A0A5K4F9Z1_SCHMA Loading...

GA-binding protein alpha chain

AlphaFold DB , UniProt , Accession A0A5K4F9Z1, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 999 aa.

						>A0A5K4F9Z1_SCHMA|A0A5K4F9Z1
MAKISNRKLSKNVHSSLEWNFQNNDPNSSSDSCWSWSDVYRYQRNNSAQDNRVKVVVSVEQTLYDVAELLERRLGICLTGCQFYLQDRIKLRGESPLVEHCVEISGLVQLLLEVKTAHAGYPFRLNVVDIQIPESVDHHGSNSTMPTEKSKRSGIAKGPGQQISSVNSAKNEESRNDSALSSSNRPTSPKPECISPLTVAAAVAAAADIASGGSGLLESQPSLNENGMVSDESVISEACTILDIHSSQNPYLGSQLEPGGIPGAYDLESLSRWVPDGHYRRLMEMNDIPRDPIEWNSTQVIMWINWACKQFRIEGLKGEKLFNMPGSRMFVLTPDDWRRLVPNANVNFLTHLELLKRCRNVCVPYCPQPPQQSATQSQKLYRQMSRSRFRSSRNLTETNSSRSFSGSIVFAPSYSGALNSYDMNDVNPRLMCSKPVFLSCSDSNGHVPTSSAVTLNSFMNETTANQNSSNYTNNGLCESSGGGQLVHGAFLLTQNGNALQQGISNSQSSAAGQVQLWQFLLELLTDWRYREAIHWISDDGEFKLSNPEQVAAMWGHRKNKPAMNYEKLSRALRYYYDGDMISKVHGKRFVYKFICDLKTLLGFSAGELYMLVKNCAERHSHRGKKRRLTTGSTYSPVNSHTLSTFPIDDRAVFPIPAEHPRPLSFLNRSVQRNLTLGYCVDVVTPSDPLSYNVPFSPTYRIRQPVKPENGVNSNTPEQHSSSSLVRQPFHRKRFLGLQSTTVNTDNIVFEDDSINNNASDSEHHENDRSRAPTSPWRLRRRWWARNPLSGVSPLGSPPYSSPSYTERLSSDSARQREDVSDRFNGSCASIAGASSQFSHSQFAVDEDWVAAAALTEDMANESSMNSSTSINSSFRSNGISLPQPPTPNATVTGFDEGEIASAAASLFSQSNQSETPLVVDQTNTIPKKRKLSSNLSDYRCETKEVRDDSLIEDTVYGSRLSHLASNKYISNNRSSMRNYGPVLLSGYSQGIDIDAFLAH
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	32.7	Very low	32.4	Very low	179 Å²	179	160.5 Å²	160.5	88%	0.882	82%	0.82	S	S	*	*				0	-48.6	0	-77.5	128.8	168.8	0	0	113.6	K3 I89	M1-K3 VanDerWaalsContact C-N 3.27Å; M1-K3 PolarHBondContact O-N 3.02Å; M1-I89 HydrophobicContact CE-CD1 4.25Å
2	A	28.5	Very low	32	Very low	110 Å²	110	160.9 Å²	160.9	91%	0.909	83%	0.826	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.8	59.7	-176.1	0	0	0	0	0	117.7
3	K	35.7	Very low	31.6	Very low	204 Å²	204	158.5 Å²	158.5	89%	0.887	82%	0.823	S	S	*	*	T	Hydrogen-bonded Turn	trans	-147	8.3	175	-87.2	-163.6	176	-175.5	0	114.4	M1	M1-K3 VanDerWaalsContact C-N 3.27Å; M1-K3 PolarHBondContact O-N 3.02Å
4	I	40.8	Very low	31.4	Very low	119 Å²	119	160.4 Å²	160.4	61%	0.61	83%	0.825	S	S	*	*	S	Bend	trans	-95.6	-33.4	-173.6	-63.6	178.2	0	0	0	112.4
5	S	35.1	Very low	31	Very low	95 Å²	95	156.1 Å²	156.1	66%	0.664	82%	0.815	S	S	*	*	S	Bend	trans	-62.3	149.1	170.8	-56	0	0	0	0	112.4
6	N	30.1	Very low	30.5	Very low	160 Å²	160	153.1 Å²	153.1	86%	0.856	81%	0.811	S	S	*	*			trans	77.7	63.7	173.7	-52	-20.4	0	0	0	116.4
7	R	34	Very low	30.3	Very low	235 Å²	235	152.1 Å²	152.1	89%	0.887	81%	0.806	S	S	*	*			trans	-124.7	100.9	150.5	-72	-171.5	179.4	-170.4	0.3	110.5
8	K	28.9	Very low	29.9	Very low	205 Å²	205	152.4 Å²	152.4	89%	0.891	80%	0.802	S	S	*	*			trans	-71.2	138.8	158.1	-66.7	-170.1	174.7	-166.9	0	108.1
9	L	32	Very low	29.7	Very low	159 Å²	159	155.4 Å²	155.4	83%	0.832	80%	0.801	S	S	*	*			trans	-122.2	143.8	170.1	-138.3	78.5	0	0	0	109.4
10	S	29.4	Very low	29.5	Very low	116 Å²	116	154.3 Å²	154.3	81%	0.811	80%	0.797	S	S	*	*			trans	-66.4	139.8	-179.2	-170.4	0	0	0	0	111	N12	S10-N12 PolarHBondContact O-N 3.09Å
11	K	29.4	Very low	29.3	Very low	183 Å²	183	155.9 Å²	155.9	80%	0.796	80%	0.798	S	S	*	*			trans	-59.1	133.6	170.6	-64.4	-177.1	179.2	-176.8	0	109.3
12	N	27.9	Very low	28.9	Very low	166 Å²	166	155 Å²	155	89%	0.888	79%	0.792	S	S	*	*			trans	-143.7	138.6	159.7	-135.2	-11.5	0	0	0	107.6	S10	S10-N12 PolarHBondContact O-N 3.09Å
13	V	26.1	Very low	28.8	Very low	130 Å²	130	156.7 Å²	156.7	79%	0.788	79%	0.786	S	S	*	*			trans	-83.1	133.5	-158.2	179.3	0	0	0	0	111.8
14	H	28.4	Very low	28.6	Very low	184 Å²	184	154.6 Å²	154.6	85%	0.852	78%	0.784	S	S	*	*			trans	-151.5	129.6	152	-124	-79.1	0	0	0	111.7
15	S	26.2	Very low	28	Very low	97 Å²	97	155.7 Å²	155.7	68%	0.678	79%	0.791	S	S	*	*			trans	-3.2	127.6	176.7	-145.4	0	0	0	0	119.5
16	S	22.9	Very low	27.9	Very low	107 Å²	107	157 Å²	157	75%	0.748	80%	0.798	S	S	*	*			trans	-60.3	154.8	145.1	-62.4	0	0	0	0	110.3
17	L	26.5	Very low	27.9	Very low	137 Å²	137	156.2 Å²	156.2	72%	0.717	79%	0.793	S	S	*	*			trans	-139.2	93.3	166.6	-108.9	161.5	0	0	0	107.2
18	E	23.5	Very low	27.8	Very low	158 Å²	158	150 Å²	150	74%	0.738	79%	0.786	S	S	*	*			trans	-66.4	139.8	166.6	-70.3	171.4	97.3	0	0	109.2
19	W	27	Very low	27.7	Very low	209 Å²	209	146.2 Å²	146.2	79%	0.792	79%	0.785	S	S	*	*			trans	-116.9	94.3	169.6	-79.4	98	0	0	0	108.9	F21	W19-F21 PolarHBondContact O-N 3.37Å
20	N	24.3	Very low	27.7	Very low	132 Å²	132	142.6 Å²	142.6	71%	0.706	77%	0.773	S	S	*	*			trans	-68.1	114.8	175.7	-78.3	-53.9	0	0	0	110.4	Q22	N20-Q22 VanDerWaalsContact C-N 3.34Å; N20-Q22 PolarHBondContact O-N 2.84Å
21	F	25.9	Very low	27.6	Very low	189 Å²	189	145.8 Å²	145.8	83%	0.829	78%	0.781	S	S	*	*			trans	-81.2	76.5	176.9	-97.7	-91.4	0	0	0	111.4	W19	W19-F21 PolarHBondContact O-N 3.37Å
22	Q	24.5	Very low	27.8	Very low	159 Å²	159	141.2 Å²	141.2	74%	0.743	77%	0.772	S	S	*	*			trans	-108	140.7	159	-126.3	75.6	22.7	0	0	109.1	N20	N20-Q22 VanDerWaalsContact C-N 3.34Å; N20-Q22 PolarHBondContact O-N 2.84Å
23	N	26.1	Very low	28	Very low	147 Å²	147	139.1 Å²	139.1	79%	0.786	77%	0.769	S	S	*	*			trans	71.6	85.2	178.2	-47.8	-32	0	0	0	116.4
24	N	30.5	Very low	28.4	Very low	160 Å²	160	140.3 Å²	140.3	86%	0.856	76%	0.76	S	S	*	*			trans	-160.8	120.8	133.7	-93.9	-44.5	0	0	0	108.2
25	D	29.9	Very low	28.8	Very low	142 Å²	142	134 Å²	134	76%	0.759	74%	0.736	S	S	*	*			trans	-72.2	130.7	-171.4	-77.6	-68.3	0	0	0	113.2	N27	D25-N27 PolarHBondContact O-N 2.76Å
26	P	31.7	Very low	29.1	Very low	123 Å²	123	136.6 Å²	136.6	80%	0.799	73%	0.731	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.9	20.6	-175.2	34.2	-37.9	0	0	0	114.5
27	N	30.6	Very low	29.7	Very low	142 Å²	142	135 Å²	135	76%	0.759	72%	0.721	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115	4	-164.9	-93.8	-21.1	0	0	0	116.2	D25 S29	D25-N27 PolarHBondContact O-N 2.76Å; N27-S29 PolarHBondContact O-N 3.06Å; N27-S29 VanDerWaalsContact O-N 3.14Å
28	S	31.6	Very low	30.5	Very low	106 Å²	106	130.4 Å²	130.4	74%	0.741	70%	0.697	S	S	*	*			trans	-83.6	83.4	172.1	62.4	0	0	0	0	111.5	S30	S28-S30 PolarHBondContact O-N 3.42Å; S28-S30 VanDerWaalsContact O-N 3.08Å
29	S	27.8	Very low	31.5	Very low	125 Å²	125	124.2 Å²	124.2	87%	0.874	67%	0.669	S	S	*	*			trans	-75.1	91.3	176.2	45.5	0	0	0	0	111.9	N27	N27-S29 PolarHBondContact O-N 3.06Å; N27-S29 VanDerWaalsContact O-N 3.14Å
30	S	30.7	Very low	32.1	Very low	82 Å²	82	119.6 Å²	119.6	57%	0.573	65%	0.652	S	S	*	*			trans	-149.3	125.2	168.8	59.3	0	0	0	0	111.5	S28 S32	S28-S30 PolarHBondContact O-N 3.42Å; S28-S30 VanDerWaalsContact O-N 3.08Å; S30-S32 VanDerWaalsContact C-N 3.3Å; S30-S32 PolarHBondContact O-N 3.1Å
31	D	27.8	Very low	33.1	Very low	184 Å²	184	119.7 Å²	119.7	98%	0.984	64%	0.643	S	S	*	*			trans	-67.6	82.4	175.2	-68.2	-68.2	0	0	0	111.6
32	S	33.4	Very low	33.9	Very low	86 Å²	86	114.7 Å²	114.7	60%	0.601	62%	0.619	S	S	*	*			trans	-111.6	96.2	174.6	60.8	0	0	0	0	110.3	S30 W34	S30-S32 VanDerWaalsContact C-N 3.3Å; S30-S32 PolarHBondContact O-N 3.1Å; S32-W34 PolarHBondContact O-N 3.36Å
33	C	33.9	Very low	34.9	Very low	123 Å²	123	109.4 Å²	109.4	83%	0.831	59%	0.594	S	S	*	*	P	Polyproline II helix	trans	-56.3	126.6	169.5	-174.6	0	0	0	0	109.5	S35	C33-S35 PolarHBondContact O-N 3.26Å
34	W	34.3	Very low	35.6	Very low	154 Å²	154	112.6 Å²	112.6	58%	0.583	60%	0.596	S	S	*	*	P	Polyproline II helix	trans	-57.6	121.3	-178.9	-78.5	67.6	0	0	0	110	S32 D38 V39	S32-W34 PolarHBondContact O-N 3.36Å; W34-D38 HydrophobicContact CD2-CB 4.48Å; W34-D38 HydrophobicContact CE3-CB 3.5Å; W34-D38 HydrophobicContact CZ3-CB 3.98Å; W34-V39 HydrophobicContact CB-CG2 4.37Å
35	S	35.8	Very low	36.2	Very low	52 Å²	52	111.4 Å²	111.4	36%	0.364	59%	0.589	S	S	.	*	P	Polyproline II helix	trans	-68.5	155.3	179.9	89.6	0	0	0	0	110	C33 S37 D38 V39	C33-S35 PolarHBondContact O-N 3.26Å; S35-S37 PolarHBondContact O-N 3.36Å; S35-S37 WeakPolarHBondContact OG-CB 3.34Å; S35-S37 PolarHBondContact OG-N 3.18Å; S35-D38 WeakPolarHBondContact CB-OD2 3.49Å; S35-D38 PolarHBondContact N-OD2 3.49Å; S35-D38 VanDerWaalsContact N-OD2 3.16Å; S35-D38 WeakPolarHBondContact O-CB 3.22Å; S35-D38 PolarHBondContact O-N 3.42Å; S35-D38 PolarHBondContact OG-OD2 3.04Å; S35-V39 PolarHBondContact O-N 3.44Å
36	W	32.1	Very low	36.7	Very low	151 Å²	151	106.9 Å²	106.9	57%	0.572	57%	0.565	S	S	*	*	H	α-helix	trans	-51	-32.3	172.7	-72.1	100	0	0	0	112.3	D38 V39 Y40	W36-D38 VanDerWaalsContact C-N 3.32Å; W36-D38 PolarHBondContact O-N 2.88Å; W36-V39 PolarHBondContact O-N 2.88Å; W36-Y40 HydrophobicContact CB-CD2 4.4Å; W36-Y40 VanDerWaalsContact O-CB 3.32Å; W36-Y40 WeakPolarHBondContact O-CB 3.28Å; W36-Y40 WeakPolarHBondContact O-CD2 3.4Å; W36-Y40 PolarHBondContact O-N 3.02Å
37	S	36.4	Very low	37	Very low	75 Å²	75	103.9 Å²	103.9	52%	0.524	55%	0.547	S	S	.	.	H	α-helix	trans	-65.4	-31.5	177.8	-49.3	0	0	0	0	113.5	S35 R41	S35-S37 PolarHBondContact O-N 3.36Å; S35-S37 WeakPolarHBondContact OG-CB 3.34Å; S35-S37 PolarHBondContact OG-N 3.18Å; S37-R41 PolarHBondContact O-N 3.11Å; S37-R41 VanDerWaalsContact O-N 3.07Å
38	D	42.7	Very low	37.5	Very low	40 Å²	40	101.5 Å²	101.5	21%	0.214	55%	0.547	C	S	.	.	H	α-helix	trans	-79.3	-41.8	179.5	-54.2	-72.3	0	0	0	110.5	W34 S35 W36 R41 Y42	W34-D38 HydrophobicContact CD2-CB 4.48Å; W34-D38 HydrophobicContact CE3-CB 3.5Å; W34-D38 HydrophobicContact CZ3-CB 3.98Å; S35-D38 WeakPolarHBondContact CB-OD2 3.49Å; S35-D38 PolarHBondContact N-OD2 3.49Å; S35-D38 VanDerWaalsContact N-OD2 3.16Å; S35-D38 WeakPolarHBondContact O-CB 3.22Å; S35-D38 PolarHBondContact O-N 3.42Å; S35-D38 PolarHBondContact OG-OD2 3.04Å; W36-D38 VanDerWaalsContact C-N 3.32Å; W36-D38 PolarHBondContact O-N 2.88Å; D38-R41 WeakPolarHBondContact O-CA 3.35Å; D38-R41 WeakPolarHBondContact O-CB 3.38Å; D38-R41 PolarHBondContact O-N 3.14Å; D38-R41 IonicContact OD1-CZ 2.77Å; D38-R41 IonicContact OD1-NH1 3.53Å; D38-R41 PolarHBondContact OD1-NH1 3.2Å; D38-R41 IonicContact OD1-NH2 3.64Å; D38-R41 PolarHBondContact OD1-NH2 3.5Å; D38-Y42 PolarHBondContact O-N 3.07Å
39	V	44	Very low	37.9	Very low	27 Å²	27	104.1 Å²	104.1	16%	0.164	55%	0.547	C	S	.	.	H	α-helix	trans	-62.5	-41.8	171.5	-177	0	0	0	0	111.1	W34 S35 W36 R41 Y42 Q43	W34-V39 HydrophobicContact CB-CG2 4.37Å; S35-V39 PolarHBondContact O-N 3.44Å; W36-V39 PolarHBondContact O-N 2.88Å; V39-R41 VanDerWaalsContact C-N 3.27Å; V39-R41 PolarHBondContact O-N 3.19Å; V39-Y42 PolarHBondContact O-N 2.64Å; V39-Q43 PolarHBondContact O-N 3.05Å
40	Y	41.1	Very low	39.2	Very low	112 Å²	112	102 Å²	102	44%	0.439	53%	0.527	S	S	.	.	H	α-helix	trans	-65.3	-26.4	171.9	-86.6	-61	0	0	0	113.1	W36 R44	W36-Y40 HydrophobicContact CB-CD2 4.4Å; W36-Y40 VanDerWaalsContact O-CB 3.32Å; W36-Y40 WeakPolarHBondContact O-CB 3.28Å; W36-Y40 WeakPolarHBondContact O-CD2 3.4Å; W36-Y40 PolarHBondContact O-N 3.02Å; Y40-R44 WeakPolarHBondContact O-CB 3.4Å; Y40-R44 PolarHBondContact O-N 2.77Å
41	R	44.1	Very low	40.9	Very low	134 Å²	134	100 Å²	100	51%	0.506	51%	0.509	S	S	.	.	H	α-helix	trans	-71.4	-46.3	171.6	-98.8	-174.7	-92.1	103.5	1.8	111.4	S37 D38 V39 Q43 R44 N45	S37-R41 PolarHBondContact O-N 3.11Å; S37-R41 VanDerWaalsContact O-N 3.07Å; D38-R41 WeakPolarHBondContact O-CA 3.35Å; D38-R41 WeakPolarHBondContact O-CB 3.38Å; D38-R41 PolarHBondContact O-N 3.14Å; D38-R41 IonicContact OD1-CZ 2.77Å; D38-R41 IonicContact OD1-NH1 3.53Å; D38-R41 PolarHBondContact OD1-NH1 3.2Å; D38-R41 IonicContact OD1-NH2 3.64Å; D38-R41 PolarHBondContact OD1-NH2 3.5Å; V39-R41 VanDerWaalsContact C-N 3.27Å; V39-R41 PolarHBondContact O-N 3.19Å; R41-Q43 PolarHBondContact O-N 3.23Å; R41-R44 PolarHBondContact O-N 3.31Å; R41-N45 PolarHBondContact O-N 3.13Å
42	Y	43.7	Very low	43.4	Very low	85 Å²	85	95.8 Å²	95.8	33%	0.333	48%	0.479	S	S	.	.	H	α-helix	trans	-55	-52.3	175	-175.8	-89.1	0	0	0	111.5	D38 V39 R44 N45 N46 I76	D38-Y42 PolarHBondContact O-N 3.07Å; V39-Y42 PolarHBondContact O-N 2.64Å; Y42-R44 PolarHBondContact O-N 3.39Å; Y42-N45 PolarHBondContact O-N 2.94Å; Y42-N46 WeakPolarHBondContact CE1-ND2 3.43Å; Y42-N46 PolarHBondContact O-N 2.93Å; Y42-N46 VanDerWaalsContact O-N 3.09Å; Y42-N46 PolarHBondContact OH-ND2 2.95Å; Y42-I76 HydrophobicContact CD1-CD1 4.14Å; Y42-I76 HydrophobicContact CE1-CD1 3.76Å
43	Q	45	Very low	45.7	Very low	47 Å²	47	93.1 Å²	93.1	22%	0.22	46%	0.459	C	S	.	.	H	α-helix	trans	-71.2	-12.3	-178.9	-168	174	61.3	0	0	114.4	V39 R41 T116	V39-Q43 PolarHBondContact O-N 3.05Å; R41-Q43 PolarHBondContact O-N 3.23Å; Q43-T116 PolarHBondContact NE2-OG1 3.39Å; Q43-T116 PolarHBondContact OE1-OG1 3.09Å
44	R	41.1	Very low	48.1	Very low	215 Å²	215	93.8 Å²	93.8	81%	0.811	45%	0.448	S	S	*	.	H	α-helix	trans	-88.1	-28.4	174	-173.9	176.2	-171.1	-179.4	1.8	112.6	Y40 R41 Y42	Y40-R44 WeakPolarHBondContact O-CB 3.4Å; Y40-R44 PolarHBondContact O-N 2.77Å; R41-R44 PolarHBondContact O-N 3.31Å; Y42-R44 PolarHBondContact O-N 3.39Å
45	N	42.9	Very low	50.4	Low	135 Å²	135	86.5 Å²	86.5	72%	0.722	42%	0.421	S	S	*	.	H	α-helix	trans	-82.7	-36.7	177.2	-68.2	0.6	0	0	0	111.3	R41 Y42	R41-N45 PolarHBondContact O-N 3.13Å; Y42-N45 PolarHBondContact O-N 2.94Å
46	N	40.8	Very low	52.5	Low	47 Å²	47	84.4 Å²	84.4	25%	0.251	41%	0.405	S	S	.	.	S	Bend	trans	-80.7	123.7	175.3	-84.3	4.3	0	0	0	111.1	Y42 D50	Y42-N46 WeakPolarHBondContact CE1-ND2 3.43Å; Y42-N46 PolarHBondContact O-N 2.93Å; Y42-N46 VanDerWaalsContact O-N 3.09Å; Y42-N46 PolarHBondContact OH-ND2 2.95Å; N46-D50 HydrophobicContact CB-CB 3.65Å
47	S	36.4	Very low	54.8	Low	59 Å²	59	77.2 Å²	77.2	41%	0.413	38%	0.378	S	S	.	.			trans	-71.7	175.6	-178.5	80.2	0	0	0	0	112.3	Q49 D50	S47-Q49 PolarHBondContact O-N 2.81Å; S47-Q49 PolarHBondContact OG-N 3.42Å; S47-D50 WeakPolarHBondContact CA-OD2 3.26Å; S47-D50 WeakPolarHBondContact CB-OD2 3.36Å; S47-D50 PolarHBondContact N-OD2 2.95Å; S47-D50 PolarHBondContact O-N 3.49Å; S47-D50 PolarHBondContact OG-OD2 3.4Å
48	A	41.9	Very low	56.8	Low	92 Å²	92	73.9 Å²	73.9	76%	0.76	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-9.2	179.3	0	0	0	0	0	114.8
49	Q	40.8	Very low	58.5	Low	161 Å²	161	72 Å²	72	75%	0.752	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.2	-22.2	174.3	-73.7	161.9	-112.3	0	0	113.3	S47	S47-Q49 PolarHBondContact O-N 2.81Å; S47-Q49 PolarHBondContact OG-N 3.42Å
50	D	54.7	Low	60.1	Low	82 Å²	82	75 Å²	75	44%	0.439	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-14.6	-174	-59.9	-57	0	0	0	113.6	N46 S47 R52	N46-D50 HydrophobicContact CB-CB 3.65Å; S47-D50 WeakPolarHBondContact CA-OD2 3.26Å; S47-D50 WeakPolarHBondContact CB-OD2 3.36Å; S47-D50 PolarHBondContact N-OD2 2.95Å; S47-D50 PolarHBondContact O-N 3.49Å; S47-D50 PolarHBondContact OG-OD2 3.4Å; D50-R52 PolarHBondContact O-N 2.97Å; D50-R52 VanDerWaalsContact O-N 3.07Å
51	N	67.2	Low	61.8	Low	38 Å²	38	71.6 Å²	71.6	20%	0.203	35%	0.346	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.5	6.6	172.3	-65.8	-49.7	0	0	0	113.5	E113 V114	N51-E113 WeakPolarHBondContact O-CA 3.44Å; N51-V114 PolarHBondContact O-N 3.36Å
52	R	78.7	Confident	63.8	Low	97 Å²	97	66.7 Å²	66.7	37%	0.366	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	116.2	179.8	-69.9	-174.1	174.3	-171.6	-3.8	111.8	D50 L111 L112 E113	D50-R52 PolarHBondContact O-N 2.97Å; D50-R52 VanDerWaalsContact O-N 3.07Å; R52-L111 HydrophobicContact CB-CD1 4.24Å; R52-L112 CarbonylContact C-O 3.46Å; R52-L112 VanDerWaalsContact CA-O 3.22Å; R52-L112 WeakPolarHBondContact CA-O 3.44Å; R52-E113 HydrophobicContact CG-CB 4.06Å; R52-E113 HydrophobicContact CG-CG 3.92Å; R52-E113 IonicContact CZ-OE1 2.81Å; R52-E113 IonicContact NE-OE1 2.95Å; R52-E113 PolarHBondContact NE-OE1 2.97Å; R52-E113 IonicContact NH2-OE1 3.68Å; R52-E113 PolarHBondContact NH2-OE1 2.82Å; R52-E113 IonicContact NH2-OE2 2.61Å
53	V	82.3	Confident	65.8	Low	29 Å²	29	62.7 Å²	62.7	18%	0.176	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	127.8	-177.7	-169.7	0	0	0	0	109.5	V55 L70 L74 L112	V53-V55 HydrophobicContact CG1-CG2 3.95Å; V53-L70 HydrophobicContact CB-CD2 4.04Å; V53-L70 HydrophobicContact CG1-CD2 3.66Å; V53-L70 HydrophobicContact CG2-CD2 4.44Å; V53-L74 HydrophobicContact CG2-CD1 4.13Å; V53-L74 HydrophobicContact CG2-CD2 4.07Å; V53-L112 PolarHBondContact N-O 3.12Å; V53-L112 WeakPolarHBondContact O-CB 3.31Å; V53-L112 PolarHBondContact O-N 3.33Å
54	K	83.9	Confident	67.9	Low	137 Å²	137	65.7 Å²	65.7	60%	0.596	33%	0.325	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.5	123.6	169.3	-67.5	180	-178	179.2	0	108.9	L110 L111	K54-L110 WeakPolarHBondContact CA-O 3.24Å; K54-L111 HydrophobicContact CG-CD1 3.87Å
55	V	83.1	Confident	70	Confident	1 Å²	1	58 Å²	58	1%	0.006	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	139.3	173.3	-173.2	0	0	0	0	107.8	V53 V57 L69 L70 L110 L112	V53-V55 HydrophobicContact CG1-CG2 3.95Å; V55-V57 HydrophobicContact CG1-CG1 3.81Å; V55-L69 HydrophobicContact CG1-CD1 4.33Å; V55-L69 HydrophobicContact CG1-CD2 3.7Å; V55-L70 HydrophobicContact CG2-CD2 3.56Å; V55-L70 HydrophobicContact CG2-CG 4.23Å; V55-L110 PolarHBondContact N-O 3.22Å; V55-L110 PolarHBondContact O-N 3.25Å; V55-L112 HydrophobicContact CB-CD1 3.99Å; V55-L112 HydrophobicContact CG2-CD1 3.83Å
56	V	79.2	Confident	72	Confident	8 Å²	8	51.5 Å²	51.5	5%	0.048	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	126.8	174.4	-169	0	0	0	0	109.3	L107 V108 Q109 M285	V56-L107 HydrophobicContact CG1-CB 4.06Å; V56-L107 HydrophobicContact CG1-CD1 4.46Å; V56-V108 WeakPolarHBondContact CA-O 3.43Å; V56-V108 WeakPolarHBondContact CG1-O 3.33Å; V56-Q109 HydrophobicContact CG2-CB 3.76Å; V56-Q109 HydrophobicContact CG2-CG 3.87Å; V56-M285 HydrophobicContact CB-CE 3.67Å; V56-M285 HydrophobicContact CB-CG 4.24Å; V56-M285 HydrophobicContact CB-SD 3.78Å; V56-M285 HydrophobicContact CG1-CE 3.62Å; V56-M285 HydrophobicContact CG1-SD 3.63Å; V56-M285 HydrophobicContact CG2-CE 4.15Å; V56-M285 HydrophobicContact CG2-CG 3.69Å; V56-M285 HydrophobicContact CG2-SD 3.65Å
57	V	81.5	Confident	74.2	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	158.7	-173.2	-59.8	0	0	0	0	110.1	V55 Q61 V66 L97 L107 V108 L110	V55-V57 HydrophobicContact CG1-CG1 3.81Å; V57-Q61 HydrophobicContact CB-CB 4.47Å; V57-V66 HydrophobicContact CB-CG2 4.41Å; V57-V66 HydrophobicContact CG1-CG1 4.25Å; V57-V66 HydrophobicContact CG1-CG2 3.92Å; V57-V66 HydrophobicContact CG2-CG2 4.26Å; V57-L97 HydrophobicContact CG2-CD1 4.38Å; V57-L107 WeakPolarHBondContact O-CA 3.26Å; V57-V108 HydrophobicContact CG2-CG2 4.24Å; V57-V108 PolarHBondContact N-O 3.47Å; V57-V108 VanDerWaalsContact N-O 3.12Å; V57-V108 PolarHBondContact O-N 2.91Å; V57-L110 HydrophobicContact CG2-CD1 3.6Å; V57-L110 HydrophobicContact CG2-CG 4.02Å
58	S	78.6	Confident	76.5	Confident	6 Å²	6	50.6 Å²	50.6	4%	0.042	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.1	140.3	159.5	178.8	0	0	0	0	108.5	E60 Q61	S58-E60 PolarHBondContact O-N 3.24Å; S58-E60 WeakPolarHBondContact OG-CB 3.37Å; S58-E60 WeakPolarHBondContact OG-CG 3.43Å; S58-E60 PolarHBondContact OG-N 3.41Å; S58-E60 PolarHBondContact OG-OE2 3.46Å; S58-Q61 WeakPolarHBondContact O-CB 3.44Å; S58-Q61 PolarHBondContact O-N 3.45Å
59	V	78.1	Confident	78.5	Confident	1 Å²	1	47.7 Å²	47.7	1%	0.006	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59	-19.9	173.7	-171.2	0	0	0	0	110.9	P96 L97 V98 V102 G106 V108	V59-P96 WeakPolarHBondContact O-CB 3.2Å; V59-L97 HydrophobicContact CG1-CB 3.71Å; V59-L97 PolarHBondContact O-N 3.38Å; V59-V98 HydrophobicContact CB-CG2 4.03Å; V59-V98 HydrophobicContact CG1-CB 4.28Å; V59-V98 HydrophobicContact CG1-CG2 3.5Å; V59-V98 VanDerWaalsContact CG1-CG2 3.5Å; V59-V102 HydrophobicContact CG1-CB 3.75Å; V59-V102 HydrophobicContact CG1-CG1 3.62Å; V59-V102 HydrophobicContact CG1-CG2 4.38Å; V59-V102 HydrophobicContact CG2-CG1 4.12Å; V59-G106 WeakPolarHBondContact CG2-O 3.32Å; V59-G106 PolarHBondContact N-O 2.71Å; V59-G106 VanDerWaalsContact N-O 3.09Å; V59-V108 HydrophobicContact CG2-CB 4.12Å; V59-V108 HydrophobicContact CG2-CG1 3.5Å; V59-V108 VanDerWaalsContact CG2-CG1 3.5Å; V59-V108 HydrophobicContact CG2-CG2 3.61Å
60	E	76	Confident	80.5	Confident	89 Å²	89	40 Å²	40	42%	0.416	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.8	-1.7	176.3	-52.5	164.1	149.9	0	0	114.6	S58 K309	S58-E60 PolarHBondContact O-N 3.24Å; S58-E60 WeakPolarHBondContact OG-CB 3.37Å; S58-E60 WeakPolarHBondContact OG-CG 3.43Å; S58-E60 PolarHBondContact OG-N 3.41Å; S58-E60 PolarHBondContact OG-OE2 3.46Å; E60-K309 PolarHBondContact O-NZ 3.05Å
61	Q	77.7	Confident	81.9	Confident	41 Å²	41	38.5 Å²	38.5	19%	0.192	18%	0.18	C	C	.	.	S	Bend	trans	-78.5	138.5	170.4	-74.7	-177.9	6.3	0	0	110.1	V57 S58 D65 V66 P96	V57-Q61 HydrophobicContact CB-CB 4.47Å; S58-Q61 WeakPolarHBondContact O-CB 3.44Å; S58-Q61 PolarHBondContact O-N 3.45Å; Q61-D65 WeakPolarHBondContact CA-OD2 3.46Å; Q61-D65 HydrophobicContact CB-CB 4.03Å; Q61-D65 HydrophobicContact CG-CB 4.41Å; Q61-V66 HydrophobicContact CB-CG2 4.44Å; Q61-P96 WeakPolarHBondContact O-CA 3Å
62	T	86.1	Confident	82.4	Confident	31 Å²	31	42.7 Å²	42.7	19%	0.19	19%	0.193	C	C	.	.	B	Isolated β-bridge	trans	-69.3	155.6	172	86.9	0	0	0	0	108.9	Y64 D65 V66 G93 E94	T62-Y64 PolarHBondContact O-N 3.09Å; T62-Y64 PolarHBondContact OG1-N 3.16Å; T62-D65 WeakPolarHBondContact CB-OD1 3.49Å; T62-D65 WeakPolarHBondContact CG2-OD1 3.46Å; T62-D65 VanDerWaalsContact N-CG 3.3Å; T62-D65 PolarHBondContact N-OD2 2.88Å; T62-D65 WeakPolarHBondContact O-CA 3.39Å; T62-D65 VanDerWaalsContact O-CB 3.26Å; T62-D65 WeakPolarHBondContact O-CB 3.38Å; T62-D65 PolarHBondContact O-N 3.38Å; T62-D65 PolarHBondContact OG1-N 2.94Å; T62-D65 VanDerWaalsContact OG1-N 3.1Å; T62-D65 PolarHBondContact OG1-OD1 3.27Å; T62-V66 WeakPolarHBondContact O-CG2 3.47Å; T62-V66 PolarHBondContact O-N 3.29Å; T62-G93 WeakPolarHBondContact CB-O 3.37Å; T62-E94 WeakPolarHBondContact CG2-O 3.35Å
63	L	86.1	Confident	82.2	Confident	1 Å²	1	43.8 Å²	43.8	1%	0.005	20%	0.197	C	C	.	.	H	α-helix	trans	-70.2	-18	178	-68	166.2	0	0	0	112.2	V66 A67 F83 L91 G93 L97	L63-V66 HydrophobicContact CD2-CG2 4.48Å; L63-V66 PolarHBondContact O-N 2.84Å; L63-A67 WeakPolarHBondContact O-CB 3.37Å; L63-A67 PolarHBondContact O-N 3.08Å; L63-F83 HydrophobicContact CB-CD1 3.68Å; L63-F83 HydrophobicContact CB-CD2 4.09Å; L63-F83 HydrophobicContact CB-CE1 3.77Å; L63-F83 HydrophobicContact CB-CE2 4.18Å; L63-F83 HydrophobicContact CB-CG 3.83Å; L63-F83 HydrophobicContact CB-CZ 4.03Å; L63-F83 HydrophobicContact CD1-CB 4Å; L63-F83 HydrophobicContact CD1-CD1 4.48Å; L63-F83 HydrophobicContact CD1-CG 4.17Å; L63-F83 WeakPolarHBondContact O-CE1 3.15Å; L63-F83 VanDerWaalsContact O-CZ 3.23Å; L63-F83 WeakPolarHBondContact O-CZ 3.38Å; L63-L91 HydrophobicContact CD1-CB 3.56Å; L63-L91 HydrophobicContact CD1-CD1 3.5Å; L63-L91 HydrophobicContact CD1-CG 4.17Å; L63-G93 PolarHBondContact N-O 3.47Å; L63-L97 HydrophobicContact CD2-CD1 4.12Å; L63-L97 HydrophobicContact CD2-CD2 4.13Å; L63-L97 HydrophobicContact CD2-CG 4.01Å
64	Y	88.5	Confident	81.8	Confident	110 Å²	110	44.2 Å²	44.2	43%	0.431	20%	0.198	S	C	.	.	H	α-helix	trans	-68.2	-41.2	164.4	-68.6	-61.2	0	0	0	112.5	T62 V66 A67 E68 F83 G93 E94	T62-Y64 PolarHBondContact O-N 3.09Å; T62-Y64 PolarHBondContact OG1-N 3.16Å; Y64-V66 PolarHBondContact O-N 3.19Å; Y64-A67 PolarHBondContact O-N 3.14Å; Y64-A67 VanDerWaalsContact O-N 3.14Å; Y64-E68 PolarHBondContact O-N 3.11Å; Y64-F83 AromaticContact CD1-CE2 3.81Å; Y64-F83 HydrophobicContact CD1-CE2 3.81Å; Y64-F83 AromaticContact CD1-CZ 3.82Å; Y64-F83 HydrophobicContact CD1-CZ 3.82Å; Y64-F83 AromaticContact CE1-CE2 3.61Å; Y64-F83 HydrophobicContact CE1-CE2 3.61Å; Y64-F83 HydrophobicContact CE1-CZ 4.03Å; Y64-F83 HydrophobicContact CG-CE2 4.36Å; Y64-F83 HydrophobicContact CG-CZ 4.41Å; Y64-G93 WeakPolarHBondContact CD2-O 3.32Å; Y64-G93 VanDerWaalsContact CE2-C 3.4Å; Y64-G93 VanDerWaalsContact CE2-CA 3.48Å; Y64-G93 PolarHBondContact N-O 3.49Å; Y64-E94 HydrophobicContact CD2-CG 4.46Å; Y64-E94 HydrophobicContact CE2-CG 3.85Å
65	D	84.9	Confident	81.1	Confident	52 Å²	52	39.9 Å²	39.9	28%	0.278	19%	0.192	S	C	.	.	H	α-helix	trans	-54.5	-42.3	172.6	-49.5	4.9	0	0	0	109.8	Q61 T62 L69 K309	Q61-D65 WeakPolarHBondContact CA-OD2 3.46Å; Q61-D65 HydrophobicContact CB-CB 4.03Å; Q61-D65 HydrophobicContact CG-CB 4.41Å; T62-D65 WeakPolarHBondContact CB-OD1 3.49Å; T62-D65 WeakPolarHBondContact CG2-OD1 3.46Å; T62-D65 VanDerWaalsContact N-CG 3.3Å; T62-D65 PolarHBondContact N-OD2 2.88Å; T62-D65 WeakPolarHBondContact O-CA 3.39Å; T62-D65 VanDerWaalsContact O-CB 3.26Å; T62-D65 WeakPolarHBondContact O-CB 3.38Å; T62-D65 PolarHBondContact O-N 3.38Å; T62-D65 PolarHBondContact OG1-N 2.94Å; T62-D65 VanDerWaalsContact OG1-N 3.1Å; T62-D65 PolarHBondContact OG1-OD1 3.27Å; D65-L69 WeakPolarHBondContact O-CB 3.48Å; D65-L69 PolarHBondContact O-N 3.34Å; D65-L69 VanDerWaalsContact O-N 3.14Å; D65-K309 IonicContact OD2-NZ 2.68Å; D65-K309 PolarHBondContact OD2-NZ 3.33Å
66	V	86.1	Confident	80.6	Confident	0 Å²	0	41 Å²	41	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-72.1	-37.2	179.3	-169.9	0	0	0	0	112.5	V57 Q61 T62 L63 Y64 L70 L110 L112	V57-V66 HydrophobicContact CB-CG2 4.41Å; V57-V66 HydrophobicContact CG1-CG1 4.25Å; V57-V66 HydrophobicContact CG1-CG2 3.92Å; V57-V66 HydrophobicContact CG2-CG2 4.26Å; Q61-V66 HydrophobicContact CB-CG2 4.44Å; T62-V66 WeakPolarHBondContact O-CG2 3.47Å; T62-V66 PolarHBondContact O-N 3.29Å; L63-V66 HydrophobicContact CD2-CG2 4.48Å; L63-V66 PolarHBondContact O-N 2.84Å; Y64-V66 PolarHBondContact O-N 3.19Å; V66-L70 PolarHBondContact O-N 3.08Å; V66-L70 VanDerWaalsContact O-N 3.12Å; V66-L110 HydrophobicContact CG1-CD1 4.2Å; V66-L112 HydrophobicContact CG1-CD1 3.62Å
67	A	86	Confident	80.2	Confident	5 Å²	5	43.6 Å²	43.6	4%	0.041	22%	0.216	C	C	.	.	H	α-helix	trans	-62.9	-50.1	174.7	0	0	0	0	0	110.7	L63 Y64 L69 L70 E71 F83	L63-A67 WeakPolarHBondContact O-CB 3.37Å; L63-A67 PolarHBondContact O-N 3.08Å; Y64-A67 PolarHBondContact O-N 3.14Å; Y64-A67 VanDerWaalsContact O-N 3.14Å; A67-L69 VanDerWaalsContact C-N 3.31Å; A67-L69 PolarHBondContact O-N 2.83Å; A67-L70 CarbonylContact O-C 3.28Å; A67-L70 WeakPolarHBondContact O-CA 3.47Å; A67-L70 WeakPolarHBondContact O-CB 3.42Å; A67-L70 PolarHBondContact O-N 3.03Å; A67-E71 WeakPolarHBondContact O-CG 3.43Å; A67-E71 PolarHBondContact O-N 3.31Å; A67-F83 HydrophobicContact CB-CE1 3.96Å; A67-F83 HydrophobicContact CB-CZ 3.94Å
68	E	84.8	Confident	79.9	Confident	81 Å²	81	43.8 Å²	43.8	38%	0.379	22%	0.217	S	C	.	.	H	α-helix	trans	-63.4	-36.1	-179	-173	171.3	-172.6	0	0	112.1	Y64 L70 E71 R72	Y64-E68 PolarHBondContact O-N 3.11Å; E68-L70 VanDerWaalsContact C-N 3.31Å; E68-L70 PolarHBondContact O-N 3.14Å; E68-E71 PolarHBondContact O-N 2.88Å; E68-R72 VanDerWaalsContact O-CG 3.29Å; E68-R72 WeakPolarHBondContact O-CG 3.49Å; E68-R72 PolarHBondContact O-N 3.28Å; E68-R72 IonicContact OE1-CZ 2.8Å; E68-R72 IonicContact OE1-NE 2.71Å; E68-R72 IonicContact OE1-NH2 2.71Å; E68-R72 PolarHBondContact OE1-NH2 3.15Å; E68-R72 IonicContact OE2-NH2 3.04Å
69	L	83.5	Confident	79.5	Confident	32 Å²	32	48.6 Å²	48.6	17%	0.168	25%	0.246	C	C	.	.	H	α-helix	trans	-60.5	-40	170.1	-169.8	161.1	0	0	0	111.6	V55 D65 A67 R73	V55-L69 HydrophobicContact CG1-CD1 4.33Å; V55-L69 HydrophobicContact CG1-CD2 3.7Å; D65-L69 WeakPolarHBondContact O-CB 3.48Å; D65-L69 PolarHBondContact O-N 3.34Å; D65-L69 VanDerWaalsContact O-N 3.14Å; A67-L69 VanDerWaalsContact C-N 3.31Å; A67-L69 PolarHBondContact O-N 2.83Å; L69-R73 HydrophobicContact CD2-CG 4.21Å; L69-R73 WeakPolarHBondContact O-CB 3.41Å; L69-R73 PolarHBondContact O-N 3.18Å
70	L	83.5	Confident	79.3	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-70.4	-36.9	173.2	-76.8	-179.8	0	0	0	113.5	V53 V55 V66 A67 E68 R72 R73 L74 L78 L112 L125	V53-L70 HydrophobicContact CB-CD2 4.04Å; V53-L70 HydrophobicContact CG1-CD2 3.66Å; V53-L70 HydrophobicContact CG2-CD2 4.44Å; V55-L70 HydrophobicContact CG2-CD2 3.56Å; V55-L70 HydrophobicContact CG2-CG 4.23Å; V66-L70 PolarHBondContact O-N 3.08Å; V66-L70 VanDerWaalsContact O-N 3.12Å; A67-L70 CarbonylContact O-C 3.28Å; A67-L70 WeakPolarHBondContact O-CA 3.47Å; A67-L70 WeakPolarHBondContact O-CB 3.42Å; A67-L70 PolarHBondContact O-N 3.03Å; E68-L70 VanDerWaalsContact C-N 3.31Å; E68-L70 PolarHBondContact O-N 3.14Å; L70-R72 VanDerWaalsContact C-N 3.31Å; L70-R72 PolarHBondContact O-N 3.27Å; L70-R73 PolarHBondContact O-N 2.85Å; L70-L74 HydrophobicContact CB-CD1 4.36Å; L70-L74 HydrophobicContact CD2-CD1 4.14Å; L70-L74 HydrophobicContact CD2-CG 4.41Å; L70-L74 VanDerWaalsContact O-CB 3.3Å; L70-L74 WeakPolarHBondContact O-CB 3.31Å; L70-L74 WeakPolarHBondContact O-CG 3.37Å; L70-L74 PolarHBondContact O-N 2.94Å; L70-L78 HydrophobicContact CB-CD1 3.7Å; L70-L78 HydrophobicContact CD1-CD1 4.31Å; L70-L112 HydrophobicContact CD1-CB 4.47Å; L70-L112 HydrophobicContact CD1-CD1 3.74Å; L70-L112 HydrophobicContact CG-CD1 4.37Å; L70-L125 HydrophobicContact CD1-CD1 3.52Å; L70-L125 HydrophobicContact CD1-CD2 3.92Å; L70-L125 HydrophobicContact CD1-CG 4.38Å
71	E	83.8	Confident	79.5	Confident	50 Å²	50	47.4 Å²	47.4	23%	0.234	26%	0.257	C	S	.	.	H	α-helix	trans	-57.6	-48.4	174.1	-62.3	-171.3	131.6	0	0	109.8	A67 E68 R73 G75 I76 L78 T79	A67-E71 WeakPolarHBondContact O-CG 3.43Å; A67-E71 PolarHBondContact O-N 3.31Å; E68-E71 PolarHBondContact O-N 2.88Å; E71-R73 PolarHBondContact O-N 3.27Å; E71-G75 WeakPolarHBondContact O-CA 3.37Å; E71-G75 PolarHBondContact O-N 3.48Å; E71-I76 WeakPolarHBondContact CA-O 3.13Å; E71-I76 WeakPolarHBondContact CG-O 3.42Å; E71-L78 HydrophobicContact CG-CB 3.77Å; E71-L78 HydrophobicContact CG-CD1 4.24Å; E71-L78 HydrophobicContact CG-CG 4Å; E71-L78 WeakPolarHBondContact OE1-CA 3.47Å; E71-L78 PolarHBondContact OE1-N 3.26Å; E71-T79 PolarHBondContact OE1-N 3.4Å
72	R	78.6	Confident	79.8	Confident	126 Å²	126	47.3 Å²	47.3	48%	0.475	26%	0.256	S	S	.	.	H	α-helix	trans	-64.7	-33.3	176.8	-63.8	170.7	-167.2	177.6	5.1	113.3	E68 L70 E319	E68-R72 VanDerWaalsContact O-CG 3.29Å; E68-R72 WeakPolarHBondContact O-CG 3.49Å; E68-R72 PolarHBondContact O-N 3.28Å; E68-R72 IonicContact OE1-CZ 2.8Å; E68-R72 IonicContact OE1-NE 2.71Å; E68-R72 IonicContact OE1-NH2 2.71Å; E68-R72 PolarHBondContact OE1-NH2 3.15Å; E68-R72 IonicContact OE2-NH2 3.04Å; L70-R72 VanDerWaalsContact C-N 3.31Å; L70-R72 PolarHBondContact O-N 3.27Å; R72-E319 IonicContact CZ-OE1 3.18Å; R72-E319 IonicContact NH1-OE1 2.74Å; R72-E319 VanDerWaalsContact NH2-CD 3.3Å; R72-E319 IonicContact NH2-OE1 3.91Å; R72-E319 PolarHBondContact NH2-OE1 3.35Å
73	R	73.4	Confident	79.9	Confident	120 Å²	120	46.1 Å²	46.1	45%	0.453	25%	0.248	S	C	.	.	H	α-helix	trans	-83.4	-27.4	178.9	-83.1	-166.8	173.9	-176.5	1.8	114.9	L69 L70 E71 N286	L69-R73 HydrophobicContact CD2-CG 4.21Å; L69-R73 WeakPolarHBondContact O-CB 3.41Å; L69-R73 PolarHBondContact O-N 3.18Å; L70-R73 PolarHBondContact O-N 2.85Å; E71-R73 PolarHBondContact O-N 3.27Å; R73-N286 PolarHBondContact NH2-OD1 2.84Å
74	L	74	Confident	80	Confident	37 Å²	37	46.2 Å²	46.2	19%	0.194	25%	0.249	C	C	.	.	H	α-helix	trans	-110.7	-17.7	-172.7	-57.4	178	0	0	0	113.9	V53 L70 I76 V114	V53-L74 HydrophobicContact CG2-CD1 4.13Å; V53-L74 HydrophobicContact CG2-CD2 4.07Å; L70-L74 HydrophobicContact CB-CD1 4.36Å; L70-L74 HydrophobicContact CD2-CD1 4.14Å; L70-L74 HydrophobicContact CD2-CG 4.41Å; L70-L74 VanDerWaalsContact O-CB 3.3Å; L70-L74 WeakPolarHBondContact O-CB 3.31Å; L70-L74 WeakPolarHBondContact O-CG 3.37Å; L70-L74 PolarHBondContact O-N 2.94Å; L74-I76 VanDerWaalsContact C-N 3.26Å; L74-I76 HydrophobicContact CB-CB 4.37Å; L74-I76 HydrophobicContact CB-CD1 3.89Å; L74-I76 HydrophobicContact CB-CG1 3.9Å; L74-I76 HydrophobicContact CD1-CD1 4.11Å; L74-I76 PolarHBondContact O-N 2.9Å; L74-V114 HydrophobicContact CD1-CG2 4.18Å
75	G	69.4	Low	79.8	Confident	47 Å²	47	41.8 Å²	41.8	49%	0.485	23%	0.233	S	C	.	.			trans	71.4	18.8	-172.1	0	0	0	0	0	114	E71	E71-G75 WeakPolarHBondContact O-CA 3.37Å; E71-G75 PolarHBondContact O-N 3.48Å
76	I	72.6	Confident	79.8	Confident	24 Å²	24	43 Å²	43	12%	0.123	24%	0.236	C	C	.	.			trans	-107.9	129.7	-176.9	-55.4	172.9	0	0	0	109.1	Y42 E71 L74 L78 F123	Y42-I76 HydrophobicContact CD1-CD1 4.14Å; Y42-I76 HydrophobicContact CE1-CD1 3.76Å; E71-I76 WeakPolarHBondContact CA-O 3.13Å; E71-I76 WeakPolarHBondContact CG-O 3.42Å; L74-I76 VanDerWaalsContact C-N 3.26Å; L74-I76 HydrophobicContact CB-CB 4.37Å; L74-I76 HydrophobicContact CB-CD1 3.89Å; L74-I76 HydrophobicContact CB-CG1 3.9Å; L74-I76 HydrophobicContact CD1-CD1 4.11Å; L74-I76 PolarHBondContact O-N 2.9Å; I76-L78 HydrophobicContact CG2-CD2 4.14Å; I76-L78 PolarHBondContact O-N 2.84Å; I76-F123 HydrophobicContact CG2-CE1 4.04Å; I76-F123 HydrophobicContact CG2-CZ 4.39Å
77	C	71.8	Confident	79.6	Confident	63 Å²	63	46.6 Å²	46.6	43%	0.426	26%	0.256	S	S	.	.			trans	-70.6	114.5	170	-50.7	0	0	0	0	110.3	F123	C77-F123 WeakPolarHBondContact O-CD2 3.35Å; C77-F123 WeakPolarHBondContact O-CE2 3.23Å
78	L	75.2	Confident	79.1	Confident	4 Å²	4	52.8 Å²	52.8	2%	0.021	28%	0.278	C	S	.	.			trans	-103.6	6.3	172.8	-59.3	177.4	0	0	0	111.7	L70 E71 I76 G80 C81 V114 F123	L70-L78 HydrophobicContact CB-CD1 3.7Å; L70-L78 HydrophobicContact CD1-CD1 4.31Å; E71-L78 HydrophobicContact CG-CB 3.77Å; E71-L78 HydrophobicContact CG-CD1 4.24Å; E71-L78 HydrophobicContact CG-CG 4Å; E71-L78 WeakPolarHBondContact OE1-CA 3.47Å; E71-L78 PolarHBondContact OE1-N 3.26Å; I76-L78 HydrophobicContact CG2-CD2 4.14Å; I76-L78 PolarHBondContact O-N 2.84Å; L78-G80 PolarHBondContact O-N 3.06Å; L78-C81 HydrophobicContact CB-CB 4.32Å; L78-C81 WeakPolarHBondContact O-CB 3.23Å; L78-C81 PolarHBondContact O-N 3.04Å; L78-C81 PolarHBondContact O-SG 2.82Å; L78-V114 HydrophobicContact CD2-CG1 4.22Å; L78-F123 HydrophobicContact CD2-CB 4.16Å; L78-F123 HydrophobicContact CD2-CD1 4.24Å; L78-F123 HydrophobicContact CD2-CG 4.21Å
79	T	70.5	Confident	78.9	Confident	106 Å²	106	52.2 Å²	52.2	65%	0.65	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-41.7	120.5	169.3	56.4	0	0	0	0	112.2	E71 C81	E71-T79 PolarHBondContact OE1-N 3.4Å; T79-C81 VanDerWaalsContact C-N 3.33Å
80	G	72.2	Confident	78.8	Confident	58 Å²	58	54.8 Å²	54.8	60%	0.598	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.7	11	-178.4	0	0	0	0	0	115.6	L78 P122	L78-G80 PolarHBondContact O-N 3.06Å; G80-P122 VanDerWaalsContact O-CB 3.3Å; G80-P122 WeakPolarHBondContact O-CB 3.34Å
81	C	80.3	Confident	78.9	Confident	7 Å²	7	55.2 Å²	55.2	5%	0.047	29%	0.289	C	S	.	.			trans	-61.8	155.7	178.2	67.7	0	0	0	0	113.5	L78 T79 F83 F123	L78-C81 HydrophobicContact CB-CB 4.32Å; L78-C81 WeakPolarHBondContact O-CB 3.23Å; L78-C81 PolarHBondContact O-N 3.04Å; L78-C81 PolarHBondContact O-SG 2.82Å; T79-C81 VanDerWaalsContact C-N 3.33Å; C81-F83 VanDerWaalsContact SG-CZ 3.55Å; C81-F123 CarbonylContact C-O 3.56Å; C81-F123 WeakPolarHBondContact CA-O 3.4Å; C81-F123 HydrophobicContact CB-CB 3.93Å; C81-F123 VanDerWaalsContact CB-O 3.23Å; C81-F123 WeakPolarHBondContact CB-O 3.42Å
82	Q	84	Confident	78.8	Confident	40 Å²	40	61 Å²	61	19%	0.187	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	125.8	176	-59.3	-168.6	17.3	0	0	111.1	Y84 P122 F123 R124 L125	Q82-Y84 HydrophobicContact CB-CD2 4.39Å; Q82-Y84 HydrophobicContact CB-CE2 3.64Å; Q82-Y84 WeakPolarHBondContact O-CD2 3.35Å; Q82-Y84 PolarHBondContact OE1-OH 3.39Å; Q82-P122 HydrophobicContact CG-CG 4.14Å; Q82-F123 PolarHBondContact N-O 2.75Å; Q82-R124 HydrophobicContact CB-CG 4.46Å; Q82-R124 WeakPolarHBondContact O-CA 3.45Å; Q82-L125 PolarHBondContact O-N 2.95Å
83	F	88.6	Confident	78.9	Confident	5 Å²	5	55.2 Å²	55.2	2%	0.022	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	136.8	-179.4	-54.8	-76.4	0	0	0	112.4	L63 Y64 A67 C81 L91 G93 L125	L63-F83 HydrophobicContact CB-CD1 3.68Å; L63-F83 HydrophobicContact CB-CD2 4.09Å; L63-F83 HydrophobicContact CB-CE1 3.77Å; L63-F83 HydrophobicContact CB-CE2 4.18Å; L63-F83 HydrophobicContact CB-CG 3.83Å; L63-F83 HydrophobicContact CB-CZ 4.03Å; L63-F83 HydrophobicContact CD1-CB 4Å; L63-F83 HydrophobicContact CD1-CD1 4.48Å; L63-F83 HydrophobicContact CD1-CG 4.17Å; L63-F83 WeakPolarHBondContact O-CE1 3.15Å; L63-F83 VanDerWaalsContact O-CZ 3.23Å; L63-F83 WeakPolarHBondContact O-CZ 3.38Å; Y64-F83 AromaticContact CD1-CE2 3.81Å; Y64-F83 HydrophobicContact CD1-CE2 3.81Å; Y64-F83 AromaticContact CD1-CZ 3.82Å; Y64-F83 HydrophobicContact CD1-CZ 3.82Å; Y64-F83 AromaticContact CE1-CE2 3.61Å; Y64-F83 HydrophobicContact CE1-CE2 3.61Å; Y64-F83 HydrophobicContact CE1-CZ 4.03Å; Y64-F83 HydrophobicContact CG-CE2 4.36Å; Y64-F83 HydrophobicContact CG-CZ 4.41Å; A67-F83 HydrophobicContact CB-CE1 3.96Å; A67-F83 HydrophobicContact CB-CZ 3.94Å; C81-F83 VanDerWaalsContact SG-CZ 3.55Å; F83-L91 HydrophobicContact CB-CB 3.91Å; F83-L91 PolarHBondContact O-N 3.33Å; F83-G93 VanDerWaalsContact CD2-CA 3.42Å; F83-G93 VanDerWaalsContact CE2-CA 3.43Å; F83-L125 WeakPolarHBondContact CA-O 3.37Å; F83-L125 HydrophobicContact CD1-CB 4.05Å; F83-L125 HydrophobicContact CD1-CD2 3.98Å; F83-L125 HydrophobicContact CD1-CG 4.5Å; F83-L125 HydrophobicContact CE1-CB 4.33Å; F83-L125 HydrophobicContact CE1-CD2 3.81Å
84	Y	87.4	Confident	79.2	Confident	4 Å²	4	56.8 Å²	56.8	2%	0.016	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	151.6	177.5	-72	-84.5	0	0	0	111.4	Q82 I89 K90 R124 L125 N126 V127 G602	Q82-Y84 HydrophobicContact CB-CD2 4.39Å; Q82-Y84 HydrophobicContact CB-CE2 3.64Å; Q82-Y84 WeakPolarHBondContact O-CD2 3.35Å; Q82-Y84 PolarHBondContact OE1-OH 3.39Å; Y84-I89 CarbonylContact C-O 3.46Å; Y84-I89 WeakPolarHBondContact CA-O 3.48Å; Y84-K90 HydrophobicContact CD1-CB 4.05Å; Y84-K90 HydrophobicContact CD1-CG 4.43Å; Y84-K90 HydrophobicContact CE1-CB 3.59Å; Y84-K90 HydrophobicContact CE1-CD 4.24Å; Y84-K90 HydrophobicContact CE1-CG 3.86Å; Y84-R124 HydrophobicContact CD2-CB 4.31Å; Y84-R124 HydrophobicContact CD2-CG 4.3Å; Y84-R124 HydrophobicContact CE2-CG 3.99Å; Y84-R124 PolarHBondContact OH-NH2 3.47Å; Y84-L125 PolarHBondContact N-O 3.36Å; Y84-N126 CarbonylContact O-C 3.28Å; Y84-V127 PolarHBondContact O-N 3.26Å; Y84-G602 VanDerWaalsContact CE1-CA 3.46Å; Y84-G602 WeakPolarHBondContact OH-CA 3.1Å; Y84-G602 PolarHBondContact OH-O 3Å
85	L	86.2	Confident	79.3	Confident	17 Å²	17	55.4 Å²	55.4	9%	0.089	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	121.1	166.5	-178.7	65.6	0	0	0	108.7	D87 R88 I89 L91 C101 V127 I130	L85-D87 PolarHBondContact O-N 3.17Å; L85-R88 PolarHBondContact O-N 3.37Å; L85-I89 HydrophobicContact CB-CB 4.32Å; L85-I89 PolarHBondContact N-O 2.92Å; L85-I89 PolarHBondContact O-N 2.73Å; L85-I89 VanDerWaalsContact O-N 3.14Å; L85-L91 HydrophobicContact CB-CD1 4.13Å; L85-L91 HydrophobicContact CB-CD2 4.03Å; L85-L91 HydrophobicContact CB-CG 4.23Å; L85-C101 HydrophobicContact CD2-CB 4.05Å; L85-V127 HydrophobicContact CD1-CB 3.84Å; L85-V127 HydrophobicContact CD1-CG1 3.78Å; L85-I130 HydrophobicContact CD1-CD1 3.94Å; L85-I130 HydrophobicContact CD1-CG1 4.34Å
86	Q	83.4	Confident	79.6	Confident	77 Å²	77	54.6 Å²	54.6	36%	0.36	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.9	38.3	177.7	-61.4	-175.8	-15.2	0	0	114	R88 N126 V127 V128	Q86-R88 WeakPolarHBondContact O-CD 3.42Å; Q86-R88 VanDerWaalsContact O-CG 3.26Å; Q86-R88 WeakPolarHBondContact O-CG 3.41Å; Q86-R88 PolarHBondContact O-N 2.96Å; Q86-R88 VanDerWaalsContact O-N 3.08Å; Q86-N126 PolarHBondContact N-OD1 3.35Å; Q86-V127 PolarHBondContact N-O 2.68Å; Q86-V128 WeakPolarHBondContact CG-O 3.3Å; Q86-V128 PolarHBondContact NE2-O 3.14Å
87	D	81.7	Confident	79.5	Confident	75 Å²	75	53.6 Å²	53.6	40%	0.401	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	55	16.8	-174.8	-63.1	-73.8	0	0	0	115.3	L85 K115 N126	L85-D87 PolarHBondContact O-N 3.17Å; D87-K115 IonicContact OD1-NZ 2.69Å; D87-K115 PolarHBondContact OD1-NZ 3.45Å; D87-K115 IonicContact OD2-NZ 3.12Å; D87-K115 PolarHBondContact OD2-NZ 3.13Å; D87-N126 PolarHBondContact N-OD1 3.34Å; D87-N126 PolarHBondContact OD1-ND2 3.29Å; D87-N126 PolarHBondContact OD2-ND2 2.94Å
88	R	76.3	Confident	79.4	Confident	136 Å²	136	54 Å²	54	51%	0.513	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-120.2	-62.2	-170.8	-70.6	158.3	-170.5	-141.8	-2.2	112	L85 Q86 T599	L85-R88 PolarHBondContact O-N 3.37Å; Q86-R88 WeakPolarHBondContact O-CD 3.42Å; Q86-R88 VanDerWaalsContact O-CG 3.26Å; Q86-R88 WeakPolarHBondContact O-CG 3.41Å; Q86-R88 PolarHBondContact O-N 2.96Å; Q86-R88 VanDerWaalsContact O-N 3.08Å; R88-T599 VanDerWaalsContact O-O 3.1Å
89	I	80.1	Confident	78.9	Confident	68 Å²	68	60.3 Å²	60.3	35%	0.349	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	115.3	-172.5	-57.9	171.7	0	0	0	107.7	M1 Y84 L85 L91	M1-I89 HydrophobicContact CE-CD1 4.25Å; Y84-I89 CarbonylContact C-O 3.46Å; Y84-I89 WeakPolarHBondContact CA-O 3.48Å; L85-I89 HydrophobicContact CB-CB 4.32Å; L85-I89 PolarHBondContact N-O 2.92Å; L85-I89 PolarHBondContact O-N 2.73Å; L85-I89 VanDerWaalsContact O-N 3.14Å; I89-L91 HydrophobicContact CG2-CD2 4.25Å; I89-L91 PolarHBondContact O-N 3.4Å
