	70%	0.7	S	S	*	*			trans	-95.4	124.6	159.5	0	0	0	0	0	109.3	Y259	A257-Y259 HydrophobicContact CB-CD2 4.2Å; A257-Y259 HydrophobicContact CB-CE2 3.81Å; A257-Y259 PolarHBondContact O-N 3.49Å; A257-Y259 VanDerWaalsContact O-N 3.08Å
258	N	25.7	Very low	33.5	Very low	160 Å²	160	124.9 Å²	124.9	86%	0.856	67%	0.674	S	S	*	*			trans	-75.9	94.9	-179.8	-92.9	1	0	0	0	111.3
259	Y	30.4	Very low	35.7	Very low	122 Å²	122	119.4 Å²	119.4	48%	0.478	64%	0.641	S	S	.	*			trans	-93.2	105.1	166.8	-71.5	-77.4	0	0	0	110.5	L202 A257	L202-Y259 HydrophobicContact CB-CE1 4.46Å; L202-Y259 HydrophobicContact CD2-CD1 3.83Å; L202-Y259 HydrophobicContact CD2-CE1 4.22Å; L202-Y259 HydrophobicContact CD2-CG 4.04Å; A257-Y259 HydrophobicContact CB-CD2 4.2Å; A257-Y259 HydrophobicContact CB-CE2 3.81Å; A257-Y259 PolarHBondContact O-N 3.49Å; A257-Y259 VanDerWaalsContact O-N 3.08Å
260	G	28.7	Very low	37.7	Very low	52 Å²	52	112.5 Å²	112.5	54%	0.536	61%	0.605	S	S	.	*			trans	-83.2	122.8	172.2	0	0	0	0	0	111.6	V262	G260-V262 PolarHBondContact O-N 2.87Å
261	Y	28.8	Very low	39.7	Very low	221 Å²	221	105.8 Å²	105.8	87%	0.867	56%	0.564	S	S	*	*			trans	-74.4	94	175.5	-73.9	-86.7	0	0	0	111.3	K263	Y261-K263 PolarHBondContact O-N 2.93Å
262	V	30.2	Very low	40.7	Very low	119 Å²	119	96.3 Å²	96.3	72%	0.721	53%	0.532	S	S	*	.			trans	-83.6	108.7	169.7	-178.1	0	0	0	0	109.1	G260 V264	G260-V262 PolarHBondContact O-N 2.87Å; V262-V264 PolarHBondContact O-N 3.38Å
263	K	33	Very low	41.7	Very low	201 Å²	201	96.5 Å²	96.5	87%	0.874	52%	0.522	S	S	*	.			trans	-72.8	91.2	171.8	-171.3	177.7	-177.3	-179.8	0	109.1	Y261 A265	Y261-K263 PolarHBondContact O-N 2.93Å; K263-A265 PolarHBondContact O-N 3.45Å
264	V	41.6	Very low	42.6	Very low	75 Å²	75	94.9 Å²	94.9	46%	0.455	51%	0.513	S	S	.	.	P	Polyproline II helix	trans	-56.9	132.9	178.8	-172.8	0	0	0	0	109.5	V262	V262-V264 PolarHBondContact O-N 3.38Å
265	A	42.1	Very low	43.7	Very low	71 Å²	71	89 Å²	89	59%	0.587	48%	0.477	S	S	*	.	P	Polyproline II helix	trans	-60.7	140.4	174.3	0	0	0	0	0	109.9	K263 K267	K263-A265 PolarHBondContact O-N 3.45Å; A265-K267 PolarHBondContact O-N 2.81Å
266	P	54.6	Low	44.7	Very low	72 Å²	72	90.6 Å²	90.6	47%	0.468	47%	0.474	S	S	.	.	P	Polyproline II helix	trans	-63.3	131.3	-178	26.1	-33.7	0	0	0	110.4	P194 I195	P194-P266 HydrophobicContact CB-CB 3.39Å; P194-P266 HydrophobicContact CB-CG 3.98Å; I195-P266 WeakPolarHBondContact O-CB 3.37Å
267	K	62.6	Low	45.8	Very low	40 Å²	40	84.9 Å²	84.9	17%	0.174	45%	0.454	C	S	.	.	B	Isolated β-bridge	trans	-87.4	138.4	175.6	-57.4	-155	-175.6	-173.5	0	110.5	I195 A265 E317 G321 C323	I195-K267 PolarHBondContact N-O 2.71Å; A265-K267 PolarHBondContact O-N 2.81Å; K267-E317 VanDerWaalsContact NZ-CD 3.28Å; K267-E317 IonicContact NZ-OE1 3.19Å; K267-E317 PolarHBondContact NZ-OE1 2.84Å; K267-E317 IonicContact NZ-OE2 3.82Å; K267-E317 PolarHBondContact NZ-OE2 2.89Å; K267-G321 CarbonylContact C-O 3.42Å; K267-G321 WeakPolarHBondContact CA-O 3.32Å; K267-C323 WeakPolarHBondContact CD-SG 3.43Å
268	I	65.9	Low	47.3	Very low	60 Å²	60	82.6 Å²	82.6	31%	0.308	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	125.1	169.5	-61	173.6	0	0	0	107.3	I191 I270 G321 C323	I191-I268 HydrophobicContact CG2-CD1 4.48Å; I191-I268 HydrophobicContact CG2-CG2 3.88Å; I268-I270 HydrophobicContact CG2-CG1 4.1Å; I268-G321 PolarHBondContact N-O 3.38Å; I268-C323 PolarHBondContact O-N 3.21Å
269	L	70.6	Confident	48.9	Very low	4 Å²	4	79.1 Å²	79.1	2%	0.021	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	133.5	164.9	-76.6	176.6	0	0	0	109.6	I195 F271 L280 F306 L313 T315 C323 V325	I195-L269 HydrophobicContact CD1-CD1 3.7Å; I195-L269 HydrophobicContact CD1-CG 3.8Å; L269-F271 HydrophobicContact CB-CE2 4.04Å; L269-F271 HydrophobicContact CD1-CE2 4.39Å; L269-L280 HydrophobicContact CD1-CD1 3.32Å; L269-F306 HydrophobicContact CD2-CD2 4.35Å; L269-F306 HydrophobicContact CD2-CE2 3.93Å; L269-F306 HydrophobicContact CD2-CZ 4.43Å; L269-L313 HydrophobicContact CD1-CD1 3.79Å; L269-T315 HydrophobicContact CD2-CG2 3.76Å; L269-C323 HydrophobicContact CD2-CB 3.84Å; L269-V325 HydrophobicContact CD2-CG2 4.13Å
270	I	68.6	Low	50.5	Low	5 Å²	5	74.5 Å²	74.5	3%	0.026	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	117	177	-77.1	-174.7	0	0	0	108.3	Y189 I268 R322 C323 N324 V325	Y189-I270 HydrophobicContact CD1-CG2 3.07Å; Y189-I270 HydrophobicContact CD2-CD1 4.14Å; Y189-I270 HydrophobicContact CD2-CG2 4.32Å; Y189-I270 HydrophobicContact CE1-CG2 3.5Å; Y189-I270 VanDerWaalsContact CE1-CG2 3.5Å; Y189-I270 HydrophobicContact CG-CD1 4.08Å; Y189-I270 HydrophobicContact CG-CG2 3.51Å; I268-I270 HydrophobicContact CG2-CG1 4.1Å; I270-R322 HydrophobicContact CD1-CG 3.52Å; I270-R322 HydrophobicContact CG1-CG 4.46Å; I270-C323 PolarHBondContact N-O 3.34Å; I270-N324 WeakPolarHBondContact CB-OD1 3.45Å; I270-N324 WeakPolarHBondContact CG2-OD1 3.22Å; I270-V325 WeakPolarHBondContact O-CB 3.49Å; I270-V325 WeakPolarHBondContact O-CG2 3.38Å; I270-V325 PolarHBondContact O-N 3.22Å
271	F	66	Low	51.6	Low	3 Å²	3	77.9 Å²	77.9	1%	0.013	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	133.7	175.5	-73.7	-94.4	0	0	0	109.9	L192 L269 V275 L278 L280 L313 V325	L192-F271 HydrophobicContact CD1-CD2 4.07Å; L192-F271 HydrophobicContact CD1-CE2 3.89Å; L269-F271 HydrophobicContact CB-CE2 4.04Å; L269-F271 HydrophobicContact CD1-CE2 4.39Å; F271-V275 HydrophobicContact CD1-CB 4.22Å; F271-V275 HydrophobicContact CD1-CG1 3.73Å; F271-V275 HydrophobicContact CE1-CG1 4.3Å; F271-L278 HydrophobicContact CZ-CB 4.47Å; F271-L280 HydrophobicContact CE2-CD1 4.27Å; F271-L280 HydrophobicContact CZ-CD1 4.16Å; F271-L313 HydrophobicContact CZ-CD1 4.29Å; F271-V325 HydrophobicContact CD1-CB 4.24Å; F271-V325 HydrophobicContact CD1-CG1 4.19Å; F271-V325 HydrophobicContact CD1-CG2 4.04Å; F271-V325 HydrophobicContact CD2-CG2 4.34Å; F271-V325 HydrophobicContact CE1-CB 4.44Å; F271-V325 HydrophobicContact CE1-CG1 4.16Å; F271-V325 HydrophobicContact CE1-CG2 3.94Å; F271-V325 HydrophobicContact CE2-CG2 4.23Å; F271-V325 HydrophobicContact CG-CG2 4.25Å; F271-V325 HydrophobicContact CZ-CG2 4.04Å
272	P	54.9	Low	53	Low	26 Å²	26	71.3 Å²	71.3	17%	0.169	40%	0.398	C	S	.	.			trans	-60	150.1	168	-19.6	30.3	0	0	0	110.8	F274 V275 V325	P272-F274 HydrophobicContact CB-CD1 3.89Å; P272-F274 HydrophobicContact CB-CD2 4.1Å; P272-F274 HydrophobicContact CB-CE1 3.47Å; P272-F274 VanDerWaalsContact CB-CE1 3.47Å; P272-F274 HydrophobicContact CB-CE2 3.7Å; P272-F274 HydrophobicContact CB-CG 4.19Å; P272-F274 HydrophobicContact CB-CZ 3.37Å; P272-F274 HydrophobicContact CG-CE1 4.39Å; P272-F274 HydrophobicContact CG-CE2 4.04Å; P272-F274 HydrophobicContact CG-CZ 3.83Å; P272-F274 PolarHBondContact O-N 3.39Å; P272-V275 HydrophobicContact CB-CG2 4.24Å; P272-V275 HydrophobicContact CG-CG2 4.08Å; P272-V275 PolarHBondContact O-N 3.31Å; P272-V325 VanDerWaalsContact CD-O 3.3Å; P272-V325 WeakPolarHBondContact CD-O 3.27Å; P272-V325 WeakPolarHBondContact CG-O 3.46Å
273	I	42.3	Very low	54.9	Low	125 Å²	125	68.1 Å²	68.1	64%	0.641	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	-25.4	-177.3	-58.4	171.5	0	0	0	112.6	N188	N188-I273 HydrophobicContact CB-CD1 4.17Å
274	F	42.9	Very low	57	Low	127 Å²	127	63 Å²	63	56%	0.557	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.3	-0.3	177.3	55.2	-101	0	0	0	115.1	P272	P272-F274 HydrophobicContact CB-CD1 3.89Å; P272-F274 HydrophobicContact CB-CD2 4.1Å; P272-F274 HydrophobicContact CB-CE1 3.47Å; P272-F274 VanDerWaalsContact CB-CE1 3.47Å; P272-F274 HydrophobicContact CB-CE2 3.7Å; P272-F274 HydrophobicContact CB-CG 4.19Å; P272-F274 HydrophobicContact CB-CZ 3.37Å; P272-F274 HydrophobicContact CG-CE1 4.39Å; P272-F274 HydrophobicContact CG-CE2 4.04Å; P272-F274 HydrophobicContact CG-CZ 3.83Å; P272-F274 PolarHBondContact O-N 3.39Å
275	V	46.8	Very low	58.9	Low	8 Å²	8	62 Å²	62	5%	0.048	35%	0.35	C	S	.	.	S	Bend	trans	-107.7	124.4	174.8	-173.9	0	0	0	0	108.9	F271 P272	F271-V275 HydrophobicContact CD1-CB 4.22Å; F271-V275 HydrophobicContact CD1-CG1 3.73Å; F271-V275 HydrophobicContact CE1-CG1 4.3Å; P272-V275 HydrophobicContact CB-CG2 4.24Å; P272-V275 HydrophobicContact CG-CG2 4.08Å; P272-V275 PolarHBondContact O-N 3.31Å
276	Q	47.7	Very low	60.9	Low	153 Å²	153	62.1 Å²	62.1	72%	0.715	34%	0.34	S	S	*	.	P	Polyproline II helix	trans	-56.8	128.2	-179.8	-174.7	174.8	8.3	0	0	110.7	L278	Q276-L278 PolarHBondContact O-N 3.41Å; Q276-L278 VanDerWaalsContact O-N 3.1Å
277	P	50.6	Low	62.4	Low	71 Å²	71	60.1 Å²	60.1	46%	0.461	33%	0.325	S	S	.	.	P	Polyproline II helix	trans	-56.4	117.6	174.2	-25.6	34.9	0	0	0	110	I190	I190-P277 HydrophobicContact CD1-CG 4.01Å
278	L	60.5	Low	63.5	Low	20 Å²	20	59.1 Å²	59.1	11%	0.105	32%	0.324	C	S	.	.	P	Polyproline II helix	trans	-98.4	132.5	-173.9	-156.4	76.9	0	0	0	110.3	F271 Q276 L280 L311 P329	F271-L278 HydrophobicContact CZ-CB 4.47Å; Q276-L278 PolarHBondContact O-N 3.41Å; Q276-L278 VanDerWaalsContact O-N 3.1Å; L278-L280 HydrophobicContact CD2-CD2 3.96Å; L278-L280 PolarHBondContact O-N 3.45Å; L278-L280 VanDerWaalsContact O-N 3.13Å; L278-L311 HydrophobicContact CD2-CD2 3.24Å; L278-P329 HydrophobicContact CD2-CB 4.23Å; L278-P329 HydrophobicContact CD2-CG 4.02Å
279	D	57.3	Low	64.6	Low	86 Å²	86	57.5 Å²	57.5	46%	0.46	32%	0.315	S	S	.	.			trans	-65.4	114.2	164.8	176.2	26.4	0	0	0	109.4	C281 S282 R283	D279-C281 WeakPolarHBondContact OD1-CA 3.46Å; D279-C281 WeakPolarHBondContact OD1-CB 3.21Å; D279-C281 PolarHBondContact OD1-N 3.46Å; D279-S282 PolarHBondContact OD1-N 2.9Å; D279-S282 WeakPolarHBondContact OD2-CB 3.4Å; D279-S282 PolarHBondContact OD2-OG 3.05Å; D279-R283 PolarHBondContact O-NE 3.01Å
280	L	64.8	Low	65.5	Low	25 Å²	25	60.3 Å²	60.3	13%	0.131	33%	0.327	C	S	.	.			trans	-107.1	-9	173.4	-61.3	175.9	0	0	0	111.8	L269 F271 L278 S282 R283 Y308 L313	L269-L280 HydrophobicContact CD1-CD1 3.32Å; F271-L280 HydrophobicContact CE2-CD1 4.27Å; F271-L280 HydrophobicContact CZ-CD1 4.16Å; L278-L280 HydrophobicContact CD2-CD2 3.96Å; L278-L280 PolarHBondContact O-N 3.45Å; L278-L280 VanDerWaalsContact O-N 3.13Å; L280-S282 VanDerWaalsContact C-N 3.31Å; L280-R283 PolarHBondContact O-N 3.06Å; L280-Y308 HydrophobicContact CB-CE1 4.48Å; L280-Y308 HydrophobicContact CD2-CE1 4.27Å; L280-Y308 HydrophobicContact CD2-CE2 4.32Å; L280-L313 HydrophobicContact CD1-CD1 4.2Å; L280-L313 HydrophobicContact CD2-CD1 4.38Å
281	C	51.8	Low	66.6	Low	123 Å²	123	60 Å²	60	83%	0.831	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.2	-25.6	179.8	-65.1	0	0	0	0	112	D279 R283	D279-C281 WeakPolarHBondContact OD1-CA 3.46Å; D279-C281 WeakPolarHBondContact OD1-CB 3.21Å; D279-C281 PolarHBondContact OD1-N 3.46Å; C281-R283 VanDerWaalsContact C-N 3.34Å
282	S	58.3	Low	67.8	Low	84 Å²	84	61.5 Å²	61.5	59%	0.587	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83	-0.7	170.3	57.2	0	0	0	0	114.8	D279 L280	D279-S282 PolarHBondContact OD1-N 2.9Å; D279-S282 WeakPolarHBondContact OD2-CB 3.4Å; D279-S282 PolarHBondContact OD2-OG 3.05Å; L280-S282 VanDerWaalsContact C-N 3.31Å
283	R	70.6	Confident	69.4	Low	51 Å²	51	60.5 Å²	60.5	19%	0.192	33%	0.327	C	S	.	.	S	Bend	trans	-116.7	130.9	-170.7	-55.4	-177.3	-165.9	-98.9	-13.8	112.7	D279 L280 C281 L285 Y308 D310	D279-R283 PolarHBondContact O-NE 3.01Å; L280-R283 PolarHBondContact O-N 3.06Å; C281-R283 VanDerWaalsContact C-N 3.34Å; R283-L285 PolarHBondContact O-N 3.44Å; R283-Y308 HydrophobicContact CB-CD1 3.56Å; R283-Y308 HydrophobicContact CB-CE1 4.11Å; R283-Y308 HydrophobicContact CB-CG 4.4Å; R283-D310 IonicContact CZ-OD1 3.14Å; R283-D310 IonicContact CZ-OD2 2.6Å; R283-D310 IonicContact NH1-OD1 3.8Å; R283-D310 PolarHBondContact NH1-OD1 3.19Å; R283-D310 IonicContact NH1-OD2 2.73Å; R283-D310 PolarHBondContact NH1-OD2 3.07Å
284	T	76.9	Confident	71.4	Confident	95 Å²	95	56.8 Å²	56.8	58%	0.583	31%	0.307	S	S	*	.			trans	-77.8	114.4	174.8	-50.6	0	0	0	0	110.3	I286 Y308 N309	T284-I286 PolarHBondContact O-N 3.44Å; T284-Y308 WeakPolarHBondContact O-CA 3.2Å; T284-N309 PolarHBondContact N-OD1 3.47Å; T284-N309 PolarHBondContact O-N 3.03Å; T284-N309 VanDerWaalsContact O-N 3.14Å
285	L	81.2	Confident	72.8	Confident	52 Å²	52	52.3 Å²	52.3	27%	0.272	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	124.2	166	178.8	67.5	0	0	0	109	I195 R283 F306 Y308	I195-L285 HydrophobicContact CG2-CD2 4.13Å; R283-L285 PolarHBondContact O-N 3.44Å; L285-F306 HydrophobicContact CD1-CB 3.83Å; L285-F306 HydrophobicContact CD1-CD1 3.84Å; L285-F306 HydrophobicContact CD1-CG 4.35Å; L285-F306 HydrophobicContact CD2-CD1 4.09Å; L285-Y308 HydrophobicContact CB-CD1 4.1Å; L285-Y308 HydrophobicContact CB-CE1 3.8Å; L285-Y308 HydrophobicContact CD1-CD1 4.5Å; L285-Y308 HydrophobicContact CD1-CD2 4.03Å; L285-Y308 HydrophobicContact CD1-CE1 4.27Å; L285-Y308 HydrophobicContact CD1-CE2 3.76Å; L285-Y308 HydrophobicContact CD1-CG 4.41Å
286	I	83.5	Confident	73.8	Confident	74 Å²	74	54.9 Å²	54.9	38%	0.379	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	-43.3	-176.8	-57	-177.9	0	0	0	111	T284 V307 N309 C376 N380	T284-I286 PolarHBondContact O-N 3.44Å; I286-V307 PolarHBondContact N-O 2.94Å; I286-N309 HydrophobicContact CD1-CB 4.25Å; I286-C376 VanDerWaalsContact CG2-SG 3.51Å; I286-N380 WeakPolarHBondContact CD1-ND2 3.42Å
287	I	85.8	Confident	74.4	Confident	30 Å²	30	57.2 Å²	57.2	15%	0.154	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	144.2	179.2	-174.7	166.1	0	0	0	111.5	E289 V307 R372 V373 C376	I287-E289 HydrophobicContact CD1-CG 3.59Å; I287-E289 HydrophobicContact CG1-CG 3.58Å; I287-V307 HydrophobicContact CG2-CB 3.62Å; I287-V307 HydrophobicContact CG2-CG2 3.46Å; I287-V307 VanDerWaalsContact CG2-CG2 3.46Å; I287-V307 PolarHBondContact N-O 3.49Å; I287-V307 PolarHBondContact O-N 2.8Å; I287-R372 HydrophobicContact CD1-CB 4.49Å; I287-V373 HydrophobicContact CD1-CG2 4.43Å; I287-C376 HydrophobicContact CG2-CB 4.27Å; I287-C376 VanDerWaalsContact CG2-SG 3.57Å
288	S	87.3	Confident	74.7	Confident	20 Å²	20	62.3 Å²	62.3	14%	0.14	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	110.5	174.2	-178.8	0	0	0	0	109.2	R203 T304 V305 F306	R203-S288 PolarHBondContact NH2-O 3.09Å; S288-T304 WeakPolarHBondContact OG-CG2 3.36Å; S288-V305 WeakPolarHBondContact CA-O 3.5Å; S288-F306 WeakPolarHBondContact OG-CD1 3.26Å; S288-F306 WeakPolarHBondContact OG-CE1 3.26Å
289	E	88.8	Confident	75.2	Confident	26 Å²	26	65.5 Å²	65.5	12%	0.121	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	143.8	-173.2	-74.5	-84.7	-158.7	0	0	110.1	I287 M291 V305 Q369 R372 V373	I287-E289 HydrophobicContact CD1-CG 3.59Å; I287-E289 HydrophobicContact CG1-CG 3.58Å; E289-M291 HydrophobicContact CB-CG 4.47Å; E289-V305 PolarHBondContact N-O 2.96Å; E289-V305 VanDerWaalsContact N-O 3.15Å; E289-V305 PolarHBondContact O-N 3.18Å; E289-Q369 HydrophobicContact CG-CG 4.45Å; E289-Q369 PolarHBondContact OE2-NE2 2.93Å; E289-R372 IonicContact OE1-CZ 2.99Å; E289-R372 IonicContact OE1-NE 3.52Å; E289-R372 PolarHBondContact OE1-NE 3.45Å; E289-R372 IonicContact OE1-NH2 3.93Å; E289-R372 PolarHBondContact OE1-NH2 2.64Å; E289-R372 IonicContact OE2-NH2 2.73Å; E289-V373 HydrophobicContact CB-CG2 4.1Å; E289-V373 HydrophobicContact CG-CG2 3.91Å
290	E	89	Confident	76.5	Confident	62 Å²	62	64.5 Å²	64.5	29%	0.29	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	133.7	172.3	-61	-165.6	112.5	0	0	109.8	K302 V303 Y365 Q369	E290-K302 VanDerWaalsContact CD-CE 3.45Å; E290-K302 VanDerWaalsContact OE1-CE 3.27Å; E290-K302 WeakPolarHBondContact OE1-CE 3.34Å; E290-K302 IonicContact OE1-NZ 2.86Å; E290-K302 PolarHBondContact OE1-NZ 3.14Å; E290-K302 WeakPolarHBondContact OE2-CE 3.25Å; E290-K302 IonicContact OE2-NZ 3.75Å; E290-K302 PolarHBondContact OE2-NZ 3.47Å; E290-V303 CarbonylContact C-O 3.59Å; E290-V303 WeakPolarHBondContact CA-O 3.29Å; E290-Y365 HydrophobicContact CB-CE2 4.14Å; E290-Y365 VanDerWaalsContact O-CD2 3.28Å; E290-Y365 WeakPolarHBondContact O-CD2 3.2Å; E290-Y365 WeakPolarHBondContact O-CE2 3.42Å; E290-Q369 PolarHBondContact O-NE2 3.23Å; E290-Q369 PolarHBondContact O-OE1 2.81Å
291	M	92.1	Very high	77.5	Confident	0 Å²	0	64.2 Å²	64.2	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	173.5	-174	-47.4	-163.7	80	0	0	110.2	E289 V303 V305 F347 L362 A364 V373	E289-M291 HydrophobicContact CB-CG 4.47Å; M291-V303 HydrophobicContact CB-CG2 4.23Å; M291-V303 PolarHBondContact N-O 3.02Å; M291-V303 WeakPolarHBondContact O-CG2 3.42Å; M291-V303 PolarHBondContact O-N 3.24Å; M291-V305 HydrophobicContact CB-CG2 4.25Å; M291-V305 HydrophobicContact CG-CB 4.47Å; M291-V305 HydrophobicContact CG-CG2 3.98Å; M291-V305 HydrophobicContact SD-CB 4.21Å; M291-V305 HydrophobicContact SD-CG2 3.87Å; M291-F347 HydrophobicContact CE-CE1 3.55Å; M291-F347 HydrophobicContact CE-CZ 3.73Å; M291-F347 HydrophobicContact SD-CZ 4.28Å; M291-L362 HydrophobicContact CB-CD2 4.48Å; M291-A364 HydrophobicContact CE-CB 3.85Å; M291-V373 HydrophobicContact CE-CB 4.32Å; M291-V373 HydrophobicContact CE-CG1 4.18Å; M291-V373 HydrophobicContact CE-CG2 4.18Å; M291-V373 HydrophobicContact SD-CG1 4.01Å; M291-V373 HydrophobicContact SD-CG2 4.22Å
292	I	89.9	Confident	79.2	Confident	34 Å²	34	63.3 Å²	63.3	17%	0.174	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	122.6	171.9	-58.4	170.4	0	0	0	108.8	L301 L362 E363 Y365	I292-L301 CarbonylContact C-O 3.54Å; I292-L301 WeakPolarHBondContact CA-O 3.21Å; I292-L362 CarbonylContact O-C 3.51Å; I292-L362 WeakPolarHBondContact O-CA 3.46Å; I292-E363 HydrophobicContact CB-CB 4.2Å; I292-E363 PolarHBondContact N-O 3.29Å; I292-E363 PolarHBondContact O-N 3.11Å; I292-Y365 HydrophobicContact CD1-CE1 3.87Å; I292-Y365 HydrophobicContact CG1-CE1 4.11Å
293	L	89.8	Confident	80.7	Confident	4 Å²	4	59.4 Å²	59.4	2%	0.021	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	131.1	170.8	178.7	72.1	0	0	0	109.1	E295 S300 L301 V303 I314 L360 L362	L293-E295 HydrophobicContact CD2-CG 4.31Å; L293-S300 CarbonylContact O-C 3.59Å; L293-S300 WeakPolarHBondContact O-CA 3.38Å; L293-L301 PolarHBondContact N-O 3.08Å; L293-L301 PolarHBondContact O-N 3.46Å; L293-V303 HydrophobicContact CB-CG1 3.88Å; L293-V303 HydrophobicContact CB-CG2 3.98Å; L293-V303 HydrophobicContact CD2-CG1 4.42Å; L293-I314 HydrophobicContact CD1-CD1 4.44Å; L293-I314 HydrophobicContact CD2-CG2 4.45Å; L293-L360 HydrophobicContact CD1-CB 4.49Å; L293-L360 HydrophobicContact CD1-CD2 4.02Å; L293-L362 HydrophobicContact CB-CD2 4.16Å; L293-L362 HydrophobicContact CD1-CD2 3.9Å; L293-L362 HydrophobicContact CD1-CG 4.44Å
294	H	84.9	Confident	81.6	Confident	47 Å²	47	57.1 Å²	57.1	22%	0.218	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	113.5	172.9	-65.5	-92.5	0	0	0	110.4	S361 E363	H294-S361 PolarHBondContact N-O 3Å; H294-E363 IonicContact CD2-OE2 3.4Å; H294-E363 IonicContact CE1-OE2 3.73Å; H294-E363 PolarHBondContact CE1-OE2 3.16Å; H294-E363 IonicContact NE2-OE2 3.91Å; H294-E363 PolarHBondContact NE2-OE2 3.05Å
295	E	71.8	Confident	82.2	Confident	33 Å²	33	52.7 Å²	52.7	15%	0.154	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	-28.3	174.8	-60.6	-168.8	-177	0	0	111.8	C8 H9 L10 L293 H299 L301	C8-E295 PolarHBondContact SG-OE1 3.23Å; H9-E295 WeakPolarHBondContact CB-OE2 3.23Å; H9-E295 PolarHBondContact N-OE2 2.85Å; L10-E295 HydrophobicContact CD1-CB 4.19Å; L10-E295 HydrophobicContact CD1-CG 3.83Å; L293-E295 HydrophobicContact CD2-CG 4.31Å; E295-H299 PolarHBondContact N-O 3.38Å; E295-H299 IonicContact OE2-CD2 2.76Å; E295-L301 VanDerWaalsContact OE1-CD1 3.26Å; E295-L301 WeakPolarHBondContact OE1-CD1 3.48Å
296	S	67.4	Low	82.5	Confident	63 Å²	63	50.5 Å²	50.5	44%	0.441	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.1	171.6	173.7	75.1	0	0	0	0	111.5	H298 H299	S296-H298 PolarHBondContact O-N 2.94Å; S296-H298 PolarHBondContact OG-N 2.73Å; S296-H299 PolarHBondContact N-O 3.12Å; S296-H299 PolarHBondContact O-N 3.42Å; S296-H299 WeakPolarHBondContact OG-CB 3.49Å; S296-H299 PolarHBondContact OG-N 3.37Å
297	K	60.6	Low	82.8	Confident	201 Å²	201	47 Å²	47	87%	0.874	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.6	-15.6	176.6	-64.9	-172.9	178	-175.8	0	114.9
298	H	56.2	Low	82.8	Confident	179 Å²	179	45.9 Å²	45.9	83%	0.829	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-131.2	11.5	-179.3	-52.7	-55.8	0	0	0	113.1	S296	S296-H298 PolarHBondContact O-N 2.94Å; S296-H298 PolarHBondContact OG-N 2.73Å
299	H	72	Confident	82.7	Confident	86 Å²	86	47.8 Å²	47.8	40%	0.398	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	111.6	177.2	-160.4	66.5	0	0	0	111.4	E295 S296	E295-H299 PolarHBondContact N-O 3.38Å; E295-H299 IonicContact OE2-CD2 2.76Å; S296-H299 PolarHBondContact N-O 3.12Å; S296-H299 PolarHBondContact O-N 3.42Å; S296-H299 WeakPolarHBondContact OG-CB 3.49Å; S296-H299 PolarHBondContact OG-N 3.37Å
300	S	83.9	Confident	82.6	Confident	66 Å²	66	48.1 Å²	48.1	46%	0.462	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	145.3	174.1	63.4	0	0	0	0	110.6	L293	L293-S300 CarbonylContact O-C 3.59Å; L293-S300 WeakPolarHBondContact O-CA 3.38Å
301	L	85.4	Confident	82.6	Confident	18 Å²	18	45.1 Å²	45.1	9%	0.094	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	133.3	-173.9	-68.2	179.6	0	0	0	110.4	I292 L293 E295 V303 L326	I292-L301 CarbonylContact C-O 3.54Å; I292-L301 WeakPolarHBondContact CA-O 3.21Å; L293-L301 PolarHBondContact N-O 3.08Å; L293-L301 PolarHBondContact O-N 3.46Å; E295-L301 VanDerWaalsContact OE1-CD1 3.26Å; E295-L301 WeakPolarHBondContact OE1-CD1 3.48Å; L301-V303 HydrophobicContact CB-CG1 4.29Å; L301-V303 PolarHBondContact O-N 3.1Å; L301-L326 HydrophobicContact CD1-CD1 4.48Å
302	K	87.9	Confident	82.4	Confident	104 Å²	104	45.1 Å²	45.1	45%	0.452	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	124.7	164.4	-169.8	-179.3	-166.5	-153.3	0	108.9	E290 Y365	E290-K302 VanDerWaalsContact CD-CE 3.45Å; E290-K302 VanDerWaalsContact OE1-CE 3.27Å; E290-K302 WeakPolarHBondContact OE1-CE 3.34Å; E290-K302 IonicContact OE1-NZ 2.86Å; E290-K302 PolarHBondContact OE1-NZ 3.14Å; E290-K302 WeakPolarHBondContact OE2-CE 3.25Å; E290-K302 IonicContact OE2-NZ 3.75Å; E290-K302 PolarHBondContact OE2-NZ 3.47Å; K302-Y365 WeakPolarHBondContact CE-OH 3.3Å; K302-Y365 WeakPolarHBondContact CG-OH 3.46Å
303	V	90.8	Very high	82.3	Confident	2 Å²	2	43.6 Å²	43.6	1%	0.012	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	149.3	-179.2	-66.1	0	0	0	0	110.9	E290 M291 L293 L301 V305 I314 T315 L326 L362	E290-V303 CarbonylContact C-O 3.59Å; E290-V303 WeakPolarHBondContact CA-O 3.29Å; M291-V303 HydrophobicContact CB-CG2 4.23Å; M291-V303 PolarHBondContact N-O 3.02Å; M291-V303 WeakPolarHBondContact O-CG2 3.42Å; M291-V303 PolarHBondContact O-N 3.24Å; L293-V303 HydrophobicContact CB-CG1 3.88Å; L293-V303 HydrophobicContact CB-CG2 3.98Å; L293-V303 HydrophobicContact CD2-CG1 4.42Å; L301-V303 HydrophobicContact CB-CG1 4.29Å; L301-V303 PolarHBondContact O-N 3.1Å; V303-V305 HydrophobicContact CG2-CG2 4.06Å; V303-I314 HydrophobicContact CB-CG2 3.79Å; V303-I314 HydrophobicContact CG1-CG2 3.79Å; V303-I314 HydrophobicContact CG2-CG2 4.02Å; V303-T315 CarbonylContact C-O 3.56Å; V303-T315 WeakPolarHBondContact CA-O 3.41Å; V303-T315 VanDerWaalsContact CB-O 3.24Å; V303-T315 WeakPolarHBondContact CB-O 3.37Å; V303-L326 HydrophobicContact CG1-CD1 3.73Å; V303-L362 HydrophobicContact CG2-CD2 4.26Å
304	T	88.1	Confident	82.2	Confident	3 Å²	3	43.4 Å²	43.4	2%	0.018	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	124	159.3	-63.6	0	0	0	0	108.1	S288 F306 T315	S288-T304 WeakPolarHBondContact OG-CG2 3.36Å; T304-F306 HydrophobicContact CG2-CD2 3.98Å; T304-F306 HydrophobicContact CG2-CE1 4.24Å; T304-F306 HydrophobicContact CG2-CE2 3.51Å; T304-F306 HydrophobicContact CG2-CZ 3.66Å; T304-T315 PolarHBondContact N-O 2.67Å; T304-T315 PolarHBondContact O-N 2.66Å; T304-T315 PolarHBondContact O-OG1 3.12Å
305	V	90.1	Very high	82.3	Confident	3 Å²	3	41.2 Å²	41.2	2%	0.018	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	125.3	176.6	179.7	0	0	0	0	108.5	S288 E289 M291 V303 V307 L312 L313 L362	S288-V305 WeakPolarHBondContact CA-O 3.5Å; E289-V305 PolarHBondContact N-O 2.96Å; E289-V305 VanDerWaalsContact N-O 3.15Å; E289-V305 PolarHBondContact O-N 3.18Å; M291-V305 HydrophobicContact CB-CG2 4.25Å; M291-V305 HydrophobicContact CG-CB 4.47Å; M291-V305 HydrophobicContact CG-CG2 3.98Å; M291-V305 HydrophobicContact SD-CB 4.21Å; M291-V305 HydrophobicContact SD-CG2 3.87Å; V303-V305 HydrophobicContact CG2-CG2 4.06Å; V305-V307 HydrophobicContact CG1-CG2 4.37Å; V305-L312 HydrophobicContact CG1-CD1 3.37Å; V305-L312 HydrophobicContact CG1-CG 4.24Å; V305-L313 WeakPolarHBondContact CA-O 3.49Å; V305-L362 HydrophobicContact CG2-CD2 4.36Å
306	F	88.3	Confident	83	Confident	5 Å²	5	44.5 Å²	44.5	2%	0.022	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	111.8	175.6	-64.4	-92	0	0	0	109.5	I195 L269 L285 S288 T304 Y308 L313 T315 C323	I195-F306 HydrophobicContact CD1-CD1 4.48Å; I195-F306 HydrophobicContact CD1-CE1 4.07Å; I195-F306 HydrophobicContact CD1-CZ 4.47Å; L269-F306 HydrophobicContact CD2-CD2 4.35Å; L269-F306 HydrophobicContact CD2-CE2 3.93Å; L269-F306 HydrophobicContact CD2-CZ 4.43Å; L285-F306 HydrophobicContact CD1-CB 3.83Å; L285-F306 HydrophobicContact CD1-CD1 3.84Å; L285-F306 HydrophobicContact CD1-CG 4.35Å; L285-F306 HydrophobicContact CD2-CD1 4.09Å; S288-F306 WeakPolarHBondContact OG-CD1 3.26Å; S288-F306 WeakPolarHBondContact OG-CE1 3.26Å; T304-F306 HydrophobicContact CG2-CD2 3.98Å; T304-F306 HydrophobicContact CG2-CE1 4.24Å; T304-F306 HydrophobicContact CG2-CE2 3.51Å; T304-F306 HydrophobicContact CG2-CZ 3.66Å; F306-Y308 HydrophobicContact CB-CD2 4.39Å; F306-Y308 HydrophobicContact CB-CE2 3.88Å; F306-L313 HydrophobicContact CB-CB 4.3Å; F306-L313 PolarHBondContact N-O 2.96Å; F306-L313 PolarHBondContact O-N 3.22Å; F306-T315 HydrophobicContact CD2-CG2 3.82Å; F306-T315 HydrophobicContact CE2-CG2 3.88Å; F306-T315 WeakPolarHBondContact CE2-OG1 3.42Å; F306-C323 HydrophobicContact CE2-CB 4.32Å
307	V	87.9	Confident	83.6	Confident	2 Å²	2	44.3 Å²	44.3	1%	0.012	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	119.7	176.3	-168	0	0	0	0	108.8	I286 I287 V305 L312 L377	I286-V307 PolarHBondContact N-O 2.94Å; I287-V307 HydrophobicContact CG2-CB 3.62Å; I287-V307 HydrophobicContact CG2-CG2 3.46Å; I287-V307 VanDerWaalsContact CG2-CG2 3.46Å; I287-V307 PolarHBondContact N-O 3.49Å; I287-V307 PolarHBondContact O-N 2.8Å; V305-V307 HydrophobicContact CG1-CG2 4.37Å; V307-L312 HydrophobicContact CB-CD1 4.2Å; V307-L312 HydrophobicContact CG1-CD1 4.47Å; V307-L312 HydrophobicContact CG2-CD1 3.63Å; V307-L377 HydrophobicContact CG1-CD2 3.77Å; V307-L377 HydrophobicContact CG2-CD2 4Å; V307-L377 HydrophobicContact CG2-CG 4.4Å
308	Y	87.6	Confident	84.2	Confident	6 Å²	6	39 Å²	39	2%	0.024	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	178.2	172.2	-72	-99.8	0	0	0	110.4	L280 R283 T284 L285 F306 D310 L311 L313 L332	L280-Y308 HydrophobicContact CB-CE1 4.48Å; L280-Y308 HydrophobicContact CD2-CE1 4.27Å; L280-Y308 HydrophobicContact CD2-CE2 4.32Å; R283-Y308 HydrophobicContact CB-CD1 3.56Å; R283-Y308 HydrophobicContact CB-CE1 4.11Å; R283-Y308 HydrophobicContact CB-CG 4.4Å; T284-Y308 WeakPolarHBondContact O-CA 3.2Å; L285-Y308 HydrophobicContact CB-CD1 4.1Å; L285-Y308 HydrophobicContact CB-CE1 3.8Å; L285-Y308 HydrophobicContact CD1-CD1 4.5Å; L285-Y308 HydrophobicContact CD1-CD2 4.03Å; L285-Y308 HydrophobicContact CD1-CE1 4.27Å; L285-Y308 HydrophobicContact CD1-CE2 3.76Å; L285-Y308 HydrophobicContact CD1-CG 4.41Å; F306-Y308 HydrophobicContact CB-CD2 4.39Å; F306-Y308 HydrophobicContact CB-CE2 3.88Å; Y308-D310 VanDerWaalsContact C-N 3.28Å; Y308-D310 PolarHBondContact O-N 3Å; Y308-L311 HydrophobicContact CD2-CD1 3.54Å; Y308-L311 HydrophobicContact CE2-CD1 4.34Å; Y308-L311 HydrophobicContact CG-CD1 3.99Å; Y308-L311 PolarHBondContact N-O 3Å; Y308-L313 HydrophobicContact CE2-CD1 4.04Å; Y308-L313 HydrophobicContact CE2-CG 4.37Å; Y308-L332 WeakPolarHBondContact O-CD1 3.11Å
309	N	85.2	Confident	85	Confident	60 Å²	60	35.2 Å²	35.2	32%	0.321	17%	0.172	S	C	.	.	S	Bend	trans	-63.7	-24.1	178.4	60.1	-44.7	0	0	0	115.2	T284 I286 Q384	T284-N309 PolarHBondContact N-OD1 3.47Å; T284-N309 PolarHBondContact O-N 3.03Å; T284-N309 VanDerWaalsContact O-N 3.14Å; I286-N309 HydrophobicContact CD1-CB 4.25Å; N309-Q384 PolarHBondContact O-NE2 3.08Å
310	D	84.9	Confident	84.9	Confident	32 Å²	32	37.4 Å²	37.4	17%	0.171	19%	0.194	C	C	.	.	S	Bend	trans	-132.9	-5.7	-179.5	79.6	-39.2	0	0	0	115.3	R283 Y308 L332	R283-D310 IonicContact CZ-OD1 3.14Å; R283-D310 IonicContact CZ-OD2 2.6Å; R283-D310 IonicContact NH1-OD1 3.8Å; R283-D310 PolarHBondContact NH1-OD1 3.19Å; R283-D310 IonicContact NH1-OD2 2.73Å; R283-D310 PolarHBondContact NH1-OD2 3.07Å; Y308-D310 VanDerWaalsContact C-N 3.28Å; Y308-D310 PolarHBondContact O-N 3Å; D310-L332 PolarHBondContact O-N 3.07Å
