A0A077Z6S4_TRITR Loading...

Cullin Nedd8 and Glyco transf 25 and Pkinase and Anp1 and Cullin domain containing protein

AlphaFold DB , UniProt , Accession A0A077Z6S4, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 1,700 aa.

						>A0A077Z6S4_TRITR|A0A077Z6S4
MMVGSGERRMLSETVATSERHSITVDELWSDLKLGLMQIYSREPMSCRRYMSIYTNVYTYCTTQYTPSQMTPIRSRRQSKAVVDKDKENSTLSSQFVGFELYYRMQRSNSVAFYSIPVFQFAHDMLDEDLVHFFTVEWTKYRFSSKIIDGLCSYLNRHWIRRIMDEGNDTILEVYHLALHTWETKFLKVIHHQITRAVLKLISSDRRGEAVNTRLISDVISCYIELSGISAGPGLCYDPKEEGMRLYIENFENAFLAETEAFYTYEAEEVLRNNPVTEYLKRVELRLNEEQRRCSMYLCSSTLVKLDQVLVDIFIGRRMDMLKSEFQSLLSSDRCSDLKRMYELCSMVEKGLCDLKDCLEEHVLAQGLAAIEKAGDAVSTDPKLYVTTLLNVYNKRSIVVKGHSFVLNVASFSACSKFMNCNKATQGFKSNSRSPELLARYCDLLMRKSTKSPEEADIEAMLSDVMIIFKYMEDKDVFETFYNKLLAKRLVGQLSASEDAESAMISKLKQTCGFDYTIKLQRMFNDVRVSKSLCEEYKQVMDKSVCKNAAFHFFLFKKFKFSNGHFAAIDFSVLVLSSGAWPLSATATVNLQSQIAKSMQAFSDYYVNRHNGRKISWLHNYSKVEVLAHCFDRKYCLVMTLFQASILQQFNHADSYTVEQLQRITLLPIEILQQVLWQLIKFKIVDAVKTDGDGQTSFRECGDSNETTLTSSVSIHLCPFRSKKLKLDFSKIPLKTESQRDQETAEKNLTEDRRILVQACVVRIMKMRKRLTHPQLLSEVIAQLSSLFHPHVSIIKVCAIEIFFEKELQKRLLFYMGIDFFVALHLFEIFGLTAVAALGTSWKWKAHAGHQPPTVLLCLLVRNKAHVLPYFFGYLEELDYPKDRIAIFVRIDRSVDESLELVTAWSKAVDGLYHSIELSQSDVAAGNFYAGERGPFDCTEERYHQLSEWKQYALTKARRMWADFIFYLDCDVLLFNQKTLQQLMAEGVIVVAPMLVSLSAYSNFWAAIDENGFYQHSDDYDAIYGREKVGCFPVPMVHSAVLIDLRMAKSLRITFANGAQQRHRDELHALADSVKSAHLPMYVSNRYKFGAILIPPKPSAQLEEGFENLRDLIVEALHSGPPGLLSSPFLPVAKRFPKDRLGFDRLFLINLERRADRKARMEACFDALDLEVDHVKAVDGASLTDDQLRSLGVQQISEYRDPYHKRPMTTGEVGCFLSHYGIWKRVVDEQLQRVIVFEDDLRFRSHFRQWVLALAEELTNYVPDWDLVYLGRKQLNKDEQESLVDNCTMVGRVGYSYWTLAYMLTLRGAEKLLAAEPLGRLVPVDEFLPIMFDQHPVDAWKNHFVKRDLNAYTSVPLLVYPVLQLICPNPNSGYGAISLIRWQETATIFGKERPPKPQKDATNSDNSTDEHERSSGRLYALKRVVCHSKADEALVQNEIHVHEMGAGNVNLLPCEGYSVRPVTDYEQLVSYNNEPGGYTVPMESTTLTEYNILLPYYKRGTIQEELRWRLSSGDFINEKRVCKLFRDICHGLSGLHNLQPEPFVHGDLKTGNVLLSDEDDRAVLMDFGSSRPARIEIASEHQAHNLQDLAAERCTMYYRAPELFAPQVGDKLDERTDIWSLGCLLYALCFWVSPFEQAVLRGDSLPLMHLSLKQVIPIHSPYSKEMHDLIMCMLQPDRQSRPFLPSVLEKLDKMEKSAAN
					

Structure Viewer

Loading PAE data...

(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	34	Very low	33	Very low	246 Å²	246	163.4 Å²	163.4	100%	1.212	86%	0.859	S	S	*	*				0	137.6	0	-76.4	171.3	170.2	0	0	107.4
2	M	28.6	Very low	33	Very low	184 Å²	184	158.8 Å²	158.8	91%	0.906	85%	0.85	S	S	*	*			trans	-72.2	160	168.9	-55.9	175.8	-168.6	0	0	109.9
3	V	36.1	Very low	33	Very low	140 Å²	140	160 Å²	160	85%	0.848	85%	0.848	S	S	*	*			trans	157.9	121.2	134	160.3	0	0	0	0	107.5
4	G	30.5	Very low	33.1	Very low	60 Å²	60	157.8 Å²	157.8	62%	0.619	84%	0.844	S	S	*	*			trans	-103.8	166.8	166.7	0	0	0	0	0	111.3
5	S	31.1	Very low	33.2	Very low	136 Å²	136	157.5 Å²	157.5	95%	0.951	85%	0.85	S	S	*	*	S	Bend	trans	38.4	95.7	154.6	57.8	0	0	0	0	118.7
6	G	31.6	Very low	33	Very low	68 Å²	68	152.9 Å²	152.9	70%	0.701	84%	0.839	S	S	*	*			trans	144.4	134.7	172.5	0	0	0	0	0	109.1
7	E	33.6	Very low	32.8	Very low	161 Å²	161	152.2 Å²	152.2	75%	0.752	84%	0.841	S	S	*	*			cis	-142	134.1	6	-62.1	160.1	115.4	0	0	108.7	R9	E7-R9 PolarHBondContact O-N 3.05Å
8	R	35.3	Very low	32.9	Very low	261 Å²	261	150.3 Å²	150.3	99%	0.985	84%	0.84	S	S	*	*	S	Bend	trans	-94.7	24.8	179.4	-116.9	-172.8	-163.4	-171.6	7.5	113.9
9	R	35.2	Very low	33	Very low	214 Å²	214	151.2 Å²	151.2	81%	0.808	84%	0.837	S	S	*	*	S	Bend	trans	-128.6	12.3	-164.1	-105.2	-176.1	-177.2	172.9	3.3	117.7	E7	E7-R9 PolarHBondContact O-N 3.05Å
10	M	33.9	Very low	33.3	Very low	151 Å²	151	156.3 Å²	156.3	74%	0.744	84%	0.843	S	S	*	*	S	Bend	trans	-122.4	14.8	-176.1	-83.5	-159.2	174.9	0	0	116.9
11	L	32.9	Very low	34.3	Very low	176 Å²	176	156.4 Å²	156.4	92%	0.921	84%	0.838	S	S	*	*	S	Bend	trans	-120.2	20.8	-174.8	-71.7	173.5	0	0	0	115.6
12	S	33.4	Very low	35.5	Very low	108 Å²	108	148.7 Å²	148.7	76%	0.755	81%	0.808	S	S	*	*	S	Bend	trans	-101.5	-3.3	179.2	52.3	0	0	0	0	115.7
13	E	32.9	Very low	37.4	Very low	175 Å²	175	141.3 Å²	141.3	82%	0.818	77%	0.772	S	S	*	*	S	Bend	trans	-138.5	52.1	-168	-63.3	-171.6	152.9	0	0	114.5
14	T	34.7	Very low	39.4	Very low	129 Å²	129	137.9 Å²	137.9	79%	0.791	75%	0.752	S	S	*	*			trans	-157.6	16.9	171.8	-9.2	0	0	0	0	119
15	V	34.7	Very low	41.6	Very low	154 Å²	154	136.3 Å²	136.3	93%	0.933	73%	0.73	S	S	*	*			trans	-119.9	70.4	176.4	-167.1	0	0	0	0	111.9
16	A	30.1	Very low	44	Very low	83 Å²	83	134.5 Å²	134.5	69%	0.686	71%	0.71	S	S	*	*			trans	-101.4	133.7	158	0	0	0	0	0	109.3
17	T	29.8	Very low	46.3	Very low	142 Å²	142	136.5 Å²	136.5	87%	0.871	70%	0.701	S	S	*	*			trans	54	86.7	160.9	59.9	0	0	0	0	118.8
18	S	34.2	Very low	48.8	Very low	118 Å²	118	128.9 Å²	128.9	83%	0.825	67%	0.665	S	S	*	*			trans	-154.5	151.8	142.9	67.5	0	0	0	0	111.7
19	E	35.1	Very low	51.2	Low	167 Å²	167	118 Å²	118	78%	0.78	62%	0.624	S	S	*	*			trans	-73.3	131	-167.1	-60.7	169.8	146.2	0	0	113.2	H21	E19-H21 PolarHBondContact O-N 2.98Å
20	R	38.1	Very low	53.5	Low	253 Å²	253	111.2 Å²	111.2	96%	0.955	61%	0.61	S	S	*	*			trans	-70.9	99	176	-71	-176.3	179.9	176.8	-0.4	111.3
21	H	54.9	Low	56	Low	158 Å²	158	105.6 Å²	105.6	73%	0.731	58%	0.583	S	S	*	*			trans	-76.1	129.8	165.4	-77.6	43.5	0	0	0	110.4	E19	E19-H21 PolarHBondContact O-N 2.98Å
22	S	58.5	Low	58.6	Low	84 Å²	84	97.2 Å²	97.2	59%	0.587	54%	0.539	S	S	*	.			trans	-85.8	114.9	176.1	55.6	0	0	0	0	110.9
23	I	69.9	Low	61	Low	30 Å²	30	96.9 Å²	96.9	15%	0.154	52%	0.524	C	S	.	.			trans	-72.7	136.6	174.2	-163.4	170	0	0	0	111	E27 L28 N56 Y60 Y65	I23-E27 HydrophobicContact CD1-CB 4.43Å; I23-E27 HydrophobicContact CG1-CB 3.9Å; I23-L28 HydrophobicContact CD1-CB 4.08Å; I23-L28 HydrophobicContact CG1-CB 4.39Å; I23-N56 HydrophobicContact CD1-CB 4.06Å; I23-Y60 HydrophobicContact CG2-CD2 4.5Å; I23-Y65 PolarHBondContact O-OH 3.28Å; I23-Y65 VanDerWaalsContact O-OH 3.14Å
24	T	77.1	Confident	63.5	Low	68 Å²	68	93.3 Å²	93.3	42%	0.417	51%	0.51	S	S	.	.			trans	-82.8	159.2	172.9	66.3	0	0	0	0	111.4	D26 E27 L28	T24-D26 PolarHBondContact O-N 2.72Å; T24-E27 WeakPolarHBondContact CB-OE2 3.35Å; T24-E27 WeakPolarHBondContact CG2-OE2 3.29Å; T24-E27 PolarHBondContact N-OE2 3.34Å; T24-E27 PolarHBondContact O-N 3.27Å; T24-E27 VanDerWaalsContact OG1-CG 3.24Å; T24-E27 WeakPolarHBondContact OG1-CG 3.34Å; T24-E27 PolarHBondContact OG1-N 3.03Å; T24-E27 PolarHBondContact OG1-OE2 3.49Å; T24-L28 PolarHBondContact O-N 2.69Å
25	V	76.7	Confident	65.9	Low	27 Å²	27	87.2 Å²	87.2	16%	0.164	47%	0.472	C	S	.	.	H	α-helix	trans	-65	-28	178.4	71.4	0	0	0	0	112.7	W29 Y60 E100	V25-W29 WeakPolarHBondContact O-CB 3.48Å; V25-W29 PolarHBondContact O-N 2.91Å; V25-Y60 HydrophobicContact CB-CE2 3.74Å; V25-Y60 WeakPolarHBondContact CB-OH 3.17Å; V25-Y60 HydrophobicContact CG2-CE1 4.31Å; V25-Y60 HydrophobicContact CG2-CE2 4.12Å; V25-Y60 WeakPolarHBondContact CG2-OH 3.41Å; V25-E100 HydrophobicContact CG1-CG 4.44Å; V25-E100 HydrophobicContact CG2-CG 3.82Å
26	D	80.7	Confident	68.3	Low	98 Å²	98	80 Å²	80	52%	0.524	43%	0.428	S	S	.	.	H	α-helix	trans	-75.7	-39.4	178.8	-66	-43.4	0	0	0	111.9	T24 S30 R104	T24-D26 PolarHBondContact O-N 2.72Å; D26-S30 WeakPolarHBondContact O-CB 3.44Å; D26-S30 PolarHBondContact O-N 3.05Å; D26-R104 IonicContact OD1-CZ 2.78Å; D26-R104 IonicContact OD1-NH1 3.49Å; D26-R104 PolarHBondContact OD1-NH1 3.21Å; D26-R104 IonicContact OD1-NH2 3.28Å; D26-R104 PolarHBondContact OD1-NH2 3.25Å
27	E	81.2	Confident	70.8	Confident	109 Å²	109	79.6 Å²	79.6	51%	0.509	41%	0.413	S	S	.	.	H	α-helix	trans	-64.2	-49.5	172.2	-70.2	162.1	142.7	0	0	111.4	I23 T24 W29 S30 D31	I23-E27 HydrophobicContact CD1-CB 4.43Å; I23-E27 HydrophobicContact CG1-CB 3.9Å; T24-E27 WeakPolarHBondContact CB-OE2 3.35Å; T24-E27 WeakPolarHBondContact CG2-OE2 3.29Å; T24-E27 PolarHBondContact N-OE2 3.34Å; T24-E27 PolarHBondContact O-N 3.27Å; T24-E27 VanDerWaalsContact OG1-CG 3.24Å; T24-E27 WeakPolarHBondContact OG1-CG 3.34Å; T24-E27 PolarHBondContact OG1-N 3.03Å; T24-E27 PolarHBondContact OG1-OE2 3.49Å; E27-W29 VanDerWaalsContact C-N 3.33Å; E27-W29 PolarHBondContact O-N 2.85Å; E27-S30 PolarHBondContact O-N 2.66Å; E27-D31 PolarHBondContact O-N 3.14Å; E27-D31 VanDerWaalsContact O-N 3.08Å
28	L	84.8	Confident	73.5	Confident	1 Å²	1	74.7 Å²	74.7	1%	0.005	38%	0.381	C	S	.	.	H	α-helix	trans	-57.4	-47	175.4	172.1	64.8	0	0	0	111.2	I23 T24 D31 L32 N56 V57 Y60 L101	I23-L28 HydrophobicContact CD1-CB 4.08Å; I23-L28 HydrophobicContact CG1-CB 4.39Å; T24-L28 PolarHBondContact O-N 2.69Å; L28-D31 PolarHBondContact O-N 2.84Å; L28-L32 VanDerWaalsContact O-CB 3.23Å; L28-L32 WeakPolarHBondContact O-CB 3.2Å; L28-L32 PolarHBondContact O-N 2.7Å; L28-N56 HydrophobicContact CD1-CB 3.68Å; L28-V57 HydrophobicContact CD1-CG2 4.01Å; L28-Y60 HydrophobicContact CD2-CD1 3.64Å; L28-Y60 HydrophobicContact CD2-CD2 4.17Å; L28-Y60 HydrophobicContact CD2-CE1 4.4Å; L28-Y60 HydrophobicContact CD2-CG 3.51Å; L28-L101 HydrophobicContact CD2-CD1 3.93Å; L28-L101 HydrophobicContact CD2-CD2 3.96Å; L28-L101 HydrophobicContact CG-CD1 4.38Å
29	W	86	Confident	75.9	Confident	32 Å²	32	69.6 Å²	69.6	12%	0.121	34%	0.344	C	S	.	.	H	α-helix	trans	-66.6	-38	-177.1	-179.9	-112.4	0	0	0	112.4	V25 E27 L32 K33 L36 L101 R104 M105 S108 S110	V25-W29 WeakPolarHBondContact O-CB 3.48Å; V25-W29 PolarHBondContact O-N 2.91Å; E27-W29 VanDerWaalsContact C-N 3.33Å; E27-W29 PolarHBondContact O-N 2.85Å; W29-L32 HydrophobicContact CE3-CD2 4.19Å; W29-L32 HydrophobicContact CZ3-CD2 4.07Å; W29-K33 HydrophobicContact CZ2-CB 4.43Å; W29-K33 WeakPolarHBondContact O-CB 3.39Å; W29-K33 PolarHBondContact O-N 3.09Å; W29-L36 HydrophobicContact CH2-CD1 4.24Å; W29-L101 HydrophobicContact CE3-CD1 4.25Å; W29-R104 HydrophobicContact CD2-CB 3.89Å; W29-R104 HydrophobicContact CD2-CG 4.47Å; W29-R104 HydrophobicContact CE3-CB 3.82Å; W29-R104 HydrophobicContact CH2-CB 4.35Å; W29-R104 HydrophobicContact CZ2-CB 4.39Å; W29-R104 HydrophobicContact CZ3-CB 4.05Å; W29-M105 HydrophobicContact CH2-CG 4.26Å; W29-M105 HydrophobicContact CZ3-CG 3.71Å; W29-S108 WeakPolarHBondContact CH2-OG 3.2Å; W29-S108 WeakPolarHBondContact CZ2-OG 3.5Å; W29-S110 WeakPolarHBondContact CH2-OG 3.37Å; W29-S110 WeakPolarHBondContact CZ2-OG 3.27Å
30	S	84.7	Confident	78.2	Confident	73 Å²	73	62.1 Å²	62.1	51%	0.51	31%	0.309	S	S	.	.	H	α-helix	trans	-60.5	-46.4	173.7	-169.4	0	0	0	0	111.5	D26 E27 L34	D26-S30 WeakPolarHBondContact O-CB 3.44Å; D26-S30 PolarHBondContact O-N 3.05Å; E27-S30 PolarHBondContact O-N 2.66Å; S30-L34 PolarHBondContact O-N 3.27Å
31	D	86.5	Confident	80.3	Confident	33 Å²	33	52.9 Å²	52.9	18%	0.176	28%	0.283	C	S	.	.	H	α-helix	trans	-68.9	-44.8	-178.9	-161.1	47	0	0	0	112.6	E27 L28 L34 G35 R49 N56	E27-D31 PolarHBondContact O-N 3.14Å; E27-D31 VanDerWaalsContact O-N 3.08Å; L28-D31 PolarHBondContact O-N 2.84Å; D31-L34 PolarHBondContact O-N 3.05Å; D31-G35 PolarHBondContact O-N 3.46Å; D31-G35 VanDerWaalsContact O-N 3.13Å; D31-R49 VanDerWaalsContact CG-NH1 3.29Å; D31-R49 IonicContact OD1-CZ 2.8Å; D31-R49 IonicContact OD1-NH1 2.75Å; D31-R49 PolarHBondContact OD1-NH1 2.84Å; D31-R49 IonicContact OD1-NH2 3.41Å; D31-R49 PolarHBondContact OD1-NH2 2.67Å; D31-R49 IonicContact OD2-CZ 2.82Å; D31-R49 IonicContact OD2-NH1 2.74Å; D31-R49 PolarHBondContact OD2-NH1 2.94Å; D31-R49 VanDerWaalsContact OD2-NH1 3.14Å; D31-R49 IonicContact OD2-NH2 3.5Å; D31-N56 PolarHBondContact OD2-ND2 3.15Å
32	L	86.3	Confident	81.5	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-63.2	-43.6	176.7	-179.3	62	0	0	0	111.2	L28 W29 L34 G35 L36 I53 L101 M105	L28-L32 VanDerWaalsContact O-CB 3.23Å; L28-L32 WeakPolarHBondContact O-CB 3.2Å; L28-L32 PolarHBondContact O-N 2.7Å; W29-L32 HydrophobicContact CE3-CD2 4.19Å; W29-L32 HydrophobicContact CZ3-CD2 4.07Å; L32-L34 VanDerWaalsContact C-N 3.33Å; L32-L34 PolarHBondContact O-N 2.74Å; L32-G35 CarbonylContact O-C 3.52Å; L32-G35 WeakPolarHBondContact O-CA 3.45Å; L32-G35 PolarHBondContact O-N 3.07Å; L32-L36 HydrophobicContact CD1-CG 4.46Å; L32-L36 HydrophobicContact CG-CD1 4.37Å; L32-L36 HydrophobicContact CG-CG 4.37Å; L32-L36 WeakPolarHBondContact O-CG 3.4Å; L32-L36 PolarHBondContact O-N 3.41Å; L32-I53 HydrophobicContact CD1-CG2 3.67Å; L32-L101 HydrophobicContact CD2-CD1 3.93Å; L32-M105 HydrophobicContact CD2-SD 4.44Å
33	K	84.5	Confident	82.7	Confident	100 Å²	100	53.5 Å²	53.5	44%	0.435	27%	0.271	S	S	.	.	H	α-helix	trans	-59.6	-42.1	178.8	-176.3	-176.5	177.6	-171.3	0	112.1	W29 G35 L36 M37	W29-K33 HydrophobicContact CZ2-CB 4.43Å; W29-K33 WeakPolarHBondContact O-CB 3.39Å; W29-K33 PolarHBondContact O-N 3.09Å; K33-G35 VanDerWaalsContact C-N 3.33Å; K33-L36 PolarHBondContact O-N 3.27Å; K33-M37 WeakPolarHBondContact O-CG 3.47Å; K33-M37 PolarHBondContact O-N 3.2Å
34	L	84.8	Confident	83.2	Confident	101 Å²	101	58 Å²	58	53%	0.529	30%	0.302	S	S	.	.	H	α-helix	trans	-62.9	-40.8	173.7	-70.4	170.5	0	0	0	111.5	S30 D31 L32 M37 Q38	S30-L34 PolarHBondContact O-N 3.27Å; D31-L34 PolarHBondContact O-N 3.05Å; L32-L34 VanDerWaalsContact C-N 3.33Å; L32-L34 PolarHBondContact O-N 2.74Å; L34-M37 PolarHBondContact O-N 3.08Å; L34-Q38 WeakPolarHBondContact O-CB 3.43Å; L34-Q38 PolarHBondContact O-N 3.03Å
35	G	85.1	Confident	83.5	Confident	0 Å²	0	57 Å²	57	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-61.5	-43.5	173.3	0	0	0	0	0	113.8	D31 L32 K33 Q38 I39	D31-G35 PolarHBondContact O-N 3.46Å; D31-G35 VanDerWaalsContact O-N 3.13Å; L32-G35 CarbonylContact O-C 3.52Å; L32-G35 WeakPolarHBondContact O-CA 3.45Å; L32-G35 PolarHBondContact O-N 3.07Å; K33-G35 VanDerWaalsContact C-N 3.33Å; G35-Q38 PolarHBondContact O-N 2.84Å; G35-I39 WeakPolarHBondContact O-CD1 3.04Å; G35-I39 VanDerWaalsContact O-CG1 3.28Å; G35-I39 WeakPolarHBondContact O-CG1 3.31Å; G35-I39 PolarHBondContact O-N 2.92Å
36	L	84.8	Confident	83.9	Confident	2 Å²	2	59.1 Å²	59.1	1%	0.01	31%	0.309	C	S	.	.	H	α-helix	trans	-60.5	-44.5	175.6	-67.1	175.7	0	0	0	111.3	W29 L32 K33 I39 Y40 I148	W29-L36 HydrophobicContact CH2-CD1 4.24Å; L32-L36 HydrophobicContact CD1-CG 4.46Å; L32-L36 HydrophobicContact CG-CD1 4.37Å; L32-L36 HydrophobicContact CG-CG 4.37Å; L32-L36 WeakPolarHBondContact O-CG 3.4Å; L32-L36 PolarHBondContact O-N 3.41Å; K33-L36 PolarHBondContact O-N 3.27Å; L36-I39 PolarHBondContact O-N 3.03Å; L36-Y40 WeakPolarHBondContact O-CD2 3.28Å; L36-Y40 PolarHBondContact O-N 3.02Å; L36-Y40 VanDerWaalsContact O-N 3.07Å; L36-I148 HydrophobicContact CD2-CB 4.24Å; L36-I148 HydrophobicContact CD2-CD1 3.74Å; L36-I148 HydrophobicContact CD2-CG1 3.75Å; L36-I148 HydrophobicContact CD2-CG2 3.44Å; L36-I148 VanDerWaalsContact CD2-CG2 3.44Å
37	M	83.5	Confident	84	Confident	76 Å²	76	59.1 Å²	59.1	37%	0.374	32%	0.316	S	S	.	.	H	α-helix	trans	-61	-47.9	175.9	-71.2	-179.7	69.7	0	0	111.2	K33 L34 I39 Y40 S41 F113	K33-M37 WeakPolarHBondContact O-CG 3.47Å; K33-M37 PolarHBondContact O-N 3.2Å; L34-M37 PolarHBondContact O-N 3.08Å; M37-I39 VanDerWaalsContact C-N 3.29Å; M37-I39 PolarHBondContact O-N 3.31Å; M37-Y40 PolarHBondContact O-N 3.36Å; M37-S41 WeakPolarHBondContact O-CB 3.42Å; M37-S41 PolarHBondContact O-N 3.43Å; M37-S41 PolarHBondContact O-OG 3.13Å; M37-F113 HydrophobicContact CE-CE1 3.94Å; M37-F113 HydrophobicContact CE-CZ 4.01Å
38	Q	85.4	Confident	84.2	Confident	39 Å²	39	64.5 Å²	64.5	18%	0.182	33%	0.331	C	S	.	.	H	α-helix	trans	-58.3	-37.8	178	-164.8	-179.8	7.3	0	0	112.6	L34 G35 S41 R42 E43 P44 M45	L34-Q38 WeakPolarHBondContact O-CB 3.43Å; L34-Q38 PolarHBondContact O-N 3.03Å; G35-Q38 PolarHBondContact O-N 2.84Å; Q38-S41 WeakPolarHBondContact CA-OG 3.24Å; Q38-S41 PolarHBondContact O-OG 3.07Å; Q38-R42 PolarHBondContact O-N 3.42Å; Q38-E43 HydrophobicContact CG-CB 3.53Å; Q38-E43 PolarHBondContact O-N 3.45Å; Q38-P44 PolarHBondContact NE2-O 2.74Å; Q38-M45 HydrophobicContact CB-CE 4.19Å; Q38-M45 HydrophobicContact CG-CE 4.41Å; Q38-M45 VanDerWaalsContact OE1-CE 3.3Å
39	I	86	Confident	84.4	Confident	11 Å²	11	67.6 Å²	67.6	6%	0.056	34%	0.343	C	S	.	.	H	α-helix	trans	-74.6	-42.1	-179.3	-68.8	161	0	0	0	112	G35 L36 M37 R42 M45 S144 I147 I148 L151	G35-I39 WeakPolarHBondContact O-CD1 3.04Å; G35-I39 VanDerWaalsContact O-CG1 3.28Å; G35-I39 WeakPolarHBondContact O-CG1 3.31Å; G35-I39 PolarHBondContact O-N 2.92Å; L36-I39 PolarHBondContact O-N 3.03Å; M37-I39 VanDerWaalsContact C-N 3.29Å; M37-I39 PolarHBondContact O-N 3.31Å; I39-R42 PolarHBondContact O-N 3.38Å; I39-M45 HydrophobicContact CD1-CE 3.95Å; I39-M45 HydrophobicContact CG1-CE 3.86Å; I39-S144 WeakPolarHBondContact CG2-O 3.23Å; I39-S144 PolarHBondContact O-OG 2.86Å; I39-I147 HydrophobicContact CD1-CG2 3.73Å; I39-I147 HydrophobicContact CG1-CG2 4.04Å; I39-I147 HydrophobicContact CG2-CB 4Å; I39-I147 HydrophobicContact CG2-CG2 4.05Å; I39-I148 HydrophobicContact CB-CD1 4.49Å; I39-I148 HydrophobicContact CB-CG1 4.35Å; I39-I148 HydrophobicContact CD1-CG1 4.01Å; I39-I148 HydrophobicContact CG2-CD1 4.04Å; I39-I148 HydrophobicContact CG2-CG1 3.88Å; I39-L151 HydrophobicContact CD1-CD1 3.48Å; I39-L151 VanDerWaalsContact CD1-CD1 3.48Å
40	Y	83.7	Confident	84.5	Confident	10 Å²	10	69.2 Å²	69.2	4%	0.039	35%	0.35	C	S	.	.	H	α-helix	trans	-74.7	-31.5	176.1	-79.8	-63.8	0	0	0	112.6	L36 M37 R42 V111 Y114 Y141 S144 S145 I148	L36-Y40 WeakPolarHBondContact O-CD2 3.28Å; L36-Y40 PolarHBondContact O-N 3.02Å; L36-Y40 VanDerWaalsContact O-N 3.07Å; M37-Y40 PolarHBondContact O-N 3.36Å; Y40-R42 PolarHBondContact O-N 3.41Å; Y40-V111 HydrophobicContact CE2-CB 4.5Å; Y40-V111 HydrophobicContact CE2-CG1 4.4Å; Y40-V111 HydrophobicContact CE2-CG2 4.33Å; Y40-Y114 HydrophobicContact CD1-CD2 4.46Å; Y40-Y114 HydrophobicContact CD1-CG 4.25Å; Y40-Y114 WeakPolarHBondContact O-CD2 3.25Å; Y40-Y114 WeakPolarHBondContact O-CE2 3.3Å; Y40-Y141 HydrophobicContact CD1-CD2 4.18Å; Y40-Y141 HydrophobicContact CD1-CE2 4.44Å; Y40-Y141 AromaticContact CE1-CD2 3.65Å; Y40-Y141 HydrophobicContact CE1-CD2 3.65Å; Y40-Y141 AromaticContact CE1-CE2 3.67Å; Y40-Y141 HydrophobicContact CE1-CE2 3.67Å; Y40-Y141 HydrophobicContact CE1-CG 4.4Å; Y40-S144 VanDerWaalsContact CD1-CB 3.48Å; Y40-S145 PolarHBondContact OH-OG 2.95Å; Y40-I148 HydrophobicContact CD2-CD1 3.72Å; Y40-I148 HydrophobicContact CE1-CD1 4.34Å; Y40-I148 HydrophobicContact CE2-CD1 3.11Å; Y40-I148 VanDerWaalsContact CZ-CD1 3.47Å
41	S	82.1	Confident	84.7	Confident	59 Å²	59	70.2 Å²	70.2	41%	0.413	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-4.5	171.2	69.6	0	0	0	0	113.8	M37 Q38 E43	M37-S41 WeakPolarHBondContact O-CB 3.42Å; M37-S41 PolarHBondContact O-N 3.43Å; M37-S41 PolarHBondContact O-OG 3.13Å; Q38-S41 WeakPolarHBondContact CA-OG 3.24Å; Q38-S41 PolarHBondContact O-OG 3.07Å; S41-E43 WeakPolarHBondContact CB-OE1 3.29Å; S41-E43 PolarHBondContact O-N 3.17Å; S41-E43 WeakPolarHBondContact OG-CG 3.33Å; S41-E43 PolarHBondContact OG-OE1 2.75Å
42	R	79.6	Confident	84.7	Confident	143 Å²	143	71 Å²	71	54%	0.54	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.3	23	-178.7	-64.2	-84	-64.8	169.1	2.1	113.7	Q38 I39 Y40	Q38-R42 PolarHBondContact O-N 3.42Å; I39-R42 PolarHBondContact O-N 3.38Å; Y40-R42 PolarHBondContact O-N 3.41Å
43	E	82.5	Confident	84.8	Confident	112 Å²	112	71 Å²	71	52%	0.523	36%	0.355	S	S	.	.	P	Polyproline II helix	trans	-69.8	143	173.5	-79.6	165.9	-122.9	0	0	111.6	Q38 S41 M45	Q38-E43 HydrophobicContact CG-CB 3.53Å; Q38-E43 PolarHBondContact O-N 3.45Å; S41-E43 WeakPolarHBondContact CB-OE1 3.29Å; S41-E43 PolarHBondContact O-N 3.17Å; S41-E43 WeakPolarHBondContact OG-CG 3.33Å; S41-E43 PolarHBondContact OG-OE1 2.75Å; E43-M45 PolarHBondContact O-N 3.41Å
44	P	81.3	Confident	84.9	Confident	125 Å²	125	69.4 Å²	69.4	81%	0.812	35%	0.347	S	S	*	.	P	Polyproline II helix	trans	-69.5	117	-178	27.5	-33.9	0	0	0	111.5	Q38	Q38-P44 PolarHBondContact NE2-O 2.74Å
45	M	83.5	Confident	85	Confident	45 Å²	45	67.6 Å²	67.6	22%	0.222	34%	0.34	C	S	.	.	P	Polyproline II helix	trans	-97.4	130.5	173.4	-171.4	-178.1	-71.9	0	0	110.5	Q38 I39 E43 R49 Y50 I53	Q38-M45 HydrophobicContact CB-CE 4.19Å; Q38-M45 HydrophobicContact CG-CE 4.41Å; Q38-M45 VanDerWaalsContact OE1-CE 3.3Å; I39-M45 HydrophobicContact CD1-CE 3.95Å; I39-M45 HydrophobicContact CG1-CE 3.86Å; E43-M45 PolarHBondContact O-N 3.41Å; M45-R49 HydrophobicContact CG-CB 3.79Å; M45-R49 HydrophobicContact CG-CG 3.65Å; M45-R49 HydrophobicContact SD-CG 4.09Å; M45-Y50 HydrophobicContact SD-CD2 4.28Å; M45-I53 HydrophobicContact CE-CD1 4.04Å; M45-I53 HydrophobicContact SD-CD1 4.28Å
46	S	85.6	Confident	85	Confident	72 Å²	72	69.5 Å²	69.5	50%	0.503	35%	0.35	S	S	.	.	P	Polyproline II helix	trans	-72.7	150.1	175.9	71.1	0	0	0	0	111.5	R48 R49 Y50	S46-R48 PolarHBondContact O-N 3.01Å; S46-R49 WeakPolarHBondContact O-CA 3.16Å; S46-R49 WeakPolarHBondContact O-CB 3.38Å; S46-R49 PolarHBondContact O-N 2.96Å; S46-R49 WeakPolarHBondContact OG-CB 3.36Å; S46-R49 PolarHBondContact OG-N 2.86Å; S46-Y50 PolarHBondContact O-N 3.34Å
47	C	83.2	Confident	85	Confident	99 Å²	99	69.4 Å²	69.4	67%	0.669	35%	0.35	S	S	*	.	H	α-helix	trans	-54.3	-39	175.5	-177.6	0	0	0	0	111.8	R49 Y50 M51	C47-R49 VanDerWaalsContact C-N 3.35Å; C47-R49 PolarHBondContact O-N 3.49Å; C47-Y50 PolarHBondContact O-N 3.5Å; C47-M51 WeakPolarHBondContact O-CB 3.4Å; C47-M51 VanDerWaalsContact O-CG 3.31Å; C47-M51 WeakPolarHBondContact O-CG 3.35Å; C47-M51 PolarHBondContact O-N 3.5Å
48	R	83.7	Confident	85.1	Confident	221 Å²	221	70.7 Å²	70.7	83%	0.834	35%	0.352	S	S	*	.	H	α-helix	trans	-60.7	-39.6	174.1	-171.5	177.4	-178.3	-179.7	1.4	112.8	S46 S52	S46-R48 PolarHBondContact O-N 3.01Å; R48-S52 WeakPolarHBondContact O-CB 3.32Å; R48-S52 PolarHBondContact O-N 3.27Å
49	R	88.9	Confident	84.9	Confident	66 Å²	66	70.8 Å²	70.8	25%	0.249	36%	0.355	C	S	.	.	H	α-helix	trans	-69.7	-43.8	177	179.7	57.9	172.5	161.3	1	111.5	D31 M45 S46 C47 S52 I53	D31-R49 VanDerWaalsContact CG-NH1 3.29Å; D31-R49 IonicContact OD1-CZ 2.8Å; D31-R49 IonicContact OD1-NH1 2.75Å; D31-R49 PolarHBondContact OD1-NH1 2.84Å; D31-R49 IonicContact OD1-NH2 3.41Å; D31-R49 PolarHBondContact OD1-NH2 2.67Å; D31-R49 IonicContact OD2-CZ 2.82Å; D31-R49 IonicContact OD2-NH1 2.74Å; D31-R49 PolarHBondContact OD2-NH1 2.94Å; D31-R49 VanDerWaalsContact OD2-NH1 3.14Å; D31-R49 IonicContact OD2-NH2 3.5Å; M45-R49 HydrophobicContact CG-CB 3.79Å; M45-R49 HydrophobicContact CG-CG 3.65Å; M45-R49 HydrophobicContact SD-CG 4.09Å; S46-R49 WeakPolarHBondContact O-CA 3.16Å; S46-R49 WeakPolarHBondContact O-CB 3.38Å; S46-R49 PolarHBondContact O-N 2.96Å; S46-R49 WeakPolarHBondContact OG-CB 3.36Å; S46-R49 PolarHBondContact OG-N 2.86Å; C47-R49 VanDerWaalsContact C-N 3.35Å; C47-R49 PolarHBondContact O-N 3.49Å; R49-S52 WeakPolarHBondContact O-CB 3.12Å; R49-S52 PolarHBondContact O-N 2.97Å; R49-I53 HydrophobicContact CG-CD1 4.31Å; R49-I53 WeakPolarHBondContact O-CG1 3.23Å; R49-I53 PolarHBondContact O-N 2.96Å; R49-I53 VanDerWaalsContact O-N 3.08Å
50	Y	89.7	Confident	84.7	Confident	67 Å²	67	71 Å²	71	26%	0.263	36%	0.355	S	S	.	.	H	α-helix	trans	-57.5	-52.2	174.6	-176	-85.3	0	0	0	111.3	M45 S46 C47 S52 I53 Y54 I147 L151	M45-Y50 HydrophobicContact SD-CD2 4.28Å; S46-Y50 PolarHBondContact O-N 3.34Å; C47-Y50 PolarHBondContact O-N 3.5Å; Y50-S52 VanDerWaalsContact C-N 3.29Å; Y50-S52 PolarHBondContact O-N 2.92Å; Y50-I53 PolarHBondContact O-N 3.25Å; Y50-Y54 WeakPolarHBondContact O-CB 3.3Å; Y50-Y54 PolarHBondContact O-N 3.26Å; Y50-I147 HydrophobicContact CE2-CG2 3.95Å; Y50-L151 HydrophobicContact CD1-CD2 4.13Å; Y50-L151 HydrophobicContact CD2-CD2 3.53Å; Y50-L151 HydrophobicContact CD2-CG 3.95Å; Y50-L151 HydrophobicContact CE1-CD2 4.06Å; Y50-L151 HydrophobicContact CE2-CD1 4.45Å; Y50-L151 HydrophobicContact CE2-CD2 3.46Å; Y50-L151 VanDerWaalsContact CE2-CD2 3.46Å; Y50-L151 HydrophobicContact CE2-CG 3.51Å; Y50-L151 HydrophobicContact CG-CD2 3.88Å; Y50-L151 PolarHBondContact OH-N 3.38Å
51	M	87.3	Confident	84.4	Confident	93 Å²	93	72.1 Å²	72.1	46%	0.458	36%	0.364	S	S	.	.	H	α-helix	trans	-64.5	-31.8	178.7	-67.7	-60.5	-72.7	0	0	112.6	C47 T55	C47-M51 WeakPolarHBondContact O-CB 3.4Å; C47-M51 VanDerWaalsContact O-CG 3.31Å; C47-M51 WeakPolarHBondContact O-CG 3.35Å; C47-M51 PolarHBondContact O-N 3.5Å; M51-T55 VanDerWaalsContact O-CB 3.24Å; M51-T55 WeakPolarHBondContact O-CB 3.36Å; M51-T55 PolarHBondContact O-N 2.89Å; M51-T55 PolarHBondContact O-OG1 3.12Å
52	S	87.6	Confident	84.1	Confident	50 Å²	50	72.1 Å²	72.1	35%	0.35	36%	0.361	S	S	.	.	H	α-helix	trans	-62.9	-49.6	173	-170.9	0	0	0	0	111.7	R48 R49 Y50 T55 N56	R48-S52 WeakPolarHBondContact O-CB 3.32Å; R48-S52 PolarHBondContact O-N 3.27Å; R49-S52 WeakPolarHBondContact O-CB 3.12Å; R49-S52 PolarHBondContact O-N 2.97Å; Y50-S52 VanDerWaalsContact C-N 3.29Å; Y50-S52 PolarHBondContact O-N 2.92Å; S52-T55 PolarHBondContact O-N 3.02Å; S52-N56 WeakPolarHBondContact O-CB 3.28Å; S52-N56 PolarHBondContact O-N 3.09Å; S52-N56 PolarHBondContact O-ND2 2.94Å; S52-N56 PolarHBondContact O-OD1 2.83Å
53	I	87.7	Confident	83.6	Confident	0 Å²	0	67.2 Å²	67.2	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-64.9	-44.6	179.5	-64.1	166.4	0	0	0	110.1	L32 M45 R49 Y50 T55 N56 V57 L151	L32-I53 HydrophobicContact CD1-CG2 3.67Å; M45-I53 HydrophobicContact CE-CD1 4.04Å; M45-I53 HydrophobicContact SD-CD1 4.28Å; R49-I53 HydrophobicContact CG-CD1 4.31Å; R49-I53 WeakPolarHBondContact O-CG1 3.23Å; R49-I53 PolarHBondContact O-N 2.96Å; R49-I53 VanDerWaalsContact O-N 3.08Å; Y50-I53 PolarHBondContact O-N 3.25Å; I53-T55 VanDerWaalsContact C-N 3.35Å; I53-T55 PolarHBondContact O-N 3.23Å; I53-N56 PolarHBondContact O-N 3Å; I53-V57 WeakPolarHBondContact O-CG2 3.48Å; I53-V57 PolarHBondContact O-N 3.22Å; I53-L151 HydrophobicContact CB-CD2 4.19Å; I53-L151 HydrophobicContact CG2-CD1 4.27Å; I53-L151 HydrophobicContact CG2-CD2 4.15Å
54	Y	87.9	Confident	82.4	Confident	66 Å²	66	71 Å²	71	26%	0.259	37%	0.365	S	S	.	.	H	α-helix	trans	-56.3	-46.5	174.5	179.1	-94.3	0	0	0	112.3	Y50 N56 V57 Y58 S153	Y50-Y54 WeakPolarHBondContact O-CB 3.3Å; Y50-Y54 PolarHBondContact O-N 3.26Å; Y54-N56 VanDerWaalsContact C-N 3.33Å; Y54-N56 PolarHBondContact O-N 3.36Å; Y54-V57 PolarHBondContact O-N 2.97Å; Y54-Y58 WeakPolarHBondContact O-CB 3.39Å; Y54-Y58 PolarHBondContact O-N 2.89Å; Y54-S153 WeakPolarHBondContact CE2-OG 3.24Å
55	T	86.2	Confident	81.3	Confident	64 Å²	64	67.3 Å²	67.3	39%	0.393	34%	0.335	S	S	.	.	H	α-helix	trans	-66.2	-35.7	178.4	-55.8	0	0	0	0	111.6	M51 S52 I53 Y58 T59	M51-T55 VanDerWaalsContact O-CB 3.24Å; M51-T55 WeakPolarHBondContact O-CB 3.36Å; M51-T55 PolarHBondContact O-N 2.89Å; M51-T55 PolarHBondContact O-OG1 3.12Å; S52-T55 PolarHBondContact O-N 3.02Å; I53-T55 VanDerWaalsContact C-N 3.35Å; I53-T55 PolarHBondContact O-N 3.23Å; T55-Y58 PolarHBondContact O-N 3.28Å; T55-T59 VanDerWaalsContact O-CB 3.28Å; T55-T59 WeakPolarHBondContact O-CB 3.33Å; T55-T59 PolarHBondContact O-N 2.81Å; T55-T59 PolarHBondContact O-OG1 2.95Å
56	N	85.5	Confident	79.4	Confident	39 Å²	39	68.5 Å²	68.5	21%	0.209	35%	0.345	C	S	.	.	H	α-helix	trans	-65.2	-44.7	175	-69.4	-13.9	0	0	0	111.2	I23 L28 D31 S52 I53 Y54 T59 Y60	I23-N56 HydrophobicContact CD1-CB 4.06Å; L28-N56 HydrophobicContact CD1-CB 3.68Å; D31-N56 PolarHBondContact OD2-ND2 3.15Å; S52-N56 WeakPolarHBondContact O-CB 3.28Å; S52-N56 PolarHBondContact O-N 3.09Å; S52-N56 PolarHBondContact O-ND2 2.94Å; S52-N56 PolarHBondContact O-OD1 2.83Å; I53-N56 PolarHBondContact O-N 3Å; Y54-N56 VanDerWaalsContact C-N 3.33Å; Y54-N56 PolarHBondContact O-N 3.36Å; N56-T59 PolarHBondContact O-N 2.91Å; N56-Y60 WeakPolarHBondContact O-CB 3.06Å; N56-Y60 PolarHBondContact O-N 3.46Å
57	V	84.8	Confident	77.4	Confident	1 Å²	1	70.7 Å²	70.7	1%	0.006	36%	0.358	C	S	.	.	H	α-helix	trans	-61.3	-46.8	173.9	173.1	0	0	0	0	111	L28 I53 Y54 C61 L101	L28-V57 HydrophobicContact CD1-CG2 4.01Å; I53-V57 WeakPolarHBondContact O-CG2 3.48Å; I53-V57 PolarHBondContact O-N 3.22Å; Y54-V57 PolarHBondContact O-N 2.97Å; V57-C61 WeakPolarHBondContact O-CB 3.31Å; V57-C61 PolarHBondContact O-N 2.68Å; V57-C61 PolarHBondContact O-SG 2.92Å; V57-L101 HydrophobicContact CG1-CD2 4.29Å
58	Y	85.1	Confident	75.6	Confident	103 Å²	103	71.1 Å²	71.1	40%	0.404	36%	0.362	S	S	.	.	H	α-helix	trans	-58	-48.2	175.7	170.2	-94.2	0	0	0	112.4	Y54 T55 C61 T62 Y154	Y54-Y58 WeakPolarHBondContact O-CB 3.39Å; Y54-Y58 PolarHBondContact O-N 2.89Å; T55-Y58 PolarHBondContact O-N 3.28Å; Y58-C61 PolarHBondContact O-N 2.81Å; Y58-T62 HydrophobicContact CD2-CG2 4.29Å; Y58-T62 HydrophobicContact CE1-CG2 4.39Å; Y58-T62 HydrophobicContact CE2-CG2 3.9Å; Y58-T62 WeakPolarHBondContact O-CB 3.35Å; Y58-T62 WeakPolarHBondContact O-CG2 3.2Å; Y58-T62 PolarHBondContact O-N 2.87Å; Y58-T62 VanDerWaalsContact O-N 3.07Å; Y58-T62 PolarHBondContact O-OG1 2.97Å; Y58-Y154 HydrophobicContact CD2-CD1 4.22Å; Y58-Y154 AromaticContact CD2-CD2 3.59Å; Y58-Y154 HydrophobicContact CD2-CD2 3.59Å; Y58-Y154 HydrophobicContact CD2-CE1 4.14Å; Y58-Y154 AromaticContact CD2-CE2 3.51Å; Y58-Y154 HydrophobicContact CD2-CE2 3.51Å; Y58-Y154 AromaticContact CD2-CG 3.95Å; Y58-Y154 HydrophobicContact CD2-CG 3.95Å; Y58-Y154 AromaticContact CD2-CZ 3.8Å; Y58-Y154 HydrophobicContact CE2-CD2 4.08Å; Y58-Y154 AromaticContact CE2-CE2 3.54Å; Y58-Y154 HydrophobicContact CE2-CE2 3.54Å; Y58-Y154 AromaticContact CE2-CZ 3.81Å
59	T	81.6	Confident	73.8	Confident	41 Å²	41	67.1 Å²	67.1	25%	0.252	35%	0.353	S	S	.	.	H	α-helix	trans	-64.5	-43.3	-177.3	-57.8	0	0	0	0	111.1	T55 N56 T62 T63	T55-T59 VanDerWaalsContact O-CB 3.28Å; T55-T59 WeakPolarHBondContact O-CB 3.33Å; T55-T59 PolarHBondContact O-N 2.81Å; T55-T59 PolarHBondContact O-OG1 2.95Å; N56-T59 PolarHBondContact O-N 2.91Å; T59-T62 WeakPolarHBondContact CA-OG1 3.5Å; T59-T62 PolarHBondContact O-N 2.86Å; T59-T62 PolarHBondContact O-OG1 3.32Å; T59-T63 WeakPolarHBondContact O-CB 3.4Å; T59-T63 PolarHBondContact O-N 2.83Å; T59-T63 PolarHBondContact O-OG1 2.75Å
60	Y	81.8	Confident	71.4	Confident	15 Å²	15	68 Å²	68	6%	0.059	36%	0.361	C	S	.	.	H	α-helix	trans	-61.4	-45.7	174.6	-177.8	-103.3	0	0	0	111.6	I23 V25 L28 N56 T62 Y65 V97 L101	I23-Y60 HydrophobicContact CG2-CD2 4.5Å; V25-Y60 HydrophobicContact CB-CE2 3.74Å; V25-Y60 WeakPolarHBondContact CB-OH 3.17Å; V25-Y60 HydrophobicContact CG2-CE1 4.31Å; V25-Y60 HydrophobicContact CG2-CE2 4.12Å; V25-Y60 WeakPolarHBondContact CG2-OH 3.41Å; L28-Y60 HydrophobicContact CD2-CD1 3.64Å; L28-Y60 HydrophobicContact CD2-CD2 4.17Å; L28-Y60 HydrophobicContact CD2-CE1 4.4Å; L28-Y60 HydrophobicContact CD2-CG 3.51Å; N56-Y60 WeakPolarHBondContact O-CB 3.06Å; N56-Y60 PolarHBondContact O-N 3.46Å; Y60-T62 PolarHBondContact O-N 3.38Å; Y60-Y65 HydrophobicContact CD2-CE2 4.48Å; Y60-Y65 WeakPolarHBondContact CD2-OH 3.44Å; Y60-Y65 HydrophobicContact CE2-CE2 4.32Å; Y60-Y65 WeakPolarHBondContact CE2-OH 3.3Å; Y60-V97 HydrophobicContact CD1-CG1 3.97Å; Y60-V97 HydrophobicContact CE1-CG1 3.63Å; Y60-V97 VanDerWaalsContact CE1-O 3.31Å; Y60-V97 WeakPolarHBondContact CE1-O 3.32Å; Y60-V97 HydrophobicContact CE2-CG1 4.42Å; Y60-V97 HydrophobicContact CG-CG1 4.5Å; Y60-V97 WeakPolarHBondContact O-CG1 3.41Å; Y60-L101 HydrophobicContact CD1-CD2 4.29Å; Y60-L101 HydrophobicContact CE1-CB 4.19Å
61	C	76.9	Confident	69.1	Low	34 Å²	34	71 Å²	71	23%	0.23	39%	0.387	C	S	.	.	H	α-helix	trans	-69.8	-9.9	178.4	-63	0	0	0	0	114.8	V57 Y58 Y154	V57-C61 WeakPolarHBondContact O-CB 3.31Å; V57-C61 PolarHBondContact O-N 2.68Å; V57-C61 PolarHBondContact O-SG 2.92Å; Y58-C61 PolarHBondContact O-N 2.81Å; C61-Y154 HydrophobicContact CB-CD1 3.63Å; C61-Y154 HydrophobicContact CB-CE1 3.59Å
62	T	76.5	Confident	66.4	Low	58 Å²	58	72.3 Å²	72.3	36%	0.356	40%	0.402	S	S	.	.	H	α-helix	trans	-114.8	-8.7	-178.3	49.7	0	0	0	0	114.3	Y58 T59 Y60 Y154	Y58-T62 HydrophobicContact CD2-CG2 4.29Å; Y58-T62 HydrophobicContact CE1-CG2 4.39Å; Y58-T62 HydrophobicContact CE2-CG2 3.9Å; Y58-T62 WeakPolarHBondContact O-CB 3.35Å; Y58-T62 WeakPolarHBondContact O-CG2 3.2Å; Y58-T62 PolarHBondContact O-N 2.87Å; Y58-T62 VanDerWaalsContact O-N 3.07Å; Y58-T62 PolarHBondContact O-OG1 2.97Å; T59-T62 WeakPolarHBondContact CA-OG1 3.5Å; T59-T62 PolarHBondContact O-N 2.86Å; T59-T62 PolarHBondContact O-OG1 3.32Å; Y60-T62 PolarHBondContact O-N 3.38Å; T62-Y154 HydrophobicContact CG2-CE1 3.91Å; T62-Y154 WeakPolarHBondContact CG2-OH 3.2Å
63	T	69.4	Low	64	Low	41 Å²	41	77.3 Å²	77.3	25%	0.252	42%	0.423	S	S	.	.			trans	-77.2	129.1	-179.5	-63.5	0	0	0	0	111.2	T59 Y65	T59-T63 WeakPolarHBondContact O-CB 3.4Å; T59-T63 PolarHBondContact O-N 2.83Å; T59-T63 PolarHBondContact O-OG1 2.75Å; T63-Y65 HydrophobicContact CG2-CE1 4.4Å; T63-Y65 HydrophobicContact CG2-CE2 4.11Å; T63-Y65 VanDerWaalsContact O-CD2 3.29Å; T63-Y65 WeakPolarHBondContact O-CD2 3.14Å; T63-Y65 PolarHBondContact O-N 3.2Å
64	Q	55.9	Low	61.4	Low	191 Å²	191	88.3 Å²	88.3	89%	0.893	47%	0.465	S	S	*	.			trans	-79.7	103.1	175.3	-68.3	-174.9	-1.8	0	0	110.6
65	Y	57.9	Low	58.7	Low	47 Å²	47	90.4 Å²	90.4	18%	0.184	49%	0.489	C	S	.	.			trans	-81.1	138	174.1	-66.1	-84.7	0	0	0	111.3	I23 Y60 T63 V97	I23-Y65 PolarHBondContact O-OH 3.28Å; I23-Y65 VanDerWaalsContact O-OH 3.14Å; Y60-Y65 HydrophobicContact CD2-CE2 4.48Å; Y60-Y65 WeakPolarHBondContact CD2-OH 3.44Å; Y60-Y65 HydrophobicContact CE2-CE2 4.32Å; Y60-Y65 WeakPolarHBondContact CE2-OH 3.3Å; T63-Y65 HydrophobicContact CG2-CE1 4.4Å; T63-Y65 HydrophobicContact CG2-CE2 4.11Å; T63-Y65 VanDerWaalsContact O-CD2 3.29Å; T63-Y65 WeakPolarHBondContact O-CD2 3.14Å; T63-Y65 PolarHBondContact O-N 3.2Å; Y65-V97 HydrophobicContact CD2-CG1 4.31Å; Y65-V97 HydrophobicContact CD2-CG2 3.73Å; Y65-V97 HydrophobicContact CE2-CG1 3.95Å; Y65-V97 HydrophobicContact CE2-CG2 4.22Å
66	T	43.8	Very low	56.1	Low	70 Å²	70	99.2 Å²	99.2	43%	0.429	52%	0.515	S	S	.	.			trans	-84.9	148.1	176.1	46.3	0	0	0	0	111.2	S68 Q69	T66-S68 PolarHBondContact O-N 3.45Å; T66-Q69 PolarHBondContact O-N 3.46Å
67	P	44.9	Very low	53.3	Low	118 Å²	118	108.7 Å²	108.7	77%	0.766	55%	0.548	S	S	*	.	G	3₁₀ helix	trans	-59.3	-18.4	-174.8	-26.3	35.2	0	0	0	115.5	Q69	P67-Q69 VanDerWaalsContact C-N 3.34Å
68	S	44.1	Very low	50.8	Low	109 Å²	109	117.5 Å²	117.5	76%	0.762	59%	0.589	S	S	*	*	G	3₁₀ helix	trans	-80	-6.9	178.2	46.4	0	0	0	0	114.7	T66	T66-S68 PolarHBondContact O-N 3.45Å
69	Q	46.6	Very low	48.2	Very low	136 Å²	136	117.4 Å²	117.4	64%	0.636	60%	0.603	S	S	*	*	G	3₁₀ helix	trans	-105.1	0.5	-178.2	-67.3	-177.5	-18.2	0	0	114.3	T66 P67	T66-Q69 PolarHBondContact O-N 3.46Å; P67-Q69 VanDerWaalsContact C-N 3.34Å
70	M	38.9	Very low	45.6	Very low	84 Å²	84	125.4 Å²	125.4	41%	0.414	63%	0.634	S	S	.	*	P	Polyproline II helix	trans	-96.6	127.8	180	-73.9	-177	164	0	0	112.5	F96 V97	M70-F96 HydrophobicContact CE-CB 3.64Å; M70-F96 HydrophobicContact SD-CB 4.08Å; M70-F96 HydrophobicContact SD-CG 4.43Å; M70-V97 HydrophobicContact CE-CG2 4.37Å
71	T	40.1	Very low	43.1	Very low	132 Å²	132	129 Å²	129	81%	0.81	67%	0.667	S	S	*	*	P	Polyproline II helix	trans	-82.3	129.7	177.6	35.1	0	0	0	0	112.2
72	P	32.1	Very low	41	Very low	120 Å²	120	133.9 Å²	133.9	78%	0.779	70%	0.696	S	S	*	*	P	Polyproline II helix	trans	-85.3	116.8	-174.6	31.4	-34.1	0	0	0	113.3
73	I	36.8	Very low	38.8	Very low	155 Å²	155	136.8 Å²	136.8	80%	0.795	71%	0.713	S	S	*	*	P	Polyproline II helix	trans	-83	121.9	174.7	-60.9	178.6	0	0	0	110.7
74	R	33	Very low	37.1	Very low	231 Å²	231	142.6 Å²	142.6	87%	0.872	74%	0.743	S	S	*	*			trans	-90.6	111.6	-177.3	-77.7	179.4	167.4	176	-3.7	113.9
75	S	29.9	Very low	35.9	Very low	109 Å²	109	141.3 Å²	141.3	76%	0.762	73%	0.734	S	S	*	*			trans	53	127.5	139.7	68	0	0	0	0	122.7
76	R	31.9	Very low	34.7	Very low	250 Å²	250	145.9 Å²	145.9	94%	0.943	76%	0.761	S	S	*	*				-159	137.5	114.4	-129.2	172.6	177.5	169.6	-2.2	113.8
77	R	27.6	Very low	34.2	Very low	238 Å²	238	152.8 Å²	152.8	90%	0.898	79%	0.786	S	S	*	*			trans	-61	150.8	-169.6	-60.2	163.7	167.2	165.8	-6	117
78	Q	32.6	Very low	33.5	Very low	186 Å²	186	155.2 Å²	155.2	87%	0.869	79%	0.787	S	S	*	*				-164.8	133.5	115.9	-107	169.7	3.3	0	0	114.6
79	S	29.8	Very low	32.7	Very low	101 Å²	101	156.5 Å²	156.5	71%	0.706	79%	0.785	S	S	*	*			trans	43.3	111.3	161	37.7	0	0	0	0	121.3
80	K	28	Very low	32	Very low	209 Å²	209	155.7 Å²	155.7	91%	0.909	80%	0.795	S	S	*	*				66.7	130.3	92.4	-74.1	-176.5	176.2	-175.8	0	113.5
81	A	29.2	Very low	31.9	Very low	90 Å²	90	156.8 Å²	156.8	74%	0.744	81%	0.806	S	S	*	*			cis	-164.7	176.6	-9.2	0	0	0	0	0	106.1
82	V	32.1	Very low	31.7	Very low	137 Å²	137	156.9 Å²	156.9	83%	0.83	80%	0.801	S	S	*	*			cis	-134	-178.5	15.6	179.2	0	0	0	0	108.5
83	V	30.9	Very low	32.1	Very low	119 Å²	119	154.7 Å²	154.7	72%	0.721	79%	0.789	S	S	*	*			trans	-131.4	137.4	169.5	170.8	0	0	0	0	108.2	K85	V83-K85 HydrophobicContact CG1-CG 4.33Å
84	D	32	Very low	32.6	Very low	163 Å²	163	150.3 Å²	150.3	87%	0.872	77%	0.771	S	S	*	*			trans	-112.2	151.1	153.9	-149.4	-10.7	0	0	0	109.5
85	K	32.1	Very low	33.4	Very low	163 Å²	163	142.9 Å²	142.9	71%	0.709	75%	0.747	S	S	*	*			trans	-104.6	173.8	-157.9	-72.4	-176.5	173.6	-179.3	0	114.2	V83	V83-K85 HydrophobicContact CG1-CG 4.33Å
86	D	31.9	Very low	34.8	Very low	143 Å²	143	143.9 Å²	143.9	77%	0.765	74%	0.738	S	S	*	*			trans	80.6	81.7	158	-52.7	-27.4	0	0	0	117.9
87	K	34.8	Very low	36.4	Very low	215 Å²	215	132.7 Å²	132.7	94%	0.935	70%	0.697	S	S	*	*				-163.4	135.8	121.8	-102.5	154.2	-170.4	175.9	0	112.2
88	E	30	Very low	38.5	Very low	169 Å²	169	121.5 Å²	121.5	79%	0.79	66%	0.656	S	S	*	*			trans	-92.4	168.1	-170.6	-56.7	-179.3	132	0	0	114.3
89	N	27.5	Very low	40.8	Very low	136 Å²	136	117.3 Å²	117.3	73%	0.727	64%	0.635	S	S	*	*			trans	80.1	104	151.7	-58.9	-40.7	0	0	0	120
90	S	31.4	Very low	43	Very low	120 Å²	120	114.9 Å²	114.9	84%	0.839	61%	0.613	S	S	*	*	S	Bend		147.1	-12.7	119.8	62.3	0	0	0	0	116.7
91	T	35.3	Very low	45.5	Very low	107 Å²	107	105 Å²	105	66%	0.656	57%	0.57	S	S	*	*			trans	-107.4	-0.3	-164.9	32.9	0	0	0	0	117.9	S93	T91-S93 PolarHBondContact O-N 2.89Å
92	L	36.6	Very low	48.2	Very low	134 Å²	134	100.8 Å²	100.8	70%	0.702	53%	0.534	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-11.7	-166.4	-116.5	80.8	0	0	0	117.4
93	S	40.9	Very low	50.5	Low	74 Å²	74	98.2 Å²	98.2	52%	0.517	51%	0.51	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.5	-19.7	-174.2	61.9	0	0	0	0	115	T91	T91-S93 PolarHBondContact O-N 2.89Å
94	S	46.4	Very low	52.8	Low	62 Å²	62	94.8 Å²	94.8	43%	0.434	48%	0.484	S	S	.	.	S	Bend	trans	-82.2	-20.4	-175.6	66.5	0	0	0	0	114.8
95	Q	51.5	Low	55	Low	75 Å²	75	87.3 Å²	87.3	35%	0.35	44%	0.444	S	S	.	.	H	α-helix	trans	-72.8	-30.5	-171.6	-76.3	177.3	-42.9	0	0	113.8	W159	Q95-W159 PolarHBondContact O-NE1 3.02Å; Q95-W159 VanDerWaalsContact O-NE1 3.09Å
96	F	58.6	Low	57.1	Low	131 Å²	131	84 Å²	84	58%	0.575	43%	0.431	S	S	*	.	H	α-helix	trans	-78.5	-23.8	-172	-89	-88.9	0	0	0	115.2	M70 F99	M70-F96 HydrophobicContact CE-CB 3.64Å; M70-F96 HydrophobicContact SD-CB 4.08Å; M70-F96 HydrophobicContact SD-CG 4.43Å; F96-F99 PolarHBondContact O-N 3.01Å
97	V	64.8	Low	58.9	Low	14 Å²	14	85.6 Å²	85.6	9%	0.085	43%	0.427	C	S	.	.	H	α-helix	trans	-68.9	-48.4	-168.4	-175.7	0	0	0	0	112.1	Y60 Y65 M70 F99	Y60-V97 HydrophobicContact CD1-CG1 3.97Å; Y60-V97 HydrophobicContact CE1-CG1 3.63Å; Y60-V97 VanDerWaalsContact CE1-O 3.31Å; Y60-V97 WeakPolarHBondContact CE1-O 3.32Å; Y60-V97 HydrophobicContact CE2-CG1 4.42Å; Y60-V97 HydrophobicContact CG-CG1 4.5Å; Y60-V97 WeakPolarHBondContact O-CG1 3.41Å; Y65-V97 HydrophobicContact CD2-CG1 4.31Å; Y65-V97 HydrophobicContact CD2-CG2 3.73Å; Y65-V97 HydrophobicContact CE2-CG1 3.95Å; Y65-V97 HydrophobicContact CE2-CG2 4.22Å; M70-V97 HydrophobicContact CE-CG2 4.37Å; V97-F99 VanDerWaalsContact C-N 3.33Å; V97-F99 PolarHBondContact O-N 3.32Å
98	G	72.9	Confident	59.9	Low	4 Å²	4	77.6 Å²	77.6	4%	0.041	40%	0.398	C	S	.	.	H	α-helix	trans	-71.3	-25.7	179.8	0	0	0	0	0	114.2	L101 Y102	G98-L101 PolarHBondContact O-N 2.85Å; G98-Y102 PolarHBondContact O-N 2.9Å; G98-Y102 VanDerWaalsContact O-N 3.07Å
99	F	79.4	Confident	61.2	Low	98 Å²	98	73.4 Å²	73.4	43%	0.43	38%	0.381	S	S	.	.	H	α-helix	trans	-62.3	-48	-177.7	-178.6	-97.4	0	0	0	112.3	F96 V97 L101 Y102 Y103 W159	F96-F99 PolarHBondContact O-N 3.01Å; V97-F99 VanDerWaalsContact C-N 3.33Å; V97-F99 PolarHBondContact O-N 3.32Å; F99-L101 VanDerWaalsContact C-N 3.32Å; F99-L101 PolarHBondContact O-N 2.99Å; F99-Y102 PolarHBondContact O-N 2.62Å; F99-Y103 HydrophobicContact CE1-CG 4.49Å; F99-Y103 WeakPolarHBondContact O-CB 3.47Å; F99-Y103 PolarHBondContact O-N 3.11Å; F99-W159 HydrophobicContact CB-CH2 4.12Å; F99-W159 HydrophobicContact CB-CZ2 3.57Å; F99-W159 HydrophobicContact CD2-CH2 4Å; F99-W159 HydrophobicContact CD2-CZ2 4Å; F99-W159 HydrophobicContact CG-CZ2 4.3Å
100	E	76.8	Confident	62.5	Low	50 Å²	50	67.6 Å²	67.6	23%	0.234	35%	0.351	C	S	.	.	H	α-helix	trans	-63.2	-38.8	-178.2	-179.5	63.6	-165.1	0	0	111.6	V25 R104	V25-E100 HydrophobicContact CG1-CG 4.44Å; V25-E100 HydrophobicContact CG2-CG 3.82Å; E100-R104 WeakPolarHBondContact O-CB 3.4Å; E100-R104 VanDerWaalsContact O-CG 3.23Å; E100-R104 WeakPolarHBondContact O-CG 3.3Å; E100-R104 PolarHBondContact O-N 2.8Å; E100-R104 IonicContact OE1-CZ 3.21Å; E100-R104 IonicContact OE1-NE 2.91Å; E100-R104 PolarHBondContact OE1-NE 3.2Å; E100-R104 IonicContact OE1-NH2 2.84Å; E100-R104 PolarHBondContact OE1-NH2 3.12Å; E100-R104 VanDerWaalsContact OE1-NH2 3.17Å
101	L	81.6	Confident	63.7	Low	1 Å²	1	62.3 Å²	62.3	1%	0.005	31%	0.314	C	S	.	.	H	α-helix	trans	-68.3	-46.9	178	-174.7	61.3	0	0	0	112	L28 W29 L32 V57 Y60 G98 F99 R104 M105 L155	L28-L101 HydrophobicContact CD2-CD1 3.93Å; L28-L101 HydrophobicContact CD2-CD2 3.96Å; L28-L101 HydrophobicContact CG-CD1 4.38Å; W29-L101 HydrophobicContact CE3-CD1 4.25Å; L32-L101 HydrophobicContact CD2-CD1 3.93Å; V57-L101 HydrophobicContact CG1-CD2 4.29Å; Y60-L101 HydrophobicContact CD1-CD2 4.29Å; Y60-L101 HydrophobicContact CE1-CB 4.19Å; G98-L101 PolarHBondContact O-N 2.85Å; F99-L101 VanDerWaalsContact C-N 3.32Å; F99-L101 PolarHBondContact O-N 2.99Å; L101-R104 PolarHBondContact O-N 3.43Å; L101-M105 WeakPolarHBondContact O-CG 3.26Å; L101-M105 PolarHBondContact O-N 3.2Å; L101-L155 HydrophobicContact CD2-CD1 4.45Å; L101-L155 HydrophobicContact CD2-CD2 4.14Å; L101-L155 HydrophobicContact CG-CD2 4.33Å
102	Y	84.7	Confident	64.8	Low	2 Å²	2	57.3 Å²	57.3	1%	0.008	28%	0.283	C	S	.	.	H	α-helix	trans	-62.9	-45.1	176.4	179.6	-93.6	0	0	0	111.8	G98 F99 R104 M105 Q106 W159 I160 I171 L172 L177	G98-Y102 PolarHBondContact O-N 2.9Å; G98-Y102 VanDerWaalsContact O-N 3.07Å; F99-Y102 PolarHBondContact O-N 2.62Å; Y102-R104 VanDerWaalsContact C-N 3.31Å; Y102-R104 PolarHBondContact O-N 2.66Å; Y102-M105 WeakPolarHBondContact O-CB 3.48Å; Y102-M105 PolarHBondContact O-N 3.41Å; Y102-M105 VanDerWaalsContact O-N 3.09Å; Y102-Q106 PolarHBondContact O-N 2.93Å; Y102-W159 HydrophobicContact CD1-CZ3 4.23Å; Y102-W159 HydrophobicContact CD2-CZ3 4.4Å; Y102-W159 AromaticContact CG-CZ3 3.81Å; Y102-W159 HydrophobicContact CG-CZ3 3.81Å; Y102-I160 HydrophobicContact CD2-CD1 3.79Å; Y102-I160 HydrophobicContact CD2-CG1 4.12Å; Y102-I160 HydrophobicContact CE2-CD1 4.09Å; Y102-I171 HydrophobicContact CD1-CD1 3.83Å; Y102-I171 HydrophobicContact CE1-CD1 3.42Å; Y102-I171 VanDerWaalsContact CE1-CD1 3.42Å; Y102-I171 HydrophobicContact CE1-CG2 4.35Å; Y102-I171 HydrophobicContact CE2-CG2 4.36Å; Y102-L172 VanDerWaalsContact CE2-O 3.23Å; Y102-L172 WeakPolarHBondContact CE2-O 3.24Å; Y102-L172 PolarHBondContact OH-N 3.05Å; Y102-L172 PolarHBondContact OH-O 2.67Å; Y102-L177 HydrophobicContact CE2-CD2 4Å
103	Y	81.2	Confident	66.2	Low	82 Å²	82	57.4 Å²	57.4	32%	0.322	28%	0.278	S	S	.	.	H	α-helix	trans	-62.7	-36.9	177.7	-177.3	-111.1	0	0	0	112	F99 Q106 R107	F99-Y103 HydrophobicContact CE1-CG 4.49Å; F99-Y103 WeakPolarHBondContact O-CB 3.47Å; F99-Y103 PolarHBondContact O-N 3.11Å; Y103-Q106 PolarHBondContact O-N 3.38Å; Y103-R107 VanDerWaalsContact CZ-CD 3.41Å; Y103-R107 WeakPolarHBondContact O-CB 3.33Å; Y103-R107 PolarHBondContact O-N 3.33Å; Y103-R107 WeakPolarHBondContact OH-CD 3.06Å; Y103-R107 PolarHBondContact OH-NH1 3.42Å
104	R	79	Confident	67.5	Low	47 Å²	47	55.7 Å²	55.7	18%	0.177	26%	0.261	C	S	.	.	H	α-helix	trans	-63.4	-45.3	170	-76.4	174.5	-178.2	-137.5	-0.2	111.8	D26 W29 E100 L101 Y102 Q106 S108	D26-R104 IonicContact OD1-CZ 2.78Å; D26-R104 IonicContact OD1-NH1 3.49Å; D26-R104 PolarHBondContact OD1-NH1 3.21Å; D26-R104 IonicContact OD1-NH2 3.28Å; D26-R104 PolarHBondContact OD1-NH2 3.25Å; W29-R104 HydrophobicContact CD2-CB 3.89Å; W29-R104 HydrophobicContact CD2-CG 4.47Å; W29-R104 HydrophobicContact CE3-CB 3.82Å; W29-R104 HydrophobicContact CH2-CB 4.35Å; W29-R104 HydrophobicContact CZ2-CB 4.39Å; W29-R104 HydrophobicContact CZ3-CB 4.05Å; E100-R104 WeakPolarHBondContact O-CB 3.4Å; E100-R104 VanDerWaalsContact O-CG 3.23Å; E100-R104 WeakPolarHBondContact O-CG 3.3Å; E100-R104 PolarHBondContact O-N 2.8Å; E100-R104 IonicContact OE1-CZ 3.21Å; E100-R104 IonicContact OE1-NE 2.91Å; E100-R104 PolarHBondContact OE1-NE 3.2Å; E100-R104 IonicContact OE1-NH2 2.84Å; E100-R104 PolarHBondContact OE1-NH2 3.12Å; E100-R104 VanDerWaalsContact OE1-NH2 3.17Å; L101-R104 PolarHBondContact O-N 3.43Å; Y102-R104 VanDerWaalsContact C-N 3.31Å; Y102-R104 PolarHBondContact O-N 2.66Å; R104-Q106 PolarHBondContact O-N 3.31Å; R104-S108 WeakPolarHBondContact O-CB 3.1Å; R104-S108 PolarHBondContact O-N 3.34Å; R104-S108 PolarHBondContact O-OG 3.34Å
105	M	78.5	Confident	68.4	Low	6 Å²	6	52.8 Å²	52.8	3%	0.03	24%	0.24	C	C	.	.	H	α-helix	trans	-58.2	-46.6	175.5	-70.3	178.6	69.6	0	0	112.2	W29 L32 L101 Y102 S108 I148 L155 V174	W29-M105 HydrophobicContact CH2-CG 4.26Å; W29-M105 HydrophobicContact CZ3-CG 3.71Å; L32-M105 HydrophobicContact CD2-SD 4.44Å; L101-M105 WeakPolarHBondContact O-CG 3.26Å; L101-M105 PolarHBondContact O-N 3.2Å; Y102-M105 WeakPolarHBondContact O-CB 3.48Å; Y102-M105 PolarHBondContact O-N 3.41Å; Y102-M105 VanDerWaalsContact O-N 3.09Å; M105-S108 PolarHBondContact O-OG 2.9Å; M105-I148 HydrophobicContact CE-CG2 4.32Å; M105-L155 HydrophobicContact SD-CD2 4.4Å; M105-V174 HydrophobicContact CE-CB 4.42Å; M105-V174 HydrophobicContact CE-CG1 3.63Å; M105-V174 HydrophobicContact CE-CG2 3.85Å; M105-V174 HydrophobicContact SD-CG2 4.44Å
106	Q	75.9	Confident	69.2	Low	93 Å²	93	53.2 Å²	53.2	44%	0.435	24%	0.244	S	C	.	.	H	α-helix	trans	-66.8	-47	179.3	-171.9	-176.4	38	0	0	112.9	Y102 Y103 R104 L177	Y102-Q106 PolarHBondContact O-N 2.93Å; Y103-Q106 PolarHBondContact O-N 3.38Å; R104-Q106 PolarHBondContact O-N 3.31Å; Q106-L177 HydrophobicContact CB-CD2 4.39Å; Q106-L177 HydrophobicContact CG-CD1 4.22Å
107	R	68.5	Low	69.9	Low	178 Å²	178	49.8 Å²	49.8	67%	0.672	24%	0.235	S	C	*	.	H	α-helix	trans	-86.6	-26.2	-170.8	-173.3	173.3	178.5	105.7	8.7	114.4	Y103 N109	Y103-R107 VanDerWaalsContact CZ-CD 3.41Å; Y103-R107 WeakPolarHBondContact O-CB 3.33Å; Y103-R107 PolarHBondContact O-N 3.33Å; Y103-R107 WeakPolarHBondContact OH-CD 3.06Å; Y103-R107 PolarHBondContact OH-NH1 3.42Å; R107-N109 PolarHBondContact O-N 3.32Å; R107-N109 VanDerWaalsContact O-N 3.16Å
108	S	56.9	Low	70.3	Confident	47 Å²	47	49.7 Å²	49.7	33%	0.329	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.4	-4.2	-175.7	61.9	0	0	0	0	114.9	W29 R104 M105 S110	W29-S108 WeakPolarHBondContact CH2-OG 3.2Å; W29-S108 WeakPolarHBondContact CZ2-OG 3.5Å; R104-S108 WeakPolarHBondContact O-CB 3.1Å; R104-S108 PolarHBondContact O-N 3.34Å; R104-S108 PolarHBondContact O-OG 3.34Å; M105-S108 PolarHBondContact O-OG 2.9Å; S108-S110 WeakPolarHBondContact CB-OG 3.4Å; S108-S110 PolarHBondContact O-N 3.43Å; S108-S110 VanDerWaalsContact O-N 3.11Å; S108-S110 WeakPolarHBondContact OG-CB 3.4Å; S108-S110 PolarHBondContact OG-N 3.45Å; S108-S110 PolarHBondContact OG-OG 3.22Å
109	N	56.9	Low	70.1	Confident	80 Å²	80	52.4 Å²	52.4	43%	0.428	25%	0.245	S	C	.	.			trans	56.9	16.8	-169.9	-104.7	11.2	0	0	0	113.4	R107 V111 A112 F113	R107-N109 PolarHBondContact O-N 3.32Å; R107-N109 VanDerWaalsContact O-N 3.16Å; N109-V111 PolarHBondContact O-N 3.47Å; N109-A112 HydrophobicContact CB-CB 4.12Å; N109-A112 CarbonylContact O-C 3.59Å; N109-A112 WeakPolarHBondContact O-CA 3.41Å; N109-A112 PolarHBondContact O-N 2.97Å; N109-F113 PolarHBondContact O-N 3.2Å
110	S	55.1	Low	69.8	Low	14 Å²	14	54.1 Å²	54.1	10%	0.098	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-29.4	-173.5	-62.3	0	0	0	0	113.4	W29 S108	W29-S110 WeakPolarHBondContact CH2-OG 3.37Å; W29-S110 WeakPolarHBondContact CZ2-OG 3.27Å; S108-S110 WeakPolarHBondContact CB-OG 3.4Å; S108-S110 PolarHBondContact O-N 3.43Å; S108-S110 VanDerWaalsContact O-N 3.11Å; S108-S110 WeakPolarHBondContact OG-CB 3.4Å; S108-S110 PolarHBondContact OG-N 3.45Å; S108-S110 PolarHBondContact OG-OG 3.22Å
111	V	56.6	Low	69.7	Low	10 Å²	10	58.4 Å²	58.4	6%	0.061	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.9	-29.7	171.9	175.8	0	0	0	0	112	Y40 N109 Y141 A178 T181	Y40-V111 HydrophobicContact CE2-CB 4.5Å; Y40-V111 HydrophobicContact CE2-CG1 4.4Å; Y40-V111 HydrophobicContact CE2-CG2 4.33Å; N109-V111 PolarHBondContact O-N 3.47Å; V111-Y141 HydrophobicContact CG1-CE2 4.36Å; V111-Y141 WeakPolarHBondContact CG1-OH 3.45Å; V111-A178 HydrophobicContact CG1-CB 3.91Å; V111-T181 HydrophobicContact CG1-CG2 4.16Å
112	A	58	Low	69.3	Low	2 Å²	2	58.4 Å²	58.4	2%	0.017	27%	0.273	C	S	.	.	H	α-helix	trans	-81.8	-11.3	178	0	0	0	0	0	114.1	N109 Y114 S115 I116 T181	N109-A112 HydrophobicContact CB-CB 4.12Å; N109-A112 CarbonylContact O-C 3.59Å; N109-A112 WeakPolarHBondContact O-CA 3.41Å; N109-A112 PolarHBondContact O-N 2.97Å; A112-Y114 PolarHBondContact O-N 2.69Å; A112-S115 WeakPolarHBondContact CA-OG 3.38Å; A112-S115 PolarHBondContact O-N 3.13Å; A112-S115 PolarHBondContact O-OG 3.19Å; A112-S115 VanDerWaalsContact O-OG 3.09Å; A112-I116 PolarHBondContact O-N 2.72Å; A112-T181 HydrophobicContact CB-CG2 3.96Å
113	F	65.8	Low	68.8	Low	135 Å²	135	63.2 Å²	63.2	59%	0.592	30%	0.295	S	S	*	.	H	α-helix	trans	-58.5	-31.3	176.1	-176.1	-96.2	0	0	0	112	M37 N109 P117	M37-F113 HydrophobicContact CE-CE1 3.94Å; M37-F113 HydrophobicContact CE-CZ 4.01Å; N109-F113 PolarHBondContact O-N 3.2Å; F113-P117 WeakPolarHBondContact O-CD 3.26Å
114	Y	69	Low	68.7	Low	39 Å²	39	65.7 Å²	65.7	15%	0.153	31%	0.314	C	S	.	.	H	α-helix	trans	-80	-41.8	174.9	-167.3	-91.5	0	0	0	112.8	Y40 A112 I116 P117 V118 E137 K140 Y141	Y40-Y114 HydrophobicContact CD1-CD2 4.46Å; Y40-Y114 HydrophobicContact CD1-CG 4.25Å; Y40-Y114 WeakPolarHBondContact O-CD2 3.25Å; Y40-Y114 WeakPolarHBondContact O-CE2 3.3Å; A112-Y114 PolarHBondContact O-N 2.69Å; Y114-I116 PolarHBondContact O-N 3.18Å; Y114-P117 WeakPolarHBondContact O-CD 3.23Å; Y114-V118 HydrophobicContact CD1-CG2 3.97Å; Y114-V118 HydrophobicContact CE1-CG2 3.68Å; Y114-V118 VanDerWaalsContact O-CG2 3.28Å; Y114-V118 WeakPolarHBondContact O-CG2 3.15Å; Y114-V118 PolarHBondContact O-N 3.18Å; Y114-E137 WeakPolarHBondContact CE1-OE2 3.48Å; Y114-E137 VanDerWaalsContact CZ-OE2 3.3Å; Y114-E137 PolarHBondContact OH-OE2 2.76Å; Y114-K140 WeakPolarHBondContact OH-CD 3.28Å; Y114-Y141 AromaticContact CD1-CD2 3.88Å; Y114-Y141 HydrophobicContact CD1-CD2 3.88Å
115	S	65.1	Low	68.7	Low	1 Å²	1	66 Å²	66	1%	0.007	32%	0.318	C	S	.	.	H	α-helix	trans	-72	-28	-171.9	58.6	0	0	0	0	114.3	A112 F119	A112-S115 WeakPolarHBondContact CA-OG 3.38Å; A112-S115 PolarHBondContact O-N 3.13Å; A112-S115 PolarHBondContact O-OG 3.19Å; A112-S115 VanDerWaalsContact O-OG 3.09Å; S115-F119 WeakPolarHBondContact O-CB 3.47Å; S115-F119 PolarHBondContact O-N 3.37Å
116	I	68.3	Low	68.9	Low	84 Å²	84	71.5 Å²	71.5	43%	0.431	35%	0.347	S	S	.	.	H	α-helix	trans	-71.7	-48.3	-176.9	-66.5	167.9	0	0	0	112.4	A112 Y114 F119 Q120	A112-I116 PolarHBondContact O-N 2.72Å; Y114-I116 PolarHBondContact O-N 3.18Å; I116-F119 PolarHBondContact O-N 2.97Å; I116-Q120 PolarHBondContact O-N 3.46Å
117	P	72.6	Confident	69.1	Low	59 Å²	59	70.6 Å²	70.6	38%	0.383	35%	0.345	S	S	.	.	H	α-helix	trans	-61.9	-40.9	172.3	-24.6	35	0	0	0	112.8	F113 Y114 F119 Q120 F121	F113-P117 WeakPolarHBondContact O-CD 3.26Å; Y114-P117 WeakPolarHBondContact O-CD 3.23Å; P117-F119 VanDerWaalsContact C-N 3.29Å; P117-F119 PolarHBondContact O-N 3.29Å; P117-Q120 PolarHBondContact O-N 2.94Å; P117-Q120 VanDerWaalsContact O-N 3.07Å; P117-F121 WeakPolarHBondContact O-CD2 3.18Å; P117-F121 PolarHBondContact O-N 3.08Å
118	V	72.7	Confident	69.8	Low	12 Å²	12	66.5 Å²	66.5	7%	0.073	33%	0.333	C	S	.	.	H	α-helix	trans	-60.5	-37.9	178.6	170.1	0	0	0	0	111.8	Y114 Q120 F121 A122 F133 E137 F186	Y114-V118 HydrophobicContact CD1-CG2 3.97Å; Y114-V118 HydrophobicContact CE1-CG2 3.68Å; Y114-V118 VanDerWaalsContact O-CG2 3.28Å; Y114-V118 WeakPolarHBondContact O-CG2 3.15Å; Y114-V118 PolarHBondContact O-N 3.18Å; V118-Q120 PolarHBondContact O-N 2.86Å; V118-F121 PolarHBondContact O-N 2.86Å; V118-A122 PolarHBondContact O-N 3.32Å; V118-A122 VanDerWaalsContact O-N 3.09Å; V118-F133 HydrophobicContact CG1-CE1 3.86Å; V118-F133 HydrophobicContact CG1-CZ 4.08Å; V118-E137 HydrophobicContact CG1-CB 4Å; V118-E137 HydrophobicContact CG1-CG 3.91Å; V118-F186 HydrophobicContact CG1-CD2 4.46Å; V118-F186 HydrophobicContact CG1-CE2 3.82Å; V118-F186 HydrophobicContact CG1-CZ 4.02Å
119	F	70.3	Confident	71.1	Confident	61 Å²	61	70 Å²	70	27%	0.268	35%	0.348	S	S	.	.	H	α-helix	trans	-59.9	-42.3	172.4	175.3	-103.6	0	0	0	113.2	S115 I116 P117 F121 A122 H123 F186 V189	S115-F119 WeakPolarHBondContact O-CB 3.47Å; S115-F119 PolarHBondContact O-N 3.37Å; I116-F119 PolarHBondContact O-N 2.97Å; P117-F119 VanDerWaalsContact C-N 3.29Å; P117-F119 PolarHBondContact O-N 3.29Å; F119-F121 VanDerWaalsContact C-N 3.3Å; F119-F121 PolarHBondContact O-N 2.93Å; F119-A122 PolarHBondContact O-N 2.91Å; F119-H123 PolarHBondContact O-N 3.05Å; F119-F186 HydrophobicContact CB-CD2 4.06Å; F119-F186 HydrophobicContact CB-CE2 4.43Å; F119-F186 HydrophobicContact CD2-CD2 4.37Å; F119-V189 HydrophobicContact CD2-CB 4.49Å; F119-V189 HydrophobicContact CD2-CG1 4.48Å; F119-V189 HydrophobicContact CE2-CB 3.85Å; F119-V189 HydrophobicContact CE2-CG1 3.44Å; F119-V189 VanDerWaalsContact CE2-CG1 3.44Å; F119-V189 HydrophobicContact CZ-CG1 3.68Å
120	Q	72	Confident	72.6	Confident	133 Å²	133	66.3 Å²	66.3	62%	0.621	33%	0.329	S	S	*	.	H	α-helix	trans	-65	-32.6	-179	-68.3	-179.6	-36.7	0	0	112.6	I116 P117 V118	I116-Q120 PolarHBondContact O-N 3.46Å; P117-Q120 PolarHBondContact O-N 2.94Å; P117-Q120 VanDerWaalsContact O-N 3.07Å; V118-Q120 PolarHBondContact O-N 2.86Å
121	F	74.9	Confident	74.1	Confident	141 Å²	141	65.7 Å²	65.7	62%	0.618	32%	0.324	S	S	*	.	H	α-helix	trans	-77.8	-34.4	173.9	-76.8	-77.1	0	0	0	113.4	P117 V118 F119 H123 F133	P117-F121 WeakPolarHBondContact O-CD2 3.18Å; P117-F121 PolarHBondContact O-N 3.08Å; V118-F121 PolarHBondContact O-N 2.86Å; F119-F121 VanDerWaalsContact C-N 3.3Å; F119-F121 PolarHBondContact O-N 2.93Å; F121-H123 VanDerWaalsContact C-N 3.35Å; F121-H123 PolarHBondContact O-N 3.41Å; F121-F133 HydrophobicContact CB-CE2 4.1Å; F121-F133 HydrophobicContact CB-CZ 3.74Å
122	A	73.6	Confident	75.6	Confident	1 Å²	1	70.2 Å²	70.2	1%	0.008	35%	0.345	C	S	.	.	H	α-helix	trans	-69.5	-30.3	-178.6	0	0	0	0	0	113.6	V118 F119 D124 M125 L130 F133 F186 I190	V118-A122 PolarHBondContact O-N 3.32Å; V118-A122 VanDerWaalsContact O-N 3.09Å; F119-A122 PolarHBondContact O-N 2.91Å; A122-D124 PolarHBondContact O-N 3.01Å; A122-M125 PolarHBondContact O-N 3.35Å; A122-L130 HydrophobicContact CB-CD1 4.43Å; A122-F133 HydrophobicContact CB-CD1 3.97Å; A122-F133 HydrophobicContact CB-CE1 3.73Å; A122-F186 HydrophobicContact CB-CE2 3.96Å; A122-F186 HydrophobicContact CB-CZ 4.2Å; A122-I190 HydrophobicContact CB-CD1 3.54Å
123	H	73.8	Confident	77.1	Confident	103 Å²	103	71.8 Å²	71.8	48%	0.477	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-30.2	-173.5	-179.6	-83.1	0	0	0	114.1	F119 F121	F119-H123 PolarHBondContact O-N 3.05Å; F121-H123 VanDerWaalsContact C-N 3.35Å; F121-H123 PolarHBondContact O-N 3.41Å
124	D	78.5	Confident	78.2	Confident	133 Å²	133	65.5 Å²	65.5	71%	0.711	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.8	3.6	-173.9	-62.2	-15	0	0	0	113.1	A122	A122-D124 PolarHBondContact O-N 3.01Å
125	M	80.6	Confident	79	Confident	55 Å²	55	64 Å²	64	27%	0.271	32%	0.318	S	S	.	.			trans	-96.7	149.5	179.4	-62.6	-175.9	-179.3	0	0	111.8	A122 L130 F133	A122-M125 PolarHBondContact O-N 3.35Å; M125-L130 HydrophobicContact CB-CB 4.05Å; M125-L130 HydrophobicContact CB-CD1 4.33Å; M125-F133 HydrophobicContact CE-CD2 3.66Å; M125-F133 HydrophobicContact CE-CE2 4.08Å; M125-F133 HydrophobicContact CE-CG 4.13Å; M125-F133 HydrophobicContact SD-CB 3.48Å; M125-F133 WeakPolarHBondContact SD-CB 3.39Å; M125-F133 HydrophobicContact SD-CD1 4.21Å; M125-F133 HydrophobicContact SD-CD2 3.71Å; M125-F133 HydrophobicContact SD-CG 3.53Å; M125-F133 VanDerWaalsContact SD-CG 3.53Å
126	L	80.8	Confident	80	Confident	121 Å²	121	66.5 Å²	66.5	63%	0.634	33%	0.333	S	S	*	.			trans	-128.5	158	-176.5	-65.1	174.4	0	0	0	111.7	E128 D129 L130	L126-E128 PolarHBondContact O-N 3.27Å; L126-D129 PolarHBondContact O-N 3.31Å; L126-L130 PolarHBondContact O-N 2.91Å
127	D	80.6	Confident	80.9	Confident	73 Å²	73	63.2 Å²	63.2	39%	0.39	32%	0.316	S	S	.	.	H	α-helix	trans	44.6	-123.4	171.8	-62.7	-43.5	0	0	0	114.1	L130 V131 A197 K200	D127-L130 PolarHBondContact O-N 3.5Å; D127-V131 PolarHBondContact O-N 3.09Å; D127-A197 WeakPolarHBondContact O-CB 3.36Å; D127-K200 VanDerWaalsContact OD1-CD 3.25Å; D127-K200 WeakPolarHBondContact OD1-CD 3.33Å; D127-K200 IonicContact OD1-NZ 3.54Å; D127-K200 PolarHBondContact OD1-NZ 2.83Å; D127-K200 IonicContact OD2-NZ 2.74Å; D127-K200 PolarHBondContact OD2-NZ 3.28Å
128	E	83.6	Confident	81.6	Confident	92 Å²	92	60.8 Å²	60.8	43%	0.43	30%	0.3	S	S	.	.	H	α-helix	trans	-68.9	-33.8	-174.3	-168.4	171.7	-171.1	0	0	112.9	L126 L130 V131 H132 L201 L215	L126-E128 PolarHBondContact O-N 3.27Å; E128-L130 VanDerWaalsContact C-N 3.31Å; E128-L130 PolarHBondContact O-N 2.89Å; E128-V131 PolarHBondContact O-N 3.39Å; E128-H132 WeakPolarHBondContact O-CB 3.5Å; E128-H132 PolarHBondContact O-N 2.93Å; E128-L201 HydrophobicContact CB-CD2 4.46Å; E128-L201 HydrophobicContact CG-CD2 4.47Å; E128-L215 HydrophobicContact CG-CD1 3.86Å
129	D	84.9	Confident	82.3	Confident	121 Å²	121	64 Å²	64	65%	0.647	32%	0.32	S	S	*	.	H	α-helix	trans	-61.7	-40.9	176.3	-70.2	-39.7	0	0	0	111.1	L126 H132 F133	L126-D129 PolarHBondContact O-N 3.31Å; D129-H132 PolarHBondContact O-N 3.44Å; D129-F133 WeakPolarHBondContact O-CB 3.43Å; D129-F133 PolarHBondContact O-N 3.5Å
130	L	87.6	Confident	83	Confident	3 Å²	3	64.6 Å²	64.6	2%	0.016	32%	0.322	C	S	.	.	H	α-helix	trans	-63.3	-44	175.5	174.1	61.9	0	0	0	111.6	A122 M125 L126 D127 E128 F133 F134 I190 Q193 I194	A122-L130 HydrophobicContact CB-CD1 4.43Å; M125-L130 HydrophobicContact CB-CB 4.05Å; M125-L130 HydrophobicContact CB-CD1 4.33Å; L126-L130 PolarHBondContact O-N 2.91Å; D127-L130 PolarHBondContact O-N 3.5Å; E128-L130 VanDerWaalsContact C-N 3.31Å; E128-L130 PolarHBondContact O-N 2.89Å; L130-F133 PolarHBondContact O-N 2.63Å; L130-F134 WeakPolarHBondContact O-CB 3.45Å; L130-F134 PolarHBondContact O-N 2.83Å; L130-I190 HydrophobicContact CD1-CD1 3.78Å; L130-Q193 HydrophobicContact CD2-CB 3.72Å; L130-I194 HydrophobicContact CD2-CG1 4.23Å; L130-I194 HydrophobicContact CG-CG1 4.32Å
131	V	87.7	Confident	83.8	Confident	0 Å²	0	58.3 Å²	58.3	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-67.6	-43.3	179.3	-175.4	0	0	0	0	110.7	D127 E128 F134 T135 A197 V198 L201 L215 V219	D127-V131 PolarHBondContact O-N 3.09Å; E128-V131 PolarHBondContact O-N 3.39Å; V131-F134 PolarHBondContact O-N 3.39Å; V131-T135 HydrophobicContact CG1-CG2 4.34Å; V131-T135 WeakPolarHBondContact O-CG2 2.98Å; V131-T135 PolarHBondContact O-N 2.96Å; V131-T135 PolarHBondContact O-OG1 3.18Å; V131-A197 HydrophobicContact CG2-CB 3.64Å; V131-V198 HydrophobicContact CG1-CG2 4.4Å; V131-V198 HydrophobicContact CG2-CG2 4.13Å; V131-L201 HydrophobicContact CG2-CD1 4.48Å; V131-L215 HydrophobicContact CG1-CB 3.76Å; V131-V219 HydrophobicContact CG1-CG2 3.77Å
132	H	88.3	Confident	84.4	Confident	106 Å²	106	55.6 Å²	55.6	49%	0.491	28%	0.278	S	S	.	.	H	α-helix	trans	-62	-42.8	175.8	179.2	-88.6	0	0	0	112.4	E128 D129 T135 V136 L215	E128-H132 WeakPolarHBondContact O-CB 3.5Å; E128-H132 PolarHBondContact O-N 2.93Å; D129-H132 PolarHBondContact O-N 3.44Å; H132-T135 PolarHBondContact O-OG1 3.29Å; H132-V136 VanDerWaalsContact O-CG2 3.29Å; H132-V136 WeakPolarHBondContact O-CG2 3.11Å; H132-V136 PolarHBondContact O-N 3.12Å; H132-L215 HydrophobicContact CB-CD1 4.48Å; H132-L215 HydrophobicContact CB-CD2 4.31Å
133	F	88	Confident	85	Confident	35 Å²	35	60.7 Å²	60.7	15%	0.154	30%	0.3	C	S	.	.	H	α-helix	trans	-61.2	-46.6	174	-179	-93	0	0	0	111.7	V118 F121 A122 M125 D129 L130 T135 V136 E137	V118-F133 HydrophobicContact CG1-CE1 3.86Å; V118-F133 HydrophobicContact CG1-CZ 4.08Å; F121-F133 HydrophobicContact CB-CE2 4.1Å; F121-F133 HydrophobicContact CB-CZ 3.74Å; A122-F133 HydrophobicContact CB-CD1 3.97Å; A122-F133 HydrophobicContact CB-CE1 3.73Å; M125-F133 HydrophobicContact CE-CD2 3.66Å; M125-F133 HydrophobicContact CE-CE2 4.08Å; M125-F133 HydrophobicContact CE-CG 4.13Å; M125-F133 HydrophobicContact SD-CB 3.48Å; M125-F133 WeakPolarHBondContact SD-CB 3.39Å; M125-F133 HydrophobicContact SD-CD1 4.21Å; M125-F133 HydrophobicContact SD-CD2 3.71Å; M125-F133 HydrophobicContact SD-CG 3.53Å; M125-F133 VanDerWaalsContact SD-CG 3.53Å; D129-F133 WeakPolarHBondContact O-CB 3.43Å; D129-F133 PolarHBondContact O-N 3.5Å; L130-F133 PolarHBondContact O-N 2.63Å; F133-T135 PolarHBondContact O-N 3.23Å; F133-V136 PolarHBondContact O-N 3.22Å; F133-E137 HydrophobicContact CD1-CG 4.29Å; F133-E137 HydrophobicContact CD2-CG 4.48Å; F133-E137 HydrophobicContact CE1-CG 3.87Å; F133-E137 HydrophobicContact CE2-CG 4.1Å; F133-E137 HydrophobicContact CZ-CG 3.78Å; F133-E137 WeakPolarHBondContact O-CG 3.23Å; F133-E137 PolarHBondContact O-N 2.67Å
134	F	88.5	Confident	85.6	Confident	2 Å²	2	55.9 Å²	55.9	1%	0.009	28%	0.278	C	S	.	.	H	α-helix	trans	-58.5	-48.2	179.4	177.6	-94.4	0	0	0	112.9	L130 V131 E137 W138 W182 F186 L187 I194 V219 C222	L130-F134 WeakPolarHBondContact O-CB 3.45Å; L130-F134 PolarHBondContact O-N 2.83Å; V131-F134 PolarHBondContact O-N 3.39Å; F134-E137 PolarHBondContact O-N 3.19Å; F134-W138 VanDerWaalsContact O-CB 3.23Å; F134-W138 WeakPolarHBondContact O-CB 3.34Å; F134-W138 PolarHBondContact O-N 3.12Å; F134-W182 HydrophobicContact CE2-CZ2 4.26Å; F134-F186 AromaticContact CD2-CE1 3.54Å; F134-F186 HydrophobicContact CD2-CE1 3.54Å; F134-F186 HydrophobicContact CD2-CZ 4.2Å; F134-F186 HydrophobicContact CE2-CD1 4.24Å; F134-F186 AromaticContact CE2-CE1 3.69Å; F134-F186 HydrophobicContact CE2-CE1 3.69Å; F134-L187 HydrophobicContact CE2-CD1 4.12Å; F134-L187 HydrophobicContact CZ-CD1 4.18Å; F134-I194 HydrophobicContact CB-CD1 4.19Å; F134-I194 HydrophobicContact CD1-CD1 4.35Å; F134-I194 HydrophobicContact CD2-CD1 3.16Å; F134-I194 HydrophobicContact CE2-CD1 3.44Å; F134-I194 VanDerWaalsContact CE2-CD1 3.44Å; F134-I194 HydrophobicContact CG-CD1 3.66Å; F134-I194 HydrophobicContact CZ-CD1 4.13Å; F134-V219 HydrophobicContact CD1-CG2 3.82Å; F134-V219 HydrophobicContact CE1-CG2 4.01Å; F134-C222 HydrophobicContact CE1-CB 3.98Å; F134-C222 HydrophobicContact CZ-CB 4.14Å; F134-C222 VanDerWaalsContact CZ-SG 3.54Å
135	T	86.7	Confident	86	Confident	7 Å²	7	49.6 Å²	49.6	4%	0.043	25%	0.245	C	C	.	.	H	α-helix	trans	-68.1	-37.4	-176.1	55.7	0	0	0	0	112.1	V131 H132 F133 T139 L215 D218 V219	V131-T135 HydrophobicContact CG1-CG2 4.34Å; V131-T135 WeakPolarHBondContact O-CG2 2.98Å; V131-T135 PolarHBondContact O-N 2.96Å; V131-T135 PolarHBondContact O-OG1 3.18Å; H132-T135 PolarHBondContact O-OG1 3.29Å; F133-T135 PolarHBondContact O-N 3.23Å; T135-T139 WeakPolarHBondContact O-CB 3.34Å; T135-T139 PolarHBondContact O-N 3.25Å; T135-T139 PolarHBondContact O-OG1 2.9Å; T135-L215 HydrophobicContact CG2-CD2 4.25Å; T135-D218 HydrophobicContact CG2-CB 3.45Å; T135-D218 VanDerWaalsContact CG2-CB 3.45Å; T135-V219 HydrophobicContact CG2-CG2 4.17Å
136	V	86.7	Confident	86.4	Confident	54 Å²	54	51.8 Å²	51.8	33%	0.327	25%	0.253	S	S	.	.	H	α-helix	trans	-62.9	-48.7	173.3	169.3	0	0	0	0	111.4	H132 F133 T139 K140	H132-V136 VanDerWaalsContact O-CG2 3.29Å; H132-V136 WeakPolarHBondContact O-CG2 3.11Å; H132-V136 PolarHBondContact O-N 3.12Å; F133-V136 PolarHBondContact O-N 3.22Å; V136-T139 PolarHBondContact O-N 2.66Å; V136-K140 HydrophobicContact CG1-CD 4.41Å; V136-K140 WeakPolarHBondContact O-CG 3.44Å; V136-K140 PolarHBondContact O-N 2.72Å; V136-K140 VanDerWaalsContact O-N 3.14Å
137	E	86.4	Confident	86.7	Confident	16 Å²	16	48.6 Å²	48.6	8%	0.075	24%	0.236	C	C	.	.	H	α-helix	trans	-71.1	-38.5	-178.2	-68.8	-54.3	132.7	0	0	112.9	Y114 V118 F133 F134 T139 K140 Y141 W182	Y114-E137 WeakPolarHBondContact CE1-OE2 3.48Å; Y114-E137 VanDerWaalsContact CZ-OE2 3.3Å; Y114-E137 PolarHBondContact OH-OE2 2.76Å; V118-E137 HydrophobicContact CG1-CB 4Å; V118-E137 HydrophobicContact CG1-CG 3.91Å; F133-E137 HydrophobicContact CD1-CG 4.29Å; F133-E137 HydrophobicContact CD2-CG 4.48Å; F133-E137 HydrophobicContact CE1-CG 3.87Å; F133-E137 HydrophobicContact CE2-CG 4.1Å; F133-E137 HydrophobicContact CZ-CG 3.78Å; F133-E137 WeakPolarHBondContact O-CG 3.23Å; F133-E137 PolarHBondContact O-N 2.67Å; F134-E137 PolarHBondContact O-N 3.19Å; E137-T139 VanDerWaalsContact C-N 3.35Å; E137-T139 PolarHBondContact O-N 2.59Å; E137-K140 PolarHBondContact O-N 3.32Å; E137-K140 IonicContact OE1-NZ 2.75Å; E137-K140 PolarHBondContact OE1-NZ 2.94Å; E137-Y141 WeakPolarHBondContact O-CB 3.46Å; E137-Y141 PolarHBondContact O-N 2.75Å; E137-W182 HydrophobicContact CB-CH2 4.09Å
138	W	88.4	Confident	86.9	Confident	8 Å²	8	45.2 Å²	45.2	3%	0.03	22%	0.218	C	C	.	.	H	α-helix	trans	-58.1	-46.8	171.4	173.2	-125.5	0	0	0	111.5	F134 K140 Y141 R142 L179 W182 C222 E225 L226	F134-W138 VanDerWaalsContact O-CB 3.23Å; F134-W138 WeakPolarHBondContact O-CB 3.34Å; F134-W138 PolarHBondContact O-N 3.12Å; W138-K140 PolarHBondContact O-N 3.35Å; W138-Y141 HydrophobicContact CZ3-CD1 4.43Å; W138-Y141 PolarHBondContact O-N 2.98Å; W138-R142 WeakPolarHBondContact O-CB 3.13Å; W138-R142 PolarHBondContact O-N 3.37Å; W138-L179 HydrophobicContact CH2-CD2 3.83Å; W138-L179 HydrophobicContact CZ3-CD2 4.14Å; W138-W182 HydrophobicContact CB-CH2 4.47Å; W138-W182 HydrophobicContact CB-CZ2 3.92Å; W138-W182 AromaticContact CE3-CD1 3.81Å; W138-W182 AromaticContact CE3-CD2 3.94Å; W138-W182 HydrophobicContact CE3-CD2 3.94Å; W138-W182 AromaticContact CE3-CE2 3.51Å; W138-W182 HydrophobicContact CE3-CG 4.1Å; W138-W182 AromaticContact CE3-CZ2 3.94Å; W138-W182 HydrophobicContact CE3-CZ2 3.94Å; W138-W182 AromaticContact CE3-NE1 3.42Å; W138-W182 HydrophobicContact CZ3-CB 4.46Å; W138-W182 AromaticContact CZ3-CD1 3.58Å; W138-W182 HydrophobicContact CZ3-CD2 4.16Å; W138-W182 AromaticContact CZ3-CG 3.85Å; W138-W182 HydrophobicContact CZ3-CG 3.85Å; W138-W182 AromaticContact CZ3-NE1 3.7Å; W138-C222 HydrophobicContact CD2-CB 4.33Å; W138-C222 VanDerWaalsContact CD2-SG 3.56Å; W138-C222 HydrophobicContact CG-CB 4.38Å; W138-C222 HydrophobicContact CZ2-CB 4.28Å; W138-E225 HydrophobicContact CZ2-CB 4.37Å; W138-E225 HydrophobicContact CZ2-CG 4.45Å; W138-L226 HydrophobicContact CH2-CD1 4.46Å; W138-L226 HydrophobicContact CH2-CD2 3.78Å; W138-L226 HydrophobicContact CH2-CG 4.03Å; W138-L226 HydrophobicContact CZ3-CD2 4.17Å
139	T	86.4	Confident	87	Confident	80 Å²	80	42.8 Å²	42.8	49%	0.491	21%	0.207	S	C	.	.	H	α-helix	trans	-60.5	-43.3	179.2	-61.9	0	0	0	0	112	T135 V136 E137 F143	T135-T139 WeakPolarHBondContact O-CB 3.34Å; T135-T139 PolarHBondContact O-N 3.25Å; T135-T139 PolarHBondContact O-OG1 2.9Å; V136-T139 PolarHBondContact O-N 2.66Å; E137-T139 VanDerWaalsContact C-N 3.35Å; E137-T139 PolarHBondContact O-N 2.59Å; T139-F143 WeakPolarHBondContact O-CB 3.28Å; T139-F143 PolarHBondContact O-N 2.96Å; T139-F143 VanDerWaalsContact O-N 3.17Å
140	K	86.2	Confident	87.1	Confident	73 Å²	73	38 Å²	38	32%	0.317	19%	0.187	S	C	.	.	H	α-helix	trans	-61.7	-51.6	174.6	-69.1	169.7	-172.9	172.2	0	111.2	Y114 V136 E137 W138 F143 S144	Y114-K140 WeakPolarHBondContact OH-CD 3.28Å; V136-K140 HydrophobicContact CG1-CD 4.41Å; V136-K140 WeakPolarHBondContact O-CG 3.44Å; V136-K140 PolarHBondContact O-N 2.72Å; V136-K140 VanDerWaalsContact O-N 3.14Å; E137-K140 PolarHBondContact O-N 3.32Å; E137-K140 IonicContact OE1-NZ 2.75Å; E137-K140 PolarHBondContact OE1-NZ 2.94Å; W138-K140 PolarHBondContact O-N 3.35Å; K140-F143 PolarHBondContact O-N 3.12Å; K140-S144 WeakPolarHBondContact O-CB 3.39Å; K140-S144 PolarHBondContact O-N 2.83Å; K140-S144 PolarHBondContact O-OG 3.14Å
141	Y	87.5	Confident	87.1	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-62.8	-45.9	-176	-173.9	-94.9	0	0	0	112.7	Y40 V111 Y114 E137 W138 F143 S144 S145 A178 W182	Y40-Y141 HydrophobicContact CD1-CD2 4.18Å; Y40-Y141 HydrophobicContact CD1-CE2 4.44Å; Y40-Y141 AromaticContact CE1-CD2 3.65Å; Y40-Y141 HydrophobicContact CE1-CD2 3.65Å; Y40-Y141 AromaticContact CE1-CE2 3.67Å; Y40-Y141 HydrophobicContact CE1-CE2 3.67Å; Y40-Y141 HydrophobicContact CE1-CG 4.4Å; V111-Y141 HydrophobicContact CG1-CE2 4.36Å; V111-Y141 WeakPolarHBondContact CG1-OH 3.45Å; Y114-Y141 AromaticContact CD1-CD2 3.88Å; Y114-Y141 HydrophobicContact CD1-CD2 3.88Å; E137-Y141 WeakPolarHBondContact O-CB 3.46Å; E137-Y141 PolarHBondContact O-N 2.75Å; W138-Y141 HydrophobicContact CZ3-CD1 4.43Å; W138-Y141 PolarHBondContact O-N 2.98Å; Y141-F143 PolarHBondContact O-N 3.36Å; Y141-S144 PolarHBondContact O-N 2.83Å; Y141-S145 WeakPolarHBondContact O-CB 3.38Å; Y141-S145 PolarHBondContact O-N 2.9Å; Y141-S145 PolarHBondContact O-OG 2.84Å; Y141-A178 HydrophobicContact CE1-CB 4.48Å; Y141-A178 PolarHBondContact OH-O 2.82Å; Y141-W182 HydrophobicContact CD1-CB 4.15Å; Y141-W182 AromaticContact CD1-CD2 3.96Å; Y141-W182 HydrophobicContact CD1-CD2 3.96Å; Y141-W182 AromaticContact CD1-CE3 3.49Å; Y141-W182 HydrophobicContact CD1-CE3 3.49Å; Y141-W182 VanDerWaalsContact CD1-CE3 3.49Å; Y141-W182 HydrophobicContact CD1-CG 4.27Å; Y141-W182 HydrophobicContact CD1-CZ3 4.16Å; Y141-W182 AromaticContact CD2-CE3 3.73Å; Y141-W182 HydrophobicContact CD2-CE3 3.73Å; Y141-W182 AromaticContact CD2-CZ3 3.94Å; Y141-W182 HydrophobicContact CD2-CZ3 3.94Å; Y141-W182 HydrophobicContact CE1-CB 3.63Å; Y141-W182 HydrophobicContact CE1-CD2 4.28Å; Y141-W182 AromaticContact CE1-CE3 3.9Å; Y141-W182 HydrophobicContact CE1-CE3 3.9Å; Y141-W182 HydrophobicContact CE1-CG 4.23Å; Y141-W182 HydrophobicContact CE2-CE3 4.1Å; Y141-W182 HydrophobicContact CG-CD2 4.27Å; Y141-W182 AromaticContact CG-CE3 3.38Å; Y141-W182 HydrophobicContact CG-CE3 3.38Å; Y141-W182 AromaticContact CG-CZ3 3.62Å; Y141-W182 HydrophobicContact CG-CZ3 3.62Å
142	R	86.7	Confident	87.1	Confident	85 Å²	85	37.9 Å²	37.9	32%	0.321	19%	0.186	S	C	.	.	H	α-helix	trans	-59.2	-46.4	176.8	-173.8	-169.5	-175.2	-140.7	7.5	111.6	W138 K146 E225	W138-R142 WeakPolarHBondContact O-CB 3.13Å; W138-R142 PolarHBondContact O-N 3.37Å; R142-K146 PolarHBondContact O-N 3.2Å; R142-E225 WeakPolarHBondContact CD-OE2 3.36Å; R142-E225 IonicContact CZ-OE1 4Å; R142-E225 VanDerWaalsContact CZ-OE1 3.28Å; R142-E225 IonicContact CZ-OE2 3.35Å; R142-E225 IonicContact NE-OE1 3.51Å; R142-E225 PolarHBondContact NE-OE1 2.96Å; R142-E225 IonicContact NE-OE2 2.88Å; R142-E225 PolarHBondContact NE-OE2 2.99Å; R142-E225 VanDerWaalsContact NH2-CD 3.32Å; R142-E225 IonicContact NH2-OE1 3.12Å; R142-E225 PolarHBondContact NH2-OE1 2.79Å; R142-E225 IonicContact NH2-OE2 3.86Å; R142-E225 PolarHBondContact NH2-OE2 2.92Å
143	F	86.4	Confident	87	Confident	108 Å²	108	35 Å²	35	47%	0.474	18%	0.178	S	C	.	.	H	α-helix	trans	-63	-48.7	177.6	178.3	-83.7	0	0	0	111.9	T139 K140 Y141 S145 K146 I147	T139-F143 WeakPolarHBondContact O-CB 3.28Å; T139-F143 PolarHBondContact O-N 2.96Å; T139-F143 VanDerWaalsContact O-N 3.17Å; K140-F143 PolarHBondContact O-N 3.12Å; Y141-F143 PolarHBondContact O-N 3.36Å; F143-S145 VanDerWaalsContact C-N 3.29Å; F143-S145 PolarHBondContact O-N 2.85Å; F143-K146 PolarHBondContact O-N 2.91Å; F143-I147 HydrophobicContact CD1-CD1 4.07Å; F143-I147 HydrophobicContact CE1-CD1 3.31Å; F143-I147 HydrophobicContact CE1-CG1 4.11Å; F143-I147 HydrophobicContact CZ-CD1 3.85Å; F143-I147 PolarHBondContact O-N 3.42Å
144	S	87.6	Confident	86.9	Confident	2 Å²	2	35.4 Å²	35.4	1%	0.014	18%	0.179	C	C	.	.	H	α-helix	trans	-61	-39.3	-179.9	-70.1	0	0	0	0	111.9	I39 Y40 K140 Y141 K146 I147 I148	I39-S144 WeakPolarHBondContact CG2-O 3.23Å; I39-S144 PolarHBondContact O-OG 2.86Å; Y40-S144 VanDerWaalsContact CD1-CB 3.48Å; K140-S144 WeakPolarHBondContact O-CB 3.39Å; K140-S144 PolarHBondContact O-N 2.83Å; K140-S144 PolarHBondContact O-OG 3.14Å; Y141-S144 PolarHBondContact O-N 2.83Å; S144-K146 VanDerWaalsContact C-N 3.34Å; S144-K146 PolarHBondContact O-N 2.91Å; S144-I147 PolarHBondContact O-N 2.94Å; S144-I148 WeakPolarHBondContact O-CG1 3.3Å; S144-I148 PolarHBondContact O-N 3.22Å
145	S	87.5	Confident	86.8	Confident	1 Å²	1	35.4 Å²	35.4	1%	0.007	18%	0.179	C	C	.	.	H	α-helix	trans	-63.6	-35.5	177.5	-55.7	0	0	0	0	112.8	Y40 Y141 F143 I148 D149	Y40-S145 PolarHBondContact OH-OG 2.95Å; Y141-S145 WeakPolarHBondContact O-CB 3.38Å; Y141-S145 PolarHBondContact O-N 2.9Å; Y141-S145 PolarHBondContact O-OG 2.84Å; F143-S145 VanDerWaalsContact C-N 3.29Å; F143-S145 PolarHBondContact O-N 2.85Å; S145-I148 PolarHBondContact O-N 3.21Å; S145-D149 PolarHBondContact O-N 3.41Å
146	K	87.1	Confident	86.8	Confident	100 Å²	100	35.4 Å²	35.4	44%	0.435	18%	0.179	S	C	.	.	H	α-helix	trans	-67	-33	174.3	-68.4	-175.6	-178.6	-174.2	0	113.5	R142 F143 S144 G150 Y175	R142-K146 PolarHBondContact O-N 3.2Å; F143-K146 PolarHBondContact O-N 2.91Å; S144-K146 VanDerWaalsContact C-N 3.34Å; S144-K146 PolarHBondContact O-N 2.91Å; K146-G150 PolarHBondContact O-N 3.46Å; K146-Y175 HydrophobicContact CD-CE2 4.33Å; K146-Y175 WeakPolarHBondContact CE-OH 3.43Å; K146-Y175 HydrophobicContact CG-CD2 3.96Å; K146-Y175 HydrophobicContact CG-CE2 3.45Å; K146-Y175 VanDerWaalsContact CG-CE2 3.45Å
147	I	87.2	Confident	86.6	Confident	55 Å²	55	41.7 Å²	41.7	28%	0.282	20%	0.197	S	C	.	.	H	α-helix	trans	-68.1	-40.7	175.3	-66.2	-174.4	0	0	0	110.9	I39 Y50 F143 S144 G150 L151	I39-I147 HydrophobicContact CD1-CG2 3.73Å; I39-I147 HydrophobicContact CG1-CG2 4.04Å; I39-I147 HydrophobicContact CG2-CB 4Å; I39-I147 HydrophobicContact CG2-CG2 4.05Å; Y50-I147 HydrophobicContact CE2-CG2 3.95Å; F143-I147 HydrophobicContact CD1-CD1 4.07Å; F143-I147 HydrophobicContact CE1-CD1 3.31Å; F143-I147 HydrophobicContact CE1-CG1 4.11Å; F143-I147 HydrophobicContact CZ-CD1 3.85Å; F143-I147 PolarHBondContact O-N 3.42Å; S144-I147 PolarHBondContact O-N 2.94Å; I147-G150 PolarHBondContact O-N 2.92Å; I147-L151 PolarHBondContact O-N 3.4Å
148	I	86.2	Confident	86.3	Confident	2 Å²	2	45.1 Å²	45.1	1%	0.01	21%	0.212	C	C	.	.	H	α-helix	trans	-68.9	-38.9	-179.2	-64.9	164.6	0	0	0	110.9	L36 I39 Y40 M105 S144 S145 G150 L151 C152 V174	L36-I148 HydrophobicContact CD2-CB 4.24Å; L36-I148 HydrophobicContact CD2-CD1 3.74Å; L36-I148 HydrophobicContact CD2-CG1 3.75Å; L36-I148 HydrophobicContact CD2-CG2 3.44Å; L36-I148 VanDerWaalsContact CD2-CG2 3.44Å; I39-I148 HydrophobicContact CB-CD1 4.49Å; I39-I148 HydrophobicContact CB-CG1 4.35Å; I39-I148 HydrophobicContact CD1-CG1 4.01Å; I39-I148 HydrophobicContact CG2-CD1 4.04Å; I39-I148 HydrophobicContact CG2-CG1 3.88Å; Y40-I148 HydrophobicContact CD2-CD1 3.72Å; Y40-I148 HydrophobicContact CE1-CD1 4.34Å; Y40-I148 HydrophobicContact CE2-CD1 3.11Å; Y40-I148 VanDerWaalsContact CZ-CD1 3.47Å; M105-I148 HydrophobicContact CE-CG2 4.32Å; S144-I148 WeakPolarHBondContact O-CG1 3.3Å; S144-I148 PolarHBondContact O-N 3.22Å; S145-I148 PolarHBondContact O-N 3.21Å; I148-G150 VanDerWaalsContact C-N 3.31Å; I148-G150 PolarHBondContact O-N 3.13Å; I148-L151 WeakPolarHBondContact O-CB 3.39Å; I148-L151 PolarHBondContact O-N 2.86Å; I148-C152 WeakPolarHBondContact O-CB 3.46Å; I148-C152 PolarHBondContact O-N 2.81Å; I148-C152 PolarHBondContact O-SG 3.21Å; I148-V174 HydrophobicContact CG2-CG1 3.73Å
149	D	86.1	Confident	86	Confident	40 Å²	40	45.9 Å²	45.9	21%	0.214	22%	0.215	C	C	.	.	H	α-helix	trans	-58.7	-43	171.5	-165.5	75.4	0	0	0	111.8	S145 L151 C152 S153 N156 Y175	S145-D149 PolarHBondContact O-N 3.41Å; D149-L151 PolarHBondContact O-N 3.11Å; D149-C152 CarbonylContact O-C 3.59Å; D149-C152 PolarHBondContact O-N 3.41Å; D149-S153 WeakPolarHBondContact O-CA 3.44Å; D149-S153 PolarHBondContact O-N 2.88Å; D149-N156 VanDerWaalsContact CG-ND2 3.26Å; D149-N156 PolarHBondContact OD1-ND2 3.23Å; D149-N156 PolarHBondContact OD2-ND2 3.23Å; D149-Y175 WeakPolarHBondContact OD1-CB 3.45Å; D149-Y175 PolarHBondContact OD1-N 3.09Å
150	G	86	Confident	85.8	Confident	21 Å²	21	42 Å²	42	22%	0.216	19%	0.192	C	C	.	.	H	α-helix	trans	-59	-45.8	172	0	0	0	0	0	113.8	K146 I147 I148 C152 S153	K146-G150 PolarHBondContact O-N 3.46Å; I147-G150 PolarHBondContact O-N 2.92Å; I148-G150 VanDerWaalsContact C-N 3.31Å; I148-G150 PolarHBondContact O-N 3.13Å; G150-C152 PolarHBondContact O-N 2.95Å; G150-S153 VanDerWaalsContact O-CB 3.3Å; G150-S153 WeakPolarHBondContact O-CB 3.44Å; G150-S153 PolarHBondContact O-N 2.73Å; G150-S153 PolarHBondContact O-OG 3.36Å
151	L	87.4	Confident	85.5	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-59.6	-36.6	175.1	-81.8	178.3	0	0	0	112.2	I39 Y50 I53 I147 I148 D149	I39-L151 HydrophobicContact CD1-CD1 3.48Å; I39-L151 VanDerWaalsContact CD1-CD1 3.48Å; Y50-L151 HydrophobicContact CD1-CD2 4.13Å; Y50-L151 HydrophobicContact CD2-CD2 3.53Å; Y50-L151 HydrophobicContact CD2-CG 3.95Å; Y50-L151 HydrophobicContact CE1-CD2 4.06Å; Y50-L151 HydrophobicContact CE2-CD1 4.45Å; Y50-L151 HydrophobicContact CE2-CD2 3.46Å; Y50-L151 VanDerWaalsContact CE2-CD2 3.46Å; Y50-L151 HydrophobicContact CE2-CG 3.51Å; Y50-L151 HydrophobicContact CG-CD2 3.88Å; Y50-L151 PolarHBondContact OH-N 3.38Å; I53-L151 HydrophobicContact CB-CD2 4.19Å; I53-L151 HydrophobicContact CG2-CD1 4.27Å; I53-L151 HydrophobicContact CG2-CD2 4.15Å; I147-L151 PolarHBondContact O-N 3.4Å; I148-L151 WeakPolarHBondContact O-CB 3.39Å; I148-L151 PolarHBondContact O-N 2.86Å; D149-L151 PolarHBondContact O-N 3.11Å
152	C	87.2	Confident	85.1	Confident	1 Å²	1	50.3 Å²	50.3	1%	0.007	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.1	8.3	-177.8	-56.3	0	0	0	0	113.1	I148 D149 G150 Y154 L155 N156 V174	I148-C152 WeakPolarHBondContact O-CB 3.46Å; I148-C152 PolarHBondContact O-N 2.81Å; I148-C152 PolarHBondContact O-SG 3.21Å; D149-C152 CarbonylContact O-C 3.59Å; D149-C152 PolarHBondContact O-N 3.41Å; G150-C152 PolarHBondContact O-N 2.95Å; C152-Y154 PolarHBondContact O-N 3.08Å; C152-Y154 VanDerWaalsContact O-N 3.09Å; C152-L155 CarbonylContact O-C 3.58Å; C152-L155 WeakPolarHBondContact O-CA 3.46Å; C152-L155 WeakPolarHBondContact O-CB 3.43Å; C152-L155 PolarHBondContact O-N 3.32Å; C152-N156 PolarHBondContact O-N 3.45Å; C152-V174 HydrophobicContact CB-CB 4.19Å; C152-V174 HydrophobicContact CB-CG1 4.23Å; C152-V174 HydrophobicContact CB-CG2 3.75Å
153	S	87.3	Confident	84.7	Confident	46 Å²	46	47.3 Å²	47.3	32%	0.322	21%	0.211	S	C	.	.	H	α-helix	trans	-58.8	-29	-172.3	55.6	0	0	0	0	114.1	Y54 D149 G150 R157	Y54-S153 WeakPolarHBondContact CE2-OG 3.24Å; D149-S153 WeakPolarHBondContact O-CA 3.44Å; D149-S153 PolarHBondContact O-N 2.88Å; G150-S153 VanDerWaalsContact O-CB 3.3Å; G150-S153 WeakPolarHBondContact O-CB 3.44Å; G150-S153 PolarHBondContact O-N 2.73Å; G150-S153 PolarHBondContact O-OG 3.36Å; S153-R157 VanDerWaalsContact O-CB 3.26Å; S153-R157 WeakPolarHBondContact O-CB 3.38Å; S153-R157 PolarHBondContact O-N 2.91Å
154	Y	85.3	Confident	84.2	Confident	43 Å²	43	45.7 Å²	45.7	17%	0.169	21%	0.206	C	C	.	.	H	α-helix	trans	-69	-41.6	171.5	-165	-93.5	0	0	0	112.3	Y58 C61 T62 C152 R157 H158	Y58-Y154 HydrophobicContact CD2-CD1 4.22Å; Y58-Y154 AromaticContact CD2-CD2 3.59Å; Y58-Y154 HydrophobicContact CD2-CD2 3.59Å; Y58-Y154 HydrophobicContact CD2-CE1 4.14Å; Y58-Y154 AromaticContact CD2-CE2 3.51Å; Y58-Y154 HydrophobicContact CD2-CE2 3.51Å; Y58-Y154 AromaticContact CD2-CG 3.95Å; Y58-Y154 HydrophobicContact CD2-CG 3.95Å; Y58-Y154 AromaticContact CD2-CZ 3.8Å; Y58-Y154 HydrophobicContact CE2-CD2 4.08Å; Y58-Y154 AromaticContact CE2-CE2 3.54Å; Y58-Y154 HydrophobicContact CE2-CE2 3.54Å; Y58-Y154 AromaticContact CE2-CZ 3.81Å; C61-Y154 HydrophobicContact CB-CD1 3.63Å; C61-Y154 HydrophobicContact CB-CE1 3.59Å; T62-Y154 HydrophobicContact CG2-CE1 3.91Å; T62-Y154 WeakPolarHBondContact CG2-OH 3.2Å; C152-Y154 PolarHBondContact O-N 3.08Å; C152-Y154 VanDerWaalsContact O-N 3.09Å; Y154-R157 PolarHBondContact O-N 2.97Å; Y154-H158 AromaticContact CD2-CD2 3.4Å; Y154-H158 WeakPolarHBondContact CD2-CD2 3.39Å; Y154-H158 AromaticContact CD2-NE2 3.76Å; Y154-H158 HydrophobicContact CE1-CB 4.23Å; Y154-H158 AromaticContact CE1-CD2 3.96Å; Y154-H158 AromaticContact CE2-CD2 3.26Å; Y154-H158 WeakPolarHBondContact CE2-CD2 3.22Å; Y154-H158 AromaticContact CE2-NE2 3.41Å; Y154-H158 WeakPolarHBondContact CE2-NE2 3.31Å; Y154-H158 AromaticContact CG-CD2 3.82Å; Y154-H158 AromaticContact CZ-CD2 3.56Å; Y154-H158 AromaticContact CZ-CG 3.91Å; Y154-H158 AromaticContact CZ-NE2 4Å; Y154-H158 WeakPolarHBondContact O-CB 3.45Å; Y154-H158 PolarHBondContact O-CD2 2.75Å; Y154-H158 PolarHBondContact O-N 3.02Å
155	L	86.3	Confident	83.6	Confident	1 Å²	1	51.8 Å²	51.8	1%	0.005	24%	0.238	C	C	.	.	H	α-helix	trans	-65.8	-44.3	175.3	-175.3	71.5	0	0	0	111	L101 M105 C152 W159 I160	L101-L155 HydrophobicContact CD2-CD1 4.45Å; L101-L155 HydrophobicContact CD2-CD2 4.14Å; L101-L155 HydrophobicContact CG-CD2 4.33Å; M105-L155 HydrophobicContact SD-CD2 4.4Å; C152-L155 CarbonylContact O-C 3.58Å; C152-L155 WeakPolarHBondContact O-CA 3.46Å; C152-L155 WeakPolarHBondContact O-CB 3.43Å; C152-L155 PolarHBondContact O-N 3.32Å; L155-W159 HydrophobicContact CD1-CB 4Å; L155-W159 HydrophobicContact CD1-CE3 4.28Å; L155-W159 HydrophobicContact CD1-CG 4.46Å; L155-W159 PolarHBondContact O-N 2.98Å; L155-W159 VanDerWaalsContact O-N 3.08Å; L155-I160 HydrophobicContact CD2-CD1 4.19Å; L155-I160 HydrophobicContact CG-CD1 4.03Å; L155-I160 HydrophobicContact CG-CG1 4.2Å; L155-I160 PolarHBondContact O-N 3.36Å
156	N	86.1	Confident	82.9	Confident	8 Å²	8	56.3 Å²	56.3	4%	0.043	26%	0.259	C	S	.	.	I	π-helix	trans	-52.6	-56.4	171.9	-79.9	-14.4	0	0	0	110.5	D149 C152 I160 R161 V174	D149-N156 VanDerWaalsContact CG-ND2 3.26Å; D149-N156 PolarHBondContact OD1-ND2 3.23Å; D149-N156 PolarHBondContact OD2-ND2 3.23Å; C152-N156 PolarHBondContact O-N 3.45Å; N156-I160 VanDerWaalsContact OD1-CD1 3.3Å; N156-I160 WeakPolarHBondContact OD1-CD1 3.41Å; N156-R161 VanDerWaalsContact O-CB 3.25Å; N156-R161 WeakPolarHBondContact O-CB 3.46Å; N156-R161 PolarHBondContact O-N 3.48Å; N156-V174 WeakPolarHBondContact OD1-CG2 3.35Å; N156-V174 PolarHBondContact OD1-N 2.76Å; N156-V174 VanDerWaalsContact OD1-N 3.08Å
157	R	83.5	Confident	81.7	Confident	185 Å²	185	54.2 Å²	54.2	70%	0.698	27%	0.267	S	S	*	.	I	π-helix	trans	-69.1	-38.8	-172.9	-175.9	176.9	-178	-178.1	1.3	114.6	S153 Y154	S153-R157 VanDerWaalsContact O-CB 3.26Å; S153-R157 WeakPolarHBondContact O-CB 3.38Å; S153-R157 PolarHBondContact O-N 2.91Å; Y154-R157 PolarHBondContact O-N 2.97Å
158	H	79.5	Confident	80.7	Confident	88 Å²	88	54.5 Å²	54.5	41%	0.407	27%	0.269	S	S	.	.	I	π-helix	trans	-107.6	-22	-166.6	-67.2	-79.2	0	0	0	115.2	Y154	Y154-H158 AromaticContact CD2-CD2 3.4Å; Y154-H158 WeakPolarHBondContact CD2-CD2 3.39Å; Y154-H158 AromaticContact CD2-NE2 3.76Å; Y154-H158 HydrophobicContact CE1-CB 4.23Å; Y154-H158 AromaticContact CE1-CD2 3.96Å; Y154-H158 AromaticContact CE2-CD2 3.26Å; Y154-H158 WeakPolarHBondContact CE2-CD2 3.22Å; Y154-H158 AromaticContact CE2-NE2 3.41Å; Y154-H158 WeakPolarHBondContact CE2-NE2 3.31Å; Y154-H158 AromaticContact CG-CD2 3.82Å; Y154-H158 AromaticContact CZ-CD2 3.56Å; Y154-H158 AromaticContact CZ-CG 3.91Å; Y154-H158 AromaticContact CZ-NE2 4Å; Y154-H158 WeakPolarHBondContact O-CB 3.45Å; Y154-H158 PolarHBondContact O-CD2 2.75Å; Y154-H158 PolarHBondContact O-N 3.02Å
159	W	82.9	Confident	79.8	Confident	24 Å²	24	59.8 Å²	59.8	9%	0.091	30%	0.297	C	S	.	.	I	π-helix	trans	-118	-57.1	177.7	-172.9	84	0	0	0	112	Q95 F99 Y102 L155 R161 R162 I163 I171	Q95-W159 PolarHBondContact O-NE1 3.02Å; Q95-W159 VanDerWaalsContact O-NE1 3.09Å; F99-W159 HydrophobicContact CB-CH2 4.12Å; F99-W159 HydrophobicContact CB-CZ2 3.57Å; F99-W159 HydrophobicContact CD2-CH2 4Å; F99-W159 HydrophobicContact CD2-CZ2 4Å; F99-W159 HydrophobicContact CG-CZ2 4.3Å; Y102-W159 HydrophobicContact CD1-CZ3 4.23Å; Y102-W159 HydrophobicContact CD2-CZ3 4.4Å; Y102-W159 AromaticContact CG-CZ3 3.81Å; Y102-W159 HydrophobicContact CG-CZ3 3.81Å; L155-W159 HydrophobicContact CD1-CB 4Å; L155-W159 HydrophobicContact CD1-CE3 4.28Å; L155-W159 HydrophobicContact CD1-CG 4.46Å; L155-W159 PolarHBondContact O-N 2.98Å; L155-W159 VanDerWaalsContact O-N 3.08Å; W159-R161 PolarHBondContact O-N 3.28Å; W159-R162 PolarHBondContact O-N 2.89Å; W159-I163 HydrophobicContact CD2-CG1 4.14Å; W159-I163 HydrophobicContact CH2-CG1 4.24Å; W159-I163 HydrophobicContact CZ2-CD1 4.3Å; W159-I163 HydrophobicContact CZ2-CG1 3.78Å; W159-I163 VanDerWaalsContact O-CG1 3.32Å; W159-I163 WeakPolarHBondContact O-CG1 3.47Å; W159-I163 PolarHBondContact O-N 3.41Å; W159-I171 HydrophobicContact CH2-CD1 4.45Å; W159-I171 HydrophobicContact CZ3-CG2 4.39Å
160	I	82.7	Confident	79.1	Confident	0 Å²	0	62.6 Å²	62.6	0%	0	32%	0.316	C	S	.	.	I	π-helix	trans	-58.4	-56	-176.7	-67	174.3	0	0	0	110.8	Y102 L155 N156 R162 I163 M164 I171 E173 V174	Y102-I160 HydrophobicContact CD2-CD1 3.79Å; Y102-I160 HydrophobicContact CD2-CG1 4.12Å; Y102-I160 HydrophobicContact CE2-CD1 4.09Å; L155-I160 HydrophobicContact CD2-CD1 4.19Å; L155-I160 HydrophobicContact CG-CD1 4.03Å; L155-I160 HydrophobicContact CG-CG1 4.2Å; L155-I160 PolarHBondContact O-N 3.36Å; N156-I160 VanDerWaalsContact OD1-CD1 3.3Å; N156-I160 WeakPolarHBondContact OD1-CD1 3.41Å; I160-R162 VanDerWaalsContact C-N 3.26Å; I160-R162 PolarHBondContact O-N 3.14Å; I160-I163 PolarHBondContact O-N 2.88Å; I160-M164 HydrophobicContact CG2-SD 3.89Å; I160-M164 WeakPolarHBondContact O-CG 3.3Å; I160-M164 PolarHBondContact O-N 3.23Å; I160-I171 HydrophobicContact CB-CG2 4.39Å; I160-I171 HydrophobicContact CG1-CG2 4.45Å; I160-I171 HydrophobicContact CG2-CG2 3.86Å; I160-E173 HydrophobicContact CG2-CG 4.15Å; I160-V174 HydrophobicContact CD1-CG2 3.93Å
161	R	79.8	Confident	78.7	Confident	139 Å²	139	62 Å²	62	53%	0.525	31%	0.307	S	S	.	.	H	α-helix	trans	-58.5	-39.3	-179.3	-171.3	172.4	-172.5	133.7	-0.8	112.3	N156 W159 I163 M164 D165	N156-R161 VanDerWaalsContact O-CB 3.25Å; N156-R161 WeakPolarHBondContact O-CB 3.46Å; N156-R161 PolarHBondContact O-N 3.48Å; W159-R161 PolarHBondContact O-N 3.28Å; R161-I163 PolarHBondContact O-N 3.09Å; R161-M164 PolarHBondContact O-N 2.87Å; R161-D165 WeakPolarHBondContact O-CB 3.21Å; R161-D165 PolarHBondContact O-N 2.65Å
162	R	78.4	Confident	78.3	Confident	108 Å²	108	63.9 Å²	63.9	41%	0.408	32%	0.317	S	S	.	.	H	α-helix	trans	-62.3	-41.7	174.5	178.2	-179.8	168.1	-177.9	-4.2	112.2	W159 I160 D165 E166	W159-R162 PolarHBondContact O-N 2.89Å; I160-R162 VanDerWaalsContact C-N 3.26Å; I160-R162 PolarHBondContact O-N 3.14Å; R162-D165 PolarHBondContact O-N 2.69Å; R162-E166 IonicContact CZ-OE1 3.28Å; R162-E166 VanDerWaalsContact CZ-OE1 3.28Å; R162-E166 IonicContact NE-OE1 3.73Å; R162-E166 PolarHBondContact NE-OE1 2.94Å; R162-E166 IonicContact NH2-OE1 2.69Å; R162-E166 PolarHBondContact NH2-OE1 2.93Å; R162-E166 WeakPolarHBondContact O-CB 3.44Å; R162-E166 VanDerWaalsContact O-CG 3.29Å; R162-E166 WeakPolarHBondContact O-CG 3.31Å; R162-E166 PolarHBondContact O-N 3.08Å
163	I	77.6	Confident	78.2	Confident	22 Å²	22	66.3 Å²	66.3	11%	0.113	33%	0.329	C	S	.	.	H	α-helix	trans	-71.5	-32.4	178.5	-64.7	-67.1	0	0	0	111.6	W159 I160 R161 E166 G167 N168 I171	W159-I163 HydrophobicContact CD2-CG1 4.14Å; W159-I163 HydrophobicContact CH2-CG1 4.24Å; W159-I163 HydrophobicContact CZ2-CD1 4.3Å; W159-I163 HydrophobicContact CZ2-CG1 3.78Å; W159-I163 VanDerWaalsContact O-CG1 3.32Å; W159-I163 WeakPolarHBondContact O-CG1 3.47Å; W159-I163 PolarHBondContact O-N 3.41Å; I160-I163 PolarHBondContact O-N 2.88Å; R161-I163 PolarHBondContact O-N 3.09Å; I163-E166 PolarHBondContact O-N 3.41Å; I163-G167 PolarHBondContact O-N 3.24Å; I163-N168 HydrophobicContact CG2-CB 3.75Å; I163-N168 WeakPolarHBondContact O-CB 3.25Å; I163-N168 PolarHBondContact O-N 3.07Å; I163-I171 HydrophobicContact CG2-CB 4.28Å; I163-I171 HydrophobicContact CG2-CG1 3.75Å
164	M	75.6	Confident	78.1	Confident	74 Å²	74	64.4 Å²	64.4	37%	0.365	32%	0.315	S	S	.	.	H	α-helix	trans	-66.6	-45.9	169.8	-65.3	173.4	71	0	0	111.2	I160 R161 E166 G167 I171 E173	I160-M164 HydrophobicContact CG2-SD 3.89Å; I160-M164 WeakPolarHBondContact O-CG 3.3Å; I160-M164 PolarHBondContact O-N 3.23Å; R161-M164 PolarHBondContact O-N 2.87Å; M164-E166 VanDerWaalsContact C-N 3.27Å; M164-E166 PolarHBondContact O-N 3.36Å; M164-G167 WeakPolarHBondContact O-CA 3.48Å; M164-G167 PolarHBondContact O-N 3.13Å; M164-I171 HydrophobicContact CG-CG2 4.48Å; M164-E173 HydrophobicContact SD-CG 4.3Å
165	D	75.2	Confident	78.2	Confident	129 Å²	129	63.8 Å²	63.8	69%	0.69	31%	0.312	S	S	*	.	H	α-helix	trans	-64.6	-29	175.7	-65.1	-26.9	0	0	0	112.3	R161 R162 G167	R161-D165 WeakPolarHBondContact O-CB 3.21Å; R161-D165 PolarHBondContact O-N 2.65Å; R162-D165 PolarHBondContact O-N 2.69Å; D165-G167 PolarHBondContact O-N 3.42Å
166	E	73.8	Confident	78.1	Confident	96 Å²	96	66.8 Å²	66.8	45%	0.449	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.2	3.4	170.3	-75	175.9	-168.9	0	0	113.1	R162 I163 M164	R162-E166 IonicContact CZ-OE1 3.28Å; R162-E166 VanDerWaalsContact CZ-OE1 3.28Å; R162-E166 IonicContact NE-OE1 3.73Å; R162-E166 PolarHBondContact NE-OE1 2.94Å; R162-E166 IonicContact NH2-OE1 2.69Å; R162-E166 PolarHBondContact NH2-OE1 2.93Å; R162-E166 WeakPolarHBondContact O-CB 3.44Å; R162-E166 VanDerWaalsContact O-CG 3.29Å; R162-E166 WeakPolarHBondContact O-CG 3.31Å; R162-E166 PolarHBondContact O-N 3.08Å; I163-E166 PolarHBondContact O-N 3.41Å; M164-E166 VanDerWaalsContact C-N 3.27Å; M164-E166 PolarHBondContact O-N 3.36Å
167	G	61.3	Low	77.9	Confident	57 Å²	57	67 Å²	67	59%	0.588	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.1	26.4	170.3	0	0	0	0	0	115.7	I163 M164 D165	I163-G167 PolarHBondContact O-N 3.24Å; M164-G167 WeakPolarHBondContact O-CA 3.48Å; M164-G167 PolarHBondContact O-N 3.13Å; D165-G167 PolarHBondContact O-N 3.42Å
168	N	67.5	Low	77.9	Confident	61 Å²	61	58.3 Å²	58.3	33%	0.326	30%	0.295	S	S	.	.			trans	-105.6	85.8	178.9	-175.4	3.4	0	0	0	112.9	I163 T170 I171	I163-N168 HydrophobicContact CG2-CB 3.75Å; I163-N168 WeakPolarHBondContact O-CB 3.25Å; I163-N168 PolarHBondContact O-N 3.07Å; N168-T170 PolarHBondContact O-N 3.28Å; N168-T170 PolarHBondContact OD1-N 2.94Å; N168-T170 PolarHBondContact OD1-OG1 3.38Å; N168-I171 PolarHBondContact O-N 3.26Å
169	D	66.4	Low	78.2	Confident	112 Å²	112	54.3 Å²	54.3	60%	0.599	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-6.9	179.6	-52.7	-13	0	0	0	114.8	I171 P233	D169-I171 VanDerWaalsContact C-N 3.32Å; D169-P233 WeakPolarHBondContact OD2-CG 3.48Å
170	T	70.4	Confident	78.1	Confident	99 Å²	99	56.5 Å²	56.5	61%	0.607	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.1	-5.9	178.6	71.5	0	0	0	0	113.8	N168	N168-T170 PolarHBondContact O-N 3.28Å; N168-T170 PolarHBondContact OD1-N 2.94Å; N168-T170 PolarHBondContact OD1-OG1 3.38Å
171	I	78.3	Confident	78	Confident	9 Å²	9	57.4 Å²	57.4	5%	0.046	29%	0.294	C	S	.	.			trans	-105	131.7	179.6	-59.1	-61.1	0	0	0	109.2	Y102 W159 I160 I163 M164 N168 D169	Y102-I171 HydrophobicContact CD1-CD1 3.83Å; Y102-I171 HydrophobicContact CE1-CD1 3.42Å; Y102-I171 VanDerWaalsContact CE1-CD1 3.42Å; Y102-I171 HydrophobicContact CE1-CG2 4.35Å; Y102-I171 HydrophobicContact CE2-CG2 4.36Å; W159-I171 HydrophobicContact CH2-CD1 4.45Å; W159-I171 HydrophobicContact CZ3-CG2 4.39Å; I160-I171 HydrophobicContact CB-CG2 4.39Å; I160-I171 HydrophobicContact CG1-CG2 4.45Å; I160-I171 HydrophobicContact CG2-CG2 3.86Å; I163-I171 HydrophobicContact CG2-CB 4.28Å; I163-I171 HydrophobicContact CG2-CG1 3.75Å; M164-I171 HydrophobicContact CG-CG2 4.48Å; N168-I171 PolarHBondContact O-N 3.26Å; D169-I171 VanDerWaalsContact C-N 3.32Å
172	L	79.9	Confident	78.3	Confident	39 Å²	39	50.8 Å²	50.8	20%	0.204	27%	0.269	C	S	.	.			trans	-118.7	151.6	-179.8	-64.6	176.1	0	0	0	109.4	Y102 H176 L177 H180 I229	Y102-L172 VanDerWaalsContact CE2-O 3.23Å; Y102-L172 WeakPolarHBondContact CE2-O 3.24Å; Y102-L172 PolarHBondContact OH-N 3.05Å; Y102-L172 PolarHBondContact OH-O 2.67Å; L172-H176 HydrophobicContact CB-CB 4.08Å; L172-H176 HydrophobicContact CD2-CB 4.47Å; L172-L177 HydrophobicContact CB-CB 4.27Å; L172-H180 HydrophobicContact CD1-CB 4.13Å; L172-I229 HydrophobicContact CD1-CG2 4.45Å
173	E	85.1	Confident	78.5	Confident	53 Å²	53	47 Å²	47	25%	0.248	26%	0.256	C	S	.	.			trans	-61.3	153.8	164.2	-61.3	-179.4	138.3	0	0	110.7	I160 M164 Y175 H176 L177	I160-E173 HydrophobicContact CG2-CG 4.15Å; M164-E173 HydrophobicContact SD-CG 4.3Å; E173-Y175 VanDerWaalsContact C-N 3.28Å; E173-Y175 PolarHBondContact O-N 2.74Å; E173-H176 PolarHBondContact O-N 3.37Å; E173-H176 IonicContact OE2-CE1 2.75Å; E173-H176 PolarHBondContact OE2-CE1 3.18Å; E173-H176 IonicContact OE2-ND1 3.14Å; E173-H176 PolarHBondContact OE2-ND1 3.34Å; E173-L177 PolarHBondContact O-N 3.08Å
174	V	84.6	Confident	78.6	Confident	5 Å²	5	48.3 Å²	48.3	3%	0.03	27%	0.265	C	S	.	.	H	α-helix	trans	-59.2	-36.2	-171.1	169.5	0	0	0	0	112.9	M105 I148 C152 N156 I160 A178	M105-V174 HydrophobicContact CE-CB 4.42Å; M105-V174 HydrophobicContact CE-CG1 3.63Å; M105-V174 HydrophobicContact CE-CG2 3.85Å; M105-V174 HydrophobicContact SD-CG2 4.44Å; I148-V174 HydrophobicContact CG2-CG1 3.73Å; C152-V174 HydrophobicContact CB-CB 4.19Å; C152-V174 HydrophobicContact CB-CG1 4.23Å; C152-V174 HydrophobicContact CB-CG2 3.75Å; N156-V174 WeakPolarHBondContact OD1-CG2 3.35Å; N156-V174 PolarHBondContact OD1-N 2.76Å; N156-V174 VanDerWaalsContact OD1-N 3.08Å; I160-V174 HydrophobicContact CD1-CG2 3.93Å; V174-A178 PolarHBondContact O-N 3.34Å; V174-A178 VanDerWaalsContact O-N 3.16Å
175	Y	86.7	Confident	78.7	Confident	31 Å²	31	50.1 Å²	50.1	12%	0.122	27%	0.27	C	S	.	.	H	α-helix	trans	-60.8	-51	170.2	-172.6	-116.6	0	0	0	112.5	K146 D149 E173 L177 A178 L179 E225	K146-Y175 HydrophobicContact CD-CE2 4.33Å; K146-Y175 WeakPolarHBondContact CE-OH 3.43Å; K146-Y175 HydrophobicContact CG-CD2 3.96Å; K146-Y175 HydrophobicContact CG-CE2 3.45Å; K146-Y175 VanDerWaalsContact CG-CE2 3.45Å; D149-Y175 WeakPolarHBondContact OD1-CB 3.45Å; D149-Y175 PolarHBondContact OD1-N 3.09Å; E173-Y175 VanDerWaalsContact C-N 3.28Å; E173-Y175 PolarHBondContact O-N 2.74Å; Y175-L177 VanDerWaalsContact C-N 3.34Å; Y175-L177 PolarHBondContact O-N 2.98Å; Y175-A178 WeakPolarHBondContact O-CB 3.46Å; Y175-A178 PolarHBondContact O-N 2.98Å; Y175-A178 VanDerWaalsContact O-N 3.1Å; Y175-L179 HydrophobicContact CD1-CD1 4.04Å; Y175-L179 HydrophobicContact CD1-CG 4.35Å; Y175-L179 HydrophobicContact CE1-CD1 3.51Å; Y175-L179 HydrophobicContact CE1-CG 4.09Å; Y175-L179 HydrophobicContact CE2-CD2 4.16Å; Y175-L179 HydrophobicContact CE2-CG 4.38Å; Y175-L179 WeakPolarHBondContact O-CG 3.5Å; Y175-L179 PolarHBondContact O-N 3.21Å; Y175-E225 PolarHBondContact OH-OE1 2.93Å
176	H	83.9	Confident	79	Confident	64 Å²	64	44 Å²	44	30%	0.296	24%	0.238	S	C	.	.	H	α-helix	trans	-63.1	-38	-179.6	-64.7	112.1	0	0	0	112.2	L172 E173 A178 L179 H180 I229	L172-H176 HydrophobicContact CB-CB 4.08Å; L172-H176 HydrophobicContact CD2-CB 4.47Å; E173-H176 PolarHBondContact O-N 3.37Å; E173-H176 IonicContact OE2-CE1 2.75Å; E173-H176 PolarHBondContact OE2-CE1 3.18Å; E173-H176 IonicContact OE2-ND1 3.14Å; E173-H176 PolarHBondContact OE2-ND1 3.34Å; H176-A178 VanDerWaalsContact C-N 3.32Å; H176-A178 PolarHBondContact O-N 3.27Å; H176-L179 PolarHBondContact O-N 3.02Å; H176-H180 WeakPolarHBondContact O-CB 3.46Å; H176-H180 PolarHBondContact O-N 2.88Å; H176-I229 HydrophobicContact CB-CG2 4.48Å
177	L	82.6	Confident	79.5	Confident	12 Å²	12	39.7 Å²	39.7	6%	0.063	22%	0.217	C	C	.	.	H	α-helix	trans	-60.2	-40.3	172.2	177.2	63	0	0	0	112.2	Y102 Q106 L172 E173 Y175 T181	Y102-L177 HydrophobicContact CE2-CD2 4Å; Q106-L177 HydrophobicContact CB-CD2 4.39Å; Q106-L177 HydrophobicContact CG-CD1 4.22Å; L172-L177 HydrophobicContact CB-CB 4.27Å; E173-L177 PolarHBondContact O-N 3.08Å; Y175-L177 VanDerWaalsContact C-N 3.34Å; Y175-L177 PolarHBondContact O-N 2.98Å; L177-T181 PolarHBondContact O-N 3.08Å; L177-T181 VanDerWaalsContact O-N 3.08Å; L177-T181 PolarHBondContact O-OG1 2.7Å
178	A	82.9	Confident	80.5	Confident	3 Å²	3	44.2 Å²	44.2	3%	0.025	22%	0.221	C	C	.	.	H	α-helix	trans	-68.2	-45.9	175.9	0	0	0	0	0	111.6	V111 Y141 V174 Y175 H176 H180 T181 W182	V111-A178 HydrophobicContact CG1-CB 3.91Å; Y141-A178 HydrophobicContact CE1-CB 4.48Å; Y141-A178 PolarHBondContact OH-O 2.82Å; V174-A178 PolarHBondContact O-N 3.34Å; V174-A178 VanDerWaalsContact O-N 3.16Å; Y175-A178 WeakPolarHBondContact O-CB 3.46Å; Y175-A178 PolarHBondContact O-N 2.98Å; Y175-A178 VanDerWaalsContact O-N 3.1Å; H176-A178 VanDerWaalsContact C-N 3.32Å; H176-A178 PolarHBondContact O-N 3.27Å; A178-H180 PolarHBondContact O-N 3.36Å; A178-T181 WeakPolarHBondContact O-CA 3.42Å; A178-T181 VanDerWaalsContact O-CB 3.32Å; A178-T181 WeakPolarHBondContact O-CB 3.35Å; A178-T181 PolarHBondContact O-N 3.06Å; A178-W182 PolarHBondContact O-N 3.39Å
179	L	86	Confident	81.2	Confident	3 Å²	3	45.4 Å²	45.4	2%	0.016	23%	0.23	C	C	.	.	H	α-helix	trans	-62.7	-41	177.5	-60.4	-168.3	0	0	0	112.7	W138 Y175 H176 T181 W182 E183 E225 L226 I229	W138-L179 HydrophobicContact CH2-CD2 3.83Å; W138-L179 HydrophobicContact CZ3-CD2 4.14Å; Y175-L179 HydrophobicContact CD1-CD1 4.04Å; Y175-L179 HydrophobicContact CD1-CG 4.35Å; Y175-L179 HydrophobicContact CE1-CD1 3.51Å; Y175-L179 HydrophobicContact CE1-CG 4.09Å; Y175-L179 HydrophobicContact CE2-CD2 4.16Å; Y175-L179 HydrophobicContact CE2-CG 4.38Å; Y175-L179 WeakPolarHBondContact O-CG 3.5Å; Y175-L179 PolarHBondContact O-N 3.21Å; H176-L179 PolarHBondContact O-N 3.02Å; L179-T181 PolarHBondContact O-N 3.38Å; L179-W182 WeakPolarHBondContact O-CB 3.43Å; L179-W182 PolarHBondContact O-N 3.13Å; L179-W182 VanDerWaalsContact O-N 3.11Å; L179-E183 PolarHBondContact O-N 2.86Å; L179-E225 HydrophobicContact CD1-CG 4.27Å; L179-L226 HydrophobicContact CB-CD2 3.97Å; L179-I229 HydrophobicContact CB-CD1 3.23Å; L179-I229 HydrophobicContact CB-CG1 4.07Å; L179-I229 HydrophobicContact CD1-CD1 3.96Å; L179-I229 HydrophobicContact CD1-CG1 4.31Å; L179-I229 HydrophobicContact CG-CD1 4.26Å
180	H	81.6	Confident	82.2	Confident	70 Å²	70	40.1 Å²	40.1	32%	0.324	20%	0.202	S	C	.	.	H	α-helix	trans	-61.6	-33.2	173	-173.6	59.6	0	0	0	112.5	L172 H176 A178 E183 T184 I229	L172-H180 HydrophobicContact CD1-CB 4.13Å; H176-H180 WeakPolarHBondContact O-CB 3.46Å; H176-H180 PolarHBondContact O-N 2.88Å; A178-H180 PolarHBondContact O-N 3.36Å; H180-E183 IonicContact CE1-OE2 3.43Å; H180-E183 IonicContact ND1-OE2 3.84Å; H180-E183 PolarHBondContact ND1-OE2 3.19Å; H180-E183 VanDerWaalsContact ND1-OE2 3.12Å; H180-T184 WeakPolarHBondContact CE1-CG2 3.48Å; H180-T184 WeakPolarHBondContact O-CB 3.37Å; H180-T184 WeakPolarHBondContact O-CG2 3.31Å; H180-T184 PolarHBondContact O-N 2.79Å; H180-T184 PolarHBondContact O-OG1 2.86Å; H180-I229 HydrophobicContact CB-CG2 3.89Å
181	T	80.3	Confident	82.9	Confident	20 Å²	20	38.1 Å²	38.1	12%	0.123	19%	0.186	C	C	.	.	H	α-helix	trans	-66.1	-41.4	173.8	-57.9	0	0	0	0	111.1	V111 A112 L177 A178 L179 K185	V111-T181 HydrophobicContact CG1-CG2 4.16Å; A112-T181 HydrophobicContact CB-CG2 3.96Å; L177-T181 PolarHBondContact O-N 3.08Å; L177-T181 VanDerWaalsContact O-N 3.08Å; L177-T181 PolarHBondContact O-OG1 2.7Å; A178-T181 WeakPolarHBondContact O-CA 3.42Å; A178-T181 VanDerWaalsContact O-CB 3.32Å; A178-T181 WeakPolarHBondContact O-CB 3.35Å; A178-T181 PolarHBondContact O-N 3.06Å; L179-T181 PolarHBondContact O-N 3.38Å; T181-K185 HydrophobicContact CG2-CG 4.03Å; T181-K185 WeakPolarHBondContact O-CB 3.39Å; T181-K185 VanDerWaalsContact O-CG 3.27Å; T181-K185 WeakPolarHBondContact O-CG 3.41Å; T181-K185 PolarHBondContact O-N 2.74Å
182	W	85.6	Confident	83.3	Confident	0 Å²	0	44 Å²	44	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-64.9	-47	175.2	-176.8	-90	0	0	0	112.7	F134 E137 W138 Y141 A178 L179 F186 L187	F134-W182 HydrophobicContact CE2-CZ2 4.26Å; E137-W182 HydrophobicContact CB-CH2 4.09Å; W138-W182 HydrophobicContact CB-CH2 4.47Å; W138-W182 HydrophobicContact CB-CZ2 3.92Å; W138-W182 AromaticContact CE3-CD1 3.81Å; W138-W182 AromaticContact CE3-CD2 3.94Å; W138-W182 HydrophobicContact CE3-CD2 3.94Å; W138-W182 AromaticContact CE3-CE2 3.51Å; W138-W182 HydrophobicContact CE3-CG 4.1Å; W138-W182 AromaticContact CE3-CZ2 3.94Å; W138-W182 HydrophobicContact CE3-CZ2 3.94Å; W138-W182 AromaticContact CE3-NE1 3.42Å; W138-W182 HydrophobicContact CZ3-CB 4.46Å; W138-W182 AromaticContact CZ3-CD1 3.58Å; W138-W182 HydrophobicContact CZ3-CD2 4.16Å; W138-W182 AromaticContact CZ3-CG 3.85Å; W138-W182 HydrophobicContact CZ3-CG 3.85Å; W138-W182 AromaticContact CZ3-NE1 3.7Å; Y141-W182 HydrophobicContact CD1-CB 4.15Å; Y141-W182 AromaticContact CD1-CD2 3.96Å; Y141-W182 HydrophobicContact CD1-CD2 3.96Å; Y141-W182 AromaticContact CD1-CE3 3.49Å; Y141-W182 HydrophobicContact CD1-CE3 3.49Å; Y141-W182 VanDerWaalsContact CD1-CE3 3.49Å; Y141-W182 HydrophobicContact CD1-CG 4.27Å; Y141-W182 HydrophobicContact CD1-CZ3 4.16Å; Y141-W182 AromaticContact CD2-CE3 3.73Å; Y141-W182 HydrophobicContact CD2-CE3 3.73Å; Y141-W182 AromaticContact CD2-CZ3 3.94Å; Y141-W182 HydrophobicContact CD2-CZ3 3.94Å; Y141-W182 HydrophobicContact CE1-CB 3.63Å; Y141-W182 HydrophobicContact CE1-CD2 4.28Å; Y141-W182 AromaticContact CE1-CE3 3.9Å; Y141-W182 HydrophobicContact CE1-CE3 3.9Å; Y141-W182 HydrophobicContact CE1-CG 4.23Å; Y141-W182 HydrophobicContact CE2-CE3 4.1Å; Y141-W182 HydrophobicContact CG-CD2 4.27Å; Y141-W182 AromaticContact CG-CE3 3.38Å; Y141-W182 HydrophobicContact CG-CE3 3.38Å; Y141-W182 AromaticContact CG-CZ3 3.62Å; Y141-W182 HydrophobicContact CG-CZ3 3.62Å; A178-W182 PolarHBondContact O-N 3.39Å; L179-W182 WeakPolarHBondContact O-CB 3.43Å; L179-W182 PolarHBondContact O-N 3.13Å; L179-W182 VanDerWaalsContact O-N 3.11Å; W182-F186 HydrophobicContact CD2-CB 4.49Å; W182-F186 HydrophobicContact CD2-CD1 4.03Å; W182-F186 AromaticContact CE2-CD1 3.48Å; W182-F186 VanDerWaalsContact CE2-CD1 3.48Å; W182-F186 AromaticContact CE2-CE1 3.95Å; W182-F186 HydrophobicContact CE3-CD1 4.4Å; W182-F186 AromaticContact CH2-CD1 3.84Å; W182-F186 HydrophobicContact CH2-CD1 3.84Å; W182-F186 AromaticContact CH2-CE1 3.73Å; W182-F186 HydrophobicContact CH2-CE1 3.73Å; W182-F186 HydrophobicContact CH2-CZ 4.47Å; W182-F186 AromaticContact CZ2-CD1 3.4Å; W182-F186 HydrophobicContact CZ2-CD1 3.4Å; W182-F186 VanDerWaalsContact CZ2-CD1 3.4Å; W182-F186 AromaticContact CZ2-CE1 3.37Å; W182-F186 HydrophobicContact CZ2-CE1 3.37Å; W182-F186 HydrophobicContact CZ2-CG 4.48Å; W182-F186 HydrophobicContact CZ2-CZ 4.46Å; W182-F186 HydrophobicContact CZ3-CD1 4.31Å; W182-F186 AromaticContact NE1-CD1 3.92Å; W182-F186 WeakPolarHBondContact O-CA 3.33Å; W182-F186 WeakPolarHBondContact O-CB 3.42Å; W182-F186 PolarHBondContact O-N 3.17Å; W182-L187 PolarHBondContact O-N 3.21Å
183	E	83.8	Confident	83.7	Confident	29 Å²	29	45.6 Å²	45.6	14%	0.136	22%	0.219	C	C	.	.	I	π-helix	trans	-53.9	-56.3	174.7	-177.1	-158.6	-174.3	0	0	110.9	L179 H180 K188 S230 L246	L179-E183 PolarHBondContact O-N 2.86Å; H180-E183 IonicContact CE1-OE2 3.43Å; H180-E183 IonicContact ND1-OE2 3.84Å; H180-E183 PolarHBondContact ND1-OE2 3.19Å; H180-E183 VanDerWaalsContact ND1-OE2 3.12Å; E183-K188 VanDerWaalsContact O-CB 3.26Å; E183-K188 WeakPolarHBondContact O-CB 3.49Å; E183-K188 PolarHBondContact O-N 2.97Å; E183-S230 PolarHBondContact OE1-OG 2.99Å; E183-S230 PolarHBondContact OE2-OG 3.09Å; E183-L246 HydrophobicContact CG-CD1 4.24Å
184	T	79.3	Confident	84	Confident	49 Å²	49	43 Å²	43	30%	0.301	21%	0.207	S	C	.	.	I	π-helix	trans	-78.1	-27.3	-170.7	58.5	0	0	0	0	114.9	H180	H180-T184 WeakPolarHBondContact CE1-CG2 3.48Å; H180-T184 WeakPolarHBondContact O-CB 3.37Å; H180-T184 WeakPolarHBondContact O-CG2 3.31Å; H180-T184 PolarHBondContact O-N 2.79Å; H180-T184 PolarHBondContact O-OG1 2.86Å
185	K	77.5	Confident	84.3	Confident	112 Å²	112	43.3 Å²	43.3	49%	0.487	21%	0.209	S	C	.	.	I	π-helix	trans	-101	-23.9	-177.1	-56.5	-57.5	-177.8	-174.1	0	114.4	T181	T181-K185 HydrophobicContact CG2-CG 4.03Å; T181-K185 WeakPolarHBondContact O-CB 3.39Å; T181-K185 VanDerWaalsContact O-CG 3.27Å; T181-K185 WeakPolarHBondContact O-CG 3.41Å; T181-K185 PolarHBondContact O-N 2.74Å
186	F	82.7	Confident	84.5	Confident	1 Å²	1	50.7 Å²	50.7	0%	0.004	24%	0.236	C	C	.	.	I	π-helix	trans	-122.2	-66.3	-175	-176.3	-109	0	0	0	111.6	V118 F119 A122 F134 W182 K188 V189 I190	V118-F186 HydrophobicContact CG1-CD2 4.46Å; V118-F186 HydrophobicContact CG1-CE2 3.82Å; V118-F186 HydrophobicContact CG1-CZ 4.02Å; F119-F186 HydrophobicContact CB-CD2 4.06Å; F119-F186 HydrophobicContact CB-CE2 4.43Å; F119-F186 HydrophobicContact CD2-CD2 4.37Å; A122-F186 HydrophobicContact CB-CE2 3.96Å; A122-F186 HydrophobicContact CB-CZ 4.2Å; F134-F186 AromaticContact CD2-CE1 3.54Å; F134-F186 HydrophobicContact CD2-CE1 3.54Å; F134-F186 HydrophobicContact CD2-CZ 4.2Å; F134-F186 HydrophobicContact CE2-CD1 4.24Å; F134-F186 AromaticContact CE2-CE1 3.69Å; F134-F186 HydrophobicContact CE2-CE1 3.69Å; W182-F186 HydrophobicContact CD2-CB 4.49Å; W182-F186 HydrophobicContact CD2-CD1 4.03Å; W182-F186 AromaticContact CE2-CD1 3.48Å; W182-F186 VanDerWaalsContact CE2-CD1 3.48Å; W182-F186 AromaticContact CE2-CE1 3.95Å; W182-F186 HydrophobicContact CE3-CD1 4.4Å; W182-F186 AromaticContact CH2-CD1 3.84Å; W182-F186 HydrophobicContact CH2-CD1 3.84Å; W182-F186 AromaticContact CH2-CE1 3.73Å; W182-F186 HydrophobicContact CH2-CE1 3.73Å; W182-F186 HydrophobicContact CH2-CZ 4.47Å; W182-F186 AromaticContact CZ2-CD1 3.4Å; W182-F186 HydrophobicContact CZ2-CD1 3.4Å; W182-F186 VanDerWaalsContact CZ2-CD1 3.4Å; W182-F186 AromaticContact CZ2-CE1 3.37Å; W182-F186 HydrophobicContact CZ2-CE1 3.37Å; W182-F186 HydrophobicContact CZ2-CG 4.48Å; W182-F186 HydrophobicContact CZ2-CZ 4.46Å; W182-F186 HydrophobicContact CZ3-CD1 4.31Å; W182-F186 AromaticContact NE1-CD1 3.92Å; W182-F186 WeakPolarHBondContact O-CA 3.33Å; W182-F186 WeakPolarHBondContact O-CB 3.42Å; W182-F186 PolarHBondContact O-N 3.17Å; F186-K188 PolarHBondContact O-N 3.48Å; F186-V189 PolarHBondContact O-N 3.3Å; F186-V189 VanDerWaalsContact O-N 3.08Å; F186-I190 HydrophobicContact CE1-CG2 4.48Å; F186-I190 PolarHBondContact O-N 2.84Å
187	L	84	Confident	84.8	Confident	4 Å²	4	47.9 Å²	47.9	2%	0.021	22%	0.224	C	C	.	.	I	π-helix	trans	-59.9	-44.7	-172.1	-177.6	61.4	0	0	0	112.4	F134 W182 V189 I190 H191 Y223 L226	F134-L187 HydrophobicContact CE2-CD1 4.12Å; F134-L187 HydrophobicContact CZ-CD1 4.18Å; W182-L187 PolarHBondContact O-N 3.21Å; L187-V189 PolarHBondContact O-N 3.11Å; L187-I190 PolarHBondContact O-N 2.9Å; L187-H191 HydrophobicContact CD1-CB 4.06Å; L187-H191 HydrophobicContact CG-CB 4.36Å; L187-H191 WeakPolarHBondContact O-CB 3.48Å; L187-H191 PolarHBondContact O-N 3.45Å; L187-Y223 HydrophobicContact CD1-CE1 3.95Å; L187-Y223 HydrophobicContact CD2-CD1 3.96Å; L187-Y223 HydrophobicContact CD2-CE1 3.88Å; L187-Y223 HydrophobicContact CG-CE1 4.3Å; L187-L226 HydrophobicContact CD2-CD1 3.38Å
188	K	81.8	Confident	85.2	Confident	152 Å²	152	47.3 Å²	47.3	66%	0.661	22%	0.221	S	C	*	.	H	α-helix	trans	-55.7	-27.5	179.6	-172.7	167.4	-173.9	166.3	0	113.6	E183 F186 H191	E183-K188 VanDerWaalsContact O-CB 3.26Å; E183-K188 WeakPolarHBondContact O-CB 3.49Å; E183-K188 PolarHBondContact O-N 2.97Å; F186-K188 PolarHBondContact O-N 3.48Å; K188-H191 PolarHBondContact O-CE1 3.36Å; K188-H191 PolarHBondContact O-ND1 3.05Å
189	V	82.3	Confident	85.7	Confident	86 Å²	86	47.7 Å²	47.7	52%	0.521	22%	0.223	S	C	.	.	H	α-helix	trans	-85.5	-32.5	179.9	-166.3	0	0	0	0	112.3	F119 F186 L187	F119-V189 HydrophobicContact CD2-CB 4.49Å; F119-V189 HydrophobicContact CD2-CG1 4.48Å; F119-V189 HydrophobicContact CE2-CB 3.85Å; F119-V189 HydrophobicContact CE2-CG1 3.44Å; F119-V189 VanDerWaalsContact CE2-CG1 3.44Å; F119-V189 HydrophobicContact CZ-CG1 3.68Å; F186-V189 PolarHBondContact O-N 3.3Å; F186-V189 VanDerWaalsContact O-N 3.08Å; L187-V189 PolarHBondContact O-N 3.11Å
190	I	86	Confident	85.9	Confident	2 Å²	2	52.5 Å²	52.5	1%	0.01	24%	0.244	C	C	.	.	H	α-helix	trans	-113.3	-9.2	-168.9	-157	163.4	0	0	0	115.2	A122 L130 F186 L187 H192 Q193 I194	A122-I190 HydrophobicContact CB-CD1 3.54Å; L130-I190 HydrophobicContact CD1-CD1 3.78Å; F186-I190 HydrophobicContact CE1-CG2 4.48Å; F186-I190 PolarHBondContact O-N 2.84Å; L187-I190 PolarHBondContact O-N 2.9Å; I190-H192 VanDerWaalsContact C-N 3.29Å; I190-H192 PolarHBondContact O-N 3.18Å; I190-H192 VanDerWaalsContact O-N 3.11Å; I190-Q193 HydrophobicContact CG1-CB 4.23Å; I190-Q193 HydrophobicContact CG1-CG 4.5Å; I190-Q193 PolarHBondContact O-N 3.16Å; I190-I194 HydrophobicContact CG1-CG1 4.39Å; I190-I194 HydrophobicContact CG2-CD1 3.67Å; I190-I194 HydrophobicContact CG2-CG1 4.35Å; I190-I194 PolarHBondContact O-N 2.94Å
191	H	86.4	Confident	86.3	Confident	56 Å²	56	50 Å²	50	26%	0.259	23%	0.232	S	C	.	.	H	α-helix	trans	-46.2	-45.5	-176.5	68.9	-74.4	0	0	0	113.9	L187 K188 Q193 I194 T195 Y223 N250	L187-H191 HydrophobicContact CD1-CB 4.06Å; L187-H191 HydrophobicContact CG-CB 4.36Å; L187-H191 WeakPolarHBondContact O-CB 3.48Å; L187-H191 PolarHBondContact O-N 3.45Å; K188-H191 PolarHBondContact O-CE1 3.36Å; K188-H191 PolarHBondContact O-ND1 3.05Å; H191-Q193 VanDerWaalsContact C-N 3.31Å; H191-Q193 PolarHBondContact O-N 2.76Å; H191-I194 PolarHBondContact O-N 3.25Å; H191-T195 WeakPolarHBondContact O-CB 3.42Å; H191-T195 PolarHBondContact O-N 2.86Å; H191-T195 PolarHBondContact O-OG1 2.73Å; H191-Y223 HydrophobicContact CB-CE1 4.48Å; H191-Y223 PolarHBondContact O-OH 3.48Å; H191-N250 PolarHBondContact CD2-OD1 2.86Å
192	H	87.5	Confident	86.9	Confident	132 Å²	132	49.1 Å²	49.1	61%	0.611	23%	0.227	S	C	*	.	H	α-helix	trans	-62.2	-35.2	-179.6	-174.1	-49.8	0	0	0	112.8	I190 R196	I190-H192 VanDerWaalsContact C-N 3.29Å; I190-H192 PolarHBondContact O-N 3.18Å; I190-H192 VanDerWaalsContact O-N 3.11Å; H192-R196 WeakPolarHBondContact O-CB 3.43Å; H192-R196 PolarHBondContact O-N 3.15Å
193	Q	88.2	Confident	87.1	Confident	73 Å²	73	49.5 Å²	49.5	34%	0.341	23%	0.23	S	C	.	.	H	α-helix	trans	-72.1	-42.9	177.7	-56.4	-167.8	37.6	0	0	110.5	L130 I190 H191 R196 A197	L130-Q193 HydrophobicContact CD2-CB 3.72Å; I190-Q193 HydrophobicContact CG1-CB 4.23Å; I190-Q193 HydrophobicContact CG1-CG 4.5Å; I190-Q193 PolarHBondContact O-N 3.16Å; H191-Q193 VanDerWaalsContact C-N 3.31Å; H191-Q193 PolarHBondContact O-N 2.76Å; Q193-R196 PolarHBondContact O-N 3.5Å; Q193-A197 PolarHBondContact O-N 3.44Å
194	I	89.9	Confident	87.3	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-65.3	-50.3	178.9	-62.6	178.4	0	0	0	111.4	L130 F134 I190 H191 R196 A197 V198 V219	L130-I194 HydrophobicContact CD2-CG1 4.23Å; L130-I194 HydrophobicContact CG-CG1 4.32Å; F134-I194 HydrophobicContact CB-CD1 4.19Å; F134-I194 HydrophobicContact CD1-CD1 4.35Å; F134-I194 HydrophobicContact CD2-CD1 3.16Å; F134-I194 HydrophobicContact CE2-CD1 3.44Å; F134-I194 VanDerWaalsContact CE2-CD1 3.44Å; F134-I194 HydrophobicContact CG-CD1 3.66Å; F134-I194 HydrophobicContact CZ-CD1 4.13Å; I190-I194 HydrophobicContact CG1-CG1 4.39Å; I190-I194 HydrophobicContact CG2-CD1 3.67Å; I190-I194 HydrophobicContact CG2-CG1 4.35Å; I190-I194 PolarHBondContact O-N 2.94Å; H191-I194 PolarHBondContact O-N 3.25Å; I194-R196 VanDerWaalsContact C-N 3.28Å; I194-R196 PolarHBondContact O-N 3.42Å; I194-A197 PolarHBondContact O-N 3.5Å; I194-A197 VanDerWaalsContact O-N 3.12Å; I194-V198 HydrophobicContact CG2-CG2 4.32Å; I194-V198 WeakPolarHBondContact O-CG2 3.5Å; I194-V198 PolarHBondContact O-N 3.47Å; I194-V219 HydrophobicContact CG2-CG1 3.71Å; I194-V219 HydrophobicContact CG2-CG2 4Å
195	T	91.2	Very high	87.8	Confident	10 Å²	10	48.5 Å²	48.5	6%	0.061	23%	0.225	C	C	.	.	H	α-helix	trans	-57.1	-43.9	178	-68	0	0	0	0	110.7	H191 A197 V198 L199 Y223 N250 F251 A254	H191-T195 WeakPolarHBondContact O-CB 3.42Å; H191-T195 PolarHBondContact O-N 2.86Å; H191-T195 PolarHBondContact O-OG1 2.73Å; T195-A197 PolarHBondContact O-N 2.82Å; T195-V198 PolarHBondContact O-N 2.76Å; T195-L199 HydrophobicContact CG2-CD1 3.85Å; T195-L199 HydrophobicContact CG2-CG 4.24Å; T195-L199 WeakPolarHBondContact O-CB 3.38Å; T195-L199 VanDerWaalsContact O-CG 3.28Å; T195-L199 WeakPolarHBondContact O-CG 3.44Å; T195-L199 PolarHBondContact O-N 3.38Å; T195-Y223 PolarHBondContact OG1-OH 3.43Å; T195-N250 WeakPolarHBondContact CB-O 3.28Å; T195-N250 WeakPolarHBondContact CG2-O 3.24Å; T195-N250 PolarHBondContact OG1-O 3.34Å; T195-F251 HydrophobicContact CG2-CD2 4.38Å; T195-A254 HydrophobicContact CG2-CB 4.26Å
196	R	91	Very high	88.4	Confident	187 Å²	187	43.3 Å²	43.3	71%	0.706	20%	0.202	S	C	*	.	H	α-helix	trans	-62.6	-39.9	177.2	-173.3	178.6	-179.4	-172.4	-0.4	112.7	H192 Q193 I194 K200	H192-R196 WeakPolarHBondContact O-CB 3.43Å; H192-R196 PolarHBondContact O-N 3.15Å; Q193-R196 PolarHBondContact O-N 3.5Å; I194-R196 VanDerWaalsContact C-N 3.28Å; I194-R196 PolarHBondContact O-N 3.42Å; R196-K200 WeakPolarHBondContact O-CB 3.39Å; R196-K200 PolarHBondContact O-N 3.37Å; R196-K200 VanDerWaalsContact O-N 3.08Å
197	A	90.4	Very high	88.7	Confident	5 Å²	5	51.1 Å²	51.1	4%	0.041	23%	0.232	C	C	.	.	H	α-helix	trans	-65.8	-43.8	175.2	0	0	0	0	0	111.9	D127 V131 Q193 I194 T195 K200 L201	D127-A197 WeakPolarHBondContact O-CB 3.36Å; V131-A197 HydrophobicContact CG2-CB 3.64Å; Q193-A197 PolarHBondContact O-N 3.44Å; I194-A197 PolarHBondContact O-N 3.5Å; I194-A197 VanDerWaalsContact O-N 3.12Å; T195-A197 PolarHBondContact O-N 2.82Å; A197-K200 WeakPolarHBondContact O-CB 3.28Å; A197-K200 PolarHBondContact O-N 3.23Å; A197-L201 WeakPolarHBondContact O-CG 3.48Å; A197-L201 PolarHBondContact O-N 3.46Å
198	V	91.7	Very high	88.7	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-64.3	-42.1	177.3	173.7	0	0	0	0	112	V131 I194 T195 K200 L201 I202 I216 V219 F251	V131-V198 HydrophobicContact CG1-CG2 4.4Å; V131-V198 HydrophobicContact CG2-CG2 4.13Å; I194-V198 HydrophobicContact CG2-CG2 4.32Å; I194-V198 WeakPolarHBondContact O-CG2 3.5Å; I194-V198 PolarHBondContact O-N 3.47Å; T195-V198 PolarHBondContact O-N 2.76Å; V198-K200 VanDerWaalsContact C-N 3.34Å; V198-K200 PolarHBondContact O-N 2.8Å; V198-L201 WeakPolarHBondContact O-CB 3.3Å; V198-L201 PolarHBondContact O-N 3.42Å; V198-I202 HydrophobicContact CG1-CD1 4.21Å; V198-I202 WeakPolarHBondContact O-CG1 3.36Å; V198-I202 PolarHBondContact O-N 3.17Å; V198-I216 HydrophobicContact CG1-CB 4.45Å; V198-I216 HydrophobicContact CG1-CG1 4.31Å; V198-I216 HydrophobicContact CG1-CG2 3.86Å; V198-V219 HydrophobicContact CG2-CB 4.16Å; V198-V219 HydrophobicContact CG2-CG1 4.07Å; V198-V219 HydrophobicContact CG2-CG2 4.06Å; V198-F251 HydrophobicContact CG1-CD2 4.49Å; V198-F251 HydrophobicContact CG1-CE2 3.82Å
199	L	92.1	Very high	88.9	Confident	11 Å²	11	51.9 Å²	51.9	6%	0.058	26%	0.256	C	S	.	.	H	α-helix	trans	-63.2	-40	175.5	-69.2	173.7	0	0	0	111.8	T195 L201 I202 S203 F251 A254 F255 E258	T195-L199 HydrophobicContact CG2-CD1 3.85Å; T195-L199 HydrophobicContact CG2-CG 4.24Å; T195-L199 WeakPolarHBondContact O-CB 3.38Å; T195-L199 VanDerWaalsContact O-CG 3.28Å; T195-L199 WeakPolarHBondContact O-CG 3.44Å; T195-L199 PolarHBondContact O-N 3.38Å; L199-L201 VanDerWaalsContact C-N 3.34Å; L199-L201 PolarHBondContact O-N 2.94Å; L199-I202 PolarHBondContact O-N 3.4Å; L199-S203 WeakPolarHBondContact O-CB 3.4Å; L199-S203 PolarHBondContact O-N 3.44Å; L199-F251 HydrophobicContact CD2-CE2 4.04Å; L199-A254 HydrophobicContact CD1-CB 3.86Å; L199-F255 HydrophobicContact CD2-CB 3.85Å; L199-F255 HydrophobicContact CD2-CD2 4.23Å; L199-E258 WeakPolarHBondContact CB-OE2 3.34Å
200	K	90.4	Very high	88.9	Confident	104 Å²	104	53.1 Å²	53.1	45%	0.452	28%	0.276	S	S	.	.	H	α-helix	trans	-58.2	-43.8	172.6	-169.7	-175.3	-174.7	178.7	0	111.9	D127 R196 A197 V198 S203 S204	D127-K200 VanDerWaalsContact OD1-CD 3.25Å; D127-K200 WeakPolarHBondContact OD1-CD 3.33Å; D127-K200 IonicContact OD1-NZ 3.54Å; D127-K200 PolarHBondContact OD1-NZ 2.83Å; D127-K200 IonicContact OD2-NZ 2.74Å; D127-K200 PolarHBondContact OD2-NZ 3.28Å; R196-K200 WeakPolarHBondContact O-CB 3.39Å; R196-K200 PolarHBondContact O-N 3.37Å; R196-K200 VanDerWaalsContact O-N 3.08Å; A197-K200 WeakPolarHBondContact O-CB 3.28Å; A197-K200 PolarHBondContact O-N 3.23Å; V198-K200 VanDerWaalsContact C-N 3.34Å; V198-K200 PolarHBondContact O-N 2.8Å; K200-S203 CarbonylContact O-C 3.59Å; K200-S203 PolarHBondContact O-N 3.44Å; K200-S204 PolarHBondContact O-N 3.1Å
201	L	90.7	Very high	88.8	Confident	16 Å²	16	54.5 Å²	54.5	8%	0.084	28%	0.284	C	S	.	.	H	α-helix	trans	-61.9	-42.4	175.2	-67.9	177	0	0	0	112.1	E128 V131 A197 V198 L199 S204 D205 V211 I216	E128-L201 HydrophobicContact CB-CD2 4.46Å; E128-L201 HydrophobicContact CG-CD2 4.47Å; V131-L201 HydrophobicContact CG2-CD1 4.48Å; A197-L201 WeakPolarHBondContact O-CG 3.48Å; A197-L201 PolarHBondContact O-N 3.46Å; V198-L201 WeakPolarHBondContact O-CB 3.3Å; V198-L201 PolarHBondContact O-N 3.42Å; L199-L201 VanDerWaalsContact C-N 3.34Å; L199-L201 PolarHBondContact O-N 2.94Å; L201-S204 WeakPolarHBondContact O-CB 3.5Å; L201-S204 PolarHBondContact O-N 2.9Å; L201-D205 PolarHBondContact O-N 3.34Å; L201-V211 HydrophobicContact CB-CG1 3.88Å; L201-V211 HydrophobicContact CD2-CG1 4.18Å; L201-V211 HydrophobicContact CG-CG1 4.45Å; L201-I216 HydrophobicContact CB-CD1 4.29Å; L201-I216 HydrophobicContact CB-CG1 4.45Å
202	I	91.7	Very high	88.7	Confident	2 Å²	2	55.2 Å²	55.2	1%	0.01	29%	0.29	C	S	.	.	H	α-helix	trans	-63.7	-42.2	174.4	-65.7	169.5	0	0	0	111	V198 L199 S204 D205 R206 I216 F251 F255 Y297	V198-I202 HydrophobicContact CG1-CD1 4.21Å; V198-I202 WeakPolarHBondContact O-CG1 3.36Å; V198-I202 PolarHBondContact O-N 3.17Å; L199-I202 PolarHBondContact O-N 3.4Å; I202-S204 PolarHBondContact O-N 3.36Å; I202-D205 PolarHBondContact O-N 2.85Å; I202-R206 WeakPolarHBondContact O-CG 3.42Å; I202-R206 PolarHBondContact O-N 3.04Å; I202-I216 HydrophobicContact CD1-CG2 4.47Å; I202-I216 HydrophobicContact CG1-CD1 3.94Å; I202-F251 HydrophobicContact CD1-CE2 4.14Å; I202-F251 HydrophobicContact CD1-CZ 3.85Å; I202-F255 HydrophobicContact CD1-CD2 4.08Å; I202-F255 HydrophobicContact CD1-CE2 4.31Å; I202-F255 HydrophobicContact CG2-CE2 4.14Å; I202-Y297 HydrophobicContact CD1-CE2 4.14Å; I202-Y297 HydrophobicContact CG1-CE2 3.95Å
203	S	90.3	Very high	88.6	Confident	8 Å²	8	51 Å²	51	6%	0.056	27%	0.274	C	S	.	.	H	α-helix	trans	-67	-21.5	176.7	-90.7	0	0	0	0	113.8	L199 K200 R207 E258	L199-S203 WeakPolarHBondContact O-CB 3.4Å; L199-S203 PolarHBondContact O-N 3.44Å; K200-S203 CarbonylContact O-C 3.59Å; K200-S203 PolarHBondContact O-N 3.44Å; S203-R207 WeakPolarHBondContact O-CG 3.44Å; S203-R207 PolarHBondContact O-NE 2.97Å; S203-E258 PolarHBondContact OG-OE1 3.02Å
204	S	88.7	Confident	88.5	Confident	22 Å²	22	56.6 Å²	56.6	15%	0.154	29%	0.292	C	S	.	.	H	α-helix	trans	-79	-45	168.7	-83.8	0	0	0	0	111.9	K200 L201 I202 R206 R207 G208 E209	K200-S204 PolarHBondContact O-N 3.1Å; L201-S204 WeakPolarHBondContact O-CB 3.5Å; L201-S204 PolarHBondContact O-N 2.9Å; I202-S204 PolarHBondContact O-N 3.36Å; S204-R206 VanDerWaalsContact C-N 3.28Å; S204-R206 PolarHBondContact O-N 2.94Å; S204-R207 WeakPolarHBondContact O-CA 3.5Å; S204-R207 WeakPolarHBondContact O-CB 3.37Å; S204-R207 PolarHBondContact O-N 3.43Å; S204-G208 PolarHBondContact O-N 3.32Å; S204-E209 WeakPolarHBondContact CB-OE2 3.25Å; S204-E209 WeakPolarHBondContact O-CB 3.18Å; S204-E209 PolarHBondContact O-N 2.69Å; S204-E209 VanDerWaalsContact O-N 3.08Å; S204-E209 PolarHBondContact OG-OE2 2.82Å
205	D	89.4	Confident	88.4	Confident	35 Å²	35	57 Å²	57	19%	0.187	29%	0.293	C	S	.	.	H	α-helix	trans	-59.2	-36	174.4	177.1	41.4	0	0	0	112.4	L201 I202 R207 G208 V211 R293 Y297	L201-D205 PolarHBondContact O-N 3.34Å; I202-D205 PolarHBondContact O-N 2.85Å; D205-R207 VanDerWaalsContact C-N 3.25Å; D205-R207 PolarHBondContact O-N 2.86Å; D205-G208 PolarHBondContact O-N 2.54Å; D205-G208 VanDerWaalsContact O-N 3.1Å; D205-V211 HydrophobicContact CB-CB 4.47Å; D205-V211 HydrophobicContact CB-CG2 4.36Å; D205-R293 PolarHBondContact O-NH2 3.06Å; D205-R293 IonicContact OD1-NE 3.34Å; D205-R293 WeakPolarHBondContact OD2-CD 3.4Å; D205-R293 WeakPolarHBondContact OD2-CG 3.5Å; D205-R293 IonicContact OD2-NE 3.86Å; D205-R293 PolarHBondContact OD2-NE 3.37Å; D205-Y297 PolarHBondContact OD2-OH 3.16Å
206	R	90.9	Very high	88.4	Confident	3 Å²	3	56.5 Å²	56.5	1%	0.011	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-24.6	171.9	-75.5	178.6	176.2	152.7	0.2	114.6	I202 S204 F255 T259 F262 E290	I202-R206 WeakPolarHBondContact O-CG 3.42Å; I202-R206 PolarHBondContact O-N 3.04Å; S204-R206 VanDerWaalsContact C-N 3.28Å; S204-R206 PolarHBondContact O-N 2.94Å; R206-F255 VanDerWaalsContact NH2-CE2 3.33Å; R206-T259 PolarHBondContact NH1-OG1 3.46Å; R206-T259 VanDerWaalsContact NH2-CG2 3.28Å; R206-T259 PolarHBondContact NH2-OG1 3.27Å; R206-F262 HydrophobicContact CB-CE1 4.07Å; R206-F262 HydrophobicContact CB-CE2 4.26Å; R206-F262 HydrophobicContact CB-CZ 3.75Å; R206-E290 IonicContact CZ-OE1 2.92Å; R206-E290 IonicContact CZ-OE2 3.76Å; R206-E290 IonicContact NE-OE1 2.73Å; R206-E290 PolarHBondContact NE-OE1 3.22Å; R206-E290 IonicContact NE-OE2 2.71Å; R206-E290 PolarHBondContact NE-OE2 3.24Å; R206-E290 IonicContact NH2-OE1 3.18Å; R206-E290 IonicContact NH2-OE2 3.57Å; R206-E290 PolarHBondContact NH2-OE2 3.32Å
207	R	89	Confident	88.2	Confident	165 Å²	165	50 Å²	50	62%	0.623	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.5	-6.2	174.8	-61.9	171.3	-145.5	-143.4	-1.4	113	S203 S204 D205	S203-R207 WeakPolarHBondContact O-CG 3.44Å; S203-R207 PolarHBondContact O-NE 2.97Å; S204-R207 WeakPolarHBondContact O-CA 3.5Å; S204-R207 WeakPolarHBondContact O-CB 3.37Å; S204-R207 PolarHBondContact O-N 3.43Å; D205-R207 VanDerWaalsContact C-N 3.25Å; D205-R207 PolarHBondContact O-N 2.86Å
208	G	83.7	Confident	88	Confident	69 Å²	69	52.8 Å²	52.8	71%	0.711	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.8	17.2	-175.5	0	0	0	0	0	114.3	S204 D205	S204-G208 PolarHBondContact O-N 3.32Å; D205-G208 PolarHBondContact O-N 2.54Å; D205-G208 VanDerWaalsContact O-N 3.1Å
209	E	85.9	Confident	87.9	Confident	103 Å²	103	52.8 Å²	52.8	48%	0.481	29%	0.288	S	S	.	.			trans	-74.5	141.1	169.5	-64.7	170.6	-163	0	0	109.8	S204 V211	S204-E209 WeakPolarHBondContact CB-OE2 3.25Å; S204-E209 WeakPolarHBondContact O-CB 3.18Å; S204-E209 PolarHBondContact O-N 2.69Å; S204-E209 VanDerWaalsContact O-N 3.08Å; S204-E209 PolarHBondContact OG-OE2 2.82Å; E209-V211 PolarHBondContact O-N 2.92Å
210	A	81.3	Confident	87.8	Confident	113 Å²	113	52.6 Å²	52.6	93%	0.934	29%	0.287	S	S	*	.			trans	-76.7	114.4	-177.7	0	0	0	0	0	111.2
211	V	84.6	Confident	87.6	Confident	30 Å²	30	50.2 Å²	50.2	18%	0.182	28%	0.284	C	S	.	.			trans	-119.4	141.2	-173.4	168.9	0	0	0	0	111	L201 D205 E209 T213 I216	L201-V211 HydrophobicContact CB-CG1 3.88Å; L201-V211 HydrophobicContact CD2-CG1 4.18Å; L201-V211 HydrophobicContact CG-CG1 4.45Å; D205-V211 HydrophobicContact CB-CB 4.47Å; D205-V211 HydrophobicContact CB-CG2 4.36Å; E209-V211 PolarHBondContact O-N 2.92Å; V211-T213 PolarHBondContact O-N 3.03Å; V211-I216 HydrophobicContact CG1-CD1 4.11Å
212	N	84.4	Confident	87.5	Confident	72 Å²	72	49.5 Å²	49.5	39%	0.385	28%	0.28	S	S	.	.			trans	-76.3	86.1	175.1	-173.9	-1.6	0	0	0	111.4	R214 L215	N212-R214 PolarHBondContact O-N 2.94Å; N212-R214 PolarHBondContact OD1-N 3Å; N212-L215 HydrophobicContact CB-CD1 4.05Å; N212-L215 HydrophobicContact CB-CG 4.14Å; N212-L215 WeakPolarHBondContact O-CB 3.4Å; N212-L215 PolarHBondContact O-N 2.86Å
213	T	86.2	Confident	87.3	Confident	44 Å²	44	49.5 Å²	49.5	27%	0.27	28%	0.28	S	S	.	.	H	α-helix	trans	-57.3	-20.4	-176.9	55	0	0	0	0	115	V211 L215 I216 S217 M296 Y297	V211-T213 PolarHBondContact O-N 3.03Å; T213-L215 VanDerWaalsContact C-N 3.33Å; T213-I216 PolarHBondContact O-N 3.45Å; T213-S217 PolarHBondContact O-N 2.81Å; T213-S217 VanDerWaalsContact O-N 3.09Å; T213-M296 HydrophobicContact CG2-CE 4.26Å; T213-Y297 HydrophobicContact CG2-CD1 3.88Å; T213-Y297 HydrophobicContact CG2-CE1 3.94Å
214	R	85.8	Confident	87.1	Confident	190 Å²	190	51.9 Å²	51.9	72%	0.717	29%	0.291	S	S	*	.	H	α-helix	trans	-64.4	-37.9	173.3	-64.6	-178.1	179.7	165.1	1.5	112.1	N212 I216 S217 D218	N212-R214 PolarHBondContact O-N 2.94Å; N212-R214 PolarHBondContact OD1-N 3Å; R214-I216 VanDerWaalsContact C-N 3.25Å; R214-I216 PolarHBondContact O-N 2.94Å; R214-S217 PolarHBondContact O-N 3.35Å; R214-D218 WeakPolarHBondContact O-CB 3.45Å; R214-D218 PolarHBondContact O-N 3.3Å
215	L	87.9	Confident	86.8	Confident	7 Å²	7	52.9 Å²	52.9	4%	0.037	29%	0.293	C	S	.	.	H	α-helix	trans	-60.3	-37.9	177.3	-67.6	-177.3	0	0	0	111.8	E128 V131 H132 T135 N212 T213 V219	E128-L215 HydrophobicContact CG-CD1 3.86Å; V131-L215 HydrophobicContact CG1-CB 3.76Å; H132-L215 HydrophobicContact CB-CD1 4.48Å; H132-L215 HydrophobicContact CB-CD2 4.31Å; T135-L215 HydrophobicContact CG2-CD2 4.25Å; N212-L215 HydrophobicContact CB-CD1 4.05Å; N212-L215 HydrophobicContact CB-CG 4.14Å; N212-L215 WeakPolarHBondContact O-CB 3.4Å; N212-L215 PolarHBondContact O-N 2.86Å; T213-L215 VanDerWaalsContact C-N 3.33Å; L215-V219 WeakPolarHBondContact O-CG2 3.43Å; L215-V219 PolarHBondContact O-N 2.88Å
216	I	90.2	Very high	86.4	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-66	-53.1	173.9	-56.1	171.9	0	0	0	109.5	V198 L201 I202 V211 T213 R214 D218 V219 I220 Y297	V198-I216 HydrophobicContact CG1-CB 4.45Å; V198-I216 HydrophobicContact CG1-CG1 4.31Å; V198-I216 HydrophobicContact CG1-CG2 3.86Å; L201-I216 HydrophobicContact CB-CD1 4.29Å; L201-I216 HydrophobicContact CB-CG1 4.45Å; I202-I216 HydrophobicContact CD1-CG2 4.47Å; I202-I216 HydrophobicContact CG1-CD1 3.94Å; V211-I216 HydrophobicContact CG1-CD1 4.11Å; T213-I216 PolarHBondContact O-N 3.45Å; R214-I216 VanDerWaalsContact C-N 3.25Å; R214-I216 PolarHBondContact O-N 2.94Å; I216-D218 VanDerWaalsContact C-N 3.32Å; I216-D218 PolarHBondContact O-N 2.86Å; I216-V219 PolarHBondContact O-N 3.47Å; I216-I220 HydrophobicContact CG2-CG1 4.3Å; I216-I220 WeakPolarHBondContact O-CG1 3.2Å; I216-I220 PolarHBondContact O-N 2.94Å; I216-Y297 HydrophobicContact CB-CD2 4.31Å; I216-Y297 HydrophobicContact CB-CG 4.34Å; I216-Y297 HydrophobicContact CD1-CD2 4.38Å; I216-Y297 HydrophobicContact CD1-CE1 4.39Å; I216-Y297 HydrophobicContact CD1-CE2 4.23Å; I216-Y297 HydrophobicContact CG2-CD2 3.49Å; I216-Y297 VanDerWaalsContact CG2-CD2 3.49Å; I216-Y297 HydrophobicContact CG2-CE2 4.11Å; I216-Y297 HydrophobicContact CG2-CG 3.96Å
217	S	87.4	Confident	85.7	Confident	50 Å²	50	51.2 Å²	51.2	35%	0.35	29%	0.285	S	S	.	.	H	α-helix	trans	-56.3	-41.7	-178.7	-168.4	0	0	0	0	113.3	T213 R214 I220 S221	T213-S217 PolarHBondContact O-N 2.81Å; T213-S217 VanDerWaalsContact O-N 3.09Å; R214-S217 PolarHBondContact O-N 3.35Å; S217-I220 PolarHBondContact O-N 3.29Å; S217-S221 VanDerWaalsContact O-CB 3.27Å; S217-S221 WeakPolarHBondContact O-CB 3.32Å; S217-S221 PolarHBondContact O-N 2.86Å
218	D	86	Confident	84.4	Confident	64 Å²	64	45.7 Å²	45.7	34%	0.342	28%	0.28	S	S	.	.	H	α-helix	trans	-68.6	-35.5	179.9	-72.7	-27.4	0	0	0	112.4	T135 R214 I216 C222	T135-D218 HydrophobicContact CG2-CB 3.45Å; T135-D218 VanDerWaalsContact CG2-CB 3.45Å; R214-D218 WeakPolarHBondContact O-CB 3.45Å; R214-D218 PolarHBondContact O-N 3.3Å; I216-D218 VanDerWaalsContact C-N 3.32Å; I216-D218 PolarHBondContact O-N 2.86Å; D218-C222 WeakPolarHBondContact O-CB 3.49Å; D218-C222 PolarHBondContact O-N 2.9Å; D218-C222 VanDerWaalsContact O-N 3.1Å
219	V	90.3	Very high	83.3	Confident	1 Å²	1	43.4 Å²	43.4	1%	0.006	25%	0.251	C	S	.	.	H	α-helix	trans	-68.9	-44.5	172.2	173.8	0	0	0	0	111.2	V131 F134 T135 I194 V198 L215 I216 S221 C222 Y223	V131-V219 HydrophobicContact CG1-CG2 3.77Å; F134-V219 HydrophobicContact CD1-CG2 3.82Å; F134-V219 HydrophobicContact CE1-CG2 4.01Å; T135-V219 HydrophobicContact CG2-CG2 4.17Å; I194-V219 HydrophobicContact CG2-CG1 3.71Å; I194-V219 HydrophobicContact CG2-CG2 4Å; V198-V219 HydrophobicContact CG2-CB 4.16Å; V198-V219 HydrophobicContact CG2-CG1 4.07Å; V198-V219 HydrophobicContact CG2-CG2 4.06Å; L215-V219 WeakPolarHBondContact O-CG2 3.43Å; L215-V219 PolarHBondContact O-N 2.88Å; I216-V219 PolarHBondContact O-N 3.47Å; V219-S221 VanDerWaalsContact C-N 3.33Å; V219-S221 PolarHBondContact O-N 2.82Å; V219-C222 WeakPolarHBondContact O-CB 3.37Å; V219-C222 PolarHBondContact O-N 2.96Å; V219-C222 VanDerWaalsContact O-N 3.14Å; V219-Y223 HydrophobicContact CG1-CD2 3.97Å; V219-Y223 HydrophobicContact CG1-CE2 3.73Å; V219-Y223 PolarHBondContact O-N 2.97Å
220	I	89.3	Confident	81.5	Confident	6 Å²	6	40.5 Å²	40.5	3%	0.031	24%	0.242	C	C	.	.	H	α-helix	trans	-61.7	-43.3	177.4	-64.5	-37.3	0	0	0	110.9	I216 S217 C222 Y223 I224 Y247 F251	I216-I220 HydrophobicContact CG2-CG1 4.3Å; I216-I220 WeakPolarHBondContact O-CG1 3.2Å; I216-I220 PolarHBondContact O-N 2.94Å; S217-I220 PolarHBondContact O-N 3.29Å; I220-C222 VanDerWaalsContact C-N 3.28Å; I220-C222 PolarHBondContact O-N 2.85Å; I220-Y223 HydrophobicContact CD1-CD2 4.49Å; I220-Y223 PolarHBondContact O-N 2.86Å; I220-I224 HydrophobicContact CG2-CD1 3.79Å; I220-I224 HydrophobicContact CG2-CG1 4.49Å; I220-I224 WeakPolarHBondContact O-CG1 3.31Å; I220-I224 PolarHBondContact O-N 3.49Å; I220-Y247 HydrophobicContact CB-CE2 4.48Å; I220-Y247 HydrophobicContact CD1-CD2 4.26Å; I220-Y247 HydrophobicContact CD1-CE2 3.9Å; I220-Y247 HydrophobicContact CG1-CE2 4.32Å; I220-Y247 HydrophobicContact CG2-CD2 3.92Å; I220-Y247 HydrophobicContact CG2-CE2 3.58Å; I220-F251 HydrophobicContact CD1-CD1 3.77Å; I220-F251 HydrophobicContact CD1-CD2 3.82Å; I220-F251 HydrophobicContact CD1-CE1 3.86Å; I220-F251 HydrophobicContact CD1-CE2 3.9Å; I220-F251 HydrophobicContact CD1-CG 3.76Å; I220-F251 HydrophobicContact CD1-CZ 3.92Å
221	S	85.8	Confident	79.8	Confident	55 Å²	55	37.8 Å²	37.8	39%	0.385	22%	0.22	S	C	.	.	H	α-helix	trans	-58.1	-38.3	173.7	-174.1	0	0	0	0	112.4	S217 V219 I224 E225	S217-S221 VanDerWaalsContact O-CB 3.27Å; S217-S221 WeakPolarHBondContact O-CB 3.32Å; S217-S221 PolarHBondContact O-N 2.86Å; V219-S221 VanDerWaalsContact C-N 3.33Å; V219-S221 PolarHBondContact O-N 2.82Å; S221-I224 PolarHBondContact O-N 2.92Å; S221-E225 WeakPolarHBondContact O-CB 3.47Å; S221-E225 PolarHBondContact O-N 2.77Å
222	C	88.6	Confident	78	Confident	1 Å²	1	38.8 Å²	38.8	1%	0.007	24%	0.236	C	C	.	.	H	α-helix	trans	-65.4	-46.6	174.9	-169.7	0	0	0	0	112.4	F134 W138 D218 V219 I220 I224 E225 L226	F134-C222 HydrophobicContact CE1-CB 3.98Å; F134-C222 HydrophobicContact CZ-CB 4.14Å; F134-C222 VanDerWaalsContact CZ-SG 3.54Å; W138-C222 HydrophobicContact CD2-CB 4.33Å; W138-C222 VanDerWaalsContact CD2-SG 3.56Å; W138-C222 HydrophobicContact CG-CB 4.38Å; W138-C222 HydrophobicContact CZ2-CB 4.28Å; D218-C222 WeakPolarHBondContact O-CB 3.49Å; D218-C222 PolarHBondContact O-N 2.9Å; D218-C222 VanDerWaalsContact O-N 3.1Å; V219-C222 WeakPolarHBondContact O-CB 3.37Å; V219-C222 PolarHBondContact O-N 2.96Å; V219-C222 VanDerWaalsContact O-N 3.14Å; I220-C222 VanDerWaalsContact C-N 3.28Å; I220-C222 PolarHBondContact O-N 2.85Å; C222-I224 VanDerWaalsContact C-N 3.31Å; C222-I224 PolarHBondContact O-N 3.44Å; C222-E225 PolarHBondContact O-N 3Å; C222-L226 WeakPolarHBondContact O-CB 3.29Å; C222-L226 VanDerWaalsContact O-CG 3.24Å; C222-L226 WeakPolarHBondContact O-CG 3.2Å; C222-L226 PolarHBondContact O-N 3.13Å; C222-L226 VanDerWaalsContact SG-CD1 3.6Å
223	Y	88.6	Confident	75.6	Confident	2 Å²	2	40.4 Å²	40.4	1%	0.008	25%	0.25	C	C	.	.	H	α-helix	trans	-61.3	-37.4	175.9	-77.1	-50.6	0	0	0	112.8	L187 H191 T195 V219 I220 S227 L246 N250 F251	L187-Y223 HydrophobicContact CD1-CE1 3.95Å; L187-Y223 HydrophobicContact CD2-CD1 3.96Å; L187-Y223 HydrophobicContact CD2-CE1 3.88Å; L187-Y223 HydrophobicContact CG-CE1 4.3Å; H191-Y223 HydrophobicContact CB-CE1 4.48Å; H191-Y223 PolarHBondContact O-OH 3.48Å; T195-Y223 PolarHBondContact OG1-OH 3.43Å; V219-Y223 HydrophobicContact CG1-CD2 3.97Å; V219-Y223 HydrophobicContact CG1-CE2 3.73Å; V219-Y223 PolarHBondContact O-N 2.97Å; I220-Y223 HydrophobicContact CD1-CD2 4.49Å; I220-Y223 PolarHBondContact O-N 2.86Å; Y223-S227 PolarHBondContact O-N 3.18Å; Y223-S227 PolarHBondContact O-OG 3.2Å; Y223-L246 HydrophobicContact CD1-CB 4.37Å; Y223-N250 HydrophobicContact CD1-CB 4.34Å; Y223-N250 HydrophobicContact CE1-CB 3.71Å; Y223-F251 HydrophobicContact CD2-CB 4.15Å; Y223-F251 HydrophobicContact CE2-CB 4.11Å
224	I	85.5	Confident	73.1	Confident	57 Å²	57	41.6 Å²	41.6	29%	0.292	27%	0.271	S	S	.	.	H	α-helix	trans	-71.7	-50.2	177.3	-64.5	168.4	0	0	0	110.8	I220 S221 C222 L226 S227 Y247 C299	I220-I224 HydrophobicContact CG2-CD1 3.79Å; I220-I224 HydrophobicContact CG2-CG1 4.49Å; I220-I224 WeakPolarHBondContact O-CG1 3.31Å; I220-I224 PolarHBondContact O-N 3.49Å; S221-I224 PolarHBondContact O-N 2.92Å; C222-I224 VanDerWaalsContact C-N 3.31Å; C222-I224 PolarHBondContact O-N 3.44Å; I224-L226 VanDerWaalsContact C-N 3.27Å; I224-L226 PolarHBondContact O-N 2.88Å; I224-S227 WeakPolarHBondContact O-CB 3.43Å; I224-S227 PolarHBondContact O-N 3.44Å; I224-Y247 HydrophobicContact CG1-CD2 4.38Å; I224-Y247 HydrophobicContact CG1-CG 4.29Å; I224-C299 HydrophobicContact CD1-CB 4.34Å
225	E	81.5	Confident	70.6	Confident	43 Å²	43	40.3 Å²	40.3	20%	0.201	28%	0.278	C	S	.	.	H	α-helix	trans	-63.9	-30.9	-177.9	-173.1	166.8	-157.1	0	0	112.8	W138 R142 Y175 L179 S221 C222	W138-E225 HydrophobicContact CZ2-CB 4.37Å; W138-E225 HydrophobicContact CZ2-CG 4.45Å; R142-E225 WeakPolarHBondContact CD-OE2 3.36Å; R142-E225 IonicContact CZ-OE1 4Å; R142-E225 VanDerWaalsContact CZ-OE1 3.28Å; R142-E225 IonicContact CZ-OE2 3.35Å; R142-E225 IonicContact NE-OE1 3.51Å; R142-E225 PolarHBondContact NE-OE1 2.96Å; R142-E225 IonicContact NE-OE2 2.88Å; R142-E225 PolarHBondContact NE-OE2 2.99Å; R142-E225 VanDerWaalsContact NH2-CD 3.32Å; R142-E225 IonicContact NH2-OE1 3.12Å; R142-E225 PolarHBondContact NH2-OE1 2.79Å; R142-E225 IonicContact NH2-OE2 3.86Å; R142-E225 PolarHBondContact NH2-OE2 2.92Å; Y175-E225 PolarHBondContact OH-OE1 2.93Å; L179-E225 HydrophobicContact CD1-CG 4.27Å; S221-E225 WeakPolarHBondContact O-CB 3.47Å; S221-E225 PolarHBondContact O-N 2.77Å; C222-E225 PolarHBondContact O-N 3Å