90	K	82.6	Confident	78.4	Confident	87 Å²	87	58 Å²	58	38%	0.378	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	127.4	171	-170.2	169.7	-178.7	163	0	109.6	Y84	Y84-K90 HydrophobicContact CD1-CB 4.05Å; Y84-K90 HydrophobicContact CD1-CG 4.43Å; Y84-K90 HydrophobicContact CE1-CB 3.59Å; Y84-K90 HydrophobicContact CE1-CD 4.24Å; Y84-K90 HydrophobicContact CE1-CG 3.86Å
91	L	84	Confident	77.7	Confident	8 Å²	8	58 Å²	58	4%	0.042	28%	0.277	C	S	.	.	P	Polyproline II helix	trans	-95.9	150.6	177.1	-52	177.4	0	0	0	109.7	L63 F83 L85 I89 L97 H100 V127	L63-L91 HydrophobicContact CD1-CB 3.56Å; L63-L91 HydrophobicContact CD1-CD1 3.5Å; L63-L91 HydrophobicContact CD1-CG 4.17Å; F83-L91 HydrophobicContact CB-CB 3.91Å; F83-L91 PolarHBondContact O-N 3.33Å; L85-L91 HydrophobicContact CB-CD1 4.13Å; L85-L91 HydrophobicContact CB-CD2 4.03Å; L85-L91 HydrophobicContact CB-CG 4.23Å; I89-L91 HydrophobicContact CG2-CD2 4.25Å; I89-L91 PolarHBondContact O-N 3.4Å; L91-L97 HydrophobicContact CD1-CD2 4.47Å; L91-H100 HydrophobicContact CD2-CB 3.95Å; L91-V127 HydrophobicContact CD1-CG2 4.15Å
92	R	81.7	Confident	76.6	Confident	171 Å²	171	58.3 Å²	58.3	65%	0.645	28%	0.279	S	S	*	.	P	Polyproline II helix	trans	-79.4	136.7	166.4	-62.7	176.3	-178.6	175.9	-1.9	108.8	S95 H100	R92-S95 WeakPolarHBondContact CB-OG 3.3Å; R92-S95 PolarHBondContact O-OG 3.45Å; R92-H100 PolarHBondContact N-NE2 3.44Å
93	G	81.7	Confident	75.2	Confident	6 Å²	6	66.3 Å²	66.3	6%	0.062	32%	0.316	C	S	.	.	S	Bend	trans	-70.3	-35.4	-179.5	0	0	0	0	0	113.5	T62 L63 Y64 F83 S95	T62-G93 WeakPolarHBondContact CB-O 3.37Å; L63-G93 PolarHBondContact N-O 3.47Å; Y64-G93 WeakPolarHBondContact CD2-O 3.32Å; Y64-G93 VanDerWaalsContact CE2-C 3.4Å; Y64-G93 VanDerWaalsContact CE2-CA 3.48Å; Y64-G93 PolarHBondContact N-O 3.49Å; F83-G93 VanDerWaalsContact CD2-CA 3.42Å; F83-G93 VanDerWaalsContact CE2-CA 3.43Å; G93-S95 VanDerWaalsContact C-N 3.32Å; G93-S95 PolarHBondContact O-N 3.04Å
94	E	79.2	Confident	73.7	Confident	153 Å²	153	68.9 Å²	68.9	72%	0.715	33%	0.33	S	S	*	.	S	Bend	trans	-69.5	-27.2	-173	-54.2	168.3	161.2	0	0	113.2	T62 Y64	T62-E94 WeakPolarHBondContact CG2-O 3.35Å; Y64-E94 HydrophobicContact CD2-CG 4.46Å; Y64-E94 HydrophobicContact CE2-CG 3.85Å
95	S	76.5	Confident	72.4	Confident	7 Å²	7	73.9 Å²	73.9	5%	0.049	37%	0.365	C	S	.	.	S	Bend	trans	-93.6	146.5	-174.5	52.8	0	0	0	0	112.4	R92 G93 E99 H100	R92-S95 WeakPolarHBondContact CB-OG 3.3Å; R92-S95 PolarHBondContact O-OG 3.45Å; G93-S95 VanDerWaalsContact C-N 3.32Å; G93-S95 PolarHBondContact O-N 3.04Å; S95-E99 WeakPolarHBondContact CB-OE2 3.35Å; S95-H100 PolarHBondContact OG-CE1 2.89Å; S95-H100 PolarHBondContact OG-ND1 3.12Å; S95-H100 VanDerWaalsContact OG-ND1 3.1Å
96	P	75.4	Confident	71.6	Confident	30 Å²	30	73.9 Å²	73.9	20%	0.195	37%	0.369	C	S	.	.	B	Isolated β-bridge	trans	-68	160.5	170.1	30.3	-34.8	0	0	0	112.1	V59 Q61 V98 E99	V59-P96 WeakPolarHBondContact O-CB 3.2Å; Q61-P96 WeakPolarHBondContact O-CA 3Å; P96-V98 HydrophobicContact CB-CG2 4.49Å; P96-V98 PolarHBondContact O-N 3.44Å; P96-V98 VanDerWaalsContact O-N 3.15Å; P96-E99 HydrophobicContact CG-CG 4.15Å; P96-E99 PolarHBondContact O-N 3.15Å
97	L	70.9	Confident	71.1	Confident	4 Å²	4	70.6 Å²	70.6	2%	0.021	35%	0.354	C	S	.	.	H	α-helix	trans	-60.9	-23.1	177.1	-80.1	154.1	0	0	0	113.1	V57 V59 L63 L91 E99 H100 C101 V102 V108 L110 I130	V57-L97 HydrophobicContact CG2-CD1 4.38Å; V59-L97 HydrophobicContact CG1-CB 3.71Å; V59-L97 PolarHBondContact O-N 3.38Å; L63-L97 HydrophobicContact CD2-CD1 4.12Å; L63-L97 HydrophobicContact CD2-CD2 4.13Å; L63-L97 HydrophobicContact CD2-CG 4.01Å; L91-L97 HydrophobicContact CD1-CD2 4.47Å; L97-E99 PolarHBondContact O-N 2.84Å; L97-H100 PolarHBondContact O-N 3.03Å; L97-C101 PolarHBondContact O-N 3.02Å; L97-V102 HydrophobicContact CB-CG2 4.36Å; L97-V102 PolarHBondContact O-N 2.78Å; L97-V108 HydrophobicContact CD1-CG2 4.47Å; L97-L110 HydrophobicContact CD1-CD1 3.81Å; L97-L110 HydrophobicContact CD1-CD2 3.9Å; L97-L110 HydrophobicContact CD1-CG 4.43Å; L97-I130 HydrophobicContact CD2-CD1 4.22Å
98	V	68.9	Low	71.1	Confident	72 Å²	72	67 Å²	67	44%	0.436	34%	0.335	S	S	.	.	H	α-helix	trans	-55.1	-50.3	174.5	-173.7	0	0	0	0	110.4	V59 P96 H100	V59-V98 HydrophobicContact CB-CG2 4.03Å; V59-V98 HydrophobicContact CG1-CB 4.28Å; V59-V98 HydrophobicContact CG1-CG2 3.5Å; V59-V98 VanDerWaalsContact CG1-CG2 3.5Å; P96-V98 HydrophobicContact CB-CG2 4.49Å; P96-V98 PolarHBondContact O-N 3.44Å; P96-V98 VanDerWaalsContact O-N 3.15Å; V98-H100 PolarHBondContact O-N 3.46Å
99	E	66	Low	71.5	Confident	136 Å²	136	63 Å²	63	64%	0.636	32%	0.322	S	S	*	.	H	α-helix	trans	-65.3	-28.2	-175.6	-71.9	-172.7	179.7	0	0	113.2	S95 P96 L97	S95-E99 WeakPolarHBondContact CB-OE2 3.35Å; P96-E99 HydrophobicContact CG-CG 4.15Å; P96-E99 PolarHBondContact O-N 3.15Å; L97-E99 PolarHBondContact O-N 2.84Å
100	H	58.8	Low	71.8	Confident	58 Å²	58	59.7 Å²	59.7	27%	0.269	31%	0.305	S	S	.	.	H	α-helix	trans	-96.7	-36.2	-168.3	-83.8	64.5	0	0	0	114.4	L91 R92 S95 L97 V98	L91-H100 HydrophobicContact CD2-CB 3.95Å; R92-H100 PolarHBondContact N-NE2 3.44Å; S95-H100 PolarHBondContact OG-CE1 2.89Å; S95-H100 PolarHBondContact OG-ND1 3.12Å; S95-H100 VanDerWaalsContact OG-ND1 3.1Å; L97-H100 PolarHBondContact O-N 3.03Å; V98-H100 PolarHBondContact O-N 3.46Å
101	C	57.9	Low	72	Confident	58 Å²	58	57.3 Å²	57.3	39%	0.392	30%	0.296	S	S	.	.	H	α-helix	trans	-162.2	4.6	-178.2	-139.7	0	0	0	0	117.5	L85 L97	L85-C101 HydrophobicContact CD2-CB 4.05Å; L97-C101 PolarHBondContact O-N 3.02Å
102	V	56.7	Low	72.3	Confident	13 Å²	13	56.9 Å²	56.9	8%	0.079	29%	0.294	C	S	.	.			trans	-126.5	100.5	-162.5	-174	0	0	0	0	112.6	V59 L97 I104 I130	V59-V102 HydrophobicContact CG1-CB 3.75Å; V59-V102 HydrophobicContact CG1-CG1 3.62Å; V59-V102 HydrophobicContact CG1-CG2 4.38Å; V59-V102 HydrophobicContact CG2-CG1 4.12Å; L97-V102 HydrophobicContact CB-CG2 4.36Å; L97-V102 PolarHBondContact O-N 2.78Å; V102-I104 HydrophobicContact CG1-CB 3.68Å; V102-I104 HydrophobicContact CG1-CD1 4.19Å; V102-I104 HydrophobicContact CG1-CG1 4.12Å; V102-I104 PolarHBondContact O-N 2.93Å; V102-I130 HydrophobicContact CG2-CD1 4.04Å
103	E	55.9	Low	72.5	Confident	208 Å²	208	49.8 Å²	49.8	97%	0.972	27%	0.268	S	S	*	.			trans	-70.5	-3.4	169.6	-66.1	176.4	175.9	0	0	113.4
104	I	55.9	Low	72.6	Confident	59 Å²	59	50.1 Å²	50.1	30%	0.303	27%	0.269	S	S	.	.			trans	-87.7	114.8	-176.2	-52.8	160.5	0	0	0	108.9	V102 I132	V102-I104 HydrophobicContact CG1-CB 3.68Å; V102-I104 HydrophobicContact CG1-CD1 4.19Å; V102-I104 HydrophobicContact CG1-CG1 4.12Å; V102-I104 PolarHBondContact O-N 2.93Å; I104-I132 HydrophobicContact CD1-CD1 3.9Å; I104-I132 HydrophobicContact CD1-CG1 3.94Å; I104-I132 HydrophobicContact CG1-CD1 4.41Å; I104-I132 HydrophobicContact CG2-CD1 4.1Å; I104-I132 HydrophobicContact CG2-CG1 4.28Å
105	S	61.3	Low	72.5	Confident	108 Å²	108	46 Å²	46	76%	0.755	25%	0.249	S	C	*	.			trans	-76.4	136.6	163.8	53.1	0	0	0	0	110.4
106	G	68.8	Low	72.1	Confident	18 Å²	18	47.1 Å²	47.1	19%	0.186	26%	0.255	C	S	.	.	S	Bend	trans	131.5	-148.1	172.6	0	0	0	0	0	114.3	V59 H278	V59-G106 WeakPolarHBondContact CG2-O 3.32Å; V59-G106 PolarHBondContact N-O 2.71Å; V59-G106 VanDerWaalsContact N-O 3.09Å; G106-H278 VanDerWaalsContact C-ND1 3.33Å; G106-H278 VanDerWaalsContact CA-ND1 3.33Å; G106-H278 WeakPolarHBondContact CA-ND1 3.22Å; G106-H278 PolarHBondContact O-CE1 3.31Å
107	L	72.2	Confident	71.1	Confident	8 Å²	8	47 Å²	47	4%	0.042	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	144	174.3	-63.9	-178.9	0	0	0	110.7	V56 V57 P133 H278 R281 L282 M285	V56-L107 HydrophobicContact CG1-CB 4.06Å; V56-L107 HydrophobicContact CG1-CD1 4.46Å; V57-L107 WeakPolarHBondContact O-CA 3.26Å; L107-P133 HydrophobicContact CB-CG 4.34Å; L107-P133 WeakPolarHBondContact O-CD 3.47Å; L107-H278 WeakPolarHBondContact CD1-O 3.35Å; L107-H278 WeakPolarHBondContact CD2-CE1 3.5Å; L107-H278 PolarHBondContact N-ND1 2.7Å; L107-R281 HydrophobicContact CD1-CB 3.7Å; L107-L282 HydrophobicContact CD1-CB 3.81Å; L107-L282 HydrophobicContact CD1-CD1 4.25Å; L107-L282 VanDerWaalsContact CD1-N 3.31Å; L107-L282 HydrophobicContact CD2-CB 4.25Å; L107-L282 HydrophobicContact CD2-CD1 3.78Å; L107-L282 HydrophobicContact CD2-CG 4.48Å; L107-M285 HydrophobicContact CD1-CE 4.09Å
108	V	82.4	Confident	70	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	132.6	169.8	-71.6	0	0	0	0	111.1	V56 V57 V59 L97 L110 I130 Q131	V56-V108 WeakPolarHBondContact CA-O 3.43Å; V56-V108 WeakPolarHBondContact CG1-O 3.33Å; V57-V108 HydrophobicContact CG2-CG2 4.24Å; V57-V108 PolarHBondContact N-O 3.47Å; V57-V108 VanDerWaalsContact N-O 3.12Å; V57-V108 PolarHBondContact O-N 2.91Å; V59-V108 HydrophobicContact CG2-CB 4.12Å; V59-V108 HydrophobicContact CG2-CG1 3.5Å; V59-V108 VanDerWaalsContact CG2-CG1 3.5Å; V59-V108 HydrophobicContact CG2-CG2 3.61Å; L97-V108 HydrophobicContact CD1-CG2 4.47Å; V108-L110 HydrophobicContact CB-CD2 4.47Å; V108-L110 HydrophobicContact CG2-CD2 3.79Å; V108-L110 HydrophobicContact CG2-CG 4.34Å; V108-L110 PolarHBondContact O-N 2.92Å; V108-I130 HydrophobicContact CB-CG2 3.67Å; V108-I130 HydrophobicContact CG1-CG2 3.7Å; V108-I130 HydrophobicContact CG2-CG2 4.05Å; V108-Q131 CarbonylContact C-O 3.55Å; V108-Q131 WeakPolarHBondContact CA-O 3.31Å
109	Q	83.9	Confident	68.8	Low	50 Å²	50	51.3 Å²	51.3	23%	0.234	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	105.9	168.6	178.6	163.2	54	0	0	108.5	V56 Q131	V56-Q109 HydrophobicContact CG2-CB 3.76Å; V56-Q109 HydrophobicContact CG2-CG 3.87Å; Q109-Q131 HydrophobicContact CB-CB 4.34Å; Q109-Q131 PolarHBondContact N-O 2.9Å; Q109-Q131 PolarHBondContact O-N 3.43Å
110	L	86.9	Confident	67.8	Low	0 Å²	0	47.9 Å²	47.9	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	126.4	173.5	-54.5	-179.7	0	0	0	108.9	K54 V55 V57 V66 L97 V108 L112 V127 I130	K54-L110 WeakPolarHBondContact CA-O 3.24Å; V55-L110 PolarHBondContact N-O 3.22Å; V55-L110 PolarHBondContact O-N 3.25Å; V57-L110 HydrophobicContact CG2-CD1 3.6Å; V57-L110 HydrophobicContact CG2-CG 4.02Å; V66-L110 HydrophobicContact CG1-CD1 4.2Å; L97-L110 HydrophobicContact CD1-CD1 3.81Å; L97-L110 HydrophobicContact CD1-CD2 3.9Å; L97-L110 HydrophobicContact CD1-CG 4.43Å; V108-L110 HydrophobicContact CB-CD2 4.47Å; V108-L110 HydrophobicContact CG2-CD2 3.79Å; V108-L110 HydrophobicContact CG2-CG 4.34Å; V108-L110 PolarHBondContact O-N 2.92Å; L110-L112 HydrophobicContact CB-CD1 4.26Å; L110-L112 HydrophobicContact CB-CD2 3.99Å; L110-L112 HydrophobicContact CB-CG 3.82Å; L110-L112 HydrophobicContact CD1-CD1 4.43Å; L110-L112 HydrophobicContact CD1-CD2 4.17Å; L110-L112 PolarHBondContact O-N 3.45Å; L110-V127 HydrophobicContact CD2-CG1 4.11Å; L110-I130 HydrophobicContact CD2-CB 4.41Å; L110-I130 HydrophobicContact CD2-CD1 4.44Å; L110-I130 HydrophobicContact CD2-CG1 3.9Å; L110-I130 HydrophobicContact CD2-CG2 4.12Å
111	L	88.2	Confident	67.5	Low	36 Å²	36	50 Å²	50	19%	0.188	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	99.6	160.2	-177.3	63.5	0	0	0	107.2	R52 K54 V128 D129	R52-L111 HydrophobicContact CB-CD1 4.24Å; K54-L111 HydrophobicContact CG-CD1 3.87Å; L111-V128 HydrophobicContact CB-CB 4.31Å; L111-V128 HydrophobicContact CD2-CB 4.05Å; L111-V128 HydrophobicContact CD2-CG1 3.99Å; L111-V128 HydrophobicContact CG-CB 4.04Å; L111-V128 WeakPolarHBondContact O-CB 3.33Å; L111-V128 PolarHBondContact O-N 3.04Å; L111-D129 HydrophobicContact CB-CB 3.99Å; L111-D129 HydrophobicContact CD2-CB 4.41Å; L111-D129 PolarHBondContact N-O 2.77Å; L111-D129 PolarHBondContact O-N 2.87Å
112	L	88.8	Confident	67.4	Low	0 Å²	0	49.5 Å²	49.5	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	149.5	-180	-61	168.3	0	0	0	109.9	R52 V53 V55 V66 L70 L110 L125 N126 V127	R52-L112 CarbonylContact C-O 3.46Å; R52-L112 VanDerWaalsContact CA-O 3.22Å; R52-L112 WeakPolarHBondContact CA-O 3.44Å; V53-L112 PolarHBondContact N-O 3.12Å; V53-L112 WeakPolarHBondContact O-CB 3.31Å; V53-L112 PolarHBondContact O-N 3.33Å; V55-L112 HydrophobicContact CB-CD1 3.99Å; V55-L112 HydrophobicContact CG2-CD1 3.83Å; V66-L112 HydrophobicContact CG1-CD1 3.62Å; L70-L112 HydrophobicContact CD1-CB 4.47Å; L70-L112 HydrophobicContact CD1-CD1 3.74Å; L70-L112 HydrophobicContact CG-CD1 4.37Å; L110-L112 HydrophobicContact CB-CD1 4.26Å; L110-L112 HydrophobicContact CB-CD2 3.99Å; L110-L112 HydrophobicContact CB-CG 3.82Å; L110-L112 HydrophobicContact CD1-CD1 4.43Å; L110-L112 HydrophobicContact CD1-CD2 4.17Å; L110-L112 PolarHBondContact O-N 3.45Å; L112-L125 HydrophobicContact CB-CD1 4.18Å; L112-L125 HydrophobicContact CD2-CD2 4.41Å; L112-L125 HydrophobicContact CD2-CG 4.33Å; L112-N126 CarbonylContact C-O 3.49Å; L112-N126 WeakPolarHBondContact CA-O 3.44Å; L112-V127 HydrophobicContact CD2-CB 4.37Å; L112-V127 HydrophobicContact CD2-CG2 3.75Å
113	E	86.1	Confident	68.1	Low	22 Å²	22	50.4 Å²	50.4	10%	0.103	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	117	179.7	-177.9	178.7	-124.9	0	0	109.2	N51 R52 K115 N126 V128	N51-E113 WeakPolarHBondContact O-CA 3.44Å; R52-E113 HydrophobicContact CG-CB 4.06Å; R52-E113 HydrophobicContact CG-CG 3.92Å; R52-E113 IonicContact CZ-OE1 2.81Å; R52-E113 IonicContact NE-OE1 2.95Å; R52-E113 PolarHBondContact NE-OE1 2.97Å; R52-E113 IonicContact NH2-OE1 3.68Å; R52-E113 PolarHBondContact NH2-OE1 2.82Å; R52-E113 IonicContact NH2-OE2 2.61Å; E113-K115 HydrophobicContact CG-CG 4.36Å; E113-K115 WeakPolarHBondContact OE2-CE 3.29Å; E113-K115 IonicContact OE2-NZ 2.7Å; E113-K115 PolarHBondContact OE2-NZ 2.88Å; E113-N126 HydrophobicContact CB-CB 4.2Å; E113-N126 PolarHBondContact N-O 3.1Å; E113-N126 PolarHBondContact O-N 2.89Å; E113-N126 PolarHBondContact OE2-ND2 3.1Å; E113-V128 HydrophobicContact CB-CG2 3.46Å; E113-V128 VanDerWaalsContact CB-CG2 3.46Å; E113-V128 HydrophobicContact CG-CG2 4.33Å
114	V	83.5	Confident	69.3	Low	13 Å²	13	42.2 Å²	42.2	8%	0.079	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	113.5	-174.9	-176.7	0	0	0	0	109	N51 L74 L78 L125	N51-V114 PolarHBondContact O-N 3.36Å; L74-V114 HydrophobicContact CD1-CG2 4.18Å; L78-V114 HydrophobicContact CD2-CG1 4.22Å; V114-L125 HydrophobicContact CG2-CD1 3.94Å
115	K	78.6	Confident	70.8	Confident	66 Å²	66	39.5 Å²	39.5	29%	0.287	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	108.5	-178.2	-70.1	-179	-176.8	167.2	0	111.1	D87 E113 R124 N126	D87-K115 IonicContact OD1-NZ 2.69Å; D87-K115 PolarHBondContact OD1-NZ 3.45Å; D87-K115 IonicContact OD2-NZ 3.12Å; D87-K115 PolarHBondContact OD2-NZ 3.13Å; E113-K115 HydrophobicContact CG-CG 4.36Å; E113-K115 WeakPolarHBondContact OE2-CE 3.29Å; E113-K115 IonicContact OE2-NZ 2.7Å; E113-K115 PolarHBondContact OE2-NZ 2.88Å; K115-R124 HydrophobicContact CB-CB 4.15Å; K115-R124 PolarHBondContact N-O 2.81Å; K115-R124 PolarHBondContact O-N 3.12Å; K115-N126 PolarHBondContact NZ-ND2 3.44Å
116	T	67.4	Low	72	Confident	31 Å²	31	34.4 Å²	34.4	19%	0.19	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	124.9	165.2	56.1	0	0	0	0	109.7	Q43 H118 F123	Q43-T116 PolarHBondContact NE2-OG1 3.39Å; Q43-T116 PolarHBondContact OE1-OG1 3.09Å; T116-H118 PolarHBondContact O-N 3.16Å; T116-F123 HydrophobicContact CG2-CD1 4.07Å; T116-F123 HydrophobicContact CG2-CE1 3.9Å
117	A	54.4	Low	72.9	Confident	28 Å²	28	33.6 Å²	33.6	23%	0.231	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	115.2	168.8	0	0	0	0	0	109.5	A119	A117-A119 PolarHBondContact O-N 3.32Å
118	H	48.3	Very low	73.6	Confident	111 Å²	111	34.6 Å²	34.6	51%	0.514	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.8	134.6	173.5	-67.9	-33.3	0	0	0	110.5	T116	T116-H118 PolarHBondContact O-N 3.16Å
119	A	43.6	Very low	73.6	Confident	54 Å²	54	36.9 Å²	36.9	45%	0.446	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	69	58.1	-178.6	0	0	0	0	0	116.8	A117	A117-A119 PolarHBondContact O-N 3.32Å
120	G	45.3	Very low	73.6	Confident	65 Å²	65	36.4 Å²	36.4	67%	0.67	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	88.4	21.4	149.3	0	0	0	0	0	117.2
121	Y	51	Low	73.1	Confident	103 Å²	103	40.6 Å²	40.6	40%	0.404	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	153.2	171.9	-81.7	-96.5	0	0	0	110.7	L611	Y121-L611 HydrophobicContact CE2-CD2 4.44Å
122	P	56.2	Low	72.2	Confident	47 Å²	47	43.6 Å²	43.6	31%	0.305	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.5	152	-176.2	23	-34.6	0	0	0	112.9	G80 Q82	G80-P122 VanDerWaalsContact O-CB 3.3Å; G80-P122 WeakPolarHBondContact O-CB 3.34Å; Q82-P122 HydrophobicContact CG-CG 4.14Å
123	F	71.9	Confident	71	Confident	31 Å²	31	44.5 Å²	44.5	14%	0.136	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-48.2	140.2	172.9	-63.6	-92.6	0	0	0	111.1	I76 C77 L78 C81 Q82 T116	I76-F123 HydrophobicContact CG2-CE1 4.04Å; I76-F123 HydrophobicContact CG2-CZ 4.39Å; C77-F123 WeakPolarHBondContact O-CD2 3.35Å; C77-F123 WeakPolarHBondContact O-CE2 3.23Å; L78-F123 HydrophobicContact CD2-CB 4.16Å; L78-F123 HydrophobicContact CD2-CD1 4.24Å; L78-F123 HydrophobicContact CD2-CG 4.21Å; C81-F123 CarbonylContact C-O 3.56Å; C81-F123 WeakPolarHBondContact CA-O 3.4Å; C81-F123 HydrophobicContact CB-CB 3.93Å; C81-F123 VanDerWaalsContact CB-O 3.23Å; C81-F123 WeakPolarHBondContact CB-O 3.42Å; Q82-F123 PolarHBondContact N-O 2.75Å; T116-F123 HydrophobicContact CG2-CD1 4.07Å; T116-F123 HydrophobicContact CG2-CE1 3.9Å
124	R	80.6	Confident	69.5	Low	36 Å²	36	50.6 Å²	50.6	14%	0.136	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	125.2	172.3	-67.3	-170.9	172.6	-146.6	-6	109.3	Q82 Y84 K115 G602 F603	Q82-R124 HydrophobicContact CB-CG 4.46Å; Q82-R124 WeakPolarHBondContact O-CA 3.45Å; Y84-R124 HydrophobicContact CD2-CB 4.31Å; Y84-R124 HydrophobicContact CD2-CG 4.3Å; Y84-R124 HydrophobicContact CE2-CG 3.99Å; Y84-R124 PolarHBondContact OH-NH2 3.47Å; K115-R124 HydrophobicContact CB-CB 4.15Å; K115-R124 PolarHBondContact N-O 2.81Å; K115-R124 PolarHBondContact O-N 3.12Å; R124-G602 PolarHBondContact NH2-O 3.1Å; R124-F603 VanDerWaalsContact NH2-CE1 3.27Å
125	L	87.5	Confident	67.8	Low	2 Å²	2	53.1 Å²	53.1	1%	0.01	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	112.2	172.4	-171.5	67.3	0	0	0	108.6	L70 Q82 F83 Y84 L112 V114	L70-L125 HydrophobicContact CD1-CD1 3.52Å; L70-L125 HydrophobicContact CD1-CD2 3.92Å; L70-L125 HydrophobicContact CD1-CG 4.38Å; Q82-L125 PolarHBondContact O-N 2.95Å; F83-L125 WeakPolarHBondContact CA-O 3.37Å; F83-L125 HydrophobicContact CD1-CB 4.05Å; F83-L125 HydrophobicContact CD1-CD2 3.98Å; F83-L125 HydrophobicContact CD1-CG 4.5Å; F83-L125 HydrophobicContact CE1-CB 4.33Å; F83-L125 HydrophobicContact CE1-CD2 3.81Å; Y84-L125 PolarHBondContact N-O 3.36Å; L112-L125 HydrophobicContact CB-CD1 4.18Å; L112-L125 HydrophobicContact CD2-CD2 4.41Å; L112-L125 HydrophobicContact CD2-CG 4.33Å; V114-L125 HydrophobicContact CG2-CD1 3.94Å
126	N	86.6	Confident	66.2	Low	2 Å²	2	55.5 Å²	55.5	1%	0.011	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	116	-174.2	-179.9	43.3	0	0	0	111	Y84 Q86 D87 L112 E113 K115 V128	Y84-N126 CarbonylContact O-C 3.28Å; Q86-N126 PolarHBondContact N-OD1 3.35Å; D87-N126 PolarHBondContact N-OD1 3.34Å; D87-N126 PolarHBondContact OD1-ND2 3.29Å; D87-N126 PolarHBondContact OD2-ND2 2.94Å; L112-N126 CarbonylContact C-O 3.49Å; L112-N126 WeakPolarHBondContact CA-O 3.44Å; E113-N126 HydrophobicContact CB-CB 4.2Å; E113-N126 PolarHBondContact N-O 3.1Å; E113-N126 PolarHBondContact O-N 2.89Å; E113-N126 PolarHBondContact OE2-ND2 3.1Å; K115-N126 PolarHBondContact NZ-ND2 3.44Å; N126-V128 PolarHBondContact O-N 2.95Å
127	V	88.2	Confident	64.7	Low	1 Å²	1	59.6 Å²	59.6	1%	0.006	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	98.5	167.5	-172.4	0	0	0	0	107.7	Y84 L85 Q86 L91 L110 L112 I130	Y84-V127 PolarHBondContact O-N 3.26Å; L85-V127 HydrophobicContact CD1-CB 3.84Å; L85-V127 HydrophobicContact CD1-CG1 3.78Å; Q86-V127 PolarHBondContact N-O 2.68Å; L91-V127 HydrophobicContact CD1-CG2 4.15Å; L110-V127 HydrophobicContact CD2-CG1 4.11Å; L112-V127 HydrophobicContact CD2-CB 4.37Å; L112-V127 HydrophobicContact CD2-CG2 3.75Å; V127-I130 HydrophobicContact CG1-CD1 4Å; V127-I130 HydrophobicContact CG1-CG1 3.55Å
128	V	86.4	Confident	63.7	Low	29 Å²	29	66.4 Å²	66.4	18%	0.176	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	-42.1	179.4	-175.4	0	0	0	0	110.6	Q86 L111 E113 N126	Q86-V128 WeakPolarHBondContact CG-O 3.3Å; Q86-V128 PolarHBondContact NE2-O 3.14Å; L111-V128 HydrophobicContact CB-CB 4.31Å; L111-V128 HydrophobicContact CD2-CB 4.05Å; L111-V128 HydrophobicContact CD2-CG1 3.99Å; L111-V128 HydrophobicContact CG-CB 4.04Å; L111-V128 WeakPolarHBondContact O-CB 3.33Å; L111-V128 PolarHBondContact O-N 3.04Å; E113-V128 HydrophobicContact CB-CG2 3.46Å; E113-V128 VanDerWaalsContact CB-CG2 3.46Å; E113-V128 HydrophobicContact CG-CG2 4.33Å; N126-V128 PolarHBondContact O-N 2.95Å
129	D	83	Confident	63.2	Low	48 Å²	48	69.7 Å²	69.7	26%	0.257	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	155.9	-177.3	-159.7	11	0	0	0	111.6	L111 Q131	L111-D129 HydrophobicContact CB-CB 3.99Å; L111-D129 HydrophobicContact CD2-CB 4.41Å; L111-D129 PolarHBondContact N-O 2.77Å; L111-D129 PolarHBondContact O-N 2.87Å; D129-Q131 WeakPolarHBondContact OD2-CG 3.48Å; D129-Q131 PolarHBondContact OD2-NE2 3.31Å
130	I	83.3	Confident	62.5	Low	40 Å²	40	70.6 Å²	70.6	21%	0.205	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	103.3	179.8	-54.7	-177.8	0	0	0	107.5	L85 L97 V102 V108 L110 V127	L85-I130 HydrophobicContact CD1-CD1 3.94Å; L85-I130 HydrophobicContact CD1-CG1 4.34Å; L97-I130 HydrophobicContact CD2-CD1 4.22Å; V102-I130 HydrophobicContact CG2-CD1 4.04Å; V108-I130 HydrophobicContact CB-CG2 3.67Å; V108-I130 HydrophobicContact CG1-CG2 3.7Å; V108-I130 HydrophobicContact CG2-CG2 4.05Å; L110-I130 HydrophobicContact CD2-CB 4.41Å; L110-I130 HydrophobicContact CD2-CD1 4.44Å; L110-I130 HydrophobicContact CD2-CG1 3.9Å; L110-I130 HydrophobicContact CD2-CG2 4.12Å; V127-I130 HydrophobicContact CG1-CD1 4Å; V127-I130 HydrophobicContact CG1-CG1 3.55Å
131	Q	75.4	Confident	61.8	Low	88 Å²	88	73.1 Å²	73.1	41%	0.411	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	142.2	-176	-60.1	-176.8	2.4	0	0	110.7	V108 Q109 D129	V108-Q131 CarbonylContact C-O 3.55Å; V108-Q131 WeakPolarHBondContact CA-O 3.31Å; Q109-Q131 HydrophobicContact CB-CB 4.34Å; Q109-Q131 PolarHBondContact N-O 2.9Å; Q109-Q131 PolarHBondContact O-N 3.43Å; D129-Q131 WeakPolarHBondContact OD2-CG 3.48Å; D129-Q131 PolarHBondContact OD2-NE2 3.31Å
132	I	71.2	Confident	60.8	Low	98 Å²	98	76.4 Å²	76.4	50%	0.503	42%	0.423	S	S	.	.	P	Polyproline II helix	trans	-78.6	126.2	164.9	-53.1	176.9	0	0	0	106.1	I104 E134	I104-I132 HydrophobicContact CD1-CD1 3.9Å; I104-I132 HydrophobicContact CD1-CG1 3.94Å; I104-I132 HydrophobicContact CG1-CD1 4.41Å; I104-I132 HydrophobicContact CG2-CD1 4.1Å; I104-I132 HydrophobicContact CG2-CG1 4.28Å; I132-E134 PolarHBondContact O-N 3.33Å
133	P	62.4	Low	59.5	Low	20 Å²	20	79.4 Å²	79.4	13%	0.13	45%	0.446	C	S	.	.	P	Polyproline II helix	trans	-60.1	131.7	175.4	24.7	-32.7	0	0	0	110.1	L107 S135	L107-P133 HydrophobicContact CB-CG 4.34Å; L107-P133 WeakPolarHBondContact O-CD 3.47Å; P133-S135 PolarHBondContact O-N 2.94Å
134	E	54.2	Low	57.6	Low	149 Å²	149	84.6 Å²	84.6	70%	0.696	48%	0.48	S	S	*	.	P	Polyproline II helix	trans	-61	135.6	-177.3	-63.2	-164.3	136.4	0	0	111	I132 V136	I132-E134 PolarHBondContact O-N 3.33Å; E134-V136 PolarHBondContact O-N 2.88Å
135	S	48.9	Very low	55.3	Low	67 Å²	67	90.4 Å²	90.4	47%	0.469	51%	0.511	S	S	.	.			trans	-68.3	115.5	170.6	49.9	0	0	0	0	109.5	P133 D137	P133-S135 PolarHBondContact O-N 2.94Å; S135-D137 PolarHBondContact O-N 2.88Å; S135-D137 PolarHBondContact OG-OD2 3.34Å; S135-D137 VanDerWaalsContact OG-OD2 3.05Å
136	V	43.7	Very low	52.5	Low	116 Å²	116	96.1 Å²	96.1	70%	0.703	55%	0.548	S	S	*	.			trans	-79.1	74.2	173.4	-169.9	0	0	0	0	108.6	E134 H138	E134-V136 PolarHBondContact O-N 2.88Å; V136-H138 PolarHBondContact O-N 2.79Å; V136-H138 PolarHBondContact O-ND1 3.09Å
137	D	36	Very low	50.1	Low	116 Å²	116	102 Å²	102	62%	0.62	58%	0.584	S	S	*	*			trans	-63.6	104	177.1	-64.6	-52.4	0	0	0	109.5	S135 H139	S135-D137 PolarHBondContact O-N 2.88Å; S135-D137 PolarHBondContact OG-OD2 3.34Å; S135-D137 VanDerWaalsContact OG-OD2 3.05Å; D137-H139 PolarHBondContact O-N 3.22Å
138	H	33.2	Very low	47.3	Very low	171 Å²	171	111.1 Å²	111.1	79%	0.792	63%	0.627	S	S	*	*			trans	-73.5	83.8	-175	-82.5	51.8	0	0	0	111.4	V136	V136-H138 PolarHBondContact O-N 2.79Å; V136-H138 PolarHBondContact O-ND1 3.09Å
139	H	38.5	Very low	44.8	Very low	181 Å²	181	119.9 Å²	119.9	84%	0.838	66%	0.663	S	S	*	*			trans	-99	106.8	171.1	-79.5	-45.7	0	0	0	112.6	D137	D137-H139 PolarHBondContact O-N 3.22Å
140	G	29.6	Very low	42.5	Very low	72 Å²	72	122.5 Å²	122.5	74%	0.742	69%	0.685	S	S	*	*			trans	58.7	93.2	143.8	0	0	0	0	0	117	N142	G140-N142 PolarHBondContact O-N 3.3Å
141	S	29.2	Very low	40.1	Very low	119 Å²	119	128.5 Å²	128.5	83%	0.832	71%	0.709	S	S	*	*			trans	-54.2	122.3	159.5	52	0	0	0	0	111.3
142	N	31.7	Very low	37.9	Very low	171 Å²	171	135 Å²	135	91%	0.914	73%	0.73	S	S	*	*			trans	-141.8	109.2	154.6	-108.2	-27.1	0	0	0	108.6	G140	G140-N142 PolarHBondContact O-N 3.3Å
143	S	28.7	Very low	35.9	Very low	111 Å²	111	135.5 Å²	135.5	78%	0.776	74%	0.742	S	S	*	*			trans	-85.4	136.1	-173.8	53.9	0	0	0	0	112.4
144	T	31.6	Very low	34.4	Very low	140 Å²	140	137.7 Å²	137.7	86%	0.859	77%	0.768	S	S	*	*			trans	-144.3	121.6	147.8	-63.1	0	0	0	0	108.8
145	M	31.4	Very low	33.2	Very low	157 Å²	157	139 Å²	139	77%	0.773	78%	0.778	S	S	*	*			trans	-80.1	142.1	179.3	-72.3	-78.9	-78.8	0	0	111.7	T147	M145-T147 PolarHBondContact O-N 2.98Å
146	P	30.1	Very low	32.5	Very low	123 Å²	123	140.6 Å²	140.6	80%	0.799	80%	0.796	S	S	*	*			trans	-84.1	97.3	168.5	32.8	-30.8	0	0	0	110.5
147	T	35.7	Very low	32	Very low	126 Å²	126	145.3 Å²	145.3	77%	0.773	81%	0.807	S	S	*	*			trans	-82.9	117	172.3	52.8	0	0	0	0	111.4	M145 K149	M145-T147 PolarHBondContact O-N 2.98Å; T147-K149 PolarHBondContact O-N 3.08Å
148	E	28.7	Very low	31.7	Very low	192 Å²	192	143.2 Å²	143.2	90%	0.897	81%	0.812	S	S	*	*			trans	-64.6	130.5	167.5	-65.3	-168.2	117.5	0	0	111.5
149	K	35.6	Very low	32	Very low	213 Å²	213	141.5 Å²	141.5	93%	0.926	82%	0.817	S	S	*	*			trans	-139.4	151.5	150.2	-77.5	-160.5	175.6	177.6	0	111.1	T147	T147-K149 PolarHBondContact O-N 3.08Å
150	S	33.7	Very low	31.6	Very low	103 Å²	103	136.2 Å²	136.2	72%	0.72	81%	0.811	S	S	*	*			trans	-95.7	154.2	-159	-152.8	0	0	0	0	114.3
151	K	32.9	Very low	31.8	Very low	165 Å²	165	141.2 Å²	141.2	72%	0.717	82%	0.816	S	S	*	*			trans	56.4	114.9	141.4	-96.6	173.6	179.5	170.2	0	119.8
152	R	29.4	Very low	31.9	Very low	224 Å²	224	142.3 Å²	142.3	85%	0.845	81%	0.807	S	S	*	*				127.8	109.9	99.1	-164.2	-169.2	-174.8	-174	1.2	117.2
153	S	28.9	Very low	31.9	Very low	109 Å²	109	141 Å²	141	76%	0.762	80%	0.799	S	S	*	*			trans	61.9	151.2	147.9	70.4	0	0	0	0	121.8
154	G	31	Very low	32.3	Very low	66 Å²	66	140.4 Å²	140.4	68%	0.68	80%	0.795	S	S	*	*			trans	97.1	113.9	-177.4	0	0	0	0	0	110
155	I	29.8	Very low	32.3	Very low	176 Å²	176	138.5 Å²	138.5	90%	0.903	79%	0.787	S	S	*	*			cis	58.1	76.4	27	-41.9	179.7	0	0	0	113
156	A	32.8	Very low	32.6	Very low	101 Å²	101	136.6 Å²	136.6	84%	0.835	78%	0.784	S	S	*	*			trans	-158.9	149.2	137.4	0	0	0	0	0	110.8
157	K	33.2	Very low	32.8	Very low	215 Å²	215	137.6 Å²	137.6	94%	0.935	78%	0.783	S	S	*	*			trans	-84.6	163.4	172.8	-50.9	163.9	-178.1	174.1	0	109.5
158	G	30.4	Very low	32.7	Very low	72 Å²	72	136.9 Å²	136.9	74%	0.742	78%	0.783	S	S	*	*			trans	140	136.9	149.6	0	0	0	0	0	115.1
159	P	39.2	Very low	33	Very low	135 Å²	135	132.2 Å²	132.2	88%	0.877	78%	0.777	S	S	*	*			trans	-122.7	155.4	-171.5	40.6	-28.7	0	0	0	116.2
160	G	30.6	Very low	32.9	Very low	71 Å²	71	129 Å²	129	73%	0.732	76%	0.763	S	S	*	*			trans	103.5	162.8	133.2	0	0	0	0	0	118.6
161	Q	33.6	Very low	33.1	Very low	177 Å²	177	130 Å²	130	83%	0.827	76%	0.76	S	S	*	*			trans	71.3	142.8	168.8	-59.1	-169.2	-5.7	0	0	115.5
162	Q	31.6	Very low	33	Very low	142 Å²	142	129 Å²	129	66%	0.664	76%	0.759	S	S	*	*			cis	-163.4	159.4	-0.9	-124	176.9	2.8	0	0	110.6
163	I	31.1	Very low	33.2	Very low	142 Å²	142	126.4 Å²	126.4	73%	0.728	76%	0.756	S	S	*	*			trans	66.7	139.9	146.5	-70	165.6	0	0	0	116.9
164	S	36.8	Very low	33.6	Very low	100 Å²	100	126 Å²	126	70%	0.699	75%	0.753	S	S	*	*			cis	-151.7	162.5	-3.8	41.2	0	0	0	0	113.6
165	S	32	Very low	33.6	Very low	99 Å²	99	133.8 Å²	133.8	69%	0.692	76%	0.762	S	S	*	*			trans	-41.4	167.3	157.7	42.1	0	0	0	0	116.3
166	V	37.1	Very low	34	Very low	118 Å²	118	132.9 Å²	132.9	72%	0.715	76%	0.759	S	S	*	*				-168.7	125.9	86.1	149.7	0	0	0	0	113.5
167	N	35.4	Very low	34	Very low	143 Å²	143	135.1 Å²	135.1	77%	0.765	76%	0.757	S	S	*	*			trans	55	168.5	142.2	-59.3	4.6	0	0	0	122
168	S	32.6	Very low	34.1	Very low	111 Å²	111	130.5 Å²	130.5	78%	0.776	75%	0.751	S	S	*	*			cis	175.2	159.5	-29.6	-79.5	0	0	0	0	107.2
169	A	34.7	Very low	34.3	Very low	94 Å²	94	131 Å²	131	78%	0.777	75%	0.749	S	S	*	*			cis	-153.9	-141.7	-13.6	0	0	0	0	0	105.7
170	K	34.7	Very low	34.1	Very low	147 Å²	147	132.6 Å²	132.6	64%	0.639	75%	0.749	S	S	*	*			cis	-165.1	-174.2	-1.2	-154.7	-147.5	141.9	-133.3	0	108.7	E172	K170-E172 WeakPolarHBondContact CE-OE2 3.36Å; K170-E172 IonicContact NZ-OE2 2.61Å; K170-E172 PolarHBondContact NZ-OE2 2.91Å
171	N	36.9	Very low	34.1	Very low	123 Å²	123	134.3 Å²	134.3	66%	0.658	75%	0.75	S	S	*	*			trans	73.1	129.8	175.6	-59.3	-1.6	0	0	0	114.9
172	E	32.4	Very low	34.1	Very low	145 Å²	145	131.2 Å²	131.2	68%	0.678	75%	0.748	S	S	*	*			cis	81	140	29.4	-54.4	172.4	160.2	0	0	113.4	K170	K170-E172 WeakPolarHBondContact CE-OE2 3.36Å; K170-E172 IonicContact NZ-OE2 2.61Å; K170-E172 PolarHBondContact NZ-OE2 2.91Å
173	E	33.3	Very low	34.1	Very low	168 Å²	168	129.5 Å²	129.5	79%	0.785	75%	0.751	S	S	*	*			cis	-155.9	170.1	19.3	-156.5	172.5	115.6	0	0	114.5
174	S	36.2	Very low	34	Very low	101 Å²	101	130.3 Å²	130.3	71%	0.706	76%	0.757	S	S	*	*			trans	65.2	127.1	163.1	65.4	0	0	0	0	118.6
175	R	31.6	Very low	33.6	Very low	229 Å²	229	136.3 Å²	136.3	86%	0.864	77%	0.765	S	S	*	*			cis	79.9	107.7	49.4	-79.1	-172.7	169.5	156.6	-2.7	115.6
176	N	37.8	Very low	33.5	Very low	158 Å²	158	137.6 Å²	137.6	85%	0.845	77%	0.771	S	S	*	*				-172.7	157.6	115	-89.4	-16.8	0	0	0	111.5
177	D	32.9	Very low	33.4	Very low	147 Å²	147	138.2 Å²	138.2	79%	0.786	78%	0.775	S	S	*	*			trans	-89.9	153.3	-166.4	-56.6	-93.8	0	0	0	115.4
178	S	35.6	Very low	33.2	Very low	118 Å²	118	136.5 Å²	136.5	83%	0.825	77%	0.774	S	S	*	*				156.5	165.1	102.9	59.2	0	0	0	0	115.7
179	A	34.5	Very low	33.5	Very low	84 Å²	84	136.6 Å²	136.6	69%	0.694	77%	0.772	S	S	*	*			trans	73.6	92.6	156.4	0	0	0	0	0	122.2
180	L	35.1	Very low	33.6	Very low	167 Å²	167	140.7 Å²	140.7	87%	0.874	77%	0.773	S	S	*	*				68.2	97.9	122	-66.5	161.3	0	0	0	122.3
181	S	31	Very low	34.4	Very low	107 Å²	107	136.9 Å²	136.9	75%	0.748	76%	0.763	S	S	*	*				43.9	118.7	117.9	-167.4	0	0	0	0	121.2
182	S	31.9	Very low	35.6	Very low	112 Å²	112	138 Å²	138	78%	0.783	76%	0.764	S	S	*	*				172.2	147.9	95.7	52.5	0	0	0	0	117
183	S	32.3	Very low	37.2	Very low	106 Å²	106	133.1 Å²	133.1	74%	0.741	75%	0.745	S	S	*	*			trans	49.4	96.3	147.5	-165.7	0	0	0	0	123
184	N	29.2	Very low	39.3	Very low	159 Å²	159	126.3 Å²	126.3	85%	0.85	71%	0.714	S	S	*	*				23.1	110.8	126.2	-67.3	-27	0	0	0	120
185	R	28.3	Very low	41.3	Very low	226 Å²	226	124.3 Å²	124.3	85%	0.853	70%	0.7	S	S	*	*			trans	-159.6	127.9	137	-147.8	177.8	-164.6	-148	2.2	112.5
186	P	30.2	Very low	43.5	Very low	126 Å²	126	116.7 Å²	116.7	82%	0.818	68%	0.68	S	S	*	*	P	Polyproline II helix	trans	-72.2	126.6	163.4	30.1	-31.7	0	0	0	109.3
187	T	34.9	Very low	45.5	Very low	131 Å²	131	115.9 Å²	115.9	80%	0.804	68%	0.675	S	S	*	*	P	Polyproline II helix	trans	-84.6	146.5	174.5	39.1	0	0	0	0	111
188	S	31.7	Very low	48	Very low	107 Å²	107	111 Å²	111	75%	0.748	65%	0.651	S	S	*	*	P	Polyproline II helix	trans	-64.1	141.4	175	-176	0	0	0	0	110.5
189	P	39.3	Very low	50.2	Low	114 Å²	114	105.7 Å²	105.7	74%	0.74	61%	0.613	S	S	*	*	P	Polyproline II helix	trans	-59.1	140.7	169.8	25.7	-33.9	0	0	0	110.6
190	K	36.3	Very low	52.5	Low	180 Å²	180	103.2 Å²	103.2	78%	0.783	59%	0.593	S	S	*	*	P	Polyproline II helix	trans	-73.2	143.7	166.5	-94.5	178.8	174	175.5	0	108.7
191	P	51.6	Low	54.8	Low	66 Å²	66	97.3 Å²	97.3	43%	0.429	57%	0.568	S	S	.	*	P	Polyproline II helix	trans	-64.6	139.9	170.9	27.9	-34	0	0	0	110.5	C193 Y365	P191-C193 PolarHBondContact O-N 2.8Å; P191-C193 PolarHBondContact O-SG 3.3Å; P191-Y365 HydrophobicContact CG-CE2 4.3Å
192	E	61.6	Low	57.4	Low	148 Å²	148	92.2 Å²	92.2	69%	0.692	53%	0.533	S	S	*	.	P	Polyproline II helix	trans	-57.3	130.5	167.7	-63.8	178.5	142.8	0	0	109.2	P275	E192-P275 WeakPolarHBondContact O-CD 3.44Å
193	C	67	Low	59.9	Low	41 Å²	41	89.4 Å²	89.4	28%	0.277	51%	0.51	S	S	.	.			trans	-122.8	144.1	-178.1	-63.3	0	0	0	0	109.2	P191 R272	P191-C193 PolarHBondContact O-N 2.8Å; P191-C193 PolarHBondContact O-SG 3.3Å; C193-R272 PolarHBondContact SG-NH1 3.34Å
194	I	76.6	Confident	62.3	Low	25 Å²	25	86.8 Å²	86.8	13%	0.128	50%	0.495	C	S	.	.			trans	-65.4	146.3	177	-49.9	175.8	0	0	0	108.4	T198 V199 W273 L354 C362	I194-T198 HydrophobicContact CG2-CG2 4.18Å; I194-V199 HydrophobicContact CB-CG2 3.93Å; I194-V199 HydrophobicContact CG2-CG2 3.98Å; I194-W273 HydrophobicContact CD1-CB 3.73Å; I194-W273 HydrophobicContact CG1-CB 4.36Å; I194-W273 PolarHBondContact N-O 3.19Å; I194-L354 HydrophobicContact CD1-CD1 4.03Å; I194-L354 HydrophobicContact CD1-CD2 4.01Å; I194-L354 HydrophobicContact CD1-CG 4.5Å; I194-L354 HydrophobicContact CG2-CD2 4.25Å; I194-C362 HydrophobicContact CD1-CB 3.76Å; I194-C362 WeakPolarHBondContact CD1-SG 3.4Å
195	S	78.7	Confident	64.9	Low	60 Å²	60	80.1 Å²	80.1	42%	0.42	46%	0.462	S	S	.	.			trans	-57.9	134.9	176.8	57.3	0	0	0	0	110.4	L197 T198 V199	S195-L197 PolarHBondContact O-N 3.48Å; S195-L197 VanDerWaalsContact O-N 3.12Å; S195-T198 PolarHBondContact O-N 2.65Å; S195-T198 VanDerWaalsContact O-N 3.1Å; S195-T198 VanDerWaalsContact OG-CB 3.31Å; S195-T198 WeakPolarHBondContact OG-CB 3.35Å; S195-T198 PolarHBondContact OG-OG1 3.05Å; S195-V199 PolarHBondContact O-N 3.27Å; S195-V199 VanDerWaalsContact O-N 3.1Å
196	P	76.3	Confident	67.6	Low	68 Å²	68	69.3 Å²	69.3	44%	0.442	42%	0.421	S	S	.	.	H	α-helix	trans	-56.4	-31.1	-179.8	-28.5	35.9	0	0	0	113.5	V199 A200 L267	P196-V199 PolarHBondContact O-N 3.3Å; P196-A200 WeakPolarHBondContact O-CB 3.27Å; P196-A200 PolarHBondContact O-N 2.69Å; P196-L267 HydrophobicContact CB-CD2 4.06Å; P196-L267 HydrophobicContact CB-CG 4.21Å
197	L	80.2	Confident	70	Confident	142 Å²	142	65.5 Å²	65.5	74%	0.743	40%	0.4	S	S	*	.	H	α-helix	trans	-66.1	-44.3	176.7	-173	64.7	0	0	0	112.7	S195 V199 A200 A201	S195-L197 PolarHBondContact O-N 3.48Å; S195-L197 VanDerWaalsContact O-N 3.12Å; L197-V199 VanDerWaalsContact C-N 3.33Å; L197-A200 PolarHBondContact O-N 2.95Å; L197-A201 WeakPolarHBondContact O-CB 3.18Å; L197-A201 PolarHBondContact O-N 3.19Å
198	T	84.9	Confident	72.1	Confident	44 Å²	44	63.8 Å²	63.8	27%	0.27	39%	0.386	S	S	.	.	H	α-helix	trans	-68.9	-34.6	176.7	-60.3	0	0	0	0	111.3	I194 S195 A202 L354	I194-T198 HydrophobicContact CG2-CG2 4.18Å; S195-T198 PolarHBondContact O-N 2.65Å; S195-T198 VanDerWaalsContact O-N 3.1Å; S195-T198 VanDerWaalsContact OG-CB 3.31Å; S195-T198 WeakPolarHBondContact OG-CB 3.35Å; S195-T198 PolarHBondContact OG-OG1 3.05Å; T198-A202 WeakPolarHBondContact O-CB 3.44Å; T198-A202 PolarHBondContact O-N 3.14Å; T198-L354 HydrophobicContact CG2-CD2 4.22Å
199	V	83.3	Confident	74.4	Confident	6 Å²	6	60 Å²	60	4%	0.036	36%	0.357	C	S	.	.	H	α-helix	trans	-62.7	-51	170.2	171.2	0	0	0	0	111.2	I194 S195 P196 L197 A201 A202 V203 W273	I194-V199 HydrophobicContact CB-CG2 3.93Å; I194-V199 HydrophobicContact CG2-CG2 3.98Å; S195-V199 PolarHBondContact O-N 3.27Å; S195-V199 VanDerWaalsContact O-N 3.1Å; P196-V199 PolarHBondContact O-N 3.3Å; L197-V199 VanDerWaalsContact C-N 3.33Å; V199-A201 VanDerWaalsContact C-N 3.33Å; V199-A201 PolarHBondContact O-N 3.23Å; V199-A202 PolarHBondContact O-N 3.02Å; V199-V203 HydrophobicContact CG1-CG2 4.27Å; V199-V203 WeakPolarHBondContact O-CG2 3.34Å; V199-V203 PolarHBondContact O-N 3.14Å; V199-W273 VanDerWaalsContact CG1-CD1 3.47Å; V199-W273 HydrophobicContact CG1-CG 4.46Å; V199-W273 HydrophobicContact CG2-CB 3.94Å; V199-W273 HydrophobicContact CG2-CG 4.22Å
200	A	81.8	Confident	76.1	Confident	32 Å²	32	56.7 Å²	56.7	26%	0.264	34%	0.34	S	S	.	.	H	α-helix	trans	-58.8	-44.1	179.7	0	0	0	0	0	111.8	P196 L197 A202 V203 A204 L270	P196-A200 WeakPolarHBondContact O-CB 3.27Å; P196-A200 PolarHBondContact O-N 2.69Å; L197-A200 PolarHBondContact O-N 2.95Å; A200-A202 VanDerWaalsContact C-N 3.3Å; A200-A202 PolarHBondContact O-N 2.91Å; A200-V203 PolarHBondContact O-N 3.42Å; A200-A204 PolarHBondContact O-N 3.03Å; A200-L270 HydrophobicContact CB-CD1 3.97Å
201	A	84.1	Confident	77.8	Confident	44 Å²	44	52.4 Å²	52.4	36%	0.364	33%	0.333	S	S	.	.	H	α-helix	trans	-64.7	-32.4	175.7	0	0	0	0	0	112.8	L197 V199 A205 R357	L197-A201 WeakPolarHBondContact O-CB 3.18Å; L197-A201 PolarHBondContact O-N 3.19Å; V199-A201 VanDerWaalsContact C-N 3.33Å; V199-A201 PolarHBondContact O-N 3.23Å; A201-A205 PolarHBondContact O-N 3.4Å; A201-R357 VanDerWaalsContact CB-NH1 3.31Å; A201-R357 PolarHBondContact O-NH1 3.42Å
202	A	85.1	Confident	78.2	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-74.8	-36.2	175	0	0	0	0	0	111.7	T198 V199 A200 A206 E353 L354	T198-A202 WeakPolarHBondContact O-CB 3.44Å; T198-A202 PolarHBondContact O-N 3.14Å; V199-A202 PolarHBondContact O-N 3.02Å; A200-A202 VanDerWaalsContact C-N 3.3Å; A200-A202 PolarHBondContact O-N 2.91Å; A202-A206 WeakPolarHBondContact O-CB 3.43Å; A202-A206 PolarHBondContact O-N 2.59Å; A202-E353 HydrophobicContact CB-CB 4.23Å; A202-E353 HydrophobicContact CB-CG 4.26Å; A202-L354 HydrophobicContact CB-CD2 3.85Å; A202-L354 HydrophobicContact CB-CG 3.84Å
203	V	83.6	Confident	77.4	Confident	52 Å²	52	46.7 Å²	46.7	32%	0.315	33%	0.325	S	S	.	.	H	α-helix	trans	-63	-44.7	172.2	172.4	0	0	0	0	111.3	V199 A200 A206 A207 L270 T350	V199-V203 HydrophobicContact CG1-CG2 4.27Å; V199-V203 WeakPolarHBondContact O-CG2 3.34Å; V199-V203 PolarHBondContact O-N 3.14Å; A200-V203 PolarHBondContact O-N 3.42Å; V203-A206 PolarHBondContact O-N 3.36Å; V203-A207 WeakPolarHBondContact O-CB 3.39Å; V203-A207 PolarHBondContact O-N 2.88Å; V203-L270 HydrophobicContact CG2-CD2 4.49Å; V203-T350 HydrophobicContact CB-CG2 4.38Å; V203-T350 HydrophobicContact CG2-CG2 3.94Å
204	A	83.4	Confident	76	Confident	51 Å²	51	49.7 Å²	49.7	42%	0.421	35%	0.347	S	S	.	.	H	α-helix	trans	-59.9	-57.1	175.7	0	0	0	0	0	111.6	A200 A206 A207 D208	A200-A204 PolarHBondContact O-N 3.03Å; A204-A206 VanDerWaalsContact C-N 3.28Å; A204-A206 PolarHBondContact O-N 3.46Å; A204-A207 WeakPolarHBondContact O-CA 3.41Å; A204-A207 WeakPolarHBondContact O-CB 3.48Å; A204-A207 PolarHBondContact O-N 2.81Å; A204-D208 PolarHBondContact O-N 3.09Å
205	A	84.2	Confident	73.8	Confident	19 Å²	19	52 Å²	52	16%	0.157	38%	0.377	C	S	.	.	H	α-helix	trans	-59.7	-36.9	179.6	0	0	0	0	0	112.9	A201 D208 I209 E353	A201-A205 PolarHBondContact O-N 3.4Å; A205-D208 PolarHBondContact O-N 3.14Å; A205-I209 WeakPolarHBondContact O-CB 3.44Å; A205-I209 WeakPolarHBondContact O-CD1 3.39Å; A205-I209 WeakPolarHBondContact O-CG1 3.32Å; A205-I209 PolarHBondContact O-N 3.35Å; A205-E353 HydrophobicContact CB-CG 4.16Å
206	A	83.9	Confident	71.6	Confident	0 Å²	0	57.4 Å²	57.4	0%	0	40%	0.4	C	S	.	.	H	α-helix	trans	-66.2	-35.2	173.3	0	0	0	0	0	113.1	A202 V203 A204 A210 V346 L349 T350	A202-A206 WeakPolarHBondContact O-CB 3.43Å; A202-A206 PolarHBondContact O-N 2.59Å; V203-A206 PolarHBondContact O-N 3.36Å; A204-A206 VanDerWaalsContact C-N 3.28Å; A204-A206 PolarHBondContact O-N 3.46Å; A206-A210 VanDerWaalsContact O-CB 3.26Å; A206-A210 WeakPolarHBondContact O-CB 3.38Å; A206-A210 PolarHBondContact O-N 3.18Å; A206-V346 HydrophobicContact CB-CG1 4.3Å; A206-L349 HydrophobicContact CB-CB 3.68Å; A206-T350 HydrophobicContact CB-CG2 3.36Å
207	A	81.4	Confident	69.4	Low	45 Å²	45	61.8 Å²	61.8	37%	0.372	42%	0.419	S	S	.	.	H	α-helix	trans	-69.1	-37.3	174.3	0	0	0	0	0	111.8	V203 A204 A210 S211	V203-A207 WeakPolarHBondContact O-CB 3.39Å; V203-A207 PolarHBondContact O-N 2.88Å; A204-A207 WeakPolarHBondContact O-CA 3.41Å; A204-A207 WeakPolarHBondContact O-CB 3.48Å; A204-A207 PolarHBondContact O-N 2.81Å; A207-A210 CarbonylContact O-C 3.58Å; A207-A210 PolarHBondContact O-N 2.93Å; A207-S211 WeakPolarHBondContact O-CB 3.42Å; A207-S211 PolarHBondContact O-N 3.02Å; A207-S211 PolarHBondContact O-OG 2.94Å