311	L	88.9	Confident	84	Confident	0 Å²	0	35.1 Å²	35.1	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	171.4	-178.7	67.5	76.6	0	0	0	114.2	L278 Y308 L313 P329 L330 Y331	L278-L311 HydrophobicContact CD2-CD2 3.24Å; Y308-L311 HydrophobicContact CD2-CD1 3.54Å; Y308-L311 HydrophobicContact CE2-CD1 4.34Å; Y308-L311 HydrophobicContact CG-CD1 3.99Å; Y308-L311 PolarHBondContact N-O 3Å; L311-L313 HydrophobicContact CD1-CD2 3.83Å; L311-L313 HydrophobicContact CD1-CG 3.78Å; L311-P329 HydrophobicContact CD2-CB 4.19Å; L311-L330 CarbonylContact C-O 3.58Å; L311-L330 VanDerWaalsContact CA-O 3.27Å; L311-L330 WeakPolarHBondContact CA-O 3.26Å; L311-Y331 HydrophobicContact CB-CD1 4.26Å; L311-Y331 HydrophobicContact CD2-CE1 4.49Å
312	L	89.1	Confident	83.3	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	129.1	175.8	-174.5	65.8	0	0	0	109.8	V305 V307 L330 L332 L335 L349 L377	V305-L312 HydrophobicContact CG1-CD1 3.37Å; V305-L312 HydrophobicContact CG1-CG 4.24Å; V307-L312 HydrophobicContact CB-CD1 4.2Å; V307-L312 HydrophobicContact CG1-CD1 4.47Å; V307-L312 HydrophobicContact CG2-CD1 3.63Å; L312-L330 HydrophobicContact CB-CB 4.27Å; L312-L330 HydrophobicContact CD2-CD1 4.35Å; L312-L330 PolarHBondContact N-O 2.57Å; L312-L330 PolarHBondContact O-N 2.99Å; L312-L332 HydrophobicContact CB-CD2 4.31Å; L312-L335 HydrophobicContact CB-CD1 4.05Å; L312-L335 HydrophobicContact CD2-CD1 4.09Å; L312-L349 HydrophobicContact CD2-CD1 3.44Å; L312-L349 VanDerWaalsContact CD2-CD1 3.44Å; L312-L377 HydrophobicContact CD1-CD2 4.01Å; L312-L377 HydrophobicContact CD2-CD2 4.27Å
313	L	87.8	Confident	82.9	Confident	1 Å²	1	32.9 Å²	32.9	1%	0.005	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	136.8	167.8	-53.5	-179.4	0	0	0	109.8	L269 F271 L280 V305 F306 Y308 L311 T315 P329	L269-L313 HydrophobicContact CD1-CD1 3.79Å; F271-L313 HydrophobicContact CZ-CD1 4.29Å; L280-L313 HydrophobicContact CD1-CD1 4.2Å; L280-L313 HydrophobicContact CD2-CD1 4.38Å; V305-L313 WeakPolarHBondContact CA-O 3.49Å; F306-L313 HydrophobicContact CB-CB 4.3Å; F306-L313 PolarHBondContact N-O 2.96Å; F306-L313 PolarHBondContact O-N 3.22Å; Y308-L313 HydrophobicContact CE2-CD1 4.04Å; Y308-L313 HydrophobicContact CE2-CG 4.37Å; L311-L313 HydrophobicContact CD1-CD2 3.83Å; L311-L313 HydrophobicContact CD1-CG 3.78Å; L313-T315 HydrophobicContact CB-CG2 4.34Å; L313-P329 HydrophobicContact CD2-CB 3.66Å; L313-P329 HydrophobicContact CD2-CG 3.75Å
314	I	87.7	Confident	82.3	Confident	1 Å²	1	33.7 Å²	33.7	1%	0.005	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	127.2	167.3	-52.3	-168.7	0	0	0	107.9	L293 V303 L326 L360	L293-I314 HydrophobicContact CD1-CD1 4.44Å; L293-I314 HydrophobicContact CD2-CG2 4.45Å; V303-I314 HydrophobicContact CB-CG2 3.79Å; V303-I314 HydrophobicContact CG1-CG2 3.79Å; V303-I314 HydrophobicContact CG2-CG2 4.02Å; I314-L326 HydrophobicContact CG2-CD1 4.32Å; I314-L326 PolarHBondContact O-N 2.81Å; I314-L360 HydrophobicContact CD1-CD1 4.36Å
315	T	87	Confident	82.1	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	157.3	-173	71.2	0	0	0	0	110.9	L269 V303 T304 F306 L313 C323 N324 V325	L269-T315 HydrophobicContact CD2-CG2 3.76Å; V303-T315 CarbonylContact C-O 3.56Å; V303-T315 WeakPolarHBondContact CA-O 3.41Å; V303-T315 VanDerWaalsContact CB-O 3.24Å; V303-T315 WeakPolarHBondContact CB-O 3.37Å; T304-T315 PolarHBondContact N-O 2.67Å; T304-T315 PolarHBondContact O-N 2.66Å; T304-T315 PolarHBondContact O-OG1 3.12Å; F306-T315 HydrophobicContact CD2-CG2 3.82Å; F306-T315 HydrophobicContact CE2-CG2 3.88Å; F306-T315 WeakPolarHBondContact CE2-OG1 3.42Å; L313-T315 HydrophobicContact CB-CG2 4.34Å; T315-C323 HydrophobicContact CG2-CB 4.49Å; T315-N324 CarbonylContact C-O 3.59Å; T315-N324 WeakPolarHBondContact CA-O 3.38Å; T315-N324 WeakPolarHBondContact CB-O 3.48Å; T315-V325 HydrophobicContact CG2-CG2 3.99Å
316	R	85.9	Confident	81.6	Confident	103 Å²	103	35.2 Å²	35.2	39%	0.389	18%	0.181	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	129.4	171.9	179.5	175.8	160.6	168.1	-1.6	109.2	N318 N324 L326	R316-N318 WeakPolarHBondContact CD-OD1 3.43Å; R316-N318 WeakPolarHBondContact CG-OD1 3.34Å; R316-N318 PolarHBondContact NE-OD1 3.45Å; R316-N318 PolarHBondContact O-N 2.78Å; R316-N324 PolarHBondContact N-O 2.74Å; R316-N324 PolarHBondContact O-N 3.18Å; R316-L326 HydrophobicContact CB-CD1 4.18Å; R316-L326 HydrophobicContact CB-CD2 3.76Å; R316-L326 HydrophobicContact CB-CG 4.11Å
317	E	81.4	Confident	80.9	Confident	59 Å²	59	36.5 Å²	36.5	28%	0.276	19%	0.187	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	99.7	175.8	-168	164.7	-160.9	0	0	108.5	K267 E319 G321 R322	K267-E317 VanDerWaalsContact NZ-CD 3.28Å; K267-E317 IonicContact NZ-OE1 3.19Å; K267-E317 PolarHBondContact NZ-OE1 2.84Å; K267-E317 IonicContact NZ-OE2 3.82Å; K267-E317 PolarHBondContact NZ-OE2 2.89Å; E317-E319 WeakPolarHBondContact CG-O 3.3Å; E317-G321 PolarHBondContact OE1-N 3.37Å; E317-R322 WeakPolarHBondContact CA-O 3.2Å
318	N	72	Confident	80.2	Confident	88 Å²	88	39.8 Å²	39.8	47%	0.471	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	-31.9	177.9	-80.7	-7.1	0	0	0	111.6	R316 N324	R316-N318 WeakPolarHBondContact CD-OD1 3.43Å; R316-N318 WeakPolarHBondContact CG-OD1 3.34Å; R316-N318 PolarHBondContact NE-OD1 3.45Å; R316-N318 PolarHBondContact O-N 2.78Å; N318-N324 PolarHBondContact ND2-ND2 2.63Å
319	E	72.4	Confident	80	Confident	100 Å²	100	40.3 Å²	40.3	47%	0.467	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	149.7	173.7	-57.9	179.4	136.4	0	0	109.1	E317 G321 R322	E317-E319 WeakPolarHBondContact CG-O 3.3Å; E319-G321 PolarHBondContact O-N 2.85Å; E319-R322 HydrophobicContact CB-CB 4.02Å; E319-R322 WeakPolarHBondContact O-CB 3.28Å; E319-R322 PolarHBondContact O-N 2.65Å; E319-R322 IonicContact OE1-NH1 2.72Å; E319-R322 WeakPolarHBondContact OE2-CD 3.35Å; E319-R322 IonicContact OE2-CZ 3.85Å; E319-R322 IonicContact OE2-NE 3.5Å; E319-R322 IonicContact OE2-NH1 3.16Å; E319-R322 PolarHBondContact OE2-NH1 3.29Å
320	P	70.1	Confident	80.1	Confident	132 Å²	132	37.9 Å²	37.9	86%	0.857	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.5	121.1	-179.3	-25.7	35.3	0	0	0	112.7
321	G	64.9	Low	80.2	Confident	19 Å²	19	39.4 Å²	39.4	20%	0.196	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	86	-0.9	-176.3	0	0	0	0	0	115.2	K267 I268 E317 E319	K267-G321 CarbonylContact C-O 3.42Å; K267-G321 WeakPolarHBondContact CA-O 3.32Å; I268-G321 PolarHBondContact N-O 3.38Å; E317-G321 PolarHBondContact OE1-N 3.37Å; E319-G321 PolarHBondContact O-N 2.85Å
322	R	71.4	Confident	80.2	Confident	75 Å²	75	39.4 Å²	39.4	28%	0.283	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	95.5	-175.7	-169.8	179.3	-177.2	165.9	1.7	111.2	I270 E317 E319	I270-R322 HydrophobicContact CD1-CG 3.52Å; I270-R322 HydrophobicContact CG1-CG 4.46Å; E317-R322 WeakPolarHBondContact CA-O 3.2Å; E319-R322 HydrophobicContact CB-CB 4.02Å; E319-R322 WeakPolarHBondContact O-CB 3.28Å; E319-R322 PolarHBondContact O-N 2.65Å; E319-R322 IonicContact OE1-NH1 2.72Å; E319-R322 WeakPolarHBondContact OE2-CD 3.35Å; E319-R322 IonicContact OE2-CZ 3.85Å; E319-R322 IonicContact OE2-NE 3.5Å; E319-R322 IonicContact OE2-NH1 3.16Å; E319-R322 PolarHBondContact OE2-NH1 3.29Å
323	C	78.6	Confident	80.1	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	101	-176.8	-74.2	0	0	0	0	111.5	K267 I268 L269 I270 F306 T315	K267-C323 WeakPolarHBondContact CD-SG 3.43Å; I268-C323 PolarHBondContact O-N 3.21Å; L269-C323 HydrophobicContact CD2-CB 3.84Å; I270-C323 PolarHBondContact N-O 3.34Å; F306-C323 HydrophobicContact CE2-CB 4.32Å; T315-C323 HydrophobicContact CG2-CB 4.49Å
324	N	80.1	Confident	80	Confident	18 Å²	18	48.7 Å²	48.7	10%	0.096	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77	120.6	175.8	-65.7	-6.6	0	0	0	109.7	I270 T315 R316 N318 L326	I270-N324 WeakPolarHBondContact CB-OD1 3.45Å; I270-N324 WeakPolarHBondContact CG2-OD1 3.22Å; T315-N324 CarbonylContact C-O 3.59Å; T315-N324 WeakPolarHBondContact CA-O 3.38Å; T315-N324 WeakPolarHBondContact CB-O 3.48Å; R316-N324 PolarHBondContact N-O 2.74Å; R316-N324 PolarHBondContact O-N 3.18Å; N318-N324 PolarHBondContact ND2-ND2 2.63Å; N324-L326 PolarHBondContact O-N 2.86Å
325	V	83.2	Confident	80.1	Confident	3 Å²	3	48.9 Å²	48.9	2%	0.018	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	121.4	178.9	177.2	0	0	0	0	109.3	L269 I270 F271 P272 T315 Q327	L269-V325 HydrophobicContact CD2-CG2 4.13Å; I270-V325 WeakPolarHBondContact O-CB 3.49Å; I270-V325 WeakPolarHBondContact O-CG2 3.38Å; I270-V325 PolarHBondContact O-N 3.22Å; F271-V325 HydrophobicContact CD1-CB 4.24Å; F271-V325 HydrophobicContact CD1-CG1 4.19Å; F271-V325 HydrophobicContact CD1-CG2 4.04Å; F271-V325 HydrophobicContact CD2-CG2 4.34Å; F271-V325 HydrophobicContact CE1-CB 4.44Å; F271-V325 HydrophobicContact CE1-CG1 4.16Å; F271-V325 HydrophobicContact CE1-CG2 3.94Å; F271-V325 HydrophobicContact CE2-CG2 4.23Å; F271-V325 HydrophobicContact CG-CG2 4.25Å; F271-V325 HydrophobicContact CZ-CG2 4.04Å; P272-V325 VanDerWaalsContact CD-O 3.3Å; P272-V325 WeakPolarHBondContact CD-O 3.27Å; P272-V325 WeakPolarHBondContact CG-O 3.46Å; T315-V325 HydrophobicContact CG2-CG2 3.99Å; V325-Q327 WeakPolarHBondContact CG1-O 3.49Å
326	L	78.6	Confident	80.1	Confident	36 Å²	36	56.2 Å²	56.2	19%	0.188	27%	0.272	C	S	.	.			trans	-81.6	-25.1	-171.6	-67.3	-176.1	0	0	0	114	L301 V303 I314 R316 N324	L301-L326 HydrophobicContact CD1-CD1 4.48Å; V303-L326 HydrophobicContact CG1-CD1 3.73Å; I314-L326 HydrophobicContact CG2-CD1 4.32Å; I314-L326 PolarHBondContact O-N 2.81Å; R316-L326 HydrophobicContact CB-CD1 4.18Å; R316-L326 HydrophobicContact CB-CD2 3.76Å; R316-L326 HydrophobicContact CB-CG 4.11Å; N324-L326 PolarHBondContact O-N 2.86Å
327	Q	74.6	Confident	80.4	Confident	31 Å²	31	53.6 Å²	53.6	15%	0.145	27%	0.265	C	S	.	.	S	Bend	trans	-155.6	165.7	-173.4	62.7	-177	-3.9	0	0	111.3	V325	V325-Q327 WeakPolarHBondContact CG1-O 3.49Å
328	S	73.3	Confident	80.6	Confident	71 Å²	71	55.6 Å²	55.6	50%	0.497	27%	0.274	S	S	.	.	S	Bend	trans	-53.6	145	175.2	-56.9	0	0	0	0	112.4	L330	S328-L330 PolarHBondContact O-N 2.84Å
329	P	83.4	Confident	81.1	Confident	17 Å²	17	54 Å²	54	11%	0.11	27%	0.266	C	S	.	.			trans	-55.7	128.4	178.1	-24.8	33.1	0	0	0	112.6	L278 L311 L313	L278-P329 HydrophobicContact CD2-CB 4.23Å; L278-P329 HydrophobicContact CD2-CG 4.02Å; L311-P329 HydrophobicContact CD2-CB 4.19Å; L313-P329 HydrophobicContact CD2-CB 3.66Å; L313-P329 HydrophobicContact CD2-CG 3.75Å
330	L	86.4	Confident	81.4	Confident	10 Å²	10	50.4 Å²	50.4	5%	0.052	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	110.7	-179.5	-53.8	172	0	0	0	109.1	L311 L312 S328 L335 H351 L360	L311-L330 CarbonylContact C-O 3.58Å; L311-L330 VanDerWaalsContact CA-O 3.27Å; L311-L330 WeakPolarHBondContact CA-O 3.26Å; L312-L330 HydrophobicContact CB-CB 4.27Å; L312-L330 HydrophobicContact CD2-CD1 4.35Å; L312-L330 PolarHBondContact N-O 2.57Å; L312-L330 PolarHBondContact O-N 2.99Å; S328-L330 PolarHBondContact O-N 2.84Å; L330-L335 HydrophobicContact CB-CD1 3.77Å; L330-L335 HydrophobicContact CB-CD2 4.33Å; L330-L335 HydrophobicContact CB-CG 4.3Å; L330-L335 HydrophobicContact CD1-CD2 4.3Å; L330-H351 HydrophobicContact CD2-CB 4.28Å; L330-L360 HydrophobicContact CD1-CD1 3.47Å; L330-L360 VanDerWaalsContact CD1-CD1 3.47Å
331	Y	88.1	Confident	81.5	Confident	63 Å²	63	54.2 Å²	54.2	25%	0.247	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	131.5	178.7	-66.2	-81	0	0	0	110.9	L311 R333 H334	L311-Y331 HydrophobicContact CB-CD1 4.26Å; L311-Y331 HydrophobicContact CD2-CE1 4.49Å; Y331-R333 PolarHBondContact O-N 3.02Å; Y331-H334 PolarHBondContact O-N 3.08Å
332	L	89.1	Confident	81.6	Confident	0 Å²	0	59.7 Å²	59.7	0%	0	28%	0.279	C	S	.	.	G	3₁₀ helix	trans	-60.4	-32.6	-175.8	-66.3	179.1	0	0	0	112.4	Y308 D310 L312 H334 L335 L377 N380 I381 Q384	Y308-L332 WeakPolarHBondContact O-CD1 3.11Å; D310-L332 PolarHBondContact O-N 3.07Å; L312-L332 HydrophobicContact CB-CD2 4.31Å; L332-H334 PolarHBondContact O-N 2.68Å; L332-H334 VanDerWaalsContact O-N 3.12Å; L332-L335 HydrophobicContact CD2-CD1 3.91Å; L332-L335 PolarHBondContact O-N 3.14Å; L332-L377 HydrophobicContact CD2-CD2 3.86Å; L332-N380 HydrophobicContact CD1-CB 3.66Å; L332-I381 HydrophobicContact CB-CG1 3.99Å; L332-I381 HydrophobicContact CD2-CG1 4.12Å; L332-Q384 HydrophobicContact CB-CG 4.24Å
333	R	85.8	Confident	81.6	Confident	121 Å²	121	57.7 Å²	57.7	46%	0.457	27%	0.274	S	S	.	.	G	3₁₀ helix	trans	-58.3	-20.5	172.1	54.1	163.1	177.1	-122.2	-10.5	114.7	Y331 Q384	Y331-R333 PolarHBondContact O-N 3.02Å; R333-Q384 HydrophobicContact CB-CB 4.24Å
334	H	86.5	Confident	81.5	Confident	76 Å²	76	60.1 Å²	60.1	35%	0.352	30%	0.299	S	S	.	.	G	3₁₀ helix	trans	-105.2	2.9	178.5	-56.6	164.7	0	0	0	112.3	Y331 L332 H351 M352	Y331-H334 PolarHBondContact O-N 3.08Å; L332-H334 PolarHBondContact O-N 2.68Å; L332-H334 VanDerWaalsContact O-N 3.12Å; H334-H351 CarbonylContact O-C 3.39Å; H334-H351 WeakPolarHBondContact O-CA 3.44Å; H334-M352 PolarHBondContact O-N 2.85Å
335	L	89.1	Confident	81.9	Confident	4 Å²	4	62.4 Å²	62.4	2%	0.021	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	134.9	-178.5	-74.9	166.1	0	0	0	110.9	L312 L330 L332 L349 I350 H351 I381	L312-L335 HydrophobicContact CB-CD1 4.05Å; L312-L335 HydrophobicContact CD2-CD1 4.09Å; L330-L335 HydrophobicContact CB-CD1 3.77Å; L330-L335 HydrophobicContact CB-CD2 4.33Å; L330-L335 HydrophobicContact CB-CG 4.3Å; L330-L335 HydrophobicContact CD1-CD2 4.3Å; L332-L335 HydrophobicContact CD2-CD1 3.91Å; L332-L335 PolarHBondContact O-N 3.14Å; L335-L349 HydrophobicContact CD2-CB 4.21Å; L335-I350 CarbonylContact C-O 3.58Å; L335-I350 WeakPolarHBondContact CA-O 3.42Å; L335-H351 HydrophobicContact CD2-CB 3.78Å; L335-I381 HydrophobicContact CB-CD1 4.09Å; L335-I381 HydrophobicContact CB-CG1 4.46Å; L335-I381 WeakPolarHBondContact O-CG2 3.5Å
336	R	87.7	Confident	82.1	Confident	154 Å²	154	65.9 Å²	65.9	58%	0.581	32%	0.322	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.1	132.3	162.5	-67.1	-177.3	176.8	166.6	4.3	109.4	L349 I350 M352	R336-L349 WeakPolarHBondContact O-CA 3.39Å; R336-I350 HydrophobicContact CB-CB 4.34Å; R336-I350 PolarHBondContact N-O 3.45Å; R336-I350 PolarHBondContact O-N 3.07Å; R336-M352 HydrophobicContact CG-SD 4.08Å; R336-M352 PolarHBondContact NE-SD 2.95Å
337	L	90.9	Very high	82.7	Confident	49 Å²	49	64.2 Å²	64.2	26%	0.257	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	125.4	171.6	178.4	67.4	0	0	0	109.4	F347 L349 C374 K378	L337-F347 HydrophobicContact CD1-CB 4.44Å; L337-F347 HydrophobicContact CD1-CD2 3.52Å; L337-F347 HydrophobicContact CD1-CE2 4.16Å; L337-F347 HydrophobicContact CD1-CG 4.28Å; L337-L349 HydrophobicContact CB-CD2 4.3Å; L337-L349 HydrophobicContact CD1-CD2 3.67Å; L337-C374 HydrophobicContact CD2-CB 3.89Å; L337-C374 VanDerWaalsContact CD2-O 3.32Å; L337-C374 WeakPolarHBondContact CD2-O 3.4Å; L337-K378 HydrophobicContact CD2-CB 4.24Å
338	Q	86.7	Confident	83.4	Confident	100 Å²	100	65.4 Å²	65.4	47%	0.467	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	114.4	169.9	177.8	175.8	-7	0	0	108.3	Y348	Q338-Y348 PolarHBondContact N-O 3.17Å; Q338-Y348 PolarHBondContact O-N 3.29Å
339	D	83.1	Confident	84.2	Confident	56 Å²	56	62 Å²	62	30%	0.299	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	143.9	175.8	-152.6	-23.7	0	0	0	110.6	K370	D339-K370 WeakPolarHBondContact OD1-CE 3.39Å; D339-K370 IonicContact OD1-NZ 3.34Å; D339-K370 PolarHBondContact OD1-NZ 2.8Å
340	D	78	Confident	84.3	Confident	24 Å²	24	63 Å²	63	13%	0.128	30%	0.297	C	S	.	.			trans	-96.4	115.6	169.4	-158.1	-42.3	0	0	0	108.6	T342 D343 Y348 K370	D340-T342 VanDerWaalsContact C-N 3.34Å; D340-T342 WeakPolarHBondContact OD1-CA 3.4Å; D340-T342 WeakPolarHBondContact OD1-CB 3.49Å; D340-T342 PolarHBondContact OD1-N 3.05Å; D340-T342 PolarHBondContact OD1-OG1 2.86Å; D340-D343 HydrophobicContact CB-CB 4.23Å; D340-D343 VanDerWaalsContact O-O 3.09Å; D340-D343 PolarHBondContact OD1-N 2.97Å; D340-Y348 HydrophobicContact CB-CE2 3.78Å; D340-Y348 VanDerWaalsContact OD2-CE2 3.25Å; D340-Y348 WeakPolarHBondContact OD2-CE2 3.2Å; D340-Y348 PolarHBondContact OD2-OH 3.37Å; D340-K370 PolarHBondContact O-NZ 2.86Å
341	Y	71.1	Confident	84.1	Confident	211 Å²	211	64 Å²	64	83%	0.827	30%	0.301	S	S	*	.	S	Bend	trans	-84.8	-10.8	176.3	-61.1	-68.2	0	0	0	112.8
342	T	67.1	Low	83.7	Confident	135 Å²	135	63.8 Å²	63.8	83%	0.828	30%	0.304	S	S	*	.	S	Bend	trans	-93	-34.7	177	71.5	0	0	0	0	111.5	D340	D340-T342 VanDerWaalsContact C-N 3.34Å; D340-T342 WeakPolarHBondContact OD1-CA 3.4Å; D340-T342 WeakPolarHBondContact OD1-CB 3.49Å; D340-T342 PolarHBondContact OD1-N 3.05Å; D340-T342 PolarHBondContact OD1-OG1 2.86Å
343	D	72.4	Confident	82.6	Confident	33 Å²	33	66.7 Å²	66.7	18%	0.176	32%	0.321	C	S	.	.			trans	-103.9	101.6	172.6	-168.7	-42.6	0	0	0	111	D340 M345 R346 K370	D340-D343 HydrophobicContact CB-CB 4.23Å; D340-D343 VanDerWaalsContact O-O 3.09Å; D340-D343 PolarHBondContact OD1-N 2.97Å; D343-M345 PolarHBondContact O-N 2.84Å; D343-M345 PolarHBondContact OD1-N 3.34Å; D343-R346 HydrophobicContact CB-CB 3.98Å; D343-R346 HydrophobicContact CB-CG 4.42Å; D343-R346 PolarHBondContact O-N 3.46Å; D343-R346 PolarHBondContact OD1-N 2.9Å; D343-R346 WeakPolarHBondContact OD2-CD 3.3Å; D343-R346 WeakPolarHBondContact OD2-CG 3.46Å; D343-R346 IonicContact OD2-CZ 3.74Å; D343-R346 VanDerWaalsContact OD2-CZ 3.29Å; D343-R346 IonicContact OD2-NE 2.8Å; D343-R346 IonicContact OD2-NH1 3.51Å; D343-R346 PolarHBondContact OD2-NH1 3.23Å; D343-K370 PolarHBondContact O-NZ 2.7Å
344	G	77.1	Confident	81.1	Confident	51 Å²	51	69.5 Å²	69.5	53%	0.526	34%	0.34	S	S	.	.	S	Bend	trans	-61.6	-8.1	-178.5	0	0	0	0	0	115.6	K370	G344-K370 WeakPolarHBondContact O-CD 3.45Å
345	M	86.8	Confident	79.3	Confident	65 Å²	65	73.9 Å²	73.9	32%	0.32	36%	0.358	S	S	.	.	S	Bend	trans	-116.9	-24.2	-176.2	-54.2	-69.1	-89.2	0	0	112.6	D343 E363 A364 Y365 A367	D343-M345 PolarHBondContact O-N 2.84Å; D343-M345 PolarHBondContact OD1-N 3.34Å; M345-E363 HydrophobicContact CB-CG 4.08Å; M345-A364 WeakPolarHBondContact CE-O 3.38Å; M345-A364 PolarHBondContact O-N 2.87Å; M345-Y365 WeakPolarHBondContact CE-O 3.48Å; M345-A367 HydrophobicContact SD-CB 4.45Å
346	R	87.9	Confident	77.6	Confident	77 Å²	77	76.8 Å²	76.8	29%	0.291	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	153	179	-65.3	-174.3	-174.3	114.8	6.1	114.5	D343 L362 E363 K370	D343-R346 HydrophobicContact CB-CB 3.98Å; D343-R346 HydrophobicContact CB-CG 4.42Å; D343-R346 PolarHBondContact O-N 3.46Å; D343-R346 PolarHBondContact OD1-N 2.9Å; D343-R346 WeakPolarHBondContact OD2-CD 3.3Å; D343-R346 WeakPolarHBondContact OD2-CG 3.46Å; D343-R346 IonicContact OD2-CZ 3.74Å; D343-R346 VanDerWaalsContact OD2-CZ 3.29Å; D343-R346 IonicContact OD2-NE 2.8Å; D343-R346 IonicContact OD2-NH1 3.51Å; D343-R346 PolarHBondContact OD2-NH1 3.23Å; R346-L362 CarbonylContact C-O 3.53Å; R346-L362 VanDerWaalsContact CA-O 3.28Å; R346-L362 WeakPolarHBondContact CA-O 3.49Å; R346-E363 HydrophobicContact CG-CB 3.76Å; R346-E363 HydrophobicContact CG-CG 3.74Å; R346-E363 IonicContact CZ-OE2 2.68Å; R346-E363 IonicContact NE-OE2 3.7Å; R346-E363 PolarHBondContact NE-OE2 3.18Å; R346-E363 IonicContact NH2-OE1 3.19Å; R346-E363 IonicContact NH2-OE2 3.76Å; R346-E363 PolarHBondContact NH2-OE2 2.86Å; R346-K370 WeakPolarHBondContact O-CE 3.46Å; R346-K370 PolarHBondContact O-NZ 3.36Å
347	F	91.3	Very high	76.9	Confident	0 Å²	0	74.3 Å²	74.3	0%	0	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	168	165.2	60.8	-81.5	0	0	0	109	M291 L337 L349 L362 K370 V373 L377	M291-F347 HydrophobicContact CE-CE1 3.55Å; M291-F347 HydrophobicContact CE-CZ 3.73Å; M291-F347 HydrophobicContact SD-CZ 4.28Å; L337-F347 HydrophobicContact CD1-CB 4.44Å; L337-F347 HydrophobicContact CD1-CD2 3.52Å; L337-F347 HydrophobicContact CD1-CE2 4.16Å; L337-F347 HydrophobicContact CD1-CG 4.28Å; F347-L349 HydrophobicContact CD2-CG 4.43Å; F347-L349 HydrophobicContact CE2-CD1 4.44Å; F347-L349 HydrophobicContact CE2-CD2 4.43Å; F347-L349 HydrophobicContact CE2-CG 4.21Å; F347-L362 HydrophobicContact CD1-CB 4.49Å; F347-L362 HydrophobicContact CD2-CB 4.46Å; F347-L362 HydrophobicContact CE1-CB 3.93Å; F347-L362 HydrophobicContact CE2-CB 3.91Å; F347-L362 HydrophobicContact CE2-CD1 3.85Å; F347-L362 HydrophobicContact CZ-CB 3.62Å; F347-L362 HydrophobicContact CZ-CD1 3.88Å; F347-L362 HydrophobicContact CZ-CG 4.41Å; F347-L362 PolarHBondContact N-O 3.23Å; F347-L362 PolarHBondContact O-N 3.19Å; F347-K370 HydrophobicContact CD1-CG 4.11Å; F347-V373 HydrophobicContact CZ-CG1 3.86Å; F347-L377 HydrophobicContact CE2-CD1 4.22Å
348	Y	89.8	Confident	75.9	Confident	56 Å²	56	74 Å²	74	22%	0.22	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	146.8	179.9	-45.4	-88.4	0	0	0	111.5	Q338 D340 L359 L360 S361	Q338-Y348 PolarHBondContact N-O 3.17Å; Q338-Y348 PolarHBondContact O-N 3.29Å; D340-Y348 HydrophobicContact CB-CE2 3.78Å; D340-Y348 VanDerWaalsContact OD2-CE2 3.25Å; D340-Y348 WeakPolarHBondContact OD2-CE2 3.2Å; D340-Y348 PolarHBondContact OD2-OH 3.37Å; Y348-L359 HydrophobicContact CD1-CD2 4.38Å; Y348-L359 HydrophobicContact CD1-CG 4.45Å; Y348-L359 HydrophobicContact CG-CD1 4.35Å; Y348-L360 CarbonylContact C-O 3.51Å; Y348-L360 VanDerWaalsContact CA-O 3.26Å; Y348-L360 WeakPolarHBondContact CA-O 3.39Å; Y348-S361 WeakPolarHBondContact CE1-OG 3.4Å
349	L	89.1	Confident	75.7	Confident	0 Å²	0	74.3 Å²	74.3	0%	0	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	122.8	170.2	-64.6	175.4	0	0	0	108.9	L312 L335 R336 L337 F347 L360 L362 L377	L312-L349 HydrophobicContact CD2-CD1 3.44Å; L312-L349 VanDerWaalsContact CD2-CD1 3.44Å; L335-L349 HydrophobicContact CD2-CB 4.21Å; R336-L349 WeakPolarHBondContact O-CA 3.39Å; L337-L349 HydrophobicContact CB-CD2 4.3Å; L337-L349 HydrophobicContact CD1-CD2 3.67Å; F347-L349 HydrophobicContact CD2-CG 4.43Å; F347-L349 HydrophobicContact CE2-CD1 4.44Å; F347-L349 HydrophobicContact CE2-CD2 4.43Å; F347-L349 HydrophobicContact CE2-CG 4.21Å; L349-L360 HydrophobicContact CB-CB 4.31Å; L349-L360 PolarHBondContact N-O 3.38Å; L349-L360 PolarHBondContact O-N 2.97Å; L349-L362 HydrophobicContact CD1-CD1 3.8Å; L349-L377 HydrophobicContact CD1-CD1 4.3Å; L349-L377 HydrophobicContact CD2-CD1 4.15Å
350	I	85.8	Confident	75.9	Confident	38 Å²	38	71.8 Å²	71.8	20%	0.195	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	110.5	173.2	-55.7	169	0	0	0	107.3	L335 R336 M352 D357 C358 L359	L335-I350 CarbonylContact C-O 3.58Å; L335-I350 WeakPolarHBondContact CA-O 3.42Å; R336-I350 HydrophobicContact CB-CB 4.34Å; R336-I350 PolarHBondContact N-O 3.45Å; R336-I350 PolarHBondContact O-N 3.07Å; I350-M352 HydrophobicContact CG2-CG 4.23Å; I350-D357 HydrophobicContact CG2-CB 3.91Å; I350-C358 WeakPolarHBondContact CA-O 3.48Å; I350-L359 HydrophobicContact CG1-CD1 3.69Å
351	H	83.2	Confident	76.5	Confident	30 Å²	30	71.5 Å²	71.5	14%	0.139	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	107.5	171	-179.1	-120.4	0	0	0	109.5	L330 H334 L335 D357 C358	L330-H351 HydrophobicContact CD2-CB 4.28Å; H334-H351 CarbonylContact O-C 3.39Å; H334-H351 WeakPolarHBondContact O-CA 3.44Å; L335-H351 HydrophobicContact CD2-CB 3.78Å; H351-D357 WeakPolarHBondContact O-CA 3.18Å; H351-C358 HydrophobicContact CB-CB 4.34Å; H351-C358 PolarHBondContact N-O 3.17Å; H351-C358 PolarHBondContact O-N 3.23Å
352	M	78.4	Confident	77.5	Confident	60 Å²	60	61.5 Å²	61.5	30%	0.296	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	128.8	-178.4	-57.8	-173.6	73.4	0	0	111.1	H334 R336 I350 D357	H334-M352 PolarHBondContact O-N 2.85Å; R336-M352 HydrophobicContact CG-SD 4.08Å; R336-M352 PolarHBondContact NE-SD 2.95Å; I350-M352 HydrophobicContact CG2-CG 4.23Å; M352-D357 VanDerWaalsContact CA-OD1 3.29Å; M352-D357 WeakPolarHBondContact CA-OD1 3.12Å
353	T	66.8	Low	78.7	Confident	60 Å²	60	57 Å²	57	37%	0.368	30%	0.298	S	S	.	.			trans	-134.5	161.4	174	77.7	0	0	0	0	110.8	K355 C356	T353-K355 PolarHBondContact O-N 2.92Å; T353-K355 PolarHBondContact OG1-N 2.81Å; T353-C356 WeakPolarHBondContact CB-O 3.24Å; T353-C356 PolarHBondContact N-O 3.49Å; T353-C356 VanDerWaalsContact N-O 3.12Å; T353-C356 PolarHBondContact O-N 3.07Å; T353-C356 PolarHBondContact OG1-N 2.72Å; T353-C356 PolarHBondContact OG1-O 2.75Å
354	E	54.9	Low	79.6	Confident	180 Å²	180	55.5 Å²	55.5	84%	0.841	29%	0.291	S	S	*	.	S	Bend	trans	-53.5	-12.6	176.9	-56.8	175.8	158.3	0	0	115.4
355	K	48.4	Very low	80.3	Confident	168 Å²	168	58.6 Å²	58.6	73%	0.73	29%	0.287	S	S	*	.	S	Bend	trans	-129.2	-20.4	-168.4	-57.3	179.8	178.4	75.6	0	113.7	T353	T353-K355 PolarHBondContact O-N 2.92Å; T353-K355 PolarHBondContact OG1-N 2.81Å
356	C	54	Low	80.5	Confident	65 Å²	65	57.2 Å²	57.2	44%	0.439	28%	0.284	S	S	.	.			trans	-170.2	152.1	175.1	53.5	0	0	0	0	111.7	T353	T353-C356 WeakPolarHBondContact CB-O 3.24Å; T353-C356 PolarHBondContact N-O 3.49Å; T353-C356 VanDerWaalsContact N-O 3.12Å; T353-C356 PolarHBondContact O-N 3.07Å; T353-C356 PolarHBondContact OG1-N 2.72Å; T353-C356 PolarHBondContact OG1-O 2.75Å
357	D	72.6	Confident	80.4	Confident	102 Å²	102	56 Å²	56	55%	0.545	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	130	162.8	-71.2	-19.3	0	0	0	109.2	I350 H351 M352	I350-D357 HydrophobicContact CG2-CB 3.91Å; H351-D357 WeakPolarHBondContact O-CA 3.18Å; M352-D357 VanDerWaalsContact CA-OD1 3.29Å; M352-D357 WeakPolarHBondContact CA-OD1 3.12Å
358	C	70.1	Confident	80.3	Confident	43 Å²	43	60.1 Å²	60.1	29%	0.291	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	121.9	177.8	-178.7	0	0	0	0	110.6	I350 H351	I350-C358 WeakPolarHBondContact CA-O 3.48Å; H351-C358 HydrophobicContact CB-CB 4.34Å; H351-C358 PolarHBondContact N-O 3.17Å; H351-C358 PolarHBondContact O-N 3.23Å
359	L	82.5	Confident	80.4	Confident	106 Å²	106	58 Å²	58	56%	0.555	31%	0.305	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.9	126.9	178.1	-168.7	73.1	0	0	0	110.9	Y348 I350	Y348-L359 HydrophobicContact CD1-CD2 4.38Å; Y348-L359 HydrophobicContact CD1-CG 4.45Å; Y348-L359 HydrophobicContact CG-CD1 4.35Å; I350-L359 HydrophobicContact CG1-CD1 3.69Å
360	L	86.9	Confident	80.5	Confident	4 Å²	4	58.7 Å²	58.7	2%	0.021	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	124	173.5	-67.5	158.1	0	0	0	108.7	L10 L293 I314 L330 Y348 L349	L10-L360 HydrophobicContact CD2-CD2 3.6Å; L293-L360 HydrophobicContact CD1-CB 4.49Å; L293-L360 HydrophobicContact CD1-CD2 4.02Å; I314-L360 HydrophobicContact CD1-CD1 4.36Å; L330-L360 HydrophobicContact CD1-CD1 3.47Å; L330-L360 VanDerWaalsContact CD1-CD1 3.47Å; Y348-L360 CarbonylContact C-O 3.51Å; Y348-L360 VanDerWaalsContact CA-O 3.26Å; Y348-L360 WeakPolarHBondContact CA-O 3.39Å; L349-L360 HydrophobicContact CB-CB 4.31Å; L349-L360 PolarHBondContact N-O 3.38Å; L349-L360 PolarHBondContact O-N 2.97Å
361	S	90.4	Very high	80.6	Confident	18 Å²	18	65.2 Å²	65.2	13%	0.126	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	120.8	175.6	-176.7	0	0	0	0	110.3	H294 Y348	H294-S361 PolarHBondContact N-O 3Å; Y348-S361 WeakPolarHBondContact CE1-OG 3.4Å
362	L	91.3	Very high	81	Confident	0 Å²	0	69.4 Å²	69.4	0%	0	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	134.4	-179.8	-73.8	170.3	0	0	0	110.2	M291 I292 L293 V303 V305 R346 F347 L349	M291-L362 HydrophobicContact CB-CD2 4.48Å; I292-L362 CarbonylContact O-C 3.51Å; I292-L362 WeakPolarHBondContact O-CA 3.46Å; L293-L362 HydrophobicContact CB-CD2 4.16Å; L293-L362 HydrophobicContact CD1-CD2 3.9Å; L293-L362 HydrophobicContact CD1-CG 4.44Å; V303-L362 HydrophobicContact CG2-CD2 4.26Å; V305-L362 HydrophobicContact CG2-CD2 4.36Å; R346-L362 CarbonylContact C-O 3.53Å; R346-L362 VanDerWaalsContact CA-O 3.28Å; R346-L362 WeakPolarHBondContact CA-O 3.49Å; F347-L362 HydrophobicContact CD1-CB 4.49Å; F347-L362 HydrophobicContact CD2-CB 4.46Å; F347-L362 HydrophobicContact CE1-CB 3.93Å; F347-L362 HydrophobicContact CE2-CB 3.91Å; F347-L362 HydrophobicContact CE2-CD1 3.85Å; F347-L362 HydrophobicContact CZ-CB 3.62Å; F347-L362 HydrophobicContact CZ-CD1 3.88Å; F347-L362 HydrophobicContact CZ-CG 4.41Å; F347-L362 PolarHBondContact N-O 3.23Å; F347-L362 PolarHBondContact O-N 3.19Å; L349-L362 HydrophobicContact CD1-CD1 3.8Å
363	E	92.5	Very high	81.5	Confident	40 Å²	40	66.6 Å²	66.6	19%	0.187	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	131.3	175.4	-170.1	176.8	154	0	0	109.9	I292 H294 M345 R346	I292-E363 HydrophobicContact CB-CB 4.2Å; I292-E363 PolarHBondContact N-O 3.29Å; I292-E363 PolarHBondContact O-N 3.11Å; H294-E363 IonicContact CD2-OE2 3.4Å; H294-E363 IonicContact CE1-OE2 3.73Å; H294-E363 PolarHBondContact CE1-OE2 3.16Å; H294-E363 IonicContact NE2-OE2 3.91Å; H294-E363 PolarHBondContact NE2-OE2 3.05Å; M345-E363 HydrophobicContact CB-CG 4.08Å; R346-E363 HydrophobicContact CG-CB 3.76Å; R346-E363 HydrophobicContact CG-CG 3.74Å; R346-E363 IonicContact CZ-OE2 2.68Å; R346-E363 IonicContact NE-OE2 3.7Å; R346-E363 PolarHBondContact NE-OE2 3.18Å; R346-E363 IonicContact NH2-OE1 3.19Å; R346-E363 IonicContact NH2-OE2 3.76Å; R346-E363 PolarHBondContact NH2-OE2 2.86Å