226	L	82.6	Confident	67.9	Low	0 Å²	0	43.6 Å²	43.6	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-78.6	-21.1	175.1	-65.2	171.7	0	0	0	113.7	W138 L179 L187 C222 I224 G228 I229 L246	W138-L226 HydrophobicContact CH2-CD1 4.46Å; W138-L226 HydrophobicContact CH2-CD2 3.78Å; W138-L226 HydrophobicContact CH2-CG 4.03Å; W138-L226 HydrophobicContact CZ3-CD2 4.17Å; L179-L226 HydrophobicContact CB-CD2 3.97Å; L187-L226 HydrophobicContact CD2-CD1 3.38Å; C222-L226 WeakPolarHBondContact O-CB 3.29Å; C222-L226 VanDerWaalsContact O-CG 3.24Å; C222-L226 WeakPolarHBondContact O-CG 3.2Å; C222-L226 PolarHBondContact O-N 3.13Å; C222-L226 VanDerWaalsContact SG-CD1 3.6Å; I224-L226 VanDerWaalsContact C-N 3.27Å; I224-L226 PolarHBondContact O-N 2.88Å; L226-G228 VanDerWaalsContact C-N 3.25Å; L226-G228 PolarHBondContact O-N 3.41Å; L226-I229 HydrophobicContact CB-CD1 4.29Å; L226-I229 HydrophobicContact CD2-CD1 3.69Å; L226-I229 WeakPolarHBondContact O-CD1 3.47Å; L226-I229 PolarHBondContact O-N 2.73Å; L226-L246 HydrophobicContact CB-CD1 3.63Å
227	S	74.5	Confident	65.5	Low	3 Å²	3	51.1 Å²	51.1	2%	0.021	33%	0.33	C	S	.	.	H	α-helix	trans	-64.4	-31.5	-179.8	-66.4	0	0	0	0	112.3	Y223 I224 I229 G243 R245 L246	Y223-S227 PolarHBondContact O-N 3.18Å; Y223-S227 PolarHBondContact O-OG 3.2Å; I224-S227 WeakPolarHBondContact O-CB 3.43Å; I224-S227 PolarHBondContact O-N 3.44Å; S227-I229 PolarHBondContact O-N 3.42Å; S227-G243 VanDerWaalsContact CB-O 3.32Å; S227-G243 WeakPolarHBondContact CB-O 3.34Å; S227-R245 PolarHBondContact OG-N 3.1Å; S227-L246 WeakPolarHBondContact OG-CB 3.44Å; S227-L246 PolarHBondContact OG-N 2.83Å
228	G	62	Low	63.4	Low	50 Å²	50	52.4 Å²	52.4	52%	0.515	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-2.5	-176.5	0	0	0	0	0	116.6	L226	L226-G228 VanDerWaalsContact C-N 3.25Å; L226-G228 PolarHBondContact O-N 3.41Å
229	I	60.4	Low	61.5	Low	21 Å²	21	54.5 Å²	54.5	11%	0.108	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.4	-24.8	-174.2	-49.7	148.8	0	0	0	111.8	L172 H176 L179 H180 L226 S227	L172-I229 HydrophobicContact CD1-CG2 4.45Å; H176-I229 HydrophobicContact CB-CG2 4.48Å; L179-I229 HydrophobicContact CB-CD1 3.23Å; L179-I229 HydrophobicContact CB-CG1 4.07Å; L179-I229 HydrophobicContact CD1-CD1 3.96Å; L179-I229 HydrophobicContact CD1-CG1 4.31Å; L179-I229 HydrophobicContact CG-CD1 4.26Å; H180-I229 HydrophobicContact CB-CG2 3.89Å; L226-I229 HydrophobicContact CB-CD1 4.29Å; L226-I229 HydrophobicContact CD2-CD1 3.69Å; L226-I229 WeakPolarHBondContact O-CD1 3.47Å; L226-I229 PolarHBondContact O-N 2.73Å; S227-I229 PolarHBondContact O-N 3.42Å
230	S	49.7	Very low	59.7	Low	42 Å²	42	62 Å²	62	29%	0.294	38%	0.382	S	S	.	.			trans	-99.8	15.4	-167.8	-63.1	0	0	0	0	113.4	E183 G232	E183-S230 PolarHBondContact OE1-OG 2.99Å; E183-S230 PolarHBondContact OE2-OG 3.09Å; S230-G232 PolarHBondContact O-N 2.79Å; S230-G232 VanDerWaalsContact O-N 3.11Å
231	A	45.3	Very low	58.2	Low	56 Å²	56	66 Å²	66	46%	0.463	40%	0.401	S	S	.	.			trans	-82	74.5	178.1	0	0	0	0	0	111.7	E242	A231-E242 HydrophobicContact CB-CG 4.1Å
232	G	45.8	Very low	56.8	Low	50 Å²	50	66.8 Å²	66.8	52%	0.515	40%	0.398	S	S	.	.			trans	-70.9	142.4	163.9	0	0	0	0	0	110.6	S230 G234	S230-G232 PolarHBondContact O-N 2.79Å; S230-G232 VanDerWaalsContact O-N 3.11Å; G232-G234 PolarHBondContact O-N 2.91Å; G232-G234 VanDerWaalsContact O-N 3.08Å
233	P	33.6	Very low	55.6	Low	106 Å²	106	68.3 Å²	68.3	69%	0.688	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.5	109.5	-173.5	27.1	-34.1	0	0	0	111.7	D169	D169-P233 WeakPolarHBondContact OD2-CG 3.48Å
234	G	34	Very low	54.9	Low	69 Å²	69	69.6 Å²	69.6	71%	0.711	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	161.4	-11.7	160.3	0	0	0	0	0	121.9	G232	G232-G234 PolarHBondContact O-N 2.91Å; G232-G234 VanDerWaalsContact O-N 3.08Å
235	L	34.3	Very low	54.7	Low	164 Å²	164	72.9 Å²	72.9	86%	0.859	43%	0.43	S	S	*	.	S	Bend	trans	-141.8	53	-161	-76.4	166.5	0	0	0	116.6
236	C	31.6	Very low	54.7	Low	76 Å²	76	71.9 Å²	71.9	51%	0.514	43%	0.426	S	S	.	.			trans	-161.6	161.1	158.4	-99.2	0	0	0	0	111.3
237	Y	39.2	Very low	55	Low	158 Å²	158	71.9 Å²	71.9	62%	0.62	43%	0.426	S	S	*	.	S	Bend	trans	-107.3	-13.7	-177.9	-110.8	-103.4	0	0	0	115.5	T840 S841	Y237-T840 HydrophobicContact CD2-CG2 4.4Å; Y237-T840 HydrophobicContact CE2-CG2 3.49Å; Y237-T840 VanDerWaalsContact CE2-CG2 3.49Å; Y237-T840 VanDerWaalsContact OH-CB 3.26Å; Y237-T840 WeakPolarHBondContact OH-CB 3.35Å; Y237-S841 PolarHBondContact OH-N 2.92Å; Y237-S841 PolarHBondContact OH-OG 3.45Å
238	D	43.8	Very low	55.5	Low	76 Å²	76	73 Å²	73	41%	0.406	43%	0.431	S	S	.	.			trans	-117.6	115	175.1	-165.7	-28.7	0	0	0	110.7	K240 E241	D238-K240 PolarHBondContact O-N 3.49Å; D238-K240 WeakPolarHBondContact OD1-CB 3.29Å; D238-K240 PolarHBondContact OD1-N 3.44Å; D238-E241 HydrophobicContact CB-CG 4.35Å; D238-E241 PolarHBondContact O-N 2.81Å; D238-E241 VanDerWaalsContact O-N 3.16Å
239	P	46.2	Very low	56.7	Low	108 Å²	108	75.3 Å²	75.3	70%	0.701	43%	0.428	S	S	*	.	H	α-helix	trans	-57.8	-16.1	175.7	-25	34.7	0	0	0	115
240	K	51.9	Low	58	Low	158 Å²	158	75.9 Å²	75.9	69%	0.687	43%	0.432	S	S	*	.	H	α-helix	trans	-80.5	-35	176.5	-67.9	-177.5	176.1	-179.2	0	113.2	D238 M244	D238-K240 PolarHBondContact O-N 3.49Å; D238-K240 WeakPolarHBondContact OD1-CB 3.29Å; D238-K240 PolarHBondContact OD1-N 3.44Å; K240-M244 VanDerWaalsContact O-CE 3.25Å; K240-M244 WeakPolarHBondContact O-CE 3.2Å
241	E	56.6	Low	60	Low	91 Å²	91	73.9 Å²	73.9	43%	0.425	42%	0.418	S	S	.	.	H	α-helix	trans	-74.3	-34.8	179.4	-66.5	-163.5	135.1	0	0	111.5	D238 G243 M244 R245 I248	D238-E241 HydrophobicContact CB-CG 4.35Å; D238-E241 PolarHBondContact O-N 2.81Å; D238-E241 VanDerWaalsContact O-N 3.16Å; E241-G243 VanDerWaalsContact C-N 3.3Å; E241-G243 PolarHBondContact O-N 3.11Å; E241-M244 CarbonylContact O-C 3.56Å; E241-M244 PolarHBondContact O-N 3.05Å; E241-R245 PolarHBondContact O-N 2.86Å; E241-R245 VanDerWaalsContact O-N 3.11Å; E241-I248 HydrophobicContact CB-CD1 4.23Å; E241-I248 HydrophobicContact CG-CD1 4.32Å
242	E	57.1	Low	62.2	Low	71 Å²	71	71.2 Å²	71.2	33%	0.332	40%	0.396	S	S	.	.	H	α-helix	trans	-59.8	-39.9	178.1	-164.4	163.6	-138.9	0	0	111.9	A231 M244	A231-E242 HydrophobicContact CB-CG 4.1Å; E242-M244 PolarHBondContact O-N 2.88Å
243	G	63.8	Low	64.4	Low	34 Å²	34	73.2 Å²	73.2	35%	0.351	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-2	174.2	0	0	0	0	0	115.8	S227 E241	S227-G243 VanDerWaalsContact CB-O 3.32Å; S227-G243 WeakPolarHBondContact CB-O 3.34Å; E241-G243 VanDerWaalsContact C-N 3.3Å; E241-G243 PolarHBondContact O-N 3.11Å
244	M	73.8	Confident	67.1	Low	29 Å²	29	70 Å²	70	14%	0.143	38%	0.378	C	S	.	.	T	Hydrogen-bonded Turn	trans	-130.5	12.3	-179.1	-64.8	-171.4	-72.3	0	0	113.2	K240 E241 E242 L246 Y247 I248	K240-M244 VanDerWaalsContact O-CE 3.25Å; K240-M244 WeakPolarHBondContact O-CE 3.2Å; E241-M244 CarbonylContact O-C 3.56Å; E241-M244 PolarHBondContact O-N 3.05Å; E242-M244 PolarHBondContact O-N 2.88Å; M244-L246 PolarHBondContact O-N 2.75Å; M244-Y247 WeakPolarHBondContact O-CA 3.2Å; M244-Y247 VanDerWaalsContact O-CB 3.32Å; M244-Y247 WeakPolarHBondContact O-CB 3.37Å; M244-Y247 PolarHBondContact O-N 3.17Å; M244-I248 HydrophobicContact CB-CD1 4.22Å; M244-I248 HydrophobicContact CB-CG1 4.35Å; M244-I248 WeakPolarHBondContact O-CG1 3.39Å; M244-I248 PolarHBondContact O-N 3.02Å
245	R	80.3	Confident	70	Confident	126 Å²	126	66.8 Å²	66.8	48%	0.475	34%	0.344	S	S	.	.	H	α-helix	trans	-51.1	-49.8	-171.4	-176.9	179	170.4	-161.7	-10.4	114.7	S227 E241 Y247 I248 E249	S227-R245 PolarHBondContact OG-N 3.1Å; E241-R245 PolarHBondContact O-N 2.86Å; E241-R245 VanDerWaalsContact O-N 3.11Å; R245-Y247 VanDerWaalsContact C-N 3.29Å; R245-Y247 PolarHBondContact O-N 3.21Å; R245-I248 PolarHBondContact O-N 2.86Å; R245-E249 HydrophobicContact CG-CG 4.33Å; R245-E249 IonicContact CZ-OE1 3.84Å; R245-E249 IonicContact NE-OE1 3.24Å; R245-E249 PolarHBondContact NE-OE1 2.93Å; R245-E249 IonicContact NE-OE2 2.93Å; R245-E249 IonicContact NH2-OE1 2.69Å; R245-E249 PolarHBondContact NH2-OE1 3.24Å; R245-E249 IonicContact NH2-OE2 3.16Å; R245-E249 WeakPolarHBondContact O-CB 3.34Å; R245-E249 WeakPolarHBondContact O-CG 3.34Å; R245-E249 PolarHBondContact O-N 2.8Å
246	L	82.8	Confident	72.8	Confident	21 Å²	21	60.1 Å²	60.1	11%	0.11	31%	0.309	C	S	.	.	H	α-helix	trans	-69.4	-28.1	-179.8	-70.8	168.3	0	0	0	112.4	E183 Y223 L226 S227 M244 N250	E183-L246 HydrophobicContact CG-CD1 4.24Å; Y223-L246 HydrophobicContact CD1-CB 4.37Å; L226-L246 HydrophobicContact CB-CD1 3.63Å; S227-L246 WeakPolarHBondContact OG-CB 3.44Å; S227-L246 PolarHBondContact OG-N 2.83Å; M244-L246 PolarHBondContact O-N 2.75Å; L246-N250 WeakPolarHBondContact CD2-ND2 3.4Å; L246-N250 VanDerWaalsContact O-CB 3.26Å; L246-N250 WeakPolarHBondContact O-CB 3.49Å; L246-N250 PolarHBondContact O-N 3.21Å; L246-N250 PolarHBondContact O-ND2 2.97Å; L246-N250 VanDerWaalsContact O-ND2 3.16Å
247	Y	88.2	Confident	75.6	Confident	0 Å²	0	59.3 Å²	59.3	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-69.3	-44.2	172.8	172.4	-99.9	0	0	0	111.2	I220 I224 M244 R245 F251 E252 C299 T302	I220-Y247 HydrophobicContact CB-CE2 4.48Å; I220-Y247 HydrophobicContact CD1-CD2 4.26Å; I220-Y247 HydrophobicContact CD1-CE2 3.9Å; I220-Y247 HydrophobicContact CG1-CE2 4.32Å; I220-Y247 HydrophobicContact CG2-CD2 3.92Å; I220-Y247 HydrophobicContact CG2-CE2 3.58Å; I224-Y247 HydrophobicContact CG1-CD2 4.38Å; I224-Y247 HydrophobicContact CG1-CG 4.29Å; M244-Y247 WeakPolarHBondContact O-CA 3.2Å; M244-Y247 VanDerWaalsContact O-CB 3.32Å; M244-Y247 WeakPolarHBondContact O-CB 3.37Å; M244-Y247 PolarHBondContact O-N 3.17Å; R245-Y247 VanDerWaalsContact C-N 3.29Å; R245-Y247 PolarHBondContact O-N 3.21Å; Y247-F251 HydrophobicContact CD2-CB 4.43Å; Y247-F251 AromaticContact CD2-CD1 3.98Å; Y247-F251 HydrophobicContact CD2-CD1 3.98Å; Y247-F251 AromaticContact CE2-CD1 3.4Å; Y247-F251 HydrophobicContact CE2-CD1 3.4Å; Y247-F251 VanDerWaalsContact CE2-CD1 3.4Å; Y247-F251 AromaticContact CE2-CE1 3.92Å; Y247-F251 HydrophobicContact CE2-CE1 3.92Å; Y247-F251 HydrophobicContact CE2-CG 4.31Å; Y247-F251 AromaticContact CZ-CD1 3.91Å; Y247-F251 CarbonylContact O-C 3.6Å; Y247-F251 WeakPolarHBondContact O-CA 3.22Å; Y247-F251 WeakPolarHBondContact O-CB 3.21Å; Y247-F251 PolarHBondContact O-N 3.45Å; Y247-F251 VanDerWaalsContact O-N 3.09Å; Y247-E252 HydrophobicContact CD1-CB 4.36Å; Y247-E252 HydrophobicContact CE1-CB 4.09Å; Y247-E252 HydrophobicContact CE1-CG 4.32Å; Y247-E252 PolarHBondContact O-N 2.78Å; Y247-C299 HydrophobicContact CD1-CB 4.43Å; Y247-C299 HydrophobicContact CE1-CB 3.68Å; Y247-C299 HydrophobicContact CE2-CB 4.48Å; Y247-C299 PolarHBondContact OH-N 3.14Å; Y247-T302 WeakPolarHBondContact CE1-OG1 3.33Å; Y247-T302 PolarHBondContact OH-OG1 3.35Å
248	I	86	Confident	78.1	Confident	27 Å²	27	55 Å²	55	14%	0.138	29%	0.293	C	S	.	.	I	π-helix	trans	-66.2	-52.3	177.6	-61.3	169.9	0	0	0	110.6	E241 M244 R245 N253	E241-I248 HydrophobicContact CB-CD1 4.23Å; E241-I248 HydrophobicContact CG-CD1 4.32Å; M244-I248 HydrophobicContact CB-CD1 4.22Å; M244-I248 HydrophobicContact CB-CG1 4.35Å; M244-I248 WeakPolarHBondContact O-CG1 3.39Å; M244-I248 PolarHBondContact O-N 3.02Å; R245-I248 PolarHBondContact O-N 2.86Å; I248-N253 PolarHBondContact O-N 3.27Å; I248-N253 PolarHBondContact O-ND2 3.21Å; I248-N253 VanDerWaalsContact O-ND2 3.08Å
249	E	86.2	Confident	80.4	Confident	98 Å²	98	51.4 Å²	51.4	46%	0.458	27%	0.274	S	S	.	.	I	π-helix	trans	-64.2	-47.3	-176.8	-72.6	179.4	179.9	0	0	112.9	R245	R245-E249 HydrophobicContact CG-CG 4.33Å; R245-E249 IonicContact CZ-OE1 3.84Å; R245-E249 IonicContact NE-OE1 3.24Å; R245-E249 PolarHBondContact NE-OE1 2.93Å; R245-E249 IonicContact NE-OE2 2.93Å; R245-E249 IonicContact NH2-OE1 2.69Å; R245-E249 PolarHBondContact NH2-OE1 3.24Å; R245-E249 IonicContact NH2-OE2 3.16Å; R245-E249 WeakPolarHBondContact O-CB 3.34Å; R245-E249 WeakPolarHBondContact O-CG 3.34Å; R245-E249 PolarHBondContact O-N 2.8Å
250	N	87.4	Confident	82.7	Confident	34 Å²	34	49.6 Å²	49.6	18%	0.182	26%	0.256	C	S	.	.	I	π-helix	trans	-99.8	-8.7	-170.1	-56.3	-54.6	0	0	0	115	H191 T195 Y223 L246	H191-N250 PolarHBondContact CD2-OD1 2.86Å; T195-N250 WeakPolarHBondContact CB-O 3.28Å; T195-N250 WeakPolarHBondContact CG2-O 3.24Å; T195-N250 PolarHBondContact OG1-O 3.34Å; Y223-N250 HydrophobicContact CD1-CB 4.34Å; Y223-N250 HydrophobicContact CE1-CB 3.71Å; L246-N250 WeakPolarHBondContact CD2-ND2 3.4Å; L246-N250 VanDerWaalsContact O-CB 3.26Å; L246-N250 WeakPolarHBondContact O-CB 3.49Å; L246-N250 PolarHBondContact O-N 3.21Å; L246-N250 PolarHBondContact O-ND2 2.97Å; L246-N250 VanDerWaalsContact O-ND2 3.16Å
251	F	91.9	Very high	84.6	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	25%	0.249	C	C	.	.	I	π-helix	trans	-136	-59.3	-177.7	177.1	-90.9	0	0	0	114	T195 V198 L199 I202 I220 Y223 Y247 N253 A254 F255 L298	T195-F251 HydrophobicContact CG2-CD2 4.38Å; V198-F251 HydrophobicContact CG1-CD2 4.49Å; V198-F251 HydrophobicContact CG1-CE2 3.82Å; L199-F251 HydrophobicContact CD2-CE2 4.04Å; I202-F251 HydrophobicContact CD1-CE2 4.14Å; I202-F251 HydrophobicContact CD1-CZ 3.85Å; I220-F251 HydrophobicContact CD1-CD1 3.77Å; I220-F251 HydrophobicContact CD1-CD2 3.82Å; I220-F251 HydrophobicContact CD1-CE1 3.86Å; I220-F251 HydrophobicContact CD1-CE2 3.9Å; I220-F251 HydrophobicContact CD1-CG 3.76Å; I220-F251 HydrophobicContact CD1-CZ 3.92Å; Y223-F251 HydrophobicContact CD2-CB 4.15Å; Y223-F251 HydrophobicContact CE2-CB 4.11Å; Y247-F251 HydrophobicContact CD2-CB 4.43Å; Y247-F251 AromaticContact CD2-CD1 3.98Å; Y247-F251 HydrophobicContact CD2-CD1 3.98Å; Y247-F251 AromaticContact CE2-CD1 3.4Å; Y247-F251 HydrophobicContact CE2-CD1 3.4Å; Y247-F251 VanDerWaalsContact CE2-CD1 3.4Å; Y247-F251 AromaticContact CE2-CE1 3.92Å; Y247-F251 HydrophobicContact CE2-CE1 3.92Å; Y247-F251 HydrophobicContact CE2-CG 4.31Å; Y247-F251 AromaticContact CZ-CD1 3.91Å; Y247-F251 CarbonylContact O-C 3.6Å; Y247-F251 WeakPolarHBondContact O-CA 3.22Å; Y247-F251 WeakPolarHBondContact O-CB 3.21Å; Y247-F251 PolarHBondContact O-N 3.45Å; Y247-F251 VanDerWaalsContact O-N 3.09Å; F251-N253 VanDerWaalsContact C-N 3.35Å; F251-N253 PolarHBondContact O-N 3.13Å; F251-A254 PolarHBondContact O-N 2.9Å; F251-A254 VanDerWaalsContact O-N 3.08Å; F251-F255 HydrophobicContact CD1-CB 4.36Å; F251-F255 HydrophobicContact CE1-CB 3.81Å; F251-F255 HydrophobicContact CE1-CD2 4.49Å; F251-F255 HydrophobicContact CE1-CG 4.07Å; F251-F255 HydrophobicContact CE2-CB 4.39Å; F251-F255 HydrophobicContact CZ-CB 3.83Å; F251-F255 HydrophobicContact CZ-CD2 4.07Å; F251-F255 HydrophobicContact CZ-CG 4.05Å; F251-F255 WeakPolarHBondContact O-CB 3.48Å; F251-F255 PolarHBondContact O-N 2.69Å; F251-L298 HydrophobicContact CE1-CD2 3.71Å; F251-L298 HydrophobicContact CZ-CD2 3.72Å
252	E	91.5	Very high	86.3	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	24%	0.238	C	C	.	.	I	π-helix	trans	-57.4	-45.3	-168.3	-167.9	-179.5	-124.7	0	0	112.4	Y247 A254 F255 L256 T302 K305	Y247-E252 HydrophobicContact CD1-CB 4.36Å; Y247-E252 HydrophobicContact CE1-CB 4.09Å; Y247-E252 HydrophobicContact CE1-CG 4.32Å; Y247-E252 PolarHBondContact O-N 2.78Å; E252-A254 PolarHBondContact O-N 2.82Å; E252-F255 PolarHBondContact O-N 2.85Å; E252-L256 HydrophobicContact CG-CD1 4.17Å; E252-L256 WeakPolarHBondContact O-CG 3.42Å; E252-L256 PolarHBondContact O-N 2.96Å; E252-T302 HydrophobicContact CG-CG2 3.95Å; E252-T302 WeakPolarHBondContact OE1-CA 3.48Å; E252-T302 WeakPolarHBondContact OE1-CB 3.46Å; E252-T302 PolarHBondContact OE1-OG1 3.23Å; E252-K305 IonicContact OE1-NZ 2.88Å; E252-K305 IonicContact OE2-NZ 3.86Å; E252-K305 PolarHBondContact OE2-NZ 2.9Å
253	N	91.2	Very high	88.1	Confident	91 Å²	91	39.5 Å²	39.5	49%	0.487	22%	0.222	S	C	.	.	H	α-helix	trans	-62.6	-39.8	179.1	-69.2	-33	0	0	0	112.8	I248 F251 A257	I248-N253 PolarHBondContact O-N 3.27Å; I248-N253 PolarHBondContact O-ND2 3.21Å; I248-N253 VanDerWaalsContact O-ND2 3.08Å; F251-N253 VanDerWaalsContact C-N 3.35Å; F251-N253 PolarHBondContact O-N 3.13Å; N253-A257 WeakPolarHBondContact O-CB 3.14Å; N253-A257 PolarHBondContact O-N 3.23Å
254	A	91.8	Very high	89.5	Confident	40 Å²	40	39.6 Å²	39.6	33%	0.331	22%	0.216	S	C	.	.	H	α-helix	trans	-72.9	-37.7	177.7	0	0	0	0	0	111.6	T195 L199 F251 E252 A257 E258	T195-A254 HydrophobicContact CG2-CB 4.26Å; L199-A254 HydrophobicContact CD1-CB 3.86Å; F251-A254 PolarHBondContact O-N 2.9Å; F251-A254 VanDerWaalsContact O-N 3.08Å; E252-A254 PolarHBondContact O-N 2.82Å; A254-A257 PolarHBondContact O-N 3.28Å; A254-E258 PolarHBondContact O-N 3.5Å
255	F	93.8	Very high	90.4	Very high	1 Å²	1	45.4 Å²	45.4	0%	0.004	24%	0.237	C	C	.	.	H	α-helix	trans	-60.6	-48.2	173.8	167.3	-99.7	0	0	0	112.1	L199 I202 R206 F251 E252 T259 L298 T302 L306	L199-F255 HydrophobicContact CD2-CB 3.85Å; L199-F255 HydrophobicContact CD2-CD2 4.23Å; I202-F255 HydrophobicContact CD1-CD2 4.08Å; I202-F255 HydrophobicContact CD1-CE2 4.31Å; I202-F255 HydrophobicContact CG2-CE2 4.14Å; R206-F255 VanDerWaalsContact NH2-CE2 3.33Å; F251-F255 HydrophobicContact CD1-CB 4.36Å; F251-F255 HydrophobicContact CE1-CB 3.81Å; F251-F255 HydrophobicContact CE1-CD2 4.49Å; F251-F255 HydrophobicContact CE1-CG 4.07Å; F251-F255 HydrophobicContact CE2-CB 4.39Å; F251-F255 HydrophobicContact CZ-CB 3.83Å; F251-F255 HydrophobicContact CZ-CD2 4.07Å; F251-F255 HydrophobicContact CZ-CG 4.05Å; F251-F255 WeakPolarHBondContact O-CB 3.48Å; F251-F255 PolarHBondContact O-N 2.69Å; E252-F255 PolarHBondContact O-N 2.85Å; F255-T259 WeakPolarHBondContact O-CB 3.17Å; F255-T259 PolarHBondContact O-N 2.82Å; F255-T259 PolarHBondContact O-OG1 3.01Å; F255-L298 HydrophobicContact CD1-CD1 4.47Å; F255-L298 HydrophobicContact CE1-CD1 3.8Å; F255-L298 HydrophobicContact CE2-CD1 3.84Å; F255-L298 HydrophobicContact CZ-CD1 3.45Å; F255-L298 VanDerWaalsContact CZ-CD1 3.45Å; F255-T302 HydrophobicContact CD1-CG2 3.96Å; F255-T302 HydrophobicContact CE1-CG2 3.82Å; F255-L306 HydrophobicContact CE1-CD1 4.06Å; F255-L306 HydrophobicContact CE1-CD2 4.21Å; F255-L306 HydrophobicContact CZ-CD1 4.15Å; F255-L306 HydrophobicContact CZ-CD2 4.11Å
256	L	93.1	Very high	90.9	Very high	23 Å²	23	40.4 Å²	40.4	12%	0.12	22%	0.219	C	C	.	.	H	α-helix	trans	-63.3	-43	178.8	-68.7	172.3	0	0	0	111.4	E252 T259 E260 K305 L306 V309	E252-L256 HydrophobicContact CG-CD1 4.17Å; E252-L256 WeakPolarHBondContact O-CG 3.42Å; E252-L256 PolarHBondContact O-N 2.96Å; L256-T259 PolarHBondContact O-N 2.68Å; L256-E260 PolarHBondContact O-N 3.29Å; L256-K305 HydrophobicContact CD1-CB 3.93Å; L256-K305 HydrophobicContact CD1-CD 4.18Å; L256-K305 HydrophobicContact CD2-CB 4.31Å; L256-L306 HydrophobicContact CD2-CB 4.31Å; L256-V309 HydrophobicContact CD2-CG2 4.5Å
257	A	91.7	Very high	91.3	Very high	60 Å²	60	39.5 Å²	39.5	50%	0.496	22%	0.215	S	C	.	.	H	α-helix	trans	-65.1	-43	178.5	0	0	0	0	0	113.6	N253 A254 T259 E260 A261	N253-A257 WeakPolarHBondContact O-CB 3.14Å; N253-A257 PolarHBondContact O-N 3.23Å; A254-A257 PolarHBondContact O-N 3.28Å; A257-T259 VanDerWaalsContact C-N 3.32Å; A257-E260 PolarHBondContact O-N 2.9Å; A257-A261 PolarHBondContact O-N 2.81Å; A257-A261 VanDerWaalsContact O-N 3.13Å
258	E	91.3	Very high	91.5	Very high	67 Å²	67	44.1 Å²	44.1	31%	0.313	24%	0.236	S	C	.	.	H	α-helix	trans	-68.3	-34.6	175.3	-172.3	170.1	145	0	0	111.5	L199 S203 A254 A261 F262	L199-E258 WeakPolarHBondContact CB-OE2 3.34Å; S203-E258 PolarHBondContact OG-OE1 3.02Å; A254-E258 PolarHBondContact O-N 3.5Å; E258-A261 PolarHBondContact O-N 3.23Å; E258-F262 VanDerWaalsContact O-CB 3.3Å; E258-F262 WeakPolarHBondContact O-CB 3.49Å; E258-F262 PolarHBondContact O-N 3.01Å
259	T	92.8	Very high	91.7	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-65.8	-42.1	175.3	-57.8	0	0	0	0	112.2	R206 F255 L256 A257 F262 Y263 L306 L310	R206-T259 PolarHBondContact NH1-OG1 3.46Å; R206-T259 VanDerWaalsContact NH2-CG2 3.28Å; R206-T259 PolarHBondContact NH2-OG1 3.27Å; F255-T259 WeakPolarHBondContact O-CB 3.17Å; F255-T259 PolarHBondContact O-N 2.82Å; F255-T259 PolarHBondContact O-OG1 3.01Å; L256-T259 PolarHBondContact O-N 2.68Å; A257-T259 VanDerWaalsContact C-N 3.32Å; T259-F262 PolarHBondContact O-N 3.32Å; T259-Y263 HydrophobicContact CG2-CD2 3.67Å; T259-Y263 HydrophobicContact CG2-CE2 3.88Å; T259-Y263 PolarHBondContact O-N 3.2Å; T259-L306 HydrophobicContact CG2-CD1 3.71Å; T259-L310 HydrophobicContact CG2-CD2 4.15Å
260	E	93.3	Very high	92	Very high	71 Å²	71	42.7 Å²	42.7	33%	0.332	23%	0.23	S	C	.	.	H	α-helix	trans	-61.4	-47.1	174.5	172.9	170.4	-161.5	0	0	111.6	L256 A257 F262 T264 V309 I313 R317	L256-E260 PolarHBondContact O-N 3.29Å; A257-E260 PolarHBondContact O-N 2.9Å; E260-F262 PolarHBondContact O-N 3.07Å; E260-T264 WeakPolarHBondContact O-CB 3.16Å; E260-T264 PolarHBondContact O-N 3.22Å; E260-T264 PolarHBondContact O-OG1 3.36Å; E260-V309 HydrophobicContact CB-CG1 4.09Å; E260-I313 HydrophobicContact CB-CD1 4.03Å; E260-I313 HydrophobicContact CG-CD1 3.91Å; E260-I313 HydrophobicContact CG-CG1 4.47Å; E260-R317 IonicContact OE1-CZ 3.32Å; E260-R317 VanDerWaalsContact OE1-CZ 3.25Å; E260-R317 IonicContact OE1-NH1 2.77Å; E260-R317 PolarHBondContact OE1-NH1 3.36Å; E260-R317 IonicContact OE1-NH2 3.38Å; E260-R317 PolarHBondContact OE1-NH2 2.88Å
261	A	92.1	Very high	92.1	Very high	64 Å²	64	43.4 Å²	43.4	53%	0.529	23%	0.234	S	C	.	.	H	α-helix	trans	-61.9	-43.5	178	0	0	0	0	0	112.1	A257 E258 Y265	A257-A261 PolarHBondContact O-N 2.81Å; A257-A261 VanDerWaalsContact O-N 3.13Å; E258-A261 PolarHBondContact O-N 3.23Å; A261-Y265 PolarHBondContact O-N 3.36Å
262	F	92.9	Very high	92.1	Very high	44 Å²	44	51.2 Å²	51.2	19%	0.193	26%	0.263	C	S	.	.	H	α-helix	trans	-61.7	-53.7	179.2	-176.7	-85.4	0	0	0	112	R206 E258 T259 E260 Y265 E266	R206-F262 HydrophobicContact CB-CE1 4.07Å; R206-F262 HydrophobicContact CB-CE2 4.26Å; R206-F262 HydrophobicContact CB-CZ 3.75Å; E258-F262 VanDerWaalsContact O-CB 3.3Å; E258-F262 WeakPolarHBondContact O-CB 3.49Å; E258-F262 PolarHBondContact O-N 3.01Å; T259-F262 PolarHBondContact O-N 3.32Å; E260-F262 PolarHBondContact O-N 3.07Å; F262-Y265 PolarHBondContact O-N 3.33Å; F262-E266 PolarHBondContact O-N 2.99Å
263	Y	94.4	Very high	92	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-77.5	-24.4	-175.5	-75.2	-59.5	0	0	0	114	T259 E266 A267 R286 E290 L310 F314	T259-Y263 HydrophobicContact CG2-CD2 3.67Å; T259-Y263 HydrophobicContact CG2-CE2 3.88Å; T259-Y263 PolarHBondContact O-N 3.2Å; Y263-E266 WeakPolarHBondContact CD1-OE2 3.48Å; Y263-E266 VanDerWaalsContact CE1-OE2 3.23Å; Y263-E266 WeakPolarHBondContact CE1-OE2 3.3Å; Y263-A267 WeakPolarHBondContact O-CB 3.43Å; Y263-A267 PolarHBondContact O-N 3.04Å; Y263-R286 HydrophobicContact CE1-CB 4.24Å; Y263-R286 HydrophobicContact CE1-CG 4.06Å; Y263-E290 HydrophobicContact CE2-CG 3.74Å; Y263-E290 VanDerWaalsContact OH-CG 3.31Å; Y263-E290 WeakPolarHBondContact OH-CG 3.41Å; Y263-E290 PolarHBondContact OH-OE1 3.11Å; Y263-L310 HydrophobicContact CD2-CD2 3.3Å; Y263-L310 HydrophobicContact CE2-CD2 3.67Å; Y263-L310 HydrophobicContact CG-CD2 3.99Å; Y263-F314 HydrophobicContact CD1-CE1 4.08Å; Y263-F314 HydrophobicContact CD1-CE2 4.33Å; Y263-F314 AromaticContact CD1-CZ 3.43Å; Y263-F314 HydrophobicContact CD1-CZ 3.43Å; Y263-F314 VanDerWaalsContact CD1-CZ 3.43Å; Y263-F314 AromaticContact CE1-CZ 3.97Å; Y263-F314 HydrophobicContact CE1-CZ 3.97Å; Y263-F314 HydrophobicContact CG-CE2 4.44Å; Y263-F314 AromaticContact CG-CZ 3.85Å; Y263-F314 HydrophobicContact CG-CZ 3.85Å
264	T	92.6	Very high	92	Very high	36 Å²	36	55.1 Å²	55.1	22%	0.221	28%	0.284	C	S	.	.	H	α-helix	trans	-60.7	-48.9	168.8	-61.4	0	0	0	0	110.2	E260 E268	E260-T264 WeakPolarHBondContact O-CB 3.16Å; E260-T264 PolarHBondContact O-N 3.22Å; E260-T264 PolarHBondContact O-OG1 3.36Å; T264-E268 WeakPolarHBondContact O-CG 3.43Å; T264-E268 PolarHBondContact O-N 2.83Å; T264-E268 VanDerWaalsContact O-N 3.16Å
265	Y	92.6	Very high	91.9	Very high	150 Å²	150	56.9 Å²	56.9	59%	0.588	29%	0.292	S	S	*	.	H	α-helix	trans	-62.9	-51.7	177.5	-178.5	-89.4	0	0	0	112.7	A261 F262 A267 E268 E269	A261-Y265 PolarHBondContact O-N 3.36Å; F262-Y265 PolarHBondContact O-N 3.33Å; Y265-A267 VanDerWaalsContact C-N 3.3Å; Y265-A267 PolarHBondContact O-N 3.09Å; Y265-E268 PolarHBondContact O-N 3.47Å; Y265-E269 PolarHBondContact O-N 3.32Å
266	E	91.7	Very high	91.8	Very high	21 Å²	21	57.9 Å²	57.9	10%	0.098	30%	0.298	C	S	.	.	H	α-helix	trans	-56.8	-46	-179.8	179.3	178.2	-164.8	0	0	110.9	F262 Y263 E268 E269 V270 R286	F262-E266 PolarHBondContact O-N 2.99Å; Y263-E266 WeakPolarHBondContact CD1-OE2 3.48Å; Y263-E266 VanDerWaalsContact CE1-OE2 3.23Å; Y263-E266 WeakPolarHBondContact CE1-OE2 3.3Å; E266-E268 PolarHBondContact O-N 3.39Å; E266-E269 PolarHBondContact O-N 3.21Å; E266-V270 HydrophobicContact CG-CG2 4.07Å; E266-V270 VanDerWaalsContact O-CG2 3.28Å; E266-V270 WeakPolarHBondContact O-CG2 3.35Å; E266-V270 PolarHBondContact O-N 3.39Å; E266-R286 IonicContact OE1-CZ 3.21Å; E266-R286 VanDerWaalsContact OE1-CZ 3.26Å; E266-R286 IonicContact OE1-NE 2.63Å; E266-R286 PolarHBondContact OE1-NE 3.01Å; E266-R286 IonicContact OE1-NH2 3.74Å; E266-R286 PolarHBondContact OE1-NH2 3.12Å; E266-R286 IonicContact OE2-CZ 2.78Å; E266-R286 IonicContact OE2-NE 3.2Å; E266-R286 PolarHBondContact OE2-NE 3.11Å; E266-R286 IonicContact OE2-NH2 2.73Å; E266-R286 PolarHBondContact OE2-NH2 3.14Å
267	A	91.7	Very high	91.7	Very high	2 Å²	2	57.7 Å²	57.7	2%	0.017	30%	0.298	C	S	.	.	H	α-helix	trans	-71.7	-28.3	-174.9	0	0	0	0	0	113.1	Y263 Y265 L271 Y279 F314 R318	Y263-A267 WeakPolarHBondContact O-CB 3.43Å; Y263-A267 PolarHBondContact O-N 3.04Å; Y265-A267 VanDerWaalsContact C-N 3.3Å; Y265-A267 PolarHBondContact O-N 3.09Å; A267-L271 WeakPolarHBondContact O-CB 3.36Å; A267-L271 WeakPolarHBondContact O-CD1 3.33Å; A267-L271 WeakPolarHBondContact O-CG 3.44Å; A267-L271 PolarHBondContact O-N 3.29Å; A267-Y279 HydrophobicContact CB-CE2 3.91Å; A267-F314 HydrophobicContact CB-CD1 3.97Å; A267-F314 HydrophobicContact CB-CE1 4.04Å; A267-R318 VanDerWaalsContact CB-NH2 3.28Å
268	E	91.1	Very high	91.7	Very high	97 Å²	97	58.8 Å²	58.8	45%	0.453	29%	0.293	S	S	.	.	H	α-helix	trans	-69.1	-40.7	168	-75.5	-176.6	-171.3	0	0	112.4	T264 Y265 E266 R272	T264-E268 WeakPolarHBondContact O-CG 3.43Å; T264-E268 PolarHBondContact O-N 2.83Å; T264-E268 VanDerWaalsContact O-N 3.16Å; Y265-E268 PolarHBondContact O-N 3.47Å; E266-E268 PolarHBondContact O-N 3.39Å; E268-R272 WeakPolarHBondContact O-CB 3.48Å; E268-R272 PolarHBondContact O-N 3.08Å
269	E	91.6	Very high	91.8	Very high	82 Å²	82	55.7 Å²	55.7	38%	0.383	28%	0.278	S	S	.	.	H	α-helix	trans	-65.4	-45	177.6	-168.1	-170.7	167.1	0	0	111.7	Y265 E266 R272 N273	Y265-E269 PolarHBondContact O-N 3.32Å; E266-E269 PolarHBondContact O-N 3.21Å; E269-R272 PolarHBondContact O-N 3.4Å; E269-N273 PolarHBondContact O-N 2.9Å; E269-N273 PolarHBondContact O-ND2 2.88Å
270	V	90.7	Very high	91.7	Very high	14 Å²	14	55.8 Å²	55.8	9%	0.085	28%	0.279	C	S	.	.	H	α-helix	trans	-62.4	-45.4	178.7	174.1	0	0	0	0	110.8	E266 R272 N273 N274 Y279 R282	E266-V270 HydrophobicContact CG-CG2 4.07Å; E266-V270 VanDerWaalsContact O-CG2 3.28Å; E266-V270 WeakPolarHBondContact O-CG2 3.35Å; E266-V270 PolarHBondContact O-N 3.39Å; V270-R272 VanDerWaalsContact C-N 3.33Å; V270-R272 PolarHBondContact O-N 3.21Å; V270-N273 PolarHBondContact O-N 2.98Å; V270-N274 HydrophobicContact CG1-CB 4.49Å; V270-N274 VanDerWaalsContact O-CB 3.31Å; V270-N274 WeakPolarHBondContact O-CB 3.35Å; V270-N274 PolarHBondContact O-N 3.17Å; V270-N274 PolarHBondContact O-ND2 3.35Å; V270-Y279 HydrophobicContact CB-CD2 4.32Å; V270-Y279 HydrophobicContact CG1-CD2 3.88Å; V270-R282 HydrophobicContact CG1-CB 4.32Å; V270-R282 HydrophobicContact CG1-CG 4.35Å; V270-R282 HydrophobicContact CG2-CG 4.27Å
271	L	91	Very high	91.7	Very high	49 Å²	49	56.2 Å²	56.2	26%	0.257	28%	0.279	S	S	.	.	H	α-helix	trans	-66.2	-31.1	177.4	-77.5	170.1	0	0	0	113.5	A267 N273 Y279 R318 M321	A267-L271 WeakPolarHBondContact O-CB 3.36Å; A267-L271 WeakPolarHBondContact O-CD1 3.33Å; A267-L271 WeakPolarHBondContact O-CG 3.44Å; A267-L271 PolarHBondContact O-N 3.29Å; L271-N273 VanDerWaalsContact C-N 3.27Å; L271-N273 PolarHBondContact O-N 3.37Å; L271-Y279 HydrophobicContact CD1-CD2 4.31Å; L271-Y279 HydrophobicContact CD1-CE2 4.09Å; L271-Y279 HydrophobicContact CD2-CD1 3.82Å; L271-Y279 HydrophobicContact CD2-CD2 3.75Å; L271-Y279 HydrophobicContact CD2-CE1 4.38Å; L271-Y279 HydrophobicContact CD2-CE2 4.31Å; L271-Y279 HydrophobicContact CD2-CG 3.47Å; L271-Y279 VanDerWaalsContact CD2-CG 3.47Å; L271-Y279 HydrophobicContact CG-CD1 4.4Å; L271-Y279 HydrophobicContact CG-CD2 3.6Å; L271-Y279 HydrophobicContact CG-CE2 3.85Å; L271-Y279 HydrophobicContact CG-CG 3.89Å; L271-R318 VanDerWaalsContact CD1-NE 3.25Å; L271-M321 HydrophobicContact CD1-CE 4.12Å; L271-M321 HydrophobicContact CD2-CE 3.69Å
272	R	90.9	Very high	91.7	Very high	163 Å²	163	58.3 Å²	58.3	62%	0.615	27%	0.274	S	S	*	.	H	α-helix	trans	-67.8	-29.7	175.9	-167.1	-178	-57.8	130.8	7.3	112.4	E268 E269 V270	E268-R272 WeakPolarHBondContact O-CB 3.48Å; E268-R272 PolarHBondContact O-N 3.08Å; E269-R272 PolarHBondContact O-N 3.4Å; V270-R272 VanDerWaalsContact C-N 3.33Å; V270-R272 PolarHBondContact O-N 3.21Å
273	N	90.4	Very high	91.7	Very high	105 Å²	105	56.3 Å²	56.3	56%	0.561	27%	0.265	S	S	*	.	H	α-helix	trans	-109.5	-11.5	-170	-66.2	-28	0	0	0	114.4	E269 V270 L271	E269-N273 PolarHBondContact O-N 2.9Å; E269-N273 PolarHBondContact O-ND2 2.88Å; V270-N273 PolarHBondContact O-N 2.98Å; L271-N273 VanDerWaalsContact C-N 3.27Å; L271-N273 PolarHBondContact O-N 3.37Å
274	N	90.3	Very high	91.5	Very high	68 Å²	68	60 Å²	60	36%	0.364	28%	0.282	S	S	.	.	S	Bend	trans	-139.8	152.4	-171.6	-57.1	-92.2	0	0	0	112.1	V270 E278	V270-N274 HydrophobicContact CG1-CB 4.49Å; V270-N274 VanDerWaalsContact O-CB 3.31Å; V270-N274 WeakPolarHBondContact O-CB 3.35Å; V270-N274 PolarHBondContact O-N 3.17Å; V270-N274 PolarHBondContact O-ND2 3.35Å; N274-E278 HydrophobicContact CB-CB 4.12Å
275	P	90.7	Very high	91.5	Very high	77 Å²	77	62.2 Å²	62.2	50%	0.5	29%	0.292	S	S	.	.			trans	-66.8	157.6	171.8	30.5	-36.4	0	0	0	111.8	T277 E278 Y279	P275-T277 PolarHBondContact O-N 3.42Å; P275-T277 VanDerWaalsContact O-N 3.12Å; P275-E278 HydrophobicContact CG-CB 4.24Å; P275-E278 HydrophobicContact CG-CG 3.98Å; P275-E278 PolarHBondContact O-N 2.96Å; P275-Y279 PolarHBondContact O-N 3.16Å
276	V	91	Very high	91.4	Very high	22 Å²	22	56.6 Å²	56.6	13%	0.133	27%	0.27	C	S	.	.	H	α-helix	trans	-53.6	-36.3	-178.8	-174.4	0	0	0	0	112.4	E278 Y279 L280 M321 L322 E325	V276-E278 PolarHBondContact O-N 3.1Å; V276-Y279 WeakPolarHBondContact O-CB 3.38Å; V276-Y279 PolarHBondContact O-N 3.45Å; V276-L280 HydrophobicContact CG1-CD1 4.5Å; V276-L280 HydrophobicContact CG1-CG 4.44Å; V276-L280 WeakPolarHBondContact O-CG 3.42Å; V276-L280 PolarHBondContact O-N 3.22Å; V276-M321 HydrophobicContact CB-SD 4.1Å; V276-M321 HydrophobicContact CG1-CE 4.22Å; V276-M321 HydrophobicContact CG1-SD 3.53Å; V276-M321 VanDerWaalsContact CG1-SD 3.53Å; V276-M321 HydrophobicContact CG2-SD 3.38Å; V276-M321 WeakPolarHBondContact CG2-SD 3.37Å; V276-L322 HydrophobicContact CG1-CD2 3.78Å; V276-E325 HydrophobicContact CB-CB 4.33Å; V276-E325 HydrophobicContact CB-CG 3.83Å; V276-E325 HydrophobicContact CG1-CB 4.16Å; V276-E325 HydrophobicContact CG1-CG 3.96Å; V276-E325 HydrophobicContact CG2-CB 4.3Å; V276-E325 HydrophobicContact CG2-CG 4.18Å
277	T	90.8	Very high	91.4	Very high	19 Å²	19	56.6 Å²	56.6	12%	0.117	27%	0.271	C	S	.	.	H	α-helix	trans	-65.5	-31.7	178	48.4	0	0	0	0	114.1	P275 K281 L329 D337	P275-T277 PolarHBondContact O-N 3.42Å; P275-T277 VanDerWaalsContact O-N 3.12Å; T277-K281 WeakPolarHBondContact O-CG 3.47Å; T277-L329 HydrophobicContact CG2-CD2 4.01Å; T277-D337 HydrophobicContact CG2-CB 4.09Å
278	E	91	Very high	91.3	Very high	83 Å²	83	60.2 Å²	60.2	39%	0.388	29%	0.29	S	S	.	.	H	α-helix	trans	-80.6	-34.2	171.1	-70.8	-55.5	139.5	0	0	111.8	N274 P275 V276 L280 K281 R282	N274-E278 HydrophobicContact CB-CB 4.12Å; P275-E278 HydrophobicContact CG-CB 4.24Å; P275-E278 HydrophobicContact CG-CG 3.98Å; P275-E278 PolarHBondContact O-N 2.96Å; V276-E278 PolarHBondContact O-N 3.1Å; E278-L280 PolarHBondContact O-N 3.26Å; E278-K281 PolarHBondContact O-N 3.27Å; E278-K281 IonicContact OE1-NZ 3.98Å; E278-K281 PolarHBondContact OE1-NZ 2.88Å; E278-K281 WeakPolarHBondContact OE2-CD 3.4Å; E278-K281 IonicContact OE2-NZ 3.64Å; E278-R282 PolarHBondContact O-N 2.78Å
279	Y	93.7	Very high	91.3	Very high	2 Å²	2	57.1 Å²	57.1	1%	0.008	28%	0.275	C	S	.	.	H	α-helix	trans	-57.2	-48.1	171.4	171.1	-101.4	0	0	0	111.9	A267 V270 L271 P275 V276 K281 R282 V283 F314 R318 M321	A267-Y279 HydrophobicContact CB-CE2 3.91Å; V270-Y279 HydrophobicContact CB-CD2 4.32Å; V270-Y279 HydrophobicContact CG1-CD2 3.88Å; L271-Y279 HydrophobicContact CD1-CD2 4.31Å; L271-Y279 HydrophobicContact CD1-CE2 4.09Å; L271-Y279 HydrophobicContact CD2-CD1 3.82Å; L271-Y279 HydrophobicContact CD2-CD2 3.75Å; L271-Y279 HydrophobicContact CD2-CE1 4.38Å; L271-Y279 HydrophobicContact CD2-CE2 4.31Å; L271-Y279 HydrophobicContact CD2-CG 3.47Å; L271-Y279 VanDerWaalsContact CD2-CG 3.47Å; L271-Y279 HydrophobicContact CG-CD1 4.4Å; L271-Y279 HydrophobicContact CG-CD2 3.6Å; L271-Y279 HydrophobicContact CG-CE2 3.85Å; L271-Y279 HydrophobicContact CG-CG 3.89Å; P275-Y279 PolarHBondContact O-N 3.16Å; V276-Y279 WeakPolarHBondContact O-CB 3.38Å; V276-Y279 PolarHBondContact O-N 3.45Å; Y279-K281 VanDerWaalsContact C-N 3.3Å; Y279-K281 PolarHBondContact O-N 3.09Å; Y279-R282 WeakPolarHBondContact O-CA 3.3Å; Y279-R282 WeakPolarHBondContact O-CB 3.47Å; Y279-R282 PolarHBondContact O-N 3.08Å; Y279-V283 HydrophobicContact CD1-CG2 4.17Å; Y279-V283 HydrophobicContact CD2-CG2 4.4Å; Y279-V283 HydrophobicContact CE1-CG2 3.65Å; Y279-V283 HydrophobicContact CE2-CG2 3.91Å; Y279-V283 VanDerWaalsContact CZ-CG2 3.49Å; Y279-V283 WeakPolarHBondContact O-CG2 3.43Å; Y279-V283 PolarHBondContact O-N 3.34Å; Y279-F314 VanDerWaalsContact OH-CA 3.31Å; Y279-F314 WeakPolarHBondContact OH-CA 3.39Å; Y279-F314 PolarHBondContact OH-O 3.21Å; Y279-R318 WeakPolarHBondContact OH-CD 3.37Å; Y279-M321 HydrophobicContact CD1-CE 4.48Å; Y279-M321 HydrophobicContact CE1-CE 4.5Å
280	L	92.3	Very high	91.3	Very high	2 Å²	2	53.4 Å²	53.4	1%	0.01	26%	0.258	C	S	.	.	H	α-helix	trans	-60.8	-36.8	178.9	-67.9	176.4	0	0	0	112.7	V276 E278 R282 V283 E284 L322 R340 M341 L344	V276-L280 HydrophobicContact CG1-CD1 4.5Å; V276-L280 HydrophobicContact CG1-CG 4.44Å; V276-L280 WeakPolarHBondContact O-CG 3.42Å; V276-L280 PolarHBondContact O-N 3.22Å; E278-L280 PolarHBondContact O-N 3.26Å; L280-R282 VanDerWaalsContact C-N 3.32Å; L280-V283 PolarHBondContact O-N 2.98Å; L280-E284 WeakPolarHBondContact O-CB 3.47Å; L280-E284 PolarHBondContact O-N 3.07Å; L280-L322 HydrophobicContact CD2-CD2 3.8Å; L280-L322 HydrophobicContact CG-CD2 4.47Å; L280-R340 HydrophobicContact CB-CG 4.25Å; L280-M341 HydrophobicContact CD1-CB 3.95Å; L280-M341 HydrophobicContact CD1-CE 3.86Å; L280-M341 HydrophobicContact CD1-CG 4.27Å; L280-L344 HydrophobicContact CB-CD1 3.86Å; L280-L344 HydrophobicContact CD2-CD1 3.62Å; L280-L344 HydrophobicContact CG-CD1 4.26Å
281	K	92.4	Very high	91	Very high	80 Å²	80	58 Å²	58	35%	0.348	28%	0.278	S	S	.	.	H	α-helix	trans	-65.7	-35.2	172.7	-65	170.4	-170.3	174.8	0	112	T277 E278 Y279 L285	T277-K281 WeakPolarHBondContact O-CG 3.47Å; E278-K281 PolarHBondContact O-N 3.27Å; E278-K281 IonicContact OE1-NZ 3.98Å; E278-K281 PolarHBondContact OE1-NZ 2.88Å; E278-K281 WeakPolarHBondContact OE2-CD 3.4Å; E278-K281 IonicContact OE2-NZ 3.64Å; Y279-K281 VanDerWaalsContact C-N 3.3Å; Y279-K281 PolarHBondContact O-N 3.09Å; K281-L285 PolarHBondContact O-N 3.03Å; K281-L285 VanDerWaalsContact O-N 3.11Å
282	R	91.4	Very high	90.8	Very high	108 Å²	108	62.1 Å²	62.1	41%	0.408	29%	0.29	S	S	.	.	H	α-helix	trans	-68.8	-40.2	175.9	-171.3	59.3	57.8	114.1	3.4	111.7	V270 E278 Y279 L280 L285 R286	V270-R282 HydrophobicContact CG1-CB 4.32Å; V270-R282 HydrophobicContact CG1-CG 4.35Å; V270-R282 HydrophobicContact CG2-CG 4.27Å; E278-R282 PolarHBondContact O-N 2.78Å; Y279-R282 WeakPolarHBondContact O-CA 3.3Å; Y279-R282 WeakPolarHBondContact O-CB 3.47Å; Y279-R282 PolarHBondContact O-N 3.08Å; L280-R282 VanDerWaalsContact C-N 3.32Å; R282-L285 PolarHBondContact O-N 2.98Å; R282-R286 WeakPolarHBondContact O-CG 3.44Å; R282-R286 PolarHBondContact O-N 2.66Å
283	V	92.7	Very high	90.7	Very high	2 Å²	2	55.5 Å²	55.5	1%	0.012	27%	0.266	C	S	.	.	H	α-helix	trans	-59.5	-50.9	173.6	173.1	0	0	0	0	110.8	Y279 L280 L285 R286 L287 F314 I315 L344	Y279-V283 HydrophobicContact CD1-CG2 4.17Å; Y279-V283 HydrophobicContact CD2-CG2 4.4Å; Y279-V283 HydrophobicContact CE1-CG2 3.65Å; Y279-V283 HydrophobicContact CE2-CG2 3.91Å; Y279-V283 VanDerWaalsContact CZ-CG2 3.49Å; Y279-V283 WeakPolarHBondContact O-CG2 3.43Å; Y279-V283 PolarHBondContact O-N 3.34Å; L280-V283 PolarHBondContact O-N 2.98Å; V283-L285 VanDerWaalsContact C-N 3.27Å; V283-L285 PolarHBondContact O-N 3.41Å; V283-R286 PolarHBondContact O-N 2.74Å; V283-R286 VanDerWaalsContact O-N 3.13Å; V283-L287 HydrophobicContact CG1-CD1 3.84Å; V283-L287 HydrophobicContact CG1-CG 4.36Å; V283-L287 WeakPolarHBondContact O-CG 3.45Å; V283-L287 PolarHBondContact O-N 2.97Å; V283-F314 HydrophobicContact CB-CB 4.36Å; V283-F314 HydrophobicContact CB-CG 4.39Å; V283-F314 HydrophobicContact CG1-CB 3.63Å; V283-F314 HydrophobicContact CG1-CD2 4.11Å; V283-F314 HydrophobicContact CG1-CG 3.89Å; V283-F314 HydrophobicContact CG2-CB 3.81Å; V283-F314 HydrophobicContact CG2-CD1 3.76Å; V283-F314 HydrophobicContact CG2-CE1 4.5Å; V283-F314 HydrophobicContact CG2-CG 3.89Å; V283-I315 HydrophobicContact CG1-CD1 4.48Å; V283-I315 HydrophobicContact CG1-CG1 4.4Å; V283-L344 HydrophobicContact CG1-CD1 4.43Å; V283-L344 HydrophobicContact CG1-CD2 4.03Å
284	E	90.5	Very high	90.5	Very high	78 Å²	78	50.7 Å²	50.7	36%	0.364	24%	0.24	S	C	.	.	H	α-helix	trans	-53.6	-43.6	176.4	-173.8	-176.6	174.3	0	0	111.6	L280 N288 R340	L280-E284 WeakPolarHBondContact O-CB 3.47Å; L280-E284 PolarHBondContact O-N 3.07Å; E284-N288 PolarHBondContact O-N 3.22Å; E284-N288 PolarHBondContact O-ND2 3.33Å; E284-R340 WeakPolarHBondContact OE2-CD 3.45Å; E284-R340 IonicContact OE2-CZ 3.66Å; E284-R340 IonicContact OE2-NE 3.58Å; E284-R340 PolarHBondContact OE2-NE 3.11Å; E284-R340 IonicContact OE2-NH2 3.85Å
285	L	92.1	Very high	90.1	Very high	82 Å²	82	52.1 Å²	52.1	43%	0.429	26%	0.255	S	S	.	.	H	α-helix	trans	-64.9	-47.2	175.5	-178.6	65.9	0	0	0	112.8	K281 R282 V283 N288 E289	K281-L285 PolarHBondContact O-N 3.03Å; K281-L285 VanDerWaalsContact O-N 3.11Å; R282-L285 PolarHBondContact O-N 2.98Å; V283-L285 VanDerWaalsContact C-N 3.27Å; V283-L285 PolarHBondContact O-N 3.41Å; L285-N288 PolarHBondContact O-N 3.42Å; L285-E289 WeakPolarHBondContact O-CG 3.09Å; L285-E289 PolarHBondContact O-N 3.38Å
286	R	92.1	Very high	89.8	Confident	33 Å²	33	54.1 Å²	54.1	13%	0.125	26%	0.26	C	S	.	.	H	α-helix	trans	-68.8	-39.5	-174.4	-72.1	-53.8	-163.3	-168.9	4.3	113.4	Y263 E266 R282 V283 N288 E289 E290 F314	Y263-R286 HydrophobicContact CE1-CB 4.24Å; Y263-R286 HydrophobicContact CE1-CG 4.06Å; E266-R286 IonicContact OE1-CZ 3.21Å; E266-R286 VanDerWaalsContact OE1-CZ 3.26Å; E266-R286 IonicContact OE1-NE 2.63Å; E266-R286 PolarHBondContact OE1-NE 3.01Å; E266-R286 IonicContact OE1-NH2 3.74Å; E266-R286 PolarHBondContact OE1-NH2 3.12Å; E266-R286 IonicContact OE2-CZ 2.78Å; E266-R286 IonicContact OE2-NE 3.2Å; E266-R286 PolarHBondContact OE2-NE 3.11Å; E266-R286 IonicContact OE2-NH2 2.73Å; E266-R286 PolarHBondContact OE2-NH2 3.14Å; R282-R286 WeakPolarHBondContact O-CG 3.44Å; R282-R286 PolarHBondContact O-N 2.66Å; V283-R286 PolarHBondContact O-N 2.74Å; V283-R286 VanDerWaalsContact O-N 3.13Å; R286-N288 VanDerWaalsContact C-N 3.34Å; R286-N288 PolarHBondContact O-N 2.96Å; R286-E289 IonicContact CZ-OE2 2.87Å; R286-E289 IonicContact NH1-OE1 3.09Å; R286-E289 IonicContact NH1-OE2 2.96Å; R286-E289 PolarHBondContact NH1-OE2 3Å; R286-E289 PolarHBondContact O-N 2.96Å; R286-E289 VanDerWaalsContact O-N 3.16Å; R286-E290 PolarHBondContact O-N 3.25Å; R286-F314 HydrophobicContact CB-CE2 3.96Å; R286-F314 HydrophobicContact CB-CZ 3.68Å; R286-F314 HydrophobicContact CG-CZ 4.15Å
287	L	91.6	Very high	89.4	Confident	21 Å²	21	53.5 Å²	53.5	11%	0.11	26%	0.255	C	S	.	.	H	α-helix	trans	-58.5	-47.1	173.7	-69.2	169.4	0	0	0	111	V283 E289 E290 Q291 L310 F314 L344 M347	V283-L287 HydrophobicContact CG1-CD1 3.84Å; V283-L287 HydrophobicContact CG1-CG 4.36Å; V283-L287 WeakPolarHBondContact O-CG 3.45Å; V283-L287 PolarHBondContact O-N 2.97Å; L287-E289 VanDerWaalsContact C-N 3.29Å; L287-E289 PolarHBondContact O-N 3.17Å; L287-E290 PolarHBondContact O-N 2.87Å; L287-Q291 WeakPolarHBondContact O-CB 3.31Å; L287-Q291 PolarHBondContact O-N 3.08Å; L287-L310 HydrophobicContact CD2-CB 3.6Å; L287-L310 HydrophobicContact CD2-CD1 4.12Å; L287-L310 HydrophobicContact CD2-CG 4.5Å; L287-F314 HydrophobicContact CD2-CD2 4.17Å; L287-F314 HydrophobicContact CD2-CE2 4.46Å; L287-F314 HydrophobicContact CG-CD2 4.35Å; L287-L344 HydrophobicContact CD1-CD2 4.24Å; L287-M347 HydrophobicContact CD1-CE 3.48Å; L287-M347 VanDerWaalsContact CD1-CE 3.48Å; L287-M347 HydrophobicContact CD1-SD 4.4Å
288	N	89.8	Confident	89.1	Confident	78 Å²	78	53.6 Å²	53.6	42%	0.417	25%	0.254	S	S	.	.	H	α-helix	trans	-64.4	-28.2	176.3	-79.9	-62.6	0	0	0	113.6	E284 L285 R286 R292	E284-N288 PolarHBondContact O-N 3.22Å; E284-N288 PolarHBondContact O-ND2 3.33Å; L285-N288 PolarHBondContact O-N 3.42Å; R286-N288 VanDerWaalsContact C-N 3.34Å; R286-N288 PolarHBondContact O-N 2.96Å; N288-R292 WeakPolarHBondContact O-CG 3.39Å; N288-R292 PolarHBondContact O-NE 3.49Å; N288-R292 PolarHBondContact O-NH2 3.37Å
289	E	90.6	Very high	88.5	Confident	32 Å²	32	50.6 Å²	50.6	15%	0.15	24%	0.243	C	C	.	.	H	α-helix	trans	-74.2	-46.6	173.2	-74.5	178.1	-167.5	0	0	112.5	L285 R286 L287 R292 R293	L285-E289 WeakPolarHBondContact O-CG 3.09Å; L285-E289 PolarHBondContact O-N 3.38Å; R286-E289 IonicContact CZ-OE2 2.87Å; R286-E289 IonicContact NH1-OE1 3.09Å; R286-E289 IonicContact NH1-OE2 2.96Å; R286-E289 PolarHBondContact NH1-OE2 3Å; R286-E289 PolarHBondContact O-N 2.96Å; R286-E289 VanDerWaalsContact O-N 3.16Å; L287-E289 VanDerWaalsContact C-N 3.29Å; L287-E289 PolarHBondContact O-N 3.17Å; E289-R292 WeakPolarHBondContact O-CB 3.45Å; E289-R292 PolarHBondContact O-N 2.88Å; E289-R292 VanDerWaalsContact O-N 3.14Å; E289-R293 PolarHBondContact O-N 3.24Å; E289-R293 IonicContact OE2-CZ 3.59Å; E289-R293 IonicContact OE2-NH1 3.65Å; E289-R293 PolarHBondContact OE2-NH1 2.8Å; E289-R293 IonicContact OE2-NH2 3.55Å; E289-R293 PolarHBondContact OE2-NH2 3.43Å; E289-R293 VanDerWaalsContact OE2-NH2 3.15Å
290	E	90.4	Very high	87.8	Confident	3 Å²	3	55.5 Å²	55.5	1%	0.014	28%	0.277	C	S	.	.	H	α-helix	trans	-67.8	-37	-178.7	-74.3	-64.2	121	0	0	112.3	R206 Y263 R286 L287 R292 R293 C294 L306 L310	R206-E290 IonicContact CZ-OE1 2.92Å; R206-E290 IonicContact CZ-OE2 3.76Å; R206-E290 IonicContact NE-OE1 2.73Å; R206-E290 PolarHBondContact NE-OE1 3.22Å; R206-E290 IonicContact NE-OE2 2.71Å; R206-E290 PolarHBondContact NE-OE2 3.24Å; R206-E290 IonicContact NH2-OE1 3.18Å; R206-E290 IonicContact NH2-OE2 3.57Å; R206-E290 PolarHBondContact NH2-OE2 3.32Å; Y263-E290 HydrophobicContact CE2-CG 3.74Å; Y263-E290 VanDerWaalsContact OH-CG 3.31Å; Y263-E290 WeakPolarHBondContact OH-CG 3.41Å; Y263-E290 PolarHBondContact OH-OE1 3.11Å; R286-E290 PolarHBondContact O-N 3.25Å; L287-E290 PolarHBondContact O-N 2.87Å; E290-R292 VanDerWaalsContact C-N 3.26Å; E290-R292 PolarHBondContact O-N 3.03Å; E290-R293 PolarHBondContact O-N 3.31Å; E290-R293 WeakPolarHBondContact OE1-CD 3.47Å; E290-R293 IonicContact OE1-CZ 3.57Å; E290-R293 IonicContact OE1-NE 2.78Å; E290-R293 IonicContact OE1-NH1 2.85Å; E290-R293 PolarHBondContact OE1-NH1 2.83Å; E290-C294 VanDerWaalsContact O-CB 3.29Å; E290-C294 WeakPolarHBondContact O-CB 3.37Å; E290-C294 PolarHBondContact O-N 3.02Å; E290-L306 HydrophobicContact CB-CD2 4.26Å; E290-L310 HydrophobicContact CB-CD1 3.58Å; E290-L310 HydrophobicContact CG-CD1 3.84Å
291	Q	86.3	Confident	87.3	Confident	110 Å²	110	57.2 Å²	57.2	51%	0.514	29%	0.289	S	S	.	.	H	α-helix	trans	-59	-38.5	170.8	-172.1	179.4	23.9	0	0	111.8	L287 S295 L303	L287-Q291 WeakPolarHBondContact O-CB 3.31Å; L287-Q291 PolarHBondContact O-N 3.08Å; Q291-S295 PolarHBondContact O-N 2.82Å; Q291-S295 PolarHBondContact O-OG 2.93Å; Q291-L303 HydrophobicContact CB-CD1 4.43Å; Q291-L303 HydrophobicContact CG-CD1 4.15Å
292	R	86.9	Confident	87.1	Confident	136 Å²	136	53.4 Å²	53.4	51%	0.513	27%	0.273	S	S	.	.	H	α-helix	trans	-70.3	-45.5	174.6	-78.6	178.9	-73.8	152.2	-1.2	112.3	N288 E289 E290 C294 S295 M296	N288-R292 WeakPolarHBondContact O-CG 3.39Å; N288-R292 PolarHBondContact O-NE 3.49Å; N288-R292 PolarHBondContact O-NH2 3.37Å; E289-R292 WeakPolarHBondContact O-CB 3.45Å; E289-R292 PolarHBondContact O-N 2.88Å; E289-R292 VanDerWaalsContact O-N 3.14Å; E290-R292 VanDerWaalsContact C-N 3.26Å; E290-R292 PolarHBondContact O-N 3.03Å; R292-C294 VanDerWaalsContact C-N 3.33Å; R292-C294 PolarHBondContact O-N 2.92Å; R292-S295 PolarHBondContact O-N 2.95Å; R292-S295 PolarHBondContact O-OG 3.24Å; R292-M296 VanDerWaalsContact O-CG 3.28Å; R292-M296 WeakPolarHBondContact O-CG 3.41Å; R292-M296 PolarHBondContact O-N 3.24Å; R292-M296 VanDerWaalsContact O-N 3.09Å
293	R	88.3	Confident	86.8	Confident	25 Å²	25	51 Å²	51	9%	0.094	27%	0.267	C	S	.	.	H	α-helix	trans	-59.2	-44.8	176.4	-72.7	-178.1	-173.3	102.6	13.8	111.6	D205 E289 E290 S295 M296 Y297	D205-R293 PolarHBondContact O-NH2 3.06Å; D205-R293 IonicContact OD1-NE 3.34Å; D205-R293 WeakPolarHBondContact OD2-CD 3.4Å; D205-R293 WeakPolarHBondContact OD2-CG 3.5Å; D205-R293 IonicContact OD2-NE 3.86Å; D205-R293 PolarHBondContact OD2-NE 3.37Å; E289-R293 PolarHBondContact O-N 3.24Å; E289-R293 IonicContact OE2-CZ 3.59Å; E289-R293 IonicContact OE2-NH1 3.65Å; E289-R293 PolarHBondContact OE2-NH1 2.8Å; E289-R293 IonicContact OE2-NH2 3.55Å; E289-R293 PolarHBondContact OE2-NH2 3.43Å; E289-R293 VanDerWaalsContact OE2-NH2 3.15Å; E290-R293 PolarHBondContact O-N 3.31Å; E290-R293 WeakPolarHBondContact OE1-CD 3.47Å; E290-R293 IonicContact OE1-CZ 3.57Å; E290-R293 IonicContact OE1-NE 2.78Å; E290-R293 IonicContact OE1-NH1 2.85Å; E290-R293 PolarHBondContact OE1-NH1 2.83Å; R293-S295 PolarHBondContact O-N 2.82Å; R293-M296 PolarHBondContact O-N 2.88Å; R293-Y297 HydrophobicContact CB-CE1 4.3Å; R293-Y297 WeakPolarHBondContact CD-OH 3.4Å; R293-Y297 HydrophobicContact CG-CE1 4.47Å; R293-Y297 PolarHBondContact O-N 2.8Å
294	C	86.6	Confident	86.5	Confident	3 Å²	3	55.3 Å²	55.3	2%	0.02	29%	0.294	C	S	.	.	H	α-helix	trans	-60.6	-44.9	178.1	-169.7	0	0	0	0	111.8	E290 R292 M296 L298 L303 L306	E290-C294 VanDerWaalsContact O-CB 3.29Å; E290-C294 WeakPolarHBondContact O-CB 3.37Å; E290-C294 PolarHBondContact O-N 3.02Å; R292-C294 VanDerWaalsContact C-N 3.33Å; R292-C294 PolarHBondContact O-N 2.92Å; C294-M296 VanDerWaalsContact C-N 3.27Å; C294-M296 PolarHBondContact O-N 2.85Å; C294-L298 HydrophobicContact CB-CD1 4.33Å; C294-L298 PolarHBondContact O-N 3.07Å; C294-L298 VanDerWaalsContact O-N 3.09Å; C294-L303 HydrophobicContact CB-CD1 4.07Å; C294-L306 HydrophobicContact CB-CD2 4.14Å
295	S	81.3	Confident	86.4	Confident	98 Å²	98	54.6 Å²	54.6	69%	0.685	29%	0.289	S	S	*	.	H	α-helix	trans	-70.7	-17.3	177.6	69.6	0	0	0	0	114.8	Q291 R292 R293	Q291-S295 PolarHBondContact O-N 2.82Å; Q291-S295 PolarHBondContact O-OG 2.93Å; R292-S295 PolarHBondContact O-N 2.95Å; R292-S295 PolarHBondContact O-OG 3.24Å; R293-S295 PolarHBondContact O-N 2.82Å
296	M	83.4	Confident	86.3	Confident	120 Å²	120	50.8 Å²	50.8	59%	0.591	27%	0.269	S	S	*	.	H	α-helix	trans	-84.9	-39.5	178.8	-76.6	176.7	64.6	0	0	114.3	T213 R292 R293 C294	T213-M296 HydrophobicContact CG2-CE 4.26Å; R292-M296 VanDerWaalsContact O-CG 3.28Å; R292-M296 WeakPolarHBondContact O-CG 3.41Å; R292-M296 PolarHBondContact O-N 3.24Å; R292-M296 VanDerWaalsContact O-N 3.09Å; R293-M296 PolarHBondContact O-N 2.88Å; C294-M296 VanDerWaalsContact C-N 3.27Å; C294-M296 PolarHBondContact O-N 2.85Å
297	Y	82.3	Confident	86.1	Confident	8 Å²	8	53 Å²	53	3%	0.031	28%	0.283	C	S	.	.	H	α-helix	trans	-148	4	-170.3	54.6	-110	0	0	0	116.6	I202 D205 T213 I216 R293	I202-Y297 HydrophobicContact CD1-CE2 4.14Å; I202-Y297 HydrophobicContact CG1-CE2 3.95Å; D205-Y297 PolarHBondContact OD2-OH 3.16Å; T213-Y297 HydrophobicContact CG2-CD1 3.88Å; T213-Y297 HydrophobicContact CG2-CE1 3.94Å; I216-Y297 HydrophobicContact CB-CD2 4.31Å; I216-Y297 HydrophobicContact CB-CG 4.34Å; I216-Y297 HydrophobicContact CD1-CD2 4.38Å; I216-Y297 HydrophobicContact CD1-CE1 4.39Å; I216-Y297 HydrophobicContact CD1-CE2 4.23Å; I216-Y297 HydrophobicContact CG2-CD2 3.49Å; I216-Y297 VanDerWaalsContact CG2-CD2 3.49Å; I216-Y297 HydrophobicContact CG2-CE2 4.11Å; I216-Y297 HydrophobicContact CG2-CG 3.96Å; R293-Y297 HydrophobicContact CB-CE1 4.3Å; R293-Y297 WeakPolarHBondContact CD-OH 3.4Å; R293-Y297 HydrophobicContact CG-CE1 4.47Å; R293-Y297 PolarHBondContact O-N 2.8Å
298	L	85	Confident	86	Confident	21 Å²	21	58.2 Å²	58.2	11%	0.11	31%	0.307	C	S	.	.	S	Bend	trans	-110.4	172.1	176.3	-56.6	-177.5	0	0	0	111.8	F251 F255 C294	F251-L298 HydrophobicContact CE1-CD2 3.71Å; F251-L298 HydrophobicContact CZ-CD2 3.72Å; F255-L298 HydrophobicContact CD1-CD1 4.47Å; F255-L298 HydrophobicContact CE1-CD1 3.8Å; F255-L298 HydrophobicContact CE2-CD1 3.84Å; F255-L298 HydrophobicContact CZ-CD1 3.45Å; F255-L298 VanDerWaalsContact CZ-CD1 3.45Å; C294-L298 HydrophobicContact CB-CD1 4.33Å; C294-L298 PolarHBondContact O-N 3.07Å; C294-L298 VanDerWaalsContact O-N 3.09Å
299	C	79.1	Confident	86	Confident	21 Å²	21	56 Å²	56	14%	0.142	30%	0.297	C	S	.	.			trans	-78.4	143.1	174.3	-163.1	0	0	0	0	110.8	I224 Y247 S301 T302	I224-C299 HydrophobicContact CD1-CB 4.34Å; Y247-C299 HydrophobicContact CD1-CB 4.43Å; Y247-C299 HydrophobicContact CE1-CB 3.68Å; Y247-C299 HydrophobicContact CE2-CB 4.48Å; Y247-C299 PolarHBondContact OH-N 3.14Å; C299-S301 PolarHBondContact O-N 2.91Å; C299-S301 VanDerWaalsContact O-N 3.14Å; C299-T302 WeakPolarHBondContact O-CB 3.28Å; C299-T302 PolarHBondContact O-N 2.8Å
300	S	79.4	Confident	86.2	Confident	105 Å²	105	54.7 Å²	54.7	73%	0.734	29%	0.291	S	S	*	.	H	α-helix	trans	-63.1	-20	-179.1	56.2	0	0	0	0	114	T302	S300-T302 VanDerWaalsContact C-N 3.32Å
301	S	81.4	Confident	86.2	Confident	37 Å²	37	55.1 Å²	55.1	26%	0.259	29%	0.294	S	S	.	.	H	α-helix	trans	-66.6	-32.6	172.3	56.4	0	0	0	0	113.1	C299 L303	C299-S301 PolarHBondContact O-N 2.91Å; C299-S301 VanDerWaalsContact O-N 3.14Å; S301-L303 VanDerWaalsContact C-N 3.29Å; S301-L303 PolarHBondContact O-N 2.89Å
302	T	87	Confident	86.5	Confident	0 Å²	0	53 Å²	53	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-72.1	-26.2	-176.6	-53.3	0	0	0	0	111.8	Y247 E252 F255 C299 S300 V304 K305 L306	Y247-T302 WeakPolarHBondContact CE1-OG1 3.33Å; Y247-T302 PolarHBondContact OH-OG1 3.35Å; E252-T302 HydrophobicContact CG-CG2 3.95Å; E252-T302 WeakPolarHBondContact OE1-CA 3.48Å; E252-T302 WeakPolarHBondContact OE1-CB 3.46Å; E252-T302 PolarHBondContact OE1-OG1 3.23Å; F255-T302 HydrophobicContact CD1-CG2 3.96Å; F255-T302 HydrophobicContact CE1-CG2 3.82Å; C299-T302 WeakPolarHBondContact O-CB 3.28Å; C299-T302 PolarHBondContact O-N 2.8Å; S300-T302 VanDerWaalsContact C-N 3.32Å; T302-V304 VanDerWaalsContact C-N 3.28Å; T302-V304 PolarHBondContact O-N 2.99Å; T302-K305 PolarHBondContact O-N 3.04Å; T302-L306 WeakPolarHBondContact O-CB 3.4Å; T302-L306 PolarHBondContact O-N 3.34Å
303	L	86.5	Confident	86.7	Confident	57 Å²	57	46.5 Å²	46.5	30%	0.298	26%	0.261	S	S	.	.	H	α-helix	trans	-55.3	-42.5	179.5	-177	60	0	0	0	112.2	Q291 C294 S301 L306 D307	Q291-L303 HydrophobicContact CB-CD1 4.43Å; Q291-L303 HydrophobicContact CG-CD1 4.15Å; C294-L303 HydrophobicContact CB-CD1 4.07Å; S301-L303 VanDerWaalsContact C-N 3.29Å; S301-L303 PolarHBondContact O-N 2.89Å; L303-L306 PolarHBondContact O-N 3.4Å; L303-D307 VanDerWaalsContact O-CB 3.31Å; L303-D307 WeakPolarHBondContact O-CB 3.42Å; L303-D307 PolarHBondContact O-N 3.16Å
304	V	85	Confident	87	Confident	93 Å²	93	45.5 Å²	45.5	56%	0.564	26%	0.257	S	S	*	.	H	α-helix	trans	-67.5	-41.5	-178.8	-176.2	0	0	0	0	111.6	T302 Q308	T302-V304 VanDerWaalsContact C-N 3.28Å; T302-V304 PolarHBondContact O-N 2.99Å; V304-Q308 WeakPolarHBondContact O-CG 3.43Å; V304-Q308 PolarHBondContact O-N 3.34Å
305	K	88.5	Confident	87.2	Confident	64 Å²	64	45.4 Å²	45.4	28%	0.278	26%	0.257	S	S	.	.	H	α-helix	trans	-69.5	-39.9	177.3	-60.2	-178.6	-175.4	178.4	0	111.4	E252 L256 T302 V309	E252-K305 IonicContact OE1-NZ 2.88Å; E252-K305 IonicContact OE2-NZ 3.86Å; E252-K305 PolarHBondContact OE2-NZ 2.9Å; L256-K305 HydrophobicContact CD1-CB 3.93Å; L256-K305 HydrophobicContact CD1-CD 4.18Å; L256-K305 HydrophobicContact CD2-CB 4.31Å; T302-K305 PolarHBondContact O-N 3.04Å; K305-V309 WeakPolarHBondContact O-CG2 3.38Å; K305-V309 PolarHBondContact O-N 3.25Å
306	L	91.4	Very high	87.6	Confident	1 Å²	1	41.8 Å²	41.8	1%	0.005	24%	0.235	C	C	.	.	H	α-helix	trans	-63.7	-47.2	177.5	176.9	59.5	0	0	0	111.4	F255 L256 T259 E290 C294 T302 L303 Q308 V309 L310	F255-L306 HydrophobicContact CE1-CD1 4.06Å; F255-L306 HydrophobicContact CE1-CD2 4.21Å; F255-L306 HydrophobicContact CZ-CD1 4.15Å; F255-L306 HydrophobicContact CZ-CD2 4.11Å; L256-L306 HydrophobicContact CD2-CB 4.31Å; T259-L306 HydrophobicContact CG2-CD1 3.71Å; E290-L306 HydrophobicContact CB-CD2 4.26Å; C294-L306 HydrophobicContact CB-CD2 4.14Å; T302-L306 WeakPolarHBondContact O-CB 3.4Å; T302-L306 PolarHBondContact O-N 3.34Å; L303-L306 PolarHBondContact O-N 3.4Å; L306-Q308 PolarHBondContact O-N 2.98Å; L306-V309 PolarHBondContact O-N 2.83Å; L306-L310 HydrophobicContact CD1-CD1 3.87Å; L306-L310 HydrophobicContact CD1-CD2 4.41Å; L306-L310 HydrophobicContact CD1-CG 3.98Å; L306-L310 HydrophobicContact CG-CD1 3.89Å; L306-L310 HydrophobicContact CG-CG 4.37Å; L306-L310 VanDerWaalsContact O-CG 3.3Å; L306-L310 WeakPolarHBondContact O-CG 2.89Å; L306-L310 PolarHBondContact O-N 2.8Å
307	D	88.1	Confident	87.9	Confident	79 Å²	79	42 Å²	42	42%	0.422	23%	0.23	S	C	.	.	H	α-helix	trans	-60.8	-44.3	179.9	-165	49	0	0	0	111.5	L303 V309 L310 V311	L303-D307 VanDerWaalsContact O-CB 3.31Å; L303-D307 WeakPolarHBondContact O-CB 3.42Å; L303-D307 PolarHBondContact O-N 3.16Å; D307-V309 PolarHBondContact O-N 2.95Å; D307-L310 PolarHBondContact O-N 3.31Å; D307-V311 WeakPolarHBondContact O-CB 3.37Å; D307-V311 VanDerWaalsContact O-CG2 3.24Å; D307-V311 WeakPolarHBondContact O-CG2 3.47Å; D307-V311 PolarHBondContact O-N 2.67Å
308	Q	88.4	Confident	88.2	Confident	131 Å²	131	43.1 Å²	43.1	61%	0.612	23%	0.234	S	C	*	.	H	α-helix	trans	-57	-45	173.4	-72.5	174.6	-9.3	0	0	112.9	V304 L306 D312	V304-Q308 WeakPolarHBondContact O-CG 3.43Å; V304-Q308 PolarHBondContact O-N 3.34Å; L306-Q308 PolarHBondContact O-N 2.98Å; Q308-D312 WeakPolarHBondContact O-CB 3.45Å; Q308-D312 PolarHBondContact O-N 3.42Å
309	V	91.3	Very high	88.3	Confident	33 Å²	33	43.1 Å²	43.1	20%	0.2	23%	0.234	C	C	.	.	H	α-helix	trans	-65.2	-44.6	177.7	169.7	0	0	0	0	111.4	L256 E260 K305 L306 D307 I313	L256-V309 HydrophobicContact CD2-CG2 4.5Å; E260-V309 HydrophobicContact CB-CG1 4.09Å; K305-V309 WeakPolarHBondContact O-CG2 3.38Å; K305-V309 PolarHBondContact O-N 3.25Å; L306-V309 PolarHBondContact O-N 2.83Å; D307-V309 PolarHBondContact O-N 2.95Å; V309-I313 HydrophobicContact CG1-CD1 3.64Å; V309-I313 VanDerWaalsContact O-CD1 3.32Å; V309-I313 WeakPolarHBondContact O-CD1 3.38Å; V309-I313 WeakPolarHBondContact O-CG1 3.04Å; V309-I313 PolarHBondContact O-N 3.02Å
310	L	93.2	Very high	88.7	Confident	4 Å²	4	48.9 Å²	48.9	2%	0.021	26%	0.263	C	S	.	.	H	α-helix	trans	-67.7	-40.8	-179.8	-64.8	174.4	0	0	0	112.2	T259 Y263 L287 E290 L306 D307 I313 F314	T259-L310 HydrophobicContact CG2-CD2 4.15Å; Y263-L310 HydrophobicContact CD2-CD2 3.3Å; Y263-L310 HydrophobicContact CE2-CD2 3.67Å; Y263-L310 HydrophobicContact CG-CD2 3.99Å; L287-L310 HydrophobicContact CD2-CB 3.6Å; L287-L310 HydrophobicContact CD2-CD1 4.12Å; L287-L310 HydrophobicContact CD2-CG 4.5Å; E290-L310 HydrophobicContact CB-CD1 3.58Å; E290-L310 HydrophobicContact CG-CD1 3.84Å; L306-L310 HydrophobicContact CD1-CD1 3.87Å; L306-L310 HydrophobicContact CD1-CD2 4.41Å; L306-L310 HydrophobicContact CD1-CG 3.98Å; L306-L310 HydrophobicContact CG-CD1 3.89Å; L306-L310 HydrophobicContact CG-CG 4.37Å; L306-L310 VanDerWaalsContact O-CG 3.3Å; L306-L310 WeakPolarHBondContact O-CG 2.89Å; L306-L310 PolarHBondContact O-N 2.8Å; D307-L310 PolarHBondContact O-N 3.31Å; L310-I313 PolarHBondContact O-N 3.24Å; L310-F314 HydrophobicContact CB-CD2 4.16Å; L310-F314 HydrophobicContact CB-CE2 4.27Å; L310-F314 HydrophobicContact CD2-CE2 4.03Å; L310-F314 VanDerWaalsContact O-CB 3.32Å; L310-F314 WeakPolarHBondContact O-CB 3.27Å; L310-F314 WeakPolarHBondContact O-CD2 3.24Å; L310-F314 PolarHBondContact O-N 2.93Å
311	V	91.5	Very high	89.1	Confident	12 Å²	12	46.3 Å²	46.3	7%	0.073	24%	0.24	C	C	.	.	H	α-helix	trans	-65.7	-42.1	177.7	169.2	0	0	0	0	111.5	D307 I315 G316 M347 V348	D307-V311 WeakPolarHBondContact O-CB 3.37Å; D307-V311 VanDerWaalsContact O-CG2 3.24Å; D307-V311 WeakPolarHBondContact O-CG2 3.47Å; D307-V311 PolarHBondContact O-N 2.67Å; V311-I315 WeakPolarHBondContact O-CA 3.37Å; V311-I315 WeakPolarHBondContact O-CB 3.43Å; V311-I315 PolarHBondContact O-N 3.07Å; V311-G316 PolarHBondContact O-N 2.77Å; V311-M347 HydrophobicContact CG1-CB 3.96Å; V311-M347 WeakPolarHBondContact CG1-O 3.45Å; V311-M347 HydrophobicContact CG2-CB 4.03Å; V311-M347 HydrophobicContact CG2-CE 4.24Å; V311-V348 HydrophobicContact CG1-CG2 3.69Å
312	D	92.2	Very high	89.5	Confident	64 Å²	64	44.6 Å²	44.6	34%	0.342	23%	0.228	S	C	.	.	H	α-helix	trans	-61.1	-50.9	173.7	177.3	52.3	0	0	0	111.5	Q308 G316 R317	Q308-D312 WeakPolarHBondContact O-CB 3.45Å; Q308-D312 PolarHBondContact O-N 3.42Å; D312-G316 CarbonylContact O-C 3.46Å; D312-G316 WeakPolarHBondContact O-CA 3.33Å; D312-G316 PolarHBondContact O-N 2.82Å; D312-R317 WeakPolarHBondContact O-CG 3.33Å; D312-R317 PolarHBondContact O-N 2.69Å; D312-R317 IonicContact OD2-CZ 3.26Å; D312-R317 IonicContact OD2-NE 2.93Å; D312-R317 PolarHBondContact OD2-NE 3.02Å; D312-R317 IonicContact OD2-NH2 2.85Å; D312-R317 PolarHBondContact OD2-NH2 3.4Å
313	I	91.6	Very high	89.4	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-60.5	-56.9	179.8	-66.4	161.8	0	0	0	110.6	E260 V309 L310 I315 R318	E260-I313 HydrophobicContact CB-CD1 4.03Å; E260-I313 HydrophobicContact CG-CD1 3.91Å; E260-I313 HydrophobicContact CG-CG1 4.47Å; V309-I313 HydrophobicContact CG1-CD1 3.64Å; V309-I313 VanDerWaalsContact O-CD1 3.32Å; V309-I313 WeakPolarHBondContact O-CD1 3.38Å; V309-I313 WeakPolarHBondContact O-CG1 3.04Å; V309-I313 PolarHBondContact O-N 3.02Å; L310-I313 PolarHBondContact O-N 3.24Å; I313-I315 PolarHBondContact O-N 3.1Å; I313-R318 PolarHBondContact O-NH1 3.41Å
314	F	93.4	Very high	89.4	Confident	4 Å²	4	48.6 Å²	48.6	2%	0.018	25%	0.253	C	S	.	.	H	α-helix	trans	-72.4	-28.1	-170.7	-72.4	-52.7	0	0	0	113.5	Y263 A267 Y279 V283 R286 L287 L310	Y263-F314 HydrophobicContact CD1-CE1 4.08Å; Y263-F314 HydrophobicContact CD1-CE2 4.33Å; Y263-F314 AromaticContact CD1-CZ 3.43Å; Y263-F314 HydrophobicContact CD1-CZ 3.43Å; Y263-F314 VanDerWaalsContact CD1-CZ 3.43Å; Y263-F314 AromaticContact CE1-CZ 3.97Å; Y263-F314 HydrophobicContact CE1-CZ 3.97Å; Y263-F314 HydrophobicContact CG-CE2 4.44Å; Y263-F314 AromaticContact CG-CZ 3.85Å; Y263-F314 HydrophobicContact CG-CZ 3.85Å; A267-F314 HydrophobicContact CB-CD1 3.97Å; A267-F314 HydrophobicContact CB-CE1 4.04Å; Y279-F314 VanDerWaalsContact OH-CA 3.31Å; Y279-F314 WeakPolarHBondContact OH-CA 3.39Å; Y279-F314 PolarHBondContact OH-O 3.21Å; V283-F314 HydrophobicContact CB-CB 4.36Å; V283-F314 HydrophobicContact CB-CG 4.39Å; V283-F314 HydrophobicContact CG1-CB 3.63Å; V283-F314 HydrophobicContact CG1-CD2 4.11Å; V283-F314 HydrophobicContact CG1-CG 3.89Å; V283-F314 HydrophobicContact CG2-CB 3.81Å; V283-F314 HydrophobicContact CG2-CD1 3.76Å; V283-F314 HydrophobicContact CG2-CE1 4.5Å; V283-F314 HydrophobicContact CG2-CG 3.89Å; R286-F314 HydrophobicContact CB-CE2 3.96Å; R286-F314 HydrophobicContact CB-CZ 3.68Å; R286-F314 HydrophobicContact CG-CZ 4.15Å; L287-F314 HydrophobicContact CD2-CD2 4.17Å; L287-F314 HydrophobicContact CD2-CE2 4.46Å; L287-F314 HydrophobicContact CG-CD2 4.35Å; L310-F314 HydrophobicContact CB-CD2 4.16Å; L310-F314 HydrophobicContact CB-CE2 4.27Å; L310-F314 HydrophobicContact CD2-CE2 4.03Å; L310-F314 VanDerWaalsContact O-CB 3.32Å; L310-F314 WeakPolarHBondContact O-CB 3.27Å; L310-F314 WeakPolarHBondContact O-CD2 3.24Å; L310-F314 PolarHBondContact O-N 2.93Å
315	I	91.6	Very high	89.5	Confident	1 Å²	1	46.3 Å²	46.3	1%	0.005	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-130.9	-52.3	-166.8	-42.7	177.7	0	0	0	111.2	V283 V311 I313 R317 R318 M319 L322 L344 M347 V348	V283-I315 HydrophobicContact CG1-CD1 4.48Å; V283-I315 HydrophobicContact CG1-CG1 4.4Å; V311-I315 WeakPolarHBondContact O-CA 3.37Å; V311-I315 WeakPolarHBondContact O-CB 3.43Å; V311-I315 PolarHBondContact O-N 3.07Å; I313-I315 PolarHBondContact O-N 3.1Å; I315-R317 PolarHBondContact O-N 3.01Å; I315-R318 CarbonylContact O-C 3.49Å; I315-R318 PolarHBondContact O-N 3.35Å; I315-M319 HydrophobicContact CG2-CE 4.02Å; I315-M319 PolarHBondContact O-N 2.85Å; I315-L322 HydrophobicContact CG2-CD1 3.82Å; I315-L344 HydrophobicContact CD1-CB 3.91Å; I315-L344 HydrophobicContact CD1-CD2 4.22Å; I315-L344 VanDerWaalsContact CD1-O 3.29Å; I315-L344 WeakPolarHBondContact CD1-O 3.38Å; I315-M347 HydrophobicContact CD1-CE 3.34Å; I315-V348 HydrophobicContact CB-CG2 3.59Å; I315-V348 HydrophobicContact CG2-CG2 3.5Å; I315-V348 VanDerWaalsContact CG2-CG2 3.5Å
316	G	88.3	Confident	89.5	Confident	23 Å²	23	43.6 Å²	43.6	24%	0.237	22%	0.224	C	C	.	.	G	3₁₀ helix	trans	-53.8	-55.9	-177.8	0	0	0	0	0	113.3	V311 D312 R318	V311-G316 PolarHBondContact O-N 2.77Å; D312-G316 CarbonylContact O-C 3.46Å; D312-G316 WeakPolarHBondContact O-CA 3.33Å; D312-G316 PolarHBondContact O-N 2.82Å; G316-R318 PolarHBondContact O-N 2.82Å
317	R	90.7	Very high	89.1	Confident	125 Å²	125	47 Å²	47	47%	0.472	24%	0.24	S	C	.	.	G	3₁₀ helix	trans	-66.1	-2.6	178.7	-62.7	178.4	-165.1	-170.6	-1	114.7	E260 D312 I315	E260-R317 IonicContact OE1-CZ 3.32Å; E260-R317 VanDerWaalsContact OE1-CZ 3.25Å; E260-R317 IonicContact OE1-NH1 2.77Å; E260-R317 PolarHBondContact OE1-NH1 3.36Å; E260-R317 IonicContact OE1-NH2 3.38Å; E260-R317 PolarHBondContact OE1-NH2 2.88Å; D312-R317 WeakPolarHBondContact O-CG 3.33Å; D312-R317 PolarHBondContact O-N 2.69Å; D312-R317 IonicContact OD2-CZ 3.26Å; D312-R317 IonicContact OD2-NE 2.93Å; D312-R317 PolarHBondContact OD2-NE 3.02Å; D312-R317 IonicContact OD2-NH2 2.85Å; D312-R317 PolarHBondContact OD2-NH2 3.4Å; I315-R317 PolarHBondContact O-N 3.01Å
318	R	89.5	Confident	88.9	Confident	30 Å²	30	46.3 Å²	46.3	11%	0.113	24%	0.241	C	C	.	.	G	3₁₀ helix	trans	-128.6	6.9	-168	-73.4	168.8	169.3	121.4	-1	113.7	A267 L271 Y279 I313 I315 G316 D320 M321 L322	A267-R318 VanDerWaalsContact CB-NH2 3.28Å; L271-R318 VanDerWaalsContact CD1-NE 3.25Å; Y279-R318 WeakPolarHBondContact OH-CD 3.37Å; I313-R318 PolarHBondContact O-NH1 3.41Å; I315-R318 CarbonylContact O-C 3.49Å; I315-R318 PolarHBondContact O-N 3.35Å; G316-R318 PolarHBondContact O-N 2.82Å; R318-D320 PolarHBondContact O-N 2.99Å; R318-M321 HydrophobicContact CB-CE 4.24Å; R318-M321 PolarHBondContact O-N 2.78Å; R318-M321 VanDerWaalsContact O-N 3.16Å; R318-L322 PolarHBondContact O-N 2.83Å
319	M	87.3	Confident	88.8	Confident	22 Å²	22	40.4 Å²	40.4	11%	0.108	21%	0.214	C	C	.	.	H	α-helix	trans	-57.1	-41.3	-173.1	-163.2	60.3	63.3	0	0	113.8	I315 M321 L322 K323 V348	I315-M319 HydrophobicContact CG2-CE 4.02Å; I315-M319 PolarHBondContact O-N 2.85Å; M319-M321 VanDerWaalsContact C-N 3.31Å; M319-M321 PolarHBondContact O-N 3.31Å; M319-L322 PolarHBondContact O-N 3Å; M319-K323 WeakPolarHBondContact O-CB 3.4Å; M319-K323 PolarHBondContact O-N 2.65Å; M319-V348 HydrophobicContact CE-CB 3.96Å; M319-V348 HydrophobicContact CE-CG1 3.96Å; M319-V348 HydrophobicContact CE-CG2 4.03Å
320	D	86	Confident	88.2	Confident	141 Å²	141	39 Å²	39	75%	0.754	21%	0.205	S	C	*	.	H	α-helix	trans	-59.1	-40.5	178.7	-68.1	-44.2	0	0	0	112.9	R318 K323 S324	R318-D320 PolarHBondContact O-N 2.99Å; D320-K323 PolarHBondContact O-N 2.79Å; D320-S324 PolarHBondContact O-N 3.37Å; D320-S324 VanDerWaalsContact O-N 3.16Å
321	M	89.1	Confident	87.5	Confident	52 Å²	52	42.4 Å²	42.4	26%	0.256	23%	0.23	S	C	.	.	H	α-helix	trans	-68.1	-44.7	176.8	176.6	-82.4	-68.8	0	0	110.8	L271 V276 Y279 R318 M319 K323 S324 E325	L271-M321 HydrophobicContact CD1-CE 4.12Å; L271-M321 HydrophobicContact CD2-CE 3.69Å; V276-M321 HydrophobicContact CB-SD 4.1Å; V276-M321 HydrophobicContact CG1-CE 4.22Å; V276-M321 HydrophobicContact CG1-SD 3.53Å; V276-M321 VanDerWaalsContact CG1-SD 3.53Å; V276-M321 HydrophobicContact CG2-SD 3.38Å; V276-M321 WeakPolarHBondContact CG2-SD 3.37Å; Y279-M321 HydrophobicContact CD1-CE 4.48Å; Y279-M321 HydrophobicContact CE1-CE 4.5Å; R318-M321 HydrophobicContact CB-CE 4.24Å; R318-M321 PolarHBondContact O-N 2.78Å; R318-M321 VanDerWaalsContact O-N 3.16Å; M319-M321 VanDerWaalsContact C-N 3.31Å; M319-M321 PolarHBondContact O-N 3.31Å; M321-K323 VanDerWaalsContact C-N 3.31Å; M321-K323 PolarHBondContact O-N 3.19Å; M321-S324 PolarHBondContact O-N 3.41Å; M321-S324 PolarHBondContact O-OG 2.89Å; M321-E325 PolarHBondContact O-N 3.38Å; M321-E325 VanDerWaalsContact O-N 3.12Å
322	L	89.5	Confident	87	Confident	1 Å²	1	45 Å²	45	1%	0.005	25%	0.248	C	C	.	.	H	α-helix	trans	-61	-40.2	176	-61.4	179.8	0	0	0	111.7	V276 L280 I315 R318 M319 S324 E325 F326 M341	V276-L322 HydrophobicContact CG1-CD2 3.78Å; L280-L322 HydrophobicContact CD2-CD2 3.8Å; L280-L322 HydrophobicContact CG-CD2 4.47Å; I315-L322 HydrophobicContact CG2-CD1 3.82Å; R318-L322 PolarHBondContact O-N 2.83Å; M319-L322 PolarHBondContact O-N 3Å; L322-S324 PolarHBondContact O-N 3.2Å; L322-E325 PolarHBondContact O-N 2.95Å; L322-F326 WeakPolarHBondContact O-CB 3.16Å; L322-F326 PolarHBondContact O-N 2.82Å; L322-M341 HydrophobicContact CD2-CE 4.35Å
323	K	84.8	Confident	86.1	Confident	62 Å²	62	45 Å²	45	27%	0.27	25%	0.248	S	C	.	.	H	α-helix	trans	-59.4	-42.7	175.5	-168.8	176.2	-170.2	168.5	0	112.1	M319 D320 M321 D354 C358	M319-K323 WeakPolarHBondContact O-CB 3.4Å; M319-K323 PolarHBondContact O-N 2.65Å; D320-K323 PolarHBondContact O-N 2.79Å; M321-K323 VanDerWaalsContact C-N 3.31Å; M321-K323 PolarHBondContact O-N 3.19Å; K323-D354 HydrophobicContact CD-CB 4.04Å; K323-D354 WeakPolarHBondContact CE-OD1 3.17Å; K323-D354 IonicContact NZ-OD1 2.88Å; K323-D354 PolarHBondContact NZ-OD1 3.1Å; K323-C358 VanDerWaalsContact CE-SG 3.51Å; K323-C358 VanDerWaalsContact CG-SG 3.57Å
324	S	85.9	Confident	85.4	Confident	79 Å²	79	50.8 Å²	50.8	55%	0.552	27%	0.27	S	S	*	.	H	α-helix	trans	-66.1	-40.9	176.4	73.5	0	0	0	0	113.3	D320 M321 L322	D320-S324 PolarHBondContact O-N 3.37Å; D320-S324 VanDerWaalsContact O-N 3.16Å; M321-S324 PolarHBondContact O-N 3.41Å; M321-S324 PolarHBondContact O-OG 2.89Å; L322-S324 PolarHBondContact O-N 3.2Å
325	E	88.3	Confident	84.5	Confident	45 Å²	45	53.4 Å²	53.4	21%	0.21	29%	0.288	C	S	.	.	H	α-helix	trans	-72.1	-33.9	179.2	-176.3	73.6	166.7	0	0	111.5	V276 M321 L322 Q327 S328 L329 M341	V276-E325 HydrophobicContact CB-CB 4.33Å; V276-E325 HydrophobicContact CB-CG 3.83Å; V276-E325 HydrophobicContact CG1-CB 4.16Å; V276-E325 HydrophobicContact CG1-CG 3.96Å; V276-E325 HydrophobicContact CG2-CB 4.3Å; V276-E325 HydrophobicContact CG2-CG 4.18Å; M321-E325 PolarHBondContact O-N 3.38Å; M321-E325 VanDerWaalsContact O-N 3.12Å; L322-E325 PolarHBondContact O-N 2.95Å; E325-Q327 VanDerWaalsContact C-N 3.25Å; E325-Q327 PolarHBondContact O-N 3.38Å; E325-S328 WeakPolarHBondContact O-CA 3.06Å; E325-S328 VanDerWaalsContact O-CB 3.26Å; E325-S328 WeakPolarHBondContact O-CB 3.24Å; E325-S328 PolarHBondContact O-N 2.86Å; E325-L329 HydrophobicContact CG-CD1 4.15Å; E325-L329 HydrophobicContact CG-CG 4.23Å; E325-L329 WeakPolarHBondContact O-CG 3.42Å; E325-L329 PolarHBondContact O-N 3.36Å; E325-M341 HydrophobicContact CB-CE 4.06Å; E325-M341 HydrophobicContact CG-CE 4.05Å
326	F	86.5	Confident	83.8	Confident	6 Å²	6	57 Å²	57	3%	0.026	31%	0.313	C	S	.	.	H	α-helix	trans	-53.8	-42.2	176	-172.8	-114.7	0	0	0	112.2	L322 S328 L329 L330 L338 M341 L355 C358 L359	L322-F326 WeakPolarHBondContact O-CB 3.16Å; L322-F326 PolarHBondContact O-N 2.82Å; F326-S328 VanDerWaalsContact C-N 3.33Å; F326-S328 PolarHBondContact O-N 3.25Å; F326-L329 PolarHBondContact O-N 3.29Å; F326-L330 HydrophobicContact CD1-CD1 3.78Å; F326-L330 HydrophobicContact CD1-CG 4.27Å; F326-L330 HydrophobicContact CE1-CD1 3.53Å; F326-L330 HydrophobicContact CE1-CG 4.09Å; F326-L330 HydrophobicContact CZ-CD1 4.12Å; F326-L330 HydrophobicContact CZ-CD2 4.3Å; F326-L330 HydrophobicContact CZ-CG 4.26Å; F326-L330 WeakPolarHBondContact O-CB 3.29Å; F326-L330 WeakPolarHBondContact O-CG 3.45Å; F326-L330 PolarHBondContact O-N 3.19Å; F326-L338 HydrophobicContact CD2-CD2 3.58Å; F326-L338 HydrophobicContact CE2-CD2 3.54Å; F326-L338 HydrophobicContact CZ-CD2 4.44Å; F326-M341 HydrophobicContact CB-SD 3.64Å; F326-M341 HydrophobicContact CD2-SD 3.65Å; F326-M341 HydrophobicContact CG-SD 4.09Å; F326-L355 HydrophobicContact CB-CD2 3.99Å; F326-L355 HydrophobicContact CD1-CD2 3.89Å; F326-L355 HydrophobicContact CD2-CD2 3.83Å; F326-L355 HydrophobicContact CE1-CB 4.13Å; F326-L355 HydrophobicContact CE1-CD2 4.25Å; F326-L355 VanDerWaalsContact CE1-O 3.27Å; F326-L355 WeakPolarHBondContact CE1-O 3.39Å; F326-L355 HydrophobicContact CE2-CD2 4.2Å; F326-L355 HydrophobicContact CG-CD2 3.65Å; F326-L355 HydrophobicContact CZ-CB 4.11Å; F326-L355 HydrophobicContact CZ-CD2 4.4Å; F326-C358 HydrophobicContact CD1-CB 3.8Å; F326-C358 HydrophobicContact CE1-CB 4.09Å; F326-L359 HydrophobicContact CE1-CB 4.31Å
327	Q	83.3	Confident	83.5	Confident	74 Å²	74	56.2 Å²	56.2	35%	0.346	30%	0.303	S	S	.	.	H	α-helix	trans	-65.7	-34.2	177.2	-173.6	64.4	-1.7	0	0	112.9	E325 S331	E325-Q327 VanDerWaalsContact C-N 3.25Å; E325-Q327 PolarHBondContact O-N 3.38Å; Q327-S331 WeakPolarHBondContact O-CB 3.46Å; Q327-S331 PolarHBondContact O-N 3.41Å; Q327-S331 PolarHBondContact O-OG 3.28Å
328	S	85.4	Confident	83.2	Confident	64 Å²	64	50.8 Å²	50.8	45%	0.448	28%	0.284	S	S	.	.	H	α-helix	trans	-66.9	-44.3	173.2	-173.8	0	0	0	0	111.3	E325 F326 S331 S332	E325-S328 WeakPolarHBondContact O-CA 3.06Å; E325-S328 VanDerWaalsContact O-CB 3.26Å; E325-S328 WeakPolarHBondContact O-CB 3.24Å; E325-S328 PolarHBondContact O-N 2.86Å; F326-S328 VanDerWaalsContact C-N 3.33Å; F326-S328 PolarHBondContact O-N 3.25Å; S328-S331 PolarHBondContact O-N 2.76Å; S328-S332 PolarHBondContact O-N 2.75Å; S328-S332 VanDerWaalsContact O-N 3.09Å; S328-S332 PolarHBondContact O-OG 3.39Å
329	L	85.3	Confident	82.7	Confident	6 Å²	6	54 Å²	54	3%	0.031	30%	0.299	C	S	.	.	H	α-helix	trans	-67.8	-38.2	178.2	-64.1	175.6	0	0	0	112.9	T277 E325 F326 S331 S332 D333 R334 D337 L338 M341	T277-L329 HydrophobicContact CG2-CD2 4.01Å; E325-L329 HydrophobicContact CG-CD1 4.15Å; E325-L329 HydrophobicContact CG-CG 4.23Å; E325-L329 WeakPolarHBondContact O-CG 3.42Å; E325-L329 PolarHBondContact O-N 3.36Å; F326-L329 PolarHBondContact O-N 3.29Å; L329-S331 VanDerWaalsContact C-N 3.32Å; L329-S331 PolarHBondContact O-N 3.28Å; L329-S332 WeakPolarHBondContact CA-OG 3.36Å; L329-S332 PolarHBondContact O-N 2.95Å; L329-S332 PolarHBondContact O-OG 2.98Å; L329-D333 PolarHBondContact O-N 3.49Å; L329-R334 HydrophobicContact CB-CB 4.38Å; L329-R334 HydrophobicContact CD2-CB 3.79Å; L329-R334 HydrophobicContact CD2-CG 4.17Å; L329-R334 PolarHBondContact O-N 3.05Å; L329-R334 VanDerWaalsContact O-N 3.12Å; L329-D337 HydrophobicContact CD1-CB 4.05Å; L329-D337 HydrophobicContact CD2-CB 4.03Å; L329-L338 HydrophobicContact CB-CD2 3.57Å; L329-L338 HydrophobicContact CB-CG 3.92Å; L329-M341 HydrophobicContact CD1-CE 3.76Å; L329-M341 HydrophobicContact CD1-SD 4.5Å
330	L	78.6	Confident	82.7	Confident	3 Å²	3	55.2 Å²	55.2	2%	0.016	30%	0.302	C	S	.	.	H	α-helix	trans	-63.6	-35.9	172.9	-77.4	178.8	0	0	0	112.6	F326 L338 L359 H362	F326-L330 HydrophobicContact CD1-CD1 3.78Å; F326-L330 HydrophobicContact CD1-CG 4.27Å; F326-L330 HydrophobicContact CE1-CD1 3.53Å; F326-L330 HydrophobicContact CE1-CG 4.09Å; F326-L330 HydrophobicContact CZ-CD1 4.12Å; F326-L330 HydrophobicContact CZ-CD2 4.3Å; F326-L330 HydrophobicContact CZ-CG 4.26Å; F326-L330 WeakPolarHBondContact O-CB 3.29Å; F326-L330 WeakPolarHBondContact O-CG 3.45Å; F326-L330 PolarHBondContact O-N 3.19Å; L330-L338 HydrophobicContact CD2-CD1 4.07Å; L330-L338 HydrophobicContact CD2-CD2 4.03Å; L330-L338 HydrophobicContact CG-CD2 4.1Å; L330-L359 HydrophobicContact CD1-CD1 4.29Å; L330-L359 HydrophobicContact CD2-CD1 3.95Å; L330-H362 HydrophobicContact CD1-CB 4.07Å
331	S	79.7	Confident	82.8	Confident	77 Å²	77	48.5 Å²	48.5	54%	0.538	27%	0.266	S	S	.	.	H	α-helix	trans	-78.7	-22	-179.4	-57.2	0	0	0	0	113.2	Q327 S328 L329	Q327-S331 WeakPolarHBondContact O-CB 3.46Å; Q327-S331 PolarHBondContact O-N 3.41Å; Q327-S331 PolarHBondContact O-OG 3.28Å; S328-S331 PolarHBondContact O-N 2.76Å; L329-S331 VanDerWaalsContact C-N 3.32Å; L329-S331 PolarHBondContact O-N 3.28Å
332	S	79.4	Confident	82.5	Confident	65 Å²	65	47.2 Å²	47.2	46%	0.455	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.6	7.9	178.1	53.9	0	0	0	0	114	S328 L329 R334	S328-S332 PolarHBondContact O-N 2.75Å; S328-S332 VanDerWaalsContact O-N 3.09Å; S328-S332 PolarHBondContact O-OG 3.39Å; L329-S332 WeakPolarHBondContact CA-OG 3.36Å; L329-S332 PolarHBondContact O-N 2.95Å; L329-S332 PolarHBondContact O-OG 2.98Å; S332-R334 PolarHBondContact O-N 3.07Å; S332-R334 VanDerWaalsContact OG-CG 3.29Å; S332-R334 WeakPolarHBondContact OG-CG 3.32Å
333	D	73.8	Confident	82.2	Confident	65 Å²	65	51.2 Å²	51.2	35%	0.348	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.2	32.1	-179.7	-66.8	-41.2	0	0	0	113.7	L329 C335 K395 R396	L329-D333 PolarHBondContact O-N 3.49Å; D333-C335 VanDerWaalsContact C-N 3.32Å; D333-C335 PolarHBondContact O-N 3.34Å; D333-C335 PolarHBondContact O-SG 3.42Å; D333-C335 VanDerWaalsContact O-SG 3.36Å; D333-K395 IonicContact OD1-NZ 2.67Å; D333-K395 VanDerWaalsContact OD2-CE 3.27Å; D333-K395 WeakPolarHBondContact OD2-CE 3.47Å; D333-K395 IonicContact OD2-NZ 2.7Å; D333-K395 PolarHBondContact OD2-NZ 3.12Å; D333-R396 IonicContact OD1-NH2 3.67Å
334	R	77.5	Confident	82.4	Confident	121 Å²	121	48.8 Å²	48.8	46%	0.457	27%	0.267	S	S	.	.			trans	-78.1	66.3	-174.3	-73	-73.8	-68.4	-117.6	-2.7	113.8	L329 S332 S336 D337 L338	L329-R334 HydrophobicContact CB-CB 4.38Å; L329-R334 HydrophobicContact CD2-CB 3.79Å; L329-R334 HydrophobicContact CD2-CG 4.17Å; L329-R334 PolarHBondContact O-N 3.05Å; L329-R334 VanDerWaalsContact O-N 3.12Å; S332-R334 PolarHBondContact O-N 3.07Å; S332-R334 VanDerWaalsContact OG-CG 3.29Å; S332-R334 WeakPolarHBondContact OG-CG 3.32Å; R334-S336 VanDerWaalsContact C-N 3.33Å; R334-S336 PolarHBondContact O-N 2.85Å; R334-S336 VanDerWaalsContact O-N 3.16Å; R334-D337 IonicContact CZ-OD2 2.75Å; R334-D337 VanDerWaalsContact CZ-OD2 3.24Å; R334-D337 IonicContact NE-OD2 2.69Å; R334-D337 PolarHBondContact NE-OD2 2.67Å; R334-D337 IonicContact NH2-OD2 2.63Å; R334-D337 PolarHBondContact NH2-OD2 3.44Å; R334-D337 PolarHBondContact O-N 3.49Å; R334-D337 VanDerWaalsContact O-N 3.07Å; R334-L338 PolarHBondContact O-N 3.19Å; R334-L338 VanDerWaalsContact O-N 3.07Å
335	C	73.1	Confident	82.4	Confident	60 Å²	60	45 Å²	45	41%	0.405	24%	0.241	S	C	.	.	H	α-helix	trans	-53.4	-37.9	-170.9	-62	0	0	0	0	115.6	D333 D337 K339	D333-C335 VanDerWaalsContact C-N 3.32Å; D333-C335 PolarHBondContact O-N 3.34Å; D333-C335 PolarHBondContact O-SG 3.42Å; D333-C335 VanDerWaalsContact O-SG 3.36Å; C335-D337 VanDerWaalsContact C-N 3.34Å; C335-D337 PolarHBondContact O-N 2.6Å; C335-K339 WeakPolarHBondContact O-CB 3.36Å; C335-K339 PolarHBondContact O-N 3.49Å
336	S	78	Confident	82.3	Confident	75 Å²	75	45.7 Å²	45.7	52%	0.524	25%	0.25	S	S	.	.	H	α-helix	trans	-67.7	-32.5	179.6	55.2	0	0	0	0	113.8	R334 R340	R334-S336 VanDerWaalsContact C-N 3.33Å; R334-S336 PolarHBondContact O-N 2.85Å; R334-S336 VanDerWaalsContact O-N 3.16Å; S336-R340 PolarHBondContact O-N 3.44Å
337	D	82.8	Confident	82.3	Confident	7 Å²	7	49.1 Å²	49.1	4%	0.037	27%	0.267	C	S	.	.	H	α-helix	trans	-87.6	-34.3	-177.1	-56.9	-44.1	0	0	0	110.3	T277 L329 R334 C335 K339 R340 M341	T277-D337 HydrophobicContact CG2-CB 4.09Å; L329-D337 HydrophobicContact CD1-CB 4.05Å; L329-D337 HydrophobicContact CD2-CB 4.03Å; R334-D337 IonicContact CZ-OD2 2.75Å; R334-D337 VanDerWaalsContact CZ-OD2 3.24Å; R334-D337 IonicContact NE-OD2 2.69Å; R334-D337 PolarHBondContact NE-OD2 2.67Å; R334-D337 IonicContact NH2-OD2 2.63Å; R334-D337 PolarHBondContact NH2-OD2 3.44Å; R334-D337 PolarHBondContact O-N 3.49Å; R334-D337 VanDerWaalsContact O-N 3.07Å; C335-D337 VanDerWaalsContact C-N 3.34Å; C335-D337 PolarHBondContact O-N 2.6Å; D337-K339 VanDerWaalsContact C-N 3.34Å; D337-R340 PolarHBondContact O-N 2.95Å; D337-R340 IonicContact OD1-NH1 3.88Å; D337-R340 PolarHBondContact OD1-NH1 3.03Å; D337-M341 WeakPolarHBondContact O-CB 3.26Å; D337-M341 PolarHBondContact O-N 3Å
338	L	82.6	Confident	82.3	Confident	11 Å²	11	46.9 Å²	46.9	6%	0.058	26%	0.259	C	S	.	.	H	α-helix	trans	-57.8	-43.9	166.6	-69.9	170	0	0	0	111.8	F326 L329 L330 R334 M341 Y342 V399	F326-L338 HydrophobicContact CD2-CD2 3.58Å; F326-L338 HydrophobicContact CE2-CD2 3.54Å; F326-L338 HydrophobicContact CZ-CD2 4.44Å; L329-L338 HydrophobicContact CB-CD2 3.57Å; L329-L338 HydrophobicContact CB-CG 3.92Å; L330-L338 HydrophobicContact CD2-CD1 4.07Å; L330-L338 HydrophobicContact CD2-CD2 4.03Å; L330-L338 HydrophobicContact CG-CD2 4.1Å; R334-L338 PolarHBondContact O-N 3.19Å; R334-L338 VanDerWaalsContact O-N 3.07Å; L338-M341 PolarHBondContact O-N 2.96Å; L338-Y342 WeakPolarHBondContact O-CB 3.22Å; L338-Y342 PolarHBondContact O-N 3.39Å; L338-V399 HydrophobicContact CD1-CG1 4.39Å
339	K	79.8	Confident	81.5	Confident	99 Å²	99	52 Å²	52	43%	0.43	28%	0.276	S	S	.	.	H	α-helix	trans	-58.3	-52.5	176	177.4	175.8	172.1	-176.8	0	111.6	C335 D337 M341 Y342 E343 H403	C335-K339 WeakPolarHBondContact O-CB 3.36Å; C335-K339 PolarHBondContact O-N 3.49Å; D337-K339 VanDerWaalsContact C-N 3.34Å; K339-M341 VanDerWaalsContact C-N 3.33Å; K339-M341 PolarHBondContact O-N 3.05Å; K339-Y342 WeakPolarHBondContact O-CB 3.44Å; K339-Y342 PolarHBondContact O-N 3.27Å; K339-E343 WeakPolarHBondContact CE-OE1 3.35Å; K339-E343 WeakPolarHBondContact CE-OE2 3.21Å; K339-E343 IonicContact NZ-OE1 3.78Å; K339-E343 PolarHBondContact NZ-OE1 3.33Å; K339-E343 WeakPolarHBondContact O-CG 3.38Å; K339-E343 PolarHBondContact O-N 2.88Å; K339-H403 WeakPolarHBondContact CB-NE2 3.14Å
340	R	87.1	Confident	80.8	Confident	47 Å²	47	59 Å²	59	18%	0.177	31%	0.306	C	S	.	.	H	α-helix	trans	-60.8	-41.8	179.9	-175.5	-178	-63.5	91.7	12.8	111.9	L280 E284 S336 D337 E343 L344	L280-R340 HydrophobicContact CB-CG 4.25Å; E284-R340 WeakPolarHBondContact OE2-CD 3.45Å; E284-R340 IonicContact OE2-CZ 3.66Å; E284-R340 IonicContact OE2-NE 3.58Å; E284-R340 PolarHBondContact OE2-NE 3.11Å; E284-R340 IonicContact OE2-NH2 3.85Å; S336-R340 PolarHBondContact O-N 3.44Å; D337-R340 PolarHBondContact O-N 2.95Å; D337-R340 IonicContact OD1-NH1 3.88Å; D337-R340 PolarHBondContact OD1-NH1 3.03Å; R340-E343 PolarHBondContact O-N 3.28Å; R340-L344 HydrophobicContact CG-CD1 3.81Å; R340-L344 HydrophobicContact CG-CG 4.39Å; R340-L344 WeakPolarHBondContact O-CB 3.19Å; R340-L344 VanDerWaalsContact O-CG 3.27Å; R340-L344 WeakPolarHBondContact O-CG 3.44Å; R340-L344 PolarHBondContact O-N 3.11Å
341	M	87.6	Confident	80.5	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-64.3	-40.5	176.7	-171.2	178.9	-77	0	0	111.7	L280 L322 E325 F326 L329 D337 L338 K339 C345 L355	L280-M341 HydrophobicContact CD1-CB 3.95Å; L280-M341 HydrophobicContact CD1-CE 3.86Å; L280-M341 HydrophobicContact CD1-CG 4.27Å; L322-M341 HydrophobicContact CD2-CE 4.35Å; E325-M341 HydrophobicContact CB-CE 4.06Å; E325-M341 HydrophobicContact CG-CE 4.05Å; F326-M341 HydrophobicContact CB-SD 3.64Å; F326-M341 HydrophobicContact CD2-SD 3.65Å; F326-M341 HydrophobicContact CG-SD 4.09Å; L329-M341 HydrophobicContact CD1-CE 3.76Å; L329-M341 HydrophobicContact CD1-SD 4.5Å; D337-M341 WeakPolarHBondContact O-CB 3.26Å; D337-M341 PolarHBondContact O-N 3Å; L338-M341 PolarHBondContact O-N 2.96Å; K339-M341 VanDerWaalsContact C-N 3.33Å; K339-M341 PolarHBondContact O-N 3.05Å; M341-C345 VanDerWaalsContact O-CB 3.3Å; M341-C345 WeakPolarHBondContact O-CB 3.26Å; M341-C345 PolarHBondContact O-N 2.98Å; M341-C345 PolarHBondContact O-SG 3.4Å; M341-C345 VanDerWaalsContact O-SG 3.35Å; M341-L355 HydrophobicContact SD-CD2 4.43Å
342	Y	83.4	Confident	80.6	Confident	24 Å²	24	56.7 Å²	56.7	9%	0.094	29%	0.288	C	S	.	.	H	α-helix	trans	-62.3	-48.1	174.5	170.5	-88	0	0	0	112.2	L338 K339 L344 S346 L352 H403 S404 L407	L338-Y342 WeakPolarHBondContact O-CB 3.22Å; L338-Y342 PolarHBondContact O-N 3.39Å; K339-Y342 WeakPolarHBondContact O-CB 3.44Å; K339-Y342 PolarHBondContact O-N 3.27Å; Y342-L344 PolarHBondContact O-N 2.78Å; Y342-S346 WeakPolarHBondContact O-CB 3.36Å; Y342-S346 PolarHBondContact O-N 3.08Å; Y342-L352 HydrophobicContact CD2-CD2 3.8Å; Y342-L352 HydrophobicContact CE2-CD1 4.12Å; Y342-L352 HydrophobicContact CE2-CD2 3.65Å; Y342-H403 AromaticContact CD1-CD2 3.93Å; Y342-S404 WeakPolarHBondContact OH-CB 3.49Å; Y342-S404 PolarHBondContact OH-OG 2.85Å; Y342-L407 HydrophobicContact CD2-CD1 3.62Å; Y342-L407 HydrophobicContact CD2-CD2 4.44Å; Y342-L407 HydrophobicContact CD2-CG 3.95Å; Y342-L407 HydrophobicContact CE2-CD1 4.1Å; Y342-L407 HydrophobicContact CE2-CG 4.02Å; Y342-L407 HydrophobicContact CG-CD1 4.31Å
343	E	83.7	Confident	80.6	Confident	86 Å²	86	57 Å²	57	40%	0.402	29%	0.289	S	S	.	.	H	α-helix	trans	-60.6	-45.7	178.7	-72.8	171.1	150.1	0	0	110.9	K339 R340 S346	K339-E343 WeakPolarHBondContact CE-OE1 3.35Å; K339-E343 WeakPolarHBondContact CE-OE2 3.21Å; K339-E343 IonicContact NZ-OE1 3.78Å; K339-E343 PolarHBondContact NZ-OE1 3.33Å; K339-E343 WeakPolarHBondContact O-CG 3.38Å; K339-E343 PolarHBondContact O-N 2.88Å; R340-E343 PolarHBondContact O-N 3.28Å; E343-S346 PolarHBondContact O-N 3.29Å; E343-S346 PolarHBondContact O-OG 2.92Å
344	L	88.6	Confident	80.7	Confident	11 Å²	11	56.3 Å²	56.3	6%	0.058	29%	0.285	C	S	.	.	H	α-helix	trans	-67	-49	178.8	-69.7	173.5	0	0	0	112.4	L280 V283 L287 I315 R340 Y342 S346 M347	L280-L344 HydrophobicContact CB-CD1 3.86Å; L280-L344 HydrophobicContact CD2-CD1 3.62Å; L280-L344 HydrophobicContact CG-CD1 4.26Å; V283-L344 HydrophobicContact CG1-CD1 4.43Å; V283-L344 HydrophobicContact CG1-CD2 4.03Å; L287-L344 HydrophobicContact CD1-CD2 4.24Å; I315-L344 HydrophobicContact CD1-CB 3.91Å; I315-L344 HydrophobicContact CD1-CD2 4.22Å; I315-L344 VanDerWaalsContact CD1-O 3.29Å; I315-L344 WeakPolarHBondContact CD1-O 3.38Å; R340-L344 HydrophobicContact CG-CD1 3.81Å; R340-L344 HydrophobicContact CG-CG 4.39Å; R340-L344 WeakPolarHBondContact O-CB 3.19Å; R340-L344 VanDerWaalsContact O-CG 3.27Å; R340-L344 WeakPolarHBondContact O-CG 3.44Å; R340-L344 PolarHBondContact O-N 3.11Å; Y342-L344 PolarHBondContact O-N 2.78Å; L344-S346 PolarHBondContact O-N 3.17Å; L344-S346 VanDerWaalsContact O-N 3.16Å; L344-M347 HydrophobicContact CD2-CE 3.61Å; L344-M347 PolarHBondContact O-N 2.91Å; L344-M347 VanDerWaalsContact O-N 3.12Å
345	C	86.7	Confident	80.8	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-66.5	-15.6	178.2	-68	0	0	0	0	113.8	M341 M347 V348 L352 L355	M341-C345 VanDerWaalsContact O-CB 3.3Å; M341-C345 WeakPolarHBondContact O-CB 3.26Å; M341-C345 PolarHBondContact O-N 2.98Å; M341-C345 PolarHBondContact O-SG 3.4Å; M341-C345 VanDerWaalsContact O-SG 3.35Å; C345-M347 PolarHBondContact O-N 3.03Å; C345-V348 PolarHBondContact O-N 3.15Å; C345-L352 HydrophobicContact CB-CD2 4.43Å; C345-L355 HydrophobicContact CB-CD1 3.68Å; C345-L355 HydrophobicContact CB-CG 4.49Å
346	S	85.9	Confident	81.1	Confident	58 Å²	58	50.6 Å²	50.6	41%	0.406	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-18.5	173.2	79.2	0	0	0	0	114.1	Y342 E343 L344	Y342-S346 WeakPolarHBondContact O-CB 3.36Å; Y342-S346 PolarHBondContact O-N 3.08Å; E343-S346 PolarHBondContact O-N 3.29Å; E343-S346 PolarHBondContact O-OG 2.92Å; L344-S346 PolarHBondContact O-N 3.17Å; L344-S346 VanDerWaalsContact O-N 3.16Å
347	M	85.4	Confident	81.2	Confident	78 Å²	78	50.7 Å²	50.7	38%	0.384	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.9	-18.4	178.3	-55.9	-174.9	-56.6	0	0	112.7	L287 V311 I315 L344 C345	L287-M347 HydrophobicContact CD1-CE 3.48Å; L287-M347 VanDerWaalsContact CD1-CE 3.48Å; L287-M347 HydrophobicContact CD1-SD 4.4Å; V311-M347 HydrophobicContact CG1-CB 3.96Å; V311-M347 WeakPolarHBondContact CG1-O 3.45Å; V311-M347 HydrophobicContact CG2-CB 4.03Å; V311-M347 HydrophobicContact CG2-CE 4.24Å; I315-M347 HydrophobicContact CD1-CE 3.34Å; L344-M347 HydrophobicContact CD2-CE 3.61Å; L344-M347 PolarHBondContact O-N 2.91Å; L344-M347 VanDerWaalsContact O-N 3.12Å; C345-M347 PolarHBondContact O-N 3.03Å
348	V	83.1	Confident	81	Confident	27 Å²	27	51.1 Å²	51.1	16%	0.164	26%	0.255	C	S	.	.	S	Bend	trans	-90.6	130	178.1	179.6	0	0	0	0	110.2	V311 I315 M319 C345 K350 G351	V311-V348 HydrophobicContact CG1-CG2 3.69Å; I315-V348 HydrophobicContact CB-CG2 3.59Å; I315-V348 HydrophobicContact CG2-CG2 3.5Å; I315-V348 VanDerWaalsContact CG2-CG2 3.5Å; M319-V348 HydrophobicContact CE-CB 3.96Å; M319-V348 HydrophobicContact CE-CG1 3.96Å; M319-V348 HydrophobicContact CE-CG2 4.03Å; C345-V348 PolarHBondContact O-N 3.15Å; V348-K350 PolarHBondContact O-N 3.21Å; V348-K350 VanDerWaalsContact O-N 3.11Å; V348-G351 PolarHBondContact O-N 2.66Å
349	E	68.9	Low	81	Confident	172 Å²	172	50.8 Å²	50.8	80%	0.804	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	118.3	172.6	-161	-172.2	151.8	0	0	110	G351	E349-G351 VanDerWaalsContact C-N 3.34Å; E349-G351 PolarHBondContact O-N 3.41Å
350	K	70.4	Confident	80.9	Confident	153 Å²	153	47.1 Å²	47.1	67%	0.665	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	73.9	-0.2	-172.3	-49.9	168.2	-172.9	167.5	0	117	V348 L352 C353	V348-K350 PolarHBondContact O-N 3.21Å; V348-K350 VanDerWaalsContact O-N 3.11Å; K350-L352 PolarHBondContact O-N 3.46Å; K350-L352 VanDerWaalsContact O-N 3.12Å; K350-C353 VanDerWaalsContact O-CB 3.3Å; K350-C353 WeakPolarHBondContact O-CB 3.35Å; K350-C353 PolarHBondContact O-N 2.75Å
351	G	73.5	Confident	80.7	Confident	1 Å²	1	51.6 Å²	51.6	1%	0.01	26%	0.26	C	S	.	.	H	α-helix	trans	-59.9	-25.8	-179.2	0	0	0	0	0	115.1	V348 E349	V348-G351 PolarHBondContact O-N 2.66Å; E349-G351 VanDerWaalsContact C-N 3.34Å; E349-G351 PolarHBondContact O-N 3.41Å
352	L	80.3	Confident	80.4	Confident	31 Å²	31	52 Å²	52	16%	0.162	26%	0.262	C	S	.	.	H	α-helix	trans	-78	-16.6	174.6	-62	-178.3	0	0	0	114.3	Y342 C345 K350 L355 K356 V406	Y342-L352 HydrophobicContact CD2-CD2 3.8Å; Y342-L352 HydrophobicContact CE2-CD1 4.12Å; Y342-L352 HydrophobicContact CE2-CD2 3.65Å; C345-L352 HydrophobicContact CB-CD2 4.43Å; K350-L352 PolarHBondContact O-N 3.46Å; K350-L352 VanDerWaalsContact O-N 3.12Å; L352-L355 HydrophobicContact CD2-CD1 4.37Å; L352-K356 WeakPolarHBondContact O-CB 3.31Å; L352-K356 PolarHBondContact O-N 2.83Å; L352-V406 HydrophobicContact CB-CG1 4.17Å; L352-V406 HydrophobicContact CD1-CG2 4.09Å
353	C	79.8	Confident	80.3	Confident	71 Å²	71	51 Å²	51	48%	0.48	26%	0.258	S	S	.	.	H	α-helix	trans	-68.4	-44.8	179.1	-64.3	0	0	0	0	111.2	K350 L355 K356 D357	K350-C353 VanDerWaalsContact O-CB 3.3Å; K350-C353 WeakPolarHBondContact O-CB 3.35Å; K350-C353 PolarHBondContact O-N 2.75Å; C353-L355 VanDerWaalsContact C-N 3.34Å; C353-L355 PolarHBondContact O-N 3.37Å; C353-K356 WeakPolarHBondContact O-CB 3.26Å; C353-K356 PolarHBondContact O-N 3.1Å; C353-D357 PolarHBondContact O-N 3.02Å
354	D	75.7	Confident	80.3	Confident	51 Å²	51	49.2 Å²	49.2	27%	0.273	25%	0.252	S	S	.	.	H	α-helix	trans	-62.7	-38.8	177.5	-77.2	-66.9	0	0	0	113	K323 C358	K323-D354 HydrophobicContact CD-CB 4.04Å; K323-D354 WeakPolarHBondContact CE-OD1 3.17Å; K323-D354 IonicContact NZ-OD1 2.88Å; K323-D354 PolarHBondContact NZ-OD1 3.1Å; D354-C358 PolarHBondContact O-N 3.06Å
355	L	80.8	Confident	80	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-70	-35.1	176.8	-59.8	-174.1	0	0	0	112.3	F326 M341 C345 L352 C353 L359	F326-L355 HydrophobicContact CB-CD2 3.99Å; F326-L355 HydrophobicContact CD1-CD2 3.89Å; F326-L355 HydrophobicContact CD2-CD2 3.83Å; F326-L355 HydrophobicContact CE1-CB 4.13Å; F326-L355 HydrophobicContact CE1-CD2 4.25Å; F326-L355 VanDerWaalsContact CE1-O 3.27Å; F326-L355 WeakPolarHBondContact CE1-O 3.39Å; F326-L355 HydrophobicContact CE2-CD2 4.2Å; F326-L355 HydrophobicContact CG-CD2 3.65Å; F326-L355 HydrophobicContact CZ-CB 4.11Å; F326-L355 HydrophobicContact CZ-CD2 4.4Å; M341-L355 HydrophobicContact SD-CD2 4.43Å; C345-L355 HydrophobicContact CB-CD1 3.68Å; C345-L355 HydrophobicContact CB-CG 4.49Å; L352-L355 HydrophobicContact CD2-CD1 4.37Å; C353-L355 VanDerWaalsContact C-N 3.34Å; C353-L355 PolarHBondContact O-N 3.37Å; L355-L359 WeakPolarHBondContact O-CB 3.48Å; L355-L359 PolarHBondContact O-N 2.86Å; L355-L359 VanDerWaalsContact O-N 3.08Å
356	K	79.5	Confident	79.9	Confident	60 Å²	60	54.5 Å²	54.5	26%	0.261	29%	0.286	S	S	.	.	H	α-helix	trans	-60.5	-48.7	176.6	-178.9	-145.9	166.9	-147.3	0	110.8	L352 C353 L359 E360 V406 A410	L352-K356 WeakPolarHBondContact O-CB 3.31Å; L352-K356 PolarHBondContact O-N 2.83Å; C353-K356 WeakPolarHBondContact O-CB 3.26Å; C353-K356 PolarHBondContact O-N 3.1Å; K356-L359 PolarHBondContact O-N 3.08Å; K356-E360 PolarHBondContact O-N 3.49Å; K356-V406 HydrophobicContact CB-CG1 4.15Å; K356-V406 HydrophobicContact CG-CG1 4.32Å; K356-A410 HydrophobicContact CB-CB 4.5Å; K356-A410 HydrophobicContact CG-CB 3.69Å; K356-A410 WeakPolarHBondContact O-CB 3.48Å
357	D	79	Confident	79.7	Confident	78 Å²	78	51.8 Å²	51.8	42%	0.417	27%	0.267	S	S	.	.	H	α-helix	trans	-66.8	-42.8	-176.4	-65.6	-14.3	0	0	0	111.5	C353 L359 E360 E361	C353-D357 PolarHBondContact O-N 3.02Å; D357-L359 VanDerWaalsContact C-N 3.35Å; D357-L359 PolarHBondContact O-N 3.48Å; D357-E360 PolarHBondContact O-N 3.15Å; D357-E361 PolarHBondContact O-N 3.37Å
358	C	79.8	Confident	79.7	Confident	16 Å²	16	51.2 Å²	51.2	11%	0.108	27%	0.265	C	S	.	.	H	α-helix	trans	-61.2	-39.3	173.9	-71.3	0	0	0	0	113	K323 F326 D354 H362	K323-C358 VanDerWaalsContact CE-SG 3.51Å; K323-C358 VanDerWaalsContact CG-SG 3.57Å; F326-C358 HydrophobicContact CD1-CB 3.8Å; F326-C358 HydrophobicContact CE1-CB 4.09Å; D354-C358 PolarHBondContact O-N 3.06Å; C358-H362 WeakPolarHBondContact O-CB 3.42Å; C358-H362 PolarHBondContact O-N 2.83Å; C358-H362 VanDerWaalsContact O-N 3.1Å
359	L	81.1	Confident	79.8	Confident	4 Å²	4	52.4 Å²	52.4	2%	0.021	28%	0.278	C	S	.	.	H	α-helix	trans	-66	-40.6	175.2	179.4	60.5	0	0	0	111.5	F326 L330 L355 K356 D357 H362 V363 L407 A410	F326-L359 HydrophobicContact CE1-CB 4.31Å; L330-L359 HydrophobicContact CD1-CD1 4.29Å; L330-L359 HydrophobicContact CD2-CD1 3.95Å; L355-L359 WeakPolarHBondContact O-CB 3.48Å; L355-L359 PolarHBondContact O-N 2.86Å; L355-L359 VanDerWaalsContact O-N 3.08Å; K356-L359 PolarHBondContact O-N 3.08Å; D357-L359 VanDerWaalsContact C-N 3.35Å; D357-L359 PolarHBondContact O-N 3.48Å; L359-H362 PolarHBondContact O-N 3.11Å; L359-V363 HydrophobicContact CD1-CG2 3.93Å; L359-V363 HydrophobicContact CG-CG2 4.43Å; L359-V363 WeakPolarHBondContact O-CG2 3.5Å; L359-V363 PolarHBondContact O-N 2.62Å; L359-L407 HydrophobicContact CD2-CB 4.01Å; L359-L407 HydrophobicContact CD2-CD2 3.84Å; L359-L407 HydrophobicContact CD2-CG 4.39Å; L359-A410 HydrophobicContact CB-CB 4.21Å; L359-A410 HydrophobicContact CD2-CB 4Å; L359-A410 HydrophobicContact CG-CB 4.17Å
360	E	79.5	Confident	80.6	Confident	22 Å²	22	45.4 Å²	45.4	10%	0.103	25%	0.25	C	C	.	.	H	α-helix	trans	-62.9	-46	179.7	-168.5	172.7	151.1	0	0	112	K356 D357 L364 A410 S413 A414 K417	K356-E360 PolarHBondContact O-N 3.49Å; D357-E360 PolarHBondContact O-N 3.15Å; E360-L364 WeakPolarHBondContact O-CB 3.39Å; E360-L364 PolarHBondContact O-N 3.3Å; E360-L364 VanDerWaalsContact O-N 3.11Å; E360-A410 HydrophobicContact CB-CB 4.42Å; E360-S413 WeakPolarHBondContact OE1-CB 3.28Å; E360-S413 PolarHBondContact OE1-OG 3.25Å; E360-S413 PolarHBondContact OE2-OG 3.17Å; E360-A414 HydrophobicContact CG-CB 4.1Å; E360-A414 WeakPolarHBondContact O-CB 3.47Å; E360-K417 IonicContact OE1-NZ 3.42Å; E360-K417 PolarHBondContact OE1-NZ 3.35Å
361	E	82	Confident	81.1	Confident	141 Å²	141	38.4 Å²	38.4	66%	0.659	22%	0.219	S	C	*	.	H	α-helix	trans	-61.1	-44.6	174	-71	-172.3	165.5	0	0	112.3	D357 V363 L364 A365	D357-E361 PolarHBondContact O-N 3.37Å; E361-V363 PolarHBondContact O-N 2.69Å; E361-L364 PolarHBondContact O-N 2.84Å; E361-A365 WeakPolarHBondContact O-CB 3.5Å; E361-A365 PolarHBondContact O-N 3.15Å
362	H	81.4	Confident	81.5	Confident	9 Å²	9	44.6 Å²	44.6	4%	0.042	25%	0.248	C	C	.	.	H	α-helix	trans	-63.3	-43.1	-178.8	-174.3	101.6	0	0	0	112.6	L330 C358 L359 Q366 R396	L330-H362 HydrophobicContact CD1-CB 4.07Å; C358-H362 WeakPolarHBondContact O-CB 3.42Å; C358-H362 PolarHBondContact O-N 2.83Å; C358-H362 VanDerWaalsContact O-N 3.1Å; L359-H362 PolarHBondContact O-N 3.11Å; H362-Q366 PolarHBondContact NE2-NE2 2.91Å; H362-Q366 WeakPolarHBondContact O-CG 3.41Å; H362-Q366 PolarHBondContact O-N 3.16Å; H362-R396 PolarHBondContact NE2-NH2 3.34Å
363	V	81.3	Confident	81.7	Confident	1 Å²	1	52.3 Å²	52.3	1%	0.006	28%	0.28	C	S	.	.	H	α-helix	trans	-69.4	-39.6	178.5	176.1	0	0	0	0	111.5	L359 E361 Q366 G367 R396 A414 F418	L359-V363 HydrophobicContact CD1-CG2 3.93Å; L359-V363 HydrophobicContact CG-CG2 4.43Å; L359-V363 WeakPolarHBondContact O-CG2 3.5Å; L359-V363 PolarHBondContact O-N 2.62Å; E361-V363 PolarHBondContact O-N 2.69Å; V363-Q366 PolarHBondContact O-N 2.72Å; V363-G367 PolarHBondContact O-N 3.36Å; V363-R396 HydrophobicContact CG2-CG 4.26Å; V363-A414 HydrophobicContact CB-CB 3.51Å; V363-A414 HydrophobicContact CG1-CB 3.53Å; V363-F418 HydrophobicContact CG1-CE1 4.49Å
364	L	83.1	Confident	81.6	Confident	50 Å²	50	50.3 Å²	50.3	26%	0.262	27%	0.269	S	S	.	.	H	α-helix	trans	-60.8	-48.1	176.2	178.2	58	0	0	0	111.6	E360 E361 Q366 G367 L368 A414 K417 F418	E360-L364 WeakPolarHBondContact O-CB 3.39Å; E360-L364 PolarHBondContact O-N 3.3Å; E360-L364 VanDerWaalsContact O-N 3.11Å; E361-L364 PolarHBondContact O-N 2.84Å; L364-Q366 VanDerWaalsContact C-N 3.33Å; L364-Q366 PolarHBondContact O-N 2.94Å; L364-G367 PolarHBondContact O-N 2.79Å; L364-L368 HydrophobicContact CD1-CD1 4.05Å; L364-L368 HydrophobicContact CD1-CG 4.28Å; L364-L368 HydrophobicContact CG-CD1 4.21Å; L364-L368 WeakPolarHBondContact O-CG 3.36Å; L364-L368 PolarHBondContact O-N 2.87Å; L364-L368 VanDerWaalsContact O-N 3.11Å; L364-A414 HydrophobicContact CB-CB 4.49Å; L364-K417 HydrophobicContact CD1-CB 3.8Å; L364-K417 HydrophobicContact CD2-CD 4.39Å; L364-F418 HydrophobicContact CD1-CB 4.03Å
365	A	83.6	Confident	81.7	Confident	60 Å²	60	49.1 Å²	49.1	50%	0.496	27%	0.269	S	S	.	.	H	α-helix	trans	-60	-41.4	178.9	0	0	0	0	0	112.4	E361 A369	E361-A365 WeakPolarHBondContact O-CB 3.5Å; E361-A365 PolarHBondContact O-N 3.15Å; A365-A369 VanDerWaalsContact O-CB 3.31Å; A365-A369 WeakPolarHBondContact O-CB 3.35Å; A365-A369 PolarHBondContact O-N 3.14Å
366	Q	83.2	Confident	81.4	Confident	62 Å²	62	54.5 Å²	54.5	29%	0.29	30%	0.298	S	S	.	.	H	α-helix	trans	-69.7	-38.5	177.5	-71.9	-163.1	-7.8	0	0	113.6	H362 V363 L364 A369 A370 R396	H362-Q366 PolarHBondContact NE2-NE2 2.91Å; H362-Q366 WeakPolarHBondContact O-CG 3.41Å; H362-Q366 PolarHBondContact O-N 3.16Å; V363-Q366 PolarHBondContact O-N 2.72Å; L364-Q366 VanDerWaalsContact C-N 3.33Å; L364-Q366 PolarHBondContact O-N 2.94Å; Q366-A369 PolarHBondContact O-N 3.32Å; Q366-A370 WeakPolarHBondContact O-CB 3.23Å; Q366-A370 PolarHBondContact O-N 3.38Å; Q366-R396 VanDerWaalsContact OE1-NE 3.11Å
367	G	82.7	Confident	81.2	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-62	-45.2	176.5	0	0	0	0	0	112.5	V363 L364 I371	V363-G367 PolarHBondContact O-N 3.36Å; L364-G367 PolarHBondContact O-N 2.79Å; G367-I371 WeakPolarHBondContact O-CG1 3.29Å; G367-I371 PolarHBondContact O-N 3.42Å
368	L	84.8	Confident	81	Confident	67 Å²	67	50.5 Å²	50.5	35%	0.351	29%	0.286	S	S	.	.	H	α-helix	trans	-64.1	-48.2	176.1	-67.7	172.7	0	0	0	112	L364 A370 I371 E372 F418 C421 N422	L364-L368 HydrophobicContact CD1-CD1 4.05Å; L364-L368 HydrophobicContact CD1-CG 4.28Å; L364-L368 HydrophobicContact CG-CD1 4.21Å; L364-L368 WeakPolarHBondContact O-CG 3.36Å; L364-L368 PolarHBondContact O-N 2.87Å; L364-L368 VanDerWaalsContact O-N 3.11Å; L368-A370 VanDerWaalsContact C-N 3.3Å; L368-A370 PolarHBondContact O-N 2.98Å; L368-I371 PolarHBondContact O-N 2.86Å; L368-E372 PolarHBondContact O-N 3.47Å; L368-F418 HydrophobicContact CG-CB 4.5Å; L368-C421 WeakPolarHBondContact CD2-O 3.42Å; L368-N422 HydrophobicContact CD2-CB 4.29Å
369	A	85.4	Confident	80.5	Confident	51 Å²	51	51.2 Å²	51.2	42%	0.421	29%	0.291	S	S	.	.	H	α-helix	trans	-63.3	-32.8	180	0	0	0	0	0	113.1	A365 Q366 K373	A365-A369 VanDerWaalsContact O-CB 3.31Å; A365-A369 WeakPolarHBondContact O-CB 3.35Å; A365-A369 PolarHBondContact O-N 3.14Å; Q366-A369 PolarHBondContact O-N 3.32Å; A369-K373 WeakPolarHBondContact O-CB 3Å; A369-K373 PolarHBondContact O-N 3.32Å
370	A	85.2	Confident	80.1	Confident	26 Å²	26	55.9 Å²	55.9	22%	0.215	32%	0.32	C	S	.	.	H	α-helix	trans	-65.9	-41.2	175.5	0	0	0	0	0	112.3	Q366 L368 A374 T388 V392	Q366-A370 WeakPolarHBondContact O-CB 3.23Å; Q366-A370 PolarHBondContact O-N 3.38Å; L368-A370 VanDerWaalsContact C-N 3.3Å; L368-A370 PolarHBondContact O-N 2.98Å; A370-A374 PolarHBondContact O-N 2.86Å; A370-T388 HydrophobicContact CB-CG2 4.13Å; A370-V392 HydrophobicContact CB-CG2 3.49Å; A370-V392 VanDerWaalsContact CB-CG2 3.49Å
371	I	82.5	Confident	80.4	Confident	5 Å²	5	58 Å²	58	3%	0.026	33%	0.332	C	S	.	.	H	α-helix	trans	-70.3	-43	177.5	-65.7	170.4	0	0	0	110.6	G367 L368 A374 V378 T388 L389 F418 N422 K423	G367-I371 WeakPolarHBondContact O-CG1 3.29Å; G367-I371 PolarHBondContact O-N 3.42Å; L368-I371 PolarHBondContact O-N 2.86Å; I371-A374 PolarHBondContact O-N 3.18Å; I371-V378 HydrophobicContact CG2-CG1 4.22Å; I371-T388 HydrophobicContact CG1-CG2 4.46Å; I371-L389 HydrophobicContact CD1-CD2 3.81Å; I371-L389 HydrophobicContact CG1-CD2 4.34Å; I371-F418 HydrophobicContact CD1-CD2 4.23Å; I371-N422 HydrophobicContact CD1-CB 3.48Å; I371-N422 VanDerWaalsContact CD1-CB 3.48Å; I371-N422 HydrophobicContact CG2-CB 4.2Å; I371-K423 HydrophobicContact CG2-CB 4.42Å
372	E	81.7	Confident	80.6	Confident	132 Å²	132	52.3 Å²	52.3	62%	0.617	31%	0.308	S	S	*	.	H	α-helix	trans	-61.7	-44.9	176.8	-174.9	173.9	-155.6	0	0	112	L368 A374 G375	L368-E372 PolarHBondContact O-N 3.47Å; E372-A374 VanDerWaalsContact C-N 3.26Å; E372-A374 PolarHBondContact O-N 3.21Å; E372-G375 PolarHBondContact O-N 3.48Å; E372-G375 VanDerWaalsContact O-N 3.08Å
373	K	83.2	Confident	80.8	Confident	192 Å²	192	57.6 Å²	57.6	84%	0.835	33%	0.33	S	S	*	.	H	α-helix	trans	-61.8	-30.1	178.7	-177.6	176.9	-179.7	-179.6	0	113.5	A369 G375	A369-K373 WeakPolarHBondContact O-CB 3Å; A369-K373 PolarHBondContact O-N 3.32Å; K373-G375 VanDerWaalsContact C-N 3.27Å
374	A	78.2	Confident	81.1	Confident	30 Å²	30	60.3 Å²	60.3	25%	0.248	35%	0.345	C	S	.	.	H	α-helix	trans	-79.8	-8.3	178.8	0	0	0	0	0	113.2	A370 I371 E372 V378 T388	A370-A374 PolarHBondContact O-N 2.86Å; I371-A374 PolarHBondContact O-N 3.18Å; E372-A374 VanDerWaalsContact C-N 3.26Å; E372-A374 PolarHBondContact O-N 3.21Å; A374-V378 VanDerWaalsContact C-CG2 3.45Å; A374-V378 HydrophobicContact CB-CG2 3.24Å; A374-V378 WeakPolarHBondContact O-CG2 3.45Å; A374-T388 HydrophobicContact CB-CG2 4.47Å
375	G	77.9	Confident	81.4	Confident	26 Å²	26	58.1 Å²	58.1	27%	0.268	33%	0.333	S	S	.	.			trans	74.7	-176	165.9	0	0	0	0	0	115.3	E372 K373 A377 V378	E372-G375 PolarHBondContact O-N 3.48Å; E372-G375 VanDerWaalsContact O-N 3.08Å; K373-G375 VanDerWaalsContact C-N 3.27Å; G375-A377 PolarHBondContact O-N 3.24Å; G375-A377 VanDerWaalsContact O-N 3.1Å; G375-V378 VanDerWaalsContact O-CB 3.22Å; G375-V378 WeakPolarHBondContact O-CB 3.49Å; G375-V378 WeakPolarHBondContact O-CG2 3.38Å; G375-V378 PolarHBondContact O-N 3Å; G375-V378 VanDerWaalsContact O-N 3.09Å
376	D	73.8	Confident	81.5	Confident	113 Å²	113	55.2 Å²	55.2	60%	0.604	31%	0.309	S	S	*	.	G	3₁₀ helix	trans	-67.5	-16.7	-169.7	-56.9	-26.9	0	0	0	114	V378 S379 K423	D376-V378 PolarHBondContact O-N 2.9Å; D376-S379 PolarHBondContact O-N 2.77Å; D376-K423 IonicContact OD1-NZ 2.71Å; D376-K423 PolarHBondContact OD1-NZ 3.42Å
377	A	75.9	Confident	81.7	Confident	52 Å²	52	54.9 Å²	54.9	43%	0.43	31%	0.311	S	S	.	.	G	3₁₀ helix	trans	-58	-34	172.2	0	0	0	0	0	112.3	G375 S379 T380 D381 L384	G375-A377 PolarHBondContact O-N 3.24Å; G375-A377 VanDerWaalsContact O-N 3.1Å; A377-S379 PolarHBondContact O-N 2.88Å; A377-T380 PolarHBondContact O-N 2.92Å; A377-T380 PolarHBondContact O-OG1 3.3Å; A377-D381 PolarHBondContact O-N 2.66Å; A377-L384 HydrophobicContact CB-CD2 3.94Å
378	V	73.8	Confident	82	Confident	2 Å²	2	55.7 Å²	55.7	1%	0.012	32%	0.316	C	S	.	.	G	3₁₀ helix	trans	-55.8	-33.8	179.4	176.1	0	0	0	0	112.6	I371 A374 G375 D376 T380 L384 Y385 A424	I371-V378 HydrophobicContact CG2-CG1 4.22Å; A374-V378 VanDerWaalsContact C-CG2 3.45Å; A374-V378 HydrophobicContact CB-CG2 3.24Å; A374-V378 WeakPolarHBondContact O-CG2 3.45Å; G375-V378 VanDerWaalsContact O-CB 3.22Å; G375-V378 WeakPolarHBondContact O-CB 3.49Å; G375-V378 WeakPolarHBondContact O-CG2 3.38Å; G375-V378 PolarHBondContact O-N 3Å; G375-V378 VanDerWaalsContact O-N 3.09Å; D376-V378 PolarHBondContact O-N 2.9Å; V378-T380 PolarHBondContact O-N 3.11Å; V378-L384 HydrophobicContact CG2-CD2 3.81Å; V378-L384 HydrophobicContact CG2-CG 4.03Å; V378-Y385 HydrophobicContact CG1-CD2 3.55Å; V378-Y385 HydrophobicContact CG1-CE2 4.31Å; V378-Y385 HydrophobicContact CG1-CG 4.47Å; V378-A424 HydrophobicContact CG1-CB 4.49Å
379	S	69.7	Low	82.1	Confident	30 Å²	30	52.5 Å²	52.5	21%	0.21	30%	0.3	C	S	.	.	G	3₁₀ helix	trans	-72.8	-10.4	178.2	-55.9	0	0	0	0	113.4	D376 A377 R433	D376-S379 PolarHBondContact O-N 2.77Å; A377-S379 PolarHBondContact O-N 2.88Å; S379-R433 PolarHBondContact O-NE 2.78Å; S379-R433 PolarHBondContact O-NH2 3.46Å
380	T	73.9	Confident	82.1	Confident	103 Å²	103	50.8 Å²	50.8	63%	0.632	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-125.5	-26.5	-173.4	60.6	0	0	0	0	114.7	A377 V378 P382	A377-T380 PolarHBondContact O-N 2.92Å; A377-T380 PolarHBondContact O-OG1 3.3Å; V378-T380 PolarHBondContact O-N 3.11Å; T380-P382 WeakPolarHBondContact O-CD 3.42Å
381	D	84.4	Confident	82.1	Confident	67 Å²	67	54.5 Å²	54.5	36%	0.358	30%	0.299	S	S	.	.			trans	-101.4	107.1	176.5	-178.9	-0	0	0	0	111.5	A377 K383 L384 Y385	A377-D381 PolarHBondContact O-N 2.66Å; D381-K383 PolarHBondContact O-N 3.04Å; D381-K383 WeakPolarHBondContact OD1-CB 3.45Å; D381-K383 PolarHBondContact OD1-N 2.8Å; D381-L384 HydrophobicContact CB-CB 4.01Å; D381-L384 PolarHBondContact O-N 2.68Å; D381-Y385 PolarHBondContact O-N 2.87Å; D381-Y385 VanDerWaalsContact O-N 3.11Å
382	P	86.1	Confident	82.1	Confident	21 Å²	21	55.1 Å²	55.1	14%	0.136	30%	0.303	C	S	.	.	H	α-helix	trans	-56.5	-33.6	176.2	-26	35.7	0	0	0	114.3	T380 V386 L437 R440	T380-P382 WeakPolarHBondContact O-CD 3.42Å; P382-V386 WeakPolarHBondContact O-CG2 3.35Å; P382-V386 PolarHBondContact O-N 2.74Å; P382-V386 VanDerWaalsContact O-N 3.07Å; P382-L437 WeakPolarHBondContact CB-O 3.19Å; P382-L437 HydrophobicContact CG-CD2 4.08Å; P382-R440 HydrophobicContact CB-CB 4.22Å; P382-R440 HydrophobicContact CG-CB 3.68Å
383	K	87.1	Confident	82.1	Confident	120 Å²	120	51.5 Å²	51.5	52%	0.522	28%	0.284	S	S	.	.	H	α-helix	trans	-72.6	-45	-176.6	179	171.2	-178.3	175.1	0	110.8	D381 Y385 T387 Y441 L444	D381-K383 PolarHBondContact O-N 3.04Å; D381-K383 WeakPolarHBondContact OD1-CB 3.45Å; D381-K383 PolarHBondContact OD1-N 2.8Å; K383-Y385 VanDerWaalsContact C-N 3.33Å; K383-T387 WeakPolarHBondContact O-CB 3.42Å; K383-T387 PolarHBondContact O-N 2.85Å; K383-T387 VanDerWaalsContact O-N 3.08Å; K383-T387 PolarHBondContact O-OG1 3.34Å; K383-Y441 HydrophobicContact CB-CD2 4.15Å; K383-Y441 HydrophobicContact CB-CE2 4.04Å; K383-Y441 HydrophobicContact CG-CE2 4.03Å; K383-L444 HydrophobicContact CB-CD2 4.39Å
384	L	87.7	Confident	81.9	Confident	58 Å²	58	45.8 Å²	45.8	30%	0.304	26%	0.263	S	S	.	.	H	α-helix	trans	-61.8	-43	175.2	-177	61.1	0	0	0	111.1	A377 V378 D381 T388	A377-L384 HydrophobicContact CB-CD2 3.94Å; V378-L384 HydrophobicContact CG2-CD2 3.81Å; V378-L384 HydrophobicContact CG2-CG 4.03Å; D381-L384 HydrophobicContact CB-CB 4.01Å; D381-L384 PolarHBondContact O-N 2.68Å; L384-T388 WeakPolarHBondContact O-CB 3.5Å; L384-T388 PolarHBondContact O-N 2.81Å; L384-T388 VanDerWaalsContact O-N 3.12Å; L384-T388 PolarHBondContact O-OG1 3.41Å
385	Y	87.8	Confident	81.6	Confident	3 Å²	3	49 Å²	49	1%	0.012	27%	0.271	C	S	.	.	H	α-helix	trans	-55.7	-60.9	176.1	-172.5	-98.4	0	0	0	112.1	V378 D381 K383 T387 T388 L389 N422 A424 S434 L437	V378-Y385 HydrophobicContact CG1-CD2 3.55Å; V378-Y385 HydrophobicContact CG1-CE2 4.31Å; V378-Y385 HydrophobicContact CG1-CG 4.47Å; D381-Y385 PolarHBondContact O-N 2.87Å; D381-Y385 VanDerWaalsContact O-N 3.11Å; K383-Y385 VanDerWaalsContact C-N 3.33Å; Y385-T387 PolarHBondContact O-N 3.24Å; Y385-T388 WeakPolarHBondContact O-CB 3.29Å; Y385-T388 PolarHBondContact O-N 2.97Å; Y385-T388 VanDerWaalsContact O-N 3.15Å; Y385-L389 HydrophobicContact CD1-CD1 4.07Å; Y385-L389 HydrophobicContact CE1-CD1 3.44Å; Y385-L389 VanDerWaalsContact CE1-CD1 3.44Å; Y385-L389 HydrophobicContact CE1-CG 4.26Å; Y385-L389 PolarHBondContact O-N 3.49Å; Y385-N422 PolarHBondContact OH-ND2 3.2Å; Y385-N422 VanDerWaalsContact OH-ND2 3.13Å; Y385-A424 HydrophobicContact CD2-CB 4.27Å; Y385-A424 HydrophobicContact CE2-CB 3.88Å; Y385-S434 VanDerWaalsContact OH-CB 3.31Å; Y385-S434 WeakPolarHBondContact OH-CB 3.38Å; Y385-S434 PolarHBondContact OH-OG 2.84Å; Y385-L437 HydrophobicContact CD1-CB 3.99Å; Y385-L437 HydrophobicContact CD1-CD1 4.09Å; Y385-L437 HydrophobicContact CD2-CD1 3.73Å; Y385-L437 HydrophobicContact CE1-CB 4.5Å; Y385-L437 HydrophobicContact CE1-CD1 4.48Å; Y385-L437 HydrophobicContact CE2-CD1 4.22Å; Y385-L437 HydrophobicContact CG-CB 4.33Å; Y385-L437 HydrophobicContact CG-CD1 3.72Å
386	V	87.5	Confident	81.1	Confident	0 Å²	0	48 Å²	48	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-62	-43.9	-175.2	169.8	0	0	0	0	112.1	P382 T388 L389 L390 L438 Y441 I468	P382-V386 WeakPolarHBondContact O-CG2 3.35Å; P382-V386 PolarHBondContact O-N 2.74Å; P382-V386 VanDerWaalsContact O-N 3.07Å; V386-T388 VanDerWaalsContact C-N 3.25Å; V386-T388 PolarHBondContact O-N 3.45Å; V386-L389 PolarHBondContact O-N 2.84Å; V386-L390 HydrophobicContact CG1-CD1 4.01Å; V386-L390 HydrophobicContact CG1-CG 4.44Å; V386-L390 WeakPolarHBondContact O-CG 3.4Å; V386-L390 PolarHBondContact O-N 3.32Å; V386-L438 HydrophobicContact CG1-CD1 4.47Å; V386-L438 HydrophobicContact CG2-CD1 3.63Å; V386-Y441 HydrophobicContact CB-CD1 4.01Å; V386-Y441 HydrophobicContact CB-CD2 4.46Å; V386-Y441 HydrophobicContact CB-CE1 4.17Å; V386-Y441 HydrophobicContact CB-CG 4.15Å; V386-Y441 HydrophobicContact CG1-CD1 3.75Å; V386-Y441 HydrophobicContact CG1-CE1 3.59Å; V386-Y441 HydrophobicContact CG1-CG 4.39Å; V386-Y441 HydrophobicContact CG2-CD1 3.84Å; V386-Y441 HydrophobicContact CG2-CE1 4.49Å; V386-Y441 HydrophobicContact CG2-CG 3.84Å; V386-I468 HydrophobicContact CB-CD1 4.47Å; V386-I468 HydrophobicContact CG1-CD1 3.8Å
387	T	87.5	Confident	80.5	Confident	54 Å²	54	43.9 Å²	43.9	33%	0.331	24%	0.239	S	C	.	.	H	α-helix	trans	-61.8	-35.2	178.6	-48.5	0	0	0	0	111.7	K383 Y385 N391	K383-T387 WeakPolarHBondContact O-CB 3.42Å; K383-T387 PolarHBondContact O-N 2.85Å; K383-T387 VanDerWaalsContact O-N 3.08Å; K383-T387 PolarHBondContact O-OG1 3.34Å; Y385-T387 PolarHBondContact O-N 3.24Å; T387-N391 VanDerWaalsContact O-CG 3.23Å; T387-N391 PolarHBondContact O-N 3.41Å; T387-N391 VanDerWaalsContact O-N 3.11Å; T387-N391 PolarHBondContact O-ND2 2.89Å
388	T	87.9	Confident	79.7	Confident	17 Å²	17	47.3 Å²	47.3	10%	0.104	25%	0.249	C	C	.	.	H	α-helix	trans	-67.7	-42.1	178.5	-57.5	0	0	0	0	111.6	A370 I371 A374 L384 Y385 V386 N391 V392	A370-T388 HydrophobicContact CB-CG2 4.13Å; I371-T388 HydrophobicContact CG1-CG2 4.46Å; A374-T388 HydrophobicContact CB-CG2 4.47Å; L384-T388 WeakPolarHBondContact O-CB 3.5Å; L384-T388 PolarHBondContact O-N 2.81Å; L384-T388 VanDerWaalsContact O-N 3.12Å; L384-T388 PolarHBondContact O-OG1 3.41Å; Y385-T388 WeakPolarHBondContact O-CB 3.29Å; Y385-T388 PolarHBondContact O-N 2.97Å; Y385-T388 VanDerWaalsContact O-N 3.15Å; V386-T388 VanDerWaalsContact C-N 3.25Å; V386-T388 PolarHBondContact O-N 3.45Å; T388-N391 PolarHBondContact O-N 3.11Å; T388-V392 PolarHBondContact O-N 2.77Å
389	L	86.8	Confident	79.1	Confident	1 Å²	1	48.3 Å²	48.3	1%	0.005	26%	0.255	C	S	.	.	H	α-helix	trans	-63.7	-45.5	175.7	-60.8	-177.1	0	0	0	112.3	I371 Y385 V386 N391 V392 Y393 F418 M419 I468	I371-L389 HydrophobicContact CD1-CD2 3.81Å; I371-L389 HydrophobicContact CG1-CD2 4.34Å; Y385-L389 HydrophobicContact CD1-CD1 4.07Å; Y385-L389 HydrophobicContact CE1-CD1 3.44Å; Y385-L389 VanDerWaalsContact CE1-CD1 3.44Å; Y385-L389 HydrophobicContact CE1-CG 4.26Å; Y385-L389 PolarHBondContact O-N 3.49Å; V386-L389 PolarHBondContact O-N 2.84Å; L389-N391 VanDerWaalsContact C-N 3.33Å; L389-N391 PolarHBondContact O-N 3.5Å; L389-V392 PolarHBondContact O-N 3.46Å; L389-Y393 PolarHBondContact O-N 3.2Å; L389-Y393 VanDerWaalsContact O-N 3.08Å; L389-F418 HydrophobicContact CD2-CD2 4.15Å; L389-F418 HydrophobicContact CD2-CE2 3.71Å; L389-M419 HydrophobicContact CD1-CG 4.43Å; L389-M419 HydrophobicContact CD2-CG 4.3Å; L389-I468 HydrophobicContact CB-CD1 3.87Å; L389-I468 HydrophobicContact CB-CG1 4.33Å; L389-I468 HydrophobicContact CD1-CD1 4.09Å; L389-I468 HydrophobicContact CD1-CG1 4.49Å; L389-I468 HydrophobicContact CD1-CG2 3.98Å
390	L	85.8	Confident	78.8	Confident	15 Å²	15	47.6 Å²	47.6	8%	0.079	25%	0.249	C	C	.	.	H	α-helix	trans	-61.7	-38.9	178.5	-68.4	172.7	0	0	0	112.3	V386 V392 Y393 N394 D464 I468	V386-L390 HydrophobicContact CG1-CD1 4.01Å; V386-L390 HydrophobicContact CG1-CG 4.44Å; V386-L390 WeakPolarHBondContact O-CG 3.4Å; V386-L390 PolarHBondContact O-N 3.32Å; L390-V392 PolarHBondContact O-N 3.47Å; L390-Y393 PolarHBondContact O-N 3.46Å; L390-N394 VanDerWaalsContact O-CB 3.31Å; L390-N394 WeakPolarHBondContact O-CB 3.48Å; L390-N394 PolarHBondContact O-N 3.13Å; L390-N394 PolarHBondContact O-ND2 3.08Å; L390-D464 HydrophobicContact CD1-CB 3.87Å; L390-D464 HydrophobicContact CD2-CB 4Å; L390-I468 HydrophobicContact CD2-CD1 3.96Å; L390-I468 HydrophobicContact CD2-CG1 4.12Å; L390-I468 HydrophobicContact CG-CD1 3.98Å
391	N	85.1	Confident	77.8	Confident	104 Å²	104	50.7 Å²	50.7	56%	0.556	25%	0.254	S	S	*	.	H	α-helix	trans	-62.6	-39.8	177.7	-75.8	-26.8	0	0	0	112.7	T387 T388 L389 K395	T387-N391 VanDerWaalsContact O-CG 3.23Å; T387-N391 PolarHBondContact O-N 3.41Å; T387-N391 VanDerWaalsContact O-N 3.11Å; T387-N391 PolarHBondContact O-ND2 2.89Å; T388-N391 PolarHBondContact O-N 3.11Å; L389-N391 VanDerWaalsContact C-N 3.33Å; L389-N391 PolarHBondContact O-N 3.5Å; N391-K395 WeakPolarHBondContact O-CB 3.35Å; N391-K395 PolarHBondContact O-N 3.46Å; N391-K395 VanDerWaalsContact O-N 3.12Å
392	V	82.3	Confident	76.1	Confident	17 Å²	17	50.8 Å²	50.8	10%	0.103	27%	0.271	C	S	.	.	H	α-helix	trans	-66.4	-46.8	175.4	177.9	0	0	0	0	110.6	A370 T388 L389 L390 R396 F418	A370-V392 HydrophobicContact CB-CG2 3.49Å; A370-V392 VanDerWaalsContact CB-CG2 3.49Å; T388-V392 PolarHBondContact O-N 2.77Å; L389-V392 PolarHBondContact O-N 3.46Å; L390-V392 PolarHBondContact O-N 3.47Å; V392-R396 PolarHBondContact O-N 3.28Å; V392-F418 HydrophobicContact CB-CE2 4.41Å; V392-F418 HydrophobicContact CB-CZ 3.94Å; V392-F418 HydrophobicContact CG1-CE1 3.84Å; V392-F418 HydrophobicContact CG1-CE2 4.25Å; V392-F418 HydrophobicContact CG1-CZ 3.51Å
393	Y	81.3	Confident	74.5	Confident	57 Å²	57	51.7 Å²	51.7	22%	0.224	27%	0.273	C	S	.	.	H	α-helix	trans	-59.1	-50.2	178.1	-179.9	-94.8	0	0	0	112	L389 L390 K395 R396 S397 I467 Y471	L389-Y393 PolarHBondContact O-N 3.2Å; L389-Y393 VanDerWaalsContact O-N 3.08Å; L390-Y393 PolarHBondContact O-N 3.46Å; Y393-K395 PolarHBondContact O-N 3.2Å; Y393-R396 PolarHBondContact O-N 2.9Å; Y393-R396 VanDerWaalsContact O-N 3.15Å; Y393-S397 PolarHBondContact O-N 3.33Å; Y393-I467 HydrophobicContact CD1-CG2 3.98Å; Y393-I467 HydrophobicContact CD2-CG2 4.16Å; Y393-I467 HydrophobicContact CE1-CD1 4.13Å; Y393-I467 HydrophobicContact CE1-CG2 3.67Å; Y393-I467 HydrophobicContact CE2-CG2 3.86Å; Y393-I467 HydrophobicContact CG-CG2 4.22Å; Y393-Y471 HydrophobicContact CD2-CE2 4.2Å; Y393-Y471 AromaticContact CE2-CE2 3.84Å; Y393-Y471 HydrophobicContact CE2-CE2 3.84Å
394	N	78.6	Confident	72.8	Confident	72 Å²	72	48.7 Å²	48.7	39%	0.385	27%	0.267	S	S	.	.	H	α-helix	trans	-65	-40.5	-177.7	-75.3	-24.9	0	0	0	112.5	L390 R396	L390-N394 VanDerWaalsContact O-CB 3.31Å; L390-N394 WeakPolarHBondContact O-CB 3.48Å; L390-N394 PolarHBondContact O-N 3.13Å; L390-N394 PolarHBondContact O-ND2 3.08Å; N394-R396 VanDerWaalsContact C-N 3.26Å; N394-R396 PolarHBondContact O-N 3.3Å
395	K	72.9	Confident	70.8	Confident	97 Å²	97	53.7 Å²	53.7	42%	0.422	29%	0.287	S	S	.	.	H	α-helix	trans	-60.4	-38.2	174.7	-170.1	-179.2	179.8	-169.4	0	111.4	D333 N391 Y393	D333-K395 IonicContact OD1-NZ 2.67Å; D333-K395 VanDerWaalsContact OD2-CE 3.27Å; D333-K395 WeakPolarHBondContact OD2-CE 3.47Å; D333-K395 IonicContact OD2-NZ 2.7Å; D333-K395 PolarHBondContact OD2-NZ 3.12Å; N391-K395 WeakPolarHBondContact O-CB 3.35Å; N391-K395 PolarHBondContact O-N 3.46Å; N391-K395 VanDerWaalsContact O-N 3.12Å; Y393-K395 PolarHBondContact O-N 3.2Å
396	R	67.4	Low	69.3	Low	6 Å²	6	55.4 Å²	55.4	2%	0.023	30%	0.298	C	S	.	.	H	α-helix	trans	-83.9	-30.5	-176.3	-69.8	-70.4	159.1	-155.4	-11	114.2	D333 H362 V363 Q366 V392 Y393 N394 I398 V399 V400	D333-R396 IonicContact OD1-NH2 3.67Å; H362-R396 PolarHBondContact NE2-NH2 3.34Å; V363-R396 HydrophobicContact CG2-CG 4.26Å; Q366-R396 VanDerWaalsContact OE1-NE 3.11Å; V392-R396 PolarHBondContact O-N 3.28Å; Y393-R396 PolarHBondContact O-N 2.9Å; Y393-R396 VanDerWaalsContact O-N 3.15Å; N394-R396 VanDerWaalsContact C-N 3.26Å; N394-R396 PolarHBondContact O-N 3.3Å; R396-I398 PolarHBondContact O-N 3.49Å; R396-I398 VanDerWaalsContact O-N 3.16Å; R396-V399 PolarHBondContact O-N 2.93Å; R396-V400 PolarHBondContact O-N 3.24Å
397	S	62.1	Low	67.9	Low	26 Å²	26	56.1 Å²	56.1	18%	0.182	30%	0.301	C	S	.	.	H	α-helix	trans	-53.8	-34.5	172.1	-169	0	0	0	0	112.4	Y393 V399 V400 K401	Y393-S397 PolarHBondContact O-N 3.33Å; S397-V399 PolarHBondContact O-N 3.19Å; S397-V400 PolarHBondContact O-N 3.06Å; S397-K401 VanDerWaalsContact O-CB 3.3Å; S397-K401 WeakPolarHBondContact O-CB 3.4Å; S397-K401 VanDerWaalsContact O-CG 3.25Å; S397-K401 WeakPolarHBondContact O-CG 3.12Å; S397-K401 PolarHBondContact O-N 3.29Å; S397-K401 WeakPolarHBondContact OG-CE 3.38Å
398	I	58.3	Low	66.5	Low	124 Å²	124	57.2 Å²	57.2	64%	0.636	31%	0.305	S	S	*	.	H	α-helix	trans	-65.7	-35	178.1	-63.6	167	0	0	0	112.6	R396	R396-I398 PolarHBondContact O-N 3.49Å; R396-I398 VanDerWaalsContact O-N 3.16Å
399	V	61.5	Low	64.9	Low	22 Å²	22	59.3 Å²	59.3	13%	0.133	32%	0.317	C	S	.	.	H	α-helix	trans	-76.3	-31.3	179.6	-176.6	0	0	0	0	111.4	L338 R396 S397 H403	L338-V399 HydrophobicContact CD1-CG1 4.39Å; R396-V399 PolarHBondContact O-N 2.93Å; S397-V399 PolarHBondContact O-N 3.19Å; V399-H403 PolarHBondContact O-ND1 2.77Å
400	V	61.9	Low	63.6	Low	15 Å²	15	59.2 Å²	59.2	9%	0.091	32%	0.317	C	S	.	.	H	α-helix	trans	-89.2	-27.6	-176.4	-174.5	0	0	0	0	112.4	R396 S397 G402 H403 N408	R396-V400 PolarHBondContact O-N 3.24Å; S397-V400 PolarHBondContact O-N 3.06Å; V400-G402 VanDerWaalsContact C-N 3.32Å; V400-G402 PolarHBondContact O-N 3.17Å; V400-H403 PolarHBondContact O-N 2.99Å; V400-N408 HydrophobicContact CG1-CB 4.38Å; V400-N408 WeakPolarHBondContact CG1-OD1 3.49Å
401	K	53.3	Low	62.5	Low	169 Å²	169	59.2 Å²	59.2	74%	0.735	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	85.2	173.7	-82.4	177.6	177.5	178.6	0	111.7	S397	S397-K401 VanDerWaalsContact O-CB 3.3Å; S397-K401 WeakPolarHBondContact O-CB 3.4Å; S397-K401 VanDerWaalsContact O-CG 3.25Å; S397-K401 WeakPolarHBondContact O-CG 3.12Å; S397-K401 PolarHBondContact O-N 3.29Å; S397-K401 WeakPolarHBondContact OG-CE 3.38Å
402	G	49.6	Very low	61.6	Low	68 Å²	68	59.6 Å²	59.6	70%	0.701	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	151.3	-7.2	177.7	0	0	0	0	0	115.1	V400	V400-G402 VanDerWaalsContact C-N 3.32Å; V400-G402 PolarHBondContact O-N 3.17Å
403	H	52.6	Low	61	Low	41 Å²	41	60.4 Å²	60.4	19%	0.19	32%	0.321	C	S	.	.	S	Bend	trans	-128.8	160.1	-172	-54.1	100.3	0	0	0	112.3	K339 Y342 V399 V400 L407 N408	K339-H403 WeakPolarHBondContact CB-NE2 3.14Å; Y342-H403 AromaticContact CD1-CD2 3.93Å; V399-H403 PolarHBondContact O-ND1 2.77Å; V400-H403 PolarHBondContact O-N 2.99Å; H403-L407 HydrophobicContact CB-CD1 3.86Å; H403-N408 PolarHBondContact O-ND2 2.58Å
404	S	51.7	Low	60.6	Low	56 Å²	56	57.7 Å²	57.7	39%	0.392	31%	0.311	S	S	.	.			trans	-72.3	177.7	-166.5	98.9	0	0	0	0	115.1	Y342 V406 L407 N408	Y342-S404 WeakPolarHBondContact OH-CB 3.49Å; Y342-S404 PolarHBondContact OH-OG 2.85Å; S404-V406 PolarHBondContact O-N 3.48Å; S404-L407 PolarHBondContact O-N 2.8Å; S404-N408 PolarHBondContact O-ND2 3.45Å
405	F	46	Very low	60.6	Low	163 Å²	163	54.3 Å²	54.3	72%	0.715	29%	0.293	S	S	*	.	H	α-helix	trans	-38.3	-41.6	178.8	-173.1	-104	0	0	0	115.1	L407 N408 V409	F405-L407 PolarHBondContact O-N 2.73Å; F405-N408 WeakPolarHBondContact O-CB 3.15Å; F405-N408 PolarHBondContact O-N 3.43Å; F405-V409 HydrophobicContact CD1-CG2 4.25Å; F405-V409 HydrophobicContact CE1-CG2 3.97Å; F405-V409 HydrophobicContact CZ-CG2 4.18Å; F405-V409 PolarHBondContact O-N 2.92Å; F405-V409 VanDerWaalsContact O-N 3.14Å
406	V	54.9	Low	60.9	Low	40 Å²	40	51 Å²	51	24%	0.242	28%	0.282	C	S	.	.	H	α-helix	trans	-62.1	-43.6	-173.2	-173.9	0	0	0	0	113.2	L352 K356 S404 N408 V409 A410	L352-V406 HydrophobicContact CB-CG1 4.17Å; L352-V406 HydrophobicContact CD1-CG2 4.09Å; K356-V406 HydrophobicContact CB-CG1 4.15Å; K356-V406 HydrophobicContact CG-CG1 4.32Å; S404-V406 PolarHBondContact O-N 3.48Å; V406-N408 VanDerWaalsContact C-N 3.33Å; V406-V409 PolarHBondContact O-N 3.31Å; V406-A410 PolarHBondContact O-N 3.24Å
407	L	57.7	Low	61.5	Low	14 Å²	14	55.2 Å²	55.2	7%	0.073	30%	0.3	C	S	.	.	H	α-helix	trans	-74.5	-25.7	179.2	-62.2	-175.1	0	0	0	112.4	Y342 L359 H403 S404 F405 S411	Y342-L407 HydrophobicContact CD2-CD1 3.62Å; Y342-L407 HydrophobicContact CD2-CD2 4.44Å; Y342-L407 HydrophobicContact CD2-CG 3.95Å; Y342-L407 HydrophobicContact CE2-CD1 4.1Å; Y342-L407 HydrophobicContact CE2-CG 4.02Å; Y342-L407 HydrophobicContact CG-CD1 4.31Å; L359-L407 HydrophobicContact CD2-CB 4.01Å; L359-L407 HydrophobicContact CD2-CD2 3.84Å; L359-L407 HydrophobicContact CD2-CG 4.39Å; H403-L407 HydrophobicContact CB-CD1 3.86Å; S404-L407 PolarHBondContact O-N 2.8Å; F405-L407 PolarHBondContact O-N 2.73Å; L407-S411 PolarHBondContact O-N 3.22Å; L407-S411 VanDerWaalsContact O-N 3.13Å
408	N	58.4	Low	62.4	Low	77 Å²	77	54 Å²	54	41%	0.412	29%	0.292	S	S	.	.	H	α-helix	trans	-65.4	-40.1	172.3	-71.8	-85.8	0	0	0	111.1	V400 H403 S404 F405 V406 S411 F412	V400-N408 HydrophobicContact CG1-CB 4.38Å; V400-N408 WeakPolarHBondContact CG1-OD1 3.49Å; H403-N408 PolarHBondContact O-ND2 2.58Å; S404-N408 PolarHBondContact O-ND2 3.45Å; F405-N408 WeakPolarHBondContact O-CB 3.15Å; F405-N408 PolarHBondContact O-N 3.43Å; V406-N408 VanDerWaalsContact C-N 3.33Å; N408-S411 PolarHBondContact O-N 3.28Å; N408-F412 WeakPolarHBondContact O-CB 3.32Å; N408-F412 PolarHBondContact O-N 3.49Å
409	V	55.9	Low	63.5	Low	61 Å²	61	48.1 Å²	48.1	37%	0.37	26%	0.262	S	S	.	.	H	α-helix	trans	-64.4	-44	176.8	175.4	0	0	0	0	111.8	F405 V406 F412 S413	F405-V409 HydrophobicContact CD1-CG2 4.25Å; F405-V409 HydrophobicContact CE1-CG2 3.97Å; F405-V409 HydrophobicContact CZ-CG2 4.18Å; F405-V409 PolarHBondContact O-N 2.92Å; F405-V409 VanDerWaalsContact O-N 3.14Å; V406-V409 PolarHBondContact O-N 3.31Å; V409-F412 PolarHBondContact O-N 3.24Å; V409-S413 PolarHBondContact O-N 3.35Å
410	A	58.5	Low	64.2	Low	0 Å²	0	47.1 Å²	47.1	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-58.1	-49	175.1	0	0	0	0	0	112	K356 L359 E360 V406 F412 S413 A414	K356-A410 HydrophobicContact CB-CB 4.5Å; K356-A410 HydrophobicContact CG-CB 3.69Å; K356-A410 WeakPolarHBondContact O-CB 3.48Å; L359-A410 HydrophobicContact CB-CB 4.21Å; L359-A410 HydrophobicContact CD2-CB 4Å; L359-A410 HydrophobicContact CG-CB 4.17Å; E360-A410 HydrophobicContact CB-CB 4.42Å; V406-A410 PolarHBondContact O-N 3.24Å; A410-F412 VanDerWaalsContact C-N 3.31Å; A410-F412 PolarHBondContact O-N 3.34Å; A410-S413 PolarHBondContact O-N 2.86Å; A410-A414 PolarHBondContact O-N 2.77Å; A410-A414 VanDerWaalsContact O-N 3.11Å
411	S	63.7	Low	64.9	Low	14 Å²	14	49.6 Å²	49.6	10%	0.098	27%	0.273	C	S	.	.	H	α-helix	trans	-64.5	-35.8	178.8	-168.4	0	0	0	0	112.2	L407 N408 C415	L407-S411 PolarHBondContact O-N 3.22Å; L407-S411 VanDerWaalsContact O-N 3.13Å; N408-S411 PolarHBondContact O-N 3.28Å; S411-C415 VanDerWaalsContact O-CB 3.3Å; S411-C415 WeakPolarHBondContact O-CB 3.26Å; S411-C415 PolarHBondContact O-N 2.69Å; S411-C415 PolarHBondContact O-SG 2.85Å
412	F	64.1	Low	66	Low	112 Å²	112	41.6 Å²	41.6	49%	0.491	24%	0.238	S	C	.	.	H	α-helix	trans	-65.8	-48.1	177.2	-174.1	-84.2	0	0	0	111.8	N408 V409 A410 A414 C415 S416 Y471	N408-F412 WeakPolarHBondContact O-CB 3.32Å; N408-F412 PolarHBondContact O-N 3.49Å; V409-F412 PolarHBondContact O-N 3.24Å; A410-F412 VanDerWaalsContact C-N 3.31Å; A410-F412 PolarHBondContact O-N 3.34Å; F412-A414 PolarHBondContact O-N 3.45Å; F412-C415 PolarHBondContact O-N 3.11Å; F412-S416 PolarHBondContact O-N 3.14Å; F412-Y471 HydrophobicContact CD2-CD1 4.31Å; F412-Y471 AromaticContact CD2-CE1 3.41Å; F412-Y471 HydrophobicContact CD2-CE1 3.41Å; F412-Y471 VanDerWaalsContact CD2-CE1 3.41Å; F412-Y471 HydrophobicContact CE2-CD1 4.09Å; F412-Y471 AromaticContact CE2-CE1 3.55Å; F412-Y471 HydrophobicContact CE2-CE1 3.55Å; F412-Y471 AromaticContact CG-CE1 3.97Å; F412-Y471 HydrophobicContact CG-CE1 3.97Å; F412-Y471 HydrophobicContact CZ-CD1 4.37Å; F412-Y471 HydrophobicContact CZ-CE1 4.23Å
413	S	70.1	Confident	67.1	Low	34 Å²	34	42.7 Å²	42.7	24%	0.238	22%	0.223	C	C	.	.	H	α-helix	trans	-58.3	-49.1	177.8	-177.2	0	0	0	0	111.6	E360 V409 A410 C415 S416 K417	E360-S413 WeakPolarHBondContact OE1-CB 3.28Å; E360-S413 PolarHBondContact OE1-OG 3.25Å; E360-S413 PolarHBondContact OE2-OG 3.17Å; V409-S413 PolarHBondContact O-N 3.35Å; A410-S413 PolarHBondContact O-N 2.86Å; S413-C415 PolarHBondContact O-N 2.92Å; S413-S416 PolarHBondContact O-N 2.92Å; S413-K417 WeakPolarHBondContact O-CG 3.44Å; S413-K417 PolarHBondContact O-N 2.9Å
414	A	74	Confident	67.8	Low	0 Å²	0	40.8 Å²	40.8	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-63.2	-42.9	178.9	0	0	0	0	0	112.9	E360 V363 L364 A410 F412 K417 F418	E360-A414 HydrophobicContact CG-CB 4.1Å; E360-A414 WeakPolarHBondContact O-CB 3.47Å; V363-A414 HydrophobicContact CB-CB 3.51Å; V363-A414 HydrophobicContact CG1-CB 3.53Å; L364-A414 HydrophobicContact CB-CB 4.49Å; A410-A414 PolarHBondContact O-N 2.77Å; A410-A414 VanDerWaalsContact O-N 3.11Å; F412-A414 PolarHBondContact O-N 3.45Å; A414-K417 PolarHBondContact O-N 3.27Å; A414-F418 VanDerWaalsContact O-CD1 3.26Å; A414-F418 WeakPolarHBondContact O-CD1 3.15Å; A414-F418 PolarHBondContact O-N 3.41Å; A414-F418 VanDerWaalsContact O-N 3.13Å
415	C	78.2	Confident	68.7	Low	2 Å²	2	38.6 Å²	38.6	1%	0.014	20%	0.199	C	C	.	.	H	α-helix	trans	-59.7	-45.5	175	-78.7	0	0	0	0	112.2	S411 F412 S413 K417 F418 M419 Y471	S411-C415 VanDerWaalsContact O-CB 3.3Å; S411-C415 WeakPolarHBondContact O-CB 3.26Å; S411-C415 PolarHBondContact O-N 2.69Å; S411-C415 PolarHBondContact O-SG 2.85Å; F412-C415 PolarHBondContact O-N 3.11Å; S413-C415 PolarHBondContact O-N 2.92Å; C415-K417 VanDerWaalsContact C-N 3.34Å; C415-K417 PolarHBondContact O-N 3.17Å; C415-F418 HydrophobicContact CB-CE1 4.3Å; C415-M419 HydrophobicContact CB-CE 4.27Å; C415-M419 WeakPolarHBondContact O-CB 3.49Å; C415-M419 VanDerWaalsContact O-CG 3.23Å; C415-M419 WeakPolarHBondContact O-CG 3.3Å; C415-M419 PolarHBondContact O-N 3.36Å; C415-Y471 HydrophobicContact CB-CD1 3.87Å; C415-Y471 HydrophobicContact CB-CE1 3.65Å; C415-Y471 HydrophobicContact CB-CG 4.42Å
416	S	78.9	Confident	69.3	Low	26 Å²	26	37.9 Å²	37.9	18%	0.182	20%	0.198	C	C	.	.	H	α-helix	trans	-59.3	-45.5	175.4	-158.2	0	0	0	0	111.4	F412 S413 N420	F412-S416 PolarHBondContact O-N 3.14Å; S413-S416 PolarHBondContact O-N 2.92Å; S416-N420 PolarHBondContact O-N 3.3Å; S416-N420 PolarHBondContact O-ND2 2.85Å
417	K	79.9	Confident	69.3	Low	95 Å²	95	39.6 Å²	39.6	41%	0.413	22%	0.224	S	C	.	.	H	α-helix	trans	-60.3	-50.4	-178.5	-74.5	172.7	179.1	178	0	112.9	E360 L364 S413 A414 C415 C421	E360-K417 IonicContact OE1-NZ 3.42Å; E360-K417 PolarHBondContact OE1-NZ 3.35Å; L364-K417 HydrophobicContact CD1-CB 3.8Å; L364-K417 HydrophobicContact CD2-CD 4.39Å; S413-K417 WeakPolarHBondContact O-CG 3.44Å; S413-K417 PolarHBondContact O-N 2.9Å; A414-K417 PolarHBondContact O-N 3.27Å; C415-K417 VanDerWaalsContact C-N 3.34Å; C415-K417 PolarHBondContact O-N 3.17Å; K417-C421 WeakPolarHBondContact O-CB 3.41Å; K417-C421 PolarHBondContact O-N 3.14Å
418	F	81.6	Confident	69.3	Low	0 Å²	0	43.4 Å²	43.4	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-77.3	-25.8	-176.5	84.1	-105.7	0	0	0	114.1	V363 L364 L368 I371 L389 V392 A414 C415 N422	V363-F418 HydrophobicContact CG1-CE1 4.49Å; L364-F418 HydrophobicContact CD1-CB 4.03Å; L368-F418 HydrophobicContact CG-CB 4.5Å; I371-F418 HydrophobicContact CD1-CD2 4.23Å; L389-F418 HydrophobicContact CD2-CD2 4.15Å; L389-F418 HydrophobicContact CD2-CE2 3.71Å; V392-F418 HydrophobicContact CB-CE2 4.41Å; V392-F418 HydrophobicContact CB-CZ 3.94Å; V392-F418 HydrophobicContact CG1-CE1 3.84Å; V392-F418 HydrophobicContact CG1-CE2 4.25Å; V392-F418 HydrophobicContact CG1-CZ 3.51Å; A414-F418 VanDerWaalsContact O-CD1 3.26Å; A414-F418 WeakPolarHBondContact O-CD1 3.15Å; A414-F418 PolarHBondContact O-N 3.41Å; A414-F418 VanDerWaalsContact O-N 3.13Å; C415-F418 HydrophobicContact CB-CE1 4.3Å; F418-N422 PolarHBondContact O-ND2 3.41Å
419	M	81.4	Confident	69.1	Low	2 Å²	2	50.4 Å²	50.4	1%	0.01	27%	0.267	C	S	.	.	H	α-helix	trans	-73.6	-34.3	177.8	-69.3	-174.2	-166.1	0	0	112.5	L389 C415 N422 S434 I468 Y471	L389-M419 HydrophobicContact CD1-CG 4.43Å; L389-M419 HydrophobicContact CD2-CG 4.3Å; C415-M419 HydrophobicContact CB-CE 4.27Å; C415-M419 WeakPolarHBondContact O-CB 3.49Å; C415-M419 VanDerWaalsContact O-CG 3.23Å; C415-M419 WeakPolarHBondContact O-CG 3.3Å; C415-M419 PolarHBondContact O-N 3.36Å; M419-N422 PolarHBondContact O-ND2 2.55Å; M419-S434 PolarHBondContact O-OG 3.25Å; M419-I468 HydrophobicContact SD-CG2 4.27Å; M419-Y471 HydrophobicContact CE-CD2 4.17Å; M419-Y471 VanDerWaalsContact SD-CB 3.56Å; M419-Y471 HydrophobicContact SD-CD2 3.92Å; M419-Y471 HydrophobicContact SD-CG 3.92Å
420	N	76.9	Confident	69	Low	1 Å²	1	49.7 Å²	49.7	1%	0.005	27%	0.265	C	S	.	.	H	α-helix	trans	-88.7	-32.5	177	-62.6	-68.9	0	0	0	112.9	S416 T425 Y471 E473	S416-N420 PolarHBondContact O-N 3.3Å; S416-N420 PolarHBondContact O-ND2 2.85Å; N420-T425 PolarHBondContact O-OG1 3.02Å; N420-Y471 PolarHBondContact ND2-O 3.02Å; N420-E473 HydrophobicContact CB-CG 4.46Å; N420-E473 PolarHBondContact ND2-OE1 3.45Å; N420-E473 PolarHBondContact OD1-N 3.29Å
421	C	75.2	Confident	69	Low	67 Å²	67	51.9 Å²	51.9	45%	0.453	28%	0.277	S	S	.	.	S	Bend	trans	-120.4	104.4	-178.6	-65.4	0	0	0	0	112	L368 K417	L368-C421 WeakPolarHBondContact CD2-O 3.42Å; K417-C421 WeakPolarHBondContact O-CB 3.41Å; K417-C421 PolarHBondContact O-N 3.14Å
422	N	76.6	Confident	69.3	Low	1 Å²	1	52.2 Å²	52.2	1%	0.005	28%	0.279	C	S	.	.	S	Bend	trans	-155.8	177	179.4	60.4	64.9	0	0	0	112.6	L368 I371 Y385 F418 M419 A424 T425 Q426	L368-N422 HydrophobicContact CD2-CB 4.29Å; I371-N422 HydrophobicContact CD1-CB 3.48Å; I371-N422 VanDerWaalsContact CD1-CB 3.48Å; I371-N422 HydrophobicContact CG2-CB 4.2Å; Y385-N422 PolarHBondContact OH-ND2 3.2Å; Y385-N422 VanDerWaalsContact OH-ND2 3.13Å; F418-N422 PolarHBondContact O-ND2 3.41Å; M419-N422 PolarHBondContact O-ND2 2.55Å; N422-A424 PolarHBondContact O-N 3.09Å; N422-A424 VanDerWaalsContact O-N 3.15Å; N422-A424 WeakPolarHBondContact OD1-CA 3.18Å; N422-A424 WeakPolarHBondContact OD1-CB 3.4Å; N422-A424 PolarHBondContact OD1-N 2.96Å; N422-T425 PolarHBondContact N-OG1 3.42Å; N422-T425 PolarHBondContact O-N 2.84Å; N422-T425 PolarHBondContact O-OG1 3.01Å; N422-T425 PolarHBondContact OD1-N 3.31Å; N422-Q426 WeakPolarHBondContact O-CG 3.44Å; N422-Q426 PolarHBondContact O-N 3.33Å
423	K	71.9	Confident	69.9	Low	90 Å²	90	48.4 Å²	48.4	39%	0.391	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-28.7	-178.2	-163.7	-171.3	-180	-162.4	0	113.7	I371 D376	I371-K423 HydrophobicContact CG2-CB 4.42Å; D376-K423 IonicContact OD1-NZ 2.71Å; D376-K423 PolarHBondContact OD1-NZ 3.42Å
424	A	69.1	Low	70.5	Confident	2 Å²	2	47 Å²	47	2%	0.017	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.1	-22.7	177.8	0	0	0	0	0	113.1	V378 Y385 N422 R433	V378-A424 HydrophobicContact CG1-CB 4.49Å; Y385-A424 HydrophobicContact CD2-CB 4.27Å; Y385-A424 HydrophobicContact CE2-CB 3.88Å; N422-A424 PolarHBondContact O-N 3.09Å; N422-A424 VanDerWaalsContact O-N 3.15Å; N422-A424 WeakPolarHBondContact OD1-CA 3.18Å; N422-A424 WeakPolarHBondContact OD1-CB 3.4Å; N422-A424 PolarHBondContact OD1-N 2.96Å; A424-R433 WeakPolarHBondContact O-CG 3.35Å
425	T	68.9	Low	71.1	Confident	9 Å²	9	47 Å²	47	6%	0.055	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.3	-28.3	170.4	60.8	0	0	0	0	112.6	N420 N422 G427 F428 R433 S434	N420-T425 PolarHBondContact O-OG1 3.02Å; N422-T425 PolarHBondContact N-OG1 3.42Å; N422-T425 PolarHBondContact O-N 2.84Å; N422-T425 PolarHBondContact O-OG1 3.01Å; N422-T425 PolarHBondContact OD1-N 3.31Å; T425-G427 PolarHBondContact O-N 3.12Å; T425-F428 PolarHBondContact O-N 3.3Å; T425-R433 HydrophobicContact CG2-CB 4.38Å; T425-S434 VanDerWaalsContact CG2-OG 3.25Å; T425-S434 WeakPolarHBondContact CG2-OG 3.23Å
426	Q	59.6	Low	71.5	Confident	148 Å²	148	47.1 Å²	47.1	69%	0.692	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.5	92.7	175.4	-70.9	173.8	2.5	0	0	112.4	N422	N422-Q426 WeakPolarHBondContact O-CG 3.44Å; N422-Q426 PolarHBondContact O-N 3.33Å
427	G	54.1	Low	71.9	Confident	77 Å²	77	45.9 Å²	45.9	79%	0.794	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	147	-18.3	-179.5	0	0	0	0	0	113.3	T425	T425-G427 PolarHBondContact O-N 3.12Å
428	F	57.6	Low	72.4	Confident	94 Å²	94	41.4 Å²	41.4	41%	0.412	22%	0.224	S	C	.	.	S	Bend	trans	-96.6	154.1	171.9	-63.5	-89	0	0	0	110.1	T425 S430 R433	T425-F428 PolarHBondContact O-N 3.3Å; F428-S430 PolarHBondContact O-N 3.18Å; F428-S430 VanDerWaalsContact O-N 3.12Å; F428-R433 HydrophobicContact CD2-CB 3.86Å; F428-R433 HydrophobicContact CD2-CG 3.9Å; F428-R433 HydrophobicContact CE2-CB 4.2Å; F428-R433 HydrophobicContact CE2-CG 3.7Å; F428-R433 HydrophobicContact CG-CB 4.28Å; F428-R433 HydrophobicContact CZ-CG 4.25Å
429	K	54.4	Low	72.8	Confident	223 Å²	223	41.4 Å²	41.4	97%	0.97	22%	0.224	S	C	*	.	S	Bend	trans	-72.1	1	-178.5	-70.8	-176.1	177.3	178	0	114.2
430	S	54.7	Low	73.2	Confident	47 Å²	47	45.8 Å²	45.8	33%	0.329	24%	0.24	S	C	.	.	S	Bend	trans	-160.1	164.1	-177.7	53.7	0	0	0	0	110.7	F428 S432	F428-S430 PolarHBondContact O-N 3.18Å; F428-S430 VanDerWaalsContact O-N 3.12Å; S430-S432 PolarHBondContact O-N 2.73Å; S430-S432 VanDerWaalsContact OG-CB 3.32Å; S430-S432 WeakPolarHBondContact OG-CB 3.48Å; S430-S432 PolarHBondContact OG-OG 2.74Å
431	N	58.9	Low	73.8	Confident	46 Å²	46	46.7 Å²	46.7	25%	0.246	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.5	12.6	174.4	-69.7	-6.1	0	0	0	113.6	R433 P435	N431-R433 PolarHBondContact O-N 2.89Å; N431-R433 VanDerWaalsContact O-N 3.12Å; N431-P435 VanDerWaalsContact O-CD 3.23Å; N431-P435 WeakPolarHBondContact O-CD 3.38Å
432	S	68.1	Low	74.5	Confident	21 Å²	21	43.5 Å²	43.5	15%	0.147	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-15.1	-176.8	56.8	0	0	0	0	115.4	S430 P435 E436 V477	S430-S432 PolarHBondContact O-N 2.73Å; S430-S432 VanDerWaalsContact OG-CB 3.32Å; S430-S432 WeakPolarHBondContact OG-CB 3.48Å; S430-S432 PolarHBondContact OG-OG 2.74Å; S432-P435 WeakPolarHBondContact O-CD 3.4Å; S432-E436 WeakPolarHBondContact O-CB 3.49Å; S432-E436 PolarHBondContact O-N 3.44Å; S432-E436 VanDerWaalsContact O-N 3.12Å; S432-V477 WeakPolarHBondContact O-CG1 3.38Å
433	R	78.4	Confident	75.1	Confident	32 Å²	32	44.2 Å²	44.2	12%	0.121	23%	0.226	C	C	.	.	H	α-helix	trans	-71.9	-39.3	-176.2	-166.9	59.7	174.2	178.8	-0.3	113.4	S379 A424 T425 F428 N431 E436 L437	S379-R433 PolarHBondContact O-NE 2.78Å; S379-R433 PolarHBondContact O-NH2 3.46Å; A424-R433 WeakPolarHBondContact O-CG 3.35Å; T425-R433 HydrophobicContact CG2-CB 4.38Å; F428-R433 HydrophobicContact CD2-CB 3.86Å; F428-R433 HydrophobicContact CD2-CG 3.9Å; F428-R433 HydrophobicContact CE2-CB 4.2Å; F428-R433 HydrophobicContact CE2-CG 3.7Å; F428-R433 HydrophobicContact CG-CB 4.28Å; F428-R433 HydrophobicContact CZ-CG 4.25Å; N431-R433 PolarHBondContact O-N 2.89Å; N431-R433 VanDerWaalsContact O-N 3.12Å; R433-E436 WeakPolarHBondContact CD-OE2 3.26Å; R433-E436 IonicContact CZ-OE2 2.69Å; R433-E436 IonicContact NE-OE2 2.65Å; R433-E436 IonicContact NH1-OE1 3.97Å; R433-E436 PolarHBondContact NH1-OE1 3.18Å; R433-E436 IonicContact NH1-OE2 2.67Å; R433-E436 PolarHBondContact NH1-OE2 3.24Å; R433-E436 PolarHBondContact O-N 3.2Å; R433-L437 HydrophobicContact CG-CD1 4.04Å; R433-L437 HydrophobicContact CG-CG 4.33Å; R433-L437 WeakPolarHBondContact O-CB 3.03Å; R433-L437 VanDerWaalsContact O-CG 3.3Å; R433-L437 WeakPolarHBondContact O-CG 3.19Å; R433-L437 PolarHBondContact O-N 3.26Å
434	S	82.8	Confident	75.8	Confident	3 Å²	3	44.8 Å²	44.8	2%	0.021	23%	0.233	C	C	.	.	H	α-helix	trans	-63.6	-48.5	177.8	-41.6	0	0	0	0	112	Y385 M419 T425 E436 L437 L438	Y385-S434 VanDerWaalsContact OH-CB 3.31Å; Y385-S434 WeakPolarHBondContact OH-CB 3.38Å; Y385-S434 PolarHBondContact OH-OG 2.84Å; M419-S434 PolarHBondContact O-OG 3.25Å; T425-S434 VanDerWaalsContact CG2-OG 3.25Å; T425-S434 WeakPolarHBondContact CG2-OG 3.23Å; S434-E436 PolarHBondContact O-N 2.95Å; S434-L437 PolarHBondContact O-N 3.02Å; S434-L438 PolarHBondContact O-N 3.28Å
435	P	86.8	Confident	76.6	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-62.7	-38.2	174.7	-22.2	33.8	0	0	0	113.8	N431 S432 L438 A439 M472 D474 V477 F478	N431-P435 VanDerWaalsContact O-CD 3.23Å; N431-P435 WeakPolarHBondContact O-CD 3.38Å; S432-P435 WeakPolarHBondContact O-CD 3.4Å; P435-L438 PolarHBondContact O-N 2.84Å; P435-A439 WeakPolarHBondContact O-CB 3.46Å; P435-A439 PolarHBondContact O-N 3.39Å; P435-M472 HydrophobicContact CB-CE 3.94Å; P435-M472 HydrophobicContact CB-SD 4.03Å; P435-M472 HydrophobicContact CG-CE 4.26Å; P435-M472 HydrophobicContact CG-SD 3.93Å; P435-D474 WeakPolarHBondContact CB-O 3.43Å; P435-D474 HydrophobicContact CG-CB 4.1Å; P435-D474 WeakPolarHBondContact CG-O 3.39Å; P435-V477 HydrophobicContact CB-CB 3.86Å; P435-V477 HydrophobicContact CB-CG1 3.89Å; P435-V477 HydrophobicContact CG-CB 4.27Å; P435-V477 HydrophobicContact CG-CG1 4.46Å; P435-F478 HydrophobicContact CB-CB 3.99Å