208	D	79.6	Confident	67.2	Low	96 Å²	96	63.7 Å²	63.7	51%	0.513	42%	0.424	S	S	.	.	H	α-helix	trans	-66.6	-43.3	174.3	-60.6	-37.9	0	0	0	111.7	A204 A205 A210 S211 G212 G213	A204-D208 PolarHBondContact O-N 3.09Å; A205-D208 PolarHBondContact O-N 3.14Å; D208-A210 PolarHBondContact O-N 2.86Å; D208-S211 WeakPolarHBondContact CA-OG 3.38Å; D208-S211 PolarHBondContact O-N 3.39Å; D208-S211 PolarHBondContact O-OG 2.69Å; D208-S211 VanDerWaalsContact O-OG 3.1Å; D208-G212 PolarHBondContact O-N 3.27Å; D208-G213 PolarHBondContact O-N 3.27Å
209	I	79.4	Confident	64.8	Low	27 Å²	27	66.1 Å²	66.1	14%	0.138	44%	0.443	C	S	.	.	H	α-helix	trans	-64.5	-28.8	173.4	-63.5	164.5	0	0	0	111.1	A205 P334 R338 L349	A205-I209 WeakPolarHBondContact O-CB 3.44Å; A205-I209 WeakPolarHBondContact O-CD1 3.39Å; A205-I209 WeakPolarHBondContact O-CG1 3.32Å; A205-I209 PolarHBondContact O-N 3.35Å; I209-P334 HydrophobicContact CD1-CG 4.44Å; I209-P334 HydrophobicContact CG1-CB 4.01Å; I209-P334 HydrophobicContact CG1-CG 4.01Å; I209-P334 HydrophobicContact CG2-CB 4.12Å; I209-R338 VanDerWaalsContact O-CZ 3.26Å; I209-R338 PolarHBondContact O-NE 3.31Å; I209-R338 PolarHBondContact O-NH2 3.27Å; I209-L349 HydrophobicContact CB-CD1 4.3Å; I209-L349 HydrophobicContact CG2-CD1 3.91Å; I209-L349 HydrophobicContact CG2-CD2 3.84Å; I209-L349 HydrophobicContact CG2-CG 4.43Å
210	A	74.4	Confident	62	Low	45 Å²	45	74.5 Å²	74.5	37%	0.372	48%	0.482	S	S	.	.	H	α-helix	trans	-82.4	-34.9	175.1	0	0	0	0	0	113.7	A206 A207 D208 R338 V346 L349	A206-A210 VanDerWaalsContact O-CB 3.26Å; A206-A210 WeakPolarHBondContact O-CB 3.38Å; A206-A210 PolarHBondContact O-N 3.18Å; A207-A210 CarbonylContact O-C 3.58Å; A207-A210 PolarHBondContact O-N 2.93Å; D208-A210 PolarHBondContact O-N 2.86Å; A210-R338 PolarHBondContact O-NH2 3.48Å; A210-V346 HydrophobicContact CB-CG2 4.16Å; A210-L349 HydrophobicContact CB-CD1 4.04Å
211	S	72	Confident	59.7	Low	90 Å²	90	78.7 Å²	78.7	63%	0.629	51%	0.506	S	S	*	.	H	α-helix	trans	-76.1	-30.4	-179.7	68.6	0	0	0	0	112.8	A207 D208	A207-S211 WeakPolarHBondContact O-CB 3.42Å; A207-S211 PolarHBondContact O-N 3.02Å; A207-S211 PolarHBondContact O-OG 2.94Å; D208-S211 WeakPolarHBondContact CA-OG 3.38Å; D208-S211 PolarHBondContact O-N 3.39Å; D208-S211 PolarHBondContact O-OG 2.69Å; D208-S211 VanDerWaalsContact O-OG 3.1Å
212	G	60.2	Low	57	Low	33 Å²	33	81.2 Å²	81.2	34%	0.34	52%	0.521	S	S	.	.	T	Hydrogen-bonded Turn	trans	96.9	29.3	176.9	0	0	0	0	0	114	D208 S214 R338	D208-G212 PolarHBondContact O-N 3.27Å; G212-S214 PolarHBondContact O-N 2.82Å; G212-R338 VanDerWaalsContact CA-NH2 3.28Å; G212-R338 VanDerWaalsContact N-NH2 3.13Å
213	G	46	Very low	54.3	Low	61 Å²	61	88.9 Å²	88.9	63%	0.629	56%	0.561	S	S	*	*			trans	-71.7	89	179.4	0	0	0	0	0	113.7	D208 G215	D208-G213 PolarHBondContact O-N 3.27Å; G213-G215 PolarHBondContact O-N 3.02Å; G213-G215 VanDerWaalsContact O-N 3.09Å
214	S	36.1	Very low	52	Low	104 Å²	104	93.5 Å²	93.5	73%	0.727	58%	0.584	S	S	*	*			trans	-78.6	81.1	165.8	-58.6	0	0	0	0	111.6	G212	G212-S214 PolarHBondContact O-N 2.82Å
215	G	31.6	Very low	49.4	Very low	74 Å²	74	99.1 Å²	99.1	76%	0.763	60%	0.602	S	S	*	*			trans	91.2	140.1	155.2	0	0	0	0	0	118.4	G213	G213-G215 PolarHBondContact O-N 3.02Å; G213-G215 VanDerWaalsContact O-N 3.09Å
216	L	31.3	Very low	46.9	Very low	172 Å²	172	105.8 Å²	105.8	90%	0.901	64%	0.635	S	S	*	*			trans	-139.8	136.4	151.2	-136.3	170.1	0	0	0	106.5
217	L	31.8	Very low	44.4	Very low	161 Å²	161	109.7 Å²	109.7	84%	0.843	68%	0.675	S	S	*	*			trans	-97.4	131	-168.5	-73.4	162.1	0	0	0	111.9
218	E	33.2	Very low	42	Very low	181 Å²	181	116.2 Å²	116.2	85%	0.846	70%	0.7	S	S	*	*			trans	-165.6	129	166.1	-152.3	74.7	-102.6	0	0	108.1
219	S	33.9	Very low	39.6	Very low	96 Å²	96	117.8 Å²	117.8	67%	0.671	71%	0.713	S	S	*	*			cis	-153.8	160.4	-22.6	49.4	0	0	0	0	109
220	Q	25.1	Very low	37.3	Very low	181 Å²	181	121.4 Å²	121.4	85%	0.846	74%	0.741	S	S	*	*			trans	-92.4	134.6	-178	-81	-103.2	-61.5	0	0	112.6
221	P	32.6	Very low	35.2	Very low	120 Å²	120	126.5 Å²	126.5	78%	0.779	76%	0.761	S	S	*	*			trans	-87.7	134	151.6	33.8	-28.1	0	0	0	110.1
222	S	27.6	Very low	33.2	Very low	98 Å²	98	130.8 Å²	130.8	69%	0.685	77%	0.772	S	S	*	*			trans	-105.2	175.6	-179.8	59.1	0	0	0	0	112.5
223	L	29.2	Very low	31.7	Very low	160 Å²	160	134.1 Å²	134.1	84%	0.838	79%	0.79	S	S	*	*			trans	77.9	141.5	178.4	-51.8	175.3	0	0	0	114.3
224	N	34.3	Very low	31.1	Very low	149 Å²	149	137 Å²	137	80%	0.797	80%	0.795	S	S	*	*			cis	-151.1	175.3	-6.6	45.3	11.3	0	0	0	112
225	E	29	Very low	30.6	Very low	169 Å²	169	139.2 Å²	139.2	79%	0.79	80%	0.797	S	S	*	*			trans	-82.4	163.8	-172.4	-59.3	175.1	116.8	0	0	114.6
226	N	32.3	Very low	30.5	Very low	160 Å²	160	140.9 Å²	140.9	86%	0.856	80%	0.797	S	S	*	*			trans	83.8	108.5	164.5	-47.2	-70.8	0	0	0	117.3
227	G	31.3	Very low	30.3	Very low	82 Å²	82	142.1 Å²	142.1	85%	0.845	80%	0.798	S	S	*	*			trans	173.5	106.7	168.8	0	0	0	0	0	111.6
228	M	30.7	Very low	30.1	Very low	182 Å²	182	137.9 Å²	137.9	90%	0.897	79%	0.786	S	S	*	*			trans	-91.3	135.4	-178.2	-74	171.1	56.6	0	0	112.5
229	V	29.3	Very low	29.8	Very low	129 Å²	129	135.9 Å²	135.9	78%	0.782	79%	0.791	S	S	*	*			trans	28.4	113.9	140.5	-172.6	0	0	0	0	118.6
230	S	31.9	Very low	29.6	Very low	103 Å²	103	136.9 Å²	136.9	72%	0.72	79%	0.793	S	S	*	*				-170.2	115.8	127	58.8	0	0	0	0	113.1
231	D	29.7	Very low	29.7	Very low	151 Å²	151	134.4 Å²	134.4	81%	0.807	78%	0.784	S	S	*	*			trans	44.6	157.6	140.2	-64.8	-55.6	0	0	0	126
232	E	31.1	Very low	29.7	Very low	180 Å²	180	137.1 Å²	137.1	84%	0.841	79%	0.791	S	S	*	*			trans	69	111	158	-76.8	-160.3	101.4	0	0	123.1
233	S	28.1	Very low	29.7	Very low	103 Å²	103	138 Å²	138	72%	0.72	79%	0.789	S	S	*	*				104.6	158.1	119.2	79.5	0	0	0	0	121.5
234	V	32.4	Very low	30.1	Very low	122 Å²	122	138.1 Å²	138.1	74%	0.739	79%	0.788	S	S	*	*			trans	65.7	92.6	164.6	-166.2	0	0	0	0	119.4
235	I	27.3	Very low	29.8	Very low	150 Å²	150	139.1 Å²	139.1	77%	0.769	79%	0.788	S	S	*	*				40.2	122.8	115.6	-55.7	165.7	0	0	0	119.3
236	S	27.6	Very low	29.9	Very low	109 Å²	109	135.9 Å²	135.9	76%	0.762	78%	0.783	S	S	*	*			trans	35.6	121	147.6	-53.7	0	0	0	0	122.2
237	E	28.6	Very low	29.9	Very low	198 Å²	198	132.9 Å²	132.9	93%	0.925	78%	0.775	S	S	*	*			trans	169.3	167	136.6	-95.3	172.5	-163.5	0	0	107.2
238	A	27.8	Very low	29.8	Very low	72 Å²	72	137.5 Å²	137.5	60%	0.595	78%	0.775	S	S	*	*			cis	-161.1	159.3	-34.7	0	0	0	0	0	107.1
239	C	27	Very low	29.9	Very low	139 Å²	139	136.4 Å²	136.4	94%	0.939	77%	0.772	S	S	*	*			trans	-138.8	74.8	168.8	-97.7	0	0	0	0	110.7
240	T	27.9	Very low	30	Very low	117 Å²	117	134.8 Å²	134.8	72%	0.718	77%	0.765	S	S	*	*			trans	-143.9	157.3	173.5	39.1	0	0	0	0	109.3
241	I	27.7	Very low	29.9	Very low	129 Å²	129	140.3 Å²	140.3	66%	0.662	77%	0.771	S	S	*	*			trans	74.3	100.1	172.9	-47.6	-177.1	0	0	0	115.4	D243	I241-D243 HydrophobicContact CG2-CB 4Å
242	L	33.1	Very low	30.1	Very low	177 Å²	177	141.7 Å²	141.7	93%	0.927	78%	0.778	S	S	*	*				-119.4	79.9	126.7	-78.8	-179	0	0	0	107.8
243	D	27.3	Very low	30	Very low	118 Å²	118	136.2 Å²	136.2	63%	0.631	77%	0.77	S	S	*	*			trans	-80.4	129.3	166.7	-82.2	-61.3	0	0	0	109.7	I241	I241-D243 HydrophobicContact CG2-CB 4Å
244	I	37.6	Very low	30.1	Very low	162 Å²	162	136.8 Å²	136.8	83%	0.831	77%	0.774	S	S	*	*			trans	-125.2	84.4	164.9	-56.4	-177.2	0	0	0	108.3
245	H	28.7	Very low	29.9	Very low	170 Å²	170	139.6 Å²	139.6	79%	0.787	78%	0.779	S	S	*	*			trans	-77.1	118.7	166.2	-112.2	-103.9	0	0	0	109.4
246	S	29.9	Very low	30.2	Very low	100 Å²	100	140.6 Å²	140.6	70%	0.699	79%	0.785	S	S	*	*				166.8	149.1	126.2	-77.1	0	0	0	0	115.9
247	S	32.3	Very low	30.3	Very low	97 Å²	97	143.8 Å²	143.8	68%	0.678	79%	0.788	S	S	*	*			trans	52.4	108.9	147.1	60.4	0	0	0	0	121.9
248	Q	30.8	Very low	30.9	Very low	180 Å²	180	140 Å²	140	84%	0.841	78%	0.78	S	S	*	*				53.1	103.8	123.6	-60.5	173.2	-1.8	0	0	119.5
249	N	31.6	Very low	31	Very low	158 Å²	158	140.3 Å²	140.3	85%	0.845	79%	0.791	S	S	*	*				-173.4	142.2	109.7	-98.5	-42.6	0	0	0	112.8
250	P	32.2	Very low	31	Very low	96 Å²	96	137.3 Å²	137.3	62%	0.623	78%	0.784	S	S	*	*			trans	-104.2	167.5	167.5	36.2	-28.5	0	0	0	113.6
251	Y	29.8	Very low	31.2	Very low	218 Å²	218	139.4 Å²	139.4	86%	0.855	79%	0.789	S	S	*	*			trans	84.8	151	171.6	-59.7	-76.2	0	0	0	119.2
252	L	33.8	Very low	31.4	Very low	180 Å²	180	139 Å²	139	94%	0.942	80%	0.795	S	S	*	*			trans	66.7	129.9	-174.5	-62.3	165.5	0	0	0	115.5
253	G	27.7	Very low	31.2	Very low	66 Å²	66	133 Å²	133	68%	0.68	78%	0.776	S	S	*	*			cis	142.5	128.4	-14.9	0	0	0	0	0	114.8
254	S	31.4	Very low	31.3	Very low	115 Å²	115	132.3 Å²	132.3	80%	0.804	79%	0.786	S	S	*	*			trans	83.3	117.1	161.6	-54.2	0	0	0	0	120.2
255	Q	28.2	Very low	31.1	Very low	181 Å²	181	134 Å²	134	85%	0.846	78%	0.783	S	S	*	*			trans	61.2	111.1	142.1	-60.4	-178.4	-12.6	0	0	120.4
256	L	32.9	Very low	31.3	Very low	171 Å²	171	130.8 Å²	130.8	90%	0.895	77%	0.772	S	S	*	*				-171.4	145	96.4	-93.5	162.7	0	0	0	111.3
257	E	30.8	Very low	32	Very low	176 Å²	176	131 Å²	131	82%	0.822	76%	0.764	S	S	*	*			trans	-131.4	173.5	-172.7	-83.3	-82.3	120	0	0	109.1
258	P	40.2	Very low	32.1	Very low	117 Å²	117	135.2 Å²	135.2	76%	0.76	77%	0.774	S	S	*	*			cis	-127	170.8	-21.7	34.4	-18.2	0	0	0	113.1
259	G	30.7	Very low	32.6	Very low	80 Å²	80	130.9 Å²	130.9	83%	0.825	76%	0.763	S	S	*	*			trans	-147.6	19.6	-172	0	0	0	0	0	119.5
260	G	26.2	Very low	33.6	Very low	76 Å²	76	125.5 Å²	125.5	78%	0.784	73%	0.734	S	S	*	*			trans	73.5	79.9	164.7	0	0	0	0	0	117.7
261	I	32.3	Very low	34.9	Very low	161 Å²	161	124.7 Å²	124.7	83%	0.826	73%	0.731	S	S	*	*			trans	-108.5	123.1	168.9	-57	174.9	0	0	0	109.7	G263	I261-G263 PolarHBondContact O-N 3.37Å; I261-G263 VanDerWaalsContact O-N 3.13Å
262	P	31.8	Very low	36.9	Very low	121 Å²	121	120.1 Å²	120.1	79%	0.786	71%	0.712	S	S	*	*			trans	-73.9	100.5	174.1	-16.5	31.5	0	0	0	112.3
263	G	29.6	Very low	39.2	Very low	51 Å²	51	111.7 Å²	111.7	53%	0.526	67%	0.668	S	S	.	*			trans	69.4	101.8	158.7	0	0	0	0	0	116.6	I261 Y265	I261-G263 PolarHBondContact O-N 3.37Å; I261-G263 VanDerWaalsContact O-N 3.13Å; G263-Y265 PolarHBondContact O-N 3.45Å; G263-Y265 VanDerWaalsContact O-N 3.11Å
264	A	28.8	Very low	41.7	Very low	102 Å²	102	109.5 Å²	109.5	84%	0.843	64%	0.641	S	S	*	*			trans	-61.5	113.6	160.8	0	0	0	0	0	109.5	D266	A264-D266 PolarHBondContact O-N 2.83Å
265	Y	33.5	Very low	44	Very low	197 Å²	197	105.3 Å²	105.3	77%	0.773	61%	0.611	S	S	*	*			trans	-67	121.6	177.8	-22	-78.5	0	0	0	109	G263 L267	G263-Y265 PolarHBondContact O-N 3.45Å; G263-Y265 VanDerWaalsContact O-N 3.11Å; Y265-L267 PolarHBondContact O-N 3.04Å
266	D	32.1	Very low	46.5	Very low	104 Å²	104	98 Å²	98	56%	0.556	58%	0.577	S	S	*	*			trans	-64.8	109.8	177.6	-176.4	-2.8	0	0	0	109.5	A264 E268 S269	A264-D266 PolarHBondContact O-N 2.83Å; D266-E268 PolarHBondContact O-N 3.48Å; D266-E268 PolarHBondContact OD1-N 2.91Å; D266-S269 WeakPolarHBondContact O-CB 3.4Å; D266-S269 PolarHBondContact O-N 2.85Å; D266-S269 PolarHBondContact O-OG 3.45Å
267	L	44.5	Very low	48.5	Very low	104 Å²	104	91.6 Å²	91.6	55%	0.545	55%	0.553	S	S	.	*	T	Hydrogen-bonded Turn	trans	-68.9	-16.7	-170.6	-149.2	77.6	0	0	0	112.5	P196 Y265 L270	P196-L267 HydrophobicContact CB-CD2 4.06Å; P196-L267 HydrophobicContact CB-CG 4.21Å; Y265-L267 PolarHBondContact O-N 3.04Å; L267-L270 HydrophobicContact CD1-CD1 3.74Å; L267-L270 HydrophobicContact CG-CD1 4.25Å
268	E	35.9	Very low	50.5	Low	186 Å²	186	84.6 Å²	84.6	87%	0.869	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.6	-16.4	171.8	-61.2	-156.8	111.7	0	0	113	D266	D266-E268 PolarHBondContact O-N 3.48Å; D266-E268 PolarHBondContact OD1-N 2.91Å
269	S	40	Very low	52.4	Low	88 Å²	88	79 Å²	79	62%	0.615	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81	-15.2	175.4	78.3	0	0	0	0	113.9	D266 S271	D266-S269 WeakPolarHBondContact O-CB 3.4Å; D266-S269 PolarHBondContact O-N 2.85Å; D266-S269 PolarHBondContact O-OG 3.45Å; S269-S271 PolarHBondContact O-N 3.46Å
270	L	53.1	Low	54.6	Low	45 Å²	45	78.7 Å²	78.7	24%	0.236	46%	0.458	C	S	.	.	S	Bend	trans	-63	122.4	174.7	-83.1	165.7	0	0	0	110.3	A200 V203 L267 R272	A200-L270 HydrophobicContact CB-CD1 3.97Å; V203-L270 HydrophobicContact CG2-CD2 4.49Å; L267-L270 HydrophobicContact CD1-CD1 3.74Å; L267-L270 HydrophobicContact CG-CD1 4.25Å; L270-R272 PolarHBondContact O-N 3.22Å
271	S	60.7	Low	56.9	Low	80 Å²	80	80.4 Å²	80.4	56%	0.559	44%	0.441	S	S	*	.			trans	-53.1	115.4	174.8	-74.3	0	0	0	0	110	S269 W273	S269-S271 PolarHBondContact O-N 3.46Å; S271-W273 PolarHBondContact O-N 3.11Å; S271-W273 PolarHBondContact O-NE1 3.03Å
272	R	70.6	Confident	59	Low	121 Å²	121	73.1 Å²	73.1	46%	0.457	40%	0.403	S	S	.	.			trans	-67.8	124.5	-174.5	-165.6	174.8	-148.7	-118.5	-11.6	109.8	C193 L270 Y365	C193-R272 PolarHBondContact SG-NH1 3.34Å; L270-R272 PolarHBondContact O-N 3.22Å; R272-Y365 WeakPolarHBondContact O-CB 3.19Å; R272-Y365 PolarHBondContact O-N 3.17Å
273	W	81.7	Confident	61.3	Low	4 Å²	4	68.2 Å²	68.2	2%	0.015	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	141.2	177	-71.3	75	0	0	0	111.9	I194 V199 S271 F311 N347 T350 H351 L354 C362 P364	I194-W273 HydrophobicContact CD1-CB 3.73Å; I194-W273 HydrophobicContact CG1-CB 4.36Å; I194-W273 PolarHBondContact N-O 3.19Å; V199-W273 VanDerWaalsContact CG1-CD1 3.47Å; V199-W273 HydrophobicContact CG1-CG 4.46Å; V199-W273 HydrophobicContact CG2-CB 3.94Å; V199-W273 HydrophobicContact CG2-CG 4.22Å; S271-W273 PolarHBondContact O-N 3.11Å; S271-W273 PolarHBondContact O-NE1 3.03Å; W273-F311 HydrophobicContact CH2-CE1 4.16Å; W273-F311 HydrophobicContact CZ3-CE1 4.43Å; W273-F311 HydrophobicContact CZ3-CZ 4.39Å; W273-N347 WeakPolarHBondContact CH2-O 3.46Å; W273-T350 WeakPolarHBondContact CH2-OG1 3.19Å; W273-T350 WeakPolarHBondContact CZ2-OG1 3.36Å; W273-H351 HydrophobicContact CH2-CB 4.3Å; W273-H351 HydrophobicContact CZ3-CB 4.1Å; W273-L354 HydrophobicContact CB-CD1 4.03Å; W273-L354 HydrophobicContact CD2-CD1 3.42Å; W273-L354 VanDerWaalsContact CD2-CD1 3.42Å; W273-L354 HydrophobicContact CE3-CD1 3.43Å; W273-L354 VanDerWaalsContact CE3-CD1 3.43Å; W273-L354 HydrophobicContact CG-CD1 3.67Å; W273-L354 HydrophobicContact CZ3-CD1 4.12Å; W273-C362 HydrophobicContact CE3-CB 4.12Å; W273-C362 WeakPolarHBondContact CZ3-O 3.29Å; W273-P364 HydrophobicContact CE3-CG 4.48Å; W273-P364 HydrophobicContact CH2-CG 3.68Å; W273-P364 HydrophobicContact CZ2-CG 3.77Å; W273-P364 HydrophobicContact CZ3-CG 4.08Å
274	V	80.5	Confident	63.5	Low	19 Å²	19	70.5 Å²	70.5	12%	0.115	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	147.7	176.4	-70.1	0	0	0	0	110.2	C362 V363 Y365	V274-C362 CarbonylContact O-C 3.53Å; V274-C362 WeakPolarHBondContact O-CA 3.22Å; V274-V363 HydrophobicContact CG2-CG2 4.12Å; V274-V363 PolarHBondContact N-O 2.98Å; V274-V363 PolarHBondContact O-N 2.58Å; V274-Y365 HydrophobicContact CG1-CD2 4.05Å; V274-Y365 HydrophobicContact CG2-CD2 4.4Å
275	P	81	Confident	65.5	Low	28 Å²	28	68.3 Å²	68.3	18%	0.182	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.7	135.6	165.2	-19.4	32.5	0	0	0	110.2	E192 G277	E192-P275 WeakPolarHBondContact O-CD 3.44Å; P275-G277 PolarHBondContact O-N 3.21Å; P275-G277 VanDerWaalsContact O-N 3.13Å
276	D	80.6	Confident	67.4	Low	26 Å²	26	59.7 Å²	59.7	14%	0.139	31%	0.307	C	S	.	.			trans	-75.6	106.3	-179.3	-177.9	27.6	0	0	0	111.4	H278 Y279 R280 W306 V361 V363	D276-H278 PolarHBondContact O-N 3.16Å; D276-H278 WeakPolarHBondContact OD1-CB 3.5Å; D276-H278 PolarHBondContact OD1-N 2.9Å; D276-H278 WeakPolarHBondContact OD2-CB 3.04Å; D276-H278 IonicContact OD2-CD2 3.73Å; D276-H278 IonicContact OD2-CG 3.99Å; D276-Y279 PolarHBondContact O-N 3.27Å; D276-Y279 VanDerWaalsContact OD2-CB 3.26Å; D276-Y279 WeakPolarHBondContact OD2-CB 3.44Å; D276-Y279 PolarHBondContact OD2-N 3.44Å; D276-R280 VanDerWaalsContact O-CB 3.27Å; D276-R280 WeakPolarHBondContact O-CB 3.41Å; D276-R280 PolarHBondContact O-N 2.78Å; D276-W306 HydrophobicContact CB-CZ2 4.44Å; D276-V361 PolarHBondContact N-O 2.55Å; D276-V363 HydrophobicContact CB-CG1 4.05Å; D276-V363 HydrophobicContact CB-CG2 3.94Å
277	G	74.3	Confident	69.5	Low	37 Å²	37	61.3 Å²	61.3	38%	0.381	32%	0.316	S	S	.	.	H	α-helix	trans	-65.7	-13	175.7	0	0	0	0	0	114.2	P275 R281	P275-G277 PolarHBondContact O-N 3.21Å; P275-G277 VanDerWaalsContact O-N 3.13Å; G277-R281 WeakPolarHBondContact O-CG 3.48Å; G277-R281 PolarHBondContact O-NE 3.28Å
278	H	73.3	Confident	71.2	Confident	29 Å²	29	56.8 Å²	56.8	13%	0.134	29%	0.293	C	S	.	.	H	α-helix	trans	-79.8	-59.2	169.8	164.4	90.2	0	0	0	110.9	G106 L107 D276 R280 R281 L282 W306	G106-H278 VanDerWaalsContact C-ND1 3.33Å; G106-H278 VanDerWaalsContact CA-ND1 3.33Å; G106-H278 WeakPolarHBondContact CA-ND1 3.22Å; G106-H278 PolarHBondContact O-CE1 3.31Å; L107-H278 WeakPolarHBondContact CD1-O 3.35Å; L107-H278 WeakPolarHBondContact CD2-CE1 3.5Å; L107-H278 PolarHBondContact N-ND1 2.7Å; D276-H278 PolarHBondContact O-N 3.16Å; D276-H278 WeakPolarHBondContact OD1-CB 3.5Å; D276-H278 PolarHBondContact OD1-N 2.9Å; D276-H278 WeakPolarHBondContact OD2-CB 3.04Å; D276-H278 IonicContact OD2-CD2 3.73Å; D276-H278 IonicContact OD2-CG 3.99Å; H278-R280 VanDerWaalsContact C-N 3.34Å; H278-R280 PolarHBondContact O-N 3.25Å; H278-R281 PolarHBondContact O-N 3.02Å; H278-L282 PolarHBondContact O-N 2.69Å; H278-W306 AromaticContact CD2-NE1 3.84Å
279	Y	79	Confident	73.4	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-66.2	-32.1	-179.1	-164.9	-88.7	0	0	0	113.2	D276 R281 L282 M283 W303 W306 V361	D276-Y279 PolarHBondContact O-N 3.27Å; D276-Y279 VanDerWaalsContact OD2-CB 3.26Å; D276-Y279 WeakPolarHBondContact OD2-CB 3.44Å; D276-Y279 PolarHBondContact OD2-N 3.44Å; Y279-R281 PolarHBondContact O-N 2.71Å; Y279-L282 HydrophobicContact CD2-CB 4.38Å; Y279-L282 HydrophobicContact CD2-CD2 3.79Å; Y279-L282 HydrophobicContact CE2-CD2 3.62Å; Y279-L282 WeakPolarHBondContact O-CA 3.34Å; Y279-L282 VanDerWaalsContact O-CB 3.31Å; Y279-L282 WeakPolarHBondContact O-CB 3.43Å; Y279-L282 PolarHBondContact O-N 3.18Å; Y279-M283 HydrophobicContact CD1-CG 3.61Å; Y279-M283 HydrophobicContact CD1-SD 3.63Å; Y279-M283 HydrophobicContact CE1-CG 3.36Å; Y279-M283 HydrophobicContact CE1-SD 3.61Å; Y279-M283 WeakPolarHBondContact O-CG 3.45Å; Y279-M283 PolarHBondContact O-N 3.43Å; Y279-W303 VanDerWaalsContact OH-CA 3.29Å; Y279-W303 WeakPolarHBondContact OH-CA 3.4Å; Y279-W303 WeakPolarHBondContact OH-CB 3.31Å; Y279-W306 HydrophobicContact CD2-CB 4.12Å; Y279-W306 AromaticContact CD2-CD1 3.56Å; Y279-W306 AromaticContact CD2-CD2 3.4Å; Y279-W306 HydrophobicContact CD2-CD2 3.4Å; Y279-W306 VanDerWaalsContact CD2-CD2 3.4Å; Y279-W306 AromaticContact CD2-CE2 3.56Å; Y279-W306 HydrophobicContact CD2-CE3 4.03Å; Y279-W306 AromaticContact CD2-CG 3.42Å; Y279-W306 HydrophobicContact CD2-CG 3.42Å; Y279-W306 VanDerWaalsContact CD2-CG 3.42Å; Y279-W306 HydrophobicContact CD2-CZ2 4.32Å; Y279-W306 AromaticContact CD2-NE1 3.61Å; Y279-W306 HydrophobicContact CE2-CB 3.8Å; Y279-W306 AromaticContact CE2-CD2 3.78Å; Y279-W306 HydrophobicContact CE2-CD2 3.78Å; Y279-W306 HydrophobicContact CE2-CE3 4.15Å; Y279-W306 AromaticContact CE2-CG 3.62Å; Y279-W306 HydrophobicContact CE2-CG 3.62Å; Y279-W306 HydrophobicContact CG-CD2 4.17Å; Y279-W306 HydrophobicContact CG-CZ2 4.34Å; Y279-V361 HydrophobicContact CD1-CB 3.74Å; Y279-V361 HydrophobicContact CD1-CG1 3.63Å; Y279-V361 HydrophobicContact CD1-CG2 3.6Å; Y279-V361 HydrophobicContact CE1-CB 4.36Å; Y279-V361 HydrophobicContact CE1-CG1 4.36Å; Y279-V361 HydrophobicContact CE1-CG2 3.7Å; Y279-V361 HydrophobicContact CG-CB 4.36Å; Y279-V361 HydrophobicContact CG-CG1 3.78Å
280	R	78.3	Confident	75.1	Confident	73 Å²	73	52.6 Å²	52.6	28%	0.275	26%	0.26	S	S	.	.	H	α-helix	trans	-52.8	-43.6	172.3	-180	176.3	-73.3	176.6	-5.6	111.6	D276 H278 L282 M283 E284 N360	D276-R280 VanDerWaalsContact O-CB 3.27Å; D276-R280 WeakPolarHBondContact O-CB 3.41Å; D276-R280 PolarHBondContact O-N 2.78Å; H278-R280 VanDerWaalsContact C-N 3.34Å; H278-R280 PolarHBondContact O-N 3.25Å; R280-L282 VanDerWaalsContact C-N 3.35Å; R280-M283 PolarHBondContact O-N 3.03Å; R280-E284 WeakPolarHBondContact CG-OE1 3.44Å; R280-E284 WeakPolarHBondContact O-CB 3.07Å; R280-E284 VanDerWaalsContact O-CG 3.26Å; R280-E284 WeakPolarHBondContact O-CG 3.37Å; R280-E284 PolarHBondContact O-N 3.01Å; R280-N360 PolarHBondContact NH2-OD1 3.29Å
281	R	74.2	Confident	76.4	Confident	113 Å²	113	52.5 Å²	52.5	43%	0.426	26%	0.259	S	S	.	.	H	α-helix	trans	-67.6	-34	174.3	-64.6	175.5	-166.7	156.4	6.2	112.2	L107 G277 H278 Y279 M283 E284 M285	L107-R281 HydrophobicContact CD1-CB 3.7Å; G277-R281 WeakPolarHBondContact O-CG 3.48Å; G277-R281 PolarHBondContact O-NE 3.28Å; H278-R281 PolarHBondContact O-N 3.02Å; Y279-R281 PolarHBondContact O-N 2.71Å; R281-M283 VanDerWaalsContact C-N 3.29Å; R281-M283 PolarHBondContact O-N 3.1Å; R281-E284 PolarHBondContact O-N 3.2Å; R281-M285 WeakPolarHBondContact O-CE 3.49Å; R281-M285 PolarHBondContact O-N 3Å
282	L	75.1	Confident	77.3	Confident	7 Å²	7	48.7 Å²	48.7	4%	0.037	23%	0.233	C	C	.	.	H	α-helix	trans	-63.9	-38.4	177.6	-170.7	69.6	0	0	0	111.1	L107 H278 Y279 R280 M285 N286	L107-L282 HydrophobicContact CD1-CB 3.81Å; L107-L282 HydrophobicContact CD1-CD1 4.25Å; L107-L282 VanDerWaalsContact CD1-N 3.31Å; L107-L282 HydrophobicContact CD2-CB 4.25Å; L107-L282 HydrophobicContact CD2-CD1 3.78Å; L107-L282 HydrophobicContact CD2-CG 4.48Å; H278-L282 PolarHBondContact O-N 2.69Å; Y279-L282 HydrophobicContact CD2-CB 4.38Å; Y279-L282 HydrophobicContact CD2-CD2 3.79Å; Y279-L282 HydrophobicContact CE2-CD2 3.62Å; Y279-L282 WeakPolarHBondContact O-CA 3.34Å; Y279-L282 VanDerWaalsContact O-CB 3.31Å; Y279-L282 WeakPolarHBondContact O-CB 3.43Å; Y279-L282 PolarHBondContact O-N 3.18Å; R280-L282 VanDerWaalsContact C-N 3.35Å; L282-M285 HydrophobicContact CD1-CE 4.41Å; L282-N286 WeakPolarHBondContact CD1-ND2 3.36Å; L282-N286 WeakPolarHBondContact O-CB 3.44Å; L282-N286 PolarHBondContact O-N 3.28Å; L282-N286 PolarHBondContact O-ND2 3.03Å
283	M	80	Confident	77.9	Confident	18 Å²	18	46.7 Å²	46.7	9%	0.089	23%	0.231	C	C	.	.	H	α-helix	trans	-65.1	-52.2	172.3	-61.2	172.4	73.2	0	0	110.9	Y279 R280 R281 M285 N286 D287 I288 P289 W295 V361	Y279-M283 HydrophobicContact CD1-CG 3.61Å; Y279-M283 HydrophobicContact CD1-SD 3.63Å; Y279-M283 HydrophobicContact CE1-CG 3.36Å; Y279-M283 HydrophobicContact CE1-SD 3.61Å; Y279-M283 WeakPolarHBondContact O-CG 3.45Å; Y279-M283 PolarHBondContact O-N 3.43Å; R280-M283 PolarHBondContact O-N 3.03Å; R281-M283 VanDerWaalsContact C-N 3.29Å; R281-M283 PolarHBondContact O-N 3.1Å; M283-M285 PolarHBondContact O-N 3.03Å; M283-M285 VanDerWaalsContact O-N 3.12Å; M283-N286 PolarHBondContact O-N 3.24Å; M283-D287 PolarHBondContact O-N 3.13Å; M283-D287 VanDerWaalsContact O-N 3.15Å; M283-I288 HydrophobicContact CB-CB 3.96Å; M283-I288 HydrophobicContact CE-CG2 4.42Å; M283-I288 HydrophobicContact CG-CB 4.15Å; M283-I288 HydrophobicContact CG-CG2 4.42Å; M283-I288 PolarHBondContact O-N 3.19Å; M283-P289 WeakPolarHBondContact CE-O 3.26Å; M283-W295 HydrophobicContact CE-CZ2 3.91Å; M283-V361 HydrophobicContact SD-CG2 4.26Å
284	E	77.2	Confident	78	Confident	99 Å²	99	52.9 Å²	52.9	46%	0.463	26%	0.259	S	S	.	.	H	α-helix	trans	-63.3	-14.7	-174.7	-73.1	167.7	168.5	0	0	115.4	R280 R281 R290	R280-E284 WeakPolarHBondContact CG-OE1 3.44Å; R280-E284 WeakPolarHBondContact O-CB 3.07Å; R280-E284 VanDerWaalsContact O-CG 3.26Å; R280-E284 WeakPolarHBondContact O-CG 3.37Å; R280-E284 PolarHBondContact O-N 3.01Å; R281-E284 PolarHBondContact O-N 3.2Å; E284-R290 IonicContact OE1-CZ 3.62Å; E284-R290 IonicContact OE1-NH2 3.63Å; E284-R290 PolarHBondContact OE1-NH2 2.98Å
285	M	69.5	Low	78.2	Confident	57 Å²	57	52 Å²	52	28%	0.281	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-132.1	21.2	169.9	104.9	-90.2	85	0	0	116.4	V56 L107 R281 L282 M283	V56-M285 HydrophobicContact CB-CE 3.67Å; V56-M285 HydrophobicContact CB-CG 4.24Å; V56-M285 HydrophobicContact CB-SD 3.78Å; V56-M285 HydrophobicContact CG1-CE 3.62Å; V56-M285 HydrophobicContact CG1-SD 3.63Å; V56-M285 HydrophobicContact CG2-CE 4.15Å; V56-M285 HydrophobicContact CG2-CG 3.69Å; V56-M285 HydrophobicContact CG2-SD 3.65Å; L107-M285 HydrophobicContact CD1-CE 4.09Å; R281-M285 WeakPolarHBondContact O-CE 3.49Å; R281-M285 PolarHBondContact O-N 3Å; L282-M285 HydrophobicContact CD1-CE 4.41Å; M283-M285 PolarHBondContact O-N 3.03Å; M283-M285 VanDerWaalsContact O-N 3.12Å
286	N	73.3	Confident	78.4	Confident	15 Å²	15	54.4 Å²	54.4	8%	0.08	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-117.5	20.6	153.8	-67.3	-81.8	0	0	0	111.3	R73 L282 M283 I288 M302	R73-N286 PolarHBondContact NH2-OD1 2.84Å; L282-N286 WeakPolarHBondContact CD1-ND2 3.36Å; L282-N286 WeakPolarHBondContact O-CB 3.44Å; L282-N286 PolarHBondContact O-N 3.28Å; L282-N286 PolarHBondContact O-ND2 3.03Å; M283-N286 PolarHBondContact O-N 3.24Å; N286-I288 HydrophobicContact CB-CD1 4.17Å; N286-I288 HydrophobicContact CB-CG1 3.91Å; N286-I288 WeakPolarHBondContact O-CG1 3.46Å; N286-I288 PolarHBondContact O-N 2.8Å; N286-I288 VanDerWaalsContact O-N 3.11Å; N286-M302 HydrophobicContact CB-CE 4.12Å
287	D	77.3	Confident	78.6	Confident	139 Å²	139	54.7 Å²	54.7	74%	0.743	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.8	41.1	177.7	-50	-59.4	0	0	0	112.3	M283 P289 Q299	M283-D287 PolarHBondContact O-N 3.13Å; M283-D287 VanDerWaalsContact O-N 3.15Å; D287-P289 WeakPolarHBondContact O-CD 3.43Å; D287-Q299 PolarHBondContact O-NE2 2.89Å
288	I	80.3	Confident	79	Confident	9 Å²	9	56.6 Å²	56.6	5%	0.046	27%	0.274	C	S	.	.			trans	-84.6	122.1	178.6	-46.1	-174.1	0	0	0	107.9	M283 N286 W295 Q299 M302	M283-I288 HydrophobicContact CB-CB 3.96Å; M283-I288 HydrophobicContact CE-CG2 4.42Å; M283-I288 HydrophobicContact CG-CB 4.15Å; M283-I288 HydrophobicContact CG-CG2 4.42Å; M283-I288 PolarHBondContact O-N 3.19Å; N286-I288 HydrophobicContact CB-CD1 4.17Å; N286-I288 HydrophobicContact CB-CG1 3.91Å; N286-I288 WeakPolarHBondContact O-CG1 3.46Å; N286-I288 PolarHBondContact O-N 2.8Å; N286-I288 VanDerWaalsContact O-N 3.11Å; I288-W295 HydrophobicContact CG2-CD2 4.36Å; I288-W295 HydrophobicContact CG2-CG 4.25Å; I288-Q299 HydrophobicContact CD1-CG 4.41Å; I288-Q299 HydrophobicContact CG1-CG 4.09Å; I288-Q299 HydrophobicContact CG2-CB 4.12Å; I288-Q299 HydrophobicContact CG2-CG 4.06Å; I288-M302 HydrophobicContact CD1-CE 4.01Å; I288-M302 HydrophobicContact CD1-SD 4.49Å
289	P	80.8	Confident	79.6	Confident	35 Å²	35	56.1 Å²	56.1	23%	0.227	27%	0.272	C	S	.	.			trans	-54.2	148.7	177.5	-27.6	34.7	0	0	0	112.9	M283 D287 D291 E294 W295	M283-P289 WeakPolarHBondContact CE-O 3.26Å; D287-P289 WeakPolarHBondContact O-CD 3.43Å; P289-D291 VanDerWaalsContact C-N 3.29Å; P289-D291 PolarHBondContact O-N 3.41Å; P289-E294 HydrophobicContact CB-CB 3.7Å; P289-E294 WeakPolarHBondContact CB-OE2 3.26Å; P289-E294 HydrophobicContact CG-CB 3.79Å; P289-W295 PolarHBondContact O-NE1 3.14Å
290	R	75.8	Confident	80	Confident	150 Å²	150	56.1 Å²	56.1	57%	0.566	27%	0.272	S	S	*	.	S	Bend	trans	-64.6	-38.9	175.6	-67.7	-174.1	179.7	-119.1	-16.2	111.1	E284 P292	E284-R290 IonicContact OE1-CZ 3.62Å; E284-R290 IonicContact OE1-NH2 3.63Å; E284-R290 PolarHBondContact OE1-NH2 2.98Å; R290-P292 WeakPolarHBondContact O-CD 3.45Å
291	D	80.9	Confident	80.2	Confident	43 Å²	43	53.4 Å²	53.4	23%	0.23	26%	0.262	C	S	.	.	S	Bend	trans	-85.3	115.7	-176.6	-79	18.7	0	0	0	111.1	P289 I293 E294 R359	P289-D291 VanDerWaalsContact C-N 3.29Å; P289-D291 PolarHBondContact O-N 3.41Å; D291-I293 PolarHBondContact O-N 3.14Å; D291-E294 HydrophobicContact CB-CG 4.46Å; D291-E294 PolarHBondContact O-N 3.22Å; D291-R359 WeakPolarHBondContact OD1-CD 3.44Å; D291-R359 VanDerWaalsContact OD2-CD 3.27Å; D291-R359 WeakPolarHBondContact OD2-CD 3.36Å; D291-R359 IonicContact OD2-CZ 3.57Å; D291-R359 IonicContact OD2-NE 2.73Å; D291-R359 IonicContact OD2-NH1 3.75Å; D291-R359 PolarHBondContact OD2-NH1 3Å
292	P	80.8	Confident	80.6	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.4	5.2	-173.8	-12.8	26.1	0	0	0	115.5	R290 W295 G326 M329 F330 L355	R290-P292 WeakPolarHBondContact O-CD 3.45Å; P292-W295 HydrophobicContact CB-CD2 3.8Å; P292-W295 HydrophobicContact CB-CE3 3.92Å; P292-W295 HydrophobicContact CB-CG 4.46Å; P292-W295 HydrophobicContact CB-CH2 3.86Å; P292-W295 HydrophobicContact CB-CZ2 3.73Å; P292-W295 HydrophobicContact CB-CZ3 3.94Å; P292-W295 HydrophobicContact CG-CH2 4.1Å; P292-W295 HydrophobicContact CG-CZ2 3.81Å; P292-G326 CarbonylContact O-C 3.59Å; P292-G326 VanDerWaalsContact O-C 3.28Å; P292-G326 WeakPolarHBondContact O-CA 3.3Å; P292-M329 HydrophobicContact CB-CE 3.92Å; P292-F330 HydrophobicContact CB-CD2 4.26Å; P292-F330 HydrophobicContact CB-CE2 3.75Å; P292-F330 HydrophobicContact CG-CE2 4.03Å; P292-L355 HydrophobicContact CB-CD1 4.48Å; P292-L355 HydrophobicContact CB-CG 4.46Å; P292-L355 HydrophobicContact CG-CD1 3.51Å; P292-L355 HydrophobicContact CG-CD2 4.4Å; P292-L355 HydrophobicContact CG-CG 3.82Å
293	I	81.8	Confident	81.1	Confident	80 Å²	80	49.9 Å²	49.9	41%	0.41	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-34.6	168.9	-61.1	175.9	0	0	0	110.1	D291 W295 S327 F330	D291-I293 PolarHBondContact O-N 3.14Å; I293-W295 VanDerWaalsContact C-N 3.31Å; I293-W295 PolarHBondContact O-N 2.86Å; I293-S327 PolarHBondContact O-N 2.87Å; I293-F330 HydrophobicContact CB-CD2 4.46Å; I293-F330 HydrophobicContact CD1-CD2 4.47Å; I293-F330 HydrophobicContact CD1-CE2 4.47Å; I293-F330 HydrophobicContact CG1-CB 4.41Å; I293-F330 HydrophobicContact CG1-CD1 4.34Å; I293-F330 HydrophobicContact CG1-CD2 3.44Å; I293-F330 VanDerWaalsContact CG1-CD2 3.44Å; I293-F330 HydrophobicContact CG1-CE2 3.63Å; I293-F330 HydrophobicContact CG1-CG 3.82Å; I293-F330 HydrophobicContact CG1-CZ 4.17Å
294	E	83.3	Confident	81.4	Confident	133 Å²	133	49.1 Å²	49.1	62%	0.621	25%	0.247	S	C	*	.	S	Bend	trans	-83.2	-4.9	-174.9	-59	-178.2	158.3	0	0	113.1	P289 D291	P289-E294 HydrophobicContact CB-CB 3.7Å; P289-E294 WeakPolarHBondContact CB-OE2 3.26Å; P289-E294 HydrophobicContact CG-CB 3.79Å; D291-E294 HydrophobicContact CB-CG 4.46Å; D291-E294 PolarHBondContact O-N 3.22Å
295	W	85.5	Confident	81.7	Confident	2 Å²	2	46.8 Å²	46.8	1%	0.008	24%	0.238	C	C	.	.			trans	-67.1	133.4	-177.8	-66	-1	0	0	0	112.3	M283 I288 P289 P292 I293 Q299 V300 W303 G326 M329 L355 V361	M283-W295 HydrophobicContact CE-CZ2 3.91Å; I288-W295 HydrophobicContact CG2-CD2 4.36Å; I288-W295 HydrophobicContact CG2-CG 4.25Å; P289-W295 PolarHBondContact O-NE1 3.14Å; P292-W295 HydrophobicContact CB-CD2 3.8Å; P292-W295 HydrophobicContact CB-CE3 3.92Å; P292-W295 HydrophobicContact CB-CG 4.46Å; P292-W295 HydrophobicContact CB-CH2 3.86Å; P292-W295 HydrophobicContact CB-CZ2 3.73Å; P292-W295 HydrophobicContact CB-CZ3 3.94Å; P292-W295 HydrophobicContact CG-CH2 4.1Å; P292-W295 HydrophobicContact CG-CZ2 3.81Å; I293-W295 VanDerWaalsContact C-N 3.31Å; I293-W295 PolarHBondContact O-N 2.86Å; W295-Q299 HydrophobicContact CB-CB 4.02Å; W295-Q299 HydrophobicContact CG-CB 4.31Å; W295-V300 HydrophobicContact CB-CG2 4.01Å; W295-V300 HydrophobicContact CE3-CG2 4.24Å; W295-W303 HydrophobicContact CE3-CB 4.23Å; W295-W303 HydrophobicContact CE3-CG 4.5Å; W295-W303 HydrophobicContact CH2-CB 4.02Å; W295-W303 AromaticContact CH2-CD1 3.78Å; W295-W303 HydrophobicContact CH2-CD2 4.42Å; W295-W303 AromaticContact CH2-CG 3.78Å; W295-W303 HydrophobicContact CH2-CG 3.78Å; W295-W303 HydrophobicContact CZ3-CB 3.5Å; W295-W303 VanDerWaalsContact CZ3-CB 3.5Å; W295-W303 AromaticContact CZ3-CD1 3.89Å; W295-W303 AromaticContact CZ3-CD2 3.81Å; W295-W303 HydrophobicContact CZ3-CD2 3.81Å; W295-W303 HydrophobicContact CZ3-CE3 4.32Å; W295-W303 AromaticContact CZ3-CG 3.41Å; W295-W303 HydrophobicContact CZ3-CG 3.41Å; W295-W303 VanDerWaalsContact CZ3-CG 3.41Å; W295-G326 PolarHBondContact O-N 3.08Å; W295-M329 HydrophobicContact CE3-CE 3.95Å; W295-M329 HydrophobicContact CZ3-CE 3.96Å; W295-L355 HydrophobicContact CH2-CD1 4.29Å; W295-L355 HydrophobicContact CH2-CD2 4.19Å; W295-L355 HydrophobicContact CZ3-CD2 4.42Å; W295-V361 HydrophobicContact CH2-CG2 4.31Å
296	N	85.2	Confident	82.4	Confident	77 Å²	77	44.9 Å²	44.9	41%	0.412	23%	0.228	S	C	.	.			trans	-75.7	168.3	166.9	68.5	49.7	0	0	0	111.5	T298 Q299 V300	N296-T298 VanDerWaalsContact C-N 3.29Å; N296-T298 PolarHBondContact O-N 3.27Å; N296-T298 WeakPolarHBondContact OD1-CA 3.3Å; N296-T298 VanDerWaalsContact OD1-CB 3.31Å; N296-T298 WeakPolarHBondContact OD1-CB 3.07Å; N296-T298 PolarHBondContact OD1-N 3.48Å; N296-T298 VanDerWaalsContact OD1-N 3.09Å; N296-Q299 VanDerWaalsContact ND2-CD 3.33Å; N296-Q299 PolarHBondContact ND2-OE1 3.26Å; N296-Q299 WeakPolarHBondContact O-CB 3.11Å; N296-Q299 PolarHBondContact O-N 3.14Å; N296-Q299 VanDerWaalsContact O-N 3.08Å; N296-Q299 WeakPolarHBondContact OD1-CG 3.23Å; N296-Q299 PolarHBondContact OD1-N 2.96Å; N296-V300 PolarHBondContact O-N 3.4Å
297	S	84.6	Confident	83	Confident	33 Å²	33	44.1 Å²	44.1	23%	0.231	22%	0.224	C	C	.	.	H	α-helix	trans	-63	-32.5	-176.6	56.3	0	0	0	0	113.6	Q299 V300 I301 N323 M324	S297-Q299 VanDerWaalsContact C-N 3.35Å; S297-V300 PolarHBondContact O-N 2.92Å; S297-I301 WeakPolarHBondContact O-CB 3.47Å; S297-I301 WeakPolarHBondContact O-CD1 3.45Å; S297-I301 VanDerWaalsContact O-CG1 3.23Å; S297-I301 WeakPolarHBondContact O-CG1 3.12Å; S297-I301 PolarHBondContact O-N 3.3Å; S297-N323 WeakPolarHBondContact CB-OD1 3.48Å; S297-N323 PolarHBondContact OG-OD1 3.27Å; S297-M324 WeakPolarHBondContact CA-O 3.34Å
298	T	83.5	Confident	83.2	Confident	76 Å²	76	38.1 Å²	38.1	47%	0.466	19%	0.192	S	C	.	.	H	α-helix	trans	-63.7	-40.2	173.1	-51.6	0	0	0	0	111.6	N296 I301 M302	N296-T298 VanDerWaalsContact C-N 3.29Å; N296-T298 PolarHBondContact O-N 3.27Å; N296-T298 WeakPolarHBondContact OD1-CA 3.3Å; N296-T298 VanDerWaalsContact OD1-CB 3.31Å; N296-T298 WeakPolarHBondContact OD1-CB 3.07Å; N296-T298 PolarHBondContact OD1-N 3.48Å; N296-T298 VanDerWaalsContact OD1-N 3.09Å; T298-I301 PolarHBondContact O-N 3.18Å; T298-M302 WeakPolarHBondContact O-CG 3.23Å; T298-M302 PolarHBondContact O-N 3.4Å
299	Q	85.7	Confident	83.2	Confident	20 Å²	20	42.3 Å²	42.3	9%	0.093	21%	0.21	C	C	.	.	H	α-helix	trans	-69.1	-38.3	176.6	-70.8	166.1	-23.4	0	0	111.9	D287 I288 W295 N296 S297 M302 W303	D287-Q299 PolarHBondContact O-NE2 2.89Å; I288-Q299 HydrophobicContact CD1-CG 4.41Å; I288-Q299 HydrophobicContact CG1-CG 4.09Å; I288-Q299 HydrophobicContact CG2-CB 4.12Å; I288-Q299 HydrophobicContact CG2-CG 4.06Å; W295-Q299 HydrophobicContact CB-CB 4.02Å; W295-Q299 HydrophobicContact CG-CB 4.31Å; N296-Q299 VanDerWaalsContact ND2-CD 3.33Å; N296-Q299 PolarHBondContact ND2-OE1 3.26Å; N296-Q299 WeakPolarHBondContact O-CB 3.11Å; N296-Q299 PolarHBondContact O-N 3.14Å; N296-Q299 VanDerWaalsContact O-N 3.08Å; N296-Q299 WeakPolarHBondContact OD1-CG 3.23Å; N296-Q299 PolarHBondContact OD1-N 2.96Å; S297-Q299 VanDerWaalsContact C-N 3.35Å; Q299-M302 PolarHBondContact O-N 2.91Å; Q299-W303 PolarHBondContact O-N 3.21Å
300	V	86.1	Confident	83.1	Confident	0 Å²	0	44 Å²	44	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-62.4	-42.7	170.5	175	0	0	0	0	111.1	W295 N296 S297 W303 I304 F322 M329	W295-V300 HydrophobicContact CB-CG2 4.01Å; W295-V300 HydrophobicContact CE3-CG2 4.24Å; N296-V300 PolarHBondContact O-N 3.4Å; S297-V300 PolarHBondContact O-N 2.92Å; V300-W303 PolarHBondContact O-N 2.96Å; V300-I304 WeakPolarHBondContact O-CG2 3.39Å; V300-I304 PolarHBondContact O-N 2.96Å; V300-F322 HydrophobicContact CG1-CB 4.18Å; V300-M329 HydrophobicContact CG1-SD 3.85Å; V300-M329 HydrophobicContact CG2-SD 4.21Å
301	I	84.5	Confident	83.4	Confident	15 Å²	15	37.8 Å²	37.8	8%	0.077	19%	0.192	C	C	.	.	H	α-helix	trans	-63.3	-40.5	175.3	-70.7	163.1	0	0	0	111.3	S297 T298 N305 E319	S297-I301 WeakPolarHBondContact O-CB 3.47Å; S297-I301 WeakPolarHBondContact O-CD1 3.45Å; S297-I301 VanDerWaalsContact O-CG1 3.23Å; S297-I301 WeakPolarHBondContact O-CG1 3.12Å; S297-I301 PolarHBondContact O-N 3.3Å; T298-I301 PolarHBondContact O-N 3.18Å; I301-N305 VanDerWaalsContact O-CB 3.26Å; I301-N305 WeakPolarHBondContact O-CB 3.47Å; I301-N305 VanDerWaalsContact O-CG 3.22Å; I301-N305 PolarHBondContact O-N 2.95Å; I301-N305 VanDerWaalsContact O-N 3.09Å; I301-N305 PolarHBondContact O-ND2 3.32Å; I301-E319 HydrophobicContact CG2-CG 4.26Å
302	M	80.6	Confident	83.2	Confident	47 Å²	47	45.7 Å²	45.7	23%	0.232	22%	0.219	C	C	.	.	H	α-helix	trans	-61.9	-46	173.5	-74.8	174.4	66.7	0	0	112	N286 I288 T298 Q299 W306	N286-M302 HydrophobicContact CB-CE 4.12Å; I288-M302 HydrophobicContact CD1-CE 4.01Å; I288-M302 HydrophobicContact CD1-SD 4.49Å; T298-M302 WeakPolarHBondContact O-CG 3.23Å; T298-M302 PolarHBondContact O-N 3.4Å; Q299-M302 PolarHBondContact O-N 2.91Å; M302-W306 PolarHBondContact O-N 3.04Å; M302-W306 VanDerWaalsContact O-N 3.09Å
303	W	87	Confident	83	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-63.2	-50.5	177.9	167.9	74.3	0	0	0	112.2	Y279 W295 Q299 V300 N305 W306 A307 M329 W337 F348 H351 L352 L355	Y279-W303 VanDerWaalsContact OH-CA 3.29Å; Y279-W303 WeakPolarHBondContact OH-CA 3.4Å; Y279-W303 WeakPolarHBondContact OH-CB 3.31Å; W295-W303 HydrophobicContact CE3-CB 4.23Å; W295-W303 HydrophobicContact CE3-CG 4.5Å; W295-W303 HydrophobicContact CH2-CB 4.02Å; W295-W303 AromaticContact CH2-CD1 3.78Å; W295-W303 HydrophobicContact CH2-CD2 4.42Å; W295-W303 AromaticContact CH2-CG 3.78Å; W295-W303 HydrophobicContact CH2-CG 3.78Å; W295-W303 HydrophobicContact CZ3-CB 3.5Å; W295-W303 VanDerWaalsContact CZ3-CB 3.5Å; W295-W303 AromaticContact CZ3-CD1 3.89Å; W295-W303 AromaticContact CZ3-CD2 3.81Å; W295-W303 HydrophobicContact CZ3-CD2 3.81Å; W295-W303 HydrophobicContact CZ3-CE3 4.32Å; W295-W303 AromaticContact CZ3-CG 3.41Å; W295-W303 HydrophobicContact CZ3-CG 3.41Å; W295-W303 VanDerWaalsContact CZ3-CG 3.41Å; Q299-W303 PolarHBondContact O-N 3.21Å; V300-W303 PolarHBondContact O-N 2.96Å; W303-N305 VanDerWaalsContact C-N 3.32Å; W303-N305 PolarHBondContact O-N 2.96Å; W303-W306 WeakPolarHBondContact O-CB 3.48Å; W303-W306 PolarHBondContact O-N 3.47Å; W303-W306 VanDerWaalsContact O-N 3.14Å; W303-A307 WeakPolarHBondContact O-CB 3.27Å; W303-A307 PolarHBondContact O-N 3.38Å; W303-M329 HydrophobicContact CE3-SD 3.64Å; W303-M329 HydrophobicContact CH2-SD 4.18Å; W303-M329 HydrophobicContact CZ3-CG 4.5Å; W303-M329 HydrophobicContact CZ3-SD 3.42Å; W303-M329 WeakPolarHBondContact CZ3-SD 3.37Å; W303-W337 AromaticContact CH2-CH2 3.91Å; W303-W337 HydrophobicContact CH2-CH2 3.91Å; W303-W337 HydrophobicContact CH2-CZ3 4.33Å; W303-W337 AromaticContact CZ3-CH2 3.96Å; W303-W337 HydrophobicContact CZ3-CH2 3.96Å; W303-W337 HydrophobicContact CZ3-CZ3 4.46Å; W303-F348 HydrophobicContact CH2-CE2 4.37Å; W303-F348 HydrophobicContact CH2-CZ 4.3Å; W303-F348 HydrophobicContact CZ2-CE2 4.45Å; W303-H351 AromaticContact CE2-NE2 3.78Å; W303-H351 AromaticContact CZ2-CD2 4Å; W303-H351 AromaticContact CZ2-NE2 3.8Å; W303-H351 AromaticContact NE1-NE2 3.16Å; W303-H351 PolarHBondContact NE1-NE2 3.49Å; W303-H351 VanDerWaalsContact NE1-NE2 3.16Å; W303-L352 HydrophobicContact CH2-CD1 4.17Å; W303-L355 HydrophobicContact CD2-CD2 4.45Å; W303-L355 HydrophobicContact CH2-CD2 4.45Å; W303-L355 HydrophobicContact CZ2-CD2 3.63Å
304	I	85.9	Confident	82.2	Confident	1 Å²	1	50.1 Å²	50.1	1%	0.005	24%	0.238	C	C	.	.	H	α-helix	trans	-67	-35.4	-176.3	-165.3	63.4	0	0	0	111.5	V300 A307 C308 F322 F348	V300-I304 WeakPolarHBondContact O-CG2 3.39Å; V300-I304 PolarHBondContact O-N 2.96Å; I304-A307 PolarHBondContact O-N 3.12Å; I304-C308 WeakPolarHBondContact O-CB 3.13Å; I304-C308 PolarHBondContact O-N 3.25Å; I304-C308 PolarHBondContact O-SG 2.86Å; I304-F322 HydrophobicContact CB-CD2 4.46Å; I304-F322 HydrophobicContact CB-CG 4.47Å; I304-F322 HydrophobicContact CD1-CE2 4.36Å; I304-F322 HydrophobicContact CD1-CZ 4.19Å; I304-F322 HydrophobicContact CG1-CD2 3.88Å; I304-F322 HydrophobicContact CG1-CE1 4.46Å; I304-F322 HydrophobicContact CG1-CE2 3.81Å; I304-F322 HydrophobicContact CG1-CG 4.25Å; I304-F322 HydrophobicContact CG1-CZ 4.1Å; I304-F322 HydrophobicContact CG2-CB 4.09Å; I304-F322 HydrophobicContact CG2-CD2 4.04Å; I304-F322 HydrophobicContact CG2-CG 4.1Å; I304-F348 HydrophobicContact CD1-CE2 4.03Å; I304-F348 HydrophobicContact CD1-CZ 3.84Å