364	A	91.8	Very high	82.7	Confident	2 Å²	2	64.2 Å²	64.2	2%	0.017	32%	0.317	C	S	.	.			trans	-92	153.2	175.9	0	0	0	0	0	111.2	M291 M345 S366 Q369 K370	M291-A364 HydrophobicContact CE-CB 3.85Å; M345-A364 WeakPolarHBondContact CE-O 3.38Å; M345-A364 PolarHBondContact O-N 2.87Å; A364-S366 VanDerWaalsContact C-N 3.29Å; A364-S366 PolarHBondContact O-N 2.83Å; A364-Q369 HydrophobicContact CB-CB 4.18Å; A364-Q369 HydrophobicContact CB-CG 4.38Å; A364-K370 HydrophobicContact CB-CB 3.82Å
365	Y	91.4	Very high	84.5	Confident	116 Å²	116	60.3 Å²	60.3	46%	0.455	30%	0.298	S	S	.	.	S	Bend	trans	-76.5	-13.7	174.2	-66.8	-71.8	0	0	0	113.6	E290 I292 K302 M345	E290-Y365 HydrophobicContact CB-CE2 4.14Å; E290-Y365 VanDerWaalsContact O-CD2 3.28Å; E290-Y365 WeakPolarHBondContact O-CD2 3.2Å; E290-Y365 WeakPolarHBondContact O-CE2 3.42Å; I292-Y365 HydrophobicContact CD1-CE1 3.87Å; I292-Y365 HydrophobicContact CG1-CE1 4.11Å; K302-Y365 WeakPolarHBondContact CE-OH 3.3Å; K302-Y365 WeakPolarHBondContact CG-OH 3.46Å; M345-Y365 WeakPolarHBondContact CE-O 3.48Å
366	S	90.8	Very high	86.5	Confident	36 Å²	36	53.1 Å²	53.1	25%	0.252	27%	0.269	S	S	.	.	S	Bend	trans	-150.4	153.2	170.7	74	0	0	0	0	112.2	A364 D368 Q369 K370	A364-S366 VanDerWaalsContact C-N 3.29Å; A364-S366 PolarHBondContact O-N 2.83Å; S366-D368 PolarHBondContact O-N 2.71Å; S366-Q369 WeakPolarHBondContact O-CA 3.37Å; S366-Q369 WeakPolarHBondContact O-CB 3.47Å; S366-Q369 PolarHBondContact O-N 2.92Å; S366-Q369 WeakPolarHBondContact OG-CB 3.23Å; S366-Q369 PolarHBondContact OG-N 2.93Å; S366-Q369 VanDerWaalsContact OG-N 3.1Å; S366-K370 PolarHBondContact O-N 3.35Å
367	A	87.5	Confident	88.3	Confident	53 Å²	53	50.1 Å²	50.1	44%	0.438	25%	0.249	S	C	.	.	H	α-helix	trans	-58.6	-30.1	174.6	0	0	0	0	0	112.4	M345 R371	M345-A367 HydrophobicContact SD-CB 4.45Å; A367-R371 WeakPolarHBondContact O-CB 3.46Å; A367-R371 PolarHBondContact O-N 2.88Å
368	D	88.6	Confident	89.2	Confident	85 Å²	85	50.5 Å²	50.5	46%	0.455	25%	0.245	S	C	.	.	H	α-helix	trans	-73.9	-32.4	173.6	-67.1	-40.2	0	0	0	112.7	S366 R371 R372	S366-D368 PolarHBondContact O-N 2.71Å; D368-R371 IonicContact OD1-NE 2.94Å; D368-R372 WeakPolarHBondContact O-CG 3.5Å; D368-R372 PolarHBondContact O-N 2.83Å; D368-R372 PolarHBondContact O-NH1 3.03Å
369	Q	90.6	Very high	90.1	Very high	11 Å²	11	51.6 Å²	51.6	5%	0.051	25%	0.249	C	C	.	.	H	α-helix	trans	-67.9	-45.1	170.8	-170.3	-167.6	44.9	0	0	110.6	E289 E290 A364 S366 R371 R372 V373	E289-Q369 HydrophobicContact CG-CG 4.45Å; E289-Q369 PolarHBondContact OE2-NE2 2.93Å; E290-Q369 PolarHBondContact O-NE2 3.23Å; E290-Q369 PolarHBondContact O-OE1 2.81Å; A364-Q369 HydrophobicContact CB-CB 4.18Å; A364-Q369 HydrophobicContact CB-CG 4.38Å; S366-Q369 WeakPolarHBondContact O-CA 3.37Å; S366-Q369 WeakPolarHBondContact O-CB 3.47Å; S366-Q369 PolarHBondContact O-N 2.92Å; S366-Q369 WeakPolarHBondContact OG-CB 3.23Å; S366-Q369 PolarHBondContact OG-N 2.93Å; S366-Q369 VanDerWaalsContact OG-N 3.1Å; Q369-R371 VanDerWaalsContact C-N 3.35Å; Q369-R371 PolarHBondContact O-N 2.89Å; Q369-R372 PolarHBondContact O-N 2.96Å; Q369-V373 HydrophobicContact CG-CG2 4.42Å; Q369-V373 WeakPolarHBondContact O-CG2 3.37Å; Q369-V373 PolarHBondContact O-N 3.37Å
370	K	91.2	Very high	90.4	Very high	16 Å²	16	47.2 Å²	47.2	7%	0.07	23%	0.226	C	C	.	.	H	α-helix	trans	-52	-53.6	170.3	-179.9	179.5	175.5	176.4	0	110.1	D339 D340 D343 G344 R346 F347 A364 S366 R372 V373 C374	D339-K370 WeakPolarHBondContact OD1-CE 3.39Å; D339-K370 IonicContact OD1-NZ 3.34Å; D339-K370 PolarHBondContact OD1-NZ 2.8Å; D340-K370 PolarHBondContact O-NZ 2.86Å; D343-K370 PolarHBondContact O-NZ 2.7Å; G344-K370 WeakPolarHBondContact O-CD 3.45Å; R346-K370 WeakPolarHBondContact O-CE 3.46Å; R346-K370 PolarHBondContact O-NZ 3.36Å; F347-K370 HydrophobicContact CD1-CG 4.11Å; A364-K370 HydrophobicContact CB-CB 3.82Å; S366-K370 PolarHBondContact O-N 3.35Å; K370-R372 PolarHBondContact O-N 3Å; K370-V373 PolarHBondContact O-N 3.38Å; K370-C374 VanDerWaalsContact O-CB 3.23Å; K370-C374 WeakPolarHBondContact O-CB 3.46Å; K370-C374 PolarHBondContact O-N 3.14Å; K370-C374 PolarHBondContact O-SG 2.81Å; K370-C374 VanDerWaalsContact O-SG 3.34Å
371	R	89.2	Confident	90.6	Very high	174 Å²	174	47.5 Å²	47.5	66%	0.657	23%	0.227	S	C	*	.	H	α-helix	trans	-55.5	-47.9	179.3	-165.5	-166.6	-55.7	-92.9	1.5	112.5	A367 D368 Q369 Q375	A367-R371 WeakPolarHBondContact O-CB 3.46Å; A367-R371 PolarHBondContact O-N 2.88Å; D368-R371 IonicContact OD1-NE 2.94Å; Q369-R371 VanDerWaalsContact C-N 3.35Å; Q369-R371 PolarHBondContact O-N 2.89Å; R371-Q375 WeakPolarHBondContact O-CB 3.44Å; R371-Q375 PolarHBondContact O-N 3.44Å
372	R	90.8	Very high	90.5	Very high	118 Å²	118	49.6 Å²	49.6	45%	0.445	24%	0.237	S	C	.	.	H	α-helix	trans	-62.5	-48.5	177.8	-74.4	-169.2	-50.5	-82.9	7.1	112.5	I287 E289 D368 Q369 K370 C376	I287-R372 HydrophobicContact CD1-CB 4.49Å; E289-R372 IonicContact OE1-CZ 2.99Å; E289-R372 IonicContact OE1-NE 3.52Å; E289-R372 PolarHBondContact OE1-NE 3.45Å; E289-R372 IonicContact OE1-NH2 3.93Å; E289-R372 PolarHBondContact OE1-NH2 2.64Å; E289-R372 IonicContact OE2-NH2 2.73Å; D368-R372 WeakPolarHBondContact O-CG 3.5Å; D368-R372 PolarHBondContact O-N 2.83Å; D368-R372 PolarHBondContact O-NH1 3.03Å; Q369-R372 PolarHBondContact O-N 2.96Å; K370-R372 PolarHBondContact O-N 3Å; R372-C376 WeakPolarHBondContact O-CB 3.44Å; R372-C376 PolarHBondContact O-N 3.26Å
373	V	90.2	Very high	90.4	Very high	2 Å²	2	54.6 Å²	54.6	1%	0.012	26%	0.259	C	S	.	.	H	α-helix	trans	-68.8	-47.2	-176.3	174.3	0	0	0	0	110.8	I287 E289 M291 F347 Q369 K370 Q375 C376 L377	I287-V373 HydrophobicContact CD1-CG2 4.43Å; E289-V373 HydrophobicContact CB-CG2 4.1Å; E289-V373 HydrophobicContact CG-CG2 3.91Å; M291-V373 HydrophobicContact CE-CB 4.32Å; M291-V373 HydrophobicContact CE-CG1 4.18Å; M291-V373 HydrophobicContact CE-CG2 4.18Å; M291-V373 HydrophobicContact SD-CG1 4.01Å; M291-V373 HydrophobicContact SD-CG2 4.22Å; F347-V373 HydrophobicContact CZ-CG1 3.86Å; Q369-V373 HydrophobicContact CG-CG2 4.42Å; Q369-V373 WeakPolarHBondContact O-CG2 3.37Å; Q369-V373 PolarHBondContact O-N 3.37Å; K370-V373 PolarHBondContact O-N 3.38Å; V373-Q375 PolarHBondContact O-N 3.44Å; V373-C376 PolarHBondContact O-N 2.68Å; V373-L377 HydrophobicContact CG1-CD1 3.72Å; V373-L377 HydrophobicContact CG1-CG 4.39Å; V373-L377 WeakPolarHBondContact O-CB 3.22Å; V373-L377 WeakPolarHBondContact O-CG 3.27Å; V373-L377 PolarHBondContact O-N 3.08Å
374	C	92.1	Very high	90.1	Very high	9 Å²	9	54.4 Å²	54.4	6%	0.061	26%	0.258	C	S	.	.	H	α-helix	trans	-59.5	-46.2	176.2	-72.2	0	0	0	0	112.2	L337 K370 L377 K378	L337-C374 HydrophobicContact CD2-CB 3.89Å; L337-C374 VanDerWaalsContact CD2-O 3.32Å; L337-C374 WeakPolarHBondContact CD2-O 3.4Å; K370-C374 VanDerWaalsContact O-CB 3.23Å; K370-C374 WeakPolarHBondContact O-CB 3.46Å; K370-C374 PolarHBondContact O-N 3.14Å; K370-C374 PolarHBondContact O-SG 2.81Å; K370-C374 VanDerWaalsContact O-SG 3.34Å; C374-L377 PolarHBondContact O-N 2.98Å; C374-K378 VanDerWaalsContact O-CB 3.31Å; C374-K378 WeakPolarHBondContact O-CB 2.81Å; C374-K378 PolarHBondContact O-N 2.86Å
375	Q	90.9	Very high	89.7	Confident	98 Å²	98	58.2 Å²	58.2	46%	0.458	28%	0.277	S	S	.	.	H	α-helix	trans	-63.9	-45.9	178.2	-174.6	61.2	40	0	0	111.4	R371 V373 L377 K378 D379	R371-Q375 WeakPolarHBondContact O-CB 3.44Å; R371-Q375 PolarHBondContact O-N 3.44Å; V373-Q375 PolarHBondContact O-N 3.44Å; Q375-L377 PolarHBondContact O-N 2.81Å; Q375-K378 PolarHBondContact O-N 3.39Å; Q375-D379 PolarHBondContact NE2-OD1 3.14Å; Q375-D379 PolarHBondContact NE2-OD2 2.97Å; Q375-D379 WeakPolarHBondContact O-CB 3.21Å; Q375-D379 PolarHBondContact O-N 2.6Å
376	C	91.4	Very high	89.4	Confident	18 Å²	18	58 Å²	58	12%	0.122	28%	0.281	C	S	.	.	H	α-helix	trans	-60.6	-43.5	177.1	-178.9	0	0	0	0	112.5	I286 I287 R372 V373 N380	I286-C376 VanDerWaalsContact CG2-SG 3.51Å; I287-C376 HydrophobicContact CG2-CB 4.27Å; I287-C376 VanDerWaalsContact CG2-SG 3.57Å; R372-C376 WeakPolarHBondContact O-CB 3.44Å; R372-C376 PolarHBondContact O-N 3.26Å; V373-C376 PolarHBondContact O-N 2.68Å; C376-N380 PolarHBondContact O-N 2.92Å; C376-N380 PolarHBondContact O-ND2 2.91Å
377	L	92	Very high	88.9	Confident	1 Å²	1	61.1 Å²	61.1	1%	0.005	29%	0.294	C	S	.	.	H	α-helix	trans	-64	-48.8	175.9	-74.2	168.1	0	0	0	110.7	V307 L312 L332 F347 L349 V373 C374 Q375 D379 N380 I381	V307-L377 HydrophobicContact CG1-CD2 3.77Å; V307-L377 HydrophobicContact CG2-CD2 4Å; V307-L377 HydrophobicContact CG2-CG 4.4Å; L312-L377 HydrophobicContact CD1-CD2 4.01Å; L312-L377 HydrophobicContact CD2-CD2 4.27Å; L332-L377 HydrophobicContact CD2-CD2 3.86Å; F347-L377 HydrophobicContact CE2-CD1 4.22Å; L349-L377 HydrophobicContact CD1-CD1 4.3Å; L349-L377 HydrophobicContact CD2-CD1 4.15Å; V373-L377 HydrophobicContact CG1-CD1 3.72Å; V373-L377 HydrophobicContact CG1-CG 4.39Å; V373-L377 WeakPolarHBondContact O-CB 3.22Å; V373-L377 WeakPolarHBondContact O-CG 3.27Å; V373-L377 PolarHBondContact O-N 3.08Å; C374-L377 PolarHBondContact O-N 2.98Å; Q375-L377 PolarHBondContact O-N 2.81Å; L377-D379 PolarHBondContact O-N 2.86Å; L377-N380 PolarHBondContact O-N 2.82Å; L377-I381 HydrophobicContact CB-CD1 4.33Å; L377-I381 WeakPolarHBondContact O-CB 3.33Å; L377-I381 WeakPolarHBondContact O-CD1 3.36Å; L377-I381 WeakPolarHBondContact O-CG1 3.32Å; L377-I381 PolarHBondContact O-N 2.87Å
378	K	90.6	Very high	88	Confident	110 Å²	110	64.7 Å²	64.7	48%	0.478	30%	0.301	S	S	.	.	H	α-helix	trans	-56.4	-53.5	178.1	-176	178	178.9	-177.7	0	112.1	L337 C374 Q375 N380 I381 D382	L337-K378 HydrophobicContact CD2-CB 4.24Å; C374-K378 VanDerWaalsContact O-CB 3.31Å; C374-K378 WeakPolarHBondContact O-CB 2.81Å; C374-K378 PolarHBondContact O-N 2.86Å; Q375-K378 PolarHBondContact O-N 3.39Å; K378-N380 PolarHBondContact O-N 2.85Å; K378-N380 VanDerWaalsContact O-N 3.16Å; K378-I381 PolarHBondContact O-N 2.99Å; K378-D382 WeakPolarHBondContact CG-OD2 3.34Å; K378-D382 WeakPolarHBondContact O-CB 3.42Å; K378-D382 PolarHBondContact O-N 2.94Å
379	D	89.8	Confident	87.1	Confident	67 Å²	67	71.2 Å²	71.2	36%	0.358	32%	0.32	S	S	.	.	H	α-helix	trans	-60.7	-28.9	-177.1	-73	-30.9	0	0	0	113	Q375 L377 K383	Q375-D379 PolarHBondContact NE2-OD1 3.14Å; Q375-D379 PolarHBondContact NE2-OD2 2.97Å; Q375-D379 WeakPolarHBondContact O-CB 3.21Å; Q375-D379 PolarHBondContact O-N 2.6Å; L377-D379 PolarHBondContact O-N 2.86Å; D379-K383 WeakPolarHBondContact O-CD 3.46Å; D379-K383 WeakPolarHBondContact O-CE 3.42Å; D379-K383 WeakPolarHBondContact O-CG 3.41Å; D379-K383 PolarHBondContact O-N 3.2Å
380	N	89.6	Confident	85.5	Confident	14 Å²	14	80.2 Å²	80.2	8%	0.075	35%	0.353	C	S	.	.	H	α-helix	trans	-92.9	-31.9	179.3	-64.5	-59.5	0	0	0	112.8	I286 L332 C376 L377 K378 K383 Q384	I286-N380 WeakPolarHBondContact CD1-ND2 3.42Å; L332-N380 HydrophobicContact CD1-CB 3.66Å; C376-N380 PolarHBondContact O-N 2.92Å; C376-N380 PolarHBondContact O-ND2 2.91Å; L377-N380 PolarHBondContact O-N 2.82Å; K378-N380 PolarHBondContact O-N 2.85Å; K378-N380 VanDerWaalsContact O-N 3.16Å; N380-K383 PolarHBondContact O-N 3.2Å; N380-K383 PolarHBondContact OD1-NZ 2.8Å; N380-Q384 VanDerWaalsContact O-CG 3.29Å; N380-Q384 WeakPolarHBondContact O-CG 3.46Å; N380-Q384 PolarHBondContact O-N 2.91Å
381	I	90.9	Very high	82.8	Confident	9 Å²	9	85.9 Å²	85.9	5%	0.046	38%	0.38	C	S	.	.	H	α-helix	trans	-59.5	-50.3	166.8	-68.8	164.1	0	0	0	109.7	L332 L335 L377 K378 K383 Q384 L385	L332-I381 HydrophobicContact CB-CG1 3.99Å; L332-I381 HydrophobicContact CD2-CG1 4.12Å; L335-I381 HydrophobicContact CB-CD1 4.09Å; L335-I381 HydrophobicContact CB-CG1 4.46Å; L335-I381 WeakPolarHBondContact O-CG2 3.5Å; L377-I381 HydrophobicContact CB-CD1 4.33Å; L377-I381 WeakPolarHBondContact O-CB 3.33Å; L377-I381 WeakPolarHBondContact O-CD1 3.36Å; L377-I381 WeakPolarHBondContact O-CG1 3.32Å; L377-I381 PolarHBondContact O-N 2.87Å; K378-I381 PolarHBondContact O-N 2.99Å; I381-K383 VanDerWaalsContact C-N 3.31Å; I381-K383 PolarHBondContact O-N 3.33Å; I381-Q384 PolarHBondContact O-N 3.01Å; I381-Q384 VanDerWaalsContact O-N 3.11Å; I381-L385 HydrophobicContact CG2-CD1 3.88Å; I381-L385 HydrophobicContact CG2-CG 4.39Å; I381-L385 WeakPolarHBondContact O-CG 2.93Å; I381-L385 PolarHBondContact O-N 3.21Å
382	D	88.4	Confident	80.3	Confident	63 Å²	63	82.8 Å²	82.8	34%	0.337	38%	0.382	S	S	.	.	H	α-helix	trans	-61.5	-37.5	180	-75.4	-24.8	0	0	0	111.9	K378 Q386	K378-D382 WeakPolarHBondContact CG-OD2 3.34Å; K378-D382 WeakPolarHBondContact O-CB 3.42Å; K378-D382 PolarHBondContact O-N 2.94Å; D382-Q386 WeakPolarHBondContact O-CB 3.32Å; D382-Q386 WeakPolarHBondContact O-CG 3.43Å; D382-Q386 PolarHBondContact O-N 3.48Å; D382-Q386 PolarHBondContact O-NE2 2.89Å
383	K	88.4	Confident	77.6	Confident	104 Å²	104	82.3 Å²	82.3	45%	0.452	40%	0.397	S	S	.	.	H	α-helix	trans	-63.9	-45.3	172	-75.1	165.3	-153.2	158.9	0	112.5	D379 N380 I381 L385 Q386 L387	D379-K383 WeakPolarHBondContact O-CD 3.46Å; D379-K383 WeakPolarHBondContact O-CE 3.42Å; D379-K383 WeakPolarHBondContact O-CG 3.41Å; D379-K383 PolarHBondContact O-N 3.2Å; N380-K383 PolarHBondContact O-N 3.2Å; N380-K383 PolarHBondContact OD1-NZ 2.8Å; I381-K383 VanDerWaalsContact C-N 3.31Å; I381-K383 PolarHBondContact O-N 3.33Å; K383-L385 VanDerWaalsContact C-N 3.33Å; K383-L385 PolarHBondContact O-N 2.9Å; K383-Q386 PolarHBondContact O-N 3.3Å; K383-L387 WeakPolarHBondContact O-CB 3.27Å; K383-L387 VanDerWaalsContact O-CG 3.32Å; K383-L387 WeakPolarHBondContact O-CG 3.22Å; K383-L387 PolarHBondContact O-N 2.79Å
384	Q	85.3	Confident	75	Confident	37 Å²	37	88.5 Å²	88.5	17%	0.173	44%	0.435	C	S	.	.	H	α-helix	trans	-64.8	-38.7	179.6	-68.9	-63.6	-21.1	0	0	111.6	N309 L332 R333 N380 I381 L387 H388	N309-Q384 PolarHBondContact O-NE2 3.08Å; L332-Q384 HydrophobicContact CB-CG 4.24Å; R333-Q384 HydrophobicContact CB-CB 4.24Å; N380-Q384 VanDerWaalsContact O-CG 3.29Å; N380-Q384 WeakPolarHBondContact O-CG 3.46Å; N380-Q384 PolarHBondContact O-N 2.91Å; I381-Q384 PolarHBondContact O-N 3.01Å; I381-Q384 VanDerWaalsContact O-N 3.11Å; Q384-L387 PolarHBondContact O-N 2.78Å; Q384-H388 PolarHBondContact O-N 3.34Å
385	L	85.1	Confident	72.3	Confident	81 Å²	81	93.3 Å²	93.3	42%	0.424	47%	0.465	S	S	.	.	H	α-helix	trans	-67.2	-36.6	173.4	-65.7	174.2	0	0	0	112.5	I381 K383 R389	I381-L385 HydrophobicContact CG2-CD1 3.88Å; I381-L385 HydrophobicContact CG2-CG 4.39Å; I381-L385 WeakPolarHBondContact O-CG 2.93Å; I381-L385 PolarHBondContact O-N 3.21Å; K383-L385 VanDerWaalsContact C-N 3.33Å; K383-L385 PolarHBondContact O-N 2.9Å; L385-R389 WeakPolarHBondContact O-CB 3.45Å; L385-R389 PolarHBondContact O-N 2.87Å
386	Q	84.6	Confident	69.6	Low	113 Å²	113	96.7 Å²	96.7	53%	0.528	48%	0.481	S	S	.	.	H	α-helix	trans	-70	-37.1	174	-76.4	172	50.9	0	0	113.1	D382 K383 R389 R390	D382-Q386 WeakPolarHBondContact O-CB 3.32Å; D382-Q386 WeakPolarHBondContact O-CG 3.43Å; D382-Q386 PolarHBondContact O-N 3.48Å; D382-Q386 PolarHBondContact O-NE2 2.89Å; K383-Q386 PolarHBondContact O-N 3.3Å; Q386-R389 PolarHBondContact O-N 3.25Å; Q386-R390 WeakPolarHBondContact O-CB 3.18Å; Q386-R390 PolarHBondContact O-N 3.1Å; Q386-R390 VanDerWaalsContact O-N 3.08Å
387	L	80.4	Confident	67.1	Low	100 Å²	100	105.5 Å²	105.5	52%	0.524	52%	0.518	S	S	.	.	H	α-helix	trans	-64.3	-46.2	174.9	-75.2	169.4	0	0	0	110.8	K383 Q384 R389 R390 E391	K383-L387 WeakPolarHBondContact O-CB 3.27Å; K383-L387 VanDerWaalsContact O-CG 3.32Å; K383-L387 WeakPolarHBondContact O-CG 3.22Å; K383-L387 PolarHBondContact O-N 2.79Å; Q384-L387 PolarHBondContact O-N 2.78Å; L387-R389 VanDerWaalsContact C-N 3.35Å; L387-R389 PolarHBondContact O-N 3.24Å; L387-R390 CarbonylContact O-C 3.6Å; L387-R390 WeakPolarHBondContact O-CA 3.41Å; L387-R390 WeakPolarHBondContact O-CB 3.37Å; L387-R390 PolarHBondContact O-N 3.35Å; L387-E391 PolarHBondContact O-N 2.99Å
388	H	68.1	Low	64.7	Low	129 Å²	129	113.9 Å²	113.9	60%	0.597	56%	0.557	S	S	*	*	H	α-helix	trans	-66.4	-35.1	176.9	-170.6	40.7	0	0	0	112.5	Q384 R390 E391	Q384-H388 PolarHBondContact O-N 3.34Å; H388-R390 PolarHBondContact O-N 2.73Å; H388-E391 IonicContact CE1-OE2 2.81Å; H388-E391 IonicContact ND1-OE2 3.27Å; H388-E391 PolarHBondContact ND1-OE2 3.08Å; H388-E391 PolarHBondContact O-N 2.9Å
389	R	68.6	Low	62.1	Low	222 Å²	222	117.2 Å²	117.2	84%	0.838	57%	0.574	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72	-6.1	170.2	-154.2	-164.6	-66.8	-163.2	-1.7	113.7	L385 Q386 L387	L385-R389 WeakPolarHBondContact O-CB 3.45Å; L385-R389 PolarHBondContact O-N 2.87Å; Q386-R389 PolarHBondContact O-N 3.25Å; L387-R389 VanDerWaalsContact C-N 3.35Å; L387-R389 PolarHBondContact O-N 3.24Å
390	R	56.9	Low	59.5	Low	200 Å²	200	121.8 Å²	121.8	76%	0.755	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.4	-7.6	175.4	-89.4	-178.2	165.3	166.3	-3.3	113.8	Q386 L387 H388 P392	Q386-R390 WeakPolarHBondContact O-CB 3.18Å; Q386-R390 PolarHBondContact O-N 3.1Å; Q386-R390 VanDerWaalsContact O-N 3.08Å; L387-R390 CarbonylContact O-C 3.6Å; L387-R390 WeakPolarHBondContact O-CA 3.41Å; L387-R390 WeakPolarHBondContact O-CB 3.37Å; L387-R390 PolarHBondContact O-N 3.35Å; H388-R390 PolarHBondContact O-N 2.73Å; R390-P392 WeakPolarHBondContact O-CD 3.48Å
391	E	36.3	Very low	57.1	Low	134 Å²	134	129.1 Å²	129.1	63%	0.626	64%	0.635	S	S	*	*	S	Bend	trans	-66.1	122.3	155.3	-71.1	-170	120.5	0	0	107.6	L387 H388 S393	L387-E391 PolarHBondContact O-N 2.99Å; H388-E391 IonicContact CE1-OE2 2.81Å; H388-E391 IonicContact ND1-OE2 3.27Å; H388-E391 PolarHBondContact ND1-OE2 3.08Å; H388-E391 PolarHBondContact O-N 2.9Å; E391-S393 PolarHBondContact O-N 3.47Å; E391-S393 VanDerWaalsContact O-N 3.16Å
392	P	36.3	Very low	54.4	Low	110 Å²	110	138.4 Å²	138.4	71%	0.714	68%	0.675	S	S	*	*			trans	-68.6	117.5	175.3	27.9	-32	0	0	0	108.4	R390 V394	R390-P392 WeakPolarHBondContact O-CD 3.48Å; P392-V394 PolarHBondContact O-N 3.12Å
393	S	34.6	Very low	51.7	Low	108 Å²	108	141.6 Å²	141.6	76%	0.755	70%	0.697	S	S	*	*			trans	-53.3	113.5	154.1	54.1	0	0	0	0	107.1	E391 P395	E391-S393 PolarHBondContact O-N 3.47Å; E391-S393 VanDerWaalsContact O-N 3.16Å; S393-P395 VanDerWaalsContact O-CD 3.29Å; S393-P395 WeakPolarHBondContact O-CD 3.26Å
394	V	35.2	Very low	49.3	Very low	132 Å²	132	143.2 Å²	143.2	80%	0.8	72%	0.715	S	S	*	*	P	Polyproline II helix	trans	-50.2	118.6	-179.6	177.7	0	0	0	0	108	P392 H396	P392-V394 PolarHBondContact O-N 3.12Å; V394-H396 PolarHBondContact O-N 3.03Å
395	P	35.8	Very low	46.5	Very low	109 Å²	109	153.2 Å²	153.2	71%	0.708	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-59.9	118.1	178.6	-24.2	34.6	0	0	0	108.9	S393 F397	S393-P395 VanDerWaalsContact O-CD 3.29Å; S393-P395 WeakPolarHBondContact O-CD 3.26Å; P395-F397 PolarHBondContact O-N 2.95Å
396	H	33.3	Very low	43.9	Very low	170 Å²	170	158.5 Å²	158.5	79%	0.787	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-59.2	135.2	167.8	-168.4	66.6	0	0	0	108	V394 E398	V394-H396 PolarHBondContact O-N 3.03Å; H396-E398 VanDerWaalsContact C-N 3.27Å; H396-E398 PolarHBondContact O-N 3.45Å
397	F	39.4	Very low	41.4	Very low	203 Å²	203	161.4 Å²	161.4	89%	0.89	79%	0.792	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.2	70.9	-165.4	-178.5	-98	0	0	0	112	P395	P395-F397 PolarHBondContact O-N 2.95Å
398	E	40.9	Very low	39.2	Very low	177 Å²	177	162 Å²	162	83%	0.827	80%	0.802	S	S	*	*	T	Hydrogen-bonded Turn	trans	-156.3	9.8	175.5	-134.8	178.2	-140.8	0	0	116.7	H396	H396-E398 VanDerWaalsContact C-N 3.27Å; H396-E398 PolarHBondContact O-N 3.45Å
399	Q	35.3	Very low	37.7	Very low	180 Å²	180	161.7 Å²	161.7	84%	0.841	81%	0.811	S	S	*	*			trans	-128.1	30.8	-174.2	-141.8	167.3	29	0	0	116.9
400	I	37	Very low	35.8	Very low	163 Å²	163	157.5 Å²	157.5	84%	0.836	81%	0.811	S	S	*	*	S	Bend	trans	-123.6	59.5	165.9	-46.3	-178.4	0	0	0	110.3
401	L	37.7	Very low	34.4	Very low	168 Å²	168	154 Å²	154	88%	0.88	81%	0.812	S	S	*	*	S	Bend	trans	-156.1	23.6	169.8	-118.9	172.1	0	0	0	114.5
402	K	34.6	Very low	34	Very low	204 Å²	204	152 Å²	152	89%	0.887	81%	0.813	S	S	*	*	S	Bend	trans	-129.1	12.2	-177.8	-82.8	-172.9	174.2	175.5	0	116
403	T	32.8	Very low	33.6	Very low	129 Å²	129	155.7 Å²	155.7	79%	0.791	82%	0.818	S	S	*	*	S	Bend	trans	-134	19.8	-176.3	33	0	0	0	0	114.6
404	V	37.4	Very low	33.3	Very low	139 Å²	139	157.5 Å²	157.5	84%	0.842	81%	0.814	S	S	*	*	S	Bend	trans	-133.6	65.3	169.4	-167.5	0	0	0	0	110.9
405	R	27.3	Very low	33	Very low	246 Å²	246	156.7 Å²	156.7	93%	0.928	81%	0.805	S	S	*	*			trans	-172.1	89.8	156.4	-112.3	174.3	-175.9	167.2	2.8	110.9
406	E	29.1	Very low	32.7	Very low	193 Å²	193	161.5 Å²	161.5	90%	0.902	81%	0.81	S	S	*	*			trans	-177.2	102.2	140.4	-107.8	174	-144.4	0	0	110.4
407	L	32.5	Very low	32.4	Very low	173 Å²	173	157.5 Å²	157.5	91%	0.906	80%	0.799	S	S	*	*			trans	-179	148	143.3	-95.3	160.1	0	0	0	108.4
408	P	34.8	Very low	31.8	Very low	113 Å²	113	155.6 Å²	155.6	73%	0.734	79%	0.793	S	S	*	*			trans	-91.9	171.5	-166.1	37.1	-36.5	0	0	0	114.5
409	P	36.7	Very low	31.1	Very low	122 Å²	122	153.9 Å²	153.9	79%	0.792	79%	0.79	S	S	*	*			trans	-99.1	157.6	-161.7	37.6	-36	0	0	0	115.9
410	T	28.8	Very low	30.6	Very low	135 Å²	135	152.2 Å²	152.2	83%	0.828	79%	0.792	S	S	*	*			trans	-136.3	106.9	162.8	52.8	0	0	0	0	112.2
411	T	27.2	Very low	30.1	Very low	127 Å²	127	150.7 Å²	150.7	78%	0.779	79%	0.794	S	S	*	*			trans	15.5	140.6	148.1	54.7	0	0	0	0	123.2
412	S	27.5	Very low	29.5	Very low	91 Å²	91	146 Å²	146	64%	0.636	79%	0.787	S	S	*	*				83.4	124.5	129.6	60.8	0	0	0	0	123.3
413	F	27.8	Very low	29.2	Very low	187 Å²	187	141 Å²	141	82%	0.82	78%	0.777	S	S	*	*			trans	49.5	139.4	135.9	-67	-111.6	0	0	0	118.5
414	E	28.2	Very low	29.2	Very low	147 Å²	147	143.7 Å²	143.7	69%	0.687	78%	0.781	S	S	*	*			cis	-164.9	165	11.5	-137.6	179.9	-153.9	0	0	114
415	N	29.6	Very low	29.5	Very low	114 Å²	114	142.8 Å²	142.8	61%	0.61	78%	0.778	S	S	*	*			trans	51.6	111	145.9	-78.1	-37.6	0	0	0	124.6
416	R	28.9	Very low	29.5	Very low	211 Å²	211	136 Å²	136	80%	0.796	77%	0.768	S	S	*	*				72.3	132.9	119.2	-83	-172.1	172	-110.5	2.9	124.3
417	C	27.3	Very low	29.4	Very low	85 Å²	85	133 Å²	133	57%	0.574	76%	0.763	S	S	*	*			trans	64.7	156.3	134.3	-60.2	0	0	0	0	119.5
418	E	26	Very low	29.1	Very low	163 Å²	163	133.3 Å²	133.3	76%	0.762	76%	0.76	S	S	*	*			cis	-174.6	161.8	-35.4	-111.3	161.9	153.3	0	0	106
419	D	25.9	Very low	28.8	Very low	142 Å²	142	134.4 Å²	134.4	76%	0.759	76%	0.764	S	S	*	*			trans	20.2	133.1	164	-57.1	-15.1	0	0	0	121
420	T	26.3	Very low	29	Very low	145 Å²	145	134 Å²	134	89%	0.89	76%	0.761	S	S	*	*				-173.1	170.8	77.7	27.5	0	0	0	0	113.5
421	C	26.4	Very low	28.8	Very low	130 Å²	130	137.3 Å²	137.3	88%	0.878	76%	0.76	S	S	*	*			trans	-102.6	151.8	177.5	176.3	0	0	0	0	112.3
422	G	24.9	Very low	28.8	Very low	70 Å²	70	140 Å²	140	72%	0.722	76%	0.761	S	S	*	*			trans	174.1	74.1	173.7	0	0	0	0	0	120.8
423	S	28.8	Very low	28.8	Very low	98 Å²	98	139.9 Å²	139.9	69%	0.685	76%	0.761	S	S	*	*			trans	27.8	112.9	137	-53.8	0	0	0	0	124.2
424	H	31.9	Very low	29.3	Very low	186 Å²	186	137.1 Å²	137.1	86%	0.861	76%	0.761	S	S	*	*			trans	62.5	168.1	133.8	-66.1	-66.4	0	0	0	120.9
425	P	44.4	Very low	29.2	Very low	120 Å²	120	135.2 Å²	135.2	78%	0.779	76%	0.764	S	S	*	*			cis	-126.8	-166.2	2.5	43.5	-27.1	0	0	0	115.9
426	S	26.2	Very low	29.4	Very low	104 Å²	104	140.9 Å²	140.9	73%	0.727	78%	0.777	S	S	*	*			trans	-55.6	167.1	176.1	-47.5	0	0	0	0	115
427	T	27.3	Very low	29.4	Very low	129 Å²	129	136.7 Å²	136.7	79%	0.791	78%	0.775	S	S	*	*				-168.8	171.1	50.4	-46	0	0	0	0	113.2
428	E	25.8	Very low	29.6	Very low	181 Å²	181	141.5 Å²	141.5	85%	0.846	79%	0.786	S	S	*	*			trans	113.8	153.6	156	-59	-160.8	170.8	0	0	119.1
429	V	29.2	Very low	29.9	Very low	135 Å²	135	138.4 Å²	138.4	82%	0.818	79%	0.788	S	S	*	*			trans	-142.1	155.3	-167.1	-121.8	0	0	0	0	107
430	P	41.2	Very low	30.3	Very low	113 Å²	113	136.6 Å²	136.6	73%	0.734	79%	0.794	S	S	*	*				-158	164.7	67.5	42.2	-20.7	0	0	0	119.7
431	Y	25	Very low	30.3	Very low	206 Å²	206	133.4 Å²	133.4	81%	0.808	79%	0.79	S	S	*	*			trans	30.4	140.4	142	-81.6	-69.5	0	0	0	126.4
432	F	26.7	Very low	30.5	Very low	183 Å²	183	136.7 Å²	136.7	80%	0.803	79%	0.792	S	S	*	*			trans	87.1	145.1	139.2	-97.9	-71.3	0	0	0	123.4
433	S	27.7	Very low	30.6	Very low	89 Å²	89	142.1 Å²	142.1	62%	0.622	80%	0.796	S	S	*	*			trans	-77.3	-179.4	-174.2	-33.7	0	0	0	0	114.9
434	P	37	Very low	30.5	Very low	128 Å²	128	144.4 Å²	144.4	83%	0.831	80%	0.796	S	S	*	*				-136.8	-169.5	115.7	38.4	-28.6	0	0	0	114.7
435	S	27.1	Very low	30.2	Very low	107 Å²	107	139.8 Å²	139.8	75%	0.748	78%	0.784	S	S	*	*			trans	-153.7	177.9	-174.9	-51.7	0	0	0	0	112.4
436	R	33.3	Very low	29.2	Very low	233 Å²	233	140.4 Å²	140.4	88%	0.879	79%	0.786	S	S	*	*			trans	84.4	148.6	173.9	-60.4	-174	155.3	-164.3	-5.6	116.6
437	T	28.8	Very low	29.2	Very low	124 Å²	124	139.9 Å²	139.9	76%	0.761	79%	0.788	S	S	*	*			cis	-148.4	-135.6	-12.1	20.4	0	0	0	0	109.3
438	K	32	Very low	29.1	Very low	185 Å²	185	142 Å²	142	80%	0.804	79%	0.789	S	S	*	*			cis	-169.3	116.1	5.3	-175.1	-167.9	173.9	-172.4	0	114.1
439	A	32.1	Very low	29.1	Very low	98 Å²	98	142.4 Å²	142.4	81%	0.81	79%	0.79	S	S	*	*			trans	61.1	176.2	154.6	0	0	0	0	0	119
440	A	34.3	Very low	29	Very low	105 Å²	105	144.8 Å²	144.8	87%	0.868	79%	0.793	S	S	*	*			cis	-173.3	161.5	-46.5	0	0	0	0	0	110.1
441	G	26.9	Very low	28.6	Very low	78 Å²	78	145 Å²	145	80%	0.804	79%	0.794	S	S	*	*			trans	156.3	152.4	167.7	0	0	0	0	0	116.1
442	Q	31	Very low	28.4	Very low	199 Å²	199	144.5 Å²	144.5	93%	0.93	80%	0.797	S	S	*	*			trans	-137.9	152	-174	-68.1	178.7	-75.7	0	0	115.4
443	K	25.9	Very low	28.3	Very low	183 Å²	183	139.4 Å²	139.4	80%	0.796	78%	0.784	S	S	*	*			trans	-168.2	158.8	146.7	-109.3	-163.1	179	-152.8	0	108.9
444	Q	26.1	Very low	28.2	Very low	147 Å²	147	142.7 Å²	142.7	69%	0.687	79%	0.787	S	S	*	*			cis	-139.3	-129.6	-12.8	-160	179.4	-87.1	0	0	109.1
445	S	26.2	Very low	27.7	Very low	88 Å²	88	142.8 Å²	142.8	62%	0.615	78%	0.776	S	S	*	*			trans	-163.6	174.1	-174.9	63.9	0	0	0	0	114.2
446	T	22.9	Very low	27.6	Very low	134 Å²	134	143.2 Å²	143.2	82%	0.822	77%	0.774	S	S	*	*			trans	68.7	156.4	163.4	34.7	0	0	0	0	116.9
447	A	26.6	Very low	27.1	Very low	92 Å²	92	136.6 Å²	136.6	76%	0.76	76%	0.764	S	S	*	*			cis	-129.7	-121.9	11.2	0	0	0	0	0	114.4
448	E	25.2	Very low	27	Very low	174 Å²	174	138.1 Å²	138.1	81%	0.813	76%	0.762	S	S	*	*			trans	-131.3	158.3	-166.9	-61.1	162.2	77.3	0	0	112.5
449	Q	26.2	Very low	26.8	Very low	189 Å²	189	137.4 Å²	137.4	88%	0.883	76%	0.762	S	S	*	*				165.8	146.5	120.1	-88.8	169.3	22.1	0	0	113.6
450	Q	27.2	Very low	26.6	Very low	186 Å²	186	140.5 Å²	140.5	87%	0.869	76%	0.759	S	S	*	*			trans	-118.8	152.9	157.9	-77.7	-170.3	-20.2	0	0	108
451	P	33.4	Very low	26.3	Very low	118 Å²	118	140.8 Å²	140.8	77%	0.766	75%	0.746	S	S	*	*				-151.1	-178.7	101.4	40.8	-23.6	0	0	0	115.9
452	F	21.1	Very low	26.4	Very low	195 Å²	195	145 Å²	145	86%	0.855	74%	0.742	S	S	*	*			trans	6.6	154.7	147.5	-91.4	-140.2	0	0	0	121.3
453	S	24.5	Very low	26.3	Very low	76 Å²	76	141.3 Å²	141.3	53%	0.531	73%	0.733	S	S	.	*			cis	175.5	163.8	-2.2	50.9	0	0	0	0	112.8
454	K	25.1	Very low	26.7	Very low	157 Å²	157	138.2 Å²	138.2	68%	0.683	73%	0.73	S	S	*	*			trans	64.2	161.8	152.3	-74.8	176	165.1	-77.2	0	116.9
455	E	26.2	Very low	26.8	Very low	130 Å²	130	138.9 Å²	138.9	61%	0.607	74%	0.738	S	S	*	*			cis	-162.4	167.6	-23.8	-113.4	161.7	-174.9	0	0	109.1
456	T	24.1	Very low	27	Very low	117 Å²	117	139.6 Å²	139.6	72%	0.718	74%	0.743	S	S	*	*			trans	46.4	113.3	153.4	51.8	0	0	0	0	120.5
457	S	23.5	Very low	27.4	Very low	93 Å²	93	141.7 Å²	141.7	65%	0.65	74%	0.741	S	S	*	*				72.8	158.2	103.2	76.7	0	0	0	0	115.1
458	E	27.5	Very low	27.5	Very low	156 Å²	156	142 Å²	142	73%	0.729	73%	0.733	S	S	*	*			cis	-146.9	174.6	16.6	-123.3	122.5	-111.3	0	0	110.7
459	E	27.9	Very low	28	Very low	170 Å²	170	140.9 Å²	140.9	79%	0.794	73%	0.731	S	S	*	*			trans	21.7	162.1	147.4	-60.4	177.3	175.7	0	0	123.2
460	E	27.9	Very low	28.3	Very low	163 Å²	163	137.6 Å²	137.6	76%	0.762	73%	0.726	S	S	*	*			cis	-168.7	144.9	-28.7	-103.3	-161	159.8	0	0	106.9
461	D	27.7	Very low	28.3	Very low	111 Å²	111	135.6 Å²	135.6	59%	0.594	72%	0.717	S	S	*	*				165.9	137.9	126.7	-113	-5.2	0	0	0	117.8
462	K	27.9	Very low	28.1	Very low	167 Å²	167	138.2 Å²	138.2	73%	0.726	72%	0.723	S	S	*	*			trans	47.4	147.4	136.4	-67.2	176.1	-171.8	78.8	0	121.5
463	V	29.6	Very low	28.3	Very low	122 Å²	122	137.6 Å²	137.6	74%	0.739	72%	0.715	S	S	*	*			cis	-159.1	138.9	1.2	107.2	0	0	0	0	114.1
464	V	33.1	Very low	28.5	Very low	118 Å²	118	141.1 Å²	141.1	72%	0.715	73%	0.727	S	S	*	*			trans	24.4	127.4	141.6	-178.7	0	0	0	0	122
465	N	29.1	Very low	28.6	Very low	161 Å²	161	138.8 Å²	138.8	86%	0.861	72%	0.722	S	S	*	*				-167.6	175	113.7	-121.8	-41.1	0	0	0	117