436	E	84.8	Confident	77.5	Confident	6 Å²	6	45.3 Å²	45.3	3%	0.028	24%	0.235	C	C	.	.	H	α-helix	trans	-62.4	-47.2	174.7	-174.4	-161.8	164.9	0	0	111.6	S432 R433 S434 L438 A439 R440 F481	S432-E436 WeakPolarHBondContact O-CB 3.49Å; S432-E436 PolarHBondContact O-N 3.44Å; S432-E436 VanDerWaalsContact O-N 3.12Å; R433-E436 WeakPolarHBondContact CD-OE2 3.26Å; R433-E436 IonicContact CZ-OE2 2.69Å; R433-E436 IonicContact NE-OE2 2.65Å; R433-E436 IonicContact NH1-OE1 3.97Å; R433-E436 PolarHBondContact NH1-OE1 3.18Å; R433-E436 IonicContact NH1-OE2 2.67Å; R433-E436 PolarHBondContact NH1-OE2 3.24Å; R433-E436 PolarHBondContact O-N 3.2Å; S434-E436 PolarHBondContact O-N 2.95Å; E436-L438 VanDerWaalsContact C-N 3.34Å; E436-L438 PolarHBondContact O-N 3.1Å; E436-A439 PolarHBondContact O-N 3.43Å; E436-R440 WeakPolarHBondContact O-CG 3.49Å; E436-R440 PolarHBondContact O-N 2.9Å; E436-R440 IonicContact OE1-CZ 2.71Å; E436-R440 IonicContact OE1-NE 3.84Å; E436-R440 PolarHBondContact OE1-NE 2.88Å; E436-R440 IonicContact OE1-NH2 3.65Å; E436-R440 PolarHBondContact OE1-NH2 3.46Å; E436-F481 HydrophobicContact CB-CD2 3.92Å; E436-F481 HydrophobicContact CB-CE2 3.92Å; E436-F481 HydrophobicContact CB-CG 4.41Å; E436-F481 HydrophobicContact CB-CZ 4.41Å; E436-F481 HydrophobicContact CG-CD1 3.96Å; E436-F481 HydrophobicContact CG-CD2 3.86Å; E436-F481 HydrophobicContact CG-CE1 3.89Å; E436-F481 HydrophobicContact CG-CE2 3.8Å; E436-F481 HydrophobicContact CG-CG 3.95Å; E436-F481 HydrophobicContact CG-CZ 3.82Å
437	L	87.4	Confident	78.6	Confident	0 Å²	0	44 Å²	44	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-62.8	-41.1	177.9	-71.6	173.4	0	0	0	110.9	P382 Y385 R433 S434 A439 R440 Y441	P382-L437 WeakPolarHBondContact CB-O 3.19Å; P382-L437 HydrophobicContact CG-CD2 4.08Å; Y385-L437 HydrophobicContact CD1-CB 3.99Å; Y385-L437 HydrophobicContact CD1-CD1 4.09Å; Y385-L437 HydrophobicContact CD2-CD1 3.73Å; Y385-L437 HydrophobicContact CE1-CB 4.5Å; Y385-L437 HydrophobicContact CE1-CD1 4.48Å; Y385-L437 HydrophobicContact CE2-CD1 4.22Å; Y385-L437 HydrophobicContact CG-CB 4.33Å; Y385-L437 HydrophobicContact CG-CD1 3.72Å; R433-L437 HydrophobicContact CG-CD1 4.04Å; R433-L437 HydrophobicContact CG-CG 4.33Å; R433-L437 WeakPolarHBondContact O-CB 3.03Å; R433-L437 VanDerWaalsContact O-CG 3.3Å; R433-L437 WeakPolarHBondContact O-CG 3.19Å; R433-L437 PolarHBondContact O-N 3.26Å; S434-L437 PolarHBondContact O-N 3.02Å; L437-A439 PolarHBondContact O-N 3.35Å; L437-R440 PolarHBondContact O-N 2.9Å; L437-Y441 WeakPolarHBondContact O-CB 3.48Å; L437-Y441 PolarHBondContact O-N 3.05Å
438	L	90.6	Very high	79.8	Confident	1 Å²	1	46.6 Å²	46.6	1%	0.005	21%	0.213	C	C	.	.	H	α-helix	trans	-62.8	-43.2	175.3	-164.9	70.7	0	0	0	111.8	V386 S434 P435 E436 R440 Y441 C442 V465 I468 F469 M472 F478	V386-L438 HydrophobicContact CG1-CD1 4.47Å; V386-L438 HydrophobicContact CG2-CD1 3.63Å; S434-L438 PolarHBondContact O-N 3.28Å; P435-L438 PolarHBondContact O-N 2.84Å; E436-L438 VanDerWaalsContact C-N 3.34Å; E436-L438 PolarHBondContact O-N 3.1Å; L438-R440 PolarHBondContact O-N 2.82Å; L438-Y441 WeakPolarHBondContact O-CB 3.48Å; L438-Y441 PolarHBondContact O-N 3.28Å; L438-C442 PolarHBondContact O-N 3.35Å; L438-C442 PolarHBondContact O-SG 3.31Å; L438-V465 HydrophobicContact CD1-CB 4.49Å; L438-V465 HydrophobicContact CD1-CG1 4.07Å; L438-V465 HydrophobicContact CD1-CG2 4.23Å; L438-V465 HydrophobicContact CD2-CG1 4.21Å; L438-V465 HydrophobicContact CG-CG1 4.1Å; L438-I468 HydrophobicContact CD1-CB 4.37Å; L438-I468 HydrophobicContact CD1-CD1 4.35Å; L438-I468 HydrophobicContact CD1-CG2 4.3Å; L438-I468 HydrophobicContact CD2-CB 4.49Å; L438-I468 HydrophobicContact CD2-CG2 4.25Å; L438-F469 HydrophobicContact CD2-CB 4.03Å; L438-F469 HydrophobicContact CD2-CD2 4.35Å; L438-M472 HydrophobicContact CB-SD 4.27Å; L438-M472 HydrophobicContact CD2-CE 3.57Å; L438-M472 HydrophobicContact CD2-SD 3.73Å; L438-F478 HydrophobicContact CB-CD2 4.09Å; L438-F478 HydrophobicContact CB-CE2 4.14Å; L438-F478 HydrophobicContact CD2-CD2 4.13Å; L438-F478 HydrophobicContact CD2-CE2 4.03Å; L438-F478 HydrophobicContact CG-CD2 4.26Å; L438-F478 HydrophobicContact CG-CE2 3.94Å
439	A	90.4	Very high	80.5	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-64	-37.7	176.4	0	0	0	0	0	112.6	P435 E436 L437 C442 D443 F478 F481 L485	P435-A439 WeakPolarHBondContact O-CB 3.46Å; P435-A439 PolarHBondContact O-N 3.39Å; E436-A439 PolarHBondContact O-N 3.43Å; L437-A439 PolarHBondContact O-N 3.35Å; A439-C442 WeakPolarHBondContact O-CB 3.46Å; A439-C442 PolarHBondContact O-N 3.09Å; A439-D443 PolarHBondContact O-N 3.07Å; A439-F478 HydrophobicContact CB-CD2 3.77Å; A439-F478 HydrophobicContact CB-CE2 3.92Å; A439-F478 HydrophobicContact CB-CG 4.34Å; A439-F481 HydrophobicContact CB-CB 3.88Å; A439-L485 HydrophobicContact CB-CD1 4.49Å
440	R	89.5	Confident	81	Confident	94 Å²	94	41.8 Å²	41.8	36%	0.355	21%	0.213	S	C	.	.	H	α-helix	trans	-69.5	-33.9	173.7	-71.5	177.1	-176.8	-83.8	4.1	112.8	P382 E436 L437 L438 D443 L444 L485	P382-R440 HydrophobicContact CB-CB 4.22Å; P382-R440 HydrophobicContact CG-CB 3.68Å; E436-R440 WeakPolarHBondContact O-CG 3.49Å; E436-R440 PolarHBondContact O-N 2.9Å; E436-R440 IonicContact OE1-CZ 2.71Å; E436-R440 IonicContact OE1-NE 3.84Å; E436-R440 PolarHBondContact OE1-NE 2.88Å; E436-R440 IonicContact OE1-NH2 3.65Å; E436-R440 PolarHBondContact OE1-NH2 3.46Å; L437-R440 PolarHBondContact O-N 2.9Å; L438-R440 PolarHBondContact O-N 2.82Å; R440-D443 PolarHBondContact O-N 3.27Å; R440-L444 PolarHBondContact O-N 3.06Å; R440-L485 HydrophobicContact CG-CD1 4.26Å
441	Y	90.3	Very high	81.6	Confident	19 Å²	19	48.2 Å²	48.2	8%	0.075	24%	0.235	C	C	.	.	H	α-helix	trans	-65.6	-41.5	172.7	-178	-111.9	0	0	0	111	K383 V386 L437 L438 D443 L444 L445 V465	K383-Y441 HydrophobicContact CB-CD2 4.15Å; K383-Y441 HydrophobicContact CB-CE2 4.04Å; K383-Y441 HydrophobicContact CG-CE2 4.03Å; V386-Y441 HydrophobicContact CB-CD1 4.01Å; V386-Y441 HydrophobicContact CB-CD2 4.46Å; V386-Y441 HydrophobicContact CB-CE1 4.17Å; V386-Y441 HydrophobicContact CB-CG 4.15Å; V386-Y441 HydrophobicContact CG1-CD1 3.75Å; V386-Y441 HydrophobicContact CG1-CE1 3.59Å; V386-Y441 HydrophobicContact CG1-CG 4.39Å; V386-Y441 HydrophobicContact CG2-CD1 3.84Å; V386-Y441 HydrophobicContact CG2-CE1 4.49Å; V386-Y441 HydrophobicContact CG2-CG 3.84Å; L437-Y441 WeakPolarHBondContact O-CB 3.48Å; L437-Y441 PolarHBondContact O-N 3.05Å; L438-Y441 WeakPolarHBondContact O-CB 3.48Å; L438-Y441 PolarHBondContact O-N 3.28Å; Y441-D443 PolarHBondContact O-N 3.03Å; Y441-L444 WeakPolarHBondContact O-CB 3.47Å; Y441-L444 PolarHBondContact O-N 3.39Å; Y441-L444 VanDerWaalsContact O-N 3.15Å; Y441-L445 HydrophobicContact CD1-CD1 4.06Å; Y441-L445 HydrophobicContact CE1-CD1 3.59Å; Y441-L445 HydrophobicContact CE1-CG 4.22Å; Y441-L445 HydrophobicContact CE2-CD2 4.42Å; Y441-L445 HydrophobicContact CE2-CG 4.45Å; Y441-L445 WeakPolarHBondContact O-CG 3.15Å; Y441-L445 PolarHBondContact O-N 3.33Å; Y441-V465 HydrophobicContact CD1-CG2 3.67Å; Y441-V465 HydrophobicContact CE1-CG2 3.72Å
442	C	90.2	Very high	81.8	Confident	0 Å²	0	49 Å²	49	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-59.1	-44.8	171.8	-59.9	0	0	0	0	112.2	L438 A439 L444 L445 M446 Y482	L438-C442 PolarHBondContact O-N 3.35Å; L438-C442 PolarHBondContact O-SG 3.31Å; A439-C442 WeakPolarHBondContact O-CB 3.46Å; A439-C442 PolarHBondContact O-N 3.09Å; C442-L444 VanDerWaalsContact C-N 3.31Å; C442-L444 PolarHBondContact O-N 3.4Å; C442-L445 PolarHBondContact O-N 3.49Å; C442-M446 HydrophobicContact CB-CE 4.02Å; C442-M446 WeakPolarHBondContact O-CE 3.06Å; C442-M446 WeakPolarHBondContact O-CG 3.4Å; C442-M446 PolarHBondContact O-N 3.39Å; C442-Y482 HydrophobicContact CB-CD2 4.15Å; C442-Y482 HydrophobicContact CB-CE2 3.98Å
443	D	88.9	Confident	81.8	Confident	17 Å²	17	50.2 Å²	50.2	9%	0.091	25%	0.252	C	S	.	.	H	α-helix	trans	-60.5	-38.9	174.1	-174	73.9	0	0	0	112.3	A439 R440 Y441 R447 L485 R489	A439-D443 PolarHBondContact O-N 3.07Å; R440-D443 PolarHBondContact O-N 3.27Å; Y441-D443 PolarHBondContact O-N 3.03Å; D443-R447 WeakPolarHBondContact O-CB 3.47Å; D443-R447 PolarHBondContact O-N 2.91Å; D443-R447 IonicContact OD2-NH1 2.69Å; D443-R447 PolarHBondContact OD2-NH1 3.23Å; D443-L485 HydrophobicContact CB-CB 4.26Å; D443-L485 HydrophobicContact CB-CD1 4.01Å; D443-L485 HydrophobicContact CB-CD2 4.34Å; D443-L485 HydrophobicContact CB-CG 4.42Å; D443-R489 VanDerWaalsContact OD1-CD 3.29Å; D443-R489 WeakPolarHBondContact OD1-CD 3.18Å; D443-R489 WeakPolarHBondContact OD1-CG 3.43Å; D443-R489 IonicContact OD1-CZ 3.96Å; D443-R489 IonicContact OD1-NE 2.73Å; D443-R489 IonicContact OD1-NH1 2.65Å; D443-R489 PolarHBondContact OD1-NH1 3.4Å
444	L	86.7	Confident	81.5	Confident	101 Å²	101	55.9 Å²	55.9	53%	0.529	28%	0.28	S	S	.	.	H	α-helix	trans	-65.3	-38.5	178	-175.7	65.3	0	0	0	112.5	K383 R440 Y441 C442	K383-L444 HydrophobicContact CB-CD2 4.39Å; R440-L444 PolarHBondContact O-N 3.06Å; Y441-L444 WeakPolarHBondContact O-CB 3.47Å; Y441-L444 PolarHBondContact O-N 3.39Å; Y441-L444 VanDerWaalsContact O-N 3.15Å; C442-L444 VanDerWaalsContact C-N 3.31Å; C442-L444 PolarHBondContact O-N 3.4Å
445	L	85.8	Confident	80.9	Confident	21 Å²	21	61.6 Å²	61.6	11%	0.11	31%	0.306	C	S	.	.	H	α-helix	trans	-70.7	-42.4	177	-67.9	178.7	0	0	0	112.4	Y441 C442 M461	Y441-L445 HydrophobicContact CD1-CD1 4.06Å; Y441-L445 HydrophobicContact CE1-CD1 3.59Å; Y441-L445 HydrophobicContact CE1-CG 4.22Å; Y441-L445 HydrophobicContact CE2-CD2 4.42Å; Y441-L445 HydrophobicContact CE2-CG 4.45Å; Y441-L445 WeakPolarHBondContact O-CG 3.15Å; Y441-L445 PolarHBondContact O-N 3.33Å; C442-L445 PolarHBondContact O-N 3.49Å; L445-M461 HydrophobicContact CD1-CB 3.86Å; L445-M461 HydrophobicContact CD2-SD 3.65Å
446	M	86.9	Confident	80.1	Confident	1 Å²	1	65.2 Å²	65.2	1%	0.005	34%	0.336	C	S	.	.	H	α-helix	trans	-94	8.3	-171.1	-60.8	-177.3	-57.8	0	0	114.6	C442 L462 Y482 R489 S495 A496 E501 M504	C442-M446 HydrophobicContact CB-CE 4.02Å; C442-M446 WeakPolarHBondContact O-CE 3.06Å; C442-M446 WeakPolarHBondContact O-CG 3.4Å; C442-M446 PolarHBondContact O-N 3.39Å; M446-L462 HydrophobicContact SD-CD2 4.27Å; M446-Y482 HydrophobicContact CE-CE2 3.6Å; M446-Y482 WeakPolarHBondContact CE-OH 3.47Å; M446-R489 VanDerWaalsContact CE-NH2 3.32Å; M446-S495 CarbonylContact O-C 3.6Å; M446-S495 WeakPolarHBondContact O-CA 3.43Å; M446-A496 WeakPolarHBondContact O-CB 3.04Å; M446-A496 PolarHBondContact O-N 2.85Å; M446-E501 WeakPolarHBondContact CE-OE2 3.23Å; M446-M504 HydrophobicContact SD-CB 4.19Å; M446-M504 HydrophobicContact SD-CG 4.46Å
447	R	84.3	Confident	79.9	Confident	120 Å²	120	68.9 Å²	68.9	45%	0.453	36%	0.355	S	S	.	.	B	Isolated β-bridge	trans	-102.9	134.2	-178.2	-174.6	173.2	-176.2	174.5	-0.6	111.8	D443 S449 L494	D443-R447 WeakPolarHBondContact O-CB 3.47Å; D443-R447 PolarHBondContact O-N 2.91Å; D443-R447 IonicContact OD2-NH1 2.69Å; D443-R447 PolarHBondContact OD2-NH1 3.23Å; R447-S449 PolarHBondContact O-N 2.74Å; R447-L494 CarbonylContact C-O 3.56Å; R447-L494 WeakPolarHBondContact CA-O 3.3Å; R447-L494 HydrophobicContact CG-CB 4.3Å
448	K	78.6	Confident	79.5	Confident	132 Å²	132	69.1 Å²	69.1	57%	0.574	36%	0.357	S	S	*	.			trans	-49.9	113.7	179.8	-71.7	-175.7	-171.8	-174.1	0	111.4	L494 S495	K448-L494 PolarHBondContact N-O 2.91Å; K448-S495 WeakPolarHBondContact CE-O 3.33Å; K448-S495 WeakPolarHBondContact CG-O 3.33Å
449	S	72.6	Confident	78.9	Confident	70 Å²	70	74 Å²	74	49%	0.49	38%	0.379	S	S	.	.			trans	-120.6	160.4	179.2	-179.7	0	0	0	0	110.3	R447 K451 S452	R447-S449 PolarHBondContact O-N 2.74Å; S449-K451 PolarHBondContact O-N 2.89Å; S449-K451 PolarHBondContact OG-N 3.35Å; S449-S452 PolarHBondContact O-OG 2.94Å
450	T	65	Low	78.5	Confident	147 Å²	147	76.6 Å²	76.6	90%	0.902	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.6	-5.1	168.2	49.6	0	0	0	0	112.9
451	K	67.3	Low	78.2	Confident	182 Å²	182	74.9 Å²	74.9	79%	0.791	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-137.1	63.9	172.7	-62.6	-174.3	179.2	-172.6	0	109.2	S449	S449-K451 PolarHBondContact O-N 2.89Å; S449-K451 PolarHBondContact OG-N 3.35Å
452	S	62	Low	78	Confident	62 Å²	62	74 Å²	74	43%	0.434	40%	0.395	S	S	.	.	P	Polyproline II helix	trans	-70.6	134	170.4	-54.6	0	0	0	0	109	S449	S449-S452 PolarHBondContact O-OG 2.94Å
453	P	68.5	Low	77.7	Confident	47 Å²	47	76.3 Å²	76.3	31%	0.305	41%	0.411	S	S	.	.	P	Polyproline II helix	trans	-65.1	164.5	169.4	26.1	-31	0	0	0	111.4	D457 I458	P453-D457 HydrophobicContact CB-CB 4.02Å; P453-I458 HydrophobicContact CB-CG1 4.4Å; P453-I458 HydrophobicContact CG-CD1 4.27Å; P453-I458 HydrophobicContact CG-CG1 3.72Å
454	E	71.5	Confident	77.6	Confident	151 Å²	151	78.4 Å²	78.4	71%	0.706	42%	0.422	S	S	*	.	P	Polyproline II helix	trans	-67.2	155.8	176.9	-63	-173.2	-179.5	0	0	111	A456 D457 I458	E454-A456 VanDerWaalsContact C-N 3.28Å; E454-A456 PolarHBondContact O-N 2.94Å; E454-D457 WeakPolarHBondContact O-CB 3.17Å; E454-D457 PolarHBondContact O-N 3.23Å; E454-I458 WeakPolarHBondContact O-CG1 3.17Å; E454-I458 PolarHBondContact O-N 2.85Å
455	E	70.6	Confident	77.6	Confident	123 Å²	123	73.6 Å²	73.6	58%	0.575	40%	0.397	S	S	*	.	H	α-helix	trans	-64.3	-32.8	-172.9	-65.6	-170.9	129.6	0	0	113	I458 E459 S497	E455-I458 WeakPolarHBondContact O-CB 3.06Å; E455-I458 PolarHBondContact O-N 2.88Å; E455-E459 PolarHBondContact O-N 3.05Å; E455-S497 VanDerWaalsContact OE1-CB 3.27Å; E455-S497 WeakPolarHBondContact OE1-CB 3.32Å; E455-S497 PolarHBondContact OE1-OG 3.27Å
456	A	70.5	Confident	77.8	Confident	76 Å²	76	73.2 Å²	73.2	63%	0.628	39%	0.394	S	S	*	.	H	α-helix	trans	-65.5	-39.7	172.6	0	0	0	0	0	112.8	E454 I458 E459 A460	E454-A456 VanDerWaalsContact C-N 3.28Å; E454-A456 PolarHBondContact O-N 2.94Å; A456-I458 VanDerWaalsContact C-N 3.31Å; A456-I458 PolarHBondContact O-N 3.41Å; A456-E459 PolarHBondContact O-N 3.36Å; A456-A460 PolarHBondContact O-N 3.33Å
457	D	79.7	Confident	77.7	Confident	82 Å²	82	75 Å²	75	44%	0.439	40%	0.404	S	S	.	.	H	α-helix	trans	-63.4	-38.6	173.7	-81	-15.3	0	0	0	110.9	P453 E454 M461	P453-D457 HydrophobicContact CB-CB 4.02Å; E454-D457 WeakPolarHBondContact O-CB 3.17Å; E454-D457 PolarHBondContact O-N 3.23Å; D457-M461 HydrophobicContact CB-CE 4.08Å; D457-M461 WeakPolarHBondContact O-CB 3.23Å; D457-M461 VanDerWaalsContact O-CG 3.27Å; D457-M461 WeakPolarHBondContact O-CG 3.43Å; D457-M461 PolarHBondContact O-N 3.4Å
458	I	79.6	Confident	77.9	Confident	6 Å²	6	69.5 Å²	69.5	3%	0.031	38%	0.383	C	S	.	.	H	α-helix	trans	-62.6	-47.9	175.4	-64.3	170.4	0	0	0	110.1	P453 E454 E455 A456 A460 M461 L462 A500	P453-I458 HydrophobicContact CB-CG1 4.4Å; P453-I458 HydrophobicContact CG-CD1 4.27Å; P453-I458 HydrophobicContact CG-CG1 3.72Å; E454-I458 WeakPolarHBondContact O-CG1 3.17Å; E454-I458 PolarHBondContact O-N 2.85Å; E455-I458 WeakPolarHBondContact O-CB 3.06Å; E455-I458 PolarHBondContact O-N 2.88Å; A456-I458 VanDerWaalsContact C-N 3.31Å; A456-I458 PolarHBondContact O-N 3.41Å; I458-A460 PolarHBondContact O-N 3.11Å; I458-M461 PolarHBondContact O-N 3.26Å; I458-L462 HydrophobicContact CG2-CD1 3.99Å; I458-L462 HydrophobicContact CG2-CG 4.17Å; I458-L462 WeakPolarHBondContact O-CB 3.29Å; I458-L462 VanDerWaalsContact O-CG 3.28Å; I458-L462 WeakPolarHBondContact O-CG 3.28Å; I458-L462 PolarHBondContact O-N 2.88Å; I458-A500 HydrophobicContact CG2-CB 3.98Å
459	E	78.6	Confident	78.4	Confident	102 Å²	102	63.2 Å²	63.2	48%	0.477	36%	0.356	S	S	.	.	H	α-helix	trans	-64.4	-38.3	-179.5	-175	170.4	-166	0	0	113	E455 A456 L462 S463 K507	E455-E459 PolarHBondContact O-N 3.05Å; A456-E459 PolarHBondContact O-N 3.36Å; E459-L462 PolarHBondContact O-N 2.93Å; E459-S463 WeakPolarHBondContact O-CB 3.3Å; E459-S463 PolarHBondContact O-N 3.27Å; E459-S463 PolarHBondContact O-OG 3.31Å; E459-K507 IonicContact OE1-NZ 3.73Å; E459-K507 PolarHBondContact OE1-NZ 2.82Å
460	A	81.6	Confident	79	Confident	56 Å²	56	66 Å²	66	46%	0.463	36%	0.359	S	S	.	.	H	α-helix	trans	-60.4	-49.2	173.4	0	0	0	0	0	111.1	A456 I458 L462 S463 D464	A456-A460 PolarHBondContact O-N 3.33Å; I458-A460 PolarHBondContact O-N 3.11Å; A460-L462 PolarHBondContact O-N 2.99Å; A460-S463 WeakPolarHBondContact O-CB 3.41Å; A460-S463 PolarHBondContact O-N 3.07Å; A460-D464 PolarHBondContact O-N 2.85Å
461	M	82.8	Confident	79.8	Confident	57 Å²	57	60.3 Å²	60.3	28%	0.281	32%	0.322	S	S	.	.	H	α-helix	trans	-64.7	-35.5	177.6	-68.1	178.7	-149.5	0	0	113.1	L445 D457 I458 S463 D464 V465	L445-M461 HydrophobicContact CD1-CB 3.86Å; L445-M461 HydrophobicContact CD2-SD 3.65Å; D457-M461 HydrophobicContact CB-CE 4.08Å; D457-M461 WeakPolarHBondContact O-CB 3.23Å; D457-M461 VanDerWaalsContact O-CG 3.27Å; D457-M461 WeakPolarHBondContact O-CG 3.43Å; D457-M461 PolarHBondContact O-N 3.4Å; I458-M461 PolarHBondContact O-N 3.26Å; M461-S463 VanDerWaalsContact C-N 3.28Å; M461-S463 PolarHBondContact O-N 3.37Å; M461-D464 PolarHBondContact O-N 2.79Å; M461-V465 WeakPolarHBondContact O-CG2 3.32Å; M461-V465 PolarHBondContact O-N 3.26Å
462	L	85.7	Confident	80.6	Confident	1 Å²	1	52 Å²	52	1%	0.005	29%	0.285	C	S	.	.	H	α-helix	trans	-63.5	-36.3	172	-71.3	177	0	0	0	111.1	M446 I458 E459 A460 V465 M466 M504 K507	M446-L462 HydrophobicContact SD-CD2 4.27Å; I458-L462 HydrophobicContact CG2-CD1 3.99Å; I458-L462 HydrophobicContact CG2-CG 4.17Å; I458-L462 WeakPolarHBondContact O-CB 3.29Å; I458-L462 VanDerWaalsContact O-CG 3.28Å; I458-L462 WeakPolarHBondContact O-CG 3.28Å; I458-L462 PolarHBondContact O-N 2.88Å; E459-L462 PolarHBondContact O-N 2.93Å; A460-L462 PolarHBondContact O-N 2.99Å; L462-V465 WeakPolarHBondContact O-CB 3.4Å; L462-V465 PolarHBondContact O-N 2.74Å; L462-M466 VanDerWaalsContact O-CG 3.31Å; L462-M466 WeakPolarHBondContact O-CG 3.15Å; L462-M466 PolarHBondContact O-N 3.31Å; L462-M466 VanDerWaalsContact O-N 3.1Å; L462-M504 HydrophobicContact CD1-CB 4.2Å; L462-M504 HydrophobicContact CD2-CB 4.24Å; L462-M504 HydrophobicContact CD2-CG 4.2Å; L462-M504 HydrophobicContact CD2-SD 3.85Å; L462-K507 HydrophobicContact CB-CD 4.48Å
463	S	85.5	Confident	81.4	Confident	48 Å²	48	52.2 Å²	52.2	34%	0.336	28%	0.28	S	S	.	.	H	α-helix	trans	-70.6	-38.6	178.3	-54.8	0	0	0	0	111.8	E459 A460 M461 M466 I467 K507	E459-S463 WeakPolarHBondContact O-CB 3.3Å; E459-S463 PolarHBondContact O-N 3.27Å; E459-S463 PolarHBondContact O-OG 3.31Å; A460-S463 WeakPolarHBondContact O-CB 3.41Å; A460-S463 PolarHBondContact O-N 3.07Å; M461-S463 VanDerWaalsContact C-N 3.28Å; M461-S463 PolarHBondContact O-N 3.37Å; S463-M466 PolarHBondContact O-N 3.04Å; S463-I467 PolarHBondContact O-N 3.08Å; S463-K507 PolarHBondContact OG-NZ 2.85Å; S463-K507 VanDerWaalsContact OG-NZ 3.15Å
464	D	85.7	Confident	82	Confident	61 Å²	61	50.5 Å²	50.5	33%	0.326	27%	0.268	S	S	.	.	H	α-helix	trans	-62.7	-42	170.7	-79.9	-12.8	0	0	0	112.5	L390 A460 M461 M466 I467	L390-D464 HydrophobicContact CD1-CB 3.87Å; L390-D464 HydrophobicContact CD2-CB 4Å; A460-D464 PolarHBondContact O-N 2.85Å; M461-D464 PolarHBondContact O-N 2.79Å; D464-M466 PolarHBondContact O-N 3.37Å; D464-I467 WeakPolarHBondContact O-CB 3.24Å; D464-I467 PolarHBondContact O-N 3.1Å
465	V	88	Confident	82.8	Confident	1 Å²	1	44.5 Å²	44.5	1%	0.006	24%	0.239	C	C	.	.	H	α-helix	trans	-56.1	-40.9	172.6	159.6	0	0	0	0	111.3	L438 Y441 M461 L462 I467 I468 F469 M504	L438-V465 HydrophobicContact CD1-CB 4.49Å; L438-V465 HydrophobicContact CD1-CG1 4.07Å; L438-V465 HydrophobicContact CD1-CG2 4.23Å; L438-V465 HydrophobicContact CD2-CG1 4.21Å; L438-V465 HydrophobicContact CG-CG1 4.1Å; Y441-V465 HydrophobicContact CD1-CG2 3.67Å; Y441-V465 HydrophobicContact CE1-CG2 3.72Å; M461-V465 WeakPolarHBondContact O-CG2 3.32Å; M461-V465 PolarHBondContact O-N 3.26Å; L462-V465 WeakPolarHBondContact O-CB 3.4Å; L462-V465 PolarHBondContact O-N 2.74Å; V465-I467 VanDerWaalsContact C-N 3.26Å; V465-I467 PolarHBondContact O-N 2.65Å; V465-I468 PolarHBondContact O-N 2.98Å; V465-F469 WeakPolarHBondContact O-CB 3.47Å; V465-F469 PolarHBondContact O-N 3.44Å; V465-M504 HydrophobicContact CG1-CE 4.12Å
466	M	89	Confident	83.6	Confident	12 Å²	12	39 Å²	39	6%	0.059	21%	0.214	C	C	.	.	H	α-helix	trans	-69.1	-20.2	178.5	-67.2	-56.4	-58.4	0	0	113.8	L462 S463 D464 F469 K470 M504 K507 L508 T511	L462-M466 VanDerWaalsContact O-CG 3.31Å; L462-M466 WeakPolarHBondContact O-CG 3.15Å; L462-M466 PolarHBondContact O-N 3.31Å; L462-M466 VanDerWaalsContact O-N 3.1Å; S463-M466 PolarHBondContact O-N 3.04Å; D464-M466 PolarHBondContact O-N 3.37Å; M466-F469 HydrophobicContact CE-CB 4.43Å; M466-F469 HydrophobicContact CE-CD1 3.56Å; M466-F469 HydrophobicContact CE-CE1 4.09Å; M466-F469 HydrophobicContact CE-CG 4.19Å; M466-F469 HydrophobicContact SD-CB 4.33Å; M466-F469 HydrophobicContact SD-CD1 4.29Å; M466-F469 HydrophobicContact SD-CG 4.34Å; M466-K470 WeakPolarHBondContact O-CG 3.32Å; M466-K470 PolarHBondContact O-N 3.1Å; M466-M504 HydrophobicContact SD-CE 4.08Å; M466-M504 HydrophobicContact SD-SD 4.24Å; M466-K507 HydrophobicContact CE-CB 4.44Å; M466-K507 WeakPolarHBondContact CE-O 3.24Å; M466-K507 HydrophobicContact CG-CB 3.95Å; M466-K507 HydrophobicContact CG-CD 4.28Å; M466-K507 HydrophobicContact SD-CB 4.22Å; M466-L508 HydrophobicContact CE-CD2 4.23Å; M466-L508 HydrophobicContact SD-CD2 4Å; M466-T511 HydrophobicContact CE-CG2 4.16Å; M466-T511 WeakPolarHBondContact CE-OG1 2.97Å
467	I	85.6	Confident	84.4	Confident	40 Å²	40	35.4 Å²	35.4	21%	0.205	18%	0.184	C	C	.	.	H	α-helix	trans	-65.6	-52.6	170.3	-59.8	174.6	0	0	0	109.4	Y393 S463 D464 V465 F469 K470 Y471	Y393-I467 HydrophobicContact CD1-CG2 3.98Å; Y393-I467 HydrophobicContact CD2-CG2 4.16Å; Y393-I467 HydrophobicContact CE1-CD1 4.13Å; Y393-I467 HydrophobicContact CE1-CG2 3.67Å; Y393-I467 HydrophobicContact CE2-CG2 3.86Å; Y393-I467 HydrophobicContact CG-CG2 4.22Å; S463-I467 PolarHBondContact O-N 3.08Å; D464-I467 WeakPolarHBondContact O-CB 3.24Å; D464-I467 PolarHBondContact O-N 3.1Å; V465-I467 VanDerWaalsContact C-N 3.26Å; V465-I467 PolarHBondContact O-N 2.65Å; I467-F469 VanDerWaalsContact C-N 3.33Å; I467-F469 PolarHBondContact O-N 2.86Å; I467-K470 PolarHBondContact O-N 3.42Å; I467-Y471 HydrophobicContact CG2-CE2 4.26Å; I467-Y471 VanDerWaalsContact O-CD2 3.24Å; I467-Y471 WeakPolarHBondContact O-CD2 3.33Å
468	I	87.3	Confident	84.8	Confident	4 Å²	4	31.5 Å²	31.5	2%	0.021	16%	0.164	C	C	.	.	H	α-helix	trans	-62.7	-42.9	178.5	-63.7	167.6	0	0	0	110.5	V386 L389 L390 M419 L438 V465 K470 Y471 M472	V386-I468 HydrophobicContact CB-CD1 4.47Å; V386-I468 HydrophobicContact CG1-CD1 3.8Å; L389-I468 HydrophobicContact CB-CD1 3.87Å; L389-I468 HydrophobicContact CB-CG1 4.33Å; L389-I468 HydrophobicContact CD1-CD1 4.09Å; L389-I468 HydrophobicContact CD1-CG1 4.49Å; L389-I468 HydrophobicContact CD1-CG2 3.98Å; L390-I468 HydrophobicContact CD2-CD1 3.96Å; L390-I468 HydrophobicContact CD2-CG1 4.12Å; L390-I468 HydrophobicContact CG-CD1 3.98Å; M419-I468 HydrophobicContact SD-CG2 4.27Å; L438-I468 HydrophobicContact CD1-CB 4.37Å; L438-I468 HydrophobicContact CD1-CD1 4.35Å; L438-I468 HydrophobicContact CD1-CG2 4.3Å; L438-I468 HydrophobicContact CD2-CB 4.49Å; L438-I468 HydrophobicContact CD2-CG2 4.25Å; V465-I468 PolarHBondContact O-N 2.98Å; I468-K470 PolarHBondContact O-N 2.78Å; I468-Y471 PolarHBondContact O-N 3.2Å; I468-M472 HydrophobicContact CG2-CG 4.36Å; I468-M472 WeakPolarHBondContact O-CG 3.17Å; I468-M472 PolarHBondContact O-N 3.33Å
469	F	89	Confident	85.2	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-56.8	-32.9	-178.6	-177.6	-93	0	0	0	113.4	L438 V465 M466 I467 Y471 M472 K475 F478 L508 T511 C512 Y516	L438-F469 HydrophobicContact CD2-CB 4.03Å; L438-F469 HydrophobicContact CD2-CD2 4.35Å; V465-F469 WeakPolarHBondContact O-CB 3.47Å; V465-F469 PolarHBondContact O-N 3.44Å; M466-F469 HydrophobicContact CE-CB 4.43Å; M466-F469 HydrophobicContact CE-CD1 3.56Å; M466-F469 HydrophobicContact CE-CE1 4.09Å; M466-F469 HydrophobicContact CE-CG 4.19Å; M466-F469 HydrophobicContact SD-CB 4.33Å; M466-F469 HydrophobicContact SD-CD1 4.29Å; M466-F469 HydrophobicContact SD-CG 4.34Å; I467-F469 VanDerWaalsContact C-N 3.33Å; I467-F469 PolarHBondContact O-N 2.86Å; F469-Y471 VanDerWaalsContact C-N 3.3Å; F469-Y471 PolarHBondContact O-N 3.04Å; F469-M472 HydrophobicContact CD2-CE 3.58Å; F469-M472 HydrophobicContact CE2-CE 4.18Å; F469-M472 HydrophobicContact CG-CE 4.36Å; F469-M472 PolarHBondContact O-N 3.39Å; F469-K475 HydrophobicContact CE1-CD 4.4Å; F469-K475 HydrophobicContact CE1-CG 4.41Å; F469-K475 HydrophobicContact CE2-CB 4.26Å; F469-K475 HydrophobicContact CE2-CG 4.17Å; F469-K475 HydrophobicContact CZ-CB 4.1Å; F469-K475 HydrophobicContact CZ-CD 4.34Å; F469-K475 HydrophobicContact CZ-CG 3.99Å; F469-F478 HydrophobicContact CD2-CD1 4.16Å; F469-F478 HydrophobicContact CD2-CD2 4.27Å; F469-F478 HydrophobicContact CD2-CE1 4.41Å; F469-F478 HydrophobicContact CD2-CG 4.09Å; F469-F478 HydrophobicContact CE2-CB 4.13Å; F469-F478 AromaticContact CE2-CD1 3.61Å; F469-F478 HydrophobicContact CE2-CD1 3.61Å; F469-F478 HydrophobicContact CE2-CD2 4.44Å; F469-F478 HydrophobicContact CE2-CE1 4.11Å; F469-F478 AromaticContact CE2-CG 3.81Å; F469-F478 HydrophobicContact CE2-CG 3.81Å; F469-L508 HydrophobicContact CD1-CD2 4.49Å; F469-L508 HydrophobicContact CD2-CD2 4.36Å; F469-L508 HydrophobicContact CE1-CD2 4.03Å; F469-L508 HydrophobicContact CE2-CD2 3.9Å; F469-L508 HydrophobicContact CZ-CD2 3.72Å; F469-T511 HydrophobicContact CD1-CG2 3.9Å; F469-T511 HydrophobicContact CE1-CG2 3.87Å; F469-C512 WeakPolarHBondContact CE1-SG 3.42Å; F469-C512 VanDerWaalsContact CZ-SG 3.54Å; F469-Y516 WeakPolarHBondContact CE2-OH 3.28Å; F469-Y516 AromaticContact CZ-CE1 3.97Å; F469-Y516 HydrophobicContact CZ-CE1 3.97Å; F469-Y516 AromaticContact CZ-CZ 3.87Å
470	K	85.6	Confident	85.5	Confident	128 Å²	128	28.6 Å²	28.6	56%	0.557	15%	0.151	S	C	*	.	H	α-helix	trans	-66.2	-28.1	175.3	-74.8	171.7	-179	-177.2	0	113.8	M466 I467 I468 T511	M466-K470 WeakPolarHBondContact O-CG 3.32Å; M466-K470 PolarHBondContact O-N 3.1Å; I467-K470 PolarHBondContact O-N 3.42Å; I468-K470 PolarHBondContact O-N 2.78Å; K470-T511 HydrophobicContact CG-CG2 3.95Å
471	Y	82.7	Confident	85.8	Confident	28 Å²	28	26.7 Å²	26.7	11%	0.11	13%	0.133	C	C	.	.	H	α-helix	trans	-90.5	-8	178.4	-68.1	-75.7	0	0	0	113.9	Y393 F412 C415 M419 N420 I467 I468 F469	Y393-Y471 HydrophobicContact CD2-CE2 4.2Å; Y393-Y471 AromaticContact CE2-CE2 3.84Å; Y393-Y471 HydrophobicContact CE2-CE2 3.84Å; F412-Y471 HydrophobicContact CD2-CD1 4.31Å; F412-Y471 AromaticContact CD2-CE1 3.41Å; F412-Y471 HydrophobicContact CD2-CE1 3.41Å; F412-Y471 VanDerWaalsContact CD2-CE1 3.41Å; F412-Y471 HydrophobicContact CE2-CD1 4.09Å; F412-Y471 AromaticContact CE2-CE1 3.55Å; F412-Y471 HydrophobicContact CE2-CE1 3.55Å; F412-Y471 AromaticContact CG-CE1 3.97Å; F412-Y471 HydrophobicContact CG-CE1 3.97Å; F412-Y471 HydrophobicContact CZ-CD1 4.37Å; F412-Y471 HydrophobicContact CZ-CE1 4.23Å; C415-Y471 HydrophobicContact CB-CD1 3.87Å; C415-Y471 HydrophobicContact CB-CE1 3.65Å; C415-Y471 HydrophobicContact CB-CG 4.42Å; M419-Y471 HydrophobicContact CE-CD2 4.17Å; M419-Y471 VanDerWaalsContact SD-CB 3.56Å; M419-Y471 HydrophobicContact SD-CD2 3.92Å; M419-Y471 HydrophobicContact SD-CG 3.92Å; N420-Y471 PolarHBondContact ND2-O 3.02Å; I467-Y471 HydrophobicContact CG2-CE2 4.26Å; I467-Y471 VanDerWaalsContact O-CD2 3.24Å; I467-Y471 WeakPolarHBondContact O-CD2 3.33Å; I468-Y471 PolarHBondContact O-N 3.2Å; F469-Y471 VanDerWaalsContact C-N 3.3Å; F469-Y471 PolarHBondContact O-N 3.04Å
472	M	82.8	Confident	86.2	Confident	6 Å²	6	24 Å²	24	3%	0.03	12%	0.119	C	C	.	.			trans	-77.5	132.8	178.8	-60.8	-162.6	-49.3	0	0	111.3	P435 L438 I468 F469 K475 F478	P435-M472 HydrophobicContact CB-CE 3.94Å; P435-M472 HydrophobicContact CB-SD 4.03Å; P435-M472 HydrophobicContact CG-CE 4.26Å; P435-M472 HydrophobicContact CG-SD 3.93Å; L438-M472 HydrophobicContact CB-SD 4.27Å; L438-M472 HydrophobicContact CD2-CE 3.57Å; L438-M472 HydrophobicContact CD2-SD 3.73Å; I468-M472 HydrophobicContact CG2-CG 4.36Å; I468-M472 WeakPolarHBondContact O-CG 3.17Å; I468-M472 PolarHBondContact O-N 3.33Å; F469-M472 HydrophobicContact CD2-CE 3.58Å; F469-M472 HydrophobicContact CE2-CE 4.18Å; F469-M472 HydrophobicContact CG-CE 4.36Å; F469-M472 PolarHBondContact O-N 3.39Å; M472-K475 HydrophobicContact CB-CG 4.46Å; M472-K475 VanDerWaalsContact O-CE 3.25Å; M472-K475 WeakPolarHBondContact O-CE 3.41Å; M472-F478 HydrophobicContact CE-CB 3.99Å; M472-F478 HydrophobicContact CE-CD2 4.07Å; M472-F478 HydrophobicContact CE-CG 4.29Å
473	E	78.7	Confident	86.3	Confident	67 Å²	67	24.4 Å²	24.4	31%	0.313	12%	0.121	S	C	.	.	S	Bend	trans	-75.6	-51.6	175	-73.3	162.3	-165.7	0	0	110.8	N420 K475 F788	N420-E473 HydrophobicContact CB-CG 4.46Å; N420-E473 PolarHBondContact ND2-OE1 3.45Å; N420-E473 PolarHBondContact OD1-N 3.29Å; E473-K475 PolarHBondContact O-N 2.7Å; E473-F788 VanDerWaalsContact O-CA 3.27Å; E473-F788 WeakPolarHBondContact O-CA 3.47Å
474	D	82.1	Confident	86.3	Confident	11 Å²	11	23.5 Å²	23.5	6%	0.059	11%	0.111	C	C	.	.			trans	-88.1	69.4	-176.7	-76.3	-37.5	0	0	0	112.9	P435 V477 R753	P435-D474 WeakPolarHBondContact CB-O 3.43Å; P435-D474 HydrophobicContact CG-CB 4.1Å; P435-D474 WeakPolarHBondContact CG-O 3.39Å; D474-V477 HydrophobicContact CB-CB 4.39Å; D474-V477 HydrophobicContact CB-CG2 3.84Å; D474-V477 WeakPolarHBondContact O-CB 3.24Å; D474-V477 PolarHBondContact O-N 3.31Å; D474-R753 VanDerWaalsContact CG-NH2 3.27Å; D474-R753 IonicContact OD1-CZ 2.86Å; D474-R753 IonicContact OD1-NH1 2.73Å; D474-R753 PolarHBondContact OD1-NH1 3.27Å; D474-R753 IonicContact OD1-NH2 3.22Å; D474-R753 PolarHBondContact OD1-NH2 2.77Å; D474-R753 IonicContact OD2-NH2 2.71Å
475	K	88.2	Confident	86.4	Confident	25 Å²	25	21.9 Å²	21.9	11%	0.109	10%	0.103	C	C	.	.	H	α-helix	trans	-74.2	-25.1	179.9	-64.2	155.1	179.1	162.9	0	113.8	F469 M472 E473 V477 F478 E479 Y516 S786 L787	F469-K475 HydrophobicContact CE1-CD 4.4Å; F469-K475 HydrophobicContact CE1-CG 4.41Å; F469-K475 HydrophobicContact CE2-CB 4.26Å; F469-K475 HydrophobicContact CE2-CG 4.17Å; F469-K475 HydrophobicContact CZ-CB 4.1Å; F469-K475 HydrophobicContact CZ-CD 4.34Å; F469-K475 HydrophobicContact CZ-CG 3.99Å; M472-K475 HydrophobicContact CB-CG 4.46Å; M472-K475 VanDerWaalsContact O-CE 3.25Å; M472-K475 WeakPolarHBondContact O-CE 3.41Å; E473-K475 PolarHBondContact O-N 2.7Å; K475-V477 VanDerWaalsContact C-N 3.26Å; K475-V477 PolarHBondContact O-N 2.89Å; K475-F478 WeakPolarHBondContact O-CB 3.24Å; K475-F478 PolarHBondContact O-N 3.16Å; K475-F478 VanDerWaalsContact O-N 3.16Å; K475-E479 PolarHBondContact O-N 3.47Å; K475-Y516 HydrophobicContact CB-CE2 4.31Å; K475-Y516 PolarHBondContact O-OH 3.04Å; K475-S786 WeakPolarHBondContact CD-O 3.34Å; K475-S786 PolarHBondContact NZ-O 2.98Å; K475-L787 CarbonylContact C-O 3.55Å; K475-L787 WeakPolarHBondContact CA-O 3.39Å; K475-L787 WeakPolarHBondContact CB-O 3.37Å; K475-L787 PolarHBondContact N-O 2.9Å
476	D	86.5	Confident	86.5	Confident	8 Å²	8	21.9 Å²	21.9	4%	0.043	10%	0.102	C	C	.	.	H	α-helix	trans	-63.9	-29.6	173.2	67.9	-23.1	0	0	0	113.1	E479 T480 L749 R753 L787 F788	D476-E479 WeakPolarHBondContact O-CB 3.48Å; D476-E479 PolarHBondContact O-N 3.39Å; D476-T480 WeakPolarHBondContact O-CB 3.3Å; D476-T480 PolarHBondContact O-N 3.28Å; D476-T480 PolarHBondContact O-OG1 3.25Å; D476-L749 HydrophobicContact CB-CD1 4.25Å; D476-L749 WeakPolarHBondContact OD2-CD1 3.12Å; D476-R753 IonicContact OD1-CZ 3.17Å; D476-R753 IonicContact OD1-NE 3.53Å; D476-R753 IonicContact OD1-NH2 2.76Å; D476-R753 PolarHBondContact OD1-NH2 3.16Å; D476-R753 VanDerWaalsContact OD2-CG 3.28Å; D476-R753 WeakPolarHBondContact OD2-CG 3.3Å; D476-R753 IonicContact OD2-CZ 3.12Å; D476-R753 IonicContact OD2-NE 3.93Å; D476-R753 PolarHBondContact OD2-NE 3.42Å; D476-R753 IonicContact OD2-NH2 3.12Å; D476-R753 PolarHBondContact OD2-NH2 3.27Å; D476-L787 PolarHBondContact N-O 2.86Å; D476-F788 HydrophobicContact CB-CD1 4.29Å; D476-F788 WeakPolarHBondContact OD1-CB 3.41Å; D476-F788 WeakPolarHBondContact OD2-CD1 3.48Å
477	V	87	Confident	86.5	Confident	1 Å²	1	21.3 Å²	21.3	1%	0.006	10%	0.1	C	C	.	.	H	α-helix	trans	-63.2	-47.7	169.8	178	0	0	0	0	109.8	S432 P435 D474 K475 E479 T480 F481 L749	S432-V477 WeakPolarHBondContact O-CG1 3.38Å; P435-V477 HydrophobicContact CB-CB 3.86Å; P435-V477 HydrophobicContact CB-CG1 3.89Å; P435-V477 HydrophobicContact CG-CB 4.27Å; P435-V477 HydrophobicContact CG-CG1 4.46Å; D474-V477 HydrophobicContact CB-CB 4.39Å; D474-V477 HydrophobicContact CB-CG2 3.84Å; D474-V477 WeakPolarHBondContact O-CB 3.24Å; D474-V477 PolarHBondContact O-N 3.31Å; K475-V477 VanDerWaalsContact C-N 3.26Å; K475-V477 PolarHBondContact O-N 2.89Å; V477-E479 VanDerWaalsContact C-N 3.32Å; V477-E479 PolarHBondContact O-N 2.99Å; V477-T480 PolarHBondContact O-N 3.03Å; V477-F481 HydrophobicContact CG1-CD2 3.73Å; V477-F481 HydrophobicContact CG1-CE2 3.78Å; V477-F481 VanDerWaalsContact O-CD2 3.32Å; V477-F481 WeakPolarHBondContact O-CD2 3.3Å; V477-F481 PolarHBondContact O-N 3.48Å; V477-L749 HydrophobicContact CG2-CD1 4.42Å; V477-L749 HydrophobicContact CG2-CD2 3.73Å
478	F	90	Very high	86.5	Confident	0 Å²	0	23 Å²	23	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-57.2	-47	174.3	179.5	-82.7	0	0	0	110.5	P435 L438 A439 F469 M472 K475 T480 F481 Y482 M504 L508 Y516	P435-F478 HydrophobicContact CB-CB 3.99Å; L438-F478 HydrophobicContact CB-CD2 4.09Å; L438-F478 HydrophobicContact CB-CE2 4.14Å; L438-F478 HydrophobicContact CD2-CD2 4.13Å; L438-F478 HydrophobicContact CD2-CE2 4.03Å; L438-F478 HydrophobicContact CG-CD2 4.26Å; L438-F478 HydrophobicContact CG-CE2 3.94Å; A439-F478 HydrophobicContact CB-CD2 3.77Å; A439-F478 HydrophobicContact CB-CE2 3.92Å; A439-F478 HydrophobicContact CB-CG 4.34Å; F469-F478 HydrophobicContact CD2-CD1 4.16Å; F469-F478 HydrophobicContact CD2-CD2 4.27Å; F469-F478 HydrophobicContact CD2-CE1 4.41Å; F469-F478 HydrophobicContact CD2-CG 4.09Å; F469-F478 HydrophobicContact CE2-CB 4.13Å; F469-F478 AromaticContact CE2-CD1 3.61Å; F469-F478 HydrophobicContact CE2-CD1 3.61Å; F469-F478 HydrophobicContact CE2-CD2 4.44Å; F469-F478 HydrophobicContact CE2-CE1 4.11Å; F469-F478 AromaticContact CE2-CG 3.81Å; F469-F478 HydrophobicContact CE2-CG 3.81Å; M472-F478 HydrophobicContact CE-CB 3.99Å; M472-F478 HydrophobicContact CE-CD2 4.07Å; M472-F478 HydrophobicContact CE-CG 4.29Å; K475-F478 WeakPolarHBondContact O-CB 3.24Å; K475-F478 PolarHBondContact O-N 3.16Å; K475-F478 VanDerWaalsContact O-N 3.16Å; F478-T480 VanDerWaalsContact C-N 3.34Å; F478-T480 PolarHBondContact O-N 3.3Å; F478-F481 PolarHBondContact O-N 2.84Å; F478-Y482 AromaticContact CE1-CD2 3.72Å; F478-Y482 HydrophobicContact CE1-CD2 3.72Å; F478-Y482 HydrophobicContact CE1-CE2 4.47Å; F478-Y482 AromaticContact CE1-CG 3.85Å; F478-Y482 HydrophobicContact CE1-CG 3.85Å; F478-Y482 AromaticContact CZ-CD2 3.62Å; F478-Y482 HydrophobicContact CZ-CD2 3.62Å; F478-Y482 HydrophobicContact CZ-CE2 4.27Å; F478-Y482 HydrophobicContact CZ-CG 4.21Å; F478-Y482 WeakPolarHBondContact O-CB 3.38Å; F478-Y482 PolarHBondContact O-N 2.89Å; F478-M504 HydrophobicContact CE1-CE 4.2Å; F478-M504 HydrophobicContact CZ-CE 3.68Å; F478-L508 HydrophobicContact CE1-CD1 4.11Å; F478-L508 HydrophobicContact CE1-CD2 3.92Å; F478-Y516 WeakPolarHBondContact CD1-OH 3.34Å
479	E	87.3	Confident	86.5	Confident	24 Å²	24	23 Å²	23	11%	0.112	11%	0.105	C	C	.	.	H	α-helix	trans	-54.8	-49.9	177.7	-158.5	-144.1	121.9	0	0	111	K475 D476 V477 F481 Y482 N483 Y516 K519	K475-E479 PolarHBondContact O-N 3.47Å; D476-E479 WeakPolarHBondContact O-CB 3.48Å; D476-E479 PolarHBondContact O-N 3.39Å; V477-E479 VanDerWaalsContact C-N 3.32Å; V477-E479 PolarHBondContact O-N 2.99Å; E479-F481 PolarHBondContact O-N 2.62Å; E479-Y482 PolarHBondContact O-N 2.8Å; E479-N483 WeakPolarHBondContact CG-ND2 3.37Å; E479-N483 WeakPolarHBondContact O-CB 3.29Å; E479-N483 VanDerWaalsContact O-CG 3.23Å; E479-N483 PolarHBondContact O-N 3.18Å; E479-N483 PolarHBondContact O-ND2 2.9Å; E479-N483 PolarHBondContact OE1-ND2 3.45Å; E479-Y516 HydrophobicContact CB-CD2 4.41Å; E479-Y516 HydrophobicContact CB-CE1 4.45Å; E479-Y516 HydrophobicContact CB-CE2 3.64Å; E479-Y516 HydrophobicContact CG-CD2 4.18Å; E479-Y516 HydrophobicContact CG-CE1 4.3Å; E479-Y516 HydrophobicContact CG-CE2 3.87Å; E479-Y516 PolarHBondContact N-OH 2.97Å; E479-K519 IonicContact OE1-NZ 2.7Å; E479-K519 PolarHBondContact OE1-NZ 2.77Å; E479-K519 VanDerWaalsContact OE1-NZ 3.15Å
480	T	85.3	Confident	86.5	Confident	22 Å²	22	23.9 Å²	23.9	14%	0.135	11%	0.11	C	C	.	.	H	α-helix	trans	-62.3	-46.4	-176.3	-60.2	0	0	0	0	112	D476 V477 F478 K484 A745	D476-T480 WeakPolarHBondContact O-CB 3.3Å; D476-T480 PolarHBondContact O-N 3.28Å; D476-T480 PolarHBondContact O-OG1 3.25Å; V477-T480 PolarHBondContact O-N 3.03Å; F478-T480 VanDerWaalsContact C-N 3.34Å; F478-T480 PolarHBondContact O-N 3.3Å; T480-K484 WeakPolarHBondContact O-CB 3.14Å; T480-K484 PolarHBondContact O-N 2.84Å; T480-A745 HydrophobicContact CG2-CB 4.08Å
481	F	86.7	Confident	86.5	Confident	17 Å²	17	19.1 Å²	19.1	8%	0.075	9%	0.092	C	C	.	.	H	α-helix	trans	-71.5	-39.4	176.7	-77.5	-75	0	0	0	112.2	E436 A439 V477 F478 E479 K484 L485	E436-F481 HydrophobicContact CB-CD2 3.92Å; E436-F481 HydrophobicContact CB-CE2 3.92Å; E436-F481 HydrophobicContact CB-CG 4.41Å; E436-F481 HydrophobicContact CB-CZ 4.41Å; E436-F481 HydrophobicContact CG-CD1 3.96Å; E436-F481 HydrophobicContact CG-CD2 3.86Å; E436-F481 HydrophobicContact CG-CE1 3.89Å; E436-F481 HydrophobicContact CG-CE2 3.8Å; E436-F481 HydrophobicContact CG-CG 3.95Å; E436-F481 HydrophobicContact CG-CZ 3.82Å; A439-F481 HydrophobicContact CB-CB 3.88Å; V477-F481 HydrophobicContact CG1-CD2 3.73Å; V477-F481 HydrophobicContact CG1-CE2 3.78Å; V477-F481 VanDerWaalsContact O-CD2 3.32Å; V477-F481 WeakPolarHBondContact O-CD2 3.3Å; V477-F481 PolarHBondContact O-N 3.48Å; F478-F481 PolarHBondContact O-N 2.84Å; E479-F481 PolarHBondContact O-N 2.62Å; F481-K484 PolarHBondContact O-N 2.98Å; F481-L485 WeakPolarHBondContact O-CB 3.46Å; F481-L485 WeakPolarHBondContact O-CD1 3.46Å; F481-L485 WeakPolarHBondContact O-CG 3.41Å; F481-L485 PolarHBondContact O-N 2.92Å
482	Y	90.7	Very high	86.3	Confident	1 Å²	1	18.5 Å²	18.5	0%	0.004	9%	0.094	C	C	.	.	H	α-helix	trans	-67.5	-46.6	-179.9	-173.9	-83	0	0	0	111.9	C442 M446 F478 E479 K484 L485 L486 M504 L508 L520	C442-Y482 HydrophobicContact CB-CD2 4.15Å; C442-Y482 HydrophobicContact CB-CE2 3.98Å; M446-Y482 HydrophobicContact CE-CE2 3.6Å; M446-Y482 WeakPolarHBondContact CE-OH 3.47Å; F478-Y482 AromaticContact CE1-CD2 3.72Å; F478-Y482 HydrophobicContact CE1-CD2 3.72Å; F478-Y482 HydrophobicContact CE1-CE2 4.47Å; F478-Y482 AromaticContact CE1-CG 3.85Å; F478-Y482 HydrophobicContact CE1-CG 3.85Å; F478-Y482 AromaticContact CZ-CD2 3.62Å; F478-Y482 HydrophobicContact CZ-CD2 3.62Å; F478-Y482 HydrophobicContact CZ-CE2 4.27Å; F478-Y482 HydrophobicContact CZ-CG 4.21Å; F478-Y482 WeakPolarHBondContact O-CB 3.38Å; F478-Y482 PolarHBondContact O-N 2.89Å; E479-Y482 PolarHBondContact O-N 2.8Å; Y482-K484 VanDerWaalsContact C-N 3.28Å; Y482-K484 PolarHBondContact O-N 2.96Å; Y482-L485 PolarHBondContact O-N 2.83Å; Y482-L486 WeakPolarHBondContact O-CB 3.44Å; Y482-L486 PolarHBondContact O-N 2.85Å; Y482-M504 HydrophobicContact CE2-CE 4.28Å; Y482-M504 HydrophobicContact CE2-CG 3.96Å; Y482-M504 WeakPolarHBondContact OH-CG 3.25Å; Y482-L508 HydrophobicContact CE1-CD1 4.3Å; Y482-L520 HydrophobicContact CD1-CD1 3.99Å; Y482-L520 HydrophobicContact CD1-CD2 3.67Å; Y482-L520 HydrophobicContact CE1-CD1 3.91Å; Y482-L520 HydrophobicContact CE1-CD2 3.84Å
483	N	88.5	Confident	86.3	Confident	8 Å²	8	25 Å²	25	4%	0.043	12%	0.124	C	C	.	.	H	α-helix	trans	-48.9	-50.2	171.2	-83.7	-45.2	0	0	0	111	E479 L486 A487 L520	E479-N483 WeakPolarHBondContact CG-ND2 3.37Å; E479-N483 WeakPolarHBondContact O-CB 3.29Å; E479-N483 VanDerWaalsContact O-CG 3.23Å; E479-N483 PolarHBondContact O-N 3.18Å; E479-N483 PolarHBondContact O-ND2 2.9Å; E479-N483 PolarHBondContact OE1-ND2 3.45Å; N483-L486 PolarHBondContact O-N 3.36Å; N483-A487 WeakPolarHBondContact O-CB 3.43Å; N483-A487 PolarHBondContact O-N 2.89Å; N483-L520 HydrophobicContact CB-CD2 4.43Å; N483-L520 WeakPolarHBondContact OD1-CD2 2.81Å; N483-L520 WeakPolarHBondContact OD1-CG 3.25Å
484	K	85.3	Confident	86.6	Confident	29 Å²	29	24.4 Å²	24.4	13%	0.126	12%	0.123	C	C	.	.	H	α-helix	trans	-70	-37.6	-177.1	177.8	176.5	164.4	-168.6	0	113.3	T480 F481 Y482 K488 P582 D741 A745	T480-K484 WeakPolarHBondContact O-CB 3.14Å; T480-K484 PolarHBondContact O-N 2.84Å; F481-K484 PolarHBondContact O-N 2.98Å; Y482-K484 VanDerWaalsContact C-N 3.28Å; Y482-K484 PolarHBondContact O-N 2.96Å; K484-K488 WeakPolarHBondContact O-CG 3.19Å; K484-K488 PolarHBondContact O-N 2.9Å; K484-P582 HydrophobicContact CB-CG 4.23Å; K484-D741 PolarHBondContact NZ-O 3.05Å; K484-A745 HydrophobicContact CD-CB 4.37Å
485	L	88	Confident	86.7	Confident	28 Å²	28	24.7 Å²	24.7	15%	0.147	13%	0.126	C	C	.	.	H	α-helix	trans	-69.2	-44.3	174.8	-70.4	165.3	0	0	0	110.6	A439 R440 D443 F481 Y482 A487 K488 R489	A439-L485 HydrophobicContact CB-CD1 4.49Å; R440-L485 HydrophobicContact CG-CD1 4.26Å; D443-L485 HydrophobicContact CB-CB 4.26Å; D443-L485 HydrophobicContact CB-CD1 4.01Å; D443-L485 HydrophobicContact CB-CD2 4.34Å; D443-L485 HydrophobicContact CB-CG 4.42Å; F481-L485 WeakPolarHBondContact O-CB 3.46Å; F481-L485 WeakPolarHBondContact O-CD1 3.46Å; F481-L485 WeakPolarHBondContact O-CG 3.41Å; F481-L485 PolarHBondContact O-N 2.92Å; Y482-L485 PolarHBondContact O-N 2.83Å; L485-A487 VanDerWaalsContact C-N 3.35Å; L485-A487 PolarHBondContact O-N 3.27Å; L485-K488 PolarHBondContact O-N 2.78Å; L485-R489 WeakPolarHBondContact O-CG 3.41Å; L485-R489 PolarHBondContact O-N 3.39Å
486	L	90.4	Very high	86.4	Confident	0 Å²	0	25 Å²	25	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-58.2	-44.7	172.6	179	66	0	0	0	111.5	Y482 N483 K488 R489 L490 E501 L520 M523 F524	Y482-L486 WeakPolarHBondContact O-CB 3.44Å; Y482-L486 PolarHBondContact O-N 2.85Å; N483-L486 PolarHBondContact O-N 3.36Å; L486-K488 VanDerWaalsContact C-N 3.27Å; L486-K488 PolarHBondContact O-N 2.93Å; L486-R489 CarbonylContact O-C 3.58Å; L486-R489 PolarHBondContact O-N 2.9Å; L486-L490 HydrophobicContact CD1-CD1 4.02Å; L486-L490 HydrophobicContact CD1-CD2 4.29Å; L486-L490 HydrophobicContact CD1-CG 3.84Å; L486-L490 HydrophobicContact CD2-CD1 4.25Å; L486-L490 HydrophobicContact CG-CD1 3.84Å; L486-L490 HydrophobicContact CG-CG 4.07Å; L486-L490 WeakPolarHBondContact O-CB 3.36Å; L486-L490 WeakPolarHBondContact O-CG 3.38Å; L486-L490 PolarHBondContact O-N 3.28Å; L486-E501 WeakPolarHBondContact CD1-OE2 3.14Å; L486-L520 HydrophobicContact CD2-CB 4.28Å; L486-L520 HydrophobicContact CD2-CD2 3.56Å; L486-M523 HydrophobicContact CB-CE 4.12Å; L486-M523 HydrophobicContact CD2-CE 3.91Å; L486-M523 HydrophobicContact CG-CE 3.85Å; L486-F524 HydrophobicContact CD1-CE2 3.76Å; L486-F524 HydrophobicContact CD1-CZ 4.21Å; L486-F524 HydrophobicContact CD2-CD2 4.24Å; L486-F524 HydrophobicContact CD2-CE2 3.86Å; L486-F524 HydrophobicContact CG-CE2 4.37Å
487	A	89.2	Confident	86.2	Confident	1 Å²	1	25.5 Å²	25.5	1%	0.008	14%	0.137	C	C	.	.	H	α-helix	trans	-57	-42.6	178.4	0	0	0	0	0	111.8	N483 L485 V491 M523 W581 P582 L583	N483-A487 WeakPolarHBondContact O-CB 3.43Å; N483-A487 PolarHBondContact O-N 2.89Å; L485-A487 VanDerWaalsContact C-N 3.35Å; L485-A487 PolarHBondContact O-N 3.27Å; A487-V491 WeakPolarHBondContact O-CB 3.4Å; A487-V491 WeakPolarHBondContact O-CG2 3.37Å; A487-V491 PolarHBondContact O-N 3.13Å; A487-M523 VanDerWaalsContact CA-CE 3.43Å; A487-M523 HydrophobicContact CB-CE 3.59Å; A487-W581 HydrophobicContact CB-CE3 3.89Å; A487-W581 HydrophobicContact CB-CZ3 4.09Å; A487-P582 HydrophobicContact CB-CG 4.01Å; A487-L583 HydrophobicContact CB-CD2 4.17Å
488	K	84.7	Confident	86	Confident	76 Å²	76	31.1 Å²	31.1	33%	0.33	16%	0.163	S	C	.	.	H	α-helix	trans	-69.4	-35.6	175	-69.5	-176.3	179.5	-165.9	0	112.8	K484 L485 L486 G492 D741	K484-K488 WeakPolarHBondContact O-CG 3.19Å; K484-K488 PolarHBondContact O-N 2.9Å; L485-K488 PolarHBondContact O-N 2.78Å; L486-K488 VanDerWaalsContact C-N 3.27Å; L486-K488 PolarHBondContact O-N 2.93Å; K488-G492 WeakPolarHBondContact O-CA 3.42Å; K488-G492 PolarHBondContact O-N 3.14Å; K488-D741 VanDerWaalsContact CE-OD2 3.31Å; K488-D741 WeakPolarHBondContact CE-OD2 3.27Å; K488-D741 IonicContact NZ-OD2 3.81Å; K488-D741 PolarHBondContact NZ-OD2 3.47Å
489	R	88.7	Confident	85.7	Confident	2 Å²	2	36.9 Å²	36.9	1%	0.008	19%	0.194	C	C	.	.	H	α-helix	trans	-66.6	-45.4	174	-69	-165.4	-58.6	-80	0.9	111.8	D443 M446 L485 L486 Q493 L494 S495 E501	D443-R489 VanDerWaalsContact OD1-CD 3.29Å; D443-R489 WeakPolarHBondContact OD1-CD 3.18Å; D443-R489 WeakPolarHBondContact OD1-CG 3.43Å; D443-R489 IonicContact OD1-CZ 3.96Å; D443-R489 IonicContact OD1-NE 2.73Å; D443-R489 IonicContact OD1-NH1 2.65Å; D443-R489 PolarHBondContact OD1-NH1 3.4Å; M446-R489 VanDerWaalsContact CE-NH2 3.32Å; L485-R489 WeakPolarHBondContact O-CG 3.41Å; L485-R489 PolarHBondContact O-N 3.39Å; L486-R489 CarbonylContact O-C 3.58Å; L486-R489 PolarHBondContact O-N 2.9Å; R489-Q493 CarbonylContact O-C 3.59Å; R489-Q493 WeakPolarHBondContact O-CA 3.49Å; R489-Q493 PolarHBondContact O-N 3.11Å; R489-L494 HydrophobicContact CB-CB 4.48Å; R489-L494 HydrophobicContact CG-CB 4.5Å; R489-L494 PolarHBondContact O-N 2.96Å; R489-S495 WeakPolarHBondContact CB-OG 3.39Å; R489-E501 IonicContact CZ-OE1 3.06Å; R489-E501 IonicContact CZ-OE2 3.45Å; R489-E501 IonicContact NE-OE1 3.96Å; R489-E501 PolarHBondContact NE-OE1 2.9Å; R489-E501 IonicContact NE-OE2 3.72Å; R489-E501 IonicContact NH2-OE1 3.14Å; R489-E501 PolarHBondContact NH2-OE1 3.21Å; R489-E501 IonicContact NH2-OE2 2.68Å; R489-E501 PolarHBondContact NH2-OE2 2.64Å
490	L	88.6	Confident	85.6	Confident	19 Å²	19	36.4 Å²	36.4	10%	0.099	19%	0.194	C	C	.	.	H	α-helix	trans	-66	-54.6	-179.7	-70.2	179.1	0	0	0	112.5	L486 G492 Q493 M523 F524 V527 W581	L486-L490 HydrophobicContact CD1-CD1 4.02Å; L486-L490 HydrophobicContact CD1-CD2 4.29Å; L486-L490 HydrophobicContact CD1-CG 3.84Å; L486-L490 HydrophobicContact CD2-CD1 4.25Å; L486-L490 HydrophobicContact CG-CD1 3.84Å; L486-L490 HydrophobicContact CG-CG 4.07Å; L486-L490 WeakPolarHBondContact O-CB 3.36Å; L486-L490 WeakPolarHBondContact O-CG 3.38Å; L486-L490 PolarHBondContact O-N 3.28Å; L490-G492 VanDerWaalsContact C-N 3.27Å; L490-G492 PolarHBondContact O-N 2.92Å; L490-Q493 PolarHBondContact O-N 3.06Å; L490-M523 HydrophobicContact CD1-CB 3.96Å; L490-M523 HydrophobicContact CD1-CE 4.13Å; L490-F524 HydrophobicContact CD1-CD2 4.33Å; L490-F524 HydrophobicContact CD1-CE2 4.34Å; L490-F524 HydrophobicContact CD2-CE1 4.13Å; L490-F524 HydrophobicContact CD2-CE2 4.33Å; L490-F524 HydrophobicContact CD2-CZ 3.95Å; L490-V527 HydrophobicContact CB-CG2 4.09Å; L490-V527 HydrophobicContact CD1-CG2 4.22Å; L490-W581 HydrophobicContact CB-CH2 3.8Å; L490-W581 HydrophobicContact CB-CZ3 4.09Å; L490-W581 HydrophobicContact CD1-CH2 3.78Å; L490-W581 HydrophobicContact CD1-CZ3 4.35Å; L490-W581 HydrophobicContact CG-CH2 4.47Å
491	V	85.6	Confident	85.7	Confident	28 Å²	28	35.3 Å²	35.3	17%	0.17	19%	0.187	C	C	.	.	H	α-helix	trans	-63.7	-35	177.3	175	0	0	0	0	111.5	A487 Q493 L576 W581 L583	A487-V491 WeakPolarHBondContact O-CB 3.4Å; A487-V491 WeakPolarHBondContact O-CG2 3.37Å; A487-V491 PolarHBondContact O-N 3.13Å; V491-Q493 VanDerWaalsContact C-N 3.34Å; V491-L576 HydrophobicContact CG2-CD1 3.83Å; V491-W581 HydrophobicContact CG2-CE3 4.3Å; V491-W581 HydrophobicContact CG2-CH2 4.33Å; V491-W581 HydrophobicContact CG2-CZ3 3.71Å; V491-L583 HydrophobicContact CG2-CD1 3.91Å
492	G	78.8	Confident	85.8	Confident	15 Å²	15	37.2 Å²	37.2	16%	0.155	20%	0.203	C	C	.	.	H	α-helix	trans	-77.9	-12.5	178.5	0	0	0	0	0	115.3	K488 L490	K488-G492 WeakPolarHBondContact O-CA 3.42Å; K488-G492 PolarHBondContact O-N 3.14Å; L490-G492 VanDerWaalsContact C-N 3.27Å; L490-G492 PolarHBondContact O-N 2.92Å
493	Q	81.9	Confident	85.6	Confident	144 Å²	144	38.5 Å²	38.5	67%	0.673	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.9	42.4	-167.9	-59.5	-176.8	-2.7	0	0	114	R489 L490 V491	R489-Q493 CarbonylContact O-C 3.59Å; R489-Q493 WeakPolarHBondContact O-CA 3.49Å; R489-Q493 PolarHBondContact O-N 3.11Å; L490-Q493 PolarHBondContact O-N 3.06Å; V491-Q493 VanDerWaalsContact C-N 3.34Å
494	L	84.7	Confident	85.7	Confident	54 Å²	54	38.1 Å²	38.1	28%	0.283	21%	0.212	S	C	.	.			trans	-103.2	-4.4	-171.9	-52.1	175.7	0	0	0	115.1	R447 K448 R489	R447-L494 CarbonylContact C-O 3.56Å; R447-L494 WeakPolarHBondContact CA-O 3.3Å; R447-L494 HydrophobicContact CG-CB 4.3Å; K448-L494 PolarHBondContact N-O 2.91Å; R489-L494 HydrophobicContact CB-CB 4.48Å; R489-L494 HydrophobicContact CG-CB 4.5Å; R489-L494 PolarHBondContact O-N 2.96Å
495	S	84.6	Confident	85.9	Confident	16 Å²	16	37.3 Å²	37.3	11%	0.112	21%	0.208	C	C	.	.	B	Isolated β-bridge	trans	-67	135.1	178.4	-59	0	0	0	0	112.4	M446 K448 R489 E501	M446-S495 CarbonylContact O-C 3.6Å; M446-S495 WeakPolarHBondContact O-CA 3.43Å; K448-S495 WeakPolarHBondContact CE-O 3.33Å; K448-S495 WeakPolarHBondContact CG-O 3.33Å; R489-S495 WeakPolarHBondContact CB-OG 3.39Å; S495-E501 WeakPolarHBondContact CB-OE1 3.43Å; S495-E501 PolarHBondContact OG-OE1 2.68Å
496	A	81.1	Confident	86	Confident	32 Å²	32	38.8 Å²	38.8	26%	0.264	22%	0.221	S	C	.	.	S	Bend	trans	-67	-48.1	-175.3	0	0	0	0	0	112.8	M446	M446-A496 WeakPolarHBondContact O-CB 3.04Å; M446-A496 PolarHBondContact O-N 2.85Å
497	S	82.7	Confident	85.9	Confident	18 Å²	18	40.4 Å²	40.4	13%	0.126	23%	0.228	C	C	.	.			trans	-141.2	142.2	176.3	176.9	0	0	0	0	108.6	E455 D499 E501	E455-S497 VanDerWaalsContact OE1-CB 3.27Å; E455-S497 WeakPolarHBondContact OE1-CB 3.32Å; E455-S497 PolarHBondContact OE1-OG 3.27Å; S497-D499 VanDerWaalsContact C-N 3.3Å; S497-D499 PolarHBondContact OG-N 3.35Å; S497-E501 WeakPolarHBondContact O-CG 3.35Å
498	E	83.7	Confident	86	Confident	120 Å²	120	40.4 Å²	40.4	56%	0.561	23%	0.228	S	C	*	.	H	α-helix	trans	-73.6	-26.4	175.7	-67.8	-171.7	173.7	0	0	110.6	S502 K531	E498-S502 PolarHBondContact O-N 3.07Å; E498-S502 PolarHBondContact O-OG 2.6Å; E498-K531 IonicContact OE1-NZ 3.87Å; E498-K531 PolarHBondContact OE1-NZ 3.23Å; E498-K531 VanDerWaalsContact OE1-NZ 3.17Å
499	D	83.9	Confident	86.2	Confident	121 Å²	121	39 Å²	39	65%	0.647	22%	0.222	S	C	*	.	H	α-helix	trans	-74.4	-40.5	178.2	-61.8	-45.1	0	0	0	112.2	S497 E501 S502 A503	S497-D499 VanDerWaalsContact C-N 3.3Å; S497-D499 PolarHBondContact OG-N 3.35Å; D499-E501 VanDerWaalsContact C-N 3.32Å; D499-E501 PolarHBondContact O-N 2.92Å; D499-S502 WeakPolarHBondContact O-CB 3.41Å; D499-S502 PolarHBondContact O-N 3.13Å; D499-S502 VanDerWaalsContact O-N 3.14Å; D499-A503 WeakPolarHBondContact O-CB 3.19Å; D499-A503 PolarHBondContact O-N 3.18Å
500	A	84.4	Confident	86	Confident	13 Å²	13	46 Å²	46	11%	0.107	26%	0.255	C	S	.	.	H	α-helix	trans	-61.4	-38.6	176.3	0	0	0	0	0	112.9	I458 M504	I458-A500 HydrophobicContact CG2-CB 3.98Å; A500-M504 PolarHBondContact O-N 3.33Å; A500-M504 VanDerWaalsContact O-N 3.1Å
501	E	87.9	Confident	85.7	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-68.6	-39.4	175.1	-58.9	-97.8	-148.9	0	0	110.7	M446 L486 R489 S495 S497 D499 M504 I505 F524	M446-E501 WeakPolarHBondContact CE-OE2 3.23Å; L486-E501 WeakPolarHBondContact CD1-OE2 3.14Å; R489-E501 IonicContact CZ-OE1 3.06Å; R489-E501 IonicContact CZ-OE2 3.45Å; R489-E501 IonicContact NE-OE1 3.96Å; R489-E501 PolarHBondContact NE-OE1 2.9Å; R489-E501 IonicContact NE-OE2 3.72Å; R489-E501 IonicContact NH2-OE1 3.14Å; R489-E501 PolarHBondContact NH2-OE1 3.21Å; R489-E501 IonicContact NH2-OE2 2.68Å; R489-E501 PolarHBondContact NH2-OE2 2.64Å; S495-E501 WeakPolarHBondContact CB-OE1 3.43Å; S495-E501 PolarHBondContact OG-OE1 2.68Å; S497-E501 WeakPolarHBondContact O-CG 3.35Å; D499-E501 VanDerWaalsContact C-N 3.32Å; D499-E501 PolarHBondContact O-N 2.92Å; E501-M504 PolarHBondContact O-N 2.82Å; E501-I505 WeakPolarHBondContact O-CG1 3.48Å; E501-I505 PolarHBondContact O-N 2.63Å; E501-F524 HydrophobicContact CB-CE1 4.41Å; E501-F524 HydrophobicContact CB-CE2 4.09Å; E501-F524 HydrophobicContact CB-CZ 3.47Å; E501-F524 VanDerWaalsContact CB-CZ 3.47Å; E501-F524 HydrophobicContact CG-CZ 4.13Å
502	S	88	Confident	85.4	Confident	56 Å²	56	47.1 Å²	47.1	39%	0.392	26%	0.263	S	S	.	.	H	α-helix	trans	-65.3	-41.5	176.6	-58.5	0	0	0	0	112.1	E498 D499 I505 S506	E498-S502 PolarHBondContact O-N 3.07Å; E498-S502 PolarHBondContact O-OG 2.6Å; D499-S502 WeakPolarHBondContact O-CB 3.41Å; D499-S502 PolarHBondContact O-N 3.13Å; D499-S502 VanDerWaalsContact O-N 3.14Å; S502-I505 PolarHBondContact O-N 2.99Å; S502-S506 PolarHBondContact O-N 2.84Å
503	A	87.8	Confident	85.4	Confident	29 Å²	29	48 Å²	48	24%	0.24	27%	0.272	C	S	.	.	H	α-helix	trans	-62.1	-41.5	174.1	0	0	0	0	0	111.9	D499 S506 K507	D499-A503 WeakPolarHBondContact O-CB 3.19Å; D499-A503 PolarHBondContact O-N 3.18Å; A503-S506 PolarHBondContact O-N 2.91Å; A503-K507 WeakPolarHBondContact O-CG 3.37Å; A503-K507 PolarHBondContact O-N 3.34Å
504	M	90.3	Very high	85.5	Confident	0 Å²	0	45 Å²	45	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-65.2	-43.1	175.4	-174.6	54.2	177.4	0	0	112.1	M446 L462 V465 M466 F478 Y482 A500 E501 S506 K507 L508	M446-M504 HydrophobicContact SD-CB 4.19Å; M446-M504 HydrophobicContact SD-CG 4.46Å; L462-M504 HydrophobicContact CD1-CB 4.2Å; L462-M504 HydrophobicContact CD2-CB 4.24Å; L462-M504 HydrophobicContact CD2-CG 4.2Å; L462-M504 HydrophobicContact CD2-SD 3.85Å; V465-M504 HydrophobicContact CG1-CE 4.12Å; M466-M504 HydrophobicContact SD-CE 4.08Å; M466-M504 HydrophobicContact SD-SD 4.24Å; F478-M504 HydrophobicContact CE1-CE 4.2Å; F478-M504 HydrophobicContact CZ-CE 3.68Å; Y482-M504 HydrophobicContact CE2-CE 4.28Å; Y482-M504 HydrophobicContact CE2-CG 3.96Å; Y482-M504 WeakPolarHBondContact OH-CG 3.25Å; A500-M504 PolarHBondContact O-N 3.33Å; A500-M504 VanDerWaalsContact O-N 3.1Å; E501-M504 PolarHBondContact O-N 2.82Å; M504-S506 VanDerWaalsContact C-N 3.29Å; M504-S506 PolarHBondContact O-N 2.91Å; M504-K507 PolarHBondContact O-N 2.76Å; M504-L508 HydrophobicContact CE-CD1 4.2Å; M504-L508 HydrophobicContact CE-CD2 3.95Å; M504-L508 HydrophobicContact CE-CG 4.04Å; M504-L508 HydrophobicContact CG-CD1 4.41Å; M504-L508 WeakPolarHBondContact O-CG 3.39Å; M504-L508 PolarHBondContact O-N 2.78Å; M504-L508 HydrophobicContact SD-CG 4.4Å
505	I	89.9	Confident	85.2	Confident	11 Å²	11	48.7 Å²	48.7	6%	0.056	28%	0.277	C	S	.	.	H	α-helix	trans	-59.5	-40.8	174.2	-69.1	167.9	0	0	0	111.1	E501 S502 L508 K509 L520 Q521 F524	E501-I505 WeakPolarHBondContact O-CG1 3.48Å; E501-I505 PolarHBondContact O-N 2.63Å; S502-I505 PolarHBondContact O-N 2.99Å; I505-L508 PolarHBondContact O-N 2.89Å; I505-K509 WeakPolarHBondContact O-CB 3.29Å; I505-K509 PolarHBondContact O-N 2.79Å; I505-L520 HydrophobicContact CD1-CB 4.03Å; I505-L520 HydrophobicContact CG1-CB 4.12Å; I505-L520 HydrophobicContact CG1-CD1 4.26Å; I505-Q521 HydrophobicContact CG2-CG 3.84Å; I505-F524 HydrophobicContact CD1-CD2 3.62Å; I505-F524 HydrophobicContact CD1-CE2 3.61Å
506	S	88.9	Confident	85.1	Confident	60 Å²	60	48.2 Å²	48.2	42%	0.42	27%	0.273	S	S	.	.	H	α-helix	trans	-62.8	-48.5	176.3	-170.2	0	0	0	0	112.4	S502 A503 M504 L508 K509 Q510	S502-S506 PolarHBondContact O-N 2.84Å; A503-S506 PolarHBondContact O-N 2.91Å; M504-S506 VanDerWaalsContact C-N 3.29Å; M504-S506 PolarHBondContact O-N 2.91Å; S506-L508 VanDerWaalsContact C-N 3.32Å; S506-L508 PolarHBondContact O-N 2.86Å; S506-K509 WeakPolarHBondContact O-CB 3.45Å; S506-K509 PolarHBondContact O-N 2.91Å; S506-K509 VanDerWaalsContact O-N 3.14Å; S506-Q510 WeakPolarHBondContact O-CG 3.19Å; S506-Q510 PolarHBondContact O-N 3.28Å
507	K	89.6	Confident	85.5	Confident	33 Å²	33	46.7 Å²	46.7	14%	0.143	26%	0.26	C	S	.	.	H	α-helix	trans	-63.2	-35.3	178	-66.4	177.3	-157.8	-85.2	0	112.4	E459 L462 S463 M466 A503 M504 T511	E459-K507 IonicContact OE1-NZ 3.73Å; E459-K507 PolarHBondContact OE1-NZ 2.82Å; L462-K507 HydrophobicContact CB-CD 4.48Å; S463-K507 PolarHBondContact OG-NZ 2.85Å; S463-K507 VanDerWaalsContact OG-NZ 3.15Å; M466-K507 HydrophobicContact CE-CB 4.44Å; M466-K507 WeakPolarHBondContact CE-O 3.24Å; M466-K507 HydrophobicContact CG-CB 3.95Å; M466-K507 HydrophobicContact CG-CD 4.28Å; M466-K507 HydrophobicContact SD-CB 4.22Å; A503-K507 WeakPolarHBondContact O-CG 3.37Å; A503-K507 PolarHBondContact O-N 3.34Å; M504-K507 PolarHBondContact O-N 2.76Å; K507-T511 PolarHBondContact O-N 3.28Å; K507-T511 PolarHBondContact O-OG1 3.36Å
508	L	90.6	Very high	85.7	Confident	1 Å²	1	49.8 Å²	49.8	1%	0.005	28%	0.275	C	S	.	.	H	α-helix	trans	-66.1	-44.3	171.7	-69.5	175.6	0	0	0	112	M466 F469 F478 Y482 M504 I505 S506 Q510 T511 C512 Y516 T517 L520	M466-L508 HydrophobicContact CE-CD2 4.23Å; M466-L508 HydrophobicContact SD-CD2 4Å; F469-L508 HydrophobicContact CD1-CD2 4.49Å; F469-L508 HydrophobicContact CD2-CD2 4.36Å; F469-L508 HydrophobicContact CE1-CD2 4.03Å; F469-L508 HydrophobicContact CE2-CD2 3.9Å; F469-L508 HydrophobicContact CZ-CD2 3.72Å; F478-L508 HydrophobicContact CE1-CD1 4.11Å; F478-L508 HydrophobicContact CE1-CD2 3.92Å; Y482-L508 HydrophobicContact CE1-CD1 4.3Å; M504-L508 HydrophobicContact CE-CD1 4.2Å; M504-L508 HydrophobicContact CE-CD2 3.95Å; M504-L508 HydrophobicContact CE-CG 4.04Å; M504-L508 HydrophobicContact CG-CD1 4.41Å; M504-L508 WeakPolarHBondContact O-CG 3.39Å; M504-L508 PolarHBondContact O-N 2.78Å; M504-L508 HydrophobicContact SD-CG 4.4Å; I505-L508 PolarHBondContact O-N 2.89Å; S506-L508 VanDerWaalsContact C-N 3.32Å; S506-L508 PolarHBondContact O-N 2.86Å; L508-Q510 VanDerWaalsContact C-N 3.31Å; L508-Q510 PolarHBondContact O-N 3.18Å; L508-T511 PolarHBondContact O-N 2.72Å; L508-T511 VanDerWaalsContact O-N 3.08Å; L508-C512 PolarHBondContact O-N 2.78Å; L508-Y516 HydrophobicContact CB-CD1 4.39Å; L508-Y516 HydrophobicContact CB-CE1 4.39Å; L508-Y516 HydrophobicContact CD1-CE1 4.45Å; L508-Y516 HydrophobicContact CD2-CE1 4.13Å; L508-T517 HydrophobicContact CB-CG2 3.94Å; L508-L520 HydrophobicContact CD1-CD1 4.08Å
509	K	88	Confident	85.9	Confident	48 Å²	48	47.3 Å²	47.3	21%	0.209	26%	0.262	C	S	.	.	H	α-helix	trans	-59.4	-41.1	176.6	-177	-179.5	173.7	-175.3	0	111.6	I505 S506 T511 G513 T517 Q1280	I505-K509 WeakPolarHBondContact O-CB 3.29Å; I505-K509 PolarHBondContact O-N 2.79Å; S506-K509 WeakPolarHBondContact O-CB 3.45Å; S506-K509 PolarHBondContact O-N 2.91Å; S506-K509 VanDerWaalsContact O-N 3.14Å; K509-T511 VanDerWaalsContact C-N 3.26Å; K509-T511 PolarHBondContact O-N 3.03Å; K509-G513 CarbonylContact O-C 3.6Å; K509-G513 WeakPolarHBondContact O-CA 3.2Å; K509-G513 PolarHBondContact O-N 2.92Å; K509-T517 HydrophobicContact CB-CG2 3.9Å; K509-Q1280 VanDerWaalsContact NZ-OE1 3.09Å
510	Q	85.7	Confident	86.3	Confident	149 Å²	149	41.6 Å²	41.6	70%	0.696	23%	0.231	S	C	*	.	H	α-helix	trans	-64.1	-27.3	176.2	-71.9	174.5	-9.5	0	0	113.6	S506 L508	S506-Q510 WeakPolarHBondContact O-CG 3.19Å; S506-Q510 PolarHBondContact O-N 3.28Å; L508-Q510 VanDerWaalsContact C-N 3.31Å; L508-Q510 PolarHBondContact O-N 3.18Å
511	T	81.7	Confident	86.5	Confident	47 Å²	47	44.3 Å²	44.3	29%	0.288	24%	0.242	S	C	.	.	H	α-helix	trans	-100.1	-32.6	-173.4	-52.6	0	0	0	0	113.6	M466 F469 K470 K507 L508 K509	M466-T511 HydrophobicContact CE-CG2 4.16Å; M466-T511 WeakPolarHBondContact CE-OG1 2.97Å; F469-T511 HydrophobicContact CD1-CG2 3.9Å; F469-T511 HydrophobicContact CE1-CG2 3.87Å; K470-T511 HydrophobicContact CG-CG2 3.95Å; K507-T511 PolarHBondContact O-N 3.28Å; K507-T511 PolarHBondContact O-OG1 3.36Å; L508-T511 PolarHBondContact O-N 2.72Å; L508-T511 VanDerWaalsContact O-N 3.08Å; K509-T511 VanDerWaalsContact C-N 3.26Å; K509-T511 PolarHBondContact O-N 3.03Å
512	C	79.3	Confident	86.6	Confident	23 Å²	23	50.3 Å²	50.3	16%	0.155	26%	0.264	C	S	.	.	H	α-helix	trans	-117.4	-1.2	-178.3	-68.4	0	0	0	0	114.4	F469 L508 Y516	F469-C512 WeakPolarHBondContact CE1-SG 3.42Å; F469-C512 VanDerWaalsContact CZ-SG 3.54Å; L508-C512 PolarHBondContact O-N 2.78Å; C512-Y516 HydrophobicContact CB-CD1 3.6Å; C512-Y516 HydrophobicContact CB-CD2 3.9Å; C512-Y516 HydrophobicContact CB-CE1 4.26Å; C512-Y516 HydrophobicContact CB-CE2 4.49Å; C512-Y516 HydrophobicContact CB-CG 3.39Å
513	G	78.6	Confident	86.8	Confident	32 Å²	32	47.6 Å²	47.6	33%	0.33	25%	0.246	S	C	.	.			trans	81.8	-178.7	-175.6	0	0	0	0	0	114.1	K509	K509-G513 CarbonylContact O-C 3.6Å; K509-G513 WeakPolarHBondContact O-CA 3.2Å; K509-G513 PolarHBondContact O-N 2.92Å
514	F	83.3	Confident	86.8	Confident	81 Å²	81	48.2 Å²	48.2	36%	0.355	24%	0.243	S	C	.	.	S	Bend	trans	-66.9	-47.1	-173.7	178.2	-105.8	0	0	0	113.3	Y516 T517 I518	F514-Y516 PolarHBondContact O-N 3.49Å; F514-Y516 VanDerWaalsContact O-N 3.11Å; F514-T517 PolarHBondContact O-N 3.1Å; F514-T517 PolarHBondContact O-OG1 3.41Å; F514-I518 HydrophobicContact CE1-CD1 4.06Å; F514-I518 HydrophobicContact CE1-CG1 4.35Å; F514-I518 HydrophobicContact CZ-CD1 4.49Å; F514-I518 HydrophobicContact CZ-CG1 4.39Å; F514-I518 PolarHBondContact O-N 2.77Å
515	D	78.6	Confident	86.7	Confident	133 Å²	133	50.7 Å²	50.7	71%	0.711	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.2	-34	-174.8	-65.4	-25.7	0	0	0	113.1	T517 I518	D515-T517 VanDerWaalsContact C-N 3.26Å; D515-T517 PolarHBondContact O-N 2.73Å; D515-I518 VanDerWaalsContact O-CG2 3.31Å; D515-I518 WeakPolarHBondContact O-CG2 3.31Å
516	Y	83.6	Confident	86.8	Confident	5 Å²	5	50.7 Å²	50.7	2%	0.02	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-23.5	177.1	-171.1	-99	0	0	0	113.8	F469 K475 F478 E479 L508 C512 F514 L787	F469-Y516 WeakPolarHBondContact CE2-OH 3.28Å; F469-Y516 AromaticContact CZ-CE1 3.97Å; F469-Y516 HydrophobicContact CZ-CE1 3.97Å; F469-Y516 AromaticContact CZ-CZ 3.87Å; K475-Y516 HydrophobicContact CB-CE2 4.31Å; K475-Y516 PolarHBondContact O-OH 3.04Å; F478-Y516 WeakPolarHBondContact CD1-OH 3.34Å; E479-Y516 HydrophobicContact CB-CD2 4.41Å; E479-Y516 HydrophobicContact CB-CE1 4.45Å; E479-Y516 HydrophobicContact CB-CE2 3.64Å; E479-Y516 HydrophobicContact CG-CD2 4.18Å; E479-Y516 HydrophobicContact CG-CE1 4.3Å; E479-Y516 HydrophobicContact CG-CE2 3.87Å; E479-Y516 PolarHBondContact N-OH 2.97Å; L508-Y516 HydrophobicContact CB-CD1 4.39Å; L508-Y516 HydrophobicContact CB-CE1 4.39Å; L508-Y516 HydrophobicContact CD1-CE1 4.45Å; L508-Y516 HydrophobicContact CD2-CE1 4.13Å; C512-Y516 HydrophobicContact CB-CD1 3.6Å; C512-Y516 HydrophobicContact CB-CD2 3.9Å; C512-Y516 HydrophobicContact CB-CE1 4.26Å; C512-Y516 HydrophobicContact CB-CE2 4.49Å; C512-Y516 HydrophobicContact CB-CG 3.39Å; F514-Y516 PolarHBondContact O-N 3.49Å; F514-Y516 VanDerWaalsContact O-N 3.11Å; Y516-L787 HydrophobicContact CD2-CD2 3.52Å; Y516-L787 HydrophobicContact CE2-CD2 4.14Å; Y516-L787 HydrophobicContact CG-CD2 4.47Å
517	T	88.7	Confident	86.7	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.9	-6.1	-173.3	61.5	0	0	0	0	114.5	L508 K509 F514 D515 K519 L520 Q521	L508-T517 HydrophobicContact CB-CG2 3.94Å; K509-T517 HydrophobicContact CB-CG2 3.9Å; F514-T517 PolarHBondContact O-N 3.1Å; F514-T517 PolarHBondContact O-OG1 3.41Å; D515-T517 VanDerWaalsContact C-N 3.26Å; D515-T517 PolarHBondContact O-N 2.73Å; T517-K519 VanDerWaalsContact C-N 3.34Å; T517-K519 PolarHBondContact O-N 2.75Å; T517-L520 WeakPolarHBondContact O-CB 3.38Å; T517-L520 PolarHBondContact O-N 3.44Å; T517-L520 VanDerWaalsContact O-N 3.16Å; T517-Q521 PolarHBondContact O-N 3.19Å
518	I	88.1	Confident	86.6	Confident	84 Å²	84	55.2 Å²	55.2	43%	0.431	27%	0.265	S	S	.	.	H	α-helix	trans	-59.3	-39.5	-172.1	-163	172.5	0	0	0	113.3	F514 D515 R522	F514-I518 HydrophobicContact CE1-CD1 4.06Å; F514-I518 HydrophobicContact CE1-CG1 4.35Å; F514-I518 HydrophobicContact CZ-CD1 4.49Å; F514-I518 HydrophobicContact CZ-CG1 4.39Å; F514-I518 PolarHBondContact O-N 2.77Å; D515-I518 VanDerWaalsContact O-CG2 3.31Å; D515-I518 WeakPolarHBondContact O-CG2 3.31Å; I518-R522 WeakPolarHBondContact O-CB 3.32Å; I518-R522 PolarHBondContact O-N 2.73Å
519	K	87.7	Confident	86.4	Confident	67 Å²	67	59.1 Å²	59.1	29%	0.291	29%	0.289	S	S	.	.	H	α-helix	trans	-64.3	-47.8	176.9	-64.7	174.6	-169.4	157.3	0	111.1	E479 T517 R522 M523 D752	E479-K519 IonicContact OE1-NZ 2.7Å; E479-K519 PolarHBondContact OE1-NZ 2.77Å; E479-K519 VanDerWaalsContact OE1-NZ 3.15Å; T517-K519 VanDerWaalsContact C-N 3.34Å; T517-K519 PolarHBondContact O-N 2.75Å; K519-R522 PolarHBondContact O-N 2.77Å; K519-M523 VanDerWaalsContact O-CG 3.29Å; K519-M523 WeakPolarHBondContact O-CG 3.37Å; K519-M523 PolarHBondContact O-N 3.42Å; K519-D752 IonicContact NZ-OD2 2.84Å
520	L	90.8	Very high	86.4	Confident	1 Å²	1	56.9 Å²	56.9	1%	0.005	28%	0.279	C	S	.	.	H	α-helix	trans	-59.6	-48.8	179.4	-57.9	172.2	0	0	0	111.7	Y482 N483 L486 I505 L508 T517 R522 M523 F524	Y482-L520 HydrophobicContact CD1-CD1 3.99Å; Y482-L520 HydrophobicContact CD1-CD2 3.67Å; Y482-L520 HydrophobicContact CE1-CD1 3.91Å; Y482-L520 HydrophobicContact CE1-CD2 3.84Å; N483-L520 HydrophobicContact CB-CD2 4.43Å; N483-L520 WeakPolarHBondContact OD1-CD2 2.81Å; N483-L520 WeakPolarHBondContact OD1-CG 3.25Å; L486-L520 HydrophobicContact CD2-CB 4.28Å; L486-L520 HydrophobicContact CD2-CD2 3.56Å; I505-L520 HydrophobicContact CD1-CB 4.03Å; I505-L520 HydrophobicContact CG1-CB 4.12Å; I505-L520 HydrophobicContact CG1-CD1 4.26Å; L508-L520 HydrophobicContact CD1-CD1 4.08Å; T517-L520 WeakPolarHBondContact O-CB 3.38Å; T517-L520 PolarHBondContact O-N 3.44Å; T517-L520 VanDerWaalsContact O-N 3.16Å; L520-R522 VanDerWaalsContact C-N 3.31Å; L520-R522 PolarHBondContact O-N 3.04Å; L520-M523 PolarHBondContact O-N 2.63Å; L520-F524 PolarHBondContact O-N 2.74Å
521	Q	89.5	Confident	86.5	Confident	70 Å²	70	54.3 Å²	54.3	33%	0.327	27%	0.265	S	S	.	.	H	α-helix	trans	-61.7	-39.7	177.5	-69.9	-175.9	-21.4	0	0	111.7	I505 T517 F524 N525	I505-Q521 HydrophobicContact CG2-CG 3.84Å; T517-Q521 PolarHBondContact O-N 3.19Å; Q521-F524 PolarHBondContact O-N 2.78Å; Q521-N525 PolarHBondContact O-N 3.45Å; Q521-N525 VanDerWaalsContact O-N 3.15Å
522	R	90.6	Very high	86.7	Confident	126 Å²	126	55 Å²	55	48%	0.475	27%	0.272	S	S	.	.	H	α-helix	trans	-66	-39.1	178	-173.9	62.3	-168.7	-140.9	3.7	112.6	I518 K519 L520 N525 D526 A580	I518-R522 WeakPolarHBondContact O-CB 3.32Å; I518-R522 PolarHBondContact O-N 2.73Å; K519-R522 PolarHBondContact O-N 2.77Å; L520-R522 VanDerWaalsContact C-N 3.31Å; L520-R522 PolarHBondContact O-N 3.04Å; R522-N525 PolarHBondContact O-N 2.82Å; R522-D526 IonicContact CZ-OD1 3.88Å; R522-D526 IonicContact NE-OD1 3.53Å; R522-D526 PolarHBondContact NE-OD1 3.1Å; R522-D526 IonicContact NH2-OD1 3.55Å; R522-D526 PolarHBondContact O-N 3.48Å; R522-A580 HydrophobicContact CB-CB 3.77Å; R522-A580 HydrophobicContact CG-CB 3.56Å
523	M	91.4	Very high	87	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-61	-44	175.8	-68.3	164.2	51.6	0	0	112	L486 A487 L490 K519 L520 N525 D526 V527 A580 W581	L486-M523 HydrophobicContact CB-CE 4.12Å; L486-M523 HydrophobicContact CD2-CE 3.91Å; L486-M523 HydrophobicContact CG-CE 3.85Å; A487-M523 VanDerWaalsContact CA-CE 3.43Å; A487-M523 HydrophobicContact CB-CE 3.59Å; L490-M523 HydrophobicContact CD1-CB 3.96Å; L490-M523 HydrophobicContact CD1-CE 4.13Å; K519-M523 VanDerWaalsContact O-CG 3.29Å; K519-M523 WeakPolarHBondContact O-CG 3.37Å; K519-M523 PolarHBondContact O-N 3.42Å; L520-M523 PolarHBondContact O-N 2.63Å; M523-N525 VanDerWaalsContact C-N 3.34Å; M523-N525 PolarHBondContact O-N 2.77Å; M523-D526 PolarHBondContact O-N 2.93Å; M523-V527 WeakPolarHBondContact O-CG2 3.45Å; M523-V527 PolarHBondContact O-N 2.86Å; M523-A580 HydrophobicContact CG-CB 4.35Å; M523-W581 HydrophobicContact CB-CD2 4.38Å; M523-W581 HydrophobicContact CB-CH2 4.1Å; M523-W581 HydrophobicContact CB-CZ2 3.72Å; M523-W581 HydrophobicContact CE-CE3 4.11Å; M523-W581 HydrophobicContact CE-CZ3 4.06Å; M523-W581 HydrophobicContact CG-CD2 3.83Å; M523-W581 HydrophobicContact CG-CE3 4.25Å; M523-W581 HydrophobicContact CG-CG 4.18Å; M523-W581 HydrophobicContact CG-CZ2 4.11Å; M523-W581 VanDerWaalsContact O-CZ2 3.23Å; M523-W581 WeakPolarHBondContact O-CZ2 3.36Å
524	F	88	Confident	87.3	Confident	41 Å²	41	53.8 Å²	53.8	18%	0.18	26%	0.258	C	S	.	.	H	α-helix	trans	-59	-44	173.9	-94.8	-88.2	0	0	0	112.6	L486 L490 E501 I505 L520 Q521 V527 R528	L486-F524 HydrophobicContact CD1-CE2 3.76Å; L486-F524 HydrophobicContact CD1-CZ 4.21Å; L486-F524 HydrophobicContact CD2-CD2 4.24Å; L486-F524 HydrophobicContact CD2-CE2 3.86Å; L486-F524 HydrophobicContact CG-CE2 4.37Å; L490-F524 HydrophobicContact CD1-CD2 4.33Å; L490-F524 HydrophobicContact CD1-CE2 4.34Å; L490-F524 HydrophobicContact CD2-CE1 4.13Å; L490-F524 HydrophobicContact CD2-CE2 4.33Å; L490-F524 HydrophobicContact CD2-CZ 3.95Å; E501-F524 HydrophobicContact CB-CE1 4.41Å; E501-F524 HydrophobicContact CB-CE2 4.09Å; E501-F524 HydrophobicContact CB-CZ 3.47Å; E501-F524 VanDerWaalsContact CB-CZ 3.47Å; E501-F524 HydrophobicContact CG-CZ 4.13Å; I505-F524 HydrophobicContact CD1-CD2 3.62Å; I505-F524 HydrophobicContact CD1-CE2 3.61Å; L520-F524 PolarHBondContact O-N 2.74Å; Q521-F524 PolarHBondContact O-N 2.78Å; F524-V527 PolarHBondContact O-N 2.72Å; F524-R528 PolarHBondContact O-N 3.03Å
525	N	89.3	Confident	87.4	Confident	53 Å²	53	55.8 Å²	55.8	28%	0.283	27%	0.268	S	S	.	.	H	α-helix	trans	-66.3	-42.1	179.4	-165.2	43.3	0	0	0	112.6	Q521 R522 M523 V527 R528 V529	Q521-N525 PolarHBondContact O-N 3.45Å; Q521-N525 VanDerWaalsContact O-N 3.15Å; R522-N525 PolarHBondContact O-N 2.82Å; M523-N525 VanDerWaalsContact C-N 3.34Å; M523-N525 PolarHBondContact O-N 2.77Å; N525-V527 VanDerWaalsContact C-N 3.32Å; N525-V527 PolarHBondContact O-N 2.99Å; N525-R528 PolarHBondContact O-N 3.47Å; N525-R528 PolarHBondContact OD1-NH2 3.29Å; N525-V529 WeakPolarHBondContact O-CG2 3.45Å; N525-V529 PolarHBondContact O-N 2.95Å
526	D	90.5	Very high	87.7	Confident	11 Å²	11	52 Å²	52	6%	0.059	25%	0.246	C	C	.	.	H	α-helix	trans	-61.9	-37.1	178.4	-73.3	-7.2	0	0	0	112.1	R522 M523 S530 S577 W581	R522-D526 IonicContact CZ-OD1 3.88Å; R522-D526 IonicContact NE-OD1 3.53Å; R522-D526 PolarHBondContact NE-OD1 3.1Å; R522-D526 IonicContact NH2-OD1 3.55Å; R522-D526 PolarHBondContact O-N 3.48Å; M523-D526 PolarHBondContact O-N 2.93Å; D526-S530 VanDerWaalsContact O-CB 3.29Å; D526-S530 WeakPolarHBondContact O-CB 3.34Å; D526-S530 PolarHBondContact O-N 3.01Å; D526-S530 PolarHBondContact O-OG 2.73Å; D526-S577 WeakPolarHBondContact OD2-CB 3.48Å; D526-S577 PolarHBondContact OD2-N 3.06Å; D526-S577 PolarHBondContact OD2-OG 2.75Å; D526-W581 HydrophobicContact CB-CZ2 4.18Å; D526-W581 PolarHBondContact OD2-NE1 3.44Å
527	V	88.1	Confident	87.7	Confident	16 Å²	16	52.4 Å²	52.4	10%	0.097	25%	0.248	C	C	.	.	H	α-helix	trans	-63.8	-46.1	173.3	174	0	0	0	0	111.2	L490 M523 F524 N525 S530 K531 W581	L490-V527 HydrophobicContact CB-CG2 4.09Å; L490-V527 HydrophobicContact CD1-CG2 4.22Å; M523-V527 WeakPolarHBondContact O-CG2 3.45Å; M523-V527 PolarHBondContact O-N 2.86Å; F524-V527 PolarHBondContact O-N 2.72Å; N525-V527 VanDerWaalsContact C-N 3.32Å; N525-V527 PolarHBondContact O-N 2.99Å; V527-S530 WeakPolarHBondContact O-CB 3.34Å; V527-S530 PolarHBondContact O-N 3.38Å; V527-K531 PolarHBondContact O-N 3.02Å; V527-W581 HydrophobicContact CG2-CH2 3.61Å; V527-W581 HydrophobicContact CG2-CZ2 3.78Å
528	R	86.2	Confident	87.4	Confident	172 Å²	172	56.4 Å²	56.4	65%	0.649	27%	0.266	S	S	*	.	H	α-helix	trans	-62	-46.3	179.6	-177.1	173.5	61.4	-179.1	-0.7	111.7	F524 N525 S530 K531 S532	F524-R528 PolarHBondContact O-N 3.03Å; N525-R528 PolarHBondContact O-N 3.47Å; N525-R528 PolarHBondContact OD1-NH2 3.29Å; R528-S530 VanDerWaalsContact C-N 3.33Å; R528-S530 PolarHBondContact O-N 3.24Å; R528-K531 PolarHBondContact O-N 3.47Å; R528-S532 PolarHBondContact O-N 3.01Å
529	V	87.5	Confident	87	Confident	82 Å²	82	57.2 Å²	57.2	50%	0.497	27%	0.267	S	S	.	.	H	α-helix	trans	-63.2	-38.9	175.7	173.2	0	0	0	0	111.3	N525 S532 L533	N525-V529 WeakPolarHBondContact O-CG2 3.45Å; N525-V529 PolarHBondContact O-N 2.95Å; V529-S532 PolarHBondContact O-N 2.76Å; V529-L533 WeakPolarHBondContact O-CB 3.09Å; V529-L533 PolarHBondContact O-N 3.29Å
530	S	88.3	Confident	86.5	Confident	1 Å²	1	57.3 Å²	57.3	1%	0.007	27%	0.273	C	S	.	.	H	α-helix	trans	-63.8	-40.1	177.2	-66	0	0	0	0	113.8	D526 V527 R528 L533 C534 V575	D526-S530 VanDerWaalsContact O-CB 3.29Å; D526-S530 WeakPolarHBondContact O-CB 3.34Å; D526-S530 PolarHBondContact O-N 3.01Å; D526-S530 PolarHBondContact O-OG 2.73Å; V527-S530 WeakPolarHBondContact O-CB 3.34Å; V527-S530 PolarHBondContact O-N 3.38Å; R528-S530 VanDerWaalsContact C-N 3.33Å; R528-S530 PolarHBondContact O-N 3.24Å; S530-L533 PolarHBondContact O-N 3.03Å; S530-C534 PolarHBondContact O-N 3.36Å; S530-C534 VanDerWaalsContact O-N 3.09Å; S530-V575 PolarHBondContact OG-N 2.84Å; S530-V575 PolarHBondContact OG-O 3.47Å
531	K	86.6	Confident	85.5	Confident	95 Å²	95	61.4 Å²	61.4	41%	0.413	29%	0.293	S	S	.	.	H	α-helix	trans	-57.3	-50.8	175.4	-71.3	174.9	-177.5	173.2	0	110	E498 V527 R528 C534 E535	E498-K531 IonicContact OE1-NZ 3.87Å; E498-K531 PolarHBondContact OE1-NZ 3.23Å; E498-K531 VanDerWaalsContact OE1-NZ 3.17Å; V527-K531 PolarHBondContact O-N 3.02Å; R528-K531 PolarHBondContact O-N 3.47Å; K531-C534 WeakPolarHBondContact O-CB 3.38Å; K531-C534 PolarHBondContact O-N 3.14Å; K531-E535 PolarHBondContact O-N 2.85Å
532	S	85.7	Confident	84.5	Confident	62 Å²	62	63.2 Å²	63.2	43%	0.434	31%	0.306	S	S	.	.	H	α-helix	trans	-61	-47	177.9	178.2	0	0	0	0	113	R528 V529 C534 E535 E536	R528-S532 PolarHBondContact O-N 3.01Å; V529-S532 PolarHBondContact O-N 2.76Å; S532-C534 VanDerWaalsContact C-N 3.26Å; S532-C534 PolarHBondContact O-N 3.46Å; S532-E535 PolarHBondContact O-N 3.48Å; S532-E535 VanDerWaalsContact O-N 3.08Å; S532-E536 WeakPolarHBondContact O-CG 3.45Å; S532-E536 PolarHBondContact O-N 3Å
533	L	86.8	Confident	83	Confident	10 Å²	10	63.5 Å²	63.5	5%	0.052	31%	0.31	C	S	.	.	H	α-helix	trans	-60.2	-33.8	179	-177.5	68.2	0	0	0	113	V529 S530 Y537 V575 F602 Y605 Y606	V529-L533 WeakPolarHBondContact O-CB 3.09Å; V529-L533 PolarHBondContact O-N 3.29Å; S530-L533 PolarHBondContact O-N 3.03Å; L533-Y537 WeakPolarHBondContact O-CB 3.45Å; L533-Y537 PolarHBondContact O-N 3.12Å; L533-Y537 VanDerWaalsContact O-N 3.08Å; L533-V575 HydrophobicContact CD2-CB 4.22Å; L533-V575 HydrophobicContact CD2-CG2 3.69Å; L533-F602 HydrophobicContact CD2-CZ 3.98Å; L533-F602 HydrophobicContact CG-CZ 4.36Å; L533-Y605 HydrophobicContact CD1-CE1 3.83Å; L533-Y605 HydrophobicContact CG-CE1 4.49Å; L533-Y606 HydrophobicContact CD2-CD2 3.85Å; L533-Y606 HydrophobicContact CD2-CE2 3.82Å
534	C	85.3	Confident	81.3	Confident	19 Å²	19	66.7 Å²	66.7	13%	0.128	33%	0.333	C	S	.	.	H	α-helix	trans	-67.4	-43	173.1	-86.2	0	0	0	0	112.9	S530 K531 S532 E536 Y537 K538 V573	S530-C534 PolarHBondContact O-N 3.36Å; S530-C534 VanDerWaalsContact O-N 3.09Å; K531-C534 WeakPolarHBondContact O-CB 3.38Å; K531-C534 PolarHBondContact O-N 3.14Å; S532-C534 VanDerWaalsContact C-N 3.26Å; S532-C534 PolarHBondContact O-N 3.46Å; C534-E536 VanDerWaalsContact C-N 3.35Å; C534-Y537 PolarHBondContact O-N 2.43Å; C534-K538 WeakPolarHBondContact O-CG 3.38Å; C534-K538 PolarHBondContact O-N 2.84Å; C534-V573 PolarHBondContact SG-N 3.21Å; C534-V573 PolarHBondContact SG-O 3.06Å
535	E	84	Confident	79.5	Confident	123 Å²	123	70.2 Å²	70.2	58%	0.575	36%	0.357	S	S	*	.	H	α-helix	trans	-63.6	-42.2	178.3	-70.4	168.6	-174.1	0	0	111	K531 S532 K538 Q539	K531-E535 PolarHBondContact O-N 2.85Å; S532-E535 PolarHBondContact O-N 3.48Å; S532-E535 VanDerWaalsContact O-N 3.08Å; E535-K538 PolarHBondContact O-N 2.86Å; E535-Q539 WeakPolarHBondContact O-CG 3.39Å; E535-Q539 PolarHBondContact O-N 2.73Å
536	E	85.2	Confident	77.2	Confident	53 Å²	53	72.9 Å²	72.9	25%	0.248	38%	0.379	C	S	.	.	H	α-helix	trans	-61.2	-45.7	173.1	-65.4	-176.3	125.7	0	0	112.5	S532 C534 K538 Q539 V540 Y605 R609	S532-E536 WeakPolarHBondContact O-CG 3.45Å; S532-E536 PolarHBondContact O-N 3Å; C534-E536 VanDerWaalsContact C-N 3.35Å; E536-K538 VanDerWaalsContact C-N 3.33Å; E536-K538 PolarHBondContact O-N 3.05Å; E536-Q539 PolarHBondContact O-N 2.94Å; E536-V540 WeakPolarHBondContact O-CG2 3.44Å; E536-V540 PolarHBondContact O-N 2.84Å; E536-Y605 WeakPolarHBondContact CB-OH 3.35Å; E536-R609 VanDerWaalsContact CD-CZ 3.42Å; E536-R609 VanDerWaalsContact CD-NH2 3.28Å; E536-R609 IonicContact OE1-CZ 3.71Å; E536-R609 IonicContact OE1-NH1 2.76Å; E536-R609 PolarHBondContact OE1-NH1 3.42Å; E536-R609 IonicContact OE1-NH2 2.72Å; E536-R609 PolarHBondContact OE1-NH2 3.09Å; E536-R609 IonicContact OE2-CZ 2.68Å; E536-R609 IonicContact OE2-NE 3.21Å; E536-R609 IonicContact OE2-NH1 3.74Å; E536-R609 PolarHBondContact OE2-NH1 3.41Å; E536-R609 IonicContact OE2-NH2 3.95Å; E536-R609 PolarHBondContact OE2-NH2 2.73Å; E536-R609 VanDerWaalsContact OE2-NH2 3.09Å
537	Y	84.7	Confident	74.8	Confident	14 Å²	14	81.1 Å²	81.1	6%	0.055	41%	0.414	C	S	.	.	H	α-helix	trans	-60.1	-43.3	177.2	178.4	-110.4	0	0	0	111.5	L533 C534 Q539 V540 M541 F571 F602 Y605	L533-Y537 WeakPolarHBondContact O-CB 3.45Å; L533-Y537 PolarHBondContact O-N 3.12Å; L533-Y537 VanDerWaalsContact O-N 3.08Å; C534-Y537 PolarHBondContact O-N 2.43Å; Y537-Q539 PolarHBondContact O-N 2.94Å; Y537-V540 PolarHBondContact O-N 2.99Å; Y537-M541 HydrophobicContact CD1-CG 4.48Å; Y537-M541 HydrophobicContact CD2-CG 4.47Å; Y537-M541 HydrophobicContact CE1-CG 4.12Å; Y537-M541 HydrophobicContact CE2-CG 4.12Å; Y537-M541 HydrophobicContact CE2-SD 4.22Å; Y537-M541 WeakPolarHBondContact O-CG 3.4Å; Y537-M541 PolarHBondContact O-N 2.8Å; Y537-F571 HydrophobicContact CE1-CD1 4.17Å; Y537-F602 AromaticContact CD1-CD2 3.93Å; Y537-F602 HydrophobicContact CD1-CD2 3.93Å; Y537-F602 AromaticContact CD2-CD2 3.91Å; Y537-F602 HydrophobicContact CD2-CD2 3.91Å; Y537-F602 HydrophobicContact CE1-CD2 4.14Å; Y537-F602 HydrophobicContact CE2-CB 4.29Å; Y537-F602 HydrophobicContact CE2-CD2 4.12Å; Y537-F602 AromaticContact CG-CD2 3.8Å; Y537-F602 HydrophobicContact CG-CD2 3.8Å; Y537-F602 HydrophobicContact CG-CE2 4.23Å; Y537-Y605 AromaticContact CD2-CD1 3.54Å; Y537-Y605 HydrophobicContact CD2-CD1 3.54Å; Y537-Y605 HydrophobicContact CD2-CD2 4.25Å; Y537-Y605 HydrophobicContact CD2-CE1 4.07Å; Y537-Y605 AromaticContact CD2-CG 3.65Å; Y537-Y605 HydrophobicContact CD2-CG 3.65Å; Y537-Y605 HydrophobicContact CE2-CD1 4.35Å; Y537-Y605 HydrophobicContact CE2-CG 4.19Å; Y537-Y605 HydrophobicContact CG-CD1 4.25Å; Y537-Y605 HydrophobicContact CG-CE1 4.43Å
538	K	81	Confident	72.2	Confident	85 Å²	85	85.5 Å²	85.5	37%	0.37	44%	0.437	S	S	.	.	H	α-helix	trans	-58.7	-46.8	174	-74	-174.2	172.3	-163.1	0	111.5	C534 E535 E536 V540 M541 D542 D570	C534-K538 WeakPolarHBondContact O-CG 3.38Å; C534-K538 PolarHBondContact O-N 2.84Å; E535-K538 PolarHBondContact O-N 2.86Å; E536-K538 VanDerWaalsContact C-N 3.33Å; E536-K538 PolarHBondContact O-N 3.05Å; K538-V540 VanDerWaalsContact C-N 3.33Å; K538-V540 PolarHBondContact O-N 3.43Å; K538-M541 PolarHBondContact O-N 3.42Å; K538-D542 PolarHBondContact O-N 3.23Å; K538-D570 WeakPolarHBondContact CE-OD1 3.28Å; K538-D570 IonicContact NZ-OD1 2.71Å; K538-D570 PolarHBondContact NZ-OD1 2.71Å; K538-D570 IonicContact NZ-OD2 3.79Å
539	Q	79.9	Confident	70.1	Confident	100 Å²	100	81.8 Å²	81.8	47%	0.467	44%	0.443	S	S	.	.	H	α-helix	trans	-61.6	-35.2	176.2	-69.2	179	35.5	0	0	114	E535 E536 Y537 K543	E535-Q539 WeakPolarHBondContact O-CG 3.39Å; E535-Q539 PolarHBondContact O-N 2.73Å; E536-Q539 PolarHBondContact O-N 2.94Å; Y537-Q539 PolarHBondContact O-N 2.94Å; Q539-K543 WeakPolarHBondContact O-CB 3.4Å; Q539-K543 WeakPolarHBondContact O-CD 3.47Å; Q539-K543 VanDerWaalsContact O-CG 3.25Å; Q539-K543 WeakPolarHBondContact O-CG 3.39Å; Q539-K543 PolarHBondContact O-N 3.24Å
540	V	77.2	Confident	68	Low	69 Å²	69	81.7 Å²	81.7	42%	0.418	45%	0.451	S	S	.	.	H	α-helix	trans	-69.9	-39.7	176.6	170.9	0	0	0	0	111	E536 Y537 K538 K543 S544 Y605	E536-V540 WeakPolarHBondContact O-CG2 3.44Å; E536-V540 PolarHBondContact O-N 2.84Å; Y537-V540 PolarHBondContact O-N 2.99Å; K538-V540 VanDerWaalsContact C-N 3.33Å; K538-V540 PolarHBondContact O-N 3.43Å; V540-K543 PolarHBondContact O-N 2.77Å; V540-S544 WeakPolarHBondContact O-CB 3.39Å; V540-S544 PolarHBondContact O-N 3.14Å; V540-S544 PolarHBondContact O-OG 3.21Å; V540-Y605 HydrophobicContact CG2-CE2 4.22Å
541	M	70.2	Confident	65.8	Low	87 Å²	87	87.8 Å²	87.8	43%	0.429	48%	0.478	S	S	.	.	H	α-helix	trans	-64.3	-44.9	173.9	-66.4	-63.4	-74.9	0	0	111.2	Y537 K538 K543 S544 V545	Y537-M541 HydrophobicContact CD1-CG 4.48Å; Y537-M541 HydrophobicContact CD2-CG 4.47Å; Y537-M541 HydrophobicContact CE1-CG 4.12Å; Y537-M541 HydrophobicContact CE2-CG 4.12Å; Y537-M541 HydrophobicContact CE2-SD 4.22Å; Y537-M541 WeakPolarHBondContact O-CG 3.4Å; Y537-M541 PolarHBondContact O-N 2.8Å; K538-M541 PolarHBondContact O-N 3.42Å; M541-K543 PolarHBondContact O-N 3.12Å; M541-S544 PolarHBondContact O-N 3.33Å; M541-S544 PolarHBondContact O-OG 3.15Å; M541-V545 WeakPolarHBondContact O-CG2 3.42Å; M541-V545 PolarHBondContact O-N 2.82Å
542	D	69	Low	63.6	Low	109 Å²	109	89.5 Å²	89.5	58%	0.583	49%	0.487	S	S	*	.	H	α-helix	trans	-62.5	-44.1	176.2	-67.9	-25.4	0	0	0	112.4	K538 S544 V545 C546	K538-D542 PolarHBondContact O-N 3.23Å; D542-S544 VanDerWaalsContact C-N 3.34Å; D542-S544 PolarHBondContact O-N 2.92Å; D542-V545 PolarHBondContact O-N 3.11Å; D542-C546 PolarHBondContact O-N 3.31Å; D542-C546 PolarHBondContact O-SG 3.24Å
543	K	59.4	Low	61.4	Low	132 Å²	132	93.7 Å²	93.7	57%	0.574	50%	0.498	S	S	*	.	H	α-helix	trans	-66.6	-32.4	179.2	-76.4	168	-177.6	163.4	0	113.2	Q539 V540 M541	Q539-K543 WeakPolarHBondContact O-CB 3.4Å; Q539-K543 WeakPolarHBondContact O-CD 3.47Å; Q539-K543 VanDerWaalsContact O-CG 3.25Å; Q539-K543 WeakPolarHBondContact O-CG 3.39Å; Q539-K543 PolarHBondContact O-N 3.24Å; V540-K543 PolarHBondContact O-N 2.77Å; M541-K543 PolarHBondContact O-N 3.12Å
544	S	53.8	Low	59.1	Low	67 Å²	67	100.6 Å²	100.6	47%	0.469	53%	0.528	S	S	.	.	H	α-helix	trans	-76.7	-28.7	179	54.9	0	0	0	0	113	V540 M541 D542	V540-S544 WeakPolarHBondContact O-CB 3.39Å; V540-S544 PolarHBondContact O-N 3.14Å; V540-S544 PolarHBondContact O-OG 3.21Å; M541-S544 PolarHBondContact O-N 3.33Å; M541-S544 PolarHBondContact O-OG 3.15Å; D542-S544 VanDerWaalsContact C-N 3.34Å; D542-S544 PolarHBondContact O-N 2.92Å
545	V	50.3	Low	56.9	Low	115 Å²	115	104.4 Å²	104.4	70%	0.697	55%	0.546	S	S	*	.	H	α-helix	trans	-67.2	-37	170.7	172.7	0	0	0	0	111.9	M541 D542	M541-V545 WeakPolarHBondContact O-CG2 3.42Å; M541-V545 PolarHBondContact O-N 2.82Å; D542-V545 PolarHBondContact O-N 3.11Å
546	C	42.7	Very low	54.9	Low	109 Å²	109	105.3 Å²	105.3	74%	0.736	55%	0.548	S	S	*	.	S	Bend	trans	-85.4	-8.4	-171.5	-69.6	0	0	0	0	116.7	D542	D542-C546 PolarHBondContact O-N 3.31Å; D542-C546 PolarHBondContact O-SG 3.24Å
547	K	38.5	Very low	52.5	Low	183 Å²	183	111 Å²	111	80%	0.796	57%	0.572	S	S	*	*	S	Bend	trans	-113.2	-3.3	-173.9	-76.9	-169.9	174.2	-175	0	116.8
548	N	34.2	Very low	50.1	Low	108 Å²	108	118.9 Å²	118.9	58%	0.578	61%	0.607	S	S	*	*			trans	-134.3	56.3	-174.6	-95.3	-31.8	0	0	0	114.3	A550 F551	N548-A550 PolarHBondContact O-N 2.68Å; N548-A550 VanDerWaalsContact O-N 3.1Å; N548-F551 HydrophobicContact CB-CB 4.06Å; N548-F551 PolarHBondContact O-N 3.04Å
549	A	42.8	Very low	47.9	Very low	95 Å²	95	121.7 Å²	121.7	79%	0.785	62%	0.619	S	S	*	*	H	α-helix	trans	-55.6	-27.1	175.3	0	0	0	0	0	114
550	A	42.8	Very low	45.4	Very low	80 Å²	80	127.1 Å²	127.1	66%	0.661	64%	0.641	S	S	*	*	H	α-helix	trans	-76.6	-30.2	176.9	0	0	0	0	0	114.1	N548 F553	N548-A550 PolarHBondContact O-N 2.68Å; N548-A550 VanDerWaalsContact O-N 3.1Å; A550-F553 PolarHBondContact O-N 3.09Å
551	F	41.2	Very low	43.4	Very low	129 Å²	129	132.4 Å²	132.4	57%	0.566	66%	0.659	S	S	*	*	H	α-helix	trans	-73.9	-35	-178.2	-164.5	-108.1	0	0	0	111.7	N548 F553 F554 L555	N548-F551 HydrophobicContact CB-CB 4.06Å; N548-F551 PolarHBondContact O-N 3.04Å; F551-F553 PolarHBondContact O-N 3.41Å; F551-F554 PolarHBondContact O-N 2.85Å; F551-L555 HydrophobicContact CD1-CD1 4Å; F551-L555 HydrophobicContact CE1-CD1 3.47Å; F551-L555 VanDerWaalsContact CE1-CD1 3.47Å; F551-L555 HydrophobicContact CZ-CD1 3.98Å; F551-L555 PolarHBondContact O-N 3.08Å
552	H	41	Very low	41.3	Very low	131 Å²	131	133.2 Å²	133.2	61%	0.606	67%	0.673	S	S	*	*	H	α-helix	trans	-64.5	-27.1	176.4	-156	-99.8	0	0	0	112.7
553	F	39.9	Very low	39.3	Very low	150 Å²	150	136 Å²	136	66%	0.658	69%	0.688	S	S	*	*	H	α-helix	trans	-77.3	-35.3	175.6	-172	-102.7	0	0	0	113.2	A550 F551	A550-F553 PolarHBondContact O-N 3.09Å; F551-F553 PolarHBondContact O-N 3.41Å
554	F	38.6	Very low	37.7	Very low	155 Å²	155	133 Å²	133	68%	0.68	70%	0.695	S	S	*	*	H	α-helix	trans	-72.4	-40	-176.3	-169.2	-104.8	0	0	0	112.8	F551	F551-F554 PolarHBondContact O-N 2.85Å
555	L	38.9	Very low	36.7	Very low	99 Å²	99	138.8 Å²	138.8	52%	0.518	71%	0.714	S	S	.	*	H	α-helix	trans	-69.3	-34.1	176	-86.1	161.2	0	0	0	112.9	F551 K557	F551-L555 HydrophobicContact CD1-CD1 4Å; F551-L555 HydrophobicContact CE1-CD1 3.47Å; F551-L555 VanDerWaalsContact CE1-CD1 3.47Å; F551-L555 HydrophobicContact CZ-CD1 3.98Å; F551-L555 PolarHBondContact O-N 3.08Å; L555-K557 PolarHBondContact O-N 2.72Å
556	F	41	Very low	35.8	Very low	142 Å²	142	142.7 Å²	142.7	62%	0.623	72%	0.722	S	S	*	*	H	α-helix	trans	-65.5	-24.8	179.9	-130.6	-87.5	0	0	0	113.7
557	K	35.7	Very low	35.8	Very low	173 Å²	173	141.3 Å²	141.3	75%	0.752	72%	0.718	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90	-12	-173.2	-150.7	173	-175.6	-179.8	0	114.4	L555	L555-K557 PolarHBondContact O-N 2.72Å
558	K	34.9	Very low	36.6	Very low	178 Å²	178	137.4 Å²	137.4	77%	0.774	72%	0.72	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.4	-17.4	-178.1	-152.8	175.2	-176.1	-179	0	114.1
559	F	33.9	Very low	38.4	Very low	145 Å²	145	135.7 Å²	135.7	64%	0.636	71%	0.71	S	S	*	*	S	Bend	trans	-117.1	109.6	176.7	-77.9	-85	0	0	0	111.1	F561	F559-F561 HydrophobicContact CB-CD2 4.39Å; F559-F561 PolarHBondContact O-N 3.33Å
560	K	27.8	Very low	40	Very low	214 Å²	214	137.3 Å²	137.3	93%	0.93	71%	0.706	S	S	*	*			trans	-66.4	94.4	169	-78.2	-177.4	173.8	-179.6	0	109.8
561	F	34.1	Very low	41.9	Very low	180 Å²	180	135.2 Å²	135.2	79%	0.789	68%	0.682	S	S	*	*			trans	-126.1	111.2	160.9	-84.3	-80.2	0	0	0	110	F559	F559-F561 HydrophobicContact CB-CD2 4.39Å; F559-F561 PolarHBondContact O-N 3.33Å
562	S	27.2	Very low	44	Very low	104 Å²	104	133.5 Å²	133.5	73%	0.727	69%	0.686	S	S	*	*			trans	-77.3	134	173.3	47	0	0	0	0	110.9
563	N	26.5	Very low	46.2	Very low	167 Å²	167	128 Å²	128	89%	0.893	66%	0.661	S	S	*	*	S	Bend	trans	67.4	112.1	164.5	-56.5	-11.9	0	0	0	117.9
564	G	26.8	Very low	48.6	Very low	69 Å²	69	124.2 Å²	124.2	71%	0.711	65%	0.648	S	S	*	*			trans	119.3	99.4	147.1	0	0	0	0	0	117.4
565	H	31.1	Very low	51	Low	188 Å²	188	118.3 Å²	118.3	87%	0.87	62%	0.624	S	S	*	*			trans	26.9	103.5	151.3	-61.2	86.8	0	0	0	119.1	A567	H565-A567 VanDerWaalsContact C-N 3.29Å; H565-A567 PolarHBondContact O-N 3.31Å
566	F	32.9	Very low	53.5	Low	197 Å²	197	115.7 Å²	115.7	86%	0.864	61%	0.611	S	S	*	*			trans	-69.8	86.8	152.9	-101.3	-92.8	0	0	0	109.3
567	A	43	Very low	55.7	Low	80 Å²	80	110.5 Å²	110.5	66%	0.661	59%	0.592	S	S	*	*	P	Polyproline II helix	trans	-81.2	122.6	167.2	0	0	0	0	0	109.2	H565	H565-A567 VanDerWaalsContact C-N 3.29Å; H565-A567 PolarHBondContact O-N 3.31Å
568	A	55.3	Low	58	Low	102 Å²	102	108.4 Å²	108.4	84%	0.843	60%	0.599	S	S	*	*	P	Polyproline II helix	trans	-67.7	133.6	174.9	0	0	0	0	0	110.3
569	I	71.1	Confident	60.1	Low	72 Å²	72	103.5 Å²	103.5	37%	0.369	60%	0.599	S	S	.	*	P	Polyproline II helix	trans	-74.9	127.8	172.4	-61.8	175.6	0	0	0	107.9	F571 Q594	I569-F571 PolarHBondContact O-N 3.08Å; I569-F571 VanDerWaalsContact O-N 3.13Å; I569-Q594 HydrophobicContact CD1-CB 3.73Å
570	D	77.3	Confident	62.5	Low	129 Å²	129	97.1 Å²	97.1	69%	0.69	57%	0.573	S	S	*	*			trans	-66.7	111	168.9	-173.3	13.8	0	0	0	109.2	K538	K538-D570 WeakPolarHBondContact CE-OD1 3.28Å; K538-D570 IonicContact NZ-OD1 2.71Å; K538-D570 PolarHBondContact NZ-OD1 2.71Å; K538-D570 IonicContact NZ-OD2 3.79Å
571	F	81.5	Confident	65.3	Low	36 Å²	36	87.7 Å²	87.7	16%	0.158	53%	0.532	C	S	.	.			trans	-120.8	124.2	-168.9	-173.1	-105.2	0	0	0	109.4	Y537 I569 V573 M599 F602 W617	Y537-F571 HydrophobicContact CE1-CD1 4.17Å; I569-F571 PolarHBondContact O-N 3.08Å; I569-F571 VanDerWaalsContact O-N 3.13Å; F571-V573 HydrophobicContact CD1-CG2 3.88Å; F571-V573 HydrophobicContact CE1-CG2 3.26Å; F571-V573 HydrophobicContact CZ-CG2 3.72Å; F571-M599 HydrophobicContact CE2-CG 4.04Å; F571-M599 HydrophobicContact CZ-CB 4.47Å; F571-M599 HydrophobicContact CZ-CG 3.77Å; F571-F602 HydrophobicContact CE1-CB 3.82Å; F571-F602 HydrophobicContact CE1-CG 4.28Å; F571-W617 HydrophobicContact CE1-CH2 4.41Å; F571-W617 AromaticContact CZ-CH2 3.94Å; F571-W617 HydrophobicContact CZ-CH2 3.94Å; F571-W617 HydrophobicContact CZ-CZ3 4.25Å
572	S	84.7	Confident	67.6	Low	93 Å²	93	82 Å²	82	65%	0.65	51%	0.512	S	S	*	.			trans	-131.8	146.3	176.9	55.3	0	0	0	0	110
573	V	88.2	Confident	70.2	Confident	15 Å²	15	78.3 Å²	78.3	9%	0.091	49%	0.485	C	S	.	.			trans	-136.1	129.7	-170.8	-173.3	0	0	0	0	110	C534 F571 V575 F602 W617	C534-V573 PolarHBondContact SG-N 3.21Å; C534-V573 PolarHBondContact SG-O 3.06Å; F571-V573 HydrophobicContact CD1-CG2 3.88Å; F571-V573 HydrophobicContact CE1-CG2 3.26Å; F571-V573 HydrophobicContact CZ-CG2 3.72Å; V573-V575 HydrophobicContact CG1-CG2 4.03Å; V573-F602 HydrophobicContact CB-CD1 4.38Å; V573-F602 HydrophobicContact CB-CE1 4.01Å; V573-F602 HydrophobicContact CB-CE2 4.14Å; V573-F602 HydrophobicContact CB-CZ 3.86Å; V573-F602 HydrophobicContact CG1-CD1 4.12Å; V573-F602 HydrophobicContact CG1-CE1 3.64Å; V573-F602 HydrophobicContact CG1-CZ 3.93Å; V573-F602 HydrophobicContact CG2-CD1 4.03Å; V573-F602 HydrophobicContact CG2-CD2 4Å; V573-F602 HydrophobicContact CG2-CE1 4.16Å; V573-F602 HydrophobicContact CG2-CE2 4.13Å; V573-F602 HydrophobicContact CG2-CG 3.95Å; V573-F602 HydrophobicContact CG2-CZ 4.2Å; V573-W617 HydrophobicContact CG1-CH2 3.97Å; V573-W617 HydrophobicContact CG1-CZ3 3.89Å; V573-W617 HydrophobicContact CG2-CH2 4.02Å; V573-W617 HydrophobicContact CG2-CZ3 4.24Å
574	L	89.7	Confident	72.6	Confident	70 Å²	70	73 Å²	73	37%	0.366	46%	0.461	S	S	.	.			trans	-97.4	119.9	167.5	-65.9	175	0	0	0	108.7	L576	L574-L576 HydrophobicContact CB-CD2 4.01Å; L574-L576 HydrophobicContact CB-CG 4.37Å
575	V	89.4	Confident	74.9	Confident	31 Å²	31	72.4 Å²	72.4	19%	0.188	45%	0.449	C	S	.	.			trans	-102.8	104.6	-179.9	-179.8	0	0	0	0	108.5	S530 L533 V573 F602 Y606	S530-V575 PolarHBondContact OG-N 2.84Å; S530-V575 PolarHBondContact OG-O 3.47Å; L533-V575 HydrophobicContact CD2-CB 4.22Å; L533-V575 HydrophobicContact CD2-CG2 3.69Å; V573-V575 HydrophobicContact CG1-CG2 4.03Å; V575-F602 HydrophobicContact CG2-CE1 3.95Å; V575-F602 HydrophobicContact CG2-CZ 3.88Å; V575-Y606 HydrophobicContact CG1-CE2 3.85Å; V575-Y606 HydrophobicContact CG2-CE2 4.39Å
576	L	90.6	Very high	76.9	Confident	45 Å²	45	64.4 Å²	64.4	24%	0.236	41%	0.414	C	S	.	.			trans	-109.4	141.4	-168.9	-50.1	-176.8	0	0	0	110.5	V491 L574 W581 L583	V491-L576 HydrophobicContact CG2-CD1 3.83Å; L574-L576 HydrophobicContact CB-CD2 4.01Å; L574-L576 HydrophobicContact CB-CG 4.37Å; L576-W581 HydrophobicContact CB-CD2 4.11Å; L576-W581 HydrophobicContact CB-CG 3.93Å; L576-W581 HydrophobicContact CD1-CD2 3.95Å; L576-W581 HydrophobicContact CD1-CE3 3.99Å; L576-W581 HydrophobicContact CD1-CG 4.41Å; L576-W581 HydrophobicContact CD1-CZ3 4.3Å; L576-W581 HydrophobicContact CD2-CD2 4.33Å; L576-W581 HydrophobicContact CD2-CH2 4.11Å; L576-W581 HydrophobicContact CD2-CZ2 3.62Å; L576-W581 HydrophobicContact CG-CD2 4.35Å; L576-W581 HydrophobicContact CG-CZ2 4.5Å; L576-L583 HydrophobicContact CD1-CD1 3.65Å
577	S	89.1	Confident	78.9	Confident	33 Å²	33	55.8 Å²	55.8	23%	0.231	38%	0.378	C	S	.	.			trans	-78.4	127.8	178.1	64.9	0	0	0	0	112.1	D526 G579 A580 W581	D526-S577 WeakPolarHBondContact OD2-CB 3.48Å; D526-S577 PolarHBondContact OD2-N 3.06Å; D526-S577 PolarHBondContact OD2-OG 2.75Å; S577-G579 PolarHBondContact O-N 3.19Å; S577-G579 VanDerWaalsContact O-N 3.08Å; S577-A580 PolarHBondContact O-N 3.16Å; S577-A580 WeakPolarHBondContact OG-CB 3.44Å; S577-W581 VanDerWaalsContact O-CD1 3.24Å; S577-W581 PolarHBondContact O-N 3.33Å
578	S	83.4	Confident	80.4	Confident	129 Å²	129	57 Å²	57	90%	0.902	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-17	-175.7	56.1	0	0	0	0	114.8
579	G	79.4	Confident	81.8	Confident	75 Å²	75	52.7 Å²	52.7	77%	0.773	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.1	-18.1	179.4	0	0	0	0	0	115.2	S577	S577-G579 PolarHBondContact O-N 3.19Å; S577-G579 VanDerWaalsContact O-N 3.08Å
580	A	82.8	Confident	82.3	Confident	11 Å²	11	53.4 Å²	53.4	9%	0.091	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.7	-25.1	-178.8	0	0	0	0	0	113.5	R522 M523 S577	R522-A580 HydrophobicContact CB-CB 3.77Å; R522-A580 HydrophobicContact CG-CB 3.56Å; M523-A580 HydrophobicContact CG-CB 4.35Å; S577-A580 PolarHBondContact O-N 3.16Å; S577-A580 WeakPolarHBondContact OG-CB 3.44Å
581	W	87.9	Confident	82.4	Confident	15 Å²	15	49.3 Å²	49.3	6%	0.057	32%	0.323	C	S	.	.			trans	-99.3	121	-172.2	-70	79.9	0	0	0	112.1	A487 L490 V491 M523 D526 V527 L576 S577 L583	A487-W581 HydrophobicContact CB-CE3 3.89Å; A487-W581 HydrophobicContact CB-CZ3 4.09Å; L490-W581 HydrophobicContact CB-CH2 3.8Å; L490-W581 HydrophobicContact CB-CZ3 4.09Å; L490-W581 HydrophobicContact CD1-CH2 3.78Å; L490-W581 HydrophobicContact CD1-CZ3 4.35Å; L490-W581 HydrophobicContact CG-CH2 4.47Å; V491-W581 HydrophobicContact CG2-CE3 4.3Å; V491-W581 HydrophobicContact CG2-CH2 4.33Å; V491-W581 HydrophobicContact CG2-CZ3 3.71Å; M523-W581 HydrophobicContact CB-CD2 4.38Å; M523-W581 HydrophobicContact CB-CH2 4.1Å; M523-W581 HydrophobicContact CB-CZ2 3.72Å; M523-W581 HydrophobicContact CE-CE3 4.11Å; M523-W581 HydrophobicContact CE-CZ3 4.06Å; M523-W581 HydrophobicContact CG-CD2 3.83Å; M523-W581 HydrophobicContact CG-CE3 4.25Å; M523-W581 HydrophobicContact CG-CG 4.18Å; M523-W581 HydrophobicContact CG-CZ2 4.11Å; M523-W581 VanDerWaalsContact O-CZ2 3.23Å; M523-W581 WeakPolarHBondContact O-CZ2 3.36Å; D526-W581 HydrophobicContact CB-CZ2 4.18Å; D526-W581 PolarHBondContact OD2-NE1 3.44Å; V527-W581 HydrophobicContact CG2-CH2 3.61Å; V527-W581 HydrophobicContact CG2-CZ2 3.78Å; L576-W581 HydrophobicContact CB-CD2 4.11Å; L576-W581 HydrophobicContact CB-CG 3.93Å; L576-W581 HydrophobicContact CD1-CD2 3.95Å; L576-W581 HydrophobicContact CD1-CE3 3.99Å; L576-W581 HydrophobicContact CD1-CG 4.41Å; L576-W581 HydrophobicContact CD1-CZ3 4.3Å; L576-W581 HydrophobicContact CD2-CD2 4.33Å; L576-W581 HydrophobicContact CD2-CH2 4.11Å; L576-W581 HydrophobicContact CD2-CZ2 3.62Å; L576-W581 HydrophobicContact CG-CD2 4.35Å; L576-W581 HydrophobicContact CG-CZ2 4.5Å; S577-W581 VanDerWaalsContact O-CD1 3.24Å; S577-W581 PolarHBondContact O-N 3.33Å; W581-L583 HydrophobicContact CB-CD1 4.23Å; W581-L583 HydrophobicContact CB-CG 4.22Å; W581-L583 HydrophobicContact CD2-CD1 4.35Å; W581-L583 HydrophobicContact CE3-CD1 3.67Å; W581-L583 HydrophobicContact CE3-CG 4.34Å; W581-L583 HydrophobicContact CZ3-CD1 4.42Å; W581-L583 PolarHBondContact O-N 2.73Å
582	P	82.8	Confident	82	Confident	60 Å²	60	50.6 Å²	50.6	39%	0.39	33%	0.33	S	S	.	.			trans	-79	55.3	176.2	34.8	-37.4	0	0	0	111.4	K484 A487	K484-P582 HydrophobicContact CB-CG 4.23Å; A487-P582 HydrophobicContact CB-CG 4.01Å
583	L	81.4	Confident	81.6	Confident	27 Å²	27	50.1 Å²	50.1	14%	0.141	33%	0.327	C	S	.	.			trans	-121.8	129.9	-176.2	-58.7	177.7	0	0	0	109.7	A487 V491 L576 W581 L618 Y621	A487-L583 HydrophobicContact CB-CD2 4.17Å; V491-L583 HydrophobicContact CG2-CD1 3.91Å; L576-L583 HydrophobicContact CD1-CD1 3.65Å; W581-L583 HydrophobicContact CB-CD1 4.23Å; W581-L583 HydrophobicContact CB-CG 4.22Å; W581-L583 HydrophobicContact CD2-CD1 4.35Å; W581-L583 HydrophobicContact CE3-CD1 3.67Å; W581-L583 HydrophobicContact CE3-CG 4.34Å; W581-L583 HydrophobicContact CZ3-CD1 4.42Å; W581-L583 PolarHBondContact O-N 2.73Å; L583-L618 HydrophobicContact CB-CD1 3.88Å; L583-Y621 HydrophobicContact CB-CE2 3.87Å; L583-Y621 HydrophobicContact CD2-CE1 3.98Å; L583-Y621 HydrophobicContact CD2-CE2 3.93Å; L583-Y621 HydrophobicContact CG-CE2 4.37Å
584	S	76.9	Confident	81	Confident	56 Å²	56	54.9 Å²	54.9	39%	0.392	35%	0.348	S	S	.	.			trans	-126.5	153.9	-179.6	66.3	0	0	0	0	112	T586 N620	S584-T586 PolarHBondContact O-N 3.06Å; S584-N620 PolarHBondContact O-ND2 2.78Å
585	A	75.2	Confident	80.7	Confident	56 Å²	56	52.8 Å²	52.8	46%	0.463	34%	0.337	S	S	.	.			trans	-82.2	114	178.8	0	0	0	0	0	110.4	L618	A585-L618 HydrophobicContact CB-CD2 3.77Å
586	T	73.1	Confident	80.5	Confident	21 Å²	21	53 Å²	53	13%	0.129	34%	0.342	C	S	.	.			trans	-75.7	-40.6	-179.2	-40.2	0	0	0	0	112.9	S584 N620 I671 E737	S584-T586 PolarHBondContact O-N 3.06Å; T586-N620 PolarHBondContact OG1-ND2 3.45Å; T586-I671 HydrophobicContact CG2-CD1 3.65Å; T586-E737 WeakPolarHBondContact CB-OE1 3.35Å; T586-E737 HydrophobicContact CG2-CG 3.92Å; T586-E737 PolarHBondContact OG1-OE1 2.88Å
587	A	74.9	Confident	80.1	Confident	15 Å²	15	57.6 Å²	57.6	12%	0.124	36%	0.36	C	S	.	.			trans	-160.6	154.2	-178.1	0	0	0	0	0	112.6	F642 L667 P668 I671	A587-F642 HydrophobicContact CB-CZ 4.14Å; A587-L667 HydrophobicContact CB-CD2 4.38Å; A587-P668 HydrophobicContact CB-CG 4.04Å; A587-I671 HydrophobicContact CB-CD1 3.77Å
588	T	74.5	Confident	79.9	Confident	105 Å²	105	57.2 Å²	57.2	64%	0.644	36%	0.358	S	S	*	.			trans	-86.2	151.4	163.8	50	0	0	0	0	110.6
589	V	83.7	Confident	80.1	Confident	12 Å²	12	51.9 Å²	51.9	7%	0.073	32%	0.318	C	S	.	.			trans	-134.4	146.6	179	66.1	0	0	0	0	110.3	L591 H619 L641 F642 S645 L667	V589-L591 HydrophobicContact CG1-CD2 3.91Å; V589-L591 PolarHBondContact O-N 3.11Å; V589-H619 HydrophobicContact CG1-CB 4.29Å; V589-L641 HydrophobicContact CG1-CD2 4.14Å; V589-L641 HydrophobicContact CG1-CG 4.19Å; V589-F642 HydrophobicContact CB-CD1 4.14Å; V589-F642 HydrophobicContact CB-CE1 4.17Å; V589-F642 HydrophobicContact CG1-CD1 4.33Å; V589-F642 HydrophobicContact CG1-CE1 4.31Å; V589-F642 HydrophobicContact CG2-CD1 4.39Å; V589-S645 WeakPolarHBondContact CG2-OG 3.29Å; V589-L667 HydrophobicContact CB-CD2 4.01Å; V589-L667 HydrophobicContact CG2-CD2 4Å; V589-L667 HydrophobicContact CG2-CG 4.21Å
590	N	82.9	Confident	80.4	Confident	87 Å²	87	53.3 Å²	53.3	47%	0.465	31%	0.305	S	S	.	.			trans	-68.5	114.8	173.4	-169.2	8.5	0	0	0	110.2	I664 T665 L666	N590-I664 VanDerWaalsContact CB-O 3.24Å; N590-I664 WeakPolarHBondContact CB-O 3.47Å; N590-I664 PolarHBondContact ND2-O 2.79Å; N590-T665 PolarHBondContact N-O 3.17Å; N590-L666 HydrophobicContact CB-CD1 4.41Å; N590-L666 HydrophobicContact CB-CG 4.48Å
591	L	78.6	Confident	80.5	Confident	43 Å²	43	54.6 Å²	54.6	23%	0.225	32%	0.315	C	S	.	.			trans	-90.2	146.1	-172.9	-63.4	170.1	0	0	0	112.1	V589 I595 A596 M599 L641	V589-L591 HydrophobicContact CG1-CD2 3.91Å; V589-L591 PolarHBondContact O-N 3.11Å; L591-I595 HydrophobicContact CD2-CG2 4.33Å; L591-A596 HydrophobicContact CB-CB 4.19Å; L591-M599 HydrophobicContact CD1-CE 3.89Å; L591-M599 HydrophobicContact CD1-SD 3.59Å; L591-M599 VanDerWaalsContact CD1-SD 3.59Å; L591-M599 HydrophobicContact CD2-SD 4.42Å; L591-L641 HydrophobicContact CD2-CD1 4.36Å; L591-L641 HydrophobicContact CD2-CD2 3.95Å
592	Q	73.7	Confident	80.5	Confident	64 Å²	64	53.9 Å²	53.9	30%	0.299	31%	0.313	S	S	.	.			trans	-57.6	143.4	166.1	-68.7	-170.4	-63.6	0	0	111.4	Q594 I595 A596 Q648	Q592-Q594 PolarHBondContact O-N 2.98Å; Q592-I595 HydrophobicContact CB-CB 4.42Å; Q592-I595 HydrophobicContact CB-CD1 4.28Å; Q592-I595 HydrophobicContact CB-CG1 4.23Å; Q592-I595 HydrophobicContact CG-CD1 4.46Å; Q592-I595 PolarHBondContact O-N 3.31Å; Q592-I595 VanDerWaalsContact O-N 3.1Å; Q592-A596 WeakPolarHBondContact O-CB 3.42Å; Q592-A596 PolarHBondContact O-N 2.82Å; Q592-Q648 VanDerWaalsContact CD-CD 3.48Å; Q592-Q648 VanDerWaalsContact CD-OE1 3.32Å; Q592-Q648 VanDerWaalsContact CG-CD 3.47Å; Q592-Q648 HydrophobicContact CG-CG 4.37Å; Q592-Q648 VanDerWaalsContact NE2-CG 3.34Å
593	S	75.4	Confident	80.7	Confident	83 Å²	83	51.9 Å²	51.9	58%	0.58	30%	0.301	S	S	*	.	H	α-helix	trans	-57.1	-25.6	176	64.9	0	0	0	0	113.8	K597	S593-K597 WeakPolarHBondContact O-CB 3.22Å; S593-K597 VanDerWaalsContact O-CD 3.26Å; S593-K597 WeakPolarHBondContact O-CD 3.45Å; S593-K597 WeakPolarHBondContact O-CG 3.32Å; S593-K597 PolarHBondContact O-N 3Å
594	Q	76.7	Confident	80.9	Confident	114 Å²	114	54.2 Å²	54.2	53%	0.533	31%	0.313	S	S	.	.	H	α-helix	trans	-75.3	-49.9	173.9	-64.5	-178.3	-13.4	0	0	112.1	I569 Q592 A596 K597 S598	I569-Q594 HydrophobicContact CD1-CB 3.73Å; Q592-Q594 PolarHBondContact O-N 2.98Å; Q594-A596 PolarHBondContact O-N 3.23Å; Q594-K597 PolarHBondContact O-N 2.86Å; Q594-S598 PolarHBondContact O-N 2.75Å; Q594-S598 VanDerWaalsContact O-N 3.07Å; Q594-S598 PolarHBondContact O-OG 3.14Å
595	I	83.3	Confident	81.4	Confident	26 Å²	26	53.1 Å²	53.1	13%	0.133	30%	0.3	C	S	.	.	H	α-helix	trans	-62.1	-44.8	177.6	-61.3	174.6	0	0	0	110.4	L591 Q592 K597 S598 M599 L641	L591-I595 HydrophobicContact CD2-CG2 4.33Å; Q592-I595 HydrophobicContact CB-CB 4.42Å; Q592-I595 HydrophobicContact CB-CD1 4.28Å; Q592-I595 HydrophobicContact CB-CG1 4.23Å; Q592-I595 HydrophobicContact CG-CD1 4.46Å; Q592-I595 PolarHBondContact O-N 3.31Å; Q592-I595 VanDerWaalsContact O-N 3.1Å; I595-K597 VanDerWaalsContact C-N 3.32Å; I595-K597 PolarHBondContact O-N 2.86Å; I595-S598 PolarHBondContact O-N 2.93Å; I595-M599 HydrophobicContact CG2-CG 4.4Å; I595-M599 HydrophobicContact CG2-SD 3.85Å; I595-M599 WeakPolarHBondContact O-CG 3.22Å; I595-M599 PolarHBondContact O-N 3.31Å; I595-L641 HydrophobicContact CD1-CD1 4.3Å
596	A	84	Confident	82	Confident	37 Å²	37	51.2 Å²	51.2	31%	0.306	28%	0.281	S	S	.	.	H	α-helix	trans	-59.5	-39.4	176.5	0	0	0	0	0	112.4	L591 Q592 Q594 Q600	L591-A596 HydrophobicContact CB-CB 4.19Å; Q592-A596 WeakPolarHBondContact O-CB 3.42Å; Q592-A596 PolarHBondContact O-N 2.82Å; Q594-A596 PolarHBondContact O-N 3.23Å; A596-Q600 WeakPolarHBondContact O-CB 3.05Å; A596-Q600 PolarHBondContact O-N 3.25Å
597	K	83.6	Confident	82.6	Confident	141 Å²	141	53.4 Å²	53.4	61%	0.613	30%	0.295	S	S	*	.	H	α-helix	trans	-65	-43.7	174.1	-79	169.4	-174.1	179.6	0	112.4	S593 Q594 I595 Q600 A601	S593-K597 WeakPolarHBondContact O-CB 3.22Å; S593-K597 VanDerWaalsContact O-CD 3.26Å; S593-K597 WeakPolarHBondContact O-CD 3.45Å; S593-K597 WeakPolarHBondContact O-CG 3.32Å; S593-K597 PolarHBondContact O-N 3Å; Q594-K597 PolarHBondContact O-N 2.86Å; I595-K597 VanDerWaalsContact C-N 3.32Å; I595-K597 PolarHBondContact O-N 2.86Å; K597-Q600 PolarHBondContact O-N 3Å; K597-A601 WeakPolarHBondContact O-CB 3.32Å; K597-A601 PolarHBondContact O-N 3.19Å
598	S	83.6	Confident	83	Confident	25 Å²	25	59.1 Å²	59.1	18%	0.175	32%	0.323	C	S	.	.	H	α-helix	trans	-64.4	-41.1	176.7	-61	0	0	0	0	112.2	Q594 I595 A601 F602	Q594-S598 PolarHBondContact O-N 2.75Å; Q594-S598 VanDerWaalsContact O-N 3.07Å; Q594-S598 PolarHBondContact O-OG 3.14Å; I595-S598 PolarHBondContact O-N 2.93Å; S598-A601 PolarHBondContact O-N 3.39Å; S598-F602 PolarHBondContact O-N 3.17Å
599	M	87.4	Confident	83.5	Confident	16 Å²	16	59.8 Å²	59.8	8%	0.079	31%	0.314	C	S	.	.	H	α-helix	trans	-64.8	-40.9	174.6	-74.4	172.5	66.8	0	0	112.5	F571 L591 I595 S603 W617	F571-M599 HydrophobicContact CE2-CG 4.04Å; F571-M599 HydrophobicContact CZ-CB 4.47Å; F571-M599 HydrophobicContact CZ-CG 3.77Å; L591-M599 HydrophobicContact CD1-CE 3.89Å; L591-M599 HydrophobicContact CD1-SD 3.59Å; L591-M599 VanDerWaalsContact CD1-SD 3.59Å; L591-M599 HydrophobicContact CD2-SD 4.42Å; I595-M599 HydrophobicContact CG2-CG 4.4Å; I595-M599 HydrophobicContact CG2-SD 3.85Å; I595-M599 WeakPolarHBondContact O-CG 3.22Å; I595-M599 PolarHBondContact O-N 3.31Å; M599-S603 WeakPolarHBondContact O-CB 3.33Å; M599-S603 PolarHBondContact O-N 2.87Å; M599-S603 PolarHBondContact O-OG 3.13Å; M599-W617 HydrophobicContact CB-CH2 4.29Å; M599-W617 HydrophobicContact CB-CZ2 3.93Å; M599-W617 HydrophobicContact CE-CB 3.79Å; M599-W617 HydrophobicContact CE-CD2 3.28Å; M599-W617 HydrophobicContact CE-CE3 3.7Å; M599-W617 HydrophobicContact CE-CG 3.32Å; M599-W617 HydrophobicContact CE-CZ2 4.41Å; M599-W617 HydrophobicContact CE-CZ3 4.41Å; M599-W617 HydrophobicContact CG-CD2 4.46Å; M599-W617 HydrophobicContact CG-CE3 4.36Å; M599-W617 HydrophobicContact CG-CH2 4.01Å; M599-W617 HydrophobicContact CG-CZ2 4.09Å; M599-W617 HydrophobicContact CG-CZ3 4.14Å
600	Q	85.6	Confident	83.4	Confident	105 Å²	105	61.6 Å²	61.6	49%	0.491	32%	0.321	S	S	.	.	H	α-helix	trans	-65.7	-47.9	175.5	-172	63.8	46.6	0	0	110.8	A596 K597 F602 S603 D604	A596-Q600 WeakPolarHBondContact O-CB 3.05Å; A596-Q600 PolarHBondContact O-N 3.25Å; K597-Q600 PolarHBondContact O-N 3Å; Q600-F602 VanDerWaalsContact C-N 3.3Å; Q600-F602 PolarHBondContact O-N 3.27Å; Q600-S603 CarbonylContact O-C 3.58Å; Q600-S603 WeakPolarHBondContact O-CA 3.46Å; Q600-S603 WeakPolarHBondContact O-CB 3.48Å; Q600-S603 PolarHBondContact O-N 2.99Å; Q600-D604 PolarHBondContact NE2-OD1 3.09Å; Q600-D604 VanDerWaalsContact O-CG 3.22Å; Q600-D604 PolarHBondContact O-N 3.36Å
601	A	84.9	Confident	83.2	Confident	38 Å²	38	64.2 Å²	64.2	31%	0.314	34%	0.335	S	S	.	.	H	α-helix	trans	-58.4	-40	178.2	0	0	0	0	0	112.6	K597 S598 Y605	K597-A601 WeakPolarHBondContact O-CB 3.32Å; K597-A601 PolarHBondContact O-N 3.19Å; S598-A601 PolarHBondContact O-N 3.39Å; A601-Y605 WeakPolarHBondContact O-CB 3.44Å; A601-Y605 PolarHBondContact O-N 2.67Å
602	F	87.9	Confident	83.2	Confident	0 Å²	0	66.6 Å²	66.6	0%	0	37%	0.37	C	S	.	.	H	α-helix	trans	-69.7	-37.1	172.4	-175.9	-91	0	0	0	112.7	L533 Y537 F571 V573 V575 S598 Q600 Y605 Y606 I615 W617	L533-F602 HydrophobicContact CD2-CZ 3.98Å; L533-F602 HydrophobicContact CG-CZ 4.36Å; Y537-F602 AromaticContact CD1-CD2 3.93Å; Y537-F602 HydrophobicContact CD1-CD2 3.93Å; Y537-F602 AromaticContact CD2-CD2 3.91Å; Y537-F602 HydrophobicContact CD2-CD2 3.91Å; Y537-F602 HydrophobicContact CE1-CD2 4.14Å; Y537-F602 HydrophobicContact CE2-CB 4.29Å; Y537-F602 HydrophobicContact CE2-CD2 4.12Å; Y537-F602 AromaticContact CG-CD2 3.8Å; Y537-F602 HydrophobicContact CG-CD2 3.8Å; Y537-F602 HydrophobicContact CG-CE2 4.23Å; F571-F602 HydrophobicContact CE1-CB 3.82Å; F571-F602 HydrophobicContact CE1-CG 4.28Å; V573-F602 HydrophobicContact CB-CD1 4.38Å; V573-F602 HydrophobicContact CB-CE1 4.01Å; V573-F602 HydrophobicContact CB-CE2 4.14Å; V573-F602 HydrophobicContact CB-CZ 3.86Å; V573-F602 HydrophobicContact CG1-CD1 4.12Å; V573-F602 HydrophobicContact CG1-CE1 3.64Å; V573-F602 HydrophobicContact CG1-CZ 3.93Å; V573-F602 HydrophobicContact CG2-CD1 4.03Å; V573-F602 HydrophobicContact CG2-CD2 4Å; V573-F602 HydrophobicContact CG2-CE1 4.16Å; V573-F602 HydrophobicContact CG2-CE2 4.13Å; V573-F602 HydrophobicContact CG2-CG 3.95Å; V573-F602 HydrophobicContact CG2-CZ 4.2Å; V575-F602 HydrophobicContact CG2-CE1 3.95Å; V575-F602 HydrophobicContact CG2-CZ 3.88Å; S598-F602 PolarHBondContact O-N 3.17Å; Q600-F602 VanDerWaalsContact C-N 3.3Å; Q600-F602 PolarHBondContact O-N 3.27Å; F602-Y605 HydrophobicContact CD2-CD1 4.24Å; F602-Y605 HydrophobicContact CE2-CD1 4.2Å; F602-Y605 HydrophobicContact CE2-CE1 4.48Å; F602-Y605 PolarHBondContact O-N 3.25Å; F602-Y606 VanDerWaalsContact O-CB 3.3Å; F602-Y606 WeakPolarHBondContact O-CB 3.44Å; F602-Y606 PolarHBondContact O-N 3.19Å; F602-I615 HydrophobicContact CD1-CD1 4.16Å; F602-I615 HydrophobicContact CE1-CD1 4.04Å; F602-W617 AromaticContact CD1-CH2 3.92Å; F602-W617 HydrophobicContact CD1-CH2 3.92Å; F602-W617 HydrophobicContact CD1-CZ2 4.12Å
603	S	87.7	Confident	83.8	Confident	19 Å²	19	70.3 Å²	70.3	13%	0.133	38%	0.382	C	S	.	.	H	α-helix	trans	-64.4	-43.2	176.7	-58.3	0	0	0	0	111.3	M599 Q600 Y606 V607 W617	M599-S603 WeakPolarHBondContact O-CB 3.33Å; M599-S603 PolarHBondContact O-N 2.87Å; M599-S603 PolarHBondContact O-OG 3.13Å; Q600-S603 CarbonylContact O-C 3.58Å; Q600-S603 WeakPolarHBondContact O-CA 3.46Å; Q600-S603 WeakPolarHBondContact O-CB 3.48Å; Q600-S603 PolarHBondContact O-N 2.99Å; S603-Y606 PolarHBondContact O-N 3.33Å; S603-V607 WeakPolarHBondContact O-CB 3.45Å; S603-V607 WeakPolarHBondContact O-CG2 3.43Å; S603-V607 PolarHBondContact O-N 2.9Å; S603-W617 PolarHBondContact OG-NE1 3.34Å
604	D	84.8	Confident	84.1	Confident	75 Å²	75	76 Å²	76	40%	0.401	40%	0.396	S	S	.	.	H	α-helix	trans	-64.4	-45.1	175.6	-61	-23	0	0	0	110.6	Q600 Y606 N608	Q600-D604 PolarHBondContact NE2-OD1 3.09Å; Q600-D604 VanDerWaalsContact O-CG 3.22Å; Q600-D604 PolarHBondContact O-N 3.36Å; D604-Y606 PolarHBondContact O-N 2.9Å; D604-N608 VanDerWaalsContact O-CB 3.29Å; D604-N608 WeakPolarHBondContact O-CB 3.43Å; D604-N608 PolarHBondContact O-N 3.34Å; D604-N608 PolarHBondContact O-ND2 2.94Å
605	Y	87.5	Confident	84.6	Confident	33 Å²	33	72.5 Å²	72.5	13%	0.129	38%	0.38	C	S	.	.	H	α-helix	trans	-56	-48.3	172.3	168	-106.4	0	0	0	112.1	L533 E536 Y537 V540 A601 F602 R609	L533-Y605 HydrophobicContact CD1-CE1 3.83Å; L533-Y605 HydrophobicContact CG-CE1 4.49Å; E536-Y605 WeakPolarHBondContact CB-OH 3.35Å; Y537-Y605 AromaticContact CD2-CD1 3.54Å; Y537-Y605 HydrophobicContact CD2-CD1 3.54Å; Y537-Y605 HydrophobicContact CD2-CD2 4.25Å; Y537-Y605 HydrophobicContact CD2-CE1 4.07Å; Y537-Y605 AromaticContact CD2-CG 3.65Å; Y537-Y605 HydrophobicContact CD2-CG 3.65Å; Y537-Y605 HydrophobicContact CE2-CD1 4.35Å; Y537-Y605 HydrophobicContact CE2-CG 4.19Å; Y537-Y605 HydrophobicContact CG-CD1 4.25Å; Y537-Y605 HydrophobicContact CG-CE1 4.43Å; V540-Y605 HydrophobicContact CG2-CE2 4.22Å; A601-Y605 WeakPolarHBondContact O-CB 3.44Å; A601-Y605 PolarHBondContact O-N 2.67Å; F602-Y605 HydrophobicContact CD2-CD1 4.24Å; F602-Y605 HydrophobicContact CE2-CD1 4.2Å; F602-Y605 HydrophobicContact CE2-CE1 4.48Å; F602-Y605 PolarHBondContact O-N 3.25Å; Y605-R609 WeakPolarHBondContact O-CB 3.18Å; Y605-R609 PolarHBondContact O-N 3.3Å; Y605-R609 VanDerWaalsContact O-N 3.08Å; Y605-R609 PolarHBondContact OH-NH1 3.24Å
606	Y	87.7	Confident	84.7	Confident	16 Å²	16	76 Å²	76	6%	0.063	41%	0.407	C	S	.	.	H	α-helix	trans	-68.4	-43	-176.4	-173.5	-96.2	0	0	0	112.6	L533 V575 F602 S603 D604 R609 H610 R613 I615	L533-Y606 HydrophobicContact CD2-CD2 3.85Å; L533-Y606 HydrophobicContact CD2-CE2 3.82Å; V575-Y606 HydrophobicContact CG1-CE2 3.85Å; V575-Y606 HydrophobicContact CG2-CE2 4.39Å; F602-Y606 VanDerWaalsContact O-CB 3.3Å; F602-Y606 WeakPolarHBondContact O-CB 3.44Å; F602-Y606 PolarHBondContact O-N 3.19Å; S603-Y606 PolarHBondContact O-N 3.33Å; D604-Y606 PolarHBondContact O-N 2.9Å; Y606-R609 PolarHBondContact O-N 2.84Å; Y606-H610 AromaticContact CD2-CD2 3.63Å; Y606-H610 HydrophobicContact CE1-CB 4.21Å; Y606-H610 AromaticContact CE2-CD2 3.33Å; Y606-H610 WeakPolarHBondContact CE2-CD2 3.49Å; Y606-H610 AromaticContact CZ-CD2 3.78Å; Y606-H610 WeakPolarHBondContact O-CB 3.23Å; Y606-H610 PolarHBondContact O-N 2.7Å; Y606-R613 HydrophobicContact CE1-CB 3.84Å; Y606-R613 VanDerWaalsContact OH-CD 3.31Å; Y606-R613 WeakPolarHBondContact OH-CD 3.34Å; Y606-R613 PolarHBondContact OH-NH1 3.34Å; Y606-I615 HydrophobicContact CD1-CD1 3.48Å; Y606-I615 VanDerWaalsContact CD1-CD1 3.48Å; Y606-I615 HydrophobicContact CD1-CG1 3.62Å; Y606-I615 HydrophobicContact CD2-CD1 4.44Å; Y606-I615 HydrophobicContact CE1-CD1 4.26Å; Y606-I615 HydrophobicContact CE1-CG1 3.95Å; Y606-I615 HydrophobicContact CG-CD1 3.58Å; Y606-I615 HydrophobicContact CG-CG1 4.2Å
607	V	85.8	Confident	84.8	Confident	67 Å²	67	77.2 Å²	77.2	41%	0.406	40%	0.404	S	S	.	.	H	α-helix	trans	-64.9	-42.9	177.4	170.7	0	0	0	0	110.6	S603 R609 H610	S603-V607 WeakPolarHBondContact O-CB 3.45Å; S603-V607 WeakPolarHBondContact O-CG2 3.43Å; S603-V607 PolarHBondContact O-N 2.9Å; V607-R609 PolarHBondContact O-N 3.49Å; V607-H610 CarbonylContact O-C 3.46Å; V607-H610 PolarHBondContact O-N 3.02Å
608	N	82.9	Confident	85	Confident	135 Å²	135	72.7 Å²	72.7	72%	0.722	39%	0.386	S	S	*	.	H	α-helix	trans	-63.3	-26.6	175.5	-72.8	-35.9	0	0	0	113.2	D604	D604-N608 VanDerWaalsContact O-CB 3.29Å; D604-N608 WeakPolarHBondContact O-CB 3.43Å; D604-N608 PolarHBondContact O-N 3.34Å; D604-N608 PolarHBondContact O-ND2 2.94Å
609	R	85	Confident	85.1	Confident	119 Å²	119	72.5 Å²	72.5	45%	0.449	38%	0.382	S	S	.	.	H	α-helix	trans	-91.3	-28.3	177.7	-171.2	170.6	179.3	132.4	2.5	113.8	E536 Y605 Y606 V607	E536-R609 VanDerWaalsContact CD-CZ 3.42Å; E536-R609 VanDerWaalsContact CD-NH2 3.28Å; E536-R609 IonicContact OE1-CZ 3.71Å; E536-R609 IonicContact OE1-NH1 2.76Å; E536-R609 PolarHBondContact OE1-NH1 3.42Å; E536-R609 IonicContact OE1-NH2 2.72Å; E536-R609 PolarHBondContact OE1-NH2 3.09Å; E536-R609 IonicContact OE2-CZ 2.68Å; E536-R609 IonicContact OE2-NE 3.21Å; E536-R609 IonicContact OE2-NH1 3.74Å; E536-R609 PolarHBondContact OE2-NH1 3.41Å; E536-R609 IonicContact OE2-NH2 3.95Å; E536-R609 PolarHBondContact OE2-NH2 2.73Å; E536-R609 VanDerWaalsContact OE2-NH2 3.09Å; Y605-R609 WeakPolarHBondContact O-CB 3.18Å; Y605-R609 PolarHBondContact O-N 3.3Å; Y605-R609 VanDerWaalsContact O-N 3.08Å; Y605-R609 PolarHBondContact OH-NH1 3.24Å; Y606-R609 PolarHBondContact O-N 2.84Å; V607-R609 PolarHBondContact O-N 3.49Å
610	H	83	Confident	84.9	Confident	50 Å²	50	72.2 Å²	72.2	23%	0.231	38%	0.381	C	S	.	.	S	Bend	trans	-134	76.3	-173.6	-62.3	-64.6	0	0	0	111.7	Y606 V607 R613	Y606-H610 AromaticContact CD2-CD2 3.63Å; Y606-H610 HydrophobicContact CE1-CB 4.21Å; Y606-H610 AromaticContact CE2-CD2 3.33Å; Y606-H610 WeakPolarHBondContact CE2-CD2 3.49Å; Y606-H610 AromaticContact CZ-CD2 3.78Å; Y606-H610 WeakPolarHBondContact O-CB 3.23Å; Y606-H610 PolarHBondContact O-N 2.7Å; V607-H610 CarbonylContact O-C 3.46Å; V607-H610 PolarHBondContact O-N 3.02Å; H610-R613 HydrophobicContact CB-CB 4.44Å; H610-R613 HydrophobicContact CB-CG 4.24Å; H610-R613 PolarHBondContact O-N 2.95Å
611	N	78.9	Confident	84.7	Confident	142 Å²	142	70 Å²	70	76%	0.759	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50	141	174	-71.5	-28.2	0	0	0	112.1	R613	N611-R613 VanDerWaalsContact C-N 3.28Å; N611-R613 PolarHBondContact O-N 3.34Å
612	G	78.8	Confident	84.8	Confident	93 Å²	93	70 Å²	70	96%	0.959	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	79	-3.2	179.1	0	0	0	0	0	115.7
613	R	85.3	Confident	84.8	Confident	142 Å²	142	75.1 Å²	75.1	54%	0.536	39%	0.389	S	S	.	.			trans	-98.7	146.2	175.6	-58.1	-168.1	-175.2	170.2	-1	112	Y606 H610 N611	Y606-R613 HydrophobicContact CE1-CB 3.84Å; Y606-R613 VanDerWaalsContact OH-CD 3.31Å; Y606-R613 WeakPolarHBondContact OH-CD 3.34Å; Y606-R613 PolarHBondContact OH-NH1 3.34Å; H610-R613 HydrophobicContact CB-CB 4.44Å; H610-R613 HydrophobicContact CB-CG 4.24Å; H610-R613 PolarHBondContact O-N 2.95Å; N611-R613 VanDerWaalsContact C-N 3.28Å; N611-R613 PolarHBondContact O-N 3.34Å
614	K	82.1	Confident	84.8	Confident	202 Å²	202	75.8 Å²	75.8	88%	0.878	39%	0.392	S	S	*	.			trans	-121	129.1	175.2	-176.9	177.8	179.1	-179.2	0	109.8
615	I	85.9	Confident	85	Confident	41 Å²	41	77.9 Å²	77.9	21%	0.21	40%	0.399	C	S	.	.			trans	-81.1	137.9	172	-68.3	166.1	0	0	0	109.6	F602 Y606 W617	F602-I615 HydrophobicContact CD1-CD1 4.16Å; F602-I615 HydrophobicContact CE1-CD1 4.04Å; Y606-I615 HydrophobicContact CD1-CD1 3.48Å; Y606-I615 VanDerWaalsContact CD1-CD1 3.48Å; Y606-I615 HydrophobicContact CD1-CG1 3.62Å; Y606-I615 HydrophobicContact CD2-CD1 4.44Å; Y606-I615 HydrophobicContact CE1-CD1 4.26Å; Y606-I615 HydrophobicContact CE1-CG1 3.95Å; Y606-I615 HydrophobicContact CG-CD1 3.58Å; Y606-I615 HydrophobicContact CG-CG1 4.2Å; I615-W617 HydrophobicContact CG2-CD2 4.06Å; I615-W617 HydrophobicContact CG2-CG 4.15Å; I615-W617 HydrophobicContact CG2-CZ2 4.25Å
616	S	86.3	Confident	85	Confident	99 Å²	99	78.7 Å²	78.7	69%	0.692	41%	0.408	S	S	*	.			trans	-117.7	129.5	162.9	-170.9	0	0	0	0	108.3
617	W	86.2	Confident	85	Confident	63 Å²	63	82.6 Å²	82.6	24%	0.239	43%	0.429	C	S	.	.			trans	-94.4	121.3	-173.4	-70.6	97.6	0	0	0	111.4	F571 V573 M599 F602 S603 I615 H619	F571-W617 HydrophobicContact CE1-CH2 4.41Å; F571-W617 AromaticContact CZ-CH2 3.94Å; F571-W617 HydrophobicContact CZ-CH2 3.94Å; F571-W617 HydrophobicContact CZ-CZ3 4.25Å; V573-W617 HydrophobicContact CG1-CH2 3.97Å; V573-W617 HydrophobicContact CG1-CZ3 3.89Å; V573-W617 HydrophobicContact CG2-CH2 4.02Å; V573-W617 HydrophobicContact CG2-CZ3 4.24Å; M599-W617 HydrophobicContact CB-CH2 4.29Å; M599-W617 HydrophobicContact CB-CZ2 3.93Å; M599-W617 HydrophobicContact CE-CB 3.79Å; M599-W617 HydrophobicContact CE-CD2 3.28Å; M599-W617 HydrophobicContact CE-CE3 3.7Å; M599-W617 HydrophobicContact CE-CG 3.32Å; M599-W617 HydrophobicContact CE-CZ2 4.41Å; M599-W617 HydrophobicContact CE-CZ3 4.41Å; M599-W617 HydrophobicContact CG-CD2 4.46Å; M599-W617 HydrophobicContact CG-CE3 4.36Å; M599-W617 HydrophobicContact CG-CH2 4.01Å; M599-W617 HydrophobicContact CG-CZ2 4.09Å; M599-W617 HydrophobicContact CG-CZ3 4.14Å; F602-W617 AromaticContact CD1-CH2 3.92Å; F602-W617 HydrophobicContact CD1-CH2 3.92Å; F602-W617 HydrophobicContact CD1-CZ2 4.12Å; S603-W617 PolarHBondContact OG-NE1 3.34Å; I615-W617 HydrophobicContact CG2-CD2 4.06Å; I615-W617 HydrophobicContact CG2-CG 4.15Å; I615-W617 HydrophobicContact CG2-CZ2 4.25Å; W617-H619 PolarHBondContact O-N 3.14Å
618	L	87.8	Confident	85	Confident	46 Å²	46	79.9 Å²	79.9	24%	0.241	41%	0.414	C	S	.	.			trans	-94.2	84.6	179.4	-54.8	-176.4	0	0	0	111.2	L583 A585 N620 Y621 S622	L583-L618 HydrophobicContact CB-CD1 3.88Å; A585-L618 HydrophobicContact CB-CD2 3.77Å; L618-N620 VanDerWaalsContact C-N 3.28Å; L618-N620 PolarHBondContact O-N 3.28Å; L618-Y621 HydrophobicContact CB-CD2 3.97Å; L618-Y621 HydrophobicContact CD1-CD2 4.1Å; L618-Y621 HydrophobicContact CD1-CE2 4.38Å; L618-Y621 PolarHBondContact O-N 3.32Å; L618-S622 PolarHBondContact O-OG 3.25Å; L618-S622 VanDerWaalsContact O-OG 3.12Å
619	H	86.4	Confident	85	Confident	21 Å²	21	79.4 Å²	79.4	10%	0.097	41%	0.407	C	S	.	.	G	3₁₀ helix	trans	-61	-31.3	-174.2	-67	-55.9	0	0	0	114.8	V589 W617 Y621 S622 L641 F642	V589-H619 HydrophobicContact CG1-CB 4.29Å; W617-H619 PolarHBondContact O-N 3.14Å; H619-Y621 PolarHBondContact O-N 3.43Å; H619-S622 WeakPolarHBondContact O-CB 3.29Å; H619-S622 PolarHBondContact O-N 3.5Å; H619-L641 HydrophobicContact CB-CD2 3.93Å; H619-L641 WeakPolarHBondContact ND1-CD2 3.32Å; H619-F642 HydrophobicContact CB-CE1 3.85Å; H619-F642 HydrophobicContact CB-CZ 4.31Å
620	N	81.6	Confident	84.7	Confident	11 Å²	11	77.8 Å²	77.8	6%	0.059	41%	0.413	C	S	.	.	G	3₁₀ helix	trans	-67.1	-33.4	-179.6	54.7	-41.8	0	0	0	113.8	S584 T586 L618 S622 F642 E737	S584-N620 PolarHBondContact O-ND2 2.78Å; T586-N620 PolarHBondContact OG1-ND2 3.45Å; L618-N620 VanDerWaalsContact C-N 3.28Å; L618-N620 PolarHBondContact O-N 3.28Å; N620-S622 VanDerWaalsContact C-N 3.33Å; N620-F642 HydrophobicContact CB-CE2 3.68Å; N620-F642 HydrophobicContact CB-CZ 3.84Å; N620-E737 WeakPolarHBondContact CB-OE1 3.41Å; N620-E737 PolarHBondContact ND2-OE1 3.01Å; N620-E737 VanDerWaalsContact ND2-OE1 3.11Å
621	Y	83	Confident	84.7	Confident	57 Å²	57	76.8 Å²	76.8	22%	0.224	41%	0.408	C	S	.	.	G	3₁₀ helix	trans	-87.5	-1.9	175.7	-57.2	-71.2	0	0	0	113.4	L583 L618 H619	L583-Y621 HydrophobicContact CB-CE2 3.87Å; L583-Y621 HydrophobicContact CD2-CE1 3.98Å; L583-Y621 HydrophobicContact CD2-CE2 3.93Å; L583-Y621 HydrophobicContact CG-CE2 4.37Å; L618-Y621 HydrophobicContact CB-CD2 3.97Å; L618-Y621 HydrophobicContact CD1-CD2 4.1Å; L618-Y621 HydrophobicContact CD1-CE2 4.38Å; L618-Y621 PolarHBondContact O-N 3.32Å; H619-Y621 PolarHBondContact O-N 3.43Å
622	S	86.5	Confident	84.7	Confident	38 Å²	38	74.4 Å²	74.4	27%	0.266	40%	0.395	S	S	.	.			trans	-77.9	126.9	-179.5	-60.3	0	0	0	0	111.3	L618 H619 N620 L641	L618-S622 PolarHBondContact O-OG 3.25Å; L618-S622 VanDerWaalsContact O-OG 3.12Å; H619-S622 WeakPolarHBondContact O-CB 3.29Å; H619-S622 PolarHBondContact O-N 3.5Å; N620-S622 VanDerWaalsContact C-N 3.33Å; S622-L641 PolarHBondContact O-N 2.71Å
623	K	87.5	Confident	84.8	Confident	108 Å²	108	75.9 Å²	75.9	47%	0.47	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	144.4	174.2	-63.7	-178.2	-176.5	176	0	110.6	M639	K623-M639 CarbonylContact C-O 3.53Å; K623-M639 WeakPolarHBondContact CA-O 3.23Å
624	V	87.9	Confident	84.7	Confident	34 Å²	34	76.3 Å²	76.3	21%	0.206	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	134.6	178.1	-173.4	0	0	0	0	108.8	V626 M639 L641 A644	V624-V626 HydrophobicContact CB-CG2 4.48Å; V624-V626 HydrophobicContact CG1-CG2 3.81Å; V624-M639 PolarHBondContact N-O 3.18Å; V624-M639 PolarHBondContact O-N 2.96Å; V624-L641 HydrophobicContact CG2-CB 4.31Å; V624-L641 HydrophobicContact CG2-CD1 3.82Å; V624-A644 HydrophobicContact CB-CB 4.17Å; V624-A644 HydrophobicContact CG1-CB 4.4Å; V624-A644 HydrophobicContact CG2-CB 4.31Å
625	E	88.8	Confident	85	Confident	118 Å²	118	66.7 Å²	66.7	55%	0.551	34%	0.336	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.9	111.4	168.4	-54.1	-150.1	160.8	0	0	109.4	L637 V638 K726	E625-L637 WeakPolarHBondContact CA-O 3.26Å; E625-V638 HydrophobicContact CG-CG2 4.1Å; E625-K726 VanDerWaalsContact OE1-CE 3.28Å; E625-K726 WeakPolarHBondContact OE1-CE 3.43Å; E625-K726 IonicContact OE1-NZ 2.68Å; E625-K726 PolarHBondContact OE1-NZ 3.39Å; E625-K726 IonicContact OE2-NZ 2.99Å; E625-K726 PolarHBondContact OE2-NZ 2.85Å
626	V	87.2	Confident	85.2	Confident	50 Å²	50	66.1 Å²	66.1	30%	0.303	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	127.7	-178.4	180	0	0	0	0	109.8	V624 L637 M639 A644	V624-V626 HydrophobicContact CB-CG2 4.48Å; V624-V626 HydrophobicContact CG1-CG2 3.81Å; V626-L637 PolarHBondContact N-O 3.2Å; V626-L637 PolarHBondContact O-N 2.71Å; V626-M639 HydrophobicContact CB-SD 3.95Å; V626-M639 HydrophobicContact CG2-CG 3.96Å; V626-M639 HydrophobicContact CG2-SD 3.58Å; V626-M639 VanDerWaalsContact CG2-SD 3.58Å; V626-A644 HydrophobicContact CG2-CB 4.12Å
627	L	87.9	Confident	85.3	Confident	99 Å²	99	61.6 Å²	61.6	52%	0.518	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	105.1	174.1	-167.3	66.9	0	0	0	109.7	H629	L627-H629 WeakPolarHBondContact CD2-NE2 3.43Å
628	A	85.5	Confident	85.5	Confident	10 Å²	10	59.2 Å²	59.2	8%	0.083	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	121.4	-178.4	0	0	0	0	0	111.2	F631 Y635 L637	A628-F631 HydrophobicContact CB-CD2 3.85Å; A628-F631 HydrophobicContact CB-CE2 3.89Å; A628-Y635 PolarHBondContact N-O 2.97Å; A628-Y635 PolarHBondContact O-N 2.85Å; A628-L637 HydrophobicContact CB-CD1 3.99Å; A628-L637 HydrophobicContact CB-CG 4.25Å
629	H	84.6	Confident	85.6	Confident	124 Å²	124	57 Å²	57	57%	0.574	28%	0.284	S	S	*	.			trans	-105.9	-10.3	-179.4	-69.1	-65.6	0	0	0	114.4	L627 F631	L627-H629 WeakPolarHBondContact CD2-NE2 3.43Å; H629-F631 VanDerWaalsContact C-N 3.35Å; H629-F631 PolarHBondContact O-N 3.06Å
630	C	77.6	Confident	85.7	Confident	85 Å²	85	57.1 Å²	57.1	57%	0.574	29%	0.286	S	S	*	.	S	Bend	trans	-84	1.9	-174.9	51.8	0	0	0	0	115.1	L717	C630-L717 HydrophobicContact CB-CD2 4.45Å
631	F	82.6	Confident	86	Confident	30 Å²	30	57.1 Å²	57.1	13%	0.132	29%	0.286	C	S	.	.	S	Bend	trans	-112.9	175.1	-177.1	-56.2	-51.6	0	0	0	112.6	A628 H629 R633 Y635 I684 L717 C718 F720	A628-F631 HydrophobicContact CB-CD2 3.85Å; A628-F631 HydrophobicContact CB-CE2 3.89Å; H629-F631 VanDerWaalsContact C-N 3.35Å; H629-F631 PolarHBondContact O-N 3.06Å; F631-R633 PolarHBondContact O-N 3.1Å; F631-Y635 HydrophobicContact CB-CD2 4.01Å; F631-Y635 HydrophobicContact CB-CE2 3.99Å; F631-Y635 HydrophobicContact CD2-CD2 4.07Å; F631-Y635 HydrophobicContact CG-CD2 4.47Å; F631-I684 HydrophobicContact CZ-CG2 4.08Å; F631-L717 HydrophobicContact CZ-CD1 4.35Å; F631-C718 VanDerWaalsContact CE1-O 3.29Å; F631-C718 WeakPolarHBondContact CE1-O 3.32Å; F631-F720 HydrophobicContact CD1-CB 3.88Å; F631-F720 HydrophobicContact CD2-CB 4.32Å; F631-F720 HydrophobicContact CD2-CD1 4.35Å; F631-F720 HydrophobicContact CE1-CB 3.76Å; F631-F720 HydrophobicContact CE2-CB 4.2Å; F631-F720 HydrophobicContact CE2-CD1 4.5Å; F631-F720 HydrophobicContact CG-CB 4.17Å; F631-F720 HydrophobicContact CZ-CB 3.92Å
632	D	78.8	Confident	86.4	Confident	92 Å²	92	54.5 Å²	54.5	49%	0.492	28%	0.276	S	S	.	.	S	Bend	trans	-57.2	-21.7	179.7	78	-32.8	0	0	0	114.1	Y635 R721	D632-Y635 WeakPolarHBondContact OD1-CE2 3.35Å; D632-Y635 PolarHBondContact OD1-OH 3.45Å; D632-Y635 VanDerWaalsContact OD1-OH 3.04Å; D632-R721 IonicContact OD2-NE 3.44Å; D632-R721 PolarHBondContact OD2-NE 2.85Å
633	R	82.4	Confident	86.5	Confident	123 Å²	123	52.7 Å²	52.7	46%	0.464	26%	0.263	S	S	.	.	S	Bend	trans	-138.7	154.1	179.3	-62.1	175.5	178.6	-153.9	-9.5	110	F631 Y635 L725	F631-R633 PolarHBondContact O-N 3.1Å; R633-Y635 HydrophobicContact CB-CD2 4.25Å; R633-Y635 HydrophobicContact CB-CE1 4.43Å; R633-Y635 HydrophobicContact CB-CE2 3.76Å; R633-Y635 WeakPolarHBondContact O-CD2 3.41Å; R633-Y635 PolarHBondContact O-N 2.65Å; R633-Y635 VanDerWaalsContact O-N 3.14Å; R633-L725 HydrophobicContact CB-CD2 4.46Å
634	K	83	Confident	86.6	Confident	151 Å²	151	48 Å²	48	66%	0.657	25%	0.245	S	C	*	.			trans	-70.9	104	168.3	-61.7	-178.5	-176.6	-179.6	0	108.7
635	Y	88.1	Confident	86.6	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	139.3	176.1	-65.3	-81.6	0	0	0	110.5	A628 F631 D632 R633 F720 S722 L725 L727	A628-Y635 PolarHBondContact N-O 2.97Å; A628-Y635 PolarHBondContact O-N 2.85Å; F631-Y635 HydrophobicContact CB-CD2 4.01Å; F631-Y635 HydrophobicContact CB-CE2 3.99Å; F631-Y635 HydrophobicContact CD2-CD2 4.07Å; F631-Y635 HydrophobicContact CG-CD2 4.47Å; D632-Y635 WeakPolarHBondContact OD1-CE2 3.35Å; D632-Y635 PolarHBondContact OD1-OH 3.45Å; D632-Y635 VanDerWaalsContact OD1-OH 3.04Å; R633-Y635 HydrophobicContact CB-CD2 4.25Å; R633-Y635 HydrophobicContact CB-CE1 4.43Å; R633-Y635 HydrophobicContact CB-CE2 3.76Å; R633-Y635 WeakPolarHBondContact O-CD2 3.41Å; R633-Y635 PolarHBondContact O-N 2.65Å; R633-Y635 VanDerWaalsContact O-N 3.14Å; Y635-F720 HydrophobicContact CD1-CE1 4.32Å; Y635-F720 HydrophobicContact CD2-CD1 4.16Å; Y635-F720 HydrophobicContact CD2-CE1 4.36Å; Y635-F720 HydrophobicContact CE1-CE1 4.29Å; Y635-F720 HydrophobicContact CE2-CD1 4.04Å; Y635-F720 HydrophobicContact CE2-CE1 4.32Å; Y635-F720 HydrophobicContact CG-CE1 4.37Å; Y635-S722 PolarHBondContact OH-N 2.9Å; Y635-S722 VanDerWaalsContact OH-N 3.09Å; Y635-S722 PolarHBondContact OH-O 2.88Å; Y635-L725 WeakPolarHBondContact CA-O 3.17Å; Y635-L727 HydrophobicContact CD1-CD1 3.86Å; Y635-L727 HydrophobicContact CE1-CD1 4.44Å; Y635-L727 HydrophobicContact CG-CD1 4.46Å
636	C	88.9	Confident	86.6	Confident	29 Å²	29	41.2 Å²	41.2	20%	0.196	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	111.2	169	172.2	0	0	0	0	107.9	L725 K726 L727	C636-L725 PolarHBondContact N-O 2.78Å; C636-K726 HydrophobicContact CB-CB 4.34Å; C636-K726 HydrophobicContact CB-CG 4.27Å; C636-K726 CarbonylContact O-C 3.58Å; C636-K726 VanDerWaalsContact O-CA 3.31Å; C636-K726 WeakPolarHBondContact O-CA 3.38Å; C636-L727 PolarHBondContact O-N 3.44Å
637	L	89.8	Confident	86.7	Confident	4 Å²	4	39.9 Å²	39.9	2%	0.021	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	113.3	-175.7	-44.9	-174.9	0	0	0	108.8	E625 V626 A628 M639 L727 F729	E625-L637 WeakPolarHBondContact CA-O 3.26Å; V626-L637 PolarHBondContact N-O 3.2Å; V626-L637 PolarHBondContact O-N 2.71Å; A628-L637 HydrophobicContact CB-CD1 3.99Å; A628-L637 HydrophobicContact CB-CG 4.25Å; L637-M639 HydrophobicContact CB-CE 3.52Å; L637-M639 HydrophobicContact CB-SD 4.41Å; L637-M639 HydrophobicContact CD1-CE 3.78Å; L637-M639 HydrophobicContact CG-CE 4.31Å; L637-L727 HydrophobicContact CD2-CB 4.15Å; L637-L727 HydrophobicContact CD2-CD1 3.87Å; L637-F729 HydrophobicContact CB-CD2 4.33Å; L637-F729 HydrophobicContact CB-CE2 4.31Å; L637-F729 HydrophobicContact CD1-CE2 4.31Å; L637-F729 HydrophobicContact CD2-CE2 3.9Å; L637-F729 HydrophobicContact CG-CE2 4.4Å
638	V	89.6	Confident	86.6	Confident	13 Å²	13	37 Å²	37	8%	0.079	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	117.7	170.3	-172.1	0	0	0	0	107.3	E625 K726 L727 D728 F729 S730	E625-V638 HydrophobicContact CG-CG2 4.1Å; V638-K726 VanDerWaalsContact CG2-CE 3.47Å; V638-K726 HydrophobicContact CG2-CG 4.29Å; V638-L727 PolarHBondContact N-O 3.1Å; V638-D728 HydrophobicContact CB-CB 4.26Å; V638-F729 PolarHBondContact O-N 3.42Å; V638-S730 PolarHBondContact O-N 2.81Å
639	M	89.5	Confident	86.8	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	161.3	-169.9	38	-177.5	52	0	0	111.3	K623 V624 V626 L637 Q643 A644 L647 F729	K623-M639 CarbonylContact C-O 3.53Å; K623-M639 WeakPolarHBondContact CA-O 3.23Å; V624-M639 PolarHBondContact N-O 3.18Å; V624-M639 PolarHBondContact O-N 2.96Å; V626-M639 HydrophobicContact CB-SD 3.95Å; V626-M639 HydrophobicContact CG2-CG 3.96Å; V626-M639 HydrophobicContact CG2-SD 3.58Å; V626-M639 VanDerWaalsContact CG2-SD 3.58Å; L637-M639 HydrophobicContact CB-CE 3.52Å; L637-M639 HydrophobicContact CB-SD 4.41Å; L637-M639 HydrophobicContact CD1-CE 3.78Å; L637-M639 HydrophobicContact CG-CE 4.31Å; M639-Q643 VanDerWaalsContact CA-OE1 3.29Å; M639-Q643 HydrophobicContact CB-CB 3.88Å; M639-A644 HydrophobicContact CG-CB 4.19Å; M639-A644 HydrophobicContact SD-CB 3.98Å; M639-L647 HydrophobicContact CE-CD1 3.28Å; M639-L647 HydrophobicContact SD-CD1 3.9Å; M639-F729 HydrophobicContact CE-CD2 4.16Å
640	T	88.8	Confident	86.9	Confident	23 Å²	23	32.3 Å²	32.3	14%	0.141	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	156	170.5	69.2	0	0	0	0	109.9	F642 Q643 A644	T640-F642 PolarHBondContact O-N 3.29Å; T640-Q643 WeakPolarHBondContact O-CB 3.37Å; T640-Q643 PolarHBondContact O-N 2.89Å; T640-Q643 VanDerWaalsContact O-N 3.1Å; T640-Q643 VanDerWaalsContact OG1-CG 3.31Å; T640-Q643 WeakPolarHBondContact OG1-CG 3.21Å; T640-Q643 PolarHBondContact OG1-N 2.71Å; T640-A644 PolarHBondContact O-N 3.09Å
641	L	88.9	Confident	87.4	Confident	11 Å²	11	33.9 Å²	33.9	6%	0.058	17%	0.166	C	C	.	.	H	α-helix	trans	-57.4	-33.3	177.2	-177.5	59.4	0	0	0	112.6	V589 L591 I595 H619 S622 V624 A644 S645	V589-L641 HydrophobicContact CG1-CD2 4.14Å; V589-L641 HydrophobicContact CG1-CG 4.19Å; L591-L641 HydrophobicContact CD2-CD1 4.36Å; L591-L641 HydrophobicContact CD2-CD2 3.95Å; I595-L641 HydrophobicContact CD1-CD1 4.3Å; H619-L641 HydrophobicContact CB-CD2 3.93Å; H619-L641 WeakPolarHBondContact ND1-CD2 3.32Å; S622-L641 PolarHBondContact O-N 2.71Å; V624-L641 HydrophobicContact CG2-CB 4.31Å; V624-L641 HydrophobicContact CG2-CD1 3.82Å; L641-A644 PolarHBondContact O-N 3.08Å; L641-S645 WeakPolarHBondContact O-CB 3.46Å; L641-S645 PolarHBondContact O-N 3.01Å; L641-S645 PolarHBondContact O-OG 3.48Å
642	F	89.9	Confident	87.5	Confident	2 Å²	2	39.1 Å²	39.1	1%	0.009	19%	0.19	C	C	.	.	H	α-helix	trans	-67.4	-44	174.2	-56.5	-28.5	0	0	0	112.8	A587 V589 H619 N620 T640 A644 S645 I646 L667 I671 V675 L734	A587-F642 HydrophobicContact CB-CZ 4.14Å; V589-F642 HydrophobicContact CB-CD1 4.14Å; V589-F642 HydrophobicContact CB-CE1 4.17Å; V589-F642 HydrophobicContact CG1-CD1 4.33Å; V589-F642 HydrophobicContact CG1-CE1 4.31Å; V589-F642 HydrophobicContact CG2-CD1 4.39Å; H619-F642 HydrophobicContact CB-CE1 3.85Å; H619-F642 HydrophobicContact CB-CZ 4.31Å; N620-F642 HydrophobicContact CB-CE2 3.68Å; N620-F642 HydrophobicContact CB-CZ 3.84Å; T640-F642 PolarHBondContact O-N 3.29Å; F642-A644 VanDerWaalsContact C-N 3.33Å; F642-A644 PolarHBondContact O-N 2.78Å; F642-S645 PolarHBondContact O-N 3.41Å; F642-S645 PolarHBondContact O-OG 3.22Å; F642-I646 PolarHBondContact O-N 3.29Å; F642-L667 HydrophobicContact CB-CD1 4.23Å; F642-L667 HydrophobicContact CD1-CD2 3.64Å; F642-L667 HydrophobicContact CE1-CD2 3.84Å; F642-L667 HydrophobicContact CG-CD2 4.14Å; F642-L667 HydrophobicContact CZ-CD2 4.48Å; F642-I671 HydrophobicContact CD2-CG2 4.11Å; F642-I671 HydrophobicContact CE2-CG2 4.32Å; F642-V675 HydrophobicContact CB-CG2 4.16Å; F642-L734 HydrophobicContact CD2-CD1 4.34Å
643	Q	89.8	Confident	87.7	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-60.6	-43.9	174.3	-73.6	166.3	-4	0	0	110.7	M639 T640 I646 L647 V675 L679 F729	M639-Q643 VanDerWaalsContact CA-OE1 3.29Å; M639-Q643 HydrophobicContact CB-CB 3.88Å; T640-Q643 WeakPolarHBondContact O-CB 3.37Å; T640-Q643 PolarHBondContact O-N 2.89Å; T640-Q643 VanDerWaalsContact O-N 3.1Å; T640-Q643 VanDerWaalsContact OG1-CG 3.31Å; T640-Q643 WeakPolarHBondContact OG1-CG 3.21Å; T640-Q643 PolarHBondContact OG1-N 2.71Å; Q643-I646 PolarHBondContact O-N 2.88Å; Q643-L647 PolarHBondContact O-N 3.41Å; Q643-L647 VanDerWaalsContact O-N 3.16Å; Q643-V675 HydrophobicContact CB-CG1 4.3Å; Q643-V675 HydrophobicContact CG-CG1 3.68Å; Q643-L679 HydrophobicContact CB-CD2 4.5Å; Q643-L679 HydrophobicContact CG-CD2 4.48Å; Q643-F729 PolarHBondContact NE2-O 2.9Å; Q643-F729 VanDerWaalsContact NE2-O 3.14Å
644	A	88.8	Confident	87.7	Confident	11 Å²	11	36.6 Å²	36.6	9%	0.091	19%	0.192	C	C	.	.	H	α-helix	trans	-64.4	-44.1	178	0	0	0	0	0	112.5	V624 V626 M639 T640 L641 F642 I646 L647 Q648	V624-A644 HydrophobicContact CB-CB 4.17Å; V624-A644 HydrophobicContact CG1-CB 4.4Å; V624-A644 HydrophobicContact CG2-CB 4.31Å; V626-A644 HydrophobicContact CG2-CB 4.12Å; M639-A644 HydrophobicContact CG-CB 4.19Å; M639-A644 HydrophobicContact SD-CB 3.98Å; T640-A644 PolarHBondContact O-N 3.09Å; L641-A644 PolarHBondContact O-N 3.08Å; F642-A644 VanDerWaalsContact C-N 3.33Å; F642-A644 PolarHBondContact O-N 2.78Å; A644-I646 PolarHBondContact O-N 3.28Å; A644-L647 PolarHBondContact O-N 2.82Å; A644-Q648 WeakPolarHBondContact O-CB 3.43Å; A644-Q648 PolarHBondContact O-N 2.8Å
645	S	87.8	Confident	87.8	Confident	8 Å²	8	31.9 Å²	31.9	6%	0.056	18%	0.178	C	C	.	.	H	α-helix	trans	-62.2	-29.9	-179.4	63	0	0	0	0	113.8	V589 L641 F642 Q649	V589-S645 WeakPolarHBondContact CG2-OG 3.29Å; L641-S645 WeakPolarHBondContact O-CB 3.46Å; L641-S645 PolarHBondContact O-N 3.01Å; L641-S645 PolarHBondContact O-OG 3.48Å; F642-S645 PolarHBondContact O-N 3.41Å; F642-S645 PolarHBondContact O-OG 3.22Å; S645-Q649 WeakPolarHBondContact O-CG 3.35Å; S645-Q649 PolarHBondContact O-NE2 3.15Å
646	I	89.8	Confident	87.8	Confident	0 Å²	0	33.2 Å²	33.2	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-77.9	-53.7	176.4	-67.8	163.7	0	0	0	109.9	F642 Q643 A644 Q648 Q649 F650 L661 T665 L667 L672 V675 L676 L679	F642-I646 PolarHBondContact O-N 3.29Å; Q643-I646 PolarHBondContact O-N 2.88Å; A644-I646 PolarHBondContact O-N 3.28Å; I646-Q648 PolarHBondContact O-N 2.82Å; I646-Q649 WeakPolarHBondContact O-CB 2.97Å; I646-Q649 PolarHBondContact O-N 2.85Å; I646-F650 HydrophobicContact CG2-CE2 4.23Å; I646-F650 WeakPolarHBondContact O-CD2 3.38Å; I646-L661 HydrophobicContact CG2-CD1 4.35Å; I646-T665 HydrophobicContact CG1-CG2 4.11Å; I646-L667 HydrophobicContact CD1-CD1 4.21Å; I646-L667 HydrophobicContact CG1-CD1 4.44Å; I646-L672 HydrophobicContact CD1-CD1 3.6Å; I646-L672 HydrophobicContact CG1-CD1 4.09Å; I646-V675 HydrophobicContact CD1-CB 3.96Å; I646-V675 HydrophobicContact CD1-CG1 3.56Å; I646-L676 HydrophobicContact CG2-CD2 4.14Å; I646-L679 HydrophobicContact CB-CD1 4.31Å; I646-L679 HydrophobicContact CG2-CD1 3.93Å