305	N	82.4	Confident	81.1	Confident	51 Å²	51	47.7 Å²	47.7	27%	0.273	25%	0.249	S	C	.	.	H	α-helix	trans	-66.6	-35	174.2	-75	-11.3	0	0	0	111.9	I301 W303 K309 G318	I301-N305 VanDerWaalsContact O-CB 3.26Å; I301-N305 WeakPolarHBondContact O-CB 3.47Å; I301-N305 VanDerWaalsContact O-CG 3.22Å; I301-N305 PolarHBondContact O-N 2.95Å; I301-N305 VanDerWaalsContact O-N 3.09Å; I301-N305 PolarHBondContact O-ND2 3.32Å; W303-N305 VanDerWaalsContact C-N 3.32Å; W303-N305 PolarHBondContact O-N 2.96Å; N305-K309 WeakPolarHBondContact O-CG 3.41Å; N305-K309 PolarHBondContact O-N 3.49Å; N305-G318 WeakPolarHBondContact OD1-CA 3.26Å; N305-G318 PolarHBondContact OD1-N 3.15Å; N305-G318 VanDerWaalsContact OD1-N 3.14Å
306	W	85.9	Confident	80.1	Confident	16 Å²	16	49.2 Å²	49.2	6%	0.061	26%	0.257	C	S	.	.	H	α-helix	trans	-68.2	-46.2	170	166.8	89.5	0	0	0	111.7	D276 H278 Y279 M302 W303 C308 K309 Q310 F311 H351 V361 V363	D276-W306 HydrophobicContact CB-CZ2 4.44Å; H278-W306 AromaticContact CD2-NE1 3.84Å; Y279-W306 HydrophobicContact CD2-CB 4.12Å; Y279-W306 AromaticContact CD2-CD1 3.56Å; Y279-W306 AromaticContact CD2-CD2 3.4Å; Y279-W306 HydrophobicContact CD2-CD2 3.4Å; Y279-W306 VanDerWaalsContact CD2-CD2 3.4Å; Y279-W306 AromaticContact CD2-CE2 3.56Å; Y279-W306 HydrophobicContact CD2-CE3 4.03Å; Y279-W306 AromaticContact CD2-CG 3.42Å; Y279-W306 HydrophobicContact CD2-CG 3.42Å; Y279-W306 VanDerWaalsContact CD2-CG 3.42Å; Y279-W306 HydrophobicContact CD2-CZ2 4.32Å; Y279-W306 AromaticContact CD2-NE1 3.61Å; Y279-W306 HydrophobicContact CE2-CB 3.8Å; Y279-W306 AromaticContact CE2-CD2 3.78Å; Y279-W306 HydrophobicContact CE2-CD2 3.78Å; Y279-W306 HydrophobicContact CE2-CE3 4.15Å; Y279-W306 AromaticContact CE2-CG 3.62Å; Y279-W306 HydrophobicContact CE2-CG 3.62Å; Y279-W306 HydrophobicContact CG-CD2 4.17Å; Y279-W306 HydrophobicContact CG-CZ2 4.34Å; M302-W306 PolarHBondContact O-N 3.04Å; M302-W306 VanDerWaalsContact O-N 3.09Å; W303-W306 WeakPolarHBondContact O-CB 3.48Å; W303-W306 PolarHBondContact O-N 3.47Å; W303-W306 VanDerWaalsContact O-N 3.14Å; W306-C308 PolarHBondContact O-N 3.12Å; W306-K309 PolarHBondContact O-N 3.4Å; W306-K309 VanDerWaalsContact O-N 3.14Å; W306-Q310 HydrophobicContact CD2-CG 4.02Å; W306-Q310 VanDerWaalsContact CE2-CG 3.48Å; W306-Q310 HydrophobicContact CG-CG 4.38Å; W306-Q310 HydrophobicContact CH2-CG 4.32Å; W306-Q310 HydrophobicContact CZ2-CB 4.48Å; W306-Q310 HydrophobicContact CZ2-CG 3.68Å; W306-Q310 PolarHBondContact O-N 3.05Å; W306-F311 HydrophobicContact CH2-CE2 4.48Å; W306-F311 HydrophobicContact CZ3-CE2 4.4Å; W306-H351 AromaticContact CH2-CE1 3.99Å; W306-H351 AromaticContact CZ3-CE1 3.74Å; W306-H351 AromaticContact CZ3-NE2 3.79Å; W306-V361 HydrophobicContact CE3-CG1 4.24Å; W306-V361 HydrophobicContact CH2-CG1 3.17Å; W306-V361 HydrophobicContact CZ2-CG1 3.76Å; W306-V361 HydrophobicContact CZ3-CG1 3.45Å; W306-V361 VanDerWaalsContact CZ3-CG1 3.45Å; W306-V363 HydrophobicContact CH2-CG1 4.03Å; W306-V363 HydrophobicContact CZ2-CG1 4.12Å
307	A	84.9	Confident	78.9	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-64.9	-40	-176.9	0	0	0	0	0	111.6	W303 I304 K309 Q310 F311 F348	W303-A307 WeakPolarHBondContact O-CB 3.27Å; W303-A307 PolarHBondContact O-N 3.38Å; I304-A307 PolarHBondContact O-N 3.12Å; A307-K309 VanDerWaalsContact C-N 3.33Å; A307-K309 PolarHBondContact O-N 3.22Å; A307-Q310 PolarHBondContact O-N 2.81Å; A307-F311 HydrophobicContact CB-CD2 4.29Å; A307-F311 WeakPolarHBondContact O-CB 3.33Å; A307-F311 VanDerWaalsContact O-CD2 3.3Å; A307-F311 WeakPolarHBondContact O-CD2 3.37Å; A307-F311 PolarHBondContact O-N 3.15Å; A307-F348 HydrophobicContact CB-CD2 4.31Å; A307-F348 HydrophobicContact CB-CE2 3.92Å
308	C	81.8	Confident	77.8	Confident	12 Å²	12	51.4 Å²	51.4	8%	0.081	26%	0.259	C	S	.	.	H	α-helix	trans	-62.4	-39.4	174.2	-65.4	0	0	0	0	111.9	I304 W306 R312 I313	I304-C308 WeakPolarHBondContact O-CB 3.13Å; I304-C308 PolarHBondContact O-N 3.25Å; I304-C308 PolarHBondContact O-SG 2.86Å; W306-C308 PolarHBondContact O-N 3.12Å; C308-R312 WeakPolarHBondContact O-CA 3.46Å; C308-R312 PolarHBondContact O-N 3Å; C308-R312 VanDerWaalsContact O-N 3.14Å; C308-I313 HydrophobicContact CB-CB 4.24Å; C308-I313 PolarHBondContact O-N 3.17Å
309	K	79.8	Confident	76.6	Confident	97 Å²	97	51 Å²	51	42%	0.422	25%	0.251	S	S	.	.	H	α-helix	trans	-65.7	-45.7	174.1	-72.4	-176.8	-179.8	-172.6	0	111.8	E60 D65 N305 W306 A307	E60-K309 PolarHBondContact O-NZ 3.05Å; D65-K309 IonicContact OD2-NZ 2.68Å; D65-K309 PolarHBondContact OD2-NZ 3.33Å; N305-K309 WeakPolarHBondContact O-CG 3.41Å; N305-K309 PolarHBondContact O-N 3.49Å; W306-K309 PolarHBondContact O-N 3.4Å; W306-K309 VanDerWaalsContact O-N 3.14Å; A307-K309 VanDerWaalsContact C-N 3.33Å; A307-K309 PolarHBondContact O-N 3.22Å
310	Q	80.1	Confident	75.4	Confident	72 Å²	72	59.2 Å²	59.2	34%	0.336	29%	0.287	S	S	.	.	H	α-helix	trans	-69.4	-47.4	-178.7	-70.5	-61.1	-38.2	0	0	113.6	W306 A307 R312	W306-Q310 HydrophobicContact CD2-CG 4.02Å; W306-Q310 VanDerWaalsContact CE2-CG 3.48Å; W306-Q310 HydrophobicContact CG-CG 4.38Å; W306-Q310 HydrophobicContact CH2-CG 4.32Å; W306-Q310 HydrophobicContact CZ2-CB 4.48Å; W306-Q310 HydrophobicContact CZ2-CG 3.68Å; W306-Q310 PolarHBondContact O-N 3.05Å; A307-Q310 PolarHBondContact O-N 2.81Å; Q310-R312 VanDerWaalsContact C-N 3.27Å; Q310-R312 PolarHBondContact O-N 3.43Å
311	F	82.1	Confident	74.3	Confident	19 Å²	19	62.7 Å²	62.7	8%	0.083	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.1	8.5	-177.9	-62.1	-72.5	0	0	0	113.7	W273 W306 A307 I313 N345 N347 F348 H351	W273-F311 HydrophobicContact CH2-CE1 4.16Å; W273-F311 HydrophobicContact CZ3-CE1 4.43Å; W273-F311 HydrophobicContact CZ3-CZ 4.39Å; W306-F311 HydrophobicContact CH2-CE2 4.48Å; W306-F311 HydrophobicContact CZ3-CE2 4.4Å; A307-F311 HydrophobicContact CB-CD2 4.29Å; A307-F311 WeakPolarHBondContact O-CB 3.33Å; A307-F311 VanDerWaalsContact O-CD2 3.3Å; A307-F311 WeakPolarHBondContact O-CD2 3.37Å; A307-F311 PolarHBondContact O-N 3.15Å; F311-I313 HydrophobicContact CB-CD1 4.3Å; F311-I313 HydrophobicContact CB-CG1 4.18Å; F311-I313 PolarHBondContact O-N 3.17Å; F311-N345 PolarHBondContact O-ND2 2.77Å; F311-N347 HydrophobicContact CD1-CB 3.94Å; F311-N347 HydrophobicContact CE1-CB 4.23Å; F311-N347 WeakPolarHBondContact CE1-O 3.35Å; F311-F348 HydrophobicContact CB-CB 4.06Å; F311-F348 HydrophobicContact CD2-CB 4.4Å; F311-F348 AromaticContact CD2-CD2 3.94Å; F311-F348 HydrophobicContact CD2-CD2 3.94Å; F311-F348 HydrophobicContact CG-CB 4.1Å; F311-F348 HydrophobicContact CG-CD2 4.41Å; F311-H351 HydrophobicContact CE1-CB 4.1Å; F311-H351 HydrophobicContact CE2-CB 3.66Å; F311-H351 AromaticContact CE2-CD2 3.76Å; F311-H351 AromaticContact CE2-CG 3.42Å; F311-H351 VanDerWaalsContact CE2-CG 3.42Å; F311-H351 AromaticContact CE2-ND1 3.85Å; F311-H351 HydrophobicContact CZ-CB 3.4Å; F311-H351 AromaticContact CZ-CG 3.52Å; F311-H351 AromaticContact CZ-ND1 3.8Å
312	R	76.7	Confident	73.7	Confident	209 Å²	209	62 Å²	62	79%	0.789	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.4	50.3	178.6	-56.3	-175.5	-176.9	-173.6	0.6	113.2	C308 Q310	C308-R312 WeakPolarHBondContact O-CA 3.46Å; C308-R312 PolarHBondContact O-N 3Å; C308-R312 VanDerWaalsContact O-N 3.14Å; Q310-R312 VanDerWaalsContact C-N 3.27Å; Q310-R312 PolarHBondContact O-N 3.43Å
313	I	76.1	Confident	73.4	Confident	10 Å²	10	65.5 Å²	65.5	5%	0.051	32%	0.321	C	S	.	.			trans	-94.2	104.3	177	-51.4	177.5	0	0	0	108.3	C308 F311 L316 V341 N343 F348	C308-I313 HydrophobicContact CB-CB 4.24Å; C308-I313 PolarHBondContact O-N 3.17Å; F311-I313 HydrophobicContact CB-CD1 4.3Å; F311-I313 HydrophobicContact CB-CG1 4.18Å; F311-I313 PolarHBondContact O-N 3.17Å; I313-L316 HydrophobicContact CG2-CD1 3.93Å; I313-L316 HydrophobicContact CG2-CG 4.35Å; I313-V341 HydrophobicContact CD1-CG1 4.11Å; I313-V341 HydrophobicContact CG2-CG1 4.12Å; I313-N343 HydrophobicContact CG2-CB 4.41Å; I313-F348 HydrophobicContact CD1-CB 3.83Å; I313-F348 HydrophobicContact CD1-CD1 3.94Å; I313-F348 HydrophobicContact CD1-CD2 3.62Å; I313-F348 HydrophobicContact CD1-CE1 4.42Å; I313-F348 HydrophobicContact CD1-CE2 4.14Å; I313-F348 HydrophobicContact CD1-CG 3.5Å
314	E	63.6	Low	73.1	Confident	162 Å²	162	66.6 Å²	66.6	76%	0.757	33%	0.327	S	S	*	.			trans	-84.1	150.2	179.4	-63.3	-176.4	-175.3	0	0	112.1
315	G	61.3	Low	72.9	Confident	82 Å²	82	69.4 Å²	69.4	85%	0.845	35%	0.345	S	S	*	.	S	Bend	trans	96.2	-13.5	172.6	0	0	0	0	0	116.6
316	L	64.2	Low	72.9	Confident	34 Å²	34	67 Å²	67	18%	0.178	33%	0.332	C	S	.	.			trans	-91.1	130.3	179.7	-60.9	-177.7	0	0	0	112.6	I313 L321 L340 V341	I313-L316 HydrophobicContact CG2-CD1 3.93Å; I313-L316 HydrophobicContact CG2-CG 4.35Å; L316-L321 HydrophobicContact CD2-CD1 3.73Å; L316-L340 WeakPolarHBondContact CD2-O 3.49Å; L316-V341 HydrophobicContact CD1-CB 4.23Å; L316-V341 HydrophobicContact CD1-CG1 3.91Å; L316-V341 HydrophobicContact CD1-CG2 3.88Å
317	K	60	Low	72.7	Confident	155 Å²	155	69 Å²	69	67%	0.674	35%	0.348	S	S	*	.			trans	-111.9	111.6	163.3	-68.3	-164.5	174.2	-161	0	108.8	E319 K320	K317-E319 VanDerWaalsContact C-N 3.27Å; K317-E319 PolarHBondContact O-N 3.07Å; K317-E319 VanDerWaalsContact O-N 3.17Å; K317-K320 PolarHBondContact O-N 2.75Å
318	G	61.2	Low	72.5	Confident	1 Å²	1	76.9 Å²	76.9	1%	0.01	38%	0.378	C	S	.	.	H	α-helix	trans	-53.7	-39.2	-170.6	0	0	0	0	0	114.3	N305 K320 L321 F322	N305-G318 WeakPolarHBondContact OD1-CA 3.26Å; N305-G318 PolarHBondContact OD1-N 3.15Å; N305-G318 VanDerWaalsContact OD1-N 3.14Å; G318-K320 VanDerWaalsContact C-N 3.26Å; G318-K320 PolarHBondContact O-N 2.9Å; G318-K320 VanDerWaalsContact O-N 3.12Å; G318-L321 PolarHBondContact O-N 3.02Å; G318-F322 PolarHBondContact O-N 3.1Å
319	E	58.5	Low	72.5	Confident	67 Å²	67	76.6 Å²	76.6	31%	0.313	38%	0.376	S	S	.	.	H	α-helix	trans	-54.9	-33.9	-175.6	-70.8	109.6	-160	0	0	115	R72 I301 K317	R72-E319 IonicContact CZ-OE1 3.18Å; R72-E319 IonicContact NH1-OE1 2.74Å; R72-E319 VanDerWaalsContact NH2-CD 3.3Å; R72-E319 IonicContact NH2-OE1 3.91Å; R72-E319 PolarHBondContact NH2-OE1 3.35Å; I301-E319 HydrophobicContact CG2-CG 4.26Å; K317-E319 VanDerWaalsContact C-N 3.27Å; K317-E319 PolarHBondContact O-N 3.07Å; K317-E319 VanDerWaalsContact O-N 3.17Å
320	K	61.4	Low	72.4	Confident	194 Å²	194	74.2 Å²	74.2	84%	0.843	37%	0.365	S	S	*	.	H	α-helix	trans	-91.1	-16.9	-174.2	-67.6	-165.1	176	-170	0	114.4	K317 G318	K317-K320 PolarHBondContact O-N 2.75Å; G318-K320 VanDerWaalsContact C-N 3.26Å; G318-K320 PolarHBondContact O-N 2.9Å; G318-K320 VanDerWaalsContact O-N 3.12Å
321	L	62.8	Low	72.5	Confident	73 Å²	73	76.3 Å²	76.3	38%	0.382	38%	0.383	S	S	.	.	H	α-helix	trans	-116.7	-28.3	-173.7	-67	171.4	0	0	0	112.9	L316 G318 L340	L316-L321 HydrophobicContact CD2-CD1 3.73Å; G318-L321 PolarHBondContact O-N 3.02Å; L321-L340 HydrophobicContact CB-CD2 4.41Å
322	F	71.4	Confident	72.2	Confident	0 Å²	0	76.3 Å²	76.3	0%	0	38%	0.384	C	S	.	.			trans	-119.1	28.4	-170.8	-66.1	-85.8	0	0	0	113.5	V300 I304 G318 M324 W337 L340 V341	V300-F322 HydrophobicContact CG1-CB 4.18Å; I304-F322 HydrophobicContact CB-CD2 4.46Å; I304-F322 HydrophobicContact CB-CG 4.47Å; I304-F322 HydrophobicContact CD1-CE2 4.36Å; I304-F322 HydrophobicContact CD1-CZ 4.19Å; I304-F322 HydrophobicContact CG1-CD2 3.88Å; I304-F322 HydrophobicContact CG1-CE1 4.46Å; I304-F322 HydrophobicContact CG1-CE2 3.81Å; I304-F322 HydrophobicContact CG1-CG 4.25Å; I304-F322 HydrophobicContact CG1-CZ 4.1Å; I304-F322 HydrophobicContact CG2-CB 4.09Å; I304-F322 HydrophobicContact CG2-CD2 4.04Å; I304-F322 HydrophobicContact CG2-CG 4.1Å; G318-F322 PolarHBondContact O-N 3.1Å; F322-M324 HydrophobicContact CD1-CE 4.31Å; F322-M324 PolarHBondContact O-N 3.19Å; F322-W337 HydrophobicContact CE1-CE3 4.47Å; F322-W337 HydrophobicContact CE1-CH2 4.07Å; F322-W337 AromaticContact CE1-CZ3 3.67Å; F322-W337 HydrophobicContact CE1-CZ3 3.67Å; F322-W337 HydrophobicContact CZ-CZ3 4.1Å; F322-L340 HydrophobicContact CE1-CB 4.3Å; F322-L340 HydrophobicContact CE1-CD1 4.07Å; F322-L340 HydrophobicContact CZ-CB 3.78Å; F322-L340 HydrophobicContact CZ-CD1 4.39Å; F322-V341 HydrophobicContact CZ-CG2 3.93Å
323	N	74.3	Confident	72.2	Confident	120 Å²	120	69.3 Å²	69.3	64%	0.642	36%	0.364	S	S	*	.			trans	-74.2	66.7	166.7	-170	14.4	0	0	0	110.8	S297	S297-N323 WeakPolarHBondContact CB-OD1 3.48Å; S297-N323 PolarHBondContact OG-OD1 3.27Å
324	M	80.2	Confident	72.1	Confident	24 Å²	24	71.6 Å²	71.6	12%	0.118	38%	0.38	C	S	.	.	S	Bend	trans	-144.7	149.1	178.9	69.5	179.9	86	0	0	110.3	S297 F322 R328 L332 L340	S297-M324 WeakPolarHBondContact CA-O 3.34Å; F322-M324 HydrophobicContact CD1-CE 4.31Å; F322-M324 PolarHBondContact O-N 3.19Å; M324-R328 HydrophobicContact CB-CB 4.31Å; M324-R328 HydrophobicContact SD-CB 4.34Å; M324-R328 HydrophobicContact SD-CG 4.14Å; M324-L332 HydrophobicContact CE-CD1 4.34Å; M324-L332 HydrophobicContact SD-CD1 3.92Å; M324-L332 HydrophobicContact SD-CD2 4.31Å; M324-L332 HydrophobicContact SD-CG 4.36Å; M324-L340 HydrophobicContact CE-CD1 4.24Å
325	P	82.2	Confident	72.5	Confident	59 Å²	59	67.2 Å²	67.2	38%	0.383	36%	0.362	S	S	.	.			trans	-69.9	158.7	175.5	30.6	-35.8	0	0	0	111.8	S327 R328 M329	P325-S327 PolarHBondContact O-N 3.15Å; P325-R328 HydrophobicContact CG-CB 4.21Å; P325-R328 WeakPolarHBondContact O-CB 3.11Å; P325-R328 PolarHBondContact O-N 3.05Å; P325-M329 PolarHBondContact O-N 3.43Å; P325-M329 VanDerWaalsContact O-N 3.09Å
326	G	82	Confident	73.3	Confident	0 Å²	0	65.4 Å²	65.4	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-57	-35.5	179.3	0	0	0	0	0	113.6	P292 W295 R328 M329 F330	P292-G326 CarbonylContact O-C 3.59Å; P292-G326 VanDerWaalsContact O-C 3.28Å; P292-G326 WeakPolarHBondContact O-CA 3.3Å; W295-G326 PolarHBondContact O-N 3.08Å; G326-R328 VanDerWaalsContact C-N 3.29Å; G326-R328 PolarHBondContact O-N 3.06Å; G326-M329 WeakPolarHBondContact O-CB 3.32Å; G326-M329 PolarHBondContact O-N 2.83Å; G326-M329 VanDerWaalsContact O-N 3.16Å; G326-F330 PolarHBondContact O-N 3.37Å
327	S	82.7	Confident	73.9	Confident	58 Å²	58	64 Å²	64	41%	0.406	33%	0.325	S	S	.	.	H	α-helix	trans	-56	-39.3	171	57.7	0	0	0	0	113.3	I293 P325 V331	I293-S327 PolarHBondContact O-N 2.87Å; P325-S327 PolarHBondContact O-N 3.15Å; S327-V331 WeakPolarHBondContact O-CG2 3.47Å
328	R	79.8	Confident	74.4	Confident	167 Å²	167	61.4 Å²	61.4	63%	0.63	31%	0.311	S	S	*	.	H	α-helix	trans	-75.7	-39.4	174.9	-168.2	171.8	-172.3	161.8	2.8	111.6	M324 P325 G326 F330 V331 L332	M324-R328 HydrophobicContact CB-CB 4.31Å; M324-R328 HydrophobicContact SD-CB 4.34Å; M324-R328 HydrophobicContact SD-CG 4.14Å; P325-R328 HydrophobicContact CG-CB 4.21Å; P325-R328 WeakPolarHBondContact O-CB 3.11Å; P325-R328 PolarHBondContact O-N 3.05Å; G326-R328 VanDerWaalsContact C-N 3.29Å; G326-R328 PolarHBondContact O-N 3.06Å; R328-F330 VanDerWaalsContact C-N 3.28Å; R328-F330 PolarHBondContact O-N 3.09Å; R328-V331 PolarHBondContact O-N 3.47Å; R328-L332 PolarHBondContact O-N 2.94Å
329	M	81.7	Confident	75	Confident	5 Å²	5	70.1 Å²	70.1	3%	0.025	34%	0.343	C	S	.	.	H	α-helix	trans	-57.2	-39.4	175	-177.6	-170.1	73.9	0	0	112.3	P292 W295 V300 W303 P325 G326 V331 L332 W337	P292-M329 HydrophobicContact CB-CE 3.92Å; W295-M329 HydrophobicContact CE3-CE 3.95Å; W295-M329 HydrophobicContact CZ3-CE 3.96Å; V300-M329 HydrophobicContact CG1-SD 3.85Å; V300-M329 HydrophobicContact CG2-SD 4.21Å; W303-M329 HydrophobicContact CE3-SD 3.64Å; W303-M329 HydrophobicContact CH2-SD 4.18Å; W303-M329 HydrophobicContact CZ3-CG 4.5Å; W303-M329 HydrophobicContact CZ3-SD 3.42Å; W303-M329 WeakPolarHBondContact CZ3-SD 3.37Å; P325-M329 PolarHBondContact O-N 3.43Å; P325-M329 VanDerWaalsContact O-N 3.09Å; G326-M329 WeakPolarHBondContact O-CB 3.32Å; G326-M329 PolarHBondContact O-N 2.83Å; G326-M329 VanDerWaalsContact O-N 3.16Å; M329-V331 VanDerWaalsContact C-N 3.33Å; M329-V331 PolarHBondContact O-N 2.95Å; M329-L332 WeakPolarHBondContact O-CB 3.41Å; M329-L332 PolarHBondContact O-N 3.12Å; M329-W337 HydrophobicContact CG-CH2 3.77Å; M329-W337 HydrophobicContact CG-CZ2 3.71Å; M329-W337 HydrophobicContact SD-CH2 4.45Å
330	F	78.2	Confident	75.8	Confident	47 Å²	47	68.3 Å²	68.3	21%	0.206	34%	0.336	C	S	.	.	H	α-helix	trans	-64.3	-35.9	178.1	-118.8	-85.4	0	0	0	113.2	P292 I293 G326 R328 K356	P292-F330 HydrophobicContact CB-CD2 4.26Å; P292-F330 HydrophobicContact CB-CE2 3.75Å; P292-F330 HydrophobicContact CG-CE2 4.03Å; I293-F330 HydrophobicContact CB-CD2 4.46Å; I293-F330 HydrophobicContact CD1-CD2 4.47Å; I293-F330 HydrophobicContact CD1-CE2 4.47Å; I293-F330 HydrophobicContact CG1-CB 4.41Å; I293-F330 HydrophobicContact CG1-CD1 4.34Å; I293-F330 HydrophobicContact CG1-CD2 3.44Å; I293-F330 VanDerWaalsContact CG1-CD2 3.44Å; I293-F330 HydrophobicContact CG1-CE2 3.63Å; I293-F330 HydrophobicContact CG1-CG 3.82Å; I293-F330 HydrophobicContact CG1-CZ 4.17Å; G326-F330 PolarHBondContact O-N 3.37Å; R328-F330 VanDerWaalsContact C-N 3.28Å; R328-F330 PolarHBondContact O-N 3.09Å; F330-K356 HydrophobicContact CD1-CG 4.23Å; F330-K356 HydrophobicContact CE1-CB 4.09Å; F330-K356 HydrophobicContact CE1-CG 3.88Å; F330-K356 HydrophobicContact CZ-CB 4.47Å; F330-K356 HydrophobicContact CZ-CG 4.34Å
331	V	81.1	Confident	76.5	Confident	117 Å²	117	59.1 Å²	59.1	71%	0.709	30%	0.296	S	S	*	.	H	α-helix	trans	-81.9	-14.5	-176.9	175.5	0	0	0	0	112.8	S327 R328 M329 T333	S327-V331 WeakPolarHBondContact O-CG2 3.47Å; R328-V331 PolarHBondContact O-N 3.47Å; M329-V331 VanDerWaalsContact C-N 3.33Å; M329-V331 PolarHBondContact O-N 2.95Å; V331-T333 PolarHBondContact O-N 3.48Å
332	L	77.4	Confident	76.9	Confident	19 Å²	19	60.3 Å²	60.3	10%	0.099	31%	0.308	C	S	.	.			trans	-55.8	127.5	178	-68.5	176.9	0	0	0	112.1	M324 R328 M329 D336 W337 L340	M324-L332 HydrophobicContact CE-CD1 4.34Å; M324-L332 HydrophobicContact SD-CD1 3.92Å; M324-L332 HydrophobicContact SD-CD2 4.31Å; M324-L332 HydrophobicContact SD-CG 4.36Å; R328-L332 PolarHBondContact O-N 2.94Å; M329-L332 WeakPolarHBondContact O-CB 3.41Å; M329-L332 PolarHBondContact O-N 3.12Å; L332-D336 HydrophobicContact CB-CB 4.23Å; L332-D336 HydrophobicContact CD2-CB 3.92Å; L332-W337 HydrophobicContact CB-CZ2 4.32Å; L332-W337 VanDerWaalsContact CB-NE1 3.28Å; L332-W337 HydrophobicContact CD1-CD2 4.38Å; L332-W337 HydrophobicContact CD1-CH2 4.15Å; L332-W337 HydrophobicContact CD1-CZ2 3.66Å; L332-W337 PolarHBondContact O-NE1 3.09Å; L332-L340 HydrophobicContact CD1-CD1 3.66Å; L332-L340 HydrophobicContact CD2-CD1 4.23Å
333	T	76.9	Confident	76.9	Confident	61 Å²	61	65.3 Å²	65.3	37%	0.374	34%	0.335	S	S	.	.			trans	-73.3	162.2	179.6	67.7	0	0	0	0	111.7	V331 D335 D336 W337	V331-T333 PolarHBondContact O-N 3.48Å; T333-D335 PolarHBondContact O-N 3.05Å; T333-D335 PolarHBondContact OG1-N 3.22Å; T333-D336 WeakPolarHBondContact CB-OD2 3.08Å; T333-D336 PolarHBondContact N-OD2 3.19Å; T333-D336 VanDerWaalsContact N-OD2 3.11Å; T333-D336 PolarHBondContact O-N 3.15Å; T333-D336 VanDerWaalsContact O-N 3.07Å; T333-D336 PolarHBondContact OG1-N 2.82Å; T333-D336 VanDerWaalsContact OG1-N 3.14Å; T333-D336 PolarHBondContact OG1-OD2 2.84Å; T333-W337 VanDerWaalsContact O-CD1 3.23Å; T333-W337 PolarHBondContact O-N 3.39Å
334	P	73.5	Confident	76.8	Confident	59 Å²	59	61.1 Å²	61.1	38%	0.383	32%	0.317	S	S	.	.	H	α-helix	trans	-46.8	-40.9	168.8	-32.9	39.7	0	0	0	113.8	I209 W337 R338	I209-P334 HydrophobicContact CD1-CG 4.44Å; I209-P334 HydrophobicContact CG1-CB 4.01Å; I209-P334 HydrophobicContact CG1-CG 4.01Å; I209-P334 HydrophobicContact CG2-CB 4.12Å; P334-W337 PolarHBondContact O-N 2.84Å; P334-R338 WeakPolarHBondContact O-CG 3.35Å; P334-R338 PolarHBondContact O-N 2.8Å
335	D	71.4	Confident	76.8	Confident	70 Å²	70	63.6 Å²	63.6	37%	0.374	33%	0.331	S	S	.	.	H	α-helix	trans	-72.1	-33.4	179.8	-64.4	-65.3	0	0	0	113.1	T333 R338 R339	T333-D335 PolarHBondContact O-N 3.05Å; T333-D335 PolarHBondContact OG1-N 3.22Å; D335-R338 PolarHBondContact O-N 3.24Å; D335-R339 WeakPolarHBondContact O-CD 3.41Å; D335-R339 WeakPolarHBondContact O-CG 3.46Å; D335-R339 PolarHBondContact O-N 3.45Å
336	D	79	Confident	76.8	Confident	44 Å²	44	64.1 Å²	64.1	24%	0.235	33%	0.332	C	S	.	.	H	α-helix	trans	-68.6	-39.5	172.8	-59.4	-49.6	0	0	0	111.4	L332 T333 R338 R339 L340	L332-D336 HydrophobicContact CB-CB 4.23Å; L332-D336 HydrophobicContact CD2-CB 3.92Å; T333-D336 WeakPolarHBondContact CB-OD2 3.08Å; T333-D336 PolarHBondContact N-OD2 3.19Å; T333-D336 VanDerWaalsContact N-OD2 3.11Å; T333-D336 PolarHBondContact O-N 3.15Å; T333-D336 VanDerWaalsContact O-N 3.07Å; T333-D336 PolarHBondContact OG1-N 2.82Å; T333-D336 VanDerWaalsContact OG1-N 3.14Å; T333-D336 PolarHBondContact OG1-OD2 2.84Å; D336-R338 VanDerWaalsContact C-N 3.34Å; D336-R338 PolarHBondContact O-N 3.22Å; D336-R339 PolarHBondContact O-N 3.25Å; D336-R339 IonicContact OD1-NH1 3.37Å; D336-R339 PolarHBondContact OD1-NH1 2.78Å; D336-L340 WeakPolarHBondContact O-CB 3.45Å; D336-L340 VanDerWaalsContact O-CG 3.28Å; D336-L340 WeakPolarHBondContact O-CG 3.45Å; D336-L340 PolarHBondContact O-N 3.46Å
337	W	75.5	Confident	76.8	Confident	5 Å²	5	68.3 Å²	68.3	2%	0.019	36%	0.355	C	S	.	.	H	α-helix	trans	-63.7	-38.7	173.2	-75.3	104.8	0	0	0	112.3	W303 F322 M329 L332 T333 P334 R339 L340 V341 F348 L352	W303-W337 AromaticContact CH2-CH2 3.91Å; W303-W337 HydrophobicContact CH2-CH2 3.91Å; W303-W337 HydrophobicContact CH2-CZ3 4.33Å; W303-W337 AromaticContact CZ3-CH2 3.96Å; W303-W337 HydrophobicContact CZ3-CH2 3.96Å; W303-W337 HydrophobicContact CZ3-CZ3 4.46Å; F322-W337 HydrophobicContact CE1-CE3 4.47Å; F322-W337 HydrophobicContact CE1-CH2 4.07Å; F322-W337 AromaticContact CE1-CZ3 3.67Å; F322-W337 HydrophobicContact CE1-CZ3 3.67Å; F322-W337 HydrophobicContact CZ-CZ3 4.1Å; M329-W337 HydrophobicContact CG-CH2 3.77Å; M329-W337 HydrophobicContact CG-CZ2 3.71Å; M329-W337 HydrophobicContact SD-CH2 4.45Å; L332-W337 HydrophobicContact CB-CZ2 4.32Å; L332-W337 VanDerWaalsContact CB-NE1 3.28Å; L332-W337 HydrophobicContact CD1-CD2 4.38Å; L332-W337 HydrophobicContact CD1-CH2 4.15Å; L332-W337 HydrophobicContact CD1-CZ2 3.66Å; L332-W337 PolarHBondContact O-NE1 3.09Å; T333-W337 VanDerWaalsContact O-CD1 3.23Å; T333-W337 PolarHBondContact O-N 3.39Å; P334-W337 PolarHBondContact O-N 2.84Å; W337-R339 VanDerWaalsContact C-N 3.31Å; W337-R339 PolarHBondContact O-N 2.61Å; W337-L340 PolarHBondContact O-N 3.23Å; W337-V341 HydrophobicContact CE3-CG2 4.13Å; W337-V341 HydrophobicContact CZ3-CG2 4.44Å; W337-V341 WeakPolarHBondContact O-CA 3.34Å; W337-V341 WeakPolarHBondContact O-CB 3.33Å; W337-V341 PolarHBondContact O-N 3.31Å; W337-F348 HydrophobicContact CE3-CE1 4.35Å; W337-F348 HydrophobicContact CZ3-CE1 4.5Å; W337-F348 HydrophobicContact CZ3-CZ 4.2Å; W337-L352 HydrophobicContact CD2-CD2 3.6Å; W337-L352 HydrophobicContact CE3-CD2 4.15Å; W337-L352 HydrophobicContact CG-CD2 3.83Å; W337-L352 HydrophobicContact CH2-CD1 3.98Å; W337-L352 HydrophobicContact CZ2-CD1 3.62Å; W337-L352 HydrophobicContact CZ2-CD2 4.04Å; W337-L352 HydrophobicContact CZ2-CG 4.49Å
338	R	71.8	Confident	76.9	Confident	99 Å²	99	65.6 Å²	65.6	37%	0.374	34%	0.336	S	S	.	.	H	α-helix	trans	-61.3	-36.4	171.6	-74.7	168.5	161.1	-111.4	-17.7	113	I209 A210 G212 P334 D335 D336	I209-R338 VanDerWaalsContact O-CZ 3.26Å; I209-R338 PolarHBondContact O-NE 3.31Å; I209-R338 PolarHBondContact O-NH2 3.27Å; A210-R338 PolarHBondContact O-NH2 3.48Å; G212-R338 VanDerWaalsContact CA-NH2 3.28Å; G212-R338 VanDerWaalsContact N-NH2 3.13Å; P334-R338 WeakPolarHBondContact O-CG 3.35Å; P334-R338 PolarHBondContact O-N 2.8Å; D335-R338 PolarHBondContact O-N 3.24Å; D336-R338 VanDerWaalsContact C-N 3.34Å; D336-R338 PolarHBondContact O-N 3.22Å
339	R	72.4	Confident	77.1	Confident	184 Å²	184	58 Å²	58	69%	0.694	31%	0.307	S	S	*	.	H	α-helix	trans	-74.3	-38.6	177.2	-69.9	161.4	-178.9	172.6	-0.9	112.8	D335 D336 W337	D335-R339 WeakPolarHBondContact O-CD 3.41Å; D335-R339 WeakPolarHBondContact O-CG 3.46Å; D335-R339 PolarHBondContact O-N 3.45Å; D336-R339 PolarHBondContact O-N 3.25Å; D336-R339 IonicContact OD1-NH1 3.37Å; D336-R339 PolarHBondContact OD1-NH1 2.78Å; W337-R339 VanDerWaalsContact C-N 3.31Å; W337-R339 PolarHBondContact O-N 2.61Å
340	L	75.4	Confident	77.3	Confident	29 Å²	29	57.9 Å²	57.9	15%	0.152	31%	0.307	C	S	.	.	H	α-helix	trans	-82.6	-29.4	-178.2	-68.1	167	0	0	0	113	L316 L321 F322 M324 L332 D336 W337	L316-L340 WeakPolarHBondContact CD2-O 3.49Å; L321-L340 HydrophobicContact CB-CD2 4.41Å; F322-L340 HydrophobicContact CE1-CB 4.3Å; F322-L340 HydrophobicContact CE1-CD1 4.07Å; F322-L340 HydrophobicContact CZ-CB 3.78Å; F322-L340 HydrophobicContact CZ-CD1 4.39Å; M324-L340 HydrophobicContact CE-CD1 4.24Å; L332-L340 HydrophobicContact CD1-CD1 3.66Å; L332-L340 HydrophobicContact CD2-CD1 4.23Å; D336-L340 WeakPolarHBondContact O-CB 3.45Å; D336-L340 VanDerWaalsContact O-CG 3.28Å; D336-L340 WeakPolarHBondContact O-CG 3.45Å; D336-L340 PolarHBondContact O-N 3.46Å; W337-L340 PolarHBondContact O-N 3.23Å
341	V	76.6	Confident	77.6	Confident	2 Å²	2	55.6 Å²	55.6	1%	0.012	30%	0.297	C	S	.	.			trans	-133.3	76.3	-178	-171.1	0	0	0	0	109.4	I313 L316 F322 W337 N343 A344 F348	I313-V341 HydrophobicContact CD1-CG1 4.11Å; I313-V341 HydrophobicContact CG2-CG1 4.12Å; L316-V341 HydrophobicContact CD1-CB 4.23Å; L316-V341 HydrophobicContact CD1-CG1 3.91Å; L316-V341 HydrophobicContact CD1-CG2 3.88Å; F322-V341 HydrophobicContact CZ-CG2 3.93Å; W337-V341 HydrophobicContact CE3-CG2 4.13Å; W337-V341 HydrophobicContact CZ3-CG2 4.44Å; W337-V341 WeakPolarHBondContact O-CA 3.34Å; W337-V341 WeakPolarHBondContact O-CB 3.33Å; W337-V341 PolarHBondContact O-N 3.31Å; V341-N343 PolarHBondContact O-N 3.46Å; V341-A344 HydrophobicContact CB-CB 4.27Å; V341-A344 HydrophobicContact CG1-CB 3.76Å; V341-A344 WeakPolarHBondContact O-CB 3.44Å; V341-A344 PolarHBondContact O-N 2.92Å; V341-F348 HydrophobicContact CB-CE1 4.4Å; V341-F348 HydrophobicContact CG1-CD1 4.32Å; V341-F348 HydrophobicContact CG1-CE1 4.05Å; V341-F348 HydrophobicContact CG2-CE1 4.12Å; V341-F348 HydrophobicContact CG2-CZ 4.4Å
342	P	70.5	Confident	77.8	Confident	97 Å²	97	50.4 Å²	50.4	63%	0.63	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-28.4	-179.3	-25	35.7	0	0	0	113.8	A344	P342-A344 PolarHBondContact O-N 2.82Å
343	N	71.7	Confident	78.1	Confident	106 Å²	106	50.8 Å²	50.8	57%	0.567	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.5	37.5	-179.3	-60.9	-18.1	0	0	0	112	I313 V341 N345	I313-N343 HydrophobicContact CG2-CB 4.41Å; V341-N343 PolarHBondContact O-N 3.46Å; N343-N345 PolarHBondContact O-N 3.46Å; N343-N345 VanDerWaalsContact O-N 3.14Å
344	A	73.8	Confident	78.6	Confident	31 Å²	31	47.9 Å²	47.9	26%	0.256	25%	0.249	S	C	.	.			trans	-71.1	104.7	-177.5	0	0	0	0	0	112.1	V341 P342 F348 L349	V341-A344 HydrophobicContact CB-CB 4.27Å; V341-A344 HydrophobicContact CG1-CB 3.76Å; V341-A344 WeakPolarHBondContact O-CB 3.44Å; V341-A344 PolarHBondContact O-N 2.92Å; P342-A344 PolarHBondContact O-N 2.82Å; A344-F348 HydrophobicContact CB-CD1 4.22Å; A344-L349 HydrophobicContact CB-CD1 4.38Å; A344-L349 HydrophobicContact CB-CD2 4.08Å; A344-L349 HydrophobicContact CB-CG 4.16Å
345	N	79.7	Confident	79.2	Confident	77 Å²	77	45.2 Å²	45.2	41%	0.412	23%	0.231	S	C	.	.			trans	-60.6	145.1	169	-74.7	-38.2	0	0	0	110.8	F311 N343 N347 F348 L349	F311-N345 PolarHBondContact O-ND2 2.77Å; N343-N345 PolarHBondContact O-N 3.46Å; N343-N345 VanDerWaalsContact O-N 3.14Å; N345-N347 PolarHBondContact O-N 3.2Å; N345-N347 VanDerWaalsContact O-N 3.15Å; N345-F348 WeakPolarHBondContact O-CA 3.48Å; N345-F348 WeakPolarHBondContact O-CB 3.34Å; N345-F348 PolarHBondContact O-N 3.49Å; N345-L349 PolarHBondContact O-N 2.91Å
346	V	81.2	Confident	79.7	Confident	69 Å²	69	44.6 Å²	44.6	42%	0.418	23%	0.225	S	C	.	.	H	α-helix	trans	-53.7	-38.9	175.8	-178.7	0	0	0	0	111.1	A206 A210 F348 L349 T350	A206-V346 HydrophobicContact CB-CG1 4.3Å; A210-V346 HydrophobicContact CB-CG2 4.16Å; V346-F348 VanDerWaalsContact C-N 3.26Å; V346-F348 PolarHBondContact O-N 2.94Å; V346-L349 PolarHBondContact O-N 2.98Å; V346-L349 VanDerWaalsContact O-N 3.08Å; V346-T350 HydrophobicContact CG1-CG2 4.35Å; V346-T350 PolarHBondContact O-N 2.78Å; V346-T350 PolarHBondContact O-OG1 3.07Å
347	N	82.9	Confident	79.7	Confident	89 Å²	89	47.6 Å²	47.6	48%	0.476	23%	0.233	S	C	.	.	H	α-helix	trans	-60.3	-29	174.9	-68.9	-22.3	0	0	0	114.1	W273 F311 N345 T350 H351	W273-N347 WeakPolarHBondContact CH2-O 3.46Å; F311-N347 HydrophobicContact CD1-CB 3.94Å; F311-N347 HydrophobicContact CE1-CB 4.23Å; F311-N347 WeakPolarHBondContact CE1-O 3.35Å; N345-N347 PolarHBondContact O-N 3.2Å; N345-N347 VanDerWaalsContact O-N 3.15Å; N347-T350 VanDerWaalsContact CA-OG1 3.3Å; N347-T350 WeakPolarHBondContact CA-OG1 3.42Å; N347-T350 PolarHBondContact O-OG1 2.81Å; N347-H351 VanDerWaalsContact O-CB 3.32Å; N347-H351 WeakPolarHBondContact O-CB 3.5Å; N347-H351 PolarHBondContact O-N 3.5Å; N347-H351 VanDerWaalsContact O-N 3.12Å
348	F	85.2	Confident	79.7	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-77.8	-37.1	173.6	172.1	-100.9	0	0	0	111.5	W303 I304 A307 F311 I313 W337 V341 A344 N345 V346 H351 L352	W303-F348 HydrophobicContact CH2-CE2 4.37Å; W303-F348 HydrophobicContact CH2-CZ 4.3Å; W303-F348 HydrophobicContact CZ2-CE2 4.45Å; I304-F348 HydrophobicContact CD1-CE2 4.03Å; I304-F348 HydrophobicContact CD1-CZ 3.84Å; A307-F348 HydrophobicContact CB-CD2 4.31Å; A307-F348 HydrophobicContact CB-CE2 3.92Å; F311-F348 HydrophobicContact CB-CB 4.06Å; F311-F348 HydrophobicContact CD2-CB 4.4Å; F311-F348 AromaticContact CD2-CD2 3.94Å; F311-F348 HydrophobicContact CD2-CD2 3.94Å; F311-F348 HydrophobicContact CG-CB 4.1Å; F311-F348 HydrophobicContact CG-CD2 4.41Å; I313-F348 HydrophobicContact CD1-CB 3.83Å; I313-F348 HydrophobicContact CD1-CD1 3.94Å; I313-F348 HydrophobicContact CD1-CD2 3.62Å; I313-F348 HydrophobicContact CD1-CE1 4.42Å; I313-F348 HydrophobicContact CD1-CE2 4.14Å; I313-F348 HydrophobicContact CD1-CG 3.5Å; W337-F348 HydrophobicContact CE3-CE1 4.35Å; W337-F348 HydrophobicContact CZ3-CE1 4.5Å; W337-F348 HydrophobicContact CZ3-CZ 4.2Å; V341-F348 HydrophobicContact CB-CE1 4.4Å; V341-F348 HydrophobicContact CG1-CD1 4.32Å; V341-F348 HydrophobicContact CG1-CE1 4.05Å; V341-F348 HydrophobicContact CG2-CE1 4.12Å; V341-F348 HydrophobicContact CG2-CZ 4.4Å; A344-F348 HydrophobicContact CB-CD1 4.22Å; N345-F348 WeakPolarHBondContact O-CA 3.48Å; N345-F348 WeakPolarHBondContact O-CB 3.34Å; N345-F348 PolarHBondContact O-N 3.49Å; V346-F348 VanDerWaalsContact C-N 3.26Å; V346-F348 PolarHBondContact O-N 2.94Å; F348-H351 WeakPolarHBondContact O-CB 3.45Å; F348-H351 PolarHBondContact O-N 3.17Å; F348-L352 WeakPolarHBondContact O-CB 2.95Å; F348-L352 PolarHBondContact O-N 2.95Å
349	L	83.9	Confident	80	Confident	7 Å²	7	50.4 Å²	50.4	4%	0.037	25%	0.249	C	C	.	.	H	α-helix	trans	-68	-39	175.4	-63.6	174.8	0	0	0	111.7	A206 I209 A210 A344 N345 V346 L352 E353	A206-L349 HydrophobicContact CB-CB 3.68Å; I209-L349 HydrophobicContact CB-CD1 4.3Å; I209-L349 HydrophobicContact CG2-CD1 3.91Å; I209-L349 HydrophobicContact CG2-CD2 3.84Å; I209-L349 HydrophobicContact CG2-CG 4.43Å; A210-L349 HydrophobicContact CB-CD1 4.04Å; A344-L349 HydrophobicContact CB-CD1 4.38Å; A344-L349 HydrophobicContact CB-CD2 4.08Å; A344-L349 HydrophobicContact CB-CG 4.16Å; N345-L349 PolarHBondContact O-N 2.91Å; V346-L349 PolarHBondContact O-N 2.98Å; V346-L349 VanDerWaalsContact O-N 3.08Å; L349-L352 PolarHBondContact O-N 2.86Å; L349-E353 PolarHBondContact O-N 3.49Å
350	T	84.3	Confident	80.3	Confident	3 Å²	3	44.2 Å²	44.2	2%	0.018	23%	0.23	C	C	.	.	H	α-helix	trans	-66.7	-37.1	171.3	54	0	0	0	0	111.9	V203 A206 W273 V346 N347 E353 L354	V203-T350 HydrophobicContact CB-CG2 4.38Å; V203-T350 HydrophobicContact CG2-CG2 3.94Å; A206-T350 HydrophobicContact CB-CG2 3.36Å; W273-T350 WeakPolarHBondContact CH2-OG1 3.19Å; W273-T350 WeakPolarHBondContact CZ2-OG1 3.36Å; V346-T350 HydrophobicContact CG1-CG2 4.35Å; V346-T350 PolarHBondContact O-N 2.78Å; V346-T350 PolarHBondContact O-OG1 3.07Å; N347-T350 VanDerWaalsContact CA-OG1 3.3Å; N347-T350 WeakPolarHBondContact CA-OG1 3.42Å; N347-T350 PolarHBondContact O-OG1 2.81Å; T350-E353 PolarHBondContact O-N 3.37Å; T350-L354 WeakPolarHBondContact O-CB 3.37Å; T350-L354 VanDerWaalsContact O-CG 3.24Å; T350-L354 WeakPolarHBondContact O-CG 3.37Å; T350-L354 PolarHBondContact O-N 3.01Å
351	H	85.6	Confident	80.6	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-60.9	-47.5	172.7	169.8	72.6	0	0	0	111.6	W273 W303 W306 F311 N347 F348 E353 L354 L355 C362	W273-H351 HydrophobicContact CH2-CB 4.3Å; W273-H351 HydrophobicContact CZ3-CB 4.1Å; W303-H351 AromaticContact CE2-NE2 3.78Å; W303-H351 AromaticContact CZ2-CD2 4Å; W303-H351 AromaticContact CZ2-NE2 3.8Å; W303-H351 AromaticContact NE1-NE2 3.16Å; W303-H351 PolarHBondContact NE1-NE2 3.49Å; W303-H351 VanDerWaalsContact NE1-NE2 3.16Å; W306-H351 AromaticContact CH2-CE1 3.99Å; W306-H351 AromaticContact CZ3-CE1 3.74Å; W306-H351 AromaticContact CZ3-NE2 3.79Å; F311-H351 HydrophobicContact CE1-CB 4.1Å; F311-H351 HydrophobicContact CE2-CB 3.66Å; F311-H351 AromaticContact CE2-CD2 3.76Å; F311-H351 AromaticContact CE2-CG 3.42Å; F311-H351 VanDerWaalsContact CE2-CG 3.42Å; F311-H351 AromaticContact CE2-ND1 3.85Å; F311-H351 HydrophobicContact CZ-CB 3.4Å; F311-H351 AromaticContact CZ-CG 3.52Å; F311-H351 AromaticContact CZ-ND1 3.8Å; N347-H351 VanDerWaalsContact O-CB 3.32Å; N347-H351 WeakPolarHBondContact O-CB 3.5Å; N347-H351 PolarHBondContact O-N 3.5Å; N347-H351 VanDerWaalsContact O-N 3.12Å; F348-H351 WeakPolarHBondContact O-CB 3.45Å; F348-H351 PolarHBondContact O-N 3.17Å; H351-E353 VanDerWaalsContact C-N 3.34Å; H351-E353 PolarHBondContact O-N 2.96Å; H351-L354 PolarHBondContact O-N 2.78Å; H351-L355 WeakPolarHBondContact O-CB 3.4Å; H351-L355 PolarHBondContact O-N 3.23Å; H351-C362 PolarHBondContact ND1-O 3.37Å
352	L	85.6	Confident	81	Confident	7 Å²	7	43.1 Å²	43.1	4%	0.037	22%	0.224	C	C	.	.	H	α-helix	trans	-60.2	-42.4	177.1	176.5	66.6	0	0	0	111.8	W303 W337 F348 L349 L355 K356	W303-L352 HydrophobicContact CH2-CD1 4.17Å; W337-L352 HydrophobicContact CD2-CD2 3.6Å; W337-L352 HydrophobicContact CE3-CD2 4.15Å; W337-L352 HydrophobicContact CG-CD2 3.83Å; W337-L352 HydrophobicContact CH2-CD1 3.98Å; W337-L352 HydrophobicContact CZ2-CD1 3.62Å; W337-L352 HydrophobicContact CZ2-CD2 4.04Å; W337-L352 HydrophobicContact CZ2-CG 4.49Å; F348-L352 WeakPolarHBondContact O-CB 2.95Å; F348-L352 PolarHBondContact O-N 2.95Å; L349-L352 PolarHBondContact O-N 2.86Å; L352-L355 WeakPolarHBondContact O-CB 3.36Å; L352-L355 PolarHBondContact O-N 2.92Å; L352-K356 WeakPolarHBondContact O-CG 3.25Å; L352-K356 PolarHBondContact O-N 3.19Å
353	E	84.2	Confident	81.4	Confident	27 Å²	27	39.6 Å²	39.6	13%	0.126	20%	0.201	C	C	.	.	H	α-helix	trans	-74.4	-32.9	179.8	-165.5	59.8	-159.9	0	0	112.6	A202 A205 L349 T350 H351 L355 K356 R357	A202-E353 HydrophobicContact CB-CB 4.23Å; A202-E353 HydrophobicContact CB-CG 4.26Å; A205-E353 HydrophobicContact CB-CG 4.16Å; L349-E353 PolarHBondContact O-N 3.49Å; T350-E353 PolarHBondContact O-N 3.37Å; H351-E353 VanDerWaalsContact C-N 3.34Å; H351-E353 PolarHBondContact O-N 2.96Å; E353-L355 VanDerWaalsContact C-N 3.35Å; E353-K356 PolarHBondContact O-N 2.82Å; E353-K356 WeakPolarHBondContact OE2-CD 3.37Å; E353-R357 WeakPolarHBondContact O-CB 3.47Å; E353-R357 VanDerWaalsContact O-CG 3.31Å; E353-R357 WeakPolarHBondContact O-CG 3.21Å; E353-R357 PolarHBondContact O-N 3.07Å; E353-R357 IonicContact OE1-CZ 2.75Å; E353-R357 IonicContact OE1-NE 3.15Å; E353-R357 PolarHBondContact OE1-NE 2.83Å; E353-R357 IonicContact OE1-NH2 2.71Å; E353-R357 PolarHBondContact OE1-NH2 2.94Å
354	L	86.3	Confident	81.7	Confident	1 Å²	1	36.9 Å²	36.9	1%	0.005	19%	0.189	C	C	.	.	H	α-helix	trans	-67.5	-34.3	168	-72.2	171.7	0	0	0	111.9	I194 T198 A202 W273 T350 H351 R357 C358 C362	I194-L354 HydrophobicContact CD1-CD1 4.03Å; I194-L354 HydrophobicContact CD1-CD2 4.01Å; I194-L354 HydrophobicContact CD1-CG 4.5Å; I194-L354 HydrophobicContact CG2-CD2 4.25Å; T198-L354 HydrophobicContact CG2-CD2 4.22Å; A202-L354 HydrophobicContact CB-CD2 3.85Å; A202-L354 HydrophobicContact CB-CG 3.84Å; W273-L354 HydrophobicContact CB-CD1 4.03Å; W273-L354 HydrophobicContact CD2-CD1 3.42Å; W273-L354 VanDerWaalsContact CD2-CD1 3.42Å; W273-L354 HydrophobicContact CE3-CD1 3.43Å; W273-L354 VanDerWaalsContact CE3-CD1 3.43Å; W273-L354 HydrophobicContact CG-CD1 3.67Å; W273-L354 HydrophobicContact CZ3-CD1 4.12Å; T350-L354 WeakPolarHBondContact O-CB 3.37Å; T350-L354 VanDerWaalsContact O-CG 3.24Å; T350-L354 WeakPolarHBondContact O-CG 3.37Å; T350-L354 PolarHBondContact O-N 3.01Å; H351-L354 PolarHBondContact O-N 2.78Å; L354-R357 PolarHBondContact O-N 3.45Å; L354-C358 WeakPolarHBondContact O-CA 3.22Å; L354-C358 VanDerWaalsContact O-CB 3.23Å; L354-C358 WeakPolarHBondContact O-CB 3.39Å; L354-C358 PolarHBondContact O-N 3.37Å; L354-C362 HydrophobicContact CB-CB 4.31Å; L354-C362 HydrophobicContact CD1-CB 4.24Å
355	L	85.5	Confident	81.6	Confident	3 Å²	3	40.3 Å²	40.3	2%	0.016	20%	0.196	C	C	.	.	H	α-helix	trans	-65.2	-41.6	173.3	-174.7	62.7	0	0	0	111	P292 W295 W303 H351 L352 E353 R359 V361	P292-L355 HydrophobicContact CB-CD1 4.48Å; P292-L355 HydrophobicContact CB-CG 4.46Å; P292-L355 HydrophobicContact CG-CD1 3.51Å; P292-L355 HydrophobicContact CG-CD2 4.4Å; P292-L355 HydrophobicContact CG-CG 3.82Å; W295-L355 HydrophobicContact CH2-CD1 4.29Å; W295-L355 HydrophobicContact CH2-CD2 4.19Å; W295-L355 HydrophobicContact CZ3-CD2 4.42Å; W303-L355 HydrophobicContact CD2-CD2 4.45Å; W303-L355 HydrophobicContact CH2-CD2 4.45Å; W303-L355 HydrophobicContact CZ2-CD2 3.63Å; H351-L355 WeakPolarHBondContact O-CB 3.4Å; H351-L355 PolarHBondContact O-N 3.23Å; L352-L355 WeakPolarHBondContact O-CB 3.36Å; L352-L355 PolarHBondContact O-N 2.92Å; E353-L355 VanDerWaalsContact C-N 3.35Å; L355-R359 WeakPolarHBondContact O-CA 3.35Å; L355-R359 PolarHBondContact O-N 3.38Å; L355-V361 HydrophobicContact CD1-CG2 3.79Å
356	K	83.1	Confident	80.6	Confident	56 Å²	56	41.6 Å²	41.6	24%	0.243	21%	0.21	C	C	.	.	H	α-helix	trans	-63.6	-44.8	173	-74.9	-179.7	171.9	-173.4	0	112.7	F330 L352 E353	F330-K356 HydrophobicContact CD1-CG 4.23Å; F330-K356 HydrophobicContact CE1-CB 4.09Å; F330-K356 HydrophobicContact CE1-CG 3.88Å; F330-K356 HydrophobicContact CZ-CB 4.47Å; F330-K356 HydrophobicContact CZ-CG 4.34Å; L352-K356 WeakPolarHBondContact O-CG 3.25Å; L352-K356 PolarHBondContact O-N 3.19Å; E353-K356 PolarHBondContact O-N 2.82Å; E353-K356 WeakPolarHBondContact OE2-CD 3.37Å
357	R	78.5	Confident	79	Confident	107 Å²	107	42.4 Å²	42.4	40%	0.404	22%	0.217	S	C	.	.	H	α-helix	trans	-86.2	-37.3	-172.6	-68.7	177.8	-172	174.5	5.1	114.9	A201 E353 L354	A201-R357 VanDerWaalsContact CB-NH1 3.31Å; A201-R357 PolarHBondContact O-NH1 3.42Å; E353-R357 WeakPolarHBondContact O-CB 3.47Å; E353-R357 VanDerWaalsContact O-CG 3.31Å; E353-R357 WeakPolarHBondContact O-CG 3.21Å; E353-R357 PolarHBondContact O-N 3.07Å; E353-R357 IonicContact OE1-CZ 2.75Å; E353-R357 IonicContact OE1-NE 3.15Å; E353-R357 PolarHBondContact OE1-NE 2.83Å; E353-R357 IonicContact OE1-NH2 2.71Å; E353-R357 PolarHBondContact OE1-NH2 2.94Å; L354-R357 PolarHBondContact O-N 3.45Å
358	C	75.9	Confident	76.7	Confident	37 Å²	37	46 Å²	46	25%	0.25	23%	0.23	C	C	.	.	H	α-helix	trans	-103.7	-5.1	-174.7	-57.7	0	0	0	0	113.6	L354 N360	L354-C358 WeakPolarHBondContact O-CA 3.22Å; L354-C358 VanDerWaalsContact O-CB 3.23Å; L354-C358 WeakPolarHBondContact O-CB 3.39Å; L354-C358 PolarHBondContact O-N 3.37Å; C358-N360 HydrophobicContact CB-CB 4.4Å; C358-N360 PolarHBondContact O-N 3.25Å; C358-N360 PolarHBondContact O-ND2 3.3Å
359	R	78.5	Confident	74.3	Confident	127 Å²	127	51.1 Å²	51.1	48%	0.479	26%	0.264	S	S	.	.	S	Bend	trans	45.8	34.2	-172.3	-52.7	-168.1	-168.5	162.9	4.4	113	D291 L355	D291-R359 WeakPolarHBondContact OD1-CD 3.44Å; D291-R359 VanDerWaalsContact OD2-CD 3.27Å; D291-R359 WeakPolarHBondContact OD2-CD 3.36Å; D291-R359 IonicContact OD2-CZ 3.57Å; D291-R359 IonicContact OD2-NE 2.73Å; D291-R359 IonicContact OD2-NH1 3.75Å; D291-R359 PolarHBondContact OD2-NH1 3Å; L355-R359 WeakPolarHBondContact O-CA 3.35Å; L355-R359 PolarHBondContact O-N 3.38Å
360	N	77.1	Confident	71.9	Confident	53 Å²	53	56.5 Å²	56.5	28%	0.283	30%	0.299	S	S	.	.	S	Bend	trans	-134.7	142.9	-178.1	-87.3	-93.7	0	0	0	108.5	R280 C358 C362	R280-N360 PolarHBondContact NH2-OD1 3.29Å; C358-N360 HydrophobicContact CB-CB 4.4Å; C358-N360 PolarHBondContact O-N 3.25Å; C358-N360 PolarHBondContact O-ND2 3.3Å; N360-C362 PolarHBondContact O-N 3.44Å; N360-C362 PolarHBondContact O-SG 2.77Å; N360-C362 VanDerWaalsContact O-SG 3.35Å