466	S	30.1	Very low	28.7	Very low	102 Å²	102	142.5 Å²	142.5	71%	0.713	73%	0.731	S	S	*	*			trans	-149.6	177.3	-171.5	-171.5	0	0	0	0	113.9
467	F	30.7	Very low	28.9	Very low	179 Å²	179	141.5 Å²	141.5	79%	0.785	73%	0.729	S	S	*	*			trans	105.2	104.4	147.7	-134.8	-104.2	0	0	0	123.1
468	V	29.4	Very low	28.9	Very low	99 Å²	99	146.7 Å²	146.7	60%	0.6	74%	0.74	S	S	*	*				50.3	122.3	129.7	-172.7	0	0	0	0	124.8
469	I	35.2	Very low	29	Very low	150 Å²	150	144 Å²	144	77%	0.769	74%	0.739	S	S	*	*			trans	22.7	133.4	135.4	-44.2	168	0	0	0	122
470	P	33.6	Very low	28.9	Very low	119 Å²	119	139.5 Å²	139.5	77%	0.773	73%	0.73	S	S	*	*				-123.4	135.8	128.4	5.5	16.5	0	0	0	112.3
471	E	25.8	Very low	28.8	Very low	145 Å²	145	139.5 Å²	139.5	68%	0.678	74%	0.735	S	S	*	*				64.5	134.1	85.6	-84.5	-135.3	156.2	0	0	117.8	R473	E471-R473 IonicContact OE1-CZ 3.88Å; E471-R473 IonicContact OE1-NH1 2.83Å; E471-R473 PolarHBondContact OE1-NH1 3.4Å; E471-R473 IonicContact OE2-NH1 2.73Å; E471-R473 PolarHBondContact OE2-NH1 2.79Å
472	L	29.2	Very low	28.8	Very low	173 Å²	173	138.2 Å²	138.2	91%	0.906	74%	0.74	S	S	*	*			trans	-139.7	140.5	172.6	-78.5	174.7	0	0	0	110.7
473	R	26.9	Very low	28.8	Very low	181 Å²	181	138.4 Å²	138.4	68%	0.683	75%	0.748	S	S	*	*			trans	-152.8	127.2	174.6	-81	-174.9	163.3	84.3	5	113.2	E471	E471-R473 IonicContact OE1-CZ 3.88Å; E471-R473 IonicContact OE1-NH1 2.83Å; E471-R473 PolarHBondContact OE1-NH1 3.4Å; E471-R473 IonicContact OE2-NH1 2.73Å; E471-R473 PolarHBondContact OE2-NH1 2.79Å
474	L	28.7	Very low	28.7	Very low	151 Å²	151	137.7 Å²	137.7	79%	0.791	75%	0.748	S	S	*	*			trans	59.4	164	144.4	-63.1	162.7	0	0	0	117.8
475	D	26.8	Very low	28.8	Very low	107 Å²	107	137.2 Å²	137.2	57%	0.572	75%	0.751	S	S	*	*			cis	-153.8	164.9	16.3	-157.2	7.3	0	0	0	113.8
476	R	27.6	Very low	29.4	Very low	208 Å²	208	135 Å²	135	79%	0.785	75%	0.745	S	S	*	*			trans	51	121.7	141.4	-99.4	-178.2	-179.4	130.3	-14.4	124.9
477	S	28.1	Very low	29.3	Very low	97 Å²	97	136.6 Å²	136.6	68%	0.678	75%	0.745	S	S	*	*				147.2	132.6	104.7	-67.4	0	0	0	0	117.5
478	F	25	Very low	29.3	Very low	202 Å²	202	132.8 Å²	132.8	89%	0.886	74%	0.737	S	S	*	*			trans	55	156.6	145.5	-83.3	-117.3	0	0	0	121.4
479	S	28.2	Very low	29.4	Very low	100 Å²	100	134.6 Å²	134.6	70%	0.699	74%	0.743	S	S	*	*			cis	-174.9	170.2	-28.1	-168.7	0	0	0	0	110.9
480	A	26.8	Very low	29.5	Very low	75 Å²	75	135.3 Å²	135.3	62%	0.62	74%	0.743	S	S	*	*			trans	82.7	107.3	152.7	0	0	0	0	0	121.8
481	D	26	Very low	29.7	Very low	163 Å²	163	138.1 Å²	138.1	87%	0.872	75%	0.746	S	S	*	*				71.6	148.8	119.1	-61.7	-49.7	0	0	0	126.1
482	A	26.9	Very low	30.5	Very low	83 Å²	83	138.1 Å²	138.1	69%	0.686	75%	0.746	S	S	*	*			trans	88.6	116.1	151.7	0	0	0	0	0	122
483	L	29.1	Very low	31	Very low	171 Å²	171	140.3 Å²	140.3	90%	0.895	74%	0.744	S	S	*	*				45.7	146.1	122.5	-52.7	-178.9	0	0	0	120
484	S	26.8	Very low	31.8	Very low	107 Å²	107	138.6 Å²	138.6	75%	0.748	75%	0.748	S	S	*	*			cis	-163.8	163.8	13.5	44.5	0	0	0	0	112.2
485	S	35.8	Very low	32.5	Very low	109 Å²	109	141 Å²	141	76%	0.762	76%	0.755	S	S	*	*			trans	-78.4	154.9	162.6	-54.3	0	0	0	0	112.7
486	P	40.8	Very low	33.3	Very low	113 Å²	113	143.6 Å²	143.6	73%	0.734	77%	0.769	S	S	*	*				-120.3	154	109.2	-0.1	21.9	0	0	0	110.9
487	N	28.1	Very low	34.1	Very low	136 Å²	136	142.3 Å²	142.3	73%	0.727	77%	0.772	S	S	*	*				68.9	124	64	-71.3	42	0	0	0	113.9
488	T	31.1	Very low	34.5	Very low	99 Å²	99	147 Å²	147	61%	0.607	78%	0.784	S	S	*	*			cis	-130.2	-103.4	-5.7	-8.9	0	0	0	0	113.8
489	D	30.6	Very low	35.4	Very low	138 Å²	138	146.8 Å²	146.8	74%	0.738	79%	0.785	S	S	*	*			cis	-154.9	160.7	-1.5	-60.5	-70.8	0	0	0	110.5
490	E	38.2	Very low	35.8	Very low	165 Å²	165	151.7 Å²	151.7	77%	0.771	80%	0.797	S	S	*	*			trans	-74.9	155.3	-168.5	-50.9	-63	162.1	0	0	114.4
491	E	37.2	Very low	36.4	Very low	177 Å²	177	153.3 Å²	153.3	83%	0.827	80%	0.804	S	S	*	*				-156.8	172.1	70.1	-100.7	-176.3	-149.4	0	0	114.6
492	E	42.5	Very low	37	Very low	145 Å²	145	155 Å²	155	68%	0.678	81%	0.806	S	S	*	*			trans	-133.5	143.4	-158.8	162.6	-169.3	-150.5	0	0	111
493	Y	40.2	Very low	37.8	Very low	219 Å²	219	159.8 Å²	159.8	86%	0.859	82%	0.815	S	S	*	*			trans	-158.3	116.7	154.7	-80.5	-66.7	0	0	0	111.3
494	D	43.8	Very low	38.4	Very low	145 Å²	145	158.6 Å²	158.6	78%	0.775	81%	0.809	S	S	*	*			trans	-93.6	161.2	169.4	-74.9	-47.5	0	0	0	112.6
495	E	43.6	Very low	39.2	Very low	201 Å²	201	160.3 Å²	160.3	94%	0.939	81%	0.81	S	S	*	*			trans	-165.7	124.4	156.8	-111.4	179.6	-175.7	0	0	108.6
496	D	42.3	Very low	39.5	Very low	163 Å²	163	164 Å²	164	87%	0.872	82%	0.815	S	S	*	*			trans	-159.6	-164.7	-176.1	-149.5	-32.8	0	0	0	111.4
497	E	44.4	Very low	39.3	Very low	181 Å²	181	165.9 Å²	165.9	85%	0.846	82%	0.819	S	S	*	*			trans	83.5	134	-170.4	-58.5	-166.9	175.1	0	0	114.1
498	E	36.6	Very low	39.9	Very low	196 Å²	196	167.4 Å²	167.4	92%	0.916	83%	0.827	S	S	*	*				-142.3	149.1	67.9	-75.2	173	157.8	0	0	114.4
499	E	44.2	Very low	40.2	Very low	196 Å²	196	167.1 Å²	167.1	92%	0.916	83%	0.829	S	S	*	*			trans	-102.2	143.2	162.1	-69.5	-166.7	147	0	0	110.7
500	E	37	Very low	40.6	Very low	203 Å²	203	168.1 Å²	168.1	95%	0.949	84%	0.835	S	S	*	*			trans	-137.9	146.1	153.5	-89.3	-161.1	157	0	0	111.2
501	S	39.4	Very low	40.4	Very low	109 Å²	109	166.3 Å²	166.3	76%	0.762	83%	0.83	S	S	*	*			trans	-149.1	141.1	-178.7	62.8	0	0	0	0	110.2
502	E	39.3	Very low	40.2	Very low	198 Å²	198	162.8 Å²	162.8	93%	0.925	83%	0.831	S	S	*	*			trans	-158.3	166	152.2	-117.7	164.8	-145.9	0	0	110.7
503	E	43.9	Very low	39.6	Very low	184 Å²	184	164.8 Å²	164.8	86%	0.86	83%	0.834	S	S	*	*			trans	-113.4	-136.3	-160.9	-56.4	-167.5	109.8	0	0	112.8
504	D	41.2	Very low	39.5	Very low	146 Å²	146	159.7 Å²	159.7	78%	0.781	82%	0.821	S	S	*	*			trans	67.7	137.6	168.9	-61.6	6.9	0	0	0	119.6
505	D	43.9	Very low	38.8	Very low	144 Å²	144	160.4 Å²	160.4	77%	0.77	82%	0.82	S	S	*	*			cis	-161.5	-179.6	-28.3	-148.3	-8.3	0	0	0	111.1
506	E	40.9	Very low	38	Very low	186 Å²	186	161.8 Å²	161.8	87%	0.869	82%	0.816	S	S	*	*			trans	134.2	132.9	145	-73.2	-163.8	175.1	0	0	116
507	D	37.5	Very low	37.4	Very low	152 Å²	152	160 Å²	160	81%	0.813	81%	0.812	S	S	*	*			trans	-77.4	158.9	-173.3	-77.2	-65.7	0	0	0	115.4
508	D	40.3	Very low	36.7	Very low	169 Å²	169	157.5 Å²	157.5	90%	0.904	80%	0.804	S	S	*	*				-144.3	129	125.4	-164.9	6.7	0	0	0	109.7
509	S	38.3	Very low	36.3	Very low	93 Å²	93	153.5 Å²	153.5	65%	0.65	80%	0.798	S	S	*	*			trans	-135.7	124.2	-172.1	162	0	0	0	0	109.8
510	D	38.1	Very low	35.8	Very low	159 Å²	159	153 Å²	153	85%	0.85	79%	0.793	S	S	*	*			trans	-147.8	148.5	157.8	-135.6	-8	0	0	0	115.2
511	D	33.1	Very low	35.5	Very low	126 Å²	126	153.7 Å²	153.7	67%	0.674	79%	0.787	S	S	*	*			trans	-57.6	152.6	-147.8	-126.4	-32.1	0	0	0	120.9
512	A	33.9	Very low	35	Very low	103 Å²	103	159.2 Å²	159.2	85%	0.851	79%	0.791	S	S	*	*			trans	-141.6	83.3	160.2	0	0	0	0	0	110.6
513	Y	30.8	Very low	34.5	Very low	187 Å²	187	155 Å²	155	73%	0.733	78%	0.784	S	S	*	*			trans	-70.7	151.4	-164	-161	-127.1	0	0	0	115.9
514	L	36.6	Very low	33.8	Very low	113 Å²	113	154.3 Å²	154.3	59%	0.592	78%	0.782	S	S	*	*			trans	80.6	89.6	172	-56.3	-178.2	0	0	0	121
515	Q	29.2	Very low	33.2	Very low	160 Å²	160	153.5 Å²	153.5	75%	0.748	78%	0.782	S	S	*	*				64.1	127.3	120.6	-65.3	166.8	3.3	0	0	119.5
516	R	27.4	Very low	32.5	Very low	229 Å²	229	155.8 Å²	155.8	86%	0.864	79%	0.788	S	S	*	*				60.1	140.8	61.2	-69.8	-160.3	-179.7	-175.3	2.5	113.3
517	T	29.2	Very low	31.9	Very low	127 Å²	127	150.8 Å²	150.8	78%	0.779	79%	0.787	S	S	*	*			cis	-167.3	159.5	-10.3	17.3	0	0	0	0	106.2
518	D	30.4	Very low	31.5	Very low	127 Å²	127	147.8 Å²	147.8	68%	0.679	78%	0.783	S	S	*	*			cis	-151.9	-171.3	-6.8	176.9	-132.3	0	0	0	107
519	S	28	Very low	30.8	Very low	113 Å²	113	146.3 Å²	146.3	79%	0.79	78%	0.781	S	S	*	*			trans	-150	112.2	162.9	-73.4	0	0	0	0	113.1
520	K	33.2	Very low	30.2	Very low	184 Å²	184	147.1 Å²	147.1	80%	0.8	79%	0.785	S	S	*	*			trans	-149.2	143	177.3	-139.9	167.8	-170.9	168.4	0	114.2
521	R	31.3	Very low	29.8	Very low	218 Å²	218	146 Å²	146	82%	0.823	78%	0.775	S	S	*	*			trans	82.3	131	166.6	-62	-173.3	163	-166.2	-3.6	119.6
522	R	29.2	Very low	29.7	Very low	225 Å²	225	147.1 Å²	147.1	85%	0.849	77%	0.773	S	S	*	*			trans	43	127.9	133.8	-62.2	179.8	169.5	-166.5	-5.3	119
523	S	29.1	Very low	29.6	Very low	111 Å²	111	150.9 Å²	150.9	78%	0.776	77%	0.773	S	S	*	*			cis	94.6	135.7	38.9	-172.5	0	0	0	0	114
524	M	28.2	Very low	29.5	Very low	169 Å²	169	145.4 Å²	145.4	83%	0.833	77%	0.773	S	S	*	*			trans	85.2	142.3	166.7	-69.9	-87.9	-76.6	0	0	121
525	V	29.5	Very low	29.3	Very low	129 Å²	129	144.2 Å²	144.2	78%	0.782	79%	0.788	S	S	*	*			trans	88.4	145.9	151.9	148.3	0	0	0	0	120.7
526	E	29.1	Very low	29.3	Very low	191 Å²	191	140.2 Å²	140.2	89%	0.893	79%	0.79	S	S	*	*			trans	-98.7	168.4	-169.6	-56.2	162.6	113.9	0	0	112.2
527	G	28.6	Very low	29.4	Very low	82 Å²	82	140.3 Å²	140.3	85%	0.845	79%	0.79	S	S	*	*			trans	173.1	139.2	171.2	0	0	0	0	0	111.7
528	A	28.2	Very low	29.6	Very low	89 Å²	89	141 Å²	141	74%	0.736	79%	0.789	S	S	*	*			trans	-126.3	-172.2	-172	0	0	0	0	0	112.9
529	T	25.3	Very low	29.6	Very low	138 Å²	138	139.9 Å²	139.9	85%	0.847	79%	0.791	S	S	*	*			trans	80.4	126.3	179.6	72.7	0	0	0	0	114.7
530	C	25.8	Very low	29.7	Very low	109 Å²	109	140.9 Å²	140.9	74%	0.736	79%	0.792	S	S	*	*				86.1	137.1	69.9	-130	0	0	0	0	111.3
531	E	29.1	Very low	29.5	Very low	136 Å²	136	139.9 Å²	139.9	64%	0.636	79%	0.79	S	S	*	*			cis	-156.3	175.7	14.5	-160.4	158.5	162.3	0	0	114.3
532	K	31.6	Very low	29.4	Very low	149 Å²	149	136.4 Å²	136.4	65%	0.648	79%	0.788	S	S	*	*			trans	-15.8	150.1	168	-58.2	155.6	-172.3	153.9	0	118.1
533	H	32.3	Very low	29.4	Very low	182 Å²	182	130.6 Å²	130.6	84%	0.843	78%	0.782	S	S	*	*				-163.8	164	57.6	-73.7	80.3	0	0	0	111.2
534	G	29.2	Very low	29.4	Very low	72 Å²	72	132.2 Å²	132.2	74%	0.742	78%	0.781	S	S	*	*			cis	171.8	149	-6.7	0	0	0	0	0	113.3
535	G	30.6	Very low	29.6	Very low	88 Å²	88	133.5 Å²	133.5	91%	0.907	78%	0.777	S	S	*	*			trans	82.6	131.1	177.6	0	0	0	0	0	114.8
536	G	30.3	Very low	29.9	Very low	76 Å²	76	135.6 Å²	135.6	78%	0.784	77%	0.77	S	S	*	*			cis	122.6	146.6	10.7	0	0	0	0	0	109.9
537	R	29.7	Very low	30.1	Very low	231 Å²	231	136.6 Å²	136.6	87%	0.872	77%	0.766	S	S	*	*			cis	-158.2	166.8	10.6	-74.6	162.3	64.8	-152.5	1	106.2
538	L	33.4	Very low	30.5	Very low	143 Å²	143	137.1 Å²	137.1	75%	0.749	75%	0.753	S	S	*	*			cis	-169.9	172	-13.6	-97.9	169.7	0	0	0	105.2
539	S	29.9	Very low	30.8	Very low	102 Å²	102	141.1 Å²	141.1	71%	0.713	76%	0.756	S	S	*	*			cis	-136.3	-119.7	-0.8	28	0	0	0	0	109.1
540	V	29.3	Very low	31.3	Very low	135 Å²	135	138.4 Å²	138.4	82%	0.818	74%	0.743	S	S	*	*			cis	-156.2	-170.8	-6.7	79.7	0	0	0	0	108.8
541	Q	30.5	Very low	31.7	Very low	162 Å²	162	142.4 Å²	142.4	76%	0.757	75%	0.75	S	S	*	*			trans	-134.3	160.1	-171.4	-56.2	172.8	-78.6	0	0	115.3
542	N	28.7	Very low	31.9	Very low	145 Å²	145	139.1 Å²	139.1	78%	0.775	75%	0.754	S	S	*	*			trans	66.6	148.8	143.3	-70.4	-19.2	0	0	0	123.1
543	S	28.6	Very low	32.1	Very low	104 Å²	104	137.2 Å²	137.2	73%	0.727	76%	0.759	S	S	*	*			trans	112.9	105.2	133.6	-146.1	0	0	0	0	119.7
544	L	30.1	Very low	32	Very low	145 Å²	145	135.5 Å²	135.5	76%	0.759	76%	0.755	S	S	*	*				46	148	128	-77.5	160.6	0	0	0	123.3
545	R	32.6	Very low	32.1	Very low	196 Å²	196	139 Å²	139	74%	0.74	76%	0.756	S	S	*	*			trans	73.8	152.6	152.1	-75.3	168	-179.9	-166.9	2.8	116.8
546	R	34.5	Very low	32	Very low	173 Å²	173	142.8 Å²	142.8	65%	0.653	75%	0.75	S	S	*	*			cis	-171.8	157	-25.6	-140.4	-162.8	-82	-104.4	15.7	108.4
547	R	33.4	Very low	32	Very low	211 Å²	211	147.4 Å²	147.4	80%	0.796	75%	0.751	S	S	*	*			trans	68.6	160.9	152.8	-73	-171.7	168.8	168.6	-5.5	117.2
548	T	37.3	Very low	33	Very low	93 Å²	93	140.9 Å²	140.9	57%	0.571	74%	0.739	S	S	*	*			cis	-170.3	158.7	-11.2	24.5	0	0	0	0	113.9
549	H	35	Very low	32.8	Very low	173 Å²	173	145.6 Å²	145.6	80%	0.801	75%	0.747	S	S	*	*			trans	63.8	159.1	143.7	-66.6	-41.8	0	0	0	119
550	S	35.1	Very low	32.7	Very low	81 Å²	81	147 Å²	147	57%	0.566	75%	0.751	S	S	*	*			cis	-165.4	159.7	-13.7	41.1	0	0	0	0	111.4
551	E	34.7	Very low	33.8	Very low	193 Å²	193	146.2 Å²	146.2	90%	0.902	75%	0.749	S	S	*	*			trans	55.4	155.9	147.4	-70.2	146.6	-160.3	0	0	121.5
552	G	33.6	Very low	33.8	Very low	68 Å²	68	144.8 Å²	144.8	70%	0.701	76%	0.755	S	S	*	*			cis	173.2	146.3	-10.1	0	0	0	0	0	114.9
553	S	34.8	Very low	33.6	Very low	109 Å²	109	146.9 Å²	146.9	76%	0.762	76%	0.758	S	S	*	*			trans	43.9	131.9	152.3	-153.3	0	0	0	0	123.6
554	L	31.5	Very low	33.5	Very low	145 Å²	145	147.9 Å²	147.9	76%	0.759	76%	0.76	S	S	*	*				167.6	126.8	111.3	-90.2	162.7	0	0	0	114.4
555	L	30.2	Very low	33.7	Very low	145 Å²	145	145.5 Å²	145.5	76%	0.759	76%	0.755	S	S	*	*			trans	45.7	157.6	148.4	-61.2	173.4	0	0	0	120.7
556	Q	30	Very low	33.7	Very low	168 Å²	168	142.9 Å²	142.9	79%	0.785	76%	0.756	S	S	*	*			cis	-156.4	162.6	19.5	-150.7	162.9	86.5	0	0	111.1
557	E	30.3	Very low	33.6	Very low	173 Å²	173	141.8 Å²	141.8	81%	0.808	76%	0.763	S	S	*	*			trans	-96.8	-161.7	170.4	-32.9	179.5	128.9	0	0	111.2
558	P	50.6	Low	33.4	Very low	95 Å²	95	135.7 Å²	135.7	62%	0.617	76%	0.758	S	S	*	*			cis	-132.4	175.1	-30.4	34.3	-17.4	0	0	0	113.5
559	R	29	Very low	33.4	Very low	241 Å²	241	138.6 Å²	138.6	91%	0.909	77%	0.768	S	S	*	*				170	159.9	129.9	-94.4	163.5	-177.9	145.8	1.7	115.4
560	T	26.1	Very low	33.1	Very low	131 Å²	131	138 Å²	138	80%	0.804	77%	0.771	S	S	*	*			trans	-118.2	-167.4	174.7	57	0	0	0	0	109.3
561	P	54.4	Low	32.9	Very low	120 Å²	120	139.7 Å²	139.7	78%	0.779	78%	0.782	S	S	*	*			cis	-126.9	172.9	-39.8	32.5	-16.4	0	0	0	113.1
562	C	28.8	Very low	32.6	Very low	131 Å²	131	139.2 Å²	139.2	89%	0.885	78%	0.784	S	S	*	*			trans	-155.1	-179.1	146.4	76.5	0	0	0	0	112.6
563	F	25.8	Very low	32.4	Very low	189 Å²	189	144.7 Å²	144.7	83%	0.829	79%	0.791	S	S	*	*			trans	-138	177.4	-161.7	-143.2	-97.4	0	0	0	111.2
564	T	25.7	Very low	32.1	Very low	125 Å²	125	144.5 Å²	144.5	77%	0.767	80%	0.796	S	S	*	*			trans	68.7	160.5	171	72.5	0	0	0	0	117.4
565	S	34.4	Very low	31.9	Very low	95 Å²	95	141.7 Å²	141.7	66%	0.664	80%	0.803	S	S	*	*			cis	-170.8	146.9	-38.8	55.7	0	0	0	0	110.8
566	D	33.4	Very low	31.7	Very low	142 Å²	142	138.4 Å²	138.4	76%	0.759	80%	0.804	S	S	*	*			trans	60.2	144.6	147	-77	-4	0	0	0	125.1
567	N	31.1	Very low	31.7	Very low	149 Å²	149	137.3 Å²	137.3	80%	0.797	81%	0.808	S	S	*	*			trans	88.4	131.9	140.1	-84.7	-43.6	0	0	0	124.8
568	A	28.9	Very low	31.7	Very low	83 Å²	83	137.9 Å²	137.9	69%	0.686	81%	0.811	S	S	*	*			trans	67.9	99.7	139.9	0	0	0	0	0	122
569	I	37.2	Very low	31	Very low	154 Å²	154	138.8 Å²	138.8	79%	0.79	82%	0.816	S	S	*	*				31.5	117.1	121.3	-56.4	173.2	0	0	0	117.5
570	N	28.8	Very low	31	Very low	161 Å²	161	137.1 Å²	137.1	86%	0.861	82%	0.816	S	S	*	*				-157.6	150.3	120.8	-110.3	-35.1	0	0	0	113.3
571	C	32.7	Very low	31.4	Very low	117 Å²	117	134.7 Å²	134.7	79%	0.791	82%	0.817	S	S	*	*			trans	-101.9	142.9	169.7	-61.9	0	0	0	0	109.3
572	L	27.4	Very low	30.1	Very low	182 Å²	182	132.5 Å²	132.5	95%	0.953	82%	0.816	S	S	*	*			trans	-154.6	167.1	154	-112.5	170.1	0	0	0	110.4
573	E	30	Very low	30	Very low	183 Å²	183	137.2 Å²	137.2	86%	0.855	82%	0.815	S	S	*	*			trans	-143.5	133.3	-150.8	172.7	-179.8	-146.8	0	0	111.6
574	A	28	Very low	30.5	Very low	105 Å²	105	134.1 Å²	134.1	87%	0.868	81%	0.812	S	S	*	*			trans	179	152.9	152.2	0	0	0	0	0	111.3
575	G	26.4	Very low	31	Very low	87 Å²	87	135.4 Å²	135.4	90%	0.897	81%	0.813	S	S	*	*			trans	121	60.9	167.5	0	0	0	0	0	115.7
576	G	27.1	Very low	31.2	Very low	76 Å²	76	134.2 Å²	134.2	78%	0.784	80%	0.803	S	S	*	*			trans	-107.6	143	-175.3	0	0	0	0	0	115.6
577	V	29.2	Very low	31.8	Very low	144 Å²	144	130.3 Å²	130.3	87%	0.873	79%	0.787	S	S	*	*			trans	-139.4	127.3	154.4	-179	0	0	0	0	108.2
578	H	30.5	Very low	32.7	Very low	186 Å²	186	128.3 Å²	128.3	86%	0.861	78%	0.782	S	S	*	*			trans	-88.5	153.1	176.3	-79.6	-59.5	0	0	0	112.2
579	P	35.2	Very low	33.6	Very low	113 Å²	113	132.9 Å²	132.9	73%	0.734	79%	0.787	S	S	*	*				-141.7	144.2	112	35.9	-23.4	0	0	0	116.4
580	K	29.3	Very low	34.7	Very low	207 Å²	207	129.2 Å²	129.2	90%	0.9	77%	0.772	S	S	*	*	S	Bend	trans	47.5	107.2	144	-61.4	179.2	179.8	176.7	0	119.8
581	G	35.7	Very low	35.7	Very low	80 Å²	80	123.6 Å²	123.6	83%	0.825	74%	0.741	S	S	*	*				96.3	10.7	129.8	0	0	0	0	0	119.6
582	G	27	Very low	36.8	Very low	73 Å²	73	123.5 Å²	123.5	75%	0.753	73%	0.728	S	S	*	*			trans	-70.5	135.6	174.4	0	0	0	0	0	113.7	T584	G582-T584 PolarHBondContact O-N 3.13Å
583	W	26.2	Very low	38.2	Very low	230 Å²	230	122.2 Å²	122.2	87%	0.871	71%	0.714	S	S	*	*			trans	-80.1	105.6	168.6	-82.2	69.4	0	0	0	110.3
584	T	36.3	Very low	39.3	Very low	124 Å²	124	118.4 Å²	118.4	76%	0.761	70%	0.697	S	S	*	*	P	Polyproline II helix	trans	-85.3	122	164.2	53.8	0	0	0	0	109.8	G582	G582-T584 PolarHBondContact O-N 3.13Å
585	L	35.5	Very low	40.4	Very low	152 Å²	152	115.2 Å²	115.2	80%	0.796	67%	0.665	S	S	*	*	P	Polyproline II helix	trans	-61.8	133.2	176	-171.8	70.9	0	0	0	110
586	P	39.6	Very low	41.6	Very low	70 Å²	70	117.4 Å²	117.4	46%	0.455	65%	0.653	S	S	.	*	P	Polyproline II helix	trans	-59.4	142.6	175.1	-22.9	33.7	0	0	0	111.4	L591	P586-L591 HydrophobicContact CB-CD1 4.47Å
587	S	45.8	Very low	42.6	Very low	60 Å²	60	121.8 Å²	121.8	42%	0.42	65%	0.651	S	S	.	*	P	Polyproline II helix	trans	-53	138.1	174.6	178.2	0	0	0	0	110.6	K589 T590 L591	S587-K589 PolarHBondContact O-N 3.44Å; S587-T590 WeakPolarHBondContact O-CA 3.21Å; S587-T590 WeakPolarHBondContact O-CB 3.5Å; S587-T590 PolarHBondContact O-N 3.27Å; S587-L591 PolarHBondContact O-N 3.44Å
588	P	49.2	Very low	43.2	Very low	108 Å²	108	121.1 Å²	121.1	70%	0.701	64%	0.642	S	S	*	*	H	α-helix	trans	-53.7	-28.6	177	-28.4	35.5	0	0	0	113.6	K592	P588-K592 VanDerWaalsContact O-CB 3.23Å; P588-K592 WeakPolarHBondContact O-CB 3.43Å; P588-K592 PolarHBondContact O-N 3.13Å
589	K	47.7	Very low	43.8	Very low	178 Å²	178	115.9 Å²	115.9	77%	0.774	64%	0.638	S	S	*	*	H	α-helix	trans	-65.9	-42.3	174.5	-63.9	-177.1	180	179.9	0	112	S587 K593	S587-K589 PolarHBondContact O-N 3.44Å; K589-K593 WeakPolarHBondContact O-CB 3.3Å; K589-K593 PolarHBondContact O-N 2.94Å; K589-K593 VanDerWaalsContact O-N 3.12Å
590	T	61	Low	44.4	Very low	77 Å²	77	111.9 Å²	111.9	47%	0.472	62%	0.618	S	S	.	*	H	α-helix	trans	-68.2	-45.8	175.7	-43.4	0	0	0	0	110.8	S587 K592 K593 E594	S587-T590 WeakPolarHBondContact O-CA 3.21Å; S587-T590 WeakPolarHBondContact O-CB 3.5Å; S587-T590 PolarHBondContact O-N 3.27Å; T590-K592 VanDerWaalsContact C-N 3.34Å; T590-K592 PolarHBondContact O-N 3.28Å; T590-K593 WeakPolarHBondContact O-CB 3.41Å; T590-K593 PolarHBondContact O-N 3.15Å; T590-K593 VanDerWaalsContact O-N 3.12Å; T590-E594 PolarHBondContact O-N 2.86Å
591	L	49.8	Very low	45.8	Very low	43 Å²	43	105.4 Å²	105.4	23%	0.225	60%	0.598	C	S	.	*	H	α-helix	trans	-65.9	-37.1	-177.9	-156.2	146.4	0	0	0	111.7	P586 S587 L595 L605	P586-L591 HydrophobicContact CB-CD1 4.47Å; S587-L591 PolarHBondContact O-N 3.44Å; L591-L595 HydrophobicContact CD2-CD1 3.68Å; L591-L595 VanDerWaalsContact O-CD1 3.31Å; L591-L595 WeakPolarHBondContact O-CD1 3.27Å; L591-L595 PolarHBondContact O-N 3.49Å; L591-L595 VanDerWaalsContact O-N 3.15Å; L591-L605 HydrophobicContact CD2-CD1 4.09Å; L591-L605 HydrophobicContact CD2-CD2 3.72Å
592	K	55.5	Low	46.5	Very low	116 Å²	116	106.1 Å²	106.1	50%	0.504	58%	0.581	S	S	.	*	H	α-helix	trans	-62.6	-43.9	169.3	-178.1	177.3	178.7	179.8	0	112.5	P588 T590 E594 L595 M596	P588-K592 VanDerWaalsContact O-CB 3.23Å; P588-K592 WeakPolarHBondContact O-CB 3.43Å; P588-K592 PolarHBondContact O-N 3.13Å; T590-K592 VanDerWaalsContact C-N 3.34Å; T590-K592 PolarHBondContact O-N 3.28Å; K592-E594 VanDerWaalsContact C-N 3.33Å; K592-E594 PolarHBondContact O-N 3.42Å; K592-L595 PolarHBondContact O-N 2.68Å; K592-M596 HydrophobicContact CD-SD 4.47Å; K592-M596 HydrophobicContact CG-CG 4.49Å; K592-M596 HydrophobicContact CG-SD 3.95Å; K592-M596 WeakPolarHBondContact O-CG 3.45Å; K592-M596 PolarHBondContact O-N 3.24Å
593	K	57.8	Low	47.7	Very low	154 Å²	154	108.9 Å²	108.9	67%	0.67	57%	0.574	S	S	*	*	H	α-helix	trans	-62.1	-40.9	179.9	-165.7	174.9	-176.1	179.2	0	111.5	K589 T590 K597	K589-K593 WeakPolarHBondContact O-CB 3.3Å; K589-K593 PolarHBondContact O-N 2.94Å; K589-K593 VanDerWaalsContact O-N 3.12Å; T590-K593 WeakPolarHBondContact O-CB 3.41Å; T590-K593 PolarHBondContact O-N 3.15Å; T590-K593 VanDerWaalsContact O-N 3.12Å; K593-K597 WeakPolarHBondContact O-CB 3.29Å; K593-K597 PolarHBondContact O-N 2.99Å
594	E	52.1	Low	48.7	Very low	104 Å²	104	104.4 Å²	104.4	49%	0.486	56%	0.563	S	S	.	*	H	α-helix	trans	-73.1	-34.8	-179.8	-127.5	68.5	173.3	0	0	113.2	T590 K592 N598	T590-E594 PolarHBondContact O-N 2.86Å; K592-E594 VanDerWaalsContact C-N 3.33Å; K592-E594 PolarHBondContact O-N 3.42Å; E594-N598 PolarHBondContact O-ND2 2.91Å
595	L	51.3	Low	49.2	Very low	38 Å²	38	100.5 Å²	100.5	20%	0.199	54%	0.537	C	S	.	.	H	α-helix	trans	-65.2	-47.6	171	-98.2	95.8	0	0	0	111.6	L591 K592 K597 N598 G599 G600 L605	L591-L595 HydrophobicContact CD2-CD1 3.68Å; L591-L595 VanDerWaalsContact O-CD1 3.31Å; L591-L595 WeakPolarHBondContact O-CD1 3.27Å; L591-L595 PolarHBondContact O-N 3.49Å; L591-L595 VanDerWaalsContact O-N 3.15Å; K592-L595 PolarHBondContact O-N 2.68Å; L595-K597 VanDerWaalsContact C-N 3.3Å; L595-K597 PolarHBondContact O-N 3.4Å; L595-N598 CarbonylContact O-C 3.54Å; L595-N598 PolarHBondContact O-N 2.91Å; L595-N598 VanDerWaalsContact O-N 3.09Å; L595-G599 PolarHBondContact O-N 3.18Å; L595-G600 PolarHBondContact O-N 3.35Å; L595-L605 HydrophobicContact CD2-CB 4.48Å
596	M	52.5	Low	49.9	Very low	133 Å²	133	96.7 Å²	96.7	66%	0.655	52%	0.523	S	S	*	.	H	α-helix	trans	-63	-35.8	-178.9	-70.4	-179.8	70.1	0	0	112.3	K592 N598 G599	K592-M596 HydrophobicContact CD-SD 4.47Å; K592-M596 HydrophobicContact CG-CG 4.49Å; K592-M596 HydrophobicContact CG-SD 3.95Å; K592-M596 WeakPolarHBondContact O-CG 3.45Å; K592-M596 PolarHBondContact O-N 3.24Å; M596-N598 PolarHBondContact O-N 2.92Å; M596-G599 PolarHBondContact O-N 2.94Å
597	K	46.4	Very low	50.5	Low	168 Å²	168	99.5 Å²	99.5	73%	0.73	53%	0.531	S	S	*	.	H	α-helix	trans	-66.1	-20.5	176.3	-165	179	179.1	-170.5	0	113.7	K593 L595	K593-K597 WeakPolarHBondContact O-CB 3.29Å; K593-K597 PolarHBondContact O-N 2.99Å; L595-K597 VanDerWaalsContact C-N 3.3Å; L595-K597 PolarHBondContact O-N 3.4Å
598	N	43.3	Very low	50.5	Low	130 Å²	130	102.4 Å²	102.4	70%	0.695	54%	0.542	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.5	16.9	-179.2	-64.5	-66.8	0	0	0	113	E594 L595 M596 G600	E594-N598 PolarHBondContact O-ND2 2.91Å; L595-N598 CarbonylContact O-C 3.54Å; L595-N598 PolarHBondContact O-N 2.91Å; L595-N598 VanDerWaalsContact O-N 3.09Å; M596-N598 PolarHBondContact O-N 2.92Å; N598-G600 PolarHBondContact O-N 3.41Å
599	G	42.8	Very low	50.3	Low	75 Å²	75	105 Å²	105	77%	0.773	54%	0.542	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.2	12.4	178.5	0	0	0	0	0	115.6	L595 M596	L595-G599 PolarHBondContact O-N 3.18Å; M596-G599 PolarHBondContact O-N 2.94Å
600	G	47.5	Very low	50.2	Low	30 Å²	30	101.3 Å²	101.3	31%	0.309	54%	0.539	S	S	.	.			trans	-79.2	126.6	-175.7	0	0	0	0	0	113.2	L595 N598	L595-G600 PolarHBondContact O-N 3.35Å; N598-G600 PolarHBondContact O-N 3.41Å
601	S	58	Low	48.8	Very low	70 Å²	70	100.4 Å²	100.4	49%	0.49	55%	0.545	S	S	.	.			trans	-73.1	136.6	175	178.1	0	0	0	0	112.4	H603 Q604	S601-H603 PolarHBondContact O-N 3.27Å; S601-H603 VanDerWaalsContact O-N 3.15Å; S601-H603 PolarHBondContact OG-N 2.93Å; S601-Q604 WeakPolarHBondContact O-CB 3.49Å; S601-Q604 PolarHBondContact O-N 3.12Å
602	M	51.5	Low	47.9	Very low	95 Å²	95	107.5 Å²	107.5	47%	0.468	57%	0.569	S	S	.	*	H	α-helix	trans	-55.1	-29.8	172.8	-76.9	-63.7	-55.2	0	0	113.1	Q604 L605 C606	M602-Q604 PolarHBondContact O-N 3.3Å; M602-L605 HydrophobicContact CE-CD2 4.15Å; M602-L605 WeakPolarHBondContact O-CB 3.37Å; M602-L605 PolarHBondContact O-N 3.43Å; M602-L605 VanDerWaalsContact O-N 3.16Å; M602-C606 PolarHBondContact O-N 2.81Å
603	H	50.9	Low	46.7	Very low	131 Å²	131	112.1 Å²	112.1	61%	0.606	59%	0.588	S	S	*	*	H	α-helix	trans	-59.3	-35.4	176.4	-176.3	88	0	0	0	112	S601 L605 C606 M607	S601-H603 PolarHBondContact O-N 3.27Å; S601-H603 VanDerWaalsContact O-N 3.15Å; S601-H603 PolarHBondContact OG-N 2.93Å; H603-L605 VanDerWaalsContact C-N 3.3Å; H603-L605 PolarHBondContact O-N 2.94Å; H603-C606 PolarHBondContact O-N 2.78Å; H603-M607 WeakPolarHBondContact O-CG 3.48Å; H603-M607 PolarHBondContact O-N 2.73Å
604	Q	48.6	Very low	45.3	Very low	136 Å²	136	114.5 Å²	114.5	64%	0.636	60%	0.599	S	S	*	*	H	α-helix	trans	-72.9	-24.1	-179	-158.6	158.3	-1.2	0	0	112.5	S601 M602 L608	S601-Q604 WeakPolarHBondContact O-CB 3.49Å; S601-Q604 PolarHBondContact O-N 3.12Å; M602-Q604 PolarHBondContact O-N 3.3Å; Q604-L608 PolarHBondContact O-N 3.49Å
605	L	47.1	Very low	44.5	Very low	42 Å²	42	117.2 Å²	117.2	22%	0.22	62%	0.616	C	S	.	*	H	α-helix	trans	-71.3	-44.7	168.8	-169.1	72.5	0	0	0	111.1	L591 L595 M602 H603 M607 L608 F609	L591-L605 HydrophobicContact CD2-CD1 4.09Å; L591-L605 HydrophobicContact CD2-CD2 3.72Å; L595-L605 HydrophobicContact CD2-CB 4.48Å; M602-L605 HydrophobicContact CE-CD2 4.15Å; M602-L605 WeakPolarHBondContact O-CB 3.37Å; M602-L605 PolarHBondContact O-N 3.43Å; M602-L605 VanDerWaalsContact O-N 3.16Å; H603-L605 VanDerWaalsContact C-N 3.3Å; H603-L605 PolarHBondContact O-N 2.94Å; L605-M607 VanDerWaalsContact C-N 3.32Å; L605-M607 PolarHBondContact O-N 2.91Å; L605-L608 WeakPolarHBondContact O-CB 3.4Å; L605-L608 PolarHBondContact O-N 3.25Å; L605-L608 VanDerWaalsContact O-N 3.12Å; L605-F609 HydrophobicContact CD1-CE2 4.04Å; L605-F609 HydrophobicContact CG-CD2 4.34Å; L605-F609 HydrophobicContact CG-CE2 3.98Å; L605-F609 VanDerWaalsContact O-CD2 3.31Å; L605-F609 WeakPolarHBondContact O-CD2 3.28Å; L605-F609 PolarHBondContact O-N 3.04Å
606	C	50.4	Low	43.4	Very low	73 Å²	73	123.4 Å²	123.4	49%	0.493	65%	0.648	S	S	.	*	H	α-helix	trans	-61.1	-40.7	176.3	-63.5	0	0	0	0	112.1	M602 H603 L608 F609 S610	M602-C606 PolarHBondContact O-N 2.81Å; H603-C606 PolarHBondContact O-N 2.78Å; C606-L608 PolarHBondContact O-N 3.49Å; C606-F609 PolarHBondContact O-N 2.94Å; C606-S610 PolarHBondContact O-N 2.61Å; C606-S610 VanDerWaalsContact O-N 3.16Å; C606-S610 PolarHBondContact O-OG 2.67Å
607	M	51.2	Low	42.1	Very low	128 Å²	128	122.4 Å²	122.4	63%	0.631	65%	0.654	S	S	*	*	H	α-helix	trans	-58.6	-29.1	174.6	-76.6	-68.8	-75	0	0	113.7	H603 L605	H603-M607 WeakPolarHBondContact O-CG 3.48Å; H603-M607 PolarHBondContact O-N 2.73Å; L605-M607 VanDerWaalsContact C-N 3.32Å; L605-M607 PolarHBondContact O-N 2.91Å
608	L	46.5	Very low	41.3	Very low	122 Å²	122	119.2 Å²	119.2	64%	0.639	66%	0.66	S	S	*	*	H	α-helix	trans	-76.4	-25.9	176	-74.6	165.3	0	0	0	113.3	Q604 L605 C606	Q604-L608 PolarHBondContact O-N 3.49Å; L605-L608 WeakPolarHBondContact O-CB 3.4Å; L605-L608 PolarHBondContact O-N 3.25Å; L605-L608 VanDerWaalsContact O-N 3.12Å; C606-L608 PolarHBondContact O-N 3.49Å
609	F	45.2	Very low	40.4	Very low	161 Å²	161	116.8 Å²	116.8	71%	0.706	67%	0.665	S	S	*	*	H	α-helix	trans	-91.4	-28.4	-178.9	-74.4	-69.5	0	0	0	114.1	L605 C606 G611	L605-F609 HydrophobicContact CD1-CE2 4.04Å; L605-F609 HydrophobicContact CG-CD2 4.34Å; L605-F609 HydrophobicContact CG-CE2 3.98Å; L605-F609 VanDerWaalsContact O-CD2 3.31Å; L605-F609 WeakPolarHBondContact O-CD2 3.28Å; L605-F609 PolarHBondContact O-N 3.04Å; C606-F609 PolarHBondContact O-N 2.94Å; F609-G611 VanDerWaalsContact C-N 3.27Å; F609-G611 PolarHBondContact O-N 3.5Å
610	S	45.8	Very low	39.7	Very low	102 Å²	102	118.7 Å²	118.7	71%	0.713	67%	0.666	S	S	*	*	S	Bend	trans	-79.3	1.3	-176.2	-60.4	0	0	0	0	115.5	C606 R612	C606-S610 PolarHBondContact O-N 2.61Å; C606-S610 VanDerWaalsContact O-N 3.16Å; C606-S610 PolarHBondContact O-OG 2.67Å; S610-R612 PolarHBondContact O-N 3.08Å; S610-R612 VanDerWaalsContact O-N 3.14Å
611	G	31.3	Very low	39.6	Very low	57 Å²	57	122.8 Å²	122.8	59%	0.588	69%	0.688	S	S	*	*			trans	-87.9	62.8	-163.2	0	0	0	0	0	118.2	F609	F609-G611 VanDerWaalsContact C-N 3.27Å; F609-G611 PolarHBondContact O-N 3.5Å
612	R	30.6	Very low	37.9	Very low	193 Å²	193	125.3 Å²	125.3	73%	0.728	70%	0.704	S	S	*	*			trans	167.1	104.7	144.8	-94.6	162.9	-177.4	172.1	4.8	114.8	S610	S610-R612 PolarHBondContact O-N 3.08Å; S610-R612 VanDerWaalsContact O-N 3.14Å
613	K	29.2	Very low	36.5	Very low	212 Å²	212	126.1 Å²	126.1	92%	0.922	72%	0.719	S	S	*	*			trans	-131.6	134.2	130.6	-82.4	-175.1	178.4	174.8	0	107.3
614	K	29.6	Very low	35.2	Very low	204 Å²	204	124.4 Å²	124.4	89%	0.887	72%	0.72	S	S	*	*			trans	-93	157	178.5	-90.6	-167.5	171.1	-169.1	0	110.8
615	L	34.4	Very low	33.9	Very low	162 Å²	162	125.3 Å²	125.3	85%	0.848	73%	0.725	S	S	*	*			trans	-56.1	153.6	163.6	-74.3	73.4	0	0	0	111.9
616	L	28.6	Very low	32.9	Very low	168 Å²	168	129.4 Å²	129.4	88%	0.88	75%	0.751	S	S	*	*			trans	169.7	142.5	133.2	-89.8	168.5	0	0	0	107.2