647	L	88.5	Confident	87.7	Confident	22 Å²	22	33.6 Å²	33.6	12%	0.115	19%	0.185	C	C	.	.	H	α-helix	trans	-60.6	-31.6	-177.3	-75.3	174.6	0	0	0	112.9	M639 Q643 A644 Q649 F650 L679 I684 V685 L717	M639-L647 HydrophobicContact CE-CD1 3.28Å; M639-L647 HydrophobicContact SD-CD1 3.9Å; Q643-L647 PolarHBondContact O-N 3.41Å; Q643-L647 VanDerWaalsContact O-N 3.16Å; A644-L647 PolarHBondContact O-N 2.82Å; L647-Q649 VanDerWaalsContact C-N 3.25Å; L647-Q649 PolarHBondContact O-N 2.7Å; L647-F650 WeakPolarHBondContact O-CB 3.44Å; L647-F650 PolarHBondContact O-N 3.32Å; L647-F650 VanDerWaalsContact O-N 3.15Å; L647-L679 HydrophobicContact CD1-CD2 3.78Å; L647-L679 HydrophobicContact CD2-CD1 4.32Å; L647-L679 HydrophobicContact CD2-CD2 4.3Å; L647-L679 HydrophobicContact CG-CD1 4.16Å; L647-L679 HydrophobicContact CG-CD2 4.04Å; L647-I684 HydrophobicContact CD1-CD1 4.48Å; L647-I684 HydrophobicContact CD1-CG2 4.32Å; L647-I684 HydrophobicContact CD2-CG2 3.58Å; L647-V685 HydrophobicContact CD2-CG1 3.95Å; L647-L717 HydrophobicContact CD2-CD1 4.48Å
648	Q	86.6	Confident	87.6	Confident	40 Å²	40	33.5 Å²	33.5	19%	0.187	18%	0.184	C	C	.	.	G	3₁₀ helix	trans	-70.1	-16.9	178.7	-176	-113	-52.7	0	0	113.9	Q592 A644 I646 F650 N651	Q592-Q648 VanDerWaalsContact CD-CD 3.48Å; Q592-Q648 VanDerWaalsContact CD-OE1 3.32Å; Q592-Q648 VanDerWaalsContact CG-CD 3.47Å; Q592-Q648 HydrophobicContact CG-CG 4.37Å; Q592-Q648 VanDerWaalsContact NE2-CG 3.34Å; A644-Q648 WeakPolarHBondContact O-CB 3.43Å; A644-Q648 PolarHBondContact O-N 2.8Å; I646-Q648 PolarHBondContact O-N 2.82Å; Q648-F650 VanDerWaalsContact C-N 3.27Å; Q648-N651 WeakPolarHBondContact O-CB 3.46Å; Q648-N651 PolarHBondContact O-N 2.79Å; Q648-N651 PolarHBondContact O-ND2 2.99Å
649	Q	88.1	Confident	87.4	Confident	22 Å²	22	36.1 Å²	36.1	10%	0.103	20%	0.196	C	C	.	.	G	3₁₀ helix	trans	-68.7	-30.3	170.7	-53.5	-45	-45	0	0	111.5	S645 I646 L647 N651 H652 Y656 L661 I664	S645-Q649 WeakPolarHBondContact O-CG 3.35Å; S645-Q649 PolarHBondContact O-NE2 3.15Å; I646-Q649 WeakPolarHBondContact O-CB 2.97Å; I646-Q649 PolarHBondContact O-N 2.85Å; L647-Q649 VanDerWaalsContact C-N 3.25Å; L647-Q649 PolarHBondContact O-N 2.7Å; Q649-N651 PolarHBondContact O-N 3.26Å; Q649-H652 PolarHBondContact O-N 2.97Å; Q649-Y656 HydrophobicContact CB-CD2 4.23Å; Q649-Y656 HydrophobicContact CB-CE2 3.71Å; Q649-Y656 WeakPolarHBondContact O-CE2 3.27Å; Q649-Y656 PolarHBondContact O-OH 3.45Å; Q649-Y656 VanDerWaalsContact O-OH 3.06Å; Q649-L661 HydrophobicContact CB-CD2 4.29Å; Q649-L661 HydrophobicContact CG-CD2 4.25Å; Q649-I664 VanDerWaalsContact CD-CG2 3.47Å; Q649-I664 HydrophobicContact CG-CG2 4.02Å; Q649-I664 VanDerWaalsContact OE1-CG2 3.3Å
650	F	88.5	Confident	87.4	Confident	12 Å²	12	40.4 Å²	40.4	5%	0.053	22%	0.216	C	C	.	.	G	3₁₀ helix	trans	-68.8	-1.5	176.9	-61.1	-92	0	0	0	113.9	I646 L647 Q648 H652 A653 D654 Y656 V685 I715 L717	I646-F650 HydrophobicContact CG2-CE2 4.23Å; I646-F650 WeakPolarHBondContact O-CD2 3.38Å; L647-F650 WeakPolarHBondContact O-CB 3.44Å; L647-F650 PolarHBondContact O-N 3.32Å; L647-F650 VanDerWaalsContact O-N 3.15Å; Q648-F650 VanDerWaalsContact C-N 3.27Å; F650-H652 PolarHBondContact O-N 2.94Å; F650-A653 WeakPolarHBondContact CA-O 3.16Å; F650-D654 WeakPolarHBondContact CD1-O 3.49Å; F650-Y656 HydrophobicContact CD1-CD2 4.38Å; F650-Y656 HydrophobicContact CE1-CD2 4.2Å; F650-Y656 HydrophobicContact CZ-CD2 4.36Å; F650-V685 HydrophobicContact CE2-CG1 4.36Å; F650-V685 HydrophobicContact CZ-CG1 4.33Å; F650-I715 HydrophobicContact CZ-CB 4.39Å; F650-I715 HydrophobicContact CZ-CG2 3.91Å; F650-L717 HydrophobicContact CB-CB 4.49Å; F650-L717 HydrophobicContact CB-CD1 4.36Å; F650-L717 HydrophobicContact CB-CD2 4.32Å; F650-L717 HydrophobicContact CD1-CB 3.81Å; F650-L717 HydrophobicContact CE1-CB 4.39Å; F650-L717 HydrophobicContact CG-CB 4.33Å; F650-L717 HydrophobicContact CG-CD1 4.37Å
651	N	86.4	Confident	87.4	Confident	119 Å²	119	39.3 Å²	39.3	64%	0.636	21%	0.209	S	C	*	.	G	3₁₀ helix	trans	-74.8	-9.9	164.4	-64.9	-27.3	0	0	0	113.1	Q648 Q649	Q648-N651 WeakPolarHBondContact O-CB 3.46Å; Q648-N651 PolarHBondContact O-N 2.79Å; Q648-N651 PolarHBondContact O-ND2 2.99Å; Q649-N651 PolarHBondContact O-N 3.26Å
652	H	85.4	Confident	87.4	Confident	139 Å²	139	42 Å²	42	64%	0.644	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-117.4	-27.8	-176.8	-59.9	-59	0	0	0	113.8	Q649 F650 Y656	Q649-H652 PolarHBondContact O-N 2.97Å; F650-H652 PolarHBondContact O-N 2.94Å; H652-Y656 WeakPolarHBondContact CB-OH 3.33Å
653	A	84.1	Confident	87.3	Confident	39 Å²	39	50.1 Å²	50.1	32%	0.322	25%	0.252	S	S	.	.			trans	-155	145.1	172.2	0	0	0	0	0	111	F650 S655 Y656	F650-A653 WeakPolarHBondContact CA-O 3.16Å; A653-S655 PolarHBondContact O-N 3.28Å; A653-Y656 HydrophobicContact CB-CE2 3.92Å; A653-Y656 WeakPolarHBondContact O-CE2 3.35Å
654	D	81.9	Confident	87.2	Confident	124 Å²	124	52.6 Å²	52.6	66%	0.663	26%	0.264	S	S	*	.	S	Bend	trans	-71	-12.9	-177.7	-60.7	-41.5	0	0	0	113.8	F650 L717	F650-D654 WeakPolarHBondContact CD1-O 3.49Å; D654-L717 PolarHBondContact O-N 3.36Å
655	S	83.7	Confident	87.1	Confident	52 Å²	52	52.1 Å²	52.1	36%	0.364	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	149.8	179.3	67.1	0	0	0	0	113.7	A653 I715 H716	A653-S655 PolarHBondContact O-N 3.28Å; S655-I715 WeakPolarHBondContact CA-O 3.48Å; S655-H716 VanDerWaalsContact CB-CE1 3.44Å; S655-H716 WeakPolarHBondContact CB-CE1 3.45Å; S655-H716 WeakPolarHBondContact CB-ND1 3.33Å
656	Y	88.9	Confident	87.1	Confident	28 Å²	28	57 Å²	57	11%	0.11	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	146.9	175.6	-71.9	-86.3	0	0	0	110.9	Q649 F650 H652 A653 Q660 L661 I664 I715	Q649-Y656 HydrophobicContact CB-CD2 4.23Å; Q649-Y656 HydrophobicContact CB-CE2 3.71Å; Q649-Y656 WeakPolarHBondContact O-CE2 3.27Å; Q649-Y656 PolarHBondContact O-OH 3.45Å; Q649-Y656 VanDerWaalsContact O-OH 3.06Å; F650-Y656 HydrophobicContact CD1-CD2 4.38Å; F650-Y656 HydrophobicContact CE1-CD2 4.2Å; F650-Y656 HydrophobicContact CZ-CD2 4.36Å; H652-Y656 WeakPolarHBondContact CB-OH 3.33Å; A653-Y656 HydrophobicContact CB-CE2 3.92Å; A653-Y656 WeakPolarHBondContact O-CE2 3.35Å; Y656-Q660 HydrophobicContact CD1-CB 4.13Å; Y656-L661 HydrophobicContact CD2-CD2 4.12Å; Y656-L661 HydrophobicContact CG-CD2 3.87Å; Y656-L661 HydrophobicContact CG-CG 4.38Å; Y656-I664 HydrophobicContact CD1-CD1 3.96Å; Y656-I664 HydrophobicContact CE1-CD1 3.74Å; Y656-I715 PolarHBondContact N-O 2.97Å; Y656-I715 PolarHBondContact O-N 3.11Å
657	T	87.5	Confident	86.9	Confident	37 Å²	37	57 Å²	57	23%	0.227	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	157	166.8	71.6	0	0	0	0	111.4	E659 Q660 L661 V713	T657-E659 PolarHBondContact O-N 2.78Å; T657-Q660 WeakPolarHBondContact O-CB 3.32Å; T657-Q660 PolarHBondContact O-N 2.86Å; T657-Q660 VanDerWaalsContact O-N 3.08Å; T657-Q660 VanDerWaalsContact OG1-CG 3.3Å; T657-Q660 WeakPolarHBondContact OG1-CG 3.43Å; T657-Q660 PolarHBondContact OG1-N 3.15Å; T657-L661 PolarHBondContact O-N 3.49Å; T657-V713 VanDerWaalsContact CA-O 3.3Å; T657-V713 WeakPolarHBondContact CA-O 3.46Å
658	V	86.3	Confident	86.8	Confident	1 Å²	1	58.3 Å²	58.3	1%	0.006	30%	0.295	C	S	.	.	H	α-helix	trans	-56.8	-38.9	174.5	177.7	0	0	0	0	111.2	L661 Q662 I669 L672 L676 L709 V713 I715	V658-L661 PolarHBondContact O-N 3.49Å; V658-Q662 WeakPolarHBondContact O-CB 3.35Å; V658-Q662 PolarHBondContact O-N 2.89Å; V658-I669 HydrophobicContact CG1-CD1 3.7Å; V658-L672 HydrophobicContact CG1-CD2 4.2Å; V658-L676 HydrophobicContact CG2-CD1 4.2Å; V658-L709 HydrophobicContact CG2-CB 4.27Å; V658-V713 HydrophobicContact CG2-CB 4.25Å; V658-V713 PolarHBondContact N-O 2.99Å; V658-I715 HydrophobicContact CG2-CD1 4.16Å; V658-I715 HydrophobicContact CG2-CG1 4.13Å
659	E	85.7	Confident	86.8	Confident	69 Å²	69	58.5 Å²	58.5	32%	0.322	30%	0.297	S	S	.	.	H	α-helix	trans	-61.8	-41.7	174.4	-170.6	-177.1	159.6	0	0	113	T657 Q662 R663 S711	T657-E659 PolarHBondContact O-N 2.78Å; E659-Q662 PolarHBondContact O-N 2.82Å; E659-R663 WeakPolarHBondContact O-CG 3.27Å; E659-R663 PolarHBondContact O-N 3.23Å; E659-R663 IonicContact OE1-CZ 3.59Å; E659-R663 IonicContact OE1-NH1 2.71Å; E659-R663 PolarHBondContact OE1-NH1 2.73Å; E659-R663 IonicContact OE1-NH2 3.75Å; E659-R663 PolarHBondContact OE1-NH2 2.85Å; E659-S711 PolarHBondContact N-O 3.31Å
660	Q	89	Confident	86.6	Confident	90 Å²	90	62.4 Å²	62.4	42%	0.421	32%	0.315	S	S	.	.	H	α-helix	trans	-65.2	-47.6	176.2	-72.5	167	-13.6	0	0	110.9	Y656 T657 Q662 R663 I664	Y656-Q660 HydrophobicContact CD1-CB 4.13Å; T657-Q660 WeakPolarHBondContact O-CB 3.32Å; T657-Q660 PolarHBondContact O-N 2.86Å; T657-Q660 VanDerWaalsContact O-N 3.08Å; T657-Q660 VanDerWaalsContact OG1-CG 3.3Å; T657-Q660 WeakPolarHBondContact OG1-CG 3.43Å; T657-Q660 PolarHBondContact OG1-N 3.15Å; Q660-Q662 VanDerWaalsContact C-N 3.29Å; Q660-Q662 PolarHBondContact O-N 3.21Å; Q660-R663 PolarHBondContact O-N 2.86Å; Q660-I664 HydrophobicContact CB-CD1 4.47Å; Q660-I664 WeakPolarHBondContact O-CB 3.5Å; Q660-I664 WeakPolarHBondContact O-CD1 3.47Å; Q660-I664 WeakPolarHBondContact O-CG1 3.23Å; Q660-I664 PolarHBondContact O-N 3.42Å
661	L	89	Confident	86.5	Confident	0 Å²	0	62.2 Å²	62.2	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-59.9	-39.9	176.9	-69.2	177.5	0	0	0	111.9	I646 Q649 Y656 T657 V658 I664 T665 L672 L676 I715	I646-L661 HydrophobicContact CG2-CD1 4.35Å; Q649-L661 HydrophobicContact CB-CD2 4.29Å; Q649-L661 HydrophobicContact CG-CD2 4.25Å; Y656-L661 HydrophobicContact CD2-CD2 4.12Å; Y656-L661 HydrophobicContact CG-CD2 3.87Å; Y656-L661 HydrophobicContact CG-CG 4.38Å; T657-L661 PolarHBondContact O-N 3.49Å; V658-L661 PolarHBondContact O-N 3.49Å; L661-I664 PolarHBondContact O-N 3.37Å; L661-T665 WeakPolarHBondContact O-CB 3.43Å; L661-T665 WeakPolarHBondContact O-CG2 3.33Å; L661-T665 PolarHBondContact O-N 2.98Å; L661-T665 PolarHBondContact O-OG1 2.9Å; L661-L672 HydrophobicContact CB-CD1 4.34Å; L661-L672 HydrophobicContact CB-CD2 4.32Å; L661-L676 HydrophobicContact CD1-CD1 4.46Å; L661-L676 HydrophobicContact CD1-CD2 3.99Å; L661-I715 HydrophobicContact CD1-CB 4.24Å; L661-I715 HydrophobicContact CD1-CG1 4.09Å
662	Q	88.7	Confident	86.6	Confident	68 Å²	68	56.5 Å²	56.5	32%	0.318	28%	0.284	S	S	.	.	H	α-helix	trans	-62.3	-48.5	175.9	-165.1	-175.1	9	0	0	111.7	V658 E659 Q660 I664 L666 L667 L672	V658-Q662 WeakPolarHBondContact O-CB 3.35Å; V658-Q662 PolarHBondContact O-N 2.89Å; E659-Q662 PolarHBondContact O-N 2.82Å; Q660-Q662 VanDerWaalsContact C-N 3.29Å; Q660-Q662 PolarHBondContact O-N 3.21Å; Q662-I664 VanDerWaalsContact C-N 3.33Å; Q662-I664 PolarHBondContact O-N 2.78Å; Q662-L666 WeakPolarHBondContact O-CA 3.49Å; Q662-L666 PolarHBondContact O-N 3.21Å; Q662-L667 WeakPolarHBondContact CG-O 3.34Å; Q662-L672 HydrophobicContact CB-CD2 3.67Å; Q662-L672 HydrophobicContact CG-CD2 4.19Å
663	R	87.8	Confident	86.6	Confident	172 Å²	172	51.7 Å²	51.7	65%	0.649	26%	0.262	S	S	*	.	H	α-helix	trans	-62.9	-36.6	177.5	-76.2	-175.5	175.8	132.2	12.1	113.3	E659 Q660 L666	E659-R663 WeakPolarHBondContact O-CG 3.27Å; E659-R663 PolarHBondContact O-N 3.23Å; E659-R663 IonicContact OE1-CZ 3.59Å; E659-R663 IonicContact OE1-NH1 2.71Å; E659-R663 PolarHBondContact OE1-NH1 2.73Å; E659-R663 IonicContact OE1-NH2 3.75Å; E659-R663 PolarHBondContact OE1-NH2 2.85Å; Q660-R663 PolarHBondContact O-N 2.86Å; R663-L666 WeakPolarHBondContact O-CD2 3.38Å
664	I	88.7	Confident	86.7	Confident	52 Å²	52	51.4 Å²	51.4	27%	0.267	25%	0.254	S	S	.	.	H	α-helix	trans	-78.2	-45.2	-177	-66.2	163	0	0	0	111.5	N590 Q649 Y656 Q660 L661 Q662	N590-I664 VanDerWaalsContact CB-O 3.24Å; N590-I664 WeakPolarHBondContact CB-O 3.47Å; N590-I664 PolarHBondContact ND2-O 2.79Å; Q649-I664 VanDerWaalsContact CD-CG2 3.47Å; Q649-I664 HydrophobicContact CG-CG2 4.02Å; Q649-I664 VanDerWaalsContact OE1-CG2 3.3Å; Y656-I664 HydrophobicContact CD1-CD1 3.96Å; Y656-I664 HydrophobicContact CE1-CD1 3.74Å; Q660-I664 HydrophobicContact CB-CD1 4.47Å; Q660-I664 WeakPolarHBondContact O-CB 3.5Å; Q660-I664 WeakPolarHBondContact O-CD1 3.47Å; Q660-I664 WeakPolarHBondContact O-CG1 3.23Å; Q660-I664 PolarHBondContact O-N 3.42Å; L661-I664 PolarHBondContact O-N 3.37Å; Q662-I664 VanDerWaalsContact C-N 3.33Å; Q662-I664 PolarHBondContact O-N 2.78Å
665	T	86.7	Confident	87	Confident	1 Å²	1	45.5 Å²	45.5	1%	0.006	22%	0.222	C	C	.	.	H	α-helix	trans	-85.7	-21	-175.3	62.4	0	0	0	0	113.7	N590 I646 L661 L667	N590-T665 PolarHBondContact N-O 3.17Å; I646-T665 HydrophobicContact CG1-CG2 4.11Å; L661-T665 WeakPolarHBondContact O-CB 3.43Å; L661-T665 WeakPolarHBondContact O-CG2 3.33Å; L661-T665 PolarHBondContact O-N 2.98Å; L661-T665 PolarHBondContact O-OG1 2.9Å; T665-L667 PolarHBondContact O-N 3.37Å
666	L	87.1	Confident	87.2	Confident	109 Å²	109	43 Å²	43	57%	0.571	21%	0.205	S	C	*	.			trans	61.4	19.3	-174.1	-54.7	175	0	0	0	114.5	N590 Q662 R663	N590-L666 HydrophobicContact CB-CD1 4.41Å; N590-L666 HydrophobicContact CB-CG 4.48Å; Q662-L666 WeakPolarHBondContact O-CA 3.49Å; Q662-L666 PolarHBondContact O-N 3.21Å; R663-L666 WeakPolarHBondContact O-CD2 3.38Å
667	L	86.4	Confident	87	Confident	2 Å²	2	44.7 Å²	44.7	1%	0.01	21%	0.211	C	C	.	.			trans	-75.7	142.1	176	-67.2	174.1	0	0	0	111.7	A587 V589 F642 I646 Q662 T665 L672	A587-L667 HydrophobicContact CB-CD2 4.38Å; V589-L667 HydrophobicContact CB-CD2 4.01Å; V589-L667 HydrophobicContact CG2-CD2 4Å; V589-L667 HydrophobicContact CG2-CG 4.21Å; F642-L667 HydrophobicContact CB-CD1 4.23Å; F642-L667 HydrophobicContact CD1-CD2 3.64Å; F642-L667 HydrophobicContact CE1-CD2 3.84Å; F642-L667 HydrophobicContact CG-CD2 4.14Å; F642-L667 HydrophobicContact CZ-CD2 4.48Å; I646-L667 HydrophobicContact CD1-CD1 4.21Å; I646-L667 HydrophobicContact CG1-CD1 4.44Å; Q662-L667 WeakPolarHBondContact CG-O 3.34Å; T665-L667 PolarHBondContact O-N 3.37Å; L667-L672 HydrophobicContact CB-CB 4.31Å
668	P	87	Confident	87	Confident	48 Å²	48	43.8 Å²	43.8	31%	0.312	20%	0.204	S	C	.	.			trans	-54.7	143.4	166.2	-24.9	34.6	0	0	0	111.6	A587 E670 I671 L672	A587-P668 HydrophobicContact CB-CG 4.04Å; P668-E670 VanDerWaalsContact CB-OE2 3.24Å; P668-E670 WeakPolarHBondContact CB-OE2 3.34Å; P668-E670 PolarHBondContact O-N 3.31Å; P668-I671 HydrophobicContact CB-CD1 4.25Å; P668-I671 HydrophobicContact CB-CG1 4.42Å; P668-I671 HydrophobicContact CG-CD1 4Å; P668-I671 PolarHBondContact O-N 3.27Å; P668-I671 VanDerWaalsContact O-N 3.15Å; P668-L672 WeakPolarHBondContact O-CB 3.49Å; P668-L672 PolarHBondContact O-N 3.14Å
669	I	85.9	Confident	87	Confident	45 Å²	45	43.7 Å²	43.7	23%	0.231	20%	0.204	C	C	.	.	H	α-helix	trans	-63.4	-32.9	-171.2	-172.1	59.6	0	0	0	112.2	V658 I671 L672 Q673	V658-I669 HydrophobicContact CG1-CD1 3.7Å; I669-I671 VanDerWaalsContact C-N 3.35Å; I669-I671 PolarHBondContact O-N 2.91Å; I669-L672 HydrophobicContact CD1-CD2 4.21Å; I669-L672 PolarHBondContact O-N 2.89Å; I669-Q673 HydrophobicContact CD1-CG 4.11Å; I669-Q673 HydrophobicContact CG1-CG 4.24Å; I669-Q673 VanDerWaalsContact O-CB 3.32Å; I669-Q673 WeakPolarHBondContact O-CB 3.38Å; I669-Q673 VanDerWaalsContact O-CG 3.24Å; I669-Q673 WeakPolarHBondContact O-CG 3.26Å; I669-Q673 PolarHBondContact O-N 3.42Å
670	E	84.7	Confident	87	Confident	104 Å²	104	41.3 Å²	41.3	49%	0.486	19%	0.193	S	C	.	.	H	α-helix	trans	-66.2	-38.9	179.5	-49.1	74.9	-165.4	0	0	111.2	P668 Q674	P668-E670 VanDerWaalsContact CB-OE2 3.24Å; P668-E670 WeakPolarHBondContact CB-OE2 3.34Å; P668-E670 PolarHBondContact O-N 3.31Å; E670-Q674 WeakPolarHBondContact O-CG 3.32Å; E670-Q674 PolarHBondContact O-N 3.4Å
671	I	85.4	Confident	86.7	Confident	7 Å²	7	44.9 Å²	44.9	4%	0.036	21%	0.207	C	C	.	.	H	α-helix	trans	-75.3	-46.6	176.6	-62.9	174.7	0	0	0	109.5	T586 A587 F642 P668 I669 Q673 Q674 V675 L734	T586-I671 HydrophobicContact CG2-CD1 3.65Å; A587-I671 HydrophobicContact CB-CD1 3.77Å; F642-I671 HydrophobicContact CD2-CG2 4.11Å; F642-I671 HydrophobicContact CE2-CG2 4.32Å; P668-I671 HydrophobicContact CB-CD1 4.25Å; P668-I671 HydrophobicContact CB-CG1 4.42Å; P668-I671 HydrophobicContact CG-CD1 4Å; P668-I671 PolarHBondContact O-N 3.27Å; P668-I671 VanDerWaalsContact O-N 3.15Å; I669-I671 VanDerWaalsContact C-N 3.35Å; I669-I671 PolarHBondContact O-N 2.91Å; I671-Q673 VanDerWaalsContact C-N 3.35Å; I671-Q673 PolarHBondContact O-N 2.92Å; I671-Q674 PolarHBondContact O-N 3.01Å; I671-V675 HydrophobicContact CG2-CG2 4.23Å; I671-V675 WeakPolarHBondContact O-CG2 3.21Å; I671-V675 PolarHBondContact O-N 3.33Å; I671-L734 HydrophobicContact CG2-CD1 4Å
672	L	87.6	Confident	86.4	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-56.5	-47.7	178.3	177.7	60.2	0	0	0	111.3	I646 V658 L661 Q662 L667 P668 I669 Q674 V675 L676	I646-L672 HydrophobicContact CD1-CD1 3.6Å; I646-L672 HydrophobicContact CG1-CD1 4.09Å; V658-L672 HydrophobicContact CG1-CD2 4.2Å; L661-L672 HydrophobicContact CB-CD1 4.34Å; L661-L672 HydrophobicContact CB-CD2 4.32Å; Q662-L672 HydrophobicContact CB-CD2 3.67Å; Q662-L672 HydrophobicContact CG-CD2 4.19Å; L667-L672 HydrophobicContact CB-CB 4.31Å; P668-L672 WeakPolarHBondContact O-CB 3.49Å; P668-L672 PolarHBondContact O-N 3.14Å; I669-L672 HydrophobicContact CD1-CD2 4.21Å; I669-L672 PolarHBondContact O-N 2.89Å; L672-Q674 PolarHBondContact O-N 2.6Å; L672-V675 PolarHBondContact O-N 3.23Å; L672-L676 HydrophobicContact CD1-CD1 4.03Å; L672-L676 HydrophobicContact CD1-CG 4.13Å; L672-L676 HydrophobicContact CG-CD1 3.96Å; L672-L676 HydrophobicContact CG-CG 4.47Å; L672-L676 WeakPolarHBondContact O-CB 3.12Å; L672-L676 VanDerWaalsContact O-CG 3.25Å; L672-L676 WeakPolarHBondContact O-CG 2.62Å; L672-L676 PolarHBondContact O-N 2.97Å
673	Q	86.7	Confident	86.1	Confident	37 Å²	37	50 Å²	50	17%	0.173	23%	0.228	C	C	.	.	H	α-helix	trans	-61.2	-43	177.5	-75.5	178.7	-16.2	0	0	112.2	I669 I671 L676 W677 L709	I669-Q673 HydrophobicContact CD1-CG 4.11Å; I669-Q673 HydrophobicContact CG1-CG 4.24Å; I669-Q673 VanDerWaalsContact O-CB 3.32Å; I669-Q673 WeakPolarHBondContact O-CB 3.38Å; I669-Q673 VanDerWaalsContact O-CG 3.24Å; I669-Q673 WeakPolarHBondContact O-CG 3.26Å; I669-Q673 PolarHBondContact O-N 3.42Å; I671-Q673 VanDerWaalsContact C-N 3.35Å; I671-Q673 PolarHBondContact O-N 2.92Å; Q673-L676 PolarHBondContact O-N 3.45Å; Q673-W677 WeakPolarHBondContact O-CB 3.25Å; Q673-W677 PolarHBondContact O-N 3.24Å; Q673-L709 HydrophobicContact CG-CB 4.23Å; Q673-L709 HydrophobicContact CG-CD1 4.46Å; Q673-L709 PolarHBondContact NE2-O 3.38Å
674	Q	86.4	Confident	86	Confident	34 Å²	34	41.9 Å²	41.9	16%	0.159	20%	0.198	C	C	.	.	H	α-helix	trans	-67.6	-40.3	177.4	-74.9	-178.5	17.9	0	0	112.7	E670 I671 L672 W677 Q678 L734 T736	E670-Q674 WeakPolarHBondContact O-CG 3.32Å; E670-Q674 PolarHBondContact O-N 3.4Å; I671-Q674 PolarHBondContact O-N 3.01Å; L672-Q674 PolarHBondContact O-N 2.6Å; Q674-W677 PolarHBondContact O-N 2.83Å; Q674-Q678 WeakPolarHBondContact O-CG 3.32Å; Q674-Q678 PolarHBondContact O-N 2.88Å; Q674-L734 HydrophobicContact CB-CD2 3.67Å; Q674-T736 PolarHBondContact NE2-OG1 2.97Å; Q674-T736 PolarHBondContact OE1-OG1 3.12Å
675	V	86.9	Confident	85.8	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-66.4	-39.9	175.4	-179.3	0	0	0	0	110.7	F642 Q643 I646 I671 L672 Q678 L679 L734	F642-V675 HydrophobicContact CB-CG2 4.16Å; Q643-V675 HydrophobicContact CB-CG1 4.3Å; Q643-V675 HydrophobicContact CG-CG1 3.68Å; I646-V675 HydrophobicContact CD1-CB 3.96Å; I646-V675 HydrophobicContact CD1-CG1 3.56Å; I671-V675 HydrophobicContact CG2-CG2 4.23Å; I671-V675 WeakPolarHBondContact O-CG2 3.21Å; I671-V675 PolarHBondContact O-N 3.33Å; L672-V675 PolarHBondContact O-N 3.23Å; V675-Q678 WeakPolarHBondContact O-CB 3.48Å; V675-Q678 PolarHBondContact O-N 3.02Å; V675-L679 HydrophobicContact CG1-CD1 4.26Å; V675-L679 WeakPolarHBondContact O-CG 3.45Å; V675-L679 PolarHBondContact O-N 3.44Å; V675-L734 HydrophobicContact CG2-CD1 4.41Å; V675-L734 HydrophobicContact CG2-CD2 3.77Å
676	L	88.5	Confident	85.6	Confident	0 Å²	0	40 Å²	40	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-60.7	-47.6	172.8	-74.8	172.6	0	0	0	111.5	I646 V658 L661 L672 Q673 Q678 L679 I680 L709 I715	I646-L676 HydrophobicContact CG2-CD2 4.14Å; V658-L676 HydrophobicContact CG2-CD1 4.2Å; L661-L676 HydrophobicContact CD1-CD1 4.46Å; L661-L676 HydrophobicContact CD1-CD2 3.99Å; L672-L676 HydrophobicContact CD1-CD1 4.03Å; L672-L676 HydrophobicContact CD1-CG 4.13Å; L672-L676 HydrophobicContact CG-CD1 3.96Å; L672-L676 HydrophobicContact CG-CG 4.47Å; L672-L676 WeakPolarHBondContact O-CB 3.12Å; L672-L676 VanDerWaalsContact O-CG 3.25Å; L672-L676 WeakPolarHBondContact O-CG 2.62Å; L672-L676 PolarHBondContact O-N 2.97Å; Q673-L676 PolarHBondContact O-N 3.45Å; L676-Q678 VanDerWaalsContact C-N 3.3Å; L676-Q678 PolarHBondContact O-N 2.97Å; L676-L679 PolarHBondContact O-N 3.16Å; L676-L679 VanDerWaalsContact O-N 3.08Å; L676-I680 VanDerWaalsContact O-CG1 3.28Å; L676-I680 WeakPolarHBondContact O-CG1 3.23Å; L676-I680 PolarHBondContact O-N 3.11Å; L676-L709 HydrophobicContact CB-CD1 4.11Å; L676-L709 HydrophobicContact CD1-CD1 4.26Å; L676-I715 HydrophobicContact CD1-CD1 4.36Å; L676-I715 HydrophobicContact CD1-CG1 4.23Å; L676-I715 HydrophobicContact CD2-CD1 4.46Å; L676-I715 HydrophobicContact CD2-CG1 4.09Å; L676-I715 HydrophobicContact CD2-CG2 4.03Å
677	W	85.3	Confident	85.2	Confident	62 Å²	62	34.8 Å²	34.8	24%	0.235	16%	0.161	C	C	.	.	H	α-helix	trans	-60.9	-35.7	175.4	-83.3	121.3	0	0	0	113.2	Q673 Q674 I680 K681 F698 L709	Q673-W677 WeakPolarHBondContact O-CB 3.25Å; Q673-W677 PolarHBondContact O-N 3.24Å; Q674-W677 PolarHBondContact O-N 2.83Å; W677-I680 HydrophobicContact CD2-CD1 4.44Å; W677-I680 HydrophobicContact CE3-CB 4.33Å; W677-I680 HydrophobicContact CE3-CD1 4.01Å; W677-I680 HydrophobicContact CE3-CG2 4.24Å; W677-I680 HydrophobicContact CZ3-CD1 4.27Å; W677-I680 HydrophobicContact CZ3-CG2 4.21Å; W677-K681 VanDerWaalsContact O-CB 3.25Å; W677-K681 WeakPolarHBondContact O-CB 3.32Å; W677-K681 PolarHBondContact O-N 3.35Å; W677-F698 HydrophobicContact CH2-CD1 4.39Å; W677-L709 HydrophobicContact CZ2-CD2 4.25Å; W677-L709 HydrophobicContact CZ2-CG 4.37Å
678	Q	86.7	Confident	84.6	Confident	18 Å²	18	35.6 Å²	35.6	8%	0.084	17%	0.166	C	C	.	.	H	α-helix	trans	-61.6	-49.1	169.9	-72.6	179.2	-2.9	0	0	111.3	Q674 V675 L676 I680 K681 F682 I732 P733	Q674-Q678 WeakPolarHBondContact O-CG 3.32Å; Q674-Q678 PolarHBondContact O-N 2.88Å; V675-Q678 WeakPolarHBondContact O-CB 3.48Å; V675-Q678 PolarHBondContact O-N 3.02Å; L676-Q678 VanDerWaalsContact C-N 3.3Å; L676-Q678 PolarHBondContact O-N 2.97Å; Q678-I680 PolarHBondContact O-N 3.33Å; Q678-K681 CarbonylContact O-C 3.54Å; Q678-K681 PolarHBondContact O-N 3.09Å; Q678-F682 HydrophobicContact CB-CD2 4.4Å; Q678-F682 HydrophobicContact CB-CE2 3.87Å; Q678-F682 HydrophobicContact CB-CZ 4.39Å; Q678-F682 WeakPolarHBondContact O-CB 3.48Å; Q678-F682 WeakPolarHBondContact O-CD2 3.43Å; Q678-F682 WeakPolarHBondContact O-CG 3.23Å; Q678-F682 PolarHBondContact O-N 3.42Å; Q678-I732 HydrophobicContact CG-CG2 4.27Å; Q678-I732 PolarHBondContact NE2-O 3.17Å; Q678-P733 PolarHBondContact NE2-O 2.94Å
679	L	86.8	Confident	83.6	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-64.2	-35.5	179.6	-66.9	172.6	0	0	0	113.1	Q643 I646 L647 V675 L676 F682 K683 I684 V685	Q643-L679 HydrophobicContact CB-CD2 4.5Å; Q643-L679 HydrophobicContact CG-CD2 4.48Å; I646-L679 HydrophobicContact CB-CD1 4.31Å; I646-L679 HydrophobicContact CG2-CD1 3.93Å; L647-L679 HydrophobicContact CD1-CD2 3.78Å; L647-L679 HydrophobicContact CD2-CD1 4.32Å; L647-L679 HydrophobicContact CD2-CD2 4.3Å; L647-L679 HydrophobicContact CG-CD1 4.16Å; L647-L679 HydrophobicContact CG-CD2 4.04Å; V675-L679 HydrophobicContact CG1-CD1 4.26Å; V675-L679 WeakPolarHBondContact O-CG 3.45Å; V675-L679 PolarHBondContact O-N 3.44Å; L676-L679 PolarHBondContact O-N 3.16Å; L676-L679 VanDerWaalsContact O-N 3.08Å; L679-F682 HydrophobicContact CD2-CD2 4.4Å; L679-F682 PolarHBondContact O-N 2.94Å; L679-K683 PolarHBondContact O-N 3.5Å; L679-I684 HydrophobicContact CD2-CD1 4.13Å; L679-I684 PolarHBondContact O-N 2.95Å; L679-V685 HydrophobicContact CB-CG2 3.67Å
680	I	85.9	Confident	82.1	Confident	19 Å²	19	39.4 Å²	39.4	10%	0.097	19%	0.185	C	C	.	.	H	α-helix	trans	-64.9	-47.1	171.5	-66.7	166.1	0	0	0	109.8	L676 W677 Q678 F682 K683 V685 A687	L676-I680 VanDerWaalsContact O-CG1 3.28Å; L676-I680 WeakPolarHBondContact O-CG1 3.23Å; L676-I680 PolarHBondContact O-N 3.11Å; W677-I680 HydrophobicContact CD2-CD1 4.44Å; W677-I680 HydrophobicContact CE3-CB 4.33Å; W677-I680 HydrophobicContact CE3-CD1 4.01Å; W677-I680 HydrophobicContact CE3-CG2 4.24Å; W677-I680 HydrophobicContact CZ3-CD1 4.27Å; W677-I680 HydrophobicContact CZ3-CG2 4.21Å; Q678-I680 PolarHBondContact O-N 3.33Å; I680-F682 VanDerWaalsContact C-N 3.29Å; I680-F682 PolarHBondContact O-N 3.04Å; I680-K683 WeakPolarHBondContact O-CA 3.46Å; I680-K683 PolarHBondContact O-N 3.13Å; I680-V685 HydrophobicContact CG1-CG2 3.78Å; I680-A687 HydrophobicContact CD1-CB 4.08Å
681	K	83.2	Confident	80.3	Confident	164 Å²	164	38.8 Å²	38.8	71%	0.713	19%	0.185	S	C	*	.	H	α-helix	trans	-63.9	-32.1	176.7	-172.4	172.1	-175.5	171	0	112.8	W677 Q678 K683	W677-K681 VanDerWaalsContact O-CB 3.25Å; W677-K681 WeakPolarHBondContact O-CB 3.32Å; W677-K681 PolarHBondContact O-N 3.35Å; Q678-K681 CarbonylContact O-C 3.54Å; Q678-K681 PolarHBondContact O-N 3.09Å; K681-K683 PolarHBondContact O-N 3.34Å
682	F	82.2	Confident	78	Confident	32 Å²	32	42.3 Å²	42.3	14%	0.14	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.7	-6.7	170.3	-59.7	-38.9	0	0	0	113.5	Q678 L679 I680 I684 F720 F729 I732	Q678-F682 HydrophobicContact CB-CD2 4.4Å; Q678-F682 HydrophobicContact CB-CE2 3.87Å; Q678-F682 HydrophobicContact CB-CZ 4.39Å; Q678-F682 WeakPolarHBondContact O-CB 3.48Å; Q678-F682 WeakPolarHBondContact O-CD2 3.43Å; Q678-F682 WeakPolarHBondContact O-CG 3.23Å; Q678-F682 PolarHBondContact O-N 3.42Å; L679-F682 HydrophobicContact CD2-CD2 4.4Å; L679-F682 PolarHBondContact O-N 2.94Å; I680-F682 VanDerWaalsContact C-N 3.29Å; I680-F682 PolarHBondContact O-N 3.04Å; F682-I684 VanDerWaalsContact C-N 3.29Å; F682-I684 HydrophobicContact CB-CD1 3.88Å; F682-I684 HydrophobicContact CB-CG1 3.92Å; F682-I684 PolarHBondContact O-N 2.96Å; F682-F720 WeakPolarHBondContact O-CE2 3.3Å; F682-F729 HydrophobicContact CB-CD1 4.17Å; F682-F729 HydrophobicContact CB-CE1 3.9Å; F682-F729 HydrophobicContact CB-CZ 4.38Å; F682-F729 AromaticContact CD1-CD1 3.52Å; F682-F729 HydrophobicContact CD1-CD1 3.52Å; F682-F729 AromaticContact CD1-CE1 3.83Å; F682-F729 HydrophobicContact CD1-CE1 3.83Å; F682-F729 HydrophobicContact CD2-CB 4.05Å; F682-F729 AromaticContact CD2-CD1 3.7Å; F682-F729 HydrophobicContact CD2-CD1 3.7Å; F682-F729 HydrophobicContact CD2-CE1 4.3Å; F682-F729 AromaticContact CD2-CG 3.92Å; F682-F729 HydrophobicContact CD2-CG 3.92Å; F682-F729 AromaticContact CE1-CD1 3.7Å; F682-F729 HydrophobicContact CE1-CD1 3.7Å; F682-F729 HydrophobicContact CE1-CE1 4.41Å; F682-F729 HydrophobicContact CE2-CB 3.61Å; F682-F729 AromaticContact CE2-CD1 3.89Å; F682-F729 HydrophobicContact CE2-CD1 3.89Å; F682-F729 AromaticContact CE2-CG 3.98Å; F682-F729 HydrophobicContact CE2-CG 3.98Å; F682-F729 AromaticContact CG-CD1 3.53Å; F682-F729 HydrophobicContact CG-CD1 3.53Å; F682-F729 AromaticContact CG-CE1 3.76Å; F682-F729 HydrophobicContact CG-CE1 3.76Å; F682-F729 HydrophobicContact CG-CG 4.21Å; F682-F729 HydrophobicContact CZ-CB 3.89Å; F682-F729 AromaticContact CZ-CD1 3.89Å; F682-F729 HydrophobicContact CZ-CD1 3.89Å; F682-F729 HydrophobicContact CZ-CG 4.28Å; F682-I732 HydrophobicContact CE1-CD1 3.45Å; F682-I732 VanDerWaalsContact CE1-CD1 3.45Å; F682-I732 HydrophobicContact CE1-CG1 4.13Å; F682-I732 HydrophobicContact CZ-CB 4.34Å; F682-I732 HydrophobicContact CZ-CD1 3.65Å; F682-I732 HydrophobicContact CZ-CG1 3.95Å
683	K	83.1	Confident	75.8	Confident	143 Å²	143	51.2 Å²	51.2	62%	0.622	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.3	26.7	-179.2	-50.1	-171.8	178.3	-168.1	0	114.5	L679 I680 K681	L679-K683 PolarHBondContact O-N 3.5Å; I680-K683 WeakPolarHBondContact O-CA 3.46Å; I680-K683 PolarHBondContact O-N 3.13Å; K681-K683 PolarHBondContact O-N 3.34Å
684	I	84.2	Confident	73.7	Confident	2 Å²	2	51.4 Å²	51.4	1%	0.01	28%	0.282	C	S	.	.	S	Bend	trans	-89	-36.6	179.2	-53.3	172.9	0	0	0	110.9	F631 L647 L679 F682 L717 C718 F720 F729	F631-I684 HydrophobicContact CZ-CG2 4.08Å; L647-I684 HydrophobicContact CD1-CD1 4.48Å; L647-I684 HydrophobicContact CD1-CG2 4.32Å; L647-I684 HydrophobicContact CD2-CG2 3.58Å; L679-I684 HydrophobicContact CD2-CD1 4.13Å; L679-I684 PolarHBondContact O-N 2.95Å; F682-I684 VanDerWaalsContact C-N 3.29Å; F682-I684 HydrophobicContact CB-CD1 3.88Å; F682-I684 HydrophobicContact CB-CG1 3.92Å; F682-I684 PolarHBondContact O-N 2.96Å; I684-L717 HydrophobicContact CG2-CD1 4.39Å; I684-C718 PolarHBondContact O-N 2.92Å; I684-F720 HydrophobicContact CG1-CD2 3.99Å; I684-F720 HydrophobicContact CG1-CE2 4.3Å; I684-F729 HydrophobicContact CD1-CD2 4.02Å; I684-F729 HydrophobicContact CD1-CE2 3.5Å; I684-F729 HydrophobicContact CD1-CZ 3.82Å
685	V	85.7	Confident	71.9	Confident	0 Å²	0	57.9 Å²	57.9	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	166.8	174	-54.6	0	0	0	0	110.2	L647 F650 L679 I680 I715 H716 L717	L647-V685 HydrophobicContact CD2-CG1 3.95Å; F650-V685 HydrophobicContact CE2-CG1 4.36Å; F650-V685 HydrophobicContact CZ-CG1 4.33Å; L679-V685 HydrophobicContact CB-CG2 3.67Å; I680-V685 HydrophobicContact CG1-CG2 3.78Å; V685-I715 HydrophobicContact CB-CG2 3.81Å; V685-I715 HydrophobicContact CG1-CG2 4.33Å; V685-I715 HydrophobicContact CG2-CG2 3.87Å; V685-H716 CarbonylContact C-O 3.41Å; V685-H716 VanDerWaalsContact CA-O 3.23Å; V685-H716 WeakPolarHBondContact CA-O 3.29Å; V685-H716 WeakPolarHBondContact CB-O 3.32Å; V685-L717 HydrophobicContact CG1-CD1 4.48Å
686	D	83	Confident	70.3	Confident	13 Å²	13	61.7 Å²	61.7	7%	0.07	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	154.3	171.4	-170.4	18.2	0	0	0	110.2	S697 R699 I715 H716 C718	D686-S697 PolarHBondContact OD1-OG 2.8Å; D686-S697 WeakPolarHBondContact OD2-CB 3.26Å; D686-S697 PolarHBondContact OD2-OG 3.43Å; D686-R699 WeakPolarHBondContact OD2-CD 3.3Å; D686-R699 IonicContact OD2-NE 3.08Å; D686-I715 CarbonylContact O-C 3.58Å; D686-I715 WeakPolarHBondContact O-CA 3.14Å; D686-H716 PolarHBondContact N-O 3.5Å; D686-H716 PolarHBondContact O-N 2.78Å; D686-C718 WeakPolarHBondContact CB-SG 3.3Å
687	A	77.9	Confident	68.6	Low	0 Å²	0	63.8 Å²	63.8	0%	0	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	132	176.8	0	0	0	0	0	109.4	I680 F698 L709 V713 I715	I680-A687 HydrophobicContact CD1-CB 4.08Å; A687-F698 HydrophobicContact CB-CB 4.21Å; A687-F698 HydrophobicContact CB-CD2 3.63Å; A687-F698 HydrophobicContact CB-CE2 4.34Å; A687-F698 HydrophobicContact CB-CG 4.19Å; A687-F698 WeakPolarHBondContact O-CD2 3.5Å; A687-F698 PolarHBondContact O-N 3.3Å; A687-F698 VanDerWaalsContact O-N 3.12Å; A687-L709 HydrophobicContact CB-CD2 4.24Å; A687-V713 HydrophobicContact CB-CG1 3.89Å; A687-I715 HydrophobicContact CB-CD1 3.9Å
688	V	73.6	Confident	67.2	Low	20 Å²	20	63.2 Å²	63.2	12%	0.121	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	123.4	179.8	-178.8	0	0	0	0	108.8	Q695 S714	V688-Q695 HydrophobicContact CG1-CB 4.28Å; V688-Q695 HydrophobicContact CG1-CG 4.45Å; V688-S714 PolarHBondContact N-O 2.99Å; V688-S714 PolarHBondContact O-N 2.83Å; V688-S714 PolarHBondContact O-OG 2.8Å
689	K	66.3	Low	65.6	Low	70 Å²	70	68.1 Å²	68.1	30%	0.304	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	129.2	173.4	-165	-173.3	179.3	-143.5	0	109.3	D691 T696 F698	K689-D691 WeakPolarHBondContact CE-OD1 3.21Å; K689-D691 WeakPolarHBondContact CE-OD2 3.48Å; K689-D691 VanDerWaalsContact NZ-CG 3.27Å; K689-D691 IonicContact NZ-OD1 3.74Å; K689-D691 PolarHBondContact NZ-OD1 2.98Å; K689-D691 IonicContact NZ-OD2 3.26Å; K689-D691 PolarHBondContact NZ-OD2 3.08Å; K689-T696 PolarHBondContact N-O 2.87Å; K689-F698 HydrophobicContact CB-CE2 4.17Å
690	T	54.7	Low	63.5	Low	102 Å²	102	76.8 Å²	76.8	63%	0.626	41%	0.408	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.5	91.8	171.3	46.4	0	0	0	0	109.8
691	D	47.3	Very low	61.3	Low	91 Å²	91	81.2 Å²	81.2	49%	0.487	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	158.6	154.7	-59.8	-35.3	0	0	0	107.5	K689 D693 G694	K689-D691 WeakPolarHBondContact CE-OD1 3.21Å; K689-D691 WeakPolarHBondContact CE-OD2 3.48Å; K689-D691 VanDerWaalsContact NZ-CG 3.27Å; K689-D691 IonicContact NZ-OD1 3.74Å; K689-D691 PolarHBondContact NZ-OD1 2.98Å; K689-D691 IonicContact NZ-OD2 3.26Å; K689-D691 PolarHBondContact NZ-OD2 3.08Å; D691-D693 PolarHBondContact O-N 3.27Å; D691-G694 PolarHBondContact O-N 3.27Å
692	G	36.7	Very low	59	Low	81 Å²	81	76.6 Å²	76.6	84%	0.835	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.4	133.8	-167.2	0	0	0	0	0	115.4	G694	G692-G694 PolarHBondContact O-N 3.02Å
693	D	41.2	Very low	56.7	Low	188 Å²	188	82.4 Å²	82.4	100%	1.005	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.2	7.9	178.6	-68.6	-8.9	0	0	0	118.3	D691	D691-D693 PolarHBondContact O-N 3.27Å
694	G	42.1	Very low	54.5	Low	40 Å²	40	80.6 Å²	80.6	41%	0.412	48%	0.476	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	123.9	178.4	0	0	0	0	0	114.9	D691 G692	D691-G694 PolarHBondContact O-N 3.27Å; G692-G694 PolarHBondContact O-N 3.02Å
695	Q	49.9	Very low	52.5	Low	170 Å²	170	87.7 Å²	87.7	79%	0.794	51%	0.514	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.4	116.3	167.9	-68.5	-179.4	1.9	0	0	109.8	V688	V688-Q695 HydrophobicContact CG1-CB 4.28Å; V688-Q695 HydrophobicContact CG1-CG 4.45Å
696	T	51.8	Low	50.8	Low	80 Å²	80	93.1 Å²	93.1	49%	0.491	54%	0.539	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	121.9	171.9	38.8	0	0	0	0	110.6	K689	K689-T696 PolarHBondContact N-O 2.87Å
697	S	52.4	Low	49.3	Very low	45 Å²	45	96.6 Å²	96.6	32%	0.315	56%	0.561	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-88	136.4	172.1	164.7	0	0	0	0	109.7	D686 R699	D686-S697 PolarHBondContact OD1-OG 2.8Å; D686-S697 WeakPolarHBondContact OD2-CB 3.26Å; D686-S697 PolarHBondContact OD2-OG 3.43Å; S697-R699 PolarHBondContact O-N 2.81Å; S697-R699 WeakPolarHBondContact OG-CB 3.32Å; S697-R699 PolarHBondContact OG-N 3.45Å; S697-R699 VanDerWaalsContact OG-N 3.14Å
698	F	57.7	Low	48.4	Very low	49 Å²	49	101.4 Å²	101.4	22%	0.215	59%	0.591	C	S	.	*	G	3₁₀ helix	trans	-73.7	1.1	175.4	-79.4	-94	0	0	0	113.7	W677 A687 K689 E700 V713	W677-F698 HydrophobicContact CH2-CD1 4.39Å; A687-F698 HydrophobicContact CB-CB 4.21Å; A687-F698 HydrophobicContact CB-CD2 3.63Å; A687-F698 HydrophobicContact CB-CE2 4.34Å; A687-F698 HydrophobicContact CB-CG 4.19Å; A687-F698 WeakPolarHBondContact O-CD2 3.5Å; A687-F698 PolarHBondContact O-N 3.3Å; A687-F698 VanDerWaalsContact O-N 3.12Å; K689-F698 HydrophobicContact CB-CE2 4.17Å; F698-E700 VanDerWaalsContact C-N 3.26Å; F698-E700 PolarHBondContact O-N 3.41Å; F698-V713 HydrophobicContact CE2-CG1 4.45Å
699	R	51.7	Low	48.1	Very low	121 Å²	121	100.7 Å²	100.7	46%	0.457	59%	0.586	S	S	.	*	G	3₁₀ helix	trans	-68	-16.8	178.1	-79.1	173.6	165	-168.1	-7.8	115.4	D686 S697 C718	D686-R699 WeakPolarHBondContact OD2-CD 3.3Å; D686-R699 IonicContact OD2-NE 3.08Å; S697-R699 PolarHBondContact O-N 2.81Å; S697-R699 WeakPolarHBondContact OG-CB 3.32Å; S697-R699 PolarHBondContact OG-N 3.45Å; S697-R699 VanDerWaalsContact OG-N 3.14Å; R699-C718 VanDerWaalsContact NH2-CB 3.29Å; R699-C718 PolarHBondContact NH2-SG 3.44Å
700	E	44.2	Very low	48	Very low	183 Å²	183	100.7 Å²	100.7	86%	0.855	59%	0.592	S	S	*	*	G	3₁₀ helix	trans	-104.8	-7.2	-172.9	-63	-170.8	155.9	0	0	114.5	F698 G702	F698-E700 VanDerWaalsContact C-N 3.26Å; F698-E700 PolarHBondContact O-N 3.41Å; E700-G702 PolarHBondContact O-N 2.97Å; E700-G702 VanDerWaalsContact O-N 3.08Å
701	C	38	Very low	48.5	Very low	112 Å²	112	99.1 Å²	99.1	76%	0.757	59%	0.585	S	S	*	*			trans	-79.1	91.4	171.7	-74.6	0	0	0	0	111.2
702	G	35.1	Very low	49.4	Very low	66 Å²	66	98.6 Å²	98.6	68%	0.68	59%	0.589	S	S	*	*			trans	-69.5	138.2	169.1	0	0	0	0	0	112.8	E700	E700-G702 PolarHBondContact O-N 2.97Å; E700-G702 VanDerWaalsContact O-N 3.08Å
703	D	34	Very low	51.3	Low	154 Å²	154	94.9 Å²	94.9	82%	0.824	55%	0.55	S	S	*	.	S	Bend	trans	56.2	133.6	166.6	-65.5	-36	0	0	0	120.6
704	S	36.5	Very low	53.2	Low	106 Å²	106	86.9 Å²	86.9	74%	0.741	51%	0.509	S	S	*	.	S	Bend	trans	58.5	66.6	158.4	58.7	0	0	0	0	118.6
705	N	42.4	Very low	55.2	Low	150 Å²	150	85 Å²	85	80%	0.802	49%	0.489	S	S	*	.				179.6	137.1	124.1	-89	-32.9	0	0	0	110.6	T707	N705-T707 VanDerWaalsContact C-N 3.31Å; N705-T707 PolarHBondContact O-N 3.22Å; N705-T707 PolarHBondContact O-OG1 2.86Å
706	E	50.7	Low	56.8	Low	114 Å²	114	79.8 Å²	79.8	53%	0.533	47%	0.465	S	S	.	.			trans	-74.6	84.1	173.4	-76.2	174.1	142.9	0	0	109.7	T708 K735	E706-T708 PolarHBondContact O-N 3.18Å; E706-K735 IonicContact OE1-NZ 2.67Å; E706-K735 PolarHBondContact OE1-NZ 3.36Å; E706-K735 IonicContact OE2-NZ 3.05Å; E706-K735 PolarHBondContact OE2-NZ 3.21Å
707	T	52	Low	58.3	Low	86 Å²	86	78.1 Å²	78.1	53%	0.528	45%	0.453	S	S	.	.			trans	-65	124.1	177.3	-26.2	0	0	0	0	109.8	N705 L709	N705-T707 VanDerWaalsContact C-N 3.31Å; N705-T707 PolarHBondContact O-N 3.22Å; N705-T707 PolarHBondContact O-OG1 2.86Å; T707-L709 PolarHBondContact O-N 3.39Å; T707-L709 VanDerWaalsContact O-N 3.13Å
708	T	58.8	Low	59.7	Low	101 Å²	101	76.7 Å²	76.7	62%	0.62	44%	0.442	S	S	*	.			trans	-58.4	115.9	-178.3	-46.7	0	0	0	0	110.9	E706 T710	E706-T708 PolarHBondContact O-N 3.18Å; T708-T710 PolarHBondContact O-N 2.6Å
709	L	66.3	Low	60.6	Low	5 Å²	5	80 Å²	80	3%	0.026	47%	0.469	C	S	.	.			trans	-66.3	104.6	175.5	-65.8	167.5	0	0	0	109	V658 Q673 L676 W677 A687 T707 V713	V658-L709 HydrophobicContact CG2-CB 4.27Å; Q673-L709 HydrophobicContact CG-CB 4.23Å; Q673-L709 HydrophobicContact CG-CD1 4.46Å; Q673-L709 PolarHBondContact NE2-O 3.38Å; L676-L709 HydrophobicContact CB-CD1 4.11Å; L676-L709 HydrophobicContact CD1-CD1 4.26Å; W677-L709 HydrophobicContact CZ2-CD2 4.25Å; W677-L709 HydrophobicContact CZ2-CG 4.37Å; A687-L709 HydrophobicContact CB-CD2 4.24Å; T707-L709 PolarHBondContact O-N 3.39Å; T707-L709 VanDerWaalsContact O-N 3.13Å; L709-V713 HydrophobicContact CD2-CG1 4.23Å
710	T	64.1	Low	62	Low	71 Å²	71	75.2 Å²	75.2	44%	0.436	45%	0.451	S	S	.	.			trans	-70.3	154.6	179.2	52.5	0	0	0	0	111.5	T708 S712 V713	T708-T710 PolarHBondContact O-N 2.6Å; T710-S712 PolarHBondContact O-N 3.48Å; T710-S712 PolarHBondContact OG1-OG 3.04Å; T710-V713 WeakPolarHBondContact O-CB 3.29Å; T710-V713 WeakPolarHBondContact O-CG2 3.36Å; T710-V713 PolarHBondContact O-N 2.79Å
711	S	65.5	Low	63.8	Low	68 Å²	68	75.9 Å²	75.9	48%	0.476	45%	0.446	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.6	-29	-174.7	-45.4	0	0	0	0	114.8	E659	E659-S711 PolarHBondContact N-O 3.31Å
712	S	67.3	Low	65.9	Low	81 Å²	81	72.3 Å²	72.3	57%	0.566	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.3	-10.2	179.9	53.7	0	0	0	0	115.7	T710 S714	T710-S712 PolarHBondContact O-N 3.48Å; T710-S712 PolarHBondContact OG1-OG 3.04Å; S712-S714 PolarHBondContact O-N 3.18Å
713	V	75.7	Confident	68.1	Low	2 Å²	2	78.9 Å²	78.9	1%	0.012	43%	0.432	C	S	.	.	P	Polyproline II helix	trans	-68.7	132.5	179	178.1	0	0	0	0	109.7	T657 V658 A687 F698 L709 T710 I715	T657-V713 VanDerWaalsContact CA-O 3.3Å; T657-V713 WeakPolarHBondContact CA-O 3.46Å; V658-V713 HydrophobicContact CG2-CB 4.25Å; V658-V713 PolarHBondContact N-O 2.99Å; A687-V713 HydrophobicContact CB-CG1 3.89Å; F698-V713 HydrophobicContact CE2-CG1 4.45Å; L709-V713 HydrophobicContact CD2-CG1 4.23Å; T710-V713 WeakPolarHBondContact O-CB 3.29Å; T710-V713 WeakPolarHBondContact O-CG2 3.36Å; T710-V713 PolarHBondContact O-N 2.79Å; V713-I715 HydrophobicContact CG1-CD1 4.31Å
714	S	80.2	Confident	70.4	Confident	21 Å²	21	78.7 Å²	78.7	15%	0.147	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	131.4	175.8	63.8	0	0	0	0	110.7	V688 S712 H716	V688-S714 PolarHBondContact N-O 2.99Å; V688-S714 PolarHBondContact O-N 2.83Å; V688-S714 PolarHBondContact O-OG 2.8Å; S712-S714 PolarHBondContact O-N 3.18Å; S714-H716 WeakPolarHBondContact CB-NE2 3.39Å; S714-H716 PolarHBondContact OG-NE2 2.78Å
715	I	84.3	Confident	72.7	Confident	0 Å²	0	78.5 Å²	78.5	0%	0	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	127.8	176.3	-51.8	-59.1	0	0	0	107.8	F650 S655 Y656 V658 L661 L676 V685 D686 A687 V713	F650-I715 HydrophobicContact CZ-CB 4.39Å; F650-I715 HydrophobicContact CZ-CG2 3.91Å; S655-I715 WeakPolarHBondContact CA-O 3.48Å; Y656-I715 PolarHBondContact N-O 2.97Å; Y656-I715 PolarHBondContact O-N 3.11Å; V658-I715 HydrophobicContact CG2-CD1 4.16Å; V658-I715 HydrophobicContact CG2-CG1 4.13Å; L661-I715 HydrophobicContact CD1-CB 4.24Å; L661-I715 HydrophobicContact CD1-CG1 4.09Å; L676-I715 HydrophobicContact CD1-CD1 4.36Å; L676-I715 HydrophobicContact CD1-CG1 4.23Å; L676-I715 HydrophobicContact CD2-CD1 4.46Å; L676-I715 HydrophobicContact CD2-CG1 4.09Å; L676-I715 HydrophobicContact CD2-CG2 4.03Å; V685-I715 HydrophobicContact CB-CG2 3.81Å; V685-I715 HydrophobicContact CG1-CG2 4.33Å; V685-I715 HydrophobicContact CG2-CG2 3.87Å; D686-I715 CarbonylContact O-C 3.58Å; D686-I715 WeakPolarHBondContact O-CA 3.14Å; A687-I715 HydrophobicContact CB-CD1 3.9Å; V713-I715 HydrophobicContact CG1-CD1 4.31Å
716	H	83.5	Confident	74.8	Confident	60 Å²	60	76.7 Å²	76.7	28%	0.278	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	142.7	-175.6	-65.3	-104.8	0	0	0	110.9	S655 V685 D686 S714	S655-H716 VanDerWaalsContact CB-CE1 3.44Å; S655-H716 WeakPolarHBondContact CB-CE1 3.45Å; S655-H716 WeakPolarHBondContact CB-ND1 3.33Å; V685-H716 CarbonylContact C-O 3.41Å; V685-H716 VanDerWaalsContact CA-O 3.23Å; V685-H716 WeakPolarHBondContact CA-O 3.29Å; V685-H716 WeakPolarHBondContact CB-O 3.32Å; D686-H716 PolarHBondContact N-O 3.5Å; D686-H716 PolarHBondContact O-N 2.78Å; S714-H716 WeakPolarHBondContact CB-NE2 3.39Å; S714-H716 PolarHBondContact OG-NE2 2.78Å
717	L	83.4	Confident	76.5	Confident	46 Å²	46	72.2 Å²	72.2	24%	0.241	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	135.9	172	-168.7	69.6	0	0	0	110.3	C630 F631 L647 F650 D654 I684 V685	C630-L717 HydrophobicContact CB-CD2 4.45Å; F631-L717 HydrophobicContact CZ-CD1 4.35Å; L647-L717 HydrophobicContact CD2-CD1 4.48Å; F650-L717 HydrophobicContact CB-CB 4.49Å; F650-L717 HydrophobicContact CB-CD1 4.36Å; F650-L717 HydrophobicContact CB-CD2 4.32Å; F650-L717 HydrophobicContact CD1-CB 3.81Å; F650-L717 HydrophobicContact CE1-CB 4.39Å; F650-L717 HydrophobicContact CG-CB 4.33Å; F650-L717 HydrophobicContact CG-CD1 4.37Å; D654-L717 PolarHBondContact O-N 3.36Å; I684-L717 HydrophobicContact CG2-CD1 4.39Å; V685-L717 HydrophobicContact CG1-CD1 4.48Å
718	C	81.7	Confident	78	Confident	14 Å²	14	71.1 Å²	71.1	10%	0.095	37%	0.369	C	S	.	.			trans	-114.8	150.6	-174.8	-96	0	0	0	0	113.7	F631 I684 D686 R699 F720	F631-C718 VanDerWaalsContact CE1-O 3.29Å; F631-C718 WeakPolarHBondContact CE1-O 3.32Å; I684-C718 PolarHBondContact O-N 2.92Å; D686-C718 WeakPolarHBondContact CB-SG 3.3Å; R699-C718 VanDerWaalsContact NH2-CB 3.29Å; R699-C718 PolarHBondContact NH2-SG 3.44Å; C718-F720 PolarHBondContact O-N 3.45Å; C718-F720 VanDerWaalsContact O-N 3.08Å
719	P	77	Confident	79.3	Confident	119 Å²	119	67.1 Å²	67.1	77%	0.773	34%	0.344	S	S	*	.			trans	-57.8	115	167.7	-22.7	33.4	0	0	0	111.1
720	F	81.9	Confident	79.9	Confident	20 Å²	20	67.9 Å²	67.9	9%	0.088	35%	0.349	C	S	.	.			trans	-107.7	140.2	-179	175.7	-96	0	0	0	111.4	F631 Y635 F682 I684 C718 L727 F729	F631-F720 HydrophobicContact CD1-CB 3.88Å; F631-F720 HydrophobicContact CD2-CB 4.32Å; F631-F720 HydrophobicContact CD2-CD1 4.35Å; F631-F720 HydrophobicContact CE1-CB 3.76Å; F631-F720 HydrophobicContact CE2-CB 4.2Å; F631-F720 HydrophobicContact CE2-CD1 4.5Å; F631-F720 HydrophobicContact CG-CB 4.17Å; F631-F720 HydrophobicContact CZ-CB 3.92Å; Y635-F720 HydrophobicContact CD1-CE1 4.32Å; Y635-F720 HydrophobicContact CD2-CD1 4.16Å; Y635-F720 HydrophobicContact CD2-CE1 4.36Å; Y635-F720 HydrophobicContact CE1-CE1 4.29Å; Y635-F720 HydrophobicContact CE2-CD1 4.04Å; Y635-F720 HydrophobicContact CE2-CE1 4.32Å; Y635-F720 HydrophobicContact CG-CE1 4.37Å; F682-F720 WeakPolarHBondContact O-CE2 3.3Å; I684-F720 HydrophobicContact CG1-CD2 3.99Å; I684-F720 HydrophobicContact CG1-CE2 4.3Å; C718-F720 PolarHBondContact O-N 3.45Å; C718-F720 VanDerWaalsContact O-N 3.08Å; F720-L727 HydrophobicContact CE1-CD1 3.51Å; F720-L727 HydrophobicContact CZ-CD1 3.58Å; F720-F729 HydrophobicContact CE2-CZ 4.33Å; F720-F729 HydrophobicContact CZ-CZ 4.07Å
721	R	81.1	Confident	80.4	Confident	198 Å²	198	71.9 Å²	71.9	75%	0.747	36%	0.36	S	S	*	.			trans	-146.5	130	179.9	-159.7	177.6	-166.5	-157.8	0.6	112.1	D632	D632-R721 IonicContact OD2-NE 3.44Å; D632-R721 PolarHBondContact OD2-NE 2.85Å
722	S	81.7	Confident	80.8	Confident	36 Å²	36	71.8 Å²	71.8	25%	0.252	35%	0.354	S	S	.	.			trans	-144.4	156.5	178.1	-173.7	0	0	0	0	112.9	Y635 K724	Y635-S722 PolarHBondContact OH-N 2.9Å; Y635-S722 VanDerWaalsContact OH-N 3.09Å; Y635-S722 PolarHBondContact OH-O 2.88Å; S722-K724 PolarHBondContact OG-N 3.04Å
723	K	81.8	Confident	81	Confident	205 Å²	205	71.8 Å²	71.8	89%	0.891	35%	0.352	S	S	*	.	S	Bend	trans	-74.8	-25.4	174.8	-68.2	-173.3	179.4	-178.3	0	113.1
724	K	83.2	Confident	81	Confident	150 Å²	150	72.1 Å²	72.1	65%	0.652	35%	0.354	S	S	*	.			trans	-97.9	134.4	-179.8	-66.1	-176.9	177.6	-176.6	0	110.2	S722 L727	S722-K724 PolarHBondContact OG-N 3.04Å; K724-L727 HydrophobicContact CB-CD2 3.94Å
725	L	84.6	Confident	80.6	Confident	101 Å²	101	76.3 Å²	76.3	53%	0.529	37%	0.369	S	S	.	.	S	Bend	trans	-79.2	-36.7	177.8	-67	174.8	0	0	0	112.8	R633 Y635 C636	R633-L725 HydrophobicContact CB-CD2 4.46Å; Y635-L725 WeakPolarHBondContact CA-O 3.17Å; C636-L725 PolarHBondContact N-O 2.78Å
726	K	86.4	Confident	79.8	Confident	112 Å²	112	78 Å²	78	49%	0.487	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	124.3	170	-170.8	158.7	-179.8	162.6	0	109.7	E625 C636 V638	E625-K726 VanDerWaalsContact OE1-CE 3.28Å; E625-K726 WeakPolarHBondContact OE1-CE 3.43Å; E625-K726 IonicContact OE1-NZ 2.68Å; E625-K726 PolarHBondContact OE1-NZ 3.39Å; E625-K726 IonicContact OE2-NZ 2.99Å; E625-K726 PolarHBondContact OE2-NZ 2.85Å; C636-K726 HydrophobicContact CB-CB 4.34Å; C636-K726 HydrophobicContact CB-CG 4.27Å; C636-K726 CarbonylContact O-C 3.58Å; C636-K726 VanDerWaalsContact O-CA 3.31Å; C636-K726 WeakPolarHBondContact O-CA 3.38Å; V638-K726 VanDerWaalsContact CG2-CE 3.47Å; V638-K726 HydrophobicContact CG2-CG 4.29Å
727	L	86.1	Confident	79.1	Confident	21 Å²	21	76.5 Å²	76.5	11%	0.11	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	128.2	-171.5	-69.1	161.6	0	0	0	109.2	Y635 C636 L637 V638 F720 K724 F729	Y635-L727 HydrophobicContact CD1-CD1 3.86Å; Y635-L727 HydrophobicContact CE1-CD1 4.44Å; Y635-L727 HydrophobicContact CG-CD1 4.46Å; C636-L727 PolarHBondContact O-N 3.44Å; L637-L727 HydrophobicContact CD2-CB 4.15Å; L637-L727 HydrophobicContact CD2-CD1 3.87Å; V638-L727 PolarHBondContact N-O 3.1Å; F720-L727 HydrophobicContact CE1-CD1 3.51Å; F720-L727 HydrophobicContact CZ-CD1 3.58Å; K724-L727 HydrophobicContact CB-CD2 3.94Å; L727-F729 HydrophobicContact CB-CE2 4.09Å; L727-F729 HydrophobicContact CB-CZ 4.01Å; L727-F729 HydrophobicContact CD1-CZ 4.21Å
728	D	84	Confident	78.3	Confident	62 Å²	62	76.7 Å²	76.7	33%	0.332	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	101.8	-178.4	-176	3.2	0	0	0	110.9	V638 S730 K731	V638-D728 HydrophobicContact CB-CB 4.26Å; D728-S730 WeakPolarHBondContact OD1-CB 3.17Å; D728-S730 PolarHBondContact OD1-N 3.27Å; D728-S730 PolarHBondContact OD1-OG 3.41Å; D728-K731 HydrophobicContact CB-CG 4.47Å; D728-K731 WeakPolarHBondContact OD2-CE 3.2Å; D728-K731 WeakPolarHBondContact OD2-CG 3.32Å; D728-K731 IonicContact OD2-NZ 2.75Å
729	F	85	Confident	77.7	Confident	18 Å²	18	81.9 Å²	81.9	8%	0.079	40%	0.401	C	S	.	.			trans	-92.8	-6.9	177	-61.2	-51.7	0	0	0	112.7	L637 V638 M639 Q643 F682 I684 F720 L727 K731	L637-F729 HydrophobicContact CB-CD2 4.33Å; L637-F729 HydrophobicContact CB-CE2 4.31Å; L637-F729 HydrophobicContact CD1-CE2 4.31Å; L637-F729 HydrophobicContact CD2-CE2 3.9Å; L637-F729 HydrophobicContact CG-CE2 4.4Å; V638-F729 PolarHBondContact O-N 3.42Å; M639-F729 HydrophobicContact CE-CD2 4.16Å; Q643-F729 PolarHBondContact NE2-O 2.9Å; Q643-F729 VanDerWaalsContact NE2-O 3.14Å; F682-F729 HydrophobicContact CB-CD1 4.17Å; F682-F729 HydrophobicContact CB-CE1 3.9Å; F682-F729 HydrophobicContact CB-CZ 4.38Å; F682-F729 AromaticContact CD1-CD1 3.52Å; F682-F729 HydrophobicContact CD1-CD1 3.52Å; F682-F729 AromaticContact CD1-CE1 3.83Å; F682-F729 HydrophobicContact CD1-CE1 3.83Å; F682-F729 HydrophobicContact CD2-CB 4.05Å; F682-F729 AromaticContact CD2-CD1 3.7Å; F682-F729 HydrophobicContact CD2-CD1 3.7Å; F682-F729 HydrophobicContact CD2-CE1 4.3Å; F682-F729 AromaticContact CD2-CG 3.92Å; F682-F729 HydrophobicContact CD2-CG 3.92Å; F682-F729 AromaticContact CE1-CD1 3.7Å; F682-F729 HydrophobicContact CE1-CD1 3.7Å; F682-F729 HydrophobicContact CE1-CE1 4.41Å; F682-F729 HydrophobicContact CE2-CB 3.61Å; F682-F729 AromaticContact CE2-CD1 3.89Å; F682-F729 HydrophobicContact CE2-CD1 3.89Å; F682-F729 AromaticContact CE2-CG 3.98Å; F682-F729 HydrophobicContact CE2-CG 3.98Å; F682-F729 AromaticContact CG-CD1 3.53Å; F682-F729 HydrophobicContact CG-CD1 3.53Å; F682-F729 AromaticContact CG-CE1 3.76Å; F682-F729 HydrophobicContact CG-CE1 3.76Å; F682-F729 HydrophobicContact CG-CG 4.21Å; F682-F729 HydrophobicContact CZ-CB 3.89Å; F682-F729 AromaticContact CZ-CD1 3.89Å; F682-F729 HydrophobicContact CZ-CD1 3.89Å; F682-F729 HydrophobicContact CZ-CG 4.28Å; I684-F729 HydrophobicContact CD1-CD2 4.02Å; I684-F729 HydrophobicContact CD1-CE2 3.5Å; I684-F729 HydrophobicContact CD1-CZ 3.82Å; F720-F729 HydrophobicContact CE2-CZ 4.33Å; F720-F729 HydrophobicContact CZ-CZ 4.07Å; L727-F729 HydrophobicContact CB-CE2 4.09Å; L727-F729 HydrophobicContact CB-CZ 4.01Å; L727-F729 HydrophobicContact CD1-CZ 4.21Å; F729-K731 PolarHBondContact O-N 3.11Å
730	S	79.8	Confident	77.5	Confident	21 Å²	21	82.4 Å²	82.4	15%	0.147	39%	0.387	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-11.3	177.5	76.7	0	0	0	0	113.6	V638 D728 I732	V638-S730 PolarHBondContact O-N 2.81Å; D728-S730 WeakPolarHBondContact OD1-CB 3.17Å; D728-S730 PolarHBondContact OD1-N 3.27Å; D728-S730 PolarHBondContact OD1-OG 3.41Å; S730-I732 VanDerWaalsContact C-N 3.35Å; S730-I732 PolarHBondContact O-N 3.23Å
731	K	73.9	Confident	76.8	Confident	154 Å²	154	82.5 Å²	82.5	67%	0.67	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.5	-13.9	-175.1	-58.9	-166.2	-178.8	-166.5	0	115.4	D728 F729 P733	D728-K731 HydrophobicContact CB-CG 4.47Å; D728-K731 WeakPolarHBondContact OD2-CE 3.2Å; D728-K731 WeakPolarHBondContact OD2-CG 3.32Å; D728-K731 IonicContact OD2-NZ 2.75Å; F729-K731 PolarHBondContact O-N 3.11Å; K731-P733 VanDerWaalsContact O-CD 3.32Å; K731-P733 WeakPolarHBondContact O-CD 3.19Å
732	I	73.6	Confident	76.2	Confident	67 Å²	67	76.5 Å²	76.5	34%	0.344	37%	0.369	S	S	.	.	S	Bend	trans	-93.8	107.2	177.9	-55.9	-165.9	0	0	0	108.6	Q678 F682 S730	Q678-I732 HydrophobicContact CG-CG2 4.27Å; Q678-I732 PolarHBondContact NE2-O 3.17Å; F682-I732 HydrophobicContact CE1-CD1 3.45Å; F682-I732 VanDerWaalsContact CE1-CD1 3.45Å; F682-I732 HydrophobicContact CE1-CG1 4.13Å; F682-I732 HydrophobicContact CZ-CB 4.34Å; F682-I732 HydrophobicContact CZ-CD1 3.65Å; F682-I732 HydrophobicContact CZ-CG1 3.95Å; S730-I732 VanDerWaalsContact C-N 3.35Å; S730-I732 PolarHBondContact O-N 3.23Å
733	P	71.9	Confident	75.7	Confident	80 Å²	80	79.8 Å²	79.8	52%	0.519	38%	0.381	S	S	.	.			trans	-67.2	155.4	175.1	30.7	-35.6	0	0	0	110.5	Q678 K731	Q678-P733 PolarHBondContact NE2-O 2.94Å; K731-P733 VanDerWaalsContact O-CD 3.32Å; K731-P733 WeakPolarHBondContact O-CD 3.19Å
734	L	75	Confident	75.3	Confident	10 Å²	10	72.4 Å²	72.4	5%	0.052	35%	0.353	C	S	.	.			trans	-70.8	142.7	171.3	-66.3	168.1	0	0	0	109.8	F642 I671 Q674 V675 E737 S738	F642-L734 HydrophobicContact CD2-CD1 4.34Å; I671-L734 HydrophobicContact CG2-CD1 4Å; Q674-L734 HydrophobicContact CB-CD2 3.67Å; V675-L734 HydrophobicContact CG2-CD1 4.41Å; V675-L734 HydrophobicContact CG2-CD2 3.77Å; L734-E737 HydrophobicContact CB-CB 4.04Å; L734-E737 HydrophobicContact CB-CG 3.88Å; L734-E737 HydrophobicContact CD1-CG 4.12Å; L734-E737 PolarHBondContact O-N 3.01Å; L734-S738 PolarHBondContact O-N 3.38Å; L734-S738 PolarHBondContact O-OG 2.85Å
735	K	71.8	Confident	74.7	Confident	108 Å²	108	65.6 Å²	65.6	47%	0.47	33%	0.325	S	S	.	.	H	α-helix	trans	-64.9	-44.8	176.2	-78.4	176.9	167.7	174.6	0	110.3	E706 E737 S738 Q739	E706-K735 IonicContact OE1-NZ 2.67Å; E706-K735 PolarHBondContact OE1-NZ 3.36Å; E706-K735 IonicContact OE2-NZ 3.05Å; E706-K735 PolarHBondContact OE2-NZ 3.21Å; K735-E737 VanDerWaalsContact C-N 3.31Å; K735-E737 PolarHBondContact O-N 2.83Å; K735-S738 PolarHBondContact O-N 3.27Å; K735-S738 VanDerWaalsContact O-N 3.14Å; K735-Q739 PolarHBondContact O-N 2.81Å
736	T	68.6	Low	74.1	Confident	37 Å²	37	65.4 Å²	65.4	23%	0.227	32%	0.321	C	S	.	.	H	α-helix	trans	-58.7	-42.7	177.2	-59.2	0	0	0	0	111.4	Q674 R740	Q674-T736 PolarHBondContact NE2-OG1 2.97Å; Q674-T736 PolarHBondContact OE1-OG1 3.12Å; T736-R740 WeakPolarHBondContact O-CB 3.41Å; T736-R740 PolarHBondContact O-N 3.46Å
737	E	68.4	Low	73.6	Confident	28 Å²	28	65.9 Å²	65.9	13%	0.131	32%	0.323	C	S	.	.	H	α-helix	trans	-65.4	-43.8	175.8	-69.5	-171.2	137.8	0	0	111.5	T586 N620 L734 K735 Q739 R740 D741	T586-E737 WeakPolarHBondContact CB-OE1 3.35Å; T586-E737 HydrophobicContact CG2-CG 3.92Å; T586-E737 PolarHBondContact OG1-OE1 2.88Å; N620-E737 WeakPolarHBondContact CB-OE1 3.41Å; N620-E737 PolarHBondContact ND2-OE1 3.01Å; N620-E737 VanDerWaalsContact ND2-OE1 3.11Å; L734-E737 HydrophobicContact CB-CB 4.04Å; L734-E737 HydrophobicContact CB-CG 3.88Å; L734-E737 HydrophobicContact CD1-CG 4.12Å; L734-E737 PolarHBondContact O-N 3.01Å; K735-E737 VanDerWaalsContact C-N 3.31Å; K735-E737 PolarHBondContact O-N 2.83Å; E737-Q739 VanDerWaalsContact C-N 3.34Å; E737-Q739 PolarHBondContact O-N 3.22Å; E737-R740 PolarHBondContact O-N 3.13Å; E737-D741 WeakPolarHBondContact O-CA 3.32Å; E737-D741 WeakPolarHBondContact O-CB 3.47Å; E737-D741 PolarHBondContact O-N 3.13Å
738	S	67.6	Low	73.3	Confident	49 Å²	49	68.4 Å²	68.4	34%	0.343	34%	0.337	S	S	.	.	H	α-helix	trans	-64.8	-36.5	-178.1	-56.5	0	0	0	0	113.1	L734 K735 Q742	L734-S738 PolarHBondContact O-N 3.38Å; L734-S738 PolarHBondContact O-OG 2.85Å; K735-S738 PolarHBondContact O-N 3.27Å; K735-S738 VanDerWaalsContact O-N 3.14Å; S738-Q742 PolarHBondContact O-N 3.32Å
739	Q	69.3	Low	73.1	Confident	124 Å²	124	66.4 Å²	66.4	58%	0.579	33%	0.326	S	S	*	.	H	α-helix	trans	-71.5	-52	174.2	-72.2	172.4	-32.8	0	0	111.3	K735 E737 D741 Q742 E743	K735-Q739 PolarHBondContact O-N 2.81Å; E737-Q739 VanDerWaalsContact C-N 3.34Å; E737-Q739 PolarHBondContact O-N 3.22Å; Q739-D741 VanDerWaalsContact C-N 3.27Å; Q739-D741 PolarHBondContact O-N 3.44Å; Q739-Q742 WeakPolarHBondContact O-CA 3.34Å; Q739-Q742 WeakPolarHBondContact O-CB 3.43Å; Q739-Q742 PolarHBondContact O-N 3.46Å; Q739-E743 PolarHBondContact O-N 3.17Å
740	R	72	Confident	72.8	Confident	129 Å²	129	69.8 Å²	69.8	49%	0.487	35%	0.348	S	S	.	.	H	α-helix	trans	-59.7	-38.3	179.1	-170.2	177.1	-172.2	173.7	1.8	112	T736 E737 Q742 T744	T736-R740 WeakPolarHBondContact O-CB 3.41Å; T736-R740 PolarHBondContact O-N 3.46Å; E737-R740 PolarHBondContact O-N 3.13Å; R740-Q742 VanDerWaalsContact C-N 3.3Å; R740-Q742 PolarHBondContact O-N 3Å; R740-T744 VanDerWaalsContact O-CB 3.23Å; R740-T744 WeakPolarHBondContact O-CB 3.37Å; R740-T744 PolarHBondContact O-N 2.91Å; R740-T744 PolarHBondContact O-OG1 2.89Å
741	D	67.5	Low	72.9	Confident	22 Å²	22	74.3 Å²	74.3	12%	0.118	37%	0.367	C	S	.	.	H	α-helix	trans	-56.4	-42.7	171.7	-94.6	5.2	0	0	0	112	K484 K488 E737 Q739 A745	K484-D741 PolarHBondContact NZ-O 3.05Å; K488-D741 VanDerWaalsContact CE-OD2 3.31Å; K488-D741 WeakPolarHBondContact CE-OD2 3.27Å; K488-D741 IonicContact NZ-OD2 3.81Å; K488-D741 PolarHBondContact NZ-OD2 3.47Å; E737-D741 WeakPolarHBondContact O-CA 3.32Å; E737-D741 WeakPolarHBondContact O-CB 3.47Å; E737-D741 PolarHBondContact O-N 3.13Å; Q739-D741 VanDerWaalsContact C-N 3.27Å; Q739-D741 PolarHBondContact O-N 3.44Å; D741-A745 WeakPolarHBondContact O-CB 3.32Å; D741-A745 PolarHBondContact O-N 3.22Å; D741-A745 VanDerWaalsContact O-N 3.07Å
742	Q	68.6	Low	73.3	Confident	73 Å²	73	70 Å²	70	34%	0.341	35%	0.352	S	S	.	.	H	α-helix	trans	-72.5	-49	-179.4	-179.5	169	-14.6	0	0	110.9	S738 Q739 R740 T744 A745 E746	S738-Q742 PolarHBondContact O-N 3.32Å; Q739-Q742 WeakPolarHBondContact O-CA 3.34Å; Q739-Q742 WeakPolarHBondContact O-CB 3.43Å; Q739-Q742 PolarHBondContact O-N 3.46Å; R740-Q742 VanDerWaalsContact C-N 3.3Å; R740-Q742 PolarHBondContact O-N 3Å; Q742-T744 VanDerWaalsContact C-N 3.26Å; Q742-T744 PolarHBondContact O-N 3.06Å; Q742-A745 PolarHBondContact O-N 3.17Å; Q742-A745 VanDerWaalsContact O-N 3.1Å; Q742-E746 VanDerWaalsContact CG-OE1 3.27Å; Q742-E746 WeakPolarHBondContact CG-OE1 3.36Å; Q742-E746 PolarHBondContact NE2-OE1 3.38Å; Q742-E746 PolarHBondContact O-N 2.88Å
743	E	71.5	Confident	73.9	Confident	105 Å²	105	68 Å²	68	49%	0.491	34%	0.34	S	S	.	.	H	α-helix	trans	-56.9	-39.7	174.5	-67.6	177.8	-164.6	0	0	112.6	Q739 K747	Q739-E743 PolarHBondContact O-N 3.17Å; E743-K747 WeakPolarHBondContact O-CB 3.43Å; E743-K747 VanDerWaalsContact O-CG 3.27Å; E743-K747 WeakPolarHBondContact O-CG 3.31Å; E743-K747 PolarHBondContact O-N 3.07Å
744	T	73.1	Confident	74.5	Confident	49 Å²	49	69.5 Å²	69.5	30%	0.301	34%	0.335	S	S	.	.	H	α-helix	trans	-69	-39.1	177.6	-53.7	0	0	0	0	110.9	R740 Q742 N748	R740-T744 VanDerWaalsContact O-CB 3.23Å; R740-T744 WeakPolarHBondContact O-CB 3.37Å; R740-T744 PolarHBondContact O-N 2.91Å; R740-T744 PolarHBondContact O-OG1 2.89Å; Q742-T744 VanDerWaalsContact C-N 3.26Å; Q742-T744 PolarHBondContact O-N 3.06Å; T744-N748 VanDerWaalsContact O-CB 3.23Å; T744-N748 WeakPolarHBondContact O-CB 3.4Å; T744-N748 PolarHBondContact O-N 2.83Å; T744-N748 PolarHBondContact O-OD1 3.34Å
745	A	70.7	Confident	75	Confident	8 Å²	8	73.8 Å²	73.8	7%	0.066	36%	0.357	C	S	.	.	H	α-helix	trans	-64.4	-41.9	175.2	0	0	0	0	0	112.2	T480 K484 D741 Q742 L749	T480-A745 HydrophobicContact CG2-CB 4.08Å; K484-A745 HydrophobicContact CD-CB 4.37Å; D741-A745 WeakPolarHBondContact O-CB 3.32Å; D741-A745 PolarHBondContact O-N 3.22Å; D741-A745 VanDerWaalsContact O-N 3.07Å; Q742-A745 PolarHBondContact O-N 3.17Å; Q742-A745 VanDerWaalsContact O-N 3.1Å; A745-L749 WeakPolarHBondContact O-CB 3.22Å; A745-L749 PolarHBondContact O-N 2.94Å
746	E	71.9	Confident	75.7	Confident	96 Å²	96	72.1 Å²	72.1	45%	0.449	35%	0.352	S	S	.	.	H	α-helix	trans	-69	-38.3	178.1	-69.6	171.4	-160.6	0	0	112.4	Q742 T750	Q742-E746 VanDerWaalsContact CG-OE1 3.27Å; Q742-E746 WeakPolarHBondContact CG-OE1 3.36Å; Q742-E746 PolarHBondContact NE2-OE1 3.38Å; Q742-E746 PolarHBondContact O-N 2.88Å; E746-T750 PolarHBondContact O-N 3.3Å; E746-T750 VanDerWaalsContact O-N 3.12Å; E746-T750 PolarHBondContact O-OG1 3.02Å
747	K	76.1	Confident	76.7	Confident	122 Å²	122	70.3 Å²	70.3	53%	0.53	34%	0.342	S	S	.	.	H	α-helix	trans	-65.4	-52.4	172.9	-76.1	169.9	-179.2	166.9	0	111.7	E743 L749 T750 E751	E743-K747 WeakPolarHBondContact O-CB 3.43Å; E743-K747 VanDerWaalsContact O-CG 3.27Å; E743-K747 WeakPolarHBondContact O-CG 3.31Å; E743-K747 PolarHBondContact O-N 3.07Å; K747-L749 VanDerWaalsContact C-N 3.31Å; K747-L749 PolarHBondContact O-N 2.71Å; K747-T750 WeakPolarHBondContact O-CB 3.49Å; K747-T750 PolarHBondContact O-N 3.4Å; K747-E751 PolarHBondContact O-N 3.01Å
748	N	78.3	Confident	77.4	Confident	74 Å²	74	71.3 Å²	71.3	40%	0.396	35%	0.346	S	S	.	.	H	α-helix	trans	-59	-42.1	178.7	-69.1	15.5	0	0	0	111.3	T744 T750 E751 D752	T744-N748 VanDerWaalsContact O-CB 3.23Å; T744-N748 WeakPolarHBondContact O-CB 3.4Å; T744-N748 PolarHBondContact O-N 2.83Å; T744-N748 PolarHBondContact O-OD1 3.34Å; N748-T750 VanDerWaalsContact C-N 3.31Å; N748-T750 PolarHBondContact O-N 2.72Å; N748-E751 PolarHBondContact O-N 3.36Å; N748-D752 VanDerWaalsContact O-CB 3.25Å; N748-D752 WeakPolarHBondContact O-CB 3.48Å; N748-D752 PolarHBondContact O-N 3.28Å
749	L	80.9	Confident	78.3	Confident	20 Å²	20	71.1 Å²	71.1	11%	0.105	35%	0.348	C	S	.	.	H	α-helix	trans	-58.9	-42.1	174	178.6	74.6	0	0	0	111.8	D476 V477 A745 K747 R753	D476-L749 HydrophobicContact CB-CD1 4.25Å; D476-L749 WeakPolarHBondContact OD2-CD1 3.12Å; V477-L749 HydrophobicContact CG2-CD1 4.42Å; V477-L749 HydrophobicContact CG2-CD2 3.73Å; A745-L749 WeakPolarHBondContact O-CB 3.22Å; A745-L749 PolarHBondContact O-N 2.94Å; K747-L749 VanDerWaalsContact C-N 3.31Å; K747-L749 PolarHBondContact O-N 2.71Å; L749-R753 VanDerWaalsContact O-CB 3.25Å; L749-R753 WeakPolarHBondContact O-CB 3.4Å; L749-R753 WeakPolarHBondContact O-CG 3.35Å; L749-R753 PolarHBondContact O-N 3.48Å
750	T	78.2	Confident	79.2	Confident	89 Å²	89	65.3 Å²	65.3	55%	0.546	32%	0.321	S	S	.	.	H	α-helix	trans	-68.9	-38.6	179.9	-54.2	0	0	0	0	111.7	E746 K747 N748 R754	E746-T750 PolarHBondContact O-N 3.3Å; E746-T750 VanDerWaalsContact O-N 3.12Å; E746-T750 PolarHBondContact O-OG1 3.02Å; K747-T750 WeakPolarHBondContact O-CB 3.49Å; K747-T750 PolarHBondContact O-N 3.4Å; N748-T750 VanDerWaalsContact C-N 3.31Å; N748-T750 PolarHBondContact O-N 2.72Å; T750-R754 WeakPolarHBondContact O-CB 3.29Å; T750-R754 PolarHBondContact O-N 3.19Å; T750-R754 VanDerWaalsContact O-N 3.07Å
751	E	81.4	Confident	79.7	Confident	116 Å²	116	59.1 Å²	59.1	54%	0.542	30%	0.297	S	S	.	.	H	α-helix	trans	-69.8	-46.5	174.9	-70.7	178.9	-179.2	0	0	111.8	K747 N748 R753 R754 I755	K747-E751 PolarHBondContact O-N 3.01Å; N748-E751 PolarHBondContact O-N 3.36Å; E751-R753 PolarHBondContact O-N 2.87Å; E751-R754 WeakPolarHBondContact O-CB 3.35Å; E751-R754 PolarHBondContact O-N 2.67Å; E751-R754 VanDerWaalsContact O-N 3.11Å; E751-I755 VanDerWaalsContact O-CG1 3.31Å; E751-I755 WeakPolarHBondContact O-CG1 3.41Å; E751-I755 PolarHBondContact O-N 3.1Å
752	D	82.7	Confident	80.3	Confident	65 Å²	65	59.8 Å²	59.8	35%	0.348	30%	0.302	S	S	.	.	H	α-helix	trans	-59.1	-45.4	174.8	-80.4	-1.1	0	0	0	110.6	K519 N748 R754 I755 L756	K519-D752 IonicContact NZ-OD2 2.84Å; N748-D752 VanDerWaalsContact O-CB 3.25Å; N748-D752 WeakPolarHBondContact O-CB 3.48Å; N748-D752 PolarHBondContact O-N 3.28Å; D752-R754 VanDerWaalsContact C-N 3.34Å; D752-R754 PolarHBondContact O-N 3.32Å; D752-I755 PolarHBondContact O-N 3.13Å; D752-L756 VanDerWaalsContact O-CB 3.3Å; D752-L756 WeakPolarHBondContact O-CB 3.22Å; D752-L756 VanDerWaalsContact O-CG 3.25Å; D752-L756 WeakPolarHBondContact O-CG 3.2Å; D752-L756 PolarHBondContact O-N 3.11Å
753	R	86.5	Confident	81.1	Confident	24 Å²	24	63.4 Å²	63.4	9%	0.091	31%	0.313	C	S	.	.	H	α-helix	trans	-57.6	-44.2	172.8	-78.9	177.7	175.3	-145.8	-11.2	111.9	D474 D476 L749 E751 L756 V757 F788	D474-R753 VanDerWaalsContact CG-NH2 3.27Å; D474-R753 IonicContact OD1-CZ 2.86Å; D474-R753 IonicContact OD1-NH1 2.73Å; D474-R753 PolarHBondContact OD1-NH1 3.27Å; D474-R753 IonicContact OD1-NH2 3.22Å; D474-R753 PolarHBondContact OD1-NH2 2.77Å; D474-R753 IonicContact OD2-NH2 2.71Å; D476-R753 IonicContact OD1-CZ 3.17Å; D476-R753 IonicContact OD1-NE 3.53Å; D476-R753 IonicContact OD1-NH2 2.76Å; D476-R753 PolarHBondContact OD1-NH2 3.16Å; D476-R753 VanDerWaalsContact OD2-CG 3.28Å; D476-R753 WeakPolarHBondContact OD2-CG 3.3Å; D476-R753 IonicContact OD2-CZ 3.12Å; D476-R753 IonicContact OD2-NE 3.93Å; D476-R753 PolarHBondContact OD2-NE 3.42Å; D476-R753 IonicContact OD2-NH2 3.12Å; D476-R753 PolarHBondContact OD2-NH2 3.27Å; L749-R753 VanDerWaalsContact O-CB 3.25Å; L749-R753 WeakPolarHBondContact O-CB 3.4Å; L749-R753 WeakPolarHBondContact O-CG 3.35Å; L749-R753 PolarHBondContact O-N 3.48Å; E751-R753 PolarHBondContact O-N 2.87Å; R753-L756 PolarHBondContact O-N 2.85Å; R753-V757 WeakPolarHBondContact O-CB 3.48Å; R753-V757 VanDerWaalsContact O-CG2 3.23Å; R753-V757 WeakPolarHBondContact O-CG2 3.46Å; R753-V757 PolarHBondContact O-N 3.41Å; R753-F788 HydrophobicContact CB-CE2 4.19Å; R753-F788 HydrophobicContact CB-CZ 3.97Å; R753-F788 HydrophobicContact CG-CD1 4.36Å; R753-F788 HydrophobicContact CG-CD2 4.22Å; R753-F788 HydrophobicContact CG-CE1 4.03Å; R753-F788 HydrophobicContact CG-CE2 3.87Å; R753-F788 HydrophobicContact CG-CG 4.46Å; R753-F788 HydrophobicContact CG-CZ 3.76Å
754	R	84.5	Confident	81.6	Confident	111 Å²	111	58.4 Å²	58.4	42%	0.419	29%	0.289	S	S	.	.	H	α-helix	trans	-63.9	-45.1	177.5	-174.7	-179.7	176.2	-156.9	1.4	111.1	T750 E751 D752 V757 Q758 E801	T750-R754 WeakPolarHBondContact O-CB 3.29Å; T750-R754 PolarHBondContact O-N 3.19Å; T750-R754 VanDerWaalsContact O-N 3.07Å; E751-R754 WeakPolarHBondContact O-CB 3.35Å; E751-R754 PolarHBondContact O-N 2.67Å; E751-R754 VanDerWaalsContact O-N 3.11Å; D752-R754 VanDerWaalsContact C-N 3.34Å; D752-R754 PolarHBondContact O-N 3.32Å; R754-V757 PolarHBondContact O-N 2.91Å; R754-Q758 VanDerWaalsContact O-CB 3.32Å; R754-Q758 WeakPolarHBondContact O-CB 3.49Å; R754-Q758 VanDerWaalsContact O-CG 3.25Å; R754-Q758 WeakPolarHBondContact O-CG 3.35Å; R754-Q758 PolarHBondContact O-N 3.41Å; R754-E801 IonicContact CZ-OE1 3.63Å; R754-E801 IonicContact CZ-OE2 3.69Å; R754-E801 IonicContact NE-OE1 2.72Å; R754-E801 IonicContact NE-OE2 2.96Å; R754-E801 PolarHBondContact NE-OE2 3.48Å; R754-E801 IonicContact NH2-OE1 2.74Å; R754-E801 PolarHBondContact NH2-OE1 2.75Å; R754-E801 IonicContact NH2-OE2 3.54Å; R754-E801 PolarHBondContact NH2-OE2 3.29Å
755	I	85.6	Confident	81.5	Confident	101 Å²	101	57.6 Å²	57.6	52%	0.518	28%	0.282	S	S	.	.	H	α-helix	trans	-64.8	-42.4	177.8	-66.4	164.1	0	0	0	110.9	E751 D752 Q758 A759	E751-I755 VanDerWaalsContact O-CG1 3.31Å; E751-I755 WeakPolarHBondContact O-CG1 3.41Å; E751-I755 PolarHBondContact O-N 3.1Å; D752-I755 PolarHBondContact O-N 3.13Å; I755-Q758 PolarHBondContact O-N 3.38Å; I755-A759 VanDerWaalsContact O-CB 3.26Å; I755-A759 WeakPolarHBondContact O-CB 3.49Å; I755-A759 PolarHBondContact O-N 2.84Å
756	L	87	Confident	81.6	Confident	72 Å²	72	64.9 Å²	64.9	38%	0.377	31%	0.313	S	S	.	.	H	α-helix	trans	-66.3	-42.7	176.5	-73.3	171.6	0	0	0	112	D752 R753 A759 C760 F788	D752-L756 VanDerWaalsContact O-CB 3.3Å; D752-L756 WeakPolarHBondContact O-CB 3.22Å; D752-L756 VanDerWaalsContact O-CG 3.25Å; D752-L756 WeakPolarHBondContact O-CG 3.2Å; D752-L756 PolarHBondContact O-N 3.11Å; R753-L756 PolarHBondContact O-N 2.85Å; L756-A759 PolarHBondContact O-N 3.24Å; L756-C760 WeakPolarHBondContact O-CB 3.47Å; L756-C760 PolarHBondContact O-N 3.39Å; L756-F788 HydrophobicContact CB-CE1 4.4Å; L756-F788 HydrophobicContact CD1-CE1 4.17Å
757	V	88	Confident	81.5	Confident	0 Å²	0	65.2 Å²	65.2	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-63.2	-45.2	172.7	172.1	0	0	0	0	110.4	R753 R754 A759 C760 V761 V780 L784 F788 P790 I794 I795 C798	R753-V757 WeakPolarHBondContact O-CB 3.48Å; R753-V757 VanDerWaalsContact O-CG2 3.23Å; R753-V757 WeakPolarHBondContact O-CG2 3.46Å; R753-V757 PolarHBondContact O-N 3.41Å; R754-V757 PolarHBondContact O-N 2.91Å; V757-A759 PolarHBondContact O-N 2.95Å; V757-C760 PolarHBondContact O-N 2.83Å; V757-V761 HydrophobicContact CG1-CG2 4.13Å; V757-V761 WeakPolarHBondContact O-CB 3.35Å; V757-V761 VanDerWaalsContact O-CG2 3.24Å; V757-V761 WeakPolarHBondContact O-CG2 3.29Å; V757-V761 PolarHBondContact O-N 2.9Å; V757-V780 HydrophobicContact CG1-CG1 4.46Å; V757-L784 HydrophobicContact CB-CD1 4.39Å; V757-L784 HydrophobicContact CG2-CD1 3.61Å; V757-F788 HydrophobicContact CG2-CE2 4.15Å; V757-F788 HydrophobicContact CG2-CZ 3.95Å; V757-P790 HydrophobicContact CG2-CB 4.13Å; V757-I794 HydrophobicContact CB-CG2 4.41Å; V757-I794 HydrophobicContact CG1-CG2 4.44Å; V757-I794 HydrophobicContact CG2-CG2 4.16Å; V757-I795 HydrophobicContact CG1-CB 4.42Å; V757-I795 HydrophobicContact CG1-CG1 4.17Å; V757-C798 HydrophobicContact CB-CB 4.46Å; V757-C798 HydrophobicContact CG1-CB 3.68Å
758	Q	84.9	Confident	81.4	Confident	48 Å²	48	64.6 Å²	64.6	22%	0.224	31%	0.31	C	S	.	.	H	α-helix	trans	-60.5	-46.1	176.3	-77.1	176.7	-10.2	0	0	111.6	R754 I755 C760 V761 V762 C798 E801 I802	R754-Q758 VanDerWaalsContact O-CB 3.32Å; R754-Q758 WeakPolarHBondContact O-CB 3.49Å; R754-Q758 VanDerWaalsContact O-CG 3.25Å; R754-Q758 WeakPolarHBondContact O-CG 3.35Å; R754-Q758 PolarHBondContact O-N 3.41Å; I755-Q758 PolarHBondContact O-N 3.38Å; Q758-C760 PolarHBondContact O-N 3.43Å; Q758-V761 PolarHBondContact O-N 2.81Å; Q758-V762 WeakPolarHBondContact O-CB 3.44Å; Q758-V762 VanDerWaalsContact O-CG2 3.28Å; Q758-V762 WeakPolarHBondContact O-CG2 3.42Å; Q758-V762 PolarHBondContact O-N 2.82Å; Q758-C798 HydrophobicContact CG-CB 3.7Å; Q758-E801 PolarHBondContact NE2-OE2 3.02Å; Q758-I802 HydrophobicContact CB-CD1 3.8Å; Q758-I802 HydrophobicContact CB-CG1 4.42Å; Q758-I802 HydrophobicContact CG-CD1 3.87Å; Q758-I802 HydrophobicContact CG-CG1 4.22Å; Q758-I802 WeakPolarHBondContact O-CD1 3.45Å
759	A	86	Confident	80.8	Confident	46 Å²	46	68.6 Å²	68.6	38%	0.38	32%	0.324	S	S	.	.	H	α-helix	trans	-64	-40.1	176.9	0	0	0	0	0	112.3	I755 L756 V757 V762 R763	I755-A759 VanDerWaalsContact O-CB 3.26Å; I755-A759 WeakPolarHBondContact O-CB 3.49Å; I755-A759 PolarHBondContact O-N 2.84Å; L756-A759 PolarHBondContact O-N 3.24Å; V757-A759 PolarHBondContact O-N 2.95Å; A759-V762 PolarHBondContact O-N 3.15Å; A759-R763 VanDerWaalsContact O-CB 3.24Å; A759-R763 WeakPolarHBondContact O-CB 3.29Å; A759-R763 PolarHBondContact O-N 3.14Å
760	C	87.9	Confident	79.9	Confident	1 Å²	1	76.8 Å²	76.8	1%	0.007	35%	0.353	C	S	.	.	H	α-helix	trans	-65.9	-49.1	176.2	-171	0	0	0	0	111.5	L756 V757 Q758 V762 R763 I764 L784	L756-C760 WeakPolarHBondContact O-CB 3.47Å; L756-C760 PolarHBondContact O-N 3.39Å; V757-C760 PolarHBondContact O-N 2.83Å; Q758-C760 PolarHBondContact O-N 3.43Å; C760-V762 VanDerWaalsContact C-N 3.34Å; C760-V762 PolarHBondContact O-N 3.19Å; C760-R763 WeakPolarHBondContact O-CB 3.48Å; C760-R763 PolarHBondContact O-N 3.41Å; C760-R763 VanDerWaalsContact O-N 3.13Å; C760-I764 WeakPolarHBondContact O-CB 3Å; C760-I764 WeakPolarHBondContact O-CG1 3.36Å; C760-I764 PolarHBondContact O-N 3.5Å; C760-I764 WeakPolarHBondContact SG-CD1 3.36Å; C760-L784 HydrophobicContact CB-CD1 4.11Å; C760-L784 HydrophobicContact CB-CD2 4.13Å; C760-L784 HydrophobicContact CB-CG 4.17Å
761	V	82.1	Confident	79.3	Confident	0 Å²	0	74.2 Å²	74.2	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-57.4	-45.4	173.3	169.9	0	0	0	0	110.6	V757 Q758 R763 M765 V780 I795 A799 I802	V757-V761 HydrophobicContact CG1-CG2 4.13Å; V757-V761 WeakPolarHBondContact O-CB 3.35Å; V757-V761 VanDerWaalsContact O-CG2 3.24Å; V757-V761 WeakPolarHBondContact O-CG2 3.29Å; V757-V761 PolarHBondContact O-N 2.9Å; Q758-V761 PolarHBondContact O-N 2.81Å; V761-R763 PolarHBondContact O-N 3.29Å; V761-M765 HydrophobicContact CG1-CG 4.11Å; V761-M765 WeakPolarHBondContact O-CB 3.35Å; V761-M765 WeakPolarHBondContact O-CG 3.37Å; V761-M765 PolarHBondContact O-N 3.38Å; V761-V780 HydrophobicContact CG2-CG2 3.7Å; V761-I795 HydrophobicContact CG2-CG2 4.14Å; V761-A799 HydrophobicContact CG1-CB 4.36Å; V761-I802 HydrophobicContact CB-CD1 4.04Å; V761-I802 HydrophobicContact CG1-CD1 3.89Å
762	V	81.4	Confident	79	Confident	36 Å²	36	70.4 Å²	70.4	22%	0.218	32%	0.321	C	S	.	.	H	α-helix	trans	-63.4	-40.8	175.7	168.8	0	0	0	0	111.8	Q758 A759 C760 K766 I802	Q758-V762 WeakPolarHBondContact O-CB 3.44Å; Q758-V762 VanDerWaalsContact O-CG2 3.28Å; Q758-V762 WeakPolarHBondContact O-CG2 3.42Å; Q758-V762 PolarHBondContact O-N 2.82Å; A759-V762 PolarHBondContact O-N 3.15Å; C760-V762 VanDerWaalsContact C-N 3.34Å; C760-V762 PolarHBondContact O-N 3.19Å; V762-K766 HydrophobicContact CG1-CD 3.96Å; V762-K766 HydrophobicContact CG1-CG 4.4Å; V762-K766 VanDerWaalsContact O-CB 3.22Å; V762-K766 WeakPolarHBondContact O-CB 3.47Å; V762-K766 WeakPolarHBondContact O-CG 3.46Å; V762-K766 PolarHBondContact O-N 2.89Å; V762-I802 HydrophobicContact CG2-CD1 3.77Å; V762-I802 HydrophobicContact CG2-CG1 4.19Å; V762-I802 HydrophobicContact CG2-CG2 3.92Å
763	R	84.5	Confident	78.4	Confident	149 Å²	149	71.3 Å²	71.3	56%	0.562	32%	0.322	S	S	*	.	H	α-helix	trans	-64.8	-48.6	178.3	-172.2	-167.8	-62.9	158.1	-6.5	111.2	A759 C760 V761 K766 M767	A759-R763 VanDerWaalsContact O-CB 3.24Å; A759-R763 WeakPolarHBondContact O-CB 3.29Å; A759-R763 PolarHBondContact O-N 3.14Å; C760-R763 WeakPolarHBondContact O-CB 3.48Å; C760-R763 PolarHBondContact O-N 3.41Å; C760-R763 VanDerWaalsContact O-N 3.13Å; V761-R763 PolarHBondContact O-N 3.29Å; R763-K766 PolarHBondContact O-N 2.83Å; R763-M767 WeakPolarHBondContact O-CB 3.35Å; R763-M767 PolarHBondContact O-N 3.06Å
764	I	81.6	Confident	78	Confident	0 Å²	0	74.3 Å²	74.3	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-63.6	-49.2	177.6	-75	165.7	0	0	0	111.1	C760 K766 M767 R768 L771 L776 E779 V780 Q783	C760-I764 WeakPolarHBondContact O-CB 3Å; C760-I764 WeakPolarHBondContact O-CG1 3.36Å; C760-I764 PolarHBondContact O-N 3.5Å; C760-I764 WeakPolarHBondContact SG-CD1 3.36Å; I764-K766 VanDerWaalsContact C-N 3.31Å; I764-K766 PolarHBondContact O-N 3.1Å; I764-M767 PolarHBondContact O-N 3.2Å; I764-R768 PolarHBondContact O-N 2.97Å; I764-L771 HydrophobicContact CG2-CD1 3.18Å; I764-L776 HydrophobicContact CB-CD1 4.42Å; I764-L776 HydrophobicContact CG2-CD1 3.65Å; I764-E779 HydrophobicContact CD1-CB 3.79Å; I764-E779 HydrophobicContact CG1-CB 4.32Å; I764-E779 HydrophobicContact CG2-CB 4.18Å; I764-E779 WeakPolarHBondContact CG2-OE2 3.47Å; I764-V780 HydrophobicContact CD1-CB 4.23Å; I764-V780 HydrophobicContact CD1-CG2 3.57Å; I764-Q783 HydrophobicContact CD1-CG 4.42Å; I764-Q783 VanDerWaalsContact CG1-NE2 3.35Å
765	M	71.5	Confident	77.9	Confident	31 Å²	31	71.4 Å²	71.4	15%	0.153	34%	0.336	C	S	.	.	H	α-helix	trans	-65.3	-32.7	178.1	-70	-62.8	-57.4	0	0	112.4	V761 K769 L771 L776 F803 L812	V761-M765 HydrophobicContact CG1-CG 4.11Å; V761-M765 WeakPolarHBondContact O-CB 3.35Å; V761-M765 WeakPolarHBondContact O-CG 3.37Å; V761-M765 PolarHBondContact O-N 3.38Å; M765-K769 VanDerWaalsContact O-CA 3.23Å; M765-K769 WeakPolarHBondContact O-CA 3.41Å; M765-K769 PolarHBondContact O-N 2.6Å; M765-L771 HydrophobicContact SD-CD1 4.46Å; M765-L776 HydrophobicContact CG-CD1 4.23Å; M765-L776 HydrophobicContact SD-CD1 4.05Å; M765-L776 HydrophobicContact SD-CD2 4.24Å; M765-F803 HydrophobicContact CE-CE1 4.12Å; M765-F803 HydrophobicContact CE-CZ 3.8Å; M765-F803 HydrophobicContact CG-CE1 4.41Å; M765-F803 HydrophobicContact CG-CZ 3.98Å; M765-F803 HydrophobicContact SD-CZ 4.12Å; M765-L812 HydrophobicContact CE-CD2 4.46Å
766	K	72.9	Confident	77.7	Confident	161 Å²	161	67.1 Å²	67.1	70%	0.7	32%	0.315	S	S	*	.	H	α-helix	trans	-65.9	-40	169.5	-80.8	174.3	174.8	-174.8	0	112.3	V762 R763 I764	V762-K766 HydrophobicContact CG1-CD 3.96Å; V762-K766 HydrophobicContact CG1-CG 4.4Å; V762-K766 VanDerWaalsContact O-CB 3.22Å; V762-K766 WeakPolarHBondContact O-CB 3.47Å; V762-K766 WeakPolarHBondContact O-CG 3.46Å; V762-K766 PolarHBondContact O-N 2.89Å; R763-K766 PolarHBondContact O-N 2.83Å; I764-K766 VanDerWaalsContact C-N 3.31Å; I764-K766 PolarHBondContact O-N 3.1Å
767	M	70.5	Confident	77.6	Confident	103 Å²	103	64.8 Å²	64.8	51%	0.507	30%	0.302	S	S	.	.	H	α-helix	trans	-74.2	-52.6	-176.8	-175.1	175.7	74	0	0	112.4	R763 I764	R763-M767 WeakPolarHBondContact O-CB 3.35Å; R763-M767 PolarHBondContact O-N 3.06Å; I764-M767 PolarHBondContact O-N 3.2Å
768	R	74	Confident	77.5	Confident	110 Å²	110	68.4 Å²	68.4	42%	0.415	33%	0.328	S	S	.	.	H	α-helix	trans	-86.5	-23.7	-175.9	-60.9	-57.6	-163	-177.9	6	114.2	I764 R770 L771 E779	I764-R768 PolarHBondContact O-N 2.97Å; R768-R770 PolarHBondContact O-N 3.27Å; R768-L771 HydrophobicContact CB-CD1 3.76Å; R768-L771 HydrophobicContact CB-CD2 4.35Å; R768-L771 HydrophobicContact CB-CG 3.76Å; R768-L771 HydrophobicContact CG-CD1 3.82Å; R768-L771 HydrophobicContact CG-CD2 4.18Å; R768-L771 HydrophobicContact CG-CG 4.04Å; R768-E779 WeakPolarHBondContact CG-OE2 3.45Å; R768-E779 IonicContact CZ-OE1 2.72Å; R768-E779 IonicContact NE-OE1 2.77Å; R768-E779 PolarHBondContact NE-OE1 2.97Å; R768-E779 IonicContact NE-OE2 3.64Å; R768-E779 PolarHBondContact NE-OE2 2.66Å; R768-E779 IonicContact NH2-OE1 3.47Å; R768-E779 PolarHBondContact NH2-OE1 3.18Å
769	K	63.8	Low	77.7	Confident	158 Å²	158	67.8 Å²	67.8	69%	0.687	33%	0.325	S	S	*	.	S	Bend	trans	63.7	-35.2	-177.1	-53.2	174.1	-175.9	169.7	0	115.7	M765	M765-K769 VanDerWaalsContact O-CA 3.23Å; M765-K769 WeakPolarHBondContact O-CA 3.41Å; M765-K769 PolarHBondContact O-N 2.6Å
770	R	62.5	Low	77.7	Confident	192 Å²	192	65.6 Å²	65.6	73%	0.725	31%	0.306	S	S	*	.			trans	-138.7	137.2	169.6	-65.4	-175.6	-179.2	-174.2	2.1	108.9	R768	R768-R770 PolarHBondContact O-N 3.27Å
771	L	66.8	Low	77.8	Confident	35 Å²	35	67.4 Å²	67.4	18%	0.183	32%	0.316	C	S	.	.			trans	-146.8	142.9	171	-80.9	155.7	0	0	0	106.2	I764 M765 R768 Q775 L776 E779	I764-L771 HydrophobicContact CG2-CD1 3.18Å; M765-L771 HydrophobicContact SD-CD1 4.46Å; R768-L771 HydrophobicContact CB-CD1 3.76Å; R768-L771 HydrophobicContact CB-CD2 4.35Å; R768-L771 HydrophobicContact CB-CG 3.76Å; R768-L771 HydrophobicContact CG-CD1 3.82Å; R768-L771 HydrophobicContact CG-CD2 4.18Å; R768-L771 HydrophobicContact CG-CG 4.04Å; L771-Q775 HydrophobicContact CB-CB 4.29Å; L771-Q775 HydrophobicContact CD2-CB 3.45Å; L771-Q775 VanDerWaalsContact CD2-CB 3.45Å; L771-Q775 HydrophobicContact CD2-CG 4.49Å; L771-Q775 HydrophobicContact CG-CB 4.48Å; L771-L776 HydrophobicContact CB-CB 4.04Å; L771-L776 HydrophobicContact CD1-CB 4.29Å; L771-L776 HydrophobicContact CD1-CD1 3.98Å; L771-E779 HydrophobicContact CD2-CG 4.5Å
772	T	75.1	Confident	77.9	Confident	36 Å²	36	70.3 Å²	70.3	22%	0.221	34%	0.34	C	S	.	.			trans	-69.8	155.5	164.2	69.4	0	0	0	0	109.2	P774 Q775 L776 E1010	T772-P774 VanDerWaalsContact C-N 3.31Å; T772-Q775 PolarHBondContact O-N 3.47Å; T772-Q775 VanDerWaalsContact OG1-CG 3.32Å; T772-Q775 WeakPolarHBondContact OG1-CG 3.34Å; T772-Q775 PolarHBondContact OG1-OE1 3.05Å; T772-L776 PolarHBondContact O-N 3.23Å; T772-E1010 WeakPolarHBondContact CG2-OE1 3.33Å
773	H	70.3	Confident	78.1	Confident	83 Å²	83	71.5 Å²	71.5	38%	0.384	34%	0.343	S	S	.	.	H	α-helix	trans	-53.8	-42.4	-179.7	169.3	-91.1	0	0	0	112.7	Q775 L776 L777 K796	H773-Q775 PolarHBondContact O-N 2.95Å; H773-L776 PolarHBondContact O-N 3.45Å; H773-L777 WeakPolarHBondContact CE1-CD1 3.41Å; H773-L777 VanDerWaalsContact O-CG 3.3Å; H773-L777 WeakPolarHBondContact O-CG 3.33Å; H773-L777 PolarHBondContact O-N 3.14Å; H773-K796 WeakPolarHBondContact CE1-CE 3.48Å; H773-K796 VanDerWaalsContact NE2-CE 3.34Å; H773-K796 WeakPolarHBondContact NE2-CE 3.41Å; H773-K796 VanDerWaalsContact NE2-CG 3.33Å; H773-K796 WeakPolarHBondContact NE2-CG 3.36Å
774	P	77.6	Confident	78.2	Confident	87 Å²	87	64.9 Å²	64.9	57%	0.565	32%	0.319	S	S	*	.	H	α-helix	trans	-59.2	-41.9	171.3	-25.7	35.9	0	0	0	114.7	T772 L777 S778	T772-P774 VanDerWaalsContact C-N 3.31Å; P774-L777 PolarHBondContact O-N 3.3Å; P774-S778 WeakPolarHBondContact O-CB 3.41Å; P774-S778 PolarHBondContact O-N 2.83Å
775	Q	82.1	Confident	78.1	Confident	51 Å²	51	67.8 Å²	67.8	24%	0.238	34%	0.339	C	S	.	.	H	α-helix	trans	-67.8	-41.1	177	-64.3	167.1	-25	0	0	111.5	L771 T772 H773 S778 E779	L771-Q775 HydrophobicContact CB-CB 4.29Å; L771-Q775 HydrophobicContact CD2-CB 3.45Å; L771-Q775 VanDerWaalsContact CD2-CB 3.45Å; L771-Q775 HydrophobicContact CD2-CG 4.49Å; L771-Q775 HydrophobicContact CG-CB 4.48Å; T772-Q775 PolarHBondContact O-N 3.47Å; T772-Q775 VanDerWaalsContact OG1-CG 3.32Å; T772-Q775 WeakPolarHBondContact OG1-CG 3.34Å; T772-Q775 PolarHBondContact OG1-OE1 3.05Å; H773-Q775 PolarHBondContact O-N 2.95Å; Q775-S778 WeakPolarHBondContact O-CB 3.49Å; Q775-S778 PolarHBondContact O-N 3.36Å; Q775-E779 PolarHBondContact O-N 3.37Å
776	L	82.1	Confident	78.3	Confident	11 Å²	11	69.1 Å²	69.1	6%	0.058	35%	0.351	C	S	.	.	H	α-helix	trans	-61.6	-43.7	174.7	177.4	63.7	0	0	0	111.3	I764 M765 L771 T772 H773 S778 V780	I764-L776 HydrophobicContact CB-CD1 4.42Å; I764-L776 HydrophobicContact CG2-CD1 3.65Å; M765-L776 HydrophobicContact CG-CD1 4.23Å; M765-L776 HydrophobicContact SD-CD1 4.05Å; M765-L776 HydrophobicContact SD-CD2 4.24Å; L771-L776 HydrophobicContact CB-CB 4.04Å; L771-L776 HydrophobicContact CD1-CB 4.29Å; L771-L776 HydrophobicContact CD1-CD1 3.98Å; T772-L776 PolarHBondContact O-N 3.23Å; H773-L776 PolarHBondContact O-N 3.45Å; L776-S778 VanDerWaalsContact C-N 3.34Å; L776-V780 HydrophobicContact CD1-CG2 3.85Å; L776-V780 HydrophobicContact CG-CG2 4.29Å; L776-V780 VanDerWaalsContact O-CB 3.31Å; L776-V780 WeakPolarHBondContact O-CB 3.23Å; L776-V780 WeakPolarHBondContact O-CG2 3.21Å; L776-V780 PolarHBondContact O-N 3.09Å
777	L	84.7	Confident	78.7	Confident	22 Å²	22	63.2 Å²	63.2	12%	0.115	33%	0.327	C	S	.	.	H	α-helix	trans	-57.7	-48.5	171.8	-71.3	178.9	0	0	0	110.8	H773 P774 E779 V780 I781 V792 I795	H773-L777 WeakPolarHBondContact CE1-CD1 3.41Å; H773-L777 VanDerWaalsContact O-CG 3.3Å; H773-L777 WeakPolarHBondContact O-CG 3.33Å; H773-L777 PolarHBondContact O-N 3.14Å; P774-L777 PolarHBondContact O-N 3.3Å; L777-E779 PolarHBondContact O-N 2.98Å; L777-V780 PolarHBondContact O-N 3.33Å; L777-I781 HydrophobicContact CB-CD1 4.47Å; L777-I781 VanDerWaalsContact O-CB 3.26Å; L777-I781 WeakPolarHBondContact O-CB 3.27Å; L777-I781 WeakPolarHBondContact O-CD1 3.42Å; L777-I781 WeakPolarHBondContact O-CG1 3.35Å; L777-I781 PolarHBondContact O-N 2.98Å; L777-V792 HydrophobicContact CD1-CG1 3.77Å; L777-V792 HydrophobicContact CD1-CG2 4.15Å; L777-V792 HydrophobicContact CD2-CB 4.29Å; L777-V792 HydrophobicContact CD2-CG1 3.89Å; L777-V792 HydrophobicContact CD2-CG2 4.21Å; L777-I795 HydrophobicContact CD2-CB 3.77Å; L777-I795 HydrophobicContact CD2-CD1 3.63Å; L777-I795 HydrophobicContact CD2-CG1 4.3Å; L777-I795 HydrophobicContact CD2-CG2 3.81Å
778	S	85.9	Confident	79.4	Confident	77 Å²	77	58.3 Å²	58.3	54%	0.538	30%	0.303	S	S	.	.	H	α-helix	trans	-59.7	-45.6	-179.3	-175.6	0	0	0	0	112.4	P774 Q775 L776 A782	P774-S778 WeakPolarHBondContact O-CB 3.41Å; P774-S778 PolarHBondContact O-N 2.83Å; Q775-S778 WeakPolarHBondContact O-CB 3.49Å; Q775-S778 PolarHBondContact O-N 3.36Å; L776-S778 VanDerWaalsContact C-N 3.34Å; S778-A782 VanDerWaalsContact O-CB 3.28Å; S778-A782 WeakPolarHBondContact O-CB 3.3Å; S778-A782 PolarHBondContact O-N 3.45Å
779	E	87.5	Confident	79.7	Confident	34 Å²	34	57.4 Å²	57.4	16%	0.159	30%	0.303	C	S	.	.	H	α-helix	trans	-70.9	-38.6	178	-67.7	-158.9	166.2	0	0	113.4	I764 R768 L771 Q775 L777 A782 Q783	I764-E779 HydrophobicContact CD1-CB 3.79Å; I764-E779 HydrophobicContact CG1-CB 4.32Å; I764-E779 HydrophobicContact CG2-CB 4.18Å; I764-E779 WeakPolarHBondContact CG2-OE2 3.47Å; R768-E779 WeakPolarHBondContact CG-OE2 3.45Å; R768-E779 IonicContact CZ-OE1 2.72Å; R768-E779 IonicContact NE-OE1 2.77Å; R768-E779 PolarHBondContact NE-OE1 2.97Å; R768-E779 IonicContact NE-OE2 3.64Å; R768-E779 PolarHBondContact NE-OE2 2.66Å; R768-E779 IonicContact NH2-OE1 3.47Å; R768-E779 PolarHBondContact NH2-OE1 3.18Å; L771-E779 HydrophobicContact CD2-CG 4.5Å; Q775-E779 PolarHBondContact O-N 3.37Å; L777-E779 PolarHBondContact O-N 2.98Å; E779-A782 PolarHBondContact O-N 3.02Å; E779-Q783 PolarHBondContact O-N 3.41Å
780	V	87.7	Confident	80.6	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-66	-41.6	176.9	172.6	0	0	0	0	110.2	V757 V761 I764 L776 L777 L784 P790 I795	V757-V780 HydrophobicContact CG1-CG1 4.46Å; V761-V780 HydrophobicContact CG2-CG2 3.7Å; I764-V780 HydrophobicContact CD1-CB 4.23Å; I764-V780 HydrophobicContact CD1-CG2 3.57Å; L776-V780 HydrophobicContact CD1-CG2 3.85Å; L776-V780 HydrophobicContact CG-CG2 4.29Å; L776-V780 VanDerWaalsContact O-CB 3.31Å; L776-V780 WeakPolarHBondContact O-CB 3.23Å; L776-V780 WeakPolarHBondContact O-CG2 3.21Å; L776-V780 PolarHBondContact O-N 3.09Å; L777-V780 PolarHBondContact O-N 3.33Å; V780-L784 HydrophobicContact CG1-CD1 3.81Å; V780-L784 VanDerWaalsContact O-CB 3.3Å; V780-L784 WeakPolarHBondContact O-CB 3.33Å; V780-L784 WeakPolarHBondContact O-CG 3.47Å; V780-L784 PolarHBondContact O-N 2.92Å; V780-L784 VanDerWaalsContact O-N 3.08Å; V780-P790 HydrophobicContact CG1-CG 4.24Å; V780-I795 HydrophobicContact CB-CD1 4.15Å; V780-I795 HydrophobicContact CB-CG2 4.32Å; V780-I795 HydrophobicContact CG1-CD1 3.71Å; V780-I795 HydrophobicContact CG1-CG1 3.8Å; V780-I795 HydrophobicContact CG1-CG2 4.09Å; V780-I795 HydrophobicContact CG2-CG2 4.26Å
781	I	88.4	Confident	81.4	Confident	40 Å²	40	46.3 Å²	46.3	21%	0.205	26%	0.262	C	S	.	.	H	α-helix	trans	-61.8	-48.2	171.8	-70.3	164.2	0	0	0	110	L777 Q783 L784 S785 P790 I795	L777-I781 HydrophobicContact CB-CD1 4.47Å; L777-I781 VanDerWaalsContact O-CB 3.26Å; L777-I781 WeakPolarHBondContact O-CB 3.27Å; L777-I781 WeakPolarHBondContact O-CD1 3.42Å; L777-I781 WeakPolarHBondContact O-CG1 3.35Å; L777-I781 PolarHBondContact O-N 2.98Å; I781-Q783 PolarHBondContact O-N 3.08Å; I781-L784 PolarHBondContact O-N 2.89Å; I781-S785 WeakPolarHBondContact O-CA 3.41Å; I781-S785 WeakPolarHBondContact O-CB 3.36Å; I781-S785 PolarHBondContact O-N 3.34Å; I781-S785 PolarHBondContact O-OG 3.17Å; I781-P790 HydrophobicContact CB-CG 4.38Å; I781-P790 HydrophobicContact CG1-CG 3.84Å; I781-I795 HydrophobicContact CG1-CD1 4.14Å
782	A	84.9	Confident	82.1	Confident	60 Å²	60	47.5 Å²	47.5	50%	0.496	27%	0.27	S	S	.	.	H	α-helix	trans	-58.9	-51.5	-178.9	0	0	0	0	0	112.3	S778 E779 S785	S778-A782 VanDerWaalsContact O-CB 3.28Å; S778-A782 WeakPolarHBondContact O-CB 3.3Å; S778-A782 PolarHBondContact O-N 3.45Å; E779-A782 PolarHBondContact O-N 3.02Å; A782-S785 PolarHBondContact O-OG 2.92Å
783	Q	84.9	Confident	82.4	Confident	62 Å²	62	49.2 Å²	49.2	29%	0.29	28%	0.284	S	S	.	.	H	α-helix	trans	-65.9	-41	-179.7	-69.3	-167.8	28.5	0	0	112.8	I764 E779 I781 S786	I764-Q783 HydrophobicContact CD1-CG 4.42Å; I764-Q783 VanDerWaalsContact CG1-NE2 3.35Å; E779-Q783 PolarHBondContact O-N 3.41Å; I781-Q783 PolarHBondContact O-N 3.08Å; Q783-S786 PolarHBondContact O-OG 3.16Å; Q783-S786 VanDerWaalsContact O-OG 3.05Å
784	L	86.9	Confident	82.9	Confident	10 Å²	10	47.5 Å²	47.5	5%	0.052	28%	0.277	C	S	.	.	H	α-helix	trans	-82.5	-19.1	-177.2	-64.5	176.2	0	0	0	113.9	V757 C760 V780 I781 S786 L787 F788 P790	V757-L784 HydrophobicContact CB-CD1 4.39Å; V757-L784 HydrophobicContact CG2-CD1 3.61Å; C760-L784 HydrophobicContact CB-CD1 4.11Å; C760-L784 HydrophobicContact CB-CD2 4.13Å; C760-L784 HydrophobicContact CB-CG 4.17Å; V780-L784 HydrophobicContact CG1-CD1 3.81Å; V780-L784 VanDerWaalsContact O-CB 3.3Å; V780-L784 WeakPolarHBondContact O-CB 3.33Å; V780-L784 WeakPolarHBondContact O-CG 3.47Å; V780-L784 PolarHBondContact O-N 2.92Å; V780-L784 VanDerWaalsContact O-N 3.08Å; I781-L784 PolarHBondContact O-N 2.89Å; L784-S786 PolarHBondContact O-N 2.83Å; L784-L787 WeakPolarHBondContact O-CA 3.49Å; L784-L787 PolarHBondContact O-N 2.83Å; L784-F788 CarbonylContact C-O 3.57Å; L784-F788 HydrophobicContact CD1-CE2 4.45Å; L784-F788 HydrophobicContact CD1-CZ 3.97Å; L784-F788 HydrophobicContact CD2-CE1 4.35Å; L784-F788 PolarHBondContact O-N 2.78Å; L784-P790 HydrophobicContact CB-CG 4.07Å; L784-P790 HydrophobicContact CD1-CB 4.07Å; L784-P790 HydrophobicContact CD1-CG 4.09Å
785	S	80.6	Confident	83.2	Confident	61 Å²	61	43.5 Å²	43.5	43%	0.427	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57	-19.2	179.4	66.2	0	0	0	0	114.8	I781 A782 L787 F788	I781-S785 WeakPolarHBondContact O-CA 3.41Å; I781-S785 WeakPolarHBondContact O-CB 3.36Å; I781-S785 PolarHBondContact O-N 3.34Å; I781-S785 PolarHBondContact O-OG 3.17Å; A782-S785 PolarHBondContact O-OG 2.92Å; S785-L787 PolarHBondContact O-N 3.31Å; S785-F788 PolarHBondContact N-O 3.27Å
786	S	76.1	Confident	83.1	Confident	58 Å²	58	45 Å²	45	41%	0.406	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-26.2	169.8	58	0	0	0	0	113.2	K475 Q783 L784	K475-S786 WeakPolarHBondContact CD-O 3.34Å; K475-S786 PolarHBondContact NZ-O 2.98Å; Q783-S786 PolarHBondContact O-OG 3.16Å; Q783-S786 VanDerWaalsContact O-OG 3.05Å; L784-S786 PolarHBondContact O-N 2.83Å
787	L	80.7	Confident	82.9	Confident	37 Å²	37	47.9 Å²	47.9	19%	0.194	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-116.9	-48.2	-174.5	-63.2	174.3	0	0	0	113.8	K475 D476 Y516 L784 S785	K475-L787 CarbonylContact C-O 3.55Å; K475-L787 WeakPolarHBondContact CA-O 3.39Å; K475-L787 WeakPolarHBondContact CB-O 3.37Å; K475-L787 PolarHBondContact N-O 2.9Å; D476-L787 PolarHBondContact N-O 2.86Å; Y516-L787 HydrophobicContact CD2-CD2 3.52Å; Y516-L787 HydrophobicContact CE2-CD2 4.14Å; Y516-L787 HydrophobicContact CG-CD2 4.47Å; L784-L787 WeakPolarHBondContact O-CA 3.49Å; L784-L787 PolarHBondContact O-N 2.83Å; S785-L787 PolarHBondContact O-N 3.31Å
788	F	84.9	Confident	82.6	Confident	1 Å²	1	46.9 Å²	46.9	0%	0.004	27%	0.27	C	S	.	.			trans	-158.9	159.3	177.5	64.4	-84	0	0	0	111.1	E473 D476 R753 L756 V757 L784 S785 P790	E473-F788 VanDerWaalsContact O-CA 3.27Å; E473-F788 WeakPolarHBondContact O-CA 3.47Å; D476-F788 HydrophobicContact CB-CD1 4.29Å; D476-F788 WeakPolarHBondContact OD1-CB 3.41Å; D476-F788 WeakPolarHBondContact OD2-CD1 3.48Å; R753-F788 HydrophobicContact CB-CE2 4.19Å; R753-F788 HydrophobicContact CB-CZ 3.97Å; R753-F788 HydrophobicContact CG-CD1 4.36Å; R753-F788 HydrophobicContact CG-CD2 4.22Å; R753-F788 HydrophobicContact CG-CE1 4.03Å; R753-F788 HydrophobicContact CG-CE2 3.87Å; R753-F788 HydrophobicContact CG-CG 4.46Å; R753-F788 HydrophobicContact CG-CZ 3.76Å; L756-F788 HydrophobicContact CB-CE1 4.4Å; L756-F788 HydrophobicContact CD1-CE1 4.17Å; V757-F788 HydrophobicContact CG2-CE2 4.15Å; V757-F788 HydrophobicContact CG2-CZ 3.95Å; L784-F788 CarbonylContact C-O 3.57Å; L784-F788 HydrophobicContact CD1-CE2 4.45Å; L784-F788 HydrophobicContact CD1-CZ 3.97Å; L784-F788 HydrophobicContact CD2-CE1 4.35Å; L784-F788 PolarHBondContact O-N 2.78Å; S785-F788 PolarHBondContact N-O 3.27Å; F788-P790 HydrophobicContact CD2-CB 4.24Å; F788-P790 HydrophobicContact CE2-CB 3.77Å; F788-P790 WeakPolarHBondContact O-CD 3.28Å
789	H	80.3	Confident	81.9	Confident	90 Å²	90	43.7 Å²	43.7	42%	0.417	25%	0.247	S	C	.	.			trans	-86.7	105.5	171.5	-165.1	88.8	0	0	0	109.8	H791	H789-H791 PolarHBondContact O-N 3.46Å
790	P	81.9	Confident	80.9	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	26%	0.259	C	S	.	.			trans	-71.1	120.4	-175.1	29.5	-36.3	0	0	0	111.1	V757 V780 I781 L784 F788 V792 I795	V757-P790 HydrophobicContact CG2-CB 4.13Å; V780-P790 HydrophobicContact CG1-CG 4.24Å; I781-P790 HydrophobicContact CB-CG 4.38Å; I781-P790 HydrophobicContact CG1-CG 3.84Å; L784-P790 HydrophobicContact CB-CG 4.07Å; L784-P790 HydrophobicContact CD1-CB 4.07Å; L784-P790 HydrophobicContact CD1-CG 4.09Å; F788-P790 HydrophobicContact CD2-CB 4.24Å; F788-P790 HydrophobicContact CE2-CB 3.77Å; F788-P790 WeakPolarHBondContact O-CD 3.28Å; P790-V792 PolarHBondContact O-N 3.45Å; P790-I795 HydrophobicContact CB-CD1 3.96Å; P790-I795 HydrophobicContact CB-CG1 4.02Å; P790-I795 HydrophobicContact CG-CD1 3.93Å; P790-I795 HydrophobicContact CG-CG1 4.49Å
791	H	80.5	Confident	80.1	Confident	117 Å²	117	47.8 Å²	47.8	54%	0.542	27%	0.269	S	S	.	.			trans	-58.8	132.3	173.4	-85.3	-60.9	0	0	0	111.3	H789 S793 I794 I795	H789-H791 PolarHBondContact O-N 3.46Å; H791-S793 PolarHBondContact O-N 3.42Å; H791-I794 HydrophobicContact CB-CD1 4.29Å; H791-I794 HydrophobicContact CB-CG1 4.26Å; H791-I794 WeakPolarHBondContact O-CB 3.34Å; H791-I794 PolarHBondContact O-N 3.14Å; H791-I795 PolarHBondContact O-N 3.22Å; H791-I795 VanDerWaalsContact O-N 3.16Å
792	V	81.8	Confident	79.1	Confident	60 Å²	60	47.1 Å²	47.1	36%	0.364	27%	0.265	S	S	.	.	H	α-helix	trans	-49.5	-34.7	175.9	173.4	0	0	0	0	112.7	L777 P790 I795 K796	L777-V792 HydrophobicContact CD1-CG1 3.77Å; L777-V792 HydrophobicContact CD1-CG2 4.15Å; L777-V792 HydrophobicContact CD2-CB 4.29Å; L777-V792 HydrophobicContact CD2-CG1 3.89Å; L777-V792 HydrophobicContact CD2-CG2 4.21Å; P790-V792 PolarHBondContact O-N 3.45Å; V792-I795 PolarHBondContact O-N 2.67Å; V792-K796 HydrophobicContact CG1-CD 4.28Å; V792-K796 HydrophobicContact CG1-CG 4.44Å; V792-K796 WeakPolarHBondContact O-CB 3.43Å; V792-K796 WeakPolarHBondContact O-CG 3.12Å; V792-K796 PolarHBondContact O-N 3.09Å
793	S	80.1	Confident	78.2	Confident	73 Å²	73	48.3 Å²	48.3	51%	0.51	26%	0.259	S	S	.	.	H	α-helix	trans	-62.9	-42.4	174.9	50.8	0	0	0	0	113.3	H791 K796 V797	H791-S793 PolarHBondContact O-N 3.42Å; S793-K796 PolarHBondContact O-N 3.27Å; S793-V797 WeakPolarHBondContact O-CG2 3.23Å; S793-V797 PolarHBondContact O-N 3.34Å
794	I	82.1	Confident	76.9	Confident	47 Å²	47	52.1 Å²	52.1	24%	0.241	28%	0.275	C	S	.	.	H	α-helix	trans	-67.9	-42.7	177.6	-59.5	176	0	0	0	109.7	V757 H791 K796 V797 C798	V757-I794 HydrophobicContact CB-CG2 4.41Å; V757-I794 HydrophobicContact CG1-CG2 4.44Å; V757-I794 HydrophobicContact CG2-CG2 4.16Å; H791-I794 HydrophobicContact CB-CD1 4.29Å; H791-I794 HydrophobicContact CB-CG1 4.26Å; H791-I794 WeakPolarHBondContact O-CB 3.34Å; H791-I794 PolarHBondContact O-N 3.14Å; I794-K796 PolarHBondContact O-N 2.86Å; I794-V797 PolarHBondContact O-N 3.25Å; I794-C798 WeakPolarHBondContact O-CB 3.38Å; I794-C798 PolarHBondContact O-N 3.13Å; I794-C798 PolarHBondContact O-SG 3.17Å
795	I	83.3	Confident	75.3	Confident	2 Å²	2	59.6 Å²	59.6	1%	0.01	31%	0.31	C	S	.	.	H	α-helix	trans	-61.9	-45.5	177.3	-51.2	168.6	0	0	0	110.5	V757 V761 L777 V780 I781 P790 H791 V792 V797 C798 A799	V757-I795 HydrophobicContact CG1-CB 4.42Å; V757-I795 HydrophobicContact CG1-CG1 4.17Å; V761-I795 HydrophobicContact CG2-CG2 4.14Å; L777-I795 HydrophobicContact CD2-CB 3.77Å; L777-I795 HydrophobicContact CD2-CD1 3.63Å; L777-I795 HydrophobicContact CD2-CG1 4.3Å; L777-I795 HydrophobicContact CD2-CG2 3.81Å; V780-I795 HydrophobicContact CB-CD1 4.15Å; V780-I795 HydrophobicContact CB-CG2 4.32Å; V780-I795 HydrophobicContact CG1-CD1 3.71Å; V780-I795 HydrophobicContact CG1-CG1 3.8Å; V780-I795 HydrophobicContact CG1-CG2 4.09Å; V780-I795 HydrophobicContact CG2-CG2 4.26Å; I781-I795 HydrophobicContact CG1-CD1 4.14Å; P790-I795 HydrophobicContact CB-CD1 3.96Å; P790-I795 HydrophobicContact CB-CG1 4.02Å; P790-I795 HydrophobicContact CG-CD1 3.93Å; P790-I795 HydrophobicContact CG-CG1 4.49Å; H791-I795 PolarHBondContact O-N 3.22Å; H791-I795 VanDerWaalsContact O-N 3.16Å; V792-I795 PolarHBondContact O-N 2.67Å; I795-V797 PolarHBondContact O-N 3.5Å; I795-C798 PolarHBondContact O-N 3.47Å; I795-A799 WeakPolarHBondContact O-CB 3.29Å; I795-A799 PolarHBondContact O-N 3.04Å
796	K	78.6	Confident	73.9	Confident	82 Å²	82	63.7 Å²	63.7	36%	0.357	32%	0.32	S	S	.	.	H	α-helix	trans	-55	-51.9	174	-80.1	-179.4	175.1	-167.7	0	111.6	H773 V792 S793 I794 A799 I800	H773-K796 WeakPolarHBondContact CE1-CE 3.48Å; H773-K796 VanDerWaalsContact NE2-CE 3.34Å; H773-K796 WeakPolarHBondContact NE2-CE 3.41Å; H773-K796 VanDerWaalsContact NE2-CG 3.33Å; H773-K796 WeakPolarHBondContact NE2-CG 3.36Å; V792-K796 HydrophobicContact CG1-CD 4.28Å; V792-K796 HydrophobicContact CG1-CG 4.44Å; V792-K796 WeakPolarHBondContact O-CB 3.43Å; V792-K796 WeakPolarHBondContact O-CG 3.12Å; V792-K796 PolarHBondContact O-N 3.09Å; S793-K796 PolarHBondContact O-N 3.27Å; I794-K796 PolarHBondContact O-N 2.86Å; K796-A799 PolarHBondContact O-N 2.78Å; K796-I800 WeakPolarHBondContact O-CB 3.31Å; K796-I800 WeakPolarHBondContact O-CD1 3.47Å; K796-I800 WeakPolarHBondContact O-CG1 3.21Å; K796-I800 PolarHBondContact O-N 2.89Å
797	V	78.1	Confident	72	Confident	73 Å²	73	69.9 Å²	69.9	44%	0.442	34%	0.342	S	S	.	.	H	α-helix	trans	-62.3	-49.9	-179.8	170.3	0	0	0	0	111.5	S793 I794 I795 A799 I800 E801	S793-V797 WeakPolarHBondContact O-CG2 3.23Å; S793-V797 PolarHBondContact O-N 3.34Å; I794-V797 PolarHBondContact O-N 3.25Å; I795-V797 PolarHBondContact O-N 3.5Å; V797-A799 VanDerWaalsContact C-N 3.34Å; V797-A799 PolarHBondContact O-N 3.49Å; V797-I800 PolarHBondContact O-N 3.02Å; V797-E801 HydrophobicContact CG1-CG 4.38Å; V797-E801 WeakPolarHBondContact CG1-OE1 3.44Å; V797-E801 VanDerWaalsContact O-CG 3.31Å; V797-E801 WeakPolarHBondContact O-CG 3.47Å; V797-E801 PolarHBondContact O-N 3.22Å
798	C	79.1	Confident	69.6	Low	1 Å²	1	76.1 Å²	76.1	1%	0.007	38%	0.375	C	S	.	.	H	α-helix	trans	-61.5	-41.8	-179.6	-65.4	0	0	0	0	112.3	V757 Q758 I794 I795 E801 I802	V757-C798 HydrophobicContact CB-CB 4.46Å; V757-C798 HydrophobicContact CG1-CB 3.68Å; Q758-C798 HydrophobicContact CG-CB 3.7Å; I794-C798 WeakPolarHBondContact O-CB 3.38Å; I794-C798 PolarHBondContact O-N 3.13Å; I794-C798 PolarHBondContact O-SG 3.17Å; I795-C798 PolarHBondContact O-N 3.47Å; C798-E801 PolarHBondContact O-N 3.24Å; C798-I802 WeakPolarHBondContact O-CB 3.15Å; C798-I802 WeakPolarHBondContact O-CD1 3.41Å; C798-I802 VanDerWaalsContact O-CG1 3.27Å; C798-I802 WeakPolarHBondContact O-CG1 3.45Å; C798-I802 PolarHBondContact O-N 3.33Å
799	A	70.7	Confident	67.2	Low	9 Å²	9	85.1 Å²	85.1	7%	0.074	42%	0.417	C	S	.	.	H	α-helix	trans	-62.3	-47.3	176.2	0	0	0	0	0	111.1	V761 I795 K796 V797 E801 I802 F803	V761-A799 HydrophobicContact CG1-CB 4.36Å; I795-A799 WeakPolarHBondContact O-CB 3.29Å; I795-A799 PolarHBondContact O-N 3.04Å; K796-A799 PolarHBondContact O-N 2.78Å; V797-A799 VanDerWaalsContact C-N 3.34Å; V797-A799 PolarHBondContact O-N 3.49Å; A799-E801 PolarHBondContact O-N 3.44Å; A799-I802 PolarHBondContact O-N 3.05Å; A799-F803 HydrophobicContact CB-CD2 4.38Å; A799-F803 HydrophobicContact CB-CE2 3.99Å; A799-F803 WeakPolarHBondContact O-CD2 3.42Å; A799-F803 VanDerWaalsContact O-CG 3.25Å; A799-F803 WeakPolarHBondContact O-CG 3.19Å; A799-F803 PolarHBondContact O-N 3.44Å
800	I	67.4	Low	64.8	Low	79 Å²	79	90.5 Å²	90.5	41%	0.405	44%	0.439	S	S	.	.	H	α-helix	trans	-56.1	-51.4	175.3	-70.9	164.8	0	0	0	110.3	K796 V797 I802 F803 F804 M816	K796-I800 WeakPolarHBondContact O-CB 3.31Å; K796-I800 WeakPolarHBondContact O-CD1 3.47Å; K796-I800 WeakPolarHBondContact O-CG1 3.21Å; K796-I800 PolarHBondContact O-N 2.89Å; V797-I800 PolarHBondContact O-N 3.02Å; I800-I802 PolarHBondContact O-N 3.3Å; I800-F803 PolarHBondContact O-N 2.62Å; I800-F803 VanDerWaalsContact O-N 3.15Å; I800-F804 HydrophobicContact CG2-CD2 3.69Å; I800-F804 HydrophobicContact CG2-CE2 3.97Å; I800-F804 WeakPolarHBondContact O-CB 3.25Å; I800-F804 WeakPolarHBondContact O-CD2 3.32Å; I800-F804 PolarHBondContact O-N 3.09Å; I800-M816 HydrophobicContact CG1-CE 4.33Å
801	E	70.1	Confident	62.5	Low	42 Å²	42	102.1 Å²	102.1	20%	0.196	48%	0.483	C	S	.	.	H	α-helix	trans	-56.7	-48.7	179.9	-70.1	170	167.9	0	0	112.6	R754 Q758 V797 C798 A799 F803 F804 E805	R754-E801 IonicContact CZ-OE1 3.63Å; R754-E801 IonicContact CZ-OE2 3.69Å; R754-E801 IonicContact NE-OE1 2.72Å; R754-E801 IonicContact NE-OE2 2.96Å; R754-E801 PolarHBondContact NE-OE2 3.48Å; R754-E801 IonicContact NH2-OE1 2.74Å; R754-E801 PolarHBondContact NH2-OE1 2.75Å; R754-E801 IonicContact NH2-OE2 3.54Å; R754-E801 PolarHBondContact NH2-OE2 3.29Å; Q758-E801 PolarHBondContact NE2-OE2 3.02Å; V797-E801 HydrophobicContact CG1-CG 4.38Å; V797-E801 WeakPolarHBondContact CG1-OE1 3.44Å; V797-E801 VanDerWaalsContact O-CG 3.31Å; V797-E801 WeakPolarHBondContact O-CG 3.47Å; V797-E801 PolarHBondContact O-N 3.22Å; C798-E801 PolarHBondContact O-N 3.24Å; A799-E801 PolarHBondContact O-N 3.44Å; E801-F803 VanDerWaalsContact C-N 3.27Å; E801-F803 PolarHBondContact O-N 2.96Å; E801-F804 PolarHBondContact O-N 2.65Å; E801-E805 PolarHBondContact O-N 3.02Å
802	I	68.9	Low	60.5	Low	26 Å²	26	102.3 Å²	102.3	13%	0.133	49%	0.487	C	S	.	.	H	α-helix	trans	-59.8	-37.4	178.2	-71.6	160.6	0	0	0	112.2	Q758 V761 V762 C798 A799 I800	Q758-I802 HydrophobicContact CB-CD1 3.8Å; Q758-I802 HydrophobicContact CB-CG1 4.42Å; Q758-I802 HydrophobicContact CG-CD1 3.87Å; Q758-I802 HydrophobicContact CG-CG1 4.22Å; Q758-I802 WeakPolarHBondContact O-CD1 3.45Å; V761-I802 HydrophobicContact CB-CD1 4.04Å; V761-I802 HydrophobicContact CG1-CD1 3.89Å; V762-I802 HydrophobicContact CG2-CD1 3.77Å; V762-I802 HydrophobicContact CG2-CG1 4.19Å; V762-I802 HydrophobicContact CG2-CG2 3.92Å; C798-I802 WeakPolarHBondContact O-CB 3.15Å; C798-I802 WeakPolarHBondContact O-CD1 3.41Å; C798-I802 VanDerWaalsContact O-CG1 3.27Å; C798-I802 WeakPolarHBondContact O-CG1 3.45Å; C798-I802 PolarHBondContact O-N 3.33Å; A799-I802 PolarHBondContact O-N 3.05Å; I800-I802 PolarHBondContact O-N 3.3Å
803	F	64.4	Low	58.1	Low	85 Å²	85	106.3 Å²	106.3	37%	0.373	51%	0.506	S	S	.	.	H	α-helix	trans	-83.1	-22.1	-179.3	-60.6	-42.4	0	0	0	113.4	M765 A799 I800 E801	M765-F803 HydrophobicContact CE-CE1 4.12Å; M765-F803 HydrophobicContact CE-CZ 3.8Å; M765-F803 HydrophobicContact CG-CE1 4.41Å; M765-F803 HydrophobicContact CG-CZ 3.98Å; M765-F803 HydrophobicContact SD-CZ 4.12Å; A799-F803 HydrophobicContact CB-CD2 4.38Å; A799-F803 HydrophobicContact CB-CE2 3.99Å; A799-F803 WeakPolarHBondContact O-CD2 3.42Å; A799-F803 VanDerWaalsContact O-CG 3.25Å; A799-F803 WeakPolarHBondContact O-CG 3.19Å; A799-F803 PolarHBondContact O-N 3.44Å; I800-F803 PolarHBondContact O-N 2.62Å; I800-F803 VanDerWaalsContact O-N 3.15Å; E801-F803 VanDerWaalsContact C-N 3.27Å; E801-F803 PolarHBondContact O-N 2.96Å
804	F	58.2	Low	56.1	Low	141 Å²	141	112 Å²	112	62%	0.618	52%	0.522	S	S	*	.	H	α-helix	trans	-89.5	-38.6	176.9	-90.9	-95.8	0	0	0	113.6	I800 E801 K806	I800-F804 HydrophobicContact CG2-CD2 3.69Å; I800-F804 HydrophobicContact CG2-CE2 3.97Å; I800-F804 WeakPolarHBondContact O-CB 3.25Å; I800-F804 WeakPolarHBondContact O-CD2 3.32Å; I800-F804 PolarHBondContact O-N 3.09Å; E801-F804 PolarHBondContact O-N 2.65Å; F804-K806 VanDerWaalsContact C-N 3.31Å; F804-K806 PolarHBondContact O-N 3.33Å
805	E	53.9	Low	54	Low	167 Å²	167	120.5 Å²	120.5	78%	0.78	55%	0.553	S	S	*	*	S	Bend	trans	-78	-8.1	-175.7	-69.4	-170.8	153.2	0	0	114.6	E801	E801-E805 PolarHBondContact O-N 3.02Å
806	K	49.8	Very low	51.4	Low	148 Å²	148	125.5 Å²	125.5	64%	0.643	58%	0.577	S	S	*	*			trans	-105.7	63.1	-178.6	-71.6	-172.4	176.2	178.8	0	113.4	F804 L808	F804-K806 VanDerWaalsContact C-N 3.31Å; F804-K806 PolarHBondContact O-N 3.33Å; K806-L808 PolarHBondContact O-N 2.87Å
807	E	37.2	Very low	49.1	Very low	187 Å²	187	125.4 Å²	125.4	87%	0.874	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.8	29.9	-170	-141.5	-178	-166.3	0	0	116.5
808	L	30.8	Very low	46.8	Very low	168 Å²	168	129.1 Å²	129.1	88%	0.88	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	-123.4	2.5	-176.9	-97.5	167.3	0	0	0	116.8	K806	K806-L808 PolarHBondContact O-N 2.87Å
809	Q	33.4	Very low	44.4	Very low	190 Å²	190	135 Å²	135	89%	0.888	65%	0.646	S	S	*	*			trans	-132	89	169.1	-77.4	-168.5	-22.4	0	0	113.4	R811	Q809-R811 PolarHBondContact O-N 2.92Å
810	K	29.5	Very low	42.4	Very low	203 Å²	203	144.8 Å²	144.8	88%	0.883	69%	0.688	S	S	*	*			trans	-66.7	111.2	175.3	-66.7	172.3	175.4	174.4	0	112.1
811	R	34.1	Very low	40.3	Very low	245 Å²	245	150.1 Å²	150.1	93%	0.925	71%	0.708	S	S	*	*			trans	-179.8	4.9	140.2	-105.1	173.1	179.7	-177.7	0.1	118.8	Q809	Q809-R811 PolarHBondContact O-N 2.92Å
812	L	38.9	Very low	38.3	Very low	120 Å²	120	154.3 Å²	154.3	63%	0.628	74%	0.736	S	S	*	*			trans	-93.1	4.4	-178	-115.6	79.6	0	0	0	116.7	M765 F814	M765-L812 HydrophobicContact CE-CD2 4.46Å; L812-F814 PolarHBondContact O-N 3.39Å
813	L	32.2	Very low	36.2	Very low	144 Å²	144	157.2 Å²	157.2	75%	0.754	76%	0.764	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86	25.2	-163.5	-106.1	156.1	0	0	0	116.5
814	F	37	Very low	34.6	Very low	194 Å²	194	161 Å²	161	85%	0.851	79%	0.788	S	S	*	*	T	Hydrogen-bonded Turn	trans	-127.2	-0.2	-174	-133.7	-91.3	0	0	0	116.5	L812	L812-F814 PolarHBondContact O-N 3.39Å
815	Y	38.1	Very low	33.2	Very low	225 Å²	225	163.1 Å²	163.1	88%	0.882	80%	0.799	S	S	*	*			trans	-119.5	15.6	-177.9	-81.2	-85.4	0	0	0	114.4	G817	Y815-G817 VanDerWaalsContact C-N 3.28Å; Y815-G817 PolarHBondContact O-N 3.45Å
816	M	28.6	Very low	32.1	Very low	106 Å²	106	161.8 Å²	161.8	52%	0.522	80%	0.797	S	S	.	*			trans	-81.7	73.2	175.9	-63	-174.1	76.6	0	0	110.8	I800 I818	I800-M816 HydrophobicContact CG1-CE 4.33Å; M816-I818 PolarHBondContact O-N 3.32Å
817	G	31.3	Very low	31.2	Very low	80 Å²	80	165 Å²	165	83%	0.825	81%	0.811	S	S	*	*			trans	-72.9	108.8	177.1	0	0	0	0	0	112.4	Y815	Y815-G817 VanDerWaalsContact C-N 3.28Å; Y815-G817 PolarHBondContact O-N 3.45Å
818	I	29.8	Very low	30.9	Very low	151 Å²	151	162.5 Å²	162.5	77%	0.774	80%	0.799	S	S	*	*			trans	-87.5	154.4	177.7	-67.1	166.2	0	0	0	110.2	M816	M816-I818 PolarHBondContact O-N 3.32Å
819	D	27.4	Very low	31.1	Very low	124 Å²	124	160.1 Å²	160.1	66%	0.663	79%	0.786	S	S	*	*			trans	-38.7	134.9	-175.7	-49.3	-82.7	0	0	0	116.5
820	F	28.6	Very low	31	Very low	216 Å²	216	161.1 Å²	161.1	95%	0.947	79%	0.788	S	S	*	*			trans	-154.6	142.7	144.7	-123.5	-83.3	0	0	0	113.5
821	F	24.6	Very low	31.1	Very low	190 Å²	190	155.4 Å²	155.4	83%	0.833	79%	0.787	S	S	*	*			trans	-88.9	150	-168.8	-134.1	-130.3	0	0	0	112.4
822	V	27.2	Very low	30.9	Very low	130 Å²	130	152.1 Å²	152.1	79%	0.788	79%	0.786	S	S	*	*			trans	61.3	96.2	154.6	-178.4	0	0	0	0	118.1
823	A	26.4	Very low	30.4	Very low	87 Å²	87	153.1 Å²	153.1	72%	0.719	80%	0.798	S	S	*	*			trans	-161.3	149	147.8	0	0	0	0	0	111.2
824	L	29.2	Very low	30.2	Very low	165 Å²	165	150.8 Å²	150.8	86%	0.864	80%	0.8	S	S	*	*			trans	67.6	61.6	174.9	-73.1	96.2	0	0	0	119.4
825	H	28.6	Very low	30.1	Very low	186 Å²	186	148.7 Å²	148.7	86%	0.861	80%	0.802	S	S	*	*				-67	162.9	121.6	-85.2	-52.8	0	0	0	109
826	L	30.5	Very low	29.6	Very low	138 Å²	138	143.2 Å²	143.2	72%	0.723	80%	0.803	S	S	*	*			trans	95.4	44	178.1	-51.2	166.4	0	0	0	118
827	F	32	Very low	29.6	Very low	216 Å²	216	141.9 Å²	141.9	95%	0.947	81%	0.81	S	S	*	*			trans	-127	47.2	141.4	-124.3	-87.6	0	0	0	111.3
828	E	30.7	Very low	29.6	Very low	134 Å²	134	146.9 Å²	146.9	63%	0.626	82%	0.816	S	S	*	*			trans	-42.5	154.9	151.9	-93.4	-174.4	142.9	0	0	113.7
829	I	35.4	Very low	29.7	Very low	118 Å²	118	143.4 Å²	143.4	61%	0.605	82%	0.818	S	S	*	*			trans	57.8	102.8	140	-58.4	163.4	0	0	0	116
830	F	31.7	Very low	29.9	Very low	212 Å²	212	142.4 Å²	142.4	93%	0.93	82%	0.816	S	S	*	*			trans	157.5	123.9	136.4	-84.8	-61.4	0	0	0	109.9
831	G	30.1	Very low	29.7	Very low	83 Å²	83	135.7 Å²	135.7	86%	0.856	80%	0.796	S	S	*	*			trans	128.2	40.6	160	0	0	0	0	0	119.9
832	L	30.4	Very low	29.9	Very low	175 Å²	175	137 Å²	137	92%	0.916	80%	0.796	S	S	*	*			trans	-98.3	109.1	165.8	-115.7	169.3	0	0	0	110.5
833	T	28.9	Very low	29.9	Very low	141 Å²	141	139.2 Å²	139.2	87%	0.865	80%	0.795	S	S	*	*			trans	-175.9	150.1	152.7	16.2	0	0	0	0	111
834	A	28.3	Very low	30.4	Very low	96 Å²	96	140.1 Å²	140.1	79%	0.793	78%	0.78	S	S	*	*			trans	76.1	65	164.2	0	0	0	0	0	120.8
835	V	33.6	Very low	30.7	Very low	149 Å²	149	139.9 Å²	139.9	90%	0.903	77%	0.772	S	S	*	*			trans	-142.5	67.8	149.4	-164.7	0	0	0	0	111.5
836	A	28.9	Very low	31	Very low	110 Å²	110	135 Å²	135	91%	0.909	76%	0.764	S	S	*	*	S	Bend	trans	-126.7	19.5	176.6	0	0	0	0	0	113.5
837	A	28.6	Very low	31.3	Very low	79 Å²	79	134.8 Å²	134.8	65%	0.653	76%	0.759	S	S	*	*	S	Bend	trans	-140.5	152.6	175.6	0	0	0	0	0	109.7
838	L	31.8	Very low	31.8	Very low	184 Å²	184	129.9 Å²	129.9	96%	0.963	76%	0.758	S	S	*	*			trans	79.3	103.4	-176.4	-48.1	168.8	0	0	0	115.2
839	G	30.5	Very low	32.6	Very low	78 Å²	78	127.4 Å²	127.4	80%	0.804	77%	0.768	S	S	*	*			trans	171.5	22.3	172.2	0	0	0	0	0	117.5
840	T	31.1	Very low	34.1	Very low	104 Å²	104	128.7 Å²	128.7	64%	0.638	77%	0.772	S	S	*	*			trans	-64.2	150.1	-176.4	40.7	0	0	0	0	113.7	Y237	Y237-T840 HydrophobicContact CD2-CG2 4.4Å; Y237-T840 HydrophobicContact CE2-CG2 3.49Å; Y237-T840 VanDerWaalsContact CE2-CG2 3.49Å; Y237-T840 VanDerWaalsContact OH-CB 3.26Å; Y237-T840 WeakPolarHBondContact OH-CB 3.35Å
841	S	26.5	Very low	36.2	Very low	75 Å²	75	125 Å²	125	52%	0.524	76%	0.757	S	S	.	*			trans	-61.3	152.1	-164.4	83.5	0	0	0	0	116.4	Y237	Y237-S841 PolarHBondContact OH-N 2.92Å; Y237-S841 PolarHBondContact OH-OG 3.45Å
842	W	27.1	Very low	38.8	Very low	216 Å²	216	122.4 Å²	122.4	82%	0.818	73%	0.725	S	S	*	*			trans	-128.2	83.5	157.3	-74.4	70.8	0	0	0	109.4
843	K	28.4	Very low	41.8	Very low	177 Å²	177	114.4 Å²	114.4	77%	0.77	68%	0.684	S	S	*	*			trans	-86.1	111.3	165.1	-85.4	-176.3	175.4	174.3	0	109.2	K845	K843-K845 VanDerWaalsContact C-N 3.34Å; K843-K845 PolarHBondContact O-N 2.97Å
844	W	36.7	Very low	45	Very low	106 Å²	106	109.3 Å²	109.3	40%	0.402	65%	0.653	S	S	.	*			trans	-72	87	176.2	-153.6	86.6	0	0	0	110.2	A846	W844-A846 HydrophobicContact CE3-CB 4.48Å; W844-A846 HydrophobicContact CZ3-CB 3.9Å
845	K	34.2	Very low	48.2	Very low	160 Å²	160	104.9 Å²	104.9	70%	0.696	62%	0.616	S	S	*	*			trans	-74.2	130.8	160.1	-78.6	-176.7	177.4	176.9	0	107.8	K843 H847	K843-K845 VanDerWaalsContact C-N 3.34Å; K843-K845 PolarHBondContact O-N 2.97Å; K845-H847 VanDerWaalsContact C-N 3.26Å; K845-H847 PolarHBondContact O-CD2 2.87Å; K845-H847 PolarHBondContact O-N 3.3Å
846	A	36.9	Very low	51.3	Low	84 Å²	84	97.9 Å²	97.9	69%	0.694	57%	0.573	S	S	*	*			trans	-65.4	85.4	171.5	0	0	0	0	0	110.2	W844 A848	W844-A846 HydrophobicContact CE3-CB 4.48Å; W844-A846 HydrophobicContact CZ3-CB 3.9Å; A846-A848 PolarHBondContact O-N 3.28Å
847	H	36	Very low	54.5	Low	133 Å²	133	92.9 Å²	92.9	62%	0.616	53%	0.531	S	S	*	.			trans	-73.8	115.7	168.8	-79.6	-87.4	0	0	0	108.5	K845 G849 H850	K845-H847 VanDerWaalsContact C-N 3.26Å; K845-H847 PolarHBondContact O-CD2 2.87Å; K845-H847 PolarHBondContact O-N 3.3Å; H847-G849 PolarHBondContact O-N 3.45Å; H847-H850 PolarHBondContact O-N 2.84Å
848	A	42.5	Very low	57.7	Low	114 Å²	114	89.2 Å²	89.2	94%	0.942	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.2	109.1	174.5	0	0	0	0	0	110	A846	A846-A848 PolarHBondContact O-N 3.28Å
849	G	47.2	Very low	60.7	Low	81 Å²	81	80.4 Å²	80.4	84%	0.835	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	136.8	-21.6	-176.7	0	0	0	0	0	115.4	H847	H847-G849 PolarHBondContact O-N 3.45Å
850	H	66.3	Low	63.5	Low	146 Å²	146	77.6 Å²	77.6	68%	0.676	42%	0.421	S	S	*	.	P	Polyproline II helix	trans	-98.2	136.6	177.9	-67.8	81.7	0	0	0	112.3	H847	H847-H850 PolarHBondContact O-N 2.84Å
851	Q	75.8	Confident	66.3	Low	134 Å²	134	72.6 Å²	72.6	63%	0.626	39%	0.39	S	S	*	.	P	Polyproline II helix	trans	-66.3	138.1	169.1	-74.9	-69.6	-12.7	0	0	110.3
852	P	85.3	Confident	69.2	Low	28 Å²	28	69.4 Å²	69.4	18%	0.182	37%	0.367	C	S	.	.	P	Polyproline II helix	trans	-60.2	149.4	175	-27.8	39.2	0	0	0	112.4	Y880 P881 R884	P852-Y880 HydrophobicContact CB-CE1 4.13Å; P852-Y880 HydrophobicContact CB-CE2 4.36Å; P852-P881 HydrophobicContact CG-CG 3.93Å; P852-R884 PolarHBondContact O-NE 3.47Å; P852-R884 PolarHBondContact O-NH2 3.2Å
853	P	92.5	Very high	72.1	Confident	8 Å²	8	59.1 Å²	59.1	5%	0.052	33%	0.328	C	S	.	.	P	Polyproline II helix	trans	-49.8	155.1	175.3	-29.5	34.9	0	0	0	114.7	Y880 D963 F964 M984	P853-Y880 VanDerWaalsContact CD-OH 3.3Å; P853-Y880 WeakPolarHBondContact CD-OH 3.38Å; P853-Y880 WeakPolarHBondContact O-CE1 3.41Å; P853-Y880 PolarHBondContact O-OH 3.46Å; P853-D963 VanDerWaalsContact CA-OD2 3.22Å; P853-D963 WeakPolarHBondContact CA-OD2 3.32Å; P853-D963 HydrophobicContact CB-CB 3.7Å; P853-F964 HydrophobicContact CB-CD2 3.77Å; P853-F964 HydrophobicContact CB-CE2 3.69Å; P853-F964 HydrophobicContact CG-CE2 3.95Å; P853-M984 HydrophobicContact CG-SD 4.43Å
854	T	96.2	Very high	75	Confident	34 Å²	34	52 Å²	52	21%	0.209	30%	0.297	C	S	.	.	P	Polyproline II helix	trans	-83.8	141.4	171.1	51.5	0	0	0	0	111.5	R884 W961 A962 D963 F964	T854-R884 WeakPolarHBondContact CA-O 3.45Å; T854-W961 PolarHBondContact OG1-O 3.26Å; T854-A962 WeakPolarHBondContact OG1-CA 3.1Å; T854-D963 PolarHBondContact N-OD2 3.34Å; T854-D963 WeakPolarHBondContact O-CB 3.2Å; T854-D963 PolarHBondContact O-N 2.9Å; T854-D963 VanDerWaalsContact O-N 3.12Å; T854-D963 PolarHBondContact OG1-N 2.96Å; T854-D963 PolarHBondContact OG1-OD2 2.95Å; T854-F964 PolarHBondContact O-N 3.08Å
855	V	96.7	Very high	77.5	Confident	3 Å²	3	47.3 Å²	47.3	2%	0.018	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	127.3	-179.5	-169	0	0	0	0	110.1	Y880 R884 I885 A886 F964 F966 L980 M984	V855-Y880 HydrophobicContact CG2-CE1 3.96Å; V855-R884 PolarHBondContact N-O 2.94Å; V855-I885 WeakPolarHBondContact O-CA 3.41Å; V855-A886 PolarHBondContact O-N 3.32Å; V855-F964 WeakPolarHBondContact CA-O 3.48Å; V855-F964 HydrophobicContact CG1-CB 4.33Å; V855-F964 HydrophobicContact CG2-CB 4.38Å; V855-F966 HydrophobicContact CG1-CB 4.12Å; V855-L980 HydrophobicContact CG1-CD2 4.39Å; V855-M984 HydrophobicContact CG2-CE 3.33Å
856	L	97.6	Very high	80	Confident	2 Å²	2	40.6 Å²	40.6	1%	0.01	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	109.8	161.3	-174.7	67.6	0	0	0	109.4	A886 F888 K956 A957 M960 A962 F964 I965 F966	L856-A886 CarbonylContact C-O 3.58Å; L856-A886 WeakPolarHBondContact CA-O 3.49Å; L856-A886 HydrophobicContact CD1-CB 3.67Å; L856-F888 HydrophobicContact CD1-CB 4.09Å; L856-K956 HydrophobicContact CD2-CG 4.46Å; L856-A957 HydrophobicContact CB-CB 4.09Å; L856-A957 HydrophobicContact CD2-CB 3.72Å; L856-M960 HydrophobicContact CB-SD 4.37Å; L856-M960 HydrophobicContact CD1-CE 4.46Å; L856-M960 HydrophobicContact CD1-SD 3.88Å; L856-M960 HydrophobicContact CD2-SD 4.18Å; L856-M960 HydrophobicContact CG-SD 4.36Å; L856-A962 HydrophobicContact CB-CB 4.24Å; L856-F964 PolarHBondContact N-O 3.25Å; L856-I965 HydrophobicContact CB-CG1 4.42Å; L856-I965 HydrophobicContact CD2-CD1 4.41Å; L856-I965 CarbonylContact O-C 3.58Å; L856-I965 VanDerWaalsContact O-CA 3.3Å; L856-I965 WeakPolarHBondContact O-CA 3.48Å; L856-I965 WeakPolarHBondContact O-CG1 3.4Å; L856-F966 PolarHBondContact O-N 3.39Å
857	L	96.1	Very high	82.6	Confident	5 Å²	5	36.6 Å²	36.6	3%	0.026	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	127.2	169.5	-175.2	74.7	0	0	0	109.5	L859 L875 I885 A886 I887 F888 F966 L968	L857-L859 HydrophobicContact CD1-CD2 4.2Å; L857-L859 HydrophobicContact CD2-CD1 4.12Å; L857-L859 HydrophobicContact CD2-CD2 3.82Å; L857-L859 HydrophobicContact CD2-CG 4.05Å; L857-L859 HydrophobicContact CG-CD2 3.75Å; L857-L859 HydrophobicContact CG-CG 4.1Å; L857-L875 HydrophobicContact CD2-CD1 3.48Å; L857-L875 VanDerWaalsContact CD2-CD1 3.48Å; L857-L875 HydrophobicContact CD2-CD2 3.76Å; L857-L875 HydrophobicContact CD2-CG 4.21Å; L857-I885 HydrophobicContact CB-CG2 4.21Å; L857-A886 PolarHBondContact N-O 3.06Å; L857-I887 HydrophobicContact CB-CG1 4.24Å; L857-I887 HydrophobicContact CD2-CD1 4.09Å; L857-I887 HydrophobicContact CD2-CG1 4.05Å; L857-I887 HydrophobicContact CD2-CG2 4.31Å; L857-I887 WeakPolarHBondContact O-CA 3.48Å; L857-F888 PolarHBondContact O-N 3.23Å; L857-F966 CarbonylContact C-O 3.59Å; L857-F966 WeakPolarHBondContact CA-O 3.47Å; L857-F966 HydrophobicContact CD1-CB 4.14Å; L857-F966 HydrophobicContact CD1-CD1 3.54Å; L857-F966 HydrophobicContact CD1-CE1 4.35Å; L857-F966 HydrophobicContact CD1-CG 4.16Å; L857-L968 HydrophobicContact CD1-CB 3.92Å; L857-L968 HydrophobicContact CD1-CD2 3.93Å
858	C	96.1	Very high	85.2	Confident	1 Å²	1	30.2 Å²	30.2	1%	0.007	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	110.3	-178.2	-67.3	0	0	0	0	110.2	F888 W949 A953 F966 Y967 L968	C858-F888 WeakPolarHBondContact CA-O 3.29Å; C858-W949 HydrophobicContact CB-CZ2 4.4Å; C858-A953 HydrophobicContact CB-CB 4.43Å; C858-F966 PolarHBondContact N-O 3.19Å; C858-Y967 HydrophobicContact CB-CD1 3.72Å; C858-Y967 HydrophobicContact CB-CE1 3.92Å; C858-Y967 HydrophobicContact CB-CG 4.47Å; C858-L968 PolarHBondContact O-N 2.88Å
859	L	94.8	Very high	87.6	Confident	0 Å²	0	24.8 Å²	24.8	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	127.6	-172.7	-59.4	-173.1	0	0	0	111.1	L857 F871 F872 L875 I887 F888 V889 R890 L968	L857-L859 HydrophobicContact CD1-CD2 4.2Å; L857-L859 HydrophobicContact CD2-CD1 4.12Å; L857-L859 HydrophobicContact CD2-CD2 3.82Å; L857-L859 HydrophobicContact CD2-CG 4.05Å; L857-L859 HydrophobicContact CG-CD2 3.75Å; L857-L859 HydrophobicContact CG-CG 4.1Å; L859-F871 HydrophobicContact CD1-CE1 3.86Å; L859-F871 HydrophobicContact CD1-CZ 4.32Å; L859-F871 HydrophobicContact CD2-CE1 4.04Å; L859-F871 HydrophobicContact CD2-CZ 3.63Å; L859-F872 HydrophobicContact CD1-CE1 4.14Å; L859-L875 HydrophobicContact CD1-CD2 4.23Å; L859-I887 HydrophobicContact CD1-CG2 3.88Å; L859-I887 HydrophobicContact CG-CG2 4.22Å; L859-F888 PolarHBondContact N-O 3.01Å; L859-V889 HydrophobicContact CB-CB 4.39Å; L859-V889 HydrophobicContact CB-CG1 4.06Å; L859-V889 HydrophobicContact CB-CG2 4.21Å; L859-V889 HydrophobicContact CD1-CG2 4.14Å; L859-V889 WeakPolarHBondContact O-CA 3.36Å; L859-R890 PolarHBondContact O-N 3.39Å; L859-L968 HydrophobicContact CD2-CB 3.84Å; L859-L968 HydrophobicContact CD2-CD2 4.32Å; L859-L968 HydrophobicContact CD2-CG 4.32Å; L859-L968 WeakPolarHBondContact CD2-O 3.43Å
860	L	88.8	Confident	89.8	Confident	18 Å²	18	22.1 Å²	22.1	9%	0.094	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	121.7	169.8	-176.6	63.4	0	0	0	110	R890 D892 L946 W949 C970	L860-R890 HydrophobicContact CD1-CB 4.33Å; L860-R890 HydrophobicContact CD1-CG 4.29Å; L860-D892 HydrophobicContact CD1-CB 4.01Å; L860-L946 HydrophobicContact CD1-CD2 3.61Å; L860-L946 HydrophobicContact CD2-CD1 4.29Å; L860-L946 HydrophobicContact CD2-CD2 3.58Å; L860-L946 HydrophobicContact CG-CD2 4.26Å; L860-W949 HydrophobicContact CB-CH2 3.79Å; L860-W949 HydrophobicContact CB-CZ3 3.76Å; L860-W949 HydrophobicContact CD1-CE3 4.18Å; L860-W949 HydrophobicContact CD1-CH2 4.44Å; L860-W949 HydrophobicContact CD1-CZ3 3.98Å; L860-W949 HydrophobicContact CD2-CZ3 4.41Å; L860-W949 HydrophobicContact CG-CZ3 4.26Å; L860-C970 PolarHBondContact O-SG 2.95Å
861	V	91.1	Very high	91.1	Very high	0 Å²	0	15.3 Å²	15.3	0%	0	8%	0.078	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	117.5	-179.7	-178.2	0	0	0	0	109.3	L868 V889 R890 I891 D892 V902 C970	V861-L868 HydrophobicContact CG1-CD1 4.04Å; V861-L868 HydrophobicContact CG1-CD2 4.31Å; V861-L868 HydrophobicContact CG2-CD2 4.28Å; V861-V889 HydrophobicContact CG2-CG1 3.64Å; V861-R890 PolarHBondContact N-O 3.38Å; V861-I891 HydrophobicContact CB-CG1 4.39Å; V861-I891 WeakPolarHBondContact O-CA 3.34Å; V861-D892 PolarHBondContact O-N 3.09Å; V861-V902 HydrophobicContact CB-CG2 4.39Å; V861-V902 HydrophobicContact CG1-CG2 3.96Å; V861-V902 HydrophobicContact CG2-CG2 3.89Å; V861-C970 HydrophobicContact CG2-CB 4.46Å; V861-C970 VanDerWaalsContact CG2-SG 3.57Å
862	R	87.2	Confident	92	Very high	8 Å²	8	9 Å²	9	3%	0.03	5%	0.048	C	C	.	.	S	Bend	trans	-149.9	117.6	166.2	177.3	160.9	154.7	169.1	7.3	112.1	K864 D892 S894 E932 P935 R942	R862-K864 WeakPolarHBondContact O-CG 3.05Å; R862-D892 HydrophobicContact CB-CB 4.17Å; R862-D892 VanDerWaalsContact CB-O 3.28Å; R862-D892 WeakPolarHBondContact CB-O 3.35Å; R862-D892 WeakPolarHBondContact CD-O 3.22Å; R862-D892 WeakPolarHBondContact CD-OD2 3.2Å; R862-D892 WeakPolarHBondContact CG-O 3.49Å; R862-D892 IonicContact NH1-OD2 3.82Å; R862-D892 PolarHBondContact NH1-OD2 3.47Å; R862-S894 WeakPolarHBondContact CA-OG 3.47Å; R862-E932 IonicContact CZ-OE1 3Å; R862-E932 IonicContact CZ-OE2 3.83Å; R862-E932 IonicContact NH1-OE1 3.65Å; R862-E932 PolarHBondContact NH1-OE1 3.31Å; R862-E932 IonicContact NH1-OE2 2.85Å; R862-E932 PolarHBondContact NH1-OE2 2.99Å; R862-E932 IonicContact NH2-OE1 3.57Å; R862-E932 PolarHBondContact NH2-OE1 3.47Å; R862-E932 VanDerWaalsContact NH2-OE1 3.07Å; R862-E932 IonicContact NH2-OE2 3.35Å; R862-E932 PolarHBondContact NH2-OE2 3.13Å; R862-P935 PolarHBondContact NE-O 2.92Å; R862-P935 PolarHBondContact NH2-O 2.86Å; R862-R942 VanDerWaalsContact NH1-CD 3.35Å; R862-R942 VanDerWaalsContact NH1-NE 3.17Å
863	N	87.5	Confident	92.3	Very high	0 Å²	0	7.7 Å²	7.7	0%	0	4%	0.04	C	C	.	.	S	Bend	trans	56.2	51.1	176.1	-57	-32.6	0	0	0	112.2	H866 S894 V895 D896 P935 F936 L1102	N863-H866 PolarHBondContact O-CE1 3.47Å; N863-S894 PolarHBondContact N-OG 3.34Å; N863-S894 WeakPolarHBondContact OD1-CA 3.3Å; N863-V895 WeakPolarHBondContact OD1-CG2 3.2Å; N863-V895 PolarHBondContact OD1-N 2.95Å; N863-D896 WeakPolarHBondContact CA-OD1 3.33Å; N863-D896 VanDerWaalsContact CA-OD2 3.22Å; N863-D896 WeakPolarHBondContact CA-OD2 3.12Å; N863-P935 HydrophobicContact CB-CB 4.48Å; N863-P935 WeakPolarHBondContact ND2-CB 3.32Å; N863-P935 PolarHBondContact ND2-O 3.26Å; N863-F936 HydrophobicContact CB-CE1 4.34Å; N863-L1102 HydrophobicContact CB-CD2 3.85Å
864	K	88.9	Confident	92.3	Very high	27 Å²	27	8.7 Å²	8.7	12%	0.117	4%	0.043	C	C	.	.			trans	-120.7	11.7	-173.8	-63.3	-63.3	169.8	176.1	0	113.4	R862 H866 V867 L868 D896 S898 C970 D971	R862-K864 WeakPolarHBondContact O-CG 3.05Å; K864-H866 PolarHBondContact O-N 3.39Å; K864-V867 HydrophobicContact CB-CG1 3.73Å; K864-V867 HydrophobicContact CD-CG1 3.75Å; K864-V867 HydrophobicContact CG-CG1 4.24Å; K864-V867 VanDerWaalsContact O-CG1 3.32Å; K864-V867 WeakPolarHBondContact O-CG1 3.44Å; K864-V867 PolarHBondContact O-N 3.06Å; K864-L868 HydrophobicContact CB-CD1 4.32Å; K864-L868 HydrophobicContact CB-CD2 4.37Å; K864-L868 HydrophobicContact CB-CG 3.94Å; K864-L868 WeakPolarHBondContact O-CG 3.12Å; K864-L868 PolarHBondContact O-N 3.38Å; K864-D896 PolarHBondContact N-OD2 2.85Å; K864-S898 PolarHBondContact N-OG 3.29Å; K864-C970 HydrophobicContact CG-CB 4.24Å; K864-D971 IonicContact NZ-OD2 2.82Å; K864-D971 PolarHBondContact NZ-OD2 2.95Å
865	A	89.1	Confident	92.1	Very high	8 Å²	8	7.3 Å²	7.3	7%	0.066	3%	0.034	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.8	-35.3	-173.9	0	0	0	0	0	113.5	P869 D896 E897 S898 L901	A865-P869 VanDerWaalsContact O-CD 3.29Å; A865-P869 WeakPolarHBondContact O-CD 3.48Å; A865-D896 HydrophobicContact CB-CB 3.98Å; A865-D896 VanDerWaalsContact CB-CG 3.48Å; A865-D896 WeakPolarHBondContact CB-OD2 3.33Å; A865-D896 PolarHBondContact N-OD2 3.08Å; A865-E897 HydrophobicContact CB-CB 4.21Å; A865-S898 PolarHBondContact N-OG 2.77Å; A865-S898 VanDerWaalsContact N-OG 3.16Å; A865-L901 HydrophobicContact CB-CD1 3.76Å; A865-L901 WeakPolarHBondContact O-CD1 3.46Å
866	H	87.6	Confident	91.9	Very high	18 Å²	18	8.5 Å²	8.5	8%	0.083	4%	0.04	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-38.7	175.4	55.5	-83.7	0	0	0	114	N863 K864 F1106 L1109	N863-H866 PolarHBondContact O-CE1 3.47Å; K864-H866 PolarHBondContact O-N 3.39Å; H866-F1106 HydrophobicContact CB-CD2 3.91Å; H866-L1109 HydrophobicContact CB-CD2 4.11Å; H866-L1109 WeakPolarHBondContact O-CD2 3.39Å
867	V	90.6	Very high	91.6	Very high	0 Å²	0	10.6 Å²	10.6	0%	0	5%	0.049	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.4	-23.7	-175.2	62.8	0	0	0	0	113.5	K864 P869 Y870 F871 C970 L973 L1093 L1109	K864-V867 HydrophobicContact CB-CG1 3.73Å; K864-V867 HydrophobicContact CD-CG1 3.75Å; K864-V867 HydrophobicContact CG-CG1 4.24Å; K864-V867 VanDerWaalsContact O-CG1 3.32Å; K864-V867 WeakPolarHBondContact O-CG1 3.44Å; K864-V867 PolarHBondContact O-N 3.06Å; V867-P869 VanDerWaalsContact C-CD 3.49Å; V867-Y870 PolarHBondContact O-N 2.7Å; V867-F871 PolarHBondContact O-N 2.95Å; V867-C970 VanDerWaalsContact CG1-O 3.26Å; V867-C970 WeakPolarHBondContact CG1-O 3.26Å; V867-L973 HydrophobicContact CG2-CD2 4.02Å; V867-L1093 HydrophobicContact CB-CD1 3.94Å; V867-L1093 HydrophobicContact CG1-CD1 4.45Å; V867-L1093 HydrophobicContact CG2-CD1 3.7Å; V867-L1109 HydrophobicContact CB-CD2 4.27Å
868	L	92.4	Very high	91.3	Very high	0 Å²	0	10.6 Å²	10.6	0%	0	5%	0.049	C	C	.	.	H	α-helix	trans	-52.2	-41.9	-178	-75.4	169.2	0	0	0	114.5	V861 K864 Y870 F871 F872 L901 V902 C970	V861-L868 HydrophobicContact CG1-CD1 4.04Å; V861-L868 HydrophobicContact CG1-CD2 4.31Å; V861-L868 HydrophobicContact CG2-CD2 4.28Å; K864-L868 HydrophobicContact CB-CD1 4.32Å; K864-L868 HydrophobicContact CB-CD2 4.37Å; K864-L868 HydrophobicContact CB-CG 3.94Å; K864-L868 WeakPolarHBondContact O-CG 3.12Å; K864-L868 PolarHBondContact O-N 3.38Å; L868-Y870 VanDerWaalsContact C-N 3.32Å; L868-Y870 PolarHBondContact O-N 2.81Å; L868-F871 PolarHBondContact O-N 3.4Å; L868-F872 HydrophobicContact CB-CD2 4.21Å; L868-F872 HydrophobicContact CB-CE2 4.21Å; L868-F872 HydrophobicContact CD2-CD2 4.28Å; L868-F872 HydrophobicContact CD2-CE2 3.66Å; L868-F872 HydrophobicContact CD2-CZ 4.17Å; L868-F872 HydrophobicContact CG-CE2 4.41Å; L868-F872 WeakPolarHBondContact O-CB 3.42Å; L868-F872 WeakPolarHBondContact O-CD2 3.25Å; L868-F872 PolarHBondContact O-N 3.37Å; L868-L901 HydrophobicContact CD1-CB 4.2Å; L868-V902 HydrophobicContact CD1-CG2 3.9Å; L868-V902 HydrophobicContact CD2-CG2 4.18Å; L868-C970 HydrophobicContact CD2-CB 3.99Å
869	P	92.3	Very high	91.1	Very high	0 Å²	0	13.8 Å²	13.8	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-56.1	-44.7	174	-26.1	35.6	0	0	0	112.4	A865 V867 G873 S1126 S1127 L1130 P1131	A865-P869 VanDerWaalsContact O-CD 3.29Å; A865-P869 WeakPolarHBondContact O-CD 3.48Å; V867-P869 VanDerWaalsContact C-CD 3.49Å; P869-G873 PolarHBondContact O-N 2.71Å; P869-G873 VanDerWaalsContact O-N 3.17Å; P869-S1126 CarbonylContact O-C 3.54Å; P869-S1126 WeakPolarHBondContact O-CA 3.33Å; P869-S1127 WeakPolarHBondContact O-CB 3.01Å; P869-S1127 PolarHBondContact O-N 3.02Å; P869-L1130 HydrophobicContact CB-CB 4.24Å; P869-L1130 HydrophobicContact CG-CB 4.28Å; P869-P1131 VanDerWaalsContact CG-O 3.31Å; P869-P1131 WeakPolarHBondContact CG-O 3.4Å
870	Y	92.1	Very high	90.9	Very high	24 Å²	24	14.5 Å²	14.5	9%	0.094	7%	0.069	C	C	.	.	H	α-helix	trans	-71.7	-43	179.1	-58.7	-79.8	0	0	0	112.4	V867 L868 F872 G873 Y874 L1109 I1113 L1124 L1125 V1132	V867-Y870 PolarHBondContact O-N 2.7Å; L868-Y870 VanDerWaalsContact C-N 3.32Å; L868-Y870 PolarHBondContact O-N 2.81Å; Y870-F872 PolarHBondContact O-N 3.39Å; Y870-G873 PolarHBondContact O-N 2.69Å; Y870-Y874 VanDerWaalsContact O-CD2 3.24Å; Y870-Y874 WeakPolarHBondContact O-CD2 3.42Å; Y870-Y874 PolarHBondContact O-N 2.81Å; Y870-L1109 HydrophobicContact CD2-CD1 4.06Å; Y870-L1109 HydrophobicContact CD2-CD2 3.91Å; Y870-L1109 HydrophobicContact CD2-CG 4.5Å; Y870-L1109 HydrophobicContact CE2-CD1 4.38Å; Y870-L1109 HydrophobicContact CE2-CD2 3.89Å; Y870-L1109 HydrophobicContact CE2-CG 4.46Å; Y870-I1113 HydrophobicContact CE1-CD1 4.42Å; Y870-I1113 HydrophobicContact CE1-CG1 4.47Å; Y870-I1113 HydrophobicContact CE2-CD1 4.03Å; Y870-I1113 WeakPolarHBondContact OH-CD1 3.45Å; Y870-L1124 HydrophobicContact CD1-CB 3.56Å; Y870-L1124 HydrophobicContact CD1-CD1 4.33Å; Y870-L1124 HydrophobicContact CE1-CB 3.86Å; Y870-L1124 HydrophobicContact CG-CB 4.5Å; Y870-L1125 WeakPolarHBondContact CA-O 3.37Å; Y870-L1125 WeakPolarHBondContact CD1-O 3.34Å; Y870-V1132 HydrophobicContact CE2-CG1 4.25Å; Y870-V1132 VanDerWaalsContact OH-CG1 3.24Å; Y870-V1132 WeakPolarHBondContact OH-CG1 3.45Å
871	F	94.1	Very high	91	Very high	4 Å²	4	15.9 Å²	15.9	2%	0.018	8%	0.079	C	C	.	.	H	α-helix	trans	-55.8	-49.9	176.9	177.1	-93.9	0	0	0	111.7	L859 V867 L868 Y874 L875 L968 D969 C970 V972 L973	L859-F871 HydrophobicContact CD1-CE1 3.86Å; L859-F871 HydrophobicContact CD1-CZ 4.32Å; L859-F871 HydrophobicContact CD2-CE1 4.04Å; L859-F871 HydrophobicContact CD2-CZ 3.63Å; V867-F871 PolarHBondContact O-N 2.95Å; L868-F871 PolarHBondContact O-N 3.4Å; F871-Y874 PolarHBondContact O-N 2.93Å; F871-L875 HydrophobicContact CE1-CD2 4.18Å; F871-L875 PolarHBondContact O-N 2.81Å; F871-L875 VanDerWaalsContact O-N 3.1Å; F871-L968 HydrophobicContact CE2-CD2 3.83Å; F871-L968 HydrophobicContact CE2-CG 3.89Å; F871-L968 HydrophobicContact CZ-CD2 3.67Å; F871-L968 HydrophobicContact CZ-CG 3.96Å; F871-D969 WeakPolarHBondContact CE2-O 3.32Å; F871-C970 HydrophobicContact CD1-CB 4.37Å; F871-C970 HydrophobicContact CD2-CB 4.28Å; F871-C970 HydrophobicContact CE2-CB 4.46Å; F871-C970 HydrophobicContact CG-CB 4.24Å; F871-V972 WeakPolarHBondContact CD2-O 3.46Å; F871-V972 WeakPolarHBondContact CE2-O 3.4Å; F871-L973 HydrophobicContact CB-CD2 4.22Å
872	F	94.6	Very high	91.1	Very high	0 Å²	0	17.5 Å²	17.5	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-70	-35.3	-178.8	-75.2	-54	0	0	0	112.8	L859 L868 Y870 Y874 L875 E876 V902 W905 L1130	L859-F872 HydrophobicContact CD1-CE1 4.14Å; L868-F872 HydrophobicContact CB-CD2 4.21Å; L868-F872 HydrophobicContact CB-CE2 4.21Å; L868-F872 HydrophobicContact CD2-CD2 4.28Å; L868-F872 HydrophobicContact CD2-CE2 3.66Å; L868-F872 HydrophobicContact CD2-CZ 4.17Å; L868-F872 HydrophobicContact CG-CE2 4.41Å; L868-F872 WeakPolarHBondContact O-CB 3.42Å; L868-F872 WeakPolarHBondContact O-CD2 3.25Å; L868-F872 PolarHBondContact O-N 3.37Å; Y870-F872 PolarHBondContact O-N 3.39Å; F872-Y874 PolarHBondContact O-N 3.49Å; F872-L875 HydrophobicContact CD1-CD2 3.98Å; F872-L875 HydrophobicContact CE1-CD2 4.25Å; F872-L875 WeakPolarHBondContact O-CB 3.16Å; F872-L875 PolarHBondContact O-N 3.01Å; F872-E876 WeakPolarHBondContact O-CB 3.28Å; F872-E876 VanDerWaalsContact O-CG 3.28Å; F872-E876 WeakPolarHBondContact O-CG 3.49Å; F872-E876 PolarHBondContact O-N 3.33Å; F872-V902 HydrophobicContact CE2-CG2 4.14Å; F872-V902 HydrophobicContact CZ-CG2 4.15Å; F872-W905 HydrophobicContact CB-CD2 4.44Å; F872-W905 HydrophobicContact CB-CG 4.27Å; F872-W905 AromaticContact CD1-CD2 3.42Å; F872-W905 HydrophobicContact CD1-CD2 3.42Å; F872-W905 VanDerWaalsContact CD1-CD2 3.42Å; F872-W905 AromaticContact CD1-CE2 3.29Å; F872-W905 AromaticContact CD1-CE3 3.76Å; F872-W905 HydrophobicContact CD1-CE3 3.76Å; F872-W905 AromaticContact CD1-CG 3.97Å; F872-W905 HydrophobicContact CD1-CG 3.97Å; F872-W905 AromaticContact CD1-CH2 3.86Å; F872-W905 HydrophobicContact CD1-CH2 3.86Å; F872-W905 AromaticContact CD1-CZ2 3.53Å; F872-W905 HydrophobicContact CD1-CZ2 3.53Å; F872-W905 AromaticContact CD1-CZ3 3.97Å; F872-W905 HydrophobicContact CD1-CZ3 3.97Å; F872-W905 AromaticContact CD1-NE1 3.75Å; F872-W905 HydrophobicContact CD2-CB 4.16Å; F872-W905 HydrophobicContact CD2-CD2 4.14Å; F872-W905 AromaticContact CD2-CG 3.84Å; F872-W905 HydrophobicContact CD2-CG 3.84Å; F872-W905 AromaticContact CE1-CD2 3.52Å; F872-W905 HydrophobicContact CE1-CD2 3.52Å; F872-W905 AromaticContact CE1-CE2 3.83Å; F872-W905 AromaticContact CE1-CE3 3.35Å; F872-W905 HydrophobicContact CE1-CE3 3.35Å; F872-W905 HydrophobicContact CE1-CG 4.23Å; F872-W905 AromaticContact CE1-CH2 3.83Å; F872-W905 HydrophobicContact CE1-CH2 3.83Å; F872-W905 AromaticContact CE1-CZ2 3.98Å; F872-W905 HydrophobicContact CE1-CZ2 3.98Å; F872-W905 AromaticContact CE1-CZ3 3.51Å; F872-W905 HydrophobicContact CE1-CZ3 3.51Å; F872-W905 HydrophobicContact CE2-CB 4.13Å; F872-W905 HydrophobicContact CE2-CD2 4.19Å; F872-W905 HydrophobicContact CE2-CE3 4.37Å; F872-W905 HydrophobicContact CE2-CG 4.07Å; F872-W905 AromaticContact CG-CD1 3.72Å; F872-W905 AromaticContact CG-CD2 3.76Å; F872-W905 HydrophobicContact CG-CD2 3.76Å; F872-W905 AromaticContact CG-CE2 3.71Å; F872-W905 HydrophobicContact CG-CE3 4.45Å; F872-W905 AromaticContact CG-CG 3.78Å; F872-W905 HydrophobicContact CG-CG 3.78Å; F872-W905 HydrophobicContact CG-CZ2 4.34Å; F872-W905 AromaticContact CG-NE1 3.68Å; F872-W905 AromaticContact CZ-CD2 3.9Å; F872-W905 HydrophobicContact CZ-CD2 3.9Å; F872-W905 AromaticContact CZ-CE3 3.69Å; F872-W905 HydrophobicContact CZ-CE3 3.69Å; F872-W905 HydrophobicContact CZ-CG 4.27Å; F872-W905 HydrophobicContact CZ-CZ3 4.23Å; F872-L1130 HydrophobicContact CD2-CD1 3.57Å; F872-L1130 HydrophobicContact CE2-CD1 4.25Å; F872-L1130 HydrophobicContact CG-CD1 4.46Å
873	G	91.5	Very high	91.4	Very high	1 Å²	1	21.4 Å²	21.4	1%	0.01	11%	0.108	C	C	.	.	H	α-helix	trans	-55.8	-47.5	172.6	0	0	0	0	0	112.6	P869 Y870 L875 E876 E877 L1125	P869-G873 PolarHBondContact O-N 2.71Å; P869-G873 VanDerWaalsContact O-N 3.17Å; Y870-G873 PolarHBondContact O-N 2.69Å; G873-L875 VanDerWaalsContact C-N 3.32Å; G873-L875 PolarHBondContact O-N 3.19Å; G873-E876 PolarHBondContact O-N 3.21Å; G873-E877 PolarHBondContact O-N 3.26Å; G873-L1125 WeakPolarHBondContact O-CD2 3.41Å
874	Y	93.2	Very high	91.7	Very high	29 Å²	29	24.4 Å²	24.4	11%	0.114	12%	0.119	C	C	.	.	H	α-helix	trans	-69.8	-26	175	-71	-67	0	0	0	113.8	Y870 F871 F872 L878 L973 F975 L1125	Y870-Y874 VanDerWaalsContact O-CD2 3.24Å; Y870-Y874 WeakPolarHBondContact O-CD2 3.42Å; Y870-Y874 PolarHBondContact O-N 2.81Å; F871-Y874 PolarHBondContact O-N 2.93Å; F872-Y874 PolarHBondContact O-N 3.49Å; Y874-L878 PolarHBondContact O-N 3.42Å; Y874-L973 HydrophobicContact CD2-CB 3.86Å; Y874-L973 HydrophobicContact CD2-CD2 4.2Å; Y874-L973 HydrophobicContact CD2-CG 4.44Å; Y874-L973 HydrophobicContact CE2-CB 4.11Å; Y874-L973 HydrophobicContact CE2-CD1 4.34Å; Y874-F975 HydrophobicContact CD1-CD1 4.08Å; Y874-F975 HydrophobicContact CD2-CD1 4.26Å; Y874-F975 HydrophobicContact CD2-CE1 4.43Å; Y874-F975 HydrophobicContact CE1-CB 4.46Å; Y874-F975 AromaticContact CE1-CD1 3.58Å; Y874-F975 HydrophobicContact CE1-CD1 3.58Å; Y874-F975 HydrophobicContact CE1-CE1 4.32Å; Y874-F975 HydrophobicContact CE1-CG 4.43Å; Y874-F975 AromaticContact CE2-CD1 3.78Å; Y874-F975 HydrophobicContact CE2-CD1 3.78Å; Y874-F975 AromaticContact CE2-CE1 3.74Å; Y874-F975 HydrophobicContact CE2-CE1 3.74Å; Y874-F975 HydrophobicContact CG-CD1 4.41Å; Y874-F975 AromaticContact CZ-CD1 3.4Å; Y874-F975 VanDerWaalsContact CZ-CD1 3.4Å; Y874-F975 AromaticContact CZ-CE1 3.68Å; Y874-L1125 HydrophobicContact CD1-CB 4.31Å; Y874-L1125 HydrophobicContact CD1-CD2 4.23Å; Y874-L1125 HydrophobicContact CE1-CB 3.78Å; Y874-L1125 HydrophobicContact CE1-CD2 4.36Å; Y874-L1125 HydrophobicContact CE2-CB 4.08Å; Y874-L1125 PolarHBondContact OH-N 3.47Å; Y874-L1125 VanDerWaalsContact OH-N 3.07Å
875	L	92.7	Very high	92	Very high	6 Å²	6	23.3 Å²	23.3	3%	0.031	11%	0.114	C	C	.	.	H	α-helix	trans	-74.7	-37.9	176.4	-170.5	70	0	0	0	112.9	L857 L859 F871 F872 G873 E877 L878 K882 I887 W905 Y913 L968	L857-L875 HydrophobicContact CD2-CD1 3.48Å; L857-L875 VanDerWaalsContact CD2-CD1 3.48Å; L857-L875 HydrophobicContact CD2-CD2 3.76Å; L857-L875 HydrophobicContact CD2-CG 4.21Å; L859-L875 HydrophobicContact CD1-CD2 4.23Å; F871-L875 HydrophobicContact CE1-CD2 4.18Å; F871-L875 PolarHBondContact O-N 2.81Å; F871-L875 VanDerWaalsContact O-N 3.1Å; F872-L875 HydrophobicContact CD1-CD2 3.98Å; F872-L875 HydrophobicContact CE1-CD2 4.25Å; F872-L875 WeakPolarHBondContact O-CB 3.16Å; F872-L875 PolarHBondContact O-N 3.01Å; G873-L875 VanDerWaalsContact C-N 3.32Å; G873-L875 PolarHBondContact O-N 3.19Å; L875-E877 VanDerWaalsContact C-N 3.25Å; L875-E877 PolarHBondContact O-N 3.24Å; L875-L878 HydrophobicContact CD1-CD1 3.77Å; L875-L878 PolarHBondContact O-N 2.75Å; L875-K882 PolarHBondContact O-NZ 3.3Å; L875-I887 HydrophobicContact CD2-CD1 4.19Å; L875-W905 HydrophobicContact CD2-CH2 3.86Å; L875-W905 HydrophobicContact CD2-CZ2 4.06Å; L875-Y913 PolarHBondContact O-OH 3.33Å; L875-L968 HydrophobicContact CD1-CD2 4.38Å