361	V	81.7	Confident	69.8	Low	8 Å²	8	65.4 Å²	65.4	5%	0.048	34%	0.341	C	S	.	.			trans	-78.9	113.2	170.8	171.5	0	0	0	0	107.9	D276 Y279 M283 W295 W306 L355	D276-V361 PolarHBondContact N-O 2.55Å; Y279-V361 HydrophobicContact CD1-CB 3.74Å; Y279-V361 HydrophobicContact CD1-CG1 3.63Å; Y279-V361 HydrophobicContact CD1-CG2 3.6Å; Y279-V361 HydrophobicContact CE1-CB 4.36Å; Y279-V361 HydrophobicContact CE1-CG1 4.36Å; Y279-V361 HydrophobicContact CE1-CG2 3.7Å; Y279-V361 HydrophobicContact CG-CB 4.36Å; Y279-V361 HydrophobicContact CG-CG1 3.78Å; M283-V361 HydrophobicContact SD-CG2 4.26Å; W295-V361 HydrophobicContact CH2-CG2 4.31Å; W306-V361 HydrophobicContact CE3-CG1 4.24Å; W306-V361 HydrophobicContact CH2-CG1 3.17Å; W306-V361 HydrophobicContact CZ2-CG1 3.76Å; W306-V361 HydrophobicContact CZ3-CG1 3.45Å; W306-V361 VanDerWaalsContact CZ3-CG1 3.45Å; L355-V361 HydrophobicContact CD1-CG2 3.79Å
362	C	85	Confident	67.4	Low	1 Å²	1	74.2 Å²	74.2	1%	0.007	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	148.2	-171	-59.6	0	0	0	0	112.3	I194 W273 V274 H351 L354 N360	I194-C362 HydrophobicContact CD1-CB 3.76Å; I194-C362 WeakPolarHBondContact CD1-SG 3.4Å; W273-C362 HydrophobicContact CE3-CB 4.12Å; W273-C362 WeakPolarHBondContact CZ3-O 3.29Å; V274-C362 CarbonylContact O-C 3.53Å; V274-C362 WeakPolarHBondContact O-CA 3.22Å; H351-C362 PolarHBondContact ND1-O 3.37Å; L354-C362 HydrophobicContact CB-CB 4.31Å; L354-C362 HydrophobicContact CD1-CB 4.24Å; N360-C362 PolarHBondContact O-N 3.44Å; N360-C362 PolarHBondContact O-SG 2.77Å; N360-C362 VanDerWaalsContact O-SG 3.35Å
363	V	80.1	Confident	64.9	Low	22 Å²	22	78.2 Å²	78.2	13%	0.133	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	155.9	-179.4	-68.6	0	0	0	0	111.9	V274 D276 W306	V274-V363 HydrophobicContact CG2-CG2 4.12Å; V274-V363 PolarHBondContact N-O 2.98Å; V274-V363 PolarHBondContact O-N 2.58Å; D276-V363 HydrophobicContact CB-CG1 4.05Å; D276-V363 HydrophobicContact CB-CG2 3.94Å; W306-V363 HydrophobicContact CH2-CG1 4.03Å; W306-V363 HydrophobicContact CZ2-CG1 4.12Å
364	P	77.8	Confident	62.6	Low	49 Å²	49	80.1 Å²	80.1	32%	0.318	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.7	134.5	169.6	-19.3	32	0	0	0	111.2	W273 C366	W273-P364 HydrophobicContact CE3-CG 4.48Å; W273-P364 HydrophobicContact CH2-CG 3.68Å; W273-P364 HydrophobicContact CZ2-CG 3.77Å; W273-P364 HydrophobicContact CZ3-CG 4.08Å; P364-C366 PolarHBondContact O-N 3.41Å
365	Y	72	Confident	60.4	Low	103 Å²	103	85.1 Å²	85.1	40%	0.404	46%	0.461	S	S	.	.			trans	-72.9	106.3	178.3	176.6	-99.8	0	0	0	111	P191 R272 V274 P367	P191-Y365 HydrophobicContact CG-CE2 4.3Å; R272-Y365 WeakPolarHBondContact O-CB 3.19Å; R272-Y365 PolarHBondContact O-N 3.17Å; V274-Y365 HydrophobicContact CG1-CD2 4.05Å; V274-Y365 HydrophobicContact CG2-CD2 4.4Å; Y365-P367 HydrophobicContact CE1-CB 3.97Å
366	C	58	Low	58.3	Low	104 Å²	104	92.1 Å²	92.1	70%	0.703	49%	0.494	S	S	*	.	P	Polyproline II helix	trans	-91.7	117.3	165.3	-171.6	0	0	0	0	109.6	P364 Q368	P364-C366 PolarHBondContact O-N 3.41Å; C366-Q368 PolarHBondContact O-N 2.91Å
367	P	47.7	Very low	56	Low	86 Å²	86	93.8 Å²	93.8	56%	0.558	51%	0.513	S	S	*	.	P	Polyproline II helix	trans	-65.4	127.2	173	26.7	-32.7	0	0	0	110.1	Y365	Y365-P367 HydrophobicContact CE1-CB 3.97Å
368	Q	35.3	Very low	54.3	Low	164 Å²	164	94.7 Å²	94.7	77%	0.766	52%	0.521	S	S	*	.	P	Polyproline II helix	trans	-73.4	139.3	174.3	-69.3	-172.6	-7.1	0	0	110.6	C366	C366-Q368 PolarHBondContact O-N 2.91Å
369	P	33.9	Very low	52.6	Low	109 Å²	109	100.1 Å²	100.1	71%	0.708	54%	0.541	S	S	*	.	P	Polyproline II helix	trans	-64.5	141.3	174.9	27.5	-34.2	0	0	0	110.5	Q371	P369-Q371 PolarHBondContact O-N 3.32Å
370	P	34.8	Very low	50.5	Low	120 Å²	120	99.2 Å²	99.2	78%	0.779	55%	0.545	S	S	*	.	P	Polyproline II helix	trans	-65.7	118.2	-175.9	25.9	-34	0	0	0	111.1	Q372	P370-Q372 PolarHBondContact O-N 2.59Å
371	Q	39	Very low	48.4	Very low	189 Å²	189	105.7 Å²	105.7	88%	0.883	57%	0.567	S	S	*	*			trans	-63.8	104.4	175.7	-68.7	-170.4	-2.8	0	0	110.5	P369	P369-Q371 PolarHBondContact O-N 3.32Å
372	Q	36	Very low	46.5	Very low	186 Å²	186	114.5 Å²	114.5	87%	0.869	60%	0.599	S	S	*	*			trans	-63.7	142.4	172.4	-67.3	-173.3	-2.7	0	0	110.4	P370 A374	P370-Q372 PolarHBondContact O-N 2.59Å; Q372-A374 PolarHBondContact O-N 3.17Å
373	S	31.9	Very low	44.5	Very low	90 Å²	90	120.7 Å²	120.7	63%	0.629	63%	0.628	S	S	*	*			trans	-68.5	102.1	-164.6	38.4	0	0	0	0	113.4	T375	S373-T375 PolarHBondContact O-N 2.92Å
374	A	35.5	Very low	42.4	Very low	67 Å²	67	126 Å²	126	55%	0.554	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.7	9.6	179.8	0	0	0	0	0	115.9	Q372	Q372-A374 PolarHBondContact O-N 3.17Å
375	T	41.7	Very low	40.6	Very low	106 Å²	106	128.4 Å²	128.4	65%	0.65	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84	-16.4	-176.1	44.3	0	0	0	0	114.6	S373	S373-T375 PolarHBondContact O-N 2.92Å
376	Q	40.5	Very low	39.1	Very low	150 Å²	150	134.7 Å²	134.7	70%	0.701	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.2	-47.1	-179.7	-158.3	162.7	8.2	0	0	112.3	Q378 K379	Q376-Q378 VanDerWaalsContact C-N 3.27Å; Q376-Q378 PolarHBondContact O-N 3.19Å; Q376-K379 PolarHBondContact O-N 3.27Å; Q376-K379 VanDerWaalsContact O-N 3.09Å
377	S	36	Very low	38	Very low	91 Å²	91	134.7 Å²	134.7	64%	0.636	70%	0.695	S	S	*	*	H	α-helix	trans	-60.5	-33.2	-178.8	-45.2	0	0	0	0	113.4	K379 Y381	S377-K379 VanDerWaalsContact C-N 3.3Å; S377-K379 PolarHBondContact O-N 3.43Å; S377-Y381 PolarHBondContact O-N 3.01Å
378	Q	42	Very low	37.4	Very low	126 Å²	126	141 Å²	141	59%	0.589	71%	0.708	S	S	*	*	H	α-helix	trans	-70.6	-19.8	178.5	-65.4	-169.7	18	0	0	114.1	Q376 R382	Q376-Q378 VanDerWaalsContact C-N 3.27Å; Q376-Q378 PolarHBondContact O-N 3.19Å; Q378-R382 WeakPolarHBondContact O-CG 3.3Å
379	K	40.2	Very low	37.3	Very low	152 Å²	152	143.1 Å²	143.1	66%	0.661	72%	0.715	S	S	*	*	H	α-helix	trans	-76.3	-49.6	174.9	-76.9	-176	174.7	179.1	0	111.5	Q376 S377 Y381 R382 Q383	Q376-K379 PolarHBondContact O-N 3.27Å; Q376-K379 VanDerWaalsContact O-N 3.09Å; S377-K379 VanDerWaalsContact C-N 3.3Å; S377-K379 PolarHBondContact O-N 3.43Å; K379-Y381 PolarHBondContact O-N 3.38Å; K379-R382 PolarHBondContact O-N 2.81Å; K379-Q383 PolarHBondContact O-N 3.19Å; K379-Q383 VanDerWaalsContact O-N 3.13Å
380	L	34.5	Very low	37	Very low	107 Å²	107	149.5 Å²	149.5	56%	0.56	73%	0.725	S	S	*	*	H	α-helix	trans	-62.8	-43	-179	-74.9	169.1	0	0	0	112.4	R382 Q383 M384	L380-R382 VanDerWaalsContact C-N 3.26Å; L380-R382 PolarHBondContact O-N 3.34Å; L380-Q383 PolarHBondContact O-N 3Å; L380-Q383 VanDerWaalsContact O-N 3.1Å; L380-M384 PolarHBondContact O-N 3.31Å
381	Y	32.2	Very low	36.8	Very low	190 Å²	190	149.7 Å²	149.7	75%	0.745	73%	0.729	S	S	*	*	H	α-helix	trans	-63.8	-31.4	178.1	-148	-96.1	0	0	0	112.6	S377 K379 S385	S377-Y381 PolarHBondContact O-N 3.01Å; K379-Y381 PolarHBondContact O-N 3.38Å; Y381-S385 PolarHBondContact O-N 3.08Å
382	R	41.4	Very low	36.5	Very low	192 Å²	192	146.5 Å²	146.5	73%	0.725	73%	0.727	S	S	*	*	H	α-helix	trans	-76.1	-23.5	174.5	-79.3	-178.9	166.6	-173.8	-1.3	114	Q378 K379 L380	Q378-R382 WeakPolarHBondContact O-CG 3.3Å; K379-R382 PolarHBondContact O-N 2.81Å; L380-R382 VanDerWaalsContact C-N 3.26Å; L380-R382 PolarHBondContact O-N 3.34Å
383	Q	44.6	Very low	36.2	Very low	131 Å²	131	148.6 Å²	148.6	61%	0.612	73%	0.727	S	S	*	*	H	α-helix	trans	-80.5	-45.2	172.7	-71.5	176.8	-85.9	0	0	111.4	K379 L380 S385 R386	K379-Q383 PolarHBondContact O-N 3.19Å; K379-Q383 VanDerWaalsContact O-N 3.13Å; L380-Q383 PolarHBondContact O-N 3Å; L380-Q383 VanDerWaalsContact O-N 3.1Å; Q383-S385 VanDerWaalsContact C-N 3.26Å; Q383-S385 PolarHBondContact O-N 2.83Å; Q383-R386 PolarHBondContact O-N 3.22Å
384	M	36.1	Very low	36.1	Very low	133 Å²	133	151.3 Å²	151.3	66%	0.655	74%	0.735	S	S	*	*	H	α-helix	trans	-63.3	-29.1	178.9	-72	-173.8	171.2	0	0	113.5	L380 R386	L380-M384 PolarHBondContact O-N 3.31Å; M384-R386 PolarHBondContact O-N 3.43Å
385	S	39.4	Very low	35.9	Very low	101 Å²	101	156.2 Å²	156.2	71%	0.706	75%	0.751	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.1	4	174.9	-167.5	0	0	0	0	114.8	Y381 Q383	Y381-S385 PolarHBondContact O-N 3.08Å; Q383-S385 VanDerWaalsContact C-N 3.26Å; Q383-S385 PolarHBondContact O-N 2.83Å
386	R	40.2	Very low	35.3	Very low	235 Å²	235	156.9 Å²	156.9	89%	0.887	76%	0.755	S	S	*	*	T	Hydrogen-bonded Turn	trans	-123	6.2	178.7	-85.1	-177.6	154.6	-180	-8.4	114.4	Q383 M384	Q383-R386 PolarHBondContact O-N 3.22Å; M384-R386 PolarHBondContact O-N 3.43Å
387	S	35.2	Very low	34.8	Very low	103 Å²	103	158 Å²	158	72%	0.72	76%	0.76	S	S	*	*			trans	-124.9	41.1	-169.9	-167.1	0	0	0	0	114.2
388	R	35.4	Very low	34.7	Very low	218 Å²	218	159.3 Å²	159.3	82%	0.823	76%	0.764	S	S	*	*			trans	-136.7	49.4	176.5	-59.8	-165.6	-155.6	160.4	4.4	114.2
389	F	32.3	Very low	34.2	Very low	209 Å²	209	160.2 Å²	160.2	92%	0.917	77%	0.773	S	S	*	*	S	Bend	trans	-160.7	71.6	165.7	-102	-64.9	0	0	0	111.7
390	R	28.9	Very low	33.7	Very low	244 Å²	244	158 Å²	158	92%	0.921	78%	0.777	S	S	*	*			trans	-178.4	144	154.8	-102.4	158.3	-166.7	-135.4	0.9	109.6
391	S	29.9	Very low	33.7	Very low	124 Å²	124	157.9 Å²	157.9	87%	0.867	79%	0.785	S	S	*	*			trans	61.4	141.8	-165.1	-59.8	0	0	0	0	114.3
392	S	32.3	Very low	33.7	Very low	121 Å²	121	159.7 Å²	159.7	85%	0.846	79%	0.79	S	S	*	*			cis	-102.6	144.2	3.8	-63.4	0	0	0	0	113.3
393	R	29.7	Very low	33.3	Very low	230 Å²	230	155.4 Å²	155.4	87%	0.868	79%	0.79	S	S	*	*			trans	-83.2	153	152.8	-72.5	174.6	168.3	153.5	-8.4	108.7
394	N	30.7	Very low	32.7	Very low	147 Å²	147	159 Å²	159	79%	0.786	80%	0.803	S	S	*	*			trans	130.8	149.4	149.8	-66.6	-1.8	0	0	0	113.1
395	L	30.3	Very low	32.6	Very low	171 Å²	171	157.5 Å²	157.5	90%	0.895	81%	0.807	S	S	*	*			trans	69.8	72.8	172.8	-63.7	141	0	0	0	116.2
396	T	28.8	Very low	32.2	Very low	119 Å²	119	155.9 Å²	155.9	73%	0.73	81%	0.806	S	S	*	*			trans	-115.5	150.3	135.5	50.2	0	0	0	0	108.2
397	E	30.6	Very low	31.8	Very low	175 Å²	175	150.3 Å²	150.3	82%	0.818	80%	0.803	S	S	*	*			trans	65.5	129.8	177	-60.7	148.6	-129	0	0	114.2
398	T	34	Very low	31.7	Very low	117 Å²	117	152.8 Å²	152.8	72%	0.718	81%	0.806	S	S	*	*			cis	-154.9	150	44.2	37.1	0	0	0	0	113.2
399	N	31	Very low	31.7	Very low	146 Å²	146	148.5 Å²	148.5	78%	0.781	80%	0.804	S	S	*	*			trans	53.5	155.7	141.2	-65.2	-22.7	0	0	0	124.3
400	S	31.4	Very low	31.5	Very low	105 Å²	105	148.8 Å²	148.8	73%	0.734	81%	0.805	S	S	*	*			trans	68.9	106.3	153.8	40.5	0	0	0	0	120.2
401	S	32.8	Very low	31.7	Very low	104 Å²	104	141.4 Å²	141.4	73%	0.727	80%	0.797	S	S	*	*				86.5	115.6	123.1	-61.3	0	0	0	0	121
402	R	32.4	Very low	32	Very low	229 Å²	229	141.6 Å²	141.6	86%	0.864	80%	0.795	S	S	*	*			trans	80.6	105	140.8	-64.3	174.7	179.8	179.3	-0.7	119.8
403	S	32.7	Very low	31.8	Very low	101 Å²	101	141.4 Å²	141.4	71%	0.706	79%	0.794	S	S	*	*				73.8	136.6	124.7	64.5	0	0	0	0	122.2
404	F	33.4	Very low	32	Very low	206 Å²	206	141.1 Å²	141.1	90%	0.904	79%	0.794	S	S	*	*			trans	66.8	151.3	162	-91.8	-121.7	0	0	0	117.3
405	S	33.3	Very low	32.1	Very low	103 Å²	103	139.6 Å²	139.6	72%	0.72	80%	0.795	S	S	*	*			cis	-170.4	151.6	-30.7	-170.3	0	0	0	0	108.8
406	G	32.2	Very low	32.2	Very low	67 Å²	67	135.1 Å²	135.1	69%	0.691	79%	0.79	S	S	*	*			trans	74.7	128.6	177	0	0	0	0	0	113.9
407	S	30.2	Very low	32.4	Very low	117 Å²	117	133.8 Å²	133.8	82%	0.818	79%	0.791	S	S	*	*			cis	74	156.7	20.3	-152.2	0	0	0	0	116.1
408	I	34.7	Very low	32.4	Very low	155 Å²	155	132.6 Å²	132.6	80%	0.795	79%	0.789	S	S	*	*			trans	77.2	97.9	-174.6	-50.1	172.8	0	0	0	111.9
409	V	34.2	Very low	32.2	Very low	129 Å²	129	132.8 Å²	132.8	78%	0.782	79%	0.786	S	S	*	*				96.5	132.9	52.2	169.3	0	0	0	0	112.3
410	F	27.6	Very low	32.1	Very low	214 Å²	214	130 Å²	130	94%	0.939	78%	0.778	S	S	*	*			trans	-62.3	132	173.1	-89.8	-106.1	0	0	0	112
411	A	33.9	Very low	32.2	Very low	90 Å²	90	133.7 Å²	133.7	74%	0.744	78%	0.777	S	S	*	*			trans	-138.2	139.1	155.7	0	0	0	0	0	109.1
412	P	35.4	Very low	32.2	Very low	128 Å²	128	135 Å²	135	83%	0.831	78%	0.776	S	S	*	*			trans	-81.1	162	-177.3	33.6	-35.6	0	0	0	112.8
413	S	29.5	Very low	32.4	Very low	117 Å²	117	130.8 Å²	130.8	82%	0.818	77%	0.768	S	S	*	*			trans	-63.7	139	-170.9	-40.9	0	0	0	0	115.2
414	Y	32.8	Very low	32.4	Very low	224 Å²	224	131.9 Å²	131.9	88%	0.878	77%	0.766	S	S	*	*			trans	-139.4	136.1	142.9	-112.7	-84	0	0	0	109.9
415	S	33.4	Very low	32.4	Very low	115 Å²	115	128.9 Å²	128.9	80%	0.804	76%	0.759	S	S	*	*			trans	24.4	129.4	162.7	-55.5	0	0	0	0	121.3
416	G	31.5	Very low	32.4	Very low	76 Å²	76	129.4 Å²	129.4	78%	0.784	76%	0.758	S	S	*	*			trans	167.1	69	157.5	0	0	0	0	0	119.7
417	A	32.8	Very low	32.3	Very low	91 Å²	91	132.5 Å²	132.5	75%	0.752	76%	0.758	S	S	*	*			trans	44.1	117.3	142.8	0	0	0	0	0	122.7
418	L	30.3	Very low	32.6	Very low	150 Å²	150	131.9 Å²	131.9	79%	0.785	75%	0.752	S	S	*	*				81.6	127.6	130	-64.2	170.4	0	0	0	122.3
419	N	30.9	Very low	32.4	Very low	122 Å²	122	134.5 Å²	134.5	65%	0.652	75%	0.752	S	S	*	*			trans	65.5	109.5	147	-58.5	-3.5	0	0	0	118
420	S	28.5	Very low	32.3	Very low	88 Å²	88	135.6 Å²	135.6	62%	0.615	75%	0.752	S	S	*	*				89.4	150.2	82.5	-153.9	0	0	0	0	110
421	Y	34.4	Very low	32.3	Very low	182 Å²	182	133.1 Å²	133.1	71%	0.714	75%	0.746	S	S	*	*			cis	-148.6	155.6	25.7	-39.8	-105.5	0	0	0	109.5
422	D	31.5	Very low	31.9	Very low	131 Å²	131	134 Å²	134	70%	0.701	75%	0.745	S	S	*	*			trans	46.6	142.4	130.7	-77	-28.1	0	0	0	122.6
423	M	37.7	Very low	31.6	Very low	141 Å²	141	133.2 Å²	133.2	70%	0.695	74%	0.743	S	S	*	*			cis	-145.9	160.5	2.7	-77.5	-144.1	163.2	0	0	111.9
424	N	31.5	Very low	31.7	Very low	123 Å²	123	136.9 Å²	136.9	66%	0.658	74%	0.744	S	S	*	*				28.6	155.5	129.3	-43.4	-24.8	0	0	0	120.4
425	D	33.6	Very low	31.8	Very low	144 Å²	144	132.3 Å²	132.3	77%	0.77	74%	0.742	S	S	*	*			cis	-167.4	173.7	34.2	-143.1	-24.5	0	0	0	115.8
426	V	34.7	Very low	31.6	Very low	114 Å²	114	132.3 Å²	132.3	69%	0.691	74%	0.736	S	S	*	*			trans	50.9	95.8	159.6	-165.7	0	0	0	0	121.5
427	N	29	Very low	31.5	Very low	131 Å²	131	137.8 Å²	137.8	70%	0.701	74%	0.739	S	S	*	*				33.3	141.4	117.5	-97.1	-51.8	0	0	0	123.9
428	P	37.5	Very low	31.2	Very low	105 Å²	105	140.1 Å²	140.1	68%	0.682	74%	0.738	S	S	*	*			trans	-93.9	152.9	177.1	37.9	-35.5	0	0	0	115.9
429	R	28.9	Very low	31.1	Very low	209 Å²	209	138.2 Å²	138.2	79%	0.789	74%	0.737	S	S	*	*			trans	-157.6	162.8	170.7	-87.1	104.1	-144.5	-97.6	-0.2	108.2
430	L	32.1	Very low	30.9	Very low	152 Å²	152	137.4 Å²	137.4	80%	0.796	74%	0.74	S	S	*	*			cis	-154.4	-165.9	3.4	-125.7	175.7	0	0	0	111.5
431	M	28.2	Very low	31	Very low	163 Å²	163	138.1 Å²	138.1	80%	0.803	75%	0.745	S	S	*	*			trans	-56	175.7	166.2	-68.6	-59.2	158.9	0	0	115.6
432	C	26.1	Very low	30.8	Very low	108 Å²	108	136 Å²	136	73%	0.73	75%	0.746	S	S	*	*			cis	-178.5	-172.2	-22.1	-173.9	0	0	0	0	108
433	S	27.8	Very low	31	Very low	112 Å²	112	133.2 Å²	133.2	78%	0.783	74%	0.737	S	S	*	*			trans	80.5	142.9	158.3	-59.9	0	0	0	0	120.8
434	K	32.2	Very low	30.7	Very low	193 Å²	193	134.2 Å²	134.2	84%	0.839	75%	0.745	S	S	*	*			trans	-90.5	173.3	165.2	-53.8	170.4	-175.6	172.5	0	109.3
435	P	34.6	Very low	30.7	Very low	128 Å²	128	131.5 Å²	131.5	83%	0.831	75%	0.746	S	S	*	*				-145.5	-165.8	99.5	38.8	-22.7	0	0	0	114.9
436	V	29.8	Very low	30.7	Very low	115 Å²	115	133.3 Å²	133.3	70%	0.697	75%	0.75	S	S	*	*			trans	-123.4	140.9	-171.6	171.6	0	0	0	0	110.8
437	F	29	Very low	30.6	Very low	191 Å²	191	133.4 Å²	133.4	84%	0.838	75%	0.75	S	S	*	*			trans	-147.3	132.9	150.1	-86.7	-91.7	0	0	0	105.9
438	L	27.6	Very low	31.1	Very low	140 Å²	140	132.1 Å²	132.1	73%	0.733	75%	0.749	S	S	*	*			cis	104.2	134.8	34.5	-88.6	175.1	0	0	0	112.5
439	S	27.6	Very low	30.8	Very low	110 Å²	110	132.7 Å²	132.7	77%	0.769	75%	0.751	S	S	*	*			trans	76.9	140.2	153.3	-145.7	0	0	0	0	118.5
440	C	26.8	Very low	30.9	Very low	105 Å²	105	127.5 Å²	127.5	71%	0.709	75%	0.747	S	S	*	*			cis	-168.2	166.7	-21.9	-110.9	0	0	0	0	110.1
441	S	30.9	Very low	30.6	Very low	103 Å²	103	125.5 Å²	125.5	72%	0.72	75%	0.745	S	S	*	*			trans	64.7	158.5	149.4	-73	0	0	0	0	119.3
442	D	30.3	Very low	30.5	Very low	137 Å²	137	121.8 Å²	121.8	73%	0.733	74%	0.741	S	S	*	*			cis	-164.6	168.6	-10.5	-116.8	47	0	0	0	107.5
443	S	34.4	Very low	30.5	Very low	74 Å²	74	123 Å²	123	52%	0.517	74%	0.744	S	S	.	*			cis	-172.3	-179.9	-30.1	54.6	0	0	0	0	109.6
444	N	31.4	Very low	30.6	Very low	162 Å²	162	123 Å²	123	87%	0.866	74%	0.74	S	S	*	*			trans	71.3	142.1	170.1	-53.9	-42.8	0	0	0	118.3
445	G	33	Very low	30.2	Very low	65 Å²	65	121.1 Å²	121.1	67%	0.67	74%	0.738	S	S	*	*			cis	177.1	173.3	-6	0	0	0	0	0	114
446	H	31.9	Very low	29.8	Very low	182 Å²	182	122 Å²	122	84%	0.843	74%	0.736	S	S	*	*			trans	60.6	116.5	172.5	-85	-81.2	0	0	0	119.1
447	V	33.2	Very low	29.8	Very low	117 Å²	117	120.7 Å²	120.7	71%	0.709	73%	0.731	S	S	*	*			cis	76.6	131.5	6.4	-167.8	0	0	0	0	114.4
448	P	39.6	Very low	29.8	Very low	104 Å²	104	119.8 Å²	119.8	68%	0.675	73%	0.728	S	S	*	*			cis	-146.9	-144	-32.9	44.3	-24.4	0	0	0	113.7
449	T	31	Very low	30.1	Very low	117 Å²	117	120 Å²	120	72%	0.718	73%	0.727	S	S	*	*			trans	108	138.5	139.8	9.5	0	0	0	0	122.2
450	S	30.8	Very low	30.4	Very low	100 Å²	100	120.2 Å²	120.2	70%	0.699	72%	0.719	S	S	*	*			trans	54.4	122.7	149.1	-62	0	0	0	0	120.3
451	S	26.5	Very low	30.5	Very low	109 Å²	109	123 Å²	123	76%	0.762	72%	0.722	S	S	*	*			cis	95.1	139.7	33.2	78.1	0	0	0	0	115.4
452	A	26.4	Very low	30.6	Very low	86 Å²	86	122 Å²	122	71%	0.711	71%	0.711	S	S	*	*			trans	95.6	113.1	157.2	0	0	0	0	0	120.4
453	V	26.3	Very low	30.7	Very low	132 Å²	132	119.9 Å²	119.9	80%	0.8	70%	0.703	S	S	*	*				77.8	156.9	129.1	177.9	0	0	0	0	119.4
454	T	28.6	Very low	30.6	Very low	114 Å²	114	119 Å²	119	70%	0.699	70%	0.701	S	S	*	*			trans	81	110.7	176.8	-19.1	0	0	0	0	113.1
455	L	24.6	Very low	30.5	Very low	153 Å²	153	116.4 Å²	116.4	80%	0.801	69%	0.687	S	S	*	*				74.5	147.4	50.2	-69.9	173.7	0	0	0	115.2
456	N	27	Very low	30.7	Very low	147 Å²	147	122.5 Å²	122.5	79%	0.786	70%	0.698	S	S	*	*			trans	73.4	156	176.4	-63.9	-11.4	0	0	0	117
457	S	28.2	Very low	30.5	Very low	86 Å²	86	121.1 Å²	121.1	60%	0.601	70%	0.697	S	S	*	*			cis	-177	-170.7	-29.3	-166.7	0	0	0	0	107.8
458	F	30.6	Very low	30.2	Very low	173 Å²	173	120.7 Å²	120.7	76%	0.759	70%	0.699	S	S	*	*			trans	83.8	106.8	172.2	-62.2	-85.9	0	0	0	115
459	M	34.2	Very low	29.7	Very low	145 Å²	145	119.8 Å²	119.8	71%	0.714	70%	0.695	S	S	*	*				87.2	137.9	60.9	-78.1	-179.2	152.3	0	0	111.5
460	N	32	Very low	29.5	Very low	114 Å²	114	119.9 Å²	119.9	61%	0.61	69%	0.691	S	S	*	*			cis	-144.5	152	9.5	-98.1	-12.8	0	0	0	109.9
461	E	29.9	Very low	29.4	Very low	162 Å²	162	124.6 Å²	124.6	76%	0.757	70%	0.695	S	S	*	*				57.2	137.3	82.2	-57.8	-160	127.3	0	0	115.9
462	T	31.9	Very low	29.4	Very low	82 Å²	82	124.2 Å²	124.2	50%	0.503	69%	0.688	S	S	.	*			cis	-150.6	-142.1	-11.3	26.3	0	0	0	0	108.8
463	T	32.4	Very low	29.5	Very low	93 Å²	93	126.3 Å²	126.3	57%	0.571	69%	0.688	S	S	*	*			cis	-166	146.5	4.3	-25.3	0	0	0	0	113.2	L663 S664	T463-L663 CarbonylContact C-O 3.52Å; T463-L663 VanDerWaalsContact C-O 3.27Å; T463-L663 PolarHBondContact N-O 3.23Å; T463-S664 CarbonylContact C-O 3.23Å; T463-S664 VanDerWaalsContact C-O 3.23Å; T463-S664 WeakPolarHBondContact CA-O 3.35Å
464	A	32.9	Very low	29.7	Very low	57 Å²	57	127.2 Å²	127.2	47%	0.471	69%	0.688	S	S	.	*			trans	51.9	138.3	168.1	0	0	0	0	0	119.8	L663 S664	A464-L663 CarbonylContact O-C 3.17Å; A464-L663 WeakPolarHBondContact O-CA 3.49Å; A464-S664 VanDerWaalsContact N-C 3.34Å; A464-S664 PolarHBondContact N-O 3.14Å; A464-S664 PolarHBondContact O-N 2.81Å; A464-S664 VanDerWaalsContact O-N 3.12Å
465	N	29.2	Very low	29.8	Very low	106 Å²	106	125.1 Å²	125.1	57%	0.567	69%	0.689	S	S	*	*			cis	97.4	76.4	1.3	-158	58.9	0	0	0	119.8
466	Q	36.9	Very low	29.9	Very low	193 Å²	193	125.7 Å²	125.7	90%	0.902	69%	0.692	S	S	*	*			trans	-142.9	138.1	145.8	-58.7	-170.2	20.5	0	0	107.3
467	N	27.5	Very low	29.8	Very low	153 Å²	153	124.1 Å²	124.1	82%	0.818	69%	0.692	S	S	*	*			cis	94.6	141.8	28.3	-130	15.1	0	0	0	114.9
468	S	28.2	Very low	29.6	Very low	108 Å²	108	128.9 Å²	128.9	76%	0.755	70%	0.704	S	S	*	*			trans	69.2	152	-177.8	-56.7	0	0	0	0	117.8
469	S	28.8	Very low	29.4	Very low	85 Å²	85	126 Å²	126	59%	0.594	71%	0.706	S	S	*	*			cis	166.4	159.3	-45.7	52.4	0	0	0	0	109.5
470	N	26.6	Very low	29.1	Very low	119 Å²	119	124.3 Å²	124.3	64%	0.636	71%	0.708	S	S	*	*			trans	79.2	158.2	161	-51.7	-30	0	0	0	119.9
471	Y	28.3	Very low	28.9	Very low	200 Å²	200	122.9 Å²	122.9	78%	0.784	72%	0.72	S	S	*	*			trans	69.4	125.4	165.8	-50	-60.1	0	0	0	118
472	T	27.3	Very low	28.7	Very low	100 Å²	100	119.2 Å²	119.2	61%	0.613	73%	0.726	S	S	*	*			cis	159	162.1	-21	31.4	0	0	0	0	105.4
473	N	29	Very low	28.5	Very low	131 Å²	131	117.3 Å²	117.3	70%	0.701	72%	0.722	S	S	*	*			trans	78.7	144	168.2	-47.2	-42.3	0	0	0	116
474	N	28.8	Very low	28.5	Very low	151 Å²	151	122.2 Å²	122.2	81%	0.807	74%	0.739	S	S	*	*			cis	-162	164.4	-17.3	-107.4	-20.3	0	0	0	111.2
475	G	30.7	Very low	28.2	Very low	70 Å²	70	124.2 Å²	124.2	72%	0.722	74%	0.741	S	S	*	*			trans	89.3	116	170.4	0	0	0	0	0	114.3
476	L	27.4	Very low	28.3	Very low	164 Å²	164	124.7 Å²	124.7	86%	0.859	75%	0.747	S	S	*	*			cis	79.6	68	3.6	-130.2	178.8	0	0	0	117.2
477	C	26.1	Very low	28	Very low	115 Å²	115	121.8 Å²	121.8	78%	0.777	73%	0.734	S	S	*	*			trans	-162	120.8	138.9	47.6	0	0	0	0	106.4
478	E	24	Very low	28.1	Very low	185 Å²	185	117.7 Å²	117.7	86%	0.864	73%	0.727	S	S	*	*				80.1	133.8	66.4	-74.9	-152.2	126.8	0	0	115.7
479	S	25.8	Very low	28.2	Very low	113 Å²	113	116.2 Å²	116.2	79%	0.79	72%	0.722	S	S	*	*			trans	85.1	142.8	164.1	-155.7	0	0	0	0	121
480	S	27.8	Very low	28.3	Very low	110 Å²	110	118.9 Å²	118.9	77%	0.769	72%	0.723	S	S	*	*			trans	67.2	80.5	151	-60.9	0	0	0	0	121.2
481	G	26.7	Very low	28.6	Very low	84 Å²	84	119.7 Å²	119.7	87%	0.866	73%	0.727	S	S	*	*				81.5	114	109.5	0	0	0	0	0	120.9
482	G	26.5	Very low	28.8	Very low	85 Å²	85	115.1 Å²	115.1	88%	0.876	72%	0.715	S	S	*	*			trans	117	125.1	136.1	0	0	0	0	0	118.8
483	G	27.6	Very low	28.9	Very low	41 Å²	41	115.4 Å²	115.4	42%	0.423	72%	0.717	S	S	.	*			trans	95.1	41.7	144.5	0	0	0	0	0	118.7	L485 R622	G483-L485 PolarHBondContact O-N 2.82Å; G483-R622 PolarHBondContact O-NH1 3.07Å
484	Q	32	Very low	29.1	Very low	196 Å²	196	117.3 Å²	117.3	92%	0.916	72%	0.722	S	S	*	*			trans	-60.3	127.9	170.8	-143	167.9	12.6	0	0	110.9
485	L	27.4	Very low	29.2	Very low	99 Å²	99	117.3 Å²	117.3	52%	0.518	72%	0.722	S	S	.	*			trans	-87.7	109.4	-172.1	-75.1	156.1	0	0	0	110.9	G483 H487	G483-L485 PolarHBondContact O-N 2.82Å; L485-H487 PolarHBondContact O-N 3.46Å
486	V	31.5	Very low	29.2	Very low	116 Å²	116	117.6 Å²	117.6	70%	0.703	72%	0.724	S	S	*	*			trans	-68.5	98.5	176.4	-175.5	0	0	0	0	110.3	G488	V486-G488 PolarHBondContact O-N 2.93Å
487	H	29.6	Very low	29.2	Very low	132 Å²	132	118.1 Å²	118.1	61%	0.611	73%	0.728	S	S	*	*			trans	-70.9	77.4	162.2	-88.4	63.3	0	0	0	109.3	L485 A489 R528	L485-H487 PolarHBondContact O-N 3.46Å; H487-A489 VanDerWaalsContact C-N 3.26Å; H487-A489 PolarHBondContact O-N 3.02Å; H487-R528 PolarHBondContact CD2-NH1 3.44Å; H487-R528 PolarHBondContact CD2-NH2 2.74Å; H487-R528 PolarHBondContact CE1-NH2 2.75Å; H487-R528 PolarHBondContact NE2-NH1 2.95Å; H487-R528 PolarHBondContact NE2-NH2 2.92Å
488	G	29.2	Very low	29.4	Very low	67 Å²	67	117.4 Å²	117.4	69%	0.691	73%	0.731	S	S	*	*			trans	-74.6	72.1	177.6	0	0	0	0	0	112.4	V486 F490	V486-G488 PolarHBondContact O-N 2.93Å; G488-F490 PolarHBondContact O-N 3.32Å
489	A	30.8	Very low	29.6	Very low	77 Å²	77	116.7 Å²	116.7	64%	0.636	73%	0.732	S	S	*	*			trans	-64.3	120.8	173.8	0	0	0	0	0	110.2	H487 L491	H487-A489 VanDerWaalsContact C-N 3.26Å; H487-A489 PolarHBondContact O-N 3.02Å; A489-L491 PolarHBondContact O-N 3.03Å
490	F	31.8	Very low	29.8	Very low	141 Å²	141	120.4 Å²	120.4	62%	0.618	74%	0.737	S	S	*	*			trans	-76.1	73.6	-180	-170.6	-103.4	0	0	0	111.1	G488 L492	G488-F490 PolarHBondContact O-N 3.32Å; F490-L492 HydrophobicContact CD1-CD2 4.49Å; F490-L492 HydrophobicContact CD1-CG 4.09Å; F490-L492 HydrophobicContact CE1-CD1 4.31Å; F490-L492 HydrophobicContact CE1-CD2 3.7Å; F490-L492 HydrophobicContact CE1-CG 3.77Å; F490-L492 HydrophobicContact CZ-CD2 4.27Å; F490-L492 PolarHBondContact O-N 3.08Å
491	L	32.8	Very low	29.8	Very low	136 Å²	136	124.4 Å²	124.4	71%	0.712	74%	0.743	S	S	*	*			trans	-70.7	101.5	178.5	-71.2	179.8	0	0	0	110.8	A489 T493	A489-L491 PolarHBondContact O-N 3.03Å; L491-T493 PolarHBondContact O-N 2.83Å
492	L	31.8	Very low	29.7	Very low	105 Å²	105	123.8 Å²	123.8	55%	0.55	74%	0.736	S	S	.	*			trans	-68.6	60	162.5	-74.6	171.7	0	0	0	111.3	F490	F490-L492 HydrophobicContact CD1-CD2 4.49Å; F490-L492 HydrophobicContact CD1-CG 4.09Å; F490-L492 HydrophobicContact CE1-CD1 4.31Å; F490-L492 HydrophobicContact CE1-CD2 3.7Å; F490-L492 HydrophobicContact CE1-CG 3.77Å; F490-L492 HydrophobicContact CZ-CD2 4.27Å; F490-L492 PolarHBondContact O-N 3.08Å
493	T	30.4	Very low	29.9	Very low	106 Å²	106	127.5 Å²	127.5	65%	0.65	74%	0.735	S	S	*	*			trans	-116.2	111.5	-177.3	-56.5	0	0	0	0	110	L491	L491-T493 PolarHBondContact O-N 2.83Å
494	Q	33	Very low	29.8	Very low	170 Å²	170	130.1 Å²	130.1	79%	0.794	75%	0.747	S	S	*	*			trans	-80.2	148.7	164.5	-71.4	-171.3	-22.1	0	0	110.4
495	N	30.8	Very low	29.5	Very low	152 Å²	152	128.1 Å²	128.1	81%	0.813	74%	0.742	S	S	*	*			trans	-34.4	145.9	-176.7	-51	-7.9	0	0	0	117
496	G	30.3	Very low	29.5	Very low	75 Å²	75	128.8 Å²	128.8	77%	0.773	76%	0.755	S	S	*	*			trans	169.4	84	158.8	0	0	0	0	0	115.2
497	N	27.2	Very low	29.3	Very low	175 Å²	175	132.4 Å²	132.4	94%	0.936	76%	0.764	S	S	*	*			trans	-77.1	126.5	170.6	-70.7	-4.6	0	0	0	110.8
498	A	30.2	Very low	29.3	Very low	101 Å²	101	131.1 Å²	131.1	84%	0.835	77%	0.77	S	S	*	*			trans	-149.3	152.5	158	0	0	0	0	0	108.9
499	L	28.2	Very low	29.4	Very low	169 Å²	169	133.7 Å²	133.7	89%	0.885	78%	0.777	S	S	*	*			trans	-92.5	172.2	-169.2	-72.1	168.5	0	0	0	113.6
500	Q	30.6	Very low	29.5	Very low	192 Å²	192	134.9 Å²	134.9	90%	0.897	79%	0.787	S	S	*	*			trans	96.9	162.9	148.4	-135.3	142.4	26.6	0	0	117.5
501	Q	27.3	Very low	29.9	Very low	194 Å²	194	132.5 Å²	132.5	91%	0.907	79%	0.794	S	S	*	*			trans	-110.9	145.5	-149.9	-62.3	164.6	-15	0	0	112.3
502	G	24.1	Very low	30.8	Very low	70 Å²	70	129.5 Å²	129.5	72%	0.722	80%	0.796	S	S	*	*			trans	113.8	136.9	145.4	0	0	0	0	0	118.3
503	I	31.4	Very low	33	Very low	164 Å²	164	132.2 Å²	132.2	84%	0.841	81%	0.806	S	S	*	*			trans	75.9	93.6	144.1	-52.7	172.3	0	0	0	117.6
504	S	25.5	Very low	35.8	Very low	96 Å²	96	128 Å²	128	67%	0.671	78%	0.78	S	S	*	*			trans	55.3	122.3	144.8	67.5	0	0	0	0	122.8
505	N	25.2	Very low	38.7	Very low	153 Å²	153	124.5 Å²	124.5	82%	0.818	76%	0.763	S	S	*	*			trans	68.5	150.8	146.6	-76.5	-14	0	0	0	121.3
506	S	27.2	Very low	41.8	Very low	113 Å²	113	117.5 Å²	117.5	79%	0.79	73%	0.726	S	S	*	*			trans	69.7	38.6	159	67.8	0	0	0	0	120
507	Q	27.7	Very low	44.8	Very low	193 Å²	193	115.5 Å²	115.5	90%	0.902	70%	0.695	S	S	*	*			trans	-152.1	83.6	164.7	-117.8	161.9	87.9	0	0	114.4
508	S	29.9	Very low	48	Very low	104 Å²	104	110 Å²	110	73%	0.727	66%	0.664	S	S	*	*			trans	-127.2	14.3	178.2	56	0	0	0	0	114.5
509	S	30.7	Very low	51.2	Low	121 Å²	121	105.7 Å²	105.7	85%	0.846	63%	0.626	S	S	*	*			trans	-99.4	-0.2	-164.6	-49.3	0	0	0	0	116.1
510	A	34.1	Very low	54.4	Low	102 Å²	102	97.6 Å²	97.6	84%	0.843	58%	0.584	S	S	*	*			trans	-104	-20.8	-166.9	0	0	0	0	0	115.7	G512	A510-G512 PolarHBondContact O-N 3.22Å
511	A	39.6	Very low	57.5	Low	92 Å²	92	88.9 Å²	88.9	76%	0.76	54%	0.544	S	S	*	.	S	Bend	trans	-71	126	172	0	0	0	0	0	109.4	Q513	A511-Q513 PolarHBondContact O-N 2.84Å
512	G	51.5	Low	60.7	Low	73 Å²	73	82.4 Å²	82.4	75%	0.753	51%	0.513	S	S	*	.			trans	-50.5	131.2	-164.2	0	0	0	0	0	114.5	A510 V514	A510-G512 PolarHBondContact O-N 3.22Å; G512-V514 PolarHBondContact O-N 3.35Å
513	Q	79.3	Confident	64.1	Low	161 Å²	161	79.5 Å²	79.5	75%	0.752	48%	0.481	S	S	*	.			trans	-52.1	100.1	-174.4	175.7	174.7	-23.3	0	0	113	A511 Q515	A511-Q513 PolarHBondContact O-N 2.84Å; Q513-Q515 PolarHBondContact O-N 2.9Å
514	V	88.3	Confident	67.1	Low	19 Å²	19	71.9 Å²	71.9	12%	0.115	44%	0.442	C	S	.	.			trans	-58.1	134.2	170.6	63.2	0	0	0	0	110.6	G512 Q518 F519 W554 R557 K558	G512-V514 PolarHBondContact O-N 3.35Å; V514-Q518 HydrophobicContact CG2-CB 4.05Å; V514-F519 HydrophobicContact CG2-CB 4.32Å; V514-W554 HydrophobicContact CG1-CZ3 4.17Å; V514-R557 HydrophobicContact CG1-CG 4.2Å; V514-K558 HydrophobicContact CG1-CD 4.11Å
515	Q	93.6	Very high	70.3	Confident	95 Å²	95	70 Å²	70	44%	0.444	43%	0.427	S	S	.	.			trans	-94.7	153.7	178.8	-59.2	-173.2	-19.6	0	0	110.7	Q513 W517 Q518 F519	Q513-Q515 PolarHBondContact O-N 2.9Å; Q515-W517 VanDerWaalsContact C-N 3.34Å; Q515-W517 PolarHBondContact O-N 3.49Å; Q515-Q518 HydrophobicContact CB-CG 4.19Å; Q515-Q518 WeakPolarHBondContact O-CB 3.25Å; Q515-Q518 PolarHBondContact O-N 2.97Å; Q515-Q518 VanDerWaalsContact O-N 3.07Å; Q515-F519 PolarHBondContact O-N 3.39Å; Q515-F519 VanDerWaalsContact O-N 3.11Å
516	L	95.2	Very high	73.5	Confident	6 Å²	6	65 Å²	65	3%	0.031	40%	0.4	C	S	.	.	H	α-helix	trans	-60.8	-40.7	-174.1	174.6	60.7	0	0	0	112.3	Q518 F519 L520 W554 L568 A571 L572 Y575	L516-Q518 VanDerWaalsContact C-N 3.29Å; L516-Q518 PolarHBondContact O-N 3.31Å; L516-F519 HydrophobicContact CD1-CD1 4.3Å; L516-F519 PolarHBondContact O-N 2.96Å; L516-L520 HydrophobicContact CD1-CD1 3.98Å; L516-L520 HydrophobicContact CD1-CD2 4.45Å; L516-L520 HydrophobicContact CD1-CG 3.95Å; L516-L520 HydrophobicContact CG-CD1 3.91Å; L516-L520 HydrophobicContact CG-CG 4.34Å; L516-L520 VanDerWaalsContact O-CG 3.32Å; L516-L520 WeakPolarHBondContact O-CG 3.31Å; L516-L520 PolarHBondContact O-N 3.38Å; L516-W554 HydrophobicContact CB-CH2 4.11Å; L516-W554 HydrophobicContact CB-CZ2 3.81Å; L516-W554 HydrophobicContact CD1-CD2 3.83Å; L516-W554 HydrophobicContact CD1-CE3 4.32Å; L516-W554 HydrophobicContact CD1-CG 4.04Å; L516-W554 HydrophobicContact CD1-CZ2 4.22Å; L516-L568 HydrophobicContact CD1-CD1 4.15Å; L516-L568 HydrophobicContact CD1-CG 4.15Å; L516-L568 HydrophobicContact CD2-CG 4.24Å; L516-A571 HydrophobicContact CD2-CB 3.61Å; L516-L572 HydrophobicContact CD2-CD2 4.29Å; L516-L572 HydrophobicContact CD2-CG 4.18Å; L516-Y575 HydrophobicContact CB-CE2 4.1Å; L516-Y575 HydrophobicContact CD2-CE2 4.35Å; L516-Y575 HydrophobicContact CG-CE2 4.37Å; L516-Y575 PolarHBondContact N-OH 2.9Å
517	W	94.7	Very high	76.5	Confident	32 Å²	32	63.5 Å²	63.5	12%	0.121	38%	0.377	C	S	.	.	H	α-helix	trans	-62.4	-35.1	176.4	73.3	-98.3	0	0	0	112.8	Q515 L521 Y575 I581 F593 L600	Q515-W517 VanDerWaalsContact C-N 3.34Å; Q515-W517 PolarHBondContact O-N 3.49Å; W517-L521 HydrophobicContact CE3-CD2 4.33Å; W517-L521 HydrophobicContact CZ3-CD2 4.13Å; W517-L521 VanDerWaalsContact O-CB 3.29Å; W517-L521 WeakPolarHBondContact O-CB 3.42Å; W517-L521 PolarHBondContact O-N 3.13Å; W517-Y575 HydrophobicContact CB-CE2 4.22Å; W517-Y575 AromaticContact CD1-CE1 3.9Å; W517-Y575 AromaticContact CD1-CZ 3.83Å; W517-Y575 PolarHBondContact N-OH 2.99Å; W517-I581 HydrophobicContact CB-CD1 3.71Å; W517-I581 HydrophobicContact CB-CG1 4.41Å; W517-F593 HydrophobicContact CB-CE1 4.23Å; W517-F593 HydrophobicContact CE3-CE1 4.42Å; W517-L600 HydrophobicContact CH2-CD2 3.81Å; W517-L600 HydrophobicContact CZ3-CD2 3.77Å
518	Q	94.5	Very high	79.4	Confident	61 Å²	61	59.3 Å²	59.3	29%	0.285	35%	0.353	S	S	.	.	H	α-helix	trans	-67.5	-44	177.5	-62	174.5	-44.3	0	0	110.7	V514 Q515 L516 L521 E522	V514-Q518 HydrophobicContact CG2-CB 4.05Å; Q515-Q518 HydrophobicContact CB-CG 4.19Å; Q515-Q518 WeakPolarHBondContact O-CB 3.25Å; Q515-Q518 PolarHBondContact O-N 2.97Å; Q515-Q518 VanDerWaalsContact O-N 3.07Å; L516-Q518 VanDerWaalsContact C-N 3.29Å; L516-Q518 PolarHBondContact O-N 3.31Å; Q518-L521 PolarHBondContact O-N 2.8Å; Q518-E522 WeakPolarHBondContact O-CB 3.13Å; Q518-E522 PolarHBondContact O-N 2.71Å
519	F	95.9	Very high	82.4	Confident	9 Å²	9	58.9 Å²	58.9	4%	0.039	34%	0.336	C	S	.	.	H	α-helix	trans	-66.5	-40.2	177.5	169.4	-101.1	0	0	0	112.9	V514 Q515 L516 L521 E522 L523 V550 M553 W554 R557	V514-F519 HydrophobicContact CG2-CB 4.32Å; Q515-F519 PolarHBondContact O-N 3.39Å; Q515-F519 VanDerWaalsContact O-N 3.11Å; L516-F519 HydrophobicContact CD1-CD1 4.3Å; L516-F519 PolarHBondContact O-N 2.96Å; F519-L521 VanDerWaalsContact C-N 3.28Å; F519-L521 PolarHBondContact O-N 2.71Å; F519-E522 WeakPolarHBondContact O-CB 3.42Å; F519-E522 PolarHBondContact O-N 2.83Å; F519-L523 HydrophobicContact CD1-CD1 4.38Å; F519-L523 HydrophobicContact CE1-CD1 3.63Å; F519-L523 HydrophobicContact CE1-CG 4.35Å; F519-L523 HydrophobicContact CE2-CD1 4.22Å; F519-L523 HydrophobicContact CE2-CD2 4.36Å; F519-L523 HydrophobicContact CE2-CG 4.2Å; F519-L523 HydrophobicContact CZ-CD1 3.55Å; F519-L523 HydrophobicContact CZ-CD2 4.35Å; F519-L523 HydrophobicContact CZ-CG 4.03Å; F519-L523 WeakPolarHBondContact O-CG 3.2Å; F519-L523 PolarHBondContact O-N 3.49Å; F519-V550 HydrophobicContact CE1-CG1 4.46Å; F519-M553 HydrophobicContact CZ-CB 3.79Å; F519-W554 HydrophobicContact CB-CE3 3.77Å; F519-W554 HydrophobicContact CB-CZ3 3.6Å; F519-W554 HydrophobicContact CD1-CB 4.06Å; F519-W554 HydrophobicContact CD1-CD2 4.08Å; F519-W554 AromaticContact CD1-CE3 3.46Å; F519-W554 HydrophobicContact CD1-CE3 3.46Å; F519-W554 VanDerWaalsContact CD1-CE3 3.46Å; F519-W554 HydrophobicContact CD1-CG 4.35Å; F519-W554 HydrophobicContact CD1-CZ3 4.2Å; F519-W554 HydrophobicContact CD2-CE3 4.15Å; F519-W554 HydrophobicContact CE1-CB 3.56Å; F519-W554 HydrophobicContact CE1-CD2 4.46Å; F519-W554 HydrophobicContact CE1-CE3 4.07Å; F519-W554 HydrophobicContact CE1-CG 4.32Å; F519-W554 AromaticContact CG-CE3 3.49Å; F519-W554 HydrophobicContact CG-CE3 3.49Å; F519-W554 VanDerWaalsContact CG-CE3 3.49Å; F519-W554 AromaticContact CG-CZ3 3.87Å; F519-W554 HydrophobicContact CG-CZ3 3.87Å; F519-W554 HydrophobicContact CZ-CB 4.13Å; F519-R557 HydrophobicContact CD2-CB 4.15Å; F519-R557 HydrophobicContact CD2-CG 3.74Å; F519-R557 HydrophobicContact CE2-CB 3.93Å; F519-R557 HydrophobicContact CE2-CG 3.99Å
520	L	96.7	Very high	85.2	Confident	0 Å²	0	58.4 Å²	58.4	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-64.2	-37.1	174.2	-69	169.5	0	0	0	111.3	L516 L524 I533 F542 L544 V550 L572 I581	L516-L520 HydrophobicContact CD1-CD1 3.98Å; L516-L520 HydrophobicContact CD1-CD2 4.45Å; L516-L520 HydrophobicContact CD1-CG 3.95Å; L516-L520 HydrophobicContact CG-CD1 3.91Å; L516-L520 HydrophobicContact CG-CG 4.34Å; L516-L520 VanDerWaalsContact O-CG 3.32Å; L516-L520 WeakPolarHBondContact O-CG 3.31Å; L516-L520 PolarHBondContact O-N 3.38Å; L520-L524 WeakPolarHBondContact O-CB 3.47Å; L520-L524 WeakPolarHBondContact O-CD1 3.41Å; L520-L524 VanDerWaalsContact O-CG 3.27Å; L520-L524 WeakPolarHBondContact O-CG 3.5Å; L520-L524 PolarHBondContact O-N 2.89Å; L520-I533 HydrophobicContact CB-CD1 4.37Å; L520-I533 HydrophobicContact CD2-CD1 3.75Å; L520-F542 HydrophobicContact CD1-CZ 4.5Å; L520-L544 HydrophobicContact CD2-CD2 4.25Å; L520-V550 HydrophobicContact CD2-CG1 3.7Å; L520-L572 HydrophobicContact CD1-CD2 3.67Å; L520-I581 HydrophobicContact CD1-CD1 4.31Å
521	L	94.9	Very high	87.9	Confident	9 Å²	9	60.9 Å²	60.9	5%	0.047	31%	0.31	C	S	.	.	H	α-helix	trans	-71.5	-38.4	176.5	-165.6	54.8	0	0	0	112.1	W517 Q518 F519 L524 T525 W535 F593 L597 L601 L608	W517-L521 HydrophobicContact CE3-CD2 4.33Å; W517-L521 HydrophobicContact CZ3-CD2 4.13Å; W517-L521 VanDerWaalsContact O-CB 3.29Å; W517-L521 WeakPolarHBondContact O-CB 3.42Å; W517-L521 PolarHBondContact O-N 3.13Å; Q518-L521 PolarHBondContact O-N 2.8Å; F519-L521 VanDerWaalsContact C-N 3.28Å; F519-L521 PolarHBondContact O-N 2.71Å; L521-L524 PolarHBondContact O-N 2.76Å; L521-T525 WeakPolarHBondContact O-CG2 3.21Å; L521-T525 PolarHBondContact O-N 3.1Å; L521-T525 PolarHBondContact O-OG1 3.43Å; L521-W535 HydrophobicContact CD1-CH2 3.88Å; L521-W535 HydrophobicContact CD1-CZ2 3.77Å; L521-F593 HydrophobicContact CB-CZ 4.04Å; L521-F593 HydrophobicContact CD1-CE2 4.29Å; L521-F593 HydrophobicContact CD1-CZ 4.24Å; L521-L597 HydrophobicContact CD1-CD1 4.38Å; L521-L597 HydrophobicContact CD2-CD2 3.86Å; L521-L601 HydrophobicContact CD2-CD1 3.75Å; L521-L601 HydrophobicContact CG-CD1 4.3Å; L521-L608 HydrophobicContact CD1-CD1 4.47Å
522	E	94.5	Very high	90.5	Very high	57 Å²	57	56.5 Å²	56.5	27%	0.266	27%	0.274	S	S	.	.	H	α-helix	trans	-52.9	-54.4	170.4	-173.1	-179.4	164.5	0	0	109.9	Q518 F519 L524 T525 R557	Q518-E522 WeakPolarHBondContact O-CB 3.13Å; Q518-E522 PolarHBondContact O-N 2.71Å; F519-E522 WeakPolarHBondContact O-CB 3.42Å; F519-E522 PolarHBondContact O-N 2.83Å; E522-L524 PolarHBondContact O-N 3.05Å; E522-T525 PolarHBondContact O-N 3.44Å; E522-T525 PolarHBondContact O-OG1 3.01Å; E522-R557 VanDerWaalsContact CD-NH2 3.35Å; E522-R557 IonicContact OE1-CZ 3.7Å; E522-R557 IonicContact OE1-NE 3.6Å; E522-R557 IonicContact OE1-NH2 2.91Å; E522-R557 PolarHBondContact OE1-NH2 3.3Å; E522-R557 IonicContact OE2-CZ 2.81Å; E522-R557 IonicContact OE2-NE 3.35Å; E522-R557 IonicContact OE2-NH2 3.62Å; E522-R557 PolarHBondContact OE2-NH2 3.5Å
523	L	95.4	Very high	92.7	Very high	10 Å²	10	53.1 Å²	53.1	5%	0.052	24%	0.238	C	C	.	.	H	α-helix	trans	-62.6	-39.5	176	-64.3	178.8	0	0	0	113.4	F519 T525 D526 Y529 I533 V550 M553	F519-L523 HydrophobicContact CD1-CD1 4.38Å; F519-L523 HydrophobicContact CE1-CD1 3.63Å; F519-L523 HydrophobicContact CE1-CG 4.35Å; F519-L523 HydrophobicContact CE2-CD1 4.22Å; F519-L523 HydrophobicContact CE2-CD2 4.36Å; F519-L523 HydrophobicContact CE2-CG 4.2Å; F519-L523 HydrophobicContact CZ-CD1 3.55Å; F519-L523 HydrophobicContact CZ-CD2 4.35Å; F519-L523 HydrophobicContact CZ-CG 4.03Å; F519-L523 WeakPolarHBondContact O-CG 3.2Å; F519-L523 PolarHBondContact O-N 3.49Å; L523-T525 PolarHBondContact O-N 3.13Å; L523-D526 PolarHBondContact O-N 3.27Å; L523-Y529 HydrophobicContact CD2-CD1 4.13Å; L523-Y529 HydrophobicContact CD2-CD2 3.63Å; L523-Y529 HydrophobicContact CD2-CE1 4.42Å; L523-Y529 HydrophobicContact CD2-CE2 3.98Å; L523-Y529 HydrophobicContact CD2-CG 3.72Å; L523-I533 HydrophobicContact CB-CG2 3.6Å; L523-I533 HydrophobicContact CD1-CG2 4Å; L523-I533 HydrophobicContact CG-CG2 4.44Å; L523-V550 HydrophobicContact CD1-CG1 4.09Å; L523-M553 HydrophobicContact CD1-CE 3.8Å; L523-M553 HydrophobicContact CD2-CE 4.17Å; L523-M553 HydrophobicContact CD2-SD 4.25Å
524	L	95.7	Very high	93.4	Very high	3 Å²	3	47.9 Å²	47.9	2%	0.016	21%	0.214	C	C	.	.	H	α-helix	trans	-68.4	-16.5	179.5	-83.9	165	0	0	0	114.2	L520 L521 E522 I533 H534 W535 F542 F593 V612	L520-L524 WeakPolarHBondContact O-CB 3.47Å; L520-L524 WeakPolarHBondContact O-CD1 3.41Å; L520-L524 VanDerWaalsContact O-CG 3.27Å; L520-L524 WeakPolarHBondContact O-CG 3.5Å; L520-L524 PolarHBondContact O-N 2.89Å; L521-L524 PolarHBondContact O-N 2.76Å; E522-L524 PolarHBondContact O-N 3.05Å; L524-I533 HydrophobicContact CD1-CD1 4.06Å; L524-I533 HydrophobicContact CD1-CG1 4.46Å; L524-I533 HydrophobicContact CD2-CD1 4.25Å; L524-I533 HydrophobicContact CD2-CG1 3.76Å; L524-I533 HydrophobicContact CG-CD1 3.78Å; L524-I533 HydrophobicContact CG-CG1 3.85Å; L524-H534 VanDerWaalsContact CD2-C 3.44Å; L524-W535 HydrophobicContact CB-CZ2 3.78Å; L524-W535 HydrophobicContact CD1-CH2 4.03Å; L524-W535 HydrophobicContact CD1-CZ2 4.01Å; L524-W535 HydrophobicContact CD1-CZ3 4.33Å; L524-W535 HydrophobicContact CD2-CD2 3.96Å; L524-W535 HydrophobicContact CD2-CG 4.04Å; L524-W535 HydrophobicContact CD2-CZ2 4.49Å; L524-W535 HydrophobicContact CG-CZ2 4.32Å; L524-W535 PolarHBondContact O-NE1 3.34Å; L524-F542 HydrophobicContact CD1-CB 3.91Å; L524-F542 HydrophobicContact CD1-CD1 4.11Å; L524-F542 HydrophobicContact CD1-CD2 3.91Å; L524-F542 HydrophobicContact CD1-CE2 4.41Å; L524-F542 HydrophobicContact CD1-CG 3.73Å; L524-F542 HydrophobicContact CD2-CB 3.84Å; L524-F542 HydrophobicContact CD2-CG 4.47Å; L524-F593 HydrophobicContact CD1-CE2 3.72Å; L524-V612 WeakPolarHBondContact O-CG2 3.43Å
525	T	92.7	Very high	93.8	Very high	58 Å²	58	47.5 Å²	47.5	36%	0.356	21%	0.21	S	C	.	.	H	α-helix	trans	-92.8	-10.8	176.5	55.5	0	0	0	0	114.4	L521 E522 L523 L608	L521-T525 WeakPolarHBondContact O-CG2 3.21Å; L521-T525 PolarHBondContact O-N 3.1Å; L521-T525 PolarHBondContact O-OG1 3.43Å; E522-T525 PolarHBondContact O-N 3.44Å; E522-T525 PolarHBondContact O-OG1 3.01Å; L523-T525 PolarHBondContact O-N 3.13Å; T525-L608 HydrophobicContact CG2-CD2 4.31Å
526	D	90.9	Very high	93.8	Very high	46 Å²	46	45.7 Å²	45.7	25%	0.246	20%	0.203	C	C	.	.			trans	-105.5	121.3	175.2	-174.7	-1.2	0	0	0	111.2	L523 R528 Y529	L523-D526 PolarHBondContact O-N 3.27Å; D526-R528 PolarHBondContact O-N 3.35Å; D526-R528 VanDerWaalsContact OD1-CG 3.24Å; D526-R528 WeakPolarHBondContact OD1-CG 3.35Å; D526-R528 PolarHBondContact OD1-N 2.77Å; D526-R528 IonicContact OD1-NE 2.71Å; D526-R528 WeakPolarHBondContact OD2-CD 3.23Å; D526-R528 IonicContact OD2-NE 3.61Å; D526-Y529 HydrophobicContact CB-CD2 4Å; D526-Y529 HydrophobicContact CB-CE2 4.38Å; D526-Y529 PolarHBondContact O-N 3.26Å