617	S	26	Very low	31.7	Very low	111 Å²	111	131 Å²	131	78%	0.776	76%	0.763	S	S	*	*			cis	-149.3	178	-1.8	-157.9	0	0	0	0	111.6
618	A	29.7	Very low	31.3	Very low	102 Å²	102	129.8 Å²	129.8	84%	0.843	77%	0.765	S	S	*	*			trans	-73.8	177	-175.4	0	0	0	0	0	115.4
619	G	22.9	Very low	30.3	Very low	79 Å²	79	131.7 Å²	131.7	81%	0.814	78%	0.776	S	S	*	*			trans	-155.3	117.3	171	0	0	0	0	0	113.6
620	S	29	Very low	29.4	Very low	114 Å²	114	127.9 Å²	127.9	80%	0.797	78%	0.782	S	S	*	*			trans	-172.4	148.8	168.9	-179.8	0	0	0	0	106.9
621	P	45.3	Very low	28.7	Very low	117 Å²	117	129.1 Å²	129.1	76%	0.76	79%	0.785	S	S	*	*			cis	-118	-159.8	-5	32.6	-12.1	0	0	0	111.7
622	C	22.2	Very low	28.7	Very low	122 Å²	122	136.3 Å²	136.3	82%	0.824	80%	0.8	S	S	*	*			trans	-68.9	156.9	155.5	-50.9	0	0	0	0	109.6
623	S	21.6	Very low	29	Very low	112 Å²	112	137.2 Å²	137.2	78%	0.783	81%	0.81	S	S	*	*			cis	-143.5	-164.8	18.6	-159.6	0	0	0	0	112.4
624	C	25.3	Very low	29.1	Very low	95 Å²	95	137.4 Å²	137.4	64%	0.642	81%	0.811	S	S	*	*			trans	-57.9	157.8	178.7	53.8	0	0	0	0	114.9
625	E	20.8	Very low	29.2	Very low	155 Å²	155	137.5 Å²	137.5	72%	0.724	81%	0.811	S	S	*	*				-152.8	151.5	64.6	-82.4	-67.6	110.8	0	0	115.8
626	V	24.6	Very low	29	Very low	128 Å²	128	135.4 Å²	135.4	78%	0.776	81%	0.81	S	S	*	*			trans	60.8	150.9	153.1	179	0	0	0	0	121.3
627	S	25.2	Very low	29.6	Very low	107 Å²	107	136.6 Å²	136.6	75%	0.748	81%	0.808	S	S	*	*			trans	-118.3	-169.3	-172.6	-47.7	0	0	0	0	111.8
628	P	43.9	Very low	30.6	Very low	103 Å²	103	137.7 Å²	137.7	67%	0.669	81%	0.805	S	S	*	*			cis	-138.3	-170.1	-6.6	37.8	-16.2	0	0	0	116.4
629	N	25.4	Very low	31.3	Very low	162 Å²	162	138 Å²	138	87%	0.866	79%	0.792	S	S	*	*			trans	94.8	142.1	156.3	-62.5	-32.3	0	0	0	121.7
630	G	27.1	Very low	32.4	Very low	81 Å²	81	137.8 Å²	137.8	84%	0.835	78%	0.782	S	S	*	*			trans	125.5	118.2	154.8	0	0	0	0	0	116.9
631	T	31	Very low	33.1	Very low	127 Å²	127	139.9 Å²	139.9	78%	0.779	78%	0.777	S	S	*	*			trans	-117.3	152.1	176.1	62.1	0	0	0	0	113.2
632	K	29.9	Very low	33.2	Very low	208 Å²	208	137.1 Å²	137.1	90%	0.904	76%	0.756	S	S	*	*				177.8	150.9	128.1	-93.5	148.8	-168	171.9	0	113.9
633	K	38.5	Very low	34.3	Very low	213 Å²	213	135.7 Å²	135.7	93%	0.926	74%	0.738	S	S	*	*			trans	-94.7	157	175	-65.2	174.2	178.1	172.5	0	111.4
634	K	29.8	Very low	35.3	Very low	216 Å²	216	138.3 Å²	138.3	94%	0.939	74%	0.736	S	S	*	*			trans	-136.2	155.4	158.8	-144.4	166.1	-174.1	174.7	0	111.4
635	K	32.5	Very low	36.3	Very low	206 Å²	206	139.4 Å²	139.4	90%	0.896	74%	0.735	S	S	*	*			trans	-94.7	153.6	-159.7	-63.7	179.1	179.4	177.7	0	114.3
636	S	30.8	Very low	37.5	Very low	118 Å²	118	139.9 Å²	139.9	83%	0.825	73%	0.73	S	S	*	*			trans	-72.9	156.4	168.2	-178.2	0	0	0	0	112.5
637	K	40.2	Very low	38.7	Very low	193 Å²	193	137.1 Å²	137.1	84%	0.839	71%	0.711	S	S	*	*			trans	-121	119	171.5	-76.8	-173.4	175.4	-177.9	0	111.7
638	N	47.3	Very low	39.6	Very low	133 Å²	133	135.3 Å²	135.3	71%	0.711	70%	0.702	S	S	*	*			trans	52.6	71.4	149.7	-62.7	-20.2	0	0	0	120.3	A640	N638-A640 PolarHBondContact O-N 3.47Å
639	L	43.5	Very low	39.7	Very low	109 Å²	109	137.4 Å²	137.4	57%	0.571	70%	0.701	S	S	*	*	H	α-helix	trans	-56.9	-33.7	163.4	-179.7	62.1	0	0	0	113.5	K641 D642 M643	L639-K641 VanDerWaalsContact C-N 3.29Å; L639-K641 PolarHBondContact O-N 2.94Å; L639-D642 PolarHBondContact O-N 3.37Å; L639-M643 PolarHBondContact O-N 2.98Å
640	A	46.8	Very low	40.3	Very low	74 Å²	74	134.1 Å²	134.1	61%	0.612	68%	0.683	S	S	*	*	H	α-helix	trans	-63.2	-27.7	-174	0	0	0	0	0	114.5	N638 K644	N638-A640 PolarHBondContact O-N 3.47Å; A640-K644 PolarHBondContact O-N 2.91Å; A640-K644 VanDerWaalsContact O-N 3.12Å
641	K	44	Very low	40.8	Very low	159 Å²	159	141.2 Å²	141.2	69%	0.691	69%	0.685	S	S	*	*	H	α-helix	trans	-73.3	-34.4	179.3	-165.5	173.1	-179.4	180	0	112	L639 N645	L639-K641 VanDerWaalsContact C-N 3.29Å; L639-K641 PolarHBondContact O-N 2.94Å; K641-N645 PolarHBondContact O-N 2.88Å
642	D	46.8	Very low	41.2	Very low	59 Å²	59	146.2 Å²	146.2	32%	0.316	69%	0.689	S	S	.	*	H	α-helix	trans	-67.7	-44.8	175.2	-171.4	19.7	0	0	0	110.7	L639 K644 N645 R646	L639-D642 PolarHBondContact O-N 3.37Å; D642-K644 PolarHBondContact O-N 3.1Å; D642-N645 PolarHBondContact O-N 2.85Å; D642-R646 WeakPolarHBondContact O-CG 3.38Å; D642-R646 PolarHBondContact O-N 2.81Å; D642-R646 VanDerWaalsContact O-N 3.1Å; D642-R646 WeakPolarHBondContact OD1-CD 3.26Å; D642-R646 IonicContact OD1-CZ 3.52Å; D642-R646 IonicContact OD1-NE 3.5Å; D642-R646 PolarHBondContact OD1-NE 3Å; D642-R646 IonicContact OD1-NH2 3.35Å; D642-R646 IonicContact OD2-NE 3.55Å
643	M	45.1	Very low	41.2	Very low	91 Å²	91	148.1 Å²	148.1	45%	0.448	69%	0.691	S	S	.	*	H	α-helix	trans	-63.5	-40	176.3	-67.1	-171.4	73.3	0	0	113.3	L639 N645 R646 L647	L639-M643 PolarHBondContact O-N 2.98Å; M643-N645 VanDerWaalsContact C-N 3.3Å; M643-N645 PolarHBondContact O-N 3.5Å; M643-R646 PolarHBondContact O-N 3.31Å; M643-L647 HydrophobicContact CE-CD1 4.4Å; M643-L647 PolarHBondContact O-N 2.96Å; M643-L647 VanDerWaalsContact O-N 3.08Å
644	K	42.7	Very low	40.7	Very low	168 Å²	168	144.9 Å²	144.9	73%	0.73	68%	0.683	S	S	*	*	H	α-helix	trans	-60.6	-38.5	178.7	-172.8	177.2	179	-178.3	0	112.3	A640 D642	A640-K644 PolarHBondContact O-N 2.91Å; A640-K644 VanDerWaalsContact O-N 3.12Å; D642-K644 PolarHBondContact O-N 3.1Å
645	N	46.1	Very low	40.5	Very low	118 Å²	118	143.4 Å²	143.4	63%	0.631	68%	0.68	S	S	*	*	H	α-helix	trans	-74	-38.2	177.3	-71.2	11	0	0	0	111.8	K641 D642 M643 L647	K641-N645 PolarHBondContact O-N 2.88Å; D642-N645 PolarHBondContact O-N 2.85Å; M643-N645 VanDerWaalsContact C-N 3.3Å; M643-N645 PolarHBondContact O-N 3.5Å; N645-L647 PolarHBondContact O-N 3.14Å
646	R	46.2	Very low	40.2	Very low	165 Å²	165	138.9 Å²	138.9	62%	0.623	67%	0.674	S	S	*	*	H	α-helix	trans	-71.3	-24.5	-178.8	-72.6	173.2	178.4	-84.6	-7.1	114.8	D642 M643 F649	D642-R646 WeakPolarHBondContact O-CG 3.38Å; D642-R646 PolarHBondContact O-N 2.81Å; D642-R646 VanDerWaalsContact O-N 3.1Å; D642-R646 WeakPolarHBondContact OD1-CD 3.26Å; D642-R646 IonicContact OD1-CZ 3.52Å; D642-R646 IonicContact OD1-NE 3.5Å; D642-R646 PolarHBondContact OD1-NE 3Å; D642-R646 IonicContact OD1-NH2 3.35Å; D642-R646 IonicContact OD2-NE 3.55Å; M643-R646 PolarHBondContact O-N 3.31Å; R646-F649 WeakPolarHBondContact O-CD1 3.4Å; R646-F649 WeakPolarHBondContact O-CE1 3.4Å
647	L	48.8	Very low	40.6	Very low	69 Å²	69	139.7 Å²	139.7	36%	0.361	68%	0.677	S	S	.	*	T	Hydrogen-bonded Turn	trans	-99.7	7	-178	-67.6	166.4	0	0	0	113.9	M643 N645 F649 L650	M643-L647 HydrophobicContact CE-CD1 4.4Å; M643-L647 PolarHBondContact O-N 2.96Å; M643-L647 VanDerWaalsContact O-N 3.08Å; N645-L647 PolarHBondContact O-N 3.14Å; L647-F649 HydrophobicContact CD2-CE1 4.41Å; L647-F649 PolarHBondContact O-N 2.93Å; L647-F649 VanDerWaalsContact O-N 3.11Å; L647-L650 HydrophobicContact CD2-CD1 3.94Å; L647-L650 PolarHBondContact O-N 2.94Å; L647-L650 VanDerWaalsContact O-N 3.14Å
648	A	44.7	Very low	40.3	Very low	69 Å²	69	133.6 Å²	133.6	57%	0.57	67%	0.669	S	S	*	*	G	3₁₀ helix	trans	-58.5	-25.9	-177.3	0	0	0	0	0	114.1	L650 R651	A648-L650 PolarHBondContact O-N 2.79Å; A648-R651 PolarHBondContact O-N 3.1Å
649	F	45.8	Very low	39.4	Very low	148 Å²	148	133.4 Å²	133.4	65%	0.649	68%	0.677	S	S	*	*	G	3₁₀ helix	trans	-68.3	-15.5	179	73.3	-87.6	0	0	0	114.5	R646 L647 R651	R646-F649 WeakPolarHBondContact O-CD1 3.4Å; R646-F649 WeakPolarHBondContact O-CE1 3.4Å; L647-F649 HydrophobicContact CD2-CE1 4.41Å; L647-F649 PolarHBondContact O-N 2.93Å; L647-F649 VanDerWaalsContact O-N 3.11Å; F649-R651 VanDerWaalsContact C-N 3.3Å; F649-R651 PolarHBondContact O-N 2.98Å
650	L	38.8	Very low	38.8	Very low	92 Å²	92	135.5 Å²	135.5	48%	0.482	69%	0.689	S	S	.	*	G	3₁₀ helix	trans	-85.5	6	-180	-66.2	175	0	0	0	114	L647 A648 R652	L647-L650 HydrophobicContact CD2-CD1 3.94Å; L647-L650 PolarHBondContact O-N 2.94Å; L647-L650 VanDerWaalsContact O-N 3.14Å; A648-L650 PolarHBondContact O-N 2.79Å; L650-R652 PolarHBondContact O-N 3.22Å
651	R	38.3	Very low	38.7	Very low	231 Å²	231	137.5 Å²	137.5	87%	0.872	70%	0.696	S	S	*	*			trans	-74.1	94.6	178.1	-174.1	175.8	175	178.5	-2.9	110.7	A648 F649	A648-R651 PolarHBondContact O-N 3.1Å; F649-R651 VanDerWaalsContact C-N 3.3Å; F649-R651 PolarHBondContact O-N 2.98Å
652	R	39.2	Very low	38.4	Very low	231 Å²	231	134.8 Å²	134.8	87%	0.872	70%	0.703	S	S	*	*			trans	-41.3	136.4	178.8	-69.5	-174.4	-74.2	-161.8	-3.5	114	L650	L650-R652 PolarHBondContact O-N 3.22Å
653	R	28.4	Very low	37.7	Very low	249 Å²	249	135.3 Å²	135.3	94%	0.94	72%	0.723	S	S	*	*			trans	-124.1	119.5	150.5	-174.5	176.2	-172.1	137.9	5.5	107.3
654	N	28.3	Very low	37.6	Very low	144 Å²	144	141.3 Å²	141.3	77%	0.77	75%	0.746	S	S	*	*			trans	-150.8	87	-177.4	-177.8	95.9	0	0	0	109.6
655	E	25.3	Very low	37.5	Very low	185 Å²	185	140.3 Å²	140.3	86%	0.864	75%	0.748	S	S	*	*			trans	-140.7	164.3	169.1	-70.6	-170.8	164.4	0	0	108.9
656	S	27.7	Very low	36.9	Very low	111 Å²	111	140.1 Å²	140.1	78%	0.776	75%	0.747	S	S	*	*			trans	-140.7	174.1	-174.1	-53.6	0	0	0	0	110.1
657	P	39.4	Very low	36.5	Very low	136 Å²	136	141 Å²	141	88%	0.883	76%	0.756	S	S	*	*				-83.1	141.8	-105.5	36.3	-30.2	0	0	0	114.3
658	G	32.2	Very low	36.1	Very low	65 Å²	65	142 Å²	142	67%	0.67	77%	0.768	S	S	*	*			trans	180	117	169.3	0	0	0	0	0	114.1
659	S	29	Very low	36	Very low	128 Å²	128	147 Å²	147	90%	0.895	78%	0.782	S	S	*	*			trans	62.3	149.2	169.8	67.9	0	0	0	0	119.4
660	N	31.9	Very low	35.8	Very low	154 Å²	154	148 Å²	148	82%	0.824	79%	0.786	S	S	*	*			trans	-101.9	170.5	170.6	-100.4	-35.8	0	0	0	109
661	P	43.3	Very low	36.2	Very low	115 Å²	115	148.2 Å²	148.2	75%	0.747	80%	0.795	S	S	*	*			cis	-135	171.5	16.3	39.5	-21.7	0	0	0	117.5
662	A	38.8	Very low	37.2	Very low	102 Å²	102	141 Å²	141	84%	0.843	78%	0.776	S	S	*	*			trans	52.1	98.9	148.3	0	0	0	0	0	120.5
663	G	32.7	Very low	38.6	Very low	71 Å²	71	135.1 Å²	135.1	73%	0.732	76%	0.757	S	S	*	*			trans	-128.1	122.9	163.8	0	0	0	0	0	112.6	L665	G663-L665 PolarHBondContact O-N 2.9Å
664	K	42.2	Very low	41.1	Very low	216 Å²	216	123.7 Å²	123.7	94%	0.939	72%	0.715	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.2	84.6	-171.1	-62.1	175.4	-178.4	175.4	0	114.3
665	L	40.9	Very low	43.7	Very low	148 Å²	148	120 Å²	120	78%	0.775	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-152.6	-23.6	154.7	-149.6	62.8	0	0	0	116	G663 K667 S668	G663-L665 PolarHBondContact O-N 2.9Å; L665-K667 PolarHBondContact O-N 3.47Å; L665-K667 VanDerWaalsContact O-N 3.13Å; L665-S668 PolarHBondContact O-N 3.32Å
666	D	32.8	Very low	46.5	Very low	113 Å²	113	113.2 Å²	113.2	60%	0.604	67%	0.67	S	S	*	*	G	3₁₀ helix	trans	-70.5	-9.5	-177.7	-150.8	-108.6	0	0	0	114.2	S668 K670	D666-S668 VanDerWaalsContact C-N 3.29Å; D666-S668 PolarHBondContact O-N 3Å; D666-K670 WeakPolarHBondContact OD1-CE 3.39Å; D666-K670 IonicContact OD1-NZ 2.76Å; D666-K670 PolarHBondContact OD1-NZ 2.63Å
667	K	39	Very low	49.2	Very low	184 Å²	184	114.9 Å²	114.9	80%	0.8	67%	0.665	S	S	*	*	G	3₁₀ helix	trans	-70.1	-18	177.2	-75.8	-166.9	171.8	-169.6	0	114.2	L665 M669	L665-K667 PolarHBondContact O-N 3.47Å; L665-K667 VanDerWaalsContact O-N 3.13Å; K667-M669 PolarHBondContact O-N 2.9Å
668	S	38.5	Very low	51.5	Low	89 Å²	89	112.2 Å²	112.2	62%	0.622	64%	0.641	S	S	*	*	G	3₁₀ helix	trans	-76.7	-12.7	-167.1	-168.3	0	0	0	0	116.1	L665 D666	L665-S668 PolarHBondContact O-N 3.32Å; D666-S668 VanDerWaalsContact C-N 3.29Å; D666-S668 PolarHBondContact O-N 3Å
669	M	44.4	Very low	54.2	Low	176 Å²	176	109.1 Å²	109.1	87%	0.867	61%	0.609	S	S	*	*	S	Bend	trans	-130.2	3.7	-177.5	-74.7	-174.8	165.2	0	0	114.2	K667	K667-M669 PolarHBondContact O-N 2.9Å
670	K	40.9	Very low	57.1	Low	168 Å²	168	107.3 Å²	107.3	73%	0.73	59%	0.589	S	S	*	*	S	Bend	trans	-99.3	9.8	176.8	-74.5	174.2	174.8	167.7	0	113.7	D666	D666-K670 WeakPolarHBondContact OD1-CE 3.39Å; D666-K670 IonicContact OD1-NZ 2.76Å; D666-K670 PolarHBondContact OD1-NZ 2.63Å
671	S	46.9	Very low	60	Low	96 Å²	96	105.5 Å²	105.5	67%	0.671	57%	0.574	S	S	*	*	S	Bend	trans	-142.3	36.2	-177.3	67.7	0	0	0	0	113.4
672	V	59.6	Low	62.4	Low	79 Å²	79	100.3 Å²	100.3	48%	0.479	54%	0.539	S	S	.	.			trans	-117.6	-7.2	176.7	-166.2	0	0	0	0	112.2	Y694	V672-Y694 WeakPolarHBondContact O-CD2 3.5Å
673	K	68.3	Low	64.8	Low	109 Å²	109	96.9 Å²	96.9	47%	0.474	52%	0.515	S	S	.	.	S	Bend	trans	-66.6	127.2	161.8	-163	175.8	-170.4	-172	0	106.7	Y694 L800 Q803	K673-Y694 HydrophobicContact CB-CE2 4.37Å; K673-Y694 HydrophobicContact CG-CE2 4.37Å; K673-L800 HydrophobicContact CG-CD2 4.17Å; K673-Q803 VanDerWaalsContact NZ-CD 3.29Å
674	P	80.8	Confident	67.6	Low	8 Å²	8	98.5 Å²	98.5	5%	0.052	51%	0.506	C	S	.	.	P	Polyproline II helix	trans	-62	156.4	-178	32	-41.9	0	0	0	110.7	E678 A679 W682 Y694 L800	P674-E678 HydrophobicContact CB-CB 4.17Å; P674-A679 HydrophobicContact CB-CB 4.39Å; P674-A679 HydrophobicContact CG-CB 4.09Å; P674-W682 HydrophobicContact CB-CH2 4.22Å; P674-W682 HydrophobicContact CB-CZ2 3.83Å; P674-W682 HydrophobicContact CG-CH2 3.63Å; P674-W682 HydrophobicContact CG-CZ2 3.78Å; P674-Y694 HydrophobicContact CG-CD1 4.43Å; P674-L800 HydrophobicContact CG-CD2 4.36Å
675	T	84.1	Confident	70.1	Confident	68 Å²	68	89.7 Å²	89.7	42%	0.417	47%	0.472	S	S	.	.	P	Polyproline II helix	trans	-63.4	151.7	158.8	61.4	0	0	0	0	109.6	E677 E678 A679	T675-E677 PolarHBondContact O-N 2.67Å; T675-E678 WeakPolarHBondContact CB-OE2 3.42Å; T675-E678 WeakPolarHBondContact CG2-OE2 3.46Å; T675-E678 PolarHBondContact N-OE2 3.25Å; T675-E678 PolarHBondContact O-N 2.76Å; T675-E678 VanDerWaalsContact O-N 3.08Å; T675-E678 WeakPolarHBondContact OG1-CB 3.29Å; T675-E678 VanDerWaalsContact OG1-CD 3.24Å; T675-E678 WeakPolarHBondContact OG1-CG 3.3Å; T675-E678 PolarHBondContact OG1-N 2.94Å; T675-E678 VanDerWaalsContact OG1-N 3.15Å; T675-E678 PolarHBondContact OG1-OE2 3.02Å; T675-A679 PolarHBondContact O-N 3.35Å
676	P	82.8	Confident	72.7	Confident	41 Å²	41	82.7 Å²	82.7	27%	0.266	44%	0.435	S	S	.	.	H	α-helix	trans	-54.2	-34.4	173	-29.9	38.6	0	0	0	113	A679 L680 Q803	P676-A679 PolarHBondContact O-N 3.16Å; P676-L680 WeakPolarHBondContact O-CB 3.31Å; P676-L680 VanDerWaalsContact O-CG 3.26Å; P676-L680 WeakPolarHBondContact O-CG 3.05Å; P676-L680 PolarHBondContact O-N 2.98Å; P676-Q803 HydrophobicContact CG-CB 4.13Å
677	E	84.8	Confident	75.7	Confident	146 Å²	146	81.7 Å²	81.7	68%	0.682	43%	0.43	S	S	*	.	H	α-helix	trans	-69.4	-31.9	177.8	-65	168.6	-148.3	0	0	113.3	T675 K681	T675-E677 PolarHBondContact O-N 2.67Å; E677-K681 WeakPolarHBondContact O-CE 3.45Å; E677-K681 WeakPolarHBondContact O-CG 3.47Å
678	E	87.2	Confident	78.3	Confident	80 Å²	80	77.6 Å²	77.6	37%	0.374	41%	0.412	S	S	.	.	H	α-helix	trans	-76.5	-37.6	170.7	-72	161.8	130.6	0	0	112.1	P674 T675 K681 W682	P674-E678 HydrophobicContact CB-CB 4.17Å; T675-E678 WeakPolarHBondContact CB-OE2 3.42Å; T675-E678 WeakPolarHBondContact CG2-OE2 3.46Å; T675-E678 PolarHBondContact N-OE2 3.25Å; T675-E678 PolarHBondContact O-N 2.76Å; T675-E678 VanDerWaalsContact O-N 3.08Å; T675-E678 WeakPolarHBondContact OG1-CB 3.29Å; T675-E678 VanDerWaalsContact OG1-CD 3.24Å; T675-E678 WeakPolarHBondContact OG1-CG 3.3Å; T675-E678 PolarHBondContact OG1-N 2.94Å; T675-E678 VanDerWaalsContact OG1-N 3.15Å; T675-E678 PolarHBondContact OG1-OE2 3.02Å; E678-K681 PolarHBondContact O-N 3.2Å; E678-W682 VanDerWaalsContact O-CD1 3.26Å; E678-W682 PolarHBondContact O-NE1 3.37Å; E678-W682 VanDerWaalsContact O-NE1 3.13Å
679	A	89	Confident	81	Confident	0 Å²	0	73.3 Å²	73.3	0%	0	38%	0.382	C	S	.	.	H	α-helix	trans	-65.3	-40.5	176.3	0	0	0	0	0	111.7	P674 T675 P676 K681 W682 Y797 L800 I801	P674-A679 HydrophobicContact CB-CB 4.39Å; P674-A679 HydrophobicContact CG-CB 4.09Å; T675-A679 PolarHBondContact O-N 3.35Å; P676-A679 PolarHBondContact O-N 3.16Å; A679-K681 VanDerWaalsContact C-N 3.26Å; A679-K681 PolarHBondContact O-N 2.67Å; A679-W682 HydrophobicContact CB-CH2 4.47Å; A679-W682 HydrophobicContact CB-CZ2 4.45Å; A679-W682 VanDerWaalsContact O-CB 3.26Å; A679-W682 WeakPolarHBondContact O-CB 3.35Å; A679-W682 PolarHBondContact O-N 3.2Å; A679-Y797 WeakPolarHBondContact O-CE2 3.46Å; A679-Y797 PolarHBondContact O-OH 2.97Å; A679-L800 HydrophobicContact CB-CB 4.2Å; A679-I801 HydrophobicContact CB-CG2 3.77Å
680	L	90.9	Very high	83.4	Confident	91 Å²	91	65.5 Å²	65.5	48%	0.476	34%	0.344	S	S	.	.	H	α-helix	trans	-57.2	-36	175.9	-80.2	165.9	0	0	0	113.1	P676 W682 G683 I801	P676-L680 WeakPolarHBondContact O-CB 3.31Å; P676-L680 VanDerWaalsContact O-CG 3.26Å; P676-L680 WeakPolarHBondContact O-CG 3.05Å; P676-L680 PolarHBondContact O-N 2.98Å; L680-W682 PolarHBondContact O-N 2.66Å; L680-W682 VanDerWaalsContact O-N 3.16Å; L680-G683 PolarHBondContact O-N 2.84Å; L680-I801 HydrophobicContact CD2-CB 4.14Å; L680-I801 HydrophobicContact CD2-CD1 4.11Å; L680-I801 HydrophobicContact CD2-CG2 3.94Å; L680-I801 HydrophobicContact CG-CB 4.21Å; L680-I801 HydrophobicContact CG-CG2 3.85Å
681	K	91.4	Very high	85.9	Confident	116 Å²	116	61.5 Å²	61.5	50%	0.504	34%	0.342	S	S	.	.	G	3₁₀ helix	trans	-63.4	-18.3	176.3	-64.7	166.7	-168.2	171.4	0	113	E677 E678 A679 G683 D684 K688	E677-K681 WeakPolarHBondContact O-CE 3.45Å; E677-K681 WeakPolarHBondContact O-CG 3.47Å; E678-K681 PolarHBondContact O-N 3.2Å; A679-K681 VanDerWaalsContact C-N 3.26Å; A679-K681 PolarHBondContact O-N 2.67Å; K681-G683 PolarHBondContact O-N 3.49Å; K681-D684 PolarHBondContact O-N 2.89Å; K681-K688 WeakPolarHBondContact O-CB 3.49Å; K681-K688 WeakPolarHBondContact O-CD 3.32Å
682	W	93.6	Very high	88.1	Confident	5 Å²	5	59.8 Å²	59.8	2%	0.019	32%	0.323	C	S	.	.	G	3₁₀ helix	trans	-76.9	-8.5	173.8	-48.3	-12.9	0	0	0	113	P674 E678 A679 L680 L689 H692 Y694 Y788 F791 Y797 L800	P674-W682 HydrophobicContact CB-CH2 4.22Å; P674-W682 HydrophobicContact CB-CZ2 3.83Å; P674-W682 HydrophobicContact CG-CH2 3.63Å; P674-W682 HydrophobicContact CG-CZ2 3.78Å; E678-W682 VanDerWaalsContact O-CD1 3.26Å; E678-W682 PolarHBondContact O-NE1 3.37Å; E678-W682 VanDerWaalsContact O-NE1 3.13Å; A679-W682 HydrophobicContact CB-CH2 4.47Å; A679-W682 HydrophobicContact CB-CZ2 4.45Å; A679-W682 VanDerWaalsContact O-CB 3.26Å; A679-W682 WeakPolarHBondContact O-CB 3.35Å; A679-W682 PolarHBondContact O-N 3.2Å; L680-W682 PolarHBondContact O-N 2.66Å; L680-W682 VanDerWaalsContact O-N 3.16Å; W682-L689 HydrophobicContact CB-CB 3.98Å; W682-L689 HydrophobicContact CB-CD1 3.79Å; W682-L689 HydrophobicContact CB-CG 4.45Å; W682-L689 HydrophobicContact CD2-CD1 3.64Å; W682-L689 HydrophobicContact CE3-CD1 3.38Å; W682-L689 HydrophobicContact CG-CB 4.38Å; W682-L689 HydrophobicContact CG-CD1 3.82Å; W682-L689 HydrophobicContact CZ3-CD1 4.2Å; W682-H692 AromaticContact CE2-ND1 3.66Å; W682-H692 HydrophobicContact CZ2-CB 4.49Å; W682-H692 AromaticContact CZ2-CE1 3.78Å; W682-H692 AromaticContact CZ2-CG 3.99Å; W682-H692 AromaticContact CZ2-ND1 3.12Å; W682-H692 WeakPolarHBondContact CZ2-ND1 3.32Å; W682-H692 AromaticContact NE1-CG 3.78Å; W682-H692 AromaticContact NE1-ND1 3.81Å; W682-Y694 AromaticContact CH2-CD1 3.78Å; W682-Y694 HydrophobicContact CH2-CD1 3.78Å; W682-Y694 HydrophobicContact CH2-CG 4.46Å; W682-Y694 HydrophobicContact CZ3-CD1 4.47Å; W682-Y788 WeakPolarHBondContact O-CE2 3.34Å; W682-Y788 PolarHBondContact O-OH 2.84Å; W682-F791 HydrophobicContact CE3-CE1 4.47Å; W682-F791 HydrophobicContact CE3-CZ 4.41Å; W682-Y797 HydrophobicContact CB-CE2 4.26Å; W682-Y797 HydrophobicContact CE3-CD2 4.24Å; W682-Y797 HydrophobicContact CE3-CE2 4.17Å; W682-L800 HydrophobicContact CH2-CD1 4.17Å; W682-L800 HydrophobicContact CZ3-CD1 3.76Å
683	G	90.2	Very high	89.6	Confident	31 Å²	31	64.8 Å²	64.8	32%	0.32	34%	0.339	S	S	.	.	G	3₁₀ helix	trans	-77.2	-24.3	169.2	0	0	0	0	0	113.3	L680 K681 Y788	L680-G683 PolarHBondContact O-N 2.84Å; K681-G683 PolarHBondContact O-N 3.49Å; G683-Y788 PolarHBondContact O-OH 3.39Å
684	D	91.6	Very high	90.8	Very high	105 Å²	105	63.2 Å²	63.2	56%	0.561	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.8	-40.7	-175.4	-57.2	-19.9	0	0	0	113	K681 K688	K681-D684 PolarHBondContact O-N 2.89Å; D684-K688 HydrophobicContact CB-CD 3.72Å; D684-K688 IonicContact OD2-NZ 2.68Å; D684-K688 PolarHBondContact OD2-NZ 3.29Å
685	S	95.2	Very high	91.3	Very high	31 Å²	31	62.9 Å²	62.9	22%	0.217	33%	0.328	C	S	.	.			trans	-161	152	176.3	72.4	0	0	0	0	113.1	D687 K688 L689 Y788	S685-D687 VanDerWaalsContact C-N 3.27Å; S685-D687 PolarHBondContact O-N 2.94Å; S685-K688 PolarHBondContact O-N 2.88Å; S685-K688 VanDerWaalsContact O-N 3.16Å; S685-K688 PolarHBondContact OG-N 3.38Å; S685-L689 PolarHBondContact O-N 3.28Å; S685-Y788 VanDerWaalsContact CA-OH 3.26Å; S685-Y788 WeakPolarHBondContact CA-OH 3.26Å; S685-Y788 PolarHBondContact N-OH 3.23Å; S685-Y788 VanDerWaalsContact N-OH 3.14Å
686	L	95.8	Very high	91.8	Very high	0 Å²	0	61.7 Å²	61.7	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-61.9	-34	175.1	174.5	61.6	0	0	0	111.6	K688 L689 L690 F699 Y780 M783 E784 Y788	L686-K688 VanDerWaalsContact C-N 3.34Å; L686-K688 PolarHBondContact O-N 3.29Å; L686-L689 HydrophobicContact CD1-CB 4.47Å; L686-L689 HydrophobicContact CD1-CD2 3.98Å; L686-L689 WeakPolarHBondContact O-CB 3.33Å; L686-L689 PolarHBondContact O-N 3.23Å; L686-L689 VanDerWaalsContact O-N 3.16Å; L686-L690 HydrophobicContact CD1-CD1 4.02Å; L686-L690 HydrophobicContact CD1-CD2 4.08Å; L686-L690 HydrophobicContact CD1-CG 3.76Å; L686-L690 HydrophobicContact CD2-CD1 4.46Å; L686-L690 HydrophobicContact CG-CD1 3.89Å; L686-L690 HydrophobicContact CG-CG 4.09Å; L686-L690 VanDerWaalsContact O-CG 3.32Å; L686-L690 WeakPolarHBondContact O-CG 3.4Å; L686-L690 PolarHBondContact O-N 2.81Å; L686-F699 HydrophobicContact CD1-CD1 4.18Å; L686-F699 HydrophobicContact CD1-CE1 3.74Å; L686-F699 HydrophobicContact CD1-CZ 4.08Å; L686-Y780 HydrophobicContact CB-CE2 4.22Å; L686-Y780 WeakPolarHBondContact CB-OH 3.43Å; L686-Y780 HydrophobicContact CD2-CD2 3.96Å; L686-Y780 HydrophobicContact CD2-CE2 3.6Å; L686-Y780 HydrophobicContact CG-CE2 3.73Å; L686-M783 HydrophobicContact CD2-CB 3.95Å; L686-E784 HydrophobicContact CD2-CB 3.94Å; L686-Y788 HydrophobicContact CB-CD1 4.39Å; L686-Y788 HydrophobicContact CB-CD2 4Å; L686-Y788 HydrophobicContact CB-CE2 4.1Å; L686-Y788 HydrophobicContact CB-CG 4.14Å; L686-Y788 HydrophobicContact CD1-CD2 3.83Å; L686-Y788 HydrophobicContact CD1-CE2 4.46Å; L686-Y788 HydrophobicContact CD1-CG 4.29Å; L686-Y788 HydrophobicContact CG-CD2 4.48Å
687	D	95.3	Very high	92.3	Very high	92 Å²	92	62.5 Å²	62.5	49%	0.492	33%	0.33	S	S	.	.	H	α-helix	trans	-55.4	-44.4	172.1	-66.4	-63.9	0	0	0	113	S685 L689 L690 A691 Y780	S685-D687 VanDerWaalsContact C-N 3.27Å; S685-D687 PolarHBondContact O-N 2.94Å; D687-L689 VanDerWaalsContact C-N 3.33Å; D687-L689 PolarHBondContact O-N 3.16Å; D687-L690 PolarHBondContact O-N 3.47Å; D687-A691 VanDerWaalsContact O-CB 3.22Å; D687-A691 WeakPolarHBondContact O-CB 3.23Å; D687-A691 PolarHBondContact O-N 3.33Å; D687-Y780 PolarHBondContact N-OH 3.44Å; D687-Y780 VanDerWaalsContact N-OH 3.17Å; D687-Y780 PolarHBondContact OD1-OH 3.48Å; D687-Y780 PolarHBondContact OD2-OH 2.89Å
688	K	94.1	Very high	92.7	Very high	98 Å²	98	56.2 Å²	56.2	43%	0.426	30%	0.302	S	S	.	.	H	α-helix	trans	-65.9	-36.2	178.2	-74.5	165.4	173.3	176.5	0	111.8	K681 D684 S685 L686 H692	K681-K688 WeakPolarHBondContact O-CB 3.49Å; K681-K688 WeakPolarHBondContact O-CD 3.32Å; D684-K688 HydrophobicContact CB-CD 3.72Å; D684-K688 IonicContact OD2-NZ 2.68Å; D684-K688 PolarHBondContact OD2-NZ 3.29Å; S685-K688 PolarHBondContact O-N 2.88Å; S685-K688 VanDerWaalsContact O-N 3.16Å; S685-K688 PolarHBondContact OG-N 3.38Å; L686-K688 VanDerWaalsContact C-N 3.34Å; L686-K688 PolarHBondContact O-N 3.29Å; K688-H692 PolarHBondContact O-N 3.09Å
689	L	95.1	Very high	93.1	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-65.2	-46.9	173.6	178.5	62.2	0	0	0	111.8	W682 S685 L686 D687 H692 G695 L696 F699 Y788 F791	W682-L689 HydrophobicContact CB-CB 3.98Å; W682-L689 HydrophobicContact CB-CD1 3.79Å; W682-L689 HydrophobicContact CB-CG 4.45Å; W682-L689 HydrophobicContact CD2-CD1 3.64Å; W682-L689 HydrophobicContact CE3-CD1 3.38Å; W682-L689 HydrophobicContact CG-CB 4.38Å; W682-L689 HydrophobicContact CG-CD1 3.82Å; W682-L689 HydrophobicContact CZ3-CD1 4.2Å; S685-L689 PolarHBondContact O-N 3.28Å; L686-L689 HydrophobicContact CD1-CB 4.47Å; L686-L689 HydrophobicContact CD1-CD2 3.98Å; L686-L689 WeakPolarHBondContact O-CB 3.33Å; L686-L689 PolarHBondContact O-N 3.23Å; L686-L689 VanDerWaalsContact O-N 3.16Å; D687-L689 VanDerWaalsContact C-N 3.33Å; D687-L689 PolarHBondContact O-N 3.16Å; L689-H692 PolarHBondContact O-N 3.44Å; L689-G695 VanDerWaalsContact CD1-CA 3.5Å; L689-G695 CarbonylContact O-C 3.54Å; L689-G695 WeakPolarHBondContact O-CA 3.29Å; L689-L696 PolarHBondContact O-N 2.92Å; L689-L696 VanDerWaalsContact O-N 3.1Å; L689-F699 HydrophobicContact CD2-CB 3.93Å; L689-F699 HydrophobicContact CD2-CD1 4.32Å; L689-F699 HydrophobicContact CD2-CD2 3.91Å; L689-F699 HydrophobicContact CD2-CG 3.8Å; L689-F699 HydrophobicContact CG-CB 4.26Å; L689-Y788 HydrophobicContact CB-CE2 4.41Å; L689-Y788 HydrophobicContact CD2-CD2 3.7Å; L689-Y788 HydrophobicContact CD2-CE2 3.91Å; L689-F791 HydrophobicContact CD1-CD1 4.45Å; L689-F791 HydrophobicContact CD1-CE1 3.56Å; L689-F791 HydrophobicContact CD1-CZ 3.93Å; L689-F791 HydrophobicContact CD2-CD1 3.66Å; L689-F791 HydrophobicContact CD2-CE1 3.61Å; L689-F791 HydrophobicContact CD2-CZ 4.44Å; L689-F791 HydrophobicContact CG-CE1 4.27Å
690	L	95.1	Very high	93.4	Very high	11 Å²	11	56.3 Å²	56.3	6%	0.058	30%	0.299	C	S	.	.	H	α-helix	trans	-74.1	-33.4	-176.8	-64.8	-178.7	0	0	0	113.1	L686 D687 H692 L696 F699 L712 W715 Y780	L686-L690 HydrophobicContact CD1-CD1 4.02Å; L686-L690 HydrophobicContact CD1-CD2 4.08Å; L686-L690 HydrophobicContact CD1-CG 3.76Å; L686-L690 HydrophobicContact CD2-CD1 4.46Å; L686-L690 HydrophobicContact CG-CD1 3.89Å; L686-L690 HydrophobicContact CG-CG 4.09Å; L686-L690 VanDerWaalsContact O-CG 3.32Å; L686-L690 WeakPolarHBondContact O-CG 3.4Å; L686-L690 PolarHBondContact O-N 2.81Å; D687-L690 PolarHBondContact O-N 3.47Å; L690-H692 VanDerWaalsContact C-N 3.29Å; L690-H692 PolarHBondContact O-N 3.34Å; L690-L696 HydrophobicContact CD2-CD1 3.62Å; L690-F699 HydrophobicContact CD2-CD1 3.85Å; L690-F699 HydrophobicContact CD2-CE1 4.34Å; L690-L712 HydrophobicContact CD2-CD1 3.63Å; L690-W715 HydrophobicContact CB-CH2 4.34Å; L690-W715 HydrophobicContact CB-CZ3 4.46Å; L690-W715 HydrophobicContact CD1-CD2 4.3Å; L690-W715 HydrophobicContact CD1-CE3 4.18Å; L690-W715 HydrophobicContact CD1-CH2 3.89Å; L690-W715 HydrophobicContact CD1-CZ2 4Å; L690-W715 HydrophobicContact CD1-CZ3 3.99Å; L690-Y780 HydrophobicContact CD1-CD2 4.39Å; L690-Y780 HydrophobicContact CD1-CE2 4.06Å
691	A	92.9	Very high	93.4	Very high	85 Å²	85	54.1 Å²	54.1	70%	0.702	29%	0.294	S	S	*	.	H	α-helix	trans	-65.5	-32	175	0	0	0	0	0	112.3	D687	D687-A691 VanDerWaalsContact O-CB 3.22Å; D687-A691 WeakPolarHBondContact O-CB 3.23Å; D687-A691 PolarHBondContact O-N 3.33Å
692	H	93.1	Very high	93.5	Very high	59 Å²	59	49.1 Å²	49.1	27%	0.273	27%	0.272	S	S	.	.	S	Bend	trans	-83.2	124.1	179.5	-170	-106.2	0	0	0	112.4	W682 K688 L689 L690 Y694 G695 L696	W682-H692 AromaticContact CE2-ND1 3.66Å; W682-H692 HydrophobicContact CZ2-CB 4.49Å; W682-H692 AromaticContact CZ2-CE1 3.78Å; W682-H692 AromaticContact CZ2-CG 3.99Å; W682-H692 AromaticContact CZ2-ND1 3.12Å; W682-H692 WeakPolarHBondContact CZ2-ND1 3.32Å; W682-H692 AromaticContact NE1-CG 3.78Å; W682-H692 AromaticContact NE1-ND1 3.81Å; K688-H692 PolarHBondContact O-N 3.09Å; L689-H692 PolarHBondContact O-N 3.44Å; L690-H692 VanDerWaalsContact C-N 3.29Å; L690-H692 PolarHBondContact O-N 3.34Å; H692-Y694 VanDerWaalsContact C-N 3.31Å; H692-Y694 PolarHBondContact ND1-N 3.46Å; H692-Y694 PolarHBondContact O-N 3.08Å; H692-G695 PolarHBondContact ND1-N 3.35Å; H692-G695 WeakPolarHBondContact O-CA 3.16Å; H692-G695 PolarHBondContact O-N 3.01Å; H692-L696 PolarHBondContact O-N 3.27Å
693	K	90.9	Very high	93.5	Very high	184 Å²	184	48.9 Å²	48.9	80%	0.8	27%	0.271	S	S	*	.	H	α-helix	trans	-57	-36.7	-174.2	-69.1	178.5	-179.3	171.2	0	114.4	A697	K693-A697 WeakPolarHBondContact O-CB 3.36Å; K693-A697 PolarHBondContact O-N 2.85Å
694	Y	92.6	Very high	93.5	Very high	77 Å²	77	52.8 Å²	52.8	30%	0.302	28%	0.276	S	S	.	.	H	α-helix	trans	-78.2	-33.6	173.9	-163	-72.9	0	0	0	111.5	V672 K673 P674 W682 H692 A697 A698 L800	V672-Y694 WeakPolarHBondContact O-CD2 3.5Å; K673-Y694 HydrophobicContact CB-CE2 4.37Å; K673-Y694 HydrophobicContact CG-CE2 4.37Å; P674-Y694 HydrophobicContact CG-CD1 4.43Å; W682-Y694 AromaticContact CH2-CD1 3.78Å; W682-Y694 HydrophobicContact CH2-CD1 3.78Å; W682-Y694 HydrophobicContact CH2-CG 4.46Å; W682-Y694 HydrophobicContact CZ3-CD1 4.47Å; H692-Y694 VanDerWaalsContact C-N 3.31Å; H692-Y694 PolarHBondContact ND1-N 3.46Å; H692-Y694 PolarHBondContact O-N 3.08Å; Y694-A697 PolarHBondContact O-N 3.45Å; Y694-A698 HydrophobicContact CD1-CB 4.29Å; Y694-A698 HydrophobicContact CE1-CB 4.35Å; Y694-A698 WeakPolarHBondContact O-CB 3.18Å; Y694-A698 PolarHBondContact O-N 3.44Å; Y694-L800 HydrophobicContact CD1-CD1 4.41Å; Y694-L800 HydrophobicContact CE1-CD1 3.88Å; Y694-L800 HydrophobicContact CE1-CD2 3.83Å