876	E	92.2	Very high	92.4	Very high	28 Å²	28	23 Å²	23	13%	0.131	11%	0.112	C	C	.	.	H	α-helix	trans	-63.7	-32.8	173.1	-72.7	162.7	-136	0	0	111.2	F872 G873 K882 W905 S1127 P1128 F1129	F872-E876 WeakPolarHBondContact O-CB 3.28Å; F872-E876 VanDerWaalsContact O-CG 3.28Å; F872-E876 WeakPolarHBondContact O-CG 3.49Å; F872-E876 PolarHBondContact O-N 3.33Å; G873-E876 PolarHBondContact O-N 3.21Å; E876-K882 WeakPolarHBondContact O-CE 3.48Å; E876-K882 PolarHBondContact O-NZ 3.48Å; E876-W905 HydrophobicContact CG-CZ2 4.43Å; E876-W905 PolarHBondContact OE1-NE1 3.3Å; E876-S1127 VanDerWaalsContact OE1-CB 3.23Å; E876-S1127 WeakPolarHBondContact OE1-CB 3.05Å; E876-S1127 PolarHBondContact OE1-OG 3.37Å; E876-P1128 WeakPolarHBondContact OE2-CD 3.2Å; E876-F1129 WeakPolarHBondContact OE2-CD2 3.4Å; E876-F1129 WeakPolarHBondContact OE2-CE2 3.49Å
877	E	90.4	Very high	92.7	Very high	46 Å²	46	22.2 Å²	22.2	22%	0.215	11%	0.108	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.1	-4.7	179.3	-77.6	-61.8	140.1	0	0	115.9	G873 L875 D879 Q977 L1125 N1472	G873-E877 PolarHBondContact O-N 3.26Å; L875-E877 VanDerWaalsContact C-N 3.25Å; L875-E877 PolarHBondContact O-N 3.24Å; E877-D879 PolarHBondContact O-N 2.86Å; E877-D879 VanDerWaalsContact O-N 3.15Å; E877-Q977 HydrophobicContact CB-CG 4.29Å; E877-Q977 VanDerWaalsContact O-CB 3.32Å; E877-Q977 WeakPolarHBondContact O-CB 3.23Å; E877-Q977 WeakPolarHBondContact O-CG 3.41Å; E877-Q977 PolarHBondContact OE2-NE2 2.71Å; E877-L1125 HydrophobicContact CB-CD2 4.18Å; E877-L1125 HydrophobicContact CG-CD2 3.43Å; E877-L1125 VanDerWaalsContact CG-CD2 3.43Å; E877-N1472 VanDerWaalsContact CD-CG 3.43Å; E877-N1472 HydrophobicContact CG-CB 4.4Å; E877-N1472 WeakPolarHBondContact CG-ND2 3.44Å; E877-N1472 PolarHBondContact OE2-ND2 2.8Å
878	L	90.7	Very high	92.9	Very high	5 Å²	5	22.6 Å²	22.6	3%	0.026	11%	0.11	C	C	.	.			trans	-59.1	121.7	177	-70.2	-178	0	0	0	112.1	Y874 L875 Y880 K882 L974 Q977 L980	Y874-L878 PolarHBondContact O-N 3.42Å; L875-L878 HydrophobicContact CD1-CD1 3.77Å; L875-L878 PolarHBondContact O-N 2.75Å; L878-Y880 PolarHBondContact O-N 3.13Å; L878-K882 PolarHBondContact O-NZ 3.14Å; L878-L974 HydrophobicContact CD2-CB 4.33Å; L878-L974 HydrophobicContact CD2-CD1 4.4Å; L878-Q977 CarbonylContact C-O 3.47Å; L878-Q977 WeakPolarHBondContact CA-O 3.48Å; L878-L980 HydrophobicContact CD1-CD1 4.16Å; L878-L980 HydrophobicContact CD1-CG 4.44Å
879	D	91	Very high	93	Very high	68 Å²	68	22.6 Å²	22.6	36%	0.364	11%	0.11	S	C	.	.	S	Bend	trans	-72.2	76.9	175.3	177.8	17.1	0	0	0	109.8	E877 Q977 K978 Q981	E877-D879 PolarHBondContact O-N 2.86Å; E877-D879 VanDerWaalsContact O-N 3.15Å; D879-Q977 HydrophobicContact CB-CB 4.04Å; D879-Q977 PolarHBondContact N-O 3.46Å; D879-K978 HydrophobicContact CB-CG 4Å; D879-K978 WeakPolarHBondContact OD2-CE 3.35Å; D879-K978 WeakPolarHBondContact OD2-CG 3.38Å; D879-K978 IonicContact OD2-NZ 2.69Å; D879-Q981 VanDerWaalsContact CG-NE2 3.34Å; D879-Q981 PolarHBondContact O-NE2 3.26Å; D879-Q981 PolarHBondContact OD1-NE2 2.84Å; D879-Q981 PolarHBondContact OD2-NE2 2.97Å
880	Y	91.1	Very high	93	Very high	15 Å²	15	24.5 Å²	24.5	6%	0.059	12%	0.117	C	C	.	.	S	Bend	trans	-156.5	141.6	175.5	-150.5	-93.4	0	0	0	108.4	P852 P853 V855 L878 K882 R884 I885 L980 Q981 M984	P852-Y880 HydrophobicContact CB-CE1 4.13Å; P852-Y880 HydrophobicContact CB-CE2 4.36Å; P853-Y880 VanDerWaalsContact CD-OH 3.3Å; P853-Y880 WeakPolarHBondContact CD-OH 3.38Å; P853-Y880 WeakPolarHBondContact O-CE1 3.41Å; P853-Y880 PolarHBondContact O-OH 3.46Å; V855-Y880 HydrophobicContact CG2-CE1 3.96Å; L878-Y880 PolarHBondContact O-N 3.13Å; Y880-K882 PolarHBondContact O-N 2.88Å; Y880-K882 VanDerWaalsContact O-N 3.12Å; Y880-R884 HydrophobicContact CD1-CB 4.44Å; Y880-R884 HydrophobicContact CE1-CB 4.11Å; Y880-I885 HydrophobicContact CD1-CD1 4.17Å; Y880-I885 HydrophobicContact CD1-CG1 3.94Å; Y880-I885 HydrophobicContact CG-CD1 4.48Å; Y880-L980 HydrophobicContact CD1-CD1 4.37Å; Y880-L980 HydrophobicContact CD2-CB 3.86Å; Y880-L980 HydrophobicContact CD2-CD1 4.25Å; Y880-L980 HydrophobicContact CE2-CB 4.24Å; Y880-L980 HydrophobicContact CG-CB 4.4Å; Y880-L980 HydrophobicContact CG-CD1 3.95Å; Y880-Q981 HydrophobicContact CD2-CG 3.97Å; Y880-Q981 HydrophobicContact CE2-CG 4.33Å; Y880-M984 HydrophobicContact CE2-CE 3.91Å; Y880-M984 HydrophobicContact CE2-SD 3.82Å; Y880-M984 WeakPolarHBondContact OH-CE 3.29Å; Y880-M984 PolarHBondContact OH-SD 2.97Å; Y880-M984 VanDerWaalsContact OH-SD 3.35Å
881	P	91.8	Very high	92.9	Very high	47 Å²	47	23.6 Å²	23.6	31%	0.305	11%	0.114	S	C	.	.			trans	-59.9	121	-179.9	-22.1	33	0	0	0	110.9	P852 D883 R884	P852-P881 HydrophobicContact CG-CG 3.93Å; P881-D883 VanDerWaalsContact C-N 3.27Å; P881-D883 WeakPolarHBondContact CB-OD1 3.36Å; P881-D883 PolarHBondContact O-N 3.04Å; P881-R884 HydrophobicContact CB-CB 4.37Å; P881-R884 HydrophobicContact CB-CG 3.81Å; P881-R884 HydrophobicContact CG-CG 4.4Å; P881-R884 WeakPolarHBondContact O-CB 3.34Å; P881-R884 PolarHBondContact O-N 3.07Å
882	K	92.5	Very high	92.5	Very high	34 Å²	34	23.5 Å²	23.5	15%	0.148	11%	0.114	C	C	.	.	G	3₁₀ helix	trans	-66.2	-31.9	-172.3	-55	-57.3	-169.5	-170.8	0	111.5	L875 E876 L878 Y880 R884 I885 L912 Y913 H914	L875-K882 PolarHBondContact O-NZ 3.3Å; E876-K882 WeakPolarHBondContact O-CE 3.48Å; E876-K882 PolarHBondContact O-NZ 3.48Å; L878-K882 PolarHBondContact O-NZ 3.14Å; Y880-K882 PolarHBondContact O-N 2.88Å; Y880-K882 VanDerWaalsContact O-N 3.12Å; K882-R884 PolarHBondContact O-N 3.15Å; K882-R884 VanDerWaalsContact O-N 3.12Å; K882-I885 PolarHBondContact O-N 3.49Å; K882-I885 VanDerWaalsContact O-O 3.07Å; K882-L912 CarbonylContact C-O 3.47Å; K882-L912 HydrophobicContact CB-CG 4.14Å; K882-L912 WeakPolarHBondContact CB-O 3.2Å; K882-L912 HydrophobicContact CG-CD2 4.1Å; K882-L912 HydrophobicContact CG-CG 4.15Å; K882-Y913 HydrophobicContact CB-CD1 4.17Å; K882-Y913 HydrophobicContact CB-CE1 4.37Å; K882-Y913 HydrophobicContact CD-CD1 4.42Å; K882-Y913 HydrophobicContact CD-CE1 3.77Å; K882-Y913 WeakPolarHBondContact O-CA 3.37Å; K882-H914 PolarHBondContact O-N 2.97Å
883	D	92.7	Very high	91.9	Very high	90 Å²	90	24.7 Å²	24.7	48%	0.481	12%	0.118	S	C	.	.	G	3₁₀ helix	trans	-63.3	-11.8	171.5	69.2	-66	0	0	0	114.5	P881 H914	P881-D883 VanDerWaalsContact C-N 3.27Å; P881-D883 WeakPolarHBondContact CB-OD1 3.36Å; P881-D883 PolarHBondContact O-N 3.04Å; D883-H914 WeakPolarHBondContact O-CB 3.32Å; D883-H914 PolarHBondContact O-ND1 3.48Å; D883-H914 VanDerWaalsContact O-ND1 3.15Å
884	R	94.3	Very high	91.6	Very high	63 Å²	63	26 Å²	26	24%	0.238	13%	0.127	C	C	.	.	G	3₁₀ helix	trans	-102.6	-5	174.3	-53.3	-66.5	-71	178.3	-1.8	112.8	P852 T854 V855 Y880 P881 K882	P852-R884 PolarHBondContact O-NE 3.47Å; P852-R884 PolarHBondContact O-NH2 3.2Å; T854-R884 WeakPolarHBondContact CA-O 3.45Å; V855-R884 PolarHBondContact N-O 2.94Å; Y880-R884 HydrophobicContact CD1-CB 4.44Å; Y880-R884 HydrophobicContact CE1-CB 4.11Å; P881-R884 HydrophobicContact CB-CB 4.37Å; P881-R884 HydrophobicContact CB-CG 3.81Å; P881-R884 HydrophobicContact CG-CG 4.4Å; P881-R884 WeakPolarHBondContact O-CB 3.34Å; P881-R884 PolarHBondContact O-N 3.07Å; K882-R884 PolarHBondContact O-N 3.15Å; K882-R884 VanDerWaalsContact O-N 3.12Å
885	I	95.4	Very high	91.2	Very high	4 Å²	4	27.3 Å²	27.3	2%	0.021	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	116.1	173.9	-62.2	172.3	0	0	0	108.8	V855 L857 Y880 K882 I887 Y913 H914 L980	V855-I885 WeakPolarHBondContact O-CA 3.41Å; L857-I885 HydrophobicContact CB-CG2 4.21Å; Y880-I885 HydrophobicContact CD1-CD1 4.17Å; Y880-I885 HydrophobicContact CD1-CG1 3.94Å; Y880-I885 HydrophobicContact CG-CD1 4.48Å; K882-I885 PolarHBondContact O-N 3.49Å; K882-I885 VanDerWaalsContact O-O 3.07Å; I885-I887 HydrophobicContact CG2-CD1 4.43Å; I885-I887 HydrophobicContact CG2-CG1 3.87Å; I885-Y913 HydrophobicContact CB-CD1 3.98Å; I885-Y913 HydrophobicContact CB-CE1 4.41Å; I885-Y913 HydrophobicContact CG2-CD1 3.9Å; I885-Y913 HydrophobicContact CG2-CE1 4.19Å; I885-H914 VanDerWaalsContact O-CB 3.31Å; I885-H914 WeakPolarHBondContact O-CB 3.36Å; I885-H914 PolarHBondContact O-N 3.36Å; I885-L980 HydrophobicContact CD1-CD1 3.84Å; I885-L980 HydrophobicContact CG1-CD1 4.42Å
886	A	96.3	Very high	90.9	Very high	2 Å²	2	28.1 Å²	28.1	2%	0.017	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	144.7	161.7	0	0	0	0	0	109.1	V855 L856 L857 H914 M960	V855-A886 PolarHBondContact O-N 3.32Å; L856-A886 CarbonylContact C-O 3.58Å; L856-A886 WeakPolarHBondContact CA-O 3.49Å; L856-A886 HydrophobicContact CD1-CB 3.67Å; L857-A886 PolarHBondContact N-O 3.06Å; A886-H914 HydrophobicContact CB-CB 4.27Å; A886-M960 HydrophobicContact CB-CE 3.54Å
887	I	95.6	Very high	90.7	Very high	1 Å²	1	32.7 Å²	32.7	1%	0.005	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	128.6	-179.3	-55.6	-175.4	0	0	0	109.5	L857 L859 L875 I885 V889 W905 Y913 S915 I916 E917	L857-I887 HydrophobicContact CB-CG1 4.24Å; L857-I887 HydrophobicContact CD2-CD1 4.09Å; L857-I887 HydrophobicContact CD2-CG1 4.05Å; L857-I887 HydrophobicContact CD2-CG2 4.31Å; L857-I887 WeakPolarHBondContact O-CA 3.48Å; L859-I887 HydrophobicContact CD1-CG2 3.88Å; L859-I887 HydrophobicContact CG-CG2 4.22Å; L875-I887 HydrophobicContact CD2-CD1 4.19Å; I885-I887 HydrophobicContact CG2-CD1 4.43Å; I885-I887 HydrophobicContact CG2-CG1 3.87Å; I887-V889 HydrophobicContact CG2-CG2 3.69Å; I887-W905 HydrophobicContact CD1-CH2 3.63Å; I887-W905 HydrophobicContact CD1-CZ3 4.19Å; I887-Y913 HydrophobicContact CD1-CD1 3.54Å; I887-Y913 HydrophobicContact CD1-CD2 4.14Å; I887-Y913 HydrophobicContact CD1-CE1 3.61Å; I887-Y913 HydrophobicContact CD1-CE2 4.21Å; I887-Y913 HydrophobicContact CD1-CG 3.81Å; I887-Y913 HydrophobicContact CG1-CD1 4.06Å; I887-Y913 HydrophobicContact CG1-CE1 4.48Å; I887-Y913 HydrophobicContact CG1-CG 4.39Å; I887-S915 PolarHBondContact N-O 3.23Å; I887-I916 HydrophobicContact CB-CG1 4.39Å; I887-I916 HydrophobicContact CB-CG2 4.34Å; I887-I916 HydrophobicContact CG2-CG2 4.47Å; I887-I916 WeakPolarHBondContact O-CA 3.21Å; I887-E917 PolarHBondContact O-N 3.13Å
888	F	94.9	Very high	90.7	Very high	7 Å²	7	30.5 Å²	30.5	3%	0.031	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	110.6	173.4	-178.7	-127.1	0	0	0	109.6	L856 L857 C858 L859 E917 W949 Y952 A953 K956	L856-F888 HydrophobicContact CD1-CB 4.09Å; L857-F888 PolarHBondContact O-N 3.23Å; C858-F888 WeakPolarHBondContact CA-O 3.29Å; L859-F888 PolarHBondContact N-O 3.01Å; F888-E917 WeakPolarHBondContact CA-O 3.44Å; F888-E917 HydrophobicContact CD2-CB 3.99Å; F888-E917 WeakPolarHBondContact CD2-O 3.45Å; F888-W949 AromaticContact CD1-NE1 3.75Å; F888-W949 AromaticContact CE1-CD1 3.75Å; F888-W949 AromaticContact CE1-NE1 3.11Å; F888-W949 AromaticContact CZ-NE1 3.79Å; F888-Y952 AromaticContact CE1-CD1 3.66Å; F888-Y952 HydrophobicContact CE1-CD1 3.66Å; F888-Y952 AromaticContact CE1-CE1 3.87Å; F888-Y952 HydrophobicContact CE1-CE1 3.87Å; F888-Y952 HydrophobicContact CE2-CE1 4.17Å; F888-Y952 AromaticContact CZ-CD1 3.63Å; F888-Y952 HydrophobicContact CZ-CD1 3.63Å; F888-Y952 AromaticContact CZ-CE1 3.45Å; F888-Y952 HydrophobicContact CZ-CE1 3.45Å; F888-Y952 VanDerWaalsContact CZ-CE1 3.45Å; F888-A953 HydrophobicContact CD1-CB 3.96Å; F888-A953 HydrophobicContact CE1-CB 4.1Å; F888-K956 HydrophobicContact CG-CD 4.48Å
889	V	94.2	Very high	90.7	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	130.1	-176.1	-166.4	0	0	0	0	110	L859 V861 I887 I891 V902 E917 L918 S919	L859-V889 HydrophobicContact CB-CB 4.39Å; L859-V889 HydrophobicContact CB-CG1 4.06Å; L859-V889 HydrophobicContact CB-CG2 4.21Å; L859-V889 HydrophobicContact CD1-CG2 4.14Å; L859-V889 WeakPolarHBondContact O-CA 3.36Å; V861-V889 HydrophobicContact CG2-CG1 3.64Å; I887-V889 HydrophobicContact CG2-CG2 3.69Å; V889-I891 HydrophobicContact CG1-CG1 4.38Å; V889-V902 HydrophobicContact CG1-CG1 3.94Å; V889-E917 PolarHBondContact N-O 2.78Å; V889-L918 HydrophobicContact CB-CD2 3.65Å; V889-L918 HydrophobicContact CG1-CD2 4.4Å; V889-L918 HydrophobicContact CG2-CD2 3.66Å; V889-S919 PolarHBondContact O-N 3.21Å
890	R	91.4	Very high	90.7	Very high	41 Å²	41	34.9 Å²	34.9	16%	0.155	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	118.3	170	-177.6	64	166.8	177.7	3	109.9	L859 L860 V861 S919 Q920 W949	L859-R890 PolarHBondContact O-N 3.39Å; L860-R890 HydrophobicContact CD1-CB 4.33Å; L860-R890 HydrophobicContact CD1-CG 4.29Å; V861-R890 PolarHBondContact N-O 3.38Å; R890-S919 WeakPolarHBondContact CA-O 3.38Å; R890-S919 WeakPolarHBondContact CD-O 3.37Å; R890-S919 PolarHBondContact NH1-OG 3Å; R890-Q920 VanDerWaalsContact NH1-C 3.26Å; R890-Q920 PolarHBondContact NH1-O 3.02Å; R890-W949 HydrophobicContact CB-CD2 3.82Å; R890-W949 HydrophobicContact CB-CG 4.11Å; R890-W949 HydrophobicContact CB-CH2 4.42Å; R890-W949 HydrophobicContact CB-CZ2 3.66Å; R890-W949 VanDerWaalsContact CB-NE1 3.31Å; R890-W949 HydrophobicContact CG-CD2 3.96Å; R890-W949 HydrophobicContact CG-CG 3.86Å
891	I	89.6	Confident	90.7	Very high	5 Å²	5	35.1 Å²	35.1	3%	0.026	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	105.3	173.6	-56	173.4	0	0	0	106.5	V861 V889 L899 V902 S919 S921	V861-I891 HydrophobicContact CB-CG1 4.39Å; V861-I891 WeakPolarHBondContact O-CA 3.34Å; V889-I891 HydrophobicContact CG1-CG1 4.38Å; I891-L899 HydrophobicContact CD1-CD1 3.4Å; I891-L899 HydrophobicContact CG2-CB 4.44Å; I891-L899 HydrophobicContact CG2-CD1 4.42Å; I891-V902 HydrophobicContact CD1-CB 4.1Å; I891-V902 HydrophobicContact CD1-CG1 3.93Å; I891-V902 HydrophobicContact CG1-CG1 4.47Å; I891-S919 PolarHBondContact N-O 3.28Å; I891-S921 PolarHBondContact O-N 2.98Å; I891-S921 VanDerWaalsContact O-N 3.14Å
892	D	86.1	Confident	90.8	Very high	2 Å²	2	32.9 Å²	32.9	1%	0.011	16%	0.161	C	C	.	.			trans	-94.2	111.1	-179.8	177.1	41.5	0	0	0	108.9	L860 V861 R862 S894 Y929 R942	L860-D892 HydrophobicContact CD1-CB 4.01Å; V861-D892 PolarHBondContact O-N 3.09Å; R862-D892 HydrophobicContact CB-CB 4.17Å; R862-D892 VanDerWaalsContact CB-O 3.28Å; R862-D892 WeakPolarHBondContact CB-O 3.35Å; R862-D892 WeakPolarHBondContact CD-O 3.22Å; R862-D892 WeakPolarHBondContact CD-OD2 3.2Å; R862-D892 WeakPolarHBondContact CG-O 3.49Å; R862-D892 IonicContact NH1-OD2 3.82Å; R862-D892 PolarHBondContact NH1-OD2 3.47Å; D892-S894 VanDerWaalsContact C-N 3.27Å; D892-S894 PolarHBondContact O-N 3.47Å; D892-S894 PolarHBondContact O-OG 2.94Å; D892-Y929 WeakPolarHBondContact OD1-CE2 3.35Å; D892-Y929 PolarHBondContact OD1-OH 3.02Å; D892-R942 IonicContact OD2-CZ 2.97Å; D892-R942 IonicContact OD2-NE 2.6Å; D892-R942 PolarHBondContact OD2-NE 2.93Å; D892-R942 IonicContact OD2-NH2 2.78Å
893	R	82.7	Confident	90.8	Very high	25 Å²	25	33.1 Å²	33.1	9%	0.094	17%	0.165	C	C	.	.	S	Bend	trans	23.8	57.8	172.4	-55.6	-167	-169	-145.5	14.7	115.5	S921 A925 G926 N927 F928 Y929 E941	R893-S921 WeakPolarHBondContact CG-OG 3.22Å; R893-S921 PolarHBondContact N-OG 3.16Å; R893-S921 VanDerWaalsContact N-OG 3.13Å; R893-A925 PolarHBondContact NH1-O 2.9Å; R893-G926 WeakPolarHBondContact CD-O 3.34Å; R893-G926 PolarHBondContact NH1-O 3.34Å; R893-N927 WeakPolarHBondContact CB-O 3.33Å; R893-F928 PolarHBondContact NH1-O 3.1Å; R893-Y929 HydrophobicContact CB-CE2 4.48Å; R893-Y929 HydrophobicContact CG-CD2 4.39Å; R893-Y929 HydrophobicContact CG-CE2 3.85Å; R893-Y929 VanDerWaalsContact NE-CE1 3.32Å; R893-Y929 VanDerWaalsContact NE-CZ 3.27Å; R893-E941 IonicContact NH2-OE1 2.69Å
894	S	84.7	Confident	90.8	Very high	29 Å²	29	31 Å²	31	20%	0.203	16%	0.16	C	C	.	.			trans	-78.5	145.6	-179.9	-59.9	0	0	0	0	111.1	R862 N863 D892	R862-S894 WeakPolarHBondContact CA-OG 3.47Å; N863-S894 PolarHBondContact N-OG 3.34Å; N863-S894 WeakPolarHBondContact OD1-CA 3.3Å; D892-S894 VanDerWaalsContact C-N 3.27Å; D892-S894 PolarHBondContact O-N 3.47Å; D892-S894 PolarHBondContact O-OG 2.94Å
895	V	85.1	Confident	90.8	Very high	56 Å²	56	28 Å²	28	34%	0.339	15%	0.149	S	C	.	.			trans	-119	-4.4	178.4	-61.6	0	0	0	0	113.6	N863 N927 F928 P935 L1102	N863-V895 WeakPolarHBondContact OD1-CG2 3.2Å; N863-V895 PolarHBondContact OD1-N 2.95Å; V895-N927 HydrophobicContact CG1-CB 3.83Å; V895-F928 HydrophobicContact CG1-CE1 4.23Å; V895-F928 HydrophobicContact CG1-CE2 4.43Å; V895-F928 HydrophobicContact CG1-CZ 3.92Å; V895-F928 HydrophobicContact CG2-CZ 4.41Å; V895-P935 HydrophobicContact CG2-CB 4.48Å; V895-L1102 HydrophobicContact CG2-CD1 4.42Å
896	D	86	Confident	90.6	Very high	23 Å²	23	28.5 Å²	28.5	12%	0.123	15%	0.153	C	C	.	.	S	Bend	trans	-100.9	-177.7	167.6	69.4	-5.3	0	0	0	110.6	N863 K864 A865 S898 L1102	N863-D896 WeakPolarHBondContact CA-OD1 3.33Å; N863-D896 VanDerWaalsContact CA-OD2 3.22Å; N863-D896 WeakPolarHBondContact CA-OD2 3.12Å; K864-D896 PolarHBondContact N-OD2 2.85Å; A865-D896 HydrophobicContact CB-CB 3.98Å; A865-D896 VanDerWaalsContact CB-CG 3.48Å; A865-D896 WeakPolarHBondContact CB-OD2 3.33Å; A865-D896 PolarHBondContact N-OD2 3.08Å; D896-S898 VanDerWaalsContact CG-OG 3.31Å; D896-S898 PolarHBondContact O-N 3.29Å; D896-S898 WeakPolarHBondContact OD1-CB 3.21Å; D896-S898 PolarHBondContact OD1-N 2.89Å; D896-S898 PolarHBondContact OD1-OG 3.42Å; D896-S898 PolarHBondContact OD2-OG 3.29Å; D896-L1102 HydrophobicContact CB-CD1 4.41Å
897	E	88.4	Confident	90.4	Very high	123 Å²	123	36.1 Å²	36.1	58%	0.575	19%	0.185	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.4	18.6	-177.6	-57.1	87.8	163.7	0	0	114.6	A865 L899 E900 L901	A865-E897 HydrophobicContact CB-CB 4.21Å; E897-L899 VanDerWaalsContact C-N 3.28Å; E897-L899 PolarHBondContact O-N 3.32Å; E897-E900 VanDerWaalsContact CA-OE2 3.31Å; E897-E900 WeakPolarHBondContact CA-OE2 3.5Å; E897-E900 PolarHBondContact O-N 2.93Å; E897-L901 HydrophobicContact CB-CD1 4.48Å; E897-L901 WeakPolarHBondContact O-CB 3.29Å; E897-L901 VanDerWaalsContact O-CG 3.29Å; E897-L901 WeakPolarHBondContact O-CG 3.44Å; E897-L901 PolarHBondContact O-N 3.22Å
898	S	90.5	Very high	90.3	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-59.8	-36.5	-179.3	-68	0	0	0	0	112.8	K864 A865 D896 V902	K864-S898 PolarHBondContact N-OG 3.29Å; A865-S898 PolarHBondContact N-OG 2.77Å; A865-S898 VanDerWaalsContact N-OG 3.16Å; D896-S898 VanDerWaalsContact CG-OG 3.31Å; D896-S898 PolarHBondContact O-N 3.29Å; D896-S898 WeakPolarHBondContact OD1-CB 3.21Å; D896-S898 PolarHBondContact OD1-N 2.89Å; D896-S898 PolarHBondContact OD1-OG 3.42Å; D896-S898 PolarHBondContact OD2-OG 3.29Å; S898-V902 WeakPolarHBondContact O-CB 3.49Å; S898-V902 WeakPolarHBondContact O-CG2 3.4Å; S898-V902 PolarHBondContact O-N 3.13Å
899	L	90	Very high	90.1	Very high	51 Å²	51	38.1 Å²	38.1	27%	0.267	20%	0.203	S	C	.	.	H	α-helix	trans	-68.9	-45.2	-179.2	173.1	60.2	0	0	0	111	I891 E897 T903	I891-L899 HydrophobicContact CD1-CD1 3.4Å; I891-L899 HydrophobicContact CG2-CB 4.44Å; I891-L899 HydrophobicContact CG2-CD1 4.42Å; E897-L899 VanDerWaalsContact C-N 3.28Å; E897-L899 PolarHBondContact O-N 3.32Å; L899-T903 WeakPolarHBondContact O-CB 3.43Å; L899-T903 PolarHBondContact O-N 3.04Å; L899-T903 PolarHBondContact O-OG1 2.89Å
900	E	90.5	Very high	89.7	Confident	115 Å²	115	44.1 Å²	44.1	54%	0.537	24%	0.235	S	C	.	.	H	α-helix	trans	-61	-48.1	176.7	-68.5	78.1	-178.3	0	0	110.8	E897 T903 A904	E897-E900 VanDerWaalsContact CA-OE2 3.31Å; E897-E900 WeakPolarHBondContact CA-OE2 3.5Å; E897-E900 PolarHBondContact O-N 2.93Å; E900-T903 PolarHBondContact O-N 3.3Å; E900-A904 VanDerWaalsContact O-CB 3.28Å; E900-A904 WeakPolarHBondContact O-CB 3.41Å; E900-A904 PolarHBondContact O-N 3.29Å
901	L	92.5	Very high	89.5	Confident	20 Å²	20	45.4 Å²	45.4	11%	0.105	26%	0.262	C	S	.	.	H	α-helix	trans	-65.8	-47.6	-179.7	-68.4	169.5	0	0	0	112.1	A865 L868 E897 T903 A904 W905 L1130 P1131	A865-L901 HydrophobicContact CB-CD1 3.76Å; A865-L901 WeakPolarHBondContact O-CD1 3.46Å; L868-L901 HydrophobicContact CD1-CB 4.2Å; E897-L901 HydrophobicContact CB-CD1 4.48Å; E897-L901 WeakPolarHBondContact O-CB 3.29Å; E897-L901 VanDerWaalsContact O-CG 3.29Å; E897-L901 WeakPolarHBondContact O-CG 3.44Å; E897-L901 PolarHBondContact O-N 3.22Å; L901-T903 VanDerWaalsContact C-N 3.29Å; L901-T903 PolarHBondContact O-N 3.35Å; L901-A904 PolarHBondContact O-N 3.5Å; L901-W905 WeakPolarHBondContact O-CB 3.25Å; L901-W905 PolarHBondContact O-N 3.15Å; L901-L1130 HydrophobicContact CB-CD1 4.34Å; L901-L1130 HydrophobicContact CB-CD2 4.25Å; L901-L1130 HydrophobicContact CD2-CB 4.4Å; L901-L1130 HydrophobicContact CD2-CD2 3.89Å; L901-L1130 VanDerWaalsContact O-CD2 3.28Å; L901-L1130 WeakPolarHBondContact O-CD2 3.34Å; L901-P1131 HydrophobicContact CD2-CG 4.01Å
902	V	92.7	Very high	89.6	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-60.8	-39.9	175.3	172.1	0	0	0	0	111.4	V861 L868 F872 V889 I891 S898 S906 L918	V861-V902 HydrophobicContact CB-CG2 4.39Å; V861-V902 HydrophobicContact CG1-CG2 3.96Å; V861-V902 HydrophobicContact CG2-CG2 3.89Å; L868-V902 HydrophobicContact CD1-CG2 3.9Å; L868-V902 HydrophobicContact CD2-CG2 4.18Å; F872-V902 HydrophobicContact CE2-CG2 4.14Å; F872-V902 HydrophobicContact CZ-CG2 4.15Å; V889-V902 HydrophobicContact CG1-CG1 3.94Å; I891-V902 HydrophobicContact CD1-CB 4.1Å; I891-V902 HydrophobicContact CD1-CG1 3.93Å; I891-V902 HydrophobicContact CG1-CG1 4.47Å; S898-V902 WeakPolarHBondContact O-CB 3.49Å; S898-V902 WeakPolarHBondContact O-CG2 3.4Å; S898-V902 PolarHBondContact O-N 3.13Å; V902-S906 WeakPolarHBondContact O-CB 3.37Å; V902-S906 PolarHBondContact O-N 3.07Å; V902-L918 HydrophobicContact CG1-CD1 4.35Å; V902-L918 HydrophobicContact CG1-CD2 3.62Å
903	T	92.6	Very high	89.9	Confident	39 Å²	39	49.8 Å²	49.8	24%	0.239	28%	0.284	C	S	.	.	H	α-helix	trans	-69.6	-37.8	178.9	-57.8	0	0	0	0	112	L899 E900 L901 K907	L899-T903 WeakPolarHBondContact O-CB 3.43Å; L899-T903 PolarHBondContact O-N 3.04Å; L899-T903 PolarHBondContact O-OG1 2.89Å; E900-T903 PolarHBondContact O-N 3.3Å; L901-T903 VanDerWaalsContact C-N 3.29Å; L901-T903 PolarHBondContact O-N 3.35Å; T903-K907 HydrophobicContact CG2-CD 4.32Å; T903-K907 VanDerWaalsContact O-CG 3.27Å; T903-K907 WeakPolarHBondContact O-CG 3.42Å; T903-K907 PolarHBondContact O-N 3.24Å
904	A	92.6	Very high	90.4	Very high	46 Å²	46	54.3 Å²	54.3	38%	0.38	31%	0.306	S	S	.	.	H	α-helix	trans	-65.6	-49.4	175.3	0	0	0	0	0	110.8	E900 L901 K907 A908 L1130	E900-A904 VanDerWaalsContact O-CB 3.28Å; E900-A904 WeakPolarHBondContact O-CB 3.41Å; E900-A904 PolarHBondContact O-N 3.29Å; L901-A904 PolarHBondContact O-N 3.5Å; A904-K907 PolarHBondContact O-N 3.2Å; A904-A908 WeakPolarHBondContact O-CB 3.2Å; A904-A908 PolarHBondContact O-N 2.9Å; A904-L1130 HydrophobicContact CB-CD2 3.94Å
905	W	94.5	Very high	90.8	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-57.4	-53.5	176.1	-177.7	77.8	0	0	0	111.7	F872 L875 E876 I887 L901 K907 A908 V909 Y913 I916 L1130	F872-W905 HydrophobicContact CB-CD2 4.44Å; F872-W905 HydrophobicContact CB-CG 4.27Å; F872-W905 AromaticContact CD1-CD2 3.42Å; F872-W905 HydrophobicContact CD1-CD2 3.42Å; F872-W905 VanDerWaalsContact CD1-CD2 3.42Å; F872-W905 AromaticContact CD1-CE2 3.29Å; F872-W905 AromaticContact CD1-CE3 3.76Å; F872-W905 HydrophobicContact CD1-CE3 3.76Å; F872-W905 AromaticContact CD1-CG 3.97Å; F872-W905 HydrophobicContact CD1-CG 3.97Å; F872-W905 AromaticContact CD1-CH2 3.86Å; F872-W905 HydrophobicContact CD1-CH2 3.86Å; F872-W905 AromaticContact CD1-CZ2 3.53Å; F872-W905 HydrophobicContact CD1-CZ2 3.53Å; F872-W905 AromaticContact CD1-CZ3 3.97Å; F872-W905 HydrophobicContact CD1-CZ3 3.97Å; F872-W905 AromaticContact CD1-NE1 3.75Å; F872-W905 HydrophobicContact CD2-CB 4.16Å; F872-W905 HydrophobicContact CD2-CD2 4.14Å; F872-W905 AromaticContact CD2-CG 3.84Å; F872-W905 HydrophobicContact CD2-CG 3.84Å; F872-W905 AromaticContact CE1-CD2 3.52Å; F872-W905 HydrophobicContact CE1-CD2 3.52Å; F872-W905 AromaticContact CE1-CE2 3.83Å; F872-W905 AromaticContact CE1-CE3 3.35Å; F872-W905 HydrophobicContact CE1-CE3 3.35Å; F872-W905 HydrophobicContact CE1-CG 4.23Å; F872-W905 AromaticContact CE1-CH2 3.83Å; F872-W905 HydrophobicContact CE1-CH2 3.83Å; F872-W905 AromaticContact CE1-CZ2 3.98Å; F872-W905 HydrophobicContact CE1-CZ2 3.98Å; F872-W905 AromaticContact CE1-CZ3 3.51Å; F872-W905 HydrophobicContact CE1-CZ3 3.51Å; F872-W905 HydrophobicContact CE2-CB 4.13Å; F872-W905 HydrophobicContact CE2-CD2 4.19Å; F872-W905 HydrophobicContact CE2-CE3 4.37Å; F872-W905 HydrophobicContact CE2-CG 4.07Å; F872-W905 AromaticContact CG-CD1 3.72Å; F872-W905 AromaticContact CG-CD2 3.76Å; F872-W905 HydrophobicContact CG-CD2 3.76Å; F872-W905 AromaticContact CG-CE2 3.71Å; F872-W905 HydrophobicContact CG-CE3 4.45Å; F872-W905 AromaticContact CG-CG 3.78Å; F872-W905 HydrophobicContact CG-CG 3.78Å; F872-W905 HydrophobicContact CG-CZ2 4.34Å; F872-W905 AromaticContact CG-NE1 3.68Å; F872-W905 AromaticContact CZ-CD2 3.9Å; F872-W905 HydrophobicContact CZ-CD2 3.9Å; F872-W905 AromaticContact CZ-CE3 3.69Å; F872-W905 HydrophobicContact CZ-CE3 3.69Å; F872-W905 HydrophobicContact CZ-CG 4.27Å; F872-W905 HydrophobicContact CZ-CZ3 4.23Å; L875-W905 HydrophobicContact CD2-CH2 3.86Å; L875-W905 HydrophobicContact CD2-CZ2 4.06Å; E876-W905 HydrophobicContact CG-CZ2 4.43Å; E876-W905 PolarHBondContact OE1-NE1 3.3Å; I887-W905 HydrophobicContact CD1-CH2 3.63Å; I887-W905 HydrophobicContact CD1-CZ3 4.19Å; L901-W905 WeakPolarHBondContact O-CB 3.25Å; L901-W905 PolarHBondContact O-N 3.15Å; W905-K907 PolarHBondContact O-N 3.14Å; W905-K907 VanDerWaalsContact O-N 3.09Å; W905-A908 PolarHBondContact O-N 3.24Å; W905-V909 HydrophobicContact CD2-CG2 3.76Å; W905-V909 HydrophobicContact CE3-CG2 3.9Å; W905-V909 HydrophobicContact CG-CG2 4.47Å; W905-V909 HydrophobicContact CH2-CG2 3.78Å; W905-V909 HydrophobicContact CZ2-CB 4.49Å; W905-V909 HydrophobicContact CZ2-CG1 4.29Å; W905-V909 HydrophobicContact CZ2-CG2 3.63Å; W905-V909 HydrophobicContact CZ3-CG2 3.91Å; W905-V909 VanDerWaalsContact O-CG2 3.3Å; W905-V909 WeakPolarHBondContact O-CG2 3.3Å; W905-V909 PolarHBondContact O-N 3.49Å; W905-Y913 HydrophobicContact CH2-CD2 4.45Å; W905-Y913 AromaticContact CH2-CE2 3.88Å; W905-Y913 HydrophobicContact CH2-CE2 3.88Å; W905-Y913 AromaticContact CZ2-CE2 3.86Å; W905-Y913 HydrophobicContact CZ2-CE2 3.86Å; W905-I916 HydrophobicContact CZ3-CD1 4.17Å; W905-L1130 HydrophobicContact CB-CD1 4.11Å; W905-L1130 HydrophobicContact CB-CD2 4.03Å; W905-L1130 HydrophobicContact CB-CG 4.19Å
906	S	92.5	Very high	91.2	Very high	14 Å²	14	53.2 Å²	53.2	10%	0.098	30%	0.298	C	S	.	.	H	α-helix	trans	-59.4	-25.4	-179	-179.6	0	0	0	0	113.8	V902 I916	V902-S906 WeakPolarHBondContact O-CB 3.37Å; V902-S906 PolarHBondContact O-N 3.07Å; S906-I916 WeakPolarHBondContact OG-CG2 3.31Å
907	K	92.3	Very high	91.5	Very high	161 Å²	161	56.3 Å²	56.3	70%	0.7	31%	0.312	S	S	*	.	H	α-helix	trans	-83.2	-32.3	173.1	-74.8	173.3	-179.1	176.5	0	112.6	T903 A904 W905	T903-K907 HydrophobicContact CG2-CD 4.32Å; T903-K907 VanDerWaalsContact O-CG 3.27Å; T903-K907 WeakPolarHBondContact O-CG 3.42Å; T903-K907 PolarHBondContact O-N 3.24Å; A904-K907 PolarHBondContact O-N 3.2Å; W905-K907 PolarHBondContact O-N 3.14Å; W905-K907 VanDerWaalsContact O-N 3.09Å
908	A	91.8	Very high	91.6	Very high	48 Å²	48	53.7 Å²	53.7	40%	0.397	30%	0.301	S	S	.	.	H	α-helix	trans	-76.1	-35.9	-179.4	0	0	0	0	0	112.6	A904 W905 F1129	A904-A908 WeakPolarHBondContact O-CB 3.2Å; A904-A908 PolarHBondContact O-N 2.9Å; W905-A908 PolarHBondContact O-N 3.24Å; A908-F1129 HydrophobicContact CB-CB 3.65Å; A908-F1129 HydrophobicContact CB-CD1 3.59Å; A908-F1129 HydrophobicContact CB-CD2 4.46Å; A908-F1129 HydrophobicContact CB-CE1 4.38Å; A908-F1129 HydrophobicContact CB-CG 3.63Å
909	V	91.5	Very high	91.4	Very high	3 Å²	3	55.4 Å²	55.4	2%	0.018	31%	0.313	C	S	.	.	S	Bend	trans	-96.7	12.3	175.3	-58.2	0	0	0	0	113.8	W905 G911 L912 Y913 I916 F1129	W905-V909 HydrophobicContact CD2-CG2 3.76Å; W905-V909 HydrophobicContact CE3-CG2 3.9Å; W905-V909 HydrophobicContact CG-CG2 4.47Å; W905-V909 HydrophobicContact CH2-CG2 3.78Å; W905-V909 HydrophobicContact CZ2-CB 4.49Å; W905-V909 HydrophobicContact CZ2-CG1 4.29Å; W905-V909 HydrophobicContact CZ2-CG2 3.63Å; W905-V909 HydrophobicContact CZ3-CG2 3.91Å; W905-V909 VanDerWaalsContact O-CG2 3.3Å; W905-V909 WeakPolarHBondContact O-CG2 3.3Å; W905-V909 PolarHBondContact O-N 3.49Å; V909-G911 PolarHBondContact O-N 2.94Å; V909-L912 HydrophobicContact CB-CB 4.4Å; V909-L912 VanDerWaalsContact O-CB 3.24Å; V909-L912 WeakPolarHBondContact O-CB 3.32Å; V909-L912 PolarHBondContact O-N 3.29Å; V909-Y913 HydrophobicContact CB-CD2 4.2Å; V909-Y913 HydrophobicContact CB-CE2 4.06Å; V909-Y913 HydrophobicContact CG2-CD2 4.03Å; V909-Y913 HydrophobicContact CG2-CE2 3.98Å; V909-I916 HydrophobicContact CG2-CD1 3.53Å; V909-F1129 HydrophobicContact CG1-CD2 3.69Å; V909-F1129 HydrophobicContact CG1-CE2 3.62Å; V909-F1129 HydrophobicContact CG1-CZ 4.42Å
910	D	85.8	Confident	90.9	Very high	125 Å²	125	57.6 Å²	57.6	67%	0.668	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	136.3	178.9	-168.7	25.5	0	0	0	110.8	L912	D910-L912 PolarHBondContact O-N 3.28Å
911	G	87.5	Confident	90	Very high	69 Å²	69	52.4 Å²	52.4	71%	0.711	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.7	-6.8	-172.6	0	0	0	0	0	116.6	V909	V909-G911 PolarHBondContact O-N 2.94Å
912	L	91.1	Very high	88.5	Confident	90 Å²	90	58.2 Å²	58.2	47%	0.471	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-41.1	170	-165.3	82.8	0	0	0	111	K882 V909 D910	K882-L912 CarbonylContact C-O 3.47Å; K882-L912 HydrophobicContact CB-CG 4.14Å; K882-L912 WeakPolarHBondContact CB-O 3.2Å; K882-L912 HydrophobicContact CG-CD2 4.1Å; K882-L912 HydrophobicContact CG-CG 4.15Å; V909-L912 HydrophobicContact CB-CB 4.4Å; V909-L912 VanDerWaalsContact O-CB 3.24Å; V909-L912 WeakPolarHBondContact O-CB 3.32Å; V909-L912 PolarHBondContact O-N 3.29Å; D910-L912 PolarHBondContact O-N 3.28Å
913	Y	93	Very high	86.8	Confident	9 Å²	9	62 Å²	62	4%	0.035	35%	0.353	C	S	.	.	S	Bend	trans	-94.9	158.3	-179.9	-67.9	-88.9	0	0	0	111.6	L875 K882 I885 I887 W905 V909 S915 I916	L875-Y913 PolarHBondContact O-OH 3.33Å; K882-Y913 HydrophobicContact CB-CD1 4.17Å; K882-Y913 HydrophobicContact CB-CE1 4.37Å; K882-Y913 HydrophobicContact CD-CD1 4.42Å; K882-Y913 HydrophobicContact CD-CE1 3.77Å; K882-Y913 WeakPolarHBondContact O-CA 3.37Å; I885-Y913 HydrophobicContact CB-CD1 3.98Å; I885-Y913 HydrophobicContact CB-CE1 4.41Å; I885-Y913 HydrophobicContact CG2-CD1 3.9Å; I885-Y913 HydrophobicContact CG2-CE1 4.19Å; I887-Y913 HydrophobicContact CD1-CD1 3.54Å; I887-Y913 HydrophobicContact CD1-CD2 4.14Å; I887-Y913 HydrophobicContact CD1-CE1 3.61Å; I887-Y913 HydrophobicContact CD1-CE2 4.21Å; I887-Y913 HydrophobicContact CD1-CG 3.81Å; I887-Y913 HydrophobicContact CG1-CD1 4.06Å; I887-Y913 HydrophobicContact CG1-CE1 4.48Å; I887-Y913 HydrophobicContact CG1-CG 4.39Å; W905-Y913 HydrophobicContact CH2-CD2 4.45Å; W905-Y913 AromaticContact CH2-CE2 3.88Å; W905-Y913 HydrophobicContact CH2-CE2 3.88Å; W905-Y913 AromaticContact CZ2-CE2 3.86Å; W905-Y913 HydrophobicContact CZ2-CE2 3.86Å; V909-Y913 HydrophobicContact CB-CD2 4.2Å; V909-Y913 HydrophobicContact CB-CE2 4.06Å; V909-Y913 HydrophobicContact CG2-CD2 4.03Å; V909-Y913 HydrophobicContact CG2-CE2 3.98Å; Y913-S915 VanDerWaalsContact C-N 3.27Å; Y913-S915 PolarHBondContact O-N 3.03Å; Y913-I916 HydrophobicContact CD2-CD1 3.96Å; Y913-I916 HydrophobicContact CG-CD1 4.43Å
914	H	92.4	Very high	85.1	Confident	119 Å²	119	65.1 Å²	65.1	55%	0.551	38%	0.382	S	S	*	.	S	Bend	trans	-53.3	-44.8	-179.7	-174.3	77.5	0	0	0	113	K882 D883 I885 A886	K882-H914 PolarHBondContact O-N 2.97Å; D883-H914 WeakPolarHBondContact O-CB 3.32Å; D883-H914 PolarHBondContact O-ND1 3.48Å; D883-H914 VanDerWaalsContact O-ND1 3.15Å; I885-H914 VanDerWaalsContact O-CB 3.31Å; I885-H914 WeakPolarHBondContact O-CB 3.36Å; I885-H914 PolarHBondContact O-N 3.36Å; A886-H914 HydrophobicContact CB-CB 4.27Å
915	S	93.3	Very high	83.4	Confident	36 Å²	36	66 Å²	66	25%	0.252	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.8	149.1	169.7	59.6	0	0	0	0	108.5	I887 Y913	I887-S915 PolarHBondContact N-O 3.23Å; Y913-S915 VanDerWaalsContact C-N 3.27Å; Y913-S915 PolarHBondContact O-N 3.03Å
916	I	93.6	Very high	82.1	Confident	27 Å²	27	67.6 Å²	67.6	14%	0.138	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	117.5	168	-51.5	177.4	0	0	0	107.1	I887 W905 S906 V909 Y913 L918	I887-I916 HydrophobicContact CB-CG1 4.39Å; I887-I916 HydrophobicContact CB-CG2 4.34Å; I887-I916 HydrophobicContact CG2-CG2 4.47Å; I887-I916 WeakPolarHBondContact O-CA 3.21Å; W905-I916 HydrophobicContact CZ3-CD1 4.17Å; S906-I916 WeakPolarHBondContact OG-CG2 3.31Å; V909-I916 HydrophobicContact CG2-CD1 3.53Å; Y913-I916 HydrophobicContact CD2-CD1 3.96Å; Y913-I916 HydrophobicContact CG-CD1 4.43Å; I916-L918 HydrophobicContact CG2-CD2 4.14Å
917	E	92.1	Very high	81	Confident	88 Å²	88	71.4 Å²	71.4	41%	0.411	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	110.4	179.5	-76.4	-174	-99.4	0	0	110.4	I887 F888 V889 K956	I887-E917 PolarHBondContact O-N 3.13Å; F888-E917 WeakPolarHBondContact CA-O 3.44Å; F888-E917 HydrophobicContact CD2-CB 3.99Å; F888-E917 WeakPolarHBondContact CD2-O 3.45Å; V889-E917 PolarHBondContact N-O 2.78Å; E917-K956 WeakPolarHBondContact OE1-CE 3.39Å; E917-K956 IonicContact OE1-NZ 2.67Å; E917-K956 PolarHBondContact OE1-NZ 3.29Å; E917-K956 IonicContact OE2-NZ 3.7Å; E917-K956 PolarHBondContact OE2-NZ 3Å
918	L	91.4	Very high	80.2	Confident	67 Å²	67	67.7 Å²	67.7	35%	0.351	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	130.8	175.5	-54.3	-175.2	0	0	0	110.2	V889 V902 I916	V889-L918 HydrophobicContact CB-CD2 3.65Å; V889-L918 HydrophobicContact CG1-CD2 4.4Å; V889-L918 HydrophobicContact CG2-CD2 3.66Å; V902-L918 HydrophobicContact CG1-CD1 4.35Å; V902-L918 HydrophobicContact CG1-CD2 3.62Å; I916-L918 HydrophobicContact CG2-CD2 4.14Å
919	S	86.2	Confident	79.5	Confident	36 Å²	36	65.8 Å²	65.8	25%	0.252	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	128.2	174.6	-177.1	0	0	0	0	110.1	V889 R890 I891	V889-S919 PolarHBondContact O-N 3.21Å; R890-S919 WeakPolarHBondContact CA-O 3.38Å; R890-S919 WeakPolarHBondContact CD-O 3.37Å; R890-S919 PolarHBondContact NH1-OG 3Å; I891-S919 PolarHBondContact N-O 3.28Å
920	Q	79.6	Confident	78.7	Confident	97 Å²	97	69.5 Å²	69.5	45%	0.453	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	146.1	178.1	-163.7	175.9	0.1	0	0	110.5	R890 V923	R890-Q920 VanDerWaalsContact NH1-C 3.26Å; R890-Q920 PolarHBondContact NH1-O 3.02Å; Q920-V923 HydrophobicContact CG-CG2 4.39Å; Q920-V923 VanDerWaalsContact NE2-CG2 3.33Å
921	S	70.4	Confident	78.2	Confident	7 Å²	7	66.5 Å²	66.5	5%	0.049	42%	0.421	C	S	.	.			trans	-65.9	139.6	164.9	55.5	0	0	0	0	110.9	I891 R893 V923	I891-S921 PolarHBondContact O-N 2.98Å; I891-S921 VanDerWaalsContact O-N 3.14Å; R893-S921 WeakPolarHBondContact CG-OG 3.22Å; R893-S921 PolarHBondContact N-OG 3.16Å; R893-S921 VanDerWaalsContact N-OG 3.13Å; S921-V923 WeakPolarHBondContact O-CG2 3.22Å; S921-V923 PolarHBondContact O-N 3.35Å
922	D	61.8	Low	77.6	Confident	142 Å²	142	64.2 Å²	64.2	76%	0.759	39%	0.392	S	S	*	.			trans	-57	105.4	177.3	-93.5	-45.5	0	0	0	111.7	A924 A925	D922-A924 PolarHBondContact O-N 2.81Å; D922-A924 VanDerWaalsContact O-N 3.11Å; D922-A925 PolarHBondContact O-N 3.02Å
923	V	56.6	Low	76.9	Confident	80 Å²	80	69.4 Å²	69.4	49%	0.485	41%	0.406	S	S	.	.	G	3₁₀ helix	trans	-66	-16.5	-174.8	-165	0	0	0	0	111.9	Q920 S921 A925 G926	Q920-V923 HydrophobicContact CG-CG2 4.39Å; Q920-V923 VanDerWaalsContact NE2-CG2 3.33Å; S921-V923 WeakPolarHBondContact O-CG2 3.22Å; S921-V923 PolarHBondContact O-N 3.35Å; V923-A925 PolarHBondContact O-N 3.02Å; V923-G926 PolarHBondContact O-N 3.33Å
924	A	56.8	Low	76.1	Confident	103 Å²	103	69.3 Å²	69.3	85%	0.851	41%	0.408	S	S	*	.	G	3₁₀ helix	trans	-56.7	-18.3	175.6	0	0	0	0	0	114.1	D922	D922-A924 PolarHBondContact O-N 2.81Å; D922-A924 VanDerWaalsContact O-N 3.11Å
925	A	57.6	Low	75.4	Confident	65 Å²	65	64.1 Å²	64.1	54%	0.537	38%	0.384	S	S	.	.	G	3₁₀ helix	trans	-92	6.4	176.1	0	0	0	0	0	114.7	R893 D922 V923	R893-A925 PolarHBondContact NH1-O 2.9Å; D922-A925 PolarHBondContact O-N 3.02Å; V923-A925 PolarHBondContact O-N 3.02Å
926	G	66	Low	74.8	Confident	33 Å²	33	63.6 Å²	63.6	34%	0.34	38%	0.378	S	S	.	.			trans	87.1	163.9	178.1	0	0	0	0	0	115.1	R893 V923 F928	R893-G926 WeakPolarHBondContact CD-O 3.34Å; R893-G926 PolarHBondContact NH1-O 3.34Å; V923-G926 PolarHBondContact O-N 3.33Å; G926-F928 PolarHBondContact O-N 2.97Å; G926-F928 VanDerWaalsContact O-N 3.09Å
927	N	70.3	Confident	74	Confident	94 Å²	94	62.8 Å²	62.8	50%	0.503	37%	0.374	S	S	.	.	S	Bend	trans	-65.3	-12.7	-171.8	-68.1	17.2	0	0	0	115.6	R893 V895	R893-N927 WeakPolarHBondContact CB-O 3.33Å; V895-N927 HydrophobicContact CG1-CB 3.83Å
928	F	75	Confident	73	Confident	83 Å²	83	60.5 Å²	60.5	36%	0.364	37%	0.367	S	S	.	.	S	Bend	trans	-137.8	147.6	-176.5	-64.6	-70.2	0	0	0	109.6	R893 V895 G926 E932	R893-F928 PolarHBondContact NH1-O 3.1Å; V895-F928 HydrophobicContact CG1-CE1 4.23Å; V895-F928 HydrophobicContact CG1-CE2 4.43Å; V895-F928 HydrophobicContact CG1-CZ 3.92Å; V895-F928 HydrophobicContact CG2-CZ 4.41Å; G926-F928 PolarHBondContact O-N 2.97Å; G926-F928 VanDerWaalsContact O-N 3.09Å; F928-E932 WeakPolarHBondContact CA-OE2 3.35Å; F928-E932 HydrophobicContact CB-CB 4.22Å; F928-E932 WeakPolarHBondContact CB-OE2 3.17Å; F928-E932 HydrophobicContact CD1-CB 4.48Å
929	Y	77.4	Confident	72.5	Confident	9 Å²	9	58.3 Å²	58.3	4%	0.035	36%	0.356	C	S	.	.			trans	-69.3	159.8	170.4	-71.1	-86.4	0	0	0	111.2	D892 R893 G931 E932 T939 E941 R942 Q945	D892-Y929 WeakPolarHBondContact OD1-CE2 3.35Å; D892-Y929 PolarHBondContact OD1-OH 3.02Å; R893-Y929 HydrophobicContact CB-CE2 4.48Å; R893-Y929 HydrophobicContact CG-CD2 4.39Å; R893-Y929 HydrophobicContact CG-CE2 3.85Å; R893-Y929 VanDerWaalsContact NE-CE1 3.32Å; R893-Y929 VanDerWaalsContact NE-CZ 3.27Å; Y929-G931 PolarHBondContact O-N 3.44Å; Y929-E932 WeakPolarHBondContact CD2-OE1 3.16Å; Y929-E932 PolarHBondContact N-OE2 3.46Å; Y929-E932 PolarHBondContact O-N 3.31Å; Y929-E932 VanDerWaalsContact O-N 3.16Å; Y929-T939 WeakPolarHBondContact CB-OG1 3.43Å; Y929-E941 HydrophobicContact CD1-CB 4.2Å; Y929-E941 HydrophobicContact CD1-CG 3.78Å; Y929-E941 HydrophobicContact CE1-CG 4.43Å; Y929-R942 HydrophobicContact CD2-CB 3.76Å; Y929-R942 HydrophobicContact CD2-CG 3.89Å; Y929-R942 HydrophobicContact CE2-CB 4.02Å; Y929-R942 HydrophobicContact CE2-CG 3.76Å; Y929-R942 HydrophobicContact CG-CB 4.06Å; Y929-Q945 HydrophobicContact CE1-CB 4.27Å; Y929-Q945 HydrophobicContact CE1-CG 3.83Å
930	A	74.2	Confident	72	Confident	80 Å²	80	61 Å²	61	66%	0.661	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	111.4	-176.2	0	0	0	0	0	111.1	E941	A930-E941 VanDerWaalsContact CB-OE2 3.3Å; A930-E941 WeakPolarHBondContact CB-OE2 3.31Å; A930-E941 PolarHBondContact N-OE2 2.85Å
931	G	75.5	Confident	72	Confident	62 Å²	62	60.1 Å²	60.1	64%	0.639	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	98.3	3.9	177.3	0	0	0	0	0	116.2	Y929	Y929-G931 PolarHBondContact O-N 3.44Å
932	E	75.6	Confident	72.6	Confident	22 Å²	22	60.8 Å²	60.8	10%	0.103	36%	0.362	C	S	.	.			trans	-67.9	133.8	171.4	-68.9	179.8	156.7	0	0	111.1	R862 F928 Y929 D937 T939 R942	R862-E932 IonicContact CZ-OE1 3Å; R862-E932 IonicContact CZ-OE2 3.83Å; R862-E932 IonicContact NH1-OE1 3.65Å; R862-E932 PolarHBondContact NH1-OE1 3.31Å; R862-E932 IonicContact NH1-OE2 2.85Å; R862-E932 PolarHBondContact NH1-OE2 2.99Å; R862-E932 IonicContact NH2-OE1 3.57Å; R862-E932 PolarHBondContact NH2-OE1 3.47Å; R862-E932 VanDerWaalsContact NH2-OE1 3.07Å; R862-E932 IonicContact NH2-OE2 3.35Å; R862-E932 PolarHBondContact NH2-OE2 3.13Å; F928-E932 WeakPolarHBondContact CA-OE2 3.35Å; F928-E932 HydrophobicContact CB-CB 4.22Å; F928-E932 WeakPolarHBondContact CB-OE2 3.17Å; F928-E932 HydrophobicContact CD1-CB 4.48Å; Y929-E932 WeakPolarHBondContact CD2-OE1 3.16Å; Y929-E932 PolarHBondContact N-OE2 3.46Å; Y929-E932 PolarHBondContact O-N 3.31Å; Y929-E932 VanDerWaalsContact O-N 3.16Å; E932-D937 HydrophobicContact CB-CB 4.16Å; E932-D937 HydrophobicContact CG-CB 4.34Å; E932-T939 HydrophobicContact CB-CG2 4.36Å; E932-T939 HydrophobicContact CG-CG2 3.52Å; E932-R942 WeakPolarHBondContact OE1-CD 3.49Å
933	R	76.1	Confident	73.5	Confident	198 Å²	198	57 Å²	57	75%	0.747	34%	0.338	S	S	*	.			trans	-95.7	-10.3	-179.1	-66.9	162.2	-69.1	174.2	1	114.1	D937	R933-D937 WeakPolarHBondContact CB-OD2 3.18Å; R933-D937 IonicContact CZ-OD1 3.37Å; R933-D937 IonicContact CZ-OD2 2.62Å; R933-D937 PolarHBondContact N-OD2 3.09Å; R933-D937 IonicContact NE-OD1 3.11Å; R933-D937 IonicContact NE-OD2 3.39Å; R933-D937 PolarHBondContact NE-OD2 3.3Å; R933-D937 IonicContact NH2-OD1 2.71Å; R933-D937 PolarHBondContact NH2-OD1 2.9Å; R933-D937 IonicContact NH2-OD2 2.96Å; R933-D937 PolarHBondContact NH2-OD2 2.87Å; R933-D937 VanDerWaalsContact NH2-OD2 3.11Å
934	G	77.2	Confident	74.6	Confident	8 Å²	8	58.6 Å²	58.6	8%	0.082	34%	0.34	C	S	.	.	S	Bend	trans	-174.2	173.3	-174.5	0	0	0	0	0	112.1	F936 D937	G934-F936 PolarHBondContact O-N 2.99Å; G934-F936 VanDerWaalsContact O-N 3.14Å; G934-D937 PolarHBondContact O-N 2.96Å; G934-D937 VanDerWaalsContact O-N 3.16Å
935	P	77.9	Confident	75.7	Confident	9 Å²	9	56.9 Å²	56.9	6%	0.058	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60	-27.3	-172.2	21.6	-32.5	0	0	0	114.7	R862 N863 V895 L1102	R862-P935 PolarHBondContact NE-O 2.92Å; R862-P935 PolarHBondContact NH2-O 2.86Å; N863-P935 HydrophobicContact CB-CB 4.48Å; N863-P935 WeakPolarHBondContact ND2-CB 3.32Å; N863-P935 PolarHBondContact ND2-O 3.26Å; V895-P935 HydrophobicContact CG2-CB 4.48Å; P935-L1102 HydrophobicContact CB-CD2 3.58Å; P935-L1102 HydrophobicContact CB-CG 4.29Å; P935-L1102 HydrophobicContact CG-CD2 3.77Å; P935-L1102 HydrophobicContact CG-CG 4.04Å
936	F	79.1	Confident	77.1	Confident	26 Å²	26	54.1 Å²	54.1	11%	0.114	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.8	3.5	-178.5	-54.3	-72.3	0	0	0	114.4	N863 G934 P1096 A1100 Q1101 L1102	N863-F936 HydrophobicContact CB-CE1 4.34Å; G934-F936 PolarHBondContact O-N 2.99Å; G934-F936 VanDerWaalsContact O-N 3.14Å; F936-P1096 HydrophobicContact CB-CB 4.49Å; F936-P1096 HydrophobicContact CD1-CB 4.27Å; F936-P1096 HydrophobicContact CD1-CG 4.05Å; F936-P1096 HydrophobicContact CD2-CB 3.79Å; F936-P1096 HydrophobicContact CD2-CG 4.26Å; F936-P1096 HydrophobicContact CE1-CB 4.49Å; F936-P1096 HydrophobicContact CE1-CG 3.94Å; F936-P1096 HydrophobicContact CE2-CB 4.01Å; F936-P1096 HydrophobicContact CE2-CG 4.12Å; F936-P1096 HydrophobicContact CG-CB 3.92Å; F936-P1096 HydrophobicContact CG-CG 4.21Å; F936-P1096 HydrophobicContact CZ-CB 4.36Å; F936-P1096 HydrophobicContact CZ-CG 3.97Å; F936-A1100 HydrophobicContact CD2-CB 3.86Å; F936-A1100 HydrophobicContact CE2-CB 4.27Å; F936-Q1101 WeakPolarHBondContact CE2-O 3.31Å; F936-L1102 HydrophobicContact CE2-CD2 4.35Å; F936-L1102 HydrophobicContact CZ-CD2 4.11Å
937	D	77.6	Confident	78	Confident	10 Å²	10	53.4 Å²	53.4	5%	0.053	28%	0.28	C	S	.	.			trans	-70.5	142.8	176	-148.2	3.5	0	0	0	110.3	E932 R933 G934 R942 P1098	E932-D937 HydrophobicContact CB-CB 4.16Å; E932-D937 HydrophobicContact CG-CB 4.34Å; R933-D937 WeakPolarHBondContact CB-OD2 3.18Å; R933-D937 IonicContact CZ-OD1 3.37Å; R933-D937 IonicContact CZ-OD2 2.62Å; R933-D937 PolarHBondContact N-OD2 3.09Å; R933-D937 IonicContact NE-OD1 3.11Å; R933-D937 IonicContact NE-OD2 3.39Å; R933-D937 PolarHBondContact NE-OD2 3.3Å; R933-D937 IonicContact NH2-OD1 2.71Å; R933-D937 PolarHBondContact NH2-OD1 2.9Å; R933-D937 IonicContact NH2-OD2 2.96Å; R933-D937 PolarHBondContact NH2-OD2 2.87Å; R933-D937 VanDerWaalsContact NH2-OD2 3.11Å; G934-D937 PolarHBondContact O-N 2.96Å; G934-D937 VanDerWaalsContact O-N 3.16Å; D937-R942 PolarHBondContact O-NH1 3.03Å; D937-P1098 HydrophobicContact CB-CB 4.41Å
938	C	71.8	Confident	78.7	Confident	40 Å²	40	53.6 Å²	53.6	27%	0.27	28%	0.278	S	S	.	.			trans	-120.2	109.1	175.6	-70.1	0	0	0	0	109.1	R942 Y943	C938-R942 PolarHBondContact SG-NH1 3.27Å; C938-Y943 HydrophobicContact CB-CD1 4.29Å; C938-Y943 HydrophobicContact CB-CE1 3.49Å; C938-Y943 VanDerWaalsContact CB-CE1 3.49Å; C938-Y943 HydrophobicContact CB-CE2 4.12Å; C938-Y943 VanDerWaalsContact CB-OH 3.32Å; C938-Y943 WeakPolarHBondContact CB-OH 2.92Å
939	T	79.7	Confident	79.3	Confident	20 Å²	20	50.3 Å²	50.3	12%	0.123	26%	0.263	C	S	.	.			trans	-85.9	162.6	174.8	54	0	0	0	0	112	Y929 E932 E941 R942 Y943	Y929-T939 WeakPolarHBondContact CB-OG1 3.43Å; E932-T939 HydrophobicContact CB-CG2 4.36Å; E932-T939 HydrophobicContact CG-CG2 3.52Å; T939-E941 PolarHBondContact O-N 2.99Å; T939-R942 WeakPolarHBondContact O-CA 3.44Å; T939-R942 WeakPolarHBondContact O-CB 3.28Å; T939-R942 PolarHBondContact O-N 3.45Å; T939-R942 PolarHBondContact OG1-N 2.98Å; T939-Y943 WeakPolarHBondContact O-CD2 3.25Å; T939-Y943 PolarHBondContact O-N 3.46Å
940	E	77	Confident	80	Confident	93 Å²	93	50.3 Å²	50.3	44%	0.435	26%	0.263	S	S	.	.	H	α-helix	trans	-53.6	-36.8	170.6	-60.6	-77.5	149.3	0	0	112.3	Y943 H944 H1063	E940-Y943 PolarHBondContact O-N 3.44Å; E940-H944 PolarHBondContact O-N 3.3Å; E940-H1063 VanDerWaalsContact CD-ND1 3.28Å; E940-H1063 IonicContact OE1-CE1 2.71Å; E940-H1063 IonicContact OE1-CG 3.18Å; E940-H1063 IonicContact OE1-ND1 3.99Å; E940-H1063 PolarHBondContact OE1-ND1 3Å; E940-H1063 WeakPolarHBondContact OE2-CA 3.37Å; E940-H1063 PolarHBondContact OE2-N 3.43Å; E940-H1063 IonicContact OE2-ND1 3.19Å; E940-H1063 PolarHBondContact OE2-ND1 3.13Å
941	E	78.7	Confident	80.8	Confident	78 Å²	78	48.1 Å²	48.1	36%	0.364	24%	0.239	S	C	.	.	H	α-helix	trans	-63.4	-45.3	175.7	-166.9	-169.7	172.6	0	0	111	R893 Y929 A930 T939 H944 Q945	R893-E941 IonicContact NH2-OE1 2.69Å; Y929-E941 HydrophobicContact CD1-CB 4.2Å; Y929-E941 HydrophobicContact CD1-CG 3.78Å; Y929-E941 HydrophobicContact CE1-CG 4.43Å; A930-E941 VanDerWaalsContact CB-OE2 3.3Å; A930-E941 WeakPolarHBondContact CB-OE2 3.31Å; A930-E941 PolarHBondContact N-OE2 2.85Å; T939-E941 PolarHBondContact O-N 2.99Å; E941-H944 PolarHBondContact O-N 3.02Å; E941-Q945 WeakPolarHBondContact O-CG 3.35Å; E941-Q945 PolarHBondContact O-N 3.43Å
942	R	82.1	Confident	81.6	Confident	22 Å²	22	51.1 Å²	51.1	8%	0.083	23%	0.232	C	C	.	.	H	α-helix	trans	-62.2	-47.3	174.5	-170.8	-174.8	-178.1	-162.7	-20.9	111.2	R862 D892 Y929 E932 D937 C938 T939 H944 Q945 L946	R862-R942 VanDerWaalsContact NH1-CD 3.35Å; R862-R942 VanDerWaalsContact NH1-NE 3.17Å; D892-R942 IonicContact OD2-CZ 2.97Å; D892-R942 IonicContact OD2-NE 2.6Å; D892-R942 PolarHBondContact OD2-NE 2.93Å; D892-R942 IonicContact OD2-NH2 2.78Å; Y929-R942 HydrophobicContact CD2-CB 3.76Å; Y929-R942 HydrophobicContact CD2-CG 3.89Å; Y929-R942 HydrophobicContact CE2-CB 4.02Å; Y929-R942 HydrophobicContact CE2-CG 3.76Å; Y929-R942 HydrophobicContact CG-CB 4.06Å; E932-R942 WeakPolarHBondContact OE1-CD 3.49Å; D937-R942 PolarHBondContact O-NH1 3.03Å; C938-R942 PolarHBondContact SG-NH1 3.27Å; T939-R942 WeakPolarHBondContact O-CA 3.44Å; T939-R942 WeakPolarHBondContact O-CB 3.28Å; T939-R942 PolarHBondContact O-N 3.45Å; T939-R942 PolarHBondContact OG1-N 2.98Å; R942-H944 VanDerWaalsContact C-N 3.31Å; R942-H944 PolarHBondContact O-N 3.1Å; R942-Q945 CarbonylContact O-C 3.55Å; R942-Q945 PolarHBondContact O-N 3.27Å; R942-Q945 VanDerWaalsContact O-N 3.11Å; R942-L946 HydrophobicContact CG-CD1 4.11Å; R942-L946 HydrophobicContact CG-CG 4.22Å; R942-L946 VanDerWaalsContact O-CG 3.31Å; R942-L946 WeakPolarHBondContact O-CG 3.44Å; R942-L946 PolarHBondContact O-N 3.13Å
943	Y	80.7	Confident	82.4	Confident	63 Å²	63	50.1 Å²	50.1	25%	0.247	23%	0.227	C	C	.	.	H	α-helix	trans	-58.6	-39.4	177.8	-68.5	-44.9	0	0	0	113.1	C938 T939 E940 L946 S947 D1065	C938-Y943 HydrophobicContact CB-CD1 4.29Å; C938-Y943 HydrophobicContact CB-CE1 3.49Å; C938-Y943 VanDerWaalsContact CB-CE1 3.49Å; C938-Y943 HydrophobicContact CB-CE2 4.12Å; C938-Y943 VanDerWaalsContact CB-OH 3.32Å; C938-Y943 WeakPolarHBondContact CB-OH 2.92Å; T939-Y943 WeakPolarHBondContact O-CD2 3.25Å; T939-Y943 PolarHBondContact O-N 3.46Å; E940-Y943 PolarHBondContact O-N 3.44Å; Y943-L946 PolarHBondContact O-N 3.3Å; Y943-S947 WeakPolarHBondContact O-CB 3.5Å; Y943-S947 PolarHBondContact O-N 2.96Å; Y943-S947 PolarHBondContact O-OG 2.78Å; Y943-D1065 HydrophobicContact CD1-CB 3.31Å; Y943-D1065 HydrophobicContact CD2-CB 4.21Å; Y943-D1065 HydrophobicContact CE1-CB 3.39Å; Y943-D1065 HydrophobicContact CE2-CB 4.29Å; Y943-D1065 HydrophobicContact CG-CB 3.76Å
944	H	79.5	Confident	83.3	Confident	112 Å²	112	40.7 Å²	40.7	52%	0.519	19%	0.192	S	C	.	.	H	α-helix	trans	-61.8	-48.7	172.9	-170.6	-76.8	0	0	0	111.3	E940 E941 R942 L946 S947 E948	E940-H944 PolarHBondContact O-N 3.3Å; E941-H944 PolarHBondContact O-N 3.02Å; R942-H944 VanDerWaalsContact C-N 3.31Å; R942-H944 PolarHBondContact O-N 3.1Å; H944-L946 VanDerWaalsContact C-N 3.35Å; H944-L946 PolarHBondContact O-N 3.22Å; H944-S947 WeakPolarHBondContact O-CB 3.28Å; H944-S947 PolarHBondContact O-N 3.01Å; H944-E948 IonicContact CE1-OE1 3.65Å; H944-E948 IonicContact CE1-OE2 3.86Å; H944-E948 PolarHBondContact CE1-OE2 2.83Å; H944-E948 VanDerWaalsContact CE1-OE2 3.24Å; H944-E948 IonicContact ND1-OE2 2.88Å; H944-E948 PolarHBondContact ND1-OE2 3.16Å; H944-E948 PolarHBondContact O-N 3.43Å
945	Q	82	Confident	84.1	Confident	68 Å²	68	42.2 Å²	42.2	32%	0.318	20%	0.2	S	C	.	.	H	α-helix	trans	-64.4	-36.3	179.2	-70.5	-60.8	-52.9	0	0	113	Y929 E941 R942 E948 W949	Y929-Q945 HydrophobicContact CE1-CB 4.27Å; Y929-Q945 HydrophobicContact CE1-CG 3.83Å; E941-Q945 WeakPolarHBondContact O-CG 3.35Å; E941-Q945 PolarHBondContact O-N 3.43Å; R942-Q945 CarbonylContact O-C 3.55Å; R942-Q945 PolarHBondContact O-N 3.27Å; R942-Q945 VanDerWaalsContact O-N 3.11Å; Q945-E948 PolarHBondContact NE2-OE2 3.28Å; Q945-W949 VanDerWaalsContact O-CB 3.3Å; Q945-W949 WeakPolarHBondContact O-CB 3.38Å; Q945-W949 PolarHBondContact O-N 3.41Å
946	L	85.6	Confident	84.8	Confident	7 Å²	7	43 Å²	43	4%	0.037	20%	0.202	C	C	.	.	H	α-helix	trans	-67.1	-38.4	172.9	-67.6	-180	0	0	0	111.7	L860 R942 Y943 H944 W949 K950 E1066	L860-L946 HydrophobicContact CD1-CD2 3.61Å; L860-L946 HydrophobicContact CD2-CD1 4.29Å; L860-L946 HydrophobicContact CD2-CD2 3.58Å; L860-L946 HydrophobicContact CG-CD2 4.26Å; R942-L946 HydrophobicContact CG-CD1 4.11Å; R942-L946 HydrophobicContact CG-CG 4.22Å; R942-L946 VanDerWaalsContact O-CG 3.31Å; R942-L946 WeakPolarHBondContact O-CG 3.44Å; R942-L946 PolarHBondContact O-N 3.13Å; Y943-L946 PolarHBondContact O-N 3.3Å; H944-L946 VanDerWaalsContact C-N 3.35Å; H944-L946 PolarHBondContact O-N 3.22Å; L946-W949 PolarHBondContact O-N 2.89Å; L946-K950 WeakPolarHBondContact O-CB 3.42Å; L946-K950 WeakPolarHBondContact O-CG 3.49Å; L946-K950 PolarHBondContact O-N 2.97Å; L946-E1066 HydrophobicContact CB-CB 4.26Å; L946-E1066 HydrophobicContact CB-CG 3.95Å
947	S	84.7	Confident	85.6	Confident	18 Å²	18	41.7 Å²	41.7	13%	0.126	20%	0.197	C	C	.	.	H	α-helix	trans	-66.9	-44.3	175.3	-59.4	0	0	0	0	112	Y943 H944 W949 K950 Q951 F1055 E1066	Y943-S947 WeakPolarHBondContact O-CB 3.5Å; Y943-S947 PolarHBondContact O-N 2.96Å; Y943-S947 PolarHBondContact O-OG 2.78Å; H944-S947 WeakPolarHBondContact O-CB 3.28Å; H944-S947 PolarHBondContact O-N 3.01Å; S947-W949 VanDerWaalsContact C-N 3.34Å; S947-W949 PolarHBondContact O-N 3.34Å; S947-K950 PolarHBondContact O-N 3.37Å; S947-Q951 WeakPolarHBondContact O-CB 3.35Å; S947-Q951 PolarHBondContact O-N 2.98Å; S947-F1055 WeakPolarHBondContact O-CB 3.38Å; S947-E1066 VanDerWaalsContact OG-CB 3.26Å; S947-E1066 WeakPolarHBondContact OG-CB 3.19Å
948	E	85.9	Confident	86.4	Confident	98 Å²	98	44.4 Å²	44.4	46%	0.458	21%	0.206	S	C	.	.	H	α-helix	trans	-62	-41.3	173.4	-73.1	-175.1	118.6	0	0	111.8	H944 Q945 Q951 Y952	H944-E948 IonicContact CE1-OE1 3.65Å; H944-E948 IonicContact CE1-OE2 3.86Å; H944-E948 PolarHBondContact CE1-OE2 2.83Å; H944-E948 VanDerWaalsContact CE1-OE2 3.24Å; H944-E948 IonicContact ND1-OE2 2.88Å; H944-E948 PolarHBondContact ND1-OE2 3.16Å; H944-E948 PolarHBondContact O-N 3.43Å; Q945-E948 PolarHBondContact NE2-OE2 3.28Å; E948-Q951 PolarHBondContact O-N 3.3Å; E948-Y952 WeakPolarHBondContact O-CB 3.47Å; E948-Y952 PolarHBondContact O-N 2.96Å
949	W	88.4	Confident	87.5	Confident	14 Å²	14	51.7 Å²	51.7	5%	0.053	23%	0.228	C	C	.	.	H	α-helix	trans	-66	-48.2	176.1	169.7	64.5	0	0	0	112.7	C858 L860 F888 R890 Q945 L946 S947 Q951 Y952 A953	C858-W949 HydrophobicContact CB-CZ2 4.4Å; L860-W949 HydrophobicContact CB-CH2 3.79Å; L860-W949 HydrophobicContact CB-CZ3 3.76Å; L860-W949 HydrophobicContact CD1-CE3 4.18Å; L860-W949 HydrophobicContact CD1-CH2 4.44Å; L860-W949 HydrophobicContact CD1-CZ3 3.98Å; L860-W949 HydrophobicContact CD2-CZ3 4.41Å; L860-W949 HydrophobicContact CG-CZ3 4.26Å; F888-W949 AromaticContact CD1-NE1 3.75Å; F888-W949 AromaticContact CE1-CD1 3.75Å; F888-W949 AromaticContact CE1-NE1 3.11Å; F888-W949 AromaticContact CZ-NE1 3.79Å; R890-W949 HydrophobicContact CB-CD2 3.82Å; R890-W949 HydrophobicContact CB-CG 4.11Å; R890-W949 HydrophobicContact CB-CH2 4.42Å; R890-W949 HydrophobicContact CB-CZ2 3.66Å; R890-W949 VanDerWaalsContact CB-NE1 3.31Å; R890-W949 HydrophobicContact CG-CD2 3.96Å; R890-W949 HydrophobicContact CG-CG 3.86Å; Q945-W949 VanDerWaalsContact O-CB 3.3Å; Q945-W949 WeakPolarHBondContact O-CB 3.38Å; Q945-W949 PolarHBondContact O-N 3.41Å; L946-W949 PolarHBondContact O-N 2.89Å; S947-W949 VanDerWaalsContact C-N 3.34Å; S947-W949 PolarHBondContact O-N 3.34Å; W949-Q951 VanDerWaalsContact C-N 3.28Å; W949-Q951 PolarHBondContact O-N 2.93Å; W949-Y952 WeakPolarHBondContact O-CB 3.3Å; W949-Y952 PolarHBondContact O-N 3.47Å; W949-Y952 VanDerWaalsContact O-N 3.11Å; W949-A953 WeakPolarHBondContact O-CB 3.22Å; W949-A953 PolarHBondContact O-N 3.13Å
950	K	90.4	Very high	88.1	Confident	9 Å²	9	54 Å²	54	4%	0.039	24%	0.238	C	C	.	.	H	α-helix	trans	-63.4	-35	176.1	-69.7	-173.7	-176.4	168.1	0	110.9	L946 S947 A953 L954 Y967 F1055 E1066	L946-K950 WeakPolarHBondContact O-CB 3.42Å; L946-K950 WeakPolarHBondContact O-CG 3.49Å; L946-K950 PolarHBondContact O-N 2.97Å; S947-K950 PolarHBondContact O-N 3.37Å; K950-A953 PolarHBondContact O-N 3.41Å; K950-L954 WeakPolarHBondContact O-CB 3.48Å; K950-L954 PolarHBondContact O-N 3.46Å; K950-Y967 HydrophobicContact CB-CE1 3.98Å; K950-Y967 HydrophobicContact CD-CD1 4.31Å; K950-Y967 HydrophobicContact CD-CE1 4.38Å; K950-Y967 HydrophobicContact CG-CD1 4.17Å; K950-Y967 HydrophobicContact CG-CE1 3.86Å; K950-Y967 PolarHBondContact O-OH 3.27Å; K950-F1055 HydrophobicContact CB-CD1 3.62Å; K950-F1055 HydrophobicContact CB-CD2 3.81Å; K950-F1055 HydrophobicContact CB-CE1 3.58Å; K950-F1055 HydrophobicContact CB-CE2 3.8Å; K950-F1055 HydrophobicContact CB-CG 3.73Å; K950-F1055 HydrophobicContact CB-CZ 3.68Å; K950-F1055 HydrophobicContact CD-CD1 4.2Å; K950-F1055 HydrophobicContact CD-CE1 3.58Å; K950-F1055 HydrophobicContact CD-CZ 4.02Å; K950-F1055 HydrophobicContact CG-CE1 4.15Å; K950-F1055 HydrophobicContact CG-CZ 4.35Å; K950-E1066 HydrophobicContact CD-CB 4.34Å; K950-E1066 HydrophobicContact CD-CG 3.57Å; K950-E1066 IonicContact NZ-OE1 2.69Å; K950-E1066 PolarHBondContact NZ-OE1 2.85Å
951	Q	91.7	Very high	88.9	Confident	34 Å²	34	60.3 Å²	60.3	16%	0.159	26%	0.258	C	S	.	.	H	α-helix	trans	-62.5	-45.1	169.9	-178.4	58.4	32.8	0	0	112.7	S947 E948 W949 A953 L954 T955 T1054 F1055 A1056	S947-Q951 WeakPolarHBondContact O-CB 3.35Å; S947-Q951 PolarHBondContact O-N 2.98Å; E948-Q951 PolarHBondContact O-N 3.3Å; W949-Q951 VanDerWaalsContact C-N 3.28Å; W949-Q951 PolarHBondContact O-N 2.93Å; Q951-A953 VanDerWaalsContact C-N 3.35Å; Q951-L954 PolarHBondContact O-N 3.3Å; Q951-T955 PolarHBondContact NE2-OG1 3.17Å; Q951-T955 VanDerWaalsContact NE2-OG1 3.08Å; Q951-T955 WeakPolarHBondContact O-CB 3.37Å; Q951-T955 PolarHBondContact O-N 3.15Å; Q951-T955 PolarHBondContact O-OG1 3.47Å; Q951-T1054 PolarHBondContact OE1-OG1 3.06Å; Q951-T1054 VanDerWaalsContact OE1-OG1 3.1Å; Q951-F1055 HydrophobicContact CB-CB 4.06Å; Q951-A1056 HydrophobicContact CG-CB 3.99Å
952	Y	92.4	Very high	89.6	Confident	125 Å²	125	57 Å²	57	49%	0.49	24%	0.244	S	C	.	.	H	α-helix	trans	-60.9	-45.8	178	176.1	-85.4	0	0	0	110.7	F888 E948 W949 T955 K956	F888-Y952 AromaticContact CE1-CD1 3.66Å; F888-Y952 HydrophobicContact CE1-CD1 3.66Å; F888-Y952 AromaticContact CE1-CE1 3.87Å; F888-Y952 HydrophobicContact CE1-CE1 3.87Å; F888-Y952 HydrophobicContact CE2-CE1 4.17Å; F888-Y952 AromaticContact CZ-CD1 3.63Å; F888-Y952 HydrophobicContact CZ-CD1 3.63Å; F888-Y952 AromaticContact CZ-CE1 3.45Å; F888-Y952 HydrophobicContact CZ-CE1 3.45Å; F888-Y952 VanDerWaalsContact CZ-CE1 3.45Å; E948-Y952 WeakPolarHBondContact O-CB 3.47Å; E948-Y952 PolarHBondContact O-N 2.96Å; W949-Y952 WeakPolarHBondContact O-CB 3.3Å; W949-Y952 PolarHBondContact O-N 3.47Å; W949-Y952 VanDerWaalsContact O-N 3.11Å; Y952-T955 PolarHBondContact O-N 2.92Å; Y952-K956 HydrophobicContact CE1-CD 3.97Å; Y952-K956 VanDerWaalsContact O-CB 3.3Å; Y952-K956 WeakPolarHBondContact O-CB 3.37Å; Y952-K956 PolarHBondContact O-N 3.09Å
953	A	92.9	Very high	90.3	Very high	0 Å²	0	58.1 Å²	58.1	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-58.6	-47.5	175.9	0	0	0	0	0	112.4	C858 F888 W949 K950 Q951 T955 K956 A957 I965 Y967	C858-A953 HydrophobicContact CB-CB 4.43Å; F888-A953 HydrophobicContact CD1-CB 3.96Å; F888-A953 HydrophobicContact CE1-CB 4.1Å; W949-A953 WeakPolarHBondContact O-CB 3.22Å; W949-A953 PolarHBondContact O-N 3.13Å; K950-A953 PolarHBondContact O-N 3.41Å; Q951-A953 VanDerWaalsContact C-N 3.35Å; A953-T955 VanDerWaalsContact C-N 3.33Å; A953-T955 PolarHBondContact O-N 3.32Å; A953-K956 WeakPolarHBondContact O-CB 3.48Å; A953-K956 PolarHBondContact O-N 3Å; A953-A957 PolarHBondContact O-N 3.18Å; A953-I965 HydrophobicContact CB-CD1 4.41Å; A953-Y967 HydrophobicContact CB-CE1 4.1Å
954	L	93.8	Very high	91.1	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-59.8	-42.2	174.4	-173.6	57.9	0	0	0	112.5	K950 Q951 K956 R958 I965 Y967 L1045 I1053 F1055	K950-L954 WeakPolarHBondContact O-CB 3.48Å; K950-L954 PolarHBondContact O-N 3.46Å; Q951-L954 PolarHBondContact O-N 3.3Å; L954-K956 VanDerWaalsContact C-N 3.32Å; L954-R958 WeakPolarHBondContact O-CG 3.5Å; L954-R958 PolarHBondContact O-N 3.43Å; L954-I965 HydrophobicContact CD1-CG2 4.12Å; L954-Y967 WeakPolarHBondContact CB-OH 3.42Å; L954-Y967 PolarHBondContact N-OH 3.25Å; L954-L1045 HydrophobicContact CD1-CD2 3.86Å; L954-I1053 HydrophobicContact CD2-CG2 4.25Å; L954-I1053 WeakPolarHBondContact CD2-O 3.48Å; L954-F1055 HydrophobicContact CD2-CD2 4.18Å; L954-F1055 HydrophobicContact CD2-CE2 4.22Å
955	T	94.2	Very high	92	Very high	40 Å²	40	50 Å²	50	25%	0.245	22%	0.216	C	C	.	.	H	α-helix	trans	-67.1	-36.6	178.3	-55.1	0	0	0	0	111.1	Q951 Y952 A953 R959	Q951-T955 PolarHBondContact NE2-OG1 3.17Å; Q951-T955 VanDerWaalsContact NE2-OG1 3.08Å; Q951-T955 WeakPolarHBondContact O-CB 3.37Å; Q951-T955 PolarHBondContact O-N 3.15Å; Q951-T955 PolarHBondContact O-OG1 3.47Å; Y952-T955 PolarHBondContact O-N 2.92Å; A953-T955 VanDerWaalsContact C-N 3.33Å; A953-T955 PolarHBondContact O-N 3.32Å; T955-R959 WeakPolarHBondContact O-CB 3.43Å; T955-R959 VanDerWaalsContact O-CG 3.3Å; T955-R959 WeakPolarHBondContact O-CG 3.28Å; T955-R959 PolarHBondContact O-N 2.77Å
956	K	93.4	Very high	92.7	Very high	25 Å²	25	46.8 Å²	46.8	11%	0.109	20%	0.201	C	C	.	.	H	α-helix	trans	-67.5	-48.8	177.2	-177.8	171.9	-178	169.5	0	112	L856 F888 E917 Y952 A953 L954 R958 R959 M960	L856-K956 HydrophobicContact CD2-CG 4.46Å; F888-K956 HydrophobicContact CG-CD 4.48Å; E917-K956 WeakPolarHBondContact OE1-CE 3.39Å; E917-K956 IonicContact OE1-NZ 2.67Å; E917-K956 PolarHBondContact OE1-NZ 3.29Å; E917-K956 IonicContact OE2-NZ 3.7Å; E917-K956 PolarHBondContact OE2-NZ 3Å; Y952-K956 HydrophobicContact CE1-CD 3.97Å; Y952-K956 VanDerWaalsContact O-CB 3.3Å; Y952-K956 WeakPolarHBondContact O-CB 3.37Å; Y952-K956 PolarHBondContact O-N 3.09Å; A953-K956 WeakPolarHBondContact O-CB 3.48Å; A953-K956 PolarHBondContact O-N 3Å; L954-K956 VanDerWaalsContact C-N 3.32Å; K956-R958 VanDerWaalsContact C-N 3.28Å; K956-R958 PolarHBondContact O-N 2.87Å; K956-R959 PolarHBondContact O-N 2.91Å; K956-M960 WeakPolarHBondContact O-CG 3.34Å; K956-M960 PolarHBondContact O-N 2.8Å
957	A	95.2	Very high	93.2	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-54.2	-45	174.9	0	0	0	0	0	112	L856 A953 M960 W961 A962 I965 L1045	L856-A957 HydrophobicContact CB-CB 4.09Å; L856-A957 HydrophobicContact CD2-CB 3.72Å; A953-A957 PolarHBondContact O-N 3.18Å; A957-M960 WeakPolarHBondContact O-CG 3.41Å; A957-M960 PolarHBondContact O-N 2.83Å; A957-W961 PolarHBondContact O-N 2.85Å; A957-A962 HydrophobicContact CB-CB 4.14Å; A957-A962 PolarHBondContact O-N 3.36Å; A957-I965 HydrophobicContact CB-CB 4.01Å; A957-I965 HydrophobicContact CB-CD1 3.89Å; A957-I965 HydrophobicContact CB-CG1 4.28Å; A957-L1045 HydrophobicContact CB-CD1 3.45Å; A957-L1045 VanDerWaalsContact CB-CD1 3.45Å
958	R	94.5	Very high	93.7	Very high	66 Å²	66	46.1 Å²	46.1	25%	0.249	20%	0.195	C	C	.	.	H	α-helix	trans	-63.1	-39.8	174.5	-69.9	172.5	179.2	159.5	2.6	113	L954 K956 W961 S1050 I1053	L954-R958 WeakPolarHBondContact O-CG 3.5Å; L954-R958 PolarHBondContact O-N 3.43Å; K956-R958 VanDerWaalsContact C-N 3.28Å; K956-R958 PolarHBondContact O-N 2.87Å; R958-W961 PolarHBondContact O-N 3.14Å; R958-S1050 PolarHBondContact NH2-O 2.92Å; R958-I1053 PolarHBondContact NH1-O 3.03Å; R958-I1053 PolarHBondContact NH2-O 3.12Å
959	R	94	Very high	94	Very high	194 Å²	194	42.8 Å²	42.8	73%	0.732	18%	0.181	S	C	*	.	H	α-helix	trans	-71.9	-31.9	179.2	-78	176.7	-179.4	-178	2.2	113.7	T955 K956 W961	T955-R959 WeakPolarHBondContact O-CB 3.43Å; T955-R959 VanDerWaalsContact O-CG 3.3Å; T955-R959 WeakPolarHBondContact O-CG 3.28Å; T955-R959 PolarHBondContact O-N 2.77Å; K956-R959 PolarHBondContact O-N 2.91Å; R959-W961 VanDerWaalsContact C-N 3.31Å; R959-W961 VanDerWaalsContact O-CD1 3.27Å
960	M	93	Very high	94.2	Very high	68 Å²	68	42.1 Å²	42.1	34%	0.335	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.1	4.4	176.3	74.7	-171.9	-70.1	0	0	113.6	L856 A886 K956 A957 A962	L856-M960 HydrophobicContact CB-SD 4.37Å; L856-M960 HydrophobicContact CD1-CE 4.46Å; L856-M960 HydrophobicContact CD1-SD 3.88Å; L856-M960 HydrophobicContact CD2-SD 4.18Å; L856-M960 HydrophobicContact CG-SD 4.36Å; A886-M960 HydrophobicContact CB-CE 3.54Å; K956-M960 WeakPolarHBondContact O-CG 3.34Å; K956-M960 PolarHBondContact O-N 2.8Å; A957-M960 WeakPolarHBondContact O-CG 3.41Å; A957-M960 PolarHBondContact O-N 2.83Å; M960-A962 VanDerWaalsContact C-N 3.28Å; M960-A962 HydrophobicContact CG-CB 4.05Å; M960-A962 PolarHBondContact O-N 3.01Å
961	W	93.2	Very high	94.1	Very high	225 Å²	225	42.5 Å²	42.5	85%	0.852	18%	0.181	S	C	*	.	T	Hydrogen-bonded Turn	trans	58	40	-179.9	-55.9	64.3	0	0	0	112.5	T854 A957 R958 R959	T854-W961 PolarHBondContact OG1-O 3.26Å; A957-W961 PolarHBondContact O-N 2.85Å; R958-W961 PolarHBondContact O-N 3.14Å; R959-W961 VanDerWaalsContact C-N 3.31Å; R959-W961 VanDerWaalsContact O-CD1 3.27Å
962	A	94.9	Very high	94.2	Very high	8 Å²	8	41 Å²	41	7%	0.066	17%	0.173	C	C	.	.			trans	-68.7	130.6	170.3	0	0	0	0	0	109.9	T854 L856 A957 M960 F964	T854-A962 WeakPolarHBondContact OG1-CA 3.1Å; L856-A962 HydrophobicContact CB-CB 4.24Å; A957-A962 HydrophobicContact CB-CB 4.14Å; A957-A962 PolarHBondContact O-N 3.36Å; M960-A962 VanDerWaalsContact C-N 3.28Å; M960-A962 HydrophobicContact CG-CB 4.05Å; M960-A962 PolarHBondContact O-N 3.01Å; A962-F964 VanDerWaalsContact C-N 3.3Å
963	D	96.1	Very high	94.2	Very high	46 Å²	46	35 Å²	35	25%	0.246	15%	0.15	C	C	.	.	S	Bend	trans	-65.7	-36.3	176.3	-71.4	-60.6	0	0	0	111.5	P853 T854 L1045 R1046	P853-D963 VanDerWaalsContact CA-OD2 3.22Å; P853-D963 WeakPolarHBondContact CA-OD2 3.32Å; P853-D963 HydrophobicContact CB-CB 3.7Å; T854-D963 PolarHBondContact N-OD2 3.34Å; T854-D963 WeakPolarHBondContact O-CB 3.2Å; T854-D963 PolarHBondContact O-N 2.9Å; T854-D963 VanDerWaalsContact O-N 3.12Å; T854-D963 PolarHBondContact OG1-N 2.96Å; T854-D963 PolarHBondContact OG1-OD2 2.95Å; D963-L1045 WeakPolarHBondContact O-CB 3.42Å; D963-L1045 PolarHBondContact O-N 2.87Å; D963-R1046 HydrophobicContact CB-CG 3.88Å; D963-R1046 WeakPolarHBondContact OD1-CD 3.26Å; D963-R1046 VanDerWaalsContact OD1-CG 3.31Å; D963-R1046 WeakPolarHBondContact OD1-CG 3.31Å
964	F	97.5	Very high	94.2	Very high	5 Å²	5	35.2 Å²	35.2	2%	0.022	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	155.6	178.1	-67.5	-94.1	0	0	0	112	P853 T854 V855 L856 A962 M984 L1042 I1043 D1044	P853-F964 HydrophobicContact CB-CD2 3.77Å; P853-F964 HydrophobicContact CB-CE2 3.69Å; P853-F964 HydrophobicContact CG-CE2 3.95Å; T854-F964 PolarHBondContact O-N 3.08Å; V855-F964 WeakPolarHBondContact CA-O 3.48Å; V855-F964 HydrophobicContact CG1-CB 4.33Å; V855-F964 HydrophobicContact CG2-CB 4.38Å; L856-F964 PolarHBondContact N-O 3.25Å; A962-F964 VanDerWaalsContact C-N 3.3Å; F964-M984 HydrophobicContact CD1-CG 4.37Å; F964-M984 HydrophobicContact CD2-CE 3.82Å; F964-M984 HydrophobicContact CD2-CG 4.29Å; F964-M984 HydrophobicContact CD2-SD 4.21Å; F964-M984 HydrophobicContact CE1-CG 3.9Å; F964-M984 HydrophobicContact CE2-CE 4.15Å; F964-M984 HydrophobicContact CE2-CG 3.82Å; F964-M984 HydrophobicContact CE2-SD 3.91Å; F964-M984 HydrophobicContact CG-CE 4.13Å; F964-M984 HydrophobicContact CZ-CB 4.04Å; F964-M984 HydrophobicContact CZ-CG 3.59Å; F964-M984 HydrophobicContact CZ-SD 4.3Å; F964-L1042 HydrophobicContact CB-CD1 3.92Å; F964-L1042 HydrophobicContact CD1-CD1 3.99Å; F964-L1042 HydrophobicContact CD1-CD2 4.09Å; F964-L1042 HydrophobicContact CD1-CG 3.93Å; F964-L1042 HydrophobicContact CE1-CD2 4.3Å; F964-L1042 HydrophobicContact CG-CD1 4.27Å; F964-I1043 WeakPolarHBondContact CA-O 3.47Å; F964-D1044 HydrophobicContact CD1-CB 3.98Å; F964-D1044 HydrophobicContact CE1-CB 3.61Å; F964-D1044 HydrophobicContact CZ-CB 4.39Å
965	I	97.3	Very high	94	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	132.8	163.7	-176.5	173.2	0	0	0	109.1	L856 A953 L954 A957 Y967 L1042 I1043 L1045	L856-I965 HydrophobicContact CB-CG1 4.42Å; L856-I965 HydrophobicContact CD2-CD1 4.41Å; L856-I965 CarbonylContact O-C 3.58Å; L856-I965 VanDerWaalsContact O-CA 3.3Å; L856-I965 WeakPolarHBondContact O-CA 3.48Å; L856-I965 WeakPolarHBondContact O-CG1 3.4Å; A953-I965 HydrophobicContact CB-CD1 4.41Å; L954-I965 HydrophobicContact CD1-CG2 4.12Å; A957-I965 HydrophobicContact CB-CB 4.01Å; A957-I965 HydrophobicContact CB-CD1 3.89Å; A957-I965 HydrophobicContact CB-CG1 4.28Å; I965-Y967 HydrophobicContact CD1-CE1 4.19Å; I965-Y967 HydrophobicContact CD1-CE2 3.73Å; I965-Y967 VanDerWaalsContact CD1-CZ 3.48Å; I965-Y967 VanDerWaalsContact CD1-OH 3.24Å; I965-Y967 WeakPolarHBondContact CD1-OH 3.32Å; I965-Y967 HydrophobicContact CG1-CD2 4.47Å; I965-Y967 HydrophobicContact CG1-CE2 4Å; I965-Y967 HydrophobicContact CG2-CE2 4.27Å; I965-L1042 WeakPolarHBondContact O-CA 3.45Å; I965-I1043 HydrophobicContact CG2-CB 3.77Å; I965-I1043 HydrophobicContact CG2-CG1 4.42Å; I965-I1043 PolarHBondContact N-O 3.2Å; I965-I1043 PolarHBondContact O-N 2.96Å; I965-L1045 HydrophobicContact CB-CD1 4.02Å; I965-L1045 HydrophobicContact CG2-CD1 3.89Å; I965-L1045 HydrophobicContact CG2-CD2 3.91Å; I965-L1045 HydrophobicContact CG2-CG 3.98Å
966	F	97.2	Very high	93.8	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	107.1	179.3	-170.2	-148.4	0	0	0	109.5	V855 L856 L857 C858 L968 L974 L980 L983 A1040 L1042	V855-F966 HydrophobicContact CG1-CB 4.12Å; L856-F966 PolarHBondContact O-N 3.39Å; L857-F966 CarbonylContact C-O 3.59Å; L857-F966 WeakPolarHBondContact CA-O 3.47Å; L857-F966 HydrophobicContact CD1-CB 4.14Å; L857-F966 HydrophobicContact CD1-CD1 3.54Å; L857-F966 HydrophobicContact CD1-CE1 4.35Å; L857-F966 HydrophobicContact CD1-CG 4.16Å; C858-F966 PolarHBondContact N-O 3.19Å; F966-L968 HydrophobicContact CE1-CD1 4.26Å; F966-L968 HydrophobicContact CE1-CD2 4.16Å; F966-L968 HydrophobicContact CZ-CD1 4.12Å; F966-L974 HydrophobicContact CE1-CD1 3.85Å; F966-L974 HydrophobicContact CZ-CD1 4.14Å; F966-L980 HydrophobicContact CD1-CD2 3.67Å; F966-L980 HydrophobicContact CE1-CD2 4.07Å; F966-L980 HydrophobicContact CG-CD2 4.25Å; F966-L983 HydrophobicContact CE2-CD1 4.33Å; F966-L983 HydrophobicContact CZ-CD1 4.37Å; F966-A1040 HydrophobicContact CE2-CB 4.12Å; F966-A1040 HydrophobicContact CZ-CB 4.14Å; F966-L1042 HydrophobicContact CB-CD1 3.75Å; F966-L1042 HydrophobicContact CD2-CB 3.78Å; F966-L1042 HydrophobicContact CD2-CD1 4.13Å; F966-L1042 HydrophobicContact CE2-CB 4.23Å; F966-L1042 HydrophobicContact CG-CD1 4.09Å
967	Y	96.5	Very high	93.7	Very high	10 Å²	10	41.3 Å²	41.3	4%	0.039	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	122.5	171.9	-68.5	-81.5	0	0	0	109	C858 K950 A953 L954 I965 A1040 V1041 I1043 F1055	C858-Y967 HydrophobicContact CB-CD1 3.72Å; C858-Y967 HydrophobicContact CB-CE1 3.92Å; C858-Y967 HydrophobicContact CB-CG 4.47Å; K950-Y967 HydrophobicContact CB-CE1 3.98Å; K950-Y967 HydrophobicContact CD-CD1 4.31Å; K950-Y967 HydrophobicContact CD-CE1 4.38Å; K950-Y967 HydrophobicContact CG-CD1 4.17Å; K950-Y967 HydrophobicContact CG-CE1 3.86Å; K950-Y967 PolarHBondContact O-OH 3.27Å; A953-Y967 HydrophobicContact CB-CE1 4.1Å; L954-Y967 WeakPolarHBondContact CB-OH 3.42Å; L954-Y967 PolarHBondContact N-OH 3.25Å; I965-Y967 HydrophobicContact CD1-CE1 4.19Å; I965-Y967 HydrophobicContact CD1-CE2 3.73Å; I965-Y967 VanDerWaalsContact CD1-CZ 3.48Å; I965-Y967 VanDerWaalsContact CD1-OH 3.24Å; I965-Y967 WeakPolarHBondContact CD1-OH 3.32Å; I965-Y967 HydrophobicContact CG1-CD2 4.47Å; I965-Y967 HydrophobicContact CG1-CE2 4Å; I965-Y967 HydrophobicContact CG2-CE2 4.27Å; Y967-A1040 CarbonylContact O-C 3.55Å; Y967-A1040 WeakPolarHBondContact O-CA 3.3Å; Y967-V1041 PolarHBondContact N-O 2.84Å; Y967-V1041 PolarHBondContact O-N 3.36Å; Y967-I1043 HydrophobicContact CD2-CD1 4.44Å; Y967-I1043 HydrophobicContact CE2-CD1 4.13Å; Y967-F1055 HydrophobicContact CE1-CZ 4.44Å; Y967-F1055 HydrophobicContact CE2-CE2 4.1Å; Y967-F1055 HydrophobicContact CE2-CZ 4.03Å; Y967-F1055 AromaticContact CZ-CE2 3.82Å; Y967-F1055 AromaticContact CZ-CZ 3.94Å; Y967-F1055 WeakPolarHBondContact OH-CE2 3.44Å
968	L	95.1	Very high	93.6	Very high	2 Å²	2	45.8 Å²	45.8	1%	0.01	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	117	-176.2	-172.9	65.5	0	0	0	110	L857 C858 L859 F871 L875 F966 V972 L974 S1039 A1040	L857-L968 HydrophobicContact CD1-CB 3.92Å; L857-L968 HydrophobicContact CD1-CD2 3.93Å; C858-L968 PolarHBondContact O-N 2.88Å; L859-L968 HydrophobicContact CD2-CB 3.84Å; L859-L968 HydrophobicContact CD2-CD2 4.32Å; L859-L968 HydrophobicContact CD2-CG 4.32Å; L859-L968 WeakPolarHBondContact CD2-O 3.43Å; F871-L968 HydrophobicContact CE2-CD2 3.83Å; F871-L968 HydrophobicContact CE2-CG 3.89Å; F871-L968 HydrophobicContact CZ-CD2 3.67Å; F871-L968 HydrophobicContact CZ-CG 3.96Å; L875-L968 HydrophobicContact CD1-CD2 4.38Å; F966-L968 HydrophobicContact CE1-CD1 4.26Å; F966-L968 HydrophobicContact CE1-CD2 4.16Å; F966-L968 HydrophobicContact CZ-CD1 4.12Å; L968-V972 HydrophobicContact CD1-CB 3.73Å; L968-V972 HydrophobicContact CD1-CG1 3.58Å; L968-V972 HydrophobicContact CD1-CG2 4.26Å; L968-L974 HydrophobicContact CD1-CD1 4.14Å; L968-L974 HydrophobicContact CD1-CG 4.44Å; L968-L974 HydrophobicContact CD2-CD1 3.92Å; L968-S1039 CarbonylContact C-O 3.38Å; L968-S1039 WeakPolarHBondContact CA-O 3.24Å; L968-A1040 HydrophobicContact CD1-CB 3.76Å
969	D	92.1	Very high	93.6	Very high	27 Å²	27	42.7 Å²	42.7	14%	0.144	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	143.3	175.6	-65.7	-19.8	0	0	0	109.6	F871 D971 V972 S1039	F871-D969 WeakPolarHBondContact CE2-O 3.32Å; D969-D971 WeakPolarHBondContact CB-OD1 3.36Å; D969-D971 PolarHBondContact O-N 3.19Å; D969-V972 WeakPolarHBondContact O-CB 3.47Å; D969-V972 PolarHBondContact O-N 3.42Å; D969-V972 VanDerWaalsContact O-N 3.1Å; D969-S1039 PolarHBondContact N-O 3.41Å; D969-S1039 WeakPolarHBondContact OD2-CA 3.21Å; D969-S1039 WeakPolarHBondContact OD2-CB 3.47Å; D969-S1039 PolarHBondContact OD2-OG 3.31Å
970	C	92.1	Very high	93.7	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77	13	-171	-65.6	0	0	0	0	115.3	L860 V861 K864 V867 L868 F871	L860-C970 PolarHBondContact O-SG 2.95Å; V861-C970 HydrophobicContact CG2-CB 4.46Å; V861-C970 VanDerWaalsContact CG2-SG 3.57Å; K864-C970 HydrophobicContact CG-CB 4.24Å; V867-C970 VanDerWaalsContact CG1-O 3.26Å; V867-C970 WeakPolarHBondContact CG1-O 3.26Å; L868-C970 HydrophobicContact CD2-CB 3.99Å; F871-C970 HydrophobicContact CD1-CB 4.37Å; F871-C970 HydrophobicContact CD2-CB 4.28Å; F871-C970 HydrophobicContact CE2-CB 4.46Å; F871-C970 HydrophobicContact CG-CB 4.24Å
971	D	89.5	Confident	93.7	Very high	18 Å²	18	34 Å²	34	10%	0.096	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.5	5.8	168.3	44.8	25.2	0	0	0	113.4	K864 D969 I1092 L1093	K864-D971 IonicContact NZ-OD2 2.82Å; K864-D971 PolarHBondContact NZ-OD2 2.95Å; D969-D971 WeakPolarHBondContact CB-OD1 3.36Å; D969-D971 PolarHBondContact O-N 3.19Å; D971-I1092 WeakPolarHBondContact O-CA 3.33Å; D971-L1093 HydrophobicContact CB-CB 4.1Å; D971-L1093 HydrophobicContact CB-CD1 4.33Å; D971-L1093 HydrophobicContact CB-CG 4.39Å; D971-L1093 PolarHBondContact O-N 3.01Å; D971-L1093 VanDerWaalsContact O-N 3.08Å
972	V	93.9	Very high	93.7	Very high	1 Å²	1	24.9 Å²	24.9	1%	0.006	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	117.7	172.8	173.6	0	0	0	0	111.1	F871 L968 D969 L974 L995 S1039 A1040 A1091 I1092	F871-V972 WeakPolarHBondContact CD2-O 3.46Å; F871-V972 WeakPolarHBondContact CE2-O 3.4Å; L968-V972 HydrophobicContact CD1-CB 3.73Å; L968-V972 HydrophobicContact CD1-CG1 3.58Å; L968-V972 HydrophobicContact CD1-CG2 4.26Å; D969-V972 WeakPolarHBondContact O-CB 3.47Å; D969-V972 PolarHBondContact O-N 3.42Å; D969-V972 VanDerWaalsContact O-N 3.1Å; V972-L974 HydrophobicContact CG1-CD2 3.57Å; V972-L974 HydrophobicContact CG1-CG 3.93Å; V972-L995 HydrophobicContact CB-CD1 4.04Å; V972-L995 HydrophobicContact CG1-CD1 3.36Å; V972-L995 HydrophobicContact CG1-CD2 3.92Å; V972-L995 HydrophobicContact CG1-CG 4.3Å; V972-L995 HydrophobicContact CG2-CD1 3.53Å; V972-S1039 WeakPolarHBondContact CG2-O 3.49Å; V972-A1040 HydrophobicContact CG1-CB 4.35Å; V972-A1091 CarbonylContact C-O 3.6Å; V972-A1091 WeakPolarHBondContact CA-O 3.49Å; V972-I1092 HydrophobicContact CG2-CB 4.45Å; V972-I1092 HydrophobicContact CG2-CD1 3.96Å; V972-I1092 HydrophobicContact CG2-CG1 4.04Å
973	L	92.5	Very high	93.7	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	100.3	176.8	-55	-174.9	0	0	0	110.2	V867 F871 Y874 F975 G1090 A1091 L1112 L1124	V867-L973 HydrophobicContact CG2-CD2 4.02Å; F871-L973 HydrophobicContact CB-CD2 4.22Å; Y874-L973 HydrophobicContact CD2-CB 3.86Å; Y874-L973 HydrophobicContact CD2-CD2 4.2Å; Y874-L973 HydrophobicContact CD2-CG 4.44Å; Y874-L973 HydrophobicContact CE2-CB 4.11Å; Y874-L973 HydrophobicContact CE2-CD1 4.34Å; L973-F975 HydrophobicContact CB-CD1 4.07Å; L973-F975 HydrophobicContact CB-CE1 3.51Å; L973-F975 HydrophobicContact CB-CZ 4.28Å; L973-F975 HydrophobicContact CD1-CE1 4.25Å; L973-F975 WeakPolarHBondContact O-CD1 3.5Å; L973-F975 PolarHBondContact O-N 3.23Å; L973-G1090 CarbonylContact O-C 3.6Å; L973-G1090 WeakPolarHBondContact O-CA 3.37Å; L973-A1091 PolarHBondContact N-O 3.44Å; L973-A1091 PolarHBondContact O-N 2.67Å; L973-L1112 HydrophobicContact CD1-CD2 3.87Å; L973-L1124 HydrophobicContact CD1-CD1 3.85Å; L973-L1124 HydrophobicContact CD1-CD2 4.4Å
974	L	92.7	Very high	93.6	Very high	5 Å²	5	23.1 Å²	23.1	3%	0.026	11%	0.108	C	C	.	.			trans	-80.4	79.3	-177.3	-63.7	-179.1	0	0	0	112.2	L878 F966 L968 V972 N976 T979 P993 L995 F1089	L878-L974 HydrophobicContact CD2-CB 4.33Å; L878-L974 HydrophobicContact CD2-CD1 4.4Å; F966-L974 HydrophobicContact CE1-CD1 3.85Å; F966-L974 HydrophobicContact CZ-CD1 4.14Å; L968-L974 HydrophobicContact CD1-CD1 4.14Å; L968-L974 HydrophobicContact CD1-CG 4.44Å; L968-L974 HydrophobicContact CD2-CD1 3.92Å; V972-L974 HydrophobicContact CG1-CD2 3.57Å; V972-L974 HydrophobicContact CG1-CG 3.93Å; L974-N976 PolarHBondContact O-N 3.42Å; L974-N976 VanDerWaalsContact O-N 3.08Å; L974-T979 HydrophobicContact CD1-CG2 4.12Å; L974-T979 HydrophobicContact CD2-CG2 4.21Å; L974-P993 HydrophobicContact CD2-CG 4.39Å; L974-L995 HydrophobicContact CD2-CD2 3.88Å; L974-F1089 CarbonylContact C-O 3.54Å
975	F	88.5	Confident	93.3	Very high	85 Å²	85	25.1 Å²	25.1	37%	0.373	13%	0.126	S	C	.	.			trans	-56	-24.7	179	-53.9	-24.9	0	0	0	114.5	Y874 L973 F1089 A1091 L1124	Y874-F975 HydrophobicContact CD1-CD1 4.08Å; Y874-F975 HydrophobicContact CD2-CD1 4.26Å; Y874-F975 HydrophobicContact CD2-CE1 4.43Å; Y874-F975 HydrophobicContact CE1-CB 4.46Å; Y874-F975 AromaticContact CE1-CD1 3.58Å; Y874-F975 HydrophobicContact CE1-CD1 3.58Å; Y874-F975 HydrophobicContact CE1-CE1 4.32Å; Y874-F975 HydrophobicContact CE1-CG 4.43Å; Y874-F975 AromaticContact CE2-CD1 3.78Å; Y874-F975 HydrophobicContact CE2-CD1 3.78Å; Y874-F975 AromaticContact CE2-CE1 3.74Å; Y874-F975 HydrophobicContact CE2-CE1 3.74Å; Y874-F975 HydrophobicContact CG-CD1 4.41Å; Y874-F975 AromaticContact CZ-CD1 3.4Å; Y874-F975 VanDerWaalsContact CZ-CD1 3.4Å; Y874-F975 AromaticContact CZ-CE1 3.68Å; L973-F975 HydrophobicContact CB-CD1 4.07Å; L973-F975 HydrophobicContact CB-CE1 3.51Å; L973-F975 HydrophobicContact CB-CZ 4.28Å; L973-F975 HydrophobicContact CD1-CE1 4.25Å; L973-F975 WeakPolarHBondContact O-CD1 3.5Å; L973-F975 PolarHBondContact O-N 3.23Å; F975-F1089 PolarHBondContact N-O 3.18Å; F975-F1089 VanDerWaalsContact N-O 3.15Å; F975-A1091 HydrophobicContact CE1-CB 4.4Å; F975-A1091 HydrophobicContact CE2-CB 3.62Å; F975-A1091 HydrophobicContact CZ-CB 3.49Å; F975-A1091 VanDerWaalsContact CZ-CB 3.49Å; F975-L1124 HydrophobicContact CE1-CD2 3.86Å; F975-L1124 HydrophobicContact CZ-CD2 3.94Å
976	N	89.7	Confident	93.1	Very high	28 Å²	28	27 Å²	27	15%	0.15	13%	0.134	C	C	.	.			trans	-94.5	105	179.5	178.9	-9.1	0	0	0	110.8	L974 K978 T979 Q982 K1088 F1089	L974-N976 PolarHBondContact O-N 3.42Å; L974-N976 VanDerWaalsContact O-N 3.08Å; N976-K978 PolarHBondContact O-N 2.82Å; N976-K978 PolarHBondContact OD1-N 2.95Å; N976-T979 WeakPolarHBondContact O-CB 3.45Å; N976-T979 PolarHBondContact O-N 3.48Å; N976-T979 PolarHBondContact O-OG1 2.8Å; N976-Q982 PolarHBondContact ND2-OE1 2.69Å; N976-K1088 VanDerWaalsContact CB-O 3.23Å; N976-K1088 WeakPolarHBondContact CB-O 3.43Å; N976-K1088 PolarHBondContact ND2-O 3.37Å; N976-K1088 VanDerWaalsContact ND2-O 3.11Å; N976-F1089 WeakPolarHBondContact CB-O 3.37Å; N976-F1089 PolarHBondContact N-O 2.76Å
977	Q	92.9	Very high	92.7	Very high	80 Å²	80	28.7 Å²	28.7	37%	0.374	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	-49.9	-32.9	177.4	-60.1	174.3	-44	0	0	112.7	E877 L878 D879 T979	E877-Q977 HydrophobicContact CB-CG 4.29Å; E877-Q977 VanDerWaalsContact O-CB 3.32Å; E877-Q977 WeakPolarHBondContact O-CB 3.23Å; E877-Q977 WeakPolarHBondContact O-CG 3.41Å; E877-Q977 PolarHBondContact OE2-NE2 2.71Å; L878-Q977 CarbonylContact C-O 3.47Å; L878-Q977 WeakPolarHBondContact CA-O 3.48Å; D879-Q977 HydrophobicContact CB-CB 4.04Å; D879-Q977 PolarHBondContact N-O 3.46Å; Q977-T979 VanDerWaalsContact C-N 3.33Å; Q977-T979 PolarHBondContact O-N 3.48Å
978	K	92.8	Very high	92.5	Very high	94 Å²	94	29.8 Å²	29.8	41%	0.409	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.2	12.1	-176.5	-67.8	176.1	176.5	168	0	114.4	D879 N976 L980 Q981 Q982	D879-K978 HydrophobicContact CB-CG 4Å; D879-K978 WeakPolarHBondContact OD2-CE 3.35Å; D879-K978 WeakPolarHBondContact OD2-CG 3.38Å; D879-K978 IonicContact OD2-NZ 2.69Å; N976-K978 PolarHBondContact O-N 2.82Å; N976-K978 PolarHBondContact OD1-N 2.95Å; K978-L980 VanDerWaalsContact C-N 3.34Å; K978-L980 PolarHBondContact O-N 2.62Å; K978-Q981 PolarHBondContact O-N 2.66Å; K978-Q982 HydrophobicContact CB-CG 4.26Å; K978-Q982 WeakPolarHBondContact O-CB 3.39Å; K978-Q982 WeakPolarHBondContact O-CG 3.27Å; K978-Q982 PolarHBondContact O-N 2.8Å
979	T	94.8	Very high	92.5	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-49.5	-49.5	-177.1	-67.6	0	0	0	0	112.8	L974 N976 Q977 Q982 L983 P993 F1089	L974-T979 HydrophobicContact CD1-CG2 4.12Å; L974-T979 HydrophobicContact CD2-CG2 4.21Å; N976-T979 WeakPolarHBondContact O-CB 3.45Å; N976-T979 PolarHBondContact O-N 3.48Å; N976-T979 PolarHBondContact O-OG1 2.8Å; Q977-T979 VanDerWaalsContact C-N 3.33Å; Q977-T979 PolarHBondContact O-N 3.48Å; T979-Q982 PolarHBondContact O-N 2.85Å; T979-L983 HydrophobicContact CG2-CD1 3.64Å; T979-L983 HydrophobicContact CG2-CG 4.24Å; T979-L983 WeakPolarHBondContact O-CB 3.21Å; T979-L983 VanDerWaalsContact O-CG 3.29Å; T979-L983 WeakPolarHBondContact O-CG 3.4Å; T979-L983 PolarHBondContact O-N 3.27Å; T979-P993 HydrophobicContact CG2-CB 4.4Å; T979-P993 HydrophobicContact CG2-CG 4.34Å; T979-F1089 HydrophobicContact CG2-CD1 3.84Å; T979-F1089 HydrophobicContact CG2-CE1 4.36Å
980	L	94.8	Very high	92.7	Very high	5 Å²	5	29.2 Å²	29.2	3%	0.026	16%	0.157	C	C	.	.	H	α-helix	trans	-60.2	-51.8	179.4	-72.7	175.1	0	0	0	112	V855 L878 Y880 I885 F966 K978 Q982 L983 M984 L1042	V855-L980 HydrophobicContact CG1-CD2 4.39Å; L878-L980 HydrophobicContact CD1-CD1 4.16Å; L878-L980 HydrophobicContact CD1-CG 4.44Å; Y880-L980 HydrophobicContact CD1-CD1 4.37Å; Y880-L980 HydrophobicContact CD2-CB 3.86Å; Y880-L980 HydrophobicContact CD2-CD1 4.25Å; Y880-L980 HydrophobicContact CE2-CB 4.24Å; Y880-L980 HydrophobicContact CG-CB 4.4Å; Y880-L980 HydrophobicContact CG-CD1 3.95Å; I885-L980 HydrophobicContact CD1-CD1 3.84Å; I885-L980 HydrophobicContact CG1-CD1 4.42Å; F966-L980 HydrophobicContact CD1-CD2 3.67Å; F966-L980 HydrophobicContact CE1-CD2 4.07Å; F966-L980 HydrophobicContact CG-CD2 4.25Å; K978-L980 VanDerWaalsContact C-N 3.34Å; K978-L980 PolarHBondContact O-N 2.62Å; L980-Q982 VanDerWaalsContact C-N 3.29Å; L980-Q982 PolarHBondContact O-N 2.61Å; L980-L983 PolarHBondContact O-N 2.91Å; L980-M984 HydrophobicContact CB-CE 4.27Å; L980-M984 HydrophobicContact CD2-CE 4.48Å; L980-M984 WeakPolarHBondContact O-CB 3.14Å; L980-M984 WeakPolarHBondContact O-CG 3.32Å; L980-M984 PolarHBondContact O-N 2.9Å; L980-L1042 HydrophobicContact CD2-CD1 4.47Å
981	Q	92.8	Very high	92.9	Very high	76 Å²	76	29.3 Å²	29.3	36%	0.355	16%	0.157	S	C	.	.	H	α-helix	trans	-57.5	-42.7	179.8	-56.6	177.8	0.3	0	0	111.6	D879 Y880 K978 A985	D879-Q981 VanDerWaalsContact CG-NE2 3.34Å; D879-Q981 PolarHBondContact O-NE2 3.26Å; D879-Q981 PolarHBondContact OD1-NE2 2.84Å; D879-Q981 PolarHBondContact OD2-NE2 2.97Å; Y880-Q981 HydrophobicContact CD2-CG 3.97Å; Y880-Q981 HydrophobicContact CE2-CG 4.33Å; K978-Q981 PolarHBondContact O-N 2.66Å; Q981-A985 WeakPolarHBondContact O-CB 3.41Å; Q981-A985 PolarHBondContact O-N 3.07Å; Q981-A985 VanDerWaalsContact O-N 3.11Å
982	Q	93.8	Very high	93.3	Very high	32 Å²	32	28.4 Å²	28.4	15%	0.15	15%	0.152	C	C	.	.	H	α-helix	trans	-72.7	-41.4	-176.7	-72.9	172.3	-2	0	0	112.7	N976 K978 T979 L980 A985 E986 Y1087 F1089	N976-Q982 PolarHBondContact ND2-OE1 2.69Å; K978-Q982 HydrophobicContact CB-CG 4.26Å; K978-Q982 WeakPolarHBondContact O-CB 3.39Å; K978-Q982 WeakPolarHBondContact O-CG 3.27Å; K978-Q982 PolarHBondContact O-N 2.8Å; T979-Q982 PolarHBondContact O-N 2.85Å; L980-Q982 VanDerWaalsContact C-N 3.29Å; L980-Q982 PolarHBondContact O-N 2.61Å; Q982-A985 PolarHBondContact O-N 3.45Å; Q982-E986 PolarHBondContact O-N 2.86Å; Q982-Y1087 HydrophobicContact CB-CD2 3.82Å; Q982-Y1087 HydrophobicContact CB-CE2 3.84Å; Q982-Y1087 VanDerWaalsContact CD-CD2 3.45Å; Q982-Y1087 HydrophobicContact CG-CD2 3.83Å; Q982-Y1087 HydrophobicContact CG-CE2 3.71Å; Q982-Y1087 HydrophobicContact CG-CG 4.42Å; Q982-F1089 HydrophobicContact CB-CE1 3.92Å; Q982-F1089 HydrophobicContact CB-CZ 4.35Å
983	L	95.3	Very high	93.5	Very high	2 Å²	2	28.4 Å²	28.4	1%	0.01	15%	0.152	C	C	.	.	H	α-helix	trans	-67.1	-40.8	175.5	-68.5	175	0	0	0	111.7	F966 T979 L980 A985 E986 V991 P993 L1042 F1089	F966-L983 HydrophobicContact CE2-CD1 4.33Å; F966-L983 HydrophobicContact CZ-CD1 4.37Å; T979-L983 HydrophobicContact CG2-CD1 3.64Å; T979-L983 HydrophobicContact CG2-CG 4.24Å; T979-L983 WeakPolarHBondContact O-CB 3.21Å; T979-L983 VanDerWaalsContact O-CG 3.29Å; T979-L983 WeakPolarHBondContact O-CG 3.4Å; T979-L983 PolarHBondContact O-N 3.27Å; L980-L983 PolarHBondContact O-N 2.91Å; L983-A985 PolarHBondContact O-N 3.43Å; L983-E986 PolarHBondContact O-N 3.06Å; L983-V991 HydrophobicContact CB-CG1 4.02Å; L983-V991 HydrophobicContact CD2-CG1 4.22Å; L983-V991 HydrophobicContact CD2-CG2 3.99Å; L983-P993 HydrophobicContact CD1-CB 4.11Å; L983-P993 HydrophobicContact CD1-CG 3.94Å; L983-P993 HydrophobicContact CD2-CB 4.11Å; L983-L1042 HydrophobicContact CB-CD2 3.61Å; L983-F1089 HydrophobicContact CD2-CE1 4.1Å; L983-F1089 HydrophobicContact CD2-CE2 4.43Å; L983-F1089 HydrophobicContact CD2-CZ 3.86Å; L983-F1089 HydrophobicContact CG-CE1 4.1Å; L983-F1089 HydrophobicContact CG-CZ 4.34Å
984	M	94.5	Very high	93.7	Very high	16 Å²	16	28.4 Å²	28.4	8%	0.079	15%	0.152	C	C	.	.	H	α-helix	trans	-60.4	-32.6	172.4	-68.5	174	-172.1	0	0	112.4	P853 V855 Y880 F964 L980 E986 G987 L1042	P853-M984 HydrophobicContact CG-SD 4.43Å; V855-M984 HydrophobicContact CG2-CE 3.33Å; Y880-M984 HydrophobicContact CE2-CE 3.91Å; Y880-M984 HydrophobicContact CE2-SD 3.82Å; Y880-M984 WeakPolarHBondContact OH-CE 3.29Å; Y880-M984 PolarHBondContact OH-SD 2.97Å; Y880-M984 VanDerWaalsContact OH-SD 3.35Å; F964-M984 HydrophobicContact CD1-CG 4.37Å; F964-M984 HydrophobicContact CD2-CE 3.82Å; F964-M984 HydrophobicContact CD2-CG 4.29Å; F964-M984 HydrophobicContact CD2-SD 4.21Å; F964-M984 HydrophobicContact CE1-CG 3.9Å; F964-M984 HydrophobicContact CE2-CE 4.15Å; F964-M984 HydrophobicContact CE2-CG 3.82Å; F964-M984 HydrophobicContact CE2-SD 3.91Å; F964-M984 HydrophobicContact CG-CE 4.13Å; F964-M984 HydrophobicContact CZ-CB 4.04Å; F964-M984 HydrophobicContact CZ-CG 3.59Å; F964-M984 HydrophobicContact CZ-SD 4.3Å; L980-M984 HydrophobicContact CB-CE 4.27Å; L980-M984 HydrophobicContact CD2-CE 4.48Å; L980-M984 WeakPolarHBondContact O-CB 3.14Å; L980-M984 WeakPolarHBondContact O-CG 3.32Å; L980-M984 PolarHBondContact O-N 2.9Å; M984-E986 VanDerWaalsContact C-N 3.33Å; M984-E986 PolarHBondContact O-N 3.39Å; M984-G987 PolarHBondContact O-N 3.19Å; M984-L1042 HydrophobicContact CG-CD2 3.98Å
985	A	91.5	Very high	93.8	Very high	47 Å²	47	28.2 Å²	28.2	39%	0.388	15%	0.151	S	C	.	.	H	α-helix	trans	-75.2	-15.4	-179.8	0	0	0	0	0	114.5	Q981 Q982 L983 G987	Q981-A985 WeakPolarHBondContact O-CB 3.41Å; Q981-A985 PolarHBondContact O-N 3.07Å; Q981-A985 VanDerWaalsContact O-N 3.11Å; Q982-A985 PolarHBondContact O-N 3.45Å; L983-A985 PolarHBondContact O-N 3.43Å; A985-G987 PolarHBondContact O-N 2.93Å
986	E	91.7	Very high	93.8	Very high	38 Å²	38	26.9 Å²	26.9	18%	0.178	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-21.2	172	-60.2	-71.2	-171.5	0	0	111.8	Q982 L983 M984 V988 C1031 S1084 R1086	Q982-E986 PolarHBondContact O-N 2.86Å; L983-E986 PolarHBondContact O-N 3.06Å; M984-E986 VanDerWaalsContact C-N 3.33Å; M984-E986 PolarHBondContact O-N 3.39Å; E986-V988 PolarHBondContact O-N 3.49Å; E986-C1031 HydrophobicContact CG-CB 4.35Å; E986-S1084 WeakPolarHBondContact OE1-CB 3.43Å; E986-S1084 PolarHBondContact OE1-OG 3.03Å; E986-R1086 IonicContact OE1-NE 3.53Å; E986-R1086 PolarHBondContact OE1-NE 3.45Å; E986-R1086 IonicContact OE2-NE 3.07Å; E986-R1086 PolarHBondContact OE2-NE 3.44Å; E986-R1086 IonicContact OE2-NH2 2.8Å
987	G	89.8	Confident	93.5	Very high	37 Å²	37	26.4 Å²	26.4	38%	0.381	15%	0.149	S	C	.	.			trans	70.8	28.6	168.3	0	0	0	0	0	115.7	M984 A985	M984-G987 PolarHBondContact O-N 3.19Å; A985-G987 PolarHBondContact O-N 2.93Å
988	V	92.8	Very high	92.7	Very high	33 Å²	33	25.2 Å²	25.2	20%	0.2	14%	0.144	C	C	.	.			trans	-117.6	157	179.9	-59.9	0	0	0	0	111.8	E986 V991 Y1082	E986-V988 PolarHBondContact O-N 3.49Å; V988-V991 HydrophobicContact CG2-CB 3.73Å; V988-V991 HydrophobicContact CG2-CG1 4.41Å; V988-V991 HydrophobicContact CG2-CG2 4.23Å; V988-Y1082 HydrophobicContact CB-CD2 3.68Å; V988-Y1082 HydrophobicContact CB-CE2 3.77Å; V988-Y1082 HydrophobicContact CB-CG 4.42Å; V988-Y1082 HydrophobicContact CG1-CD2 3.94Å; V988-Y1082 HydrophobicContact CG1-CE2 3.73Å; V988-Y1082 HydrophobicContact CG1-CG 4.42Å; V988-Y1082 HydrophobicContact CG2-CD2 3.6Å; V988-Y1082 HydrophobicContact CG2-CE2 4.22Å; V988-Y1082 HydrophobicContact CG2-CG 4Å
989	I	94.3	Very high	91.7	Very high	17 Å²	17	23 Å²	23	9%	0.087	14%	0.141	C	C	.	.	S	Bend	trans	-71	-37.5	-171.3	-63.1	171.4	0	0	0	113.1	I1043 D1044 M1047 K1049 I1053 L1079	I989-I1043 HydrophobicContact CG2-CG2 4.38Å; I989-I1043 CarbonylContact O-C 3.54Å; I989-I1043 WeakPolarHBondContact O-CA 3.24Å; I989-D1044 PolarHBondContact O-N 2.99Å; I989-M1047 HydrophobicContact CD1-CB 4.06Å; I989-M1047 HydrophobicContact CD1-CE 4.31Å; I989-M1047 HydrophobicContact CD1-SD 3.94Å; I989-M1047 HydrophobicContact CG1-CB 4Å; I989-M1047 HydrophobicContact CG1-CE 4.32Å; I989-M1047 HydrophobicContact CG1-CG 4.17Å; I989-M1047 HydrophobicContact CG1-SD 3.36Å; I989-M1047 WeakPolarHBondContact CG1-SD 3.28Å; I989-K1049 HydrophobicContact CD1-CB 3.85Å; I989-K1049 HydrophobicContact CD1-CD 4.41Å; I989-I1053 HydrophobicContact CG2-CD1 4.04Å; I989-L1079 HydrophobicContact CD1-CD1 4.14Å; I989-L1079 HydrophobicContact CD1-CD2 3.76Å; I989-L1079 HydrophobicContact CG2-CD1 4.13Å
990	V	96.2	Very high	90.8	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	114.3	-180	-175.3	0	0	0	0	108.7	V1037 V1041 L1042 I1043 I1053 V1074 M1081 Y1082	V990-V1037 HydrophobicContact CG1-CG2 4.43Å; V990-V1041 HydrophobicContact CG1-CG1 3.64Å; V990-L1042 WeakPolarHBondContact CA-O 3.48Å; V990-I1043 HydrophobicContact CG1-CG1 4.41Å; V990-I1043 HydrophobicContact CG2-CG1 4.32Å; V990-I1043 HydrophobicContact CG2-CG2 4.39Å; V990-I1053 HydrophobicContact CG2-CD1 3.77Å; V990-V1074 HydrophobicContact CG2-CG1 4.36Å; V990-V1074 HydrophobicContact CG2-CG2 4.1Å; V990-M1081 HydrophobicContact CB-CG 4.47Å; V990-M1081 HydrophobicContact CG1-CB 4.29Å; V990-M1081 HydrophobicContact CG1-CE 3.88Å; V990-M1081 HydrophobicContact CG1-CG 4.03Å; V990-Y1082 PolarHBondContact O-N 3.34Å
991	V	97.2	Very high	90.3	Very high	1 Å²	1	28.7 Å²	28.7	1%	0.006	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	142.7	-179.3	66.9	0	0	0	0	112	L983 V988 L1042 Y1082	L983-V991 HydrophobicContact CB-CG1 4.02Å; L983-V991 HydrophobicContact CD2-CG1 4.22Å; L983-V991 HydrophobicContact CD2-CG2 3.99Å; V988-V991 HydrophobicContact CG2-CB 3.73Å; V988-V991 HydrophobicContact CG2-CG1 4.41Å; V988-V991 HydrophobicContact CG2-CG2 4.23Å; V991-L1042 HydrophobicContact CG1-CB 4.04Å; V991-L1042 HydrophobicContact CG1-CD2 4.21Å; V991-L1042 PolarHBondContact N-O 3.04Å; V991-L1042 PolarHBondContact O-N 3.2Å; V991-Y1082 CarbonylContact C-O 3.54Å; V991-Y1082 VanDerWaalsContact CA-O 3.3Å; V991-Y1082 WeakPolarHBondContact CA-O 3.31Å
992	A	97.5	Very high	90.2	Very high	0 Å²	0	25 Å²	25	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	146.6	168.5	0	0	0	0	0	111.2	V1037 A1040 Y1082 V1083 S1084	A992-V1037 HydrophobicContact CB-CB 3.58Å; A992-V1037 HydrophobicContact CB-CG1 3.76Å; A992-V1037 HydrophobicContact CB-CG2 3.94Å; A992-A1040 VanDerWaalsContact CA-O 3.23Å; A992-A1040 WeakPolarHBondContact CA-O 3.48Å; A992-A1040 WeakPolarHBondContact CB-O 3.21Å; A992-Y1082 PolarHBondContact N-O 2.82Å; A992-V1083 CarbonylContact O-C 3.55Å; A992-V1083 WeakPolarHBondContact O-CA 3.26Å; A992-S1084 PolarHBondContact O-N 3.11Å
993	P	97.2	Very high	90.2	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	140.8	162	29.4	-25	0	0	0	109.2	L974 T979 L983 L995 N1003 A1040 F1089	L974-P993 HydrophobicContact CD2-CG 4.39Å; T979-P993 HydrophobicContact CG2-CB 4.4Å; T979-P993 HydrophobicContact CG2-CG 4.34Å; L983-P993 HydrophobicContact CD1-CB 4.11Å; L983-P993 HydrophobicContact CD1-CG 3.94Å; L983-P993 HydrophobicContact CD2-CB 4.11Å; P993-L995 HydrophobicContact CG-CD2 4.31Å; P993-L995 PolarHBondContact O-N 2.75Å; P993-N1003 PolarHBondContact O-ND2 2.73Å; P993-N1003 PolarHBondContact O-OD1 2.71Å; P993-A1040 WeakPolarHBondContact CD-O 3.13Å; P993-A1040 HydrophobicContact CG-CB 3.75Å; P993-F1089 HydrophobicContact CB-CB 3.39Å; P993-F1089 HydrophobicContact CB-CD1 3.77Å; P993-F1089 HydrophobicContact CB-CD2 3.49Å; P993-F1089 VanDerWaalsContact CB-CD2 3.49Å; P993-F1089 HydrophobicContact CB-CE1 4.36Å; P993-F1089 HydrophobicContact CB-CE2 4.14Å; P993-F1089 HydrophobicContact CB-CG 3.27Å; P993-F1089 HydrophobicContact CG-CB 4.46Å
994	M	96.9	Very high	90.1	Very high	1 Å²	1	23.4 Å²	23.4	1%	0.005	15%	0.151	C	C	.	.	P	Polyproline II helix	trans	-74.6	117.1	169.5	-167.4	-171.5	85.7	0	0	110.1	F1004 I1023 Y1024 R1026 V1083 S1084 N1085	M994-F1004 HydrophobicContact CG-CD1 4.12Å; M994-F1004 HydrophobicContact CG-CE1 3.77Å; M994-F1004 HydrophobicContact SD-CE1 4.09Å; M994-I1023 HydrophobicContact SD-CG2 3.88Å; M994-Y1024 VanDerWaalsContact CE-O 3.32Å; M994-Y1024 WeakPolarHBondContact CE-O 3.39Å; M994-R1026 HydrophobicContact CE-CG 4.12Å; M994-V1083 HydrophobicContact CB-CG2 3.81Å; M994-V1083 HydrophobicContact CG-CG2 4.31Å; M994-S1084 WeakPolarHBondContact CB-O 3.46Å; M994-S1084 PolarHBondContact N-O 2.88Å; M994-N1085 HydrophobicContact CB-CB 3.77Å; M994-N1085 HydrophobicContact CE-CB 3.87Å; M994-N1085 HydrophobicContact CG-CB 4.26Å; M994-N1085 HydrophobicContact SD-CB 3.46Å; M994-N1085 WeakPolarHBondContact SD-CB 3.38Å
995	L	94.9	Very high	90	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	137.3	179.3	-56.9	171.4	0	0	0	110.5	V972 L974 P993 S1002 N1003 A1040 F1089 G1090 I1092	V972-L995 HydrophobicContact CB-CD1 4.04Å; V972-L995 HydrophobicContact CG1-CD1 3.36Å; V972-L995 HydrophobicContact CG1-CD2 3.92Å; V972-L995 HydrophobicContact CG1-CG 4.3Å; V972-L995 HydrophobicContact CG2-CD1 3.53Å; L974-L995 HydrophobicContact CD2-CD2 3.88Å; P993-L995 HydrophobicContact CG-CD2 4.31Å; P993-L995 PolarHBondContact O-N 2.75Å; L995-S1002 WeakPolarHBondContact O-CB 3.48Å; L995-S1002 PolarHBondContact O-OG 2.96Å; L995-N1003 HydrophobicContact CB-CB 4.41Å; L995-N1003 WeakPolarHBondContact CB-OD1 3.28Å; L995-N1003 HydrophobicContact CD1-CB 3.94Å; L995-N1003 HydrophobicContact CG-CB 4.42Å; L995-N1003 PolarHBondContact N-OD1 3.48Å; L995-A1040 HydrophobicContact CD1-CB 4Å; L995-F1089 HydrophobicContact CD2-CB 4.49Å; L995-G1090 WeakPolarHBondContact CA-O 3.44Å; L995-I1092 HydrophobicContact CB-CB 4.04Å; L995-I1092 HydrophobicContact CB-CG2 3.94Å; L995-I1092 HydrophobicContact CD1-CB 4.08Å; L995-I1092 HydrophobicContact CD1-CD1 4.45Å
996	V	88.9	Confident	89.9	Confident	58 Å²	58	23.3 Å²	23.3	35%	0.352	14%	0.144	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	158	175.2	-63.5	0	0	0	0	111.5	Y1024 G1090 A1091 I1092	V996-Y1024 HydrophobicContact CB-CE2 4.49Å; V996-Y1024 HydrophobicContact CG1-CE2 4.31Å; V996-G1090 PolarHBondContact N-O 2.78Å; V996-G1090 VanDerWaalsContact N-O 3.1Å; V996-A1091 HydrophobicContact CG2-CB 4.23Å; V996-A1091 CarbonylContact O-C 3.58Å; V996-A1091 WeakPolarHBondContact O-CA 3.47Å; V996-A1091 WeakPolarHBondContact O-CB 3.35Å; V996-I1092 PolarHBondContact O-N 2.84Å
997	S	83.8	Confident	89.7	Confident	17 Å²	17	22.6 Å²	22.6	12%	0.119	14%	0.144	C	C	.	.			trans	-131	178.9	167	74.2	0	0	0	0	110.6	S999 Y1001 Y1024 I1092	S997-S999 PolarHBondContact O-N 2.72Å; S997-S999 VanDerWaalsContact O-N 3.14Å; S997-S999 PolarHBondContact OG-N 2.84Å; S997-S999 VanDerWaalsContact OG-N 3.16Å; S997-S999 PolarHBondContact OG-O 3.41Å; S997-S999 PolarHBondContact OG-OG 3.49Å; S997-S999 VanDerWaalsContact OG-OG 3.06Å; S997-Y1001 VanDerWaalsContact CB-O 3.29Å; S997-Y1001 WeakPolarHBondContact CB-O 3.49Å; S997-Y1001 PolarHBondContact OG-N 3.49Å; S997-Y1001 PolarHBondContact OG-O 3.13Å; S997-Y1024 PolarHBondContact N-OH 2.79Å; S997-Y1024 PolarHBondContact O-OH 2.81Å; S997-I1092 VanDerWaalsContact CB-O 3.28Å; S997-I1092 WeakPolarHBondContact CB-O 3.34Å
998	L	74.3	Confident	89.4	Confident	55 Å²	55	23 Å²	23	29%	0.288	14%	0.137	S	C	.	.	S	Bend	trans	-70.3	2.5	171.1	-60.2	173	0	0	0	113.7	I1094 D1111 L1112 E1115	L998-I1094 HydrophobicContact CB-CD1 4.44Å; L998-D1111 HydrophobicContact CD1-CB 3.45Å; L998-D1111 VanDerWaalsContact CD1-CB 3.45Å; L998-L1112 HydrophobicContact CD1-CB 4.14Å; L998-L1112 HydrophobicContact CD2-CD1 3.94Å; L998-L1112 HydrophobicContact CG-CD1 4.19Å; L998-E1115 HydrophobicContact CD2-CB 3.73Å; L998-E1115 HydrophobicContact CD2-CG 3.79Å
999	S	72.1	Confident	88.9	Confident	49 Å²	49	22.5 Å²	22.5	34%	0.343	13%	0.133	S	C	.	.	S	Bend	trans	-133	-167.9	177.5	71.3	0	0	0	0	109.7	S997 Y1001 Y1024 I1094	S997-S999 PolarHBondContact O-N 2.72Å; S997-S999 VanDerWaalsContact O-N 3.14Å; S997-S999 PolarHBondContact OG-N 2.84Å; S997-S999 VanDerWaalsContact OG-N 3.16Å; S997-S999 PolarHBondContact OG-O 3.41Å; S997-S999 PolarHBondContact OG-OG 3.49Å; S997-S999 VanDerWaalsContact OG-OG 3.06Å; S999-Y1001 PolarHBondContact O-N 3.47Å; S999-Y1001 VanDerWaalsContact OG-CB 3.3Å; S999-Y1001 WeakPolarHBondContact OG-CB 3.29Å; S999-Y1001 PolarHBondContact OG-N 2.79Å; S999-Y1024 PolarHBondContact O-OH 2.86Å; S999-I1094 WeakPolarHBondContact OG-CD1 3.5Å
1000	A	76.7	Confident	87.9	Confident	60 Å²	60	29 Å²	29	50%	0.496	16%	0.163	S	C	.	.	S	Bend	trans	-73.8	-0.5	168.6	0	0	0	0	0	113.6	Y1020	A1000-Y1020 VanDerWaalsContact O-CE1 3.3Å; A1000-Y1020 WeakPolarHBondContact O-CE1 3.47Å; A1000-Y1020 PolarHBondContact O-OH 3.01Å
1001	Y	83.1	Confident	86.5	Confident	63 Å²	63	32.5 Å²	32.5	25%	0.247	18%	0.182	C	C	.	.			trans	-70.5	140.4	179.8	-179.5	-100.5	0	0	0	112.4	S997 S999 H1038 I1092 P1095	S997-Y1001 VanDerWaalsContact CB-O 3.29Å; S997-Y1001 WeakPolarHBondContact CB-O 3.49Å; S997-Y1001 PolarHBondContact OG-N 3.49Å; S997-Y1001 PolarHBondContact OG-O 3.13Å; S999-Y1001 PolarHBondContact O-N 3.47Å; S999-Y1001 VanDerWaalsContact OG-CB 3.3Å; S999-Y1001 WeakPolarHBondContact OG-CB 3.29Å; S999-Y1001 PolarHBondContact OG-N 2.79Å; Y1001-H1038 AromaticContact CZ-CE1 3.89Å; Y1001-H1038 PolarHBondContact OH-CE1 2.95Å; Y1001-I1092 HydrophobicContact CD1-CG2 4.07Å; Y1001-I1092 HydrophobicContact CE1-CD1 4.12Å; Y1001-I1092 HydrophobicContact CE1-CG1 4.37Å; Y1001-I1092 HydrophobicContact CE1-CG2 4.07Å; Y1001-P1095 HydrophobicContact CE1-CG 3.97Å; Y1001-P1095 HydrophobicContact CE2-CG 4.35Å; Y1001-P1095 VanDerWaalsContact CZ-CD 3.48Å; Y1001-P1095 VanDerWaalsContact OH-CG 3.29Å; Y1001-P1095 WeakPolarHBondContact OH-CG 3.31Å
1002	S	90.8	Very high	85.2	Confident	0 Å²	0	32.7 Å²	32.7	0%	0	18%	0.184	C	C	.	.			trans	-151.3	171.8	179.4	-166.9	0	0	0	0	110	L995 F1004 Y1020	L995-S1002 WeakPolarHBondContact O-CB 3.48Å; L995-S1002 PolarHBondContact O-OG 2.96Å; S1002-F1004 VanDerWaalsContact C-N 3.33Å; S1002-F1004 PolarHBondContact O-N 3.39Å; S1002-F1004 WeakPolarHBondContact OG-CD1 3.18Å; S1002-F1004 WeakPolarHBondContact OG-CE1 3.43Å; S1002-Y1020 WeakPolarHBondContact CB-OH 3.39Å; S1002-Y1020 PolarHBondContact N-OH 3.47Å; S1002-Y1020 VanDerWaalsContact N-OH 3.11Å
1003	N	94.1	Very high	84.1	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	20%	0.202	C	C	.	.	S	Bend	trans	-92	22.9	-170.5	72.5	-54.3	0	0	0	115.4	P993 L995 H1038 I1092	P993-N1003 PolarHBondContact O-ND2 2.73Å; P993-N1003 PolarHBondContact O-OD1 2.71Å; L995-N1003 HydrophobicContact CB-CB 4.41Å; L995-N1003 WeakPolarHBondContact CB-OD1 3.28Å; L995-N1003 HydrophobicContact CD1-CB 3.94Å; L995-N1003 HydrophobicContact CG-CB 4.42Å; L995-N1003 PolarHBondContact N-OD1 3.48Å; N1003-H1038 VanDerWaalsContact CA-CE1 3.47Å; N1003-H1038 WeakPolarHBondContact CA-CE1 3.31Å; N1003-H1038 WeakPolarHBondContact CB-O 3.32Å; N1003-H1038 PolarHBondContact ND2-O 2.61Å; N1003-H1038 PolarHBondContact O-N 2.89Å; N1003-I1092 HydrophobicContact CB-CD1 4.11Å
1004	F	94.5	Very high	83.2	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	156.1	177.6	75.8	-79.5	0	0	0	109.8	M994 S1002 A1006 Y1020 I1023 V1034 M1036 V1037 V1083	M994-F1004 HydrophobicContact CG-CD1 4.12Å; M994-F1004 HydrophobicContact CG-CE1 3.77Å; M994-F1004 HydrophobicContact SD-CE1 4.09Å; S1002-F1004 VanDerWaalsContact C-N 3.33Å; S1002-F1004 PolarHBondContact O-N 3.39Å; S1002-F1004 WeakPolarHBondContact OG-CD1 3.18Å; S1002-F1004 WeakPolarHBondContact OG-CE1 3.43Å; F1004-A1006 HydrophobicContact CE2-CB 4.23Å; F1004-Y1020 HydrophobicContact CD1-CE2 4.33Å; F1004-Y1020 HydrophobicContact CD2-CD2 4.22Å; F1004-Y1020 HydrophobicContact CD2-CE2 4.24Å; F1004-Y1020 HydrophobicContact CE1-CD2 4.35Å; F1004-Y1020 AromaticContact CE1-CE2 3.87Å; F1004-Y1020 HydrophobicContact CE1-CE2 3.87Å; F1004-Y1020 AromaticContact CE2-CD2 3.53Å; F1004-Y1020 HydrophobicContact CE2-CD2 3.53Å; F1004-Y1020 AromaticContact CE2-CE2 3.8Å; F1004-Y1020 HydrophobicContact CE2-CE2 3.8Å; F1004-Y1020 AromaticContact CZ-CD2 3.59Å; F1004-Y1020 HydrophobicContact CZ-CD2 3.59Å; F1004-Y1020 AromaticContact CZ-CE2 3.59Å; F1004-Y1020 HydrophobicContact CZ-CE2 3.59Å; F1004-Y1020 HydrophobicContact CZ-CG 4.45Å; F1004-Y1020 VanDerWaalsContact O-CE2 3.3Å; F1004-Y1020 WeakPolarHBondContact O-CE2 3.46Å; F1004-I1023 HydrophobicContact CE1-CG2 4.26Å; F1004-I1023 HydrophobicContact CE2-CB 4.21Å; F1004-I1023 HydrophobicContact CE2-CD1 4.38Å; F1004-I1023 HydrophobicContact CE2-CG2 3.93Å; F1004-I1023 HydrophobicContact CZ-CB 3.97Å; F1004-I1023 HydrophobicContact CZ-CG2 3.58Å; F1004-V1034 HydrophobicContact CB-CG2 4.46Å; F1004-V1034 HydrophobicContact CD2-CG1 4.04Å; F1004-M1036 WeakPolarHBondContact CA-O 3.35Å; F1004-V1037 HydrophobicContact CB-CG1 3.97Å; F1004-V1083 HydrophobicContact CB-CB 4Å; F1004-V1083 HydrophobicContact CB-CG1 4.25Å; F1004-V1083 HydrophobicContact CB-CG2 3.97Å; F1004-V1083 HydrophobicContact CD1-CG1 4.47Å; F1004-V1083 HydrophobicContact CD1-CG2 3.96Å; F1004-V1083 HydrophobicContact CD2-CG1 3.84Å; F1004-V1083 HydrophobicContact CE2-CG1 4.29Å; F1004-V1083 HydrophobicContact CG-CB 4.14Å; F1004-V1083 HydrophobicContact CG-CG1 3.93Å; F1004-V1083 HydrophobicContact CG-CG2 3.96Å
1005	W	91.7	Very high	82.5	Confident	42 Å²	42	45 Å²	45	16%	0.159	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	121	171.2	-61.7	-15.4	0	0	0	108.7	I1008 G1012 Y1014 P1035 M1036 H1038	W1005-I1008 HydrophobicContact CB-CG2 4.3Å; W1005-I1008 HydrophobicContact CE3-CG2 3.68Å; W1005-I1008 HydrophobicContact CZ3-CG2 4.45Å; W1005-G1012 WeakPolarHBondContact CZ3-O 3.42Å; W1005-Y1014 HydrophobicContact CB-CD2 3.9Å; W1005-Y1014 AromaticContact CD1-CD2 3.49Å; W1005-Y1014 VanDerWaalsContact CD1-CD2 3.49Å; W1005-Y1014 HydrophobicContact CD2-CD2 4.13Å; W1005-Y1014 HydrophobicContact CD2-CG 4.44Å; W1005-Y1014 AromaticContact CG-CD2 3.59Å; W1005-Y1014 HydrophobicContact CG-CD2 3.59Å; W1005-Y1014 HydrophobicContact CG-CG 4.35Å; W1005-Y1014 VanDerWaalsContact CZ3-N 3.26Å; W1005-P1035 WeakPolarHBondContact O-CD 3.33Å; W1005-P1035 VanDerWaalsContact O-CG 3.32Å; W1005-P1035 WeakPolarHBondContact O-CG 3.35Å; W1005-M1036 HydrophobicContact CB-CB 4.29Å; W1005-M1036 HydrophobicContact CD2-CB 4.48Å; W1005-M1036 HydrophobicContact CD2-SD 4.04Å; W1005-M1036 HydrophobicContact CE3-CB 4.15Å; W1005-M1036 HydrophobicContact CE3-CE 3.97Å; W1005-M1036 HydrophobicContact CE3-CG 4.38Å; W1005-M1036 HydrophobicContact CE3-SD 3.46Å; W1005-M1036 HydrophobicContact CH2-SD 4.07Å; W1005-M1036 HydrophobicContact CZ3-CE 3.75Å; W1005-M1036 HydrophobicContact CZ3-SD 3.48Å; W1005-M1036 WeakPolarHBondContact CZ3-SD 3.41Å; W1005-M1036 PolarHBondContact N-O 3.32Å; W1005-H1038 AromaticContact NE1-NE2 3.8Å
1006	A	88.6	Confident	81.7	Confident	19 Å²	19	49.6 Å²	49.6	16%	0.157	26%	0.259	C	S	.	.	S	Bend	trans	-72.9	-29.4	-179.7	0	0	0	0	0	112.9	F1004 D1019 Y1020 P1035	F1004-A1006 HydrophobicContact CE2-CB 4.23Å; A1006-D1019 HydrophobicContact CB-CB 4.33Å; A1006-Y1020 HydrophobicContact CB-CD2 4.16Å; A1006-P1035 WeakPolarHBondContact O-CD 3.3Å
1007	A	87.9	Confident	81.2	Confident	23 Å²	23	48.1 Å²	48.1	19%	0.19	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	154.8	171.3	0	0	0	0	0	110.8	Q1015	A1007-Q1015 HydrophobicContact CB-CB 4.01Å; A1007-Q1015 HydrophobicContact CB-CG 4.37Å; A1007-Q1015 PolarHBondContact O-N 3.18Å
1008	I	84.7	Confident	81	Confident	44 Å²	44	53.8 Å²	53.8	23%	0.226	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	148.5	171.2	59.8	177.8	0	0	0	109.9	W1005 F1013 Q1015 P1035	W1005-I1008 HydrophobicContact CB-CG2 4.3Å; W1005-I1008 HydrophobicContact CE3-CG2 3.68Å; W1005-I1008 HydrophobicContact CZ3-CG2 4.45Å; I1008-F1013 CarbonylContact C-O 3.57Å; I1008-F1013 WeakPolarHBondContact CA-O 3.33Å; I1008-Q1015 PolarHBondContact O-OE1 3.15Å; I1008-P1035 HydrophobicContact CD1-CB 3.78Å; I1008-P1035 HydrophobicContact CG1-CB 3.76Å; I1008-P1035 HydrophobicContact CG1-CG 4.18Å; I1008-P1035 HydrophobicContact CG2-CB 4.16Å; I1008-P1035 HydrophobicContact CG2-CG 4.04Å
1009	D	80.4	Confident	81.4	Confident	23 Å²	23	54.8 Å²	54.8	12%	0.123	29%	0.286	C	S	.	.			trans	-72.7	176.2	174.6	86.6	-18.9	0	0	0	111.9	N1011 G1012 F1013	D1009-N1011 PolarHBondContact O-N 2.91Å; D1009-N1011 VanDerWaalsContact O-N 3.14Å; D1009-N1011 WeakPolarHBondContact OD1-CA 3.45Å; D1009-N1011 WeakPolarHBondContact OD1-CB 3.49Å; D1009-N1011 PolarHBondContact OD1-N 3.45Å; D1009-N1011 PolarHBondContact OD2-ND2 2.93Å; D1009-G1012 PolarHBondContact O-N 2.85Å; D1009-G1012 PolarHBondContact OD1-N 3.35Å; D1009-F1013 PolarHBondContact N-O 2.88Å; D1009-F1013 PolarHBondContact OD1-N 3.23Å
1010	E	74.9	Confident	82.2	Confident	153 Å²	153	52.9 Å²	52.9	72%	0.715	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-20	178.3	63.2	-167.5	154.5	0	0	114.2	T772	T772-E1010 WeakPolarHBondContact CG2-OE1 3.33Å
1011	N	67.1	Low	82.4	Confident	75 Å²	75	53.5 Å²	53.5	40%	0.401	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.3	-13.3	176.4	-54.5	-75.2	0	0	0	112.7	D1009 F1013 R1064	D1009-N1011 PolarHBondContact O-N 2.91Å; D1009-N1011 VanDerWaalsContact O-N 3.14Å; D1009-N1011 WeakPolarHBondContact OD1-CA 3.45Å; D1009-N1011 WeakPolarHBondContact OD1-CB 3.49Å; D1009-N1011 PolarHBondContact OD1-N 3.45Å; D1009-N1011 PolarHBondContact OD2-ND2 2.93Å; N1011-F1013 HydrophobicContact CB-CD2 3.74Å; N1011-F1013 HydrophobicContact CB-CE2 3.9Å; N1011-R1064 PolarHBondContact O-NH2 3.38Å
1012	G	68.6	Low	82.3	Confident	5 Å²	5	50.9 Å²	50.9	5%	0.052	26%	0.258	C	S	.	.	S	Bend	trans	102.7	-1.5	179.7	0	0	0	0	0	115.5	W1005 D1009 H1068	W1005-G1012 WeakPolarHBondContact CZ3-O 3.42Å; D1009-G1012 PolarHBondContact O-N 2.85Å; D1009-G1012 PolarHBondContact OD1-N 3.35Å; G1012-H1068 PolarHBondContact O-NE2 2.93Å
1013	F	75.3	Confident	82.2	Confident	84 Å²	84	51.2 Å²	51.2	37%	0.368	26%	0.259	S	S	.	.			trans	-82	157.4	-178.8	-62.2	-71.6	0	0	0	112.1	I1008 D1009 N1011 Q1015 H1068	I1008-F1013 CarbonylContact C-O 3.57Å; I1008-F1013 WeakPolarHBondContact CA-O 3.33Å; D1009-F1013 PolarHBondContact N-O 2.88Å; D1009-F1013 PolarHBondContact OD1-N 3.23Å; N1011-F1013 HydrophobicContact CB-CD2 3.74Å; N1011-F1013 HydrophobicContact CB-CE2 3.9Å; F1013-Q1015 PolarHBondContact O-N 3.31Å; F1013-H1068 AromaticContact CD1-CE1 3.93Å; F1013-H1068 AromaticContact CD1-NE2 3.66Å; F1013-H1068 AromaticContact CE1-CE1 3.92Å; F1013-H1068 AromaticContact CE1-NE2 3.82Å
1014	Y	76.8	Confident	81.9	Confident	83 Å²	83	53.2 Å²	53.2	33%	0.325	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-47.1	127	177.8	175.2	-102.5	0	0	0	113.5	W1005 H1016 Y1020	W1005-Y1014 HydrophobicContact CB-CD2 3.9Å; W1005-Y1014 AromaticContact CD1-CD2 3.49Å; W1005-Y1014 VanDerWaalsContact CD1-CD2 3.49Å; W1005-Y1014 HydrophobicContact CD2-CD2 4.13Å; W1005-Y1014 HydrophobicContact CD2-CG 4.44Å; W1005-Y1014 AromaticContact CG-CD2 3.59Å; W1005-Y1014 HydrophobicContact CG-CD2 3.59Å; W1005-Y1014 HydrophobicContact CG-CG 4.35Å; W1005-Y1014 VanDerWaalsContact CZ3-N 3.26Å; Y1014-H1016 HydrophobicContact CE1-CB 4.37Å; Y1014-Y1020 HydrophobicContact CE2-CD2 4.33Å; Y1014-Y1020 HydrophobicContact CE2-CE2 4.35Å
1015	Q	83.8	Confident	81	Confident	91 Å²	91	55.7 Å²	55.7	43%	0.425	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	134.5	168.3	-177.9	172.2	-15.3	0	0	109.1	A1007 I1008 F1013	A1007-Q1015 HydrophobicContact CB-CB 4.01Å; A1007-Q1015 HydrophobicContact CB-CG 4.37Å; A1007-Q1015 PolarHBondContact O-N 3.18Å; I1008-Q1015 PolarHBondContact O-OE1 3.15Å; F1013-Q1015 PolarHBondContact O-N 3.31Å
1016	H	76.9	Confident	80.6	Confident	98 Å²	98	56.7 Å²	56.7	45%	0.454	30%	0.296	S	S	.	.			trans	-66.9	143.7	175.1	-179.2	64.2	0	0	0	110.6	Y1014 D1021	Y1014-H1016 HydrophobicContact CE1-CB 4.37Å; H1016-D1021 IonicContact CE1-OD2 3.26Å; H1016-D1021 PolarHBondContact CE1-OD2 2.66Å
1017	S	79.9	Confident	80.2	Confident	27 Å²	27	63.6 Å²	63.6	19%	0.189	33%	0.325	C	S	.	.			trans	-155.3	139.2	-174.2	169.7	0	0	0	0	109.1	D1019 Y1020	S1017-D1019 PolarHBondContact O-N 3.07Å; S1017-D1019 PolarHBondContact OG-N 3.4Å; S1017-Y1020 WeakPolarHBondContact O-CB 3.47Å; S1017-Y1020 PolarHBondContact O-N 3.41Å
1018	D	78.6	Confident	79.8	Confident	136 Å²	136	67 Å²	67	73%	0.727	34%	0.336	S	S	*	.	H	α-helix	trans	-59.4	-27.4	178.3	-50.5	-23.7	0	0	0	112.4	Y1020 A1022	D1018-Y1020 PolarHBondContact O-N 3.23Å; D1018-A1022 PolarHBondContact O-N 2.83Å
1019	D	82.8	Confident	80	Confident	75 Å²	75	69.1 Å²	69.1	40%	0.401	35%	0.351	S	S	.	.	H	α-helix	trans	-66.3	-25.5	172.9	-81.3	-37.2	0	0	0	112.8	A1006 S1017 I1023 K1028	A1006-D1019 HydrophobicContact CB-CB 4.33Å; S1017-D1019 PolarHBondContact O-N 3.07Å; S1017-D1019 PolarHBondContact OG-N 3.4Å; D1019-I1023 VanDerWaalsContact O-CB 3.29Å; D1019-I1023 WeakPolarHBondContact O-CB 3.32Å; D1019-I1023 WeakPolarHBondContact O-CD1 3.39Å; D1019-I1023 WeakPolarHBondContact O-CG1 3.41Å; D1019-I1023 PolarHBondContact O-N 3.33Å; D1019-K1028 IonicContact OD1-NZ 3.78Å; D1019-K1028 PolarHBondContact OD1-NZ 3.14Å
1020	Y	89.3	Confident	80.4	Confident	9 Å²	9	68.4 Å²	68.4	4%	0.035	35%	0.349	C	S	.	.	H	α-helix	trans	-63	-52.2	176.5	-172.6	-102.4	0	0	0	111.1	A1000 S1002 F1004 A1006 Y1014 S1017 D1018 I1023 Y1024	A1000-Y1020 VanDerWaalsContact O-CE1 3.3Å; A1000-Y1020 WeakPolarHBondContact O-CE1 3.47Å; A1000-Y1020 PolarHBondContact O-OH 3.01Å; S1002-Y1020 WeakPolarHBondContact CB-OH 3.39Å; S1002-Y1020 PolarHBondContact N-OH 3.47Å; S1002-Y1020 VanDerWaalsContact N-OH 3.11Å; F1004-Y1020 HydrophobicContact CD1-CE2 4.33Å; F1004-Y1020 HydrophobicContact CD2-CD2 4.22Å; F1004-Y1020 HydrophobicContact CD2-CE2 4.24Å; F1004-Y1020 HydrophobicContact CE1-CD2 4.35Å; F1004-Y1020 AromaticContact CE1-CE2 3.87Å; F1004-Y1020 HydrophobicContact CE1-CE2 3.87Å; F1004-Y1020 AromaticContact CE2-CD2 3.53Å; F1004-Y1020 HydrophobicContact CE2-CD2 3.53Å; F1004-Y1020 AromaticContact CE2-CE2 3.8Å; F1004-Y1020 HydrophobicContact CE2-CE2 3.8Å; F1004-Y1020 AromaticContact CZ-CD2 3.59Å; F1004-Y1020 HydrophobicContact CZ-CD2 3.59Å; F1004-Y1020 AromaticContact CZ-CE2 3.59Å; F1004-Y1020 HydrophobicContact CZ-CE2 3.59Å; F1004-Y1020 HydrophobicContact CZ-CG 4.45Å; F1004-Y1020 VanDerWaalsContact O-CE2 3.3Å; F1004-Y1020 WeakPolarHBondContact O-CE2 3.46Å; A1006-Y1020 HydrophobicContact CB-CD2 4.16Å; Y1014-Y1020 HydrophobicContact CE2-CD2 4.33Å; Y1014-Y1020 HydrophobicContact CE2-CE2 4.35Å; S1017-Y1020 WeakPolarHBondContact O-CB 3.47Å; S1017-Y1020 PolarHBondContact O-N 3.41Å; D1018-Y1020 PolarHBondContact O-N 3.23Å; Y1020-I1023 PolarHBondContact O-N 2.95Å; Y1020-Y1024 WeakPolarHBondContact O-CB 3.4Å; Y1020-Y1024 PolarHBondContact O-N 3.45Å
1021	D	81.1	Confident	81.4	Confident	74 Å²	74	62.6 Å²	62.6	40%	0.396	33%	0.325	S	S	.	.	H	α-helix	trans	-69.3	-38.5	-177.6	-64.7	-30.9	0	0	0	110.7	H1016 I1023 Y1024 G1025	H1016-D1021 IonicContact CE1-OD2 3.26Å; H1016-D1021 PolarHBondContact CE1-OD2 2.66Å; D1021-I1023 PolarHBondContact O-N 2.64Å; D1021-Y1024 PolarHBondContact O-N 3.06Å; D1021-G1025 WeakPolarHBondContact O-CA 3.43Å; D1021-G1025 PolarHBondContact O-N 2.7Å
1022	A	81.3	Confident	82.7	Confident	8 Å²	8	61 Å²	61	7%	0.066	31%	0.314	C	S	.	.	H	α-helix	trans	-65	-35.4	175.6	0	0	0	0	0	113.4	D1018 R1026 E1027 K1028	D1018-A1022 PolarHBondContact O-N 2.83Å; A1022-R1026 PolarHBondContact O-N 3.45Å; A1022-E1027 HydrophobicContact CB-CB 4.38Å; A1022-E1027 PolarHBondContact O-N 3.17Å; A1022-K1028 HydrophobicContact CB-CD 4Å; A1022-K1028 HydrophobicContact CB-CG 4.12Å; A1022-K1028 PolarHBondContact O-N 2.81Å
1023	I	88	Confident	84	Confident	6 Å²	6	65 Å²	65	3%	0.031	34%	0.339	C	S	.	.	H	α-helix	trans	-75.7	-47.3	173.8	-67.6	167.5	0	0	0	110.2	M994 F1004 D1019 Y1020 D1021 R1026 F1032 V1083 N1085	M994-I1023 HydrophobicContact SD-CG2 3.88Å; F1004-I1023 HydrophobicContact CE1-CG2 4.26Å; F1004-I1023 HydrophobicContact CE2-CB 4.21Å; F1004-I1023 HydrophobicContact CE2-CD1 4.38Å; F1004-I1023 HydrophobicContact CE2-CG2 3.93Å; F1004-I1023 HydrophobicContact CZ-CB 3.97Å; F1004-I1023 HydrophobicContact CZ-CG2 3.58Å; D1019-I1023 VanDerWaalsContact O-CB 3.29Å; D1019-I1023 WeakPolarHBondContact O-CB 3.32Å; D1019-I1023 WeakPolarHBondContact O-CD1 3.39Å; D1019-I1023 WeakPolarHBondContact O-CG1 3.41Å; D1019-I1023 PolarHBondContact O-N 3.33Å; Y1020-I1023 PolarHBondContact O-N 2.95Å; D1021-I1023 PolarHBondContact O-N 2.64Å; I1023-R1026 PolarHBondContact O-N 3.16Å; I1023-R1026 VanDerWaalsContact O-N 3.13Å; I1023-F1032 HydrophobicContact CD1-CB 3.79Å; I1023-F1032 HydrophobicContact CD1-CD1 4.34Å; I1023-F1032 HydrophobicContact CD1-CD2 3.94Å; I1023-F1032 HydrophobicContact CD1-CG 3.75Å; I1023-F1032 HydrophobicContact CG1-CD1 4.45Å; I1023-F1032 HydrophobicContact CG1-CD2 3.77Å; I1023-F1032 HydrophobicContact CG1-CE2 4.06Å; I1023-F1032 HydrophobicContact CG1-CG 3.99Å; I1023-F1032 HydrophobicContact CG2-CD2 3.97Å; I1023-F1032 HydrophobicContact CG2-CE2 4.34Å; I1023-V1083 HydrophobicContact CG2-CG1 4.24Å; I1023-N1085 PolarHBondContact O-ND2 3.08Å
1024	Y	86.7	Confident	84.8	Confident	43 Å²	43	61.4 Å²	61.4	17%	0.169	32%	0.324	C	S	.	.	H	α-helix	trans	-63	-48.1	-177.7	-172.8	-108.2	0	0	0	112.4	M994 V996 S997 S999 Y1020 D1021 R1026	M994-Y1024 VanDerWaalsContact CE-O 3.32Å; M994-Y1024 WeakPolarHBondContact CE-O 3.39Å; V996-Y1024 HydrophobicContact CB-CE2 4.49Å; V996-Y1024 HydrophobicContact CG1-CE2 4.31Å; S997-Y1024 PolarHBondContact N-OH 2.79Å; S997-Y1024 PolarHBondContact O-OH 2.81Å; S999-Y1024 PolarHBondContact O-OH 2.86Å; Y1020-Y1024 WeakPolarHBondContact O-CB 3.4Å; Y1020-Y1024 PolarHBondContact O-N 3.45Å; D1021-Y1024 PolarHBondContact O-N 3.06Å; Y1024-R1026 PolarHBondContact O-N 2.73Å
1025	G	76.5	Confident	85.5	Confident	52 Å²	52	59.8 Å²	59.8	54%	0.536	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-5.3	174.9	0	0	0	0	0	114.5	D1021 E1027	D1021-G1025 WeakPolarHBondContact O-CA 3.43Å; D1021-G1025 PolarHBondContact O-N 2.7Å; G1025-E1027 PolarHBondContact O-N 3.11Å
1026	R	84.4	Confident	85.8	Confident	62 Å²	62	55.5 Å²	55.5	23%	0.234	30%	0.304	C	S	.	.	T	Hydrogen-bonded Turn	trans	61.3	23.7	-176.5	-58.5	171.6	168.2	-89.4	-24.6	114.4	M994 A1022 I1023 Y1024 V1029 N1085 Y1087	M994-R1026 HydrophobicContact CE-CG 4.12Å; A1022-R1026 PolarHBondContact O-N 3.45Å; I1023-R1026 PolarHBondContact O-N 3.16Å; I1023-R1026 VanDerWaalsContact O-N 3.13Å; Y1024-R1026 PolarHBondContact O-N 2.73Å; R1026-V1029 HydrophobicContact CB-CG2 4.18Å; R1026-V1029 VanDerWaalsContact O-CG2 3.23Å; R1026-V1029 WeakPolarHBondContact O-CG2 3.41Å; R1026-N1085 PolarHBondContact NH1-O 2.84Å; R1026-N1085 PolarHBondContact NH2-O 2.85Å; R1026-Y1087 PolarHBondContact NH2-O 2.82Å
1027	E	78.2	Confident	86.6	Confident	164 Å²	164	50.9 Å²	50.9	77%	0.766	28%	0.283	S	S	*	.	S	Bend	trans	-63.7	-36.8	169.3	-55.8	-175.6	165.9	0	0	110.5	A1022 G1025	A1022-E1027 HydrophobicContact CB-CB 4.38Å; A1022-E1027 PolarHBondContact O-N 3.17Å; G1025-E1027 PolarHBondContact O-N 3.11Å
1028	K	80.9	Confident	87.2	Confident	94 Å²	94	49.9 Å²	49.9	41%	0.409	28%	0.275	S	S	.	.	S	Bend	trans	-103.8	114.9	165.5	-63.8	178.1	-175.6	-179.3	0	108.8	D1019 A1022 F1032 N1085	D1019-K1028 IonicContact OD1-NZ 3.78Å; D1019-K1028 PolarHBondContact OD1-NZ 3.14Å; A1022-K1028 HydrophobicContact CB-CD 4Å; A1022-K1028 HydrophobicContact CB-CG 4.12Å; A1022-K1028 PolarHBondContact O-N 2.81Å; K1028-F1032 HydrophobicContact CB-CE1 3.99Å; K1028-F1032 HydrophobicContact CB-CE2 4.43Å; K1028-F1032 HydrophobicContact CB-CZ 3.62Å; K1028-F1032 WeakPolarHBondContact O-CE2 3.35Å; K1028-F1032 WeakPolarHBondContact O-CZ 3.48Å; K1028-N1085 PolarHBondContact O-ND2 3.04Å
1029	V	87.8	Confident	87.8	Confident	89 Å²	89	44 Å²	44	54%	0.539	24%	0.244	S	C	.	.			trans	-104.2	124.7	176.4	-175.8	0	0	0	0	111.4	R1026 N1085	R1026-V1029 HydrophobicContact CB-CG2 4.18Å; R1026-V1029 VanDerWaalsContact O-CG2 3.23Å; R1026-V1029 WeakPolarHBondContact O-CG2 3.41Å; V1029-N1085 WeakPolarHBondContact CA-OD1 3.41Å
1030	G	90.3	Very high	88.4	Confident	8 Å²	8	40.4 Å²	40.4	8%	0.082	23%	0.225	C	C	.	.	S	Bend	trans	168.3	-154.4	-177	0	0	0	0	0	114.4	S1084 N1085 R1086	G1030-S1084 WeakPolarHBondContact O-CA 3.05Å; G1030-N1085 PolarHBondContact N-OD1 3.05Å; G1030-N1085 PolarHBondContact O-N 3.04Å; G1030-N1085 PolarHBondContact O-OD1 3.29Å; G1030-R1086 PolarHBondContact O-N 3.47Å
1031	C	94.5	Very high	88.8	Confident	31 Å²	31	40.1 Å²	40.1	21%	0.209	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	109.9	173.1	-171.9	0	0	0	0	107.6	E986 V1083	E986-C1031 HydrophobicContact CG-CB 4.35Å; C1031-V1083 CarbonylContact C-O 3.44Å; C1031-V1083 WeakPolarHBondContact CA-O 3.43Å
1032	F	95.2	Very high	89.5	Confident	41 Å²	41	36.7 Å²	36.7	18%	0.18	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	133.4	-163.9	-58.9	-77.4	0	0	0	111.3	I1023 K1028 V1034 Y1082 V1083 N1085	I1023-F1032 HydrophobicContact CD1-CB 3.79Å; I1023-F1032 HydrophobicContact CD1-CD1 4.34Å; I1023-F1032 HydrophobicContact CD1-CD2 3.94Å; I1023-F1032 HydrophobicContact CD1-CG 3.75Å; I1023-F1032 HydrophobicContact CG1-CD1 4.45Å; I1023-F1032 HydrophobicContact CG1-CD2 3.77Å; I1023-F1032 HydrophobicContact CG1-CE2 4.06Å; I1023-F1032 HydrophobicContact CG1-CG 3.99Å; I1023-F1032 HydrophobicContact CG2-CD2 3.97Å; I1023-F1032 HydrophobicContact CG2-CE2 4.34Å; K1028-F1032 HydrophobicContact CB-CE1 3.99Å; K1028-F1032 HydrophobicContact CB-CE2 4.43Å; K1028-F1032 HydrophobicContact CB-CZ 3.62Å; K1028-F1032 WeakPolarHBondContact O-CE2 3.35Å; K1028-F1032 WeakPolarHBondContact O-CZ 3.48Å; F1032-V1034 PolarHBondContact O-N 3.18Å; F1032-Y1082 CarbonylContact O-C 3.59Å; F1032-Y1082 VanDerWaalsContact O-CA 3.22Å; F1032-Y1082 WeakPolarHBondContact O-CA 3.17Å; F1032-V1083 HydrophobicContact CB-CG1 4.32Å; F1032-V1083 PolarHBondContact N-O 3.1Å; F1032-V1083 PolarHBondContact O-N 3.26Å; F1032-N1085 WeakPolarHBondContact CE2-OD1 3.31Å
1033	P	95	Very high	90.3	Very high	89 Å²	89	36.3 Å²	36.3	58%	0.578	20%	0.203	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-67.9	129.8	171	29.7	-32.7	0	0	0	109.2	P1080 M1081 Y1082	P1033-P1080 HydrophobicContact CB-CB 4.45Å; P1033-M1081 CarbonylContact C-O 3.57Å; P1033-M1081 WeakPolarHBondContact CA-O 3.49Å; P1033-Y1082 HydrophobicContact CB-CD1 4.14Å; P1033-Y1082 HydrophobicContact CB-CE1 3.85Å; P1033-Y1082 HydrophobicContact CG-CE1 4.39Å
1034	V	93.7	Very high	90.6	Very high	10 Å²	10	36.5 Å²	36.5	6%	0.061	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	148.8	-178.3	-69.8	0	0	0	0	110.1	F1004 F1032 M1036 V1037 M1081 V1083	F1004-V1034 HydrophobicContact CB-CG2 4.46Å; F1004-V1034 HydrophobicContact CD2-CG1 4.04Å; F1032-V1034 PolarHBondContact O-N 3.18Å; V1034-M1036 VanDerWaalsContact C-N 3.31Å; V1034-M1036 PolarHBondContact O-N 2.94Å; V1034-V1037 HydrophobicContact CG2-CG1 3.49Å; V1034-V1037 VanDerWaalsContact CG2-CG1 3.49Å; V1034-M1081 PolarHBondContact N-O 3.09Å; V1034-V1083 HydrophobicContact CG1-CG1 3.73Å; V1034-V1083 HydrophobicContact CG2-CB 4.11Å; V1034-V1083 HydrophobicContact CG2-CG1 4.01Å
1035	P	90.2	Very high	91	Very high	48 Å²	48	35.4 Å²	35.4	31%	0.312	20%	0.201	S	C	.	.	S	Bend	trans	-68.2	-24.8	-177.1	24.4	-35	0	0	0	114.7	W1005 A1006 I1008	W1005-P1035 WeakPolarHBondContact O-CD 3.33Å; W1005-P1035 VanDerWaalsContact O-CG 3.32Å; W1005-P1035 WeakPolarHBondContact O-CG 3.35Å; A1006-P1035 WeakPolarHBondContact O-CD 3.3Å; I1008-P1035 HydrophobicContact CD1-CB 3.78Å; I1008-P1035 HydrophobicContact CG1-CB 3.76Å; I1008-P1035 HydrophobicContact CG1-CG 4.18Å; I1008-P1035 HydrophobicContact CG2-CB 4.16Å; I1008-P1035 HydrophobicContact CG2-CG 4.04Å
1036	M	90.4	Very high	91.8	Very high	2 Å²	2	37.8 Å²	37.8	1%	0.01	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	139.3	176	-168.5	178.4	-69.8	0	0	111.7	F1004 W1005 V1034 L1067 A1071	F1004-M1036 WeakPolarHBondContact CA-O 3.35Å; W1005-M1036 HydrophobicContact CB-CB 4.29Å; W1005-M1036 HydrophobicContact CD2-CB 4.48Å; W1005-M1036 HydrophobicContact CD2-SD 4.04Å; W1005-M1036 HydrophobicContact CE3-CB 4.15Å; W1005-M1036 HydrophobicContact CE3-CE 3.97Å; W1005-M1036 HydrophobicContact CE3-CG 4.38Å; W1005-M1036 HydrophobicContact CE3-SD 3.46Å; W1005-M1036 HydrophobicContact CH2-SD 4.07Å; W1005-M1036 HydrophobicContact CZ3-CE 3.75Å; W1005-M1036 HydrophobicContact CZ3-SD 3.48Å; W1005-M1036 WeakPolarHBondContact CZ3-SD 3.41Å; W1005-M1036 PolarHBondContact N-O 3.32Å; V1034-M1036 VanDerWaalsContact C-N 3.31Å; V1034-M1036 PolarHBondContact O-N 2.94Å; M1036-L1067 HydrophobicContact SD-CB 4.16Å; M1036-A1071 HydrophobicContact CE-CB 3.94Å; M1036-A1071 HydrophobicContact CG-CB 4.34Å
1037	V	94.2	Very high	91.9	Very high	1 Å²	1	38.6 Å²	38.6	1%	0.006	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	147.3	163.1	-63.4	0	0	0	0	109.7	V990 A992 F1004 V1034 V1041 M1081 V1083	V990-V1037 HydrophobicContact CG1-CG2 4.43Å; A992-V1037 HydrophobicContact CB-CB 3.58Å; A992-V1037 HydrophobicContact CB-CG1 3.76Å; A992-V1037 HydrophobicContact CB-CG2 3.94Å; F1004-V1037 HydrophobicContact CB-CG1 3.97Å; V1034-V1037 HydrophobicContact CG2-CG1 3.49Å; V1034-V1037 VanDerWaalsContact CG2-CG1 3.49Å; V1037-V1041 HydrophobicContact CB-CG2 4.37Å; V1037-V1041 HydrophobicContact CG2-CG1 3.9Å; V1037-V1041 HydrophobicContact CG2-CG2 3.85Å; V1037-M1081 HydrophobicContact CG2-CB 4.12Å; V1037-M1081 HydrophobicContact CG2-CE 3.7Å; V1037-M1081 HydrophobicContact CG2-SD 4.19Å; V1037-V1083 HydrophobicContact CG1-CB 4.18Å
1038	H	92	Very high	92.4	Very high	5 Å²	5	34.6 Å²	34.6	2%	0.023	20%	0.196	C	C	.	.			trans	-142	176.1	-179.1	64.2	84	0	0	0	111.6	Y1001 N1003 W1005 A1040 L1067	Y1001-H1038 AromaticContact CZ-CE1 3.89Å; Y1001-H1038 PolarHBondContact OH-CE1 2.95Å; N1003-H1038 VanDerWaalsContact CA-CE1 3.47Å; N1003-H1038 WeakPolarHBondContact CA-CE1 3.31Å; N1003-H1038 WeakPolarHBondContact CB-O 3.32Å; N1003-H1038 PolarHBondContact ND2-O 2.61Å; N1003-H1038 PolarHBondContact O-N 2.89Å; W1005-H1038 AromaticContact NE1-NE2 3.8Å; H1038-A1040 PolarHBondContact O-N 2.92Å; H1038-L1067 HydrophobicContact CB-CD1 3.7Å; H1038-L1067 HydrophobicContact CB-CD2 3.68Å; H1038-L1067 HydrophobicContact CB-CG 4.22Å
1039	S	91.7	Very high	92.8	Very high	12 Å²	12	36.3 Å²	36.3	8%	0.084	20%	0.204	C	C	.	.	S	Bend	trans	57.9	-20.6	173	-53.1	0	0	0	0	119.4	L968 D969 V972	L968-S1039 CarbonylContact C-O 3.38Å; L968-S1039 WeakPolarHBondContact CA-O 3.24Å; D969-S1039 PolarHBondContact N-O 3.41Å; D969-S1039 WeakPolarHBondContact OD2-CA 3.21Å; D969-S1039 WeakPolarHBondContact OD2-CB 3.47Å; D969-S1039 PolarHBondContact OD2-OG 3.31Å; V972-S1039 WeakPolarHBondContact CG2-O 3.49Å
1040	A	95.7	Very high	92.9	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	87.8	170.9	0	0	0	0	0	108	F966 Y967 L968 V972 A992 P993 L995 H1038	F966-A1040 HydrophobicContact CE2-CB 4.12Å; F966-A1040 HydrophobicContact CZ-CB 4.14Å; Y967-A1040 CarbonylContact O-C 3.55Å; Y967-A1040 WeakPolarHBondContact O-CA 3.3Å; L968-A1040 HydrophobicContact CD1-CB 3.76Å; V972-A1040 HydrophobicContact CG1-CB 4.35Å; A992-A1040 VanDerWaalsContact CA-O 3.23Å; A992-A1040 WeakPolarHBondContact CA-O 3.48Å; A992-A1040 WeakPolarHBondContact CB-O 3.21Å; P993-A1040 WeakPolarHBondContact CD-O 3.13Å; P993-A1040 HydrophobicContact CG-CB 3.75Å; L995-A1040 HydrophobicContact CD1-CB 4Å; H1038-A1040 PolarHBondContact O-N 2.92Å
1041	V	96.5	Very high	92.9	Very high	4 Å²	4	37.1 Å²	37.1	2%	0.024	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	109.9	-171.6	-171.8	0	0	0	0	110.9	Y967 V990 V1037 I1043 L1070	Y967-V1041 PolarHBondContact N-O 2.84Å; Y967-V1041 PolarHBondContact O-N 3.36Å; V990-V1041 HydrophobicContact CG1-CG1 3.64Å; V1037-V1041 HydrophobicContact CB-CG2 4.37Å; V1037-V1041 HydrophobicContact CG2-CG1 3.9Å; V1037-V1041 HydrophobicContact CG2-CG2 3.85Å; V1041-I1043 HydrophobicContact CG1-CG1 4.36Å; V1041-L1070 HydrophobicContact CG1-CD2 4.28Å
1042	L	97.2	Very high	92.7	Very high	2 Å²	2	43.6 Å²	43.6	1%	0.01	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	129.7	176.9	-174.9	71.4	0	0	0	109.5	F964 I965 F966 L980 L983 M984 V990 V991	F964-L1042 HydrophobicContact CB-CD1 3.92Å; F964-L1042 HydrophobicContact CD1-CD1 3.99Å; F964-L1042 HydrophobicContact CD1-CD2 4.09Å; F964-L1042 HydrophobicContact CD1-CG 3.93Å; F964-L1042 HydrophobicContact CE1-CD2 4.3Å; F964-L1042 HydrophobicContact CG-CD1 4.27Å; I965-L1042 WeakPolarHBondContact O-CA 3.45Å; F966-L1042 HydrophobicContact CB-CD1 3.75Å; F966-L1042 HydrophobicContact CD2-CB 3.78Å; F966-L1042 HydrophobicContact CD2-CD1 4.13Å; F966-L1042 HydrophobicContact CE2-CB 4.23Å; F966-L1042 HydrophobicContact CG-CD1 4.09Å; L980-L1042 HydrophobicContact CD2-CD1 4.47Å; L983-L1042 HydrophobicContact CB-CD2 3.61Å; M984-L1042 HydrophobicContact CG-CD2 3.98Å; V990-L1042 WeakPolarHBondContact CA-O 3.48Å; V991-L1042 HydrophobicContact CG1-CB 4.04Å; V991-L1042 HydrophobicContact CG1-CD2 4.21Å; V991-L1042 PolarHBondContact N-O 3.04Å; V991-L1042 PolarHBondContact O-N 3.2Å
1043	I	96.3	Very high	92.5	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	124.9	177.1	-51.7	-179.6	0	0	0	110.1	F964 I965 Y967 I989 V990 V1041 L1045 I1053 L1070	F964-I1043 WeakPolarHBondContact CA-O 3.47Å; I965-I1043 HydrophobicContact CG2-CB 3.77Å; I965-I1043 HydrophobicContact CG2-CG1 4.42Å; I965-I1043 PolarHBondContact N-O 3.2Å; I965-I1043 PolarHBondContact O-N 2.96Å; Y967-I1043 HydrophobicContact CD2-CD1 4.44Å; Y967-I1043 HydrophobicContact CE2-CD1 4.13Å; I989-I1043 HydrophobicContact CG2-CG2 4.38Å; I989-I1043 CarbonylContact O-C 3.54Å; I989-I1043 WeakPolarHBondContact O-CA 3.24Å; V990-I1043 HydrophobicContact CG1-CG1 4.41Å; V990-I1043 HydrophobicContact CG2-CG1 4.32Å; V990-I1043 HydrophobicContact CG2-CG2 4.39Å; V1041-I1043 HydrophobicContact CG1-CG1 4.36Å; I1043-L1045 HydrophobicContact CG2-CD2 4.18Å; I1043-L1045 PolarHBondContact O-N 2.69Å; I1043-I1053 HydrophobicContact CD1-CG2 4.46Å; I1043-I1053 HydrophobicContact CG2-CD1 3.88Å; I1043-L1070 HydrophobicContact CD1-CD1 4.29Å
1044	D	95.6	Very high	92.2	Very high	10 Å²	10	38.6 Å²	38.6	5%	0.053	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	112.3	172.5	-168.6	-29.5	0	0	0	110.2	F964 I989 R1046 M1047 S1050	F964-D1044 HydrophobicContact CD1-CB 3.98Å; F964-D1044 HydrophobicContact CE1-CB 3.61Å; F964-D1044 HydrophobicContact CZ-CB 4.39Å; I989-D1044 PolarHBondContact O-N 2.99Å; D1044-R1046 VanDerWaalsContact OD1-CB 3.25Å; D1044-R1046 WeakPolarHBondContact OD1-CB 3.39Å; D1044-R1046 IonicContact OD1-CZ 2.62Å; D1044-R1046 PolarHBondContact OD1-N 2.84Å; D1044-R1046 IonicContact OD1-NE 3.31Å; D1044-R1046 PolarHBondContact OD1-NE 3.3Å; D1044-R1046 IonicContact OD1-NH2 3.97Å; D1044-R1046 IonicContact OD2-CZ 3.19Å; D1044-R1046 IonicContact OD2-NE 3.14Å; D1044-R1046 PolarHBondContact OD2-NE 3.22Å; D1044-R1046 IonicContact OD2-NH2 3.9Å; D1044-R1046 PolarHBondContact OD2-NH2 2.99Å; D1044-M1047 HydrophobicContact CB-CG 4.5Å; D1044-S1050 WeakPolarHBondContact O-CB 3.38Å
1045	L	95.5	Very high	91.9	Very high	20 Å²	20	38.5 Å²	38.5	11%	0.105	19%	0.192	C	C	.	.	S	Bend	trans	-87.6	-16	-177.5	-62.6	-179.6	0	0	0	112.9	L954 A957 D963 I965 I1043 M1047 S1050	L954-L1045 HydrophobicContact CD1-CD2 3.86Å; A957-L1045 HydrophobicContact CB-CD1 3.45Å; A957-L1045 VanDerWaalsContact CB-CD1 3.45Å; D963-L1045 WeakPolarHBondContact O-CB 3.42Å; D963-L1045 PolarHBondContact O-N 2.87Å; I965-L1045 HydrophobicContact CB-CD1 4.02Å; I965-L1045 HydrophobicContact CG2-CD1 3.89Å; I965-L1045 HydrophobicContact CG2-CD2 3.91Å; I965-L1045 HydrophobicContact CG2-CG 3.98Å; I1043-L1045 HydrophobicContact CG2-CD2 4.18Å; I1043-L1045 PolarHBondContact O-N 2.69Å; L1045-M1047 VanDerWaalsContact C-N 3.27Å; L1045-M1047 PolarHBondContact O-N 2.78Å; L1045-S1050 PolarHBondContact O-OG 2.89Å
1046	R	91.4	Very high	91.2	Very high	101 Å²	101	39.2 Å²	39.2	38%	0.381	20%	0.203	S	C	.	.	S	Bend	trans	-69	-28.2	179.4	-52.5	168	-65.7	-178.5	11.7	111.9	D963 D1044 A1048	D963-R1046 HydrophobicContact CB-CG 3.88Å; D963-R1046 WeakPolarHBondContact OD1-CD 3.26Å; D963-R1046 VanDerWaalsContact OD1-CG 3.31Å; D963-R1046 WeakPolarHBondContact OD1-CG 3.31Å; D1044-R1046 VanDerWaalsContact OD1-CB 3.25Å; D1044-R1046 WeakPolarHBondContact OD1-CB 3.39Å; D1044-R1046 IonicContact OD1-CZ 2.62Å; D1044-R1046 PolarHBondContact OD1-N 2.84Å; D1044-R1046 IonicContact OD1-NE 3.31Å; D1044-R1046 PolarHBondContact OD1-NE 3.3Å; D1044-R1046 IonicContact OD1-NH2 3.97Å; D1044-R1046 IonicContact OD2-CZ 3.19Å; D1044-R1046 IonicContact OD2-NE 3.14Å; D1044-R1046 PolarHBondContact OD2-NE 3.22Å; D1044-R1046 IonicContact OD2-NH2 3.9Å; D1044-R1046 PolarHBondContact OD2-NH2 2.99Å; R1046-A1048 PolarHBondContact O-N 3.15Å
1047	M	88.1	Confident	89.7	Confident	80 Å²	80	45 Å²	45	39%	0.394	23%	0.233	S	C	.	.	S	Bend	trans	-76.5	119.8	179.1	-62.2	-159.3	75	0	0	111.1	I989 D1044 L1045 K1049 S1050	I989-M1047 HydrophobicContact CD1-CB 4.06Å; I989-M1047 HydrophobicContact CD1-CE 4.31Å; I989-M1047 HydrophobicContact CD1-SD 3.94Å; I989-M1047 HydrophobicContact CG1-CB 4Å; I989-M1047 HydrophobicContact CG1-CE 4.32Å; I989-M1047 HydrophobicContact CG1-CG 4.17Å; I989-M1047 HydrophobicContact CG1-SD 3.36Å; I989-M1047 WeakPolarHBondContact CG1-SD 3.28Å; D1044-M1047 HydrophobicContact CB-CG 4.5Å; L1045-M1047 VanDerWaalsContact C-N 3.27Å; L1045-M1047 PolarHBondContact O-N 2.78Å; M1047-K1049 PolarHBondContact O-N 3.27Å; M1047-S1050 WeakPolarHBondContact O-CB 3.34Å; M1047-S1050 PolarHBondContact O-N 3.23Å; M1047-S1050 PolarHBondContact O-OG 3.48Å
1048	A	87.8	Confident	87.6	Confident	80 Å²	80	47.9 Å²	47.9	66%	0.661	26%	0.263	S	S	*	.	G	3₁₀ helix	trans	-54.9	-25.5	-175.8	0	0	0	0	0	115.5	R1046 S1050 L1051	R1046-A1048 PolarHBondContact O-N 3.15Å; A1048-S1050 VanDerWaalsContact C-N 3.27Å; A1048-S1050 PolarHBondContact O-N 3.05Å; A1048-L1051 WeakPolarHBondContact O-CB 3.14Å; A1048-L1051 PolarHBondContact O-N 3.35Å
1049	K	89.2	Confident	85.2	Confident	129 Å²	129	52.6 Å²	52.6	56%	0.561	30%	0.303	S	S	*	.	G	3₁₀ helix	trans	-65.6	-27.7	173.7	-65.6	-173.6	-177.4	-179.5	0	112.7	I989 M1047 L1051 R1052 L1079	I989-K1049 HydrophobicContact CD1-CB 3.85Å; I989-K1049 HydrophobicContact CD1-CD 4.41Å; M1047-K1049 PolarHBondContact O-N 3.27Å; K1049-L1051 PolarHBondContact O-N 2.84Å; K1049-R1052 PolarHBondContact O-N 2.76Å; K1049-L1079 HydrophobicContact CB-CD1 4.29Å; K1049-L1079 HydrophobicContact CB-CD2 4.11Å; K1049-L1079 HydrophobicContact CD-CD2 3.8Å
1050	S	90	Very high	83	Confident	1 Å²	1	60.9 Å²	60.9	1%	0.007	34%	0.341	C	S	.	.	G	3₁₀ helix	trans	-60.4	-25.6	178.4	79.6	0	0	0	0	112.7	R958 D1044 L1045 M1047 A1048 R1052 I1053	R958-S1050 PolarHBondContact NH2-O 2.92Å; D1044-S1050 WeakPolarHBondContact O-CB 3.38Å; L1045-S1050 PolarHBondContact O-OG 2.89Å; M1047-S1050 WeakPolarHBondContact O-CB 3.34Å; M1047-S1050 PolarHBondContact O-N 3.23Å; M1047-S1050 PolarHBondContact O-OG 3.48Å; A1048-S1050 VanDerWaalsContact C-N 3.27Å; A1048-S1050 PolarHBondContact O-N 3.05Å; S1050-R1052 PolarHBondContact O-N 3.07Å; S1050-R1052 VanDerWaalsContact O-N 3.13Å; S1050-I1053 WeakPolarHBondContact O-CB 3.33Å; S1050-I1053 PolarHBondContact O-N 2.89Å
1051	L	90.5	Very high	80.7	Confident	113 Å²	113	66.5 Å²	66.5	59%	0.592	37%	0.367	S	S	*	.	G	3₁₀ helix	trans	-59.4	-22.9	177.7	-66.4	173.5	0	0	0	113.2	A1048 K1049	A1048-L1051 WeakPolarHBondContact O-CB 3.14Å; A1048-L1051 PolarHBondContact O-N 3.35Å; K1049-L1051 PolarHBondContact O-N 2.84Å
1052	R	89.5	Confident	78.3	Confident	168 Å²	168	77.3 Å²	77.3	63%	0.634	41%	0.407	S	S	*	.	G	3₁₀ helix	trans	-79.1	-17.1	176.8	-62.9	-177.5	178.3	-173	-3.2	113.7	K1049 S1050 A1077	K1049-R1052 PolarHBondContact O-N 2.76Å; S1050-R1052 PolarHBondContact O-N 3.07Å; S1050-R1052 VanDerWaalsContact O-N 3.13Å; R1052-A1077 HydrophobicContact CB-CB 3.68Å
1053	I	91	Very high	76.2	Confident	1 Å²	1	83.2 Å²	83.2	1%	0.005	44%	0.435	C	S	.	.			trans	-71	134.7	177.5	-55.8	173.7	0	0	0	108.7	L954 R958 I989 V990 I1043 S1050 L1070 S1073 V1074 L1079	L954-I1053 HydrophobicContact CD2-CG2 4.25Å; L954-I1053 WeakPolarHBondContact CD2-O 3.48Å; R958-I1053 PolarHBondContact NH1-O 3.03Å; R958-I1053 PolarHBondContact NH2-O 3.12Å; I989-I1053 HydrophobicContact CG2-CD1 4.04Å; V990-I1053 HydrophobicContact CG2-CD1 3.77Å; I1043-I1053 HydrophobicContact CD1-CG2 4.46Å; I1043-I1053 HydrophobicContact CG2-CD1 3.88Å; S1050-I1053 WeakPolarHBondContact O-CB 3.33Å; S1050-I1053 PolarHBondContact O-N 2.89Å; I1053-L1070 HydrophobicContact CG2-CD1 3.67Å; I1053-S1073 WeakPolarHBondContact CA-OG 3.31Å; I1053-V1074 HydrophobicContact CD1-CG2 4.16Å; I1053-V1074 HydrophobicContact CG1-CG2 4.14Å; I1053-V1074 HydrophobicContact CG2-CG2 4.13Å; I1053-L1079 HydrophobicContact CD1-CD1 4.13Å; I1053-L1079 HydrophobicContact CG1-CD1 4.22Å
1054	T	89.8	Confident	74.4	Confident	23 Å²	23	86.4 Å²	86.4	14%	0.141	45%	0.447	C	S	.	.			trans	-160.2	140.7	-174.4	177.5	0	0	0	0	110.2	Q951 A1056 N1057 S1073	Q951-T1054 PolarHBondContact OE1-OG1 3.06Å; Q951-T1054 VanDerWaalsContact OE1-OG1 3.1Å; T1054-A1056 WeakPolarHBondContact OG1-CB 3.49Å; T1054-A1056 PolarHBondContact OG1-N 3.01Å; T1054-N1057 HydrophobicContact CG2-CB 4.41Å; T1054-N1057 WeakPolarHBondContact CG2-OD1 3.43Å; T1054-S1073 WeakPolarHBondContact CG2-OG 3.27Å; T1054-S1073 PolarHBondContact N-OG 3.12Å; T1054-S1073 WeakPolarHBondContact O-CB 3.33Å; T1054-S1073 PolarHBondContact O-OG 3.26Å