527	W	90.3	Very high	93.5	Very high	82 Å²	82	47 Å²	47	31%	0.311	21%	0.213	S	C	.	.	G	3₁₀ helix	trans	-59.3	-20.4	-179.9	68.9	-89.7	0	0	0	113.7	R530 V612 C615 A616 H619	W527-R530 VanDerWaalsContact O-CB 3.25Å; W527-R530 WeakPolarHBondContact O-CB 2.96Å; W527-R530 PolarHBondContact O-N 3.21Å; W527-V612 HydrophobicContact CB-CG1 4.39Å; W527-C615 HydrophobicContact CB-CB 4.3Å; W527-C615 HydrophobicContact CG-CB 4.31Å; W527-A616 HydrophobicContact CB-CB 4.07Å; W527-H619 AromaticContact CE2-CD2 3.94Å; W527-H619 AromaticContact CE2-CE1 3.8Å; W527-H619 AromaticContact CE2-CG 3.67Å; W527-H619 AromaticContact CE2-ND1 3.58Å; W527-H619 HydrophobicContact CE3-CB 4.4Å; W527-H619 HydrophobicContact CH2-CB 3.76Å; W527-H619 AromaticContact CH2-CD2 3.94Å; W527-H619 AromaticContact CH2-CG 3.81Å; W527-H619 HydrophobicContact CZ2-CB 3.9Å; W527-H619 AromaticContact CZ2-CD2 3.36Å; W527-H619 WeakPolarHBondContact CZ2-CD2 3.16Å; W527-H619 AromaticContact CZ2-CE1 3.98Å; W527-H619 AromaticContact CZ2-CG 3.4Å; W527-H619 AromaticContact CZ2-ND1 3.79Å; W527-H619 AromaticContact CZ2-NE2 3.76Å; W527-H619 HydrophobicContact CZ3-CB 4.02Å; W527-H619 AromaticContact NE1-CE1 3.51Å; W527-H619 AromaticContact NE1-ND1 3.62Å; W527-H619 AromaticContact NE1-NE2 3.98Å
528	R	89.4	Confident	93.3	Very high	106 Å²	106	50.6 Å²	50.6	40%	0.4	24%	0.235	S	C	.	.	G	3₁₀ helix	trans	-67.1	-35.1	179.3	-62	170.1	-157.3	-138.8	-5.5	113.1	H487 D526 R530	H487-R528 PolarHBondContact CD2-NH1 3.44Å; H487-R528 PolarHBondContact CD2-NH2 2.74Å; H487-R528 PolarHBondContact CE1-NH2 2.75Å; H487-R528 PolarHBondContact NE2-NH1 2.95Å; H487-R528 PolarHBondContact NE2-NH2 2.92Å; D526-R528 PolarHBondContact O-N 3.35Å; D526-R528 VanDerWaalsContact OD1-CG 3.24Å; D526-R528 WeakPolarHBondContact OD1-CG 3.35Å; D526-R528 PolarHBondContact OD1-N 2.77Å; D526-R528 IonicContact OD1-NE 2.71Å; D526-R528 WeakPolarHBondContact OD2-CD 3.23Å; D526-R528 IonicContact OD2-NE 3.61Å; R528-R530 VanDerWaalsContact C-N 3.28Å; R528-R530 PolarHBondContact O-N 3.43Å
529	Y	92	Very high	93.2	Very high	95 Å²	95	51 Å²	51	37%	0.373	24%	0.239	S	C	.	.	G	3₁₀ helix	trans	-89.2	7.3	-177.5	-59.3	-69.7	0	0	0	113.2	L523 D526 E531 A532 I533 M553	L523-Y529 HydrophobicContact CD2-CD1 4.13Å; L523-Y529 HydrophobicContact CD2-CD2 3.63Å; L523-Y529 HydrophobicContact CD2-CE1 4.42Å; L523-Y529 HydrophobicContact CD2-CE2 3.98Å; L523-Y529 HydrophobicContact CD2-CG 3.72Å; D526-Y529 HydrophobicContact CB-CD2 4Å; D526-Y529 HydrophobicContact CB-CE2 4.38Å; D526-Y529 PolarHBondContact O-N 3.26Å; Y529-E531 PolarHBondContact O-N 3.28Å; Y529-E531 VanDerWaalsContact O-N 3.09Å; Y529-A532 WeakPolarHBondContact O-CA 3.42Å; Y529-A532 WeakPolarHBondContact O-CB 3.29Å; Y529-A532 PolarHBondContact O-N 3.43Å; Y529-I533 PolarHBondContact O-N 2.96Å; Y529-I533 VanDerWaalsContact O-O 3.11Å; Y529-M553 HydrophobicContact CD1-CE 4.15Å; Y529-M553 HydrophobicContact CD1-SD 3.7Å; Y529-M553 HydrophobicContact CE1-SD 3.69Å
530	R	89.5	Confident	93	Very high	110 Å²	110	50.6 Å²	50.6	42%	0.415	24%	0.237	S	C	.	.	G	3₁₀ helix	trans	-54.8	-29.1	-179.3	-170.1	179.9	-178.6	-177.3	0.8	113.8	W527 R528 I533 H534	W527-R530 VanDerWaalsContact O-CB 3.25Å; W527-R530 WeakPolarHBondContact O-CB 2.96Å; W527-R530 PolarHBondContact O-N 3.21Å; R528-R530 VanDerWaalsContact C-N 3.28Å; R528-R530 PolarHBondContact O-N 3.43Å; R530-I533 WeakPolarHBondContact CA-O 3.43Å; R530-H534 HydrophobicContact CG-CB 3.8Å; R530-H534 PolarHBondContact O-CD2 2.95Å
531	E	91.3	Very high	93	Very high	154 Å²	154	51.5 Å²	51.5	72%	0.72	24%	0.241	S	C	*	.	G	3₁₀ helix	trans	-71.1	-32.3	174.9	-63	-178	173	0	0	112.5	Y529 S545 N546	Y529-E531 PolarHBondContact O-N 3.28Å; Y529-E531 VanDerWaalsContact O-N 3.09Å; E531-S545 VanDerWaalsContact O-CB 3.26Å; E531-S545 WeakPolarHBondContact O-CB 3.24Å; E531-N546 PolarHBondContact O-ND2 2.71Å
532	A	94.7	Very high	93.1	Very high	1 Å²	1	51 Å²	51	1%	0.008	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.3	-43.7	178	0	0	0	0	0	112.4	Y529 S545 N546 Q549 V550 M553	Y529-A532 WeakPolarHBondContact O-CA 3.42Å; Y529-A532 WeakPolarHBondContact O-CB 3.29Å; Y529-A532 PolarHBondContact O-N 3.43Å; A532-S545 PolarHBondContact O-N 2.88Å; A532-N546 PolarHBondContact O-N 2.87Å; A532-N546 VanDerWaalsContact O-N 3.08Å; A532-Q549 HydrophobicContact CB-CB 4.37Å; A532-Q549 HydrophobicContact CB-CG 4.23Å; A532-V550 HydrophobicContact CB-CG2 3.96Å; A532-M553 HydrophobicContact CB-CE 3.92Å
533	I	96.8	Very high	93.2	Very high	2 Å²	2	52.2 Å²	52.2	1%	0.01	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	132.4	-175	179.5	172.8	0	0	0	110.4	L520 L523 L524 Y529 R530 F542 K543 L544 V550	L520-I533 HydrophobicContact CB-CD1 4.37Å; L520-I533 HydrophobicContact CD2-CD1 3.75Å; L523-I533 HydrophobicContact CB-CG2 3.6Å; L523-I533 HydrophobicContact CD1-CG2 4Å; L523-I533 HydrophobicContact CG-CG2 4.44Å; L524-I533 HydrophobicContact CD1-CD1 4.06Å; L524-I533 HydrophobicContact CD1-CG1 4.46Å; L524-I533 HydrophobicContact CD2-CD1 4.25Å; L524-I533 HydrophobicContact CD2-CG1 3.76Å; L524-I533 HydrophobicContact CG-CD1 3.78Å; L524-I533 HydrophobicContact CG-CG1 3.85Å; Y529-I533 PolarHBondContact O-N 2.96Å; Y529-I533 VanDerWaalsContact O-O 3.11Å; R530-I533 WeakPolarHBondContact CA-O 3.43Å; I533-F542 HydrophobicContact CD1-CD2 4.02Å; I533-F542 HydrophobicContact CD1-CE2 4.18Å; I533-F542 HydrophobicContact CG1-CD2 4.24Å; I533-K543 WeakPolarHBondContact CA-O 3.46Å; I533-L544 HydrophobicContact CB-CD2 4.24Å; I533-L544 HydrophobicContact CD1-CD2 3.55Å; I533-L544 HydrophobicContact CG1-CD2 3.84Å; I533-V550 HydrophobicContact CB-CG2 3.96Å; I533-V550 HydrophobicContact CG2-CG2 4.21Å
534	H	95.1	Very high	93.2	Very high	50 Å²	50	51.7 Å²	51.7	23%	0.231	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150	152.7	178.4	67.6	87.4	0	0	0	113.2	L524 R530 F542 K543 S545	L524-H534 VanDerWaalsContact CD2-C 3.44Å; R530-H534 HydrophobicContact CG-CB 3.8Å; R530-H534 PolarHBondContact O-CD2 2.95Å; H534-F542 CarbonylContact O-C 3.59Å; H534-F542 VanDerWaalsContact O-CA 3.31Å; H534-F542 WeakPolarHBondContact O-CA 3.5Å; H534-F542 WeakPolarHBondContact O-CB 3.47Å; H534-K543 PolarHBondContact N-O 3.03Å; H534-K543 PolarHBondContact O-N 2.63Å; H534-S545 PolarHBondContact CD2-OG 3.42Å; H534-S545 PolarHBondContact NE2-OG 3.26Å
535	W	95.8	Very high	93.2	Very high	12 Å²	12	53.5 Å²	53.5	5%	0.045	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.2	140.6	164	-59.9	107.9	0	0	0	110.9	L521 L524 F542 F593 L597 L608 Y609	L521-W535 HydrophobicContact CD1-CH2 3.88Å; L521-W535 HydrophobicContact CD1-CZ2 3.77Å; L524-W535 HydrophobicContact CB-CZ2 3.78Å; L524-W535 HydrophobicContact CD1-CH2 4.03Å; L524-W535 HydrophobicContact CD1-CZ2 4.01Å; L524-W535 HydrophobicContact CD1-CZ3 4.33Å; L524-W535 HydrophobicContact CD2-CD2 3.96Å; L524-W535 HydrophobicContact CD2-CG 4.04Å; L524-W535 HydrophobicContact CD2-CZ2 4.49Å; L524-W535 HydrophobicContact CG-CZ2 4.32Å; L524-W535 PolarHBondContact O-NE1 3.34Å; W535-F542 HydrophobicContact CE3-CB 4.1Å; W535-F542 HydrophobicContact CZ3-CB 4.47Å; W535-F593 AromaticContact CH2-CD2 3.83Å; W535-F593 HydrophobicContact CH2-CD2 3.83Å; W535-F593 HydrophobicContact CH2-CE2 4.17Å; W535-F593 AromaticContact CZ3-CD2 3.93Å; W535-F593 HydrophobicContact CZ3-CD2 3.93Å; W535-L597 HydrophobicContact CH2-CD1 4.03Å; W535-L608 HydrophobicContact CZ2-CD1 4.4Å; W535-Y609 HydrophobicContact CB-CD2 3.54Å; W535-Y609 HydrophobicContact CB-CE2 4.2Å; W535-Y609 HydrophobicContact CB-CG 4.43Å; W535-Y609 HydrophobicContact CG-CD2 4.31Å
536	I	93.7	Very high	93.4	Very high	56 Å²	56	54.2 Å²	54.2	29%	0.287	26%	0.255	S	S	.	.			trans	-95.6	-46	171.7	-53	176.7	0	0	0	109.2	E541 K543 V590	I536-E541 HydrophobicContact CB-CB 4.25Å; I536-E541 HydrophobicContact CD1-CB 4.44Å; I536-E541 PolarHBondContact N-O 3.28Å; I536-K543 HydrophobicContact CD1-CB 3.88Å; I536-K543 HydrophobicContact CG1-CB 3.89Å; I536-V590 HydrophobicContact CD1-CB 4.06Å; I536-V590 HydrophobicContact CD1-CG1 3.39Å; I536-V590 HydrophobicContact CD1-CG2 3.47Å; I536-V590 VanDerWaalsContact CD1-CG2 3.47Å
537	S	90.1	Very high	93.7	Very high	35 Å²	35	53 Å²	53	25%	0.245	25%	0.25	C	C	.	.	S	Bend	trans	-134.2	163.9	-169	-55.1	0	0	0	0	110.5	D539	S537-D539 VanDerWaalsContact C-N 3.27Å; S537-D539 VanDerWaalsContact CB-OD1 3.24Å; S537-D539 WeakPolarHBondContact CB-OD1 3.26Å
538	D	90.3	Very high	94	Very high	107 Å²	107	53.9 Å²	53.9	57%	0.572	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.5	-14.9	173.6	61.8	-28.8	0	0	0	113.9	G540 A605 G606 Y609	D538-G540 VanDerWaalsContact C-N 3.3Å; D538-G540 PolarHBondContact O-N 3.34Å; D538-A605 CarbonylContact O-C 3.6Å; D538-A605 VanDerWaalsContact O-CB 3.3Å; D538-A605 WeakPolarHBondContact O-CB 3.39Å; D538-G606 WeakPolarHBondContact O-CA 3.39Å; D538-G606 PolarHBondContact O-N 3.34Å; D538-Y609 HydrophobicContact CB-CD1 4.19Å
539	D	90.7	Very high	94.3	Very high	69 Å²	69	53 Å²	53	37%	0.369	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.8	-4.2	-179	80.4	-18.1	0	0	0	115.3	S537 E541 K592	S537-D539 VanDerWaalsContact C-N 3.27Å; S537-D539 VanDerWaalsContact CB-OD1 3.24Å; S537-D539 WeakPolarHBondContact CB-OD1 3.26Å; D539-E541 WeakPolarHBondContact OD1-CB 3.45Å; D539-E541 WeakPolarHBondContact OD1-CG 3.37Å; D539-E541 PolarHBondContact OD1-N 3.38Å; D539-K592 VanDerWaalsContact CG-NZ 3.25Å; D539-K592 WeakPolarHBondContact O-CE 3.48Å; D539-K592 IonicContact OD1-NZ 3.67Å; D539-K592 WeakPolarHBondContact OD2-CE 2.9Å; D539-K592 IonicContact OD2-NZ 3.64Å; D539-K592 PolarHBondContact OD2-NZ 3.48Å
540	G	92.5	Very high	94.5	Very high	1 Å²	1	48.5 Å²	48.5	1%	0.01	24%	0.24	C	C	.	.	S	Bend	trans	102.4	1.5	-176.4	0	0	0	0	0	115.9	D538 K592 F593	D538-G540 VanDerWaalsContact C-N 3.3Å; D538-G540 PolarHBondContact O-N 3.34Å; G540-K592 WeakPolarHBondContact O-CA 3.26Å; G540-F593 PolarHBondContact O-N 3.07Å
541	E	96.2	Very high	94.9	Very high	18 Å²	18	43.3 Å²	43.3	8%	0.084	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	133.7	169.3	-77.1	-159.8	-175.6	0	0	112.7	I536 D539 V584 K587 Y591 K592	I536-E541 HydrophobicContact CB-CB 4.25Å; I536-E541 HydrophobicContact CD1-CB 4.44Å; I536-E541 PolarHBondContact N-O 3.28Å; D539-E541 WeakPolarHBondContact OD1-CB 3.45Å; D539-E541 WeakPolarHBondContact OD1-CG 3.37Å; D539-E541 PolarHBondContact OD1-N 3.38Å; E541-V584 HydrophobicContact CG-CG2 3.92Å; E541-V584 WeakPolarHBondContact OE1-CG1 3.25Å; E541-K587 IonicContact OE1-NZ 3.88Å; E541-K587 PolarHBondContact OE1-NZ 3.05Å; E541-K587 IonicContact OE2-NZ 3.95Å; E541-K587 PolarHBondContact OE2-NZ 3.49Å; E541-Y591 CarbonylContact C-O 3.44Å; E541-Y591 WeakPolarHBondContact CA-O 3.32Å; E541-K592 HydrophobicContact CG-CB 4.21Å; E541-K592 HydrophobicContact CG-CD 3.99Å; E541-K592 HydrophobicContact CG-CG 4.3Å
542	F	96.9	Very high	95.1	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	150.5	174.5	69.2	-86.8	0	0	0	112.5	L520 L524 I533 H534 W535 L544 I581 V590 Y591 F593	L520-F542 HydrophobicContact CD1-CZ 4.5Å; L524-F542 HydrophobicContact CD1-CB 3.91Å; L524-F542 HydrophobicContact CD1-CD1 4.11Å; L524-F542 HydrophobicContact CD1-CD2 3.91Å; L524-F542 HydrophobicContact CD1-CE2 4.41Å; L524-F542 HydrophobicContact CD1-CG 3.73Å; L524-F542 HydrophobicContact CD2-CB 3.84Å; L524-F542 HydrophobicContact CD2-CG 4.47Å; I533-F542 HydrophobicContact CD1-CD2 4.02Å; I533-F542 HydrophobicContact CD1-CE2 4.18Å; I533-F542 HydrophobicContact CG1-CD2 4.24Å; H534-F542 CarbonylContact O-C 3.59Å; H534-F542 VanDerWaalsContact O-CA 3.31Å; H534-F542 WeakPolarHBondContact O-CA 3.5Å; H534-F542 WeakPolarHBondContact O-CB 3.47Å; W535-F542 HydrophobicContact CE3-CB 4.1Å; W535-F542 HydrophobicContact CZ3-CB 4.47Å; F542-L544 HydrophobicContact CD2-CD2 4.48Å; F542-L544 HydrophobicContact CE2-CD2 4.25Å; F542-I581 HydrophobicContact CE1-CG2 4.18Å; F542-I581 HydrophobicContact CZ-CD1 4.35Å; F542-I581 HydrophobicContact CZ-CG2 4.2Å; F542-V590 WeakPolarHBondContact O-CA 3.36Å; F542-Y591 WeakPolarHBondContact CD1-O 3.29Å; F542-Y591 VanDerWaalsContact CZ-CB 3.46Å; F542-Y591 HydrophobicContact CZ-CG 4.35Å; F542-Y591 PolarHBondContact N-O 2.86Å; F542-Y591 PolarHBondContact O-N 3.08Å; F542-F593 AromaticContact CD1-CD2 3.62Å; F542-F593 HydrophobicContact CD1-CD2 3.62Å; F542-F593 AromaticContact CD1-CE2 3.77Å; F542-F593 HydrophobicContact CD1-CE2 3.77Å; F542-F593 AromaticContact CE1-CD2 3.42Å; F542-F593 HydrophobicContact CE1-CD2 3.42Å; F542-F593 VanDerWaalsContact CE1-CD2 3.42Å; F542-F593 AromaticContact CE1-CE2 3.38Å; F542-F593 HydrophobicContact CE1-CE2 3.38Å; F542-F593 HydrophobicContact CE1-CG 4.37Å; F542-F593 HydrophobicContact CE1-CZ 4.33Å; F542-F593 HydrophobicContact CZ-CD2 4.42Å; F542-F593 AromaticContact CZ-CE2 3.97Å; F542-F593 HydrophobicContact CZ-CE2 3.97Å
543	K	96.5	Very high	95.2	Very high	81 Å²	81	40.6 Å²	40.6	35%	0.352	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	136.8	178.5	-168.7	179.1	177.4	-166.3	0	110.6	I533 H534 I536 V590	I533-K543 WeakPolarHBondContact CA-O 3.46Å; H534-K543 PolarHBondContact N-O 3.03Å; H534-K543 PolarHBondContact O-N 2.63Å; I536-K543 HydrophobicContact CD1-CB 3.88Å; I536-K543 HydrophobicContact CG1-CB 3.89Å; K543-V590 HydrophobicContact CB-CG2 4.27Å; K543-V590 HydrophobicContact CG-CG2 4.1Å
544	L	97.1	Very high	95.1	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	106.9	158.7	-49.3	175	0	0	0	107.1	L520 I533 F542 P547 V550 Y565 L568 L572 F589 Y591	L520-L544 HydrophobicContact CD2-CD2 4.25Å; I533-L544 HydrophobicContact CB-CD2 4.24Å; I533-L544 HydrophobicContact CD1-CD2 3.55Å; I533-L544 HydrophobicContact CG1-CD2 3.84Å; F542-L544 HydrophobicContact CD2-CD2 4.48Å; F542-L544 HydrophobicContact CE2-CD2 4.25Å; L544-P547 HydrophobicContact CB-CB 4.37Å; L544-V550 HydrophobicContact CD2-CG1 4.18Å; L544-V550 HydrophobicContact CD2-CG2 4.23Å; L544-Y565 HydrophobicContact CD1-CD2 4.36Å; L544-Y565 HydrophobicContact CD1-CE2 3.73Å; L544-L568 HydrophobicContact CD1-CD2 4.44Å; L544-L572 HydrophobicContact CD1-CD1 4.36Å; L544-F589 HydrophobicContact CB-CB 4.27Å; L544-F589 PolarHBondContact N-O 3.07Å; L544-F589 VanDerWaalsContact O-CB 3.25Å; L544-F589 WeakPolarHBondContact O-CB 3.08Å; L544-Y591 HydrophobicContact CD1-CD2 4.33Å; L544-Y591 HydrophobicContact CD1-CE2 4.02Å; L544-Y591 HydrophobicContact CG-CD2 4.47Å
545	S	95.8	Very high	95.2	Very high	40 Å²	40	39.2 Å²	39.2	28%	0.28	21%	0.211	S	C	.	.	S	Bend	trans	-81.8	-44.2	178.9	-78.2	0	0	0	0	111	E531 A532 H534 P547	E531-S545 VanDerWaalsContact O-CB 3.26Å; E531-S545 WeakPolarHBondContact O-CB 3.24Å; A532-S545 PolarHBondContact O-N 2.88Å; H534-S545 PolarHBondContact CD2-OG 3.42Å; H534-S545 PolarHBondContact NE2-OG 3.26Å; S545-P547 VanDerWaalsContact O-CD 3.23Å; S545-P547 WeakPolarHBondContact O-CD 3.46Å
546	N	95.6	Very high	95.1	Very high	74 Å²	74	46.7 Å²	46.7	40%	0.396	25%	0.246	S	C	.	.	S	Bend	trans	-112.6	81.1	170.9	-61.2	-21.6	0	0	0	109.5	E531 A532 E548 Q549 V550	E531-N546 PolarHBondContact O-ND2 2.71Å; A532-N546 PolarHBondContact O-N 2.87Å; A532-N546 VanDerWaalsContact O-N 3.08Å; N546-E548 VanDerWaalsContact C-N 3.31Å; N546-E548 PolarHBondContact O-N 3.27Å; N546-Q549 HydrophobicContact CB-CB 3.67Å; N546-Q549 PolarHBondContact ND2-OE1 2.96Å; N546-Q549 WeakPolarHBondContact O-CB 3.47Å; N546-Q549 PolarHBondContact O-N 3.11Å; N546-V550 PolarHBondContact O-N 2.84Å; N546-V550 VanDerWaalsContact O-N 3.16Å
547	P	96.6	Very high	95	Very high	21 Å²	21	49.4 Å²	49.4	14%	0.136	25%	0.253	C	S	.	.	H	α-helix	trans	-57.7	-37.8	-172.9	19.1	-31.4	0	0	0	114	L544 S545 V550 A551 Y565 F589	L544-P547 HydrophobicContact CB-CB 4.37Å; S545-P547 VanDerWaalsContact O-CD 3.23Å; S545-P547 WeakPolarHBondContact O-CD 3.46Å; P547-V550 PolarHBondContact O-N 3.3Å; P547-A551 WeakPolarHBondContact O-CB 3.44Å; P547-A551 PolarHBondContact O-N 3.07Å; P547-Y565 HydrophobicContact CB-CD1 4.44Å; P547-Y565 HydrophobicContact CB-CD2 3.42Å; P547-Y565 VanDerWaalsContact CB-CD2 3.42Å; P547-Y565 HydrophobicContact CB-CE2 3.9Å; P547-Y565 HydrophobicContact CB-CG 3.72Å; P547-F589 HydrophobicContact CB-CD1 4.19Å; P547-F589 HydrophobicContact CB-CE1 4.28Å; P547-F589 HydrophobicContact CG-CD1 4.07Å; P547-F589 HydrophobicContact CG-CE1 3.9Å; P547-F589 HydrophobicContact CG-CZ 4.17Å
548	E	96.8	Very high	95.1	Very high	100 Å²	100	50.8 Å²	50.8	47%	0.467	25%	0.254	S	S	.	.	H	α-helix	trans	-71	-32.1	176.3	-63	-57	160.3	0	0	113	N546 V550 A551 A552 N564 Y565	N546-E548 VanDerWaalsContact C-N 3.31Å; N546-E548 PolarHBondContact O-N 3.27Å; E548-V550 VanDerWaalsContact C-N 3.35Å; E548-A551 PolarHBondContact O-N 3.07Å; E548-A552 WeakPolarHBondContact O-CB 3.47Å; E548-A552 PolarHBondContact O-N 3.36Å; E548-N564 WeakPolarHBondContact OE2-CA 3.41Å; E548-Y565 WeakPolarHBondContact OE1-CB 3.4Å; E548-Y565 PolarHBondContact OE1-N 2.93Å; E548-Y565 PolarHBondContact OE2-N 2.8Å
549	Q	96.3	Very high	95.2	Very high	88 Å²	88	52.1 Å²	52.1	41%	0.411	26%	0.261	S	S	.	.	H	α-helix	trans	-65	-41.9	174.7	-166.7	179.6	10.7	0	0	110.5	A532 N546 A552 M553	A532-Q549 HydrophobicContact CB-CB 4.37Å; A532-Q549 HydrophobicContact CB-CG 4.23Å; N546-Q549 HydrophobicContact CB-CB 3.67Å; N546-Q549 PolarHBondContact ND2-OE1 2.96Å; N546-Q549 WeakPolarHBondContact O-CB 3.47Å; N546-Q549 PolarHBondContact O-N 3.11Å; Q549-A552 PolarHBondContact O-N 3.47Å; Q549-M553 HydrophobicContact CG-CE 4.35Å; Q549-M553 VanDerWaalsContact O-CG 3.29Å; Q549-M553 WeakPolarHBondContact O-CG 3.25Å; Q549-M553 PolarHBondContact O-N 3.32Å
550	V	97.2	Very high	95.2	Very high	0 Å²	0	54.8 Å²	54.8	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-65.6	-38.8	174.1	-178.5	0	0	0	0	111.3	F519 L520 L523 A532 I533 L544 N546 P547 E548 M553 W554 L568	F519-V550 HydrophobicContact CE1-CG1 4.46Å; L520-V550 HydrophobicContact CD2-CG1 3.7Å; L523-V550 HydrophobicContact CD1-CG1 4.09Å; A532-V550 HydrophobicContact CB-CG2 3.96Å; I533-V550 HydrophobicContact CB-CG2 3.96Å; I533-V550 HydrophobicContact CG2-CG2 4.21Å; L544-V550 HydrophobicContact CD2-CG1 4.18Å; L544-V550 HydrophobicContact CD2-CG2 4.23Å; N546-V550 PolarHBondContact O-N 2.84Å; N546-V550 VanDerWaalsContact O-N 3.16Å; P547-V550 PolarHBondContact O-N 3.3Å; E548-V550 VanDerWaalsContact C-N 3.35Å; V550-M553 HydrophobicContact CG2-CE 4.29Å; V550-W554 WeakPolarHBondContact O-CB 3.36Å; V550-W554 PolarHBondContact O-N 2.88Å; V550-L568 HydrophobicContact CG1-CD1 4.19Å
551	A	97.3	Very high	95.2	Very high	0 Å²	0	60.7 Å²	60.7	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-67.4	-40.3	175.9	0	0	0	0	0	113.2	P547 E548 W554 G555 M563 L568	P547-A551 WeakPolarHBondContact O-CB 3.44Å; P547-A551 PolarHBondContact O-N 3.07Å; E548-A551 PolarHBondContact O-N 3.07Å; A551-W554 PolarHBondContact O-N 3.04Å; A551-G555 PolarHBondContact O-N 2.92Å; A551-M563 WeakPolarHBondContact O-CG 3.32Å; A551-L568 HydrophobicContact CB-CB 4.33Å; A551-L568 HydrophobicContact CB-CD1 4.14Å
552	A	96.2	Very high	95	Very high	59 Å²	59	63.3 Å²	63.3	49%	0.488	33%	0.332	S	S	.	.	H	α-helix	trans	-64.7	-43.5	174.6	0	0	0	0	0	111.6	E548 Q549 W554 G555 H556	E548-A552 WeakPolarHBondContact O-CB 3.47Å; E548-A552 PolarHBondContact O-N 3.36Å; Q549-A552 PolarHBondContact O-N 3.47Å; A552-W554 PolarHBondContact O-N 3.38Å; A552-G555 PolarHBondContact O-N 3.3Å; A552-H556 PolarHBondContact O-N 2.84Å
553	M	95.6	Very high	94.9	Very high	40 Å²	40	64.8 Å²	64.8	20%	0.197	34%	0.34	C	S	.	.	H	α-helix	trans	-63.3	-40	174.1	-68.8	-174.2	-64	0	0	111.9	F519 L523 Y529 A532 Q549 V550 H556 R557	F519-M553 HydrophobicContact CZ-CB 3.79Å; L523-M553 HydrophobicContact CD1-CE 3.8Å; L523-M553 HydrophobicContact CD2-CE 4.17Å; L523-M553 HydrophobicContact CD2-SD 4.25Å; Y529-M553 HydrophobicContact CD1-CE 4.15Å; Y529-M553 HydrophobicContact CD1-SD 3.7Å; Y529-M553 HydrophobicContact CE1-SD 3.69Å; A532-M553 HydrophobicContact CB-CE 3.92Å; Q549-M553 HydrophobicContact CG-CE 4.35Å; Q549-M553 VanDerWaalsContact O-CG 3.29Å; Q549-M553 WeakPolarHBondContact O-CG 3.25Å; Q549-M553 PolarHBondContact O-N 3.32Å; V550-M553 HydrophobicContact CG2-CE 4.29Å; M553-H556 PolarHBondContact O-N 2.82Å; M553-R557 WeakPolarHBondContact O-CB 3.41Å; M553-R557 PolarHBondContact O-N 3.35Å
554	W	96	Very high	94.9	Very high	22 Å²	22	63.7 Å²	63.7	8%	0.083	34%	0.338	C	S	.	.	H	α-helix	trans	-64.5	-40.5	172.9	178.2	-129.6	0	0	0	112.1	V514 L516 F519 V550 A551 A552 R557 K558 L568	V514-W554 HydrophobicContact CG1-CZ3 4.17Å; L516-W554 HydrophobicContact CB-CH2 4.11Å; L516-W554 HydrophobicContact CB-CZ2 3.81Å; L516-W554 HydrophobicContact CD1-CD2 3.83Å; L516-W554 HydrophobicContact CD1-CE3 4.32Å; L516-W554 HydrophobicContact CD1-CG 4.04Å; L516-W554 HydrophobicContact CD1-CZ2 4.22Å; F519-W554 HydrophobicContact CB-CE3 3.77Å; F519-W554 HydrophobicContact CB-CZ3 3.6Å; F519-W554 HydrophobicContact CD1-CB 4.06Å; F519-W554 HydrophobicContact CD1-CD2 4.08Å; F519-W554 AromaticContact CD1-CE3 3.46Å; F519-W554 HydrophobicContact CD1-CE3 3.46Å; F519-W554 VanDerWaalsContact CD1-CE3 3.46Å; F519-W554 HydrophobicContact CD1-CG 4.35Å; F519-W554 HydrophobicContact CD1-CZ3 4.2Å; F519-W554 HydrophobicContact CD2-CE3 4.15Å; F519-W554 HydrophobicContact CE1-CB 3.56Å; F519-W554 HydrophobicContact CE1-CD2 4.46Å; F519-W554 HydrophobicContact CE1-CE3 4.07Å; F519-W554 HydrophobicContact CE1-CG 4.32Å; F519-W554 AromaticContact CG-CE3 3.49Å; F519-W554 HydrophobicContact CG-CE3 3.49Å; F519-W554 VanDerWaalsContact CG-CE3 3.49Å; F519-W554 AromaticContact CG-CZ3 3.87Å; F519-W554 HydrophobicContact CG-CZ3 3.87Å; F519-W554 HydrophobicContact CZ-CB 4.13Å; V550-W554 WeakPolarHBondContact O-CB 3.36Å; V550-W554 PolarHBondContact O-N 2.88Å; A551-W554 PolarHBondContact O-N 3.04Å; A552-W554 PolarHBondContact O-N 3.38Å; W554-R557 HydrophobicContact CE3-CB 4.42Å; W554-R557 PolarHBondContact O-N 3.43Å; W554-K558 HydrophobicContact CD2-CG 3.81Å; W554-K558 HydrophobicContact CE3-CD 4.36Å; W554-K558 HydrophobicContact CE3-CG 3.74Å; W554-K558 HydrophobicContact CH2-CD 3.55Å; W554-K558 HydrophobicContact CH2-CG 3.61Å; W554-K558 HydrophobicContact CZ2-CD 3.96Å; W554-K558 HydrophobicContact CZ2-CG 3.64Å; W554-K558 HydrophobicContact CZ3-CD 3.76Å; W554-K558 HydrophobicContact CZ3-CG 3.65Å; W554-K558 WeakPolarHBondContact O-CB 3.24Å; W554-K558 WeakPolarHBondContact O-CG 3.48Å; W554-K558 PolarHBondContact O-N 3.17Å; W554-L568 HydrophobicContact CB-CD1 3.96Å; W554-L568 HydrophobicContact CG-CD1 4.2Å
555	G	95.3	Very high	95	Very high	1 Å²	1	64.9 Å²	64.9	1%	0.01	34%	0.343	C	S	.	.	H	α-helix	trans	-56.1	-53.2	172.7	0	0	0	0	0	111.5	A551 A552 R557 K558 N559 K560 M563	A551-G555 PolarHBondContact O-N 2.92Å; A552-G555 PolarHBondContact O-N 3.3Å; G555-R557 PolarHBondContact O-N 3.5Å; G555-K558 CarbonylContact O-C 3.04Å; G555-K558 PolarHBondContact O-N 2.61Å; G555-N559 WeakPolarHBondContact O-CA 3.2Å; G555-N559 PolarHBondContact O-N 2.91Å; G555-K560 CarbonylContact C-O 3.27Å; G555-K560 WeakPolarHBondContact CA-O 3.19Å; G555-K560 PolarHBondContact O-N 2.81Å; G555-M563 VanDerWaalsContact CA-CB 3.48Å
556	H	93.6	Very high	95	Very high	168 Å²	168	68.1 Å²	68.1	78%	0.778	35%	0.353	S	S	*	.	H	α-helix	trans	-57.5	-50.2	176	-169.7	80.9	0	0	0	111.8	A552 M553 K558 N559	A552-H556 PolarHBondContact O-N 2.84Å; M553-H556 PolarHBondContact O-N 2.82Å; H556-K558 PolarHBondContact O-N 2.81Å; H556-K558 VanDerWaalsContact O-N 3.1Å; H556-N559 PolarHBondContact O-N 3.37Å
557	R	92.9	Very high	95	Very high	114 Å²	114	70 Å²	70	43%	0.43	36%	0.358	S	S	.	.	H	α-helix	trans	-58.9	-23.8	178	-170	64.5	154.5	123.2	-6.4	113.9	V514 F519 E522 M553 W554 G555	V514-R557 HydrophobicContact CG1-CG 4.2Å; F519-R557 HydrophobicContact CD2-CB 4.15Å; F519-R557 HydrophobicContact CD2-CG 3.74Å; F519-R557 HydrophobicContact CE2-CB 3.93Å; F519-R557 HydrophobicContact CE2-CG 3.99Å; E522-R557 VanDerWaalsContact CD-NH2 3.35Å; E522-R557 IonicContact OE1-CZ 3.7Å; E522-R557 IonicContact OE1-NE 3.6Å; E522-R557 IonicContact OE1-NH2 2.91Å; E522-R557 PolarHBondContact OE1-NH2 3.3Å; E522-R557 IonicContact OE2-CZ 2.81Å; E522-R557 IonicContact OE2-NE 3.35Å; E522-R557 IonicContact OE2-NH2 3.62Å; E522-R557 PolarHBondContact OE2-NH2 3.5Å; M553-R557 WeakPolarHBondContact O-CB 3.41Å; M553-R557 PolarHBondContact O-N 3.35Å; W554-R557 HydrophobicContact CE3-CB 4.42Å; W554-R557 PolarHBondContact O-N 3.43Å; G555-R557 PolarHBondContact O-N 3.5Å
558	K	92.3	Very high	95	Very high	64 Å²	64	69 Å²	69	28%	0.278	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.1	3.4	178.7	-68.5	-58.3	-57.3	177.3	0	114.6	V514 W554 G555 H556 K560	V514-K558 HydrophobicContact CG1-CD 4.11Å; W554-K558 HydrophobicContact CD2-CG 3.81Å; W554-K558 HydrophobicContact CE3-CD 4.36Å; W554-K558 HydrophobicContact CE3-CG 3.74Å; W554-K558 HydrophobicContact CH2-CD 3.55Å; W554-K558 HydrophobicContact CH2-CG 3.61Å; W554-K558 HydrophobicContact CZ2-CD 3.96Å; W554-K558 HydrophobicContact CZ2-CG 3.64Å; W554-K558 HydrophobicContact CZ3-CD 3.76Å; W554-K558 HydrophobicContact CZ3-CG 3.65Å; W554-K558 WeakPolarHBondContact O-CB 3.24Å; W554-K558 WeakPolarHBondContact O-CG 3.48Å; W554-K558 PolarHBondContact O-N 3.17Å; G555-K558 CarbonylContact O-C 3.04Å; G555-K558 PolarHBondContact O-N 2.61Å; H556-K558 PolarHBondContact O-N 2.81Å; H556-K558 VanDerWaalsContact O-N 3.1Å; K558-K560 VanDerWaalsContact C-N 3.29Å; K558-K560 HydrophobicContact CB-CG 4.31Å; K558-K560 PolarHBondContact O-N 2.99Å
559	N	91.1	Very high	95	Very high	134 Å²	134	64.3 Å²	64.3	72%	0.717	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.6	48.6	-167.7	-162.4	25.5	0	0	0	113.3	G555 H556	G555-N559 WeakPolarHBondContact O-CA 3.2Å; G555-N559 PolarHBondContact O-N 2.91Å; H556-N559 PolarHBondContact O-N 3.37Å
560	K	91.8	Very high	95	Very high	125 Å²	125	65.7 Å²	65.7	54%	0.543	33%	0.331	S	S	.	.			trans	-125.3	85.1	176.3	-69.2	-163.6	173.4	-161.4	0	109.3	G555 K558 A562 M563	G555-K560 CarbonylContact C-O 3.27Å; G555-K560 WeakPolarHBondContact CA-O 3.19Å; G555-K560 PolarHBondContact O-N 2.81Å; K558-K560 VanDerWaalsContact C-N 3.29Å; K558-K560 HydrophobicContact CB-CG 4.31Å; K558-K560 PolarHBondContact O-N 2.99Å; K560-A562 VanDerWaalsContact C-N 3.27Å; K560-A562 PolarHBondContact O-N 2.8Å; K560-M563 HydrophobicContact CB-CE 4.21Å; K560-M563 HydrophobicContact CD-CE 4.1Å; K560-M563 VanDerWaalsContact O-CB 3.28Å; K560-M563 WeakPolarHBondContact O-CB 3.46Å; K560-M563 PolarHBondContact O-N 3.05Å
561	P	91.6	Very high	94.9	Very high	125 Å²	125	67 Å²	67	81%	0.812	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-33.4	-176.8	23.5	-33.3	0	0	0	112.8	M563	P561-M563 PolarHBondContact O-N 3.47Å
562	A	93.6	Very high	94.8	Very high	73 Å²	73	67 Å²	67	60%	0.603	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.6	32	175.9	0	0	0	0	0	114.2	K560 K567	K560-A562 VanDerWaalsContact C-N 3.27Å; K560-A562 PolarHBondContact O-N 2.8Å; A562-K567 WeakPolarHBondContact O-CD 3.49Å; A562-K567 PolarHBondContact O-NZ 2.83Å
563	M	94.6	Very high	94.8	Very high	31 Å²	31	69.7 Å²	69.7	15%	0.153	34%	0.34	C	S	.	.			trans	-91.5	127.6	174.2	-173.5	69.3	66.5	0	0	109.9	A551 G555 K560 P561 K567	A551-M563 WeakPolarHBondContact O-CG 3.32Å; G555-M563 VanDerWaalsContact CA-CB 3.48Å; K560-M563 HydrophobicContact CB-CE 4.21Å; K560-M563 HydrophobicContact CD-CE 4.1Å; K560-M563 VanDerWaalsContact O-CB 3.28Å; K560-M563 WeakPolarHBondContact O-CB 3.46Å; K560-M563 PolarHBondContact O-N 3.05Å; P561-M563 PolarHBondContact O-N 3.47Å; M563-K567 HydrophobicContact SD-CB 3.79Å
564	N	96.7	Very high	94.7	Very high	59 Å²	59	75.2 Å²	75.2	32%	0.316	36%	0.36	S	S	.	.			trans	-134.3	172.5	177.9	64.3	-7.7	0	0	0	110	E548 E566 K567 L568	E548-N564 WeakPolarHBondContact OE2-CA 3.41Å; N564-E566 PolarHBondContact O-N 3.49Å; N564-K567 PolarHBondContact O-N 3.4Å; N564-K567 WeakPolarHBondContact OD1-CD 3.31Å; N564-K567 VanDerWaalsContact OD1-CG 3.24Å; N564-K567 WeakPolarHBondContact OD1-CG 3.42Å; N564-K567 PolarHBondContact OD1-N 2.98Å; N564-L568 PolarHBondContact O-N 3.45Å; N564-L568 VanDerWaalsContact O-N 3.07Å
565	Y	97.4	Very high	94.7	Very high	25 Å²	25	76.3 Å²	76.3	10%	0.098	36%	0.364	C	S	.	.	H	α-helix	trans	-59.2	-34.7	-177.3	177.1	-106.9	0	0	0	112.6	L544 P547 E548 K567 L568 S569 F589 Y591	L544-Y565 HydrophobicContact CD1-CD2 4.36Å; L544-Y565 HydrophobicContact CD1-CE2 3.73Å; P547-Y565 HydrophobicContact CB-CD1 4.44Å; P547-Y565 HydrophobicContact CB-CD2 3.42Å; P547-Y565 VanDerWaalsContact CB-CD2 3.42Å; P547-Y565 HydrophobicContact CB-CE2 3.9Å; P547-Y565 HydrophobicContact CB-CG 3.72Å; E548-Y565 WeakPolarHBondContact OE1-CB 3.4Å; E548-Y565 PolarHBondContact OE1-N 2.93Å; E548-Y565 PolarHBondContact OE2-N 2.8Å; Y565-K567 PolarHBondContact O-N 3.19Å; Y565-L568 CarbonylContact O-C 3.55Å; Y565-L568 PolarHBondContact O-N 3.22Å; Y565-S569 VanDerWaalsContact O-CB 3.29Å; Y565-S569 WeakPolarHBondContact O-CB 3.35Å; Y565-S569 PolarHBondContact O-N 2.82Å; Y565-F589 HydrophobicContact CD1-CE1 4.27Å; Y565-F589 HydrophobicContact CE1-CD1 4.05Å; Y565-F589 AromaticContact CE1-CE1 3.7Å; Y565-F589 HydrophobicContact CE1-CE1 3.7Å; Y565-F589 HydrophobicContact CE2-CD1 4.26Å; Y565-F589 AromaticContact CZ-CD1 3.71Å; Y565-F589 AromaticContact CZ-CE1 3.88Å; Y565-Y591 PolarHBondContact OH-OH 2.9Å; Y565-Y591 VanDerWaalsContact OH-OH 3.05Å
566	E	95.7	Very high	94.6	Very high	107 Å²	107	80.1 Å²	80.1	50%	0.5	38%	0.379	S	S	.	.	H	α-helix	trans	-61.7	-42.6	177.8	-74.9	-52.3	106.3	0	0	112.9	N564 S569 R570	N564-E566 PolarHBondContact O-N 3.49Å; E566-S569 PolarHBondContact O-OG 3.27Å; E566-R570 WeakPolarHBondContact O-CB 3.27Å; E566-R570 PolarHBondContact O-N 3.3Å
567	K	96.2	Very high	94.3	Very high	113 Å²	113	79.8 Å²	79.8	49%	0.491	38%	0.383	S	S	.	.	H	α-helix	trans	-69	-35.9	175.4	-67.4	167.9	-163.9	178	0	111.9	A562 M563 N564 Y565 A571	A562-K567 WeakPolarHBondContact O-CD 3.49Å; A562-K567 PolarHBondContact O-NZ 2.83Å; M563-K567 HydrophobicContact SD-CB 3.79Å; N564-K567 PolarHBondContact O-N 3.4Å; N564-K567 WeakPolarHBondContact OD1-CD 3.31Å; N564-K567 VanDerWaalsContact OD1-CG 3.24Å; N564-K567 WeakPolarHBondContact OD1-CG 3.42Å; N564-K567 PolarHBondContact OD1-N 2.98Å; Y565-K567 PolarHBondContact O-N 3.19Å; K567-A571 PolarHBondContact O-N 3.09Å
568	L	96.9	Very high	94	Very high	0 Å²	0	75.9 Å²	75.9	0%	0	38%	0.378	C	S	.	.	H	α-helix	trans	-70.3	-41.8	175.4	-171.4	152.3	0	0	0	111.9	L516 L544 V550 A551 W554 N564 Y565 A571 L572	L516-L568 HydrophobicContact CD1-CD1 4.15Å; L516-L568 HydrophobicContact CD1-CG 4.15Å; L516-L568 HydrophobicContact CD2-CG 4.24Å; L544-L568 HydrophobicContact CD1-CD2 4.44Å; V550-L568 HydrophobicContact CG1-CD1 4.19Å; A551-L568 HydrophobicContact CB-CB 4.33Å; A551-L568 HydrophobicContact CB-CD1 4.14Å; W554-L568 HydrophobicContact CB-CD1 3.96Å; W554-L568 HydrophobicContact CG-CD1 4.2Å; N564-L568 PolarHBondContact O-N 3.45Å; N564-L568 VanDerWaalsContact O-N 3.07Å; Y565-L568 CarbonylContact O-C 3.55Å; Y565-L568 PolarHBondContact O-N 3.22Å; L568-A571 CarbonylContact O-C 3.48Å; L568-A571 WeakPolarHBondContact O-CA 3.38Å; L568-A571 WeakPolarHBondContact O-CB 3.42Å; L568-A571 PolarHBondContact O-N 3.46Å; L568-A571 VanDerWaalsContact O-N 3.11Å; L568-L572 HydrophobicContact CD2-CD1 3.67Å; L568-L572 HydrophobicContact CD2-CG 4.07Å; L568-L572 PolarHBondContact O-N 2.85Å
569	S	96.7	Very high	93.7	Very high	2 Å²	2	77.9 Å²	77.9	1%	0.014	39%	0.392	C	S	.	.	H	α-helix	trans	-67.9	-36.8	178.1	94.5	0	0	0	0	110.8	Y565 E566 A571 L572 R573	Y565-S569 VanDerWaalsContact O-CB 3.29Å; Y565-S569 WeakPolarHBondContact O-CB 3.35Å; Y565-S569 PolarHBondContact O-N 2.82Å; E566-S569 PolarHBondContact O-OG 3.27Å; S569-A571 PolarHBondContact O-N 3.38Å; S569-L572 PolarHBondContact O-N 3.23Å; S569-R573 WeakPolarHBondContact O-CG 3.48Å; S569-R573 PolarHBondContact O-N 3.06Å; S569-R573 PolarHBondContact OG-NH2 3.21Å; S569-R573 VanDerWaalsContact OG-NH2 3.13Å
570	R	96.2	Very high	93.7	Very high	117 Å²	117	74.4 Å²	74.4	44%	0.442	37%	0.372	S	S	.	.	H	α-helix	trans	-62.2	-33.4	170.9	-176.5	62.8	-167.4	92.5	-12.1	112.1	E566 Y574	E566-R570 WeakPolarHBondContact O-CB 3.27Å; E566-R570 PolarHBondContact O-N 3.3Å; R570-Y574 VanDerWaalsContact CZ-CZ 3.44Å; R570-Y574 PolarHBondContact NH2-OH 3.46Å; R570-Y574 WeakPolarHBondContact O-CD2 3.32Å
571	A	94.5	Very high	93.8	Very high	29 Å²	29	68.5 Å²	68.5	24%	0.24	35%	0.346	C	S	.	.	H	α-helix	trans	-74.1	-39.4	173.8	0	0	0	0	0	112.7	L516 K567 L568 S569 R573 Y574	L516-A571 HydrophobicContact CD2-CB 3.61Å; K567-A571 PolarHBondContact O-N 3.09Å; L568-A571 CarbonylContact O-C 3.48Å; L568-A571 WeakPolarHBondContact O-CA 3.38Å; L568-A571 WeakPolarHBondContact O-CB 3.42Å; L568-A571 PolarHBondContact O-N 3.46Å; L568-A571 VanDerWaalsContact O-N 3.11Å; S569-A571 PolarHBondContact O-N 3.38Å; A571-R573 VanDerWaalsContact C-N 3.3Å; A571-R573 PolarHBondContact O-N 3.06Å; A571-Y574 PolarHBondContact O-N 3.46Å; A571-Y574 VanDerWaalsContact O-N 3.17Å
572	L	95.8	Very high	94	Very high	0 Å²	0	64.1 Å²	64.1	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-59.8	-37.6	172.8	-79.3	174.5	0	0	0	112.6	L516 L520 L544 L568 S569 Y574 Y575 Y576 I581 Y591	L516-L572 HydrophobicContact CD2-CD2 4.29Å; L516-L572 HydrophobicContact CD2-CG 4.18Å; L520-L572 HydrophobicContact CD1-CD2 3.67Å; L544-L572 HydrophobicContact CD1-CD1 4.36Å; L568-L572 HydrophobicContact CD2-CD1 3.67Å; L568-L572 HydrophobicContact CD2-CG 4.07Å; L568-L572 PolarHBondContact O-N 2.85Å; S569-L572 PolarHBondContact O-N 3.23Å; L572-Y574 PolarHBondContact O-N 3.32Å; L572-Y575 HydrophobicContact CD2-CD2 4.25Å; L572-Y575 PolarHBondContact O-N 3.38Å; L572-Y576 WeakPolarHBondContact O-CD1 3.45Å; L572-Y576 WeakPolarHBondContact O-CE1 3.33Å; L572-I581 HydrophobicContact CD2-CD1 4.16Å; L572-I581 HydrophobicContact CD2-CG2 4.39Å; L572-Y591 HydrophobicContact CB-CE1 4.15Å; L572-Y591 HydrophobicContact CD1-CD1 4.18Å; L572-Y591 HydrophobicContact CD1-CD2 4.12Å; L572-Y591 HydrophobicContact CD1-CE1 3.81Å; L572-Y591 HydrophobicContact CD1-CE2 3.77Å; L572-Y591 HydrophobicContact CD1-CG 4.32Å
573	R	95.6	Very high	94.1	Very high	114 Å²	114	62.7 Å²	62.7	43%	0.43	30%	0.299	S	S	.	.	G	3₁₀ helix	trans	-57.8	-27.6	175.9	-69.9	172.9	-141.3	-162.4	8.8	113.4	S569 A571 Y575 Y576	S569-R573 WeakPolarHBondContact O-CG 3.48Å; S569-R573 PolarHBondContact O-N 3.06Å; S569-R573 PolarHBondContact OG-NH2 3.21Å; S569-R573 VanDerWaalsContact OG-NH2 3.13Å; A571-R573 VanDerWaalsContact C-N 3.3Å; A571-R573 PolarHBondContact O-N 3.06Å; R573-Y575 PolarHBondContact O-N 3.43Å; R573-Y576 HydrophobicContact CB-CE2 4.15Å; R573-Y576 HydrophobicContact CG-CE2 3.75Å; R573-Y576 PolarHBondContact O-N 3.46Å
574	Y	95	Very high	94.1	Very high	157 Å²	157	62.1 Å²	62.1	62%	0.616	30%	0.297	S	S	*	.	G	3₁₀ helix	trans	-73.2	-10.2	175.5	-65	-59.3	0	0	0	114.2	R570 A571 L572	R570-Y574 VanDerWaalsContact CZ-CZ 3.44Å; R570-Y574 PolarHBondContact NH2-OH 3.46Å; R570-Y574 WeakPolarHBondContact O-CD2 3.32Å; A571-Y574 PolarHBondContact O-N 3.46Å; A571-Y574 VanDerWaalsContact O-N 3.17Å; L572-Y574 PolarHBondContact O-N 3.32Å
575	Y	94.8	Very high	94	Very high	44 Å²	44	66.8 Å²	66.8	17%	0.173	32%	0.317	C	S	.	.	G	3₁₀ helix	trans	-90.7	-10.9	175.1	-66	-54	0	0	0	113.6	L516 W517 L572 R573 D577 G578 M580 I581	L516-Y575 HydrophobicContact CB-CE2 4.1Å; L516-Y575 HydrophobicContact CD2-CE2 4.35Å; L516-Y575 HydrophobicContact CG-CE2 4.37Å; L516-Y575 PolarHBondContact N-OH 2.9Å; W517-Y575 HydrophobicContact CB-CE2 4.22Å; W517-Y575 AromaticContact CD1-CE1 3.9Å; W517-Y575 AromaticContact CD1-CZ 3.83Å; W517-Y575 PolarHBondContact N-OH 2.99Å; L572-Y575 HydrophobicContact CD2-CD2 4.25Å; L572-Y575 PolarHBondContact O-N 3.38Å; R573-Y575 PolarHBondContact O-N 3.43Å; Y575-D577 VanDerWaalsContact C-N 3.32Å; Y575-D577 PolarHBondContact O-N 3.09Å; Y575-G578 PolarHBondContact O-N 3.24Å; Y575-M580 HydrophobicContact CD1-CB 3.95Å; Y575-M580 HydrophobicContact CD1-CG 4.27Å; Y575-M580 HydrophobicContact CG-CB 4.31Å; Y575-I581 CarbonylContact C-O 3.41Å; Y575-I581 VanDerWaalsContact C-O 3.28Å; Y575-I581 WeakPolarHBondContact CB-O 3.37Å; Y575-I581 HydrophobicContact CD2-CB 4.5Å; Y575-I581 HydrophobicContact CD2-CD1 4.23Å
576	Y	94.5	Very high	93.8	Very high	81 Å²	81	70 Å²	70	32%	0.318	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-32.6	-173.6	-62	-2.4	0	0	0	112.9	L572 R573 G578 K583 Y591	L572-Y576 WeakPolarHBondContact O-CD1 3.45Å; L572-Y576 WeakPolarHBondContact O-CE1 3.33Å; R573-Y576 HydrophobicContact CB-CE2 4.15Å; R573-Y576 HydrophobicContact CG-CE2 3.75Å; R573-Y576 PolarHBondContact O-N 3.46Å; Y576-G578 PolarHBondContact O-N 3.41Å; Y576-K583 HydrophobicContact CD1-CB 4.44Å; Y576-K583 HydrophobicContact CE1-CB 3.82Å; Y576-K583 HydrophobicContact CE2-CB 3.96Å; Y576-Y591 HydrophobicContact CE1-CD1 4.46Å; Y576-Y591 HydrophobicContact CE1-CE1 4.16Å
577	D	87.2	Confident	93.7	Very high	161 Å²	161	69.3 Å²	69.3	86%	0.861	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.3	5.5	179.7	-55.5	-45.7	0	0	0	113.3	Y575	Y575-D577 VanDerWaalsContact C-N 3.32Å; Y575-D577 PolarHBondContact O-N 3.09Å
578	G	85.6	Confident	93.7	Very high	32 Å²	32	73.5 Å²	73.5	33%	0.33	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-140.1	165.3	-176.8	0	0	0	0	0	113.4	Y575 Y576 M580	Y575-G578 PolarHBondContact O-N 3.24Å; Y576-G578 PolarHBondContact O-N 3.41Å; G578-M580 PolarHBondContact O-N 2.85Å
579	D	85.4	Confident	93.7	Very high	106 Å²	106	76.1 Å²	76.1	57%	0.567	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.8	25.8	-170.7	-50	-63.4	0	0	0	114.5	I594 C595	D579-I594 CarbonylContact O-C 3.56Å; D579-C595 WeakPolarHBondContact O-CA 3.44Å; D579-C595 WeakPolarHBondContact O-CB 3.47Å; D579-C595 PolarHBondContact O-N 2.94Å
580	M	91.1	Very high	93.7	Very high	62 Å²	62	76.3 Å²	76.3	31%	0.305	38%	0.378	S	S	.	.	S	Bend	trans	-100.4	-70	-174.6	-64.4	-66.5	111.7	0	0	112.4	Y575 G578 F593 I594 C595	Y575-M580 HydrophobicContact CD1-CB 3.95Å; Y575-M580 HydrophobicContact CD1-CG 4.27Å; Y575-M580 HydrophobicContact CG-CB 4.31Å; G578-M580 PolarHBondContact O-N 2.85Å; M580-F593 WeakPolarHBondContact O-CA 3.39Å; M580-I594 PolarHBondContact O-N 3.3Å; M580-C595 HydrophobicContact CE-CB 4Å; M580-C595 HydrophobicContact SD-CB 4.48Å
581	I	95.8	Very high	93.8	Very high	0 Å²	0	71.1 Å²	71.1	0%	0	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	123.8	-174.5	-58.2	176.2	0	0	0	109.9	W517 L520 F542 L572 Y575 Y591 K592 F593	W517-I581 HydrophobicContact CB-CD1 3.71Å; W517-I581 HydrophobicContact CB-CG1 4.41Å; L520-I581 HydrophobicContact CD1-CD1 4.31Å; F542-I581 HydrophobicContact CE1-CG2 4.18Å; F542-I581 HydrophobicContact CZ-CD1 4.35Å; F542-I581 HydrophobicContact CZ-CG2 4.2Å; L572-I581 HydrophobicContact CD2-CD1 4.16Å; L572-I581 HydrophobicContact CD2-CG2 4.39Å; Y575-I581 CarbonylContact C-O 3.41Å; Y575-I581 VanDerWaalsContact C-O 3.28Å; Y575-I581 WeakPolarHBondContact CB-O 3.37Å; Y575-I581 HydrophobicContact CD2-CB 4.5Å; Y575-I581 HydrophobicContact CD2-CD1 4.23Å; I581-Y591 HydrophobicContact CG2-CD1 4.36Å; I581-K592 CarbonylContact C-O 3.57Å; I581-K592 VanDerWaalsContact CA-O 3.32Å; I581-K592 WeakPolarHBondContact CA-O 3.41Å; I581-F593 HydrophobicContact CD1-CD1 4.31Å; I581-F593 HydrophobicContact CD1-CE1 3.76Å; I581-F593 HydrophobicContact CD1-CE2 4.49Å; I581-F593 HydrophobicContact CD1-CZ 3.86Å; I581-F593 HydrophobicContact CG1-CD1 3.8Å; I581-F593 HydrophobicContact CG1-CE1 3.76Å; I581-F593 HydrophobicContact CG1-CG 4.35Å; I581-F593 HydrophobicContact CG1-CZ 4.25Å
582	S	95.3	Very high	93.8	Very high	34 Å²	34	72.6 Å²	72.6	24%	0.238	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	160.4	171	51.5	0	0	0	0	112.3	Y591 K592	S582-Y591 WeakPolarHBondContact O-CA 3.35Å; S582-K592 PolarHBondContact N-O 3.37Å; S582-K592 PolarHBondContact O-N 3.38Å; S582-K592 PolarHBondContact OG-O 3.22Å
583	K	95.4	Very high	93.8	Very high	42 Å²	42	73 Å²	73	18%	0.183	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	126.9	165.6	177.2	62.5	-166.5	137.4	0	110.2	Y576 H585 K587 V590 Y591	Y576-K583 HydrophobicContact CD1-CB 4.44Å; Y576-K583 HydrophobicContact CE1-CB 3.82Å; Y576-K583 HydrophobicContact CE2-CB 3.96Å; K583-H585 PolarHBondContact O-CE1 2.7Å; K583-H585 PolarHBondContact O-N 2.73Å; K583-H585 PolarHBondContact O-ND1 2.89Å; K583-K587 PolarHBondContact NZ-O 3.02Å; K583-V590 PolarHBondContact NZ-O 3.37Å; K583-Y591 HydrophobicContact CD-CD1 4.12Å; K583-Y591 HydrophobicContact CD-CE1 3.7Å