695	G	93	Very high	93.2	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-62.7	-50.9	178.8	0	0	0	0	0	111.2	L689 H692 A697 A698 F699	L689-G695 VanDerWaalsContact CD1-CA 3.5Å; L689-G695 CarbonylContact O-C 3.54Å; L689-G695 WeakPolarHBondContact O-CA 3.29Å; H692-G695 PolarHBondContact ND1-N 3.35Å; H692-G695 WeakPolarHBondContact O-CA 3.16Å; H692-G695 PolarHBondContact O-N 3.01Å; G695-A697 VanDerWaalsContact C-N 3.26Å; G695-A697 PolarHBondContact O-N 3Å; G695-A698 PolarHBondContact O-N 3.32Å; G695-F699 WeakPolarHBondContact O-CB 3.31Å; G695-F699 PolarHBondContact O-N 3.5Å
696	L	94.3	Very high	92.9	Very high	43 Å²	43	53.3 Å²	53.3	23%	0.225	28%	0.279	C	S	.	.	H	α-helix	trans	-52.9	-41	170.3	-176.1	67.4	0	0	0	113	L689 L690 H692 R700 L712 L716	L689-L696 PolarHBondContact O-N 2.92Å; L689-L696 VanDerWaalsContact O-N 3.1Å; L690-L696 HydrophobicContact CD2-CD1 3.62Å; H692-L696 PolarHBondContact O-N 3.27Å; L696-R700 VanDerWaalsContact O-CB 3.27Å; L696-R700 WeakPolarHBondContact O-CB 3.38Å; L696-R700 PolarHBondContact O-N 3.46Å; L696-L712 HydrophobicContact CD1-CD1 3.89Å; L696-L712 HydrophobicContact CD1-CD2 4.11Å; L696-L712 HydrophobicContact CD1-CG 4.41Å; L696-L716 HydrophobicContact CD1-CD1 4.34Å; L696-L716 HydrophobicContact CD1-CD2 4.24Å; L696-L716 HydrophobicContact CD2-CD2 4.28Å
697	A	93.2	Very high	92.4	Very high	59 Å²	59	61.9 Å²	61.9	49%	0.488	32%	0.316	S	S	.	.	H	α-helix	trans	-71.7	-40.9	179.5	0	0	0	0	0	112.7	K693 Y694 G695 A701	K693-A697 WeakPolarHBondContact O-CB 3.36Å; K693-A697 PolarHBondContact O-N 2.85Å; Y694-A697 PolarHBondContact O-N 3.45Å; G695-A697 VanDerWaalsContact C-N 3.26Å; G695-A697 PolarHBondContact O-N 3Å; A697-A701 WeakPolarHBondContact O-CB 3.2Å; A697-A701 PolarHBondContact O-N 3.44Å
698	A	93	Very high	92.3	Very high	13 Å²	13	58.1 Å²	58.1	11%	0.107	30%	0.297	C	S	.	.	H	α-helix	trans	-67.2	-44.6	175.9	0	0	0	0	0	111.3	Y694 G695 R700 A701 F702 F791	Y694-A698 HydrophobicContact CD1-CB 4.29Å; Y694-A698 HydrophobicContact CE1-CB 4.35Å; Y694-A698 WeakPolarHBondContact O-CB 3.18Å; Y694-A698 PolarHBondContact O-N 3.44Å; G695-A698 PolarHBondContact O-N 3.32Å; A698-R700 PolarHBondContact O-N 2.9Å; A698-A701 WeakPolarHBondContact O-CB 3.36Å; A698-A701 PolarHBondContact O-N 3.02Å; A698-A701 VanDerWaalsContact O-N 3.12Å; A698-F702 PolarHBondContact O-N 3.3Å; A698-F791 HydrophobicContact CB-CE2 4.06Å; A698-F791 HydrophobicContact CB-CZ 4.1Å
699	F	96.1	Very high	92.4	Very high	0 Å²	0	56 Å²	56	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-63.1	-42	175.9	-168.8	-129.1	0	0	0	111.6	L686 L689 L690 G695 A701 F702 L703 L712 M783 F791	L686-F699 HydrophobicContact CD1-CD1 4.18Å; L686-F699 HydrophobicContact CD1-CE1 3.74Å; L686-F699 HydrophobicContact CD1-CZ 4.08Å; L689-F699 HydrophobicContact CD2-CB 3.93Å; L689-F699 HydrophobicContact CD2-CD1 4.32Å; L689-F699 HydrophobicContact CD2-CD2 3.91Å; L689-F699 HydrophobicContact CD2-CG 3.8Å; L689-F699 HydrophobicContact CG-CB 4.26Å; L690-F699 HydrophobicContact CD2-CD1 3.85Å; L690-F699 HydrophobicContact CD2-CE1 4.34Å; G695-F699 WeakPolarHBondContact O-CB 3.31Å; G695-F699 PolarHBondContact O-N 3.5Å; F699-A701 VanDerWaalsContact C-N 3.28Å; F699-A701 PolarHBondContact O-N 3.35Å; F699-F702 HydrophobicContact CD2-CD1 4.31Å; F699-F702 HydrophobicContact CE2-CD1 4.34Å; F699-F702 WeakPolarHBondContact O-CB 3.48Å; F699-F702 PolarHBondContact O-N 3.06Å; F699-L703 HydrophobicContact CD1-CD1 4.01Å; F699-L703 HydrophobicContact CD2-CG 4.47Å; F699-L703 HydrophobicContact CE1-CD1 3.79Å; F699-L703 HydrophobicContact CE1-CG 4.35Å; F699-L703 HydrophobicContact CE2-CD2 4.18Å; F699-L703 HydrophobicContact CE2-CG 4.26Å; F699-L703 HydrophobicContact CG-CD1 4.5Å; F699-L703 HydrophobicContact CZ-CD1 4.09Å; F699-L703 HydrophobicContact CZ-CD2 4.03Å; F699-L703 HydrophobicContact CZ-CG 4.2Å; F699-L703 WeakPolarHBondContact O-CG 3.39Å; F699-L703 PolarHBondContact O-N 3.48Å; F699-L712 HydrophobicContact CD1-CD2 3.99Å; F699-M783 HydrophobicContact CE1-SD 4.06Å; F699-M783 HydrophobicContact CZ-CB 4.32Å; F699-F791 HydrophobicContact CD2-CB 3.82Å; F699-F791 HydrophobicContact CD2-CD1 4.18Å; F699-F791 HydrophobicContact CD2-CD2 4.03Å; F699-F791 AromaticContact CD2-CG 3.73Å; F699-F791 HydrophobicContact CD2-CG 3.73Å; F699-F791 HydrophobicContact CE2-CB 3.93Å; F699-F791 HydrophobicContact CE2-CG 4.33Å
700	R	94.3	Very high	92.4	Very high	83 Å²	83	57.8 Å²	57.8	31%	0.313	30%	0.297	S	S	.	.	H	α-helix	trans	-69.6	-20.8	173.6	-163.4	171.9	171.6	-164.4	-1.5	114	L696 A698 R704 L712 E713	L696-R700 VanDerWaalsContact O-CB 3.27Å; L696-R700 WeakPolarHBondContact O-CB 3.38Å; L696-R700 PolarHBondContact O-N 3.46Å; A698-R700 PolarHBondContact O-N 2.9Å; R700-R704 WeakPolarHBondContact O-CG 3.44Å; R700-R704 PolarHBondContact O-NH1 2.94Å; R700-L712 HydrophobicContact CB-CD2 3.65Å; R700-L712 HydrophobicContact CG-CD2 4.01Å; R700-E713 IonicContact CZ-OE1 2.98Å; R700-E713 IonicContact NE-OE1 3.22Å; R700-E713 PolarHBondContact NE-OE1 3.21Å; R700-E713 IonicContact NH2-OE1 3.57Å; R700-E713 PolarHBondContact NH2-OE1 2.83Å
701	A	90.3	Very high	92.5	Very high	44 Å²	44	57.7 Å²	57.7	36%	0.364	30%	0.297	S	S	.	.	H	α-helix	trans	-76.3	-42.3	169.9	0	0	0	0	0	110.7	A697 A698 F699 R704	A697-A701 WeakPolarHBondContact O-CB 3.2Å; A697-A701 PolarHBondContact O-N 3.44Å; A698-A701 WeakPolarHBondContact O-CB 3.36Å; A698-A701 PolarHBondContact O-N 3.02Å; A698-A701 VanDerWaalsContact O-N 3.12Å; F699-A701 VanDerWaalsContact C-N 3.28Å; F699-A701 PolarHBondContact O-N 3.35Å; A701-R704 PolarHBondContact O-N 3.45Å
702	F	94.3	Very high	92.7	Very high	12 Å²	12	53.6 Å²	53.6	5%	0.053	26%	0.263	C	S	.	.	H	α-helix	trans	-62.5	-49.8	175.5	173	-95	0	0	0	112.8	A698 F699 R704 T705 E706 S787 R790 F791 L796	A698-F702 PolarHBondContact O-N 3.3Å; F699-F702 HydrophobicContact CD2-CD1 4.31Å; F699-F702 HydrophobicContact CE2-CD1 4.34Å; F699-F702 WeakPolarHBondContact O-CB 3.48Å; F699-F702 PolarHBondContact O-N 3.06Å; F702-R704 PolarHBondContact O-N 3.37Å; F702-R704 VanDerWaalsContact O-N 3.13Å; F702-T705 WeakPolarHBondContact O-CA 3.48Å; F702-T705 PolarHBondContact O-N 2.86Å; F702-T705 PolarHBondContact O-OG1 3.34Å; F702-E706 VanDerWaalsContact CE1-CD 3.41Å; F702-E706 HydrophobicContact CE1-CG 4.07Å; F702-E706 WeakPolarHBondContact CE1-OE2 3.38Å; F702-E706 HydrophobicContact CE2-CG 4.35Å; F702-E706 HydrophobicContact CZ-CG 3.88Å; F702-E706 VanDerWaalsContact CZ-OE1 3.22Å; F702-E706 WeakPolarHBondContact CZ-OE1 3.22Å; F702-E706 WeakPolarHBondContact CZ-OE2 3.29Å; F702-E706 PolarHBondContact O-N 3.16Å; F702-S787 WeakPolarHBondContact CE1-O 3.44Å; F702-R790 HydrophobicContact CE1-CB 4.28Å; F702-R790 HydrophobicContact CZ-CB 3.67Å; F702-F791 HydrophobicContact CB-CD2 3.7Å; F702-F791 HydrophobicContact CB-CE2 4.34Å; F702-F791 HydrophobicContact CD1-CB 3.71Å; F702-F791 HydrophobicContact CD1-CD2 4.14Å; F702-F791 HydrophobicContact CD1-CG 4.4Å; F702-F791 HydrophobicContact CD2-CB 4.48Å; F702-F791 HydrophobicContact CD2-CD2 4.27Å; F702-F791 HydrophobicContact CE1-CB 3.81Å; F702-F791 HydrophobicContact CG-CB 4.07Å; F702-F791 AromaticContact CG-CD2 3.76Å; F702-F791 HydrophobicContact CG-CD2 3.76Å; F702-F791 HydrophobicContact CG-CG 4.42Å; F702-F791 HydrophobicContact CZ-CB 4.24Å; F702-F791 VanDerWaalsContact CZ-N 3.33Å; F702-L796 HydrophobicContact CB-CD1 4.25Å
703	L	94.1	Very high	92.9	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-57.9	-31.3	179.3	-69.3	173.5	0	0	0	113	F699 T705 E706 F707 S708 E709 L712 M783 S787	F699-L703 HydrophobicContact CD1-CD1 4.01Å; F699-L703 HydrophobicContact CD2-CG 4.47Å; F699-L703 HydrophobicContact CE1-CD1 3.79Å; F699-L703 HydrophobicContact CE1-CG 4.35Å; F699-L703 HydrophobicContact CE2-CD2 4.18Å; F699-L703 HydrophobicContact CE2-CG 4.26Å; F699-L703 HydrophobicContact CG-CD1 4.5Å; F699-L703 HydrophobicContact CZ-CD1 4.09Å; F699-L703 HydrophobicContact CZ-CD2 4.03Å; F699-L703 HydrophobicContact CZ-CG 4.2Å; F699-L703 WeakPolarHBondContact O-CG 3.39Å; F699-L703 PolarHBondContact O-N 3.48Å; L703-T705 VanDerWaalsContact C-N 3.32Å; L703-T705 PolarHBondContact O-N 3.11Å; L703-E706 CarbonylContact O-C 3.58Å; L703-E706 PolarHBondContact O-N 3.38Å; L703-E706 VanDerWaalsContact O-N 3.15Å; L703-F707 PolarHBondContact O-N 3.45Å; L703-S708 WeakPolarHBondContact CD2-OG 3.49Å; L703-S708 PolarHBondContact O-N 3.46Å; L703-S708 PolarHBondContact O-OG 2.93Å; L703-E709 HydrophobicContact CB-CB 4.09Å; L703-L712 HydrophobicContact CD1-CB 3.54Å; L703-L712 HydrophobicContact CD1-CD2 3.83Å; L703-L712 HydrophobicContact CD1-CG 4.33Å; L703-M783 HydrophobicContact CD1-SD 4.37Å; L703-S787 VanDerWaalsContact CD2-CB 3.45Å
704	R	89.3	Confident	93.2	Very high	112 Å²	112	43.5 Å²	43.5	42%	0.423	22%	0.219	S	C	.	.	H	α-helix	trans	-67.2	-29	172.8	-75.4	-172.7	-176.6	108.7	-3.6	114.2	R700 A701 F702 E706 E709	R700-R704 WeakPolarHBondContact O-CG 3.44Å; R700-R704 PolarHBondContact O-NH1 2.94Å; A701-R704 PolarHBondContact O-N 3.45Å; F702-R704 PolarHBondContact O-N 3.37Å; F702-R704 VanDerWaalsContact O-N 3.13Å; R704-E706 VanDerWaalsContact C-N 3.27Å; R704-E709 HydrophobicContact CG-CB 4.03Å; R704-E709 HydrophobicContact CG-CG 4.07Å; R704-E709 WeakPolarHBondContact CG-OE1 3.48Å; R704-E709 IonicContact NE-OE1 3.77Å
705	T	84.7	Confident	93.5	Very high	95 Å²	95	41.7 Å²	41.7	58%	0.583	21%	0.211	S	C	*	.	H	α-helix	trans	-77.3	-18.7	173.2	61.8	0	0	0	0	112.1	F702 L703	F702-T705 WeakPolarHBondContact O-CA 3.48Å; F702-T705 PolarHBondContact O-N 2.86Å; F702-T705 PolarHBondContact O-OG1 3.34Å; L703-T705 VanDerWaalsContact C-N 3.32Å; L703-T705 PolarHBondContact O-N 3.11Å
706	E	89.6	Confident	93.7	Very high	52 Å²	52	43.9 Å²	43.9	24%	0.243	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.5	9.7	174.1	-56.5	-161.4	134.8	0	0	113.4	F702 L703 R704 S708 R790	F702-E706 VanDerWaalsContact CE1-CD 3.41Å; F702-E706 HydrophobicContact CE1-CG 4.07Å; F702-E706 WeakPolarHBondContact CE1-OE2 3.38Å; F702-E706 HydrophobicContact CE2-CG 4.35Å; F702-E706 HydrophobicContact CZ-CG 3.88Å; F702-E706 VanDerWaalsContact CZ-OE1 3.22Å; F702-E706 WeakPolarHBondContact CZ-OE1 3.22Å; F702-E706 WeakPolarHBondContact CZ-OE2 3.29Å; F702-E706 PolarHBondContact O-N 3.16Å; L703-E706 CarbonylContact O-C 3.58Å; L703-E706 PolarHBondContact O-N 3.38Å; L703-E706 VanDerWaalsContact O-N 3.15Å; R704-E706 VanDerWaalsContact C-N 3.27Å; E706-S708 VanDerWaalsContact C-N 3.28Å; E706-S708 PolarHBondContact O-N 3.05Å; E706-R790 IonicContact OE1-CZ 2.67Å; E706-R790 IonicContact OE1-NE 3.87Å; E706-R790 IonicContact OE1-NH1 3.83Å; E706-R790 PolarHBondContact OE1-NH1 3.28Å; E706-R790 IonicContact OE2-CZ 3.38Å; E706-R790 IonicContact OE2-NE 3.89Å; E706-R790 IonicContact OE2-NH1 2.71Å; E706-R790 PolarHBondContact OE2-NH1 3.05Å; E706-R790 IonicContact OE2-NH2 3.88Å
707	F	85.2	Confident	93.8	Very high	181 Å²	181	42.3 Å²	42.3	79%	0.794	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	47.8	44	-177.6	-55.3	-87.8	0	0	0	114.3	L703	L703-F707 PolarHBondContact O-N 3.45Å
708	S	94.3	Very high	94	Very high	13 Å²	13	39.6 Å²	39.6	9%	0.091	19%	0.193	C	C	.	.			trans	-135.6	19.7	-173.8	53.7	0	0	0	0	113.8	L703 E706 E710 N711	L703-S708 WeakPolarHBondContact CD2-OG 3.49Å; L703-S708 PolarHBondContact O-N 3.46Å; L703-S708 PolarHBondContact O-OG 2.93Å; E706-S708 VanDerWaalsContact C-N 3.28Å; E706-S708 PolarHBondContact O-N 3.05Å; S708-E710 VanDerWaalsContact CA-OE2 3.22Å; S708-E710 WeakPolarHBondContact CA-OE2 3.32Å; S708-E710 PolarHBondContact O-N 3.02Å; S708-N711 PolarHBondContact O-N 2.95Å; S708-N711 PolarHBondContact O-ND2 3.35Å
709	E	95	Very high	94.2	Very high	53 Å²	53	41.3 Å²	41.3	25%	0.248	20%	0.199	C	C	.	.	H	α-helix	trans	-67.3	-18.4	-177.9	72.3	-101.3	-136.9	0	0	114.6	L703 R704 N711 L712 E713	L703-E709 HydrophobicContact CB-CB 4.09Å; R704-E709 HydrophobicContact CG-CB 4.03Å; R704-E709 HydrophobicContact CG-CG 4.07Å; R704-E709 WeakPolarHBondContact CG-OE1 3.48Å; R704-E709 IonicContact NE-OE1 3.77Å; E709-N711 PolarHBondContact O-N 3.39Å; E709-L712 PolarHBondContact O-N 3.12Å; E709-L712 VanDerWaalsContact O-N 3.12Å; E709-E713 WeakPolarHBondContact O-CG 3.36Å; E709-E713 PolarHBondContact O-N 3.49Å
710	E	95.6	Very high	94.2	Very high	38 Å²	38	47.1 Å²	47.1	18%	0.178	23%	0.226	C	C	.	.	H	α-helix	trans	-59.7	-32.5	177.8	70.2	-60.3	147.4	0	0	112.6	S708 L712 E713 F714 Y741 K748 V750	S708-E710 VanDerWaalsContact CA-OE2 3.22Å; S708-E710 WeakPolarHBondContact CA-OE2 3.32Å; S708-E710 PolarHBondContact O-N 3.02Å; E710-L712 VanDerWaalsContact C-N 3.31Å; E710-L712 PolarHBondContact O-N 2.99Å; E710-E713 PolarHBondContact O-N 2.92Å; E710-F714 WeakPolarHBondContact O-CB 3.15Å; E710-F714 PolarHBondContact O-N 2.66Å; E710-Y741 HydrophobicContact CB-CD1 4.49Å; E710-Y741 HydrophobicContact CB-CE1 4.46Å; E710-K748 HydrophobicContact CB-CB 3.78Å; E710-K748 HydrophobicContact CB-CG 4.38Å; E710-V750 HydrophobicContact CB-CG1 4.42Å; E710-V750 HydrophobicContact CG-CG1 4.02Å
711	N	96.3	Very high	94.3	Very high	8 Å²	8	43.3 Å²	43.3	4%	0.043	21%	0.212	C	C	.	.	H	α-helix	trans	-59.8	-42.8	175.5	-61.7	-68.3	0	0	0	111.8	S708 E709 W715 I779 M783	S708-N711 PolarHBondContact O-N 2.95Å; S708-N711 PolarHBondContact O-ND2 3.35Å; E709-N711 PolarHBondContact O-N 3.39Å; N711-W715 WeakPolarHBondContact O-CB 3.38Å; N711-W715 PolarHBondContact O-N 2.67Å; N711-W715 VanDerWaalsContact O-N 3.08Å; N711-I779 HydrophobicContact CB-CG2 3.55Å; N711-I779 WeakPolarHBondContact O-CG2 3.19Å; N711-M783 HydrophobicContact CB-CG 3.74Å; N711-M783 HydrophobicContact CB-SD 3.76Å
712	L	97.5	Very high	94.6	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-79.2	-36.6	178.4	-179.4	59.7	0	0	0	112.1	L690 L696 F699 R700 L703 E709 E710 F714 W715 L716 M783	L690-L712 HydrophobicContact CD2-CD1 3.63Å; L696-L712 HydrophobicContact CD1-CD1 3.89Å; L696-L712 HydrophobicContact CD1-CD2 4.11Å; L696-L712 HydrophobicContact CD1-CG 4.41Å; F699-L712 HydrophobicContact CD1-CD2 3.99Å; R700-L712 HydrophobicContact CB-CD2 3.65Å; R700-L712 HydrophobicContact CG-CD2 4.01Å; L703-L712 HydrophobicContact CD1-CB 3.54Å; L703-L712 HydrophobicContact CD1-CD2 3.83Å; L703-L712 HydrophobicContact CD1-CG 4.33Å; E709-L712 PolarHBondContact O-N 3.12Å; E709-L712 VanDerWaalsContact O-N 3.12Å; E710-L712 VanDerWaalsContact C-N 3.31Å; E710-L712 PolarHBondContact O-N 2.99Å; L712-F714 VanDerWaalsContact C-N 3.34Å; L712-W715 HydrophobicContact CD1-CE3 4.41Å; L712-W715 PolarHBondContact O-N 3.37Å; L712-L716 HydrophobicContact CD1-CD1 4.32Å; L712-L716 HydrophobicContact CD1-CG 4.22Å; L712-L716 HydrophobicContact CG-CD1 4.13Å; L712-L716 HydrophobicContact CG-CG 4.5Å; L712-L716 WeakPolarHBondContact O-CB 3.42Å; L712-L716 VanDerWaalsContact O-CG 3.26Å; L712-L716 WeakPolarHBondContact O-CG 3.47Å; L712-L716 PolarHBondContact O-N 2.84Å; L712-M783 HydrophobicContact CB-SD 3.92Å; L712-M783 HydrophobicContact CD1-SD 4.5Å
713	E	97.1	Very high	94.7	Very high	30 Å²	30	50.4 Å²	50.4	14%	0.14	24%	0.235	C	C	.	.	H	α-helix	trans	-65	-38.4	174.8	-68.6	-168	178.1	0	0	111.9	R700 E709 E710 A717 Y741 K748	R700-E713 IonicContact CZ-OE1 2.98Å; R700-E713 IonicContact NE-OE1 3.22Å; R700-E713 PolarHBondContact NE-OE1 3.21Å; R700-E713 IonicContact NH2-OE1 3.57Å; R700-E713 PolarHBondContact NH2-OE1 2.83Å; E709-E713 WeakPolarHBondContact O-CG 3.36Å; E709-E713 PolarHBondContact O-N 3.49Å; E710-E713 PolarHBondContact O-N 2.92Å; E713-A717 VanDerWaalsContact O-CB 3.3Å; E713-A717 WeakPolarHBondContact O-CB 3.37Å; E713-A717 PolarHBondContact O-N 2.86Å; E713-Y741 HydrophobicContact CB-CE1 3.96Å; E713-K748 IonicContact OE2-NZ 3.84Å; E713-K748 PolarHBondContact OE2-NZ 3.19Å
714	F	98.3	Very high	94.8	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-63.4	-50.3	170.6	171.8	-113.6	0	0	0	112.1	E710 L712 L716 A717 C718 I737 Y741 I742 V750 F772 A775 I779	E710-F714 WeakPolarHBondContact O-CB 3.15Å; E710-F714 PolarHBondContact O-N 2.66Å; L712-F714 VanDerWaalsContact C-N 3.34Å; F714-L716 VanDerWaalsContact C-N 3.32Å; F714-L716 PolarHBondContact O-N 2.86Å; F714-A717 WeakPolarHBondContact O-CB 3.24Å; F714-A717 PolarHBondContact O-N 2.73Å; F714-C718 WeakPolarHBondContact CE2-SG 3.45Å; F714-C718 VanDerWaalsContact CZ-SG 3.5Å; F714-C718 PolarHBondContact O-N 3.23Å; F714-C718 PolarHBondContact O-SG 2.68Å; F714-I737 HydrophobicContact CD2-CG2 3.96Å; F714-I737 HydrophobicContact CE2-CG2 3.69Å; F714-Y741 HydrophobicContact CB-CD1 3.68Å; F714-Y741 HydrophobicContact CB-CE1 4.23Å; F714-Y741 HydrophobicContact CB-CG 3.91Å; F714-Y741 HydrophobicContact CD2-CD2 4.33Å; F714-Y741 AromaticContact CD2-CG 3.94Å; F714-Y741 HydrophobicContact CD2-CG 3.94Å; F714-Y741 HydrophobicContact CG-CG 4.34Å; F714-I742 HydrophobicContact CD2-CD1 4.39Å; F714-I742 HydrophobicContact CE2-CD1 3.66Å; F714-I742 HydrophobicContact CE2-CG1 4.21Å; F714-I742 HydrophobicContact CZ-CD1 3.77Å; F714-V750 HydrophobicContact CB-CG1 3.73Å; F714-V750 HydrophobicContact CD1-CG1 4.26Å; F714-V750 HydrophobicContact CD1-CG2 4.1Å; F714-V750 HydrophobicContact CE1-CG2 4.38Å; F714-V750 HydrophobicContact CG-CG1 4.09Å; F714-V750 HydrophobicContact CG-CG2 4.23Å; F714-F772 HydrophobicContact CE2-CD1 4.38Å; F714-A775 HydrophobicContact CE1-CB 4.15Å; F714-A775 HydrophobicContact CZ-CB 3.76Å; F714-I779 HydrophobicContact CD1-CB 3.99Å; F714-I779 HydrophobicContact CD1-CG1 3.79Å; F714-I779 HydrophobicContact CD1-CG2 4.09Å; F714-I779 HydrophobicContact CE1-CB 4.18Å; F714-I779 HydrophobicContact CE1-CG1 3.82Å
715	W	98.1	Very high	95	Very high	39 Å²	39	55.7 Å²	55.7	15%	0.148	26%	0.262	C	S	.	.	H	α-helix	trans	-58.4	-43.8	179.5	-175.2	95.5	0	0	0	111.7	L690 N711 L712 A717 C718 E719 Q776 Y780 M783	L690-W715 HydrophobicContact CB-CH2 4.34Å; L690-W715 HydrophobicContact CB-CZ3 4.46Å; L690-W715 HydrophobicContact CD1-CD2 4.3Å; L690-W715 HydrophobicContact CD1-CE3 4.18Å; L690-W715 HydrophobicContact CD1-CH2 3.89Å; L690-W715 HydrophobicContact CD1-CZ2 4Å; L690-W715 HydrophobicContact CD1-CZ3 3.99Å; N711-W715 WeakPolarHBondContact O-CB 3.38Å; N711-W715 PolarHBondContact O-N 2.67Å; N711-W715 VanDerWaalsContact O-N 3.08Å; L712-W715 HydrophobicContact CD1-CE3 4.41Å; L712-W715 PolarHBondContact O-N 3.37Å; W715-A717 PolarHBondContact O-N 2.82Å; W715-C718 WeakPolarHBondContact O-CB 3.5Å; W715-C718 PolarHBondContact O-N 3.41Å; W715-E719 HydrophobicContact CD2-CG 4.4Å; W715-E719 HydrophobicContact CE3-CG 4.14Å; W715-E719 HydrophobicContact CH2-CG 3.91Å; W715-E719 HydrophobicContact CZ2-CG 4.17Å; W715-E719 HydrophobicContact CZ3-CG 3.89Å; W715-E719 PolarHBondContact O-N 3.28Å; W715-Q776 VanDerWaalsContact CD1-CG 3.43Å; W715-Q776 HydrophobicContact CG-CG 4.16Å; W715-Y780 AromaticContact NE1-CD2 3.51Å; W715-M783 HydrophobicContact CB-CE 3.99Å; W715-M783 HydrophobicContact CG-CE 4.19Å
716	L	97	Very high	95.6	Very high	47 Å²	47	53.9 Å²	53.9	25%	0.246	25%	0.253	C	S	.	.	H	α-helix	trans	-64.5	-37.1	173.6	-71.3	170.6	0	0	0	112.5	L696 L712 F714 C718 E719 E720	L696-L716 HydrophobicContact CD1-CD1 4.34Å; L696-L716 HydrophobicContact CD1-CD2 4.24Å; L696-L716 HydrophobicContact CD2-CD2 4.28Å; L712-L716 HydrophobicContact CD1-CD1 4.32Å; L712-L716 HydrophobicContact CD1-CG 4.22Å; L712-L716 HydrophobicContact CG-CD1 4.13Å; L712-L716 HydrophobicContact CG-CG 4.5Å; L712-L716 WeakPolarHBondContact O-CB 3.42Å; L712-L716 VanDerWaalsContact O-CG 3.26Å; L712-L716 WeakPolarHBondContact O-CG 3.47Å; L712-L716 PolarHBondContact O-N 2.84Å; F714-L716 VanDerWaalsContact C-N 3.32Å; F714-L716 PolarHBondContact O-N 2.86Å; L716-C718 VanDerWaalsContact C-N 3.33Å; L716-C718 PolarHBondContact O-N 2.99Å; L716-E719 PolarHBondContact O-N 2.98Å; L716-E720 PolarHBondContact O-N 3.27Å
717	A	97.6	Very high	95.8	Very high	9 Å²	9	56.8 Å²	56.8	7%	0.074	27%	0.266	C	S	.	.	H	α-helix	trans	-66.4	-34.7	176.7	0	0	0	0	0	112.4	E713 F714 W715 Y721 I737	E713-A717 VanDerWaalsContact O-CB 3.3Å; E713-A717 WeakPolarHBondContact O-CB 3.37Å; E713-A717 PolarHBondContact O-N 2.86Å; F714-A717 WeakPolarHBondContact O-CB 3.24Å; F714-A717 PolarHBondContact O-N 2.73Å; W715-A717 PolarHBondContact O-N 2.82Å; A717-Y721 VanDerWaalsContact O-CB 3.26Å; A717-Y721 WeakPolarHBondContact O-CB 3.18Å; A717-Y721 PolarHBondContact O-N 2.74Å; A717-I737 HydrophobicContact CB-CD1 4.14Å; A717-I737 HydrophobicContact CB-CG1 4.1Å; A717-I737 WeakPolarHBondContact O-CD1 3.13Å
718	C	97.6	Very high	96.3	Very high	2 Å²	2	52.7 Å²	52.7	1%	0.014	26%	0.261	C	S	.	.	H	α-helix	trans	-67.6	-40	170.9	-69.4	0	0	0	0	111.8	F714 W715 L716 E720 Y721 K722 F772 Q776	F714-C718 WeakPolarHBondContact CE2-SG 3.45Å; F714-C718 VanDerWaalsContact CZ-SG 3.5Å; F714-C718 PolarHBondContact O-N 3.23Å; F714-C718 PolarHBondContact O-SG 2.68Å; W715-C718 WeakPolarHBondContact O-CB 3.5Å; W715-C718 PolarHBondContact O-N 3.41Å; L716-C718 VanDerWaalsContact C-N 3.33Å; L716-C718 PolarHBondContact O-N 2.99Å; C718-E720 PolarHBondContact O-N 3.17Å; C718-Y721 WeakPolarHBondContact O-CB 3.39Å; C718-Y721 PolarHBondContact O-N 2.76Å; C718-Y721 VanDerWaalsContact O-N 3.14Å; C718-K722 WeakPolarHBondContact O-CG 2.94Å; C718-K722 PolarHBondContact O-N 3.01Å; C718-F772 VanDerWaalsContact SG-CB 3.59Å; C718-Q776 HydrophobicContact CB-CB 4.2Å; C718-Q776 HydrophobicContact CB-CG 3.94Å
719	E	95.9	Very high	96.3	Very high	50 Å²	50	58.8 Å²	58.8	23%	0.234	29%	0.285	C	S	.	.	H	α-helix	trans	-64.8	-36.1	173	-81	-50.3	114.9	0	0	113.7	W715 L716 K722 K723 Q776	W715-E719 HydrophobicContact CD2-CG 4.4Å; W715-E719 HydrophobicContact CE3-CG 4.14Å; W715-E719 HydrophobicContact CH2-CG 3.91Å; W715-E719 HydrophobicContact CZ2-CG 4.17Å; W715-E719 HydrophobicContact CZ3-CG 3.89Å; W715-E719 PolarHBondContact O-N 3.28Å; L716-E719 PolarHBondContact O-N 2.98Å; E719-K722 IonicContact OE1-NZ 3.22Å; E719-K723 VanDerWaalsContact O-CD 3.31Å; E719-K723 WeakPolarHBondContact O-CD 3.42Å; E719-K723 WeakPolarHBondContact O-CG 3.42Å; E719-K723 PolarHBondContact O-NZ 3.15Å; E719-K723 IonicContact OE2-NZ 3.37Å; E719-K723 PolarHBondContact OE2-NZ 3.47Å; E719-Q776 PolarHBondContact OE1-NE2 2.8Å
720	E	95.7	Very high	96.4	Very high	122 Å²	122	56.4 Å²	56.4	57%	0.57	27%	0.274	S	S	*	.	H	α-helix	trans	-67.4	-39	169.2	-73	-170.8	150	0	0	112.1	L716 C718 K723 K733	L716-E720 PolarHBondContact O-N 3.27Å; C718-E720 PolarHBondContact O-N 3.17Å; E720-K723 PolarHBondContact O-N 3.41Å; E720-K733 IonicContact OE2-NZ 2.57Å; E720-K733 PolarHBondContact OE2-NZ 3.17Å
721	Y	97.4	Very high	96.4	Very high	2 Å²	2	56 Å²	56	1%	0.008	28%	0.278	C	S	.	.	H	α-helix	trans	-63.8	-45.9	-176.4	172.9	-97.5	0	0	0	112.6	A717 C718 K723 I724 M730 K733 A734 I737 V767 T768 R769 C771 F772	A717-Y721 VanDerWaalsContact O-CB 3.26Å; A717-Y721 WeakPolarHBondContact O-CB 3.18Å; A717-Y721 PolarHBondContact O-N 2.74Å; C718-Y721 WeakPolarHBondContact O-CB 3.39Å; C718-Y721 PolarHBondContact O-N 2.76Å; C718-Y721 VanDerWaalsContact O-N 3.14Å; Y721-K723 PolarHBondContact O-N 3.13Å; Y721-K723 VanDerWaalsContact O-N 3.16Å; Y721-I724 HydrophobicContact CD2-CD1 4.36Å; Y721-I724 VanDerWaalsContact O-CB 3.3Å; Y721-I724 WeakPolarHBondContact O-CB 3.07Å; Y721-I724 WeakPolarHBondContact O-CG1 3.48Å; Y721-I724 PolarHBondContact O-N 3.16Å; Y721-M730 HydrophobicContact CD2-CG 4.31Å; Y721-M730 HydrophobicContact CE1-CG 4.42Å; Y721-M730 HydrophobicContact CE2-CB 4.44Å; Y721-M730 HydrophobicContact CE2-CG 3.41Å; Y721-M730 VanDerWaalsContact CE2-CG 3.41Å; Y721-M730 WeakPolarHBondContact CE2-O 3.42Å; Y721-M730 VanDerWaalsContact CZ-CG 3.48Å; Y721-M730 VanDerWaalsContact OH-CG 3.31Å; Y721-M730 WeakPolarHBondContact OH-CG 3.35Å; Y721-K733 HydrophobicContact CD2-CB 4.1Å; Y721-K733 HydrophobicContact CD2-CG 3.73Å; Y721-A734 HydrophobicContact CE2-CB 3.77Å; Y721-I737 HydrophobicContact CD2-CD1 4.16Å; Y721-I737 HydrophobicContact CG-CD1 4.15Å; Y721-V767 WeakPolarHBondContact OH-CG1 3.38Å; Y721-T768 WeakPolarHBondContact CE1-O 3.39Å; Y721-T768 PolarHBondContact OH-O 3.32Å; Y721-R769 WeakPolarHBondContact CE1-O 3.31Å; Y721-C771 HydrophobicContact CE1-CB 4.16Å; Y721-F772 AromaticContact CD1-CD2 3.78Å; Y721-F772 HydrophobicContact CD1-CD2 3.78Å; Y721-F772 HydrophobicContact CD1-CE2 4.2Å; Y721-F772 HydrophobicContact CD2-CE2 4.19Å; Y721-F772 AromaticContact CE1-CD2 3.71Å; Y721-F772 HydrophobicContact CE1-CD2 3.71Å; Y721-F772 AromaticContact CE1-CE2 3.97Å; Y721-F772 HydrophobicContact CE1-CE2 3.97Å; Y721-F772 HydrophobicContact CE2-CD2 4.48Å; Y721-F772 AromaticContact CE2-CE2 3.96Å; Y721-F772 HydrophobicContact CE2-CE2 3.96Å; Y721-F772 HydrophobicContact CG-CD2 4.2Å; Y721-F772 HydrophobicContact CG-CE2 4.3Å; Y721-F772 AromaticContact CZ-CE2 3.83Å
722	K	96.4	Very high	96.4	Very high	65 Å²	65	59.1 Å²	59.1	28%	0.283	30%	0.3	S	S	.	.	H	α-helix	trans	-55.6	-32.4	176.5	-75.8	170.3	170	176.7	0	113.2	C718 E719 I724 D773	C718-K722 WeakPolarHBondContact O-CG 2.94Å; C718-K722 PolarHBondContact O-N 3.01Å; E719-K722 IonicContact OE1-NZ 3.22Å; K722-I724 PolarHBondContact O-N 2.94Å; K722-D773 WeakPolarHBondContact CE-OD1 3.47Å; K722-D773 IonicContact NZ-OD1 2.68Å; K722-D773 PolarHBondContact NZ-OD1 3.34Å
723	K	96.1	Very high	96.4	Very high	140 Å²	140	61.2 Å²	61.2	61%	0.609	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78	-1.4	-179.3	-62.2	169.4	-177.2	64.2	0	113	E719 E720 Y721	E719-K723 VanDerWaalsContact O-CD 3.31Å; E719-K723 WeakPolarHBondContact O-CD 3.42Å; E719-K723 WeakPolarHBondContact O-CG 3.42Å; E719-K723 PolarHBondContact O-NZ 3.15Å; E719-K723 IonicContact OE2-NZ 3.37Å; E719-K723 PolarHBondContact OE2-NZ 3.47Å; E720-K723 PolarHBondContact O-N 3.41Å; Y721-K723 PolarHBondContact O-N 3.13Å; Y721-K723 VanDerWaalsContact O-N 3.16Å
724	I	96.4	Very high	96.4	Very high	28 Å²	28	59.8 Å²	59.8	14%	0.144	30%	0.302	C	S	.	.			trans	-79.7	120.5	178.3	-60.9	176.8	0	0	0	111.3	Y721 K722 S726 K729 M730 K733 R769	Y721-I724 HydrophobicContact CD2-CD1 4.36Å; Y721-I724 VanDerWaalsContact O-CB 3.3Å; Y721-I724 WeakPolarHBondContact O-CB 3.07Å; Y721-I724 WeakPolarHBondContact O-CG1 3.48Å; Y721-I724 PolarHBondContact O-N 3.16Å; K722-I724 PolarHBondContact O-N 2.94Å; I724-S726 WeakPolarHBondContact CG2-O 3.15Å; I724-K729 HydrophobicContact CG2-CB 3.8Å; I724-M730 HydrophobicContact CG2-CB 4.04Å; I724-M730 VanDerWaalsContact O-CE 3.29Å; I724-M730 WeakPolarHBondContact O-CE 3.15Å; I724-K733 HydrophobicContact CD1-CB 3.67Å; I724-K733 HydrophobicContact CD1-CG 3.74Å; I724-R769 PolarHBondContact O-NE 2.67Å
725	K	94.4	Very high	96.3	Very high	195 Å²	195	66.1 Å²	66.1	85%	0.848	33%	0.33	S	S	*	.			trans	-87	-17.8	174.8	-64.3	-167.3	177.5	-170.5	0	115
726	S	95.9	Very high	96.2	Very high	57 Å²	57	70 Å²	70	40%	0.399	35%	0.347	S	S	.	.			trans	-108.1	123.4	-172.1	174.3	0	0	0	0	113	I724 S728 K729 M730	I724-S726 WeakPolarHBondContact CG2-O 3.15Å; S726-S728 PolarHBondContact O-N 2.8Å; S726-K729 PolarHBondContact O-N 2.8Å; S726-K729 VanDerWaalsContact O-N 3.07Å; S726-M730 PolarHBondContact O-N 2.81Å
727	Q	94.7	Very high	96.2	Very high	113 Å²	113	67.9 Å²	67.9	53%	0.528	34%	0.337	S	S	.	.	H	α-helix	trans	-59.2	-39.2	-173.5	-166.6	63.6	-2.8	0	0	114.1	K729 M730 A731 V767	Q727-K729 PolarHBondContact O-N 2.86Å; Q727-M730 WeakPolarHBondContact O-CB 3.35Å; Q727-M730 PolarHBondContact O-N 3.33Å; Q727-A731 WeakPolarHBondContact O-CB 3.16Å; Q727-A731 PolarHBondContact O-N 3.2Å; Q727-V767 PolarHBondContact NE2-O 3.45Å
728	S	94.3	Very high	96.2	Very high	96 Å²	96	69.5 Å²	69.5	67%	0.671	34%	0.342	S	S	*	.	H	α-helix	trans	-65.4	-38.3	176.1	178.5	0	0	0	0	112.7	S726 M730 S732	S726-S728 PolarHBondContact O-N 2.8Å; S728-M730 VanDerWaalsContact C-N 3.35Å; S728-S732 PolarHBondContact O-N 3.36Å; S728-S732 PolarHBondContact O-OG 2.97Å
729	K	95.1	Very high	96.1	Very high	140 Å²	140	72.1 Å²	72.1	61%	0.609	36%	0.364	S	S	*	.	H	α-helix	trans	-70.5	-33.5	173.2	-66	-176.7	-177.9	175.1	0	111.6	I724 S726 Q727 S732 K733	I724-K729 HydrophobicContact CG2-CB 3.8Å; S726-K729 PolarHBondContact O-N 2.8Å; S726-K729 VanDerWaalsContact O-N 3.07Å; Q727-K729 PolarHBondContact O-N 2.86Å; K729-S732 WeakPolarHBondContact CA-OG 3.17Å; K729-S732 PolarHBondContact O-OG 3.21Å; K729-K733 VanDerWaalsContact O-CB 3.3Å; K729-K733 WeakPolarHBondContact O-CB 3.32Å; K729-K733 PolarHBondContact O-N 3.19Å