1055	F	86.5	Confident	73.4	Confident	8 Å²	8	87.1 Å²	87.1	4%	0.035	45%	0.451	C	S	.	.	S	Bend	trans	-92	-2.4	168.5	-61.3	-100.9	0	0	0	111.4	S947 K950 Q951 L954 Y967 L1070	S947-F1055 WeakPolarHBondContact O-CB 3.38Å; K950-F1055 HydrophobicContact CB-CD1 3.62Å; K950-F1055 HydrophobicContact CB-CD2 3.81Å; K950-F1055 HydrophobicContact CB-CE1 3.58Å; K950-F1055 HydrophobicContact CB-CE2 3.8Å; K950-F1055 HydrophobicContact CB-CG 3.73Å; K950-F1055 HydrophobicContact CB-CZ 3.68Å; K950-F1055 HydrophobicContact CD-CD1 4.2Å; K950-F1055 HydrophobicContact CD-CE1 3.58Å; K950-F1055 HydrophobicContact CD-CZ 4.02Å; K950-F1055 HydrophobicContact CG-CE1 4.15Å; K950-F1055 HydrophobicContact CG-CZ 4.35Å; Q951-F1055 HydrophobicContact CB-CB 4.06Å; L954-F1055 HydrophobicContact CD2-CD2 4.18Å; L954-F1055 HydrophobicContact CD2-CE2 4.22Å; Y967-F1055 HydrophobicContact CE1-CZ 4.44Å; Y967-F1055 HydrophobicContact CE2-CE2 4.1Å; Y967-F1055 HydrophobicContact CE2-CZ 4.03Å; Y967-F1055 AromaticContact CZ-CE2 3.82Å; Y967-F1055 AromaticContact CZ-CZ 3.94Å; Y967-F1055 WeakPolarHBondContact OH-CE2 3.44Å; F1055-L1070 HydrophobicContact CD1-CB 4.24Å; F1055-L1070 HydrophobicContact CE1-CB 3.65Å; F1055-L1070 HydrophobicContact CE1-CD1 4.16Å; F1055-L1070 HydrophobicContact CE1-CD2 4.27Å; F1055-L1070 HydrophobicContact CE1-CG 4.22Å; F1055-L1070 HydrophobicContact CE2-CD1 4.21Å; F1055-L1070 HydrophobicContact CZ-CB 4.14Å; F1055-L1070 HydrophobicContact CZ-CD1 3.77Å; F1055-L1070 HydrophobicContact CZ-CD2 4.09Å; F1055-L1070 HydrophobicContact CZ-CG 4.2Å
1056	A	75.7	Confident	72.6	Confident	64 Å²	64	87 Å²	87	53%	0.529	45%	0.449	S	S	.	.			trans	-90.9	4.7	-172	0	0	0	0	0	116	Q951 T1054 G1058	Q951-A1056 HydrophobicContact CG-CB 3.99Å; T1054-A1056 WeakPolarHBondContact OG1-CB 3.49Å; T1054-A1056 PolarHBondContact OG1-N 3.01Å; A1056-G1058 PolarHBondContact O-N 3.08Å
1057	N	59.6	Low	72.2	Confident	122 Å²	122	83.8 Å²	83.8	65%	0.652	44%	0.44	S	S	*	.			trans	-76.9	47.5	-178.9	-78.3	-1.7	0	0	0	112.7	T1054	T1054-N1057 HydrophobicContact CG2-CB 4.41Å; T1054-N1057 WeakPolarHBondContact CG2-OD1 3.43Å
1058	G	50.2	Low	71.8	Confident	62 Å²	62	80.1 Å²	80.1	64%	0.639	42%	0.422	S	S	*	.			trans	-90.4	8.2	-172.7	0	0	0	0	0	116.2	A1056 Q1060	A1056-G1058 PolarHBondContact O-N 3.08Å; G1058-Q1060 VanDerWaalsContact C-N 3.29Å; G1058-Q1060 PolarHBondContact O-N 2.9Å
1059	A	41.9	Very low	71.5	Confident	104 Å²	104	77.5 Å²	77.5	86%	0.86	40%	0.4	S	S	*	.	S	Bend	trans	-73.9	-8.7	-170.3	0	0	0	0	0	115.7
1060	Q	44.5	Very low	71.4	Confident	187 Å²	187	71.6 Å²	71.6	87%	0.874	37%	0.374	S	S	*	.	S	Bend	trans	-138.3	-2.6	-172.3	-75.4	-164.8	-21.2	0	0	117.6	G1058	G1058-Q1060 VanDerWaalsContact C-N 3.29Å; G1058-Q1060 PolarHBondContact O-N 2.9Å
1061	Q	48.4	Very low	71.3	Confident	118 Å²	118	72 Å²	72	55%	0.551	38%	0.378	S	S	*	.			trans	-133.4	107.4	-175.6	-67.3	-175.5	-9.9	0	0	112.7
1062	R	46.3	Very low	71	Confident	230 Å²	230	68.6 Å²	68.6	87%	0.868	36%	0.36	S	S	*	.	S	Bend	trans	-75.7	146.7	163.3	-70.3	174.7	169.3	162.1	-3.9	108.9
1063	H	52.3	Low	70.9	Confident	127 Å²	127	60.7 Å²	60.7	59%	0.588	33%	0.331	S	S	*	.	S	Bend	trans	78.1	33.2	178.1	-49.2	-58	0	0	0	118.4	E940	E940-H1063 VanDerWaalsContact CD-ND1 3.28Å; E940-H1063 IonicContact OE1-CE1 2.71Å; E940-H1063 IonicContact OE1-CG 3.18Å; E940-H1063 IonicContact OE1-ND1 3.99Å; E940-H1063 PolarHBondContact OE1-ND1 3Å; E940-H1063 WeakPolarHBondContact OE2-CA 3.37Å; E940-H1063 PolarHBondContact OE2-N 3.43Å; E940-H1063 IonicContact OE2-ND1 3.19Å; E940-H1063 PolarHBondContact OE2-ND1 3.13Å
1064	R	58.9	Low	70.8	Confident	67 Å²	67	60.7 Å²	60.7	25%	0.253	33%	0.331	S	S	.	.			trans	-123.7	137.3	166.8	-82.5	-176.4	170.3	-178.3	-8	111.5	N1011 H1068 D1072	N1011-R1064 PolarHBondContact O-NH2 3.38Å; R1064-H1068 HydrophobicContact CB-CB 3.94Å; R1064-H1068 HydrophobicContact CG-CB 3.97Å; R1064-D1072 WeakPolarHBondContact CD-OD2 3.34Å; R1064-D1072 IonicContact CZ-OD1 2.71Å; R1064-D1072 IonicContact CZ-OD2 2.7Å; R1064-D1072 IonicContact NE-OD2 3.36Å; R1064-D1072 IonicContact NH1-OD1 3.25Å; R1064-D1072 PolarHBondContact NH1-OD1 3.48Å; R1064-D1072 IonicContact NH1-OD2 2.69Å; R1064-D1072 PolarHBondContact NH1-OD2 3.43Å
1065	D	74.1	Confident	70.7	Confident	25 Å²	25	66.6 Å²	66.6	13%	0.134	35%	0.354	C	S	.	.			trans	-81.6	177.7	176.3	64.6	44.3	0	0	0	112.2	Y943 L1067 H1068 A1069	Y943-D1065 HydrophobicContact CD1-CB 3.31Å; Y943-D1065 HydrophobicContact CD2-CB 4.21Å; Y943-D1065 HydrophobicContact CE1-CB 3.39Å; Y943-D1065 HydrophobicContact CE2-CB 4.29Å; Y943-D1065 HydrophobicContact CG-CB 3.76Å; D1065-L1067 VanDerWaalsContact C-N 3.27Å; D1065-L1067 PolarHBondContact O-N 3.05Å; D1065-L1067 WeakPolarHBondContact OD1-CA 3.34Å; D1065-L1067 VanDerWaalsContact OD1-CB 3.29Å; D1065-L1067 WeakPolarHBondContact OD1-CB 3.3Å; D1065-L1067 PolarHBondContact OD1-N 2.83Å; D1065-H1068 PolarHBondContact O-N 3.05Å; D1065-H1068 IonicContact OD1-CE1 3.84Å; D1065-H1068 IonicContact OD1-CG 3.91Å; D1065-H1068 PolarHBondContact OD1-N 3.42Å; D1065-H1068 IonicContact OD1-ND1 2.66Å; D1065-H1068 PolarHBondContact OD1-ND1 3.32Å; D1065-H1068 IonicContact OD2-CE1 2.75Å; D1065-H1068 PolarHBondContact OD2-CE1 3Å; D1065-H1068 VanDerWaalsContact OD2-CE1 3.27Å; D1065-H1068 IonicContact OD2-ND1 2.73Å; D1065-H1068 PolarHBondContact OD2-ND1 3.28Å; D1065-A1069 PolarHBondContact O-N 3.15Å
1066	E	79.3	Confident	70.6	Confident	16 Å²	16	70 Å²	70	8%	0.075	38%	0.379	C	S	.	.	H	α-helix	trans	-74.3	-15	-175.9	83	-67.5	166.6	0	0	114	L946 S947 K950 L1070	L946-E1066 HydrophobicContact CB-CB 4.26Å; L946-E1066 HydrophobicContact CB-CG 3.95Å; S947-E1066 VanDerWaalsContact OG-CB 3.26Å; S947-E1066 WeakPolarHBondContact OG-CB 3.19Å; K950-E1066 HydrophobicContact CD-CB 4.34Å; K950-E1066 HydrophobicContact CD-CG 3.57Å; K950-E1066 IonicContact NZ-OE1 2.69Å; K950-E1066 PolarHBondContact NZ-OE1 2.85Å; E1066-L1070 PolarHBondContact O-N 3.43Å
1067	L	83.2	Confident	71	Confident	34 Å²	34	67.2 Å²	67.2	18%	0.178	36%	0.356	C	S	.	.	H	α-helix	trans	-77.4	-44.8	172.4	-53.7	178.6	0	0	0	110.1	M1036 H1038 D1065 A1069 L1070 A1071	M1036-L1067 HydrophobicContact SD-CB 4.16Å; H1038-L1067 HydrophobicContact CB-CD1 3.7Å; H1038-L1067 HydrophobicContact CB-CD2 3.68Å; H1038-L1067 HydrophobicContact CB-CG 4.22Å; D1065-L1067 VanDerWaalsContact C-N 3.27Å; D1065-L1067 PolarHBondContact O-N 3.05Å; D1065-L1067 WeakPolarHBondContact OD1-CA 3.34Å; D1065-L1067 VanDerWaalsContact OD1-CB 3.29Å; D1065-L1067 WeakPolarHBondContact OD1-CB 3.3Å; D1065-L1067 PolarHBondContact OD1-N 2.83Å; L1067-A1069 VanDerWaalsContact C-N 3.34Å; L1067-L1070 PolarHBondContact O-N 2.68Å; L1067-A1071 PolarHBondContact O-N 3.37Å
1068	H	80.1	Confident	72.3	Confident	4 Å²	4	69 Å²	69	2%	0.019	36%	0.361	C	S	.	.	H	α-helix	trans	-60.9	-43.6	170.6	-67.5	79.5	0	0	0	110.8	G1012 F1013 R1064 D1065 L1070 A1071 D1072	G1012-H1068 PolarHBondContact O-NE2 2.93Å; F1013-H1068 AromaticContact CD1-CE1 3.93Å; F1013-H1068 AromaticContact CD1-NE2 3.66Å; F1013-H1068 AromaticContact CE1-CE1 3.92Å; F1013-H1068 AromaticContact CE1-NE2 3.82Å; R1064-H1068 HydrophobicContact CB-CB 3.94Å; R1064-H1068 HydrophobicContact CG-CB 3.97Å; D1065-H1068 PolarHBondContact O-N 3.05Å; D1065-H1068 IonicContact OD1-CE1 3.84Å; D1065-H1068 IonicContact OD1-CG 3.91Å; D1065-H1068 PolarHBondContact OD1-N 3.42Å; D1065-H1068 IonicContact OD1-ND1 2.66Å; D1065-H1068 PolarHBondContact OD1-ND1 3.32Å; D1065-H1068 IonicContact OD2-CE1 2.75Å; D1065-H1068 PolarHBondContact OD2-CE1 3Å; D1065-H1068 VanDerWaalsContact OD2-CE1 3.27Å; D1065-H1068 IonicContact OD2-ND1 2.73Å; D1065-H1068 PolarHBondContact OD2-ND1 3.28Å; H1068-L1070 VanDerWaalsContact C-N 3.3Å; H1068-L1070 PolarHBondContact O-N 3.29Å; H1068-A1071 PolarHBondContact O-N 3.1Å; H1068-D1072 WeakPolarHBondContact O-CB 3.35Å; H1068-D1072 VanDerWaalsContact O-CG 3.31Å; H1068-D1072 PolarHBondContact O-N 3.12Å
1069	A	81	Confident	74.1	Confident	24 Å²	24	66.9 Å²	66.9	20%	0.198	33%	0.334	C	S	.	.	H	α-helix	trans	-58.1	-40	176.9	0	0	0	0	0	112.8	D1065 L1067 S1073	D1065-A1069 PolarHBondContact O-N 3.15Å; L1067-A1069 VanDerWaalsContact C-N 3.34Å; A1069-S1073 VanDerWaalsContact O-CB 3.23Å; A1069-S1073 WeakPolarHBondContact O-CB 3.36Å; A1069-S1073 PolarHBondContact O-N 3.3Å
1070	L	87	Confident	76.4	Confident	6 Å²	6	65 Å²	65	3%	0.031	31%	0.313	C	S	.	.	H	α-helix	trans	-66.7	-49.4	173.7	-178.5	59.6	0	0	0	111.8	V1041 I1043 I1053 F1055 E1066 L1067 H1068 D1072 S1073 V1074 M1081	V1041-L1070 HydrophobicContact CG1-CD2 4.28Å; I1043-L1070 HydrophobicContact CD1-CD1 4.29Å; I1053-L1070 HydrophobicContact CG2-CD1 3.67Å; F1055-L1070 HydrophobicContact CD1-CB 4.24Å; F1055-L1070 HydrophobicContact CE1-CB 3.65Å; F1055-L1070 HydrophobicContact CE1-CD1 4.16Å; F1055-L1070 HydrophobicContact CE1-CD2 4.27Å; F1055-L1070 HydrophobicContact CE1-CG 4.22Å; F1055-L1070 HydrophobicContact CE2-CD1 4.21Å; F1055-L1070 HydrophobicContact CZ-CB 4.14Å; F1055-L1070 HydrophobicContact CZ-CD1 3.77Å; F1055-L1070 HydrophobicContact CZ-CD2 4.09Å; F1055-L1070 HydrophobicContact CZ-CG 4.2Å; E1066-L1070 PolarHBondContact O-N 3.43Å; L1067-L1070 PolarHBondContact O-N 2.68Å; H1068-L1070 VanDerWaalsContact C-N 3.3Å; H1068-L1070 PolarHBondContact O-N 3.29Å; L1070-D1072 PolarHBondContact O-N 3.37Å; L1070-S1073 PolarHBondContact O-N 3.19Å; L1070-V1074 HydrophobicContact CD1-CG2 3.9Å; L1070-V1074 HydrophobicContact CG-CG2 4.33Å; L1070-V1074 WeakPolarHBondContact O-CB 3.38Å; L1070-V1074 VanDerWaalsContact O-CG2 3.28Å; L1070-V1074 WeakPolarHBondContact O-CG2 3.48Å; L1070-V1074 PolarHBondContact O-N 3.41Å; L1070-M1081 HydrophobicContact CD2-CE 3.7Å; L1070-M1081 HydrophobicContact CG-CE 3.72Å
1071	A	87.7	Confident	78.8	Confident	9 Å²	9	56.4 Å²	56.4	7%	0.074	27%	0.273	C	S	.	.	H	α-helix	trans	-60.8	-45.2	-179.3	0	0	0	0	0	111.7	M1036 L1067 H1068 S1073 V1074 K1075 M1081	M1036-A1071 HydrophobicContact CE-CB 3.94Å; M1036-A1071 HydrophobicContact CG-CB 4.34Å; L1067-A1071 PolarHBondContact O-N 3.37Å; H1068-A1071 PolarHBondContact O-N 3.1Å; A1071-S1073 PolarHBondContact O-N 2.6Å; A1071-V1074 PolarHBondContact O-N 2.94Å; A1071-K1075 WeakPolarHBondContact O-CB 3.44Å; A1071-K1075 PolarHBondContact O-N 3.49Å; A1071-M1081 HydrophobicContact CB-SD 4.21Å
1072	D	84.3	Confident	81.2	Confident	41 Å²	41	53.5 Å²	53.5	22%	0.219	26%	0.258	C	S	.	.	H	α-helix	trans	-61.7	-40.5	174.5	-74.2	-40.3	0	0	0	112.1	R1064 H1068 L1070 S1076	R1064-D1072 WeakPolarHBondContact CD-OD2 3.34Å; R1064-D1072 IonicContact CZ-OD1 2.71Å; R1064-D1072 IonicContact CZ-OD2 2.7Å; R1064-D1072 IonicContact NE-OD2 3.36Å; R1064-D1072 IonicContact NH1-OD1 3.25Å; R1064-D1072 PolarHBondContact NH1-OD1 3.48Å; R1064-D1072 IonicContact NH1-OD2 2.69Å; R1064-D1072 PolarHBondContact NH1-OD2 3.43Å; H1068-D1072 WeakPolarHBondContact O-CB 3.35Å; H1068-D1072 VanDerWaalsContact O-CG 3.31Å; H1068-D1072 PolarHBondContact O-N 3.12Å; L1070-D1072 PolarHBondContact O-N 3.37Å; D1072-S1076 WeakPolarHBondContact O-CB 3.46Å; D1072-S1076 PolarHBondContact O-N 3.49Å; D1072-S1076 PolarHBondContact O-OG 2.94Å
1073	S	87.8	Confident	83.6	Confident	3 Å²	3	42.6 Å²	42.6	2%	0.021	22%	0.216	C	C	.	.	H	α-helix	trans	-67.7	-44.6	177.6	179.7	0	0	0	0	112.3	I1053 T1054 A1069 L1070 A1071 S1076 A1077	I1053-S1073 WeakPolarHBondContact CA-OG 3.31Å; T1054-S1073 WeakPolarHBondContact CG2-OG 3.27Å; T1054-S1073 PolarHBondContact N-OG 3.12Å; T1054-S1073 WeakPolarHBondContact O-CB 3.33Å; T1054-S1073 PolarHBondContact O-OG 3.26Å; A1069-S1073 VanDerWaalsContact O-CB 3.23Å; A1069-S1073 WeakPolarHBondContact O-CB 3.36Å; A1069-S1073 PolarHBondContact O-N 3.3Å; L1070-S1073 PolarHBondContact O-N 3.19Å; A1071-S1073 PolarHBondContact O-N 2.6Å; S1073-S1076 PolarHBondContact O-N 3.49Å; S1073-A1077 VanDerWaalsContact O-CB 3.29Å; S1073-A1077 WeakPolarHBondContact O-CB 3.22Å; S1073-A1077 PolarHBondContact O-N 2.99Å
1074	V	89.2	Confident	85.7	Confident	1 Å²	1	36.5 Å²	36.5	1%	0.006	19%	0.188	C	C	.	.	H	α-helix	trans	-64.2	-43.8	177.5	170.6	0	0	0	0	110.2	V990 I1053 L1070 A1071 A1077 H1078 L1079 M1081	V990-V1074 HydrophobicContact CG2-CG1 4.36Å; V990-V1074 HydrophobicContact CG2-CG2 4.1Å; I1053-V1074 HydrophobicContact CD1-CG2 4.16Å; I1053-V1074 HydrophobicContact CG1-CG2 4.14Å; I1053-V1074 HydrophobicContact CG2-CG2 4.13Å; L1070-V1074 HydrophobicContact CD1-CG2 3.9Å; L1070-V1074 HydrophobicContact CG-CG2 4.33Å; L1070-V1074 WeakPolarHBondContact O-CB 3.38Å; L1070-V1074 VanDerWaalsContact O-CG2 3.28Å; L1070-V1074 WeakPolarHBondContact O-CG2 3.48Å; L1070-V1074 PolarHBondContact O-N 3.41Å; A1071-V1074 PolarHBondContact O-N 2.94Å; V1074-A1077 WeakPolarHBondContact O-CB 3.34Å; V1074-A1077 PolarHBondContact O-N 2.86Å; V1074-H1078 PolarHBondContact O-N 3.09Å; V1074-L1079 CarbonylContact C-O 3.6Å; V1074-L1079 HydrophobicContact CG1-CB 3.86Å; V1074-L1079 VanDerWaalsContact CG1-O 3.24Å; V1074-L1079 WeakPolarHBondContact CG1-O 3.42Å; V1074-L1079 PolarHBondContact O-N 3.24Å; V1074-M1081 HydrophobicContact CB-CG 4.26Å; V1074-M1081 HydrophobicContact CG1-CG 3.6Å; V1074-M1081 HydrophobicContact CG2-CE 4.48Å
1075	K	86.1	Confident	87.4	Confident	146 Å²	146	33.3 Å²	33.3	64%	0.635	18%	0.176	S	C	*	.	H	α-helix	trans	-60.3	-46.3	171.9	-173.6	175.8	-178.2	177.7	0	112.2	A1071 A1077 H1078	A1071-K1075 WeakPolarHBondContact O-CB 3.44Å; A1071-K1075 PolarHBondContact O-N 3.49Å; K1075-A1077 VanDerWaalsContact C-N 3.3Å; K1075-A1077 PolarHBondContact O-N 3.09Å; K1075-H1078 WeakPolarHBondContact O-CA 3.34Å; K1075-H1078 PolarHBondContact O-N 3.08Å
1076	S	84.5	Confident	88.2	Confident	79 Å²	79	37.6 Å²	37.6	55%	0.552	19%	0.191	S	C	*	.	H	α-helix	trans	-64.9	-32.5	176.2	-61.1	0	0	0	0	112.6	D1072 S1073 H1078	D1072-S1076 WeakPolarHBondContact O-CB 3.46Å; D1072-S1076 PolarHBondContact O-N 3.49Å; D1072-S1076 PolarHBondContact O-OG 2.94Å; S1073-S1076 PolarHBondContact O-N 3.49Å; S1076-H1078 PolarHBondContact O-N 3.39Å; S1076-H1078 PolarHBondContact O-ND1 3.26Å
1077	A	84.6	Confident	88.7	Confident	7 Å²	7	41.6 Å²	41.6	6%	0.058	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-5.3	172.2	0	0	0	0	0	113.4	R1052 S1073 V1074 K1075 L1079	R1052-A1077 HydrophobicContact CB-CB 3.68Å; S1073-A1077 VanDerWaalsContact O-CB 3.29Å; S1073-A1077 WeakPolarHBondContact O-CB 3.22Å; S1073-A1077 PolarHBondContact O-N 2.99Å; V1074-A1077 WeakPolarHBondContact O-CB 3.34Å; V1074-A1077 PolarHBondContact O-N 2.86Å; K1075-A1077 VanDerWaalsContact C-N 3.3Å; K1075-A1077 PolarHBondContact O-N 3.09Å; A1077-L1079 VanDerWaalsContact C-N 3.35Å; A1077-L1079 HydrophobicContact CB-CD1 4.08Å; A1077-L1079 HydrophobicContact CB-CG 4.09Å
1078	H	87	Confident	89	Confident	160 Å²	160	44.9 Å²	44.9	74%	0.741	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.6	44.7	-173.8	-59.8	53.6	0	0	0	111.5	V1074 K1075 S1076	V1074-H1078 PolarHBondContact O-N 3.09Å; K1075-H1078 WeakPolarHBondContact O-CA 3.34Å; K1075-H1078 PolarHBondContact O-N 3.08Å; S1076-H1078 PolarHBondContact O-N 3.39Å; S1076-H1078 PolarHBondContact O-ND1 3.26Å
1079	L	87.7	Confident	89.5	Confident	17 Å²	17	44.7 Å²	44.7	9%	0.089	22%	0.218	C	C	.	.			trans	-119.2	139.7	177.3	-66.2	179.8	0	0	0	109.7	I989 K1049 I1053 V1074 A1077	I989-L1079 HydrophobicContact CD1-CD1 4.14Å; I989-L1079 HydrophobicContact CD1-CD2 3.76Å; I989-L1079 HydrophobicContact CG2-CD1 4.13Å; K1049-L1079 HydrophobicContact CB-CD1 4.29Å; K1049-L1079 HydrophobicContact CB-CD2 4.11Å; K1049-L1079 HydrophobicContact CD-CD2 3.8Å; I1053-L1079 HydrophobicContact CD1-CD1 4.13Å; I1053-L1079 HydrophobicContact CG1-CD1 4.22Å; V1074-L1079 CarbonylContact C-O 3.6Å; V1074-L1079 HydrophobicContact CG1-CB 3.86Å; V1074-L1079 VanDerWaalsContact CG1-O 3.24Å; V1074-L1079 WeakPolarHBondContact CG1-O 3.42Å; V1074-L1079 PolarHBondContact O-N 3.24Å; A1077-L1079 VanDerWaalsContact C-N 3.35Å; A1077-L1079 HydrophobicContact CB-CD1 4.08Å; A1077-L1079 HydrophobicContact CB-CG 4.09Å
1080	P	90.7	Very high	90	Very high	64 Å²	64	43.9 Å²	43.9	42%	0.416	21%	0.211	S	C	.	.			trans	-82.5	150.4	166.8	27.9	-26.3	0	0	0	111.6	P1033 Y1082	P1033-P1080 HydrophobicContact CB-CB 4.45Å; P1080-Y1082 HydrophobicContact CB-CE2 4.06Å; P1080-Y1082 HydrophobicContact CG-CE2 3.62Å; P1080-Y1082 WeakPolarHBondContact CG-OH 3.26Å
1081	M	95.3	Very high	90.2	Very high	6 Å²	6	43.6 Å²	43.6	3%	0.03	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	150.6	162.3	-56.3	177.9	107.2	0	0	109	V990 P1033 V1034 V1037 L1070 A1071 V1074	V990-M1081 HydrophobicContact CB-CG 4.47Å; V990-M1081 HydrophobicContact CG1-CB 4.29Å; V990-M1081 HydrophobicContact CG1-CE 3.88Å; V990-M1081 HydrophobicContact CG1-CG 4.03Å; P1033-M1081 CarbonylContact C-O 3.57Å; P1033-M1081 WeakPolarHBondContact CA-O 3.49Å; V1034-M1081 PolarHBondContact N-O 3.09Å; V1037-M1081 HydrophobicContact CG2-CB 4.12Å; V1037-M1081 HydrophobicContact CG2-CE 3.7Å; V1037-M1081 HydrophobicContact CG2-SD 4.19Å; L1070-M1081 HydrophobicContact CD2-CE 3.7Å; L1070-M1081 HydrophobicContact CG-CE 3.72Å; A1071-M1081 HydrophobicContact CB-SD 4.21Å; V1074-M1081 HydrophobicContact CB-CG 4.26Å; V1074-M1081 HydrophobicContact CG1-CG 3.6Å; V1074-M1081 HydrophobicContact CG2-CE 4.48Å
1082	Y	97.4	Very high	90.4	Very high	58 Å²	58	43.4 Å²	43.4	23%	0.227	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	149.1	178.5	-66.9	-93.8	0	0	0	112.7	V988 V990 V991 A992 F1032 P1033 P1080	V988-Y1082 HydrophobicContact CB-CD2 3.68Å; V988-Y1082 HydrophobicContact CB-CE2 3.77Å; V988-Y1082 HydrophobicContact CB-CG 4.42Å; V988-Y1082 HydrophobicContact CG1-CD2 3.94Å; V988-Y1082 HydrophobicContact CG1-CE2 3.73Å; V988-Y1082 HydrophobicContact CG1-CG 4.42Å; V988-Y1082 HydrophobicContact CG2-CD2 3.6Å; V988-Y1082 HydrophobicContact CG2-CE2 4.22Å; V988-Y1082 HydrophobicContact CG2-CG 4Å; V990-Y1082 PolarHBondContact O-N 3.34Å; V991-Y1082 CarbonylContact C-O 3.54Å; V991-Y1082 VanDerWaalsContact CA-O 3.3Å; V991-Y1082 WeakPolarHBondContact CA-O 3.31Å; A992-Y1082 PolarHBondContact N-O 2.82Å; F1032-Y1082 CarbonylContact O-C 3.59Å; F1032-Y1082 VanDerWaalsContact O-CA 3.22Å; F1032-Y1082 WeakPolarHBondContact O-CA 3.17Å; P1033-Y1082 HydrophobicContact CB-CD1 4.14Å; P1033-Y1082 HydrophobicContact CB-CE1 3.85Å; P1033-Y1082 HydrophobicContact CG-CE1 4.39Å; P1080-Y1082 HydrophobicContact CB-CE2 4.06Å; P1080-Y1082 HydrophobicContact CG-CE2 3.62Å; P1080-Y1082 WeakPolarHBondContact CG-OH 3.26Å
1083	V	96.9	Very high	90.6	Very high	0 Å²	0	42 Å²	42	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	126.9	164.1	66.9	0	0	0	0	109.6	A992 M994 F1004 I1023 C1031 F1032 V1034 V1037	A992-V1083 CarbonylContact O-C 3.55Å; A992-V1083 WeakPolarHBondContact O-CA 3.26Å; M994-V1083 HydrophobicContact CB-CG2 3.81Å; M994-V1083 HydrophobicContact CG-CG2 4.31Å; F1004-V1083 HydrophobicContact CB-CB 4Å; F1004-V1083 HydrophobicContact CB-CG1 4.25Å; F1004-V1083 HydrophobicContact CB-CG2 3.97Å; F1004-V1083 HydrophobicContact CD1-CG1 4.47Å; F1004-V1083 HydrophobicContact CD1-CG2 3.96Å; F1004-V1083 HydrophobicContact CD2-CG1 3.84Å; F1004-V1083 HydrophobicContact CE2-CG1 4.29Å; F1004-V1083 HydrophobicContact CG-CB 4.14Å; F1004-V1083 HydrophobicContact CG-CG1 3.93Å; F1004-V1083 HydrophobicContact CG-CG2 3.96Å; I1023-V1083 HydrophobicContact CG2-CG1 4.24Å; C1031-V1083 CarbonylContact C-O 3.44Å; C1031-V1083 WeakPolarHBondContact CA-O 3.43Å; F1032-V1083 HydrophobicContact CB-CG1 4.32Å; F1032-V1083 PolarHBondContact N-O 3.1Å; F1032-V1083 PolarHBondContact O-N 3.26Å; V1034-V1083 HydrophobicContact CG1-CG1 3.73Å; V1034-V1083 HydrophobicContact CG2-CB 4.11Å; V1034-V1083 HydrophobicContact CG2-CG1 4.01Å; V1037-V1083 HydrophobicContact CG1-CB 4.18Å
1084	S	96.3	Very high	90.4	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	125.6	171.8	-178	0	0	0	0	110.3	E986 A992 M994 G1030 R1086 F1089	E986-S1084 WeakPolarHBondContact OE1-CB 3.43Å; E986-S1084 PolarHBondContact OE1-OG 3.03Å; A992-S1084 PolarHBondContact O-N 3.11Å; M994-S1084 WeakPolarHBondContact CB-O 3.46Å; M994-S1084 PolarHBondContact N-O 2.88Å; G1030-S1084 WeakPolarHBondContact O-CA 3.05Å; S1084-R1086 WeakPolarHBondContact OG-CB 3.47Å; S1084-R1086 PolarHBondContact OG-N 3.15Å; S1084-F1089 WeakPolarHBondContact O-CE2 3.27Å
1085	N	94.6	Very high	90.1	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	23%	0.23	C	C	.	.			trans	-109.9	7.6	166.1	76.7	-1.9	0	0	0	111.8	M994 I1023 R1026 K1028 V1029 G1030 F1032 Y1087	M994-N1085 HydrophobicContact CB-CB 3.77Å; M994-N1085 HydrophobicContact CE-CB 3.87Å; M994-N1085 HydrophobicContact CG-CB 4.26Å; M994-N1085 HydrophobicContact SD-CB 3.46Å; M994-N1085 WeakPolarHBondContact SD-CB 3.38Å; I1023-N1085 PolarHBondContact O-ND2 3.08Å; R1026-N1085 PolarHBondContact NH1-O 2.84Å; R1026-N1085 PolarHBondContact NH2-O 2.85Å; K1028-N1085 PolarHBondContact O-ND2 3.04Å; V1029-N1085 WeakPolarHBondContact CA-OD1 3.41Å; G1030-N1085 PolarHBondContact N-OD1 3.05Å; G1030-N1085 PolarHBondContact O-N 3.04Å; G1030-N1085 PolarHBondContact O-OD1 3.29Å; F1032-N1085 WeakPolarHBondContact CE2-OD1 3.31Å; N1085-Y1087 CarbonylContact C-O 3.57Å; N1085-Y1087 PolarHBondContact O-N 3.35Å
1086	R	91.1	Very high	89.7	Confident	115 Å²	115	41.3 Å²	41.3	43%	0.434	21%	0.207	S	C	.	.	S	Bend	trans	-50.4	-34	-178.4	-173.9	-177	-64.5	-76.2	2.7	113.1	E986 G1030 S1084	E986-R1086 IonicContact OE1-NE 3.53Å; E986-R1086 PolarHBondContact OE1-NE 3.45Å; E986-R1086 IonicContact OE2-NE 3.07Å; E986-R1086 PolarHBondContact OE2-NE 3.44Å; E986-R1086 IonicContact OE2-NH2 2.8Å; G1030-R1086 PolarHBondContact O-N 3.47Å; S1084-R1086 WeakPolarHBondContact OG-CB 3.47Å; S1084-R1086 PolarHBondContact OG-N 3.15Å
1087	Y	90.6	Very high	89.4	Confident	99 Å²	99	43.8 Å²	43.8	39%	0.388	21%	0.208	S	C	.	.	S	Bend	trans	-122	158.7	173.7	-50.5	-77.1	0	0	0	110.2	Q982 R1026 N1085 F1089	Q982-Y1087 HydrophobicContact CB-CD2 3.82Å; Q982-Y1087 HydrophobicContact CB-CE2 3.84Å; Q982-Y1087 VanDerWaalsContact CD-CD2 3.45Å; Q982-Y1087 HydrophobicContact CG-CD2 3.83Å; Q982-Y1087 HydrophobicContact CG-CE2 3.71Å; Q982-Y1087 HydrophobicContact CG-CG 4.42Å; R1026-Y1087 PolarHBondContact NH2-O 2.82Å; N1085-Y1087 CarbonylContact C-O 3.57Å; N1085-Y1087 PolarHBondContact O-N 3.35Å; Y1087-F1089 HydrophobicContact CD2-CE1 4.29Å; Y1087-F1089 AromaticContact CD2-CZ 3.83Å; Y1087-F1089 HydrophobicContact CD2-CZ 3.83Å; Y1087-F1089 HydrophobicContact CG-CZ 4.47Å; Y1087-F1089 WeakPolarHBondContact O-CD2 3.33Å; Y1087-F1089 PolarHBondContact O-N 3.15Å
1088	K	88.3	Confident	89	Confident	103 Å²	103	46.4 Å²	46.4	45%	0.448	22%	0.224	S	C	.	.			trans	-76.9	112.5	165.7	-70.6	-174.6	175	-168.5	0	107.1	N976 P1368	N976-K1088 VanDerWaalsContact CB-O 3.23Å; N976-K1088 WeakPolarHBondContact CB-O 3.43Å; N976-K1088 PolarHBondContact ND2-O 3.37Å; N976-K1088 VanDerWaalsContact ND2-O 3.11Å; K1088-P1368 PolarHBondContact NZ-O 2.94Å
1089	F	92.2	Very high	88.5	Confident	1 Å²	1	43.1 Å²	43.1	0%	0.004	22%	0.22	C	C	.	.			trans	-95.6	-39.8	-172.1	-72.9	-76.2	0	0	0	113.8	L974 F975 N976 T979 Q982 L983 P993 L995 S1084 Y1087	L974-F1089 CarbonylContact C-O 3.54Å; F975-F1089 PolarHBondContact N-O 3.18Å; F975-F1089 VanDerWaalsContact N-O 3.15Å; N976-F1089 WeakPolarHBondContact CB-O 3.37Å; N976-F1089 PolarHBondContact N-O 2.76Å; T979-F1089 HydrophobicContact CG2-CD1 3.84Å; T979-F1089 HydrophobicContact CG2-CE1 4.36Å; Q982-F1089 HydrophobicContact CB-CE1 3.92Å; Q982-F1089 HydrophobicContact CB-CZ 4.35Å; L983-F1089 HydrophobicContact CD2-CE1 4.1Å; L983-F1089 HydrophobicContact CD2-CE2 4.43Å; L983-F1089 HydrophobicContact CD2-CZ 3.86Å; L983-F1089 HydrophobicContact CG-CE1 4.1Å; L983-F1089 HydrophobicContact CG-CZ 4.34Å; P993-F1089 HydrophobicContact CB-CB 3.39Å; P993-F1089 HydrophobicContact CB-CD1 3.77Å; P993-F1089 HydrophobicContact CB-CD2 3.49Å; P993-F1089 VanDerWaalsContact CB-CD2 3.49Å; P993-F1089 HydrophobicContact CB-CE1 4.36Å; P993-F1089 HydrophobicContact CB-CE2 4.14Å; P993-F1089 HydrophobicContact CB-CG 3.27Å; P993-F1089 HydrophobicContact CG-CB 4.46Å; L995-F1089 HydrophobicContact CD2-CB 4.49Å; S1084-F1089 WeakPolarHBondContact O-CE2 3.27Å; Y1087-F1089 HydrophobicContact CD2-CE1 4.29Å; Y1087-F1089 AromaticContact CD2-CZ 3.83Å; Y1087-F1089 HydrophobicContact CD2-CZ 3.83Å; Y1087-F1089 HydrophobicContact CG-CZ 4.47Å; Y1087-F1089 WeakPolarHBondContact O-CD2 3.33Å; Y1087-F1089 PolarHBondContact O-N 3.15Å
1090	G	91.5	Very high	87.9	Confident	6 Å²	6	42.4 Å²	42.4	6%	0.062	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	169.6	-171.5	-175	0	0	0	0	0	112.9	L973 L995 V996	L973-G1090 CarbonylContact O-C 3.6Å; L973-G1090 WeakPolarHBondContact O-CA 3.37Å; L995-G1090 WeakPolarHBondContact CA-O 3.44Å; V996-G1090 PolarHBondContact N-O 2.78Å; V996-G1090 VanDerWaalsContact N-O 3.1Å
1091	A	90.4	Very high	87.3	Confident	1 Å²	1	45.2 Å²	45.2	1%	0.008	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	163.9	173.1	0	0	0	0	0	112.2	V972 L973 F975 V996 L1112	V972-A1091 CarbonylContact C-O 3.6Å; V972-A1091 WeakPolarHBondContact CA-O 3.49Å; L973-A1091 PolarHBondContact N-O 3.44Å; L973-A1091 PolarHBondContact O-N 2.67Å; F975-A1091 HydrophobicContact CE1-CB 4.4Å; F975-A1091 HydrophobicContact CE2-CB 3.62Å; F975-A1091 HydrophobicContact CZ-CB 3.49Å; F975-A1091 VanDerWaalsContact CZ-CB 3.49Å; V996-A1091 HydrophobicContact CG2-CB 4.23Å; V996-A1091 CarbonylContact O-C 3.58Å; V996-A1091 WeakPolarHBondContact O-CA 3.47Å; V996-A1091 WeakPolarHBondContact O-CB 3.35Å; A1091-L1112 HydrophobicContact CB-CD1 4.47Å; A1091-L1112 HydrophobicContact CB-CD2 4.24Å
1092	I	92.3	Very high	86.4	Confident	4 Å²	4	47.4 Å²	47.4	2%	0.021	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	134.5	170.6	-171.5	169.1	0	0	0	109.2	D971 V972 L995 V996 S997 Y1001 N1003	D971-I1092 WeakPolarHBondContact O-CA 3.33Å; V972-I1092 HydrophobicContact CG2-CB 4.45Å; V972-I1092 HydrophobicContact CG2-CD1 3.96Å; V972-I1092 HydrophobicContact CG2-CG1 4.04Å; L995-I1092 HydrophobicContact CB-CB 4.04Å; L995-I1092 HydrophobicContact CB-CG2 3.94Å; L995-I1092 HydrophobicContact CD1-CB 4.08Å; L995-I1092 HydrophobicContact CD1-CD1 4.45Å; V996-I1092 PolarHBondContact O-N 2.84Å; S997-I1092 VanDerWaalsContact CB-O 3.28Å; S997-I1092 WeakPolarHBondContact CB-O 3.34Å; Y1001-I1092 HydrophobicContact CD1-CG2 4.07Å; Y1001-I1092 HydrophobicContact CE1-CD1 4.12Å; Y1001-I1092 HydrophobicContact CE1-CG1 4.37Å; Y1001-I1092 HydrophobicContact CE1-CG2 4.07Å; N1003-I1092 HydrophobicContact CB-CD1 4.11Å
1093	L	88.5	Confident	85.4	Confident	12 Å²	12	49.9 Å²	49.9	6%	0.063	25%	0.249	C	C	.	.	P	Polyproline II helix	trans	-69.3	142.9	172.9	-60.6	177	0	0	0	110.2	V867 D971 P1095 L1109 L1112	V867-L1093 HydrophobicContact CB-CD1 3.94Å; V867-L1093 HydrophobicContact CG1-CD1 4.45Å; V867-L1093 HydrophobicContact CG2-CD1 3.7Å; D971-L1093 HydrophobicContact CB-CB 4.1Å; D971-L1093 HydrophobicContact CB-CD1 4.33Å; D971-L1093 HydrophobicContact CB-CG 4.39Å; D971-L1093 PolarHBondContact O-N 3.01Å; D971-L1093 VanDerWaalsContact O-N 3.08Å; L1093-P1095 WeakPolarHBondContact O-CD 3.17Å; L1093-L1109 HydrophobicContact CD1-CB 4.15Å; L1093-L1109 HydrophobicContact CD1-CD1 4.42Å; L1093-L1109 HydrophobicContact CD2-CB 4.3Å; L1093-L1109 HydrophobicContact CD2-CD1 4.32Å; L1093-L1112 HydrophobicContact CD2-CB 4.24Å; L1093-L1112 HydrophobicContact CD2-CD2 3.66Å
1094	I	83.7	Confident	84.3	Confident	50 Å²	50	53.5 Å²	53.5	26%	0.256	27%	0.266	S	S	.	.	P	Polyproline II helix	trans	-67	127.1	176.1	-56.7	168.5	0	0	0	108	L998 S999 P1096 N1108	L998-I1094 HydrophobicContact CB-CD1 4.44Å; S999-I1094 WeakPolarHBondContact OG-CD1 3.5Å; I1094-P1096 WeakPolarHBondContact O-CD 3.27Å; I1094-N1108 PolarHBondContact O-ND2 2.95Å
1095	P	81.3	Confident	83.2	Confident	62 Å²	62	53.6 Å²	53.6	40%	0.403	27%	0.267	S	S	.	.	P	Polyproline II helix	trans	-59	128	178.8	-26.3	34.1	0	0	0	111.5	Y1001 L1093	Y1001-P1095 HydrophobicContact CE1-CG 3.97Å; Y1001-P1095 HydrophobicContact CE2-CG 4.35Å; Y1001-P1095 VanDerWaalsContact CZ-CD 3.48Å; Y1001-P1095 VanDerWaalsContact OH-CG 3.29Å; Y1001-P1095 WeakPolarHBondContact OH-CG 3.31Å; L1093-P1095 WeakPolarHBondContact O-CD 3.17Å
1096	P	79.1	Confident	82.6	Confident	24 Å²	24	55 Å²	55	16%	0.156	27%	0.273	C	S	.	.	P	Polyproline II helix	trans	-59.3	157	172.3	-24.3	35.3	0	0	0	111.6	F936 I1094 A1100	F936-P1096 HydrophobicContact CB-CB 4.49Å; F936-P1096 HydrophobicContact CD1-CB 4.27Å; F936-P1096 HydrophobicContact CD1-CG 4.05Å; F936-P1096 HydrophobicContact CD2-CB 3.79Å; F936-P1096 HydrophobicContact CD2-CG 4.26Å; F936-P1096 HydrophobicContact CE1-CB 4.49Å; F936-P1096 HydrophobicContact CE1-CG 3.94Å; F936-P1096 HydrophobicContact CE2-CB 4.01Å; F936-P1096 HydrophobicContact CE2-CG 4.12Å; F936-P1096 HydrophobicContact CG-CB 3.92Å; F936-P1096 HydrophobicContact CG-CG 4.21Å; F936-P1096 HydrophobicContact CZ-CB 4.36Å; F936-P1096 HydrophobicContact CZ-CG 3.97Å; I1094-P1096 WeakPolarHBondContact O-CD 3.27Å; P1096-A1100 HydrophobicContact CB-CB 3.68Å
1097	K	77.5	Confident	82.1	Confident	131 Å²	131	51.5 Å²	51.5	57%	0.57	26%	0.261	S	S	*	.	P	Polyproline II helix	trans	-63.5	150.4	174.3	-64.6	163.4	-166.6	142.1	0	109.2	S1099 A1100	K1097-S1099 PolarHBondContact O-N 2.72Å; K1097-A1100 HydrophobicContact CB-CB 4.43Å; K1097-A1100 WeakPolarHBondContact O-CB 3.37Å; K1097-A1100 PolarHBondContact O-N 2.98Å
1098	P	77	Confident	81.7	Confident	61 Å²	61	47.8 Å²	47.8	40%	0.396	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-20	175.4	-29.2	36.9	0	0	0	115.3	D937	D937-P1098 HydrophobicContact CB-CB 4.41Å
1099	S	75.5	Confident	81.6	Confident	92 Å²	92	43 Å²	43	64%	0.643	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95.9	1.4	175.6	60.3	0	0	0	0	114.3	K1097	K1097-S1099 PolarHBondContact O-N 2.72Å
1100	A	75.1	Confident	81.4	Confident	1 Å²	1	43.9 Å²	43.9	1%	0.008	23%	0.231	C	C	.	.			trans	-67.3	144.1	-179.8	0	0	0	0	0	110.9	F936 P1096 K1097 E1104	F936-A1100 HydrophobicContact CD2-CB 3.86Å; F936-A1100 HydrophobicContact CE2-CB 4.27Å; P1096-A1100 HydrophobicContact CB-CB 3.68Å; K1097-A1100 HydrophobicContact CB-CB 4.43Å; K1097-A1100 WeakPolarHBondContact O-CB 3.37Å; K1097-A1100 PolarHBondContact O-N 2.98Å; A1100-E1104 HydrophobicContact CB-CB 3.89Å; A1100-E1104 HydrophobicContact CB-CG 4.41Å; A1100-E1104 WeakPolarHBondContact CB-OE2 3.48Å
1101	Q	78.7	Confident	81.1	Confident	124 Å²	124	44.1 Å²	44.1	58%	0.579	23%	0.231	S	C	*	.			trans	-83.4	166.1	164.4	-56.1	-60.9	-20.4	0	0	109.5	F936 E1103 E1104	F936-Q1101 WeakPolarHBondContact CE2-O 3.31Å; Q1101-E1103 WeakPolarHBondContact CB-OE2 3.32Å; Q1101-E1103 PolarHBondContact O-N 3.48Å; Q1101-E1103 VanDerWaalsContact O-N 3.11Å; Q1101-E1104 PolarHBondContact O-N 3.32Å; Q1101-E1104 VanDerWaalsContact O-N 3.15Å
1102	L	77.3	Confident	80.9	Confident	52 Å²	52	44.7 Å²	44.7	27%	0.272	23%	0.233	S	C	.	.	H	α-helix	trans	-57.1	-30.1	-174.7	-66.6	172.6	0	0	0	112.6	N863 V895 D896 P935 F936 E1104 G1105 F1106	N863-L1102 HydrophobicContact CB-CD2 3.85Å; V895-L1102 HydrophobicContact CG2-CD1 4.42Å; D896-L1102 HydrophobicContact CB-CD1 4.41Å; P935-L1102 HydrophobicContact CB-CD2 3.58Å; P935-L1102 HydrophobicContact CB-CG 4.29Å; P935-L1102 HydrophobicContact CG-CD2 3.77Å; P935-L1102 HydrophobicContact CG-CG 4.04Å; F936-L1102 HydrophobicContact CE2-CD2 4.35Å; F936-L1102 HydrophobicContact CZ-CD2 4.11Å; L1102-E1104 PolarHBondContact O-N 3.42Å; L1102-G1105 PolarHBondContact O-N 3.36Å; L1102-G1105 VanDerWaalsContact O-N 3.15Å; L1102-F1106 PolarHBondContact O-N 3.31Å
1103	E	76	Confident	80.6	Confident	110 Å²	110	45.5 Å²	45.5	51%	0.514	24%	0.238	S	C	.	.	H	α-helix	trans	-62.6	-38.4	179.4	-61	78.6	-175.5	0	0	113.1	Q1101 G1105 F1106 E1107	Q1101-E1103 WeakPolarHBondContact CB-OE2 3.32Å; Q1101-E1103 PolarHBondContact O-N 3.48Å; Q1101-E1103 VanDerWaalsContact O-N 3.11Å; E1103-G1105 PolarHBondContact O-N 2.8Å; E1103-F1106 WeakPolarHBondContact O-CB 3.39Å; E1103-F1106 PolarHBondContact O-N 2.7Å; E1103-F1106 VanDerWaalsContact O-N 3.1Å; E1103-E1107 PolarHBondContact O-N 2.79Å
1104	E	72.6	Confident	80.6	Confident	75 Å²	75	45.1 Å²	45.1	35%	0.35	24%	0.236	S	C	.	.	H	α-helix	trans	-62.2	-30	175.5	-95.1	-170.2	-155.7	0	0	111.3	A1100 Q1101 L1102	A1100-E1104 HydrophobicContact CB-CB 3.89Å; A1100-E1104 HydrophobicContact CB-CG 4.41Å; A1100-E1104 WeakPolarHBondContact CB-OE2 3.48Å; Q1101-E1104 PolarHBondContact O-N 3.32Å; Q1101-E1104 VanDerWaalsContact O-N 3.15Å; L1102-E1104 PolarHBondContact O-N 3.42Å
1105	G	73	Confident	80.5	Confident	2 Å²	2	45.6 Å²	45.6	2%	0.021	24%	0.237	C	C	.	.	H	α-helix	trans	-69.5	-39.7	173.7	0	0	0	0	0	112.8	L1102 E1103 E1107	L1102-G1105 PolarHBondContact O-N 3.36Å; L1102-G1105 VanDerWaalsContact O-N 3.15Å; E1103-G1105 PolarHBondContact O-N 2.8Å; G1105-E1107 VanDerWaalsContact C-N 3.35Å
1106	F	82.1	Confident	80.4	Confident	30 Å²	30	43.8 Å²	43.8	13%	0.132	23%	0.227	C	C	.	.	H	α-helix	trans	-65.5	-36	174.8	-179.7	-90.2	0	0	0	112.2	H866 L1102 E1103 N1108 L1109 R1110 A1133 F1136	H866-F1106 HydrophobicContact CB-CD2 3.91Å; L1102-F1106 PolarHBondContact O-N 3.31Å; E1103-F1106 WeakPolarHBondContact O-CB 3.39Å; E1103-F1106 PolarHBondContact O-N 2.7Å; E1103-F1106 VanDerWaalsContact O-N 3.1Å; F1106-N1108 PolarHBondContact O-N 2.85Å; F1106-L1109 PolarHBondContact O-N 2.85Å; F1106-R1110 HydrophobicContact CE1-CB 4.32Å; F1106-R1110 HydrophobicContact CE1-CG 4.29Å; F1106-R1110 WeakPolarHBondContact O-CB 3.38Å; F1106-R1110 PolarHBondContact O-N 2.69Å; F1106-A1133 HydrophobicContact CE2-CB 4.31Å; F1106-F1136 HydrophobicContact CD1-CD2 4.45Å; F1106-F1136 AromaticContact CD1-CE2 3.75Å; F1106-F1136 HydrophobicContact CD1-CE2 3.75Å; F1106-F1136 AromaticContact CE1-CD2 3.88Å; F1106-F1136 HydrophobicContact CE1-CD2 3.88Å; F1106-F1136 AromaticContact CE1-CE2 3.58Å; F1106-F1136 HydrophobicContact CE1-CE2 3.58Å; F1106-F1136 HydrophobicContact CG-CE2 4.39Å; F1106-F1136 HydrophobicContact CZ-CD2 4.31Å; F1106-F1136 HydrophobicContact CZ-CE2 4.1Å
1107	E	81.2	Confident	80.6	Confident	41 Å²	41	42.9 Å²	42.9	19%	0.192	22%	0.221	C	C	.	.	H	α-helix	trans	-58.7	-46.2	176.7	-70.8	-175.8	178	0	0	113.3	E1103 G1105 L1109 R1110 D1111 H1246 Q1249	E1103-E1107 PolarHBondContact O-N 2.79Å; G1105-E1107 VanDerWaalsContact C-N 3.35Å; E1107-L1109 PolarHBondContact O-N 2.74Å; E1107-R1110 WeakPolarHBondContact O-CB 3.43Å; E1107-R1110 PolarHBondContact O-N 2.79Å; E1107-R1110 VanDerWaalsContact O-N 3.1Å; E1107-D1111 PolarHBondContact O-N 3.34Å; E1107-H1246 IonicContact OE2-CE1 2.68Å; E1107-H1246 IonicContact OE2-ND1 3.29Å; E1107-H1246 PolarHBondContact OE2-ND1 2.82Å; E1107-Q1249 PolarHBondContact OE1-NE2 2.93Å; E1107-Q1249 PolarHBondContact OE2-NE2 3.11Å; E1107-Q1249 VanDerWaalsContact OE2-NE2 3.08Å
1108	N	82.4	Confident	80.2	Confident	21 Å²	21	37.8 Å²	37.8	11%	0.112	20%	0.199	C	C	.	.	H	α-helix	trans	-62.1	-33.5	178.6	-70.3	-11.1	0	0	0	112.3	I1094 F1106 L1112	I1094-N1108 PolarHBondContact O-ND2 2.95Å; F1106-N1108 PolarHBondContact O-N 2.85Å; N1108-L1112 PolarHBondContact O-N 3.16Å
1109	L	86.7	Confident	79.5	Confident	2 Å²	2	36.9 Å²	36.9	1%	0.01	19%	0.194	C	C	.	.	H	α-helix	trans	-73.2	-41.6	173.1	176.1	63.4	0	0	0	111.6	H866 V867 Y870 L1093 F1106 E1107 D1111 L1112 I1113 L1124	H866-L1109 HydrophobicContact CB-CD2 4.11Å; H866-L1109 WeakPolarHBondContact O-CD2 3.39Å; V867-L1109 HydrophobicContact CB-CD2 4.27Å; Y870-L1109 HydrophobicContact CD2-CD1 4.06Å; Y870-L1109 HydrophobicContact CD2-CD2 3.91Å; Y870-L1109 HydrophobicContact CD2-CG 4.5Å; Y870-L1109 HydrophobicContact CE2-CD1 4.38Å; Y870-L1109 HydrophobicContact CE2-CD2 3.89Å; Y870-L1109 HydrophobicContact CE2-CG 4.46Å; L1093-L1109 HydrophobicContact CD1-CB 4.15Å; L1093-L1109 HydrophobicContact CD1-CD1 4.42Å; L1093-L1109 HydrophobicContact CD2-CB 4.3Å; L1093-L1109 HydrophobicContact CD2-CD1 4.32Å; F1106-L1109 PolarHBondContact O-N 2.85Å; E1107-L1109 PolarHBondContact O-N 2.74Å; L1109-D1111 VanDerWaalsContact C-N 3.34Å; L1109-D1111 PolarHBondContact O-N 3.03Å; L1109-L1112 PolarHBondContact O-N 3.39Å; L1109-I1113 HydrophobicContact CD1-CD1 4.24Å; L1109-I1113 HydrophobicContact CD1-CG1 4.28Å; L1109-I1113 HydrophobicContact CG-CD1 3.89Å; L1109-I1113 HydrophobicContact CG-CG1 4.4Å; L1109-I1113 WeakPolarHBondContact O-CG1 3.18Å; L1109-I1113 PolarHBondContact O-N 3.48Å; L1109-L1124 HydrophobicContact CD1-CD1 4.06Å
1110	R	87.2	Confident	78.9	Confident	20 Å²	20	33.5 Å²	33.5	8%	0.075	17%	0.174	C	C	.	.	H	α-helix	trans	-56.2	-48.3	177.6	-159.6	-164.6	-36	-140.4	7.7	111.2	F1106 E1107 L1112 I1113 V1114 A1167 D1169	F1106-R1110 HydrophobicContact CE1-CB 4.32Å; F1106-R1110 HydrophobicContact CE1-CG 4.29Å; F1106-R1110 WeakPolarHBondContact O-CB 3.38Å; F1106-R1110 PolarHBondContact O-N 2.69Å; E1107-R1110 WeakPolarHBondContact O-CB 3.43Å; E1107-R1110 PolarHBondContact O-N 2.79Å; E1107-R1110 VanDerWaalsContact O-N 3.1Å; R1110-L1112 VanDerWaalsContact C-N 3.27Å; R1110-L1112 PolarHBondContact O-N 2.98Å; R1110-I1113 PolarHBondContact O-N 3.47Å; R1110-V1114 VanDerWaalsContact O-CG2 3.31Å; R1110-V1114 WeakPolarHBondContact O-CG2 3.49Å; R1110-V1114 PolarHBondContact O-N 3.34Å; R1110-A1167 WeakPolarHBondContact CD-O 3.24Å; R1110-A1167 WeakPolarHBondContact CG-O 3.41Å; R1110-D1169 IonicContact CZ-OD2 2.9Å; R1110-D1169 IonicContact NH1-OD2 3.16Å; R1110-D1169 PolarHBondContact NH1-OD2 3Å
1111	D	85.6	Confident	78.6	Confident	11 Å²	11	35.4 Å²	35.4	6%	0.059	19%	0.186	C	C	.	.	H	α-helix	trans	-64.3	-31.8	176.8	-73.2	-18.5	0	0	0	112.1	L998 E1107 L1109 E1115 S1245 H1246	L998-D1111 HydrophobicContact CD1-CB 3.45Å; L998-D1111 VanDerWaalsContact CD1-CB 3.45Å; E1107-D1111 PolarHBondContact O-N 3.34Å; L1109-D1111 VanDerWaalsContact C-N 3.34Å; L1109-D1111 PolarHBondContact O-N 3.03Å; D1111-E1115 VanDerWaalsContact O-CB 3.25Å; D1111-E1115 WeakPolarHBondContact O-CB 3.41Å; D1111-E1115 PolarHBondContact O-N 3.31Å; D1111-S1245 VanDerWaalsContact OD2-CA 3.23Å; D1111-S1245 WeakPolarHBondContact OD2-CA 3.26Å; D1111-S1245 WeakPolarHBondContact OD2-CB 3.35Å; D1111-H1246 VanDerWaalsContact CG-N 3.31Å; D1111-H1246 PolarHBondContact OD1-N 3.44Å; D1111-H1246 VanDerWaalsContact OD1-N 3.12Å; D1111-H1246 IonicContact OD2-CD2 3.81Å; D1111-H1246 IonicContact OD2-CG 3.32Å; D1111-H1246 PolarHBondContact OD2-N 3.48Å; D1111-H1246 IonicContact OD2-ND1 3.71Å; D1111-H1246 IonicContact OD2-NE2 3.07Å
1112	L	85.8	Confident	78.1	Confident	13 Å²	13	33 Å²	33	7%	0.068	18%	0.181	C	C	.	.	H	α-helix	trans	-74.7	-34	177.4	-173.5	65.3	0	0	0	111.8	L973 L998 A1091 L1093 N1108 L1109 R1110 A1116 L1124	L973-L1112 HydrophobicContact CD1-CD2 3.87Å; L998-L1112 HydrophobicContact CD1-CB 4.14Å; L998-L1112 HydrophobicContact CD2-CD1 3.94Å; L998-L1112 HydrophobicContact CG-CD1 4.19Å; A1091-L1112 HydrophobicContact CB-CD1 4.47Å; A1091-L1112 HydrophobicContact CB-CD2 4.24Å; L1093-L1112 HydrophobicContact CD2-CB 4.24Å; L1093-L1112 HydrophobicContact CD2-CD2 3.66Å; N1108-L1112 PolarHBondContact O-N 3.16Å; L1109-L1112 PolarHBondContact O-N 3.39Å; R1110-L1112 VanDerWaalsContact C-N 3.27Å; R1110-L1112 PolarHBondContact O-N 2.98Å; L1112-A1116 WeakPolarHBondContact O-CB 3.2Å; L1112-A1116 PolarHBondContact O-N 3.1Å; L1112-L1124 HydrophobicContact CB-CD1 4.49Å; L1112-L1124 HydrophobicContact CD2-CD1 4.15Å; L1112-L1124 HydrophobicContact CG-CD1 4.05Å; L1112-L1124 HydrophobicContact CG-CD2 4.48Å
1113	I	86.9	Confident	77.9	Confident	22 Å²	22	31.4 Å²	31.4	11%	0.113	18%	0.177	C	C	.	.	H	α-helix	trans	-63.9	-50	170.8	-66.8	162.2	0	0	0	109.5	Y870 L1109 R1110 E1115 A1116 L1117 L1124 A1167	Y870-I1113 HydrophobicContact CE1-CD1 4.42Å; Y870-I1113 HydrophobicContact CE1-CG1 4.47Å; Y870-I1113 HydrophobicContact CE2-CD1 4.03Å; Y870-I1113 WeakPolarHBondContact OH-CD1 3.45Å; L1109-I1113 HydrophobicContact CD1-CD1 4.24Å; L1109-I1113 HydrophobicContact CD1-CG1 4.28Å; L1109-I1113 HydrophobicContact CG-CD1 3.89Å; L1109-I1113 HydrophobicContact CG-CG1 4.4Å; L1109-I1113 WeakPolarHBondContact O-CG1 3.18Å; L1109-I1113 PolarHBondContact O-N 3.48Å; R1110-I1113 PolarHBondContact O-N 3.47Å; I1113-E1115 VanDerWaalsContact C-N 3.31Å; I1113-E1115 PolarHBondContact O-N 2.79Å; I1113-A1116 PolarHBondContact O-N 3.31Å; I1113-L1117 HydrophobicContact CG2-CD1 3.79Å; I1113-L1117 HydrophobicContact CG2-CG 4.35Å; I1113-L1117 WeakPolarHBondContact O-CB 3.34Å; I1113-L1117 VanDerWaalsContact O-CG 3.23Å; I1113-L1117 WeakPolarHBondContact O-CG 3.32Å; I1113-L1117 PolarHBondContact O-N 2.95Å; I1113-L1124 HydrophobicContact CG1-CD1 3.7Å; I1113-L1124 HydrophobicContact CG1-CG 4.28Å; I1113-A1167 HydrophobicContact CG2-CB 3.79Å
1114	V	87.5	Confident	78.3	Confident	4 Å²	4	26.6 Å²	26.6	2%	0.024	16%	0.155	C	C	.	.	H	α-helix	trans	-59.6	-42.1	177	173.3	0	0	0	0	110.9	R1110 L1117 H1118 A1167 L1168 F1243	R1110-V1114 VanDerWaalsContact O-CG2 3.31Å; R1110-V1114 WeakPolarHBondContact O-CG2 3.49Å; R1110-V1114 PolarHBondContact O-N 3.34Å; V1114-L1117 PolarHBondContact O-N 3.08Å; V1114-H1118 VanDerWaalsContact C-CE1 3.47Å; V1114-H1118 WeakPolarHBondContact CG1-NE2 3.32Å; V1114-H1118 PolarHBondContact O-CE1 2.9Å; V1114-H1118 PolarHBondContact O-N 2.6Å; V1114-H1118 PolarHBondContact O-ND1 3.02Å; V1114-H1118 PolarHBondContact O-NE2 3.28Å; V1114-H1118 VanDerWaalsContact O-NE2 3.09Å; V1114-A1167 HydrophobicContact CG2-CB 3.71Å; V1114-L1168 HydrophobicContact CG2-CD2 3.92Å; V1114-L1168 HydrophobicContact CG2-CG 3.76Å; V1114-F1243 HydrophobicContact CG1-CB 4.07Å; V1114-F1243 HydrophobicContact CG1-CD2 4.03Å; V1114-F1243 HydrophobicContact CG1-CG 4.43Å
1115	E	81.8	Confident	78.9	Confident	60 Å²	60	24.6 Å²	24.6	28%	0.28	15%	0.147	S	C	.	.	H	α-helix	trans	-59.6	-48.9	174.4	180	60.4	-164.7	0	0	112.4	L998 D1111 I1113 L1117 H1118 R1242	L998-E1115 HydrophobicContact CD2-CB 3.73Å; L998-E1115 HydrophobicContact CD2-CG 3.79Å; D1111-E1115 VanDerWaalsContact O-CB 3.25Å; D1111-E1115 WeakPolarHBondContact O-CB 3.41Å; D1111-E1115 PolarHBondContact O-N 3.31Å; I1113-E1115 VanDerWaalsContact C-N 3.31Å; I1113-E1115 PolarHBondContact O-N 2.79Å; E1115-L1117 VanDerWaalsContact C-N 3.3Å; E1115-L1117 PolarHBondContact O-N 3.27Å; E1115-H1118 WeakPolarHBondContact CA-CE1 3.32Å; E1115-H1118 WeakPolarHBondContact CA-ND1 3.33Å; E1115-H1118 VanDerWaalsContact CD-CE1 3.5Å; E1115-H1118 PolarHBondContact N-CE1 2.99Å; E1115-H1118 PolarHBondContact O-CE1 3.34Å; E1115-H1118 PolarHBondContact O-N 2.89Å; E1115-H1118 PolarHBondContact O-ND1 2.99Å; E1115-H1118 IonicContact OE2-CE1 2.77Å; E1115-H1118 PolarHBondContact OE2-CE1 2.94Å; E1115-H1118 IonicContact OE2-ND1 3.11Å; E1115-R1242 IonicContact OE1-CZ 3.3Å; E1115-R1242 IonicContact OE1-NE 2.76Å; E1115-R1242 IonicContact OE1-NH1 2.78Å; E1115-R1242 IonicContact OE1-NH2 3.63Å; E1115-R1242 PolarHBondContact OE1-NH2 3.27Å; E1115-R1242 IonicContact OE2-CZ 3.57Å; E1115-R1242 IonicContact OE2-NE 2.69Å; E1115-R1242 PolarHBondContact OE2-NE 3.15Å; E1115-R1242 IonicContact OE2-NH2 3.44Å; E1115-R1242 PolarHBondContact OE2-NH2 3.33Å
1116	A	79.1	Confident	79.5	Confident	23 Å²	23	26.1 Å²	26.1	19%	0.19	16%	0.157	C	C	.	.	H	α-helix	trans	-62.2	-38.8	178	0	0	0	0	0	112	L1112 I1113 H1118 S1119 L1124	L1112-A1116 WeakPolarHBondContact O-CB 3.2Å; L1112-A1116 PolarHBondContact O-N 3.1Å; I1113-A1116 PolarHBondContact O-N 3.31Å; A1116-H1118 PolarHBondContact O-N 2.8Å; A1116-S1119 PolarHBondContact O-N 3.12Å; A1116-L1124 HydrophobicContact CB-CD2 3.69Å; A1116-L1124 HydrophobicContact CB-CG 3.92Å
1117	L	82.6	Confident	79.9	Confident	6 Å²	6	24.8 Å²	24.8	3%	0.031	15%	0.152	C	C	.	.	H	α-helix	trans	-63.9	-20.1	178.8	-76	169.4	0	0	0	114	I1113 V1114 E1115 S1119 G1120 P1121 P1122 R1160 A1163 A1167	I1113-L1117 HydrophobicContact CG2-CD1 3.79Å; I1113-L1117 HydrophobicContact CG2-CG 4.35Å; I1113-L1117 WeakPolarHBondContact O-CB 3.34Å; I1113-L1117 VanDerWaalsContact O-CG 3.23Å; I1113-L1117 WeakPolarHBondContact O-CG 3.32Å; I1113-L1117 PolarHBondContact O-N 2.95Å; V1114-L1117 PolarHBondContact O-N 3.08Å; E1115-L1117 VanDerWaalsContact C-N 3.3Å; E1115-L1117 PolarHBondContact O-N 3.27Å; L1117-S1119 PolarHBondContact O-N 3.44Å; L1117-S1119 VanDerWaalsContact O-N 3.1Å; L1117-G1120 WeakPolarHBondContact O-CA 3.12Å; L1117-G1120 PolarHBondContact O-N 2.66Å; L1117-P1121 HydrophobicContact CD2-CB 4.49Å; L1117-P1122 WeakPolarHBondContact CD2-O 3.39Å; L1117-R1160 WeakPolarHBondContact O-CG 3.29Å; L1117-A1163 HydrophobicContact CD1-CB 4.07Å; L1117-A1163 WeakPolarHBondContact CD1-O 3.3Å; L1117-A1163 HydrophobicContact CD2-CB 3.71Å; L1117-A1163 HydrophobicContact CG-CB 4.46Å; L1117-A1167 HydrophobicContact CD1-CB 3.88Å
1118	H	70.9	Confident	80.1	Confident	24 Å²	24	24.4 Å²	24.4	11%	0.111	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-21.8	173.5	-65.7	107.5	0	0	0	113.5	V1114 E1115 A1116 G1120 R1160	V1114-H1118 VanDerWaalsContact C-CE1 3.47Å; V1114-H1118 WeakPolarHBondContact CG1-NE2 3.32Å; V1114-H1118 PolarHBondContact O-CE1 2.9Å; V1114-H1118 PolarHBondContact O-N 2.6Å; V1114-H1118 PolarHBondContact O-ND1 3.02Å; V1114-H1118 PolarHBondContact O-NE2 3.28Å; V1114-H1118 VanDerWaalsContact O-NE2 3.09Å; E1115-H1118 WeakPolarHBondContact CA-CE1 3.32Å; E1115-H1118 WeakPolarHBondContact CA-ND1 3.33Å; E1115-H1118 VanDerWaalsContact CD-CE1 3.5Å; E1115-H1118 PolarHBondContact N-CE1 2.99Å; E1115-H1118 PolarHBondContact O-CE1 3.34Å; E1115-H1118 PolarHBondContact O-N 2.89Å; E1115-H1118 PolarHBondContact O-ND1 2.99Å; E1115-H1118 IonicContact OE2-CE1 2.77Å; E1115-H1118 PolarHBondContact OE2-CE1 2.94Å; E1115-H1118 IonicContact OE2-ND1 3.11Å; A1116-H1118 PolarHBondContact O-N 2.8Å; H1118-G1120 VanDerWaalsContact C-N 3.28Å; H1118-R1160 WeakPolarHBondContact O-CD 3.2Å
1119	S	60.7	Low	80.4	Confident	42 Å²	42	27.9 Å²	27.9	29%	0.294	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.1	-9.4	172.5	-60.2	0	0	0	0	114	A1116 L1117 N1369	A1116-S1119 PolarHBondContact O-N 3.12Å; L1117-S1119 PolarHBondContact O-N 3.44Å; L1117-S1119 VanDerWaalsContact O-N 3.1Å; S1119-N1369 WeakPolarHBondContact CB-ND2 3.45Å; S1119-N1369 PolarHBondContact OG-ND2 3.45Å
1120	G	64.2	Low	80.4	Confident	21 Å²	21	28.2 Å²	28.2	22%	0.216	17%	0.168	C	C	.	.			trans	112.3	158.2	-169	0	0	0	0	0	112.6	L1117 H1118 G1123	L1117-G1120 WeakPolarHBondContact O-CA 3.12Å; L1117-G1120 PolarHBondContact O-N 2.66Å; H1118-G1120 VanDerWaalsContact C-N 3.28Å; G1120-G1123 PolarHBondContact O-N 2.85Å
1121	P	68.9	Low	80.2	Confident	41 Å²	41	31.5 Å²	31.5	27%	0.266	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.7	148.8	168.5	-23.7	35.3	0	0	0	112.1	L1117 A1163	L1117-P1121 HydrophobicContact CD2-CB 4.49Å; P1121-A1163 HydrophobicContact CG-CB 4.01Å
1122	P	66.6	Low	79.7	Confident	72 Å²	72	33.1 Å²	33.1	47%	0.468	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	cis	-83.2	-10.2	11.4	34.1	-36.1	0	0	0	115.2	L1117 V1469	L1117-P1122 WeakPolarHBondContact CD2-O 3.39Å; P1122-V1469 HydrophobicContact CB-CG1 3.6Å; P1122-V1469 HydrophobicContact CG-CG1 3.72Å
1123	G	74.8	Confident	78.6	Confident	19 Å²	19	33.9 Å²	33.9	20%	0.196	21%	0.211	C	C	.	.			trans	81.6	-121.6	-164.1	0	0	0	0	0	111.2	G1120	G1120-G1123 PolarHBondContact O-N 2.85Å
1124	L	83	Confident	77.4	Confident	10 Å²	10	41.8 Å²	41.8	5%	0.052	25%	0.245	C	C	.	.	S	Bend	trans	-81.3	138.9	179.9	-61.7	-179.9	0	0	0	111.8	Y870 L973 F975 L1109 L1112 I1113 A1116	Y870-L1124 HydrophobicContact CD1-CB 3.56Å; Y870-L1124 HydrophobicContact CD1-CD1 4.33Å; Y870-L1124 HydrophobicContact CE1-CB 3.86Å; Y870-L1124 HydrophobicContact CG-CB 4.5Å; L973-L1124 HydrophobicContact CD1-CD1 3.85Å; L973-L1124 HydrophobicContact CD1-CD2 4.4Å; F975-L1124 HydrophobicContact CE1-CD2 3.86Å; F975-L1124 HydrophobicContact CZ-CD2 3.94Å; L1109-L1124 HydrophobicContact CD1-CD1 4.06Å; L1112-L1124 HydrophobicContact CB-CD1 4.49Å; L1112-L1124 HydrophobicContact CD2-CD1 4.15Å; L1112-L1124 HydrophobicContact CG-CD1 4.05Å; L1112-L1124 HydrophobicContact CG-CD2 4.48Å; I1113-L1124 HydrophobicContact CG1-CD1 3.7Å; I1113-L1124 HydrophobicContact CG1-CG 4.28Å; A1116-L1124 HydrophobicContact CB-CD2 3.69Å; A1116-L1124 HydrophobicContact CB-CG 3.92Å
1125	L	85.2	Confident	76.3	Confident	32 Å²	32	46.1 Å²	46.1	17%	0.168	26%	0.26	C	S	.	.			trans	-69.3	135.2	172.7	-179.8	68.8	0	0	0	110.9	Y870 G873 Y874 E877 N1472	Y870-L1125 WeakPolarHBondContact CA-O 3.37Å; Y870-L1125 WeakPolarHBondContact CD1-O 3.34Å; G873-L1125 WeakPolarHBondContact O-CD2 3.41Å; Y874-L1125 HydrophobicContact CD1-CB 4.31Å; Y874-L1125 HydrophobicContact CD1-CD2 4.23Å; Y874-L1125 HydrophobicContact CE1-CB 3.78Å; Y874-L1125 HydrophobicContact CE1-CD2 4.36Å; Y874-L1125 HydrophobicContact CE2-CB 4.08Å; Y874-L1125 PolarHBondContact OH-N 3.47Å; Y874-L1125 VanDerWaalsContact OH-N 3.07Å; E877-L1125 HydrophobicContact CB-CD2 4.18Å; E877-L1125 HydrophobicContact CG-CD2 3.43Å; E877-L1125 VanDerWaalsContact CG-CD2 3.43Å; L1125-N1472 HydrophobicContact CD1-CB 3.96Å
1126	S	87	Confident	76	Confident	35 Å²	35	48 Å²	48	25%	0.245	27%	0.268	C	S	.	.			trans	-118.6	152.8	172.1	55.7	0	0	0	0	111.6	P869	P869-S1126 CarbonylContact O-C 3.54Å; P869-S1126 WeakPolarHBondContact O-CA 3.33Å
1127	S	89.6	Confident	76.1	Confident	2 Å²	2	52.2 Å²	52.2	1%	0.014	29%	0.294	C	S	.	.			trans	-63.4	127.4	176.3	177.3	0	0	0	0	111.4	P869 E876 F1129 L1130	P869-S1127 WeakPolarHBondContact O-CB 3.01Å; P869-S1127 PolarHBondContact O-N 3.02Å; E876-S1127 VanDerWaalsContact OE1-CB 3.23Å; E876-S1127 WeakPolarHBondContact OE1-CB 3.05Å; E876-S1127 PolarHBondContact OE1-OG 3.37Å; S1127-F1129 PolarHBondContact O-N 3.12Å; S1127-F1129 VanDerWaalsContact O-N 3.12Å; S1127-F1129 PolarHBondContact OG-N 2.92Å; S1127-L1130 PolarHBondContact O-N 3.49Å
1128	P	86	Confident	76.5	Confident	32 Å²	32	56.8 Å²	56.8	21%	0.208	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.9	-23.9	169	18.5	-33.1	0	0	0	114	E876 N1473 E1474 P1475	E876-P1128 WeakPolarHBondContact OE2-CD 3.2Å; P1128-N1473 WeakPolarHBondContact CB-O 3.32Å; P1128-E1474 WeakPolarHBondContact CA-O 3.35Å; P1128-P1475 VanDerWaalsContact CB-CD 3.46Å
1129	F	88.3	Confident	77.5	Confident	95 Å²	95	58.8 Å²	58.8	42%	0.417	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.7	-7.2	-173.4	-53.1	-64.3	0	0	0	114	E876 A908 V909 S1127	E876-F1129 WeakPolarHBondContact OE2-CD2 3.4Å; E876-F1129 WeakPolarHBondContact OE2-CE2 3.49Å; A908-F1129 HydrophobicContact CB-CB 3.65Å; A908-F1129 HydrophobicContact CB-CD1 3.59Å; A908-F1129 HydrophobicContact CB-CD2 4.46Å; A908-F1129 HydrophobicContact CB-CE1 4.38Å; A908-F1129 HydrophobicContact CB-CG 3.63Å; V909-F1129 HydrophobicContact CG1-CD2 3.69Å; V909-F1129 HydrophobicContact CG1-CE2 3.62Å; V909-F1129 HydrophobicContact CG1-CZ 4.42Å; S1127-F1129 PolarHBondContact O-N 3.12Å; S1127-F1129 VanDerWaalsContact O-N 3.12Å; S1127-F1129 PolarHBondContact OG-N 2.92Å
1130	L	87.1	Confident	79.1	Confident	8 Å²	8	60.2 Å²	60.2	4%	0.042	32%	0.323	C	S	.	.	S	Bend	trans	-126.7	138.6	-175	-65.3	-176.5	0	0	0	112.7	P869 F872 L901 A904 W905 S1127 V1132	P869-L1130 HydrophobicContact CB-CB 4.24Å; P869-L1130 HydrophobicContact CG-CB 4.28Å; F872-L1130 HydrophobicContact CD2-CD1 3.57Å; F872-L1130 HydrophobicContact CE2-CD1 4.25Å; F872-L1130 HydrophobicContact CG-CD1 4.46Å; L901-L1130 HydrophobicContact CB-CD1 4.34Å; L901-L1130 HydrophobicContact CB-CD2 4.25Å; L901-L1130 HydrophobicContact CD2-CB 4.4Å; L901-L1130 HydrophobicContact CD2-CD2 3.89Å; L901-L1130 VanDerWaalsContact O-CD2 3.28Å; L901-L1130 WeakPolarHBondContact O-CD2 3.34Å; A904-L1130 HydrophobicContact CB-CD2 3.94Å; W905-L1130 HydrophobicContact CB-CD1 4.11Å; W905-L1130 HydrophobicContact CB-CD2 4.03Å; W905-L1130 HydrophobicContact CB-CG 4.19Å; S1127-L1130 PolarHBondContact O-N 3.49Å; L1130-V1132 PolarHBondContact O-N 3.46Å
1131	P	81.6	Confident	80.5	Confident	90 Å²	90	59.5 Å²	59.5	58%	0.584	32%	0.315	S	S	*	.	P	Polyproline II helix	trans	-65.9	129.6	169.6	29.5	-33.4	0	0	0	109.6	P869 L901	P869-P1131 VanDerWaalsContact CG-O 3.31Å; P869-P1131 WeakPolarHBondContact CG-O 3.4Å; L901-P1131 HydrophobicContact CD2-CG 4.01Å
1132	V	75	Confident	81.5	Confident	45 Å²	45	60.2 Å²	60.2	27%	0.273	33%	0.329	S	S	.	.	P	Polyproline II helix	trans	-59.3	140.9	164.3	177.8	0	0	0	0	108.7	Y870 L1130	Y870-V1132 HydrophobicContact CE2-CG1 4.25Å; Y870-V1132 VanDerWaalsContact OH-CG1 3.24Å; Y870-V1132 WeakPolarHBondContact OH-CG1 3.45Å; L1130-V1132 PolarHBondContact O-N 3.46Å
1133	A	63.8	Low	82.8	Confident	29 Å²	29	57.2 Å²	57.2	24%	0.24	31%	0.309	C	S	.	.	P	Polyproline II helix	trans	-53.6	142.7	-177.7	0	0	0	0	0	112	F1106 R1135	F1106-A1133 HydrophobicContact CE2-CB 4.31Å; A1133-R1135 PolarHBondContact O-N 3.05Å; A1133-R1135 VanDerWaalsContact O-N 3.14Å
1134	K	61.4	Low	83.9	Confident	188 Å²	188	59.4 Å²	59.4	82%	0.817	32%	0.316	S	S	*	.	P	Polyproline II helix	trans	-57	120.2	-178.9	-74.3	177.1	178.4	169.4	0	110.3
1135	R	65	Low	84.5	Confident	94 Å²	94	61.3 Å²	61.3	36%	0.355	32%	0.323	S	S	.	.	P	Polyproline II helix	trans	-59.3	150.2	167.6	-65.5	-178.2	-179.7	174.4	-7.8	110.3	A1133 D1166	A1133-R1135 PolarHBondContact O-N 3.05Å; A1133-R1135 VanDerWaalsContact O-N 3.14Å; R1135-D1166 IonicContact CZ-OD2 2.83Å; R1135-D1166 IonicContact NH1-OD2 3.59Å; R1135-D1166 PolarHBondContact NH1-OD2 3.49Å; R1135-D1166 IonicContact NH2-OD2 2.72Å
1136	F	74.4	Confident	85	Confident	99 Å²	99	59.8 Å²	59.8	43%	0.434	32%	0.315	S	S	.	.	P	Polyproline II helix	trans	-75.4	158.7	174.1	-70	-89.8	0	0	0	109.5	F1106 K1138 D1169	F1106-F1136 HydrophobicContact CD1-CD2 4.45Å; F1106-F1136 AromaticContact CD1-CE2 3.75Å; F1106-F1136 HydrophobicContact CD1-CE2 3.75Å; F1106-F1136 AromaticContact CE1-CD2 3.88Å; F1106-F1136 HydrophobicContact CE1-CD2 3.88Å; F1106-F1136 AromaticContact CE1-CE2 3.58Å; F1106-F1136 HydrophobicContact CE1-CE2 3.58Å; F1106-F1136 HydrophobicContact CG-CE2 4.39Å; F1106-F1136 HydrophobicContact CZ-CD2 4.31Å; F1106-F1136 HydrophobicContact CZ-CE2 4.1Å; F1136-K1138 PolarHBondContact O-N 3.01Å; F1136-D1169 HydrophobicContact CB-CB 4.24Å; F1136-D1169 PolarHBondContact N-OD1 3.29Å
1137	P	82.1	Confident	85.5	Confident	113 Å²	113	58.1 Å²	58.1	73%	0.734	30%	0.303	S	S	*	.	P	Polyproline II helix	trans	-56.9	129	170.9	-22.3	33.8	0	0	0	109.6
1138	K	89.7	Confident	85.8	Confident	102 Å²	102	58.2 Å²	58.2	44%	0.443	30%	0.303	S	S	.	.	P	Polyproline II helix	trans	-61.6	140.4	176.9	-66.1	-177.8	174.1	-168.3	0	110.5	F1136 D1166 D1169 L1170 E1171	F1136-K1138 PolarHBondContact O-N 3.01Å; K1138-D1166 VanDerWaalsContact CE-OD1 3.26Å; K1138-D1166 WeakPolarHBondContact CE-OD1 3.25Å; K1138-D1166 IonicContact NZ-OD1 3.44Å; K1138-D1166 PolarHBondContact NZ-OD1 3.23Å; K1138-D1169 VanDerWaalsContact CA-O 3.29Å; K1138-D1169 WeakPolarHBondContact CA-O 3.42Å; K1138-L1170 WeakPolarHBondContact CD-O 3.29Å; K1138-E1171 HydrophobicContact CB-CB 4.16Å
1139	D	92.9	Very high	86.2	Confident	66 Å²	66	57.3 Å²	57.3	35%	0.353	30%	0.297	S	S	.	.	B	Isolated β-bridge	trans	-135	180	172.5	72.7	29.5	0	0	0	112.5	L1141 D1169 L1170 E1171 R1248	D1139-L1141 PolarHBondContact OD1-N 3.29Å; D1139-D1169 PolarHBondContact N-O 3.06Å; D1139-L1170 WeakPolarHBondContact O-CA 3.15Å; D1139-E1171 PolarHBondContact O-N 3.29Å; D1139-R1248 IonicContact OD1-CZ 2.94Å; D1139-R1248 IonicContact OD1-NH1 2.61Å; D1139-R1248 PolarHBondContact OD1-NH1 3.47Å; D1139-R1248 IonicContact OD1-NH2 3.32Å; D1139-R1248 PolarHBondContact OD1-NH2 3.43Å; D1139-R1248 IonicContact OD2-CZ 3.71Å; D1139-R1248 IonicContact OD2-NH2 3.65Å; D1139-R1248 PolarHBondContact OD2-NH2 2.99Å
1140	R	94.5	Very high	86.4	Confident	71 Å²	71	52.8 Å²	52.8	27%	0.268	28%	0.277	S	S	.	.			trans	-110.6	19.3	-178.6	-56.1	178.4	-168	-166.6	-3.5	112.7	G1142 F1143 D1144 L1146 E1171	R1140-G1142 PolarHBondContact O-N 3.16Å; R1140-F1143 VanDerWaalsContact CB-O 3.26Å; R1140-F1143 WeakPolarHBondContact CB-O 3.24Å; R1140-F1143 WeakPolarHBondContact O-CB 3.38Å; R1140-F1143 WeakPolarHBondContact O-CD2 3.41Å; R1140-F1143 PolarHBondContact O-N 2.67Å; R1140-D1144 WeakPolarHBondContact CD-O 3.24Å; R1140-D1144 PolarHBondContact NH1-O 3Å; R1140-L1146 HydrophobicContact CB-CG 4.34Å; R1140-E1171 HydrophobicContact CG-CB 4.08Å; R1140-E1171 IonicContact CZ-OE1 2.69Å; R1140-E1171 IonicContact CZ-OE2 3.03Å; R1140-E1171 VanDerWaalsContact NE-CD 3.34Å; R1140-E1171 IonicContact NE-OE1 3.48Å; R1140-E1171 IonicContact NE-OE2 3.49Å; R1140-E1171 PolarHBondContact NE-OE2 2.83Å; R1140-E1171 IonicContact NH2-OE1 2.8Å; R1140-E1171 PolarHBondContact NH2-OE1 2.85Å; R1140-E1171 IonicContact NH2-OE2 3.35Å; R1140-E1171 PolarHBondContact NH2-OE2 3.04Å
1141	L	92.7	Very high	86.3	Confident	6 Å²	6	54.6 Å²	54.6	3%	0.031	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	50.9	25.6	-177.9	-55.6	174.8	0	0	0	115.8	D1139 F1143 L1170 F1247 R1248 V1251 L1252	D1139-L1141 PolarHBondContact OD1-N 3.29Å; L1141-F1143 HydrophobicContact CB-CD2 4.18Å; L1141-F1143 HydrophobicContact CB-CE2 4.46Å; L1141-F1143 WeakPolarHBondContact O-CD2 3.44Å; L1141-L1170 HydrophobicContact CD1-CD2 3.61Å; L1141-L1170 HydrophobicContact CD2-CD2 3.97Å; L1141-L1170 HydrophobicContact CG-CD2 3.5Å; L1141-F1247 HydrophobicContact CD1-CE1 4.4Å; L1141-R1248 HydrophobicContact CD2-CB 4.05Å; L1141-R1248 HydrophobicContact CD2-CG 4.23Å; L1141-V1251 HydrophobicContact CB-CG1 4.26Å; L1141-V1251 HydrophobicContact CD1-CB 3.87Å; L1141-V1251 HydrophobicContact CD1-CG1 3.63Å; L1141-V1251 HydrophobicContact CD1-CG2 4.41Å; L1141-L1252 HydrophobicContact CB-CD2 4.13Å; L1141-L1252 HydrophobicContact CD2-CD1 4.27Å; L1141-L1252 HydrophobicContact CD2-CD2 4.26Å; L1141-L1252 HydrophobicContact CD2-CG 4.1Å
1142	G	90.1	Very high	86.3	Confident	56 Å²	56	56 Å²	56	58%	0.577	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.7	15.1	-176.8	0	0	0	0	0	115.7	R1140 R1233	R1140-G1142 PolarHBondContact O-N 3.16Å; G1142-R1233 PolarHBondContact O-NH2 2.94Å
1143	F	95.5	Very high	86.4	Confident	10 Å²	10	58.8 Å²	58.8	4%	0.044	29%	0.291	C	S	.	.			trans	-100.8	155	170.8	-65.6	-101.4	0	0	0	110.8	R1140 L1141 L1146 R1233 I1235 V1251 A1255 M1303	R1140-F1143 VanDerWaalsContact CB-O 3.26Å; R1140-F1143 WeakPolarHBondContact CB-O 3.24Å; R1140-F1143 WeakPolarHBondContact O-CB 3.38Å; R1140-F1143 WeakPolarHBondContact O-CD2 3.41Å; R1140-F1143 PolarHBondContact O-N 2.67Å; L1141-F1143 HydrophobicContact CB-CD2 4.18Å; L1141-F1143 HydrophobicContact CB-CE2 4.46Å; L1141-F1143 WeakPolarHBondContact O-CD2 3.44Å; F1143-L1146 HydrophobicContact CB-CD2 4.07Å; F1143-L1146 HydrophobicContact CD2-CD2 4.49Å; F1143-L1146 HydrophobicContact CG-CD2 4.32Å; F1143-R1233 HydrophobicContact CD1-CB 3.88Å; F1143-R1233 HydrophobicContact CE1-CB 4.32Å; F1143-I1235 HydrophobicContact CD1-CD1 4.28Å; F1143-I1235 HydrophobicContact CD1-CG1 3.59Å; F1143-I1235 HydrophobicContact CD2-CD1 3.93Å; F1143-I1235 HydrophobicContact CD2-CG1 4.09Å; F1143-I1235 HydrophobicContact CE1-CD1 4.05Å; F1143-I1235 HydrophobicContact CE1-CG1 3.59Å; F1143-I1235 HydrophobicContact CE2-CD1 3.72Å; F1143-I1235 HydrophobicContact CE2-CG1 4.12Å; F1143-I1235 HydrophobicContact CG-CD1 4.22Å; F1143-I1235 HydrophobicContact CG-CG1 3.85Å; F1143-I1235 HydrophobicContact CZ-CD1 3.77Å; F1143-I1235 HydrophobicContact CZ-CG1 3.87Å; F1143-V1251 HydrophobicContact CE2-CG1 3.88Å; F1143-V1251 HydrophobicContact CZ-CG1 4.41Å; F1143-A1255 HydrophobicContact CE2-CB 4.25Å; F1143-A1255 HydrophobicContact CZ-CB 4.27Å; F1143-M1303 HydrophobicContact CE1-CB 4.29Å; F1143-M1303 HydrophobicContact CE1-CE 3.7Å; F1143-M1303 HydrophobicContact CE1-CG 3.91Å; F1143-M1303 HydrophobicContact CE1-SD 4.25Å; F1143-M1303 HydrophobicContact CZ-CE 3.56Å; F1143-M1303 HydrophobicContact CZ-CG 4.02Å; F1143-M1303 HydrophobicContact CZ-SD 3.87Å
1144	D	96	Very high	87	Confident	65 Å²	65	59.7 Å²	59.7	35%	0.348	29%	0.288	S	S	.	.	S	Bend	trans	-70.2	-41.4	-179.7	-58.3	-62.3	0	0	0	111.3	R1140 L1231 Q1232 R1233	R1140-D1144 WeakPolarHBondContact CD-O 3.24Å; R1140-D1144 PolarHBondContact NH1-O 3Å; D1144-L1231 HydrophobicContact CB-CB 4.29Å; D1144-L1231 HydrophobicContact CB-CD2 4.11Å; D1144-Q1232 WeakPolarHBondContact OD2-CA 3.42Å; D1144-Q1232 WeakPolarHBondContact OD2-CB 3.43Å; D1144-Q1232 PolarHBondContact OD2-N 3.08Å; D1144-R1233 PolarHBondContact N-O 3.34Å; D1144-R1233 PolarHBondContact OD2-N 3.43Å
1145	R	95.9	Very high	87.8	Confident	50 Å²	50	51.9 Å²	51.9	19%	0.189	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	149.2	174	-67	-174.2	-176.7	-83.3	4.7	110.9	F1147 D1173 E1229 L1231 V1234 I1235	R1145-F1147 HydrophobicContact CB-CE1 4.14Å; R1145-F1147 HydrophobicContact CB-CE2 4.08Å; R1145-F1147 HydrophobicContact CB-CZ 3.85Å; R1145-F1147 VanDerWaalsContact CD-CZ 3.45Å; R1145-F1147 HydrophobicContact CG-CZ 4.3Å; R1145-D1173 WeakPolarHBondContact CD-OD2 3.32Å; R1145-D1173 WeakPolarHBondContact CG-OD2 3.25Å; R1145-D1173 IonicContact CZ-OD2 3.06Å; R1145-D1173 IonicContact NE-OD2 3.37Å; R1145-D1173 IonicContact NH1-OD1 2.79Å; R1145-D1173 PolarHBondContact NH1-OD1 2.93Å; R1145-D1173 IonicContact NH1-OD2 3.85Å; R1145-D1173 PolarHBondContact NH1-OD2 2.78Å; R1145-E1229 IonicContact CZ-OE2 3.76Å; R1145-E1229 IonicContact NE-OE2 3.61Å; R1145-E1229 PolarHBondContact NE-OE2 3.5Å; R1145-E1229 IonicContact NH2-OE1 2.72Å; R1145-E1229 IonicContact NH2-OE2 2.62Å; R1145-E1229 PolarHBondContact NH2-OE2 3.31Å; R1145-L1231 HydrophobicContact CB-CD1 4.38Å; R1145-L1231 HydrophobicContact CG-CD1 4.06Å; R1145-L1231 HydrophobicContact CG-CD2 4.38Å; R1145-V1234 HydrophobicContact CB-CG1 4.18Å; R1145-V1234 VanDerWaalsContact O-CA 3.23Å; R1145-V1234 WeakPolarHBondContact O-CA 3.43Å; R1145-V1234 WeakPolarHBondContact O-CB 3.43Å; R1145-I1235 PolarHBondContact O-N 3.17Å
1146	L	97.2	Very high	88.1	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	133.2	164.6	-55.5	179	0	0	0	106.4	R1140 F1143 L1170 V1172 D1173 I1235 F1237	R1140-L1146 HydrophobicContact CB-CG 4.34Å; F1143-L1146 HydrophobicContact CB-CD2 4.07Å; F1143-L1146 HydrophobicContact CD2-CD2 4.49Å; F1143-L1146 HydrophobicContact CG-CD2 4.32Å; L1146-L1170 HydrophobicContact CD1-CB 4.37Å; L1146-L1170 HydrophobicContact CD1-CD2 3.97Å; L1146-V1172 HydrophobicContact CB-CB 4.29Å; L1146-V1172 HydrophobicContact CB-CG1 4.15Å; L1146-V1172 HydrophobicContact CB-CG2 3.9Å; L1146-V1172 HydrophobicContact CD1-CG2 4.09Å; L1146-V1172 CarbonylContact O-C 3.58Å; L1146-V1172 WeakPolarHBondContact O-CG1 3.47Å; L1146-D1173 PolarHBondContact O-N 3.12Å; L1146-I1235 CarbonylContact C-O 3.49Å; L1146-I1235 WeakPolarHBondContact CA-O 3.46Å; L1146-I1235 HydrophobicContact CD2-CB 3.65Å; L1146-I1235 HydrophobicContact CD2-CD1 3.64Å; L1146-I1235 HydrophobicContact CD2-CG1 3.49Å; L1146-I1235 VanDerWaalsContact CD2-CG1 3.49Å; L1146-F1237 HydrophobicContact CB-CE2 4.29Å
1147	F	97.1	Very high	88.4	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	136.7	-177.6	-65	-65.8	0	0	0	111.8	R1145 D1173 V1175 I1222 V1226 L1231 V1234 I1235 V1236 F1237	R1145-F1147 HydrophobicContact CB-CE1 4.14Å; R1145-F1147 HydrophobicContact CB-CE2 4.08Å; R1145-F1147 HydrophobicContact CB-CZ 3.85Å; R1145-F1147 VanDerWaalsContact CD-CZ 3.45Å; R1145-F1147 HydrophobicContact CG-CZ 4.3Å; F1147-D1173 WeakPolarHBondContact CA-O 3.26Å; F1147-D1173 HydrophobicContact CD1-CB 3.75Å; F1147-D1173 HydrophobicContact CE1-CB 4.05Å; F1147-V1175 HydrophobicContact CB-CG2 4.01Å; F1147-V1175 HydrophobicContact CD1-CG2 3.59Å; F1147-V1175 HydrophobicContact CE1-CG2 4.38Å; F1147-V1175 HydrophobicContact CG-CG2 4.1Å; F1147-I1222 HydrophobicContact CB-CD1 3.95Å; F1147-I1222 HydrophobicContact CD2-CG2 3.64Å; F1147-I1222 HydrophobicContact CE2-CG2 3.78Å; F1147-I1222 HydrophobicContact CG-CD1 4.3Å; F1147-I1222 HydrophobicContact CG-CG2 4.3Å; F1147-V1226 HydrophobicContact CE2-CG2 4.16Å; F1147-L1231 HydrophobicContact CE2-CD1 4.26Å; F1147-L1231 HydrophobicContact CZ-CD1 3.91Å; F1147-V1234 HydrophobicContact CD2-CB 4.21Å; F1147-V1234 HydrophobicContact CD2-CG2 4.33Å; F1147-V1234 HydrophobicContact CE2-CB 4.03Å; F1147-V1234 HydrophobicContact CE2-CG1 3.92Å; F1147-V1234 HydrophobicContact CE2-CG2 4.19Å; F1147-I1235 PolarHBondContact N-O 2.84Å; F1147-V1236 HydrophobicContact CD2-CG2 4.3Å; F1147-F1237 PolarHBondContact O-N 3.16Å
1148	L	95.9	Very high	88.6	Confident	3 Å²	3	42.9 Å²	42.9	2%	0.016	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	116.5	168	176.3	70	0	0	0	109.9	N1150 M1161 F1165 V1172 D1173 V1175 F1237 D1239	L1148-N1150 HydrophobicContact CD2-CB 4.45Å; L1148-N1150 HydrophobicContact CG-CB 4.43Å; L1148-M1161 HydrophobicContact CD1-CB 4.11Å; L1148-M1161 HydrophobicContact CD1-CE 4.17Å; L1148-M1161 HydrophobicContact CD1-CG 4.11Å; L1148-M1161 HydrophobicContact CD2-CB 3.78Å; L1148-F1165 HydrophobicContact CB-CE2 4.14Å; L1148-F1165 HydrophobicContact CD1-CE2 4.1Å; L1148-F1165 HydrophobicContact CD1-CZ 4.39Å; L1148-F1165 HydrophobicContact CD2-CE2 4.15Å; L1148-F1165 HydrophobicContact CG-CE2 4.34Å; L1148-V1172 HydrophobicContact CB-CG1 3.91Å; L1148-D1173 PolarHBondContact N-O 2.82Å; L1148-V1175 WeakPolarHBondContact O-CA 3.36Å; L1148-V1175 PolarHBondContact O-N 3.08Å; L1148-F1237 CarbonylContact C-O 3.21Å; L1148-F1237 WeakPolarHBondContact CA-O 3.14Å; L1148-F1237 HydrophobicContact CD1-CB 4.23Å; L1148-D1239 HydrophobicContact CD1-CB 4.35Å
1149	I	94.5	Very high	88.4	Confident	13 Å²	13	39.2 Å²	39.2	7%	0.067	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	118.6	167.9	-60.9	174.9	0	0	0	108.1	A1177 H1219 I1222 V1236 F1237 D1239	I1149-A1177 HydrophobicContact CG2-CB 3.67Å; I1149-H1219 WeakPolarHBondContact CD1-CE1 3.49Å; I1149-H1219 WeakPolarHBondContact CD1-ND1 3.41Å; I1149-I1222 HydrophobicContact CD1-CD1 3.83Å; I1149-I1222 HydrophobicContact CG1-CD1 3.53Å; I1149-V1236 HydrophobicContact CD1-CG1 3.64Å; I1149-V1236 HydrophobicContact CG1-CG1 3.99Å; I1149-F1237 PolarHBondContact N-O 3.46Å; I1149-D1239 PolarHBondContact O-N 2.82Å
1150	N	91.9	Very high	88	Confident	1 Å²	1	37.3 Å²	37.3	1%	0.005	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	137.9	175	167.3	-109.4	0	0	0	110.8	L1148 R1154 K1158 V1175 A1177 D1239	L1148-N1150 HydrophobicContact CD2-CB 4.45Å; L1148-N1150 HydrophobicContact CG-CB 4.43Å; N1150-R1154 PolarHBondContact ND2-O 3.31Å; N1150-K1158 WeakPolarHBondContact OD1-CB 3.23Å; N1150-V1175 PolarHBondContact N-O 3.39Å; N1150-A1177 VanDerWaalsContact O-CB 3.29Å; N1150-A1177 WeakPolarHBondContact O-CB 3.4Å; N1150-A1177 PolarHBondContact O-N 3.21Å; N1150-D1239 HydrophobicContact CB-CB 4.08Å; N1150-D1239 PolarHBondContact ND2-OD2 2.8Å
1151	L	84.6	Confident	87.7	Confident	45 Å²	45	34 Å²	34	24%	0.236	17%	0.174	C	C	.	.			trans	-74.1	129.6	169.9	-76.2	165.7	0	0	0	109.2	R1153 R1154 A1177 D1179	L1151-R1153 HydrophobicContact CB-CG 4.49Å; L1151-R1153 PolarHBondContact O-N 3.49Å; L1151-R1153 VanDerWaalsContact O-N 3.07Å; L1151-R1154 HydrophobicContact CB-CB 4.39Å; L1151-R1154 HydrophobicContact CB-CG 4.11Å; L1151-R1154 WeakPolarHBondContact O-CA 3.47Å; L1151-R1154 WeakPolarHBondContact O-CB 3.48Å; L1151-R1154 PolarHBondContact O-N 3.44Å; L1151-A1177 HydrophobicContact CD2-CB 3.86Å; L1151-A1177 HydrophobicContact CG-CB 4.02Å; L1151-D1179 HydrophobicContact CD2-CB 4.06Å
1152	E	82.2	Confident	87.6	Confident	121 Å²	121	36.3 Å²	36.3	57%	0.565	19%	0.185	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-28.5	-174.1	-169.5	172.1	-105.4	0	0	113.8	R1154 K1176	E1152-R1154 PolarHBondContact O-N 3.5Å; E1152-K1176 VanDerWaalsContact CD-CE 3.44Å; E1152-K1176 WeakPolarHBondContact OE1-CD 3.38Å; E1152-K1176 VanDerWaalsContact OE1-CE 3.23Å; E1152-K1176 WeakPolarHBondContact OE1-CE 3.31Å; E1152-K1176 IonicContact OE1-NZ 3.35Å; E1152-K1176 PolarHBondContact OE1-NZ 3.33Å; E1152-K1176 VanDerWaalsContact OE2-CE 3.26Å; E1152-K1176 WeakPolarHBondContact OE2-CE 3.39Å; E1152-K1176 IonicContact OE2-NZ 2.67Å; E1152-K1176 PolarHBondContact OE2-NZ 2.95Å
1153	R	76.2	Confident	87.5	Confident	102 Å²	102	34.6 Å²	34.6	39%	0.385	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-8.6	172.4	71.4	175	-175	-86.2	4.1	114.6	L1151 D1179	L1151-R1153 HydrophobicContact CB-CG 4.49Å; L1151-R1153 PolarHBondContact O-N 3.49Å; L1151-R1153 VanDerWaalsContact O-N 3.07Å; R1153-D1179 IonicContact CZ-OD1 2.67Å; R1153-D1179 IonicContact CZ-OD2 3.62Å; R1153-D1179 IonicContact NH1-OD1 3.83Å; R1153-D1179 PolarHBondContact NH1-OD1 3.01Å; R1153-D1179 IonicContact NH1-OD2 2.78Å; R1153-D1179 PolarHBondContact NH1-OD2 3.35Å; R1153-D1179 IonicContact NH2-OD1 3.54Å
1154	R	76.3	Confident	87.2	Confident	49 Å²	49	34.1 Å²	34.1	19%	0.185	16%	0.163	C	C	.	.			trans	-107.1	50	-179.5	-63	-54.7	-57.1	-110.1	0.9	111.3	N1150 L1151 E1152 D1156 R1157 K1158 Y1374	N1150-R1154 PolarHBondContact ND2-O 3.31Å; L1151-R1154 HydrophobicContact CB-CB 4.39Å; L1151-R1154 HydrophobicContact CB-CG 4.11Å; L1151-R1154 WeakPolarHBondContact O-CA 3.47Å; L1151-R1154 WeakPolarHBondContact O-CB 3.48Å; L1151-R1154 PolarHBondContact O-N 3.44Å; E1152-R1154 PolarHBondContact O-N 3.5Å; R1154-D1156 VanDerWaalsContact C-OD1 3.24Å; R1154-D1156 WeakPolarHBondContact CA-OD1 3.38Å; R1154-D1156 IonicContact CZ-OD1 2.7Å; R1154-D1156 IonicContact CZ-OD2 2.69Å; R1154-D1156 IonicContact NE-OD1 3.84Å; R1154-D1156 PolarHBondContact NE-OD1 2.95Å; R1154-D1156 IonicContact NE-OD2 2.6Å; R1154-D1156 IonicContact NH2-OD1 3.17Å; R1154-D1156 IonicContact NH2-OD2 3.25Å; R1154-D1156 PolarHBondContact NH2-OD2 3.4Å; R1154-D1156 PolarHBondContact O-N 3.39Å; R1154-R1157 HydrophobicContact CB-CB 4.26Å; R1154-R1157 HydrophobicContact CB-CG 4.07Å; R1154-R1157 VanDerWaalsContact CZ-NE 3.29Å; R1154-R1157 PolarHBondContact O-N 3.5Å; R1154-K1158 PolarHBondContact O-N 3.02Å; R1154-K1158 VanDerWaalsContact O-N 3.1Å; R1154-Y1374 PolarHBondContact NH2-OH 3.36Å
1155	A	79	Confident	87.1	Confident	24 Å²	24	31.3 Å²	31.3	20%	0.198	15%	0.148	C	C	.	.	H	α-helix	trans	-57.9	-28.7	174.5	0	0	0	0	0	112.4	R1157 K1158 A1159	A1155-R1157 VanDerWaalsContact C-N 3.33Å; A1155-R1157 PolarHBondContact O-N 2.82Å; A1155-K1158 PolarHBondContact O-N 2.82Å; A1155-A1159 WeakPolarHBondContact O-CB 3.4Å; A1155-A1159 PolarHBondContact O-N 3.16Å
1156	D	72	Confident	86.7	Confident	22 Å²	22	30 Å²	30	12%	0.118	14%	0.144	C	C	.	.	H	α-helix	trans	-55.1	-46.3	171	68.6	-55.1	0	0	0	112.2	R1154 R1160 Y1374	R1154-D1156 VanDerWaalsContact C-OD1 3.24Å; R1154-D1156 WeakPolarHBondContact CA-OD1 3.38Å; R1154-D1156 IonicContact CZ-OD1 2.7Å; R1154-D1156 IonicContact CZ-OD2 2.69Å; R1154-D1156 IonicContact NE-OD1 3.84Å; R1154-D1156 PolarHBondContact NE-OD1 2.95Å; R1154-D1156 IonicContact NE-OD2 2.6Å; R1154-D1156 IonicContact NH2-OD1 3.17Å; R1154-D1156 IonicContact NH2-OD2 3.25Å; R1154-D1156 PolarHBondContact NH2-OD2 3.4Å; R1154-D1156 PolarHBondContact O-N 3.39Å; D1156-R1160 WeakPolarHBondContact O-CB 3.31Å; D1156-R1160 PolarHBondContact O-N 2.85Å; D1156-Y1374 PolarHBondContact OD2-OH 3.1Å
1157	R	80.2	Confident	86.3	Confident	56 Å²	56	30.5 Å²	30.5	21%	0.211	15%	0.149	C	C	.	.	H	α-helix	trans	-73.6	-40.5	179.6	-58	-166.7	169.1	-167.2	-12.4	111	R1154 A1155 R1160 M1161 D1239 D1240	R1154-R1157 HydrophobicContact CB-CB 4.26Å; R1154-R1157 HydrophobicContact CB-CG 4.07Å; R1154-R1157 VanDerWaalsContact CZ-NE 3.29Å; R1154-R1157 PolarHBondContact O-N 3.5Å; A1155-R1157 VanDerWaalsContact C-N 3.33Å; A1155-R1157 PolarHBondContact O-N 2.82Å; R1157-R1160 PolarHBondContact O-N 3.45Å; R1157-M1161 WeakPolarHBondContact O-CB 3.32Å; R1157-M1161 VanDerWaalsContact O-CG 3.32Å; R1157-M1161 WeakPolarHBondContact O-CG 3.47Å; R1157-M1161 PolarHBondContact O-N 2.86Å; R1157-D1239 HydrophobicContact CB-CB 3.88Å; R1157-D1239 WeakPolarHBondContact CD-OD1 3.46Å; R1157-D1239 WeakPolarHBondContact CD-OD2 3.28Å; R1157-D1239 IonicContact CZ-OD1 2.8Å; R1157-D1239 IonicContact NE-OD1 3.96Å; R1157-D1239 IonicContact NH1-OD1 3.98Å; R1157-D1239 PolarHBondContact NH1-OD1 3.43Å; R1157-D1240 IonicContact CZ-OD2 3.49Å; R1157-D1240 VanDerWaalsContact CZ-OD2 3.26Å; R1157-D1240 IonicContact NH1-OD2 3.73Å; R1157-D1240 PolarHBondContact NH1-OD2 2.9Å; R1157-D1240 IonicContact NH2-OD2 2.74Å; R1157-D1240 PolarHBondContact NH2-OD2 3.44Å; R1157-D1240 VanDerWaalsContact NH2-OD2 3.08Å
1158	K	86.1	Confident	86	Confident	39 Å²	39	30.6 Å²	30.6	17%	0.17	15%	0.149	C	C	.	.	H	α-helix	trans	-57.6	-55.7	176.8	-163.2	-174.1	173.9	-159.5	0	111.9	N1150 R1154 A1155 R1160 M1161 E1162 H1174 M1482	N1150-K1158 WeakPolarHBondContact OD1-CB 3.23Å; R1154-K1158 PolarHBondContact O-N 3.02Å; R1154-K1158 VanDerWaalsContact O-N 3.1Å; A1155-K1158 PolarHBondContact O-N 2.82Å; K1158-R1160 VanDerWaalsContact C-N 3.29Å; K1158-R1160 PolarHBondContact O-N 3.49Å; K1158-M1161 PolarHBondContact O-N 3.47Å; K1158-M1161 VanDerWaalsContact O-N 3.09Å; K1158-E1162 WeakPolarHBondContact CE-OE1 3.47Å; K1158-E1162 IonicContact NZ-OE1 2.8Å; K1158-E1162 WeakPolarHBondContact O-CB 3.46Å; K1158-E1162 WeakPolarHBondContact O-CG 3.14Å; K1158-E1162 PolarHBondContact O-N 3.04Å; K1158-H1174 VanDerWaalsContact CE-CD2 3.46Å; K1158-H1174 WeakPolarHBondContact CE-CD2 3.39Å; K1158-M1482 HydrophobicContact CD-CE 3.9Å; K1158-M1482 HydrophobicContact CD-SD 4.46Å; K1158-M1482 VanDerWaalsContact CE-CE 3.47Å; K1158-M1482 HydrophobicContact CG-CE 4.44Å; K1158-M1482 PolarHBondContact NZ-SD 3.36Å; K1158-M1482 VanDerWaalsContact NZ-SD 3.41Å
1159	A	84.8	Confident	85.7	Confident	25 Å²	25	30.6 Å²	30.6	21%	0.207	15%	0.149	C	C	.	.	H	α-helix	trans	-61.8	-36.7	-178.6	0	0	0	0	0	112.3	A1155 A1163	A1155-A1159 WeakPolarHBondContact O-CB 3.4Å; A1155-A1159 PolarHBondContact O-N 3.16Å; A1159-A1163 VanDerWaalsContact O-CB 3.3Å; A1159-A1163 WeakPolarHBondContact O-CB 3.43Å; A1159-A1163 PolarHBondContact O-N 3.02Å
1160	R	84.7	Confident	85.7	Confident	26 Å²	26	30 Å²	30	10%	0.098	15%	0.146	C	C	.	.	H	α-helix	trans	-60.9	-51.9	170.8	176.3	179.8	67.2	-114.1	-1	111.7	L1117 H1118 D1156 R1157 K1158 A1163 C1164 D1239	L1117-R1160 WeakPolarHBondContact O-CG 3.29Å; H1118-R1160 WeakPolarHBondContact O-CD 3.2Å; D1156-R1160 WeakPolarHBondContact O-CB 3.31Å; D1156-R1160 PolarHBondContact O-N 2.85Å; R1157-R1160 PolarHBondContact O-N 3.45Å; K1158-R1160 VanDerWaalsContact C-N 3.29Å; K1158-R1160 PolarHBondContact O-N 3.49Å; R1160-A1163 PolarHBondContact O-N 3.48Å; R1160-C1164 PolarHBondContact O-N 3.31Å; R1160-C1164 PolarHBondContact O-SG 3.49Å; R1160-C1164 VanDerWaalsContact O-SG 3.41Å; R1160-D1239 PolarHBondContact NH2-O 3.11Å
1161	M	89.6	Confident	85.8	Confident	1 Å²	1	33.7 Å²	33.7	1%	0.005	16%	0.164	C	C	.	.	H	α-helix	trans	-65.5	-42	-176.8	-73.5	-56.6	-60.8	0	0	112.1	L1148 R1157 K1158 C1164 F1165 D1239 L1241 F1243	L1148-M1161 HydrophobicContact CD1-CB 4.11Å; L1148-M1161 HydrophobicContact CD1-CE 4.17Å; L1148-M1161 HydrophobicContact CD1-CG 4.11Å; L1148-M1161 HydrophobicContact CD2-CB 3.78Å; R1157-M1161 WeakPolarHBondContact O-CB 3.32Å; R1157-M1161 VanDerWaalsContact O-CG 3.32Å; R1157-M1161 WeakPolarHBondContact O-CG 3.47Å; R1157-M1161 PolarHBondContact O-N 2.86Å; K1158-M1161 PolarHBondContact O-N 3.47Å; K1158-M1161 VanDerWaalsContact O-N 3.09Å; M1161-C1164 WeakPolarHBondContact O-CB 3.36Å; M1161-C1164 PolarHBondContact O-N 2.99Å; M1161-F1165 HydrophobicContact CB-CD2 4.47Å; M1161-F1165 HydrophobicContact CB-CE2 4.12Å; M1161-F1165 HydrophobicContact CE-CE1 4.34Å; M1161-F1165 HydrophobicContact CE-CE2 3.95Å; M1161-F1165 HydrophobicContact CE-CZ 3.68Å; M1161-F1165 WeakPolarHBondContact O-CD2 3.38Å; M1161-F1165 VanDerWaalsContact O-CG 3.32Å; M1161-F1165 WeakPolarHBondContact O-CG 3.35Å; M1161-F1165 PolarHBondContact O-N 2.9Å; M1161-D1239 HydrophobicContact CG-CB 4.49Å; M1161-D1239 WeakPolarHBondContact CG-O 3.31Å; M1161-L1241 HydrophobicContact CE-CD1 3.65Å; M1161-L1241 HydrophobicContact CE-CD2 4.1Å; M1161-L1241 HydrophobicContact CE-CG 3.7Å; M1161-L1241 HydrophobicContact SD-CD1 4.26Å; M1161-L1241 HydrophobicContact SD-CG 4.21Å; M1161-F1243 HydrophobicContact CE-CE2 3.78Å; M1161-F1243 HydrophobicContact CE-CZ 3.69Å; M1161-F1243 HydrophobicContact SD-CE2 4.46Å
1162	E	90.3	Very high	86.2	Confident	54 Å²	54	33.2 Å²	33.2	25%	0.252	16%	0.162	S	C	.	.	H	α-helix	trans	-61.1	-42.9	173.3	-72.5	169.6	157.5	0	0	111.8	K1158 C1164 F1165 D1166 M1482	K1158-E1162 WeakPolarHBondContact CE-OE1 3.47Å; K1158-E1162 IonicContact NZ-OE1 2.8Å; K1158-E1162 WeakPolarHBondContact O-CB 3.46Å; K1158-E1162 WeakPolarHBondContact O-CG 3.14Å; K1158-E1162 PolarHBondContact O-N 3.04Å; E1162-C1164 VanDerWaalsContact C-N 3.33Å; E1162-C1164 PolarHBondContact O-N 2.92Å; E1162-F1165 PolarHBondContact O-N 3.45Å; E1162-D1166 VanDerWaalsContact O-CB 3.3Å; E1162-D1166 WeakPolarHBondContact O-CB 3.26Å; E1162-D1166 PolarHBondContact O-N 3.44Å; E1162-M1482 WeakPolarHBondContact OE1-CE 3.34Å; E1162-M1482 WeakPolarHBondContact OE2-CE 3.46Å
1163	A	88	Confident	86.8	Confident	21 Å²	21	29.4 Å²	29.4	17%	0.174	15%	0.146	C	C	.	.	H	α-helix	trans	-62.8	-38.4	174	0	0	0	0	0	112.4	L1117 P1121 A1159 R1160 D1166 A1167	L1117-A1163 HydrophobicContact CD1-CB 4.07Å; L1117-A1163 WeakPolarHBondContact CD1-O 3.3Å; L1117-A1163 HydrophobicContact CD2-CB 3.71Å; L1117-A1163 HydrophobicContact CG-CB 4.46Å; P1121-A1163 HydrophobicContact CG-CB 4.01Å; A1159-A1163 VanDerWaalsContact O-CB 3.3Å; A1159-A1163 WeakPolarHBondContact O-CB 3.43Å; A1159-A1163 PolarHBondContact O-N 3.02Å; R1160-A1163 PolarHBondContact O-N 3.48Å; A1163-D1166 WeakPolarHBondContact O-CB 3.13Å; A1163-D1166 PolarHBondContact O-N 3.26Å; A1163-A1167 WeakPolarHBondContact O-CB 3.28Å; A1163-A1167 PolarHBondContact O-N 2.92Å
1164	C	89.8	Confident	87.6	Confident	0 Å²	0	27.6 Å²	27.6	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-65.5	-42.6	173.1	-70.3	0	0	0	0	112.1	R1160 M1161 E1162 A1167 L1168 F1243	R1160-C1164 PolarHBondContact O-N 3.31Å; R1160-C1164 PolarHBondContact O-SG 3.49Å; R1160-C1164 VanDerWaalsContact O-SG 3.41Å; M1161-C1164 WeakPolarHBondContact O-CB 3.36Å; M1161-C1164 PolarHBondContact O-N 2.99Å; E1162-C1164 VanDerWaalsContact C-N 3.33Å; E1162-C1164 PolarHBondContact O-N 2.92Å; C1164-A1167 PolarHBondContact O-N 3.5Å; C1164-L1168 WeakPolarHBondContact O-CB 3.15Å; C1164-L1168 VanDerWaalsContact O-CG 3.28Å; C1164-L1168 WeakPolarHBondContact O-CG 3.48Å; C1164-L1168 PolarHBondContact O-N 3.31Å; C1164-F1243 HydrophobicContact CB-CD2 4.07Å; C1164-F1243 HydrophobicContact CB-CE2 3.64Å
1165	F	92.7	Very high	88.3	Confident	5 Å²	5	26.3 Å²	26.3	2%	0.022	14%	0.139	C	C	.	.	H	α-helix	trans	-65.6	-38	175.2	-66.4	-49.7	0	0	0	112	L1148 M1161 E1162 L1168 D1169 L1170 V1172 F1237 F1243	L1148-F1165 HydrophobicContact CB-CE2 4.14Å; L1148-F1165 HydrophobicContact CD1-CE2 4.1Å; L1148-F1165 HydrophobicContact CD1-CZ 4.39Å; L1148-F1165 HydrophobicContact CD2-CE2 4.15Å; L1148-F1165 HydrophobicContact CG-CE2 4.34Å; M1161-F1165 HydrophobicContact CB-CD2 4.47Å; M1161-F1165 HydrophobicContact CB-CE2 4.12Å; M1161-F1165 HydrophobicContact CE-CE1 4.34Å; M1161-F1165 HydrophobicContact CE-CE2 3.95Å; M1161-F1165 HydrophobicContact CE-CZ 3.68Å; M1161-F1165 WeakPolarHBondContact O-CD2 3.38Å; M1161-F1165 VanDerWaalsContact O-CG 3.32Å; M1161-F1165 WeakPolarHBondContact O-CG 3.35Å; M1161-F1165 PolarHBondContact O-N 2.9Å; E1162-F1165 PolarHBondContact O-N 3.45Å; F1165-L1168 CarbonylContact O-C 3.48Å; F1165-L1168 PolarHBondContact O-N 2.86Å; F1165-D1169 PolarHBondContact O-N 3.35Å; F1165-L1170 HydrophobicContact CB-CB 4.18Å; F1165-L1170 HydrophobicContact CD1-CB 4.13Å; F1165-L1170 HydrophobicContact CD1-CD1 3.9Å; F1165-L1170 HydrophobicContact CE1-CD1 4.46Å; F1165-L1170 PolarHBondContact O-N 3.48Å; F1165-V1172 HydrophobicContact CB-CG2 4.14Å; F1165-V1172 HydrophobicContact CD1-CG2 3.58Å; F1165-V1172 HydrophobicContact CD2-CB 3.99Å; F1165-V1172 HydrophobicContact CD2-CG1 4.25Å; F1165-V1172 HydrophobicContact CD2-CG2 3.77Å; F1165-V1172 HydrophobicContact CE1-CG2 3.78Å; F1165-V1172 HydrophobicContact CE2-CB 4.11Å; F1165-V1172 HydrophobicContact CE2-CG1 3.85Å; F1165-V1172 HydrophobicContact CE2-CG2 3.99Å; F1165-V1172 HydrophobicContact CG-CB 4.28Å; F1165-V1172 HydrophobicContact CG-CG2 3.57Å; F1165-V1172 HydrophobicContact CZ-CB 4.47Å; F1165-V1172 HydrophobicContact CZ-CG1 4.06Å; F1165-V1172 HydrophobicContact CZ-CG2 4Å; F1165-F1237 AromaticContact CE1-CD2 3.98Å; F1165-F1237 HydrophobicContact CE1-CD2 3.98Å; F1165-F1237 AromaticContact CE1-CE2 3.98Å; F1165-F1237 HydrophobicContact CE1-CE2 3.98Å; F1165-F1237 HydrophobicContact CE1-CG 4.36Å; F1165-F1237 HydrophobicContact CE1-CZ 4.36Å; F1165-F1237 HydrophobicContact CZ-CB 4.25Å; F1165-F1237 AromaticContact CZ-CD2 3.79Å; F1165-F1237 HydrophobicContact CZ-CD2 3.79Å; F1165-F1237 HydrophobicContact CZ-CE2 4.27Å; F1165-F1237 HydrophobicContact CZ-CG 4.02Å; F1165-F1243 AromaticContact CD1-CZ 3.94Å; F1165-F1243 HydrophobicContact CD1-CZ 3.94Å; F1165-F1243 HydrophobicContact CE1-CE1 4.07Å; F1165-F1243 HydrophobicContact CE1-CE2 4.5Å; F1165-F1243 AromaticContact CE1-CZ 3.47Å; F1165-F1243 HydrophobicContact CE1-CZ 3.47Å; F1165-F1243 VanDerWaalsContact CE1-CZ 3.47Å; F1165-F1243 HydrophobicContact CZ-CZ 4.11Å
1166	D	88.6	Confident	88.9	Confident	22 Å²	22	30.9 Å²	30.9	12%	0.118	16%	0.155	C	C	.	.	H	α-helix	trans	-59.1	-46.4	171.6	-94.1	29.6	0	0	0	112.2	R1135 K1138 E1162 A1163 L1168 D1169	R1135-D1166 IonicContact CZ-OD2 2.83Å; R1135-D1166 IonicContact NH1-OD2 3.59Å; R1135-D1166 PolarHBondContact NH1-OD2 3.49Å; R1135-D1166 IonicContact NH2-OD2 2.72Å; K1138-D1166 VanDerWaalsContact CE-OD1 3.26Å; K1138-D1166 WeakPolarHBondContact CE-OD1 3.25Å; K1138-D1166 IonicContact NZ-OD1 3.44Å; K1138-D1166 PolarHBondContact NZ-OD1 3.23Å; E1162-D1166 VanDerWaalsContact O-CB 3.3Å; E1162-D1166 WeakPolarHBondContact O-CB 3.26Å; E1162-D1166 PolarHBondContact O-N 3.44Å; A1163-D1166 WeakPolarHBondContact O-CB 3.13Å; A1163-D1166 PolarHBondContact O-N 3.26Å; D1166-L1168 VanDerWaalsContact C-N 3.32Å; D1166-D1169 PolarHBondContact O-N 3.32Å
1167	A	87.7	Confident	89.8	Confident	11 Å²	11	30.3 Å²	30.3	9%	0.091	15%	0.153	C	C	.	.	H	α-helix	trans	-69.6	-30.2	176.7	0	0	0	0	0	112.4	R1110 I1113 V1114 L1117 A1163 C1164 D1169	R1110-A1167 WeakPolarHBondContact CD-O 3.24Å; R1110-A1167 WeakPolarHBondContact CG-O 3.41Å; I1113-A1167 HydrophobicContact CG2-CB 3.79Å; V1114-A1167 HydrophobicContact CG2-CB 3.71Å; L1117-A1167 HydrophobicContact CD1-CB 3.88Å; A1163-A1167 WeakPolarHBondContact O-CB 3.28Å; A1163-A1167 PolarHBondContact O-N 2.92Å; C1164-A1167 PolarHBondContact O-N 3.5Å; A1167-D1169 VanDerWaalsContact C-N 3.31Å
1168	L	90.2	Very high	90.3	Very high	2 Å²	2	30 Å²	30	1%	0.01	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.2	3.8	173.6	-70.7	170.7	0	0	0	113.5	V1114 C1164 F1165 D1166 L1170 F1243 F1247 R1248	V1114-L1168 HydrophobicContact CG2-CD2 3.92Å; V1114-L1168 HydrophobicContact CG2-CG 3.76Å; C1164-L1168 WeakPolarHBondContact O-CB 3.15Å; C1164-L1168 VanDerWaalsContact O-CG 3.28Å; C1164-L1168 WeakPolarHBondContact O-CG 3.48Å; C1164-L1168 PolarHBondContact O-N 3.31Å; F1165-L1168 CarbonylContact O-C 3.48Å; F1165-L1168 PolarHBondContact O-N 2.86Å; D1166-L1168 VanDerWaalsContact C-N 3.32Å; L1168-L1170 VanDerWaalsContact C-N 3.29Å; L1168-L1170 HydrophobicContact CB-CD1 3.71Å; L1168-L1170 HydrophobicContact CB-CG 3.88Å; L1168-L1170 HydrophobicContact CD1-CD1 4Å; L1168-L1170 HydrophobicContact CG-CD1 4.49Å; L1168-L1170 PolarHBondContact O-N 3.25Å; L1168-F1243 HydrophobicContact CD1-CB 4.38Å; L1168-F1243 HydrophobicContact CD1-CD1 3.74Å; L1168-F1243 HydrophobicContact CD1-CD2 3.86Å; L1168-F1243 HydrophobicContact CD1-CE1 3.9Å; L1168-F1243 HydrophobicContact CD1-CE2 4.03Å; L1168-F1243 HydrophobicContact CD1-CG 3.72Å; L1168-F1243 HydrophobicContact CD1-CZ 4.04Å; L1168-F1247 HydrophobicContact CD1-CD1 4.07Å; L1168-F1247 HydrophobicContact CD2-CB 4.31Å; L1168-R1248 HydrophobicContact CD2-CG 4.45Å; L1168-R1248 WeakPolarHBondContact O-CD 3.38Å; L1168-R1248 PolarHBondContact O-NH1 2.78Å
1169	D	90.5	Very high	90.2	Very high	3 Å²	3	30.4 Å²	30.4	2%	0.016	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.6	44.6	-175.4	-44.7	-77.8	0	0	0	112.8	R1110 F1136 K1138 D1139 F1165 D1166 A1167 R1248	R1110-D1169 IonicContact CZ-OD2 2.9Å; R1110-D1169 IonicContact NH1-OD2 3.16Å; R1110-D1169 PolarHBondContact NH1-OD2 3Å; F1136-D1169 HydrophobicContact CB-CB 4.24Å; F1136-D1169 PolarHBondContact N-OD1 3.29Å; K1138-D1169 VanDerWaalsContact CA-O 3.29Å; K1138-D1169 WeakPolarHBondContact CA-O 3.42Å; D1139-D1169 PolarHBondContact N-O 3.06Å; F1165-D1169 PolarHBondContact O-N 3.35Å; D1166-D1169 PolarHBondContact O-N 3.32Å; A1167-D1169 VanDerWaalsContact C-N 3.31Å; D1169-R1248 PolarHBondContact O-NH1 3.14Å
1170	L	93.4	Very high	90	Very high	1 Å²	1	29.3 Å²	29.3	1%	0.005	15%	0.152	C	C	.	.	B	Isolated β-bridge	trans	-109.3	134.5	-178	-67.6	172.7	0	0	0	112.6	K1138 D1139 L1141 L1146 F1165 L1168 V1172 F1247 R1248	K1138-L1170 WeakPolarHBondContact CD-O 3.29Å; D1139-L1170 WeakPolarHBondContact O-CA 3.15Å; L1141-L1170 HydrophobicContact CD1-CD2 3.61Å; L1141-L1170 HydrophobicContact CD2-CD2 3.97Å; L1141-L1170 HydrophobicContact CG-CD2 3.5Å; L1146-L1170 HydrophobicContact CD1-CB 4.37Å; L1146-L1170 HydrophobicContact CD1-CD2 3.97Å; F1165-L1170 HydrophobicContact CB-CB 4.18Å; F1165-L1170 HydrophobicContact CD1-CB 4.13Å; F1165-L1170 HydrophobicContact CD1-CD1 3.9Å; F1165-L1170 HydrophobicContact CE1-CD1 4.46Å; F1165-L1170 PolarHBondContact O-N 3.48Å; L1168-L1170 VanDerWaalsContact C-N 3.29Å; L1168-L1170 HydrophobicContact CB-CD1 3.71Å; L1168-L1170 HydrophobicContact CB-CG 3.88Å; L1168-L1170 HydrophobicContact CD1-CD1 4Å; L1168-L1170 HydrophobicContact CG-CD1 4.49Å; L1168-L1170 PolarHBondContact O-N 3.25Å; L1170-V1172 HydrophobicContact CB-CG2 4.09Å; L1170-F1247 HydrophobicContact CD1-CD1 4.23Å; L1170-F1247 HydrophobicContact CD1-CE1 3.99Å; L1170-R1248 VanDerWaalsContact CD2-NH1 3.29Å
1171	E	94	Very high	89.4	Confident	79 Å²	79	30.8 Å²	30.8	37%	0.369	17%	0.17	S	C	.	.			trans	-94.4	111.8	171.4	-169.3	-167.8	178.8	0	0	109.8	K1138 D1139 R1140	K1138-E1171 HydrophobicContact CB-CB 4.16Å; D1139-E1171 PolarHBondContact O-N 3.29Å; R1140-E1171 HydrophobicContact CG-CB 4.08Å; R1140-E1171 IonicContact CZ-OE1 2.69Å; R1140-E1171 IonicContact CZ-OE2 3.03Å; R1140-E1171 VanDerWaalsContact NE-CD 3.34Å; R1140-E1171 IonicContact NE-OE1 3.48Å; R1140-E1171 IonicContact NE-OE2 3.49Å; R1140-E1171 PolarHBondContact NE-OE2 2.83Å; R1140-E1171 IonicContact NH2-OE1 2.8Å; R1140-E1171 PolarHBondContact NH2-OE1 2.85Å; R1140-E1171 IonicContact NH2-OE2 3.35Å; R1140-E1171 PolarHBondContact NH2-OE2 3.04Å
1172	V	94.6	Very high	88.8	Confident	35 Å²	35	34 Å²	34	21%	0.212	19%	0.192	C	C	.	.			trans	-127.6	128.5	-173.3	-172.8	0	0	0	0	110.9	L1146 L1148 F1165 L1170	L1146-V1172 HydrophobicContact CB-CB 4.29Å; L1146-V1172 HydrophobicContact CB-CG1 4.15Å; L1146-V1172 HydrophobicContact CB-CG2 3.9Å; L1146-V1172 HydrophobicContact CD1-CG2 4.09Å; L1146-V1172 CarbonylContact O-C 3.58Å; L1146-V1172 WeakPolarHBondContact O-CG1 3.47Å; L1148-V1172 HydrophobicContact CB-CG1 3.91Å; F1165-V1172 HydrophobicContact CB-CG2 4.14Å; F1165-V1172 HydrophobicContact CD1-CG2 3.58Å; F1165-V1172 HydrophobicContact CD2-CB 3.99Å; F1165-V1172 HydrophobicContact CD2-CG1 4.25Å; F1165-V1172 HydrophobicContact CD2-CG2 3.77Å; F1165-V1172 HydrophobicContact CE1-CG2 3.78Å; F1165-V1172 HydrophobicContact CE2-CB 4.11Å; F1165-V1172 HydrophobicContact CE2-CG1 3.85Å; F1165-V1172 HydrophobicContact CE2-CG2 3.99Å; F1165-V1172 HydrophobicContact CG-CB 4.28Å; F1165-V1172 HydrophobicContact CG-CG2 3.57Å; F1165-V1172 HydrophobicContact CZ-CB 4.47Å; F1165-V1172 HydrophobicContact CZ-CG1 4.06Å; F1165-V1172 HydrophobicContact CZ-CG2 4Å; L1170-V1172 HydrophobicContact CB-CG2 4.09Å
1173	D	94.1	Very high	88.3	Confident	41 Å²	41	32.5 Å²	32.5	22%	0.219	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	117	174.2	-73.8	-52.9	0	0	0	110.2	R1145 L1146 F1147 L1148 V1175	R1145-D1173 WeakPolarHBondContact CD-OD2 3.32Å; R1145-D1173 WeakPolarHBondContact CG-OD2 3.25Å; R1145-D1173 IonicContact CZ-OD2 3.06Å; R1145-D1173 IonicContact NE-OD2 3.37Å; R1145-D1173 IonicContact NH1-OD1 2.79Å; R1145-D1173 PolarHBondContact NH1-OD1 2.93Å; R1145-D1173 IonicContact NH1-OD2 3.85Å; R1145-D1173 PolarHBondContact NH1-OD2 2.78Å; L1146-D1173 PolarHBondContact O-N 3.12Å; F1147-D1173 WeakPolarHBondContact CA-O 3.26Å; F1147-D1173 HydrophobicContact CD1-CB 3.75Å; F1147-D1173 HydrophobicContact CE1-CB 4.05Å; L1148-D1173 PolarHBondContact N-O 2.82Å; D1173-V1175 PolarHBondContact O-N 2.91Å
1174	H	92.1	Very high	87.9	Confident	64 Å²	64	35 Å²	35	30%	0.296	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	129.6	172.7	172.3	-102.8	0	0	0	111.5	K1158	K1158-H1174 VanDerWaalsContact CE-CD2 3.46Å; K1158-H1174 WeakPolarHBondContact CE-CD2 3.39Å
1175	V	92.5	Very high	87.1	Confident	22 Å²	22	40.1 Å²	40.1	13%	0.133	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	112.1	174.6	-177.8	0	0	0	0	108.6	F1147 L1148 N1150 D1173 A1177 I1222	F1147-V1175 HydrophobicContact CB-CG2 4.01Å; F1147-V1175 HydrophobicContact CD1-CG2 3.59Å; F1147-V1175 HydrophobicContact CE1-CG2 4.38Å; F1147-V1175 HydrophobicContact CG-CG2 4.1Å; L1148-V1175 WeakPolarHBondContact O-CA 3.36Å; L1148-V1175 PolarHBondContact O-N 3.08Å; N1150-V1175 PolarHBondContact N-O 3.39Å; D1173-V1175 PolarHBondContact O-N 2.91Å; V1175-A1177 PolarHBondContact O-N 2.82Å; V1175-I1222 HydrophobicContact CB-CD1 4.16Å; V1175-I1222 HydrophobicContact CB-CG1 4.44Å; V1175-I1222 HydrophobicContact CG1-CD1 4.07Å; V1175-I1222 HydrophobicContact CG1-CG1 3.92Å; V1175-I1222 HydrophobicContact CG2-CD1 3.91Å; V1175-I1222 HydrophobicContact CG2-CG1 4.08Å
1176	K	92	Very high	86.5	Confident	120 Å²	120	45 Å²	45	52%	0.522	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.7	109.8	172.4	177.9	173.4	-178.5	158	0	109.3	E1152	E1152-K1176 VanDerWaalsContact CD-CE 3.44Å; E1152-K1176 WeakPolarHBondContact OE1-CD 3.38Å; E1152-K1176 VanDerWaalsContact OE1-CE 3.23Å; E1152-K1176 WeakPolarHBondContact OE1-CE 3.31Å; E1152-K1176 IonicContact OE1-NZ 3.35Å; E1152-K1176 PolarHBondContact OE1-NZ 3.33Å; E1152-K1176 VanDerWaalsContact OE2-CE 3.26Å; E1152-K1176 WeakPolarHBondContact OE2-CE 3.39Å; E1152-K1176 IonicContact OE2-NZ 2.67Å; E1152-K1176 PolarHBondContact OE2-NZ 2.95Å
1177	A	89.7	Confident	86	Confident	9 Å²	9	48.1 Å²	48.1	7%	0.074	27%	0.267	C	S	.	.			trans	-65.4	145.5	176.7	0	0	0	0	0	110.7	I1149 N1150 L1151 V1175 D1179 S1218	I1149-A1177 HydrophobicContact CG2-CB 3.67Å; N1150-A1177 VanDerWaalsContact O-CB 3.29Å; N1150-A1177 WeakPolarHBondContact O-CB 3.4Å; N1150-A1177 PolarHBondContact O-N 3.21Å; L1151-A1177 HydrophobicContact CD2-CB 3.86Å; L1151-A1177 HydrophobicContact CG-CB 4.02Å; V1175-A1177 PolarHBondContact O-N 2.82Å; A1177-D1179 PolarHBondContact O-N 2.7Å; A1177-S1218 WeakPolarHBondContact CA-OG 3.2Å
1178	V	90.2	Very high	85.7	Confident	49 Å²	49	49.2 Å²	49.2	30%	0.297	27%	0.271	S	S	.	.			trans	-70.8	113.4	173.3	179.8	0	0	0	0	108.2	G1180 L1183 G1214 L1217 S1218	V1178-G1180 PolarHBondContact O-N 2.91Å; V1178-L1183 HydrophobicContact CG1-CD1 4.09Å; V1178-L1183 HydrophobicContact CG1-CD2 3.86Å; V1178-L1183 HydrophobicContact CG1-CG 4.23Å; V1178-G1214 CarbonylContact O-C 3.5Å; V1178-G1214 WeakPolarHBondContact O-CA 3.47Å; V1178-L1217 HydrophobicContact CB-CB 4.06Å; V1178-L1217 HydrophobicContact CG1-CB 4.18Å; V1178-L1217 HydrophobicContact CG1-CD1 4.11Å; V1178-L1217 HydrophobicContact CG2-CB 3.93Å; V1178-S1218 PolarHBondContact N-OG 3.01Å
1179	D	84	Confident	85.2	Confident	48 Å²	48	56.9 Å²	56.9	26%	0.257	30%	0.3	S	S	.	.			trans	-71.5	103.3	177.1	-174.7	-1.7	0	0	0	110.5	L1151 R1153 A1177 A1181 S1182	L1151-D1179 HydrophobicContact CD2-CB 4.06Å; R1153-D1179 IonicContact CZ-OD1 2.67Å; R1153-D1179 IonicContact CZ-OD2 3.62Å; R1153-D1179 IonicContact NH1-OD1 3.83Å; R1153-D1179 PolarHBondContact NH1-OD1 3.01Å; R1153-D1179 IonicContact NH1-OD2 2.78Å; R1153-D1179 PolarHBondContact NH1-OD2 3.35Å; R1153-D1179 IonicContact NH2-OD1 3.54Å; A1177-D1179 PolarHBondContact O-N 2.7Å; D1179-A1181 PolarHBondContact O-N 3.15Å; D1179-A1181 PolarHBondContact OD1-N 3.23Å; D1179-S1182 WeakPolarHBondContact O-CB 3.49Å; D1179-S1182 PolarHBondContact O-N 3.39Å; D1179-S1182 PolarHBondContact O-OG 3.31Å
1180	G	80.7	Confident	84.7	Confident	2 Å²	2	61.2 Å²	61.2	2%	0.021	33%	0.33	C	S	.	.	G	3₁₀ helix	trans	-48.2	-43.5	175.4	0	0	0	0	0	113.9	V1178 S1182 L1183 T1210	V1178-G1180 PolarHBondContact O-N 2.91Å; G1180-S1182 PolarHBondContact O-N 3.03Å; G1180-S1182 VanDerWaalsContact O-N 3.17Å; G1180-L1183 WeakPolarHBondContact O-CB 3.36Å; G1180-L1183 PolarHBondContact O-N 3.26Å; G1180-L1183 VanDerWaalsContact O-N 3.11Å; G1180-T1210 WeakPolarHBondContact CA-O 3.33Å; G1180-T1210 WeakPolarHBondContact O-CB 3.5Å
1181	A	72	Confident	84.2	Confident	57 Å²	57	64.9 Å²	64.9	47%	0.471	35%	0.35	S	S	.	.	G	3₁₀ helix	trans	-69.3	-12.4	-178.7	0	0	0	0	0	113.5	D1179	D1179-A1181 PolarHBondContact O-N 3.15Å; D1179-A1181 PolarHBondContact OD1-N 3.23Å
1182	S	78.2	Confident	83.7	Confident	68 Å²	68	62.8 Å²	62.8	48%	0.476	35%	0.349	S	S	.	.	G	3₁₀ helix	trans	-94.1	-9.4	175	77.3	0	0	0	0	114	D1179 G1180 T1184 Q1187	D1179-S1182 WeakPolarHBondContact O-CB 3.49Å; D1179-S1182 PolarHBondContact O-N 3.39Å; D1179-S1182 PolarHBondContact O-OG 3.31Å; G1180-S1182 PolarHBondContact O-N 3.03Å; G1180-S1182 VanDerWaalsContact O-N 3.17Å; S1182-T1184 PolarHBondContact O-N 3.1Å; S1182-Q1187 PolarHBondContact O-OE1 3.19Å
1183	L	79.1	Confident	83.3	Confident	23 Å²	23	62.2 Å²	62.2	12%	0.12	35%	0.345	C	S	.	.			trans	-76	121.5	-177.1	-65.4	173.5	0	0	0	111	V1178 G1180 L1188 V1213 L1217	V1178-L1183 HydrophobicContact CG1-CD1 4.09Å; V1178-L1183 HydrophobicContact CG1-CD2 3.86Å; V1178-L1183 HydrophobicContact CG1-CG 4.23Å; G1180-L1183 WeakPolarHBondContact O-CB 3.36Å; G1180-L1183 PolarHBondContact O-N 3.26Å; G1180-L1183 VanDerWaalsContact O-N 3.11Å; L1183-L1188 HydrophobicContact CB-CD2 4.2Å; L1183-L1188 HydrophobicContact CB-CG 4.37Å; L1183-L1188 HydrophobicContact CD1-CD2 3.96Å; L1183-V1213 HydrophobicContact CD1-CB 4.47Å; L1183-V1213 HydrophobicContact CD1-CG1 3.87Å; L1183-L1217 HydrophobicContact CD1-CD1 3.81Å
1184	T	78.8	Confident	82.8	Confident	74 Å²	74	66.6 Å²	66.6	45%	0.454	37%	0.365	S	S	.	.			trans	-87	154.1	171.7	58.9	0	0	0	0	111.6	S1182 D1186 Q1187 L1188	S1182-T1184 PolarHBondContact O-N 3.1Å; T1184-D1186 PolarHBondContact O-N 3.4Å; T1184-D1186 VanDerWaalsContact O-N 3.15Å; T1184-Q1187 WeakPolarHBondContact O-CA 3.28Å; T1184-Q1187 WeakPolarHBondContact O-CB 3.39Å; T1184-Q1187 PolarHBondContact O-N 2.9Å; T1184-Q1187 VanDerWaalsContact OG1-CD 3.29Å; T1184-Q1187 WeakPolarHBondContact OG1-CG 3.48Å; T1184-Q1187 PolarHBondContact OG1-N 3.04Å; T1184-Q1187 PolarHBondContact OG1-OE1 3.43Å; T1184-L1188 PolarHBondContact O-N 2.83Å
1185	D	75	Confident	82.4	Confident	107 Å²	107	66.6 Å²	66.6	57%	0.572	37%	0.365	S	S	*	.	H	α-helix	trans	-54.8	-34.2	175.9	-64.9	-17.4	0	0	0	112.8	L1188 R1189	D1185-L1188 PolarHBondContact O-N 3.24Å; D1185-R1189 WeakPolarHBondContact O-CB 3.34Å; D1185-R1189 VanDerWaalsContact O-CG 3.28Å; D1185-R1189 WeakPolarHBondContact O-CG 3.37Å; D1185-R1189 PolarHBondContact O-N 1.78Å
1186	D	78.4	Confident	82.1	Confident	109 Å²	109	65.9 Å²	65.9	58%	0.583	36%	0.36	S	S	*	.	H	α-helix	trans	-70.2	-36.4	176.4	-73.1	-32.3	0	0	0	112.5	T1184 R1189 S1190	T1184-D1186 PolarHBondContact O-N 3.4Å; T1184-D1186 VanDerWaalsContact O-N 3.15Å; D1186-R1189 IonicContact OD1-CZ 2.93Å; D1186-R1189 IonicContact OD1-NE 3.06Å; D1186-R1189 PolarHBondContact OD1-NE 3.39Å; D1186-R1189 IonicContact OD1-NH2 2.69Å; D1186-R1189 PolarHBondContact OD1-NH2 2.76Å; D1186-S1190 VanDerWaalsContact O-CB 3.28Å; D1186-S1190 WeakPolarHBondContact O-CB 3.17Å; D1186-S1190 PolarHBondContact O-N 3.47Å; D1186-S1190 PolarHBondContact O-OG 3.03Å
1187	Q	78.9	Confident	81.6	Confident	86 Å²	86	64.5 Å²	64.5	40%	0.402	37%	0.366	S	S	.	.	H	α-helix	trans	-65.9	-45.7	171.7	-74.9	163	-44.7	0	0	111.1	S1182 T1184 R1189 S1190 L1191	S1182-Q1187 PolarHBondContact O-OE1 3.19Å; T1184-Q1187 WeakPolarHBondContact O-CA 3.28Å; T1184-Q1187 WeakPolarHBondContact O-CB 3.39Å; T1184-Q1187 PolarHBondContact O-N 2.9Å; T1184-Q1187 VanDerWaalsContact OG1-CD 3.29Å; T1184-Q1187 WeakPolarHBondContact OG1-CG 3.48Å; T1184-Q1187 PolarHBondContact OG1-N 3.04Å; T1184-Q1187 PolarHBondContact OG1-OE1 3.43Å; Q1187-R1189 PolarHBondContact O-N 3.1Å; Q1187-S1190 WeakPolarHBondContact CA-OG 3.03Å; Q1187-S1190 PolarHBondContact O-N 2.86Å; Q1187-S1190 VanDerWaalsContact O-N 3.13Å; Q1187-S1190 PolarHBondContact O-OG 3.28Å; Q1187-L1191 WeakPolarHBondContact O-CG 3.46Å; Q1187-L1191 PolarHBondContact O-N 2.88Å
1188	L	80.6	Confident	81.2	Confident	34 Å²	34	68.4 Å²	68.4	18%	0.178	38%	0.383	C	S	.	.	H	α-helix	trans	-58.3	-46.9	175.7	-65.5	176	0	0	0	111.5	L1183 T1184 D1185 S1190 L1191 G1192 V1193 V1213	L1183-L1188 HydrophobicContact CB-CD2 4.2Å; L1183-L1188 HydrophobicContact CB-CG 4.37Å; L1183-L1188 HydrophobicContact CD1-CD2 3.96Å; T1184-L1188 PolarHBondContact O-N 2.83Å; D1185-L1188 PolarHBondContact O-N 3.24Å; L1188-S1190 PolarHBondContact O-N 3.05Å; L1188-L1191 PolarHBondContact O-N 3.48Å; L1188-G1192 PolarHBondContact O-N 3.33Å; L1188-V1193 HydrophobicContact CB-CB 4.39Å; L1188-V1193 HydrophobicContact CD2-CB 4.24Å; L1188-V1193 HydrophobicContact CD2-CG1 4.11Å; L1188-V1193 HydrophobicContact CD2-CG2 4.5Å; L1188-V1193 PolarHBondContact O-N 3.13Å; L1188-V1213 HydrophobicContact CD2-CG1 3.78Å
1189	R	80.2	Confident	80.9	Confident	163 Å²	163	66.2 Å²	66.2	62%	0.615	37%	0.369	S	S	*	.	H	α-helix	trans	-58.6	-43.7	172.7	-77.3	-173.4	-78.3	-102.4	6.2	112.2	D1185 D1186 Q1187 L1191 G1192	D1185-R1189 WeakPolarHBondContact O-CB 3.34Å; D1185-R1189 VanDerWaalsContact O-CG 3.28Å; D1185-R1189 WeakPolarHBondContact O-CG 3.37Å; D1185-R1189 PolarHBondContact O-N 1.78Å; D1186-R1189 IonicContact OD1-CZ 2.93Å; D1186-R1189 IonicContact OD1-NE 3.06Å; D1186-R1189 PolarHBondContact OD1-NE 3.39Å; D1186-R1189 IonicContact OD1-NH2 2.69Å; D1186-R1189 PolarHBondContact OD1-NH2 2.76Å; Q1187-R1189 PolarHBondContact O-N 3.1Å; R1189-L1191 VanDerWaalsContact C-N 3.33Å; R1189-L1191 PolarHBondContact O-N 2.89Å; R1189-G1192 PolarHBondContact O-N 2.6Å; R1189-G1192 VanDerWaalsContact O-N 3.11Å
1190	S	80.6	Confident	80.5	Confident	94 Å²	94	69.3 Å²	69.3	66%	0.657	38%	0.377	S	S	*	.	H	α-helix	trans	-67.7	-30.5	-179	76.6	0	0	0	0	113.7	D1186 Q1187 L1188 G1192	D1186-S1190 VanDerWaalsContact O-CB 3.28Å; D1186-S1190 WeakPolarHBondContact O-CB 3.17Å; D1186-S1190 PolarHBondContact O-N 3.47Å; D1186-S1190 PolarHBondContact O-OG 3.03Å; Q1187-S1190 WeakPolarHBondContact CA-OG 3.03Å; Q1187-S1190 PolarHBondContact O-N 2.86Å; Q1187-S1190 VanDerWaalsContact O-N 3.13Å; Q1187-S1190 PolarHBondContact O-OG 3.28Å; L1188-S1190 PolarHBondContact O-N 3.05Å; S1190-G1192 VanDerWaalsContact C-N 3.25Å
1191	L	82.3	Confident	79.8	Confident	79 Å²	79	69.9 Å²	69.9	41%	0.414	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81	-3.9	174.4	-68.5	171.3	0	0	0	112.8	Q1187 L1188 R1189 V1193 L1217	Q1187-L1191 WeakPolarHBondContact O-CG 3.46Å; Q1187-L1191 PolarHBondContact O-N 2.88Å; L1188-L1191 PolarHBondContact O-N 3.48Å; R1189-L1191 VanDerWaalsContact C-N 3.33Å; R1189-L1191 PolarHBondContact O-N 2.89Å; L1191-V1193 HydrophobicContact CB-CG2 3.85Å; L1191-V1193 PolarHBondContact O-N 3.35Å; L1191-L1217 HydrophobicContact CD1-CD1 4Å; L1191-L1217 HydrophobicContact CD1-CD2 4.44Å
1192	G	83.6	Confident	79.2	Confident	35 Å²	35	69 Å²	69	36%	0.361	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.8	22.2	-174.3	0	0	0	0	0	113.6	L1188 R1189 S1190 Q1194 L1318	L1188-G1192 PolarHBondContact O-N 3.33Å; R1189-G1192 PolarHBondContact O-N 2.6Å; R1189-G1192 VanDerWaalsContact O-N 3.11Å; S1190-G1192 VanDerWaalsContact C-N 3.25Å; G1192-Q1194 PolarHBondContact O-N 3.36Å; G1192-L1318 CarbonylContact O-C 3.6Å
1193	V	85.5	Confident	77.9	Confident	22 Å²	22	70.7 Å²	70.7	13%	0.133	37%	0.366	C	S	.	.			trans	-72.1	116.6	-177.9	171	0	0	0	0	110.1	L1188 L1191 V1213 L1217 L1318 L1321	L1188-V1193 HydrophobicContact CB-CB 4.39Å; L1188-V1193 HydrophobicContact CD2-CB 4.24Å; L1188-V1193 HydrophobicContact CD2-CG1 4.11Å; L1188-V1193 HydrophobicContact CD2-CG2 4.5Å; L1188-V1193 PolarHBondContact O-N 3.13Å; L1191-V1193 HydrophobicContact CB-CG2 3.85Å; L1191-V1193 PolarHBondContact O-N 3.35Å; V1193-V1213 HydrophobicContact CG1-CG1 4.33Å; V1193-L1217 HydrophobicContact CG2-CD2 4.32Å; V1193-L1318 CarbonylContact C-O 3.55Å; V1193-L1318 VanDerWaalsContact CA-O 3.31Å; V1193-L1318 WeakPolarHBondContact CA-O 3.24Å; V1193-L1318 HydrophobicContact CG2-CD2 4.49Å; V1193-L1321 HydrophobicContact CG1-CD2 3.53Å
1194	Q	84	Confident	76.7	Confident	134 Å²	134	72 Å²	72	63%	0.626	37%	0.371	S	S	*	.			trans	-135.8	118.4	174.3	-63.8	-174.3	2.3	0	0	109.1	G1192 L1318 G1319 R1320 L1321	G1192-Q1194 PolarHBondContact O-N 3.36Å; Q1194-L1318 PolarHBondContact N-O 3.02Å; Q1194-G1319 CarbonylContact O-C 3.48Å; Q1194-G1319 VanDerWaalsContact O-C 3.31Å; Q1194-R1320 CarbonylContact O-C 3.58Å; Q1194-R1320 PolarHBondContact O-N 3.05Å; Q1194-L1321 PolarHBondContact O-N 2.88Å
1195	Q	84.9	Confident	75.9	Confident	63 Å²	63	75.3 Å²	75.3	29%	0.294	38%	0.379	S	S	.	.	B	Isolated β-bridge	trans	-69.9	142.6	173.2	-164.5	-153.9	-82.2	0	0	109.9	Y1199 M1208 L1321	Q1195-Y1199 HydrophobicContact CG-CD1 4.45Å; Q1195-Y1199 PolarHBondContact NE2-O 3.12Å; Q1195-M1208 HydrophobicContact CG-CB 4.37Å; Q1195-L1321 WeakPolarHBondContact CA-O 3.45Å; Q1195-L1321 WeakPolarHBondContact CG-O 3.47Å
1196	I	86.3	Confident	75.6	Confident	7 Å²	7	71.4 Å²	71.4	4%	0.036	36%	0.357	C	S	.	.			trans	-64.1	140.7	170.3	67.7	177.3	0	0	0	110.5	E1198 Y1199 R1320 L1321 V1322 W1340 H1343	I1196-E1198 PolarHBondContact O-N 2.96Å; I1196-Y1199 PolarHBondContact O-N 3.23Å; I1196-R1320 HydrophobicContact CG2-CB 3.86Å; I1196-R1320 HydrophobicContact CG2-CG 4.32Å; I1196-L1321 PolarHBondContact N-O 3.22Å; I1196-V1322 HydrophobicContact CD1-CG1 3.47Å; I1196-V1322 VanDerWaalsContact CD1-CG1 3.47Å; I1196-V1322 HydrophobicContact CG1-CG1 3.67Å; I1196-W1340 HydrophobicContact CD1-CB 3.87Å; I1196-W1340 HydrophobicContact CD1-CG 3.81Å; I1196-H1343 HydrophobicContact CG2-CB 4.32Å; I1196-H1343 VanDerWaalsContact CG2-CD2 3.49Å; I1196-H1343 WeakPolarHBondContact CG2-CD2 3.48Å
1197	S	80.2	Confident	75.3	Confident	91 Å²	91	68.3 Å²	68.3	64%	0.636	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.2	-27	-170.8	73.3	0	0	0	0	113.1	R1200	S1197-R1200 PolarHBondContact O-NH1 2.93Å
1198	E	81.9	Confident	75.3	Confident	92 Å²	92	64.7 Å²	64.7	43%	0.43	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.1	-9.3	-176.8	-57	94.4	133.7	0	0	113.3	I1196 R1200 W1340 H1343	I1196-E1198 PolarHBondContact O-N 2.96Å; E1198-R1200 PolarHBondContact O-N 3.19Å; E1198-W1340 PolarHBondContact O-NE1 2.97Å; E1198-H1343 IonicContact OE1-CE1 3.43Å; E1198-H1343 PolarHBondContact OE1-CE1 3.28Å; E1198-H1343 IonicContact OE1-NE2 3.45Å; E1198-H1343 IonicContact OE2-CE1 3.63Å; E1198-H1343 IonicContact OE2-NE2 2.82Å
1199	Y	82.8	Confident	75.2	Confident	2 Å²	2	63.4 Å²	63.4	1%	0.008	32%	0.319	C	S	.	.			trans	-74.1	125.9	176.7	178.9	-95.6	0	0	0	110.4	Q1195 I1196 D1201 M1208 V1322 P1323 E1326 W1340	Q1195-Y1199 HydrophobicContact CG-CD1 4.45Å; Q1195-Y1199 PolarHBondContact NE2-O 3.12Å; I1196-Y1199 PolarHBondContact O-N 3.23Å; Y1199-D1201 WeakPolarHBondContact OH-CA 3.4Å; Y1199-M1208 HydrophobicContact CD1-CB 4.32Å; Y1199-M1208 HydrophobicContact CE1-CB 4.11Å; Y1199-V1322 HydrophobicContact CD2-CB 4.24Å; Y1199-V1322 HydrophobicContact CD2-CG1 3.92Å; Y1199-V1322 HydrophobicContact CG-CG1 4.1Å; Y1199-P1323 HydrophobicContact CE1-CG 4.1Å; Y1199-P1323 HydrophobicContact CE2-CG 4.28Å; Y1199-P1323 VanDerWaalsContact CZ-CD 3.43Å; Y1199-P1323 WeakPolarHBondContact OH-CG 3.42Å; Y1199-E1326 HydrophobicContact CE2-CG 4.17Å; Y1199-W1340 AromaticContact CD2-CD2 3.98Å; Y1199-W1340 HydrophobicContact CD2-CD2 3.98Å; Y1199-W1340 AromaticContact CD2-CE2 3.79Å; Y1199-W1340 AromaticContact CD2-CE3 3.92Å; Y1199-W1340 HydrophobicContact CD2-CE3 3.92Å; Y1199-W1340 AromaticContact CD2-CH2 3.57Å; Y1199-W1340 HydrophobicContact CD2-CH2 3.57Å; Y1199-W1340 AromaticContact CD2-CZ2 3.61Å; Y1199-W1340 HydrophobicContact CD2-CZ2 3.61Å; Y1199-W1340 AromaticContact CD2-CZ3 3.74Å; Y1199-W1340 HydrophobicContact CD2-CZ3 3.74Å; Y1199-W1340 HydrophobicContact CE2-CE3 4.21Å; Y1199-W1340 AromaticContact CE2-CH2 3.5Å; Y1199-W1340 HydrophobicContact CE2-CH2 3.5Å; Y1199-W1340 HydrophobicContact CE2-CZ2 4.01Å; Y1199-W1340 AromaticContact CE2-CZ3 3.62Å; Y1199-W1340 HydrophobicContact CE2-CZ3 3.62Å; Y1199-W1340 HydrophobicContact CG-CZ2 4.45Å
1200	R	76.2	Confident	75.2	Confident	114 Å²	114	56.9 Å²	56.9	43%	0.43	30%	0.297	S	S	.	.			trans	-141	131.4	165.1	-65.7	-62	-177.8	-72.5	-2.6	106.8	S1197 E1198 K1205 R1206 W1340	S1197-R1200 PolarHBondContact O-NH1 2.93Å; E1198-R1200 PolarHBondContact O-N 3.19Å; R1200-K1205 WeakPolarHBondContact CD-O 3.43Å; R1200-R1206 CarbonylContact C-O 3.29Å; R1200-R1206 VanDerWaalsContact CA-O 3.28Å; R1200-R1206 WeakPolarHBondContact CA-O 3.47Å; R1200-W1340 WeakPolarHBondContact O-CZ2 3.32Å
1201	D	67.2	Low	75.2	Confident	13 Å²	13	54.2 Å²	54.2	7%	0.07	29%	0.285	C	S	.	.			trans	-49.5	127.8	177.9	172.1	-97.6	0	0	0	110.5	Y1199 Y1203 H1204 K1205 R1206	Y1199-D1201 WeakPolarHBondContact OH-CA 3.4Å; D1201-Y1203 PolarHBondContact O-N 3.13Å; D1201-Y1203 VanDerWaalsContact O-N 3.15Å; D1201-Y1203 PolarHBondContact OD1-N 2.96Å; D1201-H1204 VanDerWaalsContact OD1-CB 3.31Å; D1201-H1204 WeakPolarHBondContact OD1-CB 3.44Å; D1201-H1204 IonicContact OD1-CD2 2.68Å; D1201-H1204 PolarHBondContact OD1-CD2 3.2Å; D1201-H1204 VanDerWaalsContact OD1-CD2 3.29Å; D1201-H1204 IonicContact OD1-CG 2.64Å; D1201-H1204 PolarHBondContact OD1-N 3.1Å; D1201-K1205 WeakPolarHBondContact O-CA 3.42Å; D1201-K1205 PolarHBondContact O-N 3.15Å; D1201-R1206 HydrophobicContact CB-CG 4.19Å; D1201-R1206 PolarHBondContact N-O 3.13Å
1202	P	59	Low	75.3	Confident	40 Å²	40	52.5 Å²	52.5	26%	0.26	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-27.3	-172.7	-33.9	43.4	0	0	0	115.2	K1205 Y1297 W1340	P1202-K1205 WeakPolarHBondContact O-CE 3.27Å; P1202-K1205 PolarHBondContact O-NZ 2.71Å; P1202-Y1297 WeakPolarHBondContact CG-OH 3.49Å; P1202-W1340 HydrophobicContact CG-CH2 3.86Å; P1202-W1340 HydrophobicContact CG-CZ3 4.44Å
1203	Y	50	Low	75.5	Confident	103 Å²	103	51.5 Å²	51.5	40%	0.404	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.1	-43.2	-173.7	-62.2	-79.9	0	0	0	113.4	D1201 L1275 Y1297	D1201-Y1203 PolarHBondContact O-N 3.13Å; D1201-Y1203 VanDerWaalsContact O-N 3.15Å; D1201-Y1203 PolarHBondContact OD1-N 2.96Å; Y1203-L1275 VanDerWaalsContact OH-CD2 3.26Å; Y1203-L1275 WeakPolarHBondContact OH-CD2 2.81Å; Y1203-Y1297 AromaticContact CE2-CE2 3.95Å; Y1203-Y1297 HydrophobicContact CE2-CE2 3.95Å
1204	H	53.9	Low	75.7	Confident	50 Å²	50	50.5 Å²	50.5	23%	0.231	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.5	-14	-175.2	-62.6	-71.8	0	0	0	113.3	D1201 R1206	D1201-H1204 VanDerWaalsContact OD1-CB 3.31Å; D1201-H1204 WeakPolarHBondContact OD1-CB 3.44Å; D1201-H1204 IonicContact OD1-CD2 2.68Å; D1201-H1204 PolarHBondContact OD1-CD2 3.2Å; D1201-H1204 VanDerWaalsContact OD1-CD2 3.29Å; D1201-H1204 IonicContact OD1-CG 2.64Å; D1201-H1204 PolarHBondContact OD1-N 3.1Å; H1204-R1206 HydrophobicContact CB-CG 3.96Å; H1204-R1206 PolarHBondContact O-N 3.43Å; H1204-R1206 VanDerWaalsContact O-N 3.12Å
1205	K	62	Low	76	Confident	144 Å²	144	46 Å²	46	63%	0.626	24%	0.239	S	C	*	.			trans	57.3	18.7	-178.2	-55.9	-55.3	-172.6	-157.9	0	115.3	R1200 D1201 P1202	R1200-K1205 WeakPolarHBondContact CD-O 3.43Å; D1201-K1205 WeakPolarHBondContact O-CA 3.42Å; D1201-K1205 PolarHBondContact O-N 3.15Å; P1202-K1205 WeakPolarHBondContact O-CE 3.27Å; P1202-K1205 PolarHBondContact O-NZ 2.71Å
1206	R	69.7	Low	76.4	Confident	25 Å²	25	43 Å²	43	9%	0.094	23%	0.225	C	C	.	.			trans	-88.1	161.4	175.2	60.8	149.7	167.9	80.6	-0.9	112.5	R1200 D1201 H1204 E1212 Q1587	R1200-R1206 CarbonylContact C-O 3.29Å; R1200-R1206 VanDerWaalsContact CA-O 3.28Å; R1200-R1206 WeakPolarHBondContact CA-O 3.47Å; D1201-R1206 HydrophobicContact CB-CG 4.19Å; D1201-R1206 PolarHBondContact N-O 3.13Å; H1204-R1206 HydrophobicContact CB-CG 3.96Å; H1204-R1206 PolarHBondContact O-N 3.43Å; H1204-R1206 VanDerWaalsContact O-N 3.12Å; R1206-E1212 IonicContact CZ-OE1 3.37Å; R1206-E1212 VanDerWaalsContact CZ-OE1 3.32Å; R1206-E1212 IonicContact CZ-OE2 3.71Å; R1206-E1212 VanDerWaalsContact NH1-CD 3.3Å; R1206-E1212 IonicContact NH1-OE1 2.78Å; R1206-E1212 PolarHBondContact NH1-OE1 3.22Å; R1206-E1212 IonicContact NH1-OE2 3.68Å; R1206-E1212 PolarHBondContact NH1-OE2 3.47Å; R1206-E1212 IonicContact NH2-OE1 3.54Å; R1206-E1212 PolarHBondContact NH2-OE1 2.86Å; R1206-E1212 IonicContact NH2-OE2 2.65Å; R1206-Q1587 VanDerWaalsContact CD-NE2 3.26Å
1207	P	72.4	Confident	76.8	Confident	43 Å²	43	43.3 Å²	43.3	28%	0.279	23%	0.226	S	C	.	.			trans	-60.2	175.6	159.1	28.5	-36.4	0	0	0	112.1
1208	M	78.3	Confident	77.4	Confident	10 Å²	10	39.3 Å²	39.3	5%	0.049	20%	0.198	C	C	.	.			trans	-67.8	137.7	-179	-168.5	164.7	69.1	0	0	111	Q1195 Y1199 E1212 V1213 L1321 P1323 H1584	Q1195-M1208 HydrophobicContact CG-CB 4.37Å; Y1199-M1208 HydrophobicContact CD1-CB 4.32Å; Y1199-M1208 HydrophobicContact CE1-CB 4.11Å; M1208-E1212 VanDerWaalsContact CA-OE2 3.27Å; M1208-E1212 WeakPolarHBondContact CA-OE2 3.41Å; M1208-E1212 HydrophobicContact CG-CB 3.38Å; M1208-E1212 HydrophobicContact CG-CG 4.36Å; M1208-E1212 WeakPolarHBondContact CG-OE2 3.29Å; M1208-E1212 HydrophobicContact SD-CB 4.17Å; M1208-V1213 HydrophobicContact CE-CB 4.32Å; M1208-V1213 HydrophobicContact CE-CG2 3.38Å; M1208-V1213 HydrophobicContact CG-CG2 4.4Å; M1208-L1321 HydrophobicContact CE-CB 4.01Å; M1208-L1321 HydrophobicContact CE-CD2 3.36Å; M1208-L1321 HydrophobicContact CE-CG 3.47Å; M1208-L1321 VanDerWaalsContact CE-CG 3.47Å; M1208-L1321 HydrophobicContact SD-CG 4.45Å; M1208-P1323 HydrophobicContact CG-CG 4Å; M1208-P1323 HydrophobicContact SD-CB 4.47Å; M1208-P1323 VanDerWaalsContact SD-CD 3.51Å; M1208-P1323 HydrophobicContact SD-CG 3.77Å; M1208-P1323 VanDerWaalsContact SD-N 3.37Å; M1208-H1584 PolarHBondContact O-CE1 3.45Å
1209	T	79	Confident	78.1	Confident	7 Å²	7	35 Å²	35	4%	0.043	18%	0.178	C	C	.	.			trans	-74.3	159	175.8	50.2	0	0	0	0	111.4	G1211 E1212 V1213 D1588	T1209-G1211 PolarHBondContact O-N 2.74Å; T1209-E1212 PolarHBondContact N-OE2 2.98Å; T1209-E1212 PolarHBondContact O-N 3.04Å; T1209-E1212 VanDerWaalsContact O-N 3.13Å; T1209-E1212 VanDerWaalsContact OG1-CG 3.31Å; T1209-E1212 WeakPolarHBondContact OG1-CG 3.48Å; T1209-E1212 PolarHBondContact OG1-N 3.11Å; T1209-E1212 PolarHBondContact OG1-OE2 2.77Å; T1209-V1213 WeakPolarHBondContact O-CG2 3.46Å; T1209-V1213 PolarHBondContact O-N 3.19Å; T1209-D1588 VanDerWaalsContact CG2-OD1 3.26Å; T1209-D1588 WeakPolarHBondContact CG2-OD1 3.35Å
1210	T	79.1	Confident	78.7	Confident	26 Å²	26	37.7 Å²	37.7	16%	0.16	19%	0.189	C	C	.	.	H	α-helix	trans	-58	-37.5	170.6	54.3	0	0	0	0	110.5	G1180 V1213 G1214	G1180-T1210 WeakPolarHBondContact CA-O 3.33Å; G1180-T1210 WeakPolarHBondContact O-CB 3.5Å; T1210-V1213 WeakPolarHBondContact O-CB 2.85Å; T1210-V1213 PolarHBondContact O-N 3.33Å; T1210-G1214 PolarHBondContact O-N 3.3Å
1211	G	81.3	Confident	79.6	Confident	39 Å²	39	34.1 Å²	34.1	40%	0.402	19%	0.187	S	C	.	.	H	α-helix	trans	-57.8	-45.5	171.6	0	0	0	0	0	114.1	T1209 G1214 C1215	T1209-G1211 PolarHBondContact O-N 2.74Å; G1211-G1214 PolarHBondContact O-N 3.11Å; G1211-C1215 WeakPolarHBondContact O-CB 3.33Å; G1211-C1215 PolarHBondContact O-N 3.05Å
1212	E	85	Confident	81	Confident	43 Å²	43	33.5 Å²	33.5	20%	0.201	18%	0.184	C	C	.	.	H	α-helix	trans	-64.5	-38.1	175.3	-76.1	154.7	-168.6	0	0	112.3	R1206 M1208 T1209 C1215 F1216 P1323	R1206-E1212 IonicContact CZ-OE1 3.37Å; R1206-E1212 VanDerWaalsContact CZ-OE1 3.32Å; R1206-E1212 IonicContact CZ-OE2 3.71Å; R1206-E1212 VanDerWaalsContact NH1-CD 3.3Å; R1206-E1212 IonicContact NH1-OE1 2.78Å; R1206-E1212 PolarHBondContact NH1-OE1 3.22Å; R1206-E1212 IonicContact NH1-OE2 3.68Å; R1206-E1212 PolarHBondContact NH1-OE2 3.47Å; R1206-E1212 IonicContact NH2-OE1 3.54Å; R1206-E1212 PolarHBondContact NH2-OE1 2.86Å; R1206-E1212 IonicContact NH2-OE2 2.65Å; M1208-E1212 VanDerWaalsContact CA-OE2 3.27Å; M1208-E1212 WeakPolarHBondContact CA-OE2 3.41Å; M1208-E1212 HydrophobicContact CG-CB 3.38Å; M1208-E1212 HydrophobicContact CG-CG 4.36Å; M1208-E1212 WeakPolarHBondContact CG-OE2 3.29Å; M1208-E1212 HydrophobicContact SD-CB 4.17Å; T1209-E1212 PolarHBondContact N-OE2 2.98Å; T1209-E1212 PolarHBondContact O-N 3.04Å; T1209-E1212 VanDerWaalsContact O-N 3.13Å; T1209-E1212 VanDerWaalsContact OG1-CG 3.31Å; T1209-E1212 WeakPolarHBondContact OG1-CG 3.48Å; T1209-E1212 PolarHBondContact OG1-N 3.11Å; T1209-E1212 PolarHBondContact OG1-OE2 2.77Å; E1212-C1215 PolarHBondContact O-N 3.13Å; E1212-F1216 PolarHBondContact O-N 2.93Å; E1212-P1323 HydrophobicContact CB-CG 4.44Å; E1212-P1323 HydrophobicContact CG-CG 4.44Å
1213	V	87.6	Confident	82.8	Confident	14 Å²	14	31.6 Å²	31.6	9%	0.085	17%	0.171	C	C	.	.	H	α-helix	trans	-60.4	-47.8	170.9	179.7	0	0	0	0	110.8	L1183 L1188 V1193 M1208 T1209 T1210 F1216 L1217 L1321	L1183-V1213 HydrophobicContact CD1-CB 4.47Å; L1183-V1213 HydrophobicContact CD1-CG1 3.87Å; L1188-V1213 HydrophobicContact CD2-CG1 3.78Å; V1193-V1213 HydrophobicContact CG1-CG1 4.33Å; M1208-V1213 HydrophobicContact CE-CB 4.32Å; M1208-V1213 HydrophobicContact CE-CG2 3.38Å; M1208-V1213 HydrophobicContact CG-CG2 4.4Å; T1209-V1213 WeakPolarHBondContact O-CG2 3.46Å; T1209-V1213 PolarHBondContact O-N 3.19Å; T1210-V1213 WeakPolarHBondContact O-CB 2.85Å; T1210-V1213 PolarHBondContact O-N 3.33Å; V1213-F1216 PolarHBondContact O-N 2.92Å; V1213-L1217 HydrophobicContact CG1-CD1 3.92Å; V1213-L1217 HydrophobicContact CG1-CG 4.36Å; V1213-L1217 WeakPolarHBondContact O-CG 3.01Å; V1213-L1217 PolarHBondContact O-N 3.09Å; V1213-L1321 HydrophobicContact CG1-CD2 4.13Å; V1213-L1321 HydrophobicContact CG2-CD2 4.44Å
1214	G	89.5	Confident	85	Confident	1 Å²	1	31.7 Å²	31.7	1%	0.01	17%	0.174	C	C	.	.	H	α-helix	trans	-62.4	-41.5	179.1	0	0	0	0	0	112.9	V1178 T1210 G1211 L1217 S1218	V1178-G1214 CarbonylContact O-C 3.5Å; V1178-G1214 WeakPolarHBondContact O-CA 3.47Å; T1210-G1214 PolarHBondContact O-N 3.3Å; G1211-G1214 PolarHBondContact O-N 3.11Å; G1214-L1217 PolarHBondContact O-N 3.34Å; G1214-S1218 PolarHBondContact O-N 3.29Å; G1214-S1218 PolarHBondContact O-OG 3.16Å
1215	C	89.9	Confident	87	Confident	39 Å²	39	33 Å²	33	26%	0.264	18%	0.177	S	C	.	.	H	α-helix	trans	-57.9	-53	171.8	-179.7	0	0	0	0	110.8	G1211 E1212 L1217 S1218 H1219	G1211-C1215 WeakPolarHBondContact O-CB 3.33Å; G1211-C1215 PolarHBondContact O-N 3.05Å; E1212-C1215 PolarHBondContact O-N 3.13Å; C1215-L1217 VanDerWaalsContact C-N 3.34Å; C1215-L1217 PolarHBondContact O-N 2.97Å; C1215-S1218 WeakPolarHBondContact O-CA 3.44Å; C1215-S1218 VanDerWaalsContact O-CB 3.28Å; C1215-S1218 WeakPolarHBondContact O-CB 3.25Å; C1215-S1218 PolarHBondContact O-N 3.03Å; C1215-H1219 PolarHBondContact O-CD2 3.47Å; C1215-H1219 VanDerWaalsContact O-CD2 3.28Å; C1215-H1219 PolarHBondContact O-N 2.72Å; C1215-H1219 VanDerWaalsContact O-N 3.13Å
1216	F	93.9	Very high	88.7	Confident	1 Å²	1	26.1 Å²	26.1	0%	0.004	15%	0.147	C	C	.	.	H	α-helix	trans	-55.7	-47.7	178.3	-165	-72	0	0	0	112.4	E1212 V1213 S1218 H1219 Y1220 W1223 P1317 L1318 L1321 V1322 V1324 F1327	E1212-F1216 PolarHBondContact O-N 2.93Å; V1213-F1216 PolarHBondContact O-N 2.92Å; F1216-S1218 PolarHBondContact O-N 3.02Å; F1216-H1219 PolarHBondContact O-N 3.06Å; F1216-Y1220 HydrophobicContact CE1-CD2 4.28Å; F1216-Y1220 WeakPolarHBondContact O-CB 3.3Å; F1216-Y1220 PolarHBondContact O-N 2.68Å; F1216-W1223 HydrophobicContact CE1-CH2 4.26Å; F1216-W1223 AromaticContact CE1-CZ3 3.96Å; F1216-W1223 HydrophobicContact CE1-CZ3 3.96Å; F1216-W1223 HydrophobicContact CE2-CH2 4.37Å; F1216-W1223 AromaticContact CZ-CH2 3.91Å; F1216-W1223 HydrophobicContact CZ-CH2 3.91Å; F1216-W1223 AromaticContact CZ-CZ3 3.85Å; F1216-W1223 HydrophobicContact CZ-CZ3 3.85Å; F1216-P1317 HydrophobicContact CE1-CB 3.94Å; F1216-P1317 HydrophobicContact CE1-CG 3.81Å; F1216-P1317 HydrophobicContact CE2-CB 4.48Å; F1216-P1317 HydrophobicContact CZ-CB 3.49Å; F1216-P1317 VanDerWaalsContact CZ-CB 3.49Å; F1216-P1317 HydrophobicContact CZ-CG 3.71Å; F1216-L1318 HydrophobicContact CE1-CD2 4.43Å; F1216-L1321 HydrophobicContact CB-CD1 4.34Å; F1216-L1321 HydrophobicContact CD1-CD1 3.49Å; F1216-L1321 VanDerWaalsContact CD1-CD1 3.49Å; F1216-L1321 HydrophobicContact CD2-CD1 3.77Å; F1216-L1321 HydrophobicContact CE1-CD1 3.68Å; F1216-L1321 HydrophobicContact CE2-CD1 3.93Å; F1216-L1321 HydrophobicContact CG-CD1 3.58Å; F1216-L1321 HydrophobicContact CZ-CD1 3.92Å; F1216-V1322 WeakPolarHBondContact CD2-O 3.46Å; F1216-V1322 WeakPolarHBondContact CE2-O 3.42Å; F1216-V1324 HydrophobicContact CD2-CB 3.91Å; F1216-V1324 HydrophobicContact CD2-CG2 4.49Å; F1216-V1324 HydrophobicContact CE2-CB 4.45Å; F1216-F1327 HydrophobicContact CE2-CB 3.68Å; F1216-F1327 AromaticContact CE2-CD1 3.63Å; F1216-F1327 HydrophobicContact CE2-CD1 3.63Å; F1216-F1327 HydrophobicContact CE2-CE1 4.4Å; F1216-F1327 AromaticContact CE2-CG 3.71Å; F1216-F1327 HydrophobicContact CE2-CG 3.71Å; F1216-F1327 HydrophobicContact CZ-CB 4.45Å; F1216-F1327 AromaticContact CZ-CD1 3.64Å; F1216-F1327 HydrophobicContact CZ-CD1 3.64Å; F1216-F1327 AromaticContact CZ-CE1 3.94Å; F1216-F1327 HydrophobicContact CZ-CE1 3.94Å; F1216-F1327 AromaticContact CZ-CG 3.98Å; F1216-F1327 HydrophobicContact CZ-CG 3.98Å
1217	L	93.5	Very high	90	Very high	13 Å²	13	26.4 Å²	26.4	7%	0.068	15%	0.151	C	C	.	.	H	α-helix	trans	-62.8	-29.7	179.4	-69.6	174.4	0	0	0	112.5	V1178 L1183 L1191 V1193 V1213 G1214 C1215 G1221 L1318	V1178-L1217 HydrophobicContact CB-CB 4.06Å; V1178-L1217 HydrophobicContact CG1-CB 4.18Å; V1178-L1217 HydrophobicContact CG1-CD1 4.11Å; V1178-L1217 HydrophobicContact CG2-CB 3.93Å; L1183-L1217 HydrophobicContact CD1-CD1 3.81Å; L1191-L1217 HydrophobicContact CD1-CD1 4Å; L1191-L1217 HydrophobicContact CD1-CD2 4.44Å; V1193-L1217 HydrophobicContact CG2-CD2 4.32Å; V1213-L1217 HydrophobicContact CG1-CD1 3.92Å; V1213-L1217 HydrophobicContact CG1-CG 4.36Å; V1213-L1217 WeakPolarHBondContact O-CG 3.01Å; V1213-L1217 PolarHBondContact O-N 3.09Å; G1214-L1217 PolarHBondContact O-N 3.34Å; C1215-L1217 VanDerWaalsContact C-N 3.34Å; C1215-L1217 PolarHBondContact O-N 2.97Å; L1217-G1221 PolarHBondContact O-N 2.98Å; L1217-L1318 HydrophobicContact CD2-CD2 3.72Å
1218	S	94	Very high	91.1	Very high	6 Å²	6	29.8 Å²	29.8	4%	0.042	17%	0.167	C	C	.	.	H	α-helix	trans	-67.4	-49.1	174.5	-53.8	0	0	0	0	111.7	A1177 V1178 G1214 C1215 F1216 G1221 I1222	A1177-S1218 WeakPolarHBondContact CA-OG 3.2Å; V1178-S1218 PolarHBondContact N-OG 3.01Å; G1214-S1218 PolarHBondContact O-N 3.29Å; G1214-S1218 PolarHBondContact O-OG 3.16Å; C1215-S1218 WeakPolarHBondContact O-CA 3.44Å; C1215-S1218 VanDerWaalsContact O-CB 3.28Å; C1215-S1218 WeakPolarHBondContact O-CB 3.25Å; C1215-S1218 PolarHBondContact O-N 3.03Å; F1216-S1218 PolarHBondContact O-N 3.02Å; S1218-G1221 PolarHBondContact O-N 3.44Å; S1218-I1222 PolarHBondContact O-N 3.35Å
1219	H	95.7	Very high	92	Very high	1 Å²	1	32.9 Å²	32.9	1%	0.005	18%	0.181	C	C	.	.	H	α-helix	trans	-64.2	-43.1	174.9	-70.8	-84.8	0	0	0	112	I1149 C1215 F1216 G1221 I1222 W1223 E1238 Y1302 V1324	I1149-H1219 WeakPolarHBondContact CD1-CE1 3.49Å; I1149-H1219 WeakPolarHBondContact CD1-ND1 3.41Å; C1215-H1219 PolarHBondContact O-CD2 3.47Å; C1215-H1219 VanDerWaalsContact O-CD2 3.28Å; C1215-H1219 PolarHBondContact O-N 2.72Å; C1215-H1219 VanDerWaalsContact O-N 3.13Å; F1216-H1219 PolarHBondContact O-N 3.06Å; H1219-G1221 VanDerWaalsContact C-N 3.29Å; H1219-G1221 PolarHBondContact O-N 2.93Å; H1219-I1222 PolarHBondContact O-N 3.41Å; H1219-W1223 HydrophobicContact CB-CH2 4.32Å; H1219-W1223 HydrophobicContact CB-CZ2 3.66Å; H1219-W1223 VanDerWaalsContact O-CD1 3.26Å; H1219-W1223 VanDerWaalsContact O-CG 3.23Å; H1219-W1223 PolarHBondContact O-N 2.93Å; H1219-E1238 IonicContact NE2-OE1 3.77Å; H1219-Y1302 AromaticContact CE1-CE1 3.72Å; H1219-Y1302 AromaticContact ND1-CE1 3.52Å; H1219-Y1302 AromaticContact ND1-CZ 3.69Å; H1219-Y1302 PolarHBondContact ND1-OH 3.37Å; H1219-V1324 HydrophobicContact CB-CG2 4.09Å
1220	Y	95.4	Very high	92.9	Very high	60 Å²	60	37.8 Å²	37.8	24%	0.235	20%	0.204	C	C	.	.	H	α-helix	trans	-57.7	-41.2	175.5	-178.1	-88	0	0	0	112.1	F1216 I1222 W1223 K1224 L1313 P1317 L1318	F1216-Y1220 HydrophobicContact CE1-CD2 4.28Å; F1216-Y1220 WeakPolarHBondContact O-CB 3.3Å; F1216-Y1220 PolarHBondContact O-N 2.68Å; Y1220-I1222 VanDerWaalsContact C-N 3.33Å; Y1220-I1222 PolarHBondContact O-N 3.04Å; Y1220-W1223 HydrophobicContact CD2-CE3 4.16Å; Y1220-W1223 HydrophobicContact CD2-CZ3 4.33Å; Y1220-W1223 PolarHBondContact O-N 2.89Å; Y1220-K1224 WeakPolarHBondContact O-CB 3.49Å; Y1220-K1224 PolarHBondContact O-N 3.49Å; Y1220-L1313 HydrophobicContact CD2-CD2 3.74Å; Y1220-L1313 HydrophobicContact CE1-CD2 4.43Å; Y1220-L1313 HydrophobicContact CE2-CD2 3.38Å; Y1220-L1313 HydrophobicContact CG-CD2 4.41Å; Y1220-P1317 HydrophobicContact CD2-CG 4.17Å; Y1220-P1317 HydrophobicContact CE2-CG 4.24Å; Y1220-L1318 HydrophobicContact CD2-CD2 4.17Å; Y1220-L1318 HydrophobicContact CD2-CG 4.43Å; Y1220-L1318 HydrophobicContact CE1-CD1 3.99Å; Y1220-L1318 HydrophobicContact CE2-CD1 4.25Å; Y1220-L1318 HydrophobicContact CE2-CD2 4.33Å; Y1220-L1318 HydrophobicContact CE2-CG 4.09Å; Y1220-L1318 HydrophobicContact CG-CD2 4.28Å
1221	G	94.6	Very high	93.7	Very high	38 Å²	38	37.4 Å²	37.4	39%	0.392	20%	0.2	S	C	.	.	H	α-helix	trans	-59.4	-40.8	173.4	0	0	0	0	0	113	L1217 S1218 H1219 R1225	L1217-G1221 PolarHBondContact O-N 2.98Å; S1218-G1221 PolarHBondContact O-N 3.44Å; H1219-G1221 VanDerWaalsContact C-N 3.29Å; H1219-G1221 PolarHBondContact O-N 2.93Å; G1221-R1225 WeakPolarHBondContact O-CB 2.88Å; G1221-R1225 PolarHBondContact O-N 3.43Å
1222	I	96.4	Very high	94.4	Very high	1 Å²	1	40.7 Å²	40.7	1%	0.005	21%	0.206	C	C	.	.	H	α-helix	trans	-68.4	-45.3	174.3	-65.1	179.7	0	0	0	111.5	F1147 I1149 V1175 S1218 H1219 Y1220 K1224 R1225 V1226 V1236	F1147-I1222 HydrophobicContact CB-CD1 3.95Å; F1147-I1222 HydrophobicContact CD2-CG2 3.64Å; F1147-I1222 HydrophobicContact CE2-CG2 3.78Å; F1147-I1222 HydrophobicContact CG-CD1 4.3Å; F1147-I1222 HydrophobicContact CG-CG2 4.3Å; I1149-I1222 HydrophobicContact CD1-CD1 3.83Å; I1149-I1222 HydrophobicContact CG1-CD1 3.53Å; V1175-I1222 HydrophobicContact CB-CD1 4.16Å; V1175-I1222 HydrophobicContact CB-CG1 4.44Å; V1175-I1222 HydrophobicContact CG1-CD1 4.07Å; V1175-I1222 HydrophobicContact CG1-CG1 3.92Å; V1175-I1222 HydrophobicContact CG2-CD1 3.91Å; V1175-I1222 HydrophobicContact CG2-CG1 4.08Å; S1218-I1222 PolarHBondContact O-N 3.35Å; H1219-I1222 PolarHBondContact O-N 3.41Å; Y1220-I1222 VanDerWaalsContact C-N 3.33Å; Y1220-I1222 PolarHBondContact O-N 3.04Å; I1222-K1224 VanDerWaalsContact C-N 3.29Å; I1222-K1224 PolarHBondContact O-N 3.19Å; I1222-R1225 CarbonylContact O-C 3.55Å; I1222-R1225 WeakPolarHBondContact O-CB 3.32Å; I1222-R1225 PolarHBondContact O-N 3.14Å; I1222-R1225 VanDerWaalsContact O-N 3.1Å; I1222-V1226 HydrophobicContact CG2-CG2 4.26Å; I1222-V1226 WeakPolarHBondContact O-CG2 3.25Å; I1222-V1226 PolarHBondContact O-N 3.4Å; I1222-V1236 HydrophobicContact CD1-CG1 3.79Å; I1222-V1236 HydrophobicContact CD1-CG2 4.4Å; I1222-V1236 HydrophobicContact CG2-CG2 3.86Å
1223	W	97.6	Very high	94.9	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-59.4	-43.7	178.4	-52.4	-24.1	0	0	0	110.9	F1216 H1219 Y1220 R1225 V1226 V1227 Y1302 L1304 A1309 L1312 L1313 V1324 F1327 L1328	F1216-W1223 HydrophobicContact CE1-CH2 4.26Å; F1216-W1223 AromaticContact CE1-CZ3 3.96Å; F1216-W1223 HydrophobicContact CE1-CZ3 3.96Å; F1216-W1223 HydrophobicContact CE2-CH2 4.37Å; F1216-W1223 AromaticContact CZ-CH2 3.91Å; F1216-W1223 HydrophobicContact CZ-CH2 3.91Å; F1216-W1223 AromaticContact CZ-CZ3 3.85Å; F1216-W1223 HydrophobicContact CZ-CZ3 3.85Å; H1219-W1223 HydrophobicContact CB-CH2 4.32Å; H1219-W1223 HydrophobicContact CB-CZ2 3.66Å; H1219-W1223 VanDerWaalsContact O-CD1 3.26Å; H1219-W1223 VanDerWaalsContact O-CG 3.23Å; H1219-W1223 PolarHBondContact O-N 2.93Å; Y1220-W1223 HydrophobicContact CD2-CE3 4.16Å; Y1220-W1223 HydrophobicContact CD2-CZ3 4.33Å; Y1220-W1223 PolarHBondContact O-N 2.89Å; W1223-R1225 PolarHBondContact O-N 3.36Å; W1223-V1226 PolarHBondContact O-N 3.35Å; W1223-V1227 PolarHBondContact O-N 3.23Å; W1223-V1227 VanDerWaalsContact O-N 3.14Å; W1223-Y1302 PolarHBondContact NE1-OH 2.85Å; W1223-Y1302 VanDerWaalsContact NE1-OH 3.13Å; W1223-L1304 VanDerWaalsContact CD1-CD2 3.5Å; W1223-L1304 HydrophobicContact CG-CD2 4.38Å; W1223-A1309 HydrophobicContact CB-CB 4.27Å; W1223-L1312 HydrophobicContact CD2-CB 4.05Å; W1223-L1312 HydrophobicContact CD2-CD1 3.84Å; W1223-L1312 HydrophobicContact CE3-CB 3.82Å; W1223-L1312 HydrophobicContact CE3-CD1 4.36Å; W1223-L1312 HydrophobicContact CG-CD1 4.18Å; W1223-L1312 HydrophobicContact CZ2-CD1 4.03Å; W1223-L1312 HydrophobicContact CZ3-CB 4.21Å; W1223-L1313 HydrophobicContact CB-CD2 4.04Å; W1223-L1313 HydrophobicContact CB-CG 4.14Å; W1223-L1313 HydrophobicContact CE3-CD2 4.44Å; W1223-V1324 HydrophobicContact CH2-CG2 4.03Å; W1223-V1324 HydrophobicContact CZ2-CG2 3.89Å; W1223-F1327 AromaticContact CH2-CD1 3.75Å; W1223-F1327 HydrophobicContact CH2-CD1 3.75Å; W1223-F1327 AromaticContact CH2-CE1 3.67Å; W1223-F1327 HydrophobicContact CH2-CE1 3.67Å; W1223-F1327 HydrophobicContact CZ3-CD1 4.18Å; W1223-F1327 AromaticContact CZ3-CE1 3.66Å; W1223-F1327 HydrophobicContact CZ3-CE1 3.66Å; W1223-L1328 HydrophobicContact CZ2-CD2 4.14Å
1224	K	96.4	Very high	95.4	Very high	104 Å²	104	41.6 Å²	41.6	45%	0.452	21%	0.205	S	C	.	.	H	α-helix	trans	-59.5	-46.3	173.4	-175.6	175.8	177.4	-177.6	0	111.5	Y1220 I1222 V1226 V1227 D1228 L1313	Y1220-K1224 WeakPolarHBondContact O-CB 3.49Å; Y1220-K1224 PolarHBondContact O-N 3.49Å; I1222-K1224 VanDerWaalsContact C-N 3.29Å; I1222-K1224 PolarHBondContact O-N 3.19Å; K1224-V1226 VanDerWaalsContact C-N 3.33Å; K1224-V1226 PolarHBondContact O-N 2.63Å; K1224-V1227 PolarHBondContact O-N 3.02Å; K1224-D1228 WeakPolarHBondContact CE-OD2 3.4Å; K1224-D1228 WeakPolarHBondContact CG-OD2 3.42Å; K1224-D1228 WeakPolarHBondContact O-CB 3.35Å; K1224-D1228 PolarHBondContact O-N 3.05Å; K1224-L1313 HydrophobicContact CB-CD1 4.41Å; K1224-L1313 HydrophobicContact CB-CD2 4.45Å
1225	R	96.3	Very high	95.8	Very high	78 Å²	78	41.5 Å²	41.5	29%	0.294	21%	0.205	S	C	.	.	H	α-helix	trans	-60.9	-38.6	176.8	-171.7	176.5	-177	-168.6	-5.5	113	G1221 I1222 W1223 V1227 E1229	G1221-R1225 WeakPolarHBondContact O-CB 2.88Å; G1221-R1225 PolarHBondContact O-N 3.43Å; I1222-R1225 CarbonylContact O-C 3.55Å; I1222-R1225 WeakPolarHBondContact O-CB 3.32Å; I1222-R1225 PolarHBondContact O-N 3.14Å; I1222-R1225 VanDerWaalsContact O-N 3.1Å; W1223-R1225 PolarHBondContact O-N 3.36Å; R1225-V1227 VanDerWaalsContact C-N 3.34Å; R1225-E1229 HydrophobicContact CG-CG 4.3Å; R1225-E1229 WeakPolarHBondContact CG-OE1 3.47Å; R1225-E1229 IonicContact CZ-OE1 3.62Å; R1225-E1229 IonicContact NE-OE1 3.21Å; R1225-E1229 PolarHBondContact NE-OE1 3.06Å; R1225-E1229 IonicContact NH2-OE1 3.8Å; R1225-E1229 PolarHBondContact NH2-OE1 3.18Å; R1225-E1229 VanDerWaalsContact O-CB 3.29Å; R1225-E1229 WeakPolarHBondContact O-CB 3.26Å; R1225-E1229 PolarHBondContact O-N 2.99Å
1226	V	97.2	Very high	96.1	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-61.2	-42.3	175.2	166.8	0	0	0	0	111.2	F1147 I1222 W1223 K1224 Q1230 L1231 V1234 L1306 A1309	F1147-V1226 HydrophobicContact CE2-CG2 4.16Å; I1222-V1226 HydrophobicContact CG2-CG2 4.26Å; I1222-V1226 WeakPolarHBondContact O-CG2 3.25Å; I1222-V1226 PolarHBondContact O-N 3.4Å; W1223-V1226 PolarHBondContact O-N 3.35Å; K1224-V1226 VanDerWaalsContact C-N 3.33Å; K1224-V1226 PolarHBondContact O-N 2.63Å; V1226-Q1230 CarbonylContact O-C 3.57Å; V1226-Q1230 WeakPolarHBondContact O-CA 3.42Å; V1226-Q1230 PolarHBondContact O-N 3.42Å; V1226-L1231 HydrophobicContact CG1-CB 4.33Å; V1226-L1231 WeakPolarHBondContact CG1-O 3.15Å; V1226-L1231 HydrophobicContact CG2-CD1 4.31Å; V1226-L1231 PolarHBondContact O-N 3.34Å; V1226-V1234 HydrophobicContact CG2-CG1 4.11Å; V1226-V1234 HydrophobicContact CG2-CG2 3.69Å; V1226-L1306 HydrophobicContact CG1-CD1 4.28Å; V1226-L1306 WeakPolarHBondContact O-CD1 3.44Å; V1226-A1309 HydrophobicContact CB-CB 3.95Å; V1226-A1309 HydrophobicContact CG1-CB 3.59Å
1227	V	97.2	Very high	96.2	Very high	30 Å²	30	39.7 Å²	39.7	18%	0.182	19%	0.193	C	C	.	.	H	α-helix	trans	-73.1	-47.2	176.9	178.3	0	0	0	0	112	W1223 K1224 R1225 E1229 Q1230 L1306 A1309 E1310 L1313	W1223-V1227 PolarHBondContact O-N 3.23Å; W1223-V1227 VanDerWaalsContact O-N 3.14Å; K1224-V1227 PolarHBondContact O-N 3.02Å; R1225-V1227 VanDerWaalsContact C-N 3.34Å; V1227-E1229 PolarHBondContact O-N 3.2Å; V1227-Q1230 PolarHBondContact O-N 3.27Å; V1227-Q1230 VanDerWaalsContact O-N 3.15Å; V1227-Q1230 PolarHBondContact O-NE2 3.33Å; V1227-L1306 HydrophobicContact CB-CD1 4.43Å; V1227-L1306 HydrophobicContact CG2-CD1 4.15Å; V1227-A1309 HydrophobicContact CG2-CB 3.81Å; V1227-E1310 HydrophobicContact CG1-CG 4.33Å; V1227-E1310 HydrophobicContact CG2-CG 3.75Å; V1227-L1313 HydrophobicContact CB-CD1 4.15Å; V1227-L1313 HydrophobicContact CG2-CD1 3.73Å
1228	D	96.3	Very high	96.2	Very high	114 Å²	114	40.6 Å²	40.6	61%	0.61	20%	0.197	S	C	*	.	H	α-helix	trans	-64	-36.8	-178.9	-71.1	-9.9	0	0	0	112	K1224	K1224-D1228 WeakPolarHBondContact CE-OD2 3.4Å; K1224-D1228 WeakPolarHBondContact CG-OD2 3.42Å; K1224-D1228 WeakPolarHBondContact O-CB 3.35Å; K1224-D1228 PolarHBondContact O-N 3.05Å
1229	E	96.8	Very high	95.9	Very high	76 Å²	76	40.9 Å²	40.9	36%	0.355	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.7	-1	174.8	-66.7	-172.9	-152.2	0	0	114	R1145 R1225 V1227 L1231	R1145-E1229 IonicContact CZ-OE2 3.76Å; R1145-E1229 IonicContact NE-OE2 3.61Å; R1145-E1229 PolarHBondContact NE-OE2 3.5Å; R1145-E1229 IonicContact NH2-OE1 2.72Å; R1145-E1229 IonicContact NH2-OE2 2.62Å; R1145-E1229 PolarHBondContact NH2-OE2 3.31Å; R1225-E1229 HydrophobicContact CG-CG 4.3Å; R1225-E1229 WeakPolarHBondContact CG-OE1 3.47Å; R1225-E1229 IonicContact CZ-OE1 3.62Å; R1225-E1229 IonicContact NE-OE1 3.21Å; R1225-E1229 PolarHBondContact NE-OE1 3.06Å; R1225-E1229 IonicContact NH2-OE1 3.8Å; R1225-E1229 PolarHBondContact NH2-OE1 3.18Å; R1225-E1229 VanDerWaalsContact O-CB 3.29Å; R1225-E1229 WeakPolarHBondContact O-CB 3.26Å; R1225-E1229 PolarHBondContact O-N 2.99Å; V1227-E1229 PolarHBondContact O-N 3.2Å; E1229-L1231 VanDerWaalsContact C-N 3.3Å; E1229-L1231 HydrophobicContact CB-CD1 4.22Å; E1229-L1231 HydrophobicContact CB-CD2 3.96Å; E1229-L1231 HydrophobicContact CB-CG 3.79Å; E1229-L1231 PolarHBondContact O-N 3.24Å
1230	Q	96.5	Very high	95.1	Very high	109 Å²	109	43 Å²	43	51%	0.509	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.7	35.4	-179.2	-64.1	-75.1	-72.7	0	0	114.9	V1226 V1227 Q1232	V1226-Q1230 CarbonylContact O-C 3.57Å; V1226-Q1230 WeakPolarHBondContact O-CA 3.42Å; V1226-Q1230 PolarHBondContact O-N 3.42Å; V1227-Q1230 PolarHBondContact O-N 3.27Å; V1227-Q1230 VanDerWaalsContact O-N 3.15Å; V1227-Q1230 PolarHBondContact O-NE2 3.33Å; Q1230-Q1232 PolarHBondContact O-N 3.29Å; Q1230-Q1232 PolarHBondContact O-NE2 3.18Å
1231	L	96.5	Very high	94.7	Very high	18 Å²	18	40.2 Å²	40.2	9%	0.094	20%	0.198	C	C	.	.			trans	-72.4	121.2	-177.6	-53.2	174.6	0	0	0	110.5	D1144 R1145 F1147 V1226 E1229 V1234 L1306	D1144-L1231 HydrophobicContact CB-CB 4.29Å; D1144-L1231 HydrophobicContact CB-CD2 4.11Å; R1145-L1231 HydrophobicContact CB-CD1 4.38Å; R1145-L1231 HydrophobicContact CG-CD1 4.06Å; R1145-L1231 HydrophobicContact CG-CD2 4.38Å; F1147-L1231 HydrophobicContact CE2-CD1 4.26Å; F1147-L1231 HydrophobicContact CZ-CD1 3.91Å; V1226-L1231 HydrophobicContact CG1-CB 4.33Å; V1226-L1231 WeakPolarHBondContact CG1-O 3.15Å; V1226-L1231 HydrophobicContact CG2-CD1 4.31Å; V1226-L1231 PolarHBondContact O-N 3.34Å; E1229-L1231 VanDerWaalsContact C-N 3.3Å; E1229-L1231 HydrophobicContact CB-CD1 4.22Å; E1229-L1231 HydrophobicContact CB-CD2 3.96Å; E1229-L1231 HydrophobicContact CB-CG 3.79Å; E1229-L1231 PolarHBondContact O-N 3.24Å; L1231-V1234 HydrophobicContact CB-CG1 3.8Å; L1231-V1234 HydrophobicContact CD1-CG1 3.91Å; L1231-V1234 HydrophobicContact CG-CG1 4.49Å; L1231-L1306 WeakPolarHBondContact O-CB 3.5Å
1232	Q	96.3	Very high	94.1	Very high	109 Å²	109	43.5 Å²	43.5	51%	0.509	20%	0.199	S	C	.	.	S	Bend	trans	-73.9	-43.1	-171.4	-60.1	-58.2	-62.3	0	0	112.7	D1144 Q1230 T1305 L1306	D1144-Q1232 WeakPolarHBondContact OD2-CA 3.42Å; D1144-Q1232 WeakPolarHBondContact OD2-CB 3.43Å; D1144-Q1232 PolarHBondContact OD2-N 3.08Å; Q1230-Q1232 PolarHBondContact O-N 3.29Å; Q1230-Q1232 PolarHBondContact O-NE2 3.18Å; Q1232-T1305 VanDerWaalsContact O-CA 3.22Å; Q1232-T1305 WeakPolarHBondContact O-CA 3.49Å; Q1232-L1306 VanDerWaalsContact NE2-CD2 3.34Å; Q1232-L1306 PolarHBondContact O-N 2.84Å; Q1232-L1306 VanDerWaalsContact O-N 3.08Å
1233	R	96	Very high	93.8	Very high	75 Å²	75	43.9 Å²	43.9	28%	0.283	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	125.7	179.5	-56.8	-174	-59.6	-174.4	8.5	110.4	G1142 F1143 D1144 T1259 W1265 L1304	G1142-R1233 PolarHBondContact O-NH2 2.94Å; F1143-R1233 HydrophobicContact CD1-CB 3.88Å; F1143-R1233 HydrophobicContact CE1-CB 4.32Å; D1144-R1233 PolarHBondContact N-O 3.34Å; D1144-R1233 PolarHBondContact OD2-N 3.43Å; R1233-T1259 PolarHBondContact NH1-OG1 3.3Å; R1233-T1259 VanDerWaalsContact NH1-OG1 3.09Å; R1233-W1265 HydrophobicContact CG-CZ2 4.18Å; R1233-L1304 WeakPolarHBondContact CA-O 3.41Å
1234	V	97.8	Very high	93.2	Very high	0 Å²	0	48 Å²	48	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	162.5	175.6	-57.3	0	0	0	0	111.7	R1145 F1147 V1226 L1231 M1303 L1304	R1145-V1234 HydrophobicContact CB-CG1 4.18Å; R1145-V1234 VanDerWaalsContact O-CA 3.23Å; R1145-V1234 WeakPolarHBondContact O-CA 3.43Å; R1145-V1234 WeakPolarHBondContact O-CB 3.43Å; F1147-V1234 HydrophobicContact CD2-CB 4.21Å; F1147-V1234 HydrophobicContact CD2-CG2 4.33Å; F1147-V1234 HydrophobicContact CE2-CB 4.03Å; F1147-V1234 HydrophobicContact CE2-CG1 3.92Å; F1147-V1234 HydrophobicContact CE2-CG2 4.19Å; V1226-V1234 HydrophobicContact CG2-CG1 4.11Å; V1226-V1234 HydrophobicContact CG2-CG2 3.69Å; L1231-V1234 HydrophobicContact CB-CG1 3.8Å; L1231-V1234 HydrophobicContact CD1-CG1 3.91Å; L1231-V1234 HydrophobicContact CG-CG1 4.49Å; V1234-M1303 CarbonylContact O-C 3.54Å; V1234-M1303 VanDerWaalsContact O-CA 3.3Å; V1234-M1303 WeakPolarHBondContact O-CA 3.2Å; V1234-L1304 HydrophobicContact CG2-CB 4Å; V1234-L1304 PolarHBondContact N-O 3.49Å; V1234-L1304 PolarHBondContact O-N 3.36Å
1235	I	97.4	Very high	92.5	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	139.4	163.8	-46.3	-172.2	0	0	0	108.5	F1143 R1145 L1146 F1147 F1237 V1251 L1270 Y1302 M1303	F1143-I1235 HydrophobicContact CD1-CD1 4.28Å; F1143-I1235 HydrophobicContact CD1-CG1 3.59Å; F1143-I1235 HydrophobicContact CD2-CD1 3.93Å; F1143-I1235 HydrophobicContact CD2-CG1 4.09Å; F1143-I1235 HydrophobicContact CE1-CD1 4.05Å; F1143-I1235 HydrophobicContact CE1-CG1 3.59Å; F1143-I1235 HydrophobicContact CE2-CD1 3.72Å; F1143-I1235 HydrophobicContact CE2-CG1 4.12Å; F1143-I1235 HydrophobicContact CG-CD1 4.22Å; F1143-I1235 HydrophobicContact CG-CG1 3.85Å; F1143-I1235 HydrophobicContact CZ-CD1 3.77Å; F1143-I1235 HydrophobicContact CZ-CG1 3.87Å; R1145-I1235 PolarHBondContact O-N 3.17Å; L1146-I1235 CarbonylContact C-O 3.49Å; L1146-I1235 WeakPolarHBondContact CA-O 3.46Å; L1146-I1235 HydrophobicContact CD2-CB 3.65Å; L1146-I1235 HydrophobicContact CD2-CD1 3.64Å; L1146-I1235 HydrophobicContact CD2-CG1 3.49Å; L1146-I1235 VanDerWaalsContact CD2-CG1 3.49Å; F1147-I1235 PolarHBondContact N-O 2.84Å; I1235-F1237 HydrophobicContact CB-CE2 4.09Å; I1235-F1237 HydrophobicContact CB-CZ 4.27Å; I1235-F1237 HydrophobicContact CG2-CD1 4.43Å; I1235-F1237 HydrophobicContact CG2-CD2 4.27Å; I1235-F1237 HydrophobicContact CG2-CE1 3.94Å; I1235-F1237 HydrophobicContact CG2-CE2 3.76Å; I1235-F1237 HydrophobicContact CG2-CZ 3.58Å; I1235-V1251 HydrophobicContact CD1-CG1 3.91Å; I1235-L1270 HydrophobicContact CD1-CD1 4.18Å; I1235-L1270 HydrophobicContact CG2-CD1 3.62Å; I1235-Y1302 WeakPolarHBondContact CA-O 3.38Å; I1235-M1303 HydrophobicContact CD1-CG 4.36Å; I1235-M1303 HydrophobicContact CG1-CG 4.08Å