584	V	95.3	Very high	93.7	Very high	20 Å²	20	71.7 Å²	71.7	12%	0.121	36%	0.362	C	S	.	.	P	Polyproline II helix	trans	-79.9	118	164.9	-175	0	0	0	0	108.3	E541 K587 V590 K592	E541-V584 HydrophobicContact CG-CG2 3.92Å; E541-V584 WeakPolarHBondContact OE1-CG1 3.25Å; V584-K587 HydrophobicContact CG1-CB 4.31Å; V584-K587 HydrophobicContact CG1-CD 3.74Å; V584-K587 HydrophobicContact CG1-CG 4.13Å; V584-V590 HydrophobicContact CB-CB 4.28Å; V584-V590 HydrophobicContact CB-CG1 3.81Å; V584-V590 HydrophobicContact CG1-CG1 4.36Å; V584-V590 HydrophobicContact CG2-CG1 3.8Å; V584-V590 PolarHBondContact N-O 3.04Å; V584-K592 HydrophobicContact CG2-CB 3.83Å
585	H	93.6	Very high	93.5	Very high	157 Å²	157	65.1 Å²	65.1	73%	0.727	34%	0.338	S	S	*	.	S	Bend	trans	-75.2	158.1	-180	-63.9	84.5	0	0	0	110.6	K583 K587	K583-H585 PolarHBondContact O-CE1 2.7Å; K583-H585 PolarHBondContact O-N 2.73Å; K583-H585 PolarHBondContact O-ND1 2.89Å; H585-K587 PolarHBondContact O-N 3Å
586	G	93.3	Very high	93.2	Very high	91 Å²	91	67.5 Å²	67.5	94%	0.938	35%	0.354	S	S	*	.	S	Bend	trans	72.1	-35.6	-172.9	0	0	0	0	0	115.5
587	K	94	Very high	92.9	Very high	94 Å²	94	63.8 Å²	63.8	41%	0.409	34%	0.34	S	S	.	.	S	Bend	trans	-91.1	116.9	-177.5	-60	-179.4	-169	163.3	0	112.3	E541 K583 V584 H585 V590	E541-K587 IonicContact OE1-NZ 3.88Å; E541-K587 PolarHBondContact OE1-NZ 3.05Å; E541-K587 IonicContact OE2-NZ 3.95Å; E541-K587 PolarHBondContact OE2-NZ 3.49Å; K583-K587 PolarHBondContact NZ-O 3.02Å; V584-K587 HydrophobicContact CG1-CB 4.31Å; V584-K587 HydrophobicContact CG1-CD 3.74Å; V584-K587 HydrophobicContact CG1-CG 4.13Å; H585-K587 PolarHBondContact O-N 3Å; K587-V590 HydrophobicContact CB-CB 3.66Å; K587-V590 HydrophobicContact CB-CG1 4.35Å; K587-V590 HydrophobicContact CB-CG2 3.62Å; K587-V590 HydrophobicContact CD-CB 4.28Å; K587-V590 HydrophobicContact CD-CG1 4.08Å; K587-V590 HydrophobicContact CD-CG2 4.21Å
588	R	95.8	Very high	92.9	Very high	200 Å²	200	60.9 Å²	60.9	76%	0.755	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	136.6	173.9	-69.8	-176.9	71.1	-172.4	3.4	111.1	V590	R588-V590 PolarHBondContact O-N 3.33Å
589	F	96.8	Very high	92.8	Very high	56 Å²	56	63.6 Å²	63.6	25%	0.246	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	57.8	11.3	178.5	-49.2	-65.9	0	0	0	117.4	L544 P547 Y565	L544-F589 HydrophobicContact CB-CB 4.27Å; L544-F589 PolarHBondContact N-O 3.07Å; L544-F589 VanDerWaalsContact O-CB 3.25Å; L544-F589 WeakPolarHBondContact O-CB 3.08Å; P547-F589 HydrophobicContact CB-CD1 4.19Å; P547-F589 HydrophobicContact CB-CE1 4.28Å; P547-F589 HydrophobicContact CG-CD1 4.07Å; P547-F589 HydrophobicContact CG-CE1 3.9Å; P547-F589 HydrophobicContact CG-CZ 4.17Å; Y565-F589 HydrophobicContact CD1-CE1 4.27Å; Y565-F589 HydrophobicContact CE1-CD1 4.05Å; Y565-F589 AromaticContact CE1-CE1 3.7Å; Y565-F589 HydrophobicContact CE1-CE1 3.7Å; Y565-F589 HydrophobicContact CE2-CD1 4.26Å; Y565-F589 AromaticContact CZ-CD1 3.71Å; Y565-F589 AromaticContact CZ-CE1 3.88Å
590	V	97.1	Very high	92.8	Very high	6 Å²	6	61.4 Å²	61.4	4%	0.036	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	137.4	176.7	-179.2	0	0	0	0	112.6	I536 F542 K543 K583 V584 K587 R588	I536-V590 HydrophobicContact CD1-CB 4.06Å; I536-V590 HydrophobicContact CD1-CG1 3.39Å; I536-V590 HydrophobicContact CD1-CG2 3.47Å; I536-V590 VanDerWaalsContact CD1-CG2 3.47Å; F542-V590 WeakPolarHBondContact O-CA 3.36Å; K543-V590 HydrophobicContact CB-CG2 4.27Å; K543-V590 HydrophobicContact CG-CG2 4.1Å; K583-V590 PolarHBondContact NZ-O 3.37Å; V584-V590 HydrophobicContact CB-CB 4.28Å; V584-V590 HydrophobicContact CB-CG1 3.81Å; V584-V590 HydrophobicContact CG1-CG1 4.36Å; V584-V590 HydrophobicContact CG2-CG1 3.8Å; V584-V590 PolarHBondContact N-O 3.04Å; K587-V590 HydrophobicContact CB-CB 3.66Å; K587-V590 HydrophobicContact CB-CG1 4.35Å; K587-V590 HydrophobicContact CB-CG2 3.62Å; K587-V590 HydrophobicContact CD-CB 4.28Å; K587-V590 HydrophobicContact CD-CG1 4.08Å; K587-V590 HydrophobicContact CD-CG2 4.21Å; R588-V590 PolarHBondContact O-N 3.33Å
591	Y	97.5	Very high	92.5	Very high	7 Å²	7	60.7 Å²	60.7	3%	0.027	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	165.3	-179.9	-66.4	-87.1	0	0	0	109.6	E541 F542 L544 Y565 L572 Y576 I581 S582 K583	E541-Y591 CarbonylContact C-O 3.44Å; E541-Y591 WeakPolarHBondContact CA-O 3.32Å; F542-Y591 WeakPolarHBondContact CD1-O 3.29Å; F542-Y591 VanDerWaalsContact CZ-CB 3.46Å; F542-Y591 HydrophobicContact CZ-CG 4.35Å; F542-Y591 PolarHBondContact N-O 2.86Å; F542-Y591 PolarHBondContact O-N 3.08Å; L544-Y591 HydrophobicContact CD1-CD2 4.33Å; L544-Y591 HydrophobicContact CD1-CE2 4.02Å; L544-Y591 HydrophobicContact CG-CD2 4.47Å; Y565-Y591 PolarHBondContact OH-OH 2.9Å; Y565-Y591 VanDerWaalsContact OH-OH 3.05Å; L572-Y591 HydrophobicContact CB-CE1 4.15Å; L572-Y591 HydrophobicContact CD1-CD1 4.18Å; L572-Y591 HydrophobicContact CD1-CD2 4.12Å; L572-Y591 HydrophobicContact CD1-CE1 3.81Å; L572-Y591 HydrophobicContact CD1-CE2 3.77Å; L572-Y591 HydrophobicContact CD1-CG 4.32Å; Y576-Y591 HydrophobicContact CE1-CD1 4.46Å; Y576-Y591 HydrophobicContact CE1-CE1 4.16Å; I581-Y591 HydrophobicContact CG2-CD1 4.36Å; S582-Y591 WeakPolarHBondContact O-CA 3.35Å; K583-Y591 HydrophobicContact CD-CD1 4.12Å; K583-Y591 HydrophobicContact CD-CE1 3.7Å
592	K	95.7	Very high	92	Very high	61 Å²	61	60.8 Å²	60.8	27%	0.265	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	127	-179.1	-179.7	166.8	-175.3	169.8	0	111.7	D539 G540 E541 I581 S582 V584 I594	D539-K592 VanDerWaalsContact CG-NZ 3.25Å; D539-K592 WeakPolarHBondContact O-CE 3.48Å; D539-K592 IonicContact OD1-NZ 3.67Å; D539-K592 WeakPolarHBondContact OD2-CE 2.9Å; D539-K592 IonicContact OD2-NZ 3.64Å; D539-K592 PolarHBondContact OD2-NZ 3.48Å; G540-K592 WeakPolarHBondContact O-CA 3.26Å; E541-K592 HydrophobicContact CG-CB 4.21Å; E541-K592 HydrophobicContact CG-CD 3.99Å; E541-K592 HydrophobicContact CG-CG 4.3Å; I581-K592 CarbonylContact C-O 3.57Å; I581-K592 VanDerWaalsContact CA-O 3.32Å; I581-K592 WeakPolarHBondContact CA-O 3.41Å; S582-K592 PolarHBondContact N-O 3.37Å; S582-K592 PolarHBondContact O-N 3.38Å; S582-K592 PolarHBondContact OG-O 3.22Å; V584-K592 HydrophobicContact CG2-CB 3.83Å; K592-I594 PolarHBondContact O-N 2.92Å
593	F	95.7	Very high	91.6	Very high	8 Å²	8	61.5 Å²	61.5	4%	0.035	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	127.5	167.3	-80.2	-86.2	0	0	0	109.5	W517 L521 L524 W535 G540 F542 M580 I581 L597	W517-F593 HydrophobicContact CB-CE1 4.23Å; W517-F593 HydrophobicContact CE3-CE1 4.42Å; L521-F593 HydrophobicContact CB-CZ 4.04Å; L521-F593 HydrophobicContact CD1-CE2 4.29Å; L521-F593 HydrophobicContact CD1-CZ 4.24Å; L524-F593 HydrophobicContact CD1-CE2 3.72Å; W535-F593 AromaticContact CH2-CD2 3.83Å; W535-F593 HydrophobicContact CH2-CD2 3.83Å; W535-F593 HydrophobicContact CH2-CE2 4.17Å; W535-F593 AromaticContact CZ3-CD2 3.93Å; W535-F593 HydrophobicContact CZ3-CD2 3.93Å; G540-F593 PolarHBondContact O-N 3.07Å; F542-F593 AromaticContact CD1-CD2 3.62Å; F542-F593 HydrophobicContact CD1-CD2 3.62Å; F542-F593 AromaticContact CD1-CE2 3.77Å; F542-F593 HydrophobicContact CD1-CE2 3.77Å; F542-F593 AromaticContact CE1-CD2 3.42Å; F542-F593 HydrophobicContact CE1-CD2 3.42Å; F542-F593 VanDerWaalsContact CE1-CD2 3.42Å; F542-F593 AromaticContact CE1-CE2 3.38Å; F542-F593 HydrophobicContact CE1-CE2 3.38Å; F542-F593 HydrophobicContact CE1-CG 4.37Å; F542-F593 HydrophobicContact CE1-CZ 4.33Å; F542-F593 HydrophobicContact CZ-CD2 4.42Å; F542-F593 AromaticContact CZ-CE2 3.97Å; F542-F593 HydrophobicContact CZ-CE2 3.97Å; M580-F593 WeakPolarHBondContact O-CA 3.39Å; I581-F593 HydrophobicContact CD1-CD1 4.31Å; I581-F593 HydrophobicContact CD1-CE1 3.76Å; I581-F593 HydrophobicContact CD1-CE2 4.49Å; I581-F593 HydrophobicContact CD1-CZ 3.86Å; I581-F593 HydrophobicContact CG1-CD1 3.8Å; I581-F593 HydrophobicContact CG1-CE1 3.76Å; I581-F593 HydrophobicContact CG1-CG 4.35Å; I581-F593 HydrophobicContact CG1-CZ 4.25Å; F593-L597 HydrophobicContact CB-CD1 4.36Å; F593-L597 HydrophobicContact CD1-CD2 4.41Å
594	I	92.3	Very high	91.4	Very high	87 Å²	87	61.1 Å²	61.1	45%	0.446	32%	0.317	S	S	.	.			trans	-101.3	-23.5	177.2	-32	174.8	0	0	0	110.9	D579 M580 K592	D579-I594 CarbonylContact O-C 3.56Å; M580-I594 PolarHBondContact O-N 3.3Å; K592-I594 PolarHBondContact O-N 2.92Å
595	C	90.4	Very high	91.2	Very high	18 Å²	18	60.8 Å²	60.8	12%	0.122	32%	0.316	C	S	.	.	S	Bend	trans	-65.4	147.1	-179.8	55.1	0	0	0	0	111.2	D579 M580 L597	D579-C595 WeakPolarHBondContact O-CA 3.44Å; D579-C595 WeakPolarHBondContact O-CB 3.47Å; D579-C595 PolarHBondContact O-N 2.94Å; M580-C595 HydrophobicContact CE-CB 4Å; M580-C595 HydrophobicContact SD-CB 4.48Å; C595-L597 VanDerWaalsContact C-N 3.32Å; C595-L597 PolarHBondContact O-N 3.11Å
596	D	88.8	Confident	91.1	Very high	94 Å²	94	54 Å²	54	50%	0.503	29%	0.29	S	S	.	.			trans	-71.9	89.3	173	-179.4	10.8	0	0	0	110.6	K598 T599 L600	D596-K598 PolarHBondContact O-N 3.48Å; D596-K598 WeakPolarHBondContact OD1-CA 3.38Å; D596-K598 WeakPolarHBondContact OD1-CB 3.23Å; D596-K598 PolarHBondContact OD1-N 2.86Å; D596-T599 PolarHBondContact O-N 2.91Å; D596-T599 VanDerWaalsContact O-N 3.17Å; D596-T599 PolarHBondContact OD1-N 3.43Å; D596-T599 WeakPolarHBondContact OD2-CB 3.33Å; D596-T599 PolarHBondContact OD2-OG1 2.61Å; D596-L600 WeakPolarHBondContact O-CB 3.21Å; D596-L600 PolarHBondContact O-N 3.45Å; D596-L600 VanDerWaalsContact O-N 3.11Å
597	L	89	Confident	91	Very high	4 Å²	4	52 Å²	52	2%	0.021	26%	0.255	C	S	.	.	H	α-helix	trans	-56.9	-27.5	174.6	-62.9	-177.6	0	0	0	112.1	L521 W535 F593 C595 L600 L601 F603 A605 L608	L521-L597 HydrophobicContact CD1-CD1 4.38Å; L521-L597 HydrophobicContact CD2-CD2 3.86Å; W535-L597 HydrophobicContact CH2-CD1 4.03Å; F593-L597 HydrophobicContact CB-CD1 4.36Å; F593-L597 HydrophobicContact CD1-CD2 4.41Å; C595-L597 VanDerWaalsContact C-N 3.32Å; C595-L597 PolarHBondContact O-N 3.11Å; L597-L600 HydrophobicContact CD2-CD2 4.3Å; L597-L600 PolarHBondContact O-N 3.26Å; L597-L601 PolarHBondContact O-N 3.32Å; L597-F603 CarbonylContact C-O 3.54Å; L597-F603 WeakPolarHBondContact CB-O 3.41Å; L597-A605 HydrophobicContact CD1-CB 4.2Å; L597-L608 HydrophobicContact CD1-CD1 4.24Å
598	K	86.7	Confident	90.9	Very high	100 Å²	100	48 Å²	48	44%	0.435	24%	0.239	S	C	.	.	H	α-helix	trans	-69.1	-38.6	179.2	-159.9	174.9	-171.2	164.5	0	111.6	D596 G602 F603	D596-K598 PolarHBondContact O-N 3.48Å; D596-K598 WeakPolarHBondContact OD1-CA 3.38Å; D596-K598 WeakPolarHBondContact OD1-CB 3.23Å; D596-K598 PolarHBondContact OD1-N 2.86Å; K598-G602 WeakPolarHBondContact O-CA 3.49Å; K598-G602 PolarHBondContact O-N 3.29Å; K598-G602 VanDerWaalsContact O-N 3.08Å; K598-F603 PolarHBondContact N-O 2.95Å
599	T	84.9	Confident	90.7	Very high	89 Å²	89	41.4 Å²	41.4	55%	0.546	21%	0.214	S	C	.	.	H	α-helix	trans	-77.7	-19.9	172.7	-66	0	0	0	0	113	R88 D596	R88-T599 VanDerWaalsContact O-O 3.1Å; D596-T599 PolarHBondContact O-N 2.91Å; D596-T599 VanDerWaalsContact O-N 3.17Å; D596-T599 PolarHBondContact OD1-N 3.43Å; D596-T599 WeakPolarHBondContact OD2-CB 3.33Å; D596-T599 PolarHBondContact OD2-OG1 2.61Å
600	L	83.8	Confident	90.4	Very high	59 Å²	59	42.7 Å²	42.7	31%	0.309	22%	0.222	S	C	.	.	H	α-helix	trans	-94.7	-33	-176.1	-174.5	60	0	0	0	114.7	W517 D596 L597	W517-L600 HydrophobicContact CH2-CD2 3.81Å; W517-L600 HydrophobicContact CZ3-CD2 3.77Å; D596-L600 WeakPolarHBondContact O-CB 3.21Å; D596-L600 PolarHBondContact O-N 3.45Å; D596-L600 VanDerWaalsContact O-N 3.11Å; L597-L600 HydrophobicContact CD2-CD2 4.3Å; L597-L600 PolarHBondContact O-N 3.26Å
601	L	85	Confident	90.1	Very high	47 Å²	47	45 Å²	45	25%	0.246	23%	0.234	C	C	.	.	H	α-helix	trans	-129.8	-5.6	-174.9	-62.4	-178.5	0	0	0	113.9	L521 L597 F603 L608	L521-L601 HydrophobicContact CD2-CD1 3.75Å; L521-L601 HydrophobicContact CG-CD1 4.3Å; L597-L601 PolarHBondContact O-N 3.32Å; L601-F603 VanDerWaalsContact C-N 3.26Å; L601-F603 WeakPolarHBondContact O-CD2 3.41Å; L601-F603 PolarHBondContact O-N 3.13Å; L601-L608 HydrophobicContact CD1-CD1 4.21Å
602	G	85.5	Confident	89.8	Confident	2 Å²	2	45.6 Å²	45.6	2%	0.021	24%	0.238	C	C	.	.	S	Bend	trans	70.7	19.1	-170.2	0	0	0	0	0	114.6	Y84 R124 K598	Y84-G602 VanDerWaalsContact CE1-CA 3.46Å; Y84-G602 WeakPolarHBondContact OH-CA 3.1Å; Y84-G602 PolarHBondContact OH-O 3Å; R124-G602 PolarHBondContact NH2-O 3.1Å; K598-G602 WeakPolarHBondContact O-CA 3.49Å; K598-G602 PolarHBondContact O-N 3.29Å; K598-G602 VanDerWaalsContact O-N 3.08Å
603	F	87.9	Confident	89.5	Confident	49 Å²	49	46 Å²	46	22%	0.215	24%	0.24	C	C	.	.			trans	-144.2	128.4	174.1	-63.2	-82	0	0	0	109.7	R124 L597 K598 L601 E607 L608 L611	R124-F603 VanDerWaalsContact NH2-CE1 3.27Å; L597-F603 CarbonylContact C-O 3.54Å; L597-F603 WeakPolarHBondContact CB-O 3.41Å; K598-F603 PolarHBondContact N-O 2.95Å; L601-F603 VanDerWaalsContact C-N 3.26Å; L601-F603 WeakPolarHBondContact O-CD2 3.41Å; L601-F603 PolarHBondContact O-N 3.13Å; F603-E607 HydrophobicContact CB-CB 4.27Å; F603-E607 HydrophobicContact CD1-CB 4.17Å; F603-L608 HydrophobicContact CB-CD1 4.49Å; F603-L608 HydrophobicContact CB-CD2 3.63Å; F603-L608 HydrophobicContact CB-CG 3.77Å; F603-L608 HydrophobicContact CD2-CD2 4.17Å; F603-L608 HydrophobicContact CG-CD2 3.97Å; F603-L611 HydrophobicContact CD1-CD1 3.92Å; F603-L611 HydrophobicContact CE1-CD1 3.69Å; F603-L611 HydrophobicContact CZ-CD1 4.33Å
604	S	90.4	Very high	89.1	Confident	35 Å²	35	48.4 Å²	48.4	25%	0.245	25%	0.253	C	S	.	.			trans	-67.9	164.8	167.7	62	0	0	0	0	111.9	G606 E607 L608	S604-G606 VanDerWaalsContact C-N 3.26Å; S604-G606 PolarHBondContact O-N 3.3Å; S604-E607 VanDerWaalsContact CB-OE2 3.25Å; S604-E607 WeakPolarHBondContact CB-OE2 3.29Å; S604-E607 PolarHBondContact N-OE2 3.05Å; S604-E607 PolarHBondContact O-N 3.42Å; S604-E607 WeakPolarHBondContact OG-CG 3.44Å; S604-E607 PolarHBondContact OG-N 3.36Å; S604-E607 PolarHBondContact OG-OE2 2.98Å; S604-L608 WeakPolarHBondContact O-CG 3.33Å; S604-L608 PolarHBondContact O-N 3.19Å
605	A	90.8	Very high	88.9	Confident	12 Å²	12	46.6 Å²	46.6	10%	0.099	25%	0.248	C	C	.	.	H	α-helix	trans	-55.1	-40.7	175.2	0	0	0	0	0	112.5	D538 L597 L608 Y609	D538-A605 CarbonylContact O-C 3.6Å; D538-A605 VanDerWaalsContact O-CB 3.3Å; D538-A605 WeakPolarHBondContact O-CB 3.39Å; L597-A605 HydrophobicContact CD1-CB 4.2Å; A605-L608 PolarHBondContact O-N 3.17Å; A605-Y609 VanDerWaalsContact O-CB 3.31Å; A605-Y609 WeakPolarHBondContact O-CB 3.29Å; A605-Y609 PolarHBondContact O-N 3.41Å
606	G	90.7	Very high	88.6	Confident	16 Å²	16	46.3 Å²	46.3	17%	0.165	25%	0.247	C	C	.	.	H	α-helix	trans	-66.1	-39.7	176.8	0	0	0	0	0	114	D538 S604 Y609 M610	D538-G606 WeakPolarHBondContact O-CA 3.39Å; D538-G606 PolarHBondContact O-N 3.34Å; S604-G606 VanDerWaalsContact C-N 3.26Å; S604-G606 PolarHBondContact O-N 3.3Å; G606-Y609 PolarHBondContact O-N 3.01Å; G606-M610 WeakPolarHBondContact O-CB 3.38Å; G606-M610 WeakPolarHBondContact O-CG 3.49Å; G606-M610 PolarHBondContact O-N 3.2Å
607	E	91.7	Very high	88.5	Confident	47 Å²	47	45.5 Å²	45.5	22%	0.22	24%	0.24	C	C	.	.	H	α-helix	trans	-63	-43.9	173.5	-72.2	162.3	116.9	0	0	110.7	F603 S604 L611	F603-E607 HydrophobicContact CB-CB 4.27Å; F603-E607 HydrophobicContact CD1-CB 4.17Å; S604-E607 VanDerWaalsContact CB-OE2 3.25Å; S604-E607 WeakPolarHBondContact CB-OE2 3.29Å; S604-E607 PolarHBondContact N-OE2 3.05Å; S604-E607 PolarHBondContact O-N 3.42Å; S604-E607 WeakPolarHBondContact OG-CG 3.44Å; S604-E607 PolarHBondContact OG-N 3.36Å; S604-E607 PolarHBondContact OG-OE2 2.98Å; E607-L611 WeakPolarHBondContact O-CB 3.35Å; E607-L611 WeakPolarHBondContact O-CD1 3.39Å; E607-L611 WeakPolarHBondContact O-CG 3.12Å; E607-L611 PolarHBondContact O-N 3.44Å
608	L	91.7	Very high	88.1	Confident	12 Å²	12	52.5 Å²	52.5	6%	0.063	27%	0.266	C	S	.	.	H	α-helix	trans	-65	-44.3	175.3	-66	177.7	0	0	0	112.5	L521 T525 W535 L597 L601 F603 S604 A605 M610 L611 V612	L521-L608 HydrophobicContact CD1-CD1 4.47Å; T525-L608 HydrophobicContact CG2-CD2 4.31Å; W535-L608 HydrophobicContact CZ2-CD1 4.4Å; L597-L608 HydrophobicContact CD1-CD1 4.24Å; L601-L608 HydrophobicContact CD1-CD1 4.21Å; F603-L608 HydrophobicContact CB-CD1 4.49Å; F603-L608 HydrophobicContact CB-CD2 3.63Å; F603-L608 HydrophobicContact CB-CG 3.77Å; F603-L608 HydrophobicContact CD2-CD2 4.17Å; F603-L608 HydrophobicContact CG-CD2 3.97Å; S604-L608 WeakPolarHBondContact O-CG 3.33Å; S604-L608 PolarHBondContact O-N 3.19Å; A605-L608 PolarHBondContact O-N 3.17Å; L608-M610 PolarHBondContact O-N 2.88Å; L608-L611 PolarHBondContact O-N 2.99Å; L608-V612 VanDerWaalsContact O-CG2 3.29Å; L608-V612 WeakPolarHBondContact O-CG2 3.33Å; L608-V612 PolarHBondContact O-N 3.16Å
609	Y	92.8	Very high	87.7	Confident	60 Å²	60	51 Å²	51	24%	0.235	26%	0.26	C	S	.	.	H	α-helix	trans	-55.4	-50.5	176.5	171.6	-119.8	0	0	0	111.5	W535 D538 A605 G606 V612 K613	W535-Y609 HydrophobicContact CB-CD2 3.54Å; W535-Y609 HydrophobicContact CB-CE2 4.2Å; W535-Y609 HydrophobicContact CB-CG 4.43Å; W535-Y609 HydrophobicContact CG-CD2 4.31Å; D538-Y609 HydrophobicContact CB-CD1 4.19Å; A605-Y609 VanDerWaalsContact O-CB 3.31Å; A605-Y609 WeakPolarHBondContact O-CB 3.29Å; A605-Y609 PolarHBondContact O-N 3.41Å; G606-Y609 PolarHBondContact O-N 3.01Å; Y609-V612 PolarHBondContact O-N 3.26Å; Y609-K613 VanDerWaalsContact O-CB 3.23Å; Y609-K613 WeakPolarHBondContact O-CB 3.21Å; Y609-K613 PolarHBondContact O-N 3.04Å
610	M	90.5	Very high	87.2	Confident	84 Å²	84	50 Å²	50	41%	0.414	26%	0.257	S	S	.	.	H	α-helix	trans	-66.5	-40.2	179.6	-70.6	-63.6	-68.9	0	0	112.2	G606 L608 K613 N614	G606-M610 WeakPolarHBondContact O-CB 3.38Å; G606-M610 WeakPolarHBondContact O-CG 3.49Å; G606-M610 PolarHBondContact O-N 3.2Å; L608-M610 PolarHBondContact O-N 2.88Å; M610-K613 PolarHBondContact O-N 3.49Å; M610-K613 HydrophobicContact SD-CD 4.48Å; M610-N614 VanDerWaalsContact O-CB 3.25Å; M610-N614 WeakPolarHBondContact O-CB 3.48Å; M610-N614 PolarHBondContact O-N 3.26Å; M610-N614 PolarHBondContact O-ND2 2.88Å
611	L	90.8	Very high	86.2	Confident	55 Å²	55	53.3 Å²	53.3	29%	0.288	27%	0.271	S	S	.	.	H	α-helix	trans	-61.3	-47.1	175.4	-74.5	167.7	0	0	0	112	Y121 F603 E607 L608 N614 C615	Y121-L611 HydrophobicContact CE2-CD2 4.44Å; F603-L611 HydrophobicContact CD1-CD1 3.92Å; F603-L611 HydrophobicContact CE1-CD1 3.69Å; F603-L611 HydrophobicContact CZ-CD1 4.33Å; E607-L611 WeakPolarHBondContact O-CB 3.35Å; E607-L611 WeakPolarHBondContact O-CD1 3.39Å; E607-L611 WeakPolarHBondContact O-CG 3.12Å; E607-L611 PolarHBondContact O-N 3.44Å; L608-L611 PolarHBondContact O-N 2.99Å; L611-N614 PolarHBondContact O-N 3.27Å; L611-C615 WeakPolarHBondContact O-CB 3.49Å; L611-C615 PolarHBondContact O-N 3.41Å; L611-C615 PolarHBondContact O-SG 3.5Å; L611-C615 VanDerWaalsContact O-SG 3.38Å
612	V	90.4	Very high	84.9	Confident	19 Å²	19	57.4 Å²	57.4	12%	0.115	28%	0.283	C	S	.	.	H	α-helix	trans	-67.3	-40.5	-180	175.3	0	0	0	0	111.4	L524 W527 L608 Y609 C615 A616	L524-V612 WeakPolarHBondContact O-CG2 3.43Å; W527-V612 HydrophobicContact CB-CG1 4.39Å; L608-V612 VanDerWaalsContact O-CG2 3.29Å; L608-V612 WeakPolarHBondContact O-CG2 3.33Å; L608-V612 PolarHBondContact O-N 3.16Å; Y609-V612 PolarHBondContact O-N 3.26Å; V612-C615 PolarHBondContact O-N 3.45Å; V612-A616 PolarHBondContact O-N 3.35Å
613	K	88.9	Confident	83.4	Confident	69 Å²	69	59.9 Å²	59.9	30%	0.3	31%	0.309	S	S	.	.	H	α-helix	trans	-59.8	-53.2	174	179.6	179.5	173.7	-174.9	0	111.6	Y609 M610 C615 A616 E617	Y609-K613 VanDerWaalsContact O-CB 3.23Å; Y609-K613 WeakPolarHBondContact O-CB 3.21Å; Y609-K613 PolarHBondContact O-N 3.04Å; M610-K613 PolarHBondContact O-N 3.49Å; M610-K613 HydrophobicContact SD-CD 4.48Å; K613-C615 VanDerWaalsContact C-N 3.27Å; K613-C615 PolarHBondContact O-N 2.98Å; K613-A616 PolarHBondContact O-N 3.4Å; K613-A616 VanDerWaalsContact O-N 3.13Å; K613-E617 WeakPolarHBondContact CE-OE1 3.39Å; K613-E617 WeakPolarHBondContact CG-OE1 3.24Å; K613-E617 WeakPolarHBondContact O-CG 3.12Å; K613-E617 PolarHBondContact O-N 2.91Å
614	N	88.8	Confident	81.8	Confident	58 Å²	58	64.6 Å²	64.6	31%	0.31	33%	0.329	S	S	.	.	H	α-helix	trans	-58.7	-38.3	177.9	-70.7	-17.7	0	0	0	111.9	M610 L611 R618	M610-N614 VanDerWaalsContact O-CB 3.25Å; M610-N614 WeakPolarHBondContact O-CB 3.48Å; M610-N614 PolarHBondContact O-N 3.26Å; M610-N614 PolarHBondContact O-ND2 2.88Å; L611-N614 PolarHBondContact O-N 3.27Å; N614-R618 WeakPolarHBondContact O-CB 3.28Å; N614-R618 VanDerWaalsContact O-CG 3.22Å; N614-R618 WeakPolarHBondContact O-CG 3.34Å; N614-R618 PolarHBondContact O-N 2.93Å; N614-R618 VanDerWaalsContact O-N 3.07Å
615	C	86.8	Confident	79.9	Confident	49 Å²	49	71 Å²	71	33%	0.331	35%	0.352	S	S	.	.	H	α-helix	trans	-64.8	-46.2	174.4	-80.7	0	0	0	0	112.5	W527 L611 V612 K613 E617 H619	W527-C615 HydrophobicContact CB-CB 4.3Å; W527-C615 HydrophobicContact CG-CB 4.31Å; L611-C615 WeakPolarHBondContact O-CB 3.49Å; L611-C615 PolarHBondContact O-N 3.41Å; L611-C615 PolarHBondContact O-SG 3.5Å; L611-C615 VanDerWaalsContact O-SG 3.38Å; V612-C615 PolarHBondContact O-N 3.45Å; K613-C615 VanDerWaalsContact C-N 3.27Å; K613-C615 PolarHBondContact O-N 2.98Å; C615-E617 PolarHBondContact O-N 3.49Å; C615-H619 PolarHBondContact O-N 3.02Å; C615-H619 PolarHBondContact O-ND1 3.1Å
616	A	85.3	Confident	77.9	Confident	13 Å²	13	81 Å²	81	11%	0.107	39%	0.388	C	S	.	.	H	α-helix	trans	-61.3	-44.1	177.7	0	0	0	0	0	112.1	W527 V612 K613 H619 S620	W527-A616 HydrophobicContact CB-CB 4.07Å; V612-A616 PolarHBondContact O-N 3.35Å; K613-A616 PolarHBondContact O-N 3.4Å; K613-A616 VanDerWaalsContact O-N 3.13Å; A616-H619 PolarHBondContact O-N 3.42Å; A616-S620 PolarHBondContact O-N 3.04Å
617	E	85.6	Confident	75.8	Confident	77 Å²	77	91.2 Å²	91.2	36%	0.36	42%	0.421	S	S	.	.	H	α-helix	trans	-64.5	-47.2	-179.7	-71.9	166.2	-171.3	0	0	111.4	K613 C615 H619 S620 H621	K613-E617 WeakPolarHBondContact CE-OE1 3.39Å; K613-E617 WeakPolarHBondContact CG-OE1 3.24Å; K613-E617 WeakPolarHBondContact O-CG 3.12Å; K613-E617 PolarHBondContact O-N 2.91Å; C615-E617 PolarHBondContact O-N 3.49Å; E617-H619 VanDerWaalsContact C-N 3.28Å; E617-H619 PolarHBondContact O-N 3.17Å; E617-S620 WeakPolarHBondContact O-CB 3.35Å; E617-S620 PolarHBondContact O-N 3.13Å; E617-S620 VanDerWaalsContact O-N 3.13Å; E617-H621 PolarHBondContact O-CD2 2.7Å; E617-H621 PolarHBondContact O-N 3.39Å; E617-H621 VanDerWaalsContact O-N 3.1Å
618	R	81.9	Confident	73.7	Confident	151 Å²	151	96.3 Å²	96.3	57%	0.57	45%	0.449	S	S	*	.	H	α-helix	trans	-56.7	-37.8	175.4	-75.5	172.1	178.2	178.7	0.5	113.1	N614	N614-R618 WeakPolarHBondContact O-CB 3.28Å; N614-R618 VanDerWaalsContact O-CG 3.22Å; N614-R618 WeakPolarHBondContact O-CG 3.34Å; N614-R618 PolarHBondContact O-N 2.93Å; N614-R618 VanDerWaalsContact O-N 3.07Å
619	H	78.4	Confident	71.5	Confident	67 Å²	67	101 Å²	101	31%	0.31	48%	0.478	S	S	.	.	H	α-helix	trans	-74.1	-38.3	176.8	-72.5	87.1	0	0	0	112.4	W527 C615 A616 E617 H621 R622 G623	W527-H619 AromaticContact CE2-CD2 3.94Å; W527-H619 AromaticContact CE2-CE1 3.8Å; W527-H619 AromaticContact CE2-CG 3.67Å; W527-H619 AromaticContact CE2-ND1 3.58Å; W527-H619 HydrophobicContact CE3-CB 4.4Å; W527-H619 HydrophobicContact CH2-CB 3.76Å; W527-H619 AromaticContact CH2-CD2 3.94Å; W527-H619 AromaticContact CH2-CG 3.81Å; W527-H619 HydrophobicContact CZ2-CB 3.9Å; W527-H619 AromaticContact CZ2-CD2 3.36Å; W527-H619 WeakPolarHBondContact CZ2-CD2 3.16Å; W527-H619 AromaticContact CZ2-CE1 3.98Å; W527-H619 AromaticContact CZ2-CG 3.4Å; W527-H619 AromaticContact CZ2-ND1 3.79Å; W527-H619 AromaticContact CZ2-NE2 3.76Å; W527-H619 HydrophobicContact CZ3-CB 4.02Å; W527-H619 AromaticContact NE1-CE1 3.51Å; W527-H619 AromaticContact NE1-ND1 3.62Å; W527-H619 AromaticContact NE1-NE2 3.98Å; C615-H619 PolarHBondContact O-N 3.02Å; C615-H619 PolarHBondContact O-ND1 3.1Å; A616-H619 PolarHBondContact O-N 3.42Å; E617-H619 VanDerWaalsContact C-N 3.28Å; E617-H619 PolarHBondContact O-N 3.17Å; H619-H621 PolarHBondContact O-N 3.2Å; H619-R622 PolarHBondContact O-N 3.21Å; H619-G623 PolarHBondContact O-N 3.41Å
620	S	74.4	Confident	69.2	Low	68 Å²	68	104.5 Å²	104.5	48%	0.476	51%	0.506	S	S	.	.	H	α-helix	trans	-58.9	-44.2	175.6	-167.3	0	0	0	0	112.6	A616 E617 R622 G623	A616-S620 PolarHBondContact O-N 3.04Å; E617-S620 WeakPolarHBondContact O-CB 3.35Å; E617-S620 PolarHBondContact O-N 3.13Å; E617-S620 VanDerWaalsContact O-N 3.13Å; S620-R622 PolarHBondContact O-N 2.94Å; S620-G623 PolarHBondContact O-N 3.37Å
621	H	61.1	Low	66.7	Low	129 Å²	129	103.9 Å²	103.9	60%	0.597	52%	0.521	S	S	*	.	H	α-helix	trans	-66.8	-32	178.9	-74.4	-73.7	0	0	0	113.8	E617 H619 G623 K624 K625	E617-H621 PolarHBondContact O-CD2 2.7Å; E617-H621 PolarHBondContact O-N 3.39Å; E617-H621 VanDerWaalsContact O-N 3.1Å; H619-H621 PolarHBondContact O-N 3.2Å; H621-G623 VanDerWaalsContact C-N 3.31Å; H621-G623 PolarHBondContact O-N 3.11Å; H621-K624 PolarHBondContact O-N 3.25Å; H621-K625 PolarHBondContact O-N 2.81Å
622	R	57.8	Low	64.1	Low	134 Å²	134	106.9 Å²	106.9	51%	0.506	55%	0.547	S	S	.	.	H	α-helix	trans	-64.4	-33.6	174.8	-99.3	-171	170.4	-153.7	-4.9	112.7	G483 H619 S620	G483-R622 PolarHBondContact O-NH1 3.07Å; H619-R622 PolarHBondContact O-N 3.21Å; S620-R622 PolarHBondContact O-N 2.94Å
623	G	53.7	Low	61.6	Low	54 Å²	54	111.4 Å²	111.4	56%	0.557	57%	0.574	S	S	*	*	H	α-helix	trans	-64.1	-41.8	176	0	0	0	0	0	113	H619 S620 H621	H619-G623 PolarHBondContact O-N 3.41Å; S620-G623 PolarHBondContact O-N 3.37Å; H621-G623 VanDerWaalsContact C-N 3.31Å; H621-G623 PolarHBondContact O-N 3.11Å
624	K	54.6	Low	59.4	Low	148 Å²	148	119.2 Å²	119.2	64%	0.643	60%	0.604	S	S	*	*	H	α-helix	trans	-72.7	-39.8	-176.2	-66.9	-178.5	178.9	178.2	0	113.4	H621 R626 R627	H621-K624 PolarHBondContact O-N 3.25Å; K624-R626 VanDerWaalsContact C-N 3.32Å; K624-R626 PolarHBondContact O-N 2.84Å; K624-R627 PolarHBondContact O-N 3.43Å
625	K	51.5	Low	56.9	Low	169 Å²	169	121 Å²	121	74%	0.735	62%	0.621	S	S	*	*	H	α-helix	trans	-65.5	-28.8	-179.3	-79.1	-164.6	172.8	-171.9	0	114	H621 R627	H621-K625 PolarHBondContact O-N 2.81Å; K625-R627 PolarHBondContact O-N 2.87Å
626	R	49.3	Very low	54.7	Low	222 Å²	222	124.5 Å²	124.5	84%	0.838	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.8	-1.1	179.4	-68.7	-169.1	71.7	156.4	2.6	115.1	K624	K624-R626 VanDerWaalsContact C-N 3.32Å; K624-R626 PolarHBondContact O-N 2.84Å
627	R	45.5	Very low	52.6	Low	230 Å²	230	130.6 Å²	130.6	87%	0.868	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.3	8.4	177.8	-148.4	179.2	-174.2	-177	1.9	114.1	K624 K625	K624-R627 PolarHBondContact O-N 3.43Å; K625-R627 PolarHBondContact O-N 2.87Å
628	L	47.3	Very low	50.3	Low	155 Å²	155	133.6 Å²	133.6	81%	0.812	70%	0.697	S	S	*	*	S	Bend	trans	-131.2	15.1	-174.9	-82.4	151.9	0	0	0	113.3
629	T	45.8	Very low	48.3	Very low	109 Å²	109	131.4 Å²	131.4	67%	0.669	71%	0.705	S	S	*	*			trans	-123.9	46.2	-176.9	61.1	0	0	0	0	112.2
630	T	44.5	Very low	46.4	Very low	135 Å²	135	135.7 Å²	135.7	83%	0.828	73%	0.725	S	S	*	*	S	Bend	trans	-144.7	68.7	172.6	53.5	0	0	0	0	109.5
631	G	38.4	Very low	44.6	Very low	70 Å²	70	137.9 Å²	137.9	72%	0.722	74%	0.736	S	S	*	*			trans	-178.6	118.9	179.8	0	0	0	0	0	112.9
632	S	36.1	Very low	43.4	Very low	119 Å²	119	139.3 Å²	139.3	83%	0.832	75%	0.747	S	S	*	*			trans	62	148	-174.1	-120.8	0	0	0	0	114.9
633	T	38	Very low	42.2	Very low	113 Å²	113	137.4 Å²	137.4	69%	0.693	75%	0.754	S	S	*	*			cis	-140.7	131.5	16.3	-59.6	0	0	0	0	111
634	Y	41.7	Very low	41.4	Very low	233 Å²	233	141.1 Å²	141.1	91%	0.914	77%	0.766	S	S	*	*			trans	-141.4	134.6	151	-104.3	-83.1	0	0	0	108.8
635	S	37.9	Very low	40.3	Very low	97 Å²	97	143.6 Å²	143.6	68%	0.678	78%	0.777	S	S	*	*			trans	-82.6	138.1	-173.2	49.9	0	0	0	0	112.4
636	P	39.3	Very low	39.8	Very low	122 Å²	122	140.6 Å²	140.6	79%	0.792	78%	0.775	S	S	*	*			trans	-76.3	151.4	176.5	32.8	-35.3	0	0	0	112
637	V	42	Very low	39.2	Very low	141 Å²	141	137.2 Å²	137.2	86%	0.855	77%	0.772	S	S	*	*			trans	-123.2	138.9	163.4	-178.5	0	0	0	0	107.7
638	N	38.2	Very low	38.7	Very low	139 Å²	139	133 Å²	133	74%	0.743	77%	0.767	S	S	*	*			trans	-67.9	145.1	-167.5	-56.5	-38.2	0	0	0	113.5
639	S	38.8	Very low	38	Very low	106 Å²	106	131.7 Å²	131.7	74%	0.741	76%	0.76	S	S	*	*				-167.5	127.8	115.7	-81.2	0	0	0	0	113.2
640	H	39	Very low	37.6	Very low	156 Å²	156	136.5 Å²	136.5	72%	0.722	77%	0.766	S	S	*	*			trans	12.7	135.8	136.9	-40	-70.3	0	0	0	118.3
641	T	36.8	Very low	37.2	Very low	115 Å²	115	134.4 Å²	134.4	71%	0.706	76%	0.763	S	S	*	*			cis	-168.1	166.1	1.4	5.2	0	0	0	0	109.2
642	L	34.7	Very low	37.2	Very low	159 Å²	159	137.8 Å²	137.8	83%	0.832	77%	0.769	S	S	*	*			trans	28.9	143.9	144.9	-59.6	166.3	0	0	0	120.2
643	S	33	Very low	37	Very low	94 Å²	94	140.8 Å²	140.8	66%	0.657	77%	0.767	S	S	*	*			cis	179.7	142	-7.4	48.1	0	0	0	0	105.7
644	T	37.1	Very low	37.1	Very low	131 Å²	131	140.7 Å²	140.7	80%	0.804	77%	0.769	S	S	*	*				165.2	160.6	97.1	-76.7	0	0	0	0	109.4
645	F	32.1	Very low	36.9	Very low	200 Å²	200	136.3 Å²	136.3	88%	0.877	76%	0.76	S	S	*	*			trans	-69	171.2	-174.6	-76.8	-83.1	0	0	0	116.2
646	P	41.3	Very low	36.9	Very low	107 Å²	107	137 Å²	137	70%	0.695	76%	0.762	S	S	*	*			trans	-101.8	-173.1	-161.1	42.3	-37.6	0	0	0	113.9
647	I	36.8	Very low	36.5	Very low	151 Å²	151	135.7 Å²	135.7	77%	0.774	76%	0.762	S	S	*	*			trans	-173.5	141.8	136.4	-100	154.8	0	0	0	113.4
648	D	33.6	Very low	36.1	Very low	141 Å²	141	138.1 Å²	138.1	75%	0.754	76%	0.763	S	S	*	*			trans	19.4	145.5	156.7	-45.2	-27.9	0	0	0	126.7
649	D	33.4	Very low	35.8	Very low	127 Å²	127	140.6 Å²	140.6	68%	0.679	77%	0.77	S	S	*	*				107.5	141.7	123	-126.2	-0.7	0	0	0	124.2
650	R	36.7	Very low	35.7	Very low	210 Å²	210	141 Å²	141	79%	0.792	77%	0.77	S	S	*	*			trans	67.7	105.7	152.7	-78.8	158.5	-156.9	-121.9	-5.4	124.2
651	A	35.5	Very low	35.5	Very low	91 Å²	91	144.9 Å²	144.9	75%	0.752	78%	0.779	S	S	*	*				78.6	135.4	116	0	0	0	0	0	122.1
652	V	39.8	Very low	35.3	Very low	141 Å²	141	144.9 Å²	144.9	86%	0.855	78%	0.78	S	S	*	*				171.2	135.5	120.8	154.6	0	0	0	0	111
653	F	31.8	Very low	35.1	Very low	182 Å²	182	143.2 Å²	143.2	80%	0.798	77%	0.772	S	S	*	*			trans	-93.9	178	171.1	-88	-86.9	0	0	0	110.3	I655	F653-I655 HydrophobicContact CD1-CD1 4.4Å; F653-I655 HydrophobicContact CD1-CG1 4.34Å
654	P	39.6	Very low	35.2	Very low	112 Å²	112	140.8 Å²	140.8	73%	0.727	76%	0.755	S	S	*	*			cis	-125.1	168.6	19.1	7.8	21.9	0	0	0	115.5
655	I	36.7	Very low	34.8	Very low	140 Å²	140	140.6 Å²	140.6	72%	0.718	74%	0.743	S	S	*	*				66.2	140.6	68.3	-51.4	167.7	0	0	0	113.1	F653	F653-I655 HydrophobicContact CD1-CD1 4.4Å; F653-I655 HydrophobicContact CD1-CG1 4.34Å
656	P	38.3	Very low	34.8	Very low	112 Å²	112	137.4 Å²	137.4	73%	0.727	73%	0.734	S	S	*	*			cis	-133.8	167	3	29.6	-6.8	0	0	0	119.7
657	A	30.9	Very low	34.3	Very low	95 Å²	95	138.4 Å²	138.4	79%	0.785	73%	0.734	S	S	*	*			trans	50.1	168.6	138.1	0	0	0	0	0	122.9
658	E	33.5	Very low	34.1	Very low	191 Å²	191	141.1 Å²	141.1	89%	0.893	74%	0.735	S	S	*	*			cis	-135.4	-166.8	7.6	-86.6	-161.4	138.6	0	0	113.3
659	H	32	Very low	34	Very low	191 Å²	191	139 Å²	139	88%	0.884	73%	0.731	S	S	*	*			trans	-96.9	-133.9	-173.4	-74.3	-74.8	0	0	0	116.5
660	P	36.9	Very low	34.2	Very low	114 Å²	114	138.7 Å²	138.7	74%	0.74	73%	0.733	S	S	*	*				-129.5	175.4	-114.3	42.1	-24.2	0	0	0	119.5
661	R	34.5	Very low	34.1	Very low	238 Å²	238	136 Å²	136	90%	0.898	73%	0.729	S	S	*	*			trans	-7.5	146.7	163.2	-46	-175.7	-170.4	-142.7	5.9	119.7
662	P	34.3	Very low	34	Very low	115 Å²	115	142 Å²	142	75%	0.747	73%	0.733	S	S	*	*				-146.4	-128.2	83.8	39.6	-19.1	0	0	0	117.8
663	L	30.4	Very low	33.6	Very low	125 Å²	125	142 Å²	142	65%	0.654	73%	0.728	S	S	*	*			trans	-148.5	153.3	-143.7	-73.2	172.3	0	0	0	119.6	T463 A464	T463-L663 CarbonylContact C-O 3.52Å; T463-L663 VanDerWaalsContact C-O 3.27Å; T463-L663 PolarHBondContact N-O 3.23Å; A464-L663 CarbonylContact O-C 3.17Å; A464-L663 WeakPolarHBondContact O-CA 3.49Å
664	S	33.5	Very low	33.5	Very low	42 Å²	42	139.8 Å²	139.8	29%	0.294	72%	0.724	S	S	.	*			trans	78.3	145.9	139.1	68.3	0	0	0	0	123.6	T463 A464	T463-S664 CarbonylContact C-O 3.23Å; T463-S664 VanDerWaalsContact C-O 3.23Å; T463-S664 WeakPolarHBondContact CA-O 3.35Å; A464-S664 VanDerWaalsContact N-C 3.34Å; A464-S664 PolarHBondContact N-O 3.14Å; A464-S664 PolarHBondContact O-N 2.81Å; A464-S664 VanDerWaalsContact O-N 3.12Å
665	F	29	Very low	33.1	Very low	128 Å²	128	139.3 Å²	139.3	56%	0.561	72%	0.719	S	S	*	*			trans	84.4	152.4	171.8	-55.5	-61.2	0	0	0	117.5
666	L	32.5	Very low	32.8	Very low	132 Å²	132	140.3 Å²	140.3	69%	0.691	73%	0.725	S	S	*	*			cis	-160.3	148.5	-1.4	-124.9	168.9	0	0	0	113.3
667	N	31	Very low	32.5	Very low	129 Å²	129	138.4 Å²	138.4	69%	0.69	73%	0.726	S	S	*	*			trans	63.5	163.8	147	-113.8	-20.4	0	0	0	119.8
668	R	31.9	Very low	32.4	Very low	208 Å²	208	144.2 Å²	144.2	79%	0.785	73%	0.729	S	S	*	*			cis	-164	140.8	15.1	-155.2	168.8	-158.9	-113.1	4.6	115.2
669	S	32.9	Very low	32.4	Very low	97 Å²	97	140.8 Å²	140.8	68%	0.678	72%	0.724	S	S	*	*			trans	60.7	165.6	155.1	-67.7	0	0	0	0	119
670	V	37.5	Very low	32.3	Very low	120 Å²	120	136.9 Å²	136.9	73%	0.727	71%	0.714	S	S	*	*			cis	-134	161.9	23.2	173.1	0	0	0	0	112.5
671	Q	32.7	Very low	32.1	Very low	152 Å²	152	139.6 Å²	139.6	71%	0.71	72%	0.722	S	S	*	*			trans	-91.6	160.8	-172.4	-37.1	104.4	-58.6	0	0	116.4
672	R	35.1	Very low	31.8	Very low	218 Å²	218	133 Å²	133	82%	0.823	71%	0.709	S	S	*	*				179.5	126.9	127.7	-89.8	143.7	-172	148.5	-1.3	108.6
673	N	30.1	Very low	31.6	Very low	140 Å²	140	134.6 Å²	134.6	75%	0.749	72%	0.716	S	S	*	*				63.9	134.8	78.6	-75.4	-8.7	0	0	0	113.2
674	L	31.3	Very low	31.7	Very low	137 Å²	137	134 Å²	134	72%	0.717	72%	0.718	S	S	*	*			cis	-164.8	151	14.9	-116.1	164.3	0	0	0	113.3
675	T	30.5	Very low	32	Very low	102 Å²	102	137.6 Å²	137.6	63%	0.626	74%	0.74	S	S	*	*			trans	38.2	126.7	151.8	44.7	0	0	0	0	125.4
676	L	30.6	Very low	32.3	Very low	160 Å²	160	136.6 Å²	136.6	84%	0.838	75%	0.749	S	S	*	*				54	123.7	115.9	-151.7	85	0	0	0	121.1
677	G	32.6	Very low	32.2	Very low	73 Å²	73	137.8 Å²	137.8	75%	0.753	76%	0.756	S	S	*	*			trans	-157.2	167.8	171.6	0	0	0	0	0	113.5
678	Y	28.6	Very low	32.4	Very low	217 Å²	217	136.9 Å²	136.9	85%	0.851	76%	0.757	S	S	*	*			trans	-118.2	-171.9	-169.5	-104.9	-102	0	0	0	113.3
679	C	32.5	Very low	32.3	Very low	118 Å²	118	134.2 Å²	134.2	80%	0.797	76%	0.757	S	S	*	*			trans	89.3	115.2	-179.7	-55.3	0	0	0	0	113.1
680	V	29.8	Very low	32	Very low	110 Å²	110	134.2 Å²	134.2	67%	0.667	76%	0.757	S	S	*	*			cis	61.1	109.9	24.1	-168.2	0	0	0	0	113.5	V682	V680-V682 HydrophobicContact CG1-CG2 4.02Å
681	D	32.5	Very low	31.6	Very low	170 Å²	170	138 Å²	138	91%	0.909	76%	0.76	S	S	*	*			trans	-134.9	147.4	147.7	-104	-46.3	0	0	0	108.4
682	V	28.2	Very low	31.5	Very low	101 Å²	101	137.4 Å²	137.4	61%	0.612	76%	0.761	S	S	*	*			trans	-127.7	131.6	-171.4	173.7	0	0	0	0	109.3	V680 T684	V680-V682 HydrophobicContact CG1-CG2 4.02Å; V682-T684 HydrophobicContact CG1-CG2 4.05Å
683	V	31.6	Very low	31.2	Very low	148 Å²	148	133.6 Å²	133.6	90%	0.897	76%	0.762	S	S	*	*			trans	-132.3	114.6	161.2	-174.3	0	0	0	0	108.7
684	T	32.6	Very low	31.3	Very low	113 Å²	113	132 Å²	132	69%	0.693	76%	0.76	S	S	*	*			trans	-128.4	-173	171.8	62.3	0	0	0	0	108	V682	V682-T684 HydrophobicContact CG1-CG2 4.05Å
685	P	39.5	Very low	31.3	Very low	117 Å²	117	135.2 Å²	135.2	76%	0.76	77%	0.768	S	S	*	*				-114.4	159.5	-113.9	28.2	-8	0	0	0	114.3
686	S	33.7	Very low	31.1	Very low	107 Å²	107	135.3 Å²	135.3	75%	0.748	77%	0.773	S	S	*	*			trans	-153.1	121.5	167.9	-55	0	0	0	0	113
687	D	30.7	Very low	31.2	Very low	157 Å²	157	133.8 Å²	133.8	84%	0.84	77%	0.773	S	S	*	*			trans	70.3	158.1	133.1	-64.8	-5.8	0	0	0	122.6
688	P	36.3	Very low	31	Very low	109 Å²	109	135.4 Å²	135.4	71%	0.708	77%	0.768	S	S	*	*			trans	-124.8	-153.9	-151.6	39	-20	0	0	0	113.6
689	L	29.8	Very low	31.1	Very low	152 Å²	152	136.1 Å²	136.1	80%	0.796	77%	0.771	S	S	*	*			trans	88.5	102.6	169.5	-51.6	-179.2	0	0	0	118.2
690	S	25.8	Very low	30.8	Very low	98 Å²	98	141 Å²	141	69%	0.685	77%	0.773	S	S	*	*				90.8	151.8	119.8	76.5	0	0	0	0	121.9
691	Y	28.8	Very low	30.8	Very low	200 Å²	200	143.1 Å²	143.1	78%	0.784	78%	0.779	S	S	*	*			trans	82.1	119	160.9	-72.5	-68.1	0	0	0	123
692	N	31.1	Very low	30.7	Very low	138 Å²	138	146.1 Å²	146.1	74%	0.738	78%	0.777	S	S	*	*			trans	82.7	101.6	140.2	-64.4	-26.7	0	0	0	121.6
693	V	28.5	Very low	30.7	Very low	138 Å²	138	150.2 Å²	150.2	84%	0.836	79%	0.79	S	S	*	*			trans	-60.4	146.1	151.3	-170.9	0	0	0	0	110.8
694	P	33.1	Very low	31.1	Very low	107 Å²	107	149 Å²	149	70%	0.695	79%	0.785	S	S	*	*			trans	-137.7	125.4	139.3	20.7	0.2	0	0	0	115.6
695	F	30.5	Very low	31.2	Very low	204 Å²	204	150 Å²	150	90%	0.895	79%	0.79	S	S	*	*			trans	55.3	127.7	144.4	-68.5	-79.7	0	0	0	123.7
696	S	25.9	Very low	30.7	Very low	105 Å²	105	153.6 Å²	153.6	73%	0.734	79%	0.794	S	S	*	*			trans	-86	154.5	165.7	-28.8	0	0	0	0	113.1
697	P	34.6	Very low	31.1	Very low	127 Å²	127	154.3 Å²	154.3	83%	0.825	80%	0.796	S	S	*	*			trans	-81.1	135.5	164	32.6	-31.7	0	0	0	111.6
698	T	27.2	Very low	31.2	Very low	108 Å²	108	154.6 Å²	154.6	66%	0.663	79%	0.792	S	S	*	*			trans	-106.7	139	177.2	-69.7	0	0	0	0	111.3	R700	T698-R700 HydrophobicContact CG2-CG 4.3Å
699	Y	29.8	Very low	31	Very low	232 Å²	232	156.4 Å²	156.4	91%	0.91	80%	0.796	S	S	*	*			trans	-130.6	121	154.4	-85.2	-80.9	0	0	0	111.4
700	R	27.1	Very low	31.2	Very low	220 Å²	220	152.8 Å²	152.8	83%	0.83	80%	0.796	S	S	*	*			trans	-93.9	162.6	169.3	-72.1	172.3	163.4	158.4	-6.7	109.4	T698	T698-R700 HydrophobicContact CG2-CG 4.3Å
701	I	30.5	Very low	31.6	Very low	155 Å²	155	154 Å²	154	80%	0.795	80%	0.799	S	S	*	*				-164.2	116.8	122.9	-100.7	150.9	0	0	0	113
702	R	30.7	Very low	31.8	Very low	232 Å²	232	151.3 Å²	151.3	88%	0.875	80%	0.798	S	S	*	*			trans	49	118	146.5	-54.4	-178.2	-179.2	-151.5	-2.1	122
703	Q	28.1	Very low	31.7	Very low	188 Å²	188	149.3 Å²	149.3	88%	0.879	80%	0.795	S	S	*	*			trans	-89.6	162.1	142.8	-66.5	175.9	-27.6	0	0	110.8
704	P	38.1	Very low	31.9	Very low	122 Å²	122	149.5 Å²	149.5	79%	0.792	79%	0.791	S	S	*	*			trans	-114.6	105.9	162	34.6	-22.4	0	0	0	113.9
705	V	35	Very low	32	Very low	134 Å²	134	150.7 Å²	150.7	81%	0.812	80%	0.796	S	S	*	*			trans	23.1	128.6	136.8	-177.9	0	0	0	0	120.2
706	K	29.1	Very low	32.3	Very low	193 Å²	193	146.2 Å²	146.2	84%	0.839	79%	0.788	S	S	*	*			trans	-71.7	143.1	159.3	-71.9	-178.5	175.6	-178.5	0	112.4
707	P	42.7	Very low	32.6	Very low	122 Å²	122	148.9 Å²	148.9	79%	0.792	79%	0.789	S	S	*	*			trans	-93	164	143.7	35.7	-29.6	0	0	0	111.6
708	E	31.8	Very low	32.6	Very low	162 Å²	162	148.8 Å²	148.8	76%	0.757	78%	0.777	S	S	*	*			trans	-106.9	169.1	176.7	-55.3	-169	146.6	0	0	113
709	N	33.6	Very low	33	Very low	148 Å²	148	151.1 Å²	151.1	79%	0.791	78%	0.78	S	S	*	*			trans	61.3	116	154.4	-53	-39.9	0	0	0	118.2
710	G	33.7	Very low	33.1	Very low	76 Å²	76	144.6 Å²	144.6	78%	0.784	77%	0.769	S	S	*	*			trans	178.5	45.2	-179.7	0	0	0	0	0	119.3
711	V	34.2	Very low	33.5	Very low	124 Å²	124	139.2 Å²	139.2	75%	0.752	77%	0.765	S	S	*	*			trans	28	113.4	146.3	-175.9	0	0	0	0	119.8
712	N	32	Very low	33.6	Very low	143 Å²	143	137.2 Å²	137.2	77%	0.765	76%	0.764	S	S	*	*			trans	73.3	127.8	145.8	-63	-5.1	0	0	0	123.9
713	S	30.4	Very low	33.8	Very low	96 Å²	96	130.4 Å²	130.4	67%	0.671	75%	0.753	S	S	*	*				81	123.1	127.8	66.6	0	0	0	0	122.9
714	N	32.9	Very low	33.9	Very low	142 Å²	142	128.7 Å²	128.7	76%	0.759	75%	0.749	S	S	*	*			trans	78	97.5	133	-62.1	-0.2	0	0	0	122
715	T	34	Very low	33.5	Very low	131 Å²	131	128.7 Å²	128.7	80%	0.804	75%	0.746	S	S	*	*				60.7	171	121.7	10.8	0	0	0	0	119.2
716	P	37.1	Very low	33.3	Very low	111 Å²	111	133.7 Å²	133.7	72%	0.721	75%	0.75	S	S	*	*				-124.8	-137.7	-129.2	42.9	-22.5	0	0	0	112.8
717	E	32.7	Very low	33.6	Very low	160 Å²	160	133.4 Å²	133.4	75%	0.748	75%	0.752	S	S	*	*			trans	78.9	152.4	179.7	-50.8	-147.7	113.1	0	0	114.9
718	Q	33.5	Very low	33.6	Very low	125 Å²	125	132.6 Å²	132.6	58%	0.584	75%	0.747	S	S	*	*			cis	-159.1	176.6	-26.9	-109.2	-158.3	67.6	0	0	107.3
719	H	35.9	Very low	33.8	Very low	157 Å²	157	133 Å²	133	73%	0.727	75%	0.747	S	S	*	*			trans	70.9	162.7	161.9	-47.9	-49.7	0	0	0	118.4
720	S	32.8	Very low	33.9	Very low	96 Å²	96	132 Å²	132	67%	0.671	74%	0.737	S	S	*	*			cis	-169.2	153	-38.4	-92.7	0	0	0	0	110.7
721	S	34.3	Very low	34	Very low	106 Å²	106	138.3 Å²	138.3	74%	0.741	74%	0.737	S	S	*	*			trans	60.6	116.2	144.3	-61.7	0	0	0	0	122.7
722	S	34.1	Very low	34.1	Very low	113 Å²	113	141.2 Å²	141.2	79%	0.79	74%	0.74	S	S	*	*			trans	78.3	158.5	134	101	0	0	0	0	117.4
723	S	33.1	Very low	34.2	Very low	90 Å²	90	144.4 Å²	144.4	63%	0.629	74%	0.741	S	S	*	*			cis	-169.7	176.6	-18.5	46.4	0	0	0	0	112.3
724	L	32	Very low	34.3	Very low	151 Å²	151	148.2 Å²	148.2	79%	0.791	75%	0.746	S	S	*	*			trans	70.2	107.7	153.5	-70.7	163.2	0	0	0	120.8