730	M	96.4	Very high	96.1	Very high	4 Å²	4	71.9 Å²	71.9	2%	0.02	36%	0.363	C	S	.	.	H	α-helix	trans	-66.5	-54.7	177.1	-163.3	-178.1	-60.9	0	0	110.2	Y721 I724 S726 Q727 S728 S732 K733 A734 V767 T768 R769	Y721-M730 HydrophobicContact CD2-CG 4.31Å; Y721-M730 HydrophobicContact CE1-CG 4.42Å; Y721-M730 HydrophobicContact CE2-CB 4.44Å; Y721-M730 HydrophobicContact CE2-CG 3.41Å; Y721-M730 VanDerWaalsContact CE2-CG 3.41Å; Y721-M730 WeakPolarHBondContact CE2-O 3.42Å; Y721-M730 VanDerWaalsContact CZ-CG 3.48Å; Y721-M730 VanDerWaalsContact OH-CG 3.31Å; Y721-M730 WeakPolarHBondContact OH-CG 3.35Å; I724-M730 HydrophobicContact CG2-CB 4.04Å; I724-M730 VanDerWaalsContact O-CE 3.29Å; I724-M730 WeakPolarHBondContact O-CE 3.15Å; S726-M730 PolarHBondContact O-N 2.81Å; Q727-M730 WeakPolarHBondContact O-CB 3.35Å; Q727-M730 PolarHBondContact O-N 3.33Å; S728-M730 VanDerWaalsContact C-N 3.35Å; M730-S732 VanDerWaalsContact C-N 3.28Å; M730-S732 PolarHBondContact O-N 2.71Å; M730-K733 PolarHBondContact O-N 2.91Å; M730-K733 VanDerWaalsContact O-N 3.17Å; M730-A734 WeakPolarHBondContact O-CB 3.19Å; M730-A734 PolarHBondContact O-N 3.31Å; M730-V767 HydrophobicContact CG-CG1 3.95Å; M730-V767 HydrophobicContact SD-CG1 4.34Å; M730-T768 VanDerWaalsContact SD-C 3.59Å; M730-R769 HydrophobicContact CE-CG 3.54Å; M730-R769 HydrophobicContact SD-CG 4.11Å
731	A	95.9	Very high	96.2	Very high	30 Å²	30	66.6 Å²	66.6	25%	0.248	34%	0.338	C	S	.	.	H	α-helix	trans	-57.4	-36.4	177.8	0	0	0	0	0	113.8	Q727 K735 V767	Q727-A731 WeakPolarHBondContact O-CB 3.16Å; Q727-A731 PolarHBondContact O-N 3.2Å; A731-K735 WeakPolarHBondContact O-CG 3.45Å; A731-K735 PolarHBondContact O-N 2.94Å; A731-V767 HydrophobicContact CB-CG2 4.37Å
732	S	96	Very high	96	Very high	72 Å²	72	66.5 Å²	66.5	50%	0.503	34%	0.338	S	S	.	.	H	α-helix	trans	-76.1	-38.2	176.3	48.4	0	0	0	0	113.5	S728 K729 M730 K736	S728-S732 PolarHBondContact O-N 3.36Å; S728-S732 PolarHBondContact O-OG 2.97Å; K729-S732 WeakPolarHBondContact CA-OG 3.17Å; K729-S732 PolarHBondContact O-OG 3.21Å; M730-S732 VanDerWaalsContact C-N 3.28Å; M730-S732 PolarHBondContact O-N 2.71Å; S732-K736 PolarHBondContact O-N 3.38Å; S732-K736 VanDerWaalsContact O-N 3.17Å
733	K	97.2	Very high	95.8	Very high	45 Å²	45	64.6 Å²	64.6	20%	0.196	33%	0.334	C	S	.	.	H	α-helix	trans	-67.3	-39.5	171.6	179.5	75.3	160.4	176	0	111.4	E720 Y721 I724 K729 M730 K736 I737	E720-K733 IonicContact OE2-NZ 2.57Å; E720-K733 PolarHBondContact OE2-NZ 3.17Å; Y721-K733 HydrophobicContact CD2-CB 4.1Å; Y721-K733 HydrophobicContact CD2-CG 3.73Å; I724-K733 HydrophobicContact CD1-CB 3.67Å; I724-K733 HydrophobicContact CD1-CG 3.74Å; K729-K733 VanDerWaalsContact O-CB 3.3Å; K729-K733 WeakPolarHBondContact O-CB 3.32Å; K729-K733 PolarHBondContact O-N 3.19Å; M730-K733 PolarHBondContact O-N 2.91Å; M730-K733 VanDerWaalsContact O-N 3.17Å; K733-K736 PolarHBondContact O-N 2.6Å; K733-I737 HydrophobicContact CD-CD1 4.19Å; K733-I737 HydrophobicContact CD-CG1 4.35Å; K733-I737 HydrophobicContact CG-CD1 3.88Å; K733-I737 HydrophobicContact CG-CG1 4.36Å; K733-I737 WeakPolarHBondContact O-CG1 3.2Å; K733-I737 PolarHBondContact O-N 3.34Å
734	A	97.3	Very high	95.2	Very high	0 Å²	0	63.2 Å²	63.2	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-59.3	-51.8	176.5	0	0	0	0	0	111.5	Y721 M730 K736 I737 F738 V767 F772	Y721-A734 HydrophobicContact CE2-CB 3.77Å; M730-A734 WeakPolarHBondContact O-CB 3.19Å; M730-A734 PolarHBondContact O-N 3.31Å; A734-K736 VanDerWaalsContact C-N 3.26Å; A734-K736 PolarHBondContact O-N 2.82Å; A734-I737 PolarHBondContact O-N 3.14Å; A734-F738 WeakPolarHBondContact O-CB 3.48Å; A734-F738 PolarHBondContact O-N 2.97Å; A734-V767 HydrophobicContact CB-CG1 3.79Å; A734-V767 HydrophobicContact CB-CG2 4.45Å; A734-F772 HydrophobicContact CB-CE2 3.95Å; A734-F772 HydrophobicContact CB-CZ 4Å
735	K	96.2	Very high	94.6	Very high	132 Å²	132	70.6 Å²	70.6	57%	0.574	37%	0.366	S	S	*	.	H	α-helix	trans	-60.2	-34.4	176.5	-71	178.9	-179.2	-172.8	0	112.5	A731 A739 L764	A731-K735 WeakPolarHBondContact O-CG 3.45Å; A731-K735 PolarHBondContact O-N 2.94Å; K735-A739 WeakPolarHBondContact O-CB 3.42Å; K735-A739 PolarHBondContact O-N 2.86Å; K735-A739 VanDerWaalsContact O-N 3.07Å; K735-L764 HydrophobicContact CG-CD2 4.15Å
736	K	96.9	Very high	94.2	Very high	120 Å²	120	62.5 Å²	62.5	52%	0.522	33%	0.334	S	S	.	.	H	α-helix	trans	-68.3	-48.2	172.8	-172	177	-170.2	-72.7	0	112.7	S732 K733 A734 F738 A739 E740	S732-K736 PolarHBondContact O-N 3.38Å; S732-K736 VanDerWaalsContact O-N 3.17Å; K733-K736 PolarHBondContact O-N 2.6Å; A734-K736 VanDerWaalsContact C-N 3.26Å; A734-K736 PolarHBondContact O-N 2.82Å; K736-F738 VanDerWaalsContact C-N 3.31Å; K736-F738 PolarHBondContact O-N 2.78Å; K736-A739 PolarHBondContact O-N 2.94Å; K736-E740 IonicContact NZ-OE2 2.66Å; K736-E740 PolarHBondContact NZ-OE2 3.29Å; K736-E740 VanDerWaalsContact O-CB 3.26Å; K736-E740 WeakPolarHBondContact O-CB 3.44Å; K736-E740 PolarHBondContact O-N 2.72Å
737	I	97.5	Very high	93.5	Very high	4 Å²	4	65.6 Å²	65.6	2%	0.021	35%	0.354	C	S	.	.	H	α-helix	trans	-60	-44.7	178.3	-70.3	171.6	0	0	0	110	F714 A717 Y721 K733 A734 E740 Y741 F772	F714-I737 HydrophobicContact CD2-CG2 3.96Å; F714-I737 HydrophobicContact CE2-CG2 3.69Å; A717-I737 HydrophobicContact CB-CD1 4.14Å; A717-I737 HydrophobicContact CB-CG1 4.1Å; A717-I737 WeakPolarHBondContact O-CD1 3.13Å; Y721-I737 HydrophobicContact CD2-CD1 4.16Å; Y721-I737 HydrophobicContact CG-CD1 4.15Å; K733-I737 HydrophobicContact CD-CD1 4.19Å; K733-I737 HydrophobicContact CD-CG1 4.35Å; K733-I737 HydrophobicContact CG-CD1 3.88Å; K733-I737 HydrophobicContact CG-CG1 4.36Å; K733-I737 WeakPolarHBondContact O-CG1 3.2Å; K733-I737 PolarHBondContact O-N 3.34Å; A734-I737 PolarHBondContact O-N 3.14Å; I737-E740 PolarHBondContact O-N 2.99Å; I737-Y741 HydrophobicContact CG2-CD2 4.49Å; I737-Y741 PolarHBondContact O-N 3.16Å; I737-F772 HydrophobicContact CB-CE1 4.25Å; I737-F772 HydrophobicContact CB-CE2 4.27Å; I737-F772 HydrophobicContact CB-CZ 3.88Å; I737-F772 HydrophobicContact CD1-CD2 4.5Å; I737-F772 HydrophobicContact CD1-CE2 4.17Å; I737-F772 HydrophobicContact CG2-CD1 4.03Å; I737-F772 HydrophobicContact CG2-CE1 3.68Å; I737-F772 HydrophobicContact CG2-CE2 4.22Å; I737-F772 HydrophobicContact CG2-CG 4.46Å; I737-F772 HydrophobicContact CG2-CZ 3.79Å
738	F	96.9	Very high	93.3	Very high	42 Å²	42	63.1 Å²	63.1	18%	0.184	34%	0.342	C	S	.	.	I	π-helix	trans	-59.9	-51.7	177.4	-172.6	-88	0	0	0	111.4	A734 K736 E740 I742 A743 T760 K761 L764	A734-F738 WeakPolarHBondContact O-CB 3.48Å; A734-F738 PolarHBondContact O-N 2.97Å; K736-F738 VanDerWaalsContact C-N 3.31Å; K736-F738 PolarHBondContact O-N 2.78Å; F738-E740 VanDerWaalsContact C-N 3.33Å; F738-E740 PolarHBondContact O-N 2.78Å; F738-I742 HydrophobicContact CD2-CB 3.71Å; F738-I742 HydrophobicContact CD2-CG1 4.4Å; F738-I742 HydrophobicContact CD2-CG2 3.6Å; F738-I742 HydrophobicContact CE2-CB 4.06Å; F738-I742 HydrophobicContact CE2-CG2 3.5Å; F738-I742 VanDerWaalsContact CE2-CG2 3.5Å; F738-I742 HydrophobicContact CG-CB 4.17Å; F738-I742 HydrophobicContact CG-CG2 4.49Å; F738-I742 HydrophobicContact CZ-CG2 4.32Å; F738-I742 CarbonylContact O-C 3.55Å; F738-I742 WeakPolarHBondContact O-CA 3.11Å; F738-I742 PolarHBondContact O-N 2.89Å; F738-A743 HydrophobicContact CD1-CB 4.19Å; F738-A743 HydrophobicContact CE1-CB 4.04Å; F738-A743 WeakPolarHBondContact O-CB 3.24Å; F738-A743 PolarHBondContact O-N 2.97Å; F738-T760 HydrophobicContact CD2-CG2 4.35Å; F738-K761 HydrophobicContact CE2-CB 3.75Å; F738-K761 HydrophobicContact CE2-CG 4.38Å; F738-K761 HydrophobicContact CZ-CB 3.93Å; F738-K761 HydrophobicContact CZ-CG 4.11Å; F738-L764 HydrophobicContact CB-CD1 4.05Å; F738-L764 HydrophobicContact CB-CD2 3.54Å; F738-L764 HydrophobicContact CB-CG 4.46Å; F738-L764 HydrophobicContact CD1-CD2 4.19Å; F738-L764 HydrophobicContact CD2-CD1 3.74Å; F738-L764 HydrophobicContact CD2-CD2 3.98Å; F738-L764 HydrophobicContact CD2-CG 4.49Å; F738-L764 HydrophobicContact CG-CD1 4.15Å; F738-L764 HydrophobicContact CG-CD2 3.63Å
739	A	95.9	Very high	93.2	Very high	58 Å²	58	61.6 Å²	61.6	48%	0.479	32%	0.324	S	S	.	.	I	π-helix	trans	-65.2	-31.2	179.8	0	0	0	0	0	114.1	K735 K736 S746	K735-A739 WeakPolarHBondContact O-CB 3.42Å; K735-A739 PolarHBondContact O-N 2.86Å; K735-A739 VanDerWaalsContact O-N 3.07Å; K736-A739 PolarHBondContact O-N 2.94Å; A739-S746 WeakPolarHBondContact O-CB 3.29Å; A739-S746 PolarHBondContact O-OG 2.9Å
740	E	95.9	Very high	93.2	Very high	45 Å²	45	55 Å²	55	21%	0.21	30%	0.296	C	S	.	.	I	π-helix	trans	-88.1	-26.3	-177.3	-167.9	179.2	160.4	0	0	113.4	K736 I737 F738 S746 K748	K736-E740 IonicContact NZ-OE2 2.66Å; K736-E740 PolarHBondContact NZ-OE2 3.29Å; K736-E740 VanDerWaalsContact O-CB 3.26Å; K736-E740 WeakPolarHBondContact O-CB 3.44Å; K736-E740 PolarHBondContact O-N 2.72Å; I737-E740 PolarHBondContact O-N 2.99Å; F738-E740 VanDerWaalsContact C-N 3.33Å; F738-E740 PolarHBondContact O-N 2.78Å; E740-S746 PolarHBondContact O-OG 3.2Å; E740-S746 VanDerWaalsContact O-OG 3.08Å; E740-K748 HydrophobicContact CG-CD 4.39Å; E740-K748 WeakPolarHBondContact O-CB 3.41Å; E740-K748 IonicContact OE1-NZ 2.66Å; E740-K748 PolarHBondContact OE1-NZ 3.5Å; E740-K748 VanDerWaalsContact OE1-NZ 3.14Å
741	Y	96.4	Very high	93	Very high	10 Å²	10	60.7 Å²	60.7	4%	0.039	33%	0.326	C	S	.	.	I	π-helix	trans	-132.4	-23.6	-173.1	-58.3	-85.4	0	0	0	116	E710 E713 F714 I737 K748 E749 V750	E710-Y741 HydrophobicContact CB-CD1 4.49Å; E710-Y741 HydrophobicContact CB-CE1 4.46Å; E713-Y741 HydrophobicContact CB-CE1 3.96Å; F714-Y741 HydrophobicContact CB-CD1 3.68Å; F714-Y741 HydrophobicContact CB-CE1 4.23Å; F714-Y741 HydrophobicContact CB-CG 3.91Å; F714-Y741 HydrophobicContact CD2-CD2 4.33Å; F714-Y741 AromaticContact CD2-CG 3.94Å; F714-Y741 HydrophobicContact CD2-CG 3.94Å; F714-Y741 HydrophobicContact CG-CG 4.34Å; I737-Y741 HydrophobicContact CG2-CD2 4.49Å; I737-Y741 PolarHBondContact O-N 3.16Å; Y741-K748 WeakPolarHBondContact CA-O 3.4Å; Y741-K748 HydrophobicContact CD1-CB 3.94Å; Y741-K748 HydrophobicContact CD1-CD 4.37Å; Y741-K748 HydrophobicContact CE1-CB 3.95Å; Y741-K748 HydrophobicContact CE1-CD 3.56Å; Y741-K748 HydrophobicContact CE1-CG 4.48Å; Y741-K748 PolarHBondContact OH-NZ 3Å; Y741-K748 VanDerWaalsContact OH-NZ 3.08Å; Y741-E749 WeakPolarHBondContact O-CA 3.32Å; Y741-V750 HydrophobicContact CD1-CG1 4.36Å; Y741-V750 VanDerWaalsContact O-CG2 3.29Å; Y741-V750 WeakPolarHBondContact O-CG2 3.41Å; Y741-V750 PolarHBondContact O-N 3.2Å
742	I	94.3	Very high	92.8	Very high	1 Å²	1	60 Å²	60	1%	0.005	32%	0.318	C	S	.	.	I	π-helix	trans	-110.3	-26.2	-171.6	-52.3	-65.5	0	0	0	112.9	F714 F738 V750 L752 R757 T760 F772 A775	F714-I742 HydrophobicContact CD2-CD1 4.39Å; F714-I742 HydrophobicContact CE2-CD1 3.66Å; F714-I742 HydrophobicContact CE2-CG1 4.21Å; F714-I742 HydrophobicContact CZ-CD1 3.77Å; F738-I742 HydrophobicContact CD2-CB 3.71Å; F738-I742 HydrophobicContact CD2-CG1 4.4Å; F738-I742 HydrophobicContact CD2-CG2 3.6Å; F738-I742 HydrophobicContact CE2-CB 4.06Å; F738-I742 HydrophobicContact CE2-CG2 3.5Å; F738-I742 VanDerWaalsContact CE2-CG2 3.5Å; F738-I742 HydrophobicContact CG-CB 4.17Å; F738-I742 HydrophobicContact CG-CG2 4.49Å; F738-I742 HydrophobicContact CZ-CG2 4.32Å; F738-I742 CarbonylContact O-C 3.55Å; F738-I742 WeakPolarHBondContact O-CA 3.11Å; F738-I742 PolarHBondContact O-N 2.89Å; I742-V750 HydrophobicContact CD1-CG2 3.98Å; I742-L752 HydrophobicContact CD1-CD1 3.52Å; I742-R757 HydrophobicContact CG2-CG 3.9Å; I742-R757 VanDerWaalsContact O-CD 3.23Å; I742-R757 WeakPolarHBondContact O-CD 3.42Å; I742-T760 HydrophobicContact CG1-CG2 4.39Å; I742-T760 HydrophobicContact CG2-CG2 4.14Å; I742-F772 HydrophobicContact CG1-CE1 4.4Å; I742-A775 HydrophobicContact CD1-CB 4.32Å
743	A	91.4	Very high	92.3	Very high	25 Å²	25	59.5 Å²	59.5	21%	0.207	31%	0.31	C	S	.	.	S	Bend	trans	-69.9	134	-179.2	0	0	0	0	0	110.9	F738 Q745 S746	F738-A743 HydrophobicContact CD1-CB 4.19Å; F738-A743 HydrophobicContact CE1-CB 4.04Å; F738-A743 WeakPolarHBondContact O-CB 3.24Å; F738-A743 PolarHBondContact O-N 2.97Å; A743-Q745 PolarHBondContact O-N 2.84Å; A743-S746 WeakPolarHBondContact O-CB 3.33Å; A743-S746 PolarHBondContact O-N 3.24Å
744	I	84.9	Confident	92	Very high	110 Å²	110	60 Å²	60	56%	0.564	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	136.1	176.6	-45.9	-177.5	0	0	0	109.2	S746 E749	I744-S746 VanDerWaalsContact C-N 3.3Å; I744-E749 VanDerWaalsContact CA-OE2 3.3Å; I744-E749 WeakPolarHBondContact CA-OE2 3.09Å
745	Q	82.5	Confident	91.7	Very high	183 Å²	183	67.5 Å²	67.5	86%	0.855	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.2	12.2	-174.9	-42.2	-175.3	-44.2	0	0	115.1	A743 E749	A743-Q745 PolarHBondContact O-N 2.84Å; Q745-E749 PolarHBondContact N-OE2 2.84Å
746	S	87.4	Confident	91.6	Very high	25 Å²	25	61.2 Å²	61.2	18%	0.175	32%	0.321	C	S	.	.			trans	-70	146.7	173.4	-161.7	0	0	0	0	111.7	A739 E740 A743 I744 K748 E749	A739-S746 WeakPolarHBondContact O-CB 3.29Å; A739-S746 PolarHBondContact O-OG 2.9Å; E740-S746 PolarHBondContact O-OG 3.2Å; E740-S746 VanDerWaalsContact O-OG 3.08Å; A743-S746 WeakPolarHBondContact O-CB 3.33Å; A743-S746 PolarHBondContact O-N 3.24Å; I744-S746 VanDerWaalsContact C-N 3.3Å; S746-K748 PolarHBondContact O-N 2.96Å; S746-E749 PolarHBondContact O-N 3.39Å; S746-E749 VanDerWaalsContact O-N 3.14Å
747	C	80.8	Confident	91.5	Very high	123 Å²	123	57.5 Å²	57.5	83%	0.831	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.7	1.1	-177.6	63	0	0	0	0	114.5
748	K	90	Very high	91.2	Very high	61 Å²	61	60.2 Å²	60.2	27%	0.265	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-142.9	34.4	171.3	-59.1	-175.7	-174	174.7	0	111.1	E710 E713 E740 Y741 S746 V750	E710-K748 HydrophobicContact CB-CB 3.78Å; E710-K748 HydrophobicContact CB-CG 4.38Å; E713-K748 IonicContact OE2-NZ 3.84Å; E713-K748 PolarHBondContact OE2-NZ 3.19Å; E740-K748 HydrophobicContact CG-CD 4.39Å; E740-K748 WeakPolarHBondContact O-CB 3.41Å; E740-K748 IonicContact OE1-NZ 2.66Å; E740-K748 PolarHBondContact OE1-NZ 3.5Å; E740-K748 VanDerWaalsContact OE1-NZ 3.14Å; Y741-K748 WeakPolarHBondContact CA-O 3.4Å; Y741-K748 HydrophobicContact CD1-CB 3.94Å; Y741-K748 HydrophobicContact CD1-CD 4.37Å; Y741-K748 HydrophobicContact CE1-CB 3.95Å; Y741-K748 HydrophobicContact CE1-CD 3.56Å; Y741-K748 HydrophobicContact CE1-CG 4.48Å; Y741-K748 PolarHBondContact OH-NZ 3Å; Y741-K748 VanDerWaalsContact OH-NZ 3.08Å; S746-K748 PolarHBondContact O-N 2.96Å; K748-V750 PolarHBondContact O-N 3.08Å; K748-V750 VanDerWaalsContact O-N 3.14Å
749	E	92.2	Very high	91.1	Very high	63 Å²	63	61.5 Å²	61.5	29%	0.294	33%	0.325	S	S	.	.			trans	-56.8	116.6	178.5	-175.9	174.2	-177.9	0	0	110.4	Y741 I744 Q745 S746 R757	Y741-E749 WeakPolarHBondContact O-CA 3.32Å; I744-E749 VanDerWaalsContact CA-OE2 3.3Å; I744-E749 WeakPolarHBondContact CA-OE2 3.09Å; Q745-E749 PolarHBondContact N-OE2 2.84Å; S746-E749 PolarHBondContact O-N 3.39Å; S746-E749 VanDerWaalsContact O-N 3.14Å; E749-R757 IonicContact OE1-NH1 2.7Å; E749-R757 PolarHBondContact OE1-NH1 2.91Å
750	V	94.8	Very high	91.1	Very high	3 Å²	3	58.8 Å²	58.8	2%	0.018	30%	0.302	C	S	.	.			trans	-78.8	145.9	178.3	-71.1	0	0	0	0	111.1	E710 F714 Y741 I742 K748 L752 I779	E710-V750 HydrophobicContact CB-CG1 4.42Å; E710-V750 HydrophobicContact CG-CG1 4.02Å; F714-V750 HydrophobicContact CB-CG1 3.73Å; F714-V750 HydrophobicContact CD1-CG1 4.26Å; F714-V750 HydrophobicContact CD1-CG2 4.1Å; F714-V750 HydrophobicContact CE1-CG2 4.38Å; F714-V750 HydrophobicContact CG-CG1 4.09Å; F714-V750 HydrophobicContact CG-CG2 4.23Å; Y741-V750 HydrophobicContact CD1-CG1 4.36Å; Y741-V750 VanDerWaalsContact O-CG2 3.29Å; Y741-V750 WeakPolarHBondContact O-CG2 3.41Å; Y741-V750 PolarHBondContact O-N 3.2Å; I742-V750 HydrophobicContact CD1-CG2 3.98Å; K748-V750 PolarHBondContact O-N 3.08Å; K748-V750 VanDerWaalsContact O-N 3.14Å; V750-L752 HydrophobicContact CG2-CD1 3.9Å; V750-L752 HydrophobicContact CG2-CG 4.08Å; V750-L752 PolarHBondContact O-N 3.28Å; V750-I779 HydrophobicContact CB-CD1 3.73Å; V750-I779 HydrophobicContact CB-CG1 3.99Å; V750-I779 HydrophobicContact CG2-CD1 4.02Å; V750-I779 HydrophobicContact CG2-CG1 3.95Å
751	N	91.9	Very high	91	Very high	122 Å²	122	62.1 Å²	62.1	65%	0.652	32%	0.316	S	S	*	.			trans	-70.4	98.5	-175.1	-173.9	7.9	0	0	0	112.1	I779 L782	N751-I779 VanDerWaalsContact O-CD1 3.24Å; N751-I779 WeakPolarHBondContact O-CD1 3.23Å; N751-L782 HydrophobicContact CB-CD2 3.92Å
752	L	92.3	Very high	90.9	Very high	17 Å²	17	65.8 Å²	65.8	9%	0.089	34%	0.336	C	S	.	.			trans	-126.6	144.3	-179.4	-69	175	0	0	0	112	I742 V750 T756 A775 R778 I779	I742-L752 HydrophobicContact CD1-CD1 3.52Å; V750-L752 HydrophobicContact CG2-CD1 3.9Å; V750-L752 HydrophobicContact CG2-CG 4.08Å; V750-L752 PolarHBondContact O-N 3.28Å; L752-T756 HydrophobicContact CD1-CG2 4.39Å; L752-T756 HydrophobicContact CD2-CG2 3.93Å; L752-A775 HydrophobicContact CD1-CB 3.93Å; L752-A775 HydrophobicContact CD2-CB 4.41Å; L752-R778 HydrophobicContact CD2-CB 3.67Å; L752-R778 HydrophobicContact CD2-CG 4.29Å; L752-I779 HydrophobicContact CD2-CD1 3.66Å; L752-I779 HydrophobicContact CD2-CG1 3.9Å; L752-I779 HydrophobicContact CG-CD1 4.03Å; L752-I779 HydrophobicContact CG-CG1 4.42Å
753	D	86	Confident	90.8	Very high	61 Å²	61	67.7 Å²	67.7	33%	0.326	35%	0.346	S	S	.	.			trans	-68.5	147	166.7	57	-29.2	0	0	0	111	Y755 T756 R757 R778	D753-Y755 VanDerWaalsContact C-N 3.27Å; D753-Y755 PolarHBondContact O-N 3.19Å; D753-T756 PolarHBondContact O-N 2.68Å; D753-T756 WeakPolarHBondContact OD1-CB 3.12Å; D753-T756 PolarHBondContact OD1-OG1 3.17Å; D753-R757 PolarHBondContact O-N 3.19Å; D753-R757 VanDerWaalsContact O-N 3.16Å; D753-R778 IonicContact OD1-CZ 3.61Å; D753-R778 IonicContact OD1-NH1 2.72Å; D753-R778 PolarHBondContact OD1-NH1 2.97Å; D753-R778 IonicContact OD1-NH2 2.94Å; D753-R778 IonicContact OD2-CZ 2.82Å; D753-R778 IonicContact OD2-NH1 3.42Å; D753-R778 PolarHBondContact OD2-NH1 3.09Å; D753-R778 IonicContact OD2-NH2 2.78Å; D753-R778 PolarHBondContact OD2-NH2 2.96Å
754	S	89.9	Confident	90.9	Very high	56 Å²	56	67.8 Å²	67.8	39%	0.392	34%	0.343	S	S	.	.	H	α-helix	trans	-58.3	-40.7	-172.4	-145.5	0	0	0	0	112.1	T756 R757 D758	S754-T756 VanDerWaalsContact C-N 3.28Å; S754-T756 PolarHBondContact O-N 3.36Å; S754-R757 CarbonylContact O-C 3.56Å; S754-R757 PolarHBondContact O-N 2.81Å; S754-R757 PolarHBondContact OG-NH2 3.1Å; S754-R757 VanDerWaalsContact OG-NH2 3.08Å; S754-D758 WeakPolarHBondContact CB-OD2 3.41Å; S754-D758 WeakPolarHBondContact O-CB 3.4Å; S754-D758 VanDerWaalsContact O-CG 3.32Å; S754-D758 PolarHBondContact O-N 3.48Å; S754-D758 PolarHBondContact OG-OD2 2.89Å
755	Y	92.5	Very high	91.1	Very high	157 Å²	157	69.6 Å²	69.6	62%	0.616	35%	0.35	S	S	*	.	H	α-helix	trans	-48.6	-46.7	173.3	173.2	-99.2	0	0	0	113.1	D753 H759 L774	D753-Y755 VanDerWaalsContact C-N 3.27Å; D753-Y755 PolarHBondContact O-N 3.19Å; Y755-H759 WeakPolarHBondContact O-CB 3.47Å; Y755-H759 PolarHBondContact O-N 3.46Å; Y755-L774 HydrophobicContact CD1-CD2 4.33Å; Y755-L774 HydrophobicContact CE1-CD2 3.84Å
756	T	93.6	Very high	91.5	Very high	0 Å²	0	67.5 Å²	67.5	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-70	-39	179.2	-59.1	0	0	0	0	111.9	L752 D753 S754 T760 L774 A775 R778	L752-T756 HydrophobicContact CD1-CG2 4.39Å; L752-T756 HydrophobicContact CD2-CG2 3.93Å; D753-T756 PolarHBondContact O-N 2.68Å; D753-T756 WeakPolarHBondContact OD1-CB 3.12Å; D753-T756 PolarHBondContact OD1-OG1 3.17Å; S754-T756 VanDerWaalsContact C-N 3.28Å; S754-T756 PolarHBondContact O-N 3.36Å; T756-T760 VanDerWaalsContact O-CB 3.32Å; T756-T760 WeakPolarHBondContact O-CB 3.37Å; T756-T760 PolarHBondContact O-N 3.43Å; T756-T760 PolarHBondContact O-OG1 3.18Å; T756-L774 HydrophobicContact CG2-CB 4.37Å; T756-L774 HydrophobicContact CG2-CD2 3.99Å; T756-L774 HydrophobicContact CG2-CG 3.81Å; T756-A775 HydrophobicContact CG2-CB 3.89Å; T756-R778 HydrophobicContact CG2-CG 4.08Å; T756-R778 PolarHBondContact OG1-NH2 3.11Å
757	R	94.2	Very high	91.7	Very high	41 Å²	41	67 Å²	67	16%	0.155	34%	0.34	C	S	.	.	H	α-helix	trans	-66.6	-43.9	177.6	178	171.6	58.7	-145.8	-11.8	112.1	I742 E749 D753 S754 T760 K761	I742-R757 HydrophobicContact CG2-CG 3.9Å; I742-R757 VanDerWaalsContact O-CD 3.23Å; I742-R757 WeakPolarHBondContact O-CD 3.42Å; E749-R757 IonicContact OE1-NH1 2.7Å; E749-R757 PolarHBondContact OE1-NH1 2.91Å; D753-R757 PolarHBondContact O-N 3.19Å; D753-R757 VanDerWaalsContact O-N 3.16Å; S754-R757 CarbonylContact O-C 3.56Å; S754-R757 PolarHBondContact O-N 2.81Å; S754-R757 PolarHBondContact OG-NH2 3.1Å; S754-R757 VanDerWaalsContact OG-NH2 3.08Å; R757-T760 PolarHBondContact O-N 3Å; R757-K761 WeakPolarHBondContact O-CB 3.26Å; R757-K761 PolarHBondContact O-N 3.37Å
758	D	92.3	Very high	92.4	Very high	61 Å²	61	64.1 Å²	64.1	33%	0.326	32%	0.318	S	S	.	.	H	α-helix	trans	-72	-42.7	-179.4	-65.5	-51	0	0	0	110.7	S754 T760 K761 D762	S754-D758 WeakPolarHBondContact CB-OD2 3.41Å; S754-D758 WeakPolarHBondContact O-CB 3.4Å; S754-D758 VanDerWaalsContact O-CG 3.32Å; S754-D758 PolarHBondContact O-N 3.48Å; S754-D758 PolarHBondContact OG-OD2 2.89Å; D758-T760 VanDerWaalsContact C-N 3.31Å; D758-T760 PolarHBondContact O-N 3.46Å; D758-K761 WeakPolarHBondContact O-CB 3.37Å; D758-K761 PolarHBondContact O-N 3.49Å; D758-K761 VanDerWaalsContact O-N 3.08Å; D758-D762 PolarHBondContact O-N 2.8Å
759	H	94.3	Very high	92.6	Very high	70 Å²	70	67.8 Å²	67.8	32%	0.324	33%	0.331	S	S	.	.	H	α-helix	trans	-58.9	-40.1	169.2	177.8	64.6	0	0	0	112.5	Y755 K761 D762 N763	Y755-H759 WeakPolarHBondContact O-CB 3.47Å; Y755-H759 PolarHBondContact O-N 3.46Å; H759-K761 VanDerWaalsContact C-N 3.32Å; H759-K761 PolarHBondContact O-N 3.22Å; H759-D762 PolarHBondContact O-N 3.27Å; H759-N763 PolarHBondContact CD2-ND2 3.43Å; H759-N763 PolarHBondContact NE2-ND2 2.87Å; H759-N763 PolarHBondContact O-N 3.19Å; H759-N763 PolarHBondContact O-ND2 3.34Å
760	T	95.1	Very high	92.7	Very high	0 Å²	0	67.8 Å²	67.8	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-65.2	-36	175	-57.5	0	0	0	0	111.9	F738 I742 T756 R757 D758 N763 L764 F772	F738-T760 HydrophobicContact CD2-CG2 4.35Å; I742-T760 HydrophobicContact CG1-CG2 4.39Å; I742-T760 HydrophobicContact CG2-CG2 4.14Å; T756-T760 VanDerWaalsContact O-CB 3.32Å; T756-T760 WeakPolarHBondContact O-CB 3.37Å; T756-T760 PolarHBondContact O-N 3.43Å; T756-T760 PolarHBondContact O-OG1 3.18Å; R757-T760 PolarHBondContact O-N 3Å; D758-T760 VanDerWaalsContact C-N 3.31Å; D758-T760 PolarHBondContact O-N 3.46Å; T760-N763 PolarHBondContact O-N 2.94Å; T760-L764 HydrophobicContact CG2-CD1 4.42Å; T760-L764 WeakPolarHBondContact O-CD1 3.47Å; T760-L764 PolarHBondContact O-N 2.88Å; T760-F772 HydrophobicContact CG2-CD1 3.55Å; T760-F772 HydrophobicContact CG2-CE1 3.64Å
761	K	94.3	Very high	92.8	Very high	116 Å²	116	67.6 Å²	67.6	50%	0.504	34%	0.337	S	S	.	.	H	α-helix	trans	-66.9	-37.1	176.2	176.2	-169.6	168.3	-160.3	0	111.9	F738 R757 D758 H759 L764	F738-K761 HydrophobicContact CE2-CB 3.75Å; F738-K761 HydrophobicContact CE2-CG 4.38Å; F738-K761 HydrophobicContact CZ-CB 3.93Å; F738-K761 HydrophobicContact CZ-CG 4.11Å; R757-K761 WeakPolarHBondContact O-CB 3.26Å; R757-K761 PolarHBondContact O-N 3.37Å; D758-K761 WeakPolarHBondContact O-CB 3.37Å; D758-K761 PolarHBondContact O-N 3.49Å; D758-K761 VanDerWaalsContact O-N 3.08Å; H759-K761 VanDerWaalsContact C-N 3.32Å; H759-K761 PolarHBondContact O-N 3.22Å; K761-L764 WeakPolarHBondContact O-CB 3.17Å; K761-L764 PolarHBondContact O-N 3.35Å
762	D	94.2	Very high	93	Very high	87 Å²	87	62 Å²	62	47%	0.465	31%	0.306	S	S	.	.	H	α-helix	trans	-72.4	-37.7	174.7	-67.7	-31.5	0	0	0	112	D758 H759 L764 Q765	D758-D762 PolarHBondContact O-N 2.8Å; H759-D762 PolarHBondContact O-N 3.27Å; D762-L764 PolarHBondContact O-N 3.08Å; D762-L764 VanDerWaalsContact O-N 3.1Å; D762-Q765 WeakPolarHBondContact O-CB 3.37Å; D762-Q765 WeakPolarHBondContact O-CG 3.49Å; D762-Q765 PolarHBondContact O-N 3.33Å; D762-Q765 PolarHBondContact OD1-NE2 2.86Å
763	N	93.2	Very high	93.3	Very high	40 Å²	40	63.4 Å²	63.4	21%	0.214	31%	0.314	C	S	.	.	H	α-helix	trans	-61.1	-17	170.3	-66.2	-20.6	0	0	0	113.4	H759 T760 Q765 N766 C771	H759-N763 PolarHBondContact CD2-ND2 3.43Å; H759-N763 PolarHBondContact NE2-ND2 2.87Å; H759-N763 PolarHBondContact O-N 3.19Å; H759-N763 PolarHBondContact O-ND2 3.34Å; T760-N763 PolarHBondContact O-N 2.94Å; N763-Q765 VanDerWaalsContact C-N 3.31Å; N763-N766 CarbonylContact O-C 3.46Å; N763-C771 HydrophobicContact CB-CB 4.29Å; N763-C771 PolarHBondContact ND2-O 3.2Å; N763-C771 PolarHBondContact O-SG 3.03Å
764	L	92.7	Very high	93.7	Very high	28 Å²	28	62.3 Å²	62.3	15%	0.147	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.6	-13.3	172.3	-104.3	82.2	0	0	0	114	K735 F738 T760 K761 D762 V767 F772	K735-L764 HydrophobicContact CG-CD2 4.15Å; F738-L764 HydrophobicContact CB-CD1 4.05Å; F738-L764 HydrophobicContact CB-CD2 3.54Å; F738-L764 HydrophobicContact CB-CG 4.46Å; F738-L764 HydrophobicContact CD1-CD2 4.19Å; F738-L764 HydrophobicContact CD2-CD1 3.74Å; F738-L764 HydrophobicContact CD2-CD2 3.98Å; F738-L764 HydrophobicContact CD2-CG 4.49Å; F738-L764 HydrophobicContact CG-CD1 4.15Å; F738-L764 HydrophobicContact CG-CD2 3.63Å; T760-L764 HydrophobicContact CG2-CD1 4.42Å; T760-L764 WeakPolarHBondContact O-CD1 3.47Å; T760-L764 PolarHBondContact O-N 2.88Å; K761-L764 WeakPolarHBondContact O-CB 3.17Å; K761-L764 PolarHBondContact O-N 3.35Å; D762-L764 PolarHBondContact O-N 3.08Å; D762-L764 VanDerWaalsContact O-N 3.1Å; L764-V767 WeakPolarHBondContact O-CG2 3.32Å; L764-F772 HydrophobicContact CD1-CE1 4.17Å; L764-F772 HydrophobicContact CD1-CZ 4.06Å
765	Q	89.6	Confident	94.1	Very high	148 Å²	148	59.6 Å²	59.6	69%	0.692	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.2	-53.6	172.1	-56	-169.8	42.7	0	0	109.8	D762 N763	D762-Q765 WeakPolarHBondContact O-CB 3.37Å; D762-Q765 WeakPolarHBondContact O-CG 3.49Å; D762-Q765 PolarHBondContact O-N 3.33Å; D762-Q765 PolarHBondContact OD1-NE2 2.86Å; N763-Q765 VanDerWaalsContact C-N 3.31Å
766	N	89.7	Confident	94.3	Very high	139 Å²	139	52.6 Å²	52.6	74%	0.743	26%	0.262	S	S	*	.	S	Bend	trans	-109.3	79.8	177.9	-72.9	-37.8	0	0	0	110.5	N763 T768	N763-N766 CarbonylContact O-C 3.46Å; N766-T768 PolarHBondContact O-N 3.21Å; N766-T768 VanDerWaalsContact O-N 3.16Å
767	V	93.1	Very high	94.5	Very high	13 Å²	13	60.5 Å²	60.5	8%	0.079	29%	0.292	C	S	.	.			trans	-65	113	-171.1	-176.4	0	0	0	0	112.5	Y721 Q727 M730 A731 A734 L764	Y721-V767 WeakPolarHBondContact OH-CG1 3.38Å; Q727-V767 PolarHBondContact NE2-O 3.45Å; M730-V767 HydrophobicContact CG-CG1 3.95Å; M730-V767 HydrophobicContact SD-CG1 4.34Å; A731-V767 HydrophobicContact CB-CG2 4.37Å; A734-V767 HydrophobicContact CB-CG1 3.79Å; A734-V767 HydrophobicContact CB-CG2 4.45Å; L764-V767 WeakPolarHBondContact O-CG2 3.32Å
768	T	94.6	Very high	94.6	Very high	63 Å²	63	63.5 Å²	63.5	39%	0.387	30%	0.303	S	S	.	.			trans	-116.3	170.5	175.4	63.7	0	0	0	0	112.3	Y721 M730 N766 S770 C771	Y721-T768 WeakPolarHBondContact CE1-O 3.39Å; Y721-T768 PolarHBondContact OH-O 3.32Å; M730-T768 VanDerWaalsContact SD-C 3.59Å; N766-T768 PolarHBondContact O-N 3.21Å; N766-T768 VanDerWaalsContact O-N 3.16Å; T768-S770 PolarHBondContact O-N 3.03Å; T768-S770 PolarHBondContact OG1-N 3.08Å; T768-S770 PolarHBondContact OG1-OG 3.27Å; T768-S770 VanDerWaalsContact OG1-OG 3.09Å; T768-C771 WeakPolarHBondContact O-CB 3.47Å; T768-C771 PolarHBondContact O-N 3.22Å; T768-C771 PolarHBondContact OG1-N 3.2Å
769	R	94.1	Very high	94.8	Very high	138 Å²	138	60.6 Å²	60.6	52%	0.521	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-28	172.5	-67.6	-172.1	-175.3	109.3	10.6	113.4	Y721 I724 M730	Y721-R769 WeakPolarHBondContact CE1-O 3.31Å; I724-R769 PolarHBondContact O-NE 2.67Å; M730-R769 HydrophobicContact CE-CG 3.54Å; M730-R769 HydrophobicContact SD-CG 4.11Å
770	S	95.1	Very high	95	Very high	63 Å²	63	58.7 Å²	58.7	44%	0.441	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88	0.6	-179.9	49.1	0	0	0	0	114.6	T768 F772 D773	T768-S770 PolarHBondContact O-N 3.03Å; T768-S770 PolarHBondContact OG1-N 3.08Å; T768-S770 PolarHBondContact OG1-OG 3.27Å; T768-S770 VanDerWaalsContact OG1-OG 3.09Å; S770-F772 PolarHBondContact O-N 3.34Å; S770-D773 WeakPolarHBondContact CA-OD2 3.27Å; S770-D773 WeakPolarHBondContact CB-OD2 3.2Å; S770-D773 WeakPolarHBondContact O-CB 3.36Å; S770-D773 PolarHBondContact O-N 3.27Å
771	C	95.6	Very high	95	Very high	0 Å²	0	59.4 Å²	59.4	0%	0	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-45.4	-32.9	-176.9	-179	0	0	0	0	115.1	Y721 N763 T768	Y721-C771 HydrophobicContact CE1-CB 4.16Å; N763-C771 HydrophobicContact CB-CB 4.29Å; N763-C771 PolarHBondContact ND2-O 3.2Å; N763-C771 PolarHBondContact O-SG 3.03Å; T768-C771 WeakPolarHBondContact O-CB 3.47Å; T768-C771 PolarHBondContact O-N 3.22Å; T768-C771 PolarHBondContact OG1-N 3.2Å