1236	V	97	Very high	91.9	Very high	1 Å²	1	44.2 Å²	44.2	1%	0.006	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	133.2	172.5	-174.2	0	0	0	0	108.6	F1147 I1149 I1222 A1301 Y1302	F1147-V1236 HydrophobicContact CD2-CG2 4.3Å; I1149-V1236 HydrophobicContact CD1-CG1 3.64Å; I1149-V1236 HydrophobicContact CG1-CG1 3.99Å; I1222-V1236 HydrophobicContact CD1-CG1 3.79Å; I1222-V1236 HydrophobicContact CD1-CG2 4.4Å; I1222-V1236 HydrophobicContact CG2-CG2 3.86Å; V1236-A1301 CarbonylContact O-C 3.41Å; V1236-A1301 WeakPolarHBondContact O-CA 3.3Å; V1236-A1301 WeakPolarHBondContact O-CB 3.27Å; V1236-Y1302 HydrophobicContact CB-CD1 4.42Å; V1236-Y1302 HydrophobicContact CB-CD2 4.46Å; V1236-Y1302 HydrophobicContact CB-CE1 3.96Å; V1236-Y1302 HydrophobicContact CB-CE2 3.96Å; V1236-Y1302 HydrophobicContact CG1-CE1 4.15Å; V1236-Y1302 HydrophobicContact CG2-CD2 4.47Å; V1236-Y1302 HydrophobicContact CG2-CE2 3.72Å; V1236-Y1302 PolarHBondContact N-O 3.37Å; V1236-Y1302 PolarHBondContact O-N 3.28Å
1237	F	95.9	Very high	91.6	Very high	1 Å²	1	44.2 Å²	44.2	0%	0.004	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	138.8	178.7	-63.2	-74.8	0	0	0	110.1	L1146 F1147 L1148 I1149 F1165 I1235 L1241 F1243 F1247 A1301	L1146-F1237 HydrophobicContact CB-CE2 4.29Å; F1147-F1237 PolarHBondContact O-N 3.16Å; L1148-F1237 CarbonylContact C-O 3.21Å; L1148-F1237 WeakPolarHBondContact CA-O 3.14Å; L1148-F1237 HydrophobicContact CD1-CB 4.23Å; I1149-F1237 PolarHBondContact N-O 3.46Å; F1165-F1237 AromaticContact CE1-CD2 3.98Å; F1165-F1237 HydrophobicContact CE1-CD2 3.98Å; F1165-F1237 AromaticContact CE1-CE2 3.98Å; F1165-F1237 HydrophobicContact CE1-CE2 3.98Å; F1165-F1237 HydrophobicContact CE1-CG 4.36Å; F1165-F1237 HydrophobicContact CE1-CZ 4.36Å; F1165-F1237 HydrophobicContact CZ-CB 4.25Å; F1165-F1237 AromaticContact CZ-CD2 3.79Å; F1165-F1237 HydrophobicContact CZ-CD2 3.79Å; F1165-F1237 HydrophobicContact CZ-CE2 4.27Å; F1165-F1237 HydrophobicContact CZ-CG 4.02Å; I1235-F1237 HydrophobicContact CB-CE2 4.09Å; I1235-F1237 HydrophobicContact CB-CZ 4.27Å; I1235-F1237 HydrophobicContact CG2-CD1 4.43Å; I1235-F1237 HydrophobicContact CG2-CD2 4.27Å; I1235-F1237 HydrophobicContact CG2-CE1 3.94Å; I1235-F1237 HydrophobicContact CG2-CE2 3.76Å; I1235-F1237 HydrophobicContact CG2-CZ 3.58Å; F1237-L1241 HydrophobicContact CB-CD2 3.87Å; F1237-L1241 HydrophobicContact CD1-CD2 3.66Å; F1237-L1241 HydrophobicContact CG-CD2 4.22Å; F1237-F1243 HydrophobicContact CE1-CE1 4.14Å; F1237-F1247 HydrophobicContact CE1-CE1 4.47Å; F1237-F1247 AromaticContact CE1-CZ 3.75Å; F1237-F1247 HydrophobicContact CE1-CZ 3.75Å; F1237-F1247 HydrophobicContact CZ-CE1 4.21Å; F1237-F1247 AromaticContact CZ-CZ 3.82Å; F1237-F1247 HydrophobicContact CZ-CZ 3.82Å; F1237-A1301 HydrophobicContact CD1-CB 3.68Å; F1237-A1301 HydrophobicContact CE1-CB 4.22Å
1238	E	92.7	Very high	91.4	Very high	32 Å²	32	44 Å²	44	15%	0.15	20%	0.204	C	C	.	.			trans	-85.5	170.3	163.5	-64.7	-175.9	148.9	0	0	111	H1219 L1241 T1299 L1300	H1219-E1238 IonicContact NE2-OE1 3.77Å; E1238-L1241 WeakPolarHBondContact O-CD2 3.36Å; E1238-T1299 VanDerWaalsContact CD-O 3.27Å; E1238-L1300 PolarHBondContact N-O 2.77Å; E1238-L1300 VanDerWaalsContact OE2-CA 3.29Å; E1238-L1300 WeakPolarHBondContact OE2-CA 3.17Å; E1238-L1300 PolarHBondContact OE2-N 2.94Å
1239	D	87.9	Confident	91	Very high	11 Å²	11	41.5 Å²	41.5	6%	0.059	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.1	-3.5	-170	69.5	11.8	0	0	0	116.1	L1148 I1149 N1150 R1157 R1160 M1161	L1148-D1239 HydrophobicContact CD1-CB 4.35Å; I1149-D1239 PolarHBondContact O-N 2.82Å; N1150-D1239 HydrophobicContact CB-CB 4.08Å; N1150-D1239 PolarHBondContact ND2-OD2 2.8Å; R1157-D1239 HydrophobicContact CB-CB 3.88Å; R1157-D1239 WeakPolarHBondContact CD-OD1 3.46Å; R1157-D1239 WeakPolarHBondContact CD-OD2 3.28Å; R1157-D1239 IonicContact CZ-OD1 2.8Å; R1157-D1239 IonicContact NE-OD1 3.96Å; R1157-D1239 IonicContact NH1-OD1 3.98Å; R1157-D1239 PolarHBondContact NH1-OD1 3.43Å; R1160-D1239 PolarHBondContact NH2-O 3.11Å; M1161-D1239 HydrophobicContact CG-CB 4.49Å; M1161-D1239 WeakPolarHBondContact CG-O 3.31Å
1240	D	80	Confident	90.8	Very high	47 Å²	47	41.9 Å²	41.9	25%	0.251	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-122.1	36.9	-179.3	57.1	10.3	0	0	0	114.6	R1157 V1362	R1157-D1240 IonicContact CZ-OD2 3.49Å; R1157-D1240 VanDerWaalsContact CZ-OD2 3.26Å; R1157-D1240 IonicContact NH1-OD2 3.73Å; R1157-D1240 PolarHBondContact NH1-OD2 2.9Å; R1157-D1240 IonicContact NH2-OD2 2.74Å; R1157-D1240 PolarHBondContact NH2-OD2 3.44Å; R1157-D1240 VanDerWaalsContact NH2-OD2 3.08Å; D1240-V1362 WeakPolarHBondContact O-CG2 3.26Å; D1240-V1362 PolarHBondContact O-N 2.89Å
1241	L	86	Confident	90.7	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	160.2	172.3	71.7	80.4	0	0	0	113.5	M1161 F1237 E1238 F1243 A1301 V1359 Y1360	M1161-L1241 HydrophobicContact CE-CD1 3.65Å; M1161-L1241 HydrophobicContact CE-CD2 4.1Å; M1161-L1241 HydrophobicContact CE-CG 3.7Å; M1161-L1241 HydrophobicContact SD-CD1 4.26Å; M1161-L1241 HydrophobicContact SD-CG 4.21Å; F1237-L1241 HydrophobicContact CB-CD2 3.87Å; F1237-L1241 HydrophobicContact CD1-CD2 3.66Å; F1237-L1241 HydrophobicContact CG-CD2 4.22Å; E1238-L1241 WeakPolarHBondContact O-CD2 3.36Å; L1241-F1243 HydrophobicContact CD1-CD1 4.08Å; L1241-F1243 HydrophobicContact CD1-CD2 3.95Å; L1241-F1243 HydrophobicContact CD1-CE1 3.78Å; L1241-F1243 HydrophobicContact CD1-CE2 3.62Å; L1241-F1243 HydrophobicContact CD1-CG 4.16Å; L1241-F1243 HydrophobicContact CD1-CZ 3.54Å; L1241-A1301 HydrophobicContact CD2-CB 4.32Å; L1241-V1359 HydrophobicContact CB-CB 4.2Å; L1241-V1359 HydrophobicContact CB-CG2 4.23Å; L1241-V1359 HydrophobicContact CD1-CB 4.02Å; L1241-V1359 HydrophobicContact CD1-CG1 3.88Å; L1241-V1359 HydrophobicContact CD2-CB 4.41Å; L1241-V1359 HydrophobicContact CD2-CG1 4.4Å; L1241-V1359 HydrophobicContact CD2-CG2 4.16Å; L1241-V1359 HydrophobicContact CG-CB 4.45Å; L1241-Y1360 CarbonylContact C-O 3.6Å; L1241-Y1360 WeakPolarHBondContact CA-O 3.16Å
1242	R	82.7	Confident	90.5	Very high	108 Å²	108	39.8 Å²	39.8	41%	0.408	18%	0.178	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	128.5	171.7	164.7	156.8	176.9	-137.6	-3.8	110.1	E1115 V1359 Y1360 V1362	E1115-R1242 IonicContact OE1-CZ 3.3Å; E1115-R1242 IonicContact OE1-NE 2.76Å; E1115-R1242 IonicContact OE1-NH1 2.78Å; E1115-R1242 IonicContact OE1-NH2 3.63Å; E1115-R1242 PolarHBondContact OE1-NH2 3.27Å; E1115-R1242 IonicContact OE2-CZ 3.57Å; E1115-R1242 IonicContact OE2-NE 2.69Å; E1115-R1242 PolarHBondContact OE2-NE 3.15Å; E1115-R1242 IonicContact OE2-NH2 3.44Å; E1115-R1242 PolarHBondContact OE2-NH2 3.33Å; R1242-V1359 CarbonylContact O-C 3.42Å; R1242-V1359 VanDerWaalsContact O-CA 3.27Å; R1242-V1359 WeakPolarHBondContact O-CA 3.49Å; R1242-Y1360 PolarHBondContact N-O 3.49Å; R1242-Y1360 PolarHBondContact O-N 2.66Å; R1242-V1362 HydrophobicContact CB-CG2 4.17Å
1243	F	88.7	Confident	90.3	Very high	9 Å²	9	36.4 Å²	36.4	4%	0.039	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76	144.5	-178.7	-61.8	-84.2	0	0	0	112.1	V1114 M1161 C1164 F1165 L1168 F1237 L1241 F1247 V1359	V1114-F1243 HydrophobicContact CG1-CB 4.07Å; V1114-F1243 HydrophobicContact CG1-CD2 4.03Å; V1114-F1243 HydrophobicContact CG1-CG 4.43Å; M1161-F1243 HydrophobicContact CE-CE2 3.78Å; M1161-F1243 HydrophobicContact CE-CZ 3.69Å; M1161-F1243 HydrophobicContact SD-CE2 4.46Å; C1164-F1243 HydrophobicContact CB-CD2 4.07Å; C1164-F1243 HydrophobicContact CB-CE2 3.64Å; F1165-F1243 AromaticContact CD1-CZ 3.94Å; F1165-F1243 HydrophobicContact CD1-CZ 3.94Å; F1165-F1243 HydrophobicContact CE1-CE1 4.07Å; F1165-F1243 HydrophobicContact CE1-CE2 4.5Å; F1165-F1243 AromaticContact CE1-CZ 3.47Å; F1165-F1243 HydrophobicContact CE1-CZ 3.47Å; F1165-F1243 VanDerWaalsContact CE1-CZ 3.47Å; F1165-F1243 HydrophobicContact CZ-CZ 4.11Å; L1168-F1243 HydrophobicContact CD1-CB 4.38Å; L1168-F1243 HydrophobicContact CD1-CD1 3.74Å; L1168-F1243 HydrophobicContact CD1-CD2 3.86Å; L1168-F1243 HydrophobicContact CD1-CE1 3.9Å; L1168-F1243 HydrophobicContact CD1-CE2 4.03Å; L1168-F1243 HydrophobicContact CD1-CG 3.72Å; L1168-F1243 HydrophobicContact CD1-CZ 4.04Å; F1237-F1243 HydrophobicContact CE1-CE1 4.14Å; L1241-F1243 HydrophobicContact CD1-CD1 4.08Å; L1241-F1243 HydrophobicContact CD1-CD2 3.95Å; L1241-F1243 HydrophobicContact CD1-CE1 3.78Å; L1241-F1243 HydrophobicContact CD1-CE2 3.62Å; L1241-F1243 HydrophobicContact CD1-CG 4.16Å; L1241-F1243 HydrophobicContact CD1-CZ 3.54Å; F1243-F1247 HydrophobicContact CB-CB 4.37Å; F1243-F1247 HydrophobicContact CD1-CB 4.43Å; F1243-F1247 AromaticContact CD1-CD1 3.85Å; F1243-F1247 HydrophobicContact CD1-CD1 3.85Å; F1243-F1247 AromaticContact CD1-CD2 3.76Å; F1243-F1247 HydrophobicContact CD1-CD2 3.76Å; F1243-F1247 AromaticContact CD1-CE1 4Å; F1243-F1247 HydrophobicContact CD1-CE1 4Å; F1243-F1247 AromaticContact CD1-CE2 3.91Å; F1243-F1247 HydrophobicContact CD1-CE2 3.91Å; F1243-F1247 AromaticContact CD1-CG 3.74Å; F1243-F1247 HydrophobicContact CD1-CG 3.74Å; F1243-F1247 HydrophobicContact CD1-CZ 4.03Å; F1243-F1247 HydrophobicContact CE1-CD1 4.22Å; F1243-F1247 AromaticContact CE1-CE1 3.97Å; F1243-F1247 HydrophobicContact CE1-CE1 3.97Å; F1243-F1247 HydrophobicContact CE1-CE2 4.33Å; F1243-F1247 HydrophobicContact CE1-CZ 4.03Å; F1243-V1359 HydrophobicContact CD1-CG1 3.83Å; F1243-V1359 HydrophobicContact CE1-CG1 4.18Å
1244	R	84.9	Confident	90.2	Very high	85 Å²	85	32.8 Å²	32.8	32%	0.321	16%	0.156	S	C	.	.	P	Polyproline II helix	trans	-74.7	144.3	167.4	-172.6	-179	-177.4	83.9	9.9	110.4	F1247 P1356 L1358 Y1360	R1244-F1247 WeakPolarHBondContact O-CA 3.44Å; R1244-F1247 WeakPolarHBondContact O-CB 3.38Å; R1244-F1247 PolarHBondContact O-N 3.42Å; R1244-F1247 VanDerWaalsContact O-N 3.11Å; R1244-P1356 VanDerWaalsContact CZ-CG 3.43Å; R1244-L1358 WeakPolarHBondContact CB-O 3.47Å; R1244-L1358 PolarHBondContact N-O 3.15Å; R1244-Y1360 HydrophobicContact CB-CE2 4.2Å; R1244-Y1360 HydrophobicContact CG-CE2 4.44Å; R1244-Y1360 PolarHBondContact NH1-OH 2.67Å
1245	S	81.6	Confident	90	Very high	44 Å²	44	33.3 Å²	33.3	31%	0.308	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.3	139.6	170.2	-53.2	0	0	0	0	112.3	D1111 F1247 W1250	D1111-S1245 VanDerWaalsContact OD2-CA 3.23Å; D1111-S1245 WeakPolarHBondContact OD2-CA 3.26Å; D1111-S1245 WeakPolarHBondContact OD2-CB 3.35Å; S1245-F1247 VanDerWaalsContact C-N 3.32Å; S1245-W1250 VanDerWaalsContact O-CD1 3.23Å; S1245-W1250 PolarHBondContact O-NE1 2.86Å
1246	H	85.2	Confident	89.7	Confident	59 Å²	59	39.2 Å²	39.2	27%	0.273	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.3	36.6	-170.9	-49.4	-88.3	0	0	0	113.8	E1107 D1111 R1248 Q1249 W1250	E1107-H1246 IonicContact OE2-CE1 2.68Å; E1107-H1246 IonicContact OE2-ND1 3.29Å; E1107-H1246 PolarHBondContact OE2-ND1 2.82Å; D1111-H1246 VanDerWaalsContact CG-N 3.31Å; D1111-H1246 PolarHBondContact OD1-N 3.44Å; D1111-H1246 VanDerWaalsContact OD1-N 3.12Å; D1111-H1246 IonicContact OD2-CD2 3.81Å; D1111-H1246 IonicContact OD2-CG 3.32Å; D1111-H1246 PolarHBondContact OD2-N 3.48Å; D1111-H1246 IonicContact OD2-ND1 3.71Å; D1111-H1246 IonicContact OD2-NE2 3.07Å; H1246-R1248 VanDerWaalsContact C-N 3.31Å; H1246-R1248 PolarHBondContact O-N 3.29Å; H1246-Q1249 HydrophobicContact CB-CB 4.3Å; H1246-Q1249 HydrophobicContact CB-CG 4.4Å; H1246-Q1249 PolarHBondContact O-N 2.85Å; H1246-Q1249 VanDerWaalsContact O-N 3.16Å; H1246-Q1249 PolarHBondContact O-OE1 2.8Å; H1246-W1250 PolarHBondContact O-N 3.33Å; H1246-W1250 VanDerWaalsContact O-N 3.09Å
1247	F	91.2	Very high	89.6	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-49.2	-46.9	-177.1	176.7	-104.3	0	0	0	113.6	L1141 L1168 L1170 F1237 F1243 R1244 S1245 Q1249 W1250 V1251 L1358 V1359	L1141-F1247 HydrophobicContact CD1-CE1 4.4Å; L1168-F1247 HydrophobicContact CD1-CD1 4.07Å; L1168-F1247 HydrophobicContact CD2-CB 4.31Å; L1170-F1247 HydrophobicContact CD1-CD1 4.23Å; L1170-F1247 HydrophobicContact CD1-CE1 3.99Å; F1237-F1247 HydrophobicContact CE1-CE1 4.47Å; F1237-F1247 AromaticContact CE1-CZ 3.75Å; F1237-F1247 HydrophobicContact CE1-CZ 3.75Å; F1237-F1247 HydrophobicContact CZ-CE1 4.21Å; F1237-F1247 AromaticContact CZ-CZ 3.82Å; F1237-F1247 HydrophobicContact CZ-CZ 3.82Å; F1243-F1247 HydrophobicContact CB-CB 4.37Å; F1243-F1247 HydrophobicContact CD1-CB 4.43Å; F1243-F1247 AromaticContact CD1-CD1 3.85Å; F1243-F1247 HydrophobicContact CD1-CD1 3.85Å; F1243-F1247 AromaticContact CD1-CD2 3.76Å; F1243-F1247 HydrophobicContact CD1-CD2 3.76Å; F1243-F1247 AromaticContact CD1-CE1 4Å; F1243-F1247 HydrophobicContact CD1-CE1 4Å; F1243-F1247 AromaticContact CD1-CE2 3.91Å; F1243-F1247 HydrophobicContact CD1-CE2 3.91Å; F1243-F1247 AromaticContact CD1-CG 3.74Å; F1243-F1247 HydrophobicContact CD1-CG 3.74Å; F1243-F1247 HydrophobicContact CD1-CZ 4.03Å; F1243-F1247 HydrophobicContact CE1-CD1 4.22Å; F1243-F1247 AromaticContact CE1-CE1 3.97Å; F1243-F1247 HydrophobicContact CE1-CE1 3.97Å; F1243-F1247 HydrophobicContact CE1-CE2 4.33Å; F1243-F1247 HydrophobicContact CE1-CZ 4.03Å; R1244-F1247 WeakPolarHBondContact O-CA 3.44Å; R1244-F1247 WeakPolarHBondContact O-CB 3.38Å; R1244-F1247 PolarHBondContact O-N 3.42Å; R1244-F1247 VanDerWaalsContact O-N 3.11Å; S1245-F1247 VanDerWaalsContact C-N 3.32Å; F1247-Q1249 VanDerWaalsContact C-N 3.35Å; F1247-Q1249 PolarHBondContact O-N 3.07Å; F1247-W1250 PolarHBondContact O-N 3.05Å; F1247-V1251 HydrophobicContact CD1-CG2 4.36Å; F1247-V1251 HydrophobicContact CD2-CG2 4.15Å; F1247-V1251 HydrophobicContact CE1-CG2 3.88Å; F1247-V1251 HydrophobicContact CE2-CG2 3.64Å; F1247-V1251 HydrophobicContact CG-CG2 4.49Å; F1247-V1251 HydrophobicContact CZ-CG2 3.49Å; F1247-V1251 VanDerWaalsContact CZ-CG2 3.49Å; F1247-V1251 WeakPolarHBondContact O-CG2 3.25Å; F1247-V1251 PolarHBondContact O-N 2.87Å; F1247-L1358 HydrophobicContact CD2-CB 3.95Å; F1247-L1358 HydrophobicContact CE2-CB 3.87Å; F1247-V1359 HydrophobicContact CD2-CG1 4.29Å; F1247-V1359 HydrophobicContact CE2-CG1 3.74Å; F1247-V1359 HydrophobicContact CZ-CG1 4.47Å
1248	R	91.1	Very high	89.4	Confident	27 Å²	27	40.3 Å²	40.3	10%	0.102	19%	0.192	C	C	.	.	H	α-helix	trans	-58.2	-47.2	-178.9	-63.1	179.1	66.7	73.2	7.5	111.5	D1139 L1141 L1168 D1169 L1170 H1246 V1251 L1252	D1139-R1248 IonicContact OD1-CZ 2.94Å; D1139-R1248 IonicContact OD1-NH1 2.61Å; D1139-R1248 PolarHBondContact OD1-NH1 3.47Å; D1139-R1248 IonicContact OD1-NH2 3.32Å; D1139-R1248 PolarHBondContact OD1-NH2 3.43Å; D1139-R1248 IonicContact OD2-CZ 3.71Å; D1139-R1248 IonicContact OD2-NH2 3.65Å; D1139-R1248 PolarHBondContact OD2-NH2 2.99Å; L1141-R1248 HydrophobicContact CD2-CB 4.05Å; L1141-R1248 HydrophobicContact CD2-CG 4.23Å; L1168-R1248 HydrophobicContact CD2-CG 4.45Å; L1168-R1248 WeakPolarHBondContact O-CD 3.38Å; L1168-R1248 PolarHBondContact O-NH1 2.78Å; D1169-R1248 PolarHBondContact O-NH1 3.14Å; L1170-R1248 VanDerWaalsContact CD2-NH1 3.29Å; H1246-R1248 VanDerWaalsContact C-N 3.31Å; H1246-R1248 PolarHBondContact O-N 3.29Å; R1248-V1251 PolarHBondContact O-N 2.7Å; R1248-L1252 VanDerWaalsContact O-CG 3.3Å; R1248-L1252 WeakPolarHBondContact O-CG 3.39Å; R1248-L1252 PolarHBondContact O-N 2.62Å
1249	Q	88.9	Confident	89.4	Confident	60 Å²	60	42.2 Å²	42.2	28%	0.28	21%	0.206	S	C	.	.	H	α-helix	trans	-64.8	-43.7	-177.6	-61	79.1	-8.1	0	0	110.2	E1107 H1246 F1247 L1252 A1253	E1107-Q1249 PolarHBondContact OE1-NE2 2.93Å; E1107-Q1249 PolarHBondContact OE2-NE2 3.11Å; E1107-Q1249 VanDerWaalsContact OE2-NE2 3.08Å; H1246-Q1249 HydrophobicContact CB-CB 4.3Å; H1246-Q1249 HydrophobicContact CB-CG 4.4Å; H1246-Q1249 PolarHBondContact O-N 2.85Å; H1246-Q1249 VanDerWaalsContact O-N 3.16Å; H1246-Q1249 PolarHBondContact O-OE1 2.8Å; F1247-Q1249 VanDerWaalsContact C-N 3.35Å; F1247-Q1249 PolarHBondContact O-N 3.07Å; Q1249-L1252 PolarHBondContact O-N 3.26Å; Q1249-A1253 WeakPolarHBondContact O-CB 3.35Å; Q1249-A1253 PolarHBondContact O-N 2.78Å
1250	W	91.8	Very high	89.6	Confident	85 Å²	85	46.1 Å²	46.1	32%	0.322	23%	0.227	S	C	.	.	H	α-helix	trans	-63.1	-42.5	175.6	-67.8	117.6	0	0	0	112.7	S1245 H1246 F1247 L1254 M1289 L1358	S1245-W1250 VanDerWaalsContact O-CD1 3.23Å; S1245-W1250 PolarHBondContact O-NE1 2.86Å; H1246-W1250 PolarHBondContact O-N 3.33Å; H1246-W1250 VanDerWaalsContact O-N 3.09Å; F1247-W1250 PolarHBondContact O-N 3.05Å; W1250-L1254 WeakPolarHBondContact O-CB 3.43Å; W1250-L1254 PolarHBondContact O-N 2.88Å; W1250-M1289 HydrophobicContact CE3-CE 4.31Å; W1250-M1289 HydrophobicContact CE3-SD 3.4Å; W1250-M1289 HydrophobicContact CZ3-SD 3.51Å; W1250-M1289 VanDerWaalsContact CZ3-SD 3.51Å; W1250-M1289 WeakPolarHBondContact O-CE 3.39Å; W1250-L1358 HydrophobicContact CB-CD1 3.64Å; W1250-L1358 HydrophobicContact CB-CD2 3.49Å; W1250-L1358 VanDerWaalsContact CB-CD2 3.49Å; W1250-L1358 HydrophobicContact CB-CG 4.19Å; W1250-L1358 HydrophobicContact CD2-CD2 4.46Å; W1250-L1358 HydrophobicContact CG-CD2 3.84Å
1251	V	94.1	Very high	90.2	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-67.2	-40.9	177.6	171.6	0	0	0	0	111.8	L1141 F1143 I1235 F1247 R1248 L1254 A1255 L1358	L1141-V1251 HydrophobicContact CB-CG1 4.26Å; L1141-V1251 HydrophobicContact CD1-CB 3.87Å; L1141-V1251 HydrophobicContact CD1-CG1 3.63Å; L1141-V1251 HydrophobicContact CD1-CG2 4.41Å; F1143-V1251 HydrophobicContact CE2-CG1 3.88Å; F1143-V1251 HydrophobicContact CZ-CG1 4.41Å; I1235-V1251 HydrophobicContact CD1-CG1 3.91Å; F1247-V1251 HydrophobicContact CD1-CG2 4.36Å; F1247-V1251 HydrophobicContact CD2-CG2 4.15Å; F1247-V1251 HydrophobicContact CE1-CG2 3.88Å; F1247-V1251 HydrophobicContact CE2-CG2 3.64Å; F1247-V1251 HydrophobicContact CG-CG2 4.49Å; F1247-V1251 HydrophobicContact CZ-CG2 3.49Å; F1247-V1251 VanDerWaalsContact CZ-CG2 3.49Å; F1247-V1251 WeakPolarHBondContact O-CG2 3.25Å; F1247-V1251 PolarHBondContact O-N 2.87Å; R1248-V1251 PolarHBondContact O-N 2.7Å; V1251-L1254 PolarHBondContact O-N 3.01Å; V1251-A1255 WeakPolarHBondContact O-CB 3.31Å; V1251-A1255 PolarHBondContact O-N 3Å; V1251-L1358 HydrophobicContact CG2-CD1 3.67Å
1252	L	93.3	Very high	90.5	Very high	82 Å²	82	49.6 Å²	49.6	43%	0.429	24%	0.238	S	C	.	.	H	α-helix	trans	-63.3	-47.2	177.4	-72.2	169	0	0	0	111.6	L1141 R1248 Q1249 L1254 A1255 E1256	L1141-L1252 HydrophobicContact CB-CD2 4.13Å; L1141-L1252 HydrophobicContact CD2-CD1 4.27Å; L1141-L1252 HydrophobicContact CD2-CD2 4.26Å; L1141-L1252 HydrophobicContact CD2-CG 4.1Å; R1248-L1252 VanDerWaalsContact O-CG 3.3Å; R1248-L1252 WeakPolarHBondContact O-CG 3.39Å; R1248-L1252 PolarHBondContact O-N 2.62Å; Q1249-L1252 PolarHBondContact O-N 3.26Å; L1252-L1254 VanDerWaalsContact C-N 3.32Å; L1252-L1254 PolarHBondContact O-N 3.14Å; L1252-A1255 PolarHBondContact O-N 3.44Å; L1252-E1256 PolarHBondContact O-N 3.26Å
1253	A	92.2	Very high	90.8	Very high	38 Å²	38	49.3 Å²	49.3	31%	0.314	25%	0.25	S	C	.	.	H	α-helix	trans	-64.8	-35.1	175.7	0	0	0	0	0	112.3	Q1249 E1256 E1257 M1289	Q1249-A1253 WeakPolarHBondContact O-CB 3.35Å; Q1249-A1253 PolarHBondContact O-N 2.78Å; A1253-E1256 PolarHBondContact O-N 3.35Å; A1253-E1257 PolarHBondContact O-N 2.86Å; A1253-M1289 VanDerWaalsContact C-CE 3.45Å; A1253-M1289 HydrophobicContact CB-CE 3.56Å; A1253-M1289 HydrophobicContact CB-SD 4.36Å
1254	L	94	Very high	91	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-66.6	-44.1	175.6	-176.8	68.1	0	0	0	111.1	W1250 V1251 L1252 E1256 E1257 L1258 V1268 L1270 M1289 V1290 M1303 L1358	W1250-L1254 WeakPolarHBondContact O-CB 3.43Å; W1250-L1254 PolarHBondContact O-N 2.88Å; V1251-L1254 PolarHBondContact O-N 3.01Å; L1252-L1254 VanDerWaalsContact C-N 3.32Å; L1252-L1254 PolarHBondContact O-N 3.14Å; L1254-E1256 VanDerWaalsContact C-N 3.3Å; L1254-E1256 PolarHBondContact O-N 3.14Å; L1254-E1257 PolarHBondContact O-N 3.32Å; L1254-L1258 HydrophobicContact CD1-CD1 4.27Å; L1254-L1258 HydrophobicContact CD1-CG 4.49Å; L1254-L1258 HydrophobicContact CG-CD1 3.85Å; L1254-L1258 HydrophobicContact CG-CG 4.48Å; L1254-L1258 WeakPolarHBondContact O-CB 3.3Å; L1254-L1258 WeakPolarHBondContact O-CD1 3.48Å; L1254-L1258 WeakPolarHBondContact O-CG 3.14Å; L1254-L1258 PolarHBondContact O-N 3.15Å; L1254-V1268 HydrophobicContact CD2-CG1 4.49Å; L1254-L1270 HydrophobicContact CD2-CD2 3.41Å; L1254-L1270 VanDerWaalsContact CD2-CD2 3.41Å; L1254-M1289 HydrophobicContact CB-CE 3.76Å; L1254-M1289 HydrophobicContact CD1-CB 4.2Å; L1254-M1289 HydrophobicContact CD1-CE 4.48Å; L1254-V1290 HydrophobicContact CD1-CG2 3.75Å; L1254-M1303 HydrophobicContact CD2-SD 3.86Å; L1254-M1303 HydrophobicContact CG-SD 4.42Å; L1254-L1358 HydrophobicContact CD2-CD1 4.23Å
1255	A	92.9	Very high	91.5	Very high	10 Å²	10	48.8 Å²	48.8	8%	0.083	25%	0.253	C	S	.	.	H	α-helix	trans	-64	-35	176.2	0	0	0	0	0	112	F1143 V1251 L1252 T1259	F1143-A1255 HydrophobicContact CE2-CB 4.25Å; F1143-A1255 HydrophobicContact CZ-CB 4.27Å; V1251-A1255 WeakPolarHBondContact O-CB 3.31Å; V1251-A1255 PolarHBondContact O-N 3Å; L1252-A1255 PolarHBondContact O-N 3.44Å; A1255-T1259 VanDerWaalsContact O-CB 3.3Å; A1255-T1259 WeakPolarHBondContact O-CB 3.37Å; A1255-T1259 PolarHBondContact O-N 2.83Å; A1255-T1259 PolarHBondContact O-OG1 3.19Å
1256	E	92.6	Very high	92.3	Very high	125 Å²	125	46.7 Å²	46.7	58%	0.584	24%	0.238	S	C	*	.	H	α-helix	trans	-66.2	-50.6	172.6	-175.9	172.2	-168.2	0	0	111.9	L1252 A1253 L1254 L1258 T1259 N1260	L1252-E1256 PolarHBondContact O-N 3.26Å; A1253-E1256 PolarHBondContact O-N 3.35Å; L1254-E1256 VanDerWaalsContact C-N 3.3Å; L1254-E1256 PolarHBondContact O-N 3.14Å; E1256-L1258 PolarHBondContact O-N 2.91Å; E1256-T1259 PolarHBondContact O-N 3.25Å; E1256-N1260 WeakPolarHBondContact CG-ND2 3.35Å; E1256-N1260 WeakPolarHBondContact O-CB 3.38Å; E1256-N1260 VanDerWaalsContact O-CG 3.3Å; E1256-N1260 PolarHBondContact O-N 3.08Å; E1256-N1260 PolarHBondContact O-ND2 2.71Å
1257	E	93.1	Very high	92.8	Very high	24 Å²	24	43.9 Å²	43.9	11%	0.112	23%	0.225	C	C	.	.	H	α-helix	trans	-58.5	-45.4	176.3	-74.9	-163.1	165	0	0	112.2	A1253 L1254 T1259 N1260 Y1261 C1287 T1288 M1289 V1290	A1253-E1257 PolarHBondContact O-N 2.86Å; L1254-E1257 PolarHBondContact O-N 3.32Å; E1257-T1259 VanDerWaalsContact C-N 3.33Å; E1257-T1259 PolarHBondContact O-N 3.15Å; E1257-N1260 PolarHBondContact O-N 2.98Å; E1257-Y1261 HydrophobicContact CB-CD2 4.2Å; E1257-Y1261 HydrophobicContact CG-CD2 4.4Å; E1257-Y1261 HydrophobicContact CG-CE2 4.44Å; E1257-Y1261 WeakPolarHBondContact O-CB 3.3Å; E1257-Y1261 WeakPolarHBondContact O-CD2 3.28Å; E1257-Y1261 PolarHBondContact O-N 2.93Å; E1257-C1287 WeakPolarHBondContact OE2-CA 3.44Å; E1257-C1287 WeakPolarHBondContact OE2-CB 3.49Å; E1257-T1288 WeakPolarHBondContact OE1-CA 3.23Å; E1257-T1288 WeakPolarHBondContact OE1-CB 3.45Å; E1257-T1288 PolarHBondContact OE1-N 2.94Å; E1257-T1288 PolarHBondContact OE1-OG1 3.27Å; E1257-T1288 PolarHBondContact OE2-N 3.11Å; E1257-M1289 PolarHBondContact OE2-N 2.95Å; E1257-V1290 HydrophobicContact CB-CG2 4.16Å
1258	L	93.4	Very high	93.1	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-63.5	-38	178.2	-73.5	167.2	0	0	0	112.5	L1254 E1256 V1262 W1265 V1268 V1290 M1303	L1254-L1258 HydrophobicContact CD1-CD1 4.27Å; L1254-L1258 HydrophobicContact CD1-CG 4.49Å; L1254-L1258 HydrophobicContact CG-CD1 3.85Å; L1254-L1258 HydrophobicContact CG-CG 4.48Å; L1254-L1258 WeakPolarHBondContact O-CB 3.3Å; L1254-L1258 WeakPolarHBondContact O-CD1 3.48Å; L1254-L1258 WeakPolarHBondContact O-CG 3.14Å; L1254-L1258 PolarHBondContact O-N 3.15Å; E1256-L1258 PolarHBondContact O-N 2.91Å; L1258-V1262 HydrophobicContact CD2-CB 4.06Å; L1258-V1262 HydrophobicContact CD2-CG2 4.29Å; L1258-V1262 CarbonylContact O-C 3.56Å; L1258-V1262 PolarHBondContact O-N 2.87Å; L1258-W1265 HydrophobicContact CD2-CB 4.28Å; L1258-W1265 HydrophobicContact CD2-CG 4.1Å; L1258-V1268 HydrophobicContact CD1-CB 4.39Å; L1258-V1268 HydrophobicContact CD1-CG1 4.38Å; L1258-V1268 HydrophobicContact CD1-CG2 3.73Å; L1258-V1268 HydrophobicContact CD2-CG2 3.88Å; L1258-V1268 HydrophobicContact CG-CG2 4.5Å; L1258-V1290 HydrophobicContact CD2-CB 4.36Å; L1258-V1290 HydrophobicContact CD2-CG1 3.72Å; L1258-V1290 HydrophobicContact CD2-CG2 3.63Å; L1258-V1290 HydrophobicContact CG-CG2 3.79Å; L1258-M1303 HydrophobicContact CD1-CE 3.26Å; L1258-M1303 HydrophobicContact CD1-SD 3.94Å
1259	T	92.1	Very high	93.3	Very high	72 Å²	72	42.6 Å²	42.6	44%	0.442	22%	0.221	S	C	.	.	H	α-helix	trans	-68.2	-38.4	176.3	-57.9	0	0	0	0	111.4	R1233 A1255 E1256 E1257	R1233-T1259 PolarHBondContact NH1-OG1 3.3Å; R1233-T1259 VanDerWaalsContact NH1-OG1 3.09Å; A1255-T1259 VanDerWaalsContact O-CB 3.3Å; A1255-T1259 WeakPolarHBondContact O-CB 3.37Å; A1255-T1259 PolarHBondContact O-N 2.83Å; A1255-T1259 PolarHBondContact O-OG1 3.19Å; E1256-T1259 PolarHBondContact O-N 3.25Å; E1257-T1259 VanDerWaalsContact C-N 3.33Å; E1257-T1259 PolarHBondContact O-N 3.15Å
1260	N	92.2	Very high	93.5	Very high	94 Å²	94	39.8 Å²	39.8	50%	0.503	21%	0.207	S	C	.	.	H	α-helix	trans	-84.4	-33.1	-174.5	-70.9	-27.1	0	0	0	114	E1256 E1257	E1256-N1260 WeakPolarHBondContact CG-ND2 3.35Å; E1256-N1260 WeakPolarHBondContact O-CB 3.38Å; E1256-N1260 VanDerWaalsContact O-CG 3.3Å; E1256-N1260 PolarHBondContact O-N 3.08Å; E1256-N1260 PolarHBondContact O-ND2 2.71Å; E1257-N1260 PolarHBondContact O-N 2.98Å
1261	Y	92.5	Very high	93.3	Very high	118 Å²	118	35.7 Å²	35.7	46%	0.463	19%	0.192	S	C	.	.	H	α-helix	trans	-123.6	-21.8	-167.7	-55.8	-58.6	0	0	0	115.1	E1257 P1263 N1286 C1287	E1257-Y1261 HydrophobicContact CB-CD2 4.2Å; E1257-Y1261 HydrophobicContact CG-CD2 4.4Å; E1257-Y1261 HydrophobicContact CG-CE2 4.44Å; E1257-Y1261 WeakPolarHBondContact O-CB 3.3Å; E1257-Y1261 WeakPolarHBondContact O-CD2 3.28Å; E1257-Y1261 PolarHBondContact O-N 2.93Å; Y1261-P1263 VanDerWaalsContact C-CD 3.43Å; Y1261-N1286 HydrophobicContact CD1-CB 3.73Å; Y1261-N1286 HydrophobicContact CE1-CB 3.9Å; Y1261-N1286 WeakPolarHBondContact CE2-O 3.49Å; Y1261-N1286 HydrophobicContact CG-CB 4.07Å; Y1261-C1287 VanDerWaalsContact CB-SG 3.59Å
1262	V	91.4	Very high	92.9	Very high	2 Å²	2	36.1 Å²	36.1	1%	0.012	19%	0.193	C	C	.	.			trans	-130.9	47.5	-176.5	-157.9	0	0	0	0	111.4	L1258 D1264 W1265 V1284 C1287 V1290 Y1352	L1258-V1262 HydrophobicContact CD2-CB 4.06Å; L1258-V1262 HydrophobicContact CD2-CG2 4.29Å; L1258-V1262 CarbonylContact O-C 3.56Å; L1258-V1262 PolarHBondContact O-N 2.87Å; V1262-D1264 PolarHBondContact O-N 2.85Å; V1262-W1265 HydrophobicContact CG1-CB 4.24Å; V1262-W1265 PolarHBondContact O-N 2.75Å; V1262-V1284 HydrophobicContact CG2-CB 4.39Å; V1262-V1284 HydrophobicContact CG2-CG1 3.81Å; V1262-C1287 VanDerWaalsContact CG2-SG 3.55Å; V1262-V1290 HydrophobicContact CG2-CG1 4.35Å; V1262-Y1352 HydrophobicContact CG1-CD1 4.38Å; V1262-Y1352 HydrophobicContact CG1-CD2 4.1Å; V1262-Y1352 HydrophobicContact CG1-CE1 3.8Å; V1262-Y1352 HydrophobicContact CG1-CE2 3.51Å; V1262-Y1352 WeakPolarHBondContact CG1-OH 3.11Å
1263	P	90.7	Very high	92	Very high	102 Å²	102	36.4 Å²	36.4	66%	0.662	19%	0.191	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63	-11	-167.8	29.1	-38.2	0	0	0	114.5	Y1261	Y1261-P1263 VanDerWaalsContact C-CD 3.43Å
1264	D	92.5	Very high	90.9	Very high	71 Å²	71	38.3 Å²	38.3	38%	0.38	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.5	27.1	173.3	72.1	-42.7	0	0	0	113.6	V1262 R1307 N1350	V1262-D1264 PolarHBondContact O-N 2.85Å; D1264-R1307 PolarHBondContact O-NH2 3.3Å; D1264-N1350 VanDerWaalsContact O-CB 3.24Å; D1264-N1350 WeakPolarHBondContact O-CB 3.46Å; D1264-N1350 PolarHBondContact O-ND2 2.92Å; D1264-N1350 PolarHBondContact OD2-ND2 3.33Å
1265	W	95.6	Very high	89.5	Confident	11 Å²	11	40.5 Å²	40.5	4%	0.042	21%	0.205	C	C	.	.			trans	-66.5	142	166.5	73.3	-93.7	0	0	0	112	R1233 L1258 V1262 V1268 M1303 T1305 Y1352	R1233-W1265 HydrophobicContact CG-CZ2 4.18Å; L1258-W1265 HydrophobicContact CD2-CB 4.28Å; L1258-W1265 HydrophobicContact CD2-CG 4.1Å; V1262-W1265 HydrophobicContact CG1-CB 4.24Å; V1262-W1265 PolarHBondContact O-N 2.75Å; W1265-V1268 HydrophobicContact CB-CG2 4.3Å; W1265-V1268 HydrophobicContact CD2-CG2 3.9Å; W1265-V1268 HydrophobicContact CE3-CG2 3.57Å; W1265-V1268 HydrophobicContact CG-CG2 4.24Å; W1265-V1268 HydrophobicContact CZ3-CG2 4.14Å; W1265-M1303 HydrophobicContact CH2-CB 3.69Å; W1265-M1303 HydrophobicContact CH2-CE 3.55Å; W1265-M1303 HydrophobicContact CZ2-CE 3.49Å; W1265-M1303 VanDerWaalsContact CZ2-CE 3.49Å; W1265-M1303 HydrophobicContact CZ3-CB 3.7Å; W1265-M1303 HydrophobicContact CZ3-CE 4.21Å; W1265-T1305 HydrophobicContact CD2-CG2 3.72Å; W1265-T1305 HydrophobicContact CE3-CG2 3.58Å; W1265-T1305 HydrophobicContact CH2-CG2 3.52Å; W1265-T1305 HydrophobicContact CZ2-CG2 3.66Å; W1265-T1305 HydrophobicContact CZ3-CG2 3.48Å; W1265-T1305 VanDerWaalsContact CZ3-CG2 3.48Å; W1265-T1305 VanDerWaalsContact O-CG2 3.31Å; W1265-T1305 WeakPolarHBondContact O-CG2 3.1Å; W1265-T1305 PolarHBondContact O-OG1 3.02Å; W1265-Y1352 HydrophobicContact CB-CD2 3.82Å; W1265-Y1352 HydrophobicContact CB-CE2 3.94Å
1266	D	97.3	Very high	87.8	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	22%	0.224	C	C	.	.			trans	-108	-42.7	173.6	-71.9	-41.3	0	0	0	111.7	L1304 T1305 R1307 K1311 L1349 N1350	D1266-L1304 WeakPolarHBondContact O-CA 3.38Å; D1266-T1305 PolarHBondContact O-N 3.11Å; D1266-R1307 VanDerWaalsContact CG-NH2 3.33Å; D1266-R1307 IonicContact OD1-CZ 3.49Å; D1266-R1307 IonicContact OD1-NE 3.71Å; D1266-R1307 PolarHBondContact OD1-NE 3.2Å; D1266-R1307 IonicContact OD1-NH2 2.7Å; D1266-R1307 PolarHBondContact OD1-NH2 3.32Å; D1266-R1307 IonicContact OD2-NH2 3.95Å; D1266-K1311 IonicContact OD1-NZ 2.71Å; D1266-K1311 WeakPolarHBondContact OD2-CD 3.33Å; D1266-K1311 IonicContact OD2-NZ 3.22Å; D1266-K1311 PolarHBondContact OD2-NZ 3.25Å; D1266-L1349 HydrophobicContact CB-CD1 3.65Å; D1266-L1349 HydrophobicContact CB-CG 4.07Å; D1266-N1350 HydrophobicContact CB-CB 4.27Å; D1266-N1350 PolarHBondContact N-O 3.28Å; D1266-N1350 WeakPolarHBondContact OD2-CB 3.42Å; D1266-N1350 PolarHBondContact OD2-N 2.77Å
1267	L	96.9	Very high	85.7	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	140.5	179.7	-176.9	150	0	0	0	110.2	Y1269 Y1302 M1303 L1304 L1328 L1349 N1350 A1351 Y1352	L1267-Y1269 HydrophobicContact CD2-CD2 3.59Å; L1267-Y1269 HydrophobicContact CD2-CE2 3.57Å; L1267-Y1269 HydrophobicContact CD2-CG 4.12Å; L1267-Y1302 HydrophobicContact CD1-CD2 3.85Å; L1267-Y1302 HydrophobicContact CD1-CE2 4.33Å; L1267-Y1302 HydrophobicContact CD1-CG 4.19Å; L1267-Y1302 HydrophobicContact CG-CD2 4.05Å; L1267-Y1302 HydrophobicContact CG-CG 4.32Å; L1267-M1303 CarbonylContact C-O 3.59Å; L1267-M1303 VanDerWaalsContact CA-O 3.29Å; L1267-M1303 WeakPolarHBondContact CA-O 3.38Å; L1267-L1304 HydrophobicContact CB-CD1 4.31Å; L1267-L1304 HydrophobicContact CD1-CD1 4.25Å; L1267-L1328 HydrophobicContact CD1-CD1 4.12Å; L1267-L1328 HydrophobicContact CD1-CD2 3.94Å; L1267-L1349 HydrophobicContact CB-CD2 4.25Å; L1267-L1349 HydrophobicContact CD1-CD2 4.4Å; L1267-N1350 PolarHBondContact N-O 2.97Å; L1267-A1351 HydrophobicContact CB-CB 4.45Å; L1267-A1351 HydrophobicContact CD2-CB 4.33Å; L1267-A1351 CarbonylContact O-C 3.54Å; L1267-A1351 VanDerWaalsContact O-CA 3.29Å; L1267-A1351 WeakPolarHBondContact O-CA 3.37Å; L1267-Y1352 PolarHBondContact O-N 3.35Å
1268	V	96.3	Very high	83.3	Confident	0 Å²	0	53 Å²	53	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	114.6	171.7	-169.3	0	0	0	0	110.4	L1254 L1258 W1265 L1270 Y1302 M1303 Y1352	L1254-V1268 HydrophobicContact CD2-CG1 4.49Å; L1258-V1268 HydrophobicContact CD1-CB 4.39Å; L1258-V1268 HydrophobicContact CD1-CG1 4.38Å; L1258-V1268 HydrophobicContact CD1-CG2 3.73Å; L1258-V1268 HydrophobicContact CD2-CG2 3.88Å; L1258-V1268 HydrophobicContact CG-CG2 4.5Å; W1265-V1268 HydrophobicContact CB-CG2 4.3Å; W1265-V1268 HydrophobicContact CD2-CG2 3.9Å; W1265-V1268 HydrophobicContact CE3-CG2 3.57Å; W1265-V1268 HydrophobicContact CG-CG2 4.24Å; W1265-V1268 HydrophobicContact CZ3-CG2 4.14Å; V1268-L1270 PolarHBondContact O-N 3.05Å; V1268-Y1302 CarbonylContact O-C 3.31Å; V1268-Y1302 WeakPolarHBondContact O-CA 3.41Å; V1268-Y1302 WeakPolarHBondContact O-CB 3.46Å; V1268-M1303 HydrophobicContact CB-CB 4.14Å; V1268-M1303 HydrophobicContact CB-SD 4.27Å; V1268-M1303 HydrophobicContact CG2-CE 4.5Å; V1268-M1303 PolarHBondContact N-O 2.98Å; V1268-M1303 PolarHBondContact O-N 3.34Å; V1268-Y1352 CarbonylContact C-O 3.06Å; V1268-Y1352 WeakPolarHBondContact CA-O 3.5Å
1269	Y	94.7	Very high	81.2	Confident	1 Å²	1	59.1 Å²	59.1	0%	0.004	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	128.3	174.3	-73.5	-84.9	0	0	0	111.3	L1267 R1272 V1293 T1299 L1328 F1332 Y1352 T1353 S1354	L1267-Y1269 HydrophobicContact CD2-CD2 3.59Å; L1267-Y1269 HydrophobicContact CD2-CE2 3.57Å; L1267-Y1269 HydrophobicContact CD2-CG 4.12Å; Y1269-R1272 HydrophobicContact CD1-CB 3.99Å; Y1269-R1272 HydrophobicContact CD1-CG 4.03Å; Y1269-R1272 HydrophobicContact CE1-CB 4.42Å; Y1269-R1272 HydrophobicContact CG-CG 4.12Å; Y1269-V1293 HydrophobicContact CD2-CB 4.44Å; Y1269-V1293 HydrophobicContact CD2-CG2 3.81Å; Y1269-V1293 HydrophobicContact CE2-CG2 3.93Å; Y1269-T1299 HydrophobicContact CE1-CG2 3.9Å; Y1269-L1328 WeakPolarHBondContact OH-CB 3.39Å; Y1269-F1332 AromaticContact CE2-CE1 3.78Å; Y1269-F1332 HydrophobicContact CE2-CE1 3.78Å; Y1269-F1332 AromaticContact CE2-CZ 3.99Å; Y1269-F1332 HydrophobicContact CE2-CZ 3.99Å; Y1269-Y1352 PolarHBondContact N-O 3.36Å; Y1269-T1353 CarbonylContact O-C 3.59Å; Y1269-T1353 WeakPolarHBondContact O-CA 3.49Å; Y1269-S1354 PolarHBondContact O-N 3.25Å
1270	L	94	Very high	79.2	Confident	0 Å²	0	61.3 Å²	61.3	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	-24.7	170.7	-58.4	-174.6	0	0	0	111.8	I1235 L1254 V1268 A1301 M1303 L1357 L1358 V1359	I1235-L1270 HydrophobicContact CD1-CD1 4.18Å; I1235-L1270 HydrophobicContact CG2-CD1 3.62Å; L1254-L1270 HydrophobicContact CD2-CD2 3.41Å; L1254-L1270 VanDerWaalsContact CD2-CD2 3.41Å; V1268-L1270 PolarHBondContact O-N 3.05Å; L1270-A1301 HydrophobicContact CB-CB 4.07Å; L1270-A1301 PolarHBondContact N-O 3.06Å; L1270-M1303 HydrophobicContact CD1-CG 4.08Å; L1270-M1303 HydrophobicContact CD2-CG 4.09Å; L1270-M1303 HydrophobicContact CD2-SD 3.92Å; L1270-M1303 HydrophobicContact CG-CG 4.16Å; L1270-L1357 CarbonylContact O-C 3.49Å; L1270-L1358 HydrophobicContact CD2-CD1 4.34Å; L1270-L1358 PolarHBondContact O-N 3.35Å; L1270-V1359 PolarHBondContact O-N 3.08Å
1271	G	87.7	Confident	78	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155	135.4	173.8	0	0	0	0	0	111.3	L1300 A1301 V1359	G1271-L1300 PolarHBondContact O-N 3.25Å; G1271-A1301 PolarHBondContact N-O 3.25Å; G1271-A1301 VanDerWaalsContact N-O 3.16Å; G1271-A1301 PolarHBondContact O-N 3.28Å; G1271-V1359 WeakPolarHBondContact CA-O 3.14Å
1272	R	84.9	Confident	77.2	Confident	9 Å²	9	56 Å²	56	3%	0.034	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-169.5	172.3	177.4	52.5	167.4	175.6	103.2	30.8	112.3	Y1269 E1281 S1296 W1298 T1353 L1357	Y1269-R1272 HydrophobicContact CD1-CB 3.99Å; Y1269-R1272 HydrophobicContact CD1-CG 4.03Å; Y1269-R1272 HydrophobicContact CE1-CB 4.42Å; Y1269-R1272 HydrophobicContact CG-CG 4.12Å; R1272-E1281 IonicContact CZ-OE1 2.65Å; R1272-E1281 IonicContact CZ-OE2 3.93Å; R1272-E1281 IonicContact NH1-OE1 2.63Å; R1272-E1281 PolarHBondContact NH1-OE1 2.98Å; R1272-E1281 IonicContact NH1-OE2 2.82Å; R1272-E1281 IonicContact NH2-OE1 3.64Å; R1272-E1281 PolarHBondContact NH2-OE1 3.41Å; R1272-E1281 IonicContact NH2-OE2 3.28Å; R1272-E1281 PolarHBondContact NH2-OE2 3.3Å; R1272-S1296 VanDerWaalsContact CD-OG 3.25Å; R1272-S1296 WeakPolarHBondContact CD-OG 3.49Å; R1272-S1296 PolarHBondContact NH1-OG 2.93Å; R1272-W1298 WeakPolarHBondContact CA-O 3.44Å; R1272-W1298 VanDerWaalsContact CB-O 3.26Å; R1272-W1298 WeakPolarHBondContact CB-O 3.19Å; R1272-T1353 PolarHBondContact NE-OG1 3.4Å; R1272-T1353 VanDerWaalsContact NH2-CB 3.27Å; R1272-T1353 PolarHBondContact NH2-OG1 3.28Å; R1272-L1357 HydrophobicContact CG-CD1 4.43Å; R1272-L1357 HydrophobicContact CG-CD2 4.21Å; R1272-L1357 VanDerWaalsContact O-CD1 3.31Å; R1272-L1357 WeakPolarHBondContact O-CD1 3.15Å
1273	K	75.1	Confident	76.9	Confident	87 Å²	87	59.7 Å²	59.7	38%	0.378	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	101.7	173.9	-172.6	-179.5	-176.5	178.9	0	111.3	L1275 S1296 Y1297 W1298	K1273-L1275 PolarHBondContact O-N 2.93Å; K1273-S1296 WeakPolarHBondContact O-CA 3.35Å; K1273-S1296 VanDerWaalsContact O-CB 3.24Å; K1273-S1296 WeakPolarHBondContact O-CB 2.76Å; K1273-Y1297 WeakPolarHBondContact CA-O 3.36Å; K1273-Y1297 WeakPolarHBondContact CB-O 3.43Å; K1273-Y1297 PolarHBondContact N-O 3.44Å; K1273-Y1297 PolarHBondContact O-N 2.92Å; K1273-Y1297 VanDerWaalsContact O-N 3.08Å; K1273-W1298 HydrophobicContact CB-CB 4.11Å; K1273-W1298 HydrophobicContact CB-CD2 4.03Å; K1273-W1298 HydrophobicContact CB-CE3 3.93Å; K1273-W1298 HydrophobicContact CB-CG 4.12Å; K1273-W1298 HydrophobicContact CD-CD2 3.68Å; K1273-W1298 HydrophobicContact CD-CE3 3.69Å; K1273-W1298 HydrophobicContact CD-CG 4.33Å; K1273-W1298 HydrophobicContact CD-CH2 4.02Å; K1273-W1298 HydrophobicContact CD-CZ2 3.99Å; K1273-W1298 HydrophobicContact CD-CZ3 3.86Å; K1273-W1298 HydrophobicContact CG-CD2 4.5Å; K1273-W1298 HydrophobicContact CG-CE3 4.3Å
1274	Q	69.9	Low	76.6	Confident	79 Å²	79	55.5 Å²	55.5	37%	0.369	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.2	128.3	166.3	-68.5	161.3	-27.4	0	0	109.7	E1281	Q1274-E1281 PolarHBondContact NE2-OE2 3.5Å
1275	L	63.8	Low	76	Confident	46 Å²	46	58 Å²	58	24%	0.241	29%	0.289	C	S	.	.	S	Bend	trans	-82.5	-51.8	177.3	-74	161.3	0	0	0	112	Y1203 K1273 K1277 Y1295 Y1297	Y1203-L1275 VanDerWaalsContact OH-CD2 3.26Å; Y1203-L1275 WeakPolarHBondContact OH-CD2 2.81Å; K1273-L1275 PolarHBondContact O-N 2.93Å; L1275-K1277 PolarHBondContact O-N 3.31Å; L1275-Y1295 HydrophobicContact CD1-CD1 3.22Å; L1275-Y1295 HydrophobicContact CD1-CE1 3.29Å; L1275-Y1295 HydrophobicContact CD1-CG 3.98Å; L1275-Y1297 HydrophobicContact CD1-CD2 3.57Å; L1275-Y1297 HydrophobicContact CD1-CE2 3.56Å; L1275-Y1297 HydrophobicContact CD2-CD2 3.7Å; L1275-Y1297 HydrophobicContact CD2-CE2 3.94Å; L1275-Y1297 HydrophobicContact CG-CD2 3.82Å; L1275-Y1297 HydrophobicContact CG-CE2 4.18Å
1276	N	57	Low	75.5	Confident	88 Å²	88	63.5 Å²	63.5	47%	0.471	32%	0.319	S	S	.	.			trans	-90.4	81.5	-177.5	-66.2	-10.9	0	0	0	109.4	D1278 E1279	N1276-D1278 PolarHBondContact O-N 3.18Å; N1276-D1278 VanDerWaalsContact O-N 3.11Å; N1276-E1279 HydrophobicContact CB-CB 3.92Å; N1276-E1279 HydrophobicContact CB-CG 3.94Å; N1276-E1279 WeakPolarHBondContact CB-OE2 2.94Å; N1276-E1279 PolarHBondContact ND2-OE2 3.27Å; N1276-E1279 PolarHBondContact O-N 2.91Å
1277	K	48.8	Very low	74.9	Confident	179 Å²	179	63.9 Å²	63.9	78%	0.778	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	-24.2	177	-72.4	-175.1	177.6	178.9	0	113.7	L1275	L1275-K1277 PolarHBondContact O-N 3.31Å
1278	D	41.8	Very low	74.4	Confident	155 Å²	155	68.5 Å²	68.5	83%	0.829	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.8	-20.6	179	-57.9	-43.5	0	0	0	113.1	N1276 Q1280	N1276-D1278 PolarHBondContact O-N 3.18Å; N1276-D1278 VanDerWaalsContact O-N 3.11Å; D1278-Q1280 PolarHBondContact O-N 3.41Å; D1278-Q1280 VanDerWaalsContact O-N 3.09Å
1279	E	50.7	Low	74	Confident	128 Å²	128	69.2 Å²	69.2	60%	0.598	35%	0.354	S	S	*	.	S	Bend	trans	-82.4	84.5	171.8	-71.5	-171.5	136	0	0	109.7	N1276 E1281	N1276-E1279 HydrophobicContact CB-CB 3.92Å; N1276-E1279 HydrophobicContact CB-CG 3.94Å; N1276-E1279 WeakPolarHBondContact CB-OE2 2.94Å; N1276-E1279 PolarHBondContact ND2-OE2 3.27Å; N1276-E1279 PolarHBondContact O-N 2.91Å; E1279-E1281 PolarHBondContact O-N 3.42Å
1280	Q	49	Very low	73.8	Confident	118 Å²	118	69.2 Å²	69.2	55%	0.551	35%	0.354	S	S	*	.			trans	-52.7	108.1	168.2	-78	-178.4	-33	0	0	110.5	K509 D1278 S1282	K509-Q1280 VanDerWaalsContact NZ-OE1 3.09Å; D1278-Q1280 PolarHBondContact O-N 3.41Å; D1278-Q1280 VanDerWaalsContact O-N 3.09Å; Q1280-S1282 PolarHBondContact O-N 2.91Å
1281	E	67.6	Low	73.5	Confident	35 Å²	35	69.2 Å²	69.2	16%	0.164	35%	0.354	C	S	.	.	P	Polyproline II helix	trans	-58.4	118.2	173.7	-73.9	177.9	145.9	0	0	109.9	R1272 Q1274 E1279 L1283 R1292 G1294	R1272-E1281 IonicContact CZ-OE1 2.65Å; R1272-E1281 IonicContact CZ-OE2 3.93Å; R1272-E1281 IonicContact NH1-OE1 2.63Å; R1272-E1281 PolarHBondContact NH1-OE1 2.98Å; R1272-E1281 IonicContact NH1-OE2 2.82Å; R1272-E1281 IonicContact NH2-OE1 3.64Å; R1272-E1281 PolarHBondContact NH2-OE1 3.41Å; R1272-E1281 IonicContact NH2-OE2 3.28Å; R1272-E1281 PolarHBondContact NH2-OE2 3.3Å; Q1274-E1281 PolarHBondContact NE2-OE2 3.5Å; E1279-E1281 PolarHBondContact O-N 3.42Å; E1281-L1283 PolarHBondContact O-N 2.96Å; E1281-R1292 WeakPolarHBondContact CB-O 2.94Å; E1281-R1292 WeakPolarHBondContact CG-O 3.45Å; E1281-G1294 PolarHBondContact OE1-N 3.31Å
1282	S	75.1	Confident	73.6	Confident	64 Å²	64	75.1 Å²	75.1	45%	0.448	38%	0.376	S	S	.	.	P	Polyproline II helix	trans	-67.6	125.3	-177.4	59.4	0	0	0	0	109.7	Q1280 R1292	Q1280-S1282 PolarHBondContact O-N 2.91Å; S1282-R1292 PolarHBondContact O-N 3.36Å; S1282-R1292 WeakPolarHBondContact OG-CD 3.1Å
1283	L	85.2	Confident	73.7	Confident	80 Å²	80	75.2 Å²	75.2	42%	0.419	38%	0.378	S	S	.	.	B	Isolated β-bridge	trans	-52.5	143.5	165.8	-70.9	172.8	0	0	0	110.4	E1281 V1290 V1355	E1281-L1283 PolarHBondContact O-N 2.96Å; L1283-V1290 CarbonylContact C-O 3.58Å; L1283-V1290 WeakPolarHBondContact CA-O 3.39Å; L1283-V1290 WeakPolarHBondContact CD2-O 3.14Å; L1283-V1355 HydrophobicContact CD2-CB 3.9Å; L1283-V1355 HydrophobicContact CD2-CG1 4.13Å; L1283-V1355 HydrophobicContact CD2-CG2 4.25Å
1284	V	85.7	Confident	74.1	Confident	15 Å²	15	71.9 Å²	71.9	9%	0.091	37%	0.368	C	S	.	.	P	Polyproline II helix	trans	-73.1	141.2	172.6	-176.7	0	0	0	0	108.5	V1262 N1286 C1287 V1290 R1292 Y1352	V1262-V1284 HydrophobicContact CG2-CB 4.39Å; V1262-V1284 HydrophobicContact CG2-CG1 3.81Å; V1284-N1286 PolarHBondContact O-N 3.05Å; V1284-C1287 HydrophobicContact CB-CB 4.23Å; V1284-C1287 WeakPolarHBondContact O-CB 3.3Å; V1284-C1287 PolarHBondContact O-N 3.33Å; V1284-V1290 HydrophobicContact CB-CB 4.4Å; V1284-V1290 HydrophobicContact CB-CG1 4.41Å; V1284-V1290 HydrophobicContact CG2-CB 4.26Å; V1284-V1290 HydrophobicContact CG2-CG1 3.81Å; V1284-V1290 PolarHBondContact N-O 2.86Å; V1284-R1292 HydrophobicContact CG2-CG 4.18Å; V1284-Y1352 HydrophobicContact CG2-CD1 3.51Å; V1284-Y1352 HydrophobicContact CG2-CE1 3.59Å
1285	D	79	Confident	74.7	Confident	122 Å²	122	69.9 Å²	69.9	65%	0.652	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.9	129.6	-177.3	-64.8	-40.6	0	0	0	111.3	C1287	D1285-C1287 PolarHBondContact O-N 3.23Å
1286	N	84.8	Confident	75	Confident	127 Å²	127	67.8 Å²	67.8	68%	0.679	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.4	-2.1	-175.4	-39.5	-76.2	0	0	0	116.8	Y1261 V1284	Y1261-N1286 HydrophobicContact CD1-CB 3.73Å; Y1261-N1286 HydrophobicContact CE1-CB 3.9Å; Y1261-N1286 WeakPolarHBondContact CE2-O 3.49Å; Y1261-N1286 HydrophobicContact CG-CB 4.07Å; V1284-N1286 PolarHBondContact O-N 3.05Å
1287	C	85.5	Confident	75.6	Confident	8 Å²	8	64.4 Å²	64.4	5%	0.054	33%	0.327	C	S	.	.			trans	-93.4	138.1	172	-54.6	0	0	0	0	110.2	E1257 Y1261 V1262 V1284 D1285 V1290	E1257-C1287 WeakPolarHBondContact OE2-CA 3.44Å; E1257-C1287 WeakPolarHBondContact OE2-CB 3.49Å; Y1261-C1287 VanDerWaalsContact CB-SG 3.59Å; V1262-C1287 VanDerWaalsContact CG2-SG 3.55Å; V1284-C1287 HydrophobicContact CB-CB 4.23Å; V1284-C1287 WeakPolarHBondContact O-CB 3.3Å; V1284-C1287 PolarHBondContact O-N 3.33Å; D1285-C1287 PolarHBondContact O-N 3.23Å; C1287-V1290 HydrophobicContact CB-CB 3.63Å; C1287-V1290 HydrophobicContact CB-CG2 3.86Å
1288	T	86	Confident	76.5	Confident	98 Å²	98	61.1 Å²	61.1	60%	0.601	31%	0.31	S	S	*	.	S	Bend	trans	-92.7	-18.2	170.9	67.7	0	0	0	0	112.3	E1257	E1257-T1288 WeakPolarHBondContact OE1-CA 3.23Å; E1257-T1288 WeakPolarHBondContact OE1-CB 3.45Å; E1257-T1288 PolarHBondContact OE1-N 2.94Å; E1257-T1288 PolarHBondContact OE1-OG1 3.27Å; E1257-T1288 PolarHBondContact OE2-N 3.11Å
1289	M	87	Confident	78.3	Confident	15 Å²	15	53.9 Å²	53.9	7%	0.074	27%	0.272	C	S	.	.	S	Bend	trans	-130.3	-6.1	-172.5	-42.8	-165.7	-44.2	0	0	114.7	W1250 A1253 L1254 E1257 S1354 V1355	W1250-M1289 HydrophobicContact CE3-CE 4.31Å; W1250-M1289 HydrophobicContact CE3-SD 3.4Å; W1250-M1289 HydrophobicContact CZ3-SD 3.51Å; W1250-M1289 VanDerWaalsContact CZ3-SD 3.51Å; W1250-M1289 WeakPolarHBondContact O-CE 3.39Å; A1253-M1289 VanDerWaalsContact C-CE 3.45Å; A1253-M1289 HydrophobicContact CB-CE 3.56Å; A1253-M1289 HydrophobicContact CB-SD 4.36Å; L1254-M1289 HydrophobicContact CB-CE 3.76Å; L1254-M1289 HydrophobicContact CD1-CB 4.2Å; L1254-M1289 HydrophobicContact CD1-CE 4.48Å; E1257-M1289 PolarHBondContact OE2-N 2.95Å; M1289-S1354 CarbonylContact O-C 3.19Å; M1289-S1354 VanDerWaalsContact O-CA 3.32Å; M1289-S1354 WeakPolarHBondContact O-CA 3.42Å; M1289-V1355 WeakPolarHBondContact CA-O 3.38Å; M1289-V1355 PolarHBondContact O-N 3.34Å
1290	V	91.5	Very high	80	Confident	0 Å²	0	48 Å²	48	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	121.1	174.4	-169	0	0	0	0	109.6	L1254 E1257 L1258 V1262 L1283 V1284 C1287 Y1352	L1254-V1290 HydrophobicContact CD1-CG2 3.75Å; E1257-V1290 HydrophobicContact CB-CG2 4.16Å; L1258-V1290 HydrophobicContact CD2-CB 4.36Å; L1258-V1290 HydrophobicContact CD2-CG1 3.72Å; L1258-V1290 HydrophobicContact CD2-CG2 3.63Å; L1258-V1290 HydrophobicContact CG-CG2 3.79Å; V1262-V1290 HydrophobicContact CG2-CG1 4.35Å; L1283-V1290 CarbonylContact C-O 3.58Å; L1283-V1290 WeakPolarHBondContact CA-O 3.39Å; L1283-V1290 WeakPolarHBondContact CD2-O 3.14Å; V1284-V1290 HydrophobicContact CB-CB 4.4Å; V1284-V1290 HydrophobicContact CB-CG1 4.41Å; V1284-V1290 HydrophobicContact CG2-CB 4.26Å; V1284-V1290 HydrophobicContact CG2-CG1 3.81Å; V1284-V1290 PolarHBondContact N-O 2.86Å; C1287-V1290 HydrophobicContact CB-CB 3.63Å; C1287-V1290 HydrophobicContact CB-CG2 3.86Å; V1290-Y1352 HydrophobicContact CG1-CD1 4.03Å; V1290-Y1352 HydrophobicContact CG1-CG 4.1Å
1291	G	88.6	Confident	82.2	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	155.8	172.8	0	0	0	0	0	113	Y1352 T1353	G1291-Y1352 WeakPolarHBondContact O-CA 3.23Å; G1291-Y1352 WeakPolarHBondContact O-CB 3.39Å; G1291-T1353 PolarHBondContact N-O 3.12Å; G1291-T1353 PolarHBondContact O-N 3.45Å
1292	R	88.3	Confident	83.5	Confident	125 Å²	125	40.9 Å²	40.9	47%	0.472	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	126.6	163.8	-62.4	-173.7	-174.7	-88.2	-3.5	108.8	E1281 S1282 V1284	E1281-R1292 WeakPolarHBondContact CB-O 2.94Å; E1281-R1292 WeakPolarHBondContact CG-O 3.45Å; S1282-R1292 PolarHBondContact O-N 3.36Å; S1282-R1292 WeakPolarHBondContact OG-CD 3.1Å; V1284-R1292 HydrophobicContact CG2-CG 4.18Å
1293	V	87.6	Confident	84.6	Confident	10 Å²	10	37.9 Å²	37.9	6%	0.061	19%	0.19	C	C	.	.			trans	-80.2	130.1	-179.2	56.2	0	0	0	0	111.4	Y1269 F1332 A1351 T1353	Y1269-V1293 HydrophobicContact CD2-CB 4.44Å; Y1269-V1293 HydrophobicContact CD2-CG2 3.81Å; Y1269-V1293 HydrophobicContact CE2-CG2 3.93Å; V1293-F1332 HydrophobicContact CB-CE2 4.41Å; V1293-F1332 HydrophobicContact CG1-CD2 4.01Å; V1293-F1332 HydrophobicContact CG1-CE1 4.47Å; V1293-F1332 HydrophobicContact CG1-CE2 3.65Å; V1293-F1332 HydrophobicContact CG1-CZ 3.91Å; V1293-F1332 HydrophobicContact CG2-CE2 4.01Å; V1293-F1332 HydrophobicContact CG2-CZ 3.82Å; V1293-A1351 VanDerWaalsContact CG1-C 3.48Å; V1293-A1351 HydrophobicContact CG1-CB 3.61Å; V1293-A1351 WeakPolarHBondContact CG1-O 3.5Å; V1293-T1353 HydrophobicContact CB-CG2 4.37Å
1294	G	83.2	Confident	85.2	Confident	18 Å²	18	34 Å²	34	19%	0.186	17%	0.17	C	C	.	.			trans	-90.2	-169	167.4	0	0	0	0	0	112.6	E1281	E1281-G1294 PolarHBondContact OE1-N 3.31Å
1295	Y	81.9	Confident	85.8	Confident	37 Å²	37	34.2 Å²	34.2	15%	0.145	17%	0.171	C	C	.	.	S	Bend	trans	-67	138.6	173.9	-176.5	-133.1	0	0	0	112.3	L1275 Y1297 E1326 P1329 H1335 P1336	L1275-Y1295 HydrophobicContact CD1-CD1 3.22Å; L1275-Y1295 HydrophobicContact CD1-CE1 3.29Å; L1275-Y1295 HydrophobicContact CD1-CG 3.98Å; Y1295-Y1297 HydrophobicContact CE1-CE2 4.12Å; Y1295-Y1297 AromaticContact CZ-CE2 3.95Å; Y1295-Y1297 AromaticContact CZ-CZ 3.99Å; Y1295-Y1297 VanDerWaalsContact OH-CZ 3.26Å; Y1295-Y1297 PolarHBondContact OH-OH 3.13Å; Y1295-E1326 WeakPolarHBondContact CE2-OE2 3.25Å; Y1295-E1326 PolarHBondContact OH-OE1 2.85Å; Y1295-E1326 PolarHBondContact OH-OE2 2.83Å; Y1295-P1329 HydrophobicContact CD2-CB 3.76Å; Y1295-P1329 HydrophobicContact CD2-CG 3.99Å; Y1295-P1329 HydrophobicContact CE2-CB 4.16Å; Y1295-P1329 HydrophobicContact CE2-CG 4.22Å; Y1295-H1335 AromaticContact CE2-CD2 3.55Å; Y1295-H1335 AromaticContact CE2-NE2 3.71Å; Y1295-H1335 AromaticContact CZ-NE2 3.66Å; Y1295-H1335 PolarHBondContact OH-NE2 3.39Å; Y1295-P1336 HydrophobicContact CD1-CG 3.7Å; Y1295-P1336 VanDerWaalsContact CE1-CD 3.45Å; Y1295-P1336 HydrophobicContact CE1-CG 3.43Å; Y1295-P1336 VanDerWaalsContact CE1-CG 3.43Å; Y1295-P1336 HydrophobicContact CE2-CG 4.5Å; Y1295-P1336 HydrophobicContact CG-CG 4.34Å
1296	S	70.6	Confident	86.7	Confident	1 Å²	1	29.2 Å²	29.2	1%	0.007	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-164.1	154.3	-172.7	49.7	0	0	0	0	113	R1272 K1273	R1272-S1296 VanDerWaalsContact CD-OG 3.25Å; R1272-S1296 WeakPolarHBondContact CD-OG 3.49Å; R1272-S1296 PolarHBondContact NH1-OG 2.93Å; K1273-S1296 WeakPolarHBondContact O-CA 3.35Å; K1273-S1296 VanDerWaalsContact O-CB 3.24Å; K1273-S1296 WeakPolarHBondContact O-CB 2.76Å
1297	Y	70.5	Confident	87.2	Confident	17 Å²	17	27.7 Å²	27.7	7%	0.067	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	175.9	172.5	-73.7	-86.8	0	0	0	112.1	P1202 Y1203 K1273 L1275 Y1295 D1325 E1326	P1202-Y1297 WeakPolarHBondContact CG-OH 3.49Å; Y1203-Y1297 AromaticContact CE2-CE2 3.95Å; Y1203-Y1297 HydrophobicContact CE2-CE2 3.95Å; K1273-Y1297 WeakPolarHBondContact CA-O 3.36Å; K1273-Y1297 WeakPolarHBondContact CB-O 3.43Å; K1273-Y1297 PolarHBondContact N-O 3.44Å; K1273-Y1297 PolarHBondContact O-N 2.92Å; K1273-Y1297 VanDerWaalsContact O-N 3.08Å; L1275-Y1297 HydrophobicContact CD1-CD2 3.57Å; L1275-Y1297 HydrophobicContact CD1-CE2 3.56Å; L1275-Y1297 HydrophobicContact CD2-CD2 3.7Å; L1275-Y1297 HydrophobicContact CD2-CE2 3.94Å; L1275-Y1297 HydrophobicContact CG-CD2 3.82Å; L1275-Y1297 HydrophobicContact CG-CE2 4.18Å; Y1295-Y1297 HydrophobicContact CE1-CE2 4.12Å; Y1295-Y1297 AromaticContact CZ-CE2 3.95Å; Y1295-Y1297 AromaticContact CZ-CZ 3.99Å; Y1295-Y1297 VanDerWaalsContact OH-CZ 3.26Å; Y1295-Y1297 PolarHBondContact OH-OH 3.13Å; Y1297-D1325 WeakPolarHBondContact CD1-OD2 3.25Å; Y1297-E1326 VanDerWaalsContact CE1-CD 3.42Å; Y1297-E1326 HydrophobicContact CE1-CG 4.2Å; Y1297-E1326 WeakPolarHBondContact CE1-OE1 3.48Å; Y1297-E1326 PolarHBondContact OH-OE1 2.83Å
1298	W	68.2	Low	87.8	Confident	111 Å²	111	27.3 Å²	27.3	42%	0.42	13%	0.126	S	C	.	.	E	Extended strand (participates in β ladder)	trans	61.5	98.6	172.7	-57.9	-5.8	0	0	0	112.8	R1272 K1273 L1300 D1325 P1361	R1272-W1298 WeakPolarHBondContact CA-O 3.44Å; R1272-W1298 VanDerWaalsContact CB-O 3.26Å; R1272-W1298 WeakPolarHBondContact CB-O 3.19Å; K1273-W1298 HydrophobicContact CB-CB 4.11Å; K1273-W1298 HydrophobicContact CB-CD2 4.03Å; K1273-W1298 HydrophobicContact CB-CE3 3.93Å; K1273-W1298 HydrophobicContact CB-CG 4.12Å; K1273-W1298 HydrophobicContact CD-CD2 3.68Å; K1273-W1298 HydrophobicContact CD-CE3 3.69Å; K1273-W1298 HydrophobicContact CD-CG 4.33Å; K1273-W1298 HydrophobicContact CD-CH2 4.02Å; K1273-W1298 HydrophobicContact CD-CZ2 3.99Å; K1273-W1298 HydrophobicContact CD-CZ3 3.86Å; K1273-W1298 HydrophobicContact CG-CD2 4.5Å; K1273-W1298 HydrophobicContact CG-CE3 4.3Å; W1298-L1300 VanDerWaalsContact C-N 3.35Å; W1298-L1300 PolarHBondContact O-N 3.46Å; W1298-L1300 VanDerWaalsContact O-N 3.14Å; W1298-D1325 PolarHBondContact N-OD2 2.91Å; W1298-D1325 VanDerWaalsContact N-OD2 3.09Å; W1298-P1361 HydrophobicContact CE3-CB 4.34Å; W1298-P1361 HydrophobicContact CE3-CG 4.27Å; W1298-P1361 HydrophobicContact CZ3-CB 4.35Å; W1298-P1361 HydrophobicContact CZ3-CG 4.17Å
1299	T	79.5	Confident	88.3	Confident	3 Å²	3	22.6 Å²	22.6	2%	0.018	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	58	-170.7	-61.4	0	0	0	0	112.4	E1238 Y1269 A1301 Y1302 L1328	E1238-T1299 VanDerWaalsContact CD-O 3.27Å; Y1269-T1299 HydrophobicContact CE1-CG2 3.9Å; T1299-A1301 VanDerWaalsContact C-N 3.35Å; T1299-A1301 PolarHBondContact O-N 3.46Å; T1299-Y1302 HydrophobicContact CG2-CD1 3.38Å; T1299-Y1302 HydrophobicContact CG2-CE1 3.56Å; T1299-L1328 HydrophobicContact CG2-CD1 3.85Å
1300	L	86	Confident	88.8	Confident	5 Å²	5	26 Å²	26	3%	0.026	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-55.8	-41.6	-170.4	-56.8	169.4	0	0	0	114.7	E1238 G1271 W1298 V1359 P1361	E1238-L1300 PolarHBondContact N-O 2.77Å; E1238-L1300 VanDerWaalsContact OE2-CA 3.29Å; E1238-L1300 WeakPolarHBondContact OE2-CA 3.17Å; E1238-L1300 PolarHBondContact OE2-N 2.94Å; G1271-L1300 PolarHBondContact O-N 3.25Å; W1298-L1300 VanDerWaalsContact C-N 3.35Å; W1298-L1300 PolarHBondContact O-N 3.46Å; W1298-L1300 VanDerWaalsContact O-N 3.14Å; L1300-V1359 HydrophobicContact CB-CG2 4.28Å; L1300-P1361 HydrophobicContact CD1-CB 3.85Å; L1300-P1361 VanDerWaalsContact CD1-CD 3.49Å; L1300-P1361 HydrophobicContact CD1-CG 4.09Å; L1300-P1361 HydrophobicContact CD2-CB 4.16Å
1301	A	94.2	Very high	89.1	Confident	1 Å²	1	27.4 Å²	27.4	1%	0.008	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.2	147.1	171.1	0	0	0	0	0	112.3	V1236 F1237 L1241 L1270 G1271 T1299 V1359	V1236-A1301 CarbonylContact O-C 3.41Å; V1236-A1301 WeakPolarHBondContact O-CA 3.3Å; V1236-A1301 WeakPolarHBondContact O-CB 3.27Å; F1237-A1301 HydrophobicContact CD1-CB 3.68Å; F1237-A1301 HydrophobicContact CE1-CB 4.22Å; L1241-A1301 HydrophobicContact CD2-CB 4.32Å; L1270-A1301 HydrophobicContact CB-CB 4.07Å; L1270-A1301 PolarHBondContact N-O 3.06Å; G1271-A1301 PolarHBondContact N-O 3.25Å; G1271-A1301 VanDerWaalsContact N-O 3.16Å; G1271-A1301 PolarHBondContact O-N 3.28Å; T1299-A1301 VanDerWaalsContact C-N 3.35Å; T1299-A1301 PolarHBondContact O-N 3.46Å; A1301-V1359 HydrophobicContact CB-CG2 3.64Å
1302	Y	96.2	Very high	89.5	Confident	1 Å²	1	27.4 Å²	27.4	0%	0.004	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	150	174.4	60.6	-89.3	0	0	0	112.8	H1219 W1223 I1235 V1236 L1267 V1268 T1299 L1304	H1219-Y1302 AromaticContact CE1-CE1 3.72Å; H1219-Y1302 AromaticContact ND1-CE1 3.52Å; H1219-Y1302 AromaticContact ND1-CZ 3.69Å; H1219-Y1302 PolarHBondContact ND1-OH 3.37Å; W1223-Y1302 PolarHBondContact NE1-OH 2.85Å; W1223-Y1302 VanDerWaalsContact NE1-OH 3.13Å; I1235-Y1302 WeakPolarHBondContact CA-O 3.38Å; V1236-Y1302 HydrophobicContact CB-CD1 4.42Å; V1236-Y1302 HydrophobicContact CB-CD2 4.46Å; V1236-Y1302 HydrophobicContact CB-CE1 3.96Å; V1236-Y1302 HydrophobicContact CB-CE2 3.96Å; V1236-Y1302 HydrophobicContact CG1-CE1 4.15Å; V1236-Y1302 HydrophobicContact CG2-CD2 4.47Å; V1236-Y1302 HydrophobicContact CG2-CE2 3.72Å; V1236-Y1302 PolarHBondContact N-O 3.37Å; V1236-Y1302 PolarHBondContact O-N 3.28Å; L1267-Y1302 HydrophobicContact CD1-CD2 3.85Å; L1267-Y1302 HydrophobicContact CD1-CE2 4.33Å; L1267-Y1302 HydrophobicContact CD1-CG 4.19Å; L1267-Y1302 HydrophobicContact CG-CD2 4.05Å; L1267-Y1302 HydrophobicContact CG-CG 4.32Å; V1268-Y1302 CarbonylContact O-C 3.31Å; V1268-Y1302 WeakPolarHBondContact O-CA 3.41Å; V1268-Y1302 WeakPolarHBondContact O-CB 3.46Å; T1299-Y1302 HydrophobicContact CG2-CD1 3.38Å; T1299-Y1302 HydrophobicContact CG2-CE1 3.56Å; Y1302-L1304 HydrophobicContact CD2-CB 4.06Å; Y1302-L1304 HydrophobicContact CE2-CB 3.95Å; Y1302-L1304 HydrophobicContact CE2-CD1 4.49Å; Y1302-L1304 HydrophobicContact CE2-CD2 4.24Å; Y1302-L1304 HydrophobicContact CE2-CG 4.47Å
1303	M	97.2	Very high	89.8	Confident	1 Å²	1	23 Å²	23	1%	0.005	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	144.3	162.8	-60	167.4	43.1	0	0	109.5	F1143 V1234 I1235 L1254 L1258 W1265 L1267 V1268 L1270	F1143-M1303 HydrophobicContact CE1-CB 4.29Å; F1143-M1303 HydrophobicContact CE1-CE 3.7Å; F1143-M1303 HydrophobicContact CE1-CG 3.91Å; F1143-M1303 HydrophobicContact CE1-SD 4.25Å; F1143-M1303 HydrophobicContact CZ-CE 3.56Å; F1143-M1303 HydrophobicContact CZ-CG 4.02Å; F1143-M1303 HydrophobicContact CZ-SD 3.87Å; V1234-M1303 CarbonylContact O-C 3.54Å; V1234-M1303 VanDerWaalsContact O-CA 3.3Å; V1234-M1303 WeakPolarHBondContact O-CA 3.2Å; I1235-M1303 HydrophobicContact CD1-CG 4.36Å; I1235-M1303 HydrophobicContact CG1-CG 4.08Å; L1254-M1303 HydrophobicContact CD2-SD 3.86Å; L1254-M1303 HydrophobicContact CG-SD 4.42Å; L1258-M1303 HydrophobicContact CD1-CE 3.26Å; L1258-M1303 HydrophobicContact CD1-SD 3.94Å; W1265-M1303 HydrophobicContact CH2-CB 3.69Å; W1265-M1303 HydrophobicContact CH2-CE 3.55Å; W1265-M1303 HydrophobicContact CZ2-CE 3.49Å; W1265-M1303 VanDerWaalsContact CZ2-CE 3.49Å; W1265-M1303 HydrophobicContact CZ3-CB 3.7Å; W1265-M1303 HydrophobicContact CZ3-CE 4.21Å; L1267-M1303 CarbonylContact C-O 3.59Å; L1267-M1303 VanDerWaalsContact CA-O 3.29Å; L1267-M1303 WeakPolarHBondContact CA-O 3.38Å; V1268-M1303 HydrophobicContact CB-CB 4.14Å; V1268-M1303 HydrophobicContact CB-SD 4.27Å; V1268-M1303 HydrophobicContact CG2-CE 4.5Å; V1268-M1303 PolarHBondContact N-O 2.98Å; V1268-M1303 PolarHBondContact O-N 3.34Å; L1270-M1303 HydrophobicContact CD1-CG 4.08Å; L1270-M1303 HydrophobicContact CD2-CG 4.09Å; L1270-M1303 HydrophobicContact CD2-SD 3.92Å; L1270-M1303 HydrophobicContact CG-CG 4.16Å
1304	L	97.7	Very high	90.2	Very high	0 Å²	0	26 Å²	26	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	138.4	177.3	-172.5	70.9	0	0	0	110.5	W1223 R1233 V1234 D1266 L1267 Y1302 A1309 L1312	W1223-L1304 VanDerWaalsContact CD1-CD2 3.5Å; W1223-L1304 HydrophobicContact CG-CD2 4.38Å; R1233-L1304 WeakPolarHBondContact CA-O 3.41Å; V1234-L1304 HydrophobicContact CG2-CB 4Å; V1234-L1304 PolarHBondContact N-O 3.49Å; V1234-L1304 PolarHBondContact O-N 3.36Å; D1266-L1304 WeakPolarHBondContact O-CA 3.38Å; L1267-L1304 HydrophobicContact CB-CD1 4.31Å; L1267-L1304 HydrophobicContact CD1-CD1 4.25Å; Y1302-L1304 HydrophobicContact CD2-CB 4.06Å; Y1302-L1304 HydrophobicContact CE2-CB 3.95Å; Y1302-L1304 HydrophobicContact CE2-CD1 4.49Å; Y1302-L1304 HydrophobicContact CE2-CD2 4.24Å; Y1302-L1304 HydrophobicContact CE2-CG 4.47Å; L1304-A1309 HydrophobicContact CD2-CB 3.85Å; L1304-A1309 HydrophobicContact CG-CB 4.39Å; L1304-L1312 HydrophobicContact CD1-CD1 3.94Å
1305	T	97.7	Very high	90.7	Very high	19 Å²	19	25.8 Å²	25.8	12%	0.117	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	161.7	168.8	67.7	0	0	0	0	112.2	Q1232 W1265 D1266 R1307 G1308 A1309	Q1232-T1305 VanDerWaalsContact O-CA 3.22Å; Q1232-T1305 WeakPolarHBondContact O-CA 3.49Å; W1265-T1305 HydrophobicContact CD2-CG2 3.72Å; W1265-T1305 HydrophobicContact CE3-CG2 3.58Å; W1265-T1305 HydrophobicContact CH2-CG2 3.52Å; W1265-T1305 HydrophobicContact CZ2-CG2 3.66Å; W1265-T1305 HydrophobicContact CZ3-CG2 3.48Å; W1265-T1305 VanDerWaalsContact CZ3-CG2 3.48Å; W1265-T1305 VanDerWaalsContact O-CG2 3.31Å; W1265-T1305 WeakPolarHBondContact O-CG2 3.1Å; W1265-T1305 PolarHBondContact O-OG1 3.02Å; D1266-T1305 PolarHBondContact O-N 3.11Å; T1305-R1307 VanDerWaalsContact C-N 3.26Å; T1305-R1307 PolarHBondContact O-N 2.98Å; T1305-G1308 WeakPolarHBondContact O-CA 3.34Å; T1305-G1308 PolarHBondContact O-N 3.42Å; T1305-G1308 PolarHBondContact OG1-N 3.42Å; T1305-G1308 VanDerWaalsContact OG1-N 3.15Å; T1305-A1309 PolarHBondContact O-N 3.42Å
1306	L	97.6	Very high	91.2	Very high	16 Å²	16	30.5 Å²	30.5	8%	0.084	15%	0.151	C	C	.	.	H	α-helix	trans	-48.1	-50.5	170.8	-179.5	55.9	0	0	0	111.7	V1226 V1227 L1231 Q1232 G1308 A1309 E1310	V1226-L1306 HydrophobicContact CG1-CD1 4.28Å; V1226-L1306 WeakPolarHBondContact O-CD1 3.44Å; V1227-L1306 HydrophobicContact CB-CD1 4.43Å; V1227-L1306 HydrophobicContact CG2-CD1 4.15Å; L1231-L1306 WeakPolarHBondContact O-CB 3.5Å; Q1232-L1306 VanDerWaalsContact NE2-CD2 3.34Å; Q1232-L1306 PolarHBondContact O-N 2.84Å; Q1232-L1306 VanDerWaalsContact O-N 3.08Å; L1306-G1308 VanDerWaalsContact C-N 3.3Å; L1306-G1308 PolarHBondContact O-N 3.29Å; L1306-A1309 WeakPolarHBondContact O-CB 3.38Å; L1306-A1309 PolarHBondContact O-N 3.45Å; L1306-A1309 VanDerWaalsContact O-N 3.13Å; L1306-E1310 WeakPolarHBondContact O-CG 3.31Å; L1306-E1310 PolarHBondContact O-N 3.48Å
1307	R	96.8	Very high	92.3	Very high	95 Å²	95	30.5 Å²	30.5	36%	0.358	15%	0.151	S	C	.	.	H	α-helix	trans	-63.8	-34.2	-179.5	-166.1	-172.4	67.8	-175	1.2	112.5	D1264 D1266 T1305 K1311	D1264-R1307 PolarHBondContact O-NH2 3.3Å; D1266-R1307 VanDerWaalsContact CG-NH2 3.33Å; D1266-R1307 IonicContact OD1-CZ 3.49Å; D1266-R1307 IonicContact OD1-NE 3.71Å; D1266-R1307 PolarHBondContact OD1-NE 3.2Å; D1266-R1307 IonicContact OD1-NH2 2.7Å; D1266-R1307 PolarHBondContact OD1-NH2 3.32Å; D1266-R1307 IonicContact OD2-NH2 3.95Å; T1305-R1307 VanDerWaalsContact C-N 3.26Å; T1305-R1307 PolarHBondContact O-N 2.98Å; R1307-K1311 WeakPolarHBondContact O-CG 3.17Å; R1307-K1311 PolarHBondContact O-N 2.88Å; R1307-K1311 VanDerWaalsContact O-N 3.1Å
1308	G	97	Very high	93.3	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-63.8	-47.3	171.3	0	0	0	0	0	112.1	T1305 L1306 E1310 K1311 L1312	T1305-G1308 WeakPolarHBondContact O-CA 3.34Å; T1305-G1308 PolarHBondContact O-N 3.42Å; T1305-G1308 PolarHBondContact OG1-N 3.42Å; T1305-G1308 VanDerWaalsContact OG1-N 3.15Å; L1306-G1308 VanDerWaalsContact C-N 3.3Å; L1306-G1308 PolarHBondContact O-N 3.29Å; G1308-E1310 PolarHBondContact O-N 3.29Å; G1308-K1311 PolarHBondContact O-N 3.12Å; G1308-L1312 WeakPolarHBondContact O-CG 3.36Å; G1308-L1312 PolarHBondContact O-N 3.08Å
1309	A	97.4	Very high	94.3	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-60.6	-43.8	176.2	0	0	0	0	0	112.2	W1223 V1226 V1227 L1304 T1305 L1306 K1311 L1312 L1313	W1223-A1309 HydrophobicContact CB-CB 4.27Å; V1226-A1309 HydrophobicContact CB-CB 3.95Å; V1226-A1309 HydrophobicContact CG1-CB 3.59Å; V1227-A1309 HydrophobicContact CG2-CB 3.81Å; L1304-A1309 HydrophobicContact CD2-CB 3.85Å; L1304-A1309 HydrophobicContact CG-CB 4.39Å; T1305-A1309 PolarHBondContact O-N 3.42Å; L1306-A1309 WeakPolarHBondContact O-CB 3.38Å; L1306-A1309 PolarHBondContact O-N 3.45Å; L1306-A1309 VanDerWaalsContact O-N 3.13Å; A1309-K1311 PolarHBondContact O-N 3.21Å; A1309-L1312 PolarHBondContact O-N 3.16Å; A1309-L1313 WeakPolarHBondContact O-CG 3.25Å; A1309-L1313 PolarHBondContact O-N 3.41Å
1310	E	97.6	Very high	94.8	Very high	87 Å²	87	30.9 Å²	30.9	41%	0.407	17%	0.166	S	C	.	.	H	α-helix	trans	-57.6	-44.6	174.8	-70.4	176.7	151.9	0	0	112.1	V1227 L1306 G1308 L1313 A1314	V1227-E1310 HydrophobicContact CG1-CG 4.33Å; V1227-E1310 HydrophobicContact CG2-CG 3.75Å; L1306-E1310 WeakPolarHBondContact O-CG 3.31Å; L1306-E1310 PolarHBondContact O-N 3.48Å; G1308-E1310 PolarHBondContact O-N 3.29Å; E1310-L1313 PolarHBondContact O-N 2.97Å; E1310-A1314 WeakPolarHBondContact O-CB 3.38Å; E1310-A1314 PolarHBondContact O-N 3.22Å
1311	K	97.3	Very high	95.1	Very high	29 Å²	29	30.6 Å²	30.6	13%	0.126	16%	0.164	C	C	.	.	H	α-helix	trans	-63	-42.7	176.5	-75.4	175.7	178.5	-179.3	0	112.7	D1266 R1307 G1308 A1309 A1314 A1315 D1348 L1349	D1266-K1311 IonicContact OD1-NZ 2.71Å; D1266-K1311 WeakPolarHBondContact OD2-CD 3.33Å; D1266-K1311 IonicContact OD2-NZ 3.22Å; D1266-K1311 PolarHBondContact OD2-NZ 3.25Å; R1307-K1311 WeakPolarHBondContact O-CG 3.17Å; R1307-K1311 PolarHBondContact O-N 2.88Å; R1307-K1311 VanDerWaalsContact O-N 3.1Å; G1308-K1311 PolarHBondContact O-N 3.12Å; A1309-K1311 PolarHBondContact O-N 3.21Å; K1311-A1314 PolarHBondContact O-N 3.49Å; K1311-A1315 PolarHBondContact O-N 2.75Å; K1311-D1348 WeakPolarHBondContact CE-O 3Å; K1311-D1348 WeakPolarHBondContact CE-OD2 3.42Å; K1311-D1348 PolarHBondContact NZ-O 3.39Å; K1311-D1348 IonicContact NZ-OD2 2.68Å; K1311-L1349 HydrophobicContact CB-CD1 4.13Å; K1311-L1349 HydrophobicContact CD-CD1 4.37Å
1312	L	96.8	Very high	94.9	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-65	-41	178.9	-67.3	174.5	0	0	0	112.1	W1223 L1304 G1308 A1309 F1327 L1328 M1331 L1349	W1223-L1312 HydrophobicContact CD2-CB 4.05Å; W1223-L1312 HydrophobicContact CD2-CD1 3.84Å; W1223-L1312 HydrophobicContact CE3-CB 3.82Å; W1223-L1312 HydrophobicContact CE3-CD1 4.36Å; W1223-L1312 HydrophobicContact CG-CD1 4.18Å; W1223-L1312 HydrophobicContact CZ2-CD1 4.03Å; W1223-L1312 HydrophobicContact CZ3-CB 4.21Å; L1304-L1312 HydrophobicContact CD1-CD1 3.94Å; G1308-L1312 WeakPolarHBondContact O-CG 3.36Å; G1308-L1312 PolarHBondContact O-N 3.08Å; A1309-L1312 PolarHBondContact O-N 3.16Å; L1312-F1327 HydrophobicContact CB-CE1 4.44Å; L1312-F1327 HydrophobicContact CD2-CE1 3.82Å; L1312-F1327 HydrophobicContact CD2-CZ 4.35Å; L1312-L1328 HydrophobicContact CD1-CD2 3.91Å; L1312-L1328 HydrophobicContact CD2-CD2 3.57Å; L1312-L1328 HydrophobicContact CG-CD2 4.42Å; L1312-M1331 HydrophobicContact CD2-CB 4.03Å; L1312-M1331 HydrophobicContact CD2-CG 3.94Å; L1312-L1349 HydrophobicContact CD2-CD1 4.13Å; L1312-L1349 HydrophobicContact CD2-CD2 3.83Å; L1312-L1349 HydrophobicContact CG-CD1 4.08Å
1313	L	95.9	Very high	94.6	Very high	32 Å²	32	30.8 Å²	30.8	17%	0.168	17%	0.165	C	C	.	.	H	α-helix	trans	-71.4	-39.8	176.9	-65.3	174.5	0	0	0	112.3	Y1220 W1223 K1224 V1227 A1309 E1310 A1315 E1316	Y1220-L1313 HydrophobicContact CD2-CD2 3.74Å; Y1220-L1313 HydrophobicContact CE1-CD2 4.43Å; Y1220-L1313 HydrophobicContact CE2-CD2 3.38Å; Y1220-L1313 HydrophobicContact CG-CD2 4.41Å; W1223-L1313 HydrophobicContact CB-CD2 4.04Å; W1223-L1313 HydrophobicContact CB-CG 4.14Å; W1223-L1313 HydrophobicContact CE3-CD2 4.44Å; K1224-L1313 HydrophobicContact CB-CD1 4.41Å; K1224-L1313 HydrophobicContact CB-CD2 4.45Å; V1227-L1313 HydrophobicContact CB-CD1 4.15Å; V1227-L1313 HydrophobicContact CG2-CD1 3.73Å; A1309-L1313 WeakPolarHBondContact O-CG 3.25Å; A1309-L1313 PolarHBondContact O-N 3.41Å; E1310-L1313 PolarHBondContact O-N 2.97Å; L1313-A1315 PolarHBondContact O-N 2.82Å; L1313-A1315 VanDerWaalsContact O-N 3.12Å; L1313-E1316 PolarHBondContact O-N 2.7Å
1314	A	95.3	Very high	94.3	Very high	73 Å²	73	31 Å²	31	60%	0.603	17%	0.167	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-10.3	179.6	0	0	0	0	0	114.3	E1310 K1311 E1316	E1310-A1314 WeakPolarHBondContact O-CB 3.38Å; E1310-A1314 PolarHBondContact O-N 3.22Å; K1311-A1314 PolarHBondContact O-N 3.49Å; A1314-E1316 VanDerWaalsContact C-N 3.27Å
1315	A	93.4	Very high	93.8	Very high	14 Å²	14	32.4 Å²	32.4	12%	0.116	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.8	-9.4	171.7	0	0	0	0	0	113.8	K1311 L1313 F1327 M1331 F1344	K1311-A1315 PolarHBondContact O-N 2.75Å; L1313-A1315 PolarHBondContact O-N 2.82Å; L1313-A1315 VanDerWaalsContact O-N 3.12Å; A1315-F1327 HydrophobicContact CB-CE2 4.09Å; A1315-F1327 HydrophobicContact CB-CZ 3.95Å; A1315-M1331 HydrophobicContact CB-CE 3.73Å; A1315-M1331 HydrophobicContact CB-SD 3.55Å; A1315-M1331 VanDerWaalsContact CB-SD 3.55Å; A1315-F1344 HydrophobicContact CB-CD1 4.13Å; A1315-F1344 HydrophobicContact CB-CE1 4.45Å
1316	E	93.2	Very high	93.5	Very high	136 Å²	136	31.5 Å²	31.5	64%	0.636	17%	0.169	S	C	*	.			trans	49.2	55.6	-177.4	-57.3	175.2	153.4	0	0	113.7	L1313 A1314 L1318 R1320	L1313-E1316 PolarHBondContact O-N 2.7Å; A1314-E1316 VanDerWaalsContact C-N 3.27Å; E1316-L1318 VanDerWaalsContact C-N 3.33Å; E1316-L1318 PolarHBondContact O-N 3.49Å; E1316-R1320 IonicContact OE2-NH2 3.15Å; E1316-R1320 PolarHBondContact OE2-NH2 2.65Å
1317	P	92.7	Very high	93.3	Very high	1 Å²	1	30.8 Å²	30.8	1%	0.006	17%	0.165	C	C	.	.	G	3₁₀ helix	trans	-69.6	-22.7	-168.7	26.9	-35.6	0	0	0	115.4	F1216 Y1220 G1319 R1320 L1321 F1327 F1344	F1216-P1317 HydrophobicContact CE1-CB 3.94Å; F1216-P1317 HydrophobicContact CE1-CG 3.81Å; F1216-P1317 HydrophobicContact CE2-CB 4.48Å; F1216-P1317 HydrophobicContact CZ-CB 3.49Å; F1216-P1317 VanDerWaalsContact CZ-CB 3.49Å; F1216-P1317 HydrophobicContact CZ-CG 3.71Å; Y1220-P1317 HydrophobicContact CD2-CG 4.17Å; Y1220-P1317 HydrophobicContact CE2-CG 4.24Å; P1317-G1319 VanDerWaalsContact C-N 3.32Å; P1317-G1319 PolarHBondContact O-N 3Å; P1317-R1320 CarbonylContact O-C 3.54Å; P1317-R1320 PolarHBondContact O-N 2.76Å; P1317-L1321 WeakPolarHBondContact O-CA 3.44Å; P1317-L1321 PolarHBondContact O-N 3.46Å; P1317-L1321 VanDerWaalsContact O-N 3.14Å; P1317-F1327 HydrophobicContact CB-CD2 4.23Å; P1317-F1327 HydrophobicContact CB-CE1 4.32Å; P1317-F1327 HydrophobicContact CB-CE2 3.74Å; P1317-F1327 HydrophobicContact CB-CZ 3.78Å; P1317-F1327 HydrophobicContact CG-CE1 4.34Å; P1317-F1327 HydrophobicContact CG-CE2 4.41Å; P1317-F1327 HydrophobicContact CG-CZ 3.95Å; P1317-F1344 HydrophobicContact CB-CE1 4.23Å; P1317-F1344 HydrophobicContact CB-CZ 4.42Å
1318	L	92	Very high	93.2	Very high	25 Å²	25	26.2 Å²	26.2	13%	0.131	15%	0.148	C	C	.	.	G	3₁₀ helix	trans	-60.1	-40.4	-174.2	-59.4	-177.3	0	0	0	112.5	G1192 V1193 Q1194 F1216 L1217 Y1220 E1316 R1320	G1192-L1318 CarbonylContact O-C 3.6Å; V1193-L1318 CarbonylContact C-O 3.55Å; V1193-L1318 VanDerWaalsContact CA-O 3.31Å; V1193-L1318 WeakPolarHBondContact CA-O 3.24Å; V1193-L1318 HydrophobicContact CG2-CD2 4.49Å; Q1194-L1318 PolarHBondContact N-O 3.02Å; F1216-L1318 HydrophobicContact CE1-CD2 4.43Å; L1217-L1318 HydrophobicContact CD2-CD2 3.72Å; Y1220-L1318 HydrophobicContact CD2-CD2 4.17Å; Y1220-L1318 HydrophobicContact CD2-CG 4.43Å; Y1220-L1318 HydrophobicContact CE1-CD1 3.99Å; Y1220-L1318 HydrophobicContact CE2-CD1 4.25Å; Y1220-L1318 HydrophobicContact CE2-CD2 4.33Å; Y1220-L1318 HydrophobicContact CE2-CG 4.09Å; Y1220-L1318 HydrophobicContact CG-CD2 4.28Å; E1316-L1318 VanDerWaalsContact C-N 3.33Å; E1316-L1318 PolarHBondContact O-N 3.49Å; L1318-R1320 VanDerWaalsContact C-N 3.25Å; L1318-R1320 PolarHBondContact O-N 2.64Å
1319	G	89.3	Confident	92.9	Very high	39 Å²	39	26.2 Å²	26.2	40%	0.402	15%	0.148	S	C	.	.	G	3₁₀ helix	trans	-79.9	1.2	177.1	0	0	0	0	0	115.2	Q1194 P1317	Q1194-G1319 CarbonylContact O-C 3.48Å; Q1194-G1319 VanDerWaalsContact O-C 3.31Å; P1317-G1319 VanDerWaalsContact C-N 3.32Å; P1317-G1319 PolarHBondContact O-N 3Å
1320	R	90.6	Very high	92.6	Very high	74 Å²	74	26.2 Å²	26.2	28%	0.279	15%	0.148	S	C	.	.	G	3₁₀ helix	trans	-142.6	42.1	-177	-74.8	171	-81.5	-163.2	-14.1	110.4	Q1194 I1196 E1316 P1317 L1318 H1343 F1344	Q1194-R1320 CarbonylContact O-C 3.58Å; Q1194-R1320 PolarHBondContact O-N 3.05Å; I1196-R1320 HydrophobicContact CG2-CB 3.86Å; I1196-R1320 HydrophobicContact CG2-CG 4.32Å; E1316-R1320 IonicContact OE2-NH2 3.15Å; E1316-R1320 PolarHBondContact OE2-NH2 2.65Å; P1317-R1320 CarbonylContact O-C 3.54Å; P1317-R1320 PolarHBondContact O-N 2.76Å; L1318-R1320 VanDerWaalsContact C-N 3.25Å; L1318-R1320 PolarHBondContact O-N 2.64Å; R1320-H1343 WeakPolarHBondContact CD-O 3.45Å; R1320-H1343 HydrophobicContact CG-CB 4.49Å; R1320-H1343 PolarHBondContact NH1-O 2.94Å; R1320-F1344 HydrophobicContact CB-CE1 4.19Å; R1320-F1344 HydrophobicContact CB-CE2 4.36Å; R1320-F1344 HydrophobicContact CB-CZ 3.76Å; R1320-F1344 VanDerWaalsContact O-CZ 3.24Å; R1320-F1344 WeakPolarHBondContact O-CZ 3.31Å
1321	L	91.4	Very high	92.5	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	13%	0.129	C	C	.	.	B	Isolated β-bridge	trans	-69.9	136.5	-162.9	-156.9	62.4	0	0	0	112.6	V1193 Q1194 Q1195 I1196 M1208 V1213 F1216 P1317	V1193-L1321 HydrophobicContact CG1-CD2 3.53Å; Q1194-L1321 PolarHBondContact O-N 2.88Å; Q1195-L1321 WeakPolarHBondContact CA-O 3.45Å; Q1195-L1321 WeakPolarHBondContact CG-O 3.47Å; I1196-L1321 PolarHBondContact N-O 3.22Å; M1208-L1321 HydrophobicContact CE-CB 4.01Å; M1208-L1321 HydrophobicContact CE-CD2 3.36Å; M1208-L1321 HydrophobicContact CE-CG 3.47Å; M1208-L1321 VanDerWaalsContact CE-CG 3.47Å; M1208-L1321 HydrophobicContact SD-CG 4.45Å; V1213-L1321 HydrophobicContact CG1-CD2 4.13Å; V1213-L1321 HydrophobicContact CG2-CD2 4.44Å; F1216-L1321 HydrophobicContact CB-CD1 4.34Å; F1216-L1321 HydrophobicContact CD1-CD1 3.49Å; F1216-L1321 VanDerWaalsContact CD1-CD1 3.49Å; F1216-L1321 HydrophobicContact CD2-CD1 3.77Å; F1216-L1321 HydrophobicContact CE1-CD1 3.68Å; F1216-L1321 HydrophobicContact CE2-CD1 3.93Å; F1216-L1321 HydrophobicContact CG-CD1 3.58Å; F1216-L1321 HydrophobicContact CZ-CD1 3.92Å; P1317-L1321 WeakPolarHBondContact O-CA 3.44Å; P1317-L1321 PolarHBondContact O-N 3.46Å; P1317-L1321 VanDerWaalsContact O-N 3.14Å
1322	V	91	Very high	92.3	Very high	1 Å²	1	21.6 Å²	21.6	1%	0.006	13%	0.126	C	C	.	.			trans	-139.1	163.8	167.3	-63.3	0	0	0	0	107.2	I1196 Y1199 F1216 E1326 F1327 I1330	I1196-V1322 HydrophobicContact CD1-CG1 3.47Å; I1196-V1322 VanDerWaalsContact CD1-CG1 3.47Å; I1196-V1322 HydrophobicContact CG1-CG1 3.67Å; Y1199-V1322 HydrophobicContact CD2-CB 4.24Å; Y1199-V1322 HydrophobicContact CD2-CG1 3.92Å; Y1199-V1322 HydrophobicContact CG-CG1 4.1Å; F1216-V1322 WeakPolarHBondContact CD2-O 3.46Å; F1216-V1322 WeakPolarHBondContact CE2-O 3.42Å; V1322-E1326 HydrophobicContact CB-CB 4.43Å; V1322-E1326 HydrophobicContact CG2-CB 4.22Å; V1322-F1327 HydrophobicContact CG2-CB 3.87Å; V1322-I1330 HydrophobicContact CG2-CD1 4.2Å
1323	P	89.2	Confident	92.1	Very high	4 Å²	4	24.9 Å²	24.9	3%	0.026	14%	0.144	C	C	.	.			trans	-55	151.4	177.9	-28.9	37.5	0	0	0	113	Y1199 M1208 E1212 D1325 E1326 F1327	Y1199-P1323 HydrophobicContact CE1-CG 4.1Å; Y1199-P1323 HydrophobicContact CE2-CG 4.28Å; Y1199-P1323 VanDerWaalsContact CZ-CD 3.43Å; Y1199-P1323 WeakPolarHBondContact OH-CG 3.42Å; M1208-P1323 HydrophobicContact CG-CG 4Å; M1208-P1323 HydrophobicContact SD-CB 4.47Å; M1208-P1323 VanDerWaalsContact SD-CD 3.51Å; M1208-P1323 HydrophobicContact SD-CG 3.77Å; M1208-P1323 VanDerWaalsContact SD-N 3.37Å; E1212-P1323 HydrophobicContact CB-CG 4.44Å; E1212-P1323 HydrophobicContact CG-CG 4.44Å; P1323-D1325 VanDerWaalsContact CB-OD1 3.27Å; P1323-D1325 WeakPolarHBondContact CB-OD1 3.27Å; P1323-D1325 PolarHBondContact O-N 3.27Å; P1323-E1326 HydrophobicContact CB-CG 4.19Å; P1323-E1326 HydrophobicContact CG-CG 4.36Å; P1323-E1326 PolarHBondContact O-N 3.34Å; P1323-F1327 PolarHBondContact O-N 2.71Å
1324	V	91.2	Very high	91.7	Very high	7 Å²	7	28.2 Å²	28.2	4%	0.042	16%	0.159	C	C	.	.	H	α-helix	trans	-62.1	-34.4	-173.5	66	0	0	0	0	112.3	F1216 H1219 W1223 E1326 F1327 L1328	F1216-V1324 HydrophobicContact CD2-CB 3.91Å; F1216-V1324 HydrophobicContact CD2-CG2 4.49Å; F1216-V1324 HydrophobicContact CE2-CB 4.45Å; H1219-V1324 HydrophobicContact CB-CG2 4.09Å; W1223-V1324 HydrophobicContact CH2-CG2 4.03Å; W1223-V1324 HydrophobicContact CZ2-CG2 3.89Å; V1324-E1326 VanDerWaalsContact C-N 3.31Å; V1324-E1326 PolarHBondContact O-N 3.47Å; V1324-F1327 PolarHBondContact O-N 3.49Å; V1324-L1328 HydrophobicContact CG2-CD1 4.16Å; V1324-L1328 HydrophobicContact CG2-CG 4.23Å; V1324-L1328 WeakPolarHBondContact O-CB 3.27Å; V1324-L1328 VanDerWaalsContact O-CG 3.32Å; V1324-L1328 WeakPolarHBondContact O-CG 3.35Å; V1324-L1328 PolarHBondContact O-N 2.7Å
1325	D	87.4	Confident	91.3	Very high	28 Å²	28	25 Å²	25	15%	0.15	13%	0.131	C	C	.	.	H	α-helix	trans	-77.5	-11.6	176.9	57.2	-15.2	0	0	0	114	Y1297 W1298 P1323 P1329	Y1297-D1325 WeakPolarHBondContact CD1-OD2 3.25Å; W1298-D1325 PolarHBondContact N-OD2 2.91Å; W1298-D1325 VanDerWaalsContact N-OD2 3.09Å; P1323-D1325 VanDerWaalsContact CB-OD1 3.27Å; P1323-D1325 WeakPolarHBondContact CB-OD1 3.27Å; P1323-D1325 PolarHBondContact O-N 3.27Å; D1325-P1329 WeakPolarHBondContact O-CD 3.37Å; D1325-P1329 WeakPolarHBondContact O-CG 3.48Å
1326	E	89.7	Confident	90.9	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-92.1	-39.5	165.4	-57.8	-76.6	-145	0	0	111	Y1199 Y1295 Y1297 V1322 P1323 V1324 P1329 I1330 H1335 W1340	Y1199-E1326 HydrophobicContact CE2-CG 4.17Å; Y1295-E1326 WeakPolarHBondContact CE2-OE2 3.25Å; Y1295-E1326 PolarHBondContact OH-OE1 2.85Å; Y1295-E1326 PolarHBondContact OH-OE2 2.83Å; Y1297-E1326 VanDerWaalsContact CE1-CD 3.42Å; Y1297-E1326 HydrophobicContact CE1-CG 4.2Å; Y1297-E1326 WeakPolarHBondContact CE1-OE1 3.48Å; Y1297-E1326 PolarHBondContact OH-OE1 2.83Å; V1322-E1326 HydrophobicContact CB-CB 4.43Å; V1322-E1326 HydrophobicContact CG2-CB 4.22Å; P1323-E1326 HydrophobicContact CB-CG 4.19Å; P1323-E1326 HydrophobicContact CG-CG 4.36Å; P1323-E1326 PolarHBondContact O-N 3.34Å; V1324-E1326 VanDerWaalsContact C-N 3.31Å; V1324-E1326 PolarHBondContact O-N 3.47Å; E1326-P1329 WeakPolarHBondContact O-CD 3.28Å; E1326-I1330 VanDerWaalsContact O-CG1 3.27Å; E1326-I1330 WeakPolarHBondContact O-CG1 3.3Å; E1326-I1330 PolarHBondContact O-N 3.14Å; E1326-I1330 VanDerWaalsContact O-N 3.13Å; E1326-H1335 WeakPolarHBondContact CB-NE2 3.19Å; E1326-H1335 WeakPolarHBondContact CG-NE2 3.36Å; E1326-H1335 PolarHBondContact O-CD2 2.99Å; E1326-H1335 IonicContact OE1-NE2 2.75Å; E1326-H1335 PolarHBondContact OE1-NE2 3.3Å; E1326-H1335 VanDerWaalsContact OE1-NE2 3.1Å; E1326-H1335 IonicContact OE2-CD2 3.33Å; E1326-H1335 PolarHBondContact OE2-CD2 3.47Å; E1326-H1335 CovalentContact OE2-NE2 1.78Å; E1326-H1335 IonicContact OE2-NE2 3.03Å; E1326-H1335 PolarHBondContact OE2-NE2 3.02Å; E1326-W1340 HydrophobicContact CG-CZ3 4.38Å; E1326-W1340 WeakPolarHBondContact OE1-CZ3 3.47Å
1327	F	94.1	Very high	90.5	Very high	1 Å²	1	24 Å²	24	0%	0.004	13%	0.134	C	C	.	.	H	α-helix	trans	-64.9	-43.1	179.7	174.3	-113	0	0	0	113	F1216 W1223 L1312 A1315 P1317 V1322 P1323 V1324 I1330 M1331 F1344	F1216-F1327 HydrophobicContact CE2-CB 3.68Å; F1216-F1327 AromaticContact CE2-CD1 3.63Å; F1216-F1327 HydrophobicContact CE2-CD1 3.63Å; F1216-F1327 HydrophobicContact CE2-CE1 4.4Å; F1216-F1327 AromaticContact CE2-CG 3.71Å; F1216-F1327 HydrophobicContact CE2-CG 3.71Å; F1216-F1327 HydrophobicContact CZ-CB 4.45Å; F1216-F1327 AromaticContact CZ-CD1 3.64Å; F1216-F1327 HydrophobicContact CZ-CD1 3.64Å; F1216-F1327 AromaticContact CZ-CE1 3.94Å; F1216-F1327 HydrophobicContact CZ-CE1 3.94Å; F1216-F1327 AromaticContact CZ-CG 3.98Å; F1216-F1327 HydrophobicContact CZ-CG 3.98Å; W1223-F1327 AromaticContact CH2-CD1 3.75Å; W1223-F1327 HydrophobicContact CH2-CD1 3.75Å; W1223-F1327 AromaticContact CH2-CE1 3.67Å; W1223-F1327 HydrophobicContact CH2-CE1 3.67Å; W1223-F1327 HydrophobicContact CZ3-CD1 4.18Å; W1223-F1327 AromaticContact CZ3-CE1 3.66Å; W1223-F1327 HydrophobicContact CZ3-CE1 3.66Å; L1312-F1327 HydrophobicContact CB-CE1 4.44Å; L1312-F1327 HydrophobicContact CD2-CE1 3.82Å; L1312-F1327 HydrophobicContact CD2-CZ 4.35Å; A1315-F1327 HydrophobicContact CB-CE2 4.09Å; A1315-F1327 HydrophobicContact CB-CZ 3.95Å; P1317-F1327 HydrophobicContact CB-CD2 4.23Å; P1317-F1327 HydrophobicContact CB-CE1 4.32Å; P1317-F1327 HydrophobicContact CB-CE2 3.74Å; P1317-F1327 HydrophobicContact CB-CZ 3.78Å; P1317-F1327 HydrophobicContact CG-CE1 4.34Å; P1317-F1327 HydrophobicContact CG-CE2 4.41Å; P1317-F1327 HydrophobicContact CG-CZ 3.95Å; V1322-F1327 HydrophobicContact CG2-CB 3.87Å; P1323-F1327 PolarHBondContact O-N 2.71Å; V1324-F1327 PolarHBondContact O-N 3.49Å; F1327-I1330 WeakPolarHBondContact O-CB 3.25Å; F1327-I1330 PolarHBondContact O-N 2.81Å; F1327-M1331 HydrophobicContact CD1-CG 4.39Å; F1327-M1331 HydrophobicContact CD2-CG 4.02Å; F1327-M1331 HydrophobicContact CE1-CG 3.95Å; F1327-M1331 HydrophobicContact CE2-CG 3.5Å; F1327-M1331 HydrophobicContact CE2-SD 3.75Å; F1327-M1331 HydrophobicContact CG-CG 4.43Å; F1327-M1331 HydrophobicContact CZ-CG 3.48Å; F1327-M1331 VanDerWaalsContact CZ-CG 3.48Å; F1327-M1331 HydrophobicContact CZ-SD 3.93Å; F1327-M1331 WeakPolarHBondContact O-CG 3.41Å; F1327-M1331 PolarHBondContact O-N 3.4Å; F1327-F1344 HydrophobicContact CD2-CD1 4.49Å; F1327-F1344 HydrophobicContact CD2-CE1 4.03Å; F1327-F1344 HydrophobicContact CD2-CE2 4.19Å; F1327-F1344 AromaticContact CD2-CZ 3.84Å; F1327-F1344 HydrophobicContact CD2-CZ 3.84Å; F1327-F1344 AromaticContact CE2-CD1 3.95Å; F1327-F1344 HydrophobicContact CE2-CD1 3.95Å; F1327-F1344 AromaticContact CE2-CE1 3.6Å; F1327-F1344 HydrophobicContact CE2-CE1 3.6Å; F1327-F1344 AromaticContact CE2-CZ 3.9Å; F1327-F1344 HydrophobicContact CE2-CZ 3.9Å
1328	L	94	Very high	90.2	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-61	-51.9	179.6	-69.3	176.8	0	0	0	111.3	W1223 L1267 Y1269 T1299 L1312 V1324 I1330 M1331 F1332	W1223-L1328 HydrophobicContact CZ2-CD2 4.14Å; L1267-L1328 HydrophobicContact CD1-CD1 4.12Å; L1267-L1328 HydrophobicContact CD1-CD2 3.94Å; Y1269-L1328 WeakPolarHBondContact OH-CB 3.39Å; T1299-L1328 HydrophobicContact CG2-CD1 3.85Å; L1312-L1328 HydrophobicContact CD1-CD2 3.91Å; L1312-L1328 HydrophobicContact CD2-CD2 3.57Å; L1312-L1328 HydrophobicContact CG-CD2 4.42Å; V1324-L1328 HydrophobicContact CG2-CD1 4.16Å; V1324-L1328 HydrophobicContact CG2-CG 4.23Å; V1324-L1328 WeakPolarHBondContact O-CB 3.27Å; V1324-L1328 VanDerWaalsContact O-CG 3.32Å; V1324-L1328 WeakPolarHBondContact O-CG 3.35Å; V1324-L1328 PolarHBondContact O-N 2.7Å; L1328-I1330 VanDerWaalsContact C-N 3.26Å; L1328-I1330 PolarHBondContact O-N 2.95Å; L1328-M1331 WeakPolarHBondContact O-CA 3.49Å; L1328-M1331 PolarHBondContact O-N 3.37Å; L1328-F1332 VanDerWaalsContact C-CD1 3.44Å; L1328-F1332 HydrophobicContact CB-CE1 4.26Å; L1328-F1332 WeakPolarHBondContact O-CD1 3.36Å; L1328-F1332 WeakPolarHBondContact O-CE1 3.38Å; L1328-F1332 PolarHBondContact O-N 3.31Å; L1328-F1332 VanDerWaalsContact O-N 3.12Å
1329	P	90.6	Very high	90	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-60.2	-27.3	172.2	-25.5	35.1	0	0	0	115.6	Y1295 D1325 E1326 F1332 D1333 Q1334 H1335	Y1295-P1329 HydrophobicContact CD2-CB 3.76Å; Y1295-P1329 HydrophobicContact CD2-CG 3.99Å; Y1295-P1329 HydrophobicContact CE2-CB 4.16Å; Y1295-P1329 HydrophobicContact CE2-CG 4.22Å; D1325-P1329 WeakPolarHBondContact O-CD 3.37Å; D1325-P1329 WeakPolarHBondContact O-CG 3.48Å; E1326-P1329 WeakPolarHBondContact O-CD 3.28Å; P1329-F1332 VanDerWaalsContact CA-CE1 3.43Å; P1329-F1332 HydrophobicContact CB-CE1 4.25Å; P1329-F1332 HydrophobicContact CB-CE2 4.24Å; P1329-F1332 HydrophobicContact CB-CZ 3.88Å; P1329-F1332 HydrophobicContact CG-CE1 4.12Å; P1329-F1332 HydrophobicContact CG-CZ 3.85Å; P1329-D1333 PolarHBondContact O-N 3.28Å; P1329-Q1334 PolarHBondContact O-N 2.65Å; P1329-H1335 HydrophobicContact CB-CB 4.21Å; P1329-H1335 PolarHBondContact O-N 3.14Å; P1329-H1335 VanDerWaalsContact O-N 3.13Å
1330	I	92.8	Very high	90	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-64.9	-49.2	168.3	-70	165.5	0	0	0	109.2	V1322 E1326 F1327 L1328 F1332 D1333 H1335 W1340 K1341 F1344 R1347	V1322-I1330 HydrophobicContact CG2-CD1 4.2Å; E1326-I1330 VanDerWaalsContact O-CG1 3.27Å; E1326-I1330 WeakPolarHBondContact O-CG1 3.3Å; E1326-I1330 PolarHBondContact O-N 3.14Å; E1326-I1330 VanDerWaalsContact O-N 3.13Å; F1327-I1330 WeakPolarHBondContact O-CB 3.25Å; F1327-I1330 PolarHBondContact O-N 2.81Å; L1328-I1330 VanDerWaalsContact C-N 3.26Å; L1328-I1330 PolarHBondContact O-N 2.95Å; I1330-F1332 VanDerWaalsContact C-N 3.26Å; I1330-F1332 PolarHBondContact O-N 2.96Å; I1330-D1333 WeakPolarHBondContact O-CA 3.41Å; I1330-D1333 PolarHBondContact O-N 2.97Å; I1330-H1335 HydrophobicContact CB-CB 4.41Å; I1330-H1335 HydrophobicContact CG1-CB 3.57Å; I1330-W1340 HydrophobicContact CD1-CB 3.94Å; I1330-K1341 HydrophobicContact CG1-CG 4.04Å; I1330-K1341 HydrophobicContact CG2-CG 4.33Å; I1330-F1344 HydrophobicContact CD1-CD2 4.39Å; I1330-F1344 HydrophobicContact CG2-CB 3.68Å; I1330-F1344 HydrophobicContact CG2-CD2 3.75Å; I1330-F1344 HydrophobicContact CG2-CG 3.98Å; I1330-R1347 HydrophobicContact CG2-CG 4.38Å; I1330-R1347 WeakPolarHBondContact O-CB 3.48Å; I1330-R1347 WeakPolarHBondContact O-CD 3.29Å; I1330-R1347 VanDerWaalsContact O-CG 3.3Å; I1330-R1347 WeakPolarHBondContact O-CG 3.18Å
1331	M	95.5	Very high	90	Very high	1 Å²	1	26 Å²	26	1%	0.005	15%	0.146	C	C	.	.	H	α-helix	trans	-64.5	-24.4	-176.8	-71.1	-57.5	-59.3	0	0	114.7	L1312 A1315 F1327 L1328 K1346 R1347 D1348 L1349	L1312-M1331 HydrophobicContact CD2-CB 4.03Å; L1312-M1331 HydrophobicContact CD2-CG 3.94Å; A1315-M1331 HydrophobicContact CB-CE 3.73Å; A1315-M1331 HydrophobicContact CB-SD 3.55Å; A1315-M1331 VanDerWaalsContact CB-SD 3.55Å; F1327-M1331 HydrophobicContact CD1-CG 4.39Å; F1327-M1331 HydrophobicContact CD2-CG 4.02Å; F1327-M1331 HydrophobicContact CE1-CG 3.95Å; F1327-M1331 HydrophobicContact CE2-CG 3.5Å; F1327-M1331 HydrophobicContact CE2-SD 3.75Å; F1327-M1331 HydrophobicContact CG-CG 4.43Å; F1327-M1331 HydrophobicContact CZ-CG 3.48Å; F1327-M1331 VanDerWaalsContact CZ-CG 3.48Å; F1327-M1331 HydrophobicContact CZ-SD 3.93Å; F1327-M1331 WeakPolarHBondContact O-CG 3.41Å; F1327-M1331 PolarHBondContact O-N 3.4Å; L1328-M1331 WeakPolarHBondContact O-CA 3.49Å; L1328-M1331 PolarHBondContact O-N 3.37Å; M1331-K1346 WeakPolarHBondContact CE-O 3.45Å; M1331-R1347 CarbonylContact O-C 3.29Å; M1331-R1347 VanDerWaalsContact O-CA 3.3Å; M1331-R1347 WeakPolarHBondContact O-CA 3.41Å; M1331-D1348 PolarHBondContact O-N 3.22Å; M1331-L1349 HydrophobicContact CB-CB 4.06Å; M1331-L1349 HydrophobicContact CB-CD2 4.15Å; M1331-L1349 VanDerWaalsContact O-CB 3.25Å; M1331-L1349 WeakPolarHBondContact O-CB 3.46Å; M1331-L1349 PolarHBondContact O-N 3.39Å
1332	F	92.8	Very high	90	Very high	18 Å²	18	31.1 Å²	31.1	8%	0.079	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102	18.1	169.3	63.6	-101.6	0	0	0	114.5	Y1269 V1293 L1328 P1329 I1330 Q1334 L1349 A1351	Y1269-F1332 AromaticContact CE2-CE1 3.78Å; Y1269-F1332 HydrophobicContact CE2-CE1 3.78Å; Y1269-F1332 AromaticContact CE2-CZ 3.99Å; Y1269-F1332 HydrophobicContact CE2-CZ 3.99Å; V1293-F1332 HydrophobicContact CB-CE2 4.41Å; V1293-F1332 HydrophobicContact CG1-CD2 4.01Å; V1293-F1332 HydrophobicContact CG1-CE1 4.47Å; V1293-F1332 HydrophobicContact CG1-CE2 3.65Å; V1293-F1332 HydrophobicContact CG1-CZ 3.91Å; V1293-F1332 HydrophobicContact CG2-CE2 4.01Å; V1293-F1332 HydrophobicContact CG2-CZ 3.82Å; L1328-F1332 VanDerWaalsContact C-CD1 3.44Å; L1328-F1332 HydrophobicContact CB-CE1 4.26Å; L1328-F1332 WeakPolarHBondContact O-CD1 3.36Å; L1328-F1332 WeakPolarHBondContact O-CE1 3.38Å; L1328-F1332 PolarHBondContact O-N 3.31Å; L1328-F1332 VanDerWaalsContact O-N 3.12Å; P1329-F1332 VanDerWaalsContact CA-CE1 3.43Å; P1329-F1332 HydrophobicContact CB-CE1 4.25Å; P1329-F1332 HydrophobicContact CB-CE2 4.24Å; P1329-F1332 HydrophobicContact CB-CZ 3.88Å; P1329-F1332 HydrophobicContact CG-CE1 4.12Å; P1329-F1332 HydrophobicContact CG-CZ 3.85Å; I1330-F1332 VanDerWaalsContact C-N 3.26Å; I1330-F1332 PolarHBondContact O-N 2.96Å; F1332-Q1334 VanDerWaalsContact C-N 3.25Å; F1332-Q1334 HydrophobicContact CD2-CB 3.74Å; F1332-Q1334 HydrophobicContact CD2-CG 3.54Å; F1332-Q1334 HydrophobicContact CE2-CB 3.65Å; F1332-Q1334 HydrophobicContact CE2-CG 3.78Å; F1332-Q1334 PolarHBondContact O-N 3.45Å; F1332-Q1334 VanDerWaalsContact O-N 3.13Å; F1332-L1349 HydrophobicContact CB-CB 4.29Å; F1332-L1349 WeakPolarHBondContact CB-O 3.49Å; F1332-L1349 HydrophobicContact CD1-CD2 4.37Å; F1332-A1351 HydrophobicContact CB-CB 3.64Å; F1332-A1351 HydrophobicContact CD1-CB 3.34Å; F1332-A1351 HydrophobicContact CD2-CB 4.12Å; F1332-A1351 HydrophobicContact CE1-CB 3.93Å; F1332-A1351 HydrophobicContact CG-CB 3.48Å; F1332-A1351 VanDerWaalsContact CG-CB 3.48Å
1333	D	92.5	Very high	90	Very high	68 Å²	68	33.3 Å²	33.3	36%	0.364	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.8	10	172.4	-157.2	43.8	0	0	0	117.3	P1329 I1330 K1341 R1347	P1329-D1333 PolarHBondContact O-N 3.28Å; I1330-D1333 WeakPolarHBondContact O-CA 3.41Å; I1330-D1333 PolarHBondContact O-N 2.97Å; D1333-K1341 PolarHBondContact O-NZ 3.08Å; D1333-K1341 WeakPolarHBondContact OD1-CE 3.48Å; D1333-K1341 IonicContact OD1-NZ 2.9Å; D1333-K1341 PolarHBondContact OD1-NZ 3.03Å; D1333-K1341 IonicContact OD2-NZ 3.61Å; D1333-R1347 HydrophobicContact CB-CB 4.09Å; D1333-R1347 IonicContact OD1-CZ 3.24Å; D1333-R1347 VanDerWaalsContact OD1-CZ 3.26Å; D1333-R1347 IonicContact OD1-NE 3.78Å; D1333-R1347 PolarHBondContact OD1-NE 3.42Å; D1333-R1347 IonicContact OD1-NH2 2.72Å; D1333-R1347 PolarHBondContact OD1-NH2 3.32Å
1334	Q	87.5	Confident	90.2	Very high	103 Å²	103	33.3 Å²	33.3	48%	0.481	18%	0.183	S	C	.	.			trans	-92.6	0.3	-179.2	-63.3	-62.1	-45.2	0	0	115.1	P1329 F1332	P1329-Q1334 PolarHBondContact O-N 2.65Å; F1332-Q1334 VanDerWaalsContact C-N 3.25Å; F1332-Q1334 HydrophobicContact CD2-CB 3.74Å; F1332-Q1334 HydrophobicContact CD2-CG 3.54Å; F1332-Q1334 HydrophobicContact CE2-CB 3.65Å; F1332-Q1334 HydrophobicContact CE2-CG 3.78Å; F1332-Q1334 PolarHBondContact O-N 3.45Å; F1332-Q1334 VanDerWaalsContact O-N 3.13Å
1335	H	86.9	Confident	89.9	Confident	5 Å²	5	39.1 Å²	39.1	2%	0.023	22%	0.218	C	C	.	.			trans	-66	139.5	176.9	-165.4	-75.4	0	0	0	112.4	Y1295 E1326 P1329 I1330 V1337 W1340 K1341	Y1295-H1335 AromaticContact CE2-CD2 3.55Å; Y1295-H1335 AromaticContact CE2-NE2 3.71Å; Y1295-H1335 AromaticContact CZ-NE2 3.66Å; Y1295-H1335 PolarHBondContact OH-NE2 3.39Å; E1326-H1335 WeakPolarHBondContact CB-NE2 3.19Å; E1326-H1335 WeakPolarHBondContact CG-NE2 3.36Å; E1326-H1335 PolarHBondContact O-CD2 2.99Å; E1326-H1335 IonicContact OE1-NE2 2.75Å; E1326-H1335 PolarHBondContact OE1-NE2 3.3Å; E1326-H1335 VanDerWaalsContact OE1-NE2 3.1Å; E1326-H1335 IonicContact OE2-CD2 3.33Å; E1326-H1335 PolarHBondContact OE2-CD2 3.47Å; E1326-H1335 CovalentContact OE2-NE2 1.78Å; E1326-H1335 IonicContact OE2-NE2 3.03Å; E1326-H1335 PolarHBondContact OE2-NE2 3.02Å; P1329-H1335 HydrophobicContact CB-CB 4.21Å; P1329-H1335 PolarHBondContact O-N 3.14Å; P1329-H1335 VanDerWaalsContact O-N 3.13Å; I1330-H1335 HydrophobicContact CB-CB 4.41Å; I1330-H1335 HydrophobicContact CG1-CB 3.57Å; H1335-V1337 WeakPolarHBondContact CE1-CB 3.41Å; H1335-V1337 WeakPolarHBondContact CE1-CG2 3.31Å; H1335-V1337 PolarHBondContact ND1-N 2.92Å; H1335-W1340 AromaticContact CE1-CD2 3.65Å; H1335-W1340 AromaticContact CE1-CE3 2.74Å; H1335-W1340 AromaticContact CE1-CH2 3.84Å; H1335-W1340 AromaticContact CE1-CZ3 2.85Å; H1335-W1340 WeakPolarHBondContact CE1-CZ3 3.33Å; H1335-W1340 AromaticContact NE2-CE3 3.5Å; H1335-W1340 AromaticContact NE2-CZ3 3.29Å; H1335-W1340 VanDerWaalsContact NE2-CZ3 3.29Å; H1335-W1340 WeakPolarHBondContact NE2-CZ3 3.37Å; H1335-K1341 HydrophobicContact CB-CD 3.96Å; H1335-K1341 HydrophobicContact CB-CG 3.95Å; H1335-K1341 WeakPolarHBondContact O-CD 3.45Å
1336	P	83.5	Confident	90.1	Very high	81 Å²	81	44 Å²	44	53%	0.526	24%	0.238	S	C	.	.	S	Bend	trans	-80.7	-15.1	-176.6	30.8	-37.1	0	0	0	115.3	Y1295	Y1295-P1336 HydrophobicContact CD1-CG 3.7Å; Y1295-P1336 VanDerWaalsContact CE1-CD 3.45Å; Y1295-P1336 HydrophobicContact CE1-CG 3.43Å; Y1295-P1336 VanDerWaalsContact CE1-CG 3.43Å; Y1295-P1336 HydrophobicContact CE2-CG 4.5Å; Y1295-P1336 HydrophobicContact CG-CG 4.34Å
1337	V	85.5	Confident	90.3	Very high	48 Å²	48	47 Å²	47	29%	0.291	25%	0.249	S	C	.	.			trans	-101.4	100.6	-175.1	-174.8	0	0	0	0	111	H1335 A1339 W1340 K1341	H1335-V1337 WeakPolarHBondContact CE1-CB 3.41Å; H1335-V1337 WeakPolarHBondContact CE1-CG2 3.31Å; H1335-V1337 PolarHBondContact ND1-N 2.92Å; V1337-A1339 HydrophobicContact CG1-CB 4.07Å; V1337-A1339 PolarHBondContact O-N 3.07Å; V1337-W1340 HydrophobicContact CB-CD2 4.01Å; V1337-W1340 HydrophobicContact CB-CE3 4.14Å; V1337-W1340 HydrophobicContact CB-CG 4.27Å; V1337-W1340 HydrophobicContact CG1-CD2 3.89Å; V1337-W1340 HydrophobicContact CG1-CG 3.92Å; V1337-W1340 HydrophobicContact CG2-CE3 4.37Å; V1337-W1340 HydrophobicContact CG2-CH2 4.5Å; V1337-W1340 HydrophobicContact CG2-CZ3 4.35Å; V1337-W1340 PolarHBondContact O-N 3.47Å; V1337-W1340 VanDerWaalsContact O-N 3.15Å; V1337-K1341 PolarHBondContact O-N 3.43Å; V1337-K1341 VanDerWaalsContact O-N 3.15Å
1338	D	87.2	Confident	90.3	Very high	102 Å²	102	49.6 Å²	49.6	55%	0.545	26%	0.263	S	S	.	.	H	α-helix	trans	-57.9	-32.7	179	-76.4	-36.6	0	0	0	113.6	W1340 K1341 N1342	D1338-W1340 VanDerWaalsContact C-N 3.28Å; D1338-W1340 PolarHBondContact O-N 3.07Å; D1338-K1341 PolarHBondContact O-N 2.93Å; D1338-N1342 WeakPolarHBondContact O-CB 3.47Å; D1338-N1342 PolarHBondContact O-N 3.21Å; D1338-N1342 PolarHBondContact O-ND2 3.35Å; D1338-N1342 VanDerWaalsContact O-ND2 3.14Å
1339	A	87.5	Confident	90.3	Very high	47 Å²	47	49.9 Å²	49.9	39%	0.388	27%	0.265	S	S	.	.	H	α-helix	trans	-59	-38.5	178.6	0	0	0	0	0	112.7	V1337 H1343	V1337-A1339 HydrophobicContact CG1-CB 4.07Å; V1337-A1339 PolarHBondContact O-N 3.07Å; A1339-H1343 PolarHBondContact O-ND1 3.28Å
1340	W	89.3	Confident	90.6	Very high	13 Å²	13	52.2 Å²	52.2	5%	0.049	28%	0.277	C	S	.	.	H	α-helix	trans	-81.4	-40.8	177.8	-52.4	-15	0	0	0	110.6	I1196 E1198 Y1199 R1200 P1202 E1326 I1330 H1335 V1337 D1338 N1342 H1343	I1196-W1340 HydrophobicContact CD1-CB 3.87Å; I1196-W1340 HydrophobicContact CD1-CG 3.81Å; E1198-W1340 PolarHBondContact O-NE1 2.97Å; Y1199-W1340 AromaticContact CD2-CD2 3.98Å; Y1199-W1340 HydrophobicContact CD2-CD2 3.98Å; Y1199-W1340 AromaticContact CD2-CE2 3.79Å; Y1199-W1340 AromaticContact CD2-CE3 3.92Å; Y1199-W1340 HydrophobicContact CD2-CE3 3.92Å; Y1199-W1340 AromaticContact CD2-CH2 3.57Å; Y1199-W1340 HydrophobicContact CD2-CH2 3.57Å; Y1199-W1340 AromaticContact CD2-CZ2 3.61Å; Y1199-W1340 HydrophobicContact CD2-CZ2 3.61Å; Y1199-W1340 AromaticContact CD2-CZ3 3.74Å; Y1199-W1340 HydrophobicContact CD2-CZ3 3.74Å; Y1199-W1340 HydrophobicContact CE2-CE3 4.21Å; Y1199-W1340 AromaticContact CE2-CH2 3.5Å; Y1199-W1340 HydrophobicContact CE2-CH2 3.5Å; Y1199-W1340 HydrophobicContact CE2-CZ2 4.01Å; Y1199-W1340 AromaticContact CE2-CZ3 3.62Å; Y1199-W1340 HydrophobicContact CE2-CZ3 3.62Å; Y1199-W1340 HydrophobicContact CG-CZ2 4.45Å; R1200-W1340 WeakPolarHBondContact O-CZ2 3.32Å; P1202-W1340 HydrophobicContact CG-CH2 3.86Å; P1202-W1340 HydrophobicContact CG-CZ3 4.44Å; E1326-W1340 HydrophobicContact CG-CZ3 4.38Å; E1326-W1340 WeakPolarHBondContact OE1-CZ3 3.47Å; I1330-W1340 HydrophobicContact CD1-CB 3.94Å; H1335-W1340 AromaticContact CE1-CD2 3.65Å; H1335-W1340 AromaticContact CE1-CE3 2.74Å; H1335-W1340 AromaticContact CE1-CH2 3.84Å; H1335-W1340 AromaticContact CE1-CZ3 2.85Å; H1335-W1340 WeakPolarHBondContact CE1-CZ3 3.33Å; H1335-W1340 AromaticContact NE2-CE3 3.5Å; H1335-W1340 AromaticContact NE2-CZ3 3.29Å; H1335-W1340 VanDerWaalsContact NE2-CZ3 3.29Å; H1335-W1340 WeakPolarHBondContact NE2-CZ3 3.37Å; V1337-W1340 HydrophobicContact CB-CD2 4.01Å; V1337-W1340 HydrophobicContact CB-CE3 4.14Å; V1337-W1340 HydrophobicContact CB-CG 4.27Å; V1337-W1340 HydrophobicContact CG1-CD2 3.89Å; V1337-W1340 HydrophobicContact CG1-CG 3.92Å; V1337-W1340 HydrophobicContact CG2-CE3 4.37Å; V1337-W1340 HydrophobicContact CG2-CH2 4.5Å; V1337-W1340 HydrophobicContact CG2-CZ3 4.35Å; V1337-W1340 PolarHBondContact O-N 3.47Å; V1337-W1340 VanDerWaalsContact O-N 3.15Å; D1338-W1340 VanDerWaalsContact C-N 3.28Å; D1338-W1340 PolarHBondContact O-N 3.07Å; W1340-N1342 PolarHBondContact O-N 3.16Å; W1340-H1343 WeakPolarHBondContact O-CB 3.37Å; W1340-H1343 PolarHBondContact O-N 3.37Å; W1340-H1343 VanDerWaalsContact O-N 3.14Å
1341	K	90.3	Very high	90.6	Very high	19 Å²	19	52.9 Å²	52.9	8%	0.083	28%	0.282	C	S	.	.	H	α-helix	trans	-53.9	-40.1	172.7	-72.8	178.1	53.8	164.1	0	112.5	I1330 D1333 H1335 V1337 D1338 H1343 F1344 R1347	I1330-K1341 HydrophobicContact CG1-CG 4.04Å; I1330-K1341 HydrophobicContact CG2-CG 4.33Å; D1333-K1341 PolarHBondContact O-NZ 3.08Å; D1333-K1341 WeakPolarHBondContact OD1-CE 3.48Å; D1333-K1341 IonicContact OD1-NZ 2.9Å; D1333-K1341 PolarHBondContact OD1-NZ 3.03Å; D1333-K1341 IonicContact OD2-NZ 3.61Å; H1335-K1341 HydrophobicContact CB-CD 3.96Å; H1335-K1341 HydrophobicContact CB-CG 3.95Å; H1335-K1341 WeakPolarHBondContact O-CD 3.45Å; V1337-K1341 PolarHBondContact O-N 3.43Å; V1337-K1341 VanDerWaalsContact O-N 3.15Å; D1338-K1341 PolarHBondContact O-N 2.93Å; K1341-H1343 PolarHBondContact O-N 2.96Å; K1341-H1343 VanDerWaalsContact O-N 3.14Å; K1341-F1344 CarbonylContact O-C 3.6Å; K1341-F1344 WeakPolarHBondContact O-CA 3.24Å; K1341-F1344 PolarHBondContact O-N 3Å; K1341-R1347 PolarHBondContact O-NH1 3.28Å
1342	N	91.3	Very high	90.6	Very high	107 Å²	107	54 Å²	54	57%	0.572	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-19.9	-178.1	-73.8	-23.6	0	0	0	114.5	D1338 W1340 F1344	D1338-N1342 WeakPolarHBondContact O-CB 3.47Å; D1338-N1342 PolarHBondContact O-N 3.21Å; D1338-N1342 PolarHBondContact O-ND2 3.35Å; D1338-N1342 VanDerWaalsContact O-ND2 3.14Å; W1340-N1342 PolarHBondContact O-N 3.16Å; N1342-F1344 VanDerWaalsContact C-N 3.25Å; N1342-F1344 PolarHBondContact O-N 2.8Å
1343	H	91.2	Very high	90.6	Very high	47 Å²	47	53.1 Å²	53.1	22%	0.218	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-22.1	172.2	-73.3	78.8	0	0	0	112.9	I1196 E1198 R1320 A1339 W1340 K1341	I1196-H1343 HydrophobicContact CG2-CB 4.32Å; I1196-H1343 VanDerWaalsContact CG2-CD2 3.49Å; I1196-H1343 WeakPolarHBondContact CG2-CD2 3.48Å; E1198-H1343 IonicContact OE1-CE1 3.43Å; E1198-H1343 PolarHBondContact OE1-CE1 3.28Å; E1198-H1343 IonicContact OE1-NE2 3.45Å; E1198-H1343 IonicContact OE2-CE1 3.63Å; E1198-H1343 IonicContact OE2-NE2 2.82Å; R1320-H1343 WeakPolarHBondContact CD-O 3.45Å; R1320-H1343 HydrophobicContact CG-CB 4.49Å; R1320-H1343 PolarHBondContact NH1-O 2.94Å; A1339-H1343 PolarHBondContact O-ND1 3.28Å; W1340-H1343 WeakPolarHBondContact O-CB 3.37Å; W1340-H1343 PolarHBondContact O-N 3.37Å; W1340-H1343 VanDerWaalsContact O-N 3.14Å; K1341-H1343 PolarHBondContact O-N 2.96Å; K1341-H1343 VanDerWaalsContact O-N 3.14Å
1344	F	92.3	Very high	90.5	Very high	4 Å²	4	50 Å²	50	2%	0.018	27%	0.267	C	S	.	.			trans	-119.7	92.6	-177.4	-62	-77.2	0	0	0	109.4	A1315 P1317 R1320 F1327 I1330 K1341 N1342 R1347	A1315-F1344 HydrophobicContact CB-CD1 4.13Å; A1315-F1344 HydrophobicContact CB-CE1 4.45Å; P1317-F1344 HydrophobicContact CB-CE1 4.23Å; P1317-F1344 HydrophobicContact CB-CZ 4.42Å; R1320-F1344 HydrophobicContact CB-CE1 4.19Å; R1320-F1344 HydrophobicContact CB-CE2 4.36Å; R1320-F1344 HydrophobicContact CB-CZ 3.76Å; R1320-F1344 VanDerWaalsContact O-CZ 3.24Å; R1320-F1344 WeakPolarHBondContact O-CZ 3.31Å; F1327-F1344 HydrophobicContact CD2-CD1 4.49Å; F1327-F1344 HydrophobicContact CD2-CE1 4.03Å; F1327-F1344 HydrophobicContact CD2-CE2 4.19Å; F1327-F1344 AromaticContact CD2-CZ 3.84Å; F1327-F1344 HydrophobicContact CD2-CZ 3.84Å; F1327-F1344 AromaticContact CE2-CD1 3.95Å; F1327-F1344 HydrophobicContact CE2-CD1 3.95Å; F1327-F1344 AromaticContact CE2-CE1 3.6Å; F1327-F1344 HydrophobicContact CE2-CE1 3.6Å; F1327-F1344 AromaticContact CE2-CZ 3.9Å; F1327-F1344 HydrophobicContact CE2-CZ 3.9Å; I1330-F1344 HydrophobicContact CD1-CD2 4.39Å; I1330-F1344 HydrophobicContact CG2-CB 3.68Å; I1330-F1344 HydrophobicContact CG2-CD2 3.75Å; I1330-F1344 HydrophobicContact CG2-CG 3.98Å; K1341-F1344 CarbonylContact O-C 3.6Å; K1341-F1344 WeakPolarHBondContact O-CA 3.24Å; K1341-F1344 PolarHBondContact O-N 3Å; N1342-F1344 VanDerWaalsContact C-N 3.25Å; N1342-F1344 PolarHBondContact O-N 2.8Å; F1344-R1347 HydrophobicContact CB-CG 4.44Å; F1344-R1347 WeakPolarHBondContact O-CD 3.38Å; F1344-R1347 WeakPolarHBondContact O-CG 3.44Å; F1344-R1347 PolarHBondContact O-NH1 3.04Å
1345	V	86.7	Confident	90.4	Very high	129 Å²	129	47.4 Å²	47.4	78%	0.782	26%	0.258	S	S	*	.			trans	-74.3	-33.5	-173.2	-178.1	0	0	0	0	112.4
1346	K	91	Very high	90.2	Very high	130 Å²	130	49.3 Å²	49.3	57%	0.565	27%	0.271	S	S	*	.			trans	-98.5	103.4	179.7	-171.6	-175.6	174.9	-159	0	109.6	M1331 D1348	M1331-K1346 WeakPolarHBondContact CE-O 3.45Å; K1346-D1348 VanDerWaalsContact CE-OD1 3.25Å; K1346-D1348 WeakPolarHBondContact CE-OD1 3.49Å; K1346-D1348 WeakPolarHBondContact CE-OD2 3.49Å; K1346-D1348 IonicContact NZ-OD1 2.95Å; K1346-D1348 IonicContact NZ-OD2 3.17Å; K1346-D1348 PolarHBondContact NZ-OD2 3.16Å
1347	R	93.4	Very high	90.4	Very high	64 Å²	64	46.1 Å²	46.1	24%	0.242	25%	0.249	C	C	.	.			trans	-121.6	65	-175.2	-58.7	-177.9	-57.8	-114.4	13.8	109.7	I1330 M1331 D1333 K1341 F1344	I1330-R1347 HydrophobicContact CG2-CG 4.38Å; I1330-R1347 WeakPolarHBondContact O-CB 3.48Å; I1330-R1347 WeakPolarHBondContact O-CD 3.29Å; I1330-R1347 VanDerWaalsContact O-CG 3.3Å; I1330-R1347 WeakPolarHBondContact O-CG 3.18Å; M1331-R1347 CarbonylContact O-C 3.29Å; M1331-R1347 VanDerWaalsContact O-CA 3.3Å; M1331-R1347 WeakPolarHBondContact O-CA 3.41Å; D1333-R1347 HydrophobicContact CB-CB 4.09Å; D1333-R1347 IonicContact OD1-CZ 3.24Å; D1333-R1347 VanDerWaalsContact OD1-CZ 3.26Å; D1333-R1347 IonicContact OD1-NE 3.78Å; D1333-R1347 PolarHBondContact OD1-NE 3.42Å; D1333-R1347 IonicContact OD1-NH2 2.72Å; D1333-R1347 PolarHBondContact OD1-NH2 3.32Å; K1341-R1347 PolarHBondContact O-NH1 3.28Å; F1344-R1347 HydrophobicContact CB-CG 4.44Å; F1344-R1347 WeakPolarHBondContact O-CD 3.38Å; F1344-R1347 WeakPolarHBondContact O-CG 3.44Å; F1344-R1347 PolarHBondContact O-NH1 3.04Å
1348	D	93.6	Very high	90.6	Very high	55 Å²	55	44 Å²	44	29%	0.294	24%	0.236	S	C	.	.			trans	-110.6	21.7	-171.6	72.1	-35.2	0	0	0	113.8	K1311 M1331 K1346 N1350	K1311-D1348 WeakPolarHBondContact CE-O 3Å; K1311-D1348 WeakPolarHBondContact CE-OD2 3.42Å; K1311-D1348 PolarHBondContact NZ-O 3.39Å; K1311-D1348 IonicContact NZ-OD2 2.68Å; M1331-D1348 PolarHBondContact O-N 3.22Å; K1346-D1348 VanDerWaalsContact CE-OD1 3.25Å; K1346-D1348 WeakPolarHBondContact CE-OD1 3.49Å; K1346-D1348 WeakPolarHBondContact CE-OD2 3.49Å; K1346-D1348 IonicContact NZ-OD1 2.95Å; K1346-D1348 IonicContact NZ-OD2 3.17Å; K1346-D1348 PolarHBondContact NZ-OD2 3.16Å; D1348-N1350 PolarHBondContact O-N 3.02Å
1349	L	95.4	Very high	90.7	Very high	6 Å²	6	39.2 Å²	39.2	3%	0.031	21%	0.21	C	C	.	.			trans	-75.8	117.7	177.8	-167.8	79.2	0	0	0	110.7	D1266 L1267 K1311 L1312 M1331 F1332 A1351	D1266-L1349 HydrophobicContact CB-CD1 3.65Å; D1266-L1349 HydrophobicContact CB-CG 4.07Å; L1267-L1349 HydrophobicContact CB-CD2 4.25Å; L1267-L1349 HydrophobicContact CD1-CD2 4.4Å; K1311-L1349 HydrophobicContact CB-CD1 4.13Å; K1311-L1349 HydrophobicContact CD-CD1 4.37Å; L1312-L1349 HydrophobicContact CD2-CD1 4.13Å; L1312-L1349 HydrophobicContact CD2-CD2 3.83Å; L1312-L1349 HydrophobicContact CG-CD1 4.08Å; M1331-L1349 HydrophobicContact CB-CB 4.06Å; M1331-L1349 HydrophobicContact CB-CD2 4.15Å; M1331-L1349 VanDerWaalsContact O-CB 3.25Å; M1331-L1349 WeakPolarHBondContact O-CB 3.46Å; M1331-L1349 PolarHBondContact O-N 3.39Å; F1332-L1349 HydrophobicContact CB-CB 4.29Å; F1332-L1349 WeakPolarHBondContact CB-O 3.49Å; F1332-L1349 HydrophobicContact CD1-CD2 4.37Å; L1349-A1351 VanDerWaalsContact C-N 3.35Å; L1349-A1351 PolarHBondContact O-N 3.17Å
1350	N	95.4	Very high	90.2	Very high	50 Å²	50	40.9 Å²	40.9	27%	0.267	21%	0.207	S	C	.	.			trans	-79.1	82.3	176.3	-73.3	-6	0	0	0	110.4	D1264 D1266 L1267 D1348 Y1352	D1264-N1350 VanDerWaalsContact O-CB 3.24Å; D1264-N1350 WeakPolarHBondContact O-CB 3.46Å; D1264-N1350 PolarHBondContact O-ND2 2.92Å; D1264-N1350 PolarHBondContact OD2-ND2 3.33Å; D1266-N1350 HydrophobicContact CB-CB 4.27Å; D1266-N1350 PolarHBondContact N-O 3.28Å; D1266-N1350 WeakPolarHBondContact OD2-CB 3.42Å; D1266-N1350 PolarHBondContact OD2-N 2.77Å; L1267-N1350 PolarHBondContact N-O 2.97Å; D1348-N1350 PolarHBondContact O-N 3.02Å; N1350-Y1352 HydrophobicContact CB-CE2 4.15Å
1351	A	94.5	Very high	89.2	Confident	13 Å²	13	42 Å²	42	11%	0.107	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	146.5	179.6	0	0	0	0	0	113.2	L1267 V1293 F1332 L1349	L1267-A1351 HydrophobicContact CB-CB 4.45Å; L1267-A1351 HydrophobicContact CD2-CB 4.33Å; L1267-A1351 CarbonylContact O-C 3.54Å; L1267-A1351 VanDerWaalsContact O-CA 3.29Å; L1267-A1351 WeakPolarHBondContact O-CA 3.37Å; V1293-A1351 VanDerWaalsContact CG1-C 3.48Å; V1293-A1351 HydrophobicContact CG1-CB 3.61Å; V1293-A1351 WeakPolarHBondContact CG1-O 3.5Å; F1332-A1351 HydrophobicContact CB-CB 3.64Å; F1332-A1351 HydrophobicContact CD1-CB 3.34Å; F1332-A1351 HydrophobicContact CD2-CB 4.12Å; F1332-A1351 HydrophobicContact CE1-CB 3.93Å; F1332-A1351 HydrophobicContact CG-CB 3.48Å; F1332-A1351 VanDerWaalsContact CG-CB 3.48Å; L1349-A1351 VanDerWaalsContact C-N 3.35Å; L1349-A1351 PolarHBondContact O-N 3.17Å
1352	Y	94.3	Very high	87.8	Confident	24 Å²	24	44.1 Å²	44.1	9%	0.094	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	-178.4	176.6	-60.6	-88.5	0	0	0	110.4	V1262 W1265 L1267 V1268 Y1269 V1284 V1290 G1291 N1350	V1262-Y1352 HydrophobicContact CG1-CD1 4.38Å; V1262-Y1352 HydrophobicContact CG1-CD2 4.1Å; V1262-Y1352 HydrophobicContact CG1-CE1 3.8Å; V1262-Y1352 HydrophobicContact CG1-CE2 3.51Å; V1262-Y1352 WeakPolarHBondContact CG1-OH 3.11Å; W1265-Y1352 HydrophobicContact CB-CD2 3.82Å; W1265-Y1352 HydrophobicContact CB-CE2 3.94Å; L1267-Y1352 PolarHBondContact O-N 3.35Å; V1268-Y1352 CarbonylContact C-O 3.06Å; V1268-Y1352 WeakPolarHBondContact CA-O 3.5Å; Y1269-Y1352 PolarHBondContact N-O 3.36Å; V1284-Y1352 HydrophobicContact CG2-CD1 3.51Å; V1284-Y1352 HydrophobicContact CG2-CE1 3.59Å; V1290-Y1352 HydrophobicContact CG1-CD1 4.03Å; V1290-Y1352 HydrophobicContact CG1-CG 4.1Å; G1291-Y1352 WeakPolarHBondContact O-CA 3.23Å; G1291-Y1352 WeakPolarHBondContact O-CB 3.39Å; N1350-Y1352 HydrophobicContact CB-CE2 4.15Å
1353	T	92.5	Very high	85.3	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	152.5	176.6	-173.4	0	0	0	0	110.3	Y1269 R1272 G1291 V1293 V1355 L1357	Y1269-T1353 CarbonylContact O-C 3.59Å; Y1269-T1353 WeakPolarHBondContact O-CA 3.49Å; R1272-T1353 PolarHBondContact NE-OG1 3.4Å; R1272-T1353 VanDerWaalsContact NH2-CB 3.27Å; R1272-T1353 PolarHBondContact NH2-OG1 3.28Å; G1291-T1353 PolarHBondContact N-O 3.12Å; G1291-T1353 PolarHBondContact O-N 3.45Å; V1293-T1353 HydrophobicContact CB-CG2 4.37Å; T1353-V1355 HydrophobicContact CG2-CG2 4.09Å; T1353-L1357 WeakPolarHBondContact OG1-CD2 3.3Å
1354	S	91.8	Very high	82.2	Confident	3 Å²	3	51.1 Å²	51.1	2%	0.021	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	144.4	165.3	77.4	0	0	0	0	110.4	Y1269 M1289 P1356 L1357 L1358	Y1269-S1354 PolarHBondContact O-N 3.25Å; M1289-S1354 CarbonylContact O-C 3.19Å; M1289-S1354 VanDerWaalsContact O-CA 3.32Å; M1289-S1354 WeakPolarHBondContact O-CA 3.42Å; S1354-P1356 CarbonylContact C-O 3.35Å; S1354-P1356 WeakPolarHBondContact CB-O 3.38Å; S1354-P1356 CarbonylContact O-C 3.6Å; S1354-P1356 PolarHBondContact OG-O 3.08Å; S1354-L1357 PolarHBondContact O-N 2.58Å; S1354-L1357 WeakPolarHBondContact OG-CA 3.33Å; S1354-L1358 PolarHBondContact OG-N 3.01Å
1355	V	84.5	Confident	79	Confident	49 Å²	49	57.1 Å²	57.1	30%	0.297	30%	0.295	S	S	.	.	S	Bend	trans	-132.1	104.3	177.7	-178.6	0	0	0	0	107.7	L1283 M1289 T1353	L1283-V1355 HydrophobicContact CD2-CB 3.9Å; L1283-V1355 HydrophobicContact CD2-CG1 4.13Å; L1283-V1355 HydrophobicContact CD2-CG2 4.25Å; M1289-V1355 WeakPolarHBondContact CA-O 3.38Å; M1289-V1355 PolarHBondContact O-N 3.34Å; T1353-V1355 HydrophobicContact CG2-CG2 4.09Å
1356	P	82.3	Confident	76	Confident	45 Å²	45	57.2 Å²	57.2	29%	0.292	29%	0.289	S	S	.	.	S	Bend	cis	-69.3	166.1	-1	31.4	-36.3	0	0	0	113.4	R1244 S1354	R1244-P1356 VanDerWaalsContact CZ-CG 3.43Å; S1354-P1356 CarbonylContact C-O 3.35Å; S1354-P1356 WeakPolarHBondContact CB-O 3.38Å; S1354-P1356 CarbonylContact O-C 3.6Å; S1354-P1356 PolarHBondContact OG-O 3.08Å
1357	L	88	Confident	72.7	Confident	14 Å²	14	56.1 Å²	56.1	7%	0.073	30%	0.297	C	S	.	.			trans	-58.6	140.6	164.3	-65	173.8	0	0	0	110.1	L1270 R1272 T1353 S1354 Y1360	L1270-L1357 CarbonylContact O-C 3.49Å; R1272-L1357 HydrophobicContact CG-CD1 4.43Å; R1272-L1357 HydrophobicContact CG-CD2 4.21Å; R1272-L1357 VanDerWaalsContact O-CD1 3.31Å; R1272-L1357 WeakPolarHBondContact O-CD1 3.15Å; T1353-L1357 WeakPolarHBondContact OG1-CD2 3.3Å; S1354-L1357 PolarHBondContact O-N 2.58Å; S1354-L1357 WeakPolarHBondContact OG-CA 3.33Å; L1357-Y1360 HydrophobicContact CB-CE1 3.94Å; L1357-Y1360 VanDerWaalsContact O-CZ 3.32Å; L1357-Y1360 PolarHBondContact O-OH 2.8Å
1358	L	90.7	Very high	69.4	Low	4 Å²	4	56.9 Å²	56.9	2%	0.021	31%	0.31	C	S	.	.	S	Bend	trans	-97.9	-16.6	-176.6	-55.9	-170.7	0	0	0	113	R1244 F1247 W1250 V1251 L1254 L1270 S1354	R1244-L1358 WeakPolarHBondContact CB-O 3.47Å; R1244-L1358 PolarHBondContact N-O 3.15Å; F1247-L1358 HydrophobicContact CD2-CB 3.95Å; F1247-L1358 HydrophobicContact CE2-CB 3.87Å; W1250-L1358 HydrophobicContact CB-CD1 3.64Å; W1250-L1358 HydrophobicContact CB-CD2 3.49Å; W1250-L1358 VanDerWaalsContact CB-CD2 3.49Å; W1250-L1358 HydrophobicContact CB-CG 4.19Å; W1250-L1358 HydrophobicContact CD2-CD2 4.46Å; W1250-L1358 HydrophobicContact CG-CD2 3.84Å; V1251-L1358 HydrophobicContact CG2-CD1 3.67Å; L1254-L1358 HydrophobicContact CD2-CD1 4.23Å; L1270-L1358 HydrophobicContact CD2-CD1 4.34Å; L1270-L1358 PolarHBondContact O-N 3.35Å; S1354-L1358 PolarHBondContact OG-N 3.01Å
1359	V	89.3	Confident	66.2	Low	0 Å²	0	57.1 Å²	57.1	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	152.1	167.2	-51	0	0	0	0	111.5	L1241 R1242 F1243 F1247 L1270 G1271 L1300 A1301	L1241-V1359 HydrophobicContact CB-CB 4.2Å; L1241-V1359 HydrophobicContact CB-CG2 4.23Å; L1241-V1359 HydrophobicContact CD1-CB 4.02Å; L1241-V1359 HydrophobicContact CD1-CG1 3.88Å; L1241-V1359 HydrophobicContact CD2-CB 4.41Å; L1241-V1359 HydrophobicContact CD2-CG1 4.4Å; L1241-V1359 HydrophobicContact CD2-CG2 4.16Å; L1241-V1359 HydrophobicContact CG-CB 4.45Å; R1242-V1359 CarbonylContact O-C 3.42Å; R1242-V1359 VanDerWaalsContact O-CA 3.27Å; R1242-V1359 WeakPolarHBondContact O-CA 3.49Å; F1243-V1359 HydrophobicContact CD1-CG1 3.83Å; F1243-V1359 HydrophobicContact CE1-CG1 4.18Å; F1247-V1359 HydrophobicContact CD2-CG1 4.29Å; F1247-V1359 HydrophobicContact CE2-CG1 3.74Å; F1247-V1359 HydrophobicContact CZ-CG1 4.47Å; L1270-V1359 PolarHBondContact O-N 3.08Å; G1271-V1359 WeakPolarHBondContact CA-O 3.14Å; L1300-V1359 HydrophobicContact CB-CG2 4.28Å; A1301-V1359 HydrophobicContact CB-CG2 3.64Å
1360	Y	77.3	Confident	62.8	Low	83 Å²	83	62 Å²	62	33%	0.325	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	155.7	-174.9	-61.7	-77.4	0	0	0	110.5	L1241 R1242 R1244 L1357	L1241-Y1360 CarbonylContact C-O 3.6Å; L1241-Y1360 WeakPolarHBondContact CA-O 3.16Å; R1242-Y1360 PolarHBondContact N-O 3.49Å; R1242-Y1360 PolarHBondContact O-N 2.66Å; R1244-Y1360 HydrophobicContact CB-CE2 4.2Å; R1244-Y1360 HydrophobicContact CG-CE2 4.44Å; R1244-Y1360 PolarHBondContact NH1-OH 2.67Å; L1357-Y1360 HydrophobicContact CB-CE1 3.94Å; L1357-Y1360 VanDerWaalsContact O-CZ 3.32Å; L1357-Y1360 PolarHBondContact O-OH 2.8Å
1361	P	67.9	Low	59.5	Low	36 Å²	36	65.7 Å²	65.7	23%	0.234	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	146	177.7	28.5	-31	0	0	0	110.6	W1298 L1300 L1363	W1298-P1361 HydrophobicContact CE3-CB 4.34Å; W1298-P1361 HydrophobicContact CE3-CG 4.27Å; W1298-P1361 HydrophobicContact CZ3-CB 4.35Å; W1298-P1361 HydrophobicContact CZ3-CG 4.17Å; L1300-P1361 HydrophobicContact CD1-CB 3.85Å; L1300-P1361 VanDerWaalsContact CD1-CD 3.49Å; L1300-P1361 HydrophobicContact CD1-CG 4.09Å; L1300-P1361 HydrophobicContact CD2-CB 4.16Å; P1361-L1363 VanDerWaalsContact C-N 3.26Å; P1361-L1363 HydrophobicContact CG-CG 4.41Å; P1361-L1363 PolarHBondContact O-N 3.33Å
1362	V	60.4	Low	56.4	Low	64 Å²	64	67.8 Å²	67.8	39%	0.388	38%	0.377	S	S	.	.			trans	-72.5	81.3	172	-179.4	0	0	0	0	109.9	D1240 R1242 Q1364	D1240-V1362 WeakPolarHBondContact O-CG2 3.26Å; D1240-V1362 PolarHBondContact O-N 2.89Å; R1242-V1362 HydrophobicContact CB-CG2 4.17Å; V1362-Q1364 PolarHBondContact O-N 3.42Å
1363	L	38	Very low	53.1	Low	115 Å²	115	69.1 Å²	69.1	60%	0.602	40%	0.398	S	S	*	.			trans	-68.5	123.9	172.4	-76.6	165.4	0	0	0	110.4	P1361 L1365	P1361-L1363 VanDerWaalsContact C-N 3.26Å; P1361-L1363 HydrophobicContact CG-CG 4.41Å; P1361-L1363 PolarHBondContact O-N 3.33Å; L1363-L1365 PolarHBondContact O-N 3.37Å
1364	Q	26.3	Very low	50	Low	186 Å²	186	75.8 Å²	75.8	87%	0.869	42%	0.424	S	S	*	.			trans	-67.7	20.2	173.5	-74	-177.3	-30.8	0	0	114.5	V1362 I1366	V1362-Q1364 PolarHBondContact O-N 3.42Å; Q1364-I1366 PolarHBondContact O-N 3.34Å; Q1364-I1366 VanDerWaalsContact O-N 3.15Å
1365	L	25.3	Very low	47.1	Very low	130 Å²	130	76.7 Å²	76.7	68%	0.681	43%	0.434	S	S	*	.			trans	-85.2	90.8	-179.3	-80.5	167.3	0	0	0	111.8	L1363 C1367	L1363-L1365 PolarHBondContact O-N 3.37Å; L1365-C1367 PolarHBondContact O-N 2.82Å
1366	I	23.7	Very low	45.1	Very low	130 Å²	130	76.2 Å²	76.2	67%	0.667	44%	0.436	S	S	*	.	S	Bend	trans	53.3	61.9	147.1	-37.8	179.9	0	0	0	115	Q1364	Q1364-I1366 PolarHBondContact O-N 3.34Å; Q1364-I1366 VanDerWaalsContact O-N 3.15Å
1367	C	22.4	Very low	43.8	Very low	107 Å²	107	78.4 Å²	78.4	72%	0.723	44%	0.444	S	S	*	.			trans	-115.3	107.5	136.5	-94.4	0	0	0	0	108	L1365 N1369	L1365-C1367 PolarHBondContact O-N 2.82Å; C1367-N1369 VanDerWaalsContact C-N 3.28Å; C1367-N1369 PolarHBondContact O-N 3.33Å
1368	P	23.8	Very low	42.5	Very low	81 Å²	81	79.5 Å²	79.5	53%	0.526	45%	0.452	S	S	.	.			trans	-69.7	94.4	170.7	26.1	-31.1	0	0	0	108	K1088	K1088-P1368 PolarHBondContact NZ-O 2.94Å
1369	N	25.9	Very low	41.6	Very low	60 Å²	60	83.5 Å²	83.5	32%	0.321	47%	0.473	S	S	.	.			trans	-81.4	118.2	141.9	-175.1	-4.4	0	0	0	105.7	S1119 C1367 N1371 S1372	S1119-N1369 WeakPolarHBondContact CB-ND2 3.45Å; S1119-N1369 PolarHBondContact OG-ND2 3.45Å; C1367-N1369 VanDerWaalsContact C-N 3.28Å; C1367-N1369 PolarHBondContact O-N 3.33Å; N1369-N1371 PolarHBondContact O-N 3.3Å; N1369-N1371 PolarHBondContact OD1-N 3.03Å; N1369-N1371 VanDerWaalsContact OD1-N 3.12Å; N1369-S1372 PolarHBondContact O-N 3.49Å; N1369-S1372 PolarHBondContact O-OG 3.17Å
1370	P	24.3	Very low	40.8	Very low	109 Å²	109	83.9 Å²	83.9	71%	0.708	48%	0.476	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	-13	176	-24.1	35.4	0	0	0	114
1371	N	27	Very low	40.7	Very low	126 Å²	126	85.3 Å²	85.3	67%	0.674	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.5	-0.2	-171.8	-59	-8.8	0	0	0	114.5	N1369 G1373	N1369-N1371 PolarHBondContact O-N 3.3Å; N1369-N1371 PolarHBondContact OD1-N 3.03Å; N1369-N1371 VanDerWaalsContact OD1-N 3.12Å; N1371-G1373 PolarHBondContact O-N 3Å
1372	S	27.7	Very low	40.8	Very low	58 Å²	58	85.2 Å²	85.2	41%	0.406	48%	0.475	S	S	.	.	S	Bend	trans	-78.8	111.4	179.6	58.2	0	0	0	0	111.2	N1369 Y1374	N1369-S1372 PolarHBondContact O-N 3.49Å; N1369-S1372 PolarHBondContact O-OG 3.17Å; S1372-Y1374 PolarHBondContact O-N 3.5Å
1373	G	27.1	Very low	41.1	Very low	52 Å²	52	88.5 Å²	88.5	54%	0.536	49%	0.487	S	S	.	.	S	Bend	trans	-62.9	123.3	-166.3	0	0	0	0	0	116.1	N1371	N1371-G1373 PolarHBondContact O-N 3Å
1374	Y	25.7	Very low	42.6	Very low	139 Å²	139	86.7 Å²	86.7	55%	0.545	48%	0.475	S	S	.	.	S	Bend		-148.4	103.4	107.7	-97.7	-81.2	0	0	0	107.1	R1154 D1156 S1372	R1154-Y1374 PolarHBondContact NH2-OH 3.36Å; D1156-Y1374 PolarHBondContact OD2-OH 3.1Å; S1372-Y1374 PolarHBondContact O-N 3.5Å
1375	G	31.2	Very low	44.7	Very low	22 Å²	22	78 Å²	78	23%	0.227	43%	0.434	C	S	.	.	S	Bend	trans	77	74.4	-173.3	0	0	0	0	0	113.3	I1377 R1423	G1375-I1377 PolarHBondContact O-N 3.44Å; G1375-I1377 VanDerWaalsContact O-N 3.11Å; G1375-R1423 VanDerWaalsContact CA-O 3.29Å; G1375-R1423 WeakPolarHBondContact CA-O 3.36Å
1376	A	43.1	Very low	46.6	Very low	40 Å²	40	74.1 Å²	74.1	33%	0.331	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	113.2	173.7	0	0	0	0	0	109.4	L1421 R1423	A1376-L1421 VanDerWaalsContact O-O 3.1Å; A1376-R1423 PolarHBondContact N-O 3.2Å; A1376-R1423 PolarHBondContact O-N 3.19Å
1377	I	54.8	Low	48.7	Very low	90 Å²	90	72.7 Å²	72.7	46%	0.462	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	112.8	174.8	-59.1	-179.5	0	0	0	108.6	G1375 A1420 L1421 K1422	G1375-I1377 PolarHBondContact O-N 3.44Å; G1375-I1377 VanDerWaalsContact O-N 3.11Å; I1377-A1420 HydrophobicContact CG2-CB 3.81Å; I1377-L1421 WeakPolarHBondContact CA-O 3.44Å; I1377-K1422 HydrophobicContact CG1-CB 4.1Å; I1377-K1422 HydrophobicContact CG1-CG 4.21Å
1378	S	61.1	Low	50.8	Low	37 Å²	37	68.8 Å²	68.8	26%	0.259	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	148.3	175.3	49.4	0	0	0	0	110.9	A1420 L1421	S1378-A1420 CarbonylContact O-C 3.59Å; S1378-A1420 WeakPolarHBondContact O-CA 3.49Å; S1378-L1421 PolarHBondContact N-O 3.38Å; S1378-L1421 PolarHBondContact O-N 3.4Å; S1378-L1421 PolarHBondContact OG-O 3.47Å
1379	L	71.4	Confident	53.1	Low	88 Å²	88	65.7 Å²	65.7	46%	0.461	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	122.7	173.1	-65	179.2	0	0	0	109.5	Y1419 A1420 Y1496	L1379-Y1419 WeakPolarHBondContact CA-O 3.43Å; L1379-A1420 HydrophobicContact CD2-CB 4.43Å; L1379-Y1496 HydrophobicContact CD1-CD2 4.47Å; L1379-Y1496 HydrophobicContact CD1-CE2 4.04Å; L1379-Y1496 HydrophobicContact CD2-CD2 3.32Å; L1379-Y1496 HydrophobicContact CD2-CE2 3.66Å; L1379-Y1496 HydrophobicContact CD2-CG 3.82Å
1380	I	71.6	Confident	54.7	Low	9 Å²	9	64.5 Å²	64.5	5%	0.046	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	157.5	179.5	70.6	169.6	0	0	0	111.3	E1384 T1385 I1388 L1418 Y1419 L1421 L1493	I1380-E1384 WeakPolarHBondContact CA-OE2 3.39Å; I1380-E1384 HydrophobicContact CB-CB 4.35Å; I1380-E1384 WeakPolarHBondContact CB-OE2 3.16Å; I1380-T1385 HydrophobicContact CD1-CG2 3.96Å; I1380-I1388 HydrophobicContact CD1-CD1 4.06Å; I1380-I1388 HydrophobicContact CG2-CD1 4.18Å; I1380-L1418 CarbonylContact O-C 3.44Å; I1380-L1418 WeakPolarHBondContact O-CA 3.43Å; I1380-Y1419 PolarHBondContact N-O 2.99Å; I1380-Y1419 PolarHBondContact O-N 2.91Å; I1380-L1421 HydrophobicContact CD1-CB 4.26Å; I1380-L1421 HydrophobicContact CD1-CD1 4.47Å; I1380-L1421 HydrophobicContact CD1-CD2 4.37Å; I1380-L1421 HydrophobicContact CG1-CB 4.41Å; I1380-L1421 HydrophobicContact CG2-CB 4.4Å; I1380-L1421 HydrophobicContact CG2-CD2 4.37Å; I1380-L1493 HydrophobicContact CD1-CD1 3.73Å; I1380-L1493 HydrophobicContact CG1-CD1 4.14Å
1381	R	75.4	Confident	56	Low	113 Å²	113	69.7 Å²	69.7	43%	0.426	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	155.4	167.1	-62.6	178.4	180	-86.3	7.6	110.3	Q1383 E1384 G1416 L1418	R1381-Q1383 PolarHBondContact O-N 2.85Å; R1381-E1384 PolarHBondContact N-OE2 3.28Å; R1381-E1384 WeakPolarHBondContact O-CB 3.48Å; R1381-E1384 PolarHBondContact O-N 2.92Å; R1381-G1416 PolarHBondContact NH1-O 3.25Å; R1381-L1418 HydrophobicContact CG-CD2 3.97Å
1382	W	69.8	Low	57.2	Low	34 Å²	34	71.9 Å²	71.9	13%	0.129	39%	0.388	C	S	.	.	G	3₁₀ helix	trans	-52.5	-33.8	176.1	-174.7	-93.1	0	0	0	113.6	E1384 T1385 P1394 Y1419 L1493	W1382-E1384 VanDerWaalsContact C-N 3.29Å; W1382-E1384 PolarHBondContact O-N 3.39Å; W1382-T1385 HydrophobicContact CE3-CG2 4.46Å; W1382-T1385 WeakPolarHBondContact O-CB 3.36Å; W1382-T1385 WeakPolarHBondContact O-CG2 3.26Å; W1382-T1385 PolarHBondContact O-N 3.35Å; W1382-T1385 PolarHBondContact O-OG1 3.16Å; W1382-P1394 HydrophobicContact CH2-CG 4.44Å; W1382-Y1419 HydrophobicContact CB-CE2 4.02Å; W1382-Y1419 HydrophobicContact CE3-CD2 4.49Å; W1382-Y1419 HydrophobicContact CE3-CE1 4.11Å; W1382-Y1419 AromaticContact CE3-CE2 3.89Å; W1382-Y1419 HydrophobicContact CE3-CE2 3.89Å; W1382-Y1419 AromaticContact CE3-CZ 3.66Å; W1382-Y1419 HydrophobicContact CZ3-CE1 4.31Å; W1382-L1493 HydrophobicContact CZ3-CD2 4.21Å
1383	Q	68.4	Low	58.3	Low	133 Å²	133	75.4 Å²	75.4	62%	0.621	39%	0.393	S	S	*	.	G	3₁₀ helix	trans	-65	-30	178.8	-66.5	170.9	-8.1	0	0	113.1	R1381 T1385	R1381-Q1383 PolarHBondContact O-N 2.85Å; Q1383-T1385 VanDerWaalsContact C-N 3.3Å
1384	E	69.1	Low	59.5	Low	76 Å²	76	73.4 Å²	73.4	36%	0.355	37%	0.37	S	S	.	.	G	3₁₀ helix	trans	-79.6	-12.6	-179.9	-64.9	148.8	-155.6	0	0	112.2	I1380 R1381 W1382 A1386 T1387	I1380-E1384 WeakPolarHBondContact CA-OE2 3.39Å; I1380-E1384 HydrophobicContact CB-CB 4.35Å; I1380-E1384 WeakPolarHBondContact CB-OE2 3.16Å; R1381-E1384 PolarHBondContact N-OE2 3.28Å; R1381-E1384 WeakPolarHBondContact O-CB 3.48Å; R1381-E1384 PolarHBondContact O-N 2.92Å; W1382-E1384 VanDerWaalsContact C-N 3.29Å; W1382-E1384 PolarHBondContact O-N 3.39Å; E1384-A1386 PolarHBondContact O-N 3.43Å; E1384-T1387 PolarHBondContact O-N 2.9Å; E1384-T1387 PolarHBondContact O-OG1 2.8Å; E1384-T1387 VanDerWaalsContact O-OG1 3.13Å
1385	T	69	Low	60.6	Low	3 Å²	3	71.9 Å²	71.9	2%	0.018	38%	0.377	C	S	.	.	H	α-helix	trans	-60.6	-32.2	175.5	63.7	0	0	0	0	112.3	I1380 W1382 Q1383 T1387 I1388 F1389 L1493	I1380-T1385 HydrophobicContact CD1-CG2 3.96Å; W1382-T1385 HydrophobicContact CE3-CG2 4.46Å; W1382-T1385 WeakPolarHBondContact O-CB 3.36Å; W1382-T1385 WeakPolarHBondContact O-CG2 3.26Å; W1382-T1385 PolarHBondContact O-N 3.35Å; W1382-T1385 PolarHBondContact O-OG1 3.16Å; Q1383-T1385 VanDerWaalsContact C-N 3.3Å; T1385-T1387 PolarHBondContact O-N 3.44Å; T1385-I1388 PolarHBondContact O-N 2.98Å; T1385-I1388 VanDerWaalsContact O-N 3.09Å; T1385-F1389 HydrophobicContact CG2-CD2 4.47Å; T1385-F1389 HydrophobicContact CG2-CE2 4.45Å; T1385-F1389 WeakPolarHBondContact O-CD2 3.38Å; T1385-F1389 PolarHBondContact O-N 3.24Å; T1385-L1493 HydrophobicContact CG2-CD2 3.98Å
1386	A	66.1	Low	61.3	Low	49 Å²	49	75.2 Å²	75.2	41%	0.405	39%	0.386	S	S	.	.	H	α-helix	trans	-62	-28.7	179.3	0	0	0	0	0	113.1	E1384 G1390	E1384-A1386 PolarHBondContact O-N 3.43Å; A1386-G1390 CarbonylContact O-C 3.59Å; A1386-G1390 WeakPolarHBondContact O-CA 3.44Å; A1386-G1390 PolarHBondContact O-N 3.49Å
1387	T	67.8	Low	61.1	Low	101 Å²	101	76.4 Å²	76.4	62%	0.62	39%	0.39	S	S	*	.	H	α-helix	trans	-80.5	-23.5	177.8	-13.9	0	0	0	0	112.7	E1384 T1385	E1384-T1387 PolarHBondContact O-N 2.9Å; E1384-T1387 PolarHBondContact O-OG1 2.8Å; E1384-T1387 VanDerWaalsContact O-OG1 3.13Å; T1385-T1387 PolarHBondContact O-N 3.44Å
1388	I	66.5	Low	60.1	Low	24 Å²	24	81.7 Å²	81.7	12%	0.123	41%	0.413	C	S	.	.	H	α-helix	trans	-103.3	-42.1	-169.9	-59.6	178.7	0	0	0	111.7	I1380 T1385 L1421 N1491	I1380-I1388 HydrophobicContact CD1-CD1 4.06Å; I1380-I1388 HydrophobicContact CG2-CD1 4.18Å; T1385-I1388 PolarHBondContact O-N 2.98Å; T1385-I1388 VanDerWaalsContact O-N 3.09Å; I1388-L1421 HydrophobicContact CD1-CD2 3.62Å; I1388-L1421 HydrophobicContact CG2-CD1 4.46Å; I1388-L1421 HydrophobicContact CG2-CD2 3.97Å; I1388-N1491 HydrophobicContact CG2-CB 4.46Å
1389	F	71.9	Confident	59.1	Low	17 Å²	17	87.5 Å²	87.5	8%	0.075	43%	0.433	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.9	-8	177.6	-59.9	-96	0	0	0	111.8	T1385 P1394 L1421 S1458 N1491 L1493	T1385-F1389 HydrophobicContact CG2-CD2 4.47Å; T1385-F1389 HydrophobicContact CG2-CE2 4.45Å; T1385-F1389 WeakPolarHBondContact O-CD2 3.38Å; T1385-F1389 PolarHBondContact O-N 3.24Å; F1389-P1394 HydrophobicContact CD1-CB 4.49Å; F1389-P1394 HydrophobicContact CG-CG 4.47Å; F1389-L1421 HydrophobicContact CE2-CD1 3.89Å; F1389-L1421 HydrophobicContact CZ-CD1 3.61Å; F1389-S1458 WeakPolarHBondContact CD1-OG 3.25Å; F1389-N1491 HydrophobicContact CE1-CB 4.41Å; F1389-N1491 HydrophobicContact CZ-CB 4.36Å; F1389-L1493 HydrophobicContact CE2-CD1 4.5Å; F1389-L1493 HydrophobicContact CZ-CB 3.88Å
1390	G	60.2	Low	57.4	Low	35 Å²	35	89.9 Å²	89.9	36%	0.361	45%	0.447	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.7	-149.6	178.7	0	0	0	0	0	113	A1386 E1392	A1386-G1390 CarbonylContact O-C 3.59Å; A1386-G1390 WeakPolarHBondContact O-CA 3.44Å; A1386-G1390 PolarHBondContact O-N 3.49Å; G1390-E1392 PolarHBondContact O-N 2.97Å
1391	K	50.3	Low	55.5	Low	218 Å²	218	94.8 Å²	94.8	95%	0.948	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69	-24.5	178	-73.4	-176.8	177.8	176.2	0	112.8	R1393	K1391-R1393 PolarHBondContact O-N 3.13Å
1392	E	52.4	Low	53.6	Low	172 Å²	172	94.7 Å²	94.7	80%	0.804	50%	0.5	S	S	*	.	S	Bend	trans	-86.2	84.6	176	-65	-176.6	174.9	0	0	108.5	G1390	G1390-E1392 PolarHBondContact O-N 2.97Å
1393	R	51.9	Low	51.9	Low	132 Å²	132	100.2 Å²	100.2	50%	0.498	53%	0.532	S	S	.	.	P	Polyproline II helix	trans	-56.5	143.1	172.5	-72.6	-176	179.8	173.2	1.2	109.6	K1391	K1391-R1393 PolarHBondContact O-N 3.13Å
1394	P	52	Low	50.1	Low	10 Å²	10	99.6 Å²	99.6	7%	0.065	54%	0.543	C	S	.	.	P	Polyproline II helix	trans	-52.9	126	176.5	20.1	-31.6	0	0	0	110.2	W1382 F1389 K1396 L1493	W1382-P1394 HydrophobicContact CH2-CG 4.44Å; F1389-P1394 HydrophobicContact CD1-CB 4.49Å; F1389-P1394 HydrophobicContact CG-CG 4.47Å; P1394-K1396 PolarHBondContact O-N 3.28Å; P1394-L1493 HydrophobicContact CG-CD2 4.22Å
1395	P	48.2	Very low	48.6	Very low	106 Å²	106	101.2 Å²	101.2	69%	0.688	55%	0.554	S	S	*	*	P	Polyproline II helix	trans	-68.7	117.2	176.4	26.9	-31.9	0	0	0	108.8
1396	K	45.3	Very low	47	Very low	93 Å²	93	108.6 Å²	108.6	40%	0.404	59%	0.593	S	S	.	*	P	Polyproline II helix	trans	-50.4	129.7	168.1	-95.3	-177	174.3	176.3	0	107.9	P1394 Q1398 D1409 E1412	P1394-K1396 PolarHBondContact O-N 3.28Å; K1396-Q1398 PolarHBondContact O-N 3.11Å; K1396-D1409 IonicContact NZ-OD1 2.7Å; K1396-D1409 PolarHBondContact NZ-OD1 3.28Å; K1396-E1412 IonicContact NZ-OE2 2.75Å; K1396-E1412 PolarHBondContact NZ-OE2 3.4Å
1397	P	40.2	Very low	45.7	Very low	65 Å²	65	110 Å²	110	42%	0.422	60%	0.6	S	S	.	*	P	Polyproline II helix	trans	-51.3	130.4	174.2	-27.6	34.5	0	0	0	110.3	K1399	P1397-K1399 VanDerWaalsContact C-N 3.28Å; P1397-K1399 PolarHBondContact O-N 2.99Å
1398	Q	34.1	Very low	44.4	Very low	201 Å²	201	109.6 Å²	109.6	94%	0.939	60%	0.598	S	S	*	*			trans	-68.4	82.4	-177.2	-75.9	-175.9	-37.6	0	0	111.1	K1396 D1400	K1396-Q1398 PolarHBondContact O-N 3.11Å; Q1398-D1400 PolarHBondContact O-N 3.31Å
1399	K	39.7	Very low	43.4	Very low	159 Å²	159	110.6 Å²	110.6	69%	0.691	60%	0.603	S	S	*	*			trans	-75.1	103.2	163.7	-79.4	-172.1	173.6	178.7	0	109.3	P1397	P1397-K1399 VanDerWaalsContact C-N 3.28Å; P1397-K1399 PolarHBondContact O-N 2.99Å
1400	D	34.6	Very low	41.9	Very low	138 Å²	138	116.9 Å²	116.9	74%	0.738	63%	0.633	S	S	*	*			trans	38.3	106.5	166.2	-63.1	-40.3	0	0	0	117.1	Q1398 T1402	Q1398-D1400 PolarHBondContact O-N 3.31Å; D1400-T1402 PolarHBondContact O-N 3.4Å
1401	A	31.7	Very low	41.1	Very low	111 Å²	111	122.3 Å²	122.3	92%	0.917	65%	0.649	S	S	*	*	S	Bend	trans	-70.3	57.6	178.3	0	0	0	0	0	113.9
1402	T	35.8	Very low	41	Very low	111 Å²	111	116.1 Å²	116.1	68%	0.681	62%	0.623	S	S	*	*			trans	-142.9	55.5	175.4	59.8	0	0	0	0	113.4	D1400	D1400-T1402 PolarHBondContact O-N 3.4Å
1403	N	35.8	Very low	40.8	Very low	150 Å²	150	112.5 Å²	112.5	80%	0.802	60%	0.602	S	S	*	*			trans	-178.2	119	140.6	-90.4	-37.1	0	0	0	110.6
1404	S	29.8	Very low	40.6	Very low	121 Å²	121	109.7 Å²	109.7	85%	0.846	60%	0.603	S	S	*	*			trans	-81.5	113.2	175.1	54	0	0	0	0	111.2
1405	D	36.9	Very low	40.7	Very low	110 Å²	110	112.7 Å²	112.7	59%	0.588	62%	0.624	S	S	*	*			trans	-148.6	89.5	163.1	-146.3	-25.2	0	0	0	110.1	S1407	D1405-S1407 PolarHBondContact O-N 2.92Å; D1405-S1407 PolarHBondContact OD1-OG 3.37Å
1406	N	35.9	Very low	41.4	Very low	157 Å²	157	109.1 Å²	109.1	84%	0.84	61%	0.606	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.7	4.5	-175.7	-79.7	-13.3	0	0	0	114
1407	S	39.2	Very low	42.6	Very low	78 Å²	78	110.2 Å²	110.2	55%	0.545	61%	0.608	S	S	.	*	T	Hydrogen-bonded Turn	trans	-87.8	-26.2	-172.5	61.4	0	0	0	0	114.4	D1405	D1405-S1407 PolarHBondContact O-N 2.92Å; D1405-S1407 PolarHBondContact OD1-OG 3.37Å
1408	T	40.2	Very low	44.4	Very low	94 Å²	94	110 Å²	110	58%	0.577	60%	0.603	S	S	*	*	H	α-helix	trans	-74.8	-30.5	179.3	47.3	0	0	0	0	112.8	E1410 H1411 E1412	T1408-E1410 VanDerWaalsContact C-N 3.32Å; T1408-E1410 PolarHBondContact O-N 2.87Å; T1408-H1411 PolarHBondContact O-N 3.12Å; T1408-H1411 VanDerWaalsContact O-N 3.12Å; T1408-E1412 PolarHBondContact O-N 2.96Å
1409	D	45.1	Very low	46.6	Very low	45 Å²	45	101.1 Å²	101.1	24%	0.241	56%	0.561	C	S	.	*	H	α-helix	trans	-73.3	-19.7	-169.6	-149.7	59.5	0	0	0	113.2	K1396 R1413	K1396-D1409 IonicContact NZ-OD1 2.7Å; K1396-D1409 PolarHBondContact NZ-OD1 3.28Å; D1409-R1413 WeakPolarHBondContact O-CD 3.22Å; D1409-R1413 WeakPolarHBondContact O-CG 3.23Å; D1409-R1413 PolarHBondContact O-NE 2.68Å; D1409-R1413 IonicContact OD2-CZ 3.38Å; D1409-R1413 IonicContact OD2-NE 3.71Å; D1409-R1413 PolarHBondContact OD2-NE 3.03Å; D1409-R1413 IonicContact OD2-NH2 3.17Å; D1409-R1413 PolarHBondContact OD2-NH2 2.95Å
1410	E	41.2	Very low	48.7	Very low	148 Å²	148	94.1 Å²	94.1	69%	0.692	53%	0.533	S	S	*	.	H	α-helix	trans	-76.7	-33.9	168.9	-70.6	-162.6	142.6	0	0	112.9	T1408 R1413 S1414	T1408-E1410 VanDerWaalsContact C-N 3.32Å; T1408-E1410 PolarHBondContact O-N 2.87Å; E1410-R1413 PolarHBondContact O-N 3.02Å; E1410-S1414 PolarHBondContact O-N 2.79Å
1411	H	43.6	Very low	51	Low	150 Å²	150	87.6 Å²	87.6	69%	0.694	50%	0.498	S	S	*	.	H	α-helix	trans	-70.8	-40.8	-178.2	-118.6	-44.3	0	0	0	111.9	T1408 R1413 S1414 S1415	T1408-H1411 PolarHBondContact O-N 3.12Å; T1408-H1411 VanDerWaalsContact O-N 3.12Å; H1411-R1413 VanDerWaalsContact C-N 3.32Å; H1411-R1413 PolarHBondContact O-N 3.12Å; H1411-S1414 PolarHBondContact O-N 2.83Å; H1411-S1414 PolarHBondContact O-OG 2.81Å; H1411-S1415 PolarHBondContact O-N 3.09Å
1412	E	48.4	Very low	53.4	Low	88 Å²	88	83.2 Å²	83.2	41%	0.411	46%	0.458	S	S	.	.	H	α-helix	trans	-58.7	-43.1	173.1	-72.4	-162.5	131.7	0	0	111.8	K1396 T1408 S1414 S1415	K1396-E1412 IonicContact NZ-OE2 2.75Å; K1396-E1412 PolarHBondContact NZ-OE2 3.4Å; T1408-E1412 PolarHBondContact O-N 2.96Å; E1412-S1414 PolarHBondContact O-N 2.87Å; E1412-S1415 VanDerWaalsContact O-CB 3.28Å; E1412-S1415 WeakPolarHBondContact O-CB 3.47Å; E1412-S1415 PolarHBondContact O-N 3.21Å; E1412-S1415 VanDerWaalsContact O-N 3.08Å; E1412-S1415 PolarHBondContact O-OG 2.88Å
1413	R	48.3	Very low	55.4	Low	95 Å²	95	81 Å²	81	36%	0.358	44%	0.437	S	S	.	.	H	α-helix	trans	-63	-21.7	179.3	-66.7	167.9	-171.5	-170.6	-0.6	113.8	D1409 E1410 H1411	D1409-R1413 WeakPolarHBondContact O-CD 3.22Å; D1409-R1413 WeakPolarHBondContact O-CG 3.23Å; D1409-R1413 PolarHBondContact O-NE 2.68Å; D1409-R1413 IonicContact OD2-CZ 3.38Å; D1409-R1413 IonicContact OD2-NE 3.71Å; D1409-R1413 PolarHBondContact OD2-NE 3.03Å; D1409-R1413 IonicContact OD2-NH2 3.17Å; D1409-R1413 PolarHBondContact OD2-NH2 2.95Å; E1410-R1413 PolarHBondContact O-N 3.02Å; H1411-R1413 VanDerWaalsContact C-N 3.32Å; H1411-R1413 PolarHBondContact O-N 3.12Å
1414	S	46	Very low	57.2	Low	74 Å²	74	74.8 Å²	74.8	52%	0.517	41%	0.405	S	S	.	.	H	α-helix	trans	-91.2	-14.2	176.5	73.6	0	0	0	0	114.4	E1410 H1411 E1412 G1416	E1410-S1414 PolarHBondContact O-N 2.79Å; H1411-S1414 PolarHBondContact O-N 2.83Å; H1411-S1414 PolarHBondContact O-OG 2.81Å; E1412-S1414 PolarHBondContact O-N 2.87Å; S1414-G1416 PolarHBondContact O-N 3.15Å
1415	S	55.6	Low	59.2	Low	73 Å²	73	70.7 Å²	70.7	51%	0.51	38%	0.375	S	S	.	.	S	Bend	trans	-65.7	-13.5	-166.1	66.5	0	0	0	0	116.2	H1411 E1412 R1417	H1411-S1415 PolarHBondContact O-N 3.09Å; E1412-S1415 VanDerWaalsContact O-CB 3.28Å; E1412-S1415 WeakPolarHBondContact O-CB 3.47Å; E1412-S1415 PolarHBondContact O-N 3.21Å; E1412-S1415 VanDerWaalsContact O-N 3.08Å; E1412-S1415 PolarHBondContact O-OG 2.88Å; S1415-R1417 PolarHBondContact O-N 2.98Å; S1415-R1417 WeakPolarHBondContact OG-CB 3.37Å; S1415-R1417 PolarHBondContact OG-N 3.39Å
1416	G	63.1	Low	60.7	Low	31 Å²	31	65.6 Å²	65.6	32%	0.32	35%	0.347	S	S	.	.			trans	66	12	-174.5	0	0	0	0	0	114.5	R1381 S1414	R1381-G1416 PolarHBondContact NH1-O 3.25Å; S1414-G1416 PolarHBondContact O-N 3.15Å
1417	R	69.3	Low	62	Low	115 Å²	115	59.8 Å²	59.8	43%	0.434	32%	0.315	S	S	.	.			trans	-54.4	137.7	176.2	-171.3	176.5	-170.3	164.3	7.4	111.1	S1415 Y1419	S1415-R1417 PolarHBondContact O-N 2.98Å; S1415-R1417 WeakPolarHBondContact OG-CB 3.37Å; S1415-R1417 PolarHBondContact OG-N 3.39Å; R1417-Y1419 HydrophobicContact CB-CE2 4.17Å; R1417-Y1419 HydrophobicContact CG-CE2 4.16Å
1418	L	77.8	Confident	63.3	Low	62 Å²	62	57.4 Å²	57.4	33%	0.325	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	147.7	174.6	-66.1	172.4	0	0	0	110.5	I1380 R1381 Y1496	I1380-L1418 CarbonylContact O-C 3.44Å; I1380-L1418 WeakPolarHBondContact O-CA 3.43Å; R1381-L1418 HydrophobicContact CG-CD2 3.97Å; L1418-Y1496 HydrophobicContact CB-CD1 3.87Å; L1418-Y1496 HydrophobicContact CB-CG 4.29Å; L1418-Y1496 HydrophobicContact CD1-CD1 4.23Å; L1418-Y1496 HydrophobicContact CD1-CE1 4.23Å; L1418-Y1496 WeakPolarHBondContact O-CB 3.45Å
1419	Y	80.7	Confident	64.9	Low	14 Å²	14	60 Å²	60	6%	0.055	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	150.4	174.8	-67.6	-100.3	0	0	0	108.4	L1379 I1380 W1382 R1417 E1455 L1493 L1494	L1379-Y1419 WeakPolarHBondContact CA-O 3.43Å; I1380-Y1419 PolarHBondContact N-O 2.99Å; I1380-Y1419 PolarHBondContact O-N 2.91Å; W1382-Y1419 HydrophobicContact CB-CE2 4.02Å; W1382-Y1419 HydrophobicContact CE3-CD2 4.49Å; W1382-Y1419 HydrophobicContact CE3-CE1 4.11Å; W1382-Y1419 AromaticContact CE3-CE2 3.89Å; W1382-Y1419 HydrophobicContact CE3-CE2 3.89Å; W1382-Y1419 AromaticContact CE3-CZ 3.66Å; W1382-Y1419 HydrophobicContact CZ3-CE1 4.31Å; R1417-Y1419 HydrophobicContact CB-CE2 4.17Å; R1417-Y1419 HydrophobicContact CG-CE2 4.16Å; Y1419-E1455 HydrophobicContact CD1-CG 4.23Å; Y1419-E1455 HydrophobicContact CE1-CG 4.08Å; Y1419-L1493 HydrophobicContact CD1-CD1 4.49Å; Y1419-L1493 HydrophobicContact CD1-CD2 4.43Å; Y1419-L1493 HydrophobicContact CD1-CG 4.28Å; Y1419-L1493 HydrophobicContact CG-CD1 4.33Å; Y1419-L1494 CarbonylContact C-O 3.53Å
1420	A	84	Confident	66	Low	12 Å²	12	60.8 Å²	60.8	10%	0.099	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	131.8	172.9	0	0	0	0	0	109.2	I1377 S1378 L1379 L1494	I1377-A1420 HydrophobicContact CG2-CB 3.81Å; S1378-A1420 CarbonylContact O-C 3.59Å; S1378-A1420 WeakPolarHBondContact O-CA 3.49Å; L1379-A1420 HydrophobicContact CD2-CB 4.43Å; A1420-L1494 HydrophobicContact CB-CB 4.27Å; A1420-L1494 PolarHBondContact N-O 3.05Å; A1420-L1494 PolarHBondContact O-N 2.99Å
1421	L	81.8	Confident	67.3	Low	0 Å²	0	55.7 Å²	55.7	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	104.1	-180	179.4	78	0	0	0	109.3	A1376 I1377 S1378 I1380 I1388 F1389 R1423 N1491 I1492 L1493	A1376-L1421 VanDerWaalsContact O-O 3.1Å; I1377-L1421 WeakPolarHBondContact CA-O 3.44Å; S1378-L1421 PolarHBondContact N-O 3.38Å; S1378-L1421 PolarHBondContact O-N 3.4Å; S1378-L1421 PolarHBondContact OG-O 3.47Å; I1380-L1421 HydrophobicContact CD1-CB 4.26Å; I1380-L1421 HydrophobicContact CD1-CD1 4.47Å; I1380-L1421 HydrophobicContact CD1-CD2 4.37Å; I1380-L1421 HydrophobicContact CG1-CB 4.41Å; I1380-L1421 HydrophobicContact CG2-CB 4.4Å; I1380-L1421 HydrophobicContact CG2-CD2 4.37Å; I1388-L1421 HydrophobicContact CD1-CD2 3.62Å; I1388-L1421 HydrophobicContact CG2-CD1 4.46Å; I1388-L1421 HydrophobicContact CG2-CD2 3.97Å; F1389-L1421 HydrophobicContact CE2-CD1 3.89Å; F1389-L1421 HydrophobicContact CZ-CD1 3.61Å; L1421-R1423 HydrophobicContact CD2-CG 4.16Å; L1421-R1423 HydrophobicContact CG-CG 4.24Å; L1421-N1491 HydrophobicContact CD1-CB 4.14Å; L1421-I1492 CarbonylContact C-O 3.42Å; L1421-I1492 WeakPolarHBondContact CA-O 3.47Å; L1421-L1493 HydrophobicContact CD1-CD1 4.25Å