725	V	28.9	Very low	34.4	Very low	122 Å²	122	148.2 Å²	148.2	74%	0.739	75%	0.745	S	S	*	*				67.2	113.6	123.6	175.1	0	0	0	0	120
726	R	31.5	Very low	34.3	Very low	239 Å²	239	145.2 Å²	145.2	90%	0.902	74%	0.74	S	S	*	*				-166.8	130.2	116.9	-106.3	168.4	-175.7	-176.6	1.5	113.1
727	Q	35.2	Very low	34.2	Very low	187 Å²	187	147.7 Å²	147.7	87%	0.874	75%	0.746	S	S	*	*			trans	-106.9	156.2	152.9	-87.1	-165.3	-5.7	0	0	109.1
728	P	43	Very low	34.3	Very low	106 Å²	106	148 Å²	148	69%	0.688	75%	0.748	S	S	*	*			trans	-139.4	126	145.4	17.9	4.8	0	0	0	116
729	F	33.9	Very low	34.1	Very low	170 Å²	170	146.6 Å²	146.6	75%	0.746	75%	0.752	S	S	*	*			trans	69.7	126.5	130.6	-69.6	-56.6	0	0	0	125.1
730	H	37.1	Very low	34	Very low	128 Å²	128	146.1 Å²	146.1	59%	0.593	76%	0.76	S	S	*	*			trans	75.2	151.9	131.5	-71.4	-29.4	0	0	0	119.4
731	R	35.5	Very low	33.7	Very low	208 Å²	208	148 Å²	148	79%	0.785	77%	0.767	S	S	*	*			cis	-150.5	175.3	-0.1	-107.8	149.3	-156.9	-179.7	5.7	107.2
732	K	36.5	Very low	33.8	Very low	185 Å²	185	149.5 Å²	149.5	80%	0.804	77%	0.772	S	S	*	*			cis	-139.9	-108.7	19.8	-161.6	177.8	176	179.1	0	112.7
733	R	33	Very low	33.5	Very low	209 Å²	209	151.2 Å²	151.2	79%	0.789	77%	0.772	S	S	*	*			trans	-168.7	156.2	-172.8	-69.1	179.4	170.7	157.9	-5.8	111.2
734	F	32.9	Very low	33.6	Very low	177 Å²	177	152.6 Å²	152.6	78%	0.776	78%	0.777	S	S	*	*				-166.1	110.2	112.7	-106	-87.5	0	0	0	106.7
735	L	35.2	Very low	33.7	Very low	142 Å²	142	152.2 Å²	152.2	74%	0.743	78%	0.776	S	S	*	*				51.3	132.1	95.4	-56.5	178.3	0	0	0	114.2
736	G	32.3	Very low	33.8	Very low	68 Å²	68	153.6 Å²	153.6	70%	0.701	78%	0.779	S	S	*	*			cis	-178.5	154.9	-3.8	0	0	0	0	0	107.8
737	L	35.3	Very low	33.8	Very low	162 Å²	162	149.7 Å²	149.7	85%	0.848	78%	0.775	S	S	*	*				-178.2	161.7	74.9	-92.8	161.9	0	0	0	112
738	Q	33.6	Very low	33.6	Very low	167 Å²	167	146.5 Å²	146.5	78%	0.78	77%	0.767	S	S	*	*			trans	-20.2	166.2	152.4	-63.3	-177.2	25.6	0	0	119.5
739	S	30.1	Very low	33.1	Very low	95 Å²	95	149.4 Å²	149.4	66%	0.664	77%	0.769	S	S	*	*			cis	179.1	152.4	-18.1	-86.1	0	0	0	0	108.5
740	T	33.2	Very low	33.1	Very low	148 Å²	148	148.4 Å²	148.4	91%	0.908	77%	0.767	S	S	*	*			trans	168.4	155.5	132.9	31	0	0	0	0	111.9
741	T	28.1	Very low	32.8	Very low	134 Å²	134	149.8 Å²	149.8	82%	0.822	78%	0.779	S	S	*	*			trans	-137.5	143.3	-175.8	49.5	0	0	0	0	110.5
742	V	35.3	Very low	32.8	Very low	138 Å²	138	146.7 Å²	146.7	84%	0.836	78%	0.778	S	S	*	*			trans	-140.1	121.8	161.8	-177	0	0	0	0	109.3
743	N	27.5	Very low	32.5	Very low	150 Å²	150	142.2 Å²	142.2	80%	0.802	77%	0.77	S	S	*	*			trans	-98.9	153.1	161.6	-73	-15.8	0	0	0	108.5
744	T	36.2	Very low	32.6	Very low	119 Å²	119	139.1 Å²	139.1	73%	0.73	77%	0.768	S	S	*	*			trans	165.2	144.7	147	45.5	0	0	0	0	108.6
745	D	33.1	Very low	32.6	Very low	143 Å²	143	136.9 Å²	136.9	77%	0.765	76%	0.764	S	S	*	*			cis	-161.9	168.5	-19.4	-104.8	-25.8	0	0	0	109.1
746	N	30.6	Very low	32.5	Very low	150 Å²	150	136.7 Å²	136.7	80%	0.802	76%	0.764	S	S	*	*			trans	-81.7	141.2	176.4	-51.6	-69.8	0	0	0	111.9
747	I	32.6	Very low	32.4	Very low	158 Å²	158	139.4 Å²	139.4	81%	0.81	76%	0.762	S	S	*	*			trans	-133.7	135.5	148.8	-62.3	-175.5	0	0	0	108.2	F749	I747-F749 HydrophobicContact CG2-CD2 4.29Å; I747-F749 HydrophobicContact CG2-CE2 4.44Å
748	V	30	Very low	32.2	Very low	119 Å²	119	135.6 Å²	135.6	72%	0.721	75%	0.754	S	S	*	*			trans	-122.4	139.1	178	172.6	0	0	0	0	108.2
749	F	32.3	Very low	32.3	Very low	167 Å²	167	132.5 Å²	132.5	73%	0.732	75%	0.751	S	S	*	*			trans	-146.2	114.2	153.3	-83.9	-74	0	0	0	105.7	I747	I747-F749 HydrophobicContact CG2-CD2 4.29Å; I747-F749 HydrophobicContact CG2-CE2 4.44Å
750	E	35.4	Very low	32.4	Very low	150 Å²	150	134.5 Å²	134.5	70%	0.701	75%	0.754	S	S	*	*				63.6	104.6	94.8	-67.2	-175.9	166.2	0	0	111.3
751	D	31.2	Very low	32.4	Very low	156 Å²	156	132.3 Å²	132.3	83%	0.834	74%	0.744	S	S	*	*				73.4	101.5	69.2	-84.1	-42.4	0	0	0	114.3
752	D	35	Very low	32.5	Very low	144 Å²	144	134.1 Å²	134.1	77%	0.77	74%	0.744	S	S	*	*			trans	-162.7	121	138.2	-110.1	-31.4	0	0	0	106.6
753	S	29.8	Very low	32.4	Very low	91 Å²	91	134.2 Å²	134.2	64%	0.636	74%	0.735	S	S	*	*			cis	80.4	161.2	40.9	115.9	0	0	0	0	114.1
754	I	34.8	Very low	32.7	Very low	144 Å²	144	134.1 Å²	134.1	74%	0.738	73%	0.729	S	S	*	*			trans	74.4	91	-164.5	-50.3	171.3	0	0	0	112.1
755	N	32.2	Very low	32.4	Very low	130 Å²	130	135.1 Å²	135.1	70%	0.695	73%	0.725	S	S	*	*			cis	67.1	107.8	43.2	-138.4	11.1	0	0	0	113.6
756	N	33.9	Very low	32.3	Very low	138 Å²	138	134.5 Å²	134.5	74%	0.738	72%	0.722	S	S	*	*			trans	-178.2	125.5	139.7	-89.1	-32.6	0	0	0	108.4
757	N	29.6	Very low	32.3	Very low	125 Å²	125	132.6 Å²	132.6	67%	0.668	71%	0.712	S	S	*	*				60.8	126.7	59.5	-54.6	-39.3	0	0	0	110.8
758	A	32.4	Very low	32.1	Very low	82 Å²	82	135 Å²	135	68%	0.678	71%	0.711	S	S	*	*			cis	-158.3	-178.1	8.9	0	0	0	0	0	109.9
759	S	34.7	Very low	32.2	Very low	102 Å²	102	134.4 Å²	134.4	71%	0.713	71%	0.712	S	S	*	*			trans	68.3	148.5	154.4	-68.4	0	0	0	0	118.1
760	D	32.3	Very low	32.2	Very low	137 Å²	137	138.3 Å²	138.3	73%	0.733	72%	0.722	S	S	*	*			cis	-160.3	174.3	-14	-116.3	-49.9	0	0	0	110
761	S	34.2	Very low	32.3	Very low	101 Å²	101	134.9 Å²	134.9	71%	0.706	72%	0.72	S	S	*	*			trans	51.8	88.7	156	60.8	0	0	0	0	119
762	E	30.2	Very low	32.4	Very low	172 Å²	172	133.9 Å²	133.9	80%	0.804	72%	0.721	S	S	*	*				8.2	161.1	130	-51.4	-178.8	123.6	0	0	123.3
763	H	33.2	Very low	32.6	Very low	141 Å²	141	133.3 Å²	133.3	65%	0.653	72%	0.724	S	S	*	*			trans	85.6	123.6	150.7	-78.6	-64.8	0	0	0	122.1
764	H	33.1	Very low	32.7	Very low	147 Å²	147	134.1 Å²	134.1	68%	0.681	73%	0.729	S	S	*	*			trans	49.6	143.6	150	-67	-76.2	0	0	0	121.1
765	E	30.5	Very low	32.5	Very low	140 Å²	140	133 Å²	133	65%	0.654	73%	0.731	S	S	*	*			cis	-175.3	179.9	-22.4	-150.1	-178.4	158.1	0	0	107
766	N	30.5	Very low	32.5	Very low	130 Å²	130	135.7 Å²	135.7	70%	0.695	73%	0.731	S	S	*	*			trans	65.8	96.8	154	-70.8	-51.9	0	0	0	120.3
767	D	30.2	Very low	32.8	Very low	111 Å²	111	140.2 Å²	140.2	59%	0.594	74%	0.738	S	S	*	*				109.9	143.1	112.8	-154.5	13	0	0	0	119.3
768	R	28.3	Very low	33.2	Very low	207 Å²	207	141.9 Å²	141.9	78%	0.781	75%	0.746	S	S	*	*			trans	52.8	119.4	172	-71.4	155.7	-131.6	-167.2	9.5	117.2
769	S	32.7	Very low	33.5	Very low	107 Å²	107	148.3 Å²	148.3	75%	0.748	75%	0.753	S	S	*	*				177.1	168.4	67.5	54.3	0	0	0	0	115.4
770	R	32.6	Very low	33.7	Very low	249 Å²	249	154 Å²	154	94%	0.94	76%	0.759	S	S	*	*			trans	72.8	151.2	163.8	-81.2	179	165.8	158.9	-3.4	119.2
771	A	35.9	Very low	34	Very low	79 Å²	79	157.8 Å²	157.8	65%	0.653	76%	0.763	S	S	*	*			trans	-128.2	-169.9	-174.4	0	0	0	0	0	109.8
772	P	34.4	Very low	34	Very low	134 Å²	134	163.4 Å²	163.4	87%	0.87	77%	0.769	S	S	*	*				-125.7	163.9	103.3	36.6	-33.7	0	0	0	114.6
773	T	38.9	Very low	34	Very low	133 Å²	133	166.5 Å²	166.5	82%	0.816	77%	0.773	S	S	*	*			trans	-96.4	146.2	-168.3	49.9	0	0	0	0	114.3
774	S	32.2	Very low	34.3	Very low	107 Å²	107	163.4 Å²	163.4	75%	0.748	77%	0.772	S	S	*	*			trans	-141.4	148.2	140.1	85.5	0	0	0	0	111.3	W776	S774-W776 PolarHBondContact O-N 2.79Å
775	P	30.8	Very low	34.2	Very low	120 Å²	120	167.1 Å²	167.1	78%	0.779	78%	0.78	S	S	*	*	S	Bend	trans	-113.2	67.9	-142	39.5	-30.7	0	0	0	115.4
776	W	31.1	Very low	34.3	Very low	187 Å²	187	167.3 Å²	167.3	71%	0.708	79%	0.786	S	S	*	*			trans	-121.1	-19	176.5	-75.4	95.2	0	0	0	116.5	S774 L778	S774-W776 PolarHBondContact O-N 2.79Å; W776-L778 PolarHBondContact O-N 3.43Å
777	R	40.4	Very low	34.4	Very low	233 Å²	233	166.6 Å²	166.6	88%	0.879	79%	0.788	S	S	*	*	S	Bend	trans	-75	-22.9	-172	-79.1	-170.1	175.6	-167.2	-0.5	115.9
778	L	39.4	Very low	34.6	Very low	161 Å²	161	169.3 Å²	169.3	84%	0.843	80%	0.802	S	S	*	*	G	3₁₀ helix	trans	-71.7	-31	-179.3	-91	76.4	0	0	0	113.5	W776 R780 R781	W776-L778 PolarHBondContact O-N 3.43Å; L778-R780 VanDerWaalsContact C-N 3.31Å; L778-R780 PolarHBondContact O-N 2.97Å; L778-R781 PolarHBondContact O-N 3.06Å
779	R	38.5	Very low	34.9	Very low	217 Å²	217	165.4 Å²	165.4	82%	0.819	81%	0.806	S	S	*	*	G	3₁₀ helix	trans	-74.6	-15	-170.4	-149.5	170.9	-168.4	162	5	114.6
780	R	39.3	Very low	34.8	Very low	221 Å²	221	164.1 Å²	164.1	83%	0.834	81%	0.81	S	S	*	*	G	3₁₀ helix	trans	-90.7	-15.5	176.5	-61.7	-166.2	-167.3	-170	5.6	114.5	L778	L778-R780 VanDerWaalsContact C-N 3.31Å; L778-R780 PolarHBondContact O-N 2.97Å
781	R	38.5	Very low	34.9	Very low	216 Å²	216	159.1 Å²	159.1	82%	0.815	81%	0.807	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.4	-13.4	-178.2	-103	-175.4	169.8	-170.4	-3.9	114.8	L778	L778-R781 PolarHBondContact O-N 3.06Å
782	W	33.3	Very low	34.8	Very low	220 Å²	220	160.8 Å²	160.8	83%	0.833	81%	0.813	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.8	-24.8	-178.5	-142.9	70	0	0	0	113.8	A784	W782-A784 VanDerWaalsContact C-N 3.32Å
783	W	31.1	Very low	34.9	Very low	237 Å²	237	159.5 Å²	159.5	90%	0.898	81%	0.805	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.7	4	177.2	-80.3	83.6	0	0	0	114.2
784	A	38.3	Very low	34.8	Very low	76 Å²	76	161.7 Å²	161.7	63%	0.628	81%	0.811	S	S	*	*	S	Bend	trans	-114.4	20.1	-170.1	0	0	0	0	0	114	W782	W782-A784 VanDerWaalsContact C-N 3.32Å
785	R	32	Very low	34.9	Very low	224 Å²	224	159.8 Å²	159.8	85%	0.845	81%	0.808	S	S	*	*	S	Bend	trans	-146.1	14.8	-175.5	-113	-176.2	-173.4	-147.1	-1.3	117.5
786	N	32.6	Very low	35.2	Very low	145 Å²	145	160 Å²	160	78%	0.775	81%	0.813	S	S	*	*			trans	-125.1	96.1	170.8	-86.9	-27.3	0	0	0	110.6
787	P	32.5	Very low	35.9	Very low	114 Å²	114	156.8 Å²	156.8	74%	0.74	82%	0.816	S	S	*	*			trans	-86.4	116.9	165.2	32.6	-27.1	0	0	0	109.3
788	L	34	Very low	36	Very low	168 Å²	168	150.5 Å²	150.5	88%	0.88	81%	0.805	S	S	*	*			trans	-120.3	110	168.5	-75.9	178.4	0	0	0	110.4
789	S	33.5	Very low	35.9	Very low	126 Å²	126	153.3 Å²	153.3	88%	0.881	81%	0.806	S	S	*	*			trans	-62.8	156.1	-177.4	-45.9	0	0	0	0	113.4
790	G	31.2	Very low	35.8	Very low	80 Å²	80	147.2 Å²	147.2	83%	0.825	80%	0.797	S	S	*	*			trans	-170.6	40.7	176.9	0	0	0	0	0	114.1
791	V	34.4	Very low	35.8	Very low	144 Å²	144	141.9 Å²	141.9	87%	0.873	79%	0.793	S	S	*	*			trans	-103.3	131.5	-179	-177.9	0	0	0	0	111
792	S	34.6	Very low	35.9	Very low	113 Å²	113	136.9 Å²	136.9	79%	0.79	79%	0.789	S	S	*	*			trans	-170	161.1	169.1	-81.4	0	0	0	0	107.2
793	P	36.5	Very low	36.1	Very low	108 Å²	108	131.7 Å²	131.7	70%	0.701	79%	0.786	S	S	*	*			cis	-140.5	-171.3	20.6	43.3	-24.9	0	0	0	116.5
794	L	35.7	Very low	36.3	Very low	179 Å²	179	130.2 Å²	130.2	94%	0.937	78%	0.782	S	S	*	*			trans	68.9	141.4	169.7	-80.2	101.5	0	0	0	118.7
795	G	34.4	Very low	36.2	Very low	67 Å²	67	131.1 Å²	131.1	69%	0.691	78%	0.78	S	S	*	*			trans	174.8	-21.2	179.3	0	0	0	0	0	119.9
796	S	38.5	Very low	36.5	Very low	124 Å²	124	126.4 Å²	126.4	87%	0.867	77%	0.767	S	S	*	*			trans	63.5	150.6	174.7	39.6	0	0	0	0	120.2
797	P	45.9	Very low	36.7	Very low	119 Å²	119	128.1 Å²	128.1	77%	0.773	76%	0.763	S	S	*	*			trans	-106.7	-168.7	-176.7	42.8	-34.9	0	0	0	113.7
798	P	42.8	Very low	36.9	Very low	101 Å²	101	129.8 Å²	129.8	66%	0.656	77%	0.765	S	S	*	*				-153.1	165.9	103.1	42.2	-26.4	0	0	0	117.9
799	Y	37	Very low	37	Very low	220 Å²	220	126.1 Å²	126.1	86%	0.863	75%	0.753	S	S	*	*			trans	61.5	144	160.6	-64.6	-57.3	0	0	0	119
800	S	35.9	Very low	37.1	Very low	89 Å²	89	125.1 Å²	125.1	62%	0.622	75%	0.746	S	S	*	*			cis	-160.5	133.3	-1	-99.7	0	0	0	0	113.9
801	S	39.8	Very low	37.3	Very low	109 Å²	109	127.7 Å²	127.7	76%	0.762	74%	0.741	S	S	*	*			trans	71.8	167.4	138.5	-44.9	0	0	0	0	119.7
802	P	40.7	Very low	37.4	Very low	111 Å²	111	125.8 Å²	125.8	72%	0.721	73%	0.734	S	S	*	*				-144.1	-167.3	-95.4	39.4	-16.3	0	0	0	117.4
803	S	36.7	Very low	37.6	Very low	112 Å²	112	123.9 Å²	123.9	78%	0.783	73%	0.725	S	S	*	*			trans	89.9	146.8	165.9	-29.7	0	0	0	0	116.2
804	Y	35.7	Very low	37.6	Very low	206 Å²	206	129.4 Å²	129.4	81%	0.808	73%	0.732	S	S	*	*			cis	-142.8	173.5	4.7	-166.7	-112.1	0	0	0	112.3
805	T	36.7	Very low	37.6	Very low	94 Å²	94	127.5 Å²	127.5	58%	0.577	72%	0.718	S	S	*	*			trans	-77.7	163.4	-172.1	50.1	0	0	0	0	114.2
806	E	37.2	Very low	37.7	Very low	126 Å²	126	132.9 Å²	132.9	59%	0.589	72%	0.718	S	S	*	*				179.9	170.5	73.6	-80.1	-151.2	140.2	0	0	109.6
807	R	36.2	Very low	37.6	Very low	181 Å²	181	133.1 Å²	133.1	68%	0.683	71%	0.705	S	S	*	*			cis	-167.4	151.9	-8.1	-114.7	-175.4	-154.7	166.8	26	109.8
808	L	37.6	Very low	37	Very low	148 Å²	148	133.8 Å²	133.8	78%	0.775	70%	0.702	S	S	*	*			trans	58.2	161.3	144.8	-60.3	174.6	0	0	0	121.7
809	S	35.2	Very low	36.8	Very low	91 Å²	91	134.4 Å²	134.4	64%	0.636	70%	0.704	S	S	*	*			cis	-175.5	147.6	-40.4	-102.1	0	0	0	0	112.4
810	S	37.1	Very low	36.7	Very low	105 Å²	105	128 Å²	128	73%	0.734	69%	0.691	S	S	*	*			trans	64.9	167.1	150.4	-54.2	0	0	0	0	119
811	D	35.4	Very low	36.7	Very low	134 Å²	134	129.5 Å²	129.5	72%	0.717	69%	0.692	S	S	*	*			cis	-153.9	159.9	2.4	-139.7	-45.8	0	0	0	113.8
812	S	36.6	Very low	36.4	Very low	105 Å²	105	132.9 Å²	132.9	73%	0.734	69%	0.688	S	S	*	*			trans	44.4	160.4	144.8	-75.9	0	0	0	0	124.7
813	A	38.8	Very low	36.1	Very low	72 Å²	72	135.1 Å²	135.1	60%	0.595	69%	0.687	S	S	*	*			cis	-178.5	154.1	-26.3	0	0	0	0	0	112.4
814	R	35.9	Very low	35.8	Very low	224 Å²	224	137 Å²	137	85%	0.845	69%	0.689	S	S	*	*			trans	68.5	160.3	151.7	-69.5	165.3	-172.6	-162.7	4.5	118
815	Q	36.7	Very low	35.7	Very low	140 Å²	140	130.6 Å²	130.6	65%	0.654	68%	0.684	S	S	*	*			cis	-157.4	145.2	-4.3	-125.2	162.7	-43.9	0	0	113.7
816	R	35.1	Very low	35.5	Very low	180 Å²	180	132.1 Å²	132.1	68%	0.679	70%	0.699	S	S	*	*			trans	49.3	118.3	136.7	-72.9	-176.9	160.7	-121	-1.8	122.5
817	E	36.5	Very low	35.2	Very low	129 Å²	129	131.7 Å²	131.7	60%	0.603	71%	0.709	S	S	*	*				97.7	164	92.4	-75.7	164.6	-176	0	0	111.8
818	D	34.7	Very low	35	Very low	133 Å²	133	127.4 Å²	127.4	71%	0.711	71%	0.712	S	S	*	*			cis	-157.1	176.4	3	-144.2	-5.6	0	0	0	115.3
819	V	37.7	Very low	34.6	Very low	114 Å²	114	125.3 Å²	125.3	69%	0.691	71%	0.71	S	S	*	*			trans	40.1	142.2	138.9	157.6	0	0	0	0	122.6
820	S	34.7	Very low	34.5	Very low	86 Å²	86	128 Å²	128	60%	0.601	72%	0.716	S	S	*	*			cis	-174.9	172.9	-14.6	-86.7	0	0	0	0	112.4
821	D	35.6	Very low	34.2	Very low	119 Å²	119	127.8 Å²	127.8	64%	0.636	72%	0.72	S	S	*	*			trans	69.6	153.5	149.3	-75.1	-23.9	0	0	0	119.8
822	R	33.9	Very low	33.9	Very low	181 Å²	181	124.7 Å²	124.7	68%	0.683	72%	0.719	S	S	*	*			cis	-163.6	159	-7.7	-119.7	163.2	-150.8	-170.1	29.5	115.6
823	F	34.5	Very low	33.6	Very low	157 Å²	157	124.4 Å²	124.4	69%	0.689	72%	0.723	S	S	*	*			trans	70.4	120.5	142	-79.4	-45	0	0	0	127.8
824	N	30.9	Very low	33.1	Very low	153 Å²	153	125.9 Å²	125.9	82%	0.818	73%	0.729	S	S	*	*				67.9	143.5	124.4	-79.1	-3	0	0	0	126.8
825	G	32.6	Very low	32.8	Very low	70 Å²	70	120.5 Å²	120.5	72%	0.722	73%	0.726	S	S	*	*			trans	128.8	98.2	157.1	0	0	0	0	0	113.9
826	S	33	Very low	32.5	Very low	126 Å²	126	121.5 Å²	121.5	88%	0.881	73%	0.731	S	S	*	*				56.8	138	72.7	-80.9	0	0	0	0	116
827	C	29.6	Very low	32.1	Very low	117 Å²	117	120.9 Å²	120.9	79%	0.791	73%	0.733	S	S	*	*			cis	-169.3	170.2	-14.1	-162.5	0	0	0	0	110.2
828	A	32.5	Very low	31.6	Very low	91 Å²	91	119 Å²	119	75%	0.752	74%	0.735	S	S	*	*			trans	65	163.1	157.9	0	0	0	0	0	119.2
829	S	29.9	Very low	31.4	Very low	104 Å²	104	121.8 Å²	121.8	73%	0.727	74%	0.743	S	S	*	*			cis	-171	-176.9	-31.2	-173.1	0	0	0	0	108.8
830	I	32.3	Very low	30.8	Very low	149 Å²	149	120.4 Å²	120.4	76%	0.764	74%	0.738	S	S	*	*			trans	69.1	101.6	166.5	-50.1	177.9	0	0	0	113.4
831	A	30.3	Very low	30.6	Very low	100 Å²	100	125.2 Å²	125.2	83%	0.826	75%	0.751	S	S	*	*				65.7	139.8	74.2	0	0	0	0	0	114.3
832	G	29.9	Very low	30.1	Very low	68 Å²	68	128.4 Å²	128.4	70%	0.701	76%	0.76	S	S	*	*			cis	172.9	-179.7	-3.6	0	0	0	0	0	111.2
833	A	31.4	Very low	30.1	Very low	99 Å²	99	124.5 Å²	124.5	82%	0.818	77%	0.766	S	S	*	*			trans	62.5	166.3	174.8	0	0	0	0	0	116.1
834	S	28.5	Very low	29.9	Very low	103 Å²	103	122.4 Å²	122.4	72%	0.72	77%	0.766	S	S	*	*			cis	-167.4	153	-36.1	-92.6	0	0	0	0	108.4
835	S	29.4	Very low	30	Very low	112 Å²	112	121.5 Å²	121.5	78%	0.783	76%	0.761	S	S	*	*			trans	64.5	160.1	158	73.3	0	0	0	0	117.3
836	Q	29.7	Very low	30	Very low	160 Å²	160	125.8 Å²	125.8	75%	0.748	76%	0.762	S	S	*	*			cis	-159.4	170.5	-23.4	-112.8	-170.7	9.2	0	0	109.2
837	F	26	Very low	30.3	Very low	168 Å²	168	127.4 Å²	127.4	74%	0.737	76%	0.761	S	S	*	*			trans	36	104.7	152.7	-75.6	-117	0	0	0	118.3
838	S	25.6	Very low	30.5	Very low	90 Å²	90	131.5 Å²	131.5	63%	0.629	76%	0.76	S	S	*	*				67.4	121.2	72.5	77.7	0	0	0	0	116.1
839	H	30.8	Very low	30.6	Very low	191 Å²	191	132.6 Å²	132.6	88%	0.884	76%	0.757	S	S	*	*			trans	-150.4	161.6	138.6	-128.7	-87.6	0	0	0	112.3
840	S	26.2	Very low	30.8	Very low	85 Å²	85	132 Å²	132	59%	0.594	76%	0.759	S	S	*	*			trans	-97.8	152.6	-177.3	55.8	0	0	0	0	113
841	Q	30.5	Very low	30.8	Very low	187 Å²	187	129.2 Å²	129.2	87%	0.874	76%	0.758	S	S	*	*			trans	-134.7	137.6	153.9	-158.6	77.1	18.5	0	0	109.3
842	F	24.7	Very low	30.9	Very low	185 Å²	185	129.2 Å²	129.2	81%	0.811	76%	0.758	S	S	*	*			trans	-86.8	151	166	-94.1	-111.9	0	0	0	109.8
843	A	33.1	Very low	31	Very low	99 Å²	99	130.2 Å²	130.2	82%	0.818	76%	0.76	S	S	*	*			trans	-140.3	153.5	155	0	0	0	0	0	107.9
844	V	30.7	Very low	31.4	Very low	113 Å²	113	132.9 Å²	132.9	69%	0.685	76%	0.759	S	S	*	*			trans	-126.1	-169.8	-174.4	-167.7	0	0	0	0	107.7
845	D	32.7	Very low	31.6	Very low	134 Å²	134	133.5 Å²	133.5	72%	0.717	76%	0.759	S	S	*	*			trans	77.1	115.9	169.7	-44.6	-38.8	0	0	0	113
846	E	33.4	Very low	31.9	Very low	160 Å²	160	137 Å²	137	75%	0.748	76%	0.763	S	S	*	*				98.9	128.3	50	-85.5	-154.3	159.2	0	0	111
847	D	38.9	Very low	31.9	Very low	161 Å²	161	136 Å²	136	86%	0.861	76%	0.763	S	S	*	*			trans	-160.1	157.6	160.7	-133.7	-27.6	0	0	0	113.2
848	W	33.9	Very low	32.5	Very low	202 Å²	202	137 Å²	137	77%	0.765	77%	0.772	S	S	*	*			trans	-141.2	162.5	-152.3	-94	56.3	0	0	0	112.7
849	V	35.4	Very low	32.8	Very low	114 Å²	114	135.9 Å²	135.9	69%	0.691	77%	0.769	S	S	*	*			cis	-168	-174.7	-13.1	66.2	0	0	0	0	109.1
850	A	32.6	Very low	32.7	Very low	93 Å²	93	134.7 Å²	134.7	77%	0.769	77%	0.769	S	S	*	*			trans	75.1	159.7	167.6	0	0	0	0	0	117
851	A	33.7	Very low	32.9	Very low	90 Å²	90	139.3 Å²	139.3	74%	0.744	78%	0.781	S	S	*	*			cis	-133.9	152.6	1.9	0	0	0	0	0	109.1
852	A	32.3	Very low	33.1	Very low	99 Å²	99	134.7 Å²	134.7	82%	0.818	77%	0.769	S	S	*	*				60.8	135.7	60.9	0	0	0	0	0	113.4
853	A	31.2	Very low	33.2	Very low	90 Å²	90	131.3 Å²	131.3	74%	0.744	77%	0.768	S	S	*	*			cis	-153.3	-152.8	4.8	0	0	0	0	0	111.9
854	L	39.3	Very low	33.2	Very low	154 Å²	154	134.5 Å²	134.5	81%	0.806	77%	0.769	S	S	*	*			trans	78.3	117.6	-177.2	-50	179.5	0	0	0	114.5
855	T	33.5	Very low	33.3	Very low	116 Å²	116	135.6 Å²	135.6	71%	0.712	77%	0.77	S	S	*	*			cis	71.9	132.2	16.4	91.5	0	0	0	0	113.5
856	E	34.8	Very low	33.3	Very low	187 Å²	187	134.2 Å²	134.2	87%	0.874	77%	0.772	S	S	*	*			cis	-149.9	171.7	6	-57.9	177.6	130.4	0	0	108.8
857	D	30.6	Very low	33.1	Very low	138 Å²	138	132.1 Å²	132.1	74%	0.738	77%	0.774	S	S	*	*			cis	-146.2	-96.5	-16.8	177.6	66.8	0	0	0	110	A859	D857-A859 PolarHBondContact OD2-N 3.32Å
858	M	38	Very low	32.8	Very low	188 Å²	188	130.6 Å²	130.6	93%	0.926	77%	0.771	S	S	*	*			trans	67.3	59.7	-173.9	-57.1	-157.9	82.9	0	0	117.9
859	A	31.4	Very low	32.6	Very low	68 Å²	68	125.6 Å²	125.6	56%	0.562	77%	0.767	S	S	*	*			trans	-89.1	149	145.8	0	0	0	0	0	111.7	D857	D857-A859 PolarHBondContact OD2-N 3.32Å
860	N	28.8	Very low	32.6	Very low	165 Å²	165	126.6 Å²	126.6	88%	0.882	77%	0.767	S	S	*	*			trans	59.7	116.2	174.8	-57.5	-28.3	0	0	0	117.9
861	E	32.2	Very low	32.5	Very low	182 Å²	182	129 Å²	129	85%	0.85	77%	0.767	S	S	*	*				-157.6	163.3	117.3	-125.7	-174.1	-160.2	0	0	113.9
862	S	33.3	Very low	32.4	Very low	91 Å²	91	129.2 Å²	129.2	64%	0.636	76%	0.763	S	S	*	*			trans	21.4	119.1	163.2	56.1	0	0	0	0	119.8
863	S	27.6	Very low	32.3	Very low	113 Å²	113	129.4 Å²	129.4	79%	0.79	76%	0.758	S	S	*	*			cis	61.7	99	44.7	91.2	0	0	0	0	115
864	M	33.5	Very low	32.4	Very low	167 Å²	167	134.3 Å²	134.3	82%	0.823	76%	0.763	S	S	*	*			trans	-164.6	123.4	153	-92	-124	165.7	0	0	111.6
865	N	31.7	Very low	32	Very low	135 Å²	135	137.6 Å²	137.6	72%	0.722	77%	0.765	S	S	*	*			trans	64.2	145.1	149.4	-47.7	-22.7	0	0	0	118.2
866	S	32.6	Very low	32	Very low	106 Å²	106	136.3 Å²	136.3	74%	0.741	76%	0.761	S	S	*	*			cis	-157.9	129.6	-5.8	35.7	0	0	0	0	107.3
867	S	29.4	Very low	32	Very low	115 Å²	115	135 Å²	135	80%	0.804	76%	0.76	S	S	*	*				87.4	71.8	64.6	-60	0	0	0	0	115.7
868	T	33.2	Very low	32.1	Very low	129 Å²	129	131.9 Å²	131.9	79%	0.791	76%	0.76	S	S	*	*			trans	-161.2	121	145.4	34.1	0	0	0	0	106.1
869	S	30.3	Very low	32.1	Very low	97 Å²	97	130.9 Å²	130.9	68%	0.678	76%	0.756	S	S	*	*			cis	69.1	135	41.5	100.2	0	0	0	0	110.9
870	I	34.1	Very low	32.3	Very low	136 Å²	136	132.2 Å²	132.2	70%	0.697	76%	0.762	S	S	*	*			cis	-157.6	144	37.4	-111.5	154.4	0	0	0	110.6
871	N	30.5	Very low	32.6	Very low	144 Å²	144	132.2 Å²	132.2	77%	0.77	76%	0.761	S	S	*	*			trans	40	162.1	138.6	-56.8	-11.1	0	0	0	123.1
872	S	31.6	Very low	32.8	Very low	94 Å²	94	129.1 Å²	129.1	66%	0.657	76%	0.756	S	S	*	*			cis	-169	143.4	-17.2	47.2	0	0	0	0	113.4
873	S	31.6	Very low	33	Very low	103 Å²	103	133.4 Å²	133.4	72%	0.72	77%	0.766	S	S	*	*				28	128.7	129.6	-43.1	0	0	0	0	123.2
874	F	31.8	Very low	33.9	Very low	192 Å²	192	133.5 Å²	133.5	84%	0.842	76%	0.764	S	S	*	*				-147.9	124.8	127.3	-83	-79	0	0	0	107
875	R	32	Very low	34.4	Very low	224 Å²	224	131.4 Å²	131.4	85%	0.845	76%	0.763	S	S	*	*				64.6	138.3	75.9	-71.1	-168.7	178.6	-140.4	2.8	113.8
876	S	32.3	Very low	34.8	Very low	89 Å²	89	131.4 Å²	131.4	62%	0.622	77%	0.768	S	S	*	*			cis	-166.5	-172.1	-7.8	53.5	0	0	0	0	111.5
877	N	34.5	Very low	35.4	Very low	160 Å²	160	131.6 Å²	131.6	86%	0.856	77%	0.767	S	S	*	*			trans	87.6	129.5	171.2	-43.5	-9.5	0	0	0	114.3
878	G	33.8	Very low	35.7	Very low	71 Å²	71	133.8 Å²	133.8	73%	0.732	77%	0.77	S	S	*	*			cis	179.4	-172.4	-5.7	0	0	0	0	0	112.9
879	I	37	Very low	36	Very low	168 Å²	168	132 Å²	132	86%	0.862	77%	0.768	S	S	*	*			trans	81.6	85	168.2	-49	178.8	0	0	0	117.8
880	S	36.5	Very low	36.3	Very low	96 Å²	96	133.4 Å²	133.4	67%	0.671	77%	0.773	S	S	*	*			trans	35.1	118.1	138	57.6	0	0	0	0	124.5
881	L	34.4	Very low	36.7	Very low	165 Å²	165	132.9 Å²	132.9	86%	0.864	78%	0.776	S	S	*	*				32.9	154.2	105.9	-70.9	161.3	0	0	0	121.4
882	P	38.2	Very low	37.2	Very low	117 Å²	117	132.4 Å²	132.4	76%	0.76	78%	0.778	S	S	*	*			cis	-134	-165.5	-9.3	39.3	-19.1	0	0	0	114.8
883	Q	35.8	Very low	37.5	Very low	180 Å²	180	130.9 Å²	130.9	84%	0.841	78%	0.777	S	S	*	*			trans	-91.2	-162.9	174.4	-56.7	-175.5	-67.5	0	0	113.3
884	P	47.3	Very low	37.9	Very low	115 Å²	115	135.4 Å²	135.4	75%	0.747	78%	0.784	S	S	*	*				-118.9	-178.8	-97.5	39.7	-22.1	0	0	0	113.6
885	P	44.8	Very low	38.5	Very low	124 Å²	124	132.7 Å²	132.7	81%	0.805	78%	0.779	S	S	*	*				-149	168.4	124	37.8	-22.4	0	0	0	115.9
886	T	40.2	Very low	39	Very low	135 Å²	135	131 Å²	131	83%	0.828	78%	0.78	S	S	*	*			trans	-104.1	153	165.6	49.9	0	0	0	0	111.5
887	P	43.9	Very low	39.4	Very low	110 Å²	110	129.7 Å²	129.7	71%	0.714	78%	0.78	S	S	*	*			trans	-148.6	134.6	134.7	34.7	-17.4	0	0	0	117.1
888	N	35.4	Very low	39.8	Very low	160 Å²	160	131.2 Å²	131.2	86%	0.856	78%	0.782	S	S	*	*				47.5	157.7	129.7	-62.1	-0.3	0	0	0	125.4
889	A	39.4	Very low	40.2	Very low	92 Å²	92	135.6 Å²	135.6	76%	0.76	79%	0.787	S	S	*	*			trans	98.6	136.1	154.7	0	0	0	0	0	118.5
890	T	38.3	Very low	40.5	Very low	127 Å²	127	131.7 Å²	131.7	78%	0.779	78%	0.781	S	S	*	*			cis	-164.5	153.9	-17.4	-78.2	0	0	0	0	108.1
891	V	41.2	Very low	40.4	Very low	125 Å²	125	132.3 Å²	132.3	76%	0.758	79%	0.785	S	S	*	*			trans	159.3	123.4	134	162.6	0	0	0	0	112.2
892	T	40.7	Very low	40.5	Very low	133 Å²	133	128.5 Å²	128.5	82%	0.816	78%	0.777	S	S	*	*			trans	-10.3	152	166.5	59.7	0	0	0	0	121.5
893	G	39	Very low	40.1	Very low	62 Å²	62	127.6 Å²	127.6	64%	0.639	78%	0.779	S	S	*	*			cis	161.7	-179.6	0.9	0	0	0	0	0	113.3
894	F	39.7	Very low	39.9	Very low	198 Å²	198	123 Å²	123	87%	0.868	77%	0.773	S	S	*	*			trans	67.8	154.1	-175.8	-59.1	-85.9	0	0	0	116.8
895	D	44.2	Very low	39.3	Very low	136 Å²	136	122.9 Å²	122.9	73%	0.727	77%	0.774	S	S	*	*				-172.4	165.1	-59.1	-84	-21.5	0	0	0	106.2
896	E	41.7	Very low	38.6	Very low	188 Å²	188	123.3 Å²	123.3	88%	0.879	77%	0.769	S	S	*	*			cis	-155.5	174	4.3	-141.6	-178	173.4	0	0	109.8
897	G	42.4	Very low	38.3	Very low	61 Å²	61	125 Å²	125	63%	0.629	77%	0.765	S	S	*	*			trans	85	108.1	165.9	0	0	0	0	0	116.4
898	E	41.8	Very low	37.7	Very low	192 Å²	192	124.5 Å²	124.5	90%	0.897	76%	0.764	S	S	*	*				63.8	136.4	68	-57.4	-157	130	0	0	113.7
899	I	42.8	Very low	37.7	Very low	163 Å²	163	125.5 Å²	125.5	84%	0.836	76%	0.764	S	S	*	*			cis	-134.8	152.9	33.6	-67.8	168.5	0	0	0	113.4
900	A	42.2	Very low	37.5	Very low	87 Å²	87	125.1 Å²	125.1	72%	0.719	76%	0.756	S	S	*	*			trans	-48.8	-175.5	173.3	0	0	0	0	0	117.7
901	S	35.9	Very low	37	Very low	109 Å²	109	126.2 Å²	126.2	76%	0.762	76%	0.757	S	S	*	*			cis	-162.4	163.3	13.2	-155.1	0	0	0	0	114
902	A	34.9	Very low	36.7	Very low	84 Å²	84	129 Å²	129	69%	0.694	76%	0.762	S	S	*	*			trans	49.9	133.3	151.8	0	0	0	0	0	120.3
903	A	30.3	Very low	36.2	Very low	98 Å²	98	127.2 Å²	127.2	81%	0.81	75%	0.754	S	S	*	*			cis	66.9	137.3	42.5	0	0	0	0	0	113.4
904	A	31.6	Very low	36	Very low	85 Å²	85	133.1 Å²	133.1	70%	0.702	77%	0.765	S	S	*	*			cis	-165.4	-167.9	-12.2	0	0	0	0	0	108.3
905	S	35.2	Very low	35.7	Very low	111 Å²	111	129.7 Å²	129.7	78%	0.776	76%	0.761	S	S	*	*			trans	76.1	156.6	160.7	-56.1	0	0	0	0	117.3
906	L	30.1	Very low	35.4	Very low	134 Å²	134	128.6 Å²	128.6	70%	0.702	76%	0.761	S	S	*	*			cis	-169.7	165.4	-29.6	-110.2	165.3	0	0	0	107.4
907	F	34.1	Very low	34.8	Very low	169 Å²	169	127.1 Å²	127.1	74%	0.741	76%	0.758	S	S	*	*			trans	66.9	137.3	176.7	-53.5	-74.7	0	0	0	114.7
908	S	31.3	Very low	34.4	Very low	100 Å²	100	130.3 Å²	130.3	70%	0.699	77%	0.765	S	S	*	*			cis	87.8	141.5	32	-55.6	0	0	0	0	114.7
909	Q	35.7	Very low	34.1	Very low	182 Å²	182	127 Å²	127	85%	0.85	76%	0.758	S	S	*	*			trans	82.8	151.1	-175.8	-57.4	172.7	89.9	0	0	115.7
910	S	34	Very low	33.7	Very low	84 Å²	84	124.7 Å²	124.7	59%	0.587	75%	0.747	S	S	*	*				176.6	134.1	-56.2	46.2	0	0	0	0	111.3
911	N	29.3	Very low	33.4	Very low	150 Å²	150	127.3 Å²	127.3	80%	0.802	75%	0.745	S	S	*	*			trans	65	162.4	157.6	-57.8	-11.1	0	0	0	119.3
912	Q	33.2	Very low	33.3	Very low	184 Å²	184	127.5 Å²	127.5	86%	0.86	74%	0.741	S	S	*	*			trans	76.4	140.6	164.8	-54.9	-171.4	100.3	0	0	116
913	S	31.3	Very low	33.1	Very low	94 Å²	94	129.6 Å²	129.6	66%	0.657	74%	0.741	S	S	*	*			cis	-169.6	-172.6	-12.6	42.7	0	0	0	0	110.9
914	E	35.3	Very low	33.2	Very low	187 Å²	187	130.1 Å²	130.1	87%	0.874	73%	0.734	S	S	*	*			trans	91.6	118	157.7	-48.5	-159.5	132.5	0	0	119.6
915	T	32.2	Very low	33.2	Very low	126 Å²	126	133.3 Å²	133.3	77%	0.773	74%	0.738	S	S	*	*			trans	-103.1	160.5	159.6	56.3	0	0	0	0	108.1
916	P	37.2	Very low	33.3	Very low	113 Å²	113	132.3 Å²	132.3	73%	0.734	73%	0.729	S	S	*	*				-145.9	138.3	105.8	25.7	-4.7	0	0	0	114.3
917	L	29.5	Very low	33.4	Very low	157 Å²	157	134.7 Å²	134.7	82%	0.822	73%	0.734	S	S	*	*				75.6	167.6	87.3	-61.3	174	0	0	0	116.5
918	V	35.2	Very low	33.1	Very low	127 Å²	127	135.2 Å²	135.2	77%	0.77	74%	0.735	S	S	*	*			trans	91.4	91.8	173.2	-174.8	0	0	0	0	113.9
919	V	35.6	Very low	32.9	Very low	122 Å²	122	141 Å²	141	74%	0.739	74%	0.742	S	S	*	*				89.3	134.8	86.8	152.2	0	0	0	0	111.3
920	D	34.4	Very low	32.6	Very low	115 Å²	115	139.9 Å²	139.9	62%	0.615	73%	0.734	S	S	*	*			cis	-153.7	160.3	29	-140.9	-8.8	0	0	0	118.6
921	Q	34.6	Very low	32.4	Very low	142 Å²	142	142.8 Å²	142.8	66%	0.664	74%	0.742	S	S	*	*			trans	33.9	123.5	145	-83.3	166.1	73	0	0	126.3
922	T	33.4	Very low	32.5	Very low	113 Å²	113	139.9 Å²	139.9	69%	0.693	73%	0.734	S	S	*	*				75.8	160.2	127.3	70.4	0	0	0	0	120.7
923	N	30.8	Very low	32.4	Very low	129 Å²	129	135.4 Å²	135.4	69%	0.69	72%	0.723	S	S	*	*			cis	-158	163.9	-7.3	-126	-30.4	0	0	0	112.4
924	T	34.1	Very low	32.4	Very low	109 Å²	109	137.5 Å²	137.5	67%	0.669	73%	0.727	S	S	*	*			trans	54.7	131.7	153	52.8	0	0	0	0	120.7
925	I	29.9	Very low	32.2	Very low	152 Å²	152	135.4 Å²	135.4	78%	0.779	72%	0.721	S	S	*	*			cis	73.2	128.7	27.4	-45.9	162.1	0	0	0	113.6
926	P	37.1	Very low	32.3	Very low	90 Å²	90	133.5 Å²	133.5	58%	0.584	71%	0.713	S	S	*	*			cis	-140.4	-136.4	-39.9	40.6	-17.7	0	0	0	110
927	K	32.4	Very low	32	Very low	184 Å²	184	134.3 Å²	134.3	80%	0.8	71%	0.711	S	S	*	*			trans	69.2	152.5	161.9	-74.4	148.8	-166.5	169.4	0	115.7
928	K	27.7	Very low	32.1	Very low	180 Å²	180	136.6 Å²	136.6	78%	0.783	71%	0.71	S	S	*	*			cis	169.5	167.9	-19.9	-125.8	-179.7	-178.7	177	0	103.5
929	R	28.5	Very low	31.8	Very low	221 Å²	221	139.5 Å²	139.5	83%	0.834	71%	0.707	S	S	*	*			trans	70.8	150.7	157.8	-83.2	174.2	176.4	167.4	-2.8	115.9
930	K	29.5	Very low	31.5	Very low	158 Å²	158	138.3 Å²	138.3	69%	0.687	70%	0.703	S	S	*	*			cis	-168.9	171.9	-13	-143.3	-177	169.8	-162.9	0	108.8
931	L	30	Very low	31.3	Very low	145 Å²	145	138.3 Å²	138.3	76%	0.759	70%	0.7	S	S	*	*			trans	68.7	154.6	154.2	-69.1	163	0	0	0	115.7
932	S	31.6	Very low	31	Very low	89 Å²	89	137.3 Å²	137.3	62%	0.622	70%	0.703	S	S	*	*			cis	-161.2	128.2	-8.9	42.7	0	0	0	0	107.9
933	S	30.6	Very low	31	Very low	90 Å²	90	140.3 Å²	140.3	63%	0.629	71%	0.707	S	S	*	*				103.1	160	90.6	63.8	0	0	0	0	112.8
934	N	30.9	Very low	30.8	Very low	139 Å²	139	142.4 Å²	142.4	74%	0.743	71%	0.712	S	S	*	*			trans	76	135.4	164.6	-55.4	-12.6	0	0	0	115.8
935	L	32.2	Very low	30.8	Very low	143 Å²	143	143.9 Å²	143.9	75%	0.749	72%	0.721	S	S	*	*			cis	-164.5	160.3	-16.2	-155.8	71.7	0	0	0	109.1
936	S	33.2	Very low	31	Very low	86 Å²	86	146.5 Å²	146.5	60%	0.601	72%	0.721	S	S	*	*			trans	55.8	145.4	148.1	56.4	0	0	0	0	121.1
937	D	31.7	Very low	30.9	Very low	130 Å²	130	148.2 Å²	148.2	70%	0.695	73%	0.725	S	S	*	*			cis	-167	177.5	-15.1	-97.8	-34.6	0	0	0	108.5
938	Y	31.8	Very low	31	Very low	205 Å²	205	146.1 Å²	146.1	80%	0.804	72%	0.723	S	S	*	*			trans	70.5	113.5	171.6	-62.5	-77.3	0	0	0	115.6
939	R	28.7	Very low	31.3	Very low	187 Å²	187	142.2 Å²	142.2	71%	0.706	72%	0.718	S	S	*	*			cis	65.1	123.7	33.1	-144.2	-171.7	169.9	138.8	8.4	110.4	E941	R939-E941 IonicContact CZ-OE1 3.68Å; R939-E941 IonicContact CZ-OE2 3.46Å; R939-E941 IonicContact NE-OE1 2.75Å; R939-E941 IonicContact NE-OE2 2.63Å; R939-E941 PolarHBondContact NE-OE2 2.78Å; R939-E941 VanDerWaalsContact NH2-CD 3.28Å; R939-E941 IonicContact NH2-OE1 2.65Å; R939-E941 PolarHBondContact NH2-OE1 3.18Å; R939-E941 IonicContact NH2-OE2 2.88Å; R939-E941 PolarHBondContact NH2-OE2 3.19Å; R939-E941 VanDerWaalsContact NH2-OE2 3.15Å
940	C	29.1	Very low	31.6	Very low	98 Å²	98	138.4 Å²	138.4	66%	0.662	71%	0.713	S	S	*	*				-148.1	140.6	56.9	-77.6	0	0	0	0	111.1
941	E	30.8	Very low	31.8	Very low	115 Å²	115	136.9 Å²	136.9	54%	0.537	71%	0.712	S	S	.	*				61.5	102.6	82.5	-67.4	172.5	128.4	0	0	112.4	R939	R939-E941 IonicContact CZ-OE1 3.68Å; R939-E941 IonicContact CZ-OE2 3.46Å; R939-E941 IonicContact NE-OE1 2.75Å; R939-E941 IonicContact NE-OE2 2.63Å; R939-E941 PolarHBondContact NE-OE2 2.78Å; R939-E941 VanDerWaalsContact NH2-CD 3.28Å; R939-E941 IonicContact NH2-OE1 2.65Å; R939-E941 PolarHBondContact NH2-OE1 3.18Å; R939-E941 IonicContact NH2-OE2 2.88Å; R939-E941 PolarHBondContact NH2-OE2 3.19Å; R939-E941 VanDerWaalsContact NH2-OE2 3.15Å
942	T	28.4	Very low	32.1	Very low	120 Å²	120	137.3 Å²	137.3	74%	0.736	71%	0.71	S	S	*	*				82.2	163.3	67.3	62.4	0	0	0	0	114.3
943	K	33.3	Very low	32.2	Very low	177 Å²	177	139.6 Å²	139.6	77%	0.77	72%	0.715	S	S	*	*			trans	85.7	118.2	-176.8	-58.6	175.8	-177.8	175.5	0	113.6
944	E	26.6	Very low	32.4	Very low	172 Å²	172	140.9 Å²	140.9	80%	0.804	72%	0.719	S	S	*	*				74.4	84.8	60.2	-68.4	-177.2	126.4	0	0	113.3
945	V	34.3	Very low	32.5	Very low	141 Å²	141	139.5 Å²	139.5	86%	0.855	72%	0.716	S	S	*	*			trans	-135.3	105.8	131	-176.4	0	0	0	0	104
946	R	32.1	Very low	32.4	Very low	207 Å²	207	143.8 Å²	143.8	78%	0.781	72%	0.723	S	S	*	*				70.9	133.8	73.7	-94.4	-163.6	-169.9	166.1	2.5	114.5
947	D	35.2	Very low	32.4	Very low	126 Å²	126	142.1 Å²	142.1	67%	0.674	72%	0.72	S	S	*	*			trans	68.4	137.2	150.4	-43.9	-17.7	0	0	0	116.3
948	D	34.3	Very low	32.5	Very low	140 Å²	140	142 Å²	142	75%	0.749	73%	0.729	S	S	*	*			cis	-157.3	160.1	1.9	-141.3	-26.4	0	0	0	112.3
949	S	34.9	Very low	32.4	Very low	97 Å²	97	142.3 Å²	142.3	68%	0.678	73%	0.729	S	S	*	*			trans	61.5	154.9	158.2	71.3	0	0	0	0	120.1
950	L	35.1	Very low	32.4	Very low	141 Å²	141	139.3 Å²	139.3	74%	0.738	73%	0.726	S	S	*	*			cis	-158.4	138.7	-21.4	-100.9	169	0	0	0	104.7
951	I	34.1	Very low	32.3	Very low	127 Å²	127	140.1 Å²	140.1	65%	0.651	73%	0.733	S	S	*	*				51.5	132.6	99.3	-75.7	-169.3	0	0	0	114.2
952	E	35.6	Very low	32.4	Very low	154 Å²	154	141.6 Å²	141.6	72%	0.72	74%	0.739	S	S	*	*			cis	-152.2	143.7	-6.9	-105	161.3	-170.7	0	0	105.5
953	D	32.7	Very low	32.5	Very low	136 Å²	136	143.2 Å²	143.2	73%	0.727	74%	0.743	S	S	*	*				79.8	150.3	66.6	-140.8	-7.8	0	0	0	115.1
954	T	35.6	Very low	32.5	Very low	117 Å²	117	139.2 Å²	139.2	72%	0.718	74%	0.743	S	S	*	*			trans	61.7	127.8	177	60.1	0	0	0	0	119
955	V	33.4	Very low	32.8	Very low	111 Å²	111	136.2 Å²	136.2	67%	0.673	74%	0.741	S	S	*	*			cis	82.6	106.2	33.3	-177	0	0	0	0	113.5
956	Y	30.7	Very low	32.8	Very low	232 Å²	232	135.9 Å²	135.9	91%	0.91	73%	0.734	S	S	*	*			trans	66.5	153.2	163.6	-73.6	-139.9	0	0	0	115.9
957	G	32.9	Very low	33	Very low	52 Å²	52	133.5 Å²	133.5	54%	0.536	73%	0.729	S	S	.	*			cis	154.6	141.7	-4.8	0	0	0	0	0	111.8
958	S	33.7	Very low	32.9	Very low	126 Å²	126	135.9 Å²	135.9	88%	0.881	73%	0.73	S	S	*	*			trans	63.2	160.5	-177.8	-45.6	0	0	0	0	115
959	R	28.2	Very low	33.2	Very low	213 Å²	213	135.7 Å²	135.7	80%	0.804	73%	0.728	S	S	*	*				174.5	144.1	106.1	-92.7	-169.1	172.9	-148.2	-2.6	112.8
960	L	29.6	Very low	33.3	Very low	124 Å²	124	136.2 Å²	136.2	65%	0.649	73%	0.731	S	S	*	*			trans	48.9	109.1	146.1	-83.9	55.5	0	0	0	118.9
961	S	27.4	Very low	33.3	Very low	115 Å²	115	135.9 Å²	135.9	80%	0.804	73%	0.73	S	S	*	*	S	Bend		-74	98.2	115.2	49.4	0	0	0	0	109
962	H	32.4	Very low	33.3	Very low	145 Å²	145	135.5 Å²	135.5	67%	0.671	73%	0.73	S	S	*	*	S	Bend	trans	176.5	105.6	141	-101.7	-75.7	0	0	0	112
963	L	30.7	Very low	33.2	Very low	155 Å²	155	138.4 Å²	138.4	81%	0.812	73%	0.734	S	S	*	*			trans	66	97.8	146.7	-57.6	168.4	0	0	0	120.3
964	A	32.2	Very low	33.3	Very low	92 Å²	92	137.3 Å²	137.3	76%	0.76	74%	0.737	S	S	*	*				57.6	110.6	129.7	0	0	0	0	0	121.6
965	S	33.7	Very low	33.2	Very low	109 Å²	109	136.6 Å²	136.6	76%	0.762	74%	0.737	S	S	*	*				174.9	140.2	97.7	-74.9	0	0	0	0	113.8
966	N	33.2	Very low	33.3	Very low	134 Å²	134	138 Å²	138	72%	0.717	74%	0.738	S	S	*	*			trans	49.1	117.3	160.6	-65.7	-29.8	0	0	0	120
967	K	36.8	Very low	33.4	Very low	157 Å²	157	136.5 Å²	136.5	68%	0.683	73%	0.731	S	S	*	*				67.2	134	74.5	-67	-171.1	179.3	-173.4	0	113.2
968	Y	34.6	Very low	33.5	Very low	176 Å²	176	140 Å²	140	69%	0.69	74%	0.737	S	S	*	*			cis	-166	152.6	10	-116.8	-174.5	0	0	0	111.7
969	I	39.4	Very low	33.5	Very low	136 Å²	136	144.9 Å²	144.9	70%	0.697	74%	0.738	S	S	*	*				46.6	139.5	128.7	-58	179.1	0	0	0	118.8
970	S	37.9	Very low	33.8	Very low	108 Å²	108	138 Å²	138	76%	0.755	73%	0.733	S	S	*	*			cis	-164.7	-176.2	19.6	28.8	0	0	0	0	110.4
971	N	35.4	Very low	34.4	Very low	134 Å²	134	138 Å²	138	72%	0.717	74%	0.741	S	S	*	*			cis	150.1	147.8	-30.7	-167.9	9.7	0	0	0	110.9
972	N	33.3	Very low	34.7	Very low	120 Å²	120	138.7 Å²	138.7	64%	0.642	74%	0.74	S	S	*	*			trans	74.2	155.5	172.7	-61.8	-65.6	0	0	0	117.5
973	R	33.3	Very low	34.6	Very low	214 Å²	214	139 Å²	139	81%	0.808	75%	0.746	S	S	*	*			cis	-166.4	161.4	0.2	-126.4	172.4	-173	-169.5	0.3	113.3
974	S	35	Very low	34.6	Very low	113 Å²	113	139.7 Å²	139.7	79%	0.79	75%	0.749	S	S	*	*			trans	62.9	156.6	151.6	46.8	0	0	0	0	120.9
975	S	34.3	Very low	34.6	Very low	102 Å²	102	140.5 Å²	140.5	71%	0.713	75%	0.749	S	S	*	*			cis	-173.7	165.3	-21.4	-174.9	0	0	0	0	110.8
976	M	33.7	Very low	34.5	Very low	142 Å²	142	138 Å²	138	70%	0.7	74%	0.741	S	S	*	*			trans	74.4	147.9	165.6	-50.9	-163.6	80.8	0	0	118.4
977	R	34	Very low	34.4	Very low	199 Å²	199	142.7 Å²	142.7	75%	0.751	75%	0.75	S	S	*	*			cis	-166	156.4	-28.2	-121.7	-168.1	-155.7	169.4	5.6	110.6
978	N	34.9	Very low	34.2	Very low	127 Å²	127	140.7 Å²	140.7	68%	0.679	76%	0.756	S	S	*	*			trans	67.3	143.3	164.6	-47.9	-12.6	0	0	0	116.3
979	Y	34.2	Very low	34.4	Very low	227 Å²	227	140.8 Å²	140.8	89%	0.89	76%	0.763	S	S	*	*			cis	-114.9	160.1	-6.7	-85	-97.6	0	0	0	110.6
980	G	34.1	Very low	34.1	Very low	69 Å²	69	138.4 Å²	138.4	71%	0.711	77%	0.772	S	S	*	*			trans	-122.1	-129.4	-174.5	0	0	0	0	0	114.9
981	P	41.1	Very low	34.2	Very low	123 Å²	123	140.3 Å²	140.3	80%	0.799	77%	0.772	S	S	*	*				-124.1	-159.7	-96.4	37.8	-24.6	0	0	0	112.5
982	V	34.1	Very low	34.6	Very low	131 Å²	131	138.8 Å²	138.8	79%	0.794	76%	0.764	S	S	*	*				-163.8	147.7	82.2	157.4	0	0	0	0	110.3
983	L	30	Very low	35.3	Very low	151 Å²	151	139.1 Å²	139.1	79%	0.791	76%	0.764	S	S	*	*			trans	-96	165	175.5	-61.9	163.1	0	0	0	111.3
984	L	32.4	Very low	35.8	Very low	169 Å²	169	135 Å²	135	89%	0.885	76%	0.758	S	S	*	*				179.6	153.9	119.6	-96.8	160.9	0	0	0	114
985	S	32.1	Very low	36.5	Very low	109 Å²	109	132.4 Å²	132.4	76%	0.762	74%	0.744	S	S	*	*			trans	7.3	133.1	164.1	-145	0	0	0	0	119.7
986	G	29.9	Very low	37	Very low	58 Å²	58	135.2 Å²	135.2	60%	0.598	74%	0.743	S	S	*	*			cis	110.1	110.3	8	0	0	0	0	0	112.5
987	Y	31.1	Very low	37.8	Very low	231 Å²	231	134.8 Å²	134.8	91%	0.906	74%	0.743	S	S	*	*			trans	-164	120	151.8	-116	-74.6	0	0	0	108.1
988	S	32.5	Very low	38.7	Very low	115 Å²	115	129.3 Å²	129.3	80%	0.804	74%	0.74	S	S	*	*			trans	-123.9	112.3	-178.5	56.7	0	0	0	0	110.6
989	Q	39.2	Very low	39.2	Very low	179 Å²	179	134.6 Å²	134.6	84%	0.836	76%	0.761	S	S	*	*			trans	-128.8	102.2	163.5	-95	177.8	-32	0	0	108.3	I991	Q989-I991 PolarHBondContact O-N 2.98Å
990	G	33.6	Very low	39.4	Very low	85 Å²	85	130 Å²	130	88%	0.876	75%	0.754	S	S	*	*	P	Polyproline II helix	trans	-71.1	122.7	165.2	0	0	0	0	0	108.4
991	I	39.5	Very low	39.7	Very low	148 Å²	148	133.2 Å²	133.2	76%	0.759	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-83.1	128	171.4	-63.3	176.4	0	0	0	107.4	Q989 I993	Q989-I991 PolarHBondContact O-N 2.98Å; I991-I993 PolarHBondContact O-N 3.25Å
992	D	43.4	Very low	39.6	Very low	103 Å²	103	133.8 Å²	133.8	55%	0.551	75%	0.754	S	S	*	*	P	Polyproline II helix	trans	-64.7	120.3	176.5	-170.2	-20.6	0	0	0	110.1	D994 A995 F996	D992-D994 VanDerWaalsContact C-N 3.34Å; D992-D994 PolarHBondContact OD1-N 3.12Å; D992-A995 HydrophobicContact CB-CB 4.02Å; D992-A995 PolarHBondContact O-N 2.93Å; D992-F996 PolarHBondContact O-N 3.32Å
993	I	47.9	Very low	39.9	Very low	126 Å²	126	133.9 Å²	133.9	65%	0.646	75%	0.752	S	S	*	*	H	α-helix	trans	-71.8	-32.4	-175.4	-66.5	175.2	0	0	0	110.7	I991 A995 F996 L997	I991-I993 PolarHBondContact O-N 3.25Å; I993-A995 VanDerWaalsContact C-N 3.33Å; I993-F996 PolarHBondContact O-N 3.37Å; I993-L997 HydrophobicContact CG2-CD1 4.37Å; I993-L997 PolarHBondContact O-N 2.69Å
994	D	44.2	Very low	40.5	Very low	128 Å²	128	132.9 Å²	132.9	68%	0.684	75%	0.749	S	S	*	*	H	α-helix	trans	-75.8	-26	-178.9	-68.2	-33	0	0	0	111.4	D992	D992-D994 VanDerWaalsContact C-N 3.34Å; D992-D994 PolarHBondContact OD1-N 3.12Å
995	A	50.2	Low	41.1	Very low	58 Å²	58	130.5 Å²	130.5	48%	0.479	74%	0.74	S	S	.	*	H	α-helix	trans	-69.6	-32.6	169.9	0	0	0	0	0	113	D992 I993 L997	D992-A995 HydrophobicContact CB-CB 4.02Å; D992-A995 PolarHBondContact O-N 2.93Å; I993-A995 VanDerWaalsContact C-N 3.33Å; A995-L997 VanDerWaalsContact C-N 3.33Å
996	F	44.3	Very low	41.7	Very low	162 Å²	162	132 Å²	132	71%	0.711	74%	0.739	S	S	*	*	H	α-helix	trans	-75.9	-19.7	177.9	-172	-97.8	0	0	0	113.2	D992 I993	D992-F996 PolarHBondContact O-N 3.32Å; I993-F996 PolarHBondContact O-N 3.37Å
997	L	50.9	Low	42.6	Very low	133 Å²	133	137.7 Å²	137.7	70%	0.696	75%	0.749	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.8	1.4	177.6	-67.3	173.2	0	0	0	113.8	I993 A995	I993-L997 HydrophobicContact CG2-CD1 4.37Å; I993-L997 PolarHBondContact O-N 2.69Å; A995-L997 VanDerWaalsContact C-N 3.33Å
998	A	53.9	Low	43.6	Very low	83 Å²	83	129.9 Å²	129.9	69%	0.686	74%	0.736	S	S	*	*			trans	-103.5	3.2	-178.3	0	0	0	0	0	114.5
999	H	43.6	Very low	44.6	Very low	239 Å²	239	131.3 Å²	131.3	100%	1.106	73%	0.73	S	S	*	*			trans	-128.3	0	-172.7	-112.1	-55.6	0	0	0	113.7

Retrieved 999 of 999 residues in 396.6 ms (Link to these results)

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