772	F	97.5	Very high	95.1	Very high	3 Å²	3	56.2 Å²	56.2	1%	0.013	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.2	5.5	-178.8	-58.6	-75.5	0	0	0	114.5	F714 C718 Y721 A734 I737 I742 T760 L764 S770 L774 A775 Q776	F714-F772 HydrophobicContact CE2-CD1 4.38Å; C718-F772 VanDerWaalsContact SG-CB 3.59Å; Y721-F772 AromaticContact CD1-CD2 3.78Å; Y721-F772 HydrophobicContact CD1-CD2 3.78Å; Y721-F772 HydrophobicContact CD1-CE2 4.2Å; Y721-F772 HydrophobicContact CD2-CE2 4.19Å; Y721-F772 AromaticContact CE1-CD2 3.71Å; Y721-F772 HydrophobicContact CE1-CD2 3.71Å; Y721-F772 AromaticContact CE1-CE2 3.97Å; Y721-F772 HydrophobicContact CE1-CE2 3.97Å; Y721-F772 HydrophobicContact CE2-CD2 4.48Å; Y721-F772 AromaticContact CE2-CE2 3.96Å; Y721-F772 HydrophobicContact CE2-CE2 3.96Å; Y721-F772 HydrophobicContact CG-CD2 4.2Å; Y721-F772 HydrophobicContact CG-CE2 4.3Å; Y721-F772 AromaticContact CZ-CE2 3.83Å; A734-F772 HydrophobicContact CB-CE2 3.95Å; A734-F772 HydrophobicContact CB-CZ 4Å; I737-F772 HydrophobicContact CB-CE1 4.25Å; I737-F772 HydrophobicContact CB-CE2 4.27Å; I737-F772 HydrophobicContact CB-CZ 3.88Å; I737-F772 HydrophobicContact CD1-CD2 4.5Å; I737-F772 HydrophobicContact CD1-CE2 4.17Å; I737-F772 HydrophobicContact CG2-CD1 4.03Å; I737-F772 HydrophobicContact CG2-CE1 3.68Å; I737-F772 HydrophobicContact CG2-CE2 4.22Å; I737-F772 HydrophobicContact CG2-CG 4.46Å; I737-F772 HydrophobicContact CG2-CZ 3.79Å; I742-F772 HydrophobicContact CG1-CE1 4.4Å; T760-F772 HydrophobicContact CG2-CD1 3.55Å; T760-F772 HydrophobicContact CG2-CE1 3.64Å; L764-F772 HydrophobicContact CD1-CE1 4.17Å; L764-F772 HydrophobicContact CD1-CZ 4.06Å; S770-F772 PolarHBondContact O-N 3.34Å; F772-L774 PolarHBondContact O-N 2.88Å; F772-A775 PolarHBondContact O-N 2.92Å; F772-A775 VanDerWaalsContact O-N 3.17Å; F772-Q776 WeakPolarHBondContact O-CB 3.33Å; F772-Q776 PolarHBondContact O-N 2.96Å
773	D	97.1	Very high	95.2	Very high	48 Å²	48	52.1 Å²	52.1	26%	0.257	25%	0.251	S	S	.	.	H	α-helix	trans	-60.6	-40.4	-170.6	-87.3	-36.5	0	0	0	113.5	K722 S770 R777	K722-D773 WeakPolarHBondContact CE-OD1 3.47Å; K722-D773 IonicContact NZ-OD1 2.68Å; K722-D773 PolarHBondContact NZ-OD1 3.34Å; S770-D773 WeakPolarHBondContact CA-OD2 3.27Å; S770-D773 WeakPolarHBondContact CB-OD2 3.2Å; S770-D773 WeakPolarHBondContact O-CB 3.36Å; S770-D773 PolarHBondContact O-N 3.27Å; D773-R777 VanDerWaalsContact O-CB 3.28Å; D773-R777 WeakPolarHBondContact O-CB 3.36Å; D773-R777 PolarHBondContact O-N 3.03Å
774	L	96.2	Very high	95.3	Very high	37 Å²	37	53.7 Å²	53.7	19%	0.194	26%	0.257	C	S	.	.	H	α-helix	trans	-64.1	-48.4	176	-176.3	64.7	0	0	0	111	Y755 T756 F772 R777 R778	Y755-L774 HydrophobicContact CD1-CD2 4.33Å; Y755-L774 HydrophobicContact CE1-CD2 3.84Å; T756-L774 HydrophobicContact CG2-CB 4.37Å; T756-L774 HydrophobicContact CG2-CD2 3.99Å; T756-L774 HydrophobicContact CG2-CG 3.81Å; F772-L774 PolarHBondContact O-N 2.88Å; L774-R777 PolarHBondContact O-N 3.29Å; L774-R778 WeakPolarHBondContact O-CG 3.48Å; L774-R778 PolarHBondContact O-N 2.56Å
775	A	96.6	Very high	95.3	Very high	0 Å²	0	60.4 Å²	60.4	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-63.1	-46.1	179.1	0	0	0	0	0	112.2	F714 I742 L752 T756 F772 R777 R778 I779	F714-A775 HydrophobicContact CE1-CB 4.15Å; F714-A775 HydrophobicContact CZ-CB 3.76Å; I742-A775 HydrophobicContact CD1-CB 4.32Å; L752-A775 HydrophobicContact CD1-CB 3.93Å; L752-A775 HydrophobicContact CD2-CB 4.41Å; T756-A775 HydrophobicContact CG2-CB 3.89Å; F772-A775 PolarHBondContact O-N 2.92Å; F772-A775 VanDerWaalsContact O-N 3.17Å; A775-R777 VanDerWaalsContact C-N 3.28Å; A775-R777 PolarHBondContact O-N 2.82Å; A775-R778 PolarHBondContact O-N 3.39Å; A775-I779 WeakPolarHBondContact O-CG1 3.28Å; A775-I779 PolarHBondContact O-N 3.3Å
776	Q	97.9	Very high	95.4	Very high	9 Å²	9	56.7 Å²	56.7	4%	0.042	27%	0.271	C	S	.	.	H	α-helix	trans	-59.8	-39.4	176.1	-170.7	-175.9	1.6	0	0	111.1	W715 C718 E719 F772 Y780	W715-Q776 VanDerWaalsContact CD1-CG 3.43Å; W715-Q776 HydrophobicContact CG-CG 4.16Å; C718-Q776 HydrophobicContact CB-CB 4.2Å; C718-Q776 HydrophobicContact CB-CG 3.94Å; E719-Q776 PolarHBondContact OE1-NE2 2.8Å; F772-Q776 WeakPolarHBondContact O-CB 3.33Å; F772-Q776 PolarHBondContact O-N 2.96Å; Q776-Y780 VanDerWaalsContact O-CB 3.27Å; Q776-Y780 WeakPolarHBondContact O-CB 3.18Å; Q776-Y780 PolarHBondContact O-N 3.33Å
777	R	97.4	Very high	95.6	Very high	167 Å²	167	50.3 Å²	50.3	63%	0.63	24%	0.237	S	C	*	.	H	α-helix	trans	-67.5	-39.9	176.1	-167.5	-175.7	-58.9	134.1	4.6	112.6	D773 L774 A775 G781	D773-R777 VanDerWaalsContact O-CB 3.28Å; D773-R777 WeakPolarHBondContact O-CB 3.36Å; D773-R777 PolarHBondContact O-N 3.03Å; L774-R777 PolarHBondContact O-N 3.29Å; A775-R777 VanDerWaalsContact C-N 3.28Å; A775-R777 PolarHBondContact O-N 2.82Å; R777-G781 PolarHBondContact O-N 3.28Å
778	R	96.5	Very high	95.8	Very high	104 Å²	104	50.5 Å²	50.5	39%	0.392	24%	0.236	S	C	.	.	H	α-helix	trans	-62.9	-47	174.3	-67	-50.7	-169.7	87	13.2	111.5	L752 D753 T756 L774 A775 G781 L782	L752-R778 HydrophobicContact CD2-CB 3.67Å; L752-R778 HydrophobicContact CD2-CG 4.29Å; D753-R778 IonicContact OD1-CZ 3.61Å; D753-R778 IonicContact OD1-NH1 2.72Å; D753-R778 PolarHBondContact OD1-NH1 2.97Å; D753-R778 IonicContact OD1-NH2 2.94Å; D753-R778 IonicContact OD2-CZ 2.82Å; D753-R778 IonicContact OD2-NH1 3.42Å; D753-R778 PolarHBondContact OD2-NH1 3.09Å; D753-R778 IonicContact OD2-NH2 2.78Å; D753-R778 PolarHBondContact OD2-NH2 2.96Å; T756-R778 HydrophobicContact CG2-CG 4.08Å; T756-R778 PolarHBondContact OG1-NH2 3.11Å; L774-R778 WeakPolarHBondContact O-CG 3.48Å; L774-R778 PolarHBondContact O-N 2.56Å; A775-R778 PolarHBondContact O-N 3.39Å; R778-G781 PolarHBondContact O-N 2.87Å; R778-L782 PolarHBondContact O-N 2.82Å
779	I	97.2	Very high	95.8	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-71.9	-34.5	-178.8	-60.9	-51.1	0	0	0	112.7	N711 F714 V750 N751 L752 A775 L782 M783	N711-I779 HydrophobicContact CB-CG2 3.55Å; N711-I779 WeakPolarHBondContact O-CG2 3.19Å; F714-I779 HydrophobicContact CD1-CB 3.99Å; F714-I779 HydrophobicContact CD1-CG1 3.79Å; F714-I779 HydrophobicContact CD1-CG2 4.09Å; F714-I779 HydrophobicContact CE1-CB 4.18Å; F714-I779 HydrophobicContact CE1-CG1 3.82Å; V750-I779 HydrophobicContact CB-CD1 3.73Å; V750-I779 HydrophobicContact CB-CG1 3.99Å; V750-I779 HydrophobicContact CG2-CD1 4.02Å; V750-I779 HydrophobicContact CG2-CG1 3.95Å; N751-I779 VanDerWaalsContact O-CD1 3.24Å; N751-I779 WeakPolarHBondContact O-CD1 3.23Å; L752-I779 HydrophobicContact CD2-CD1 3.66Å; L752-I779 HydrophobicContact CD2-CG1 3.9Å; L752-I779 HydrophobicContact CG-CD1 4.03Å; L752-I779 HydrophobicContact CG-CG1 4.42Å; A775-I779 WeakPolarHBondContact O-CG1 3.28Å; A775-I779 PolarHBondContact O-N 3.3Å; I779-L782 HydrophobicContact CD1-CD2 4.24Å; I779-L782 PolarHBondContact O-N 3.36Å; I779-M783 HydrophobicContact CG2-CE 4.39Å; I779-M783 PolarHBondContact O-N 2.89Å
780	Y	97.7	Very high	95.8	Very high	30 Å²	30	46.8 Å²	46.8	12%	0.118	22%	0.221	C	C	.	.	H	α-helix	trans	-59.7	-50.7	169.1	-178.4	-91.7	0	0	0	111	L686 D687 L690 W715 Q776 L782 M783 E784	L686-Y780 HydrophobicContact CB-CE2 4.22Å; L686-Y780 WeakPolarHBondContact CB-OH 3.43Å; L686-Y780 HydrophobicContact CD2-CD2 3.96Å; L686-Y780 HydrophobicContact CD2-CE2 3.6Å; L686-Y780 HydrophobicContact CG-CE2 3.73Å; D687-Y780 PolarHBondContact N-OH 3.44Å; D687-Y780 VanDerWaalsContact N-OH 3.17Å; D687-Y780 PolarHBondContact OD1-OH 3.48Å; D687-Y780 PolarHBondContact OD2-OH 2.89Å; L690-Y780 HydrophobicContact CD1-CD2 4.39Å; L690-Y780 HydrophobicContact CD1-CE2 4.06Å; W715-Y780 AromaticContact NE1-CD2 3.51Å; Q776-Y780 VanDerWaalsContact O-CB 3.27Å; Q776-Y780 WeakPolarHBondContact O-CB 3.18Å; Q776-Y780 PolarHBondContact O-N 3.33Å; Y780-L782 PolarHBondContact O-N 3.21Å; Y780-M783 PolarHBondContact O-N 3.44Å; Y780-E784 HydrophobicContact CE1-CB 4.4Å; Y780-E784 WeakPolarHBondContact CE1-OE1 3.3Å; Y780-E784 VanDerWaalsContact O-CB 3.29Å; Y780-E784 WeakPolarHBondContact O-CB 3.26Å; Y780-E784 PolarHBondContact O-N 2.86Å
781	G	95.8	Very high	95.8	Very high	15 Å²	15	43.8 Å²	43.8	16%	0.155	20%	0.2	C	C	.	.	H	α-helix	trans	-65.8	-21.3	178.1	0	0	0	0	0	114.7	R777 R778 K785	R777-G781 PolarHBondContact O-N 3.28Å; R778-G781 PolarHBondContact O-N 2.87Å; G781-K785 WeakPolarHBondContact O-CB 3.46Å; G781-K785 WeakPolarHBondContact O-CD 3.42Å; G781-K785 WeakPolarHBondContact O-CG 3.43Å; G781-K785 PolarHBondContact O-N 3.08Å
782	L	94.5	Very high	95.8	Very high	49 Å²	49	45.6 Å²	45.6	26%	0.257	21%	0.209	S	C	.	.	H	α-helix	trans	-71.9	-55	169.2	176.2	62.7	0	0	0	110.4	N751 R778 I779 Y780 E784 K785 D786	N751-L782 HydrophobicContact CB-CD2 3.92Å; R778-L782 PolarHBondContact O-N 2.82Å; I779-L782 HydrophobicContact CD1-CD2 4.24Å; I779-L782 PolarHBondContact O-N 3.36Å; Y780-L782 PolarHBondContact O-N 3.21Å; L782-E784 VanDerWaalsContact C-N 3.29Å; L782-E784 PolarHBondContact O-N 3.19Å; L782-K785 PolarHBondContact O-N 3.36Å; L782-D786 WeakPolarHBondContact O-CB 3.41Å; L782-D786 PolarHBondContact O-N 2.98Å; L782-D786 VanDerWaalsContact O-N 3.08Å
783	M	96.4	Very high	95.5	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-57	-42.5	177.2	-70.9	-172.6	-65.7	0	0	111.8	L686 F699 L703 N711 L712 W715 I779 Y780 K785 S787 Y788	L686-M783 HydrophobicContact CD2-CB 3.95Å; F699-M783 HydrophobicContact CE1-SD 4.06Å; F699-M783 HydrophobicContact CZ-CB 4.32Å; L703-M783 HydrophobicContact CD1-SD 4.37Å; N711-M783 HydrophobicContact CB-CG 3.74Å; N711-M783 HydrophobicContact CB-SD 3.76Å; L712-M783 HydrophobicContact CB-SD 3.92Å; L712-M783 HydrophobicContact CD1-SD 4.5Å; W715-M783 HydrophobicContact CB-CE 3.99Å; W715-M783 HydrophobicContact CG-CE 4.19Å; I779-M783 HydrophobicContact CG2-CE 4.39Å; I779-M783 PolarHBondContact O-N 2.89Å; Y780-M783 PolarHBondContact O-N 3.44Å; M783-K785 VanDerWaalsContact C-N 3.35Å; M783-K785 PolarHBondContact O-N 3.36Å; M783-S787 PolarHBondContact O-N 2.99Å; M783-Y788 WeakPolarHBondContact O-CB 3.33Å; M783-Y788 PolarHBondContact O-N 3.13Å
784	E	97	Very high	95.3	Very high	73 Å²	73	52.3 Å²	52.3	34%	0.341	23%	0.234	S	C	.	.	H	α-helix	trans	-64.2	-33.5	-179.5	-175.7	175.6	-119.8	0	0	113.7	L686 Y780 L782 P789	L686-E784 HydrophobicContact CD2-CB 3.94Å; Y780-E784 HydrophobicContact CE1-CB 4.4Å; Y780-E784 WeakPolarHBondContact CE1-OE1 3.3Å; Y780-E784 VanDerWaalsContact O-CB 3.29Å; Y780-E784 WeakPolarHBondContact O-CB 3.26Å; Y780-E784 PolarHBondContact O-N 2.86Å; L782-E784 VanDerWaalsContact C-N 3.29Å; L782-E784 PolarHBondContact O-N 3.19Å; E784-P789 VanDerWaalsContact O-CD 3.27Å; E784-P789 WeakPolarHBondContact O-CD 3.46Å; E784-P789 WeakPolarHBondContact O-CG 3.27Å
785	K	92.7	Very high	94.8	Very high	169 Å²	169	58 Å²	58	74%	0.735	26%	0.259	S	S	*	.	H	α-helix	trans	-93.1	-22.4	-175.9	-70	175.3	-173.8	178.6	0	114	G781 L782 M783	G781-K785 WeakPolarHBondContact O-CB 3.46Å; G781-K785 WeakPolarHBondContact O-CD 3.42Å; G781-K785 WeakPolarHBondContact O-CG 3.43Å; G781-K785 PolarHBondContact O-N 3.08Å; L782-K785 PolarHBondContact O-N 3.36Å; M783-K785 VanDerWaalsContact C-N 3.35Å; M783-K785 PolarHBondContact O-N 3.36Å
786	D	91.4	Very high	94.3	Very high	71 Å²	71	62.1 Å²	62.1	38%	0.38	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-121.4	-68.5	-170.2	179.2	26.6	0	0	0	112.8	L782 P789 R790	L782-D786 WeakPolarHBondContact O-CB 3.41Å; L782-D786 PolarHBondContact O-N 2.98Å; L782-D786 VanDerWaalsContact O-N 3.08Å; D786-P789 WeakPolarHBondContact O-CD 3.5Å; D786-R790 WeakPolarHBondContact O-CG 3.39Å; D786-R790 PolarHBondContact O-N 3.01Å; D786-R790 PolarHBondContact O-NE 3.24Å; D786-R790 IonicContact OD1-CZ 3.29Å; D786-R790 VanDerWaalsContact OD1-CZ 3.22Å; D786-R790 IonicContact OD1-NE 2.68Å; D786-R790 PolarHBondContact OD1-NE 3.47Å; D786-R790 IonicContact OD1-NH2 2.64Å; D786-R790 PolarHBondContact OD1-NH2 2.93Å; D786-R790 IonicContact OD2-CZ 3.9Å; D786-R790 IonicContact OD2-NH2 3.38Å; D786-R790 PolarHBondContact OD2-NH2 2.91Å
787	S	93.1	Very high	93.9	Very high	4 Å²	4	62.3 Å²	62.3	3%	0.028	28%	0.281	C	S	.	.	H	α-helix	trans	-71.2	-38.3	-176	-44.9	0	0	0	0	113.4	F702 L703 M783 R790 F791	F702-S787 WeakPolarHBondContact CE1-O 3.44Å; L703-S787 VanDerWaalsContact CD2-CB 3.45Å; M783-S787 PolarHBondContact O-N 2.99Å; S787-R790 CarbonylContact O-C 3.34Å; S787-R790 PolarHBondContact O-N 3.13Å; S787-F791 PolarHBondContact O-N 3.14Å
788	Y	96.7	Very high	93.5	Very high	18 Å²	18	57.3 Å²	57.3	7%	0.071	27%	0.267	C	S	.	.	H	α-helix	trans	-66.2	-45.9	-178	167.3	-104.4	0	0	0	112.6	W682 G683 S685 L686 L689 M783 R790 F791 L792	W682-Y788 WeakPolarHBondContact O-CE2 3.34Å; W682-Y788 PolarHBondContact O-OH 2.84Å; G683-Y788 PolarHBondContact O-OH 3.39Å; S685-Y788 VanDerWaalsContact CA-OH 3.26Å; S685-Y788 WeakPolarHBondContact CA-OH 3.26Å; S685-Y788 PolarHBondContact N-OH 3.23Å; S685-Y788 VanDerWaalsContact N-OH 3.14Å; L686-Y788 HydrophobicContact CB-CD1 4.39Å; L686-Y788 HydrophobicContact CB-CD2 4Å; L686-Y788 HydrophobicContact CB-CE2 4.1Å; L686-Y788 HydrophobicContact CB-CG 4.14Å; L686-Y788 HydrophobicContact CD1-CD2 3.83Å; L686-Y788 HydrophobicContact CD1-CE2 4.46Å; L686-Y788 HydrophobicContact CD1-CG 4.29Å; L686-Y788 HydrophobicContact CG-CD2 4.48Å; L689-Y788 HydrophobicContact CB-CE2 4.41Å; L689-Y788 HydrophobicContact CD2-CD2 3.7Å; L689-Y788 HydrophobicContact CD2-CE2 3.91Å; M783-Y788 WeakPolarHBondContact O-CB 3.33Å; M783-Y788 PolarHBondContact O-N 3.13Å; Y788-R790 PolarHBondContact O-N 2.77Å; Y788-F791 WeakPolarHBondContact O-CB 3.22Å; Y788-F791 PolarHBondContact O-N 3.37Å; Y788-L792 HydrophobicContact CD1-CD1 4.41Å; Y788-L792 HydrophobicContact CD2-CG 4.43Å; Y788-L792 HydrophobicContact CE1-CD1 3.86Å; Y788-L792 HydrophobicContact CE2-CD1 3.99Å; Y788-L792 HydrophobicContact CE2-CD2 4.27Å; Y788-L792 HydrophobicContact CE2-CG 4.16Å; Y788-L792 WeakPolarHBondContact O-CG 3.43Å; Y788-L792 PolarHBondContact O-N 3.39Å
789	P	95.3	Very high	93.1	Very high	45 Å²	45	57.8 Å²	57.8	29%	0.292	28%	0.277	S	S	.	.	H	α-helix	trans	-66.1	-17.3	171.9	-23	35.8	0	0	0	113.8	E784 D786 R793	E784-P789 VanDerWaalsContact O-CD 3.27Å; E784-P789 WeakPolarHBondContact O-CD 3.46Å; E784-P789 WeakPolarHBondContact O-CG 3.27Å; D786-P789 WeakPolarHBondContact O-CD 3.5Å; P789-R793 PolarHBondContact O-NE 3.28Å; P789-R793 PolarHBondContact O-NH2 2.97Å; P789-R793 VanDerWaalsContact O-NH2 3.13Å
790	R	94.6	Very high	92.5	Very high	78 Å²	78	58.1 Å²	58.1	29%	0.294	28%	0.279	S	S	.	.	H	α-helix	trans	-82.7	-43.2	169.9	-68.3	-175.5	-81	150.6	-6.5	111.3	F702 E706 D786 S787 Y788 L792 R793 S794	F702-R790 HydrophobicContact CE1-CB 4.28Å; F702-R790 HydrophobicContact CZ-CB 3.67Å; E706-R790 IonicContact OE1-CZ 2.67Å; E706-R790 IonicContact OE1-NE 3.87Å; E706-R790 IonicContact OE1-NH1 3.83Å; E706-R790 PolarHBondContact OE1-NH1 3.28Å; E706-R790 IonicContact OE2-CZ 3.38Å; E706-R790 IonicContact OE2-NE 3.89Å; E706-R790 IonicContact OE2-NH1 2.71Å; E706-R790 PolarHBondContact OE2-NH1 3.05Å; E706-R790 IonicContact OE2-NH2 3.88Å; D786-R790 WeakPolarHBondContact O-CG 3.39Å; D786-R790 PolarHBondContact O-N 3.01Å; D786-R790 PolarHBondContact O-NE 3.24Å; D786-R790 IonicContact OD1-CZ 3.29Å; D786-R790 VanDerWaalsContact OD1-CZ 3.22Å; D786-R790 IonicContact OD1-NE 2.68Å; D786-R790 PolarHBondContact OD1-NE 3.47Å; D786-R790 IonicContact OD1-NH2 2.64Å; D786-R790 PolarHBondContact OD1-NH2 2.93Å; D786-R790 IonicContact OD2-CZ 3.9Å; D786-R790 IonicContact OD2-NH2 3.38Å; D786-R790 PolarHBondContact OD2-NH2 2.91Å; S787-R790 CarbonylContact O-C 3.34Å; S787-R790 PolarHBondContact O-N 3.13Å; Y788-R790 PolarHBondContact O-N 2.77Å; R790-L792 VanDerWaalsContact C-N 3.35Å; R790-L792 PolarHBondContact O-N 3.16Å; R790-R793 CarbonylContact O-C 3.54Å; R790-R793 PolarHBondContact O-N 3.3Å; R790-S794 PolarHBondContact O-N 3.37Å; R790-S794 VanDerWaalsContact O-N 3.09Å
791	F	95.6	Very high	92	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-54.1	-47.1	173.1	170.7	-103.2	0	0	0	112.3	W682 L689 A698 F699 F702 S787 Y788 R793 S794 Y797	W682-F791 HydrophobicContact CE3-CE1 4.47Å; W682-F791 HydrophobicContact CE3-CZ 4.41Å; L689-F791 HydrophobicContact CD1-CD1 4.45Å; L689-F791 HydrophobicContact CD1-CE1 3.56Å; L689-F791 HydrophobicContact CD1-CZ 3.93Å; L689-F791 HydrophobicContact CD2-CD1 3.66Å; L689-F791 HydrophobicContact CD2-CE1 3.61Å; L689-F791 HydrophobicContact CD2-CZ 4.44Å; L689-F791 HydrophobicContact CG-CE1 4.27Å; A698-F791 HydrophobicContact CB-CE2 4.06Å; A698-F791 HydrophobicContact CB-CZ 4.1Å; F699-F791 HydrophobicContact CD2-CB 3.82Å; F699-F791 HydrophobicContact CD2-CD1 4.18Å; F699-F791 HydrophobicContact CD2-CD2 4.03Å; F699-F791 AromaticContact CD2-CG 3.73Å; F699-F791 HydrophobicContact CD2-CG 3.73Å; F699-F791 HydrophobicContact CE2-CB 3.93Å; F699-F791 HydrophobicContact CE2-CG 4.33Å; F702-F791 HydrophobicContact CB-CD2 3.7Å; F702-F791 HydrophobicContact CB-CE2 4.34Å; F702-F791 HydrophobicContact CD1-CB 3.71Å; F702-F791 HydrophobicContact CD1-CD2 4.14Å; F702-F791 HydrophobicContact CD1-CG 4.4Å; F702-F791 HydrophobicContact CD2-CB 4.48Å; F702-F791 HydrophobicContact CD2-CD2 4.27Å; F702-F791 HydrophobicContact CE1-CB 3.81Å; F702-F791 HydrophobicContact CG-CB 4.07Å; F702-F791 AromaticContact CG-CD2 3.76Å; F702-F791 HydrophobicContact CG-CD2 3.76Å; F702-F791 HydrophobicContact CG-CG 4.42Å; F702-F791 HydrophobicContact CZ-CB 4.24Å; F702-F791 VanDerWaalsContact CZ-N 3.33Å; S787-F791 PolarHBondContact O-N 3.14Å; Y788-F791 WeakPolarHBondContact O-CB 3.22Å; Y788-F791 PolarHBondContact O-N 3.37Å; F791-R793 PolarHBondContact O-N 3.16Å; F791-R793 VanDerWaalsContact O-N 3.11Å; F791-S794 WeakPolarHBondContact O-CB 3.38Å; F791-S794 PolarHBondContact O-N 3.17Å; F791-S794 PolarHBondContact O-OG 2.98Å; F791-Y797 AromaticContact CE1-CD2 3.69Å; F791-Y797 HydrophobicContact CE1-CD2 3.69Å; F791-Y797 HydrophobicContact CE1-CE2 4.44Å; F791-Y797 HydrophobicContact CE1-CG 4.17Å; F791-Y797 AromaticContact CZ-CD2 3.96Å; F791-Y797 HydrophobicContact CZ-CD2 3.96Å; F791-Y797 HydrophobicContact CZ-CG 4.41Å; F791-Y797 VanDerWaalsContact O-CB 3.26Å; F791-Y797 WeakPolarHBondContact O-CB 3.29Å
792	L	94.3	Very high	91.4	Very high	37 Å²	37	63 Å²	63	19%	0.194	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-11.9	178.4	-65	179.5	0	0	0	114.5	Y788 R790 Y797	Y788-L792 HydrophobicContact CD1-CD1 4.41Å; Y788-L792 HydrophobicContact CD2-CG 4.43Å; Y788-L792 HydrophobicContact CE1-CD1 3.86Å; Y788-L792 HydrophobicContact CE2-CD1 3.99Å; Y788-L792 HydrophobicContact CE2-CD2 4.27Å; Y788-L792 HydrophobicContact CE2-CG 4.16Å; Y788-L792 WeakPolarHBondContact O-CG 3.43Å; Y788-L792 PolarHBondContact O-N 3.39Å; R790-L792 VanDerWaalsContact C-N 3.35Å; R790-L792 PolarHBondContact O-N 3.16Å; L792-Y797 HydrophobicContact CB-CD1 4.36Å; L792-Y797 HydrophobicContact CB-CE1 4.39Å; L792-Y797 HydrophobicContact CD2-CD1 4.03Å; L792-Y797 HydrophobicContact CD2-CD2 4.13Å; L792-Y797 HydrophobicContact CD2-CE1 3.68Å; L792-Y797 HydrophobicContact CD2-CE2 3.82Å; L792-Y797 HydrophobicContact CD2-CG 4.23Å; L792-Y797 VanDerWaalsContact O-CD1 3.3Å; L792-Y797 WeakPolarHBondContact O-CD1 3.2Å
793	R	92	Very high	90.1	Very high	175 Å²	175	64.1 Å²	64.1	66%	0.66	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.7	-3.6	172.4	-71.2	178.4	-71.9	158.6	0	113.1	P789 R790 F791	P789-R793 PolarHBondContact O-NE 3.28Å; P789-R793 PolarHBondContact O-NH2 2.97Å; P789-R793 VanDerWaalsContact O-NH2 3.13Å; R790-R793 CarbonylContact O-C 3.54Å; R790-R793 PolarHBondContact O-N 3.3Å; F791-R793 PolarHBondContact O-N 3.16Å; F791-R793 VanDerWaalsContact O-N 3.11Å
794	S	91.6	Very high	87.8	Confident	18 Å²	18	73.7 Å²	73.7	13%	0.126	35%	0.348	C	S	.	.	S	Bend	trans	-76.5	148.1	-179.2	74.4	0	0	0	0	111.8	R790 F791 L796 Y797 L798	R790-S794 PolarHBondContact O-N 3.37Å; R790-S794 VanDerWaalsContact O-N 3.09Å; F791-S794 WeakPolarHBondContact O-CB 3.38Å; F791-S794 PolarHBondContact O-N 3.17Å; F791-S794 PolarHBondContact O-OG 2.98Å; S794-L796 PolarHBondContact O-N 3.06Å; S794-Y797 PolarHBondContact O-N 3Å; S794-Y797 PolarHBondContact OG-N 3.41Å; S794-L798 WeakPolarHBondContact O-CG 3.41Å; S794-L798 PolarHBondContact O-N 3.4Å
795	E	87.2	Confident	85.4	Confident	157 Å²	157	79.4 Å²	79.4	73%	0.734	37%	0.372	S	S	*	.	H	α-helix	trans	-54.2	-36.6	174.3	-61.9	-179.2	158.3	0	0	111.3	Y797 L798 D799	E795-Y797 PolarHBondContact O-N 2.8Å; E795-L798 PolarHBondContact O-N 3.45Å; E795-D799 VanDerWaalsContact O-CB 3.24Å; E795-D799 WeakPolarHBondContact O-CB 3.43Å; E795-D799 PolarHBondContact O-N 3.37Å
796	L	86	Confident	82.9	Confident	86 Å²	86	77.5 Å²	77.5	45%	0.45	38%	0.377	S	S	.	.	H	α-helix	trans	-57	-31.6	176	-64.2	176.9	0	0	0	114.3	F702 S794 L800	F702-L796 HydrophobicContact CB-CD1 4.25Å; S794-L796 PolarHBondContact O-N 3.06Å; L796-L800 VanDerWaalsContact O-CD1 3.29Å; L796-L800 WeakPolarHBondContact O-CD1 3.44Å; L796-L800 WeakPolarHBondContact O-CG 3.41Å
797	Y	89.4	Confident	80.3	Confident	12 Å²	12	79.2 Å²	79.2	5%	0.047	40%	0.395	C	S	.	.	H	α-helix	trans	-91.2	-43.2	175.4	177.1	-104.5	0	0	0	111.6	A679 W682 F791 L792 S794 E795 D799 L800 I801	A679-Y797 WeakPolarHBondContact O-CE2 3.46Å; A679-Y797 PolarHBondContact O-OH 2.97Å; W682-Y797 HydrophobicContact CB-CE2 4.26Å; W682-Y797 HydrophobicContact CE3-CD2 4.24Å; W682-Y797 HydrophobicContact CE3-CE2 4.17Å; F791-Y797 AromaticContact CE1-CD2 3.69Å; F791-Y797 HydrophobicContact CE1-CD2 3.69Å; F791-Y797 HydrophobicContact CE1-CE2 4.44Å; F791-Y797 HydrophobicContact CE1-CG 4.17Å; F791-Y797 AromaticContact CZ-CD2 3.96Å; F791-Y797 HydrophobicContact CZ-CD2 3.96Å; F791-Y797 HydrophobicContact CZ-CG 4.41Å; F791-Y797 VanDerWaalsContact O-CB 3.26Å; F791-Y797 WeakPolarHBondContact O-CB 3.29Å; L792-Y797 HydrophobicContact CB-CD1 4.36Å; L792-Y797 HydrophobicContact CB-CE1 4.39Å; L792-Y797 HydrophobicContact CD2-CD1 4.03Å; L792-Y797 HydrophobicContact CD2-CD2 4.13Å; L792-Y797 HydrophobicContact CD2-CE1 3.68Å; L792-Y797 HydrophobicContact CD2-CE2 3.82Å; L792-Y797 HydrophobicContact CD2-CG 4.23Å; L792-Y797 VanDerWaalsContact O-CD1 3.3Å; L792-Y797 WeakPolarHBondContact O-CD1 3.2Å; S794-Y797 PolarHBondContact O-N 3Å; S794-Y797 PolarHBondContact OG-N 3.41Å; E795-Y797 PolarHBondContact O-N 2.8Å; Y797-D799 VanDerWaalsContact C-N 3.3Å; Y797-D799 PolarHBondContact O-N 2.76Å; Y797-L800 WeakPolarHBondContact O-CB 3.26Å; Y797-L800 PolarHBondContact O-N 2.66Å; Y797-I801 HydrophobicContact CD1-CD1 4.39Å; Y797-I801 HydrophobicContact CE1-CD1 3.89Å; Y797-I801 HydrophobicContact CE1-CG2 4.27Å; Y797-I801 HydrophobicContact CE2-CG2 4.13Å; Y797-I801 PolarHBondContact O-N 3.15Å
798	L	88.8	Confident	77.8	Confident	63 Å²	63	83.9 Å²	83.9	33%	0.33	43%	0.434	S	S	.	.	H	α-helix	trans	-60.4	-38.6	179.5	-64.8	176.6	0	0	0	111.7	S794 E795 L800 I801 N802	S794-L798 WeakPolarHBondContact O-CG 3.41Å; S794-L798 PolarHBondContact O-N 3.4Å; E795-L798 PolarHBondContact O-N 3.45Å; L798-L800 VanDerWaalsContact C-N 3.26Å; L798-L800 PolarHBondContact O-N 3.11Å; L798-I801 HydrophobicContact CD2-CD1 4.18Å; L798-I801 WeakPolarHBondContact O-CG1 3.42Å; L798-I801 PolarHBondContact O-N 3.25Å; L798-N802 WeakPolarHBondContact O-CB 3.35Å; L798-N802 PolarHBondContact O-N 3.36Å; L798-N802 PolarHBondContact O-ND2 3.03Å
799	D	87	Confident	74.9	Confident	114 Å²	114	89.2 Å²	89.2	61%	0.61	47%	0.468	S	S	*	.	H	α-helix	trans	-69.2	-18.1	174.6	-81.4	-2.5	0	0	0	114	E795 Y797 Q803	E795-D799 VanDerWaalsContact O-CB 3.24Å; E795-D799 WeakPolarHBondContact O-CB 3.43Å; E795-D799 PolarHBondContact O-N 3.37Å; Y797-D799 VanDerWaalsContact C-N 3.3Å; Y797-D799 PolarHBondContact O-N 2.76Å; D799-Q803 VanDerWaalsContact O-CG 3.23Å; D799-Q803 WeakPolarHBondContact O-CG 3.32Å
800	L	85.1	Confident	72.2	Confident	7 Å²	7	92.5 Å²	92.5	4%	0.037	49%	0.492	C	S	.	.	H	α-helix	trans	-80.8	-44.2	174.5	-68.8	169.9	0	0	0	110.9	K673 P674 A679 W682 Y694 L796 Y797 L798 Q803	K673-L800 HydrophobicContact CG-CD2 4.17Å; P674-L800 HydrophobicContact CG-CD2 4.36Å; A679-L800 HydrophobicContact CB-CB 4.2Å; W682-L800 HydrophobicContact CH2-CD1 4.17Å; W682-L800 HydrophobicContact CZ3-CD1 3.76Å; Y694-L800 HydrophobicContact CD1-CD1 4.41Å; Y694-L800 HydrophobicContact CE1-CD1 3.88Å; Y694-L800 HydrophobicContact CE1-CD2 3.83Å; L796-L800 VanDerWaalsContact O-CD1 3.29Å; L796-L800 WeakPolarHBondContact O-CD1 3.44Å; L796-L800 WeakPolarHBondContact O-CG 3.41Å; Y797-L800 WeakPolarHBondContact O-CB 3.26Å; Y797-L800 PolarHBondContact O-N 2.66Å; L798-L800 VanDerWaalsContact C-N 3.26Å; L798-L800 PolarHBondContact O-N 3.11Å; L800-Q803 PolarHBondContact O-NE2 2.97Å
801	I	88.4	Confident	69.5	Low	35 Å²	35	95 Å²	95	18%	0.179	52%	0.517	C	S	.	.	H	α-helix	trans	-79.6	-31.5	179.8	64.4	171.4	0	0	0	112.9	A679 L680 Y797 L798 Q803	A679-I801 HydrophobicContact CB-CG2 3.77Å; L680-I801 HydrophobicContact CD2-CB 4.14Å; L680-I801 HydrophobicContact CD2-CD1 4.11Å; L680-I801 HydrophobicContact CD2-CG2 3.94Å; L680-I801 HydrophobicContact CG-CB 4.21Å; L680-I801 HydrophobicContact CG-CG2 3.85Å; Y797-I801 HydrophobicContact CD1-CD1 4.39Å; Y797-I801 HydrophobicContact CE1-CD1 3.89Å; Y797-I801 HydrophobicContact CE1-CG2 4.27Å; Y797-I801 HydrophobicContact CE2-CG2 4.13Å; Y797-I801 PolarHBondContact O-N 3.15Å; L798-I801 HydrophobicContact CD2-CD1 4.18Å; L798-I801 WeakPolarHBondContact O-CG1 3.42Å; L798-I801 PolarHBondContact O-N 3.25Å; I801-Q803 VanDerWaalsContact C-N 3.27Å; I801-Q803 PolarHBondContact O-N 2.88Å
802	N	82	Confident	66.9	Low	112 Å²	112	100.5 Å²	100.5	60%	0.599	56%	0.555	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.3	19.6	-177.9	-67.7	-58.3	0	0	0	114.3	L798 K804	L798-N802 WeakPolarHBondContact O-CB 3.35Å; L798-N802 PolarHBondContact O-N 3.36Å; L798-N802 PolarHBondContact O-ND2 3.03Å; N802-K804 PolarHBondContact O-N 3.16Å
803	Q	67	Low	64.2	Low	72 Å²	72	104.3 Å²	104.3	34%	0.336	58%	0.584	S	S	.	*			trans	-69.5	75.4	171.1	-65.6	177.1	96.3	0	0	111.1	K673 P676 D799 L800 I801 K805	K673-Q803 VanDerWaalsContact NZ-CD 3.29Å; P676-Q803 HydrophobicContact CG-CB 4.13Å; D799-Q803 VanDerWaalsContact O-CG 3.23Å; D799-Q803 WeakPolarHBondContact O-CG 3.32Å; L800-Q803 PolarHBondContact O-NE2 2.97Å; I801-Q803 VanDerWaalsContact C-N 3.27Å; I801-Q803 PolarHBondContact O-N 2.88Å; Q803-K805 PolarHBondContact O-N 2.68Å
804	K	49.1	Very low	61.7	Low	201 Å²	201	101.3 Å²	101.3	87%	0.874	59%	0.59	S	S	*	*	P	Polyproline II helix	trans	-52.9	133.2	165.1	-94.8	-179.7	174.6	173.9	0	109	N802	N802-K804 PolarHBondContact O-N 3.16Å
805	K	45.9	Very low	59.1	Low	193 Å²	193	109.9 Å²	109.9	84%	0.839	65%	0.65	S	S	*	*	P	Polyproline II helix	trans	-49.7	136.3	168.6	-64.7	174.4	-179.4	173.9	0	108.5	Q803 S807	Q803-K805 PolarHBondContact O-N 2.68Å; K805-S807 PolarHBondContact O-N 3.39Å
806	P	40.8	Very low	57.7	Low	130 Å²	130	107.5 Å²	107.5	84%	0.844	65%	0.646	S	S	*	*	P	Polyproline II helix	trans	-57.4	117.7	169.8	25.1	-32.9	0	0	0	107.8	A808	P806-A808 PolarHBondContact O-N 3.46Å
807	S	36.2	Very low	56.2	Low	107 Å²	107	108.6 Å²	108.6	75%	0.748	66%	0.656	S	S	*	*	P	Polyproline II helix	trans	-61.2	123	179.8	49	0	0	0	0	108.9	K805 T809	K805-S807 PolarHBondContact O-N 3.39Å; S807-T809 PolarHBondContact O-N 3.08Å; S807-T809 VanDerWaalsContact O-N 3.11Å
808	A	40.3	Very low	54.4	Low	102 Å²	102	114 Å²	114	84%	0.843	69%	0.69	S	S	*	*	P	Polyproline II helix	trans	-55.6	119.4	176.8	0	0	0	0	0	109.5	P806 S810	P806-A808 PolarHBondContact O-N 3.46Å; A808-S810 PolarHBondContact O-N 3.2Å
809	T	35.9	Very low	52.3	Low	130 Å²	130	117 Å²	117	80%	0.798	71%	0.711	S	S	*	*	P	Polyproline II helix	trans	-61.6	125.8	178.5	-52.5	0	0	0	0	109.2	S807 T811	S807-T809 PolarHBondContact O-N 3.08Å; S807-T809 VanDerWaalsContact O-N 3.11Å; T809-T811 PolarHBondContact O-N 3.27Å
810	S	40	Very low	50.2	Low	113 Å²	113	117.2 Å²	117.2	79%	0.79	72%	0.718	S	S	*	*			trans	-63.5	101.4	176.9	51.3	0	0	0	0	110.6	A808 S812	A808-S810 PolarHBondContact O-N 3.2Å; S810-S812 PolarHBondContact O-N 2.99Å
811	T	36.7	Very low	47.8	Very low	132 Å²	132	124.5 Å²	124.5	81%	0.81	76%	0.763	S	S	*	*			trans	-70.9	112.2	167.6	41.1	0	0	0	0	109.5	T809 S813	T809-T811 PolarHBondContact O-N 3.27Å; T811-S813 PolarHBondContact O-N 3.29Å
812	S	41.9	Very low	44.9	Very low	114 Å²	114	130.9 Å²	130.9	80%	0.797	81%	0.805	S	S	*	*			trans	-64.9	108.7	169.3	52	0	0	0	0	110.7	S810	S810-S812 PolarHBondContact O-N 2.99Å
813	S	37.9	Very low	42.1	Very low	117 Å²	117	132.4 Å²	132.4	82%	0.818	82%	0.82	S	S	*	*			trans	-87.6	103.4	169.1	54.6	0	0	0	0	109.8	T811	T811-S813 PolarHBondContact O-N 3.29Å
814	S	37.8	Very low	40	Very low	112 Å²	112	137.4 Å²	137.4	78%	0.783	86%	0.861	S	S	*	*			trans	-74.9	129.8	170.6	-55.6	0	0	0	0	111.1
815	S	37.7	Very low	39.2	Very low	198 Å²	198	131.6 Å²	131.6	100%	1.385	86%	0.86	S	S	*	*			trans	-158.7	0	159.4	-70.4	0	0	0	0	108

Retrieved 815 of 815 residues in 374.6 ms (Link to these results)

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