1422	K	83.2	Confident	69.1	Low	20 Å²	20	49.7 Å²	49.7	9%	0.087	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	112.1	175.5	-175.3	179.9	178.8	-176.7	0	108.6	I1377 V1424 E1438 I1492 L1494 D1566	I1377-K1422 HydrophobicContact CG1-CB 4.1Å; I1377-K1422 HydrophobicContact CG1-CG 4.21Å; K1422-V1424 HydrophobicContact CD-CG2 4.39Å; K1422-V1424 HydrophobicContact CG-CG2 4Å; K1422-E1438 IonicContact NZ-OE1 2.66Å; K1422-E1438 PolarHBondContact NZ-OE1 2.97Å; K1422-E1438 IonicContact NZ-OE2 2.64Å; K1422-E1438 PolarHBondContact NZ-OE2 3.28Å; K1422-I1492 HydrophobicContact CB-CB 4.37Å; K1422-I1492 PolarHBondContact N-O 2.78Å; K1422-I1492 PolarHBondContact O-N 3.05Å; K1422-L1494 HydrophobicContact CB-CD1 4.29Å; K1422-D1566 IonicContact NZ-OD1 2.81Å; K1422-D1566 PolarHBondContact NZ-OD1 3.2Å
1423	R	77.3	Confident	70.7	Confident	63 Å²	63	48 Å²	48	24%	0.238	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	117.3	176.2	-54.9	-165.8	-178.9	177.5	3	110.6	G1375 A1376 L1421 E1489 Y1490 N1491	G1375-R1423 VanDerWaalsContact CA-O 3.29Å; G1375-R1423 WeakPolarHBondContact CA-O 3.36Å; A1376-R1423 PolarHBondContact N-O 3.2Å; A1376-R1423 PolarHBondContact O-N 3.19Å; L1421-R1423 HydrophobicContact CD2-CG 4.16Å; L1421-R1423 HydrophobicContact CG-CG 4.24Å; R1423-E1489 WeakPolarHBondContact CD-OE1 3.23Å; R1423-Y1490 WeakPolarHBondContact CA-O 3.27Å; R1423-N1491 WeakPolarHBondContact CG-OD1 3.27Å
1424	V	74.2	Confident	72.3	Confident	21 Å²	21	46.2 Å²	46.2	13%	0.127	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	111.8	-178.5	-166.6	0	0	0	0	110.1	K1422 V1435 E1489 Y1490	K1422-V1424 HydrophobicContact CD-CG2 4.39Å; K1422-V1424 HydrophobicContact CG-CG2 4Å; V1424-V1435 HydrophobicContact CB-CG1 4.49Å; V1424-V1435 HydrophobicContact CB-CG2 4.05Å; V1424-V1435 HydrophobicContact CG1-CG2 3.56Å; V1424-E1489 WeakPolarHBondContact O-CA 3.35Å; V1424-Y1490 PolarHBondContact N-O 3.4Å; V1424-Y1490 PolarHBondContact O-N 3.02Å
1425	V	71	Confident	74.1	Confident	35 Å²	35	43.1 Å²	43.1	21%	0.212	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85	117.3	172.1	-176.2	0	0	0	0	108.4	H1427 L1468 L1487 E1489	V1425-H1427 PolarHBondContact O-CE1 3.43Å; V1425-H1427 VanDerWaalsContact O-CE1 3.24Å; V1425-H1427 PolarHBondContact O-ND1 3.44Å; V1425-L1468 HydrophobicContact CG2-CD1 3.67Å; V1425-L1468 HydrophobicContact CG2-CD2 4.4Å; V1425-L1487 HydrophobicContact CG1-CB 4.5Å; V1425-E1489 HydrophobicContact CG2-CB 4.41Å; V1425-E1489 HydrophobicContact CG2-CG 4.08Å
1426	C	68.2	Low	75.7	Confident	2 Å²	2	44.5 Å²	44.5	1%	0.014	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	122.5	177.3	-62.9	0	0	0	0	109.2	D1431 E1432 T1488 Y1490	C1426-D1431 HydrophobicContact CB-CB 3.7Å; C1426-E1432 HydrophobicContact CB-CG 3.71Å; C1426-T1488 WeakPolarHBondContact CB-O 3.39Å; C1426-T1488 PolarHBondContact N-O 3.13Å; C1426-T1488 PolarHBondContact O-N 3.34Å; C1426-Y1490 VanDerWaalsContact SG-CD2 3.58Å
1427	H	63.1	Low	76.9	Confident	35 Å²	35	45 Å²	45	16%	0.162	23%	0.234	C	C	.	.			trans	-97.1	-10.4	-178.4	-55	81.6	0	0	0	112.8	V1425 D1431 L1487	V1425-H1427 PolarHBondContact O-CE1 3.43Å; V1425-H1427 VanDerWaalsContact O-CE1 3.24Å; V1425-H1427 PolarHBondContact O-ND1 3.44Å; H1427-D1431 PolarHBondContact N-OD2 3.4Å; H1427-D1431 IonicContact ND1-OD2 2.88Å; H1427-L1487 HydrophobicContact CB-CD2 4.06Å
1428	S	67	Low	77.9	Confident	29 Å²	29	39.9 Å²	39.9	20%	0.203	22%	0.215	C	C	.	.	S	Bend	trans	-146.2	165.1	178.2	86.1	0	0	0	0	111.8	A1430 D1431 E1432	S1428-A1430 PolarHBondContact O-N 3.25Å; S1428-A1430 WeakPolarHBondContact OG-CB 3.36Å; S1428-A1430 PolarHBondContact OG-N 3.35Å; S1428-A1430 VanDerWaalsContact OG-N 3.11Å; S1428-D1431 PolarHBondContact N-OD2 3.15Å; S1428-D1431 WeakPolarHBondContact O-CB 3.34Å; S1428-D1431 PolarHBondContact O-N 3.2Å; S1428-D1431 VanDerWaalsContact O-N 3.13Å; S1428-D1431 PolarHBondContact OG-N 3.1Å; S1428-D1431 VanDerWaalsContact OG-N 3.14Å; S1428-D1431 PolarHBondContact OG-OD1 3.21Å; S1428-E1432 PolarHBondContact O-N 3.34Å; S1428-E1432 VanDerWaalsContact O-N 3.08Å
1429	K	73.2	Confident	78.4	Confident	149 Å²	149	37.1 Å²	37.1	65%	0.648	20%	0.201	S	C	*	.	H	α-helix	trans	-64.3	-21.5	170.6	-74	-66.6	176.6	-145.1	0	113.5	E1432 A1433	K1429-E1432 WeakPolarHBondContact CD-OE2 3.29Å; K1429-E1432 IonicContact NZ-OE1 3.19Å; K1429-E1432 PolarHBondContact NZ-OE1 3.43Å; K1429-E1432 IonicContact NZ-OE2 3.4Å; K1429-E1432 PolarHBondContact NZ-OE2 2.86Å; K1429-A1433 PolarHBondContact O-N 3.01Å
1430	A	68.8	Low	78.8	Confident	60 Å²	60	40.7 Å²	40.7	50%	0.496	22%	0.218	S	C	.	.	H	α-helix	trans	-70	-47.2	170.1	0	0	0	0	0	110	S1428 E1432 A1433 L1434	S1428-A1430 PolarHBondContact O-N 3.25Å; S1428-A1430 WeakPolarHBondContact OG-CB 3.36Å; S1428-A1430 PolarHBondContact OG-N 3.35Å; S1428-A1430 VanDerWaalsContact OG-N 3.11Å; A1430-E1432 VanDerWaalsContact C-N 3.3Å; A1430-E1432 PolarHBondContact O-N 3.31Å; A1430-A1433 PolarHBondContact O-N 3.35Å; A1430-A1433 VanDerWaalsContact O-N 3.12Å; A1430-L1434 WeakPolarHBondContact O-CD1 3.41Å; A1430-L1434 WeakPolarHBondContact O-CG 3.29Å; A1430-L1434 PolarHBondContact O-N 2.9Å
1431	D	68.8	Low	79.1	Confident	42 Å²	42	40.1 Å²	40.1	23%	0.225	21%	0.213	C	C	.	.	H	α-helix	trans	-54.8	-45.9	175.9	-53.8	21.4	0	0	0	111.1	C1426 H1427 S1428 A1433 L1434 V1435	C1426-D1431 HydrophobicContact CB-CB 3.7Å; H1427-D1431 PolarHBondContact N-OD2 3.4Å; H1427-D1431 IonicContact ND1-OD2 2.88Å; S1428-D1431 PolarHBondContact N-OD2 3.15Å; S1428-D1431 WeakPolarHBondContact O-CB 3.34Å; S1428-D1431 PolarHBondContact O-N 3.2Å; S1428-D1431 VanDerWaalsContact O-N 3.13Å; S1428-D1431 PolarHBondContact OG-N 3.1Å; S1428-D1431 VanDerWaalsContact OG-N 3.14Å; S1428-D1431 PolarHBondContact OG-OD1 3.21Å; D1431-A1433 PolarHBondContact O-N 3.02Å; D1431-L1434 PolarHBondContact O-N 3.43Å; D1431-V1435 WeakPolarHBondContact O-CG2 3.31Å; D1431-V1435 PolarHBondContact O-N 3.01Å
1432	E	80.5	Confident	79.4	Confident	23 Å²	23	40.2 Å²	40.2	11%	0.107	21%	0.214	C	C	.	.	H	α-helix	trans	-57.4	-48.6	175.9	-67.9	-175.8	-152.6	0	0	112.2	C1426 S1428 K1429 A1430 L1434 V1435 Q1436 T1488 Y1490	C1426-E1432 HydrophobicContact CB-CG 3.71Å; S1428-E1432 PolarHBondContact O-N 3.34Å; S1428-E1432 VanDerWaalsContact O-N 3.08Å; K1429-E1432 WeakPolarHBondContact CD-OE2 3.29Å; K1429-E1432 IonicContact NZ-OE1 3.19Å; K1429-E1432 PolarHBondContact NZ-OE1 3.43Å; K1429-E1432 IonicContact NZ-OE2 3.4Å; K1429-E1432 PolarHBondContact NZ-OE2 2.86Å; A1430-E1432 VanDerWaalsContact C-N 3.3Å; A1430-E1432 PolarHBondContact O-N 3.31Å; E1432-L1434 PolarHBondContact O-N 3.48Å; E1432-V1435 PolarHBondContact O-N 3.06Å; E1432-Q1436 WeakPolarHBondContact O-CB 3.48Å; E1432-Q1436 VanDerWaalsContact O-CG 3.24Å; E1432-Q1436 WeakPolarHBondContact O-CG 3.42Å; E1432-Q1436 PolarHBondContact O-N 3.1Å; E1432-T1488 VanDerWaalsContact CD-OG1 3.29Å; E1432-T1488 VanDerWaalsContact CG-OG1 3.3Å; E1432-T1488 WeakPolarHBondContact CG-OG1 3.47Å; E1432-T1488 PolarHBondContact OE1-OG1 3.16Å; E1432-Y1490 HydrophobicContact CB-CE2 4.34Å; E1432-Y1490 HydrophobicContact CG-CE2 4.05Å
1433	A	83.8	Confident	79.5	Confident	53 Å²	53	44 Å²	44	44%	0.438	23%	0.231	S	C	.	.	H	α-helix	trans	-62.6	-29.7	180	0	0	0	0	0	112.6	K1429 A1430 D1431 N1437	K1429-A1433 PolarHBondContact O-N 3.01Å; A1430-A1433 PolarHBondContact O-N 3.35Å; A1430-A1433 VanDerWaalsContact O-N 3.12Å; D1431-A1433 PolarHBondContact O-N 3.02Å; A1433-N1437 WeakPolarHBondContact O-CB 3.49Å; A1433-N1437 PolarHBondContact O-N 3.36Å
1434	L	81.5	Confident	79.9	Confident	57 Å²	57	43.1 Å²	43.1	30%	0.298	23%	0.231	S	C	.	.	H	α-helix	trans	-76.8	-41.4	179.4	-65.1	164.9	0	0	0	112.2	A1430 D1431 E1432 Q1436 N1437 E1438	A1430-L1434 WeakPolarHBondContact O-CD1 3.41Å; A1430-L1434 WeakPolarHBondContact O-CG 3.29Å; A1430-L1434 PolarHBondContact O-N 2.9Å; D1431-L1434 PolarHBondContact O-N 3.43Å; E1432-L1434 PolarHBondContact O-N 3.48Å; L1434-Q1436 VanDerWaalsContact C-N 3.35Å; L1434-N1437 PolarHBondContact O-N 2.75Å; L1434-E1438 PolarHBondContact O-N 3.21Å
1435	V	83.7	Confident	80.1	Confident	9 Å²	9	42.5 Å²	42.5	6%	0.055	23%	0.229	C	C	.	.	H	α-helix	trans	-68.9	-37	173.7	-177.2	0	0	0	0	110.8	V1424 D1431 E1432 N1437 E1438 I1439 Y1490 I1492	V1424-V1435 HydrophobicContact CB-CG1 4.49Å; V1424-V1435 HydrophobicContact CB-CG2 4.05Å; V1424-V1435 HydrophobicContact CG1-CG2 3.56Å; D1431-V1435 WeakPolarHBondContact O-CG2 3.31Å; D1431-V1435 PolarHBondContact O-N 3.01Å; E1432-V1435 PolarHBondContact O-N 3.06Å; V1435-N1437 VanDerWaalsContact C-N 3.33Å; V1435-N1437 PolarHBondContact O-N 3.19Å; V1435-E1438 PolarHBondContact O-N 3.12Å; V1435-I1439 HydrophobicContact CG1-CD1 4.02Å; V1435-I1439 VanDerWaalsContact O-CG1 3.3Å; V1435-I1439 WeakPolarHBondContact O-CG1 3.29Å; V1435-I1439 PolarHBondContact O-N 2.72Å; V1435-Y1490 HydrophobicContact CB-CD1 4.39Å; V1435-Y1490 HydrophobicContact CB-CG 4.3Å; V1435-Y1490 HydrophobicContact CG1-CD1 3.75Å; V1435-Y1490 HydrophobicContact CG1-CD2 4.42Å; V1435-Y1490 HydrophobicContact CG1-CG 3.69Å; V1435-I1492 HydrophobicContact CG1-CD1 4.04Å
1436	Q	88.6	Confident	80.1	Confident	102 Å²	102	42.7 Å²	42.7	48%	0.477	23%	0.234	S	C	.	.	H	α-helix	trans	-60.7	-40.8	170.2	-74.5	175.1	-5.9	0	0	112	E1432 L1434 I1439 H1440 Y1490	E1432-Q1436 WeakPolarHBondContact O-CB 3.48Å; E1432-Q1436 VanDerWaalsContact O-CG 3.24Å; E1432-Q1436 WeakPolarHBondContact O-CG 3.42Å; E1432-Q1436 PolarHBondContact O-N 3.1Å; L1434-Q1436 VanDerWaalsContact C-N 3.35Å; Q1436-I1439 PolarHBondContact O-N 2.9Å; Q1436-H1440 VanDerWaalsContact O-CB 3.24Å; Q1436-H1440 WeakPolarHBondContact O-CB 3.23Å; Q1436-H1440 PolarHBondContact O-N 2.94Å; Q1436-Y1490 HydrophobicContact CG-CE1 3.88Å; Q1436-Y1490 PolarHBondContact NE2-OH 3.19Å
1437	N	88.2	Confident	80.6	Confident	41 Å²	41	45 Å²	45	22%	0.219	26%	0.258	C	S	.	.	H	α-helix	trans	-66.6	-39.6	174.2	177.4	81.8	0	0	0	112.5	A1433 L1434 V1435 H1440 V1441 S1570	A1433-N1437 WeakPolarHBondContact O-CB 3.49Å; A1433-N1437 PolarHBondContact O-N 3.36Å; L1434-N1437 PolarHBondContact O-N 2.75Å; V1435-N1437 VanDerWaalsContact C-N 3.33Å; V1435-N1437 PolarHBondContact O-N 3.19Å; N1437-H1440 PolarHBondContact O-N 3.06Å; N1437-V1441 WeakPolarHBondContact O-CG2 3.47Å; N1437-V1441 PolarHBondContact O-N 3.47Å; N1437-S1570 PolarHBondContact ND2-O 3.39Å
1438	E	89.7	Confident	81.7	Confident	8 Å²	8	45.5 Å²	45.5	4%	0.037	26%	0.262	C	S	.	.	H	α-helix	trans	-59.5	-48.5	172.7	-176.5	-179.6	164.2	0	0	111.3	K1422 L1434 V1435 H1440 V1441 H1442 F1567	K1422-E1438 IonicContact NZ-OE1 2.66Å; K1422-E1438 PolarHBondContact NZ-OE1 2.97Å; K1422-E1438 IonicContact NZ-OE2 2.64Å; K1422-E1438 PolarHBondContact NZ-OE2 3.28Å; L1434-E1438 PolarHBondContact O-N 3.21Å; V1435-E1438 PolarHBondContact O-N 3.12Å; E1438-H1440 VanDerWaalsContact C-N 3.34Å; E1438-H1440 PolarHBondContact O-N 3.15Å; E1438-V1441 PolarHBondContact O-N 3.33Å; E1438-H1442 PolarHBondContact O-CD2 3.18Å; E1438-H1442 VanDerWaalsContact O-CD2 3.24Å; E1438-H1442 PolarHBondContact O-N 3.33Å; E1438-H1442 IonicContact OE1-NE2 3.23Å; E1438-F1567 HydrophobicContact CG-CB 4.1Å
1439	I	88.9	Confident	82.9	Confident	5 Å²	5	48.2 Å²	48.2	3%	0.026	28%	0.277	C	S	.	.	H	α-helix	trans	-60.3	-44.4	176.1	-69.1	165.1	0	0	0	110.6	V1435 Q1436 V1441 H1442 E1443 Y1457 Y1490 I1492	V1435-I1439 HydrophobicContact CG1-CD1 4.02Å; V1435-I1439 VanDerWaalsContact O-CG1 3.3Å; V1435-I1439 WeakPolarHBondContact O-CG1 3.29Å; V1435-I1439 PolarHBondContact O-N 2.72Å; Q1436-I1439 PolarHBondContact O-N 2.9Å; I1439-V1441 VanDerWaalsContact C-N 3.33Å; I1439-V1441 PolarHBondContact O-N 3.08Å; I1439-H1442 WeakPolarHBondContact O-CB 3.16Å; I1439-H1442 PolarHBondContact O-N 3.35Å; I1439-H1442 VanDerWaalsContact O-N 3.17Å; I1439-E1443 HydrophobicContact CG2-CG 4.42Å; I1439-E1443 WeakPolarHBondContact O-CG 3.3Å; I1439-E1443 PolarHBondContact O-N 2.77Å; I1439-Y1457 HydrophobicContact CD1-CD1 4.38Å; I1439-Y1457 HydrophobicContact CD1-CD2 4.03Å; I1439-Y1457 HydrophobicContact CD1-CG 3.91Å; I1439-Y1457 HydrophobicContact CG2-CD1 3.55Å; I1439-Y1457 HydrophobicContact CG2-CE1 3.55Å; I1439-Y1457 HydrophobicContact CG2-CG 4.18Å; I1439-Y1490 HydrophobicContact CD1-CD1 3.78Å; I1439-Y1490 HydrophobicContact CD1-CE1 4.38Å; I1439-I1492 HydrophobicContact CD1-CD1 4.11Å; I1439-I1492 HydrophobicContact CD1-CG1 4.1Å; I1439-I1492 HydrophobicContact CG1-CD1 3.71Å; I1439-I1492 HydrophobicContact CG1-CG1 4.03Å
1440	H	89.6	Confident	83.8	Confident	88 Å²	88	41.6 Å²	41.6	41%	0.407	25%	0.249	S	C	.	.	H	α-helix	trans	-61.6	-38.9	178.2	-174.9	46.3	0	0	0	112.2	Q1436 N1437 E1438 E1443 M1444	Q1436-H1440 VanDerWaalsContact O-CB 3.24Å; Q1436-H1440 WeakPolarHBondContact O-CB 3.23Å; Q1436-H1440 PolarHBondContact O-N 2.94Å; N1437-H1440 PolarHBondContact O-N 3.06Å; E1438-H1440 VanDerWaalsContact C-N 3.34Å; E1438-H1440 PolarHBondContact O-N 3.15Å; H1440-E1443 PolarHBondContact O-N 3.23Å; H1440-M1444 VanDerWaalsContact CD2-CE 3.44Å; H1440-M1444 WeakPolarHBondContact CD2-CE 3.34Å; H1440-M1444 WeakPolarHBondContact O-CB 3.34Å; H1440-M1444 WeakPolarHBondContact O-CG 3.2Å; H1440-M1444 PolarHBondContact O-N 2.84Å
1441	V	89	Confident	85	Confident	0 Å²	0	39 Å²	39	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-68.6	-38.7	174.4	174.3	0	0	0	0	111.6	N1437 E1438 I1439 E1443 M1444 G1445 L1535 F1543 F1567	N1437-V1441 WeakPolarHBondContact O-CG2 3.47Å; N1437-V1441 PolarHBondContact O-N 3.47Å; E1438-V1441 PolarHBondContact O-N 3.33Å; I1439-V1441 VanDerWaalsContact C-N 3.33Å; I1439-V1441 PolarHBondContact O-N 3.08Å; V1441-E1443 VanDerWaalsContact C-N 3.35Å; V1441-E1443 PolarHBondContact O-N 3.4Å; V1441-M1444 HydrophobicContact CG2-CE 4.03Å; V1441-G1445 PolarHBondContact O-N 3.49Å; V1441-L1535 HydrophobicContact CG1-CD2 3.64Å; V1441-F1543 HydrophobicContact CG2-CD1 3.69Å; V1441-F1543 HydrophobicContact CG2-CE1 3.79Å; V1441-F1543 HydrophobicContact CG2-CG 4.47Å; V1441-F1567 HydrophobicContact CB-CB 4.04Å; V1441-F1567 HydrophobicContact CB-CG 4.42Å; V1441-F1567 HydrophobicContact CG1-CB 3.73Å; V1441-F1567 HydrophobicContact CG1-CD1 4.08Å; V1441-F1567 HydrophobicContact CG1-CD2 4.11Å; V1441-F1567 HydrophobicContact CG1-CG 3.7Å
1442	H	88.4	Confident	86	Confident	3 Å²	3	37.1 Å²	37.1	1%	0.014	22%	0.217	C	C	.	.	H	α-helix	trans	-59.6	-43.1	170.3	-81.4	-74.2	0	0	0	112.4	E1438 I1439 A1446 L1452 C1454 F1567	E1438-H1442 PolarHBondContact O-CD2 3.18Å; E1438-H1442 VanDerWaalsContact O-CD2 3.24Å; E1438-H1442 PolarHBondContact O-N 3.33Å; E1438-H1442 IonicContact OE1-NE2 3.23Å; I1439-H1442 WeakPolarHBondContact O-CB 3.16Å; I1439-H1442 PolarHBondContact O-N 3.35Å; I1439-H1442 VanDerWaalsContact O-N 3.17Å; H1442-A1446 PolarHBondContact O-N 2.93Å; H1442-L1452 PolarHBondContact CE1-O 2.87Å; H1442-L1452 PolarHBondContact ND1-O 3.38Å; H1442-C1454 HydrophobicContact CB-CB 3.63Å; H1442-F1567 AromaticContact CD2-CD2 3.81Å; H1442-F1567 AromaticContact CE1-CD2 3.49Å; H1442-F1567 VanDerWaalsContact CE1-CD2 3.49Å; H1442-F1567 WeakPolarHBondContact CE1-CD2 3.06Å; H1442-F1567 AromaticContact CE1-CE2 3.53Å; H1442-F1567 AromaticContact CG-CD2 3.73Å; H1442-F1567 AromaticContact ND1-CD2 3.54Å; H1442-F1567 AromaticContact ND1-CE2 3.44Å; H1442-F1567 WeakPolarHBondContact ND1-CE2 3.47Å; H1442-F1567 AromaticContact NE2-CD2 3.66Å
1443	E	86	Confident	86.4	Confident	98 Å²	98	37.9 Å²	37.9	46%	0.458	22%	0.223	S	C	.	.	H	α-helix	trans	-68.4	-45.7	179	-72.8	178.7	155.7	0	0	112	I1439 H1440 V1441 G1445 A1446 Y1457	I1439-E1443 HydrophobicContact CG2-CG 4.42Å; I1439-E1443 WeakPolarHBondContact O-CG 3.3Å; I1439-E1443 PolarHBondContact O-N 2.77Å; H1440-E1443 PolarHBondContact O-N 3.23Å; V1441-E1443 VanDerWaalsContact C-N 3.35Å; V1441-E1443 PolarHBondContact O-N 3.4Å; E1443-G1445 VanDerWaalsContact C-N 3.28Å; E1443-G1445 PolarHBondContact O-N 3.09Å; E1443-A1446 WeakPolarHBondContact O-CB 3.32Å; E1443-A1446 PolarHBondContact O-N 2.87Å; E1443-A1446 VanDerWaalsContact O-N 3.11Å; E1443-Y1457 WeakPolarHBondContact OE1-CE1 3.38Å
1444	M	84.8	Confident	86.5	Confident	46 Å²	46	35.8 Å²	35.8	23%	0.227	21%	0.205	C	C	.	.	H	α-helix	trans	-63.6	-34.2	175.1	-73.6	-170.1	-68.9	0	0	112.4	H1440 V1441 A1446 L1538 F1543	H1440-M1444 VanDerWaalsContact CD2-CE 3.44Å; H1440-M1444 WeakPolarHBondContact CD2-CE 3.34Å; H1440-M1444 WeakPolarHBondContact O-CB 3.34Å; H1440-M1444 WeakPolarHBondContact O-CG 3.2Å; H1440-M1444 PolarHBondContact O-N 2.84Å; V1441-M1444 HydrophobicContact CG2-CE 4.03Å; M1444-A1446 VanDerWaalsContact C-N 3.28Å; M1444-A1446 PolarHBondContact O-N 2.91Å; M1444-L1538 HydrophobicContact CB-CD1 3.84Å; M1444-L1538 HydrophobicContact CB-CD2 3.94Å; M1444-L1538 HydrophobicContact CB-CG 4.45Å; M1444-L1538 HydrophobicContact CE-CD1 4.04Å; M1444-L1538 WeakPolarHBondContact O-CD2 3.44Å; M1444-L1538 HydrophobicContact SD-CD1 4.34Å; M1444-F1543 HydrophobicContact CE-CD2 4.33Å; M1444-F1543 HydrophobicContact CE-CE1 4.45Å; M1444-F1543 HydrophobicContact CE-CE2 3.89Å; M1444-F1543 HydrophobicContact CE-CZ 3.96Å
1445	G	80.3	Confident	86.6	Confident	8 Å²	8	35.1 Å²	35.1	8%	0.082	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.1	-7.2	174.6	0	0	0	0	0	114.9	V1441 E1443 G1447 N1448	V1441-G1445 PolarHBondContact O-N 3.49Å; E1443-G1445 VanDerWaalsContact C-N 3.28Å; E1443-G1445 PolarHBondContact O-N 3.09Å; G1445-G1447 VanDerWaalsContact C-N 3.32Å; G1445-G1447 PolarHBondContact O-N 3.04Å; G1445-N1448 PolarHBondContact O-N 3.27Å; G1445-N1448 VanDerWaalsContact O-N 3.13Å
1446	A	70.9	Confident	86.5	Confident	39 Å²	39	35 Å²	35	32%	0.322	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.9	79.8	-170.3	0	0	0	0	0	113.3	H1442 E1443 M1444	H1442-A1446 PolarHBondContact O-N 2.93Å; E1443-A1446 WeakPolarHBondContact O-CB 3.32Å; E1443-A1446 PolarHBondContact O-N 2.87Å; E1443-A1446 VanDerWaalsContact O-N 3.11Å; M1444-A1446 VanDerWaalsContact C-N 3.28Å; M1444-A1446 PolarHBondContact O-N 2.91Å
1447	G	77.5	Confident	86.4	Confident	51 Å²	51	35 Å²	35	53%	0.526	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	167.1	-31.7	-176.7	0	0	0	0	0	112	G1445 V1449	G1445-G1447 VanDerWaalsContact C-N 3.32Å; G1445-G1447 PolarHBondContact O-N 3.04Å; G1447-V1449 PolarHBondContact O-N 3.47Å
1448	N	87.5	Confident	86.2	Confident	44 Å²	44	34.2 Å²	34.2	24%	0.235	20%	0.196	C	C	.	.			trans	-75.6	120.5	172.9	-170.8	-35.3	0	0	0	110.2	G1445 N1450 L1451 H1530 G1534	G1445-N1448 PolarHBondContact O-N 3.27Å; G1445-N1448 VanDerWaalsContact O-N 3.13Å; N1448-N1450 PolarHBondContact O-N 3.34Å; N1448-N1450 WeakPolarHBondContact OD1-CB 3.07Å; N1448-N1450 PolarHBondContact OD1-N 2.84Å; N1448-L1451 HydrophobicContact CB-CB 4.31Å; N1448-L1451 HydrophobicContact CB-CD1 4.02Å; N1448-L1451 HydrophobicContact CB-CG 4Å; N1448-L1451 PolarHBondContact O-N 2.9Å; N1448-H1530 PolarHBondContact ND2-O 3.22Å; N1448-G1534 WeakPolarHBondContact ND2-CA 3.47Å
1449	V	90.9	Very high	85.9	Confident	86 Å²	86	37.1 Å²	37.1	52%	0.521	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-13.7	-177.9	-62.3	0	0	0	0	113.9	G1447 R1561	G1447-V1449 PolarHBondContact O-N 3.47Å; V1449-R1561 VanDerWaalsContact O-CZ 3.29Å; V1449-R1561 PolarHBondContact O-NE 2.91Å; V1449-R1561 PolarHBondContact O-NH2 3.5Å
1450	N	93.6	Very high	85.3	Confident	10 Å²	10	40.6 Å²	40.6	5%	0.053	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.4	7.7	177.2	-57.1	102.6	0	0	0	112.9	N1448 D1527 R1561 A1562 V1563 L1564	N1448-N1450 PolarHBondContact O-N 3.34Å; N1448-N1450 WeakPolarHBondContact OD1-CB 3.07Å; N1448-N1450 PolarHBondContact OD1-N 2.84Å; N1450-D1527 VanDerWaalsContact CB-O 3.29Å; N1450-D1527 WeakPolarHBondContact CB-O 3.36Å; N1450-D1527 VanDerWaalsContact CG-O 3.31Å; N1450-D1527 VanDerWaalsContact ND2-CB 3.3Å; N1450-D1527 WeakPolarHBondContact ND2-CB 3.5Å; N1450-D1527 PolarHBondContact ND2-O 2.72Å; N1450-D1527 PolarHBondContact ND2-OD1 2.85Å; N1450-R1561 VanDerWaalsContact ND2-CG 3.32Å; N1450-R1561 WeakPolarHBondContact ND2-CG 3.46Å; N1450-A1562 PolarHBondContact ND2-O 3.34Å; N1450-V1563 CarbonylContact O-C 3.55Å; N1450-V1563 WeakPolarHBondContact O-CA 3.45Å; N1450-L1564 PolarHBondContact O-N 2.79Å
1451	L	92.6	Very high	84.2	Confident	5 Å²	5	40.3 Å²	40.3	3%	0.026	23%	0.233	C	C	.	.	B	Isolated β-bridge	trans	-112	138.8	167.3	-63.8	-178	0	0	0	109.3	N1448 P1453 G1531 L1535 L1564 F1567	N1448-L1451 HydrophobicContact CB-CB 4.31Å; N1448-L1451 HydrophobicContact CB-CD1 4.02Å; N1448-L1451 HydrophobicContact CB-CG 4Å; N1448-L1451 PolarHBondContact O-N 2.9Å; L1451-P1453 VanDerWaalsContact O-CD 3.32Å; L1451-P1453 WeakPolarHBondContact O-CD 3.48Å; L1451-G1531 WeakPolarHBondContact CD2-O 3.4Å; L1451-L1535 HydrophobicContact CD1-CD2 3.94Å; L1451-L1535 HydrophobicContact CD1-CG 4.24Å; L1451-L1535 HydrophobicContact CD2-CD1 4.4Å; L1451-L1535 HydrophobicContact CD2-CD2 4.33Å; L1451-L1535 HydrophobicContact CD2-CG 4.07Å; L1451-L1564 HydrophobicContact CD2-CB 3.94Å; L1451-L1564 HydrophobicContact CD2-CD1 4.05Å; L1451-L1564 HydrophobicContact CD2-CG 4.34Å; L1451-F1567 HydrophobicContact CB-CZ 4.28Å; L1451-F1567 HydrophobicContact CD2-CE1 4.11Å; L1451-F1567 HydrophobicContact CD2-CZ 3.91Å
1452	L	90.5	Very high	82.8	Confident	4 Å²	4	41.2 Å²	41.2	2%	0.021	24%	0.238	C	C	.	.	P	Polyproline II helix	trans	-68	117.9	177.4	-175.4	67	0	0	0	109.4	H1442 L1494 P1495 Y1497 L1554 V1563 L1564 M1565	H1442-L1452 PolarHBondContact CE1-O 2.87Å; H1442-L1452 PolarHBondContact ND1-O 3.38Å; L1452-L1494 HydrophobicContact CD2-CB 4.29Å; L1452-L1494 HydrophobicContact CD2-CD1 4.01Å; L1452-L1494 HydrophobicContact CD2-CD2 4.03Å; L1452-L1494 HydrophobicContact CD2-CG 4.33Å; L1452-L1494 HydrophobicContact CG-CD2 4.23Å; L1452-P1495 HydrophobicContact CD1-CG 4.41Å; L1452-Y1497 HydrophobicContact CD1-CD2 4.05Å; L1452-Y1497 HydrophobicContact CD1-CE2 3.42Å; L1452-Y1497 VanDerWaalsContact CD1-CE2 3.42Å; L1452-L1554 HydrophobicContact CD1-CD1 3.95Å; L1452-L1554 HydrophobicContact CD2-CD1 4.09Å; L1452-V1563 HydrophobicContact CB-CG1 4.12Å; L1452-L1564 VanDerWaalsContact CB-O 3.25Å; L1452-L1564 WeakPolarHBondContact CB-O 3.4Å; L1452-L1564 PolarHBondContact N-O 3.28Å; L1452-M1565 HydrophobicContact CB-CB 4.21Å; L1452-M1565 HydrophobicContact CD2-CB 3.69Å
1453	P	87.9	Confident	80.9	Confident	38 Å²	38	46.5 Å²	46.5	25%	0.247	27%	0.271	C	S	.	.	P	Polyproline II helix	trans	-75.5	151.5	177.4	31.8	-35.4	0	0	0	111.3	L1451 L1494 P1495	L1451-P1453 VanDerWaalsContact O-CD 3.32Å; L1451-P1453 WeakPolarHBondContact O-CD 3.48Å; P1453-L1494 WeakPolarHBondContact O-CD2 3.41Å; P1453-P1495 HydrophobicContact CG-CG 3.73Å; P1453-P1495 VanDerWaalsContact O-CD 3.29Å; P1453-P1495 WeakPolarHBondContact O-CD 3.45Å
1454	C	86.3	Confident	78.9	Confident	9 Å²	9	45.3 Å²	45.3	6%	0.061	27%	0.267	C	S	.	.	P	Polyproline II helix	trans	-86.8	121.4	161.3	-178.9	0	0	0	0	108.7	H1442 G1456	H1442-C1454 HydrophobicContact CB-CB 3.63Å; C1454-G1456 VanDerWaalsContact SG-C 3.54Å; C1454-G1456 PolarHBondContact SG-N 2.79Å; C1454-G1456 VanDerWaalsContact SG-N 3.4Å; C1454-G1456 PolarHBondContact SG-O 3.49Å; C1454-G1456 VanDerWaalsContact SG-O 3.41Å
1455	E	83.2	Confident	76.6	Confident	43 Å²	43	47.5 Å²	47.5	20%	0.201	27%	0.274	C	S	.	.			trans	-79.6	-11.4	174.4	-64.6	-70.4	162.7	0	0	111.7	Y1419 L1493 P1495	Y1419-E1455 HydrophobicContact CD1-CG 4.23Å; Y1419-E1455 HydrophobicContact CE1-CG 4.08Å; E1455-L1493 HydrophobicContact CB-CB 4.26Å; E1455-L1493 HydrophobicContact CB-CD2 4.03Å; E1455-L1493 HydrophobicContact CB-CG 4.04Å; E1455-L1493 PolarHBondContact N-O 2.92Å; E1455-P1495 HydrophobicContact CG-CG 4.1Å
1456	G	81.3	Confident	74.4	Confident	8 Å²	8	53 Å²	53	8%	0.082	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	148.3	168.8	170.5	0	0	0	0	0	112.1	C1454 L1493	C1454-G1456 VanDerWaalsContact SG-C 3.54Å; C1454-G1456 PolarHBondContact SG-N 2.79Å; C1454-G1456 VanDerWaalsContact SG-N 3.4Å; C1454-G1456 PolarHBondContact SG-O 3.49Å; C1454-G1456 VanDerWaalsContact SG-O 3.41Å; G1456-L1493 VanDerWaalsContact O-CB 3.31Å; G1456-L1493 WeakPolarHBondContact O-CB 3.49Å; G1456-L1493 PolarHBondContact O-N 3.12Å
1457	Y	86.6	Confident	72.7	Confident	102 Å²	102	57 Å²	57	40%	0.4	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	162.3	178.8	65.7	-84.9	0	0	0	112.2	I1439 E1443 V1459 N1491	I1439-Y1457 HydrophobicContact CD1-CD1 4.38Å; I1439-Y1457 HydrophobicContact CD1-CD2 4.03Å; I1439-Y1457 HydrophobicContact CD1-CG 3.91Å; I1439-Y1457 HydrophobicContact CG2-CD1 3.55Å; I1439-Y1457 HydrophobicContact CG2-CE1 3.55Å; I1439-Y1457 HydrophobicContact CG2-CG 4.18Å; E1443-Y1457 WeakPolarHBondContact OE1-CE1 3.38Å; Y1457-V1459 HydrophobicContact CD2-CG2 4.28Å; Y1457-V1459 HydrophobicContact CE2-CG2 4.41Å; Y1457-N1491 CarbonylContact C-O 3.42Å; Y1457-N1491 WeakPolarHBondContact CA-O 3.32Å; Y1457-N1491 WeakPolarHBondContact CB-O 3.42Å
1458	S	84.2	Confident	70.7	Confident	23 Å²	23	57.9 Å²	57.9	16%	0.161	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	152.5	164.4	60	0	0	0	0	110.7	F1389 Y1490 N1491	F1389-S1458 WeakPolarHBondContact CD1-OG 3.25Å; S1458-Y1490 WeakPolarHBondContact O-CA 3.23Å; S1458-N1491 PolarHBondContact N-O 2.82Å; S1458-N1491 PolarHBondContact O-N 3.25Å
1459	V	84.4	Confident	68.2	Low	69 Å²	69	58.3 Å²	58.3	42%	0.418	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	126.9	174	-170.1	0	0	0	0	107.6	Y1457 E1489 Y1490	Y1457-V1459 HydrophobicContact CD2-CG2 4.28Å; Y1457-V1459 HydrophobicContact CE2-CG2 4.41Å; V1459-E1489 WeakPolarHBondContact CA-O 3.31Å; V1459-Y1490 HydrophobicContact CB-CE1 4.45Å; V1459-Y1490 HydrophobicContact CG1-CD2 4.14Å; V1459-Y1490 HydrophobicContact CG1-CE1 4.24Å; V1459-Y1490 HydrophobicContact CG1-CE2 3.75Å; V1459-Y1490 HydrophobicContact CG2-CD1 3.61Å; V1459-Y1490 HydrophobicContact CG2-CE1 3.38Å; V1459-Y1490 HydrophobicContact CG2-CE2 4.4Å; V1459-Y1490 HydrophobicContact CG2-CG 4.22Å
1460	R	75.7	Confident	65.3	Low	79 Å²	79	56.2 Å²	56.2	30%	0.298	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	134	175.6	63.5	-174.6	-173.8	-168.1	0.4	110.7	V1462 E1489	R1460-V1462 PolarHBondContact O-N 3.29Å; R1460-E1489 HydrophobicContact CG-CB 3.94Å; R1460-E1489 IonicContact CZ-OE1 3.55Å; R1460-E1489 VanDerWaalsContact CZ-OE1 3.23Å; R1460-E1489 IonicContact CZ-OE2 3.88Å; R1460-E1489 PolarHBondContact N-O 3.04Å; R1460-E1489 IonicContact NE-OE1 2.76Å; R1460-E1489 PolarHBondContact NE-OE1 3.06Å; R1460-E1489 IonicContact NE-OE2 3.07Å; R1460-E1489 PolarHBondContact NE-OE2 3.11Å; R1460-E1489 IonicContact NH2-OE1 3.23Å; R1460-E1489 PolarHBondContact NH2-OE1 3.09Å; R1460-E1489 IonicContact NH2-OE2 3.4Å; R1460-E1489 PolarHBondContact NH2-OE2 3.3Å; R1460-E1489 PolarHBondContact O-N 3.32Å
1461	P	67.9	Low	62.3	Low	82 Å²	82	63.8 Å²	63.8	53%	0.532	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	132.4	167	28.6	-32.4	0	0	0	108.7	T1463	P1461-T1463 HydrophobicContact CB-CG2 4.24Å; P1461-T1463 HydrophobicContact CG-CG2 4.3Å; P1461-T1463 PolarHBondContact O-N 2.75Å; P1461-T1463 VanDerWaalsContact O-N 3.13Å
1462	V	58.9	Low	59.4	Low	19 Å²	19	66.4 Å²	66.4	12%	0.115	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	89.4	171.9	178.4	0	0	0	0	106.5	R1460 L1468 L1487 E1489	R1460-V1462 PolarHBondContact O-N 3.29Å; V1462-L1468 HydrophobicContact CG1-CD1 3.82Å; V1462-L1468 HydrophobicContact CG2-CD1 3.85Å; V1462-L1487 HydrophobicContact CB-CB 4Å; V1462-L1487 HydrophobicContact CG2-CB 4.37Å; V1462-L1487 PolarHBondContact N-O 3.18Å; V1462-E1489 HydrophobicContact CG2-CB 3.75Å
1463	T	47.3	Very low	56.4	Low	114 Å²	114	71 Å²	71	70%	0.699	36%	0.363	S	S	*	.			trans	-80	-20.8	-178.6	49	0	0	0	0	113.4	P1461	P1461-T1463 HydrophobicContact CB-CG2 4.24Å; P1461-T1463 HydrophobicContact CG-CG2 4.3Å; P1461-T1463 PolarHBondContact O-N 2.75Å; P1461-T1463 VanDerWaalsContact O-N 3.13Å
1464	D	44.1	Very low	53.7	Low	72 Å²	72	76.1 Å²	76.1	39%	0.385	38%	0.383	S	S	.	.			trans	-132.6	114.7	173.3	-75.7	-50.5	0	0	0	109.5	E1466 Q1467	D1464-E1466 PolarHBondContact O-N 3.41Å; D1464-Q1467 HydrophobicContact CB-CB 4.09Å; D1464-Q1467 HydrophobicContact CB-CG 3.78Å; D1464-Q1467 PolarHBondContact O-N 3.33Å; D1464-Q1467 VanDerWaalsContact O-N 3.09Å; D1464-Q1467 PolarHBondContact OD2-NE2 2.85Å; D1464-Q1467 VanDerWaalsContact OD2-NE2 3.07Å
1465	Y	36.5	Very low	51	Low	93 Å²	93	80 Å²	80	37%	0.365	41%	0.408	S	S	.	.	H	α-helix	trans	-63.3	-25.7	171.1	-148.3	-78.1	0	0	0	111	Q1467 L1487	Y1465-Q1467 VanDerWaalsContact C-N 3.28Å; Y1465-Q1467 PolarHBondContact O-N 2.8Å; Y1465-L1487 HydrophobicContact CD2-CD1 3.5Å; Y1465-L1487 HydrophobicContact CE2-CD1 3.36Å
1466	E	34.2	Very low	48.4	Very low	124 Å²	124	80.7 Å²	80.7	58%	0.579	43%	0.427	S	S	*	.	H	α-helix	trans	-62.7	-29	173.1	-61.1	-173.7	161.5	0	0	112.7	D1464 V1469 S1470	D1464-E1466 PolarHBondContact O-N 3.41Å; E1466-V1469 WeakPolarHBondContact O-CB 3.31Å; E1466-V1469 PolarHBondContact O-N 3.06Å; E1466-S1470 VanDerWaalsContact O-CB 3.25Å; E1466-S1470 WeakPolarHBondContact O-CB 3.38Å; E1466-S1470 PolarHBondContact O-N 3.37Å; E1466-S1470 VanDerWaalsContact O-N 3.08Å; E1466-S1470 PolarHBondContact O-OG 3.12Å; E1466-S1470 VanDerWaalsContact O-OG 3.13Å
1467	Q	35.3	Very low	45.7	Very low	121 Å²	121	83.7 Å²	83.7	57%	0.565	46%	0.458	S	S	*	.	H	α-helix	trans	-81.8	-25.6	-177.2	-73.7	-173.4	23.7	0	0	115.1	D1464 Y1465 V1469 S1470	D1464-Q1467 HydrophobicContact CB-CB 4.09Å; D1464-Q1467 HydrophobicContact CB-CG 3.78Å; D1464-Q1467 PolarHBondContact O-N 3.33Å; D1464-Q1467 VanDerWaalsContact O-N 3.09Å; D1464-Q1467 PolarHBondContact OD2-NE2 2.85Å; D1464-Q1467 VanDerWaalsContact OD2-NE2 3.07Å; Y1465-Q1467 VanDerWaalsContact C-N 3.28Å; Y1465-Q1467 PolarHBondContact O-N 2.8Å; Q1467-V1469 PolarHBondContact O-N 3.48Å; Q1467-S1470 WeakPolarHBondContact CA-OG 3.43Å; Q1467-S1470 PolarHBondContact O-N 3.41Å
1468	L	36.4	Very low	42.9	Very low	70 Å²	70	85 Å²	85	37%	0.366	46%	0.463	S	S	.	.	H	α-helix	trans	-68.2	-18.9	170.3	-101.8	162.8	0	0	0	112.3	V1425 V1462	V1425-L1468 HydrophobicContact CG2-CD1 3.67Å; V1425-L1468 HydrophobicContact CG2-CD2 4.4Å; V1462-L1468 HydrophobicContact CG1-CD1 3.82Å; V1462-L1468 HydrophobicContact CG2-CD1 3.85Å
1469	V	34.6	Very low	40.1	Very low	54 Å²	54	89.7 Å²	89.7	33%	0.327	49%	0.491	S	S	.	.	H	α-helix	trans	-94.2	-31.2	179.8	159.8	0	0	0	0	112	P1122 E1466 Q1467	P1122-V1469 HydrophobicContact CB-CG1 3.6Å; P1122-V1469 HydrophobicContact CG-CG1 3.72Å; E1466-V1469 WeakPolarHBondContact O-CB 3.31Å; E1466-V1469 PolarHBondContact O-N 3.06Å; Q1467-V1469 PolarHBondContact O-N 3.48Å
1470	S	30.9	Very low	37.4	Very low	41 Å²	41	91 Å²	91	29%	0.287	50%	0.499	S	S	.	.			trans	-104.8	30.9	-164	75.2	0	0	0	0	116.3	E1466 Q1467 N1472 N1473	E1466-S1470 VanDerWaalsContact O-CB 3.25Å; E1466-S1470 WeakPolarHBondContact O-CB 3.38Å; E1466-S1470 PolarHBondContact O-N 3.37Å; E1466-S1470 VanDerWaalsContact O-N 3.08Å; E1466-S1470 PolarHBondContact O-OG 3.12Å; E1466-S1470 VanDerWaalsContact O-OG 3.13Å; Q1467-S1470 WeakPolarHBondContact CA-OG 3.43Å; Q1467-S1470 PolarHBondContact O-N 3.41Å; S1470-N1472 PolarHBondContact O-N 3.49Å; S1470-N1472 VanDerWaalsContact O-N 3.17Å; S1470-N1473 PolarHBondContact O-N 3.43Å
1471	Y	30.4	Very low	35.1	Very low	169 Å²	169	93.2 Å²	93.2	66%	0.663	52%	0.524	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-9.5	164.9	-125.1	-84.3	0	0	0	112.8
1472	N	30.6	Very low	33.3	Very low	60 Å²	60	94 Å²	94	32%	0.321	52%	0.521	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.9	69.6	162.1	-66.6	16.9	0	0	0	110	E877 L1125 S1470	E877-N1472 VanDerWaalsContact CD-CG 3.43Å; E877-N1472 HydrophobicContact CG-CB 4.4Å; E877-N1472 WeakPolarHBondContact CG-ND2 3.44Å; E877-N1472 PolarHBondContact OE2-ND2 2.8Å; L1125-N1472 HydrophobicContact CD1-CB 3.96Å; S1470-N1472 PolarHBondContact O-N 3.49Å; S1470-N1472 VanDerWaalsContact O-N 3.17Å
1473	N	28.4	Very low	32.1	Very low	101 Å²	101	102.1 Å²	102.1	54%	0.54	56%	0.558	S	S	.	*			trans	26.7	107.3	156.8	-60.1	-46	0	0	0	122	P1128 S1470	P1128-N1473 WeakPolarHBondContact CB-O 3.32Å; S1470-N1473 PolarHBondContact O-N 3.43Å
1474	E	31.5	Very low	31.2	Very low	145 Å²	145	102.2 Å²	102.2	68%	0.678	56%	0.564	S	S	*	*			trans	54.7	-173.6	132	-55.9	-157.1	154.8	0	0	119.8	P1128	P1128-E1474 WeakPolarHBondContact CA-O 3.35Å
1475	P	29.7	Very low	31.2	Very low	91 Å²	91	103.7 Å²	103.7	59%	0.591	58%	0.575	S	S	*	*				-122.9	111.7	-77.3	34.9	-21.4	0	0	0	113.9	P1128	P1128-P1475 VanDerWaalsContact CB-CD 3.46Å
1476	G	27.5	Very low	32	Very low	57 Å²	57	105.1 Å²	105.1	59%	0.588	59%	0.594	S	S	*	*			trans	-133	100.1	169.8	0	0	0	0	0	111
1477	G	24.9	Very low	33.4	Very low	72 Å²	72	99.7 Å²	99.7	74%	0.742	57%	0.569	S	S	*	*			trans	-73.1	132.2	-158.9	0	0	0	0	0	116.9
1478	Y	27.9	Very low	35.4	Very low	128 Å²	128	94.9 Å²	94.9	50%	0.502	55%	0.547	S	S	.	.			trans	-138.3	82.9	154.3	-80.7	-78	0	0	0	109.7	V1480	Y1478-V1480 PolarHBondContact O-N 3.42Å
1479	T	25.8	Very low	37.5	Very low	122 Å²	122	91.6 Å²	91.6	75%	0.748	53%	0.53	S	S	*	.			trans	-66.1	110.2	172.6	51.1	0	0	0	0	110.4
1480	V	27.7	Very low	40	Very low	97 Å²	97	89.3 Å²	89.3	59%	0.588	52%	0.516	S	S	*	.			trans	-100.6	114.1	164.5	-178.5	0	0	0	0	107.8	Y1478 M1482	Y1478-V1480 PolarHBondContact O-N 3.42Å; V1480-M1482 PolarHBondContact O-N 2.97Å
1481	P	27.3	Very low	42.5	Very low	125 Å²	125	87.4 Å²	87.4	81%	0.812	50%	0.502	S	S	*	.			trans	-73.9	111.2	176.9	-7.2	23.1	0	0	0	109.7
1482	M	29.9	Very low	45.2	Very low	98 Å²	98	79.3 Å²	79.3	48%	0.483	47%	0.471	S	S	.	.			trans	-101.9	136.6	160.7	-83.5	-129.2	-174.9	0	0	110.5	K1158 E1162 V1480	K1158-M1482 HydrophobicContact CD-CE 3.9Å; K1158-M1482 HydrophobicContact CD-SD 4.46Å; K1158-M1482 VanDerWaalsContact CE-CE 3.47Å; K1158-M1482 HydrophobicContact CG-CE 4.44Å; K1158-M1482 PolarHBondContact NZ-SD 3.36Å; K1158-M1482 VanDerWaalsContact NZ-SD 3.41Å; E1162-M1482 WeakPolarHBondContact OE1-CE 3.34Å; E1162-M1482 WeakPolarHBondContact OE2-CE 3.46Å; V1480-M1482 PolarHBondContact O-N 2.97Å
1483	E	32.7	Very low	47.8	Very low	190 Å²	190	76.5 Å²	76.5	89%	0.888	46%	0.455	S	S	*	.			trans	-65.4	147	176	-63.1	179.7	142.2	0	0	111	T1485	E1483-T1485 PolarHBondContact O-N 3.03Å; E1483-T1485 VanDerWaalsContact O-N 3.1Å
1484	S	29.9	Very low	50.7	Low	117 Å²	117	72 Å²	72	82%	0.818	43%	0.432	S	S	*	.			trans	-67.7	104.5	-157.5	57.2	0	0	0	0	115.2
1485	T	43.2	Very low	53.3	Low	102 Å²	102	65.7 Å²	65.7	63%	0.626	40%	0.403	S	S	*	.			trans	-104	108	152.9	42.6	0	0	0	0	109.4	E1483 L1487	E1483-T1485 PolarHBondContact O-N 3.03Å; E1483-T1485 VanDerWaalsContact O-N 3.1Å; T1485-L1487 PolarHBondContact O-N 2.91Å
1486	T	53	Low	55.9	Low	123 Å²	123	65.2 Å²	65.2	76%	0.755	39%	0.39	S	S	*	.			trans	-72.4	96.5	176.1	51.5	0	0	0	0	109.9
1487	L	64.8	Low	58.6	Low	11 Å²	11	63.9 Å²	63.9	6%	0.058	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	153	173.9	-59.7	167.7	0	0	0	110.2	V1425 H1427 V1462 Y1465 T1485	V1425-L1487 HydrophobicContact CG1-CB 4.5Å; H1427-L1487 HydrophobicContact CB-CD2 4.06Å; V1462-L1487 HydrophobicContact CB-CB 4Å; V1462-L1487 HydrophobicContact CG2-CB 4.37Å; V1462-L1487 PolarHBondContact N-O 3.18Å; Y1465-L1487 HydrophobicContact CD2-CD1 3.5Å; Y1465-L1487 HydrophobicContact CE2-CD1 3.36Å; T1485-L1487 PolarHBondContact O-N 2.91Å
1488	T	76.7	Confident	61.3	Low	19 Å²	19	68 Å²	68	12%	0.117	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	136.7	176.5	50.1	0	0	0	0	110.4	C1426 E1432	C1426-T1488 WeakPolarHBondContact CB-O 3.39Å; C1426-T1488 PolarHBondContact N-O 3.13Å; C1426-T1488 PolarHBondContact O-N 3.34Å; E1432-T1488 VanDerWaalsContact CD-OG1 3.29Å; E1432-T1488 VanDerWaalsContact CG-OG1 3.3Å; E1432-T1488 WeakPolarHBondContact CG-OG1 3.47Å; E1432-T1488 PolarHBondContact OE1-OG1 3.16Å
1489	E	80.2	Confident	63.8	Low	2 Å²	2	66.5 Å²	66.5	1%	0.009	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	125.1	176.8	-173.2	-163.7	139.8	0	0	110.2	R1423 V1424 V1425 V1459 R1460 V1462 N1491	R1423-E1489 WeakPolarHBondContact CD-OE1 3.23Å; V1424-E1489 WeakPolarHBondContact O-CA 3.35Å; V1425-E1489 HydrophobicContact CG2-CB 4.41Å; V1425-E1489 HydrophobicContact CG2-CG 4.08Å; V1459-E1489 WeakPolarHBondContact CA-O 3.31Å; R1460-E1489 HydrophobicContact CG-CB 3.94Å; R1460-E1489 IonicContact CZ-OE1 3.55Å; R1460-E1489 VanDerWaalsContact CZ-OE1 3.23Å; R1460-E1489 IonicContact CZ-OE2 3.88Å; R1460-E1489 PolarHBondContact N-O 3.04Å; R1460-E1489 IonicContact NE-OE1 2.76Å; R1460-E1489 PolarHBondContact NE-OE1 3.06Å; R1460-E1489 IonicContact NE-OE2 3.07Å; R1460-E1489 PolarHBondContact NE-OE2 3.11Å; R1460-E1489 IonicContact NH2-OE1 3.23Å; R1460-E1489 PolarHBondContact NH2-OE1 3.09Å; R1460-E1489 IonicContact NH2-OE2 3.4Å; R1460-E1489 PolarHBondContact NH2-OE2 3.3Å; R1460-E1489 PolarHBondContact O-N 3.32Å; V1462-E1489 HydrophobicContact CG2-CB 3.75Å; E1489-N1491 PolarHBondContact OE1-ND2 3.4Å; E1489-N1491 PolarHBondContact OE1-OD1 3.21Å
1490	Y	86.5	Confident	66.7	Low	6 Å²	6	61.4 Å²	61.4	2%	0.024	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	127.2	172.4	-74.3	-111.7	0	0	0	108.9	R1423 V1424 C1426 E1432 V1435 Q1436 I1439 S1458 V1459	R1423-Y1490 WeakPolarHBondContact CA-O 3.27Å; V1424-Y1490 PolarHBondContact N-O 3.4Å; V1424-Y1490 PolarHBondContact O-N 3.02Å; C1426-Y1490 VanDerWaalsContact SG-CD2 3.58Å; E1432-Y1490 HydrophobicContact CB-CE2 4.34Å; E1432-Y1490 HydrophobicContact CG-CE2 4.05Å; V1435-Y1490 HydrophobicContact CB-CD1 4.39Å; V1435-Y1490 HydrophobicContact CB-CG 4.3Å; V1435-Y1490 HydrophobicContact CG1-CD1 3.75Å; V1435-Y1490 HydrophobicContact CG1-CD2 4.42Å; V1435-Y1490 HydrophobicContact CG1-CG 3.69Å; Q1436-Y1490 HydrophobicContact CG-CE1 3.88Å; Q1436-Y1490 PolarHBondContact NE2-OH 3.19Å; I1439-Y1490 HydrophobicContact CD1-CD1 3.78Å; I1439-Y1490 HydrophobicContact CD1-CE1 4.38Å; S1458-Y1490 WeakPolarHBondContact O-CA 3.23Å; V1459-Y1490 HydrophobicContact CB-CE1 4.45Å; V1459-Y1490 HydrophobicContact CG1-CD2 4.14Å; V1459-Y1490 HydrophobicContact CG1-CE1 4.24Å; V1459-Y1490 HydrophobicContact CG1-CE2 3.75Å; V1459-Y1490 HydrophobicContact CG2-CD1 3.61Å; V1459-Y1490 HydrophobicContact CG2-CE1 3.38Å; V1459-Y1490 HydrophobicContact CG2-CE2 4.4Å; V1459-Y1490 HydrophobicContact CG2-CG 4.22Å
1491	N	84.3	Confident	69.8	Low	0 Å²	0	57.8 Å²	57.8	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	111.7	175.3	-77.5	-94	0	0	0	108	I1388 F1389 L1421 R1423 Y1457 S1458 E1489	I1388-N1491 HydrophobicContact CG2-CB 4.46Å; F1389-N1491 HydrophobicContact CE1-CB 4.41Å; F1389-N1491 HydrophobicContact CZ-CB 4.36Å; L1421-N1491 HydrophobicContact CD1-CB 4.14Å; R1423-N1491 WeakPolarHBondContact CG-OD1 3.27Å; Y1457-N1491 CarbonylContact C-O 3.42Å; Y1457-N1491 WeakPolarHBondContact CA-O 3.32Å; Y1457-N1491 WeakPolarHBondContact CB-O 3.42Å; S1458-N1491 PolarHBondContact N-O 2.82Å; S1458-N1491 PolarHBondContact O-N 3.25Å; E1489-N1491 PolarHBondContact OE1-ND2 3.4Å; E1489-N1491 PolarHBondContact OE1-OD1 3.21Å
1492	I	86.1	Confident	72.9	Confident	0 Å²	0	52 Å²	52	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	121.3	-179.9	-50.9	176.3	0	0	0	109.1	L1421 K1422 V1435 I1439 L1494	L1421-I1492 CarbonylContact C-O 3.42Å; L1421-I1492 WeakPolarHBondContact CA-O 3.47Å; K1422-I1492 HydrophobicContact CB-CB 4.37Å; K1422-I1492 PolarHBondContact N-O 2.78Å; K1422-I1492 PolarHBondContact O-N 3.05Å; V1435-I1492 HydrophobicContact CG1-CD1 4.04Å; I1439-I1492 HydrophobicContact CD1-CD1 4.11Å; I1439-I1492 HydrophobicContact CD1-CG1 4.1Å; I1439-I1492 HydrophobicContact CG1-CD1 3.71Å; I1439-I1492 HydrophobicContact CG1-CG1 4.03Å; I1492-L1494 HydrophobicContact CG2-CD2 3.91Å; I1492-L1494 HydrophobicContact CG2-CG 4.15Å
1493	L	86.4	Confident	75.7	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	127.5	176.7	-167	65.7	0	0	0	110.5	I1380 W1382 T1385 F1389 P1394 Y1419 L1421 E1455 G1456	I1380-L1493 HydrophobicContact CD1-CD1 3.73Å; I1380-L1493 HydrophobicContact CG1-CD1 4.14Å; W1382-L1493 HydrophobicContact CZ3-CD2 4.21Å; T1385-L1493 HydrophobicContact CG2-CD2 3.98Å; F1389-L1493 HydrophobicContact CE2-CD1 4.5Å; F1389-L1493 HydrophobicContact CZ-CB 3.88Å; P1394-L1493 HydrophobicContact CG-CD2 4.22Å; Y1419-L1493 HydrophobicContact CD1-CD1 4.49Å; Y1419-L1493 HydrophobicContact CD1-CD2 4.43Å; Y1419-L1493 HydrophobicContact CD1-CG 4.28Å; Y1419-L1493 HydrophobicContact CG-CD1 4.33Å; L1421-L1493 HydrophobicContact CD1-CD1 4.25Å; E1455-L1493 HydrophobicContact CB-CB 4.26Å; E1455-L1493 HydrophobicContact CB-CD2 4.03Å; E1455-L1493 HydrophobicContact CB-CG 4.04Å; E1455-L1493 PolarHBondContact N-O 2.92Å; G1456-L1493 VanDerWaalsContact O-CB 3.31Å; G1456-L1493 WeakPolarHBondContact O-CB 3.49Å; G1456-L1493 PolarHBondContact O-N 3.12Å
1494	L	88	Confident	78.2	Confident	8 Å²	8	44.5 Å²	44.5	4%	0.042	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	151	-174.8	-57.9	168.8	0	0	0	109.2	Y1419 A1420 K1422 L1452 P1453 I1492	Y1419-L1494 CarbonylContact C-O 3.53Å; A1420-L1494 HydrophobicContact CB-CB 4.27Å; A1420-L1494 PolarHBondContact N-O 3.05Å; A1420-L1494 PolarHBondContact O-N 2.99Å; K1422-L1494 HydrophobicContact CB-CD1 4.29Å; L1452-L1494 HydrophobicContact CD2-CB 4.29Å; L1452-L1494 HydrophobicContact CD2-CD1 4.01Å; L1452-L1494 HydrophobicContact CD2-CD2 4.03Å; L1452-L1494 HydrophobicContact CD2-CG 4.33Å; L1452-L1494 HydrophobicContact CG-CD2 4.23Å; P1453-L1494 WeakPolarHBondContact O-CD2 3.41Å; I1492-L1494 HydrophobicContact CG2-CD2 3.91Å; I1492-L1494 HydrophobicContact CG2-CG 4.15Å
1495	P	86.2	Confident	81.1	Confident	11 Å²	11	40.5 Å²	40.5	7%	0.071	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	142.7	171.4	-12.7	24.7	0	0	0	111	L1452 P1453 E1455 Y1497	L1452-P1495 HydrophobicContact CD1-CG 4.41Å; P1453-P1495 HydrophobicContact CG-CG 3.73Å; P1453-P1495 VanDerWaalsContact O-CD 3.29Å; P1453-P1495 WeakPolarHBondContact O-CD 3.45Å; E1455-P1495 HydrophobicContact CG-CG 4.1Å; P1495-Y1497 HydrophobicContact CB-CD2 4.46Å; P1495-Y1497 HydrophobicContact CB-CE2 3.89Å; P1495-Y1497 HydrophobicContact CG-CE2 4.41Å; P1495-Y1497 WeakPolarHBondContact O-CD2 3.46Å
1496	Y	85.1	Confident	83.3	Confident	81 Å²	81	35.7 Å²	35.7	32%	0.318	17%	0.173	S	C	.	.			trans	-85.2	133.6	172.1	176.3	-119.6	0	0	0	111.5	L1379 L1418 K1498	L1379-Y1496 HydrophobicContact CD1-CD2 4.47Å; L1379-Y1496 HydrophobicContact CD1-CE2 4.04Å; L1379-Y1496 HydrophobicContact CD2-CD2 3.32Å; L1379-Y1496 HydrophobicContact CD2-CE2 3.66Å; L1379-Y1496 HydrophobicContact CD2-CG 3.82Å; L1418-Y1496 HydrophobicContact CB-CD1 3.87Å; L1418-Y1496 HydrophobicContact CB-CG 4.29Å; L1418-Y1496 HydrophobicContact CD1-CD1 4.23Å; L1418-Y1496 HydrophobicContact CD1-CE1 4.23Å; L1418-Y1496 WeakPolarHBondContact O-CB 3.45Å; Y1496-K1498 HydrophobicContact CE1-CB 3.85Å; Y1496-K1498 HydrophobicContact CE1-CG 4.21Å
1497	Y	83.9	Confident	84.7	Confident	30 Å²	30	36.7 Å²	36.7	12%	0.118	16%	0.163	C	C	.	.			trans	-114.4	107.3	176.7	-73.7	-106.4	0	0	0	108.4	L1452 P1495 R1499 G1500 L1554 V1563	L1452-Y1497 HydrophobicContact CD1-CD2 4.05Å; L1452-Y1497 HydrophobicContact CD1-CE2 3.42Å; L1452-Y1497 VanDerWaalsContact CD1-CE2 3.42Å; P1495-Y1497 HydrophobicContact CB-CD2 4.46Å; P1495-Y1497 HydrophobicContact CB-CE2 3.89Å; P1495-Y1497 HydrophobicContact CG-CE2 4.41Å; P1495-Y1497 WeakPolarHBondContact O-CD2 3.46Å; Y1497-R1499 VanDerWaalsContact C-N 3.31Å; Y1497-R1499 PolarHBondContact O-N 3.29Å; Y1497-G1500 PolarHBondContact O-N 3.02Å; Y1497-G1500 VanDerWaalsContact O-N 3.14Å; Y1497-L1554 HydrophobicContact CD1-CB 4.24Å; Y1497-L1554 HydrophobicContact CD2-CD1 3.83Å; Y1497-L1554 HydrophobicContact CE2-CD1 4.38Å; Y1497-L1554 HydrophobicContact CG-CB 4.12Å; Y1497-L1554 HydrophobicContact CG-CD1 4.13Å; Y1497-V1563 HydrophobicContact CE1-CB 4.34Å; Y1497-V1563 HydrophobicContact CE1-CG2 3.83Å
1498	K	81.4	Confident	85.3	Confident	158 Å²	158	43.5 Å²	43.5	69%	0.687	19%	0.188	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.8	-26.8	-167.8	-175.6	-171.5	171.4	-170.3	0	113.4	Y1496 G1500 D1557	Y1496-K1498 HydrophobicContact CE1-CB 3.85Å; Y1496-K1498 HydrophobicContact CE1-CG 4.21Å; K1498-G1500 PolarHBondContact O-N 3Å; K1498-D1557 WeakPolarHBondContact CB-OD1 3.5Å; K1498-D1557 WeakPolarHBondContact CB-OD2 3.4Å; K1498-D1557 PolarHBondContact N-OD1 2.67Å; K1498-D1557 PolarHBondContact N-OD2 3.29Å
1499	R	81.7	Confident	85.8	Confident	97 Å²	97	43.8 Å²	43.8	37%	0.366	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.9	-4.5	174.3	-75.6	176.7	69.4	-156.1	0.7	115	Y1497 E1505 L1555 S1556 D1557 D1560	Y1497-R1499 VanDerWaalsContact C-N 3.31Å; Y1497-R1499 PolarHBondContact O-N 3.29Å; R1499-E1505 IonicContact NH2-OE2 3.37Å; R1499-L1555 HydrophobicContact CB-CB 4.04Å; R1499-S1556 PolarHBondContact NH1-O 3.07Å; R1499-D1557 VanDerWaalsContact CG-OD1 3.27Å; R1499-D1557 WeakPolarHBondContact CG-OD1 3.41Å; R1499-D1557 PolarHBondContact N-OD1 3.06Å; R1499-D1560 IonicContact CZ-OD1 2.67Å; R1499-D1560 IonicContact NH1-OD1 3.74Å; R1499-D1560 PolarHBondContact NH1-OD1 2.94Å; R1499-D1560 IonicContact NH2-OD1 3.21Å; R1499-D1560 PolarHBondContact NH2-OD1 3.15Å
1500	G	86.4	Confident	85.9	Confident	15 Å²	15	48 Å²	48	16%	0.155	21%	0.209	C	C	.	.			trans	66.1	-145.4	175.9	0	0	0	0	0	112.9	Y1497 K1498 E1504 L1554 L1555	Y1497-G1500 PolarHBondContact O-N 3.02Å; Y1497-G1500 VanDerWaalsContact O-N 3.14Å; K1498-G1500 PolarHBondContact O-N 3Å; G1500-E1504 WeakPolarHBondContact CA-OE2 3.44Å; G1500-L1554 CarbonylContact O-C 3.6Å; G1500-L1554 WeakPolarHBondContact O-CA 3.47Å; G1500-L1555 PolarHBondContact O-N 2.7Å
1501	T	91.8	Very high	85.1	Confident	21 Å²	21	52.4 Å²	52.4	13%	0.129	24%	0.24	C	C	.	.	B	Isolated β-bridge	trans	-100.6	157.6	-171.9	63	0	0	0	0	113.1	Q1503 E1504 E1505 G1551 V1553 L1554 M1565	T1501-Q1503 PolarHBondContact O-N 2.95Å; T1501-E1504 PolarHBondContact N-OE2 3.1Å; T1501-E1504 PolarHBondContact O-N 2.65Å; T1501-E1504 VanDerWaalsContact O-N 3.09Å; T1501-E1504 WeakPolarHBondContact OG1-CG 3.42Å; T1501-E1504 PolarHBondContact OG1-OE2 3.3Å; T1501-E1505 PolarHBondContact O-N 2.86Å; T1501-G1551 VanDerWaalsContact CG2-O 3.27Å; T1501-G1551 WeakPolarHBondContact CG2-O 3.48Å; T1501-V1553 CarbonylContact C-O 3.6Å; T1501-V1553 WeakPolarHBondContact CA-O 3.48Å; T1501-L1554 HydrophobicContact CG2-CD2 3.89Å; T1501-M1565 HydrophobicContact CG2-SD 4.42Å
1502	I	92.1	Very high	84.6	Confident	3 Å²	3	55.5 Å²	55.5	2%	0.015	26%	0.262	C	S	.	.	H	α-helix	trans	-58.8	-35.1	173.2	-69.9	-176.4	0	0	0	111.3	E1504 E1505 L1506 I1528 T1550 V1553 L1555 A1562 L1628	I1502-E1504 VanDerWaalsContact C-N 3.25Å; I1502-E1504 PolarHBondContact O-N 2.95Å; I1502-E1505 PolarHBondContact O-N 2.96Å; I1502-L1506 HydrophobicContact CG2-CD1 3.78Å; I1502-L1506 HydrophobicContact CG2-CG 4Å; I1502-L1506 WeakPolarHBondContact O-CG 3.28Å; I1502-L1506 PolarHBondContact O-N 3.24Å; I1502-I1528 HydrophobicContact CD1-CD1 4.03Å; I1502-T1550 HydrophobicContact CG2-CG2 4.15Å; I1502-T1550 PolarHBondContact N-O 2.98Å; I1502-V1553 HydrophobicContact CB-CB 4.46Å; I1502-V1553 HydrophobicContact CD1-CB 3.87Å; I1502-V1553 HydrophobicContact CD1-CG1 3.52Å; I1502-V1553 HydrophobicContact CG1-CB 4.14Å; I1502-V1553 HydrophobicContact CG1-CG1 4.11Å; I1502-V1553 PolarHBondContact N-O 2.63Å; I1502-L1555 HydrophobicContact CD1-CD2 4.14Å; I1502-L1555 HydrophobicContact CG1-CD1 4.2Å; I1502-L1555 HydrophobicContact CG1-CD2 3.78Å; I1502-L1555 HydrophobicContact CG1-CG 3.88Å; I1502-A1562 HydrophobicContact CD1-CB 4.5Å; I1502-L1628 HydrophobicContact CD1-CD2 4.27Å; I1502-L1628 HydrophobicContact CG2-CD2 3.6Å
1503	Q	90.1	Very high	84.2	Confident	29 Å²	29	57.6 Å²	57.6	14%	0.136	28%	0.284	C	S	.	.	H	α-helix	trans	-60	-33.6	176.2	-173	63	9.1	0	0	113.1	T1501 R1507 T1550	T1501-Q1503 PolarHBondContact O-N 2.95Å; Q1503-R1507 WeakPolarHBondContact O-CG 3.48Å; Q1503-R1507 PolarHBondContact O-N 3.41Å; Q1503-T1550 PolarHBondContact N-O 3.34Å; Q1503-T1550 PolarHBondContact OE1-OG1 2.96Å
1504	E	85	Confident	84	Confident	101 Å²	101	61.1 Å²	61.1	47%	0.472	30%	0.302	S	S	.	.	H	α-helix	trans	-72.4	-39.8	177.7	-69.5	164	128	0	0	111.4	G1500 T1501 I1502 W1508	G1500-E1504 WeakPolarHBondContact CA-OE2 3.44Å; T1501-E1504 PolarHBondContact N-OE2 3.1Å; T1501-E1504 PolarHBondContact O-N 2.65Å; T1501-E1504 VanDerWaalsContact O-N 3.09Å; T1501-E1504 WeakPolarHBondContact OG1-CG 3.42Å; T1501-E1504 PolarHBondContact OG1-OE2 3.3Å; I1502-E1504 VanDerWaalsContact C-N 3.25Å; I1502-E1504 PolarHBondContact O-N 2.95Å; E1504-W1508 PolarHBondContact O-N 3.38Å
1505	E	89.8	Confident	84.1	Confident	34 Å²	34	64 Å²	64	16%	0.159	32%	0.315	C	S	.	.	H	α-helix	trans	-64.3	-43	171.7	-167.9	179.9	158	0	0	111.4	R1499 T1501 I1502 W1508 R1509 R1520 L1555	R1499-E1505 IonicContact NH2-OE2 3.37Å; T1501-E1505 PolarHBondContact O-N 2.86Å; I1502-E1505 PolarHBondContact O-N 2.96Å; E1505-W1508 PolarHBondContact O-N 2.81Å; E1505-R1509 HydrophobicContact CG-CG 4.47Å; E1505-R1509 WeakPolarHBondContact O-CB 3.36Å; E1505-R1509 WeakPolarHBondContact O-CG 3.31Å; E1505-R1509 PolarHBondContact O-N 3.14Å; E1505-R1509 IonicContact OE1-CZ 3.84Å; E1505-R1509 VanDerWaalsContact OE1-CZ 3.31Å; E1505-R1509 IonicContact OE1-NE 2.99Å; E1505-R1509 PolarHBondContact OE1-NE 3.04Å; E1505-R1509 IonicContact OE1-NH2 3.43Å; E1505-R1509 PolarHBondContact OE1-NH2 3.34Å; E1505-R1520 IonicContact OE1-CZ 3.68Å; E1505-R1520 IonicContact OE1-NH1 3.68Å; E1505-R1520 PolarHBondContact OE1-NH1 3.04Å; E1505-R1520 IonicContact OE1-NH2 3.71Å; E1505-R1520 IonicContact OE2-CZ 3.76Å; E1505-R1520 IonicContact OE2-NH1 3.18Å; E1505-R1520 PolarHBondContact OE2-NH1 3.07Å; E1505-R1520 IonicContact OE2-NH2 2.69Å; E1505-R1520 PolarHBondContact OE2-NH2 3.43Å; E1505-L1555 WeakPolarHBondContact OE2-CD1 3.27Å
1506	L	90.9	Very high	84.4	Confident	1 Å²	1	63.7 Å²	63.7	1%	0.005	31%	0.312	C	S	.	.	H	α-helix	trans	-66.2	-37.2	179.8	-69	177.4	0	0	0	113	I1502 R1509 L1510 I1516 T1550 A1627	I1502-L1506 HydrophobicContact CG2-CD1 3.78Å; I1502-L1506 HydrophobicContact CG2-CG 4Å; I1502-L1506 WeakPolarHBondContact O-CG 3.28Å; I1502-L1506 PolarHBondContact O-N 3.24Å; L1506-R1509 PolarHBondContact O-N 3.41Å; L1506-L1510 WeakPolarHBondContact O-CB 3.36Å; L1506-L1510 PolarHBondContact O-N 2.98Å; L1506-I1516 HydrophobicContact CD2-CD1 3.74Å; L1506-T1550 HydrophobicContact CD1-CG2 3.58Å; L1506-A1627 HydrophobicContact CD1-CB 4.37Å; L1506-A1627 WeakPolarHBondContact CD1-O 3.43Å
1507	R	82.2	Confident	84.7	Confident	144 Å²	144	65 Å²	65	54%	0.543	33%	0.325	S	S	.	.	H	α-helix	trans	-61.4	-43.5	172.2	-77.9	179.3	-171.3	147.8	4	112.1	Q1503 L1510 S1511	Q1503-R1507 WeakPolarHBondContact O-CG 3.48Å; Q1503-R1507 PolarHBondContact O-N 3.41Å; R1507-L1510 PolarHBondContact O-N 3.49Å; R1507-S1511 PolarHBondContact O-N 3.33Å
1508	W	76.2	Confident	85.1	Confident	153 Å²	153	66.1 Å²	66.1	58%	0.58	33%	0.331	S	S	*	.	H	α-helix	trans	-62.7	-46.2	176.1	176.3	75.8	0	0	0	110.9	E1504 E1505 L1510 S1511 S1512	E1504-W1508 PolarHBondContact O-N 3.38Å; E1505-W1508 PolarHBondContact O-N 2.81Å; W1508-L1510 PolarHBondContact O-N 3.09Å; W1508-S1511 PolarHBondContact O-N 3.44Å; W1508-S1511 VanDerWaalsContact O-N 3.14Å; W1508-S1511 PolarHBondContact O-OG 3.08Å; W1508-S1512 PolarHBondContact O-N 3.21Å; W1508-S1512 PolarHBondContact O-OG 3.44Å
1509	R	88.3	Confident	85.6	Confident	26 Å²	26	65.5 Å²	65.5	10%	0.098	33%	0.329	C	S	.	.	H	α-helix	trans	-62.3	-37.4	176.8	-76.3	-178.9	175.8	-75.6	-13.7	114.2	E1505 L1506 S1511 S1512 G1513 D1514 F1515 W1631	E1505-R1509 HydrophobicContact CG-CG 4.47Å; E1505-R1509 WeakPolarHBondContact O-CB 3.36Å; E1505-R1509 WeakPolarHBondContact O-CG 3.31Å; E1505-R1509 PolarHBondContact O-N 3.14Å; E1505-R1509 IonicContact OE1-CZ 3.84Å; E1505-R1509 VanDerWaalsContact OE1-CZ 3.31Å; E1505-R1509 IonicContact OE1-NE 2.99Å; E1505-R1509 PolarHBondContact OE1-NE 3.04Å; E1505-R1509 IonicContact OE1-NH2 3.43Å; E1505-R1509 PolarHBondContact OE1-NH2 3.34Å; L1506-R1509 PolarHBondContact O-N 3.41Å; R1509-S1511 VanDerWaalsContact C-N 3.27Å; R1509-S1511 PolarHBondContact O-N 3.05Å; R1509-S1512 PolarHBondContact O-N 2.97Å; R1509-S1512 PolarHBondContact O-OG 3.03Å; R1509-G1513 WeakPolarHBondContact O-CA 3.18Å; R1509-G1513 PolarHBondContact O-N 3.08Å; R1509-D1514 WeakPolarHBondContact CB-O 3.49Å; R1509-D1514 IonicContact CZ-OD2 3.92Å; R1509-D1514 VanDerWaalsContact NH1-CG 3.29Å; R1509-D1514 PolarHBondContact NH1-O 3.27Å; R1509-D1514 IonicContact NH1-OD1 3.17Å; R1509-D1514 IonicContact NH1-OD2 3.28Å; R1509-D1514 PolarHBondContact NH1-OD2 3.26Å; R1509-D1514 IonicContact NH2-OD2 3.17Å; R1509-D1514 PolarHBondContact O-N 3.23Å; R1509-D1514 VanDerWaalsContact O-N 3.13Å; R1509-F1515 PolarHBondContact NH1-O 3.31Å; R1509-W1631 VanDerWaalsContact CB-CD1 3.49Å
1510	L	82.6	Confident	86.1	Confident	90 Å²	90	63.1 Å²	63.1	47%	0.471	32%	0.32	S	S	.	.	H	α-helix	trans	-61.7	-37	174.3	-179.5	60.5	0	0	0	111.4	L1506 R1507 W1508 W1631 V1632	L1506-L1510 WeakPolarHBondContact O-CB 3.36Å; L1506-L1510 PolarHBondContact O-N 2.98Å; R1507-L1510 PolarHBondContact O-N 3.49Å; W1508-L1510 PolarHBondContact O-N 3.09Å; L1510-W1631 HydrophobicContact CB-CB 3.96Å; L1510-W1631 HydrophobicContact CB-CG 4.18Å; L1510-W1631 HydrophobicContact CD1-CB 4.08Å; L1510-W1631 HydrophobicContact CD1-CD2 4.34Å; L1510-W1631 HydrophobicContact CD1-CE3 4.18Å; L1510-W1631 HydrophobicContact CD1-CG 4.33Å; L1510-W1631 HydrophobicContact CG-CB 4.47Å; L1510-V1632 HydrophobicContact CD2-CG1 4.19Å
1511	S	68.3	Low	86.5	Confident	98 Å²	98	62.4 Å²	62.4	69%	0.685	31%	0.312	S	S	*	.	H	α-helix	trans	-73.4	-26.3	177.6	75	0	0	0	0	113.9	R1507 W1508 R1509	R1507-S1511 PolarHBondContact O-N 3.33Å; W1508-S1511 PolarHBondContact O-N 3.44Å; W1508-S1511 VanDerWaalsContact O-N 3.14Å; W1508-S1511 PolarHBondContact O-OG 3.08Å; R1509-S1511 VanDerWaalsContact C-N 3.27Å; R1509-S1511 PolarHBondContact O-N 3.05Å
1512	S	73.9	Confident	86.6	Confident	66 Å²	66	61.8 Å²	61.8	46%	0.462	31%	0.308	S	S	.	.	H	α-helix	trans	-96.3	-12.7	177.3	62.2	0	0	0	0	114.3	W1508 R1509 D1514	W1508-S1512 PolarHBondContact O-N 3.21Å; W1508-S1512 PolarHBondContact O-OG 3.44Å; R1509-S1512 PolarHBondContact O-N 2.97Å; R1509-S1512 PolarHBondContact O-OG 3.03Å; S1512-D1514 VanDerWaalsContact C-N 3.27Å; S1512-D1514 WeakPolarHBondContact OG-CB 3.44Å; S1512-D1514 PolarHBondContact OG-N 3.17Å
1513	G	78.1	Confident	86.7	Confident	43 Å²	43	64.8 Å²	64.8	44%	0.443	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.7	15.9	-171.7	0	0	0	0	0	114.4	R1509	R1509-G1513 WeakPolarHBondContact O-CA 3.18Å; R1509-G1513 PolarHBondContact O-N 3.08Å
1514	D	83.1	Confident	86.9	Confident	74 Å²	74	63.5 Å²	63.5	40%	0.396	32%	0.315	S	S	.	.	P	Polyproline II helix	trans	-90	119.3	-173.1	-175.9	36.8	0	0	0	113	R1509 S1512 W1631	R1509-D1514 WeakPolarHBondContact CB-O 3.49Å; R1509-D1514 IonicContact CZ-OD2 3.92Å; R1509-D1514 VanDerWaalsContact NH1-CG 3.29Å; R1509-D1514 PolarHBondContact NH1-O 3.27Å; R1509-D1514 IonicContact NH1-OD1 3.17Å; R1509-D1514 IonicContact NH1-OD2 3.28Å; R1509-D1514 PolarHBondContact NH1-OD2 3.26Å; R1509-D1514 IonicContact NH2-OD2 3.17Å; R1509-D1514 PolarHBondContact O-N 3.23Å; R1509-D1514 VanDerWaalsContact O-N 3.13Å; S1512-D1514 VanDerWaalsContact C-N 3.27Å; S1512-D1514 WeakPolarHBondContact OG-CB 3.44Å; S1512-D1514 PolarHBondContact OG-N 3.17Å; D1514-W1631 PolarHBondContact O-NE1 2.84Å
1515	F	90	Very high	87.5	Confident	69 Å²	69	58.7 Å²	58.7	30%	0.303	29%	0.293	S	S	.	.	P	Polyproline II helix	trans	-79.8	145.1	178.9	-69.4	-87.6	0	0	0	111.9	R1509 N1517 C1629 F1630 W1631 P1661 Y1662	R1509-F1515 PolarHBondContact NH1-O 3.31Å; F1515-N1517 PolarHBondContact O-N 3.43Å; F1515-C1629 WeakPolarHBondContact CD1-O 3.35Å; F1515-F1630 HydrophobicContact CE1-CD1 4.33Å; F1515-W1631 AromaticContact CD1-CH2 3.73Å; F1515-W1631 HydrophobicContact CD1-CH2 3.73Å; F1515-W1631 AromaticContact CD1-CZ2 3.55Å; F1515-W1631 HydrophobicContact CD1-CZ2 3.55Å; F1515-W1631 HydrophobicContact CD1-CZ3 4.5Å; F1515-W1631 HydrophobicContact CD2-CH2 4.03Å; F1515-W1631 AromaticContact CD2-CZ2 3.86Å; F1515-W1631 HydrophobicContact CD2-CZ2 3.86Å; F1515-W1631 AromaticContact CE1-CH2 3.27Å; F1515-W1631 HydrophobicContact CE1-CH2 3.27Å; F1515-W1631 AromaticContact CE1-CZ2 3.64Å; F1515-W1631 HydrophobicContact CE1-CZ2 3.64Å; F1515-W1631 AromaticContact CE1-CZ3 3.84Å; F1515-W1631 HydrophobicContact CE1-CZ3 3.84Å; F1515-W1631 AromaticContact CE2-CH2 3.6Å; F1515-W1631 HydrophobicContact CE2-CH2 3.6Å; F1515-W1631 AromaticContact CE2-CZ2 3.94Å; F1515-W1631 HydrophobicContact CE2-CZ2 3.94Å; F1515-W1631 HydrophobicContact CG-CH2 4.11Å; F1515-W1631 AromaticContact CG-CZ2 3.7Å; F1515-W1631 HydrophobicContact CG-CZ2 3.7Å; F1515-W1631 AromaticContact CZ-CH2 3.22Å; F1515-W1631 HydrophobicContact CZ-CH2 3.22Å; F1515-W1631 AromaticContact CZ-CZ2 3.86Å; F1515-W1631 HydrophobicContact CZ-CZ2 3.86Å; F1515-W1631 AromaticContact CZ-CZ3 3.98Å; F1515-W1631 HydrophobicContact CZ-CZ3 3.98Å; F1515-P1661 HydrophobicContact CB-CG 4.13Å; F1515-P1661 HydrophobicContact CD1-CG 3.52Å; F1515-P1661 HydrophobicContact CD2-CG 3.85Å; F1515-P1661 HydrophobicContact CE1-CG 3.68Å; F1515-P1661 HydrophobicContact CE2-CG 3.99Å; F1515-P1661 HydrophobicContact CG-CG 3.58Å; F1515-P1661 HydrophobicContact CZ-CG 3.89Å; F1515-Y1662 AromaticContact CD1-CE2 3.78Å; F1515-Y1662 HydrophobicContact CD1-CE2 3.78Å; F1515-Y1662 HydrophobicContact CE1-CE2 4.29Å
1516	I	92.3	Very high	87.7	Confident	4 Å²	4	58.8 Å²	58.8	2%	0.021	29%	0.292	C	S	.	.	P	Polyproline II helix	trans	-71.8	131	173.4	-59.5	178.1	0	0	0	108.4	L1506 E1518 R1520 V1521 L1628 Y1662	L1506-I1516 HydrophobicContact CD2-CD1 3.74Å; I1516-E1518 PolarHBondContact O-N 3.27Å; I1516-R1520 HydrophobicContact CG2-CB 3.96Å; I1516-R1520 HydrophobicContact CG2-CG 4.04Å; I1516-V1521 HydrophobicContact CB-CG2 3.65Å; I1516-V1521 HydrophobicContact CG2-CG2 3.55Å; I1516-L1628 HydrophobicContact CD1-CD2 3.99Å; I1516-Y1662 PolarHBondContact N-OH 2.71Å; I1516-Y1662 VanDerWaalsContact O-CE1 3.27Å; I1516-Y1662 WeakPolarHBondContact O-CE1 3.47Å; I1516-Y1662 PolarHBondContact O-OH 2.69Å
1517	N	90.6	Very high	88	Confident	109 Å²	109	59.8 Å²	59.8	58%	0.583	30%	0.297	S	S	*	.	P	Polyproline II helix	trans	-55.1	133.2	174.8	-178.7	-84.6	0	0	0	111.3	F1515 K1519 R1520 V1521	F1515-N1517 PolarHBondContact O-N 3.43Å; N1517-K1519 PolarHBondContact O-N 2.98Å; N1517-K1519 VanDerWaalsContact O-N 3.1Å; N1517-K1519 WeakPolarHBondContact OD1-CB 3.46Å; N1517-K1519 PolarHBondContact OD1-N 3.39Å; N1517-R1520 CarbonylContact O-C 3.56Å; N1517-R1520 WeakPolarHBondContact O-CA 3.4Å; N1517-R1520 WeakPolarHBondContact O-CB 3.46Å; N1517-R1520 PolarHBondContact O-N 3.05Å; N1517-V1521 PolarHBondContact O-N 2.81Å
1518	E	92.7	Very high	88.7	Confident	53 Å²	53	53 Å²	53	25%	0.248	27%	0.272	C	S	.	.	H	α-helix	trans	-55.3	-35.1	-173.4	-169	170	142	0	0	113.7	I1516 R1520 V1521 C1522 Y1662 S1663 M1666	I1516-E1518 PolarHBondContact O-N 3.27Å; E1518-R1520 VanDerWaalsContact C-N 3.3Å; E1518-R1520 PolarHBondContact O-N 2.88Å; E1518-V1521 PolarHBondContact O-N 2.76Å; E1518-C1522 PolarHBondContact O-N 2.59Å; E1518-C1522 PolarHBondContact O-SG 3.43Å; E1518-Y1662 HydrophobicContact CB-CD1 4.15Å; E1518-Y1662 HydrophobicContact CG-CD1 4.21Å; E1518-Y1662 WeakPolarHBondContact OE2-CA 3.32Å; E1518-S1663 VanDerWaalsContact OE1-CB 3.26Å; E1518-S1663 WeakPolarHBondContact OE1-CB 3.25Å; E1518-S1663 PolarHBondContact OE1-OG 3.32Å; E1518-S1663 PolarHBondContact OE2-N 3.3Å; E1518-S1663 PolarHBondContact OE2-OG 2.68Å; E1518-M1666 HydrophobicContact CG-CE 3.77Å
1519	K	91	Very high	89.7	Confident	146 Å²	146	45.7 Å²	45.7	64%	0.635	24%	0.244	S	C	*	.	H	α-helix	trans	-64.3	-35.3	175.2	-63.2	-172.3	175.6	-172.6	0	112.3	N1517 K1523	N1517-K1519 PolarHBondContact O-N 2.98Å; N1517-K1519 VanDerWaalsContact O-N 3.1Å; N1517-K1519 WeakPolarHBondContact OD1-CB 3.46Å; N1517-K1519 PolarHBondContact OD1-N 3.39Å; K1519-K1523 WeakPolarHBondContact O-CB 3.45Å; K1519-K1523 PolarHBondContact O-N 2.7Å
1520	R	93.8	Very high	90	Very high	47 Å²	47	48.1 Å²	48.1	18%	0.177	26%	0.256	C	S	.	.	H	α-helix	trans	-76.1	-35.5	174.7	-174.6	166.4	176.5	-107.1	-9	111.7	E1505 I1516 N1517 E1518 K1523 L1524 D1560	E1505-R1520 IonicContact OE1-CZ 3.68Å; E1505-R1520 IonicContact OE1-NH1 3.68Å; E1505-R1520 PolarHBondContact OE1-NH1 3.04Å; E1505-R1520 IonicContact OE1-NH2 3.71Å; E1505-R1520 IonicContact OE2-CZ 3.76Å; E1505-R1520 IonicContact OE2-NH1 3.18Å; E1505-R1520 PolarHBondContact OE2-NH1 3.07Å; E1505-R1520 IonicContact OE2-NH2 2.69Å; E1505-R1520 PolarHBondContact OE2-NH2 3.43Å; I1516-R1520 HydrophobicContact CG2-CB 3.96Å; I1516-R1520 HydrophobicContact CG2-CG 4.04Å; N1517-R1520 CarbonylContact O-C 3.56Å; N1517-R1520 WeakPolarHBondContact O-CA 3.4Å; N1517-R1520 WeakPolarHBondContact O-CB 3.46Å; N1517-R1520 PolarHBondContact O-N 3.05Å; E1518-R1520 VanDerWaalsContact C-N 3.3Å; E1518-R1520 PolarHBondContact O-N 2.88Å; R1520-K1523 PolarHBondContact O-N 3.14Å; R1520-L1524 HydrophobicContact CG-CD1 3.96Å; R1520-L1524 HydrophobicContact CG-CG 4.17Å; R1520-L1524 WeakPolarHBondContact O-CB 3.46Å; R1520-L1524 VanDerWaalsContact O-CG 3.29Å; R1520-L1524 WeakPolarHBondContact O-CG 3.27Å; R1520-L1524 PolarHBondContact O-N 3.02Å; R1520-D1560 IonicContact CZ-OD1 3.71Å; R1520-D1560 IonicContact CZ-OD2 2.79Å; R1520-D1560 IonicContact NE-OD1 3.15Å; R1520-D1560 PolarHBondContact NE-OD1 3.4Å; R1520-D1560 IonicContact NE-OD2 2.79Å; R1520-D1560 PolarHBondContact NE-OD2 2.78Å; R1520-D1560 IonicContact NH2-OD1 3.69Å; R1520-D1560 PolarHBondContact NH2-OD1 3.31Å; R1520-D1560 IonicContact NH2-OD2 3.31Å
1521	V	94.6	Very high	90.5	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-57.5	-51	168.5	178.3	0	0	0	0	110	I1516 N1517 E1518 K1523 L1524 F1525 L1625 L1628 Y1662 M1666	I1516-V1521 HydrophobicContact CB-CG2 3.65Å; I1516-V1521 HydrophobicContact CG2-CG2 3.55Å; N1517-V1521 PolarHBondContact O-N 2.81Å; E1518-V1521 PolarHBondContact O-N 2.76Å; V1521-K1523 PolarHBondContact O-N 3.31Å; V1521-L1524 PolarHBondContact O-N 3.11Å; V1521-F1525 WeakPolarHBondContact O-CB 3.43Å; V1521-F1525 PolarHBondContact O-N 3.42Å; V1521-L1625 HydrophobicContact CG1-CD1 3.62Å; V1521-L1628 HydrophobicContact CG1-CB 4.22Å; V1521-Y1662 HydrophobicContact CG2-CE1 3.89Å; V1521-M1666 HydrophobicContact CB-CE 4.33Å; V1521-M1666 HydrophobicContact CG1-CE 3.82Å; V1521-M1666 HydrophobicContact CG1-SD 4.42Å
1522	C	93.5	Very high	91.8	Very high	7 Å²	7	39.2 Å²	39.2	5%	0.047	20%	0.201	C	C	.	.	H	α-helix	trans	-58.6	-43.8	177.7	-69.4	0	0	0	0	112.7	E1518 R1526 L1691	E1518-C1522 PolarHBondContact O-N 2.59Å; E1518-C1522 PolarHBondContact O-SG 3.43Å; C1522-R1526 WeakPolarHBondContact O-CB 3.46Å; C1522-R1526 PolarHBondContact O-N 3.47Å; C1522-L1691 HydrophobicContact CB-CD1 4.1Å
1523	K	93.3	Very high	92.8	Very high	67 Å²	67	37.5 Å²	37.5	29%	0.291	19%	0.189	S	C	.	.	H	α-helix	trans	-62	-54.8	176.4	-174	-153.9	171.3	-154.3	0	112.1	K1519 R1520 V1521 F1525 R1526 D1527 D1559 D1560	K1519-K1523 WeakPolarHBondContact O-CB 3.45Å; K1519-K1523 PolarHBondContact O-N 2.7Å; R1520-K1523 PolarHBondContact O-N 3.14Å; V1521-K1523 PolarHBondContact O-N 3.31Å; K1523-F1525 VanDerWaalsContact C-N 3.29Å; K1523-F1525 PolarHBondContact O-N 3.43Å; K1523-R1526 WeakPolarHBondContact O-CB 3.47Å; K1523-R1526 PolarHBondContact O-N 3.45Å; K1523-D1527 PolarHBondContact O-N 3.28Å; K1523-D1559 PolarHBondContact NZ-O 2.97Å; K1523-D1560 PolarHBondContact NZ-O 2.95Å; K1523-D1560 IonicContact NZ-OD2 2.66Å
1524	L	95.4	Very high	93.5	Very high	1 Å²	1	36.1 Å²	36.1	1%	0.005	18%	0.176	C	C	.	.	H	α-helix	trans	-61.2	-40.1	-179.2	-68.1	174.6	0	0	0	111.2	R1520 V1521 D1527 I1528 L1555 D1560 A1562	R1520-L1524 HydrophobicContact CG-CD1 3.96Å; R1520-L1524 HydrophobicContact CG-CG 4.17Å; R1520-L1524 WeakPolarHBondContact O-CB 3.46Å; R1520-L1524 VanDerWaalsContact O-CG 3.29Å; R1520-L1524 WeakPolarHBondContact O-CG 3.27Å; R1520-L1524 PolarHBondContact O-N 3.02Å; V1521-L1524 PolarHBondContact O-N 3.11Å; L1524-D1527 PolarHBondContact O-N 3.38Å; L1524-I1528 WeakPolarHBondContact O-CD1 3.5Å; L1524-I1528 VanDerWaalsContact O-CG1 3.25Å; L1524-I1528 WeakPolarHBondContact O-CG1 3.41Å; L1524-I1528 PolarHBondContact O-N 2.81Å; L1524-L1555 HydrophobicContact CD2-CD2 3.59Å; L1524-D1560 WeakPolarHBondContact CD2-O 2.82Å; L1524-A1562 HydrophobicContact CD2-CB 4.16Å
1525	F	96.7	Very high	94	Very high	1 Å²	1	32.6 Å²	32.6	0%	0.004	16%	0.157	C	C	.	.	H	α-helix	trans	-68	-36.6	176.9	-171.9	-110.1	0	0	0	112.5	V1521 K1523 I1528 C1529 L1621 L1625 L1628 L1669 M1673 V1687 L1691	V1521-F1525 WeakPolarHBondContact O-CB 3.43Å; V1521-F1525 PolarHBondContact O-N 3.42Å; K1523-F1525 VanDerWaalsContact C-N 3.29Å; K1523-F1525 PolarHBondContact O-N 3.43Å; F1525-I1528 PolarHBondContact O-N 2.98Å; F1525-C1529 WeakPolarHBondContact O-CB 3.49Å; F1525-C1529 PolarHBondContact O-N 3.31Å; F1525-C1529 PolarHBondContact O-SG 2.91Å; F1525-L1621 HydrophobicContact CD2-CD1 4.23Å; F1525-L1621 HydrophobicContact CE2-CD1 3.39Å; F1525-L1621 HydrophobicContact CE2-CD2 4.3Å; F1525-L1621 HydrophobicContact CE2-CG 3.57Å; F1525-L1621 HydrophobicContact CZ-CD1 3.89Å; F1525-L1621 HydrophobicContact CZ-CD2 3.94Å; F1525-L1621 HydrophobicContact CZ-CG 3.66Å; F1525-L1625 HydrophobicContact CB-CD1 4.15Å; F1525-L1625 HydrophobicContact CD1-CD1 4.3Å; F1525-L1625 HydrophobicContact CD1-CD2 4.3Å; F1525-L1625 HydrophobicContact CD2-CB 3.96Å; F1525-L1625 HydrophobicContact CD2-CD1 3.78Å; F1525-L1625 HydrophobicContact CD2-CD2 4.43Å; F1525-L1625 HydrophobicContact CD2-CG 4.26Å; F1525-L1625 HydrophobicContact CE1-CD2 4.03Å; F1525-L1625 HydrophobicContact CE2-CB 3.67Å; F1525-L1625 HydrophobicContact CE2-CD1 4.25Å; F1525-L1625 HydrophobicContact CE2-CD2 4.15Å; F1525-L1625 HydrophobicContact CE2-CG 4.23Å; F1525-L1625 HydrophobicContact CG-CD1 3.81Å; F1525-L1625 HydrophobicContact CZ-CB 4.24Å; F1525-L1625 HydrophobicContact CZ-CD2 3.96Å; F1525-L1628 HydrophobicContact CB-CD1 4.42Å; F1525-L1669 HydrophobicContact CE1-CD2 4.25Å; F1525-M1673 HydrophobicContact CE1-CE 4.29Å; F1525-M1673 HydrophobicContact CE2-CE 4.31Å; F1525-M1673 HydrophobicContact CZ-CE 3.59Å; F1525-M1673 HydrophobicContact CZ-SD 3.82Å; F1525-V1687 HydrophobicContact CE1-CG1 3.83Å; F1525-V1687 HydrophobicContact CZ-CG1 4.08Å; F1525-L1691 HydrophobicContact CD1-CD1 4.2Å; F1525-L1691 HydrophobicContact CD1-CD2 3.96Å
1526	R	95.5	Very high	94.2	Very high	36 Å²	36	30.1 Å²	30.1	14%	0.136	15%	0.146	C	C	.	.	H	α-helix	trans	-62.2	-46.9	171.4	-176.6	178.6	-61.4	92.6	18.2	111.6	C1522 K1523 I1528 C1529 H1530 L1688 L1691 D1692 E1695	C1522-R1526 WeakPolarHBondContact O-CB 3.46Å; C1522-R1526 PolarHBondContact O-N 3.47Å; K1523-R1526 WeakPolarHBondContact O-CB 3.47Å; K1523-R1526 PolarHBondContact O-N 3.45Å; R1526-I1528 VanDerWaalsContact C-N 3.32Å; R1526-I1528 PolarHBondContact O-N 3.07Å; R1526-C1529 CarbonylContact O-C 3.5Å; R1526-C1529 WeakPolarHBondContact O-CB 3.47Å; R1526-C1529 PolarHBondContact O-N 3.12Å; R1526-C1529 VanDerWaalsContact O-N 3.13Å; R1526-H1530 WeakPolarHBondContact CG-NE2 3.4Å; R1526-H1530 PolarHBondContact O-CD2 3.44Å; R1526-H1530 PolarHBondContact O-N 3Å; R1526-L1688 HydrophobicContact CG-CD2 4.44Å; R1526-L1691 HydrophobicContact CB-CD2 3.68Å; R1526-L1691 HydrophobicContact CG-CD2 4.35Å; R1526-D1692 IonicContact NE-OD1 3.43Å; R1526-E1695 VanDerWaalsContact CZ-CD 3.49Å; R1526-E1695 IonicContact CZ-OE1 3.36Å; R1526-E1695 IonicContact CZ-OE2 3.33Å; R1526-E1695 IonicContact NH1-OE1 3.85Å; R1526-E1695 PolarHBondContact NH1-OE1 3.14Å; R1526-E1695 IonicContact NH1-OE2 3.1Å; R1526-E1695 PolarHBondContact NH1-OE2 3.38Å; R1526-E1695 IonicContact NH2-OE1 3.97Å; R1526-E1695 PolarHBondContact NH2-OE1 3.2Å; R1526-E1695 IonicContact NH2-OE2 1.78Å; R1526-E1695 PolarHBondContact NH2-OE2 3.08Å
1527	D	96.2	Very high	94.2	Very high	22 Å²	22	35 Å²	35	12%	0.118	17%	0.172	C	C	.	.	H	α-helix	trans	-57.9	-45.3	177.4	-78.6	-29.4	0	0	0	111.4	N1450 K1523 L1524 C1529 H1530 G1531 R1561 A1562	N1450-D1527 VanDerWaalsContact CB-O 3.29Å; N1450-D1527 WeakPolarHBondContact CB-O 3.36Å; N1450-D1527 VanDerWaalsContact CG-O 3.31Å; N1450-D1527 VanDerWaalsContact ND2-CB 3.3Å; N1450-D1527 WeakPolarHBondContact ND2-CB 3.5Å; N1450-D1527 PolarHBondContact ND2-O 2.72Å; N1450-D1527 PolarHBondContact ND2-OD1 2.85Å; K1523-D1527 PolarHBondContact O-N 3.28Å; L1524-D1527 PolarHBondContact O-N 3.38Å; D1527-C1529 PolarHBondContact O-N 2.99Å; D1527-H1530 PolarHBondContact O-N 3.04Å; D1527-G1531 PolarHBondContact O-N 3.03Å; D1527-R1561 HydrophobicContact CB-CG 4.46Å; D1527-R1561 WeakPolarHBondContact OD2-CA 3.47Å; D1527-A1562 HydrophobicContact CB-CB 3.6Å; D1527-A1562 PolarHBondContact OD2-N 3.42Å
1528	I	97	Very high	94	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-59.4	-45.7	173.1	-71.4	167.3	0	0	0	111.2	I1502 L1524 F1525 R1526 H1530 G1531 L1532 V1553 A1562 L1564 L1621 L1624 L1628	I1502-I1528 HydrophobicContact CD1-CD1 4.03Å; L1524-I1528 WeakPolarHBondContact O-CD1 3.5Å; L1524-I1528 VanDerWaalsContact O-CG1 3.25Å; L1524-I1528 WeakPolarHBondContact O-CG1 3.41Å; L1524-I1528 PolarHBondContact O-N 2.81Å; F1525-I1528 PolarHBondContact O-N 2.98Å; R1526-I1528 VanDerWaalsContact C-N 3.32Å; R1526-I1528 PolarHBondContact O-N 3.07Å; I1528-H1530 VanDerWaalsContact C-N 3.33Å; I1528-H1530 PolarHBondContact O-N 3.29Å; I1528-G1531 PolarHBondContact O-N 2.91Å; I1528-L1532 WeakPolarHBondContact O-CB 3.48Å; I1528-L1532 PolarHBondContact O-N 3.05Å; I1528-V1553 HydrophobicContact CD1-CG1 3.97Å; I1528-V1553 HydrophobicContact CD1-CG2 4.11Å; I1528-V1553 HydrophobicContact CG1-CG1 3.79Å; I1528-V1553 HydrophobicContact CG1-CG2 4.24Å; I1528-A1562 HydrophobicContact CD1-CB 4.47Å; I1528-A1562 HydrophobicContact CG1-CB 3.86Å; I1528-L1564 HydrophobicContact CG1-CD2 4.3Å; I1528-L1564 HydrophobicContact CG2-CD2 4.21Å; I1528-L1621 HydrophobicContact CG2-CD1 3.57Å; I1528-L1624 HydrophobicContact CD1-CD1 4.41Å; I1528-L1624 HydrophobicContact CD1-CD2 3.54Å; I1528-L1628 HydrophobicContact CD1-CD1 4.35Å
1529	C	96.8	Very high	93.6	Very high	0 Å²	0	35 Å²	35	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-64.4	-34.5	176.4	-68.6	0	0	0	0	112.5	F1525 R1526 D1527 S1533 L1684 L1688	F1525-C1529 WeakPolarHBondContact O-CB 3.49Å; F1525-C1529 PolarHBondContact O-N 3.31Å; F1525-C1529 PolarHBondContact O-SG 2.91Å; R1526-C1529 CarbonylContact O-C 3.5Å; R1526-C1529 WeakPolarHBondContact O-CB 3.47Å; R1526-C1529 PolarHBondContact O-N 3.12Å; R1526-C1529 VanDerWaalsContact O-N 3.13Å; D1527-C1529 PolarHBondContact O-N 2.99Å; C1529-S1533 WeakPolarHBondContact O-CB 3.35Å; C1529-S1533 PolarHBondContact O-N 3.39Å; C1529-L1684 HydrophobicContact CB-CD1 4.05Å; C1529-L1688 HydrophobicContact CB-CD2 3.56Å; C1529-L1688 HydrophobicContact CB-CG 4.08Å
1530	H	95.1	Very high	93.4	Very high	78 Å²	78	33.7 Å²	33.7	36%	0.361	18%	0.175	S	C	.	.	H	α-helix	trans	-71.1	-37	174.4	-75.1	-45.4	0	0	0	112.4	N1448 R1526 D1527 I1528 S1533 G1534	N1448-H1530 PolarHBondContact ND2-O 3.22Å; R1526-H1530 WeakPolarHBondContact CG-NE2 3.4Å; R1526-H1530 PolarHBondContact O-CD2 3.44Å; R1526-H1530 PolarHBondContact O-N 3Å; D1527-H1530 PolarHBondContact O-N 3.04Å; I1528-H1530 VanDerWaalsContact C-N 3.33Å; I1528-H1530 PolarHBondContact O-N 3.29Å; H1530-S1533 PolarHBondContact O-N 3.24Å; H1530-G1534 PolarHBondContact O-N 3.41Å; H1530-G1534 VanDerWaalsContact O-N 3.09Å
1531	G	93.7	Very high	93.1	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-60.9	-51.8	170.4	0	0	0	0	0	111.2	L1451 D1527 I1528 S1533 G1534 L1535	L1451-G1531 WeakPolarHBondContact CD2-O 3.4Å; D1527-G1531 PolarHBondContact O-N 3.03Å; I1528-G1531 PolarHBondContact O-N 2.91Å; G1531-S1533 VanDerWaalsContact C-N 3.29Å; G1531-S1533 PolarHBondContact O-N 2.76Å; G1531-G1534 VanDerWaalsContact O-CA 3.32Å; G1531-G1534 WeakPolarHBondContact O-CA 3.46Å; G1531-G1534 PolarHBondContact O-N 2.99Å; G1531-L1535 PolarHBondContact O-N 2.87Å
1532	L	95.5	Very high	93	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-61.9	-37.2	179.3	-169.2	65.9	0	0	0	112.1	I1528 G1534 L1535 H1536 H1545 L1548 L1564 D1617 L1621 L1684	I1528-L1532 WeakPolarHBondContact O-CB 3.48Å; I1528-L1532 PolarHBondContact O-N 3.05Å; L1532-G1534 PolarHBondContact O-N 3.23Å; L1532-L1535 PolarHBondContact O-N 3.45Å; L1532-L1535 VanDerWaalsContact O-N 3.13Å; L1532-H1536 WeakPolarHBondContact CD1-NE2 3.34Å; L1532-H1536 WeakPolarHBondContact O-CB 3.22Å; L1532-H1536 PolarHBondContact O-CD2 3.3Å; L1532-H1536 PolarHBondContact O-N 3.31Å; L1532-H1545 HydrophobicContact CD1-CB 4.22Å; L1532-L1548 HydrophobicContact CD1-CD2 4.4Å; L1532-L1548 HydrophobicContact CD2-CD2 4.03Å; L1532-L1564 HydrophobicContact CB-CD1 4.22Å; L1532-D1617 HydrophobicContact CD1-CB 4.01Å; L1532-D1617 WeakPolarHBondContact CD1-OD2 3.49Å; L1532-D1617 HydrophobicContact CD2-CB 4.1Å; L1532-L1621 HydrophobicContact CD2-CD1 4.47Å; L1532-L1621 HydrophobicContact CD2-CD2 4.1Å; L1532-L1684 HydrophobicContact CB-CD2 3.92Å; L1532-L1684 HydrophobicContact CD2-CD1 4.17Å; L1532-L1684 HydrophobicContact CD2-CD2 4.07Å; L1532-L1684 HydrophobicContact CG-CD2 3.94Å
1533	S	94.4	Very high	93	Very high	30 Å²	30	36.2 Å²	36.2	21%	0.21	19%	0.19	C	C	.	.	H	α-helix	trans	-63.5	-28.4	172.3	-171.1	0	0	0	0	112.3	C1529 H1530 G1531 N1537 L1684	C1529-S1533 WeakPolarHBondContact O-CB 3.35Å; C1529-S1533 PolarHBondContact O-N 3.39Å; H1530-S1533 PolarHBondContact O-N 3.24Å; G1531-S1533 VanDerWaalsContact C-N 3.29Å; G1531-S1533 PolarHBondContact O-N 2.76Å; S1533-N1537 WeakPolarHBondContact O-CB 3.3Å; S1533-N1537 PolarHBondContact O-N 3.5Å; S1533-N1537 PolarHBondContact O-ND2 3.24Å; S1533-N1537 PolarHBondContact OG-ND2 3.07Å; S1533-N1537 VanDerWaalsContact OG-ND2 3.11Å; S1533-L1684 VanDerWaalsContact N-CD2 3.32Å
1534	G	91.7	Very high	93	Very high	15 Å²	15	33 Å²	33	16%	0.155	18%	0.176	C	C	.	.	H	α-helix	trans	-59.1	-52.7	168.2	0	0	0	0	0	111.9	N1448 H1530 G1531 L1532 N1537 L1538	N1448-G1534 WeakPolarHBondContact ND2-CA 3.47Å; H1530-G1534 PolarHBondContact O-N 3.41Å; H1530-G1534 VanDerWaalsContact O-N 3.09Å; G1531-G1534 VanDerWaalsContact O-CA 3.32Å; G1531-G1534 WeakPolarHBondContact O-CA 3.46Å; G1531-G1534 PolarHBondContact O-N 2.99Å; L1532-G1534 PolarHBondContact O-N 3.23Å; G1534-N1537 PolarHBondContact O-N 3.3Å; G1534-L1538 WeakPolarHBondContact O-CD2 3.48Å; G1534-L1538 WeakPolarHBondContact O-CG 3.48Å; G1534-L1538 PolarHBondContact O-N 3.41Å
1535	L	93.4	Very high	93	Very high	0 Å²	0	33 Å²	33	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-64	-45.7	179	-60.8	177.3	0	0	0	112.3	V1441 L1451 G1531 L1532 N1537 L1538 F1543 H1545 F1567	V1441-L1535 HydrophobicContact CG1-CD2 3.64Å; L1451-L1535 HydrophobicContact CD1-CD2 3.94Å; L1451-L1535 HydrophobicContact CD1-CG 4.24Å; L1451-L1535 HydrophobicContact CD2-CD1 4.4Å; L1451-L1535 HydrophobicContact CD2-CD2 4.33Å; L1451-L1535 HydrophobicContact CD2-CG 4.07Å; G1531-L1535 PolarHBondContact O-N 2.87Å; L1532-L1535 PolarHBondContact O-N 3.45Å; L1532-L1535 VanDerWaalsContact O-N 3.13Å; L1535-N1537 PolarHBondContact O-N 2.93Å; L1535-L1538 HydrophobicContact CD2-CD1 4.16Å; L1535-L1538 PolarHBondContact O-N 3.15Å; L1535-F1543 CarbonylContact C-O 3.38Å; L1535-F1543 PolarHBondContact O-N 2.76Å; L1535-H1545 HydrophobicContact CD1-CB 3.83Å; L1535-F1567 HydrophobicContact CD1-CD1 4.29Å; L1535-F1567 HydrophobicContact CD1-CE1 4.08Å; L1535-F1567 HydrophobicContact CD2-CD1 4.49Å; L1535-F1567 HydrophobicContact CD2-CE1 4.36Å
1536	H	94.5	Very high	92.7	Very high	17 Å²	17	33.3 Å²	33.3	8%	0.079	18%	0.179	C	C	.	.	H	α-helix	trans	-69.2	-11.4	-178.5	-70	-165.6	0	0	0	113.5	L1532 P1542 F1543 E1614 D1617	L1532-H1536 WeakPolarHBondContact CD1-NE2 3.34Å; L1532-H1536 WeakPolarHBondContact O-CB 3.22Å; L1532-H1536 PolarHBondContact O-CD2 3.3Å; L1532-H1536 PolarHBondContact O-N 3.31Å; H1536-P1542 VanDerWaalsContact O-CB 3.25Å; H1536-P1542 WeakPolarHBondContact O-CB 3.05Å; H1536-F1543 PolarHBondContact CD2-O 2.7Å; H1536-F1543 VanDerWaalsContact CD2-O 3.23Å; H1536-E1614 HydrophobicContact CB-CG 4.39Å; H1536-E1614 PolarHBondContact CE1-O 2.95Å; H1536-E1614 VanDerWaalsContact CE1-O 3.27Å; H1536-D1617 IonicContact CD2-OD2 2.73Å; H1536-D1617 IonicContact CE1-OD2 3.21Å; H1536-D1617 IonicContact NE2-OD2 3.04Å; H1536-D1617 PolarHBondContact NE2-OD2 3.21Å
1537	N	92	Very high	92.6	Very high	107 Å²	107	32 Å²	32	57%	0.572	18%	0.175	S	C	*	.	T	Hydrogen-bonded Turn	trans	-117	9.7	176.1	-67.6	-68.4	0	0	0	113.7	S1533 G1534 L1535	S1533-N1537 WeakPolarHBondContact O-CB 3.3Å; S1533-N1537 PolarHBondContact O-N 3.5Å; S1533-N1537 PolarHBondContact O-ND2 3.24Å; S1533-N1537 PolarHBondContact OG-ND2 3.07Å; S1533-N1537 VanDerWaalsContact OG-ND2 3.11Å; G1534-N1537 PolarHBondContact O-N 3.3Å; L1535-N1537 PolarHBondContact O-N 2.93Å
1538	L	87.9	Confident	92.5	Very high	16 Å²	16	31 Å²	31	8%	0.084	17%	0.17	C	C	.	.			trans	-56.5	154.3	173.8	-68.3	-175.9	0	0	0	111.6	M1444 G1534 L1535 E1541 F1543	M1444-L1538 HydrophobicContact CB-CD1 3.84Å; M1444-L1538 HydrophobicContact CB-CD2 3.94Å; M1444-L1538 HydrophobicContact CB-CG 4.45Å; M1444-L1538 HydrophobicContact CE-CD1 4.04Å; M1444-L1538 WeakPolarHBondContact O-CD2 3.44Å; M1444-L1538 HydrophobicContact SD-CD1 4.34Å; G1534-L1538 WeakPolarHBondContact O-CD2 3.48Å; G1534-L1538 WeakPolarHBondContact O-CG 3.48Å; G1534-L1538 PolarHBondContact O-N 3.41Å; L1535-L1538 HydrophobicContact CD2-CD1 4.16Å; L1535-L1538 PolarHBondContact O-N 3.15Å; L1538-E1541 CarbonylContact C-O 3.46Å; L1538-E1541 CarbonylContact O-C 3.12Å; L1538-E1541 VanDerWaalsContact O-C 3.29Å; L1538-E1541 VanDerWaalsContact O-O 3.12Å; L1538-F1543 HydrophobicContact CD1-CB 4.34Å; L1538-F1543 HydrophobicContact CD1-CD2 4.32Å; L1538-F1543 HydrophobicContact CD1-CG 4.44Å
1539	Q	84.5	Confident	92.4	Very high	145 Å²	145	33.1 Å²	33.1	68%	0.678	18%	0.179	S	C	*	.	S	Bend	trans	-124.5	140.9	179.9	-64.9	-61.8	-69.2	0	0	108.7
1540	P	85.2	Confident	92.2	Very high	118 Å²	118	33.3 Å²	33.3	77%	0.766	18%	0.18	S	C	*	.	S	Bend	cis	-80.1	-13.9	12.3	32.7	-37.3	0	0	0	115.3
1541	E	88.5	Confident	92	Very high	86 Å²	86	30.6 Å²	30.6	40%	0.402	17%	0.173	S	C	.	.	S	Bend	trans	-135.8	149.2	-178.4	67.2	-174.6	155.2	0	0	112.4	L1538 F1543 P1572	L1538-E1541 CarbonylContact C-O 3.46Å; L1538-E1541 CarbonylContact O-C 3.12Å; L1538-E1541 VanDerWaalsContact O-C 3.29Å; L1538-E1541 VanDerWaalsContact O-O 3.12Å; E1541-F1543 HydrophobicContact CG-CD2 4.45Å; E1541-F1543 HydrophobicContact CG-CE2 3.89Å; E1541-F1543 WeakPolarHBondContact O-CD2 3.35Å; E1541-P1572 HydrophobicContact CG-CB 4.45Å; E1541-P1572 WeakPolarHBondContact OE1-CG 3.18Å
1542	P	92.2	Very high	92	Very high	13 Å²	13	31 Å²	31	8%	0.084	18%	0.175	C	C	.	.			trans	-72.8	140.9	179.2	30.4	-35.3	0	0	0	111	H1536 A1573 R1574 E1614	H1536-P1542 VanDerWaalsContact O-CB 3.25Å; H1536-P1542 WeakPolarHBondContact O-CB 3.05Å; P1542-A1573 HydrophobicContact CB-CB 4.31Å; P1542-A1573 HydrophobicContact CG-CB 4.23Å; P1542-A1573 VanDerWaalsContact O-CB 3.29Å; P1542-A1573 WeakPolarHBondContact O-CB 3.44Å; P1542-A1573 PolarHBondContact O-N 3.22Å; P1542-R1574 HydrophobicContact CG-CG 4.28Å; P1542-E1614 HydrophobicContact CB-CG 4.25Å; P1542-E1614 VanDerWaalsContact CG-OE1 3.31Å; P1542-E1614 WeakPolarHBondContact CG-OE1 3.46Å
1543	F	93.4	Very high	91.9	Very high	9 Å²	9	31 Å²	31	4%	0.039	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	144	176.7	-84.3	-114.6	0	0	0	111.1	V1441 M1444 L1535 H1536 L1538 E1541 R1571 P1572	V1441-F1543 HydrophobicContact CG2-CD1 3.69Å; V1441-F1543 HydrophobicContact CG2-CE1 3.79Å; V1441-F1543 HydrophobicContact CG2-CG 4.47Å; M1444-F1543 HydrophobicContact CE-CD2 4.33Å; M1444-F1543 HydrophobicContact CE-CE1 4.45Å; M1444-F1543 HydrophobicContact CE-CE2 3.89Å; M1444-F1543 HydrophobicContact CE-CZ 3.96Å; L1535-F1543 CarbonylContact C-O 3.38Å; L1535-F1543 PolarHBondContact O-N 2.76Å; H1536-F1543 PolarHBondContact CD2-O 2.7Å; H1536-F1543 VanDerWaalsContact CD2-O 3.23Å; L1538-F1543 HydrophobicContact CD1-CB 4.34Å; L1538-F1543 HydrophobicContact CD1-CD2 4.32Å; L1538-F1543 HydrophobicContact CD1-CG 4.44Å; E1541-F1543 HydrophobicContact CG-CD2 4.45Å; E1541-F1543 HydrophobicContact CG-CE2 3.89Å; E1541-F1543 WeakPolarHBondContact O-CD2 3.35Å; F1543-R1571 CarbonylContact C-O 3.58Å; F1543-R1571 VanDerWaalsContact CA-O 3.31Å; F1543-R1571 WeakPolarHBondContact CA-O 3.14Å; F1543-R1571 WeakPolarHBondContact CD1-O 3.49Å; F1543-P1572 HydrophobicContact CE1-CG 4.35Å; F1543-P1572 HydrophobicContact CE2-CG 4.48Å; F1543-P1572 HydrophobicContact CZ-CG 4.07Å
1544	V	94.2	Very high	91.9	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	148.9	160.8	-74.7	0	0	0	0	109.9	S1570 R1571 A1573 D1617	V1544-S1570 VanDerWaalsContact O-CA 3.22Å; V1544-S1570 WeakPolarHBondContact O-CA 3.46Å; V1544-S1570 WeakPolarHBondContact O-CB 3.33Å; V1544-R1571 HydrophobicContact CG2-CG 3.55Å; V1544-R1571 WeakPolarHBondContact CG2-O 3.41Å; V1544-R1571 PolarHBondContact N-O 3.23Å; V1544-R1571 PolarHBondContact O-N 3.34Å; V1544-A1573 HydrophobicContact CG1-CB 3.76Å; V1544-D1617 WeakPolarHBondContact CA-OD2 3.46Å; V1544-D1617 WeakPolarHBondContact CB-OD2 3.49Å; V1544-D1617 WeakPolarHBondContact CG1-OD2 3.25Å
1545	H	94.8	Very high	91.9	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	16%	0.163	C	C	.	.			trans	-67.5	-39.4	171.4	-172.8	-30.9	0	0	0	111.1	L1532 L1535 D1547 L1548 M1565 D1566 S1569 S1570 D1617	L1532-H1545 HydrophobicContact CD1-CB 4.22Å; L1535-H1545 HydrophobicContact CD1-CB 3.83Å; H1545-D1547 PolarHBondContact O-N 3.42Å; H1545-D1547 VanDerWaalsContact O-N 3.14Å; H1545-L1548 HydrophobicContact CB-CB 4.48Å; H1545-M1565 PolarHBondContact CE1-O 3.27Å; H1545-M1565 VanDerWaalsContact CE1-O 3.32Å; H1545-M1565 PolarHBondContact NE2-O 3.07Å; H1545-D1566 PolarHBondContact CE1-O 3.02Å; H1545-S1569 CarbonylContact O-C 3.47Å; H1545-S1569 VanDerWaalsContact O-C 3.29Å; H1545-S1570 WeakPolarHBondContact O-CA 3.45Å; H1545-S1570 PolarHBondContact O-N 3.21Å; H1545-S1570 PolarHBondContact O-OG 3.01Å; H1545-D1617 PolarHBondContact N-OD1 3.26Å; H1545-D1617 PolarHBondContact N-OD2 2.92Å
1546	G	90.7	Very high	91.6	Very high	8 Å²	8	30.3 Å²	30.3	8%	0.082	17%	0.166	C	C	.	.	S	Bend	trans	80.3	-22.2	175.7	0	0	0	0	0	115.6	C1594 D1617	G1546-C1594 PolarHBondContact O-SG 3.29Å; G1546-D1617 PolarHBondContact N-OD1 2.93Å
1547	D	93.2	Very high	90.8	Very high	9 Å²	9	33.1 Å²	33.1	5%	0.048	18%	0.182	C	C	.	.			trans	-140.6	46.2	177.8	-168.4	39	0	0	0	112.3	H1545 K1549 N1552 R1593 T1595	H1545-D1547 PolarHBondContact O-N 3.42Å; H1545-D1547 VanDerWaalsContact O-N 3.14Å; D1547-K1549 PolarHBondContact O-N 3.49Å; D1547-K1549 VanDerWaalsContact O-N 3.11Å; D1547-K1549 IonicContact OD1-NZ 3.44Å; D1547-K1549 WeakPolarHBondContact OD2-CE 3.38Å; D1547-K1549 IonicContact OD2-NZ 3.99Å; D1547-K1549 PolarHBondContact OD2-NZ 3.35Å; D1547-N1552 PolarHBondContact O-ND2 3.22Å; D1547-N1552 PolarHBondContact OD2-ND2 3.49Å; D1547-N1552 VanDerWaalsContact OD2-ND2 3.1Å; D1547-R1593 WeakPolarHBondContact CB-O 3.33Å; D1547-T1595 VanDerWaalsContact OD1-CB 3.23Å; D1547-T1595 WeakPolarHBondContact OD1-CB 3.26Å; D1547-T1595 PolarHBondContact OD1-N 3.34Å; D1547-T1595 PolarHBondContact OD1-OG1 3.11Å; D1547-T1595 PolarHBondContact OD2-OG1 2.75Å
1548	L	94.4	Very high	90.1	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	19%	0.193	C	C	.	.			trans	-69.9	107.8	-179.1	-172.8	72	0	0	0	111	L1532 H1545 L1564 S1620 L1621 L1624	L1532-L1548 HydrophobicContact CD1-CD2 4.4Å; L1532-L1548 HydrophobicContact CD2-CD2 4.03Å; H1545-L1548 HydrophobicContact CB-CB 4.48Å; L1548-L1564 HydrophobicContact CD1-CD1 4.23Å; L1548-L1564 HydrophobicContact CD1-CD2 3.76Å; L1548-S1620 WeakPolarHBondContact O-CB 3.4Å; L1548-L1621 HydrophobicContact CD2-CB 3.78Å; L1548-L1621 HydrophobicContact CD2-CD1 3.83Å; L1548-L1621 HydrophobicContact CD2-CG 4.41Å; L1548-L1624 HydrophobicContact CD1-CD1 4.26Å; L1548-L1624 HydrophobicContact CG-CD1 3.97Å
1549	K	94.1	Very high	90	Very high	45 Å²	45	39 Å²	39	20%	0.196	21%	0.207	C	C	.	.			trans	-146.4	162.6	-179.4	72.4	-156.8	-174	-159.4	0	110.9	D1547 G1551 N1552 T1595 Y1598	D1547-K1549 PolarHBondContact O-N 3.49Å; D1547-K1549 VanDerWaalsContact O-N 3.11Å; D1547-K1549 IonicContact OD1-NZ 3.44Å; D1547-K1549 WeakPolarHBondContact OD2-CE 3.38Å; D1547-K1549 IonicContact OD2-NZ 3.99Å; D1547-K1549 PolarHBondContact OD2-NZ 3.35Å; K1549-G1551 PolarHBondContact O-N 2.94Å; K1549-G1551 VanDerWaalsContact O-N 3.1Å; K1549-N1552 VanDerWaalsContact CE-OD1 3.22Å; K1549-N1552 WeakPolarHBondContact CE-OD1 3.27Å; K1549-N1552 HydrophobicContact CG-CB 4.15Å; K1549-N1552 PolarHBondContact O-N 3.38Å; K1549-T1595 HydrophobicContact CD-CG2 4.22Å; K1549-T1595 WeakPolarHBondContact CD-OG1 3.11Å; K1549-T1595 PolarHBondContact NZ-OG1 3.2Å; K1549-Y1598 HydrophobicContact CB-CD1 4.05Å; K1549-Y1598 HydrophobicContact CB-CD2 3.83Å; K1549-Y1598 HydrophobicContact CB-CE1 4.16Å; K1549-Y1598 HydrophobicContact CB-CE2 3.91Å; K1549-Y1598 HydrophobicContact CB-CG 3.91Å
1550	T	93.1	Very high	90.1	Very high	4 Å²	4	33.5 Å²	33.5	3%	0.025	18%	0.183	C	C	.	.	G	3₁₀ helix	trans	-54.5	-27.1	176.8	46.4	0	0	0	0	114.8	I1502 Q1503 L1506 Y1598 L1624 A1627	I1502-T1550 HydrophobicContact CG2-CG2 4.15Å; I1502-T1550 PolarHBondContact N-O 2.98Å; Q1503-T1550 PolarHBondContact N-O 3.34Å; Q1503-T1550 PolarHBondContact OE1-OG1 2.96Å; L1506-T1550 HydrophobicContact CD1-CG2 3.58Å; T1550-Y1598 PolarHBondContact OG1-OH 3.5Å; T1550-L1624 HydrophobicContact CG2-CG 4.08Å; T1550-A1627 HydrophobicContact CG2-CB 3.7Å
1551	G	90.1	Very high	90.5	Very high	21 Å²	21	30.2 Å²	30.2	22%	0.216	16%	0.155	C	C	.	.	G	3₁₀ helix	trans	-76.2	-18	174.3	0	0	0	0	0	114.7	T1501 K1549	T1501-G1551 VanDerWaalsContact CG2-O 3.27Å; T1501-G1551 WeakPolarHBondContact CG2-O 3.48Å; K1549-G1551 PolarHBondContact O-N 2.94Å; K1549-G1551 VanDerWaalsContact O-N 3.1Å
1552	N	94	Very high	90.9	Very high	9 Å²	9	26.1 Å²	26.1	5%	0.048	14%	0.136	C	C	.	.	G	3₁₀ helix	trans	-103	23.8	-179.8	-68.6	-0	0	0	0	111.7	D1547 K1549 M1565	D1547-N1552 PolarHBondContact O-ND2 3.22Å; D1547-N1552 PolarHBondContact OD2-ND2 3.49Å; D1547-N1552 VanDerWaalsContact OD2-ND2 3.1Å; K1549-N1552 VanDerWaalsContact CE-OD1 3.22Å; K1549-N1552 WeakPolarHBondContact CE-OD1 3.27Å; K1549-N1552 HydrophobicContact CG-CB 4.15Å; K1549-N1552 PolarHBondContact O-N 3.38Å; N1552-M1565 HydrophobicContact CB-CG 4.45Å; N1552-M1565 WeakPolarHBondContact O-CG 3.42Å; N1552-M1565 PolarHBondContact O-N 3Å
1553	V	94.8	Very high	90.9	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	113.9	176	-168.8	0	0	0	0	110	T1501 I1502 I1528 A1562 V1563 L1564 L1624	T1501-V1553 CarbonylContact C-O 3.6Å; T1501-V1553 WeakPolarHBondContact CA-O 3.48Å; I1502-V1553 HydrophobicContact CB-CB 4.46Å; I1502-V1553 HydrophobicContact CD1-CB 3.87Å; I1502-V1553 HydrophobicContact CD1-CG1 3.52Å; I1502-V1553 HydrophobicContact CG1-CB 4.14Å; I1502-V1553 HydrophobicContact CG1-CG1 4.11Å; I1502-V1553 PolarHBondContact N-O 2.63Å; I1528-V1553 HydrophobicContact CD1-CG1 3.97Å; I1528-V1553 HydrophobicContact CD1-CG2 4.11Å; I1528-V1553 HydrophobicContact CG1-CG1 3.79Å; I1528-V1553 HydrophobicContact CG1-CG2 4.24Å; V1553-A1562 HydrophobicContact CG1-CB 3.75Å; V1553-V1563 CarbonylContact C-O 3.45Å; V1553-V1563 WeakPolarHBondContact CA-O 3.45Å; V1553-L1564 HydrophobicContact CG1-CD2 4.37Å; V1553-L1564 HydrophobicContact CG2-CD2 3.75Å; V1553-L1624 HydrophobicContact CG2-CD1 3.97Å
1554	L	93	Very high	91	Very high	19 Å²	19	25.1 Å²	25.1	10%	0.099	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	152.9	174.9	-66.5	167.9	0	0	0	111.6	L1452 Y1497 G1500 T1501 A1562 V1563 M1565	L1452-L1554 HydrophobicContact CD1-CD1 3.95Å; L1452-L1554 HydrophobicContact CD2-CD1 4.09Å; Y1497-L1554 HydrophobicContact CD1-CB 4.24Å; Y1497-L1554 HydrophobicContact CD2-CD1 3.83Å; Y1497-L1554 HydrophobicContact CE2-CD1 4.38Å; Y1497-L1554 HydrophobicContact CG-CB 4.12Å; Y1497-L1554 HydrophobicContact CG-CD1 4.13Å; G1500-L1554 CarbonylContact O-C 3.6Å; G1500-L1554 WeakPolarHBondContact O-CA 3.47Å; T1501-L1554 HydrophobicContact CG2-CD2 3.89Å; L1554-A1562 WeakPolarHBondContact O-CA 3.35Å; L1554-V1563 HydrophobicContact CB-CB 4.42Å; L1554-V1563 PolarHBondContact N-O 3.43Å; L1554-V1563 PolarHBondContact O-N 3.4Å; L1554-M1565 HydrophobicContact CD1-CB 4.11Å; L1554-M1565 HydrophobicContact CD1-CG 4.3Å; L1554-M1565 HydrophobicContact CD1-SD 3.75Å; L1554-M1565 HydrophobicContact CD2-SD 3.71Å; L1554-M1565 HydrophobicContact CG-CB 4.43Å; L1554-M1565 HydrophobicContact CG-CG 4.14Å; L1554-M1565 HydrophobicContact CG-SD 3.5Å; L1554-M1565 VanDerWaalsContact CG-SD 3.5Å
1555	L	91.4	Very high	90.8	Very high	2 Å²	2	26.5 Å²	26.5	1%	0.01	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	124.8	173.9	-68.1	175	0	0	0	111	R1499 G1500 I1502 E1505 L1524	R1499-L1555 HydrophobicContact CB-CB 4.04Å; G1500-L1555 PolarHBondContact O-N 2.7Å; I1502-L1555 HydrophobicContact CD1-CD2 4.14Å; I1502-L1555 HydrophobicContact CG1-CD1 4.2Å; I1502-L1555 HydrophobicContact CG1-CD2 3.78Å; I1502-L1555 HydrophobicContact CG1-CG 3.88Å; E1505-L1555 WeakPolarHBondContact OE2-CD1 3.27Å; L1524-L1555 HydrophobicContact CD2-CD2 3.59Å
1556	S	87.4	Confident	90.5	Very high	8 Å²	8	28.8 Å²	28.8	6%	0.056	15%	0.149	C	C	.	.			trans	-66.9	137.4	174.5	178.8	0	0	0	0	112.6	R1499 E1558 D1559 D1560 R1561	R1499-S1556 PolarHBondContact NH1-O 3.07Å; S1556-E1558 PolarHBondContact OG-N 2.96Å; S1556-D1559 WeakPolarHBondContact CB-OD1 3.35Å; S1556-D1559 PolarHBondContact OG-OD1 2.69Å; S1556-D1560 WeakPolarHBondContact O-CA 3.44Å; S1556-D1560 PolarHBondContact O-N 3.44Å; S1556-R1561 WeakPolarHBondContact CB-O 3.39Å; S1556-R1561 PolarHBondContact N-O 2.99Å
1557	D	79	Confident	90.5	Very high	76 Å²	76	28.4 Å²	28.4	41%	0.406	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.1	-29.2	178.6	-61.2	-39.2	0	0	0	112.5	K1498 R1499	K1498-D1557 WeakPolarHBondContact CB-OD1 3.5Å; K1498-D1557 WeakPolarHBondContact CB-OD2 3.4Å; K1498-D1557 PolarHBondContact N-OD1 2.67Å; K1498-D1557 PolarHBondContact N-OD2 3.29Å; R1499-D1557 VanDerWaalsContact CG-OD1 3.27Å; R1499-D1557 WeakPolarHBondContact CG-OD1 3.41Å; R1499-D1557 PolarHBondContact N-OD1 3.06Å
1558	E	77	Confident	90	Very high	173 Å²	173	29 Å²	29	81%	0.808	15%	0.153	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.6	-35.6	-171.2	-63.9	-179.7	178.5	0	0	112.8	S1556	S1556-E1558 PolarHBondContact OG-N 2.96Å
1559	D	85.2	Confident	89.7	Confident	73 Å²	73	29.9 Å²	29.9	39%	0.39	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	-139.5	5.7	-167.6	64.9	-12.5	0	0	0	114.8	K1523 S1556 R1561	K1523-D1559 PolarHBondContact NZ-O 2.97Å; S1556-D1559 WeakPolarHBondContact CB-OD1 3.35Å; S1556-D1559 PolarHBondContact OG-OD1 2.69Å; D1559-R1561 PolarHBondContact O-N 3.42Å; D1559-R1561 WeakPolarHBondContact OD1-CB 3.35Å; D1559-R1561 PolarHBondContact OD1-N 2.96Å; D1559-R1561 IonicContact OD1-NH1 3.4Å; D1559-R1561 PolarHBondContact OD1-NH1 3.47Å; D1559-R1561 WeakPolarHBondContact OD2-CB 3.42Å; D1559-R1561 IonicContact OD2-CZ 2.68Å; D1559-R1561 IonicContact OD2-NH1 3.29Å; D1559-R1561 PolarHBondContact OD2-NH1 3.5Å
1560	D	86.8	Confident	89.5	Confident	31 Å²	31	28 Å²	28	17%	0.166	15%	0.152	C	C	.	.			trans	54.1	30.4	-175.5	-175.1	60.9	0	0	0	112.8	R1499 R1520 K1523 L1524 S1556	R1499-D1560 IonicContact CZ-OD1 2.67Å; R1499-D1560 IonicContact NH1-OD1 3.74Å; R1499-D1560 PolarHBondContact NH1-OD1 2.94Å; R1499-D1560 IonicContact NH2-OD1 3.21Å; R1499-D1560 PolarHBondContact NH2-OD1 3.15Å; R1520-D1560 IonicContact CZ-OD1 3.71Å; R1520-D1560 IonicContact CZ-OD2 2.79Å; R1520-D1560 IonicContact NE-OD1 3.15Å; R1520-D1560 PolarHBondContact NE-OD1 3.4Å; R1520-D1560 IonicContact NE-OD2 2.79Å; R1520-D1560 PolarHBondContact NE-OD2 2.78Å; R1520-D1560 IonicContact NH2-OD1 3.69Å; R1520-D1560 PolarHBondContact NH2-OD1 3.31Å; R1520-D1560 IonicContact NH2-OD2 3.31Å; K1523-D1560 PolarHBondContact NZ-O 2.95Å; K1523-D1560 IonicContact NZ-OD2 2.66Å; L1524-D1560 WeakPolarHBondContact CD2-O 2.82Å; S1556-D1560 WeakPolarHBondContact O-CA 3.44Å; S1556-D1560 PolarHBondContact O-N 3.44Å
1561	R	93.8	Very high	89.3	Confident	49 Å²	49	29.1 Å²	29.1	19%	0.185	16%	0.156	C	C	.	.			trans	-78.1	138.2	175.3	-172.1	176.8	79.7	-111.4	5.5	111.1	V1449 N1450 D1527 S1556 D1559	V1449-R1561 VanDerWaalsContact O-CZ 3.29Å; V1449-R1561 PolarHBondContact O-NE 2.91Å; V1449-R1561 PolarHBondContact O-NH2 3.5Å; N1450-R1561 VanDerWaalsContact ND2-CG 3.32Å; N1450-R1561 WeakPolarHBondContact ND2-CG 3.46Å; D1527-R1561 HydrophobicContact CB-CG 4.46Å; D1527-R1561 WeakPolarHBondContact OD2-CA 3.47Å; S1556-R1561 WeakPolarHBondContact CB-O 3.39Å; S1556-R1561 PolarHBondContact N-O 2.99Å; D1559-R1561 PolarHBondContact O-N 3.42Å; D1559-R1561 WeakPolarHBondContact OD1-CB 3.35Å; D1559-R1561 PolarHBondContact OD1-N 2.96Å; D1559-R1561 IonicContact OD1-NH1 3.4Å; D1559-R1561 PolarHBondContact OD1-NH1 3.47Å; D1559-R1561 WeakPolarHBondContact OD2-CB 3.42Å; D1559-R1561 IonicContact OD2-CZ 2.68Å; D1559-R1561 IonicContact OD2-NH1 3.29Å; D1559-R1561 PolarHBondContact OD2-NH1 3.5Å
1562	A	95.6	Very high	89.3	Confident	0 Å²	0	29.9 Å²	29.9	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	138.4	173.4	0	0	0	0	0	111.7	N1450 I1502 L1524 D1527 I1528 V1553 L1554	N1450-A1562 PolarHBondContact ND2-O 3.34Å; I1502-A1562 HydrophobicContact CD1-CB 4.5Å; L1524-A1562 HydrophobicContact CD2-CB 4.16Å; D1527-A1562 HydrophobicContact CB-CB 3.6Å; D1527-A1562 PolarHBondContact OD2-N 3.42Å; I1528-A1562 HydrophobicContact CD1-CB 4.47Å; I1528-A1562 HydrophobicContact CG1-CB 3.86Å; V1553-A1562 HydrophobicContact CG1-CB 3.75Å; L1554-A1562 WeakPolarHBondContact O-CA 3.35Å
1563	V	93.5	Very high	89.2	Confident	0 Å²	0	29.5 Å²	29.5	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	122.3	-176.7	-177.2	0	0	0	0	109.9	N1450 L1452 Y1497 V1553 L1554	N1450-V1563 CarbonylContact O-C 3.55Å; N1450-V1563 WeakPolarHBondContact O-CA 3.45Å; L1452-V1563 HydrophobicContact CB-CG1 4.12Å; Y1497-V1563 HydrophobicContact CE1-CB 4.34Å; Y1497-V1563 HydrophobicContact CE1-CG2 3.83Å; V1553-V1563 CarbonylContact C-O 3.45Å; V1553-V1563 WeakPolarHBondContact CA-O 3.45Å; L1554-V1563 HydrophobicContact CB-CB 4.42Å; L1554-V1563 PolarHBondContact N-O 3.43Å; L1554-V1563 PolarHBondContact O-N 3.4Å
1564	L	94.6	Very high	89.1	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	142.5	178	-55	-177.5	0	0	0	111.4	N1450 L1451 L1452 I1528 L1532 L1548 V1553 F1567	N1450-L1564 PolarHBondContact O-N 2.79Å; L1451-L1564 HydrophobicContact CD2-CB 3.94Å; L1451-L1564 HydrophobicContact CD2-CD1 4.05Å; L1451-L1564 HydrophobicContact CD2-CG 4.34Å; L1452-L1564 VanDerWaalsContact CB-O 3.25Å; L1452-L1564 WeakPolarHBondContact CB-O 3.4Å; L1452-L1564 PolarHBondContact N-O 3.28Å; I1528-L1564 HydrophobicContact CG1-CD2 4.3Å; I1528-L1564 HydrophobicContact CG2-CD2 4.21Å; L1532-L1564 HydrophobicContact CB-CD1 4.22Å; L1548-L1564 HydrophobicContact CD1-CD1 4.23Å; L1548-L1564 HydrophobicContact CD1-CD2 3.76Å; V1553-L1564 HydrophobicContact CG1-CD2 4.37Å; V1553-L1564 HydrophobicContact CG2-CD2 3.75Å; L1564-F1567 HydrophobicContact CB-CE1 4.32Å
1565	M	91.2	Very high	88.9	Confident	30 Å²	30	38.8 Å²	38.8	15%	0.148	19%	0.192	C	C	.	.			trans	-138.1	171.6	-179.9	66.6	167.7	-70.6	0	0	112.2	L1452 T1501 H1545 N1552 L1554	L1452-M1565 HydrophobicContact CB-CB 4.21Å; L1452-M1565 HydrophobicContact CD2-CB 3.69Å; T1501-M1565 HydrophobicContact CG2-SD 4.42Å; H1545-M1565 PolarHBondContact CE1-O 3.27Å; H1545-M1565 VanDerWaalsContact CE1-O 3.32Å; H1545-M1565 PolarHBondContact NE2-O 3.07Å; N1552-M1565 HydrophobicContact CB-CG 4.45Å; N1552-M1565 WeakPolarHBondContact O-CG 3.42Å; N1552-M1565 PolarHBondContact O-N 3Å; L1554-M1565 HydrophobicContact CD1-CB 4.11Å; L1554-M1565 HydrophobicContact CD1-CG 4.3Å; L1554-M1565 HydrophobicContact CD1-SD 3.75Å; L1554-M1565 HydrophobicContact CD2-SD 3.71Å; L1554-M1565 HydrophobicContact CG-CB 4.43Å; L1554-M1565 HydrophobicContact CG-CG 4.14Å; L1554-M1565 HydrophobicContact CG-SD 3.5Å; L1554-M1565 VanDerWaalsContact CG-SD 3.5Å
1566	D	87.6	Confident	88.9	Confident	47 Å²	47	44 Å²	44	25%	0.251	22%	0.216	S	C	.	.			trans	63.9	73	175.3	-157.3	31.4	0	0	0	114.1	K1422 H1545 G1568	K1422-D1566 IonicContact NZ-OD1 2.81Å; K1422-D1566 PolarHBondContact NZ-OD1 3.2Å; H1545-D1566 PolarHBondContact CE1-O 3.02Å; D1566-G1568 PolarHBondContact O-N 3.02Å
1567	F	90.5	Very high	88.9	Confident	1 Å²	1	43.8 Å²	43.8	0%	0.004	21%	0.214	C	C	.	.	G	3₁₀ helix	trans	-84.3	12.9	-178.9	-52.2	-58.2	0	0	0	113.8	E1438 V1441 H1442 L1451 L1535 L1564 S1569 S1570	E1438-F1567 HydrophobicContact CG-CB 4.1Å; V1441-F1567 HydrophobicContact CB-CB 4.04Å; V1441-F1567 HydrophobicContact CB-CG 4.42Å; V1441-F1567 HydrophobicContact CG1-CB 3.73Å; V1441-F1567 HydrophobicContact CG1-CD1 4.08Å; V1441-F1567 HydrophobicContact CG1-CD2 4.11Å; V1441-F1567 HydrophobicContact CG1-CG 3.7Å; H1442-F1567 AromaticContact CD2-CD2 3.81Å; H1442-F1567 AromaticContact CE1-CD2 3.49Å; H1442-F1567 VanDerWaalsContact CE1-CD2 3.49Å; H1442-F1567 WeakPolarHBondContact CE1-CD2 3.06Å; H1442-F1567 AromaticContact CE1-CE2 3.53Å; H1442-F1567 AromaticContact CG-CD2 3.73Å; H1442-F1567 AromaticContact ND1-CD2 3.54Å; H1442-F1567 AromaticContact ND1-CE2 3.44Å; H1442-F1567 WeakPolarHBondContact ND1-CE2 3.47Å; H1442-F1567 AromaticContact NE2-CD2 3.66Å; L1451-F1567 HydrophobicContact CB-CZ 4.28Å; L1451-F1567 HydrophobicContact CD2-CE1 4.11Å; L1451-F1567 HydrophobicContact CD2-CZ 3.91Å; L1535-F1567 HydrophobicContact CD1-CD1 4.29Å; L1535-F1567 HydrophobicContact CD1-CE1 4.08Å; L1535-F1567 HydrophobicContact CD2-CD1 4.49Å; L1535-F1567 HydrophobicContact CD2-CE1 4.36Å; L1564-F1567 HydrophobicContact CB-CE1 4.32Å; F1567-S1569 PolarHBondContact O-N 2.96Å; F1567-S1569 VanDerWaalsContact O-N 3.13Å; F1567-S1570 WeakPolarHBondContact CA-OG 3.34Å; F1567-S1570 VanDerWaalsContact O-CB 3.23Å; F1567-S1570 WeakPolarHBondContact O-CB 3.29Å; F1567-S1570 PolarHBondContact O-N 2.9Å; F1567-S1570 PolarHBondContact O-OG 3.36Å
1568	G	83.8	Confident	89.1	Confident	20 Å²	20	43.8 Å²	43.8	21%	0.206	23%	0.225	C	C	.	.	G	3₁₀ helix	trans	-62.8	-18.1	179	0	0	0	0	0	115	D1566 R1593	D1566-G1568 PolarHBondContact O-N 3.02Å; G1568-R1593 PolarHBondContact O-NH1 2.89Å
1569	S	86.9	Confident	89.4	Confident	20 Å²	20	37.8 Å²	37.8	14%	0.14	20%	0.202	C	C	.	.	G	3₁₀ helix	trans	-97.9	-1.9	173.4	-51	0	0	0	0	113.6	H1545 F1567 R1593	H1545-S1569 CarbonylContact O-C 3.47Å; H1545-S1569 VanDerWaalsContact O-C 3.29Å; F1567-S1569 PolarHBondContact O-N 2.96Å; F1567-S1569 VanDerWaalsContact O-N 3.13Å; S1569-R1593 PolarHBondContact OG-O 2.92Å
1570	S	90.3	Very high	88.9	Confident	4 Å²	4	41 Å²	41	3%	0.028	22%	0.215	C	C	.	.			trans	-76	137.7	-174.8	-62.2	0	0	0	0	112.1	N1437 V1544 H1545 F1567	N1437-S1570 PolarHBondContact ND2-O 3.39Å; V1544-S1570 VanDerWaalsContact O-CA 3.22Å; V1544-S1570 WeakPolarHBondContact O-CA 3.46Å; V1544-S1570 WeakPolarHBondContact O-CB 3.33Å; H1545-S1570 WeakPolarHBondContact O-CA 3.45Å; H1545-S1570 PolarHBondContact O-N 3.21Å; H1545-S1570 PolarHBondContact O-OG 3.01Å; F1567-S1570 WeakPolarHBondContact CA-OG 3.34Å; F1567-S1570 VanDerWaalsContact O-CB 3.23Å; F1567-S1570 WeakPolarHBondContact O-CB 3.29Å; F1567-S1570 PolarHBondContact O-N 2.9Å; F1567-S1570 PolarHBondContact O-OG 3.36Å
1571	R	89	Confident	88.2	Confident	29 Å²	29	43.8 Å²	43.8	11%	0.109	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	163.1	-176.4	60.1	169.4	-179.7	74.9	-2.8	110.5	F1543 V1544 A1573	F1543-R1571 CarbonylContact C-O 3.58Å; F1543-R1571 VanDerWaalsContact CA-O 3.31Å; F1543-R1571 WeakPolarHBondContact CA-O 3.14Å; F1543-R1571 WeakPolarHBondContact CD1-O 3.49Å; V1544-R1571 HydrophobicContact CG2-CG 3.55Å; V1544-R1571 WeakPolarHBondContact CG2-O 3.41Å; V1544-R1571 PolarHBondContact N-O 3.23Å; V1544-R1571 PolarHBondContact O-N 3.34Å; R1571-A1573 PolarHBondContact O-N 3.48Å
1572	P	90.2	Very high	87.5	Confident	37 Å²	37	46 Å²	46	24%	0.24	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-48.3	130.5	166.4	-29.7	37.4	0	0	0	111.1	E1541 F1543	E1541-P1572 HydrophobicContact CG-CB 4.45Å; E1541-P1572 WeakPolarHBondContact OE1-CG 3.18Å; F1543-P1572 HydrophobicContact CE1-CG 4.35Å; F1543-P1572 HydrophobicContact CE2-CG 4.48Å; F1543-P1572 HydrophobicContact CZ-CG 4.07Å
1573	A	91.5	Very high	86.8	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	24%	0.24	C	C	.	.	S	Bend	trans	-68.3	-41.5	-175.3	0	0	0	0	0	111.2	P1542 V1544 R1571 L1612 D1613 E1614	P1542-A1573 HydrophobicContact CB-CB 4.31Å; P1542-A1573 HydrophobicContact CG-CB 4.23Å; P1542-A1573 VanDerWaalsContact O-CB 3.29Å; P1542-A1573 WeakPolarHBondContact O-CB 3.44Å; P1542-A1573 PolarHBondContact O-N 3.22Å; V1544-A1573 HydrophobicContact CG1-CB 3.76Å; R1571-A1573 PolarHBondContact O-N 3.48Å; A1573-L1612 CarbonylContact O-C 3.56Å; A1573-D1613 WeakPolarHBondContact O-CA 3.48Å; A1573-D1613 PolarHBondContact O-N 3.1Å; A1573-E1614 HydrophobicContact CB-CG 3.86Å
1574	R	93.2	Very high	85.8	Confident	161 Å²	161	47.3 Å²	47.3	61%	0.608	25%	0.246	S	C	*	.			trans	-93.1	105.7	-170.6	-62.3	-179.7	-170.8	167.6	7.1	110.8	P1542 L1612 E1614	P1542-R1574 HydrophobicContact CG-CG 4.28Å; R1574-L1612 VanDerWaalsContact CA-O 3.31Å; R1574-L1612 WeakPolarHBondContact CA-O 3.36Å; R1574-E1614 IonicContact CZ-OE1 3.5Å; R1574-E1614 IonicContact NE-OE1 3.64Å; R1574-E1614 PolarHBondContact NE-OE1 3.27Å; R1574-E1614 IonicContact NE-OE2 2.67Å; R1574-E1614 IonicContact NH2-OE1 2.7Å; R1574-E1614 PolarHBondContact NH2-OE1 3.32Å
1575	I	89.3	Confident	84.9	Confident	53 Å²	53	50.6 Å²	50.6	27%	0.272	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	126.3	-179.1	-56.5	-177.4	0	0	0	108.8	I1577 K1611 L1612	I1575-I1577 HydrophobicContact CG2-CG1 4.46Å; I1575-K1611 CarbonylContact O-C 3.58Å; I1575-K1611 WeakPolarHBondContact O-CA 3.4Å; I1575-L1612 PolarHBondContact N-O 3.01Å; I1575-L1612 PolarHBondContact O-N 3.37Å
1576	E	90.9	Very high	84.6	Confident	112 Å²	112	49.9 Å²	49.9	52%	0.523	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	119.5	168.8	179.2	160.2	-174.9	0	0	109.4	A1578 D1610 K1611	E1576-A1578 PolarHBondContact O-N 2.96Å; E1576-D1610 WeakPolarHBondContact CA-O 3.4Å; E1576-K1611 HydrophobicContact CB-CG 4.3Å; E1576-K1611 HydrophobicContact CG-CG 4.02Å; E1576-K1611 WeakPolarHBondContact OE1-CE 3.43Å; E1576-K1611 IonicContact OE1-NZ 3.63Å; E1576-K1611 PolarHBondContact OE1-NZ 2.68Å; E1576-K1611 IonicContact OE2-NZ 2.74Å; E1576-K1611 PolarHBondContact OE2-NZ 3.06Å
1577	I	87.1	Confident	84.2	Confident	3 Å²	3	48.1 Å²	48.1	2%	0.015	25%	0.25	C	S	.	.			trans	-83.2	103	-173.1	-56.7	-173.6	0	0	0	109.1	I1575 Q1582 A1583 L1586 P1606 Q1607 G1609 D1610	I1575-I1577 HydrophobicContact CG2-CG1 4.46Å; I1577-Q1582 HydrophobicContact CG2-CB 4.11Å; I1577-A1583 HydrophobicContact CG2-CB 3.7Å; I1577-L1586 HydrophobicContact CD1-CD2 3.74Å; I1577-P1606 HydrophobicContact CD1-CB 3.55Å; I1577-Q1607 WeakPolarHBondContact CB-O 3.24Å; I1577-G1609 PolarHBondContact O-N 3.44Å; I1577-D1610 HydrophobicContact CD1-CB 4.06Å; I1577-D1610 HydrophobicContact CG1-CB 4.41Å; I1577-D1610 PolarHBondContact N-O 2.76Å
1578	A	83.8	Confident	83.3	Confident	76 Å²	76	50.5 Å²	50.5	63%	0.628	26%	0.263	S	S	*	.			trans	-90	-11.9	-172.2	0	0	0	0	0	114.4	E1576	E1576-A1578 PolarHBondContact O-N 2.96Å
1579	S	82.5	Confident	82.8	Confident	47 Å²	47	52.5 Å²	52.5	33%	0.329	27%	0.269	S	S	.	.	S	Bend	trans	-152	157.7	-179.7	66.4	0	0	0	0	112.6	H1581 Q1582 A1583 V1608	S1579-H1581 PolarHBondContact O-N 2.93Å; S1579-Q1582 WeakPolarHBondContact O-CB 3.37Å; S1579-Q1582 PolarHBondContact O-N 3.47Å; S1579-Q1582 VanDerWaalsContact O-N 3.07Å; S1579-Q1582 PolarHBondContact OG-N 3.17Å; S1579-A1583 PolarHBondContact O-N 2.89Å; S1579-V1608 VanDerWaalsContact C-CG2 3.47Å
1580	E	74.7	Confident	82.5	Confident	140 Å²	140	51.8 Å²	51.8	65%	0.654	26%	0.264	S	S	*	.	H	α-helix	trans	-59.9	-34.9	175.9	-66.9	-175.8	151.6	0	0	111.3	Q1582 A1583 H1584 V1608	E1580-Q1582 PolarHBondContact O-N 2.67Å; E1580-A1583 WeakPolarHBondContact O-CB 3.33Å; E1580-A1583 PolarHBondContact O-N 3.49Å; E1580-A1583 VanDerWaalsContact O-N 3.14Å; E1580-H1584 PolarHBondContact O-CD2 3.2Å; E1580-H1584 PolarHBondContact O-N 2.81Å; E1580-V1608 HydrophobicContact CB-CG2 4.36Å; E1580-V1608 HydrophobicContact CG-CG2 3.66Å
1581	H	71.9	Confident	81.4	Confident	91 Å²	91	54.1 Å²	54.1	42%	0.421	28%	0.283	S	S	.	.	H	α-helix	trans	-62.2	-41.5	173.6	-172.3	-176.2	0	0	0	112	S1579 A1583 H1584 N1585	S1579-H1581 PolarHBondContact O-N 2.93Å; H1581-A1583 VanDerWaalsContact C-N 3.32Å; H1581-A1583 PolarHBondContact O-N 3.38Å; H1581-H1584 PolarHBondContact O-N 3.36Å; H1581-N1585 VanDerWaalsContact CD2-CG 3.47Å; H1581-N1585 PolarHBondContact CD2-ND2 3.25Å; H1581-N1585 PolarHBondContact CD2-OD1 3.2Å; H1581-N1585 VanDerWaalsContact CD2-OD1 3.3Å; H1581-N1585 PolarHBondContact NE2-ND2 3.03Å; H1581-N1585 PolarHBondContact NE2-OD1 3.15Å; H1581-N1585 WeakPolarHBondContact O-CB 3.38Å; H1581-N1585 PolarHBondContact O-N 2.82Å; H1581-N1585 PolarHBondContact O-ND2 2.86Å
1582	Q	79.3	Confident	80.5	Confident	94 Å²	94	59 Å²	59	44%	0.439	31%	0.308	S	S	.	.	H	α-helix	trans	-64.9	-36.3	172.3	-78.2	-177.2	-14.7	0	0	112.5	I1577 S1579 E1580 L1586	I1577-Q1582 HydrophobicContact CG2-CB 4.11Å; S1579-Q1582 WeakPolarHBondContact O-CB 3.37Å; S1579-Q1582 PolarHBondContact O-N 3.47Å; S1579-Q1582 VanDerWaalsContact O-N 3.07Å; S1579-Q1582 PolarHBondContact OG-N 3.17Å; E1580-Q1582 PolarHBondContact O-N 2.67Å; Q1582-L1586 WeakPolarHBondContact O-CB 3.42Å; Q1582-L1586 PolarHBondContact O-N 3.18Å
1583	A	81	Confident	79.7	Confident	3 Å²	3	59.7 Å²	59.7	3%	0.025	31%	0.305	C	S	.	.	H	α-helix	trans	-62.9	-50.6	175.6	0	0	0	0	0	111.3	I1577 S1579 E1580 H1581 L1586 Q1587 P1606	I1577-A1583 HydrophobicContact CG2-CB 3.7Å; S1579-A1583 PolarHBondContact O-N 2.89Å; E1580-A1583 WeakPolarHBondContact O-CB 3.33Å; E1580-A1583 PolarHBondContact O-N 3.49Å; E1580-A1583 VanDerWaalsContact O-N 3.14Å; H1581-A1583 VanDerWaalsContact C-N 3.32Å; H1581-A1583 PolarHBondContact O-N 3.38Å; A1583-L1586 PolarHBondContact O-N 3.08Å; A1583-Q1587 PolarHBondContact O-N 3.12Å; A1583-P1606 HydrophobicContact CB-CB 4.49Å; A1583-P1606 HydrophobicContact CB-CG 4.38Å; A1583-P1606 VanDerWaalsContact O-CG 3.22Å; A1583-P1606 WeakPolarHBondContact O-CG 3.31Å
1584	H	73.4	Confident	79.2	Confident	26 Å²	26	60.4 Å²	60.4	12%	0.12	31%	0.31	C	S	.	.	H	α-helix	trans	-61.1	-47.3	178.6	-77.7	-138.3	0	0	0	111.5	M1208 E1580 H1581 L1586 Q1587 D1588	M1208-H1584 PolarHBondContact O-CE1 3.45Å; E1580-H1584 PolarHBondContact O-CD2 3.2Å; E1580-H1584 PolarHBondContact O-N 2.81Å; H1581-H1584 PolarHBondContact O-N 3.36Å; H1584-L1586 VanDerWaalsContact C-N 3.28Å; H1584-L1586 PolarHBondContact O-N 3.2Å; H1584-Q1587 WeakPolarHBondContact O-CB 3.4Å; H1584-Q1587 PolarHBondContact O-N 3.07Å; H1584-Q1587 VanDerWaalsContact O-N 3.08Å; H1584-D1588 PolarHBondContact O-N 3.01Å
1585	N	75	Confident	78.8	Confident	68 Å²	68	54 Å²	54	36%	0.364	29%	0.289	S	S	.	.	H	α-helix	trans	-60.9	-38.1	178.5	-71	-9.2	0	0	0	112.1	H1581 L1589	H1581-N1585 VanDerWaalsContact CD2-CG 3.47Å; H1581-N1585 PolarHBondContact CD2-ND2 3.25Å; H1581-N1585 PolarHBondContact CD2-OD1 3.2Å; H1581-N1585 VanDerWaalsContact CD2-OD1 3.3Å; H1581-N1585 PolarHBondContact NE2-ND2 3.03Å; H1581-N1585 PolarHBondContact NE2-OD1 3.15Å; H1581-N1585 WeakPolarHBondContact O-CB 3.38Å; H1581-N1585 PolarHBondContact O-N 2.82Å; H1581-N1585 PolarHBondContact O-ND2 2.86Å; N1585-L1589 WeakPolarHBondContact O-CB 3.16Å; N1585-L1589 PolarHBondContact O-N 2.99Å
1586	L	84	Confident	78.5	Confident	16 Å²	16	55.1 Å²	55.1	8%	0.084	29%	0.294	C	S	.	.	H	α-helix	trans	-68.9	-38.9	174.7	-179.7	66.1	0	0	0	112.1	I1577 Q1582 A1583 H1584 A1590 L1603 P1606 L1612	I1577-L1586 HydrophobicContact CD1-CD2 3.74Å; Q1582-L1586 WeakPolarHBondContact O-CB 3.42Å; Q1582-L1586 PolarHBondContact O-N 3.18Å; A1583-L1586 PolarHBondContact O-N 3.08Å; H1584-L1586 VanDerWaalsContact C-N 3.28Å; H1584-L1586 PolarHBondContact O-N 3.2Å; L1586-A1590 VanDerWaalsContact O-CB 3.3Å; L1586-A1590 WeakPolarHBondContact O-CB 3.22Å; L1586-A1590 PolarHBondContact O-N 2.69Å; L1586-L1603 HydrophobicContact CD2-CD2 4.43Å; L1586-P1606 HydrophobicContact CD2-CB 4.32Å; L1586-L1612 HydrophobicContact CD2-CD1 3.44Å; L1586-L1612 VanDerWaalsContact CD2-CD1 3.44Å
1587	Q	80.6	Confident	78.2	Confident	10 Å²	10	53 Å²	53	5%	0.047	28%	0.281	C	S	.	.	H	α-helix	trans	-64.2	-44.6	176.2	-177.3	171.4	-13.3	0	0	111.6	R1206 A1583 H1584 A1590 A1591 F1604 P1606	R1206-Q1587 VanDerWaalsContact CD-NE2 3.26Å; A1583-Q1587 PolarHBondContact O-N 3.12Å; H1584-Q1587 WeakPolarHBondContact O-CB 3.4Å; H1584-Q1587 PolarHBondContact O-N 3.07Å; H1584-Q1587 VanDerWaalsContact O-N 3.08Å; Q1587-A1590 PolarHBondContact O-N 2.9Å; Q1587-A1591 WeakPolarHBondContact O-CB 3.43Å; Q1587-A1591 PolarHBondContact O-N 3.24Å; Q1587-F1604 VanDerWaalsContact CD-O 3.24Å; Q1587-F1604 PolarHBondContact NE2-O 3.1Å; Q1587-P1606 HydrophobicContact CB-CG 3.91Å
1588	D	70.7	Confident	78.4	Confident	51 Å²	51	53.1 Å²	53.1	27%	0.273	28%	0.282	S	S	.	.	H	α-helix	trans	-67.8	-40.5	178.7	-71.5	-19.4	0	0	0	111	T1209 H1584 A1590 A1591 E1592	T1209-D1588 VanDerWaalsContact CG2-OD1 3.26Å; T1209-D1588 WeakPolarHBondContact CG2-OD1 3.35Å; H1584-D1588 PolarHBondContact O-N 3.01Å; D1588-A1590 PolarHBondContact O-N 2.9Å; D1588-A1591 WeakPolarHBondContact O-CB 3.17Å; D1588-A1591 PolarHBondContact O-N 3.38Å; D1588-E1592 WeakPolarHBondContact O-CB 3.36Å; D1588-E1592 PolarHBondContact O-N 3.24Å
1589	L	73.4	Confident	78.7	Confident	62 Å²	62	50.4 Å²	50.4	33%	0.325	26%	0.255	S	S	.	.	H	α-helix	trans	-60.7	-43	172	-170.6	75.2	0	0	0	111.8	N1585 A1591 E1592 R1593	N1585-L1589 WeakPolarHBondContact O-CB 3.16Å; N1585-L1589 PolarHBondContact O-N 2.99Å; L1589-A1591 VanDerWaalsContact C-N 3.34Å; L1589-E1592 PolarHBondContact O-N 3.39Å; L1589-R1593 VanDerWaalsContact CD1-CZ 3.4Å; L1589-R1593 WeakPolarHBondContact O-CB 3.45Å; L1589-R1593 WeakPolarHBondContact O-CG 3.24Å; L1589-R1593 PolarHBondContact O-N 3.24Å
1590	A	80.3	Confident	79.1	Confident	4 Å²	4	48.2 Å²	48.2	3%	0.033	24%	0.24	C	C	.	.	H	α-helix	trans	-69.5	-32.2	175.3	0	0	0	0	0	112.2	L1586 Q1587 D1588 C1594 R1599 L1603	L1586-A1590 VanDerWaalsContact O-CB 3.3Å; L1586-A1590 WeakPolarHBondContact O-CB 3.22Å; L1586-A1590 PolarHBondContact O-N 2.69Å; Q1587-A1590 PolarHBondContact O-N 2.9Å; D1588-A1590 PolarHBondContact O-N 2.9Å; A1590-C1594 VanDerWaalsContact O-CB 3.26Å; A1590-C1594 WeakPolarHBondContact O-CB 3.35Å; A1590-C1594 PolarHBondContact O-N 3.12Å; A1590-R1599 PolarHBondContact O-NE 3.27Å; A1590-R1599 PolarHBondContact O-NH2 3.34Å; A1590-L1603 HydrophobicContact CB-CB 3.91Å; A1590-L1603 HydrophobicContact CB-CD1 4.3Å
1591	A	68.7	Low	79.8	Confident	53 Å²	53	43 Å²	43	44%	0.438	22%	0.218	S	C	.	.	H	α-helix	trans	-63.3	-45.1	173.7	0	0	0	0	0	111.7	Q1587 D1588 L1589 R1599	Q1587-A1591 WeakPolarHBondContact O-CB 3.43Å; Q1587-A1591 PolarHBondContact O-N 3.24Å; D1588-A1591 WeakPolarHBondContact O-CB 3.17Å; D1588-A1591 PolarHBondContact O-N 3.38Å; L1589-A1591 VanDerWaalsContact C-N 3.34Å; A1591-R1599 PolarHBondContact O-NH2 3.5Å
1592	E	68.4	Low	80.6	Confident	133 Å²	133	39.9 Å²	39.9	62%	0.621	20%	0.204	S	C	*	.	H	α-helix	trans	-68.4	-37.8	177.7	-177.7	-177	-117.8	0	0	112.9	D1588 L1589	D1588-E1592 WeakPolarHBondContact O-CB 3.36Å; D1588-E1592 PolarHBondContact O-N 3.24Å; L1589-E1592 PolarHBondContact O-N 3.39Å
1593	R	74.8	Confident	81.1	Confident	51 Å²	51	35.6 Å²	35.6	19%	0.192	18%	0.184	C	C	.	.	H	α-helix	trans	-122.9	-12.9	-161.4	-58	-166.3	-164.6	178	13.9	118	D1547 G1568 S1569 L1589	D1547-R1593 WeakPolarHBondContact CB-O 3.33Å; G1568-R1593 PolarHBondContact O-NH1 2.89Å; S1569-R1593 PolarHBondContact OG-O 2.92Å; L1589-R1593 VanDerWaalsContact CD1-CZ 3.4Å; L1589-R1593 WeakPolarHBondContact O-CB 3.45Å; L1589-R1593 WeakPolarHBondContact O-CG 3.24Å; L1589-R1593 PolarHBondContact O-N 3.24Å
1594	C	80.4	Confident	81.2	Confident	15 Å²	15	35.8 Å²	35.8	10%	0.101	18%	0.184	C	C	.	.	S	Bend	trans	-103.6	123.8	177.7	-53.5	0	0	0	0	109.6	G1546 A1590 M1596 R1599	G1546-C1594 PolarHBondContact O-SG 3.29Å; A1590-C1594 VanDerWaalsContact O-CB 3.26Å; A1590-C1594 WeakPolarHBondContact O-CB 3.35Å; A1590-C1594 PolarHBondContact O-N 3.12Å; C1594-M1596 PolarHBondContact O-N 3.11Å; C1594-R1599 HydrophobicContact CB-CB 4.17Å; C1594-R1599 HydrophobicContact CB-CG 3.86Å; C1594-R1599 PolarHBondContact O-NE 3.28Å; C1594-R1599 PolarHBondContact O-NH2 3.32Å
1595	T	85.1	Confident	81.7	Confident	26 Å²	26	36.5 Å²	36.5	16%	0.16	20%	0.195	C	C	.	.			trans	-58.7	120.8	178.3	-58.8	0	0	0	0	110.4	D1547 K1549 Y1597 Y1598 R1599	D1547-T1595 VanDerWaalsContact OD1-CB 3.23Å; D1547-T1595 WeakPolarHBondContact OD1-CB 3.26Å; D1547-T1595 PolarHBondContact OD1-N 3.34Å; D1547-T1595 PolarHBondContact OD1-OG1 3.11Å; D1547-T1595 PolarHBondContact OD2-OG1 2.75Å; K1549-T1595 HydrophobicContact CD-CG2 4.22Å; K1549-T1595 WeakPolarHBondContact CD-OG1 3.11Å; K1549-T1595 PolarHBondContact NZ-OG1 3.2Å; T1595-Y1597 VanDerWaalsContact C-N 3.31Å; T1595-Y1597 HydrophobicContact CG2-CD1 4.41Å; T1595-Y1597 HydrophobicContact CG2-CD2 4.44Å; T1595-Y1597 HydrophobicContact CG2-CE1 3.98Å; T1595-Y1597 HydrophobicContact CG2-CE2 4.05Å; T1595-Y1597 PolarHBondContact O-N 2.94Å; T1595-Y1597 VanDerWaalsContact O-N 3.09Å; T1595-Y1598 HydrophobicContact CG2-CD2 3.95Å; T1595-Y1598 CarbonylContact O-C 3.51Å; T1595-Y1598 PolarHBondContact O-N 2.88Å; T1595-R1599 PolarHBondContact O-N 2.76Å
1596	M	82.7	Confident	82.1	Confident	77 Å²	77	33.8 Å²	33.8	38%	0.379	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.5	-40.7	-161.4	-157.6	-165.4	179.9	0	0	114.5	C1594 F1604 V1639 L1645	C1594-M1596 PolarHBondContact O-N 3.11Å; M1596-F1604 HydrophobicContact CG-CE1 4.39Å; M1596-F1604 WeakPolarHBondContact O-CZ 3.39Å; M1596-V1639 HydrophobicContact SD-CG1 4.47Å; M1596-L1645 HydrophobicContact CB-CD1 4.22Å; M1596-L1645 HydrophobicContact CE-CD1 3.81Å; M1596-L1645 HydrophobicContact CG-CD1 3.51Å; M1596-L1645 HydrophobicContact SD-CD1 3.66Å
1597	Y	85.4	Confident	82.2	Confident	66 Å²	66	39.4 Å²	39.4	26%	0.259	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.9	6.9	-178.7	47.2	-89.7	0	0	0	114.7	T1595 S1633 E1636 V1639	T1595-Y1597 VanDerWaalsContact C-N 3.31Å; T1595-Y1597 HydrophobicContact CG2-CD1 4.41Å; T1595-Y1597 HydrophobicContact CG2-CD2 4.44Å; T1595-Y1597 HydrophobicContact CG2-CE1 3.98Å; T1595-Y1597 HydrophobicContact CG2-CE2 4.05Å; T1595-Y1597 PolarHBondContact O-N 2.94Å; T1595-Y1597 VanDerWaalsContact O-N 3.09Å; Y1597-S1633 PolarHBondContact O-OG 2.64Å; Y1597-E1636 HydrophobicContact CD2-CB 3.91Å; Y1597-E1636 HydrophobicContact CD2-CG 4.01Å; Y1597-E1636 HydrophobicContact CE2-CB 4.26Å; Y1597-E1636 HydrophobicContact CE2-CG 3.86Å; Y1597-E1636 HydrophobicContact CG-CB 4.28Å; Y1597-E1636 HydrophobicContact CG-CG 4.43Å; Y1597-V1639 HydrophobicContact CD1-CG2 4.26Å
1598	Y	90.8	Very high	82.4	Confident	6 Å²	6	42.7 Å²	42.7	2%	0.024	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-112.4	-15.2	164.5	-74.5	-92.8	0	0	0	112.1	K1549 T1550 T1595 S1620 C1623 L1624 A1627	K1549-Y1598 HydrophobicContact CB-CD1 4.05Å; K1549-Y1598 HydrophobicContact CB-CD2 3.83Å; K1549-Y1598 HydrophobicContact CB-CE1 4.16Å; K1549-Y1598 HydrophobicContact CB-CE2 3.91Å; K1549-Y1598 HydrophobicContact CB-CG 3.91Å; T1550-Y1598 PolarHBondContact OG1-OH 3.5Å; T1595-Y1598 HydrophobicContact CG2-CD2 3.95Å; T1595-Y1598 CarbonylContact O-C 3.51Å; T1595-Y1598 PolarHBondContact O-N 2.88Å; Y1598-S1620 PolarHBondContact O-OG 3.38Å; Y1598-C1623 HydrophobicContact CD1-CB 3.45Å; Y1598-C1623 VanDerWaalsContact CD1-CB 3.45Å; Y1598-C1623 HydrophobicContact CE1-CB 3.74Å; Y1598-C1623 HydrophobicContact CG-CB 4.28Å; Y1598-L1624 HydrophobicContact CE1-CB 4.28Å; Y1598-A1627 WeakPolarHBondContact OH-CB 3.43Å
1599	R	90.5	Very high	83.1	Confident	20 Å²	20	42.4 Å²	42.4	8%	0.075	24%	0.237	C	C	.	.	S	Bend	trans	-61.8	136	-176.3	-170.8	-176.2	-54	172.7	2.4	112.1	A1590 A1591 C1594 T1595 L1603 F1604 W1619	A1590-R1599 PolarHBondContact O-NE 3.27Å; A1590-R1599 PolarHBondContact O-NH2 3.34Å; A1591-R1599 PolarHBondContact O-NH2 3.5Å; C1594-R1599 HydrophobicContact CB-CB 4.17Å; C1594-R1599 HydrophobicContact CB-CG 3.86Å; C1594-R1599 PolarHBondContact O-NE 3.28Å; C1594-R1599 PolarHBondContact O-NH2 3.32Å; T1595-R1599 PolarHBondContact O-N 2.76Å; R1599-L1603 HydrophobicContact CG-CB 3.86Å; R1599-L1603 HydrophobicContact CG-CD1 4.16Å; R1599-F1604 HydrophobicContact CB-CE2 3.73Å; R1599-F1604 HydrophobicContact CB-CZ 3.9Å; R1599-F1604 HydrophobicContact CG-CD2 4.23Å; R1599-F1604 HydrophobicContact CG-CE2 3.71Å; R1599-F1604 HydrophobicContact CG-CZ 4.14Å; R1599-W1619 PolarHBondContact O-NE1 3.45Å; R1599-W1619 VanDerWaalsContact O-NE1 3.12Å
1600	A	90.7	Very high	83.7	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	23%	0.234	C	C	.	.			trans	-70.9	145.4	177.7	0	0	0	0	0	112.5	E1602 L1603 F1604 T1616 W1619	A1600-E1602 VanDerWaalsContact C-N 3.28Å; A1600-E1602 VanDerWaalsContact CB-OE2 3.26Å; A1600-E1602 WeakPolarHBondContact CB-OE2 3.45Å; A1600-E1602 PolarHBondContact O-N 2.91Å; A1600-L1603 PolarHBondContact O-N 3.3Å; A1600-F1604 WeakPolarHBondContact O-CD2 3.31Å; A1600-T1616 HydrophobicContact CB-CG2 4.01Å; A1600-W1619 VanDerWaalsContact CA-CD1 3.45Å; A1600-W1619 HydrophobicContact CB-CB 3.87Å; A1600-W1619 HydrophobicContact CB-CG 4.02Å
1601	P	89	Confident	84.2	Confident	31 Å²	31	47 Å²	47	20%	0.201	26%	0.256	C	S	.	.	G	3₁₀ helix	trans	-54.6	-38.2	-174.6	-27.4	34.9	0	0	0	114.6	L1603 F1604 W1619 H1649	P1601-L1603 PolarHBondContact O-N 3.09Å; P1601-F1604 PolarHBondContact O-N 2.91Å; P1601-F1604 VanDerWaalsContact O-N 3.12Å; P1601-W1619 HydrophobicContact CG-CD2 4.19Å; P1601-W1619 HydrophobicContact CG-CE3 4.13Å; P1601-W1619 HydrophobicContact CG-CH2 3.87Å; P1601-W1619 HydrophobicContact CG-CZ2 3.91Å; P1601-W1619 HydrophobicContact CG-CZ3 3.99Å; P1601-H1649 HydrophobicContact CG-CB 4.14Å
1602	E	88.8	Confident	85.3	Confident	25 Å²	25	44.8 Å²	44.8	12%	0.117	24%	0.236	C	C	.	.	G	3₁₀ helix	trans	-66.3	-15.5	-179.7	68.8	-85.4	-153.6	0	0	114.2	A1600 L1612 T1616 R1681	A1600-E1602 VanDerWaalsContact C-N 3.28Å; A1600-E1602 VanDerWaalsContact CB-OE2 3.26Å; A1600-E1602 WeakPolarHBondContact CB-OE2 3.45Å; A1600-E1602 PolarHBondContact O-N 2.91Å; E1602-L1612 HydrophobicContact CB-CD2 4.2Å; E1602-L1612 HydrophobicContact CG-CD2 3.67Å; E1602-T1616 WeakPolarHBondContact OE1-CA 3.46Å; E1602-T1616 WeakPolarHBondContact OE1-CB 3.45Å; E1602-T1616 PolarHBondContact OE1-OG1 2.86Å; E1602-R1681 IonicContact OE1-CZ 3.62Å; E1602-R1681 IonicContact OE1-NH1 2.7Å; E1602-R1681 PolarHBondContact OE1-NH1 3.2Å; E1602-R1681 IonicContact OE1-NH2 2.9Å; E1602-R1681 IonicContact OE2-CZ 3.91Å; E1602-R1681 IonicContact OE2-NH1 3.84Å; E1602-R1681 PolarHBondContact OE2-NH1 3.27Å; E1602-R1681 IonicContact OE2-NH2 3.27Å; E1602-R1681 PolarHBondContact OE2-NH2 2.86Å
1603	L	89.4	Confident	86.5	Confident	5 Å²	5	39.2 Å²	39.2	3%	0.026	21%	0.211	C	C	.	.	G	3₁₀ helix	trans	-90	-3.2	175.8	-59	-178.1	0	0	0	113.4	L1586 A1590 R1599 A1600 P1601 L1612 T1616	L1586-L1603 HydrophobicContact CD2-CD2 4.43Å; A1590-L1603 HydrophobicContact CB-CB 3.91Å; A1590-L1603 HydrophobicContact CB-CD1 4.3Å; R1599-L1603 HydrophobicContact CG-CB 3.86Å; R1599-L1603 HydrophobicContact CG-CD1 4.16Å; A1600-L1603 PolarHBondContact O-N 3.3Å; P1601-L1603 PolarHBondContact O-N 3.09Å; L1603-L1612 HydrophobicContact CD2-CD1 3.9Å; L1603-T1616 HydrophobicContact CD1-CG2 3.67Å; L1603-T1616 HydrophobicContact CD2-CG2 4.31Å; L1603-T1616 HydrophobicContact CG-CG2 4.05Å
1604	F	83.2	Confident	87.4	Confident	6 Å²	6	37.4 Å²	37.4	3%	0.026	21%	0.205	C	C	.	.	S	Bend	trans	-88.1	-25	176.7	-74	-95.9	0	0	0	113.8	Q1587 M1596 R1599 A1600 P1601 L1645 P1646 H1649	Q1587-F1604 VanDerWaalsContact CD-O 3.24Å; Q1587-F1604 PolarHBondContact NE2-O 3.1Å; M1596-F1604 HydrophobicContact CG-CE1 4.39Å; M1596-F1604 WeakPolarHBondContact O-CZ 3.39Å; R1599-F1604 HydrophobicContact CB-CE2 3.73Å; R1599-F1604 HydrophobicContact CB-CZ 3.9Å; R1599-F1604 HydrophobicContact CG-CD2 4.23Å; R1599-F1604 HydrophobicContact CG-CE2 3.71Å; R1599-F1604 HydrophobicContact CG-CZ 4.14Å; A1600-F1604 WeakPolarHBondContact O-CD2 3.31Å; P1601-F1604 PolarHBondContact O-N 2.91Å; P1601-F1604 VanDerWaalsContact O-N 3.12Å; F1604-L1645 HydrophobicContact CE1-CB 4.38Å; F1604-L1645 HydrophobicContact CZ-CB 4.43Å; F1604-L1645 HydrophobicContact CZ-CD1 4.41Å; F1604-P1646 HydrophobicContact CB-CG 4.45Å; F1604-P1646 HydrophobicContact CD1-CG 3.96Å; F1604-P1646 HydrophobicContact CE1-CG 4.48Å; F1604-P1646 HydrophobicContact CG-CG 4.28Å; F1604-H1649 AromaticContact CE2-CE1 3.56Å; F1604-H1649 AromaticContact CE2-ND1 3.99Å; F1604-H1649 AromaticContact CZ-CE1 3.91Å
1605	A	83.4	Confident	88.2	Confident	42 Å²	42	38.3 Å²	38.3	35%	0.347	21%	0.206	S	C	.	.	S	Bend	trans	-157.5	62.9	179.4	0	0	0	0	0	110.5
1606	P	84.3	Confident	88.6	Confident	11 Å²	11	37.2 Å²	37.2	7%	0.071	20%	0.199	C	C	.	.			trans	-58.3	147.9	175.8	26	-35.5	0	0	0	111.6	I1577 A1583 L1586 Q1587	I1577-P1606 HydrophobicContact CD1-CB 3.55Å; A1583-P1606 HydrophobicContact CB-CB 4.49Å; A1583-P1606 HydrophobicContact CB-CG 4.38Å; A1583-P1606 VanDerWaalsContact O-CG 3.22Å; A1583-P1606 WeakPolarHBondContact O-CG 3.31Å; L1586-P1606 HydrophobicContact CD2-CB 4.32Å; Q1587-P1606 HydrophobicContact CB-CG 3.91Å
1607	Q	85.1	Confident	89.2	Confident	134 Å²	134	33.5 Å²	33.5	63%	0.626	18%	0.181	S	C	*	.			trans	-123.7	158.1	-177.1	-58.3	-172.9	8.5	0	0	112.4	I1577 G1609 D1610	I1577-Q1607 WeakPolarHBondContact CB-O 3.24Å; Q1607-G1609 PolarHBondContact O-N 3.39Å; Q1607-D1610 PolarHBondContact N-OD2 3.08Å; Q1607-D1610 WeakPolarHBondContact O-CB 3.33Å; Q1607-D1610 PolarHBondContact O-N 3.4Å
1608	V	84.9	Confident	89.7	Confident	78 Å²	78	30.4 Å²	30.4	47%	0.473	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.1	127	173.6	-173.6	0	0	0	0	109.5	S1579 E1580	S1579-V1608 VanDerWaalsContact C-CG2 3.47Å; E1580-V1608 HydrophobicContact CB-CG2 4.36Å; E1580-V1608 HydrophobicContact CG-CG2 3.66Å
1609	G	85.7	Confident	89.9	Confident	46 Å²	46	30.1 Å²	30.1	47%	0.474	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	94.7	-6.8	-173	0	0	0	0	0	114.8	I1577 Q1607 K1611	I1577-G1609 PolarHBondContact O-N 3.44Å; Q1607-G1609 PolarHBondContact O-N 3.39Å; G1609-K1611 PolarHBondContact O-N 2.98Å
1610	D	86.6	Confident	90.2	Very high	51 Å²	51	29.4 Å²	29.4	27%	0.273	17%	0.166	S	C	.	.			trans	-64.8	132.5	170.2	-83.5	-35	0	0	0	110.8	E1576 I1577 Q1607	E1576-D1610 WeakPolarHBondContact CA-O 3.4Å; I1577-D1610 HydrophobicContact CD1-CB 4.06Å; I1577-D1610 HydrophobicContact CG1-CB 4.41Å; I1577-D1610 PolarHBondContact N-O 2.76Å; Q1607-D1610 PolarHBondContact N-OD2 3.08Å; Q1607-D1610 WeakPolarHBondContact O-CB 3.33Å; Q1607-D1610 PolarHBondContact O-N 3.4Å
1611	K	90.6	Very high	90.5	Very high	112 Å²	112	29.4 Å²	29.4	49%	0.487	17%	0.166	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	77.6	-179	-65.1	174.9	-172.5	-93.9	0	110.3	I1575 E1576 G1609 R1678	I1575-K1611 CarbonylContact O-C 3.58Å; I1575-K1611 WeakPolarHBondContact O-CA 3.4Å; E1576-K1611 HydrophobicContact CB-CG 4.3Å; E1576-K1611 HydrophobicContact CG-CG 4.02Å; E1576-K1611 WeakPolarHBondContact OE1-CE 3.43Å; E1576-K1611 IonicContact OE1-NZ 3.63Å; E1576-K1611 PolarHBondContact OE1-NZ 2.68Å; E1576-K1611 IonicContact OE2-NZ 2.74Å; E1576-K1611 PolarHBondContact OE2-NZ 3.06Å; G1609-K1611 PolarHBondContact O-N 2.98Å; K1611-R1678 PolarHBondContact O-NH1 3.14Å; K1611-R1678 PolarHBondContact O-NH2 3.01Å
1612	L	91.7	Very high	90.8	Very high	5 Å²	5	28 Å²	28	3%	0.026	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.9	155.2	-178	-59.7	-169.3	0	0	0	112	A1573 R1574 I1575 L1586 E1602 L1603	A1573-L1612 CarbonylContact O-C 3.56Å; R1574-L1612 VanDerWaalsContact CA-O 3.31Å; R1574-L1612 WeakPolarHBondContact CA-O 3.36Å; I1575-L1612 PolarHBondContact N-O 3.01Å; I1575-L1612 PolarHBondContact O-N 3.37Å; L1586-L1612 HydrophobicContact CD2-CD1 3.44Å; L1586-L1612 VanDerWaalsContact CD2-CD1 3.44Å; E1602-L1612 HydrophobicContact CB-CD2 4.2Å; E1602-L1612 HydrophobicContact CG-CD2 3.67Å; L1603-L1612 HydrophobicContact CD2-CD1 3.9Å
1613	D	93.5	Very high	91.1	Very high	17 Å²	17	26.8 Å²	26.8	9%	0.091	15%	0.151	C	C	.	.			trans	-154.6	-172.8	-176.5	67	-0.6	0	0	0	111.5	A1573 R1615 T1616 R1678	A1573-D1613 WeakPolarHBondContact O-CA 3.48Å; A1573-D1613 PolarHBondContact O-N 3.1Å; D1613-R1615 PolarHBondContact O-N 2.67Å; D1613-R1615 WeakPolarHBondContact OD1-CB 3.24Å; D1613-R1615 PolarHBondContact OD1-N 3.41Å; D1613-R1615 IonicContact OD1-NE 3.66Å; D1613-R1615 PolarHBondContact OD1-NE 3.44Å; D1613-R1615 IonicContact OD2-CZ 2.65Å; D1613-R1615 VanDerWaalsContact OD2-CZ 3.25Å; D1613-R1615 IonicContact OD2-NE 3.45Å; D1613-R1615 PolarHBondContact OD2-NE 3.13Å; D1613-R1615 IonicContact OD2-NH2 3.72Å; D1613-R1615 PolarHBondContact OD2-NH2 3.07Å; D1613-T1616 PolarHBondContact O-N 3.25Å; D1613-R1678 IonicContact OD1-CZ 4Å; D1613-R1678 IonicContact OD1-NH1 3.73Å; D1613-R1678 PolarHBondContact OD1-NH1 2.94Å; D1613-R1678 IonicContact OD2-NH1 2.79Å; D1613-R1678 PolarHBondContact OD2-NH1 3.49Å
1614	E	94.6	Very high	91.4	Very high	13 Å²	13	26.5 Å²	26.5	6%	0.061	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-19.8	-174.4	-54.9	83.8	174.7	0	0	113.3	H1536 P1542 A1573 R1574 T1616 D1617	H1536-E1614 HydrophobicContact CB-CG 4.39Å; H1536-E1614 PolarHBondContact CE1-O 2.95Å; H1536-E1614 VanDerWaalsContact CE1-O 3.27Å; P1542-E1614 HydrophobicContact CB-CG 4.25Å; P1542-E1614 VanDerWaalsContact CG-OE1 3.31Å; P1542-E1614 WeakPolarHBondContact CG-OE1 3.46Å; A1573-E1614 HydrophobicContact CB-CG 3.86Å; R1574-E1614 IonicContact CZ-OE1 3.5Å; R1574-E1614 IonicContact NE-OE1 3.64Å; R1574-E1614 PolarHBondContact NE-OE1 3.27Å; R1574-E1614 IonicContact NE-OE2 2.67Å; R1574-E1614 IonicContact NH2-OE1 2.7Å; R1574-E1614 PolarHBondContact NH2-OE1 3.32Å; E1614-T1616 PolarHBondContact O-N 3.49Å; E1614-D1617 PolarHBondContact O-N 3.1Å
1615	R	95.2	Very high	92.1	Very high	33 Å²	33	26.2 Å²	26.2	13%	0.125	15%	0.148	C	C	.	.	H	α-helix	trans	-71.6	-8.7	-178.5	-64.2	178.9	-75.3	-175.5	-8.3	114.1	D1613 I1618 R1678 Q1679 R1681 F1683	D1613-R1615 PolarHBondContact O-N 2.67Å; D1613-R1615 WeakPolarHBondContact OD1-CB 3.24Å; D1613-R1615 PolarHBondContact OD1-N 3.41Å; D1613-R1615 IonicContact OD1-NE 3.66Å; D1613-R1615 PolarHBondContact OD1-NE 3.44Å; D1613-R1615 IonicContact OD2-CZ 2.65Å; D1613-R1615 VanDerWaalsContact OD2-CZ 3.25Å; D1613-R1615 IonicContact OD2-NE 3.45Å; D1613-R1615 PolarHBondContact OD2-NE 3.13Å; D1613-R1615 IonicContact OD2-NH2 3.72Å; D1613-R1615 PolarHBondContact OD2-NH2 3.07Å; R1615-I1618 PolarHBondContact O-N 3.48Å; R1615-R1678 HydrophobicContact CB-CG 3.95Å; R1615-R1678 PolarHBondContact NH1-O 3.05Å; R1615-Q1679 PolarHBondContact NH1-O 3.4Å; R1615-Q1679 VanDerWaalsContact NH1-O 3.14Å; R1615-R1681 HydrophobicContact CB-CB 4.31Å; R1615-R1681 VanDerWaalsContact CD-O 3.22Å; R1615-R1681 WeakPolarHBondContact CD-O 3.32Å; R1615-R1681 PolarHBondContact O-NH1 3.43Å; R1615-F1683 HydrophobicContact CG-CD1 3.93Å; R1615-F1683 HydrophobicContact CG-CE1 3.89Å; R1615-F1683 HydrophobicContact CG-CG 4.26Å; R1615-F1683 HydrophobicContact CG-CZ 4.19Å
1616	T	93.5	Very high	92.6	Very high	3 Å²	3	25.3 Å²	25.3	2%	0.018	14%	0.136	C	C	.	.	H	α-helix	trans	-62	-41.5	169.4	-68.2	0	0	0	0	111.5	A1600 E1602 L1603 D1613 E1614 I1618	A1600-T1616 HydrophobicContact CB-CG2 4.01Å; E1602-T1616 WeakPolarHBondContact OE1-CA 3.46Å; E1602-T1616 WeakPolarHBondContact OE1-CB 3.45Å; E1602-T1616 PolarHBondContact OE1-OG1 2.86Å; L1603-T1616 HydrophobicContact CD1-CG2 3.67Å; L1603-T1616 HydrophobicContact CD2-CG2 4.31Å; L1603-T1616 HydrophobicContact CG-CG2 4.05Å; D1613-T1616 PolarHBondContact O-N 3.25Å; E1614-T1616 PolarHBondContact O-N 3.49Å; T1616-I1618 VanDerWaalsContact C-N 3.3Å; T1616-I1618 PolarHBondContact O-N 3.37Å
1617	D	95.9	Very high	93.2	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-71	-24.7	175.6	-71.9	-33.9	0	0	0	112.9	L1532 H1536 V1544 H1545 G1546 E1614 W1619 S1620 L1621	L1532-D1617 HydrophobicContact CD1-CB 4.01Å; L1532-D1617 WeakPolarHBondContact CD1-OD2 3.49Å; L1532-D1617 HydrophobicContact CD2-CB 4.1Å; H1536-D1617 IonicContact CD2-OD2 2.73Å; H1536-D1617 IonicContact CE1-OD2 3.21Å; H1536-D1617 IonicContact NE2-OD2 3.04Å; H1536-D1617 PolarHBondContact NE2-OD2 3.21Å; V1544-D1617 WeakPolarHBondContact CA-OD2 3.46Å; V1544-D1617 WeakPolarHBondContact CB-OD2 3.49Å; V1544-D1617 WeakPolarHBondContact CG1-OD2 3.25Å; H1545-D1617 PolarHBondContact N-OD1 3.26Å; H1545-D1617 PolarHBondContact N-OD2 2.92Å; G1546-D1617 PolarHBondContact N-OD1 2.93Å; E1614-D1617 PolarHBondContact O-N 3.1Å; D1617-W1619 VanDerWaalsContact C-N 3.27Å; D1617-W1619 PolarHBondContact O-N 2.95Å; D1617-S1620 WeakPolarHBondContact O-CB 3.34Å; D1617-S1620 PolarHBondContact O-N 2.87Å; D1617-S1620 VanDerWaalsContact O-N 3.16Å; D1617-L1621 WeakPolarHBondContact O-CB 3.28Å; D1617-L1621 PolarHBondContact O-N 3.42Å
1618	I	97.1	Very high	93.7	Very high	0 Å²	0	18.4 Å²	18.4	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-65	-31.9	-177.8	-60.6	-66.1	0	0	0	111.7	R1615 T1616 L1621 G1622 M1673 P1682 L1684	R1615-I1618 PolarHBondContact O-N 3.48Å; T1616-I1618 VanDerWaalsContact C-N 3.3Å; T1616-I1618 PolarHBondContact O-N 3.37Å; I1618-L1621 HydrophobicContact CD1-CD2 4Å; I1618-G1622 PolarHBondContact O-N 2.9Å; I1618-M1673 HydrophobicContact CG2-CB 4.04Å; I1618-M1673 HydrophobicContact CG2-CG 3.87Å; I1618-M1673 HydrophobicContact CG2-SD 4.49Å; I1618-P1682 HydrophobicContact CG2-CG 4.24Å; I1618-L1684 HydrophobicContact CD1-CB 3.97Å; I1618-L1684 HydrophobicContact CD1-CD1 3.94Å
1619	W	94.9	Very high	94.2	Very high	0 Å²	0	14.7 Å²	14.7	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-63.6	-51.1	171	175.2	-86.2	0	0	0	111.2	R1599 A1600 P1601 D1617 L1621 G1622 C1623 F1635 H1649 L1674 P1676	R1599-W1619 PolarHBondContact O-NE1 3.45Å; R1599-W1619 VanDerWaalsContact O-NE1 3.12Å; A1600-W1619 VanDerWaalsContact CA-CD1 3.45Å; A1600-W1619 HydrophobicContact CB-CB 3.87Å; A1600-W1619 HydrophobicContact CB-CG 4.02Å; P1601-W1619 HydrophobicContact CG-CD2 4.19Å; P1601-W1619 HydrophobicContact CG-CE3 4.13Å; P1601-W1619 HydrophobicContact CG-CH2 3.87Å; P1601-W1619 HydrophobicContact CG-CZ2 3.91Å; P1601-W1619 HydrophobicContact CG-CZ3 3.99Å; D1617-W1619 VanDerWaalsContact C-N 3.27Å; D1617-W1619 PolarHBondContact O-N 2.95Å; W1619-L1621 VanDerWaalsContact C-N 3.26Å; W1619-L1621 PolarHBondContact O-N 2.94Å; W1619-G1622 WeakPolarHBondContact O-CA 2.82Å; W1619-G1622 PolarHBondContact O-N 3.41Å; W1619-C1623 PolarHBondContact O-N 3.25Å; W1619-F1635 AromaticContact CE2-CE2 3.99Å; W1619-F1635 HydrophobicContact CH2-CE2 4.19Å; W1619-F1635 AromaticContact CH2-CZ 3.92Å; W1619-F1635 HydrophobicContact CH2-CZ 3.92Å; W1619-F1635 HydrophobicContact CZ2-CD2 4.44Å; W1619-F1635 AromaticContact CZ2-CE2 3.4Å; W1619-F1635 HydrophobicContact CZ2-CE2 3.4Å; W1619-F1635 AromaticContact CZ2-CZ 3.57Å; W1619-F1635 HydrophobicContact CZ2-CZ 3.57Å; W1619-H1649 HydrophobicContact CH2-CB 4.05Å; W1619-H1649 HydrophobicContact CZ2-CB 4.13Å; W1619-H1649 AromaticContact CZ2-CD2 3.57Å; W1619-H1649 AromaticContact CZ2-CE1 3.98Å; W1619-H1649 AromaticContact CZ2-CG 3.65Å; W1619-H1649 AromaticContact CZ2-ND1 3.93Å; W1619-H1649 AromaticContact CZ2-NE2 3.79Å; W1619-L1674 HydrophobicContact CD2-CD2 4.28Å; W1619-L1674 HydrophobicContact CE3-CD2 4.37Å; W1619-L1674 HydrophobicContact CZ3-CB 4.49Å; W1619-P1676 HydrophobicContact CZ3-CB 4.44Å; W1619-P1676 HydrophobicContact CZ3-CG 4.25Å
1620	S	95.5	Very high	94.5	Very high	6 Å²	6	13 Å²	13	4%	0.042	6%	0.06	C	C	.	.	H	α-helix	trans	-59.5	-37.7	177.9	-44.8	0	0	0	0	111.9	L1548 Y1598 D1617 C1623 L1624	L1548-S1620 WeakPolarHBondContact O-CB 3.4Å; Y1598-S1620 PolarHBondContact O-OG 3.38Å; D1617-S1620 WeakPolarHBondContact O-CB 3.34Å; D1617-S1620 PolarHBondContact O-N 2.87Å; D1617-S1620 VanDerWaalsContact O-N 3.16Å; S1620-C1623 WeakPolarHBondContact O-CB 3.47Å; S1620-C1623 PolarHBondContact O-N 2.92Å; S1620-L1624 WeakPolarHBondContact O-CB 3.32Å; S1620-L1624 PolarHBondContact O-N 3.32Å
1621	L	96.6	Very high	94.7	Very high	0 Å²	0	12.5 Å²	12.5	0%	0	5%	0.054	C	C	.	.	H	α-helix	trans	-63.4	-38.2	173.6	-175.3	69	0	0	0	112	F1525 I1528 L1532 L1548 D1617 I1618 W1619 L1624 L1625 M1673 L1684	F1525-L1621 HydrophobicContact CD2-CD1 4.23Å; F1525-L1621 HydrophobicContact CE2-CD1 3.39Å; F1525-L1621 HydrophobicContact CE2-CD2 4.3Å; F1525-L1621 HydrophobicContact CE2-CG 3.57Å; F1525-L1621 HydrophobicContact CZ-CD1 3.89Å; F1525-L1621 HydrophobicContact CZ-CD2 3.94Å; F1525-L1621 HydrophobicContact CZ-CG 3.66Å; I1528-L1621 HydrophobicContact CG2-CD1 3.57Å; L1532-L1621 HydrophobicContact CD2-CD1 4.47Å; L1532-L1621 HydrophobicContact CD2-CD2 4.1Å; L1548-L1621 HydrophobicContact CD2-CB 3.78Å; L1548-L1621 HydrophobicContact CD2-CD1 3.83Å; L1548-L1621 HydrophobicContact CD2-CG 4.41Å; D1617-L1621 WeakPolarHBondContact O-CB 3.28Å; D1617-L1621 PolarHBondContact O-N 3.42Å; I1618-L1621 HydrophobicContact CD1-CD2 4Å; W1619-L1621 VanDerWaalsContact C-N 3.26Å; W1619-L1621 PolarHBondContact O-N 2.94Å; L1621-L1624 PolarHBondContact O-N 3.42Å; L1621-L1625 PolarHBondContact O-N 3.42Å; L1621-M1673 HydrophobicContact CB-SD 4.39Å; L1621-M1673 HydrophobicContact CD2-SD 3.88Å; L1621-M1673 HydrophobicContact CG-SD 3.96Å; L1621-L1684 HydrophobicContact CD2-CD1 3.76Å
1622	G	95.8	Very high	94.7	Very high	0 Å²	0	8.5 Å²	8.5	0%	0	4%	0.039	C	C	.	.	H	α-helix	trans	-64.9	-43.5	171.8	0	0	0	0	0	113	I1618 W1619 L1624 L1625 Y1626	I1618-G1622 PolarHBondContact O-N 2.9Å; W1619-G1622 WeakPolarHBondContact O-CA 2.82Å; W1619-G1622 PolarHBondContact O-N 3.41Å; G1622-L1624 VanDerWaalsContact C-N 3.29Å; G1622-L1624 PolarHBondContact O-N 3.49Å; G1622-L1625 PolarHBondContact O-N 3.25Å; G1622-Y1626 WeakPolarHBondContact O-CB 3.17Å; G1622-Y1626 PolarHBondContact O-N 3.2Å
1623	C	94.9	Very high	94.6	Very high	0 Å²	0	8.4 Å²	8.4	0%	0	4%	0.039	C	C	.	.	H	α-helix	trans	-61.9	-37.3	172.2	-69	0	0	0	0	112	Y1598 W1619 S1620 A1627 P1634	Y1598-C1623 HydrophobicContact CD1-CB 3.45Å; Y1598-C1623 VanDerWaalsContact CD1-CB 3.45Å; Y1598-C1623 HydrophobicContact CE1-CB 3.74Å; Y1598-C1623 HydrophobicContact CG-CB 4.28Å; W1619-C1623 PolarHBondContact O-N 3.25Å; S1620-C1623 WeakPolarHBondContact O-CB 3.47Å; S1620-C1623 PolarHBondContact O-N 2.92Å; C1623-A1627 WeakPolarHBondContact O-CB 3.41Å; C1623-A1627 PolarHBondContact O-N 3.21Å; C1623-P1634 HydrophobicContact CB-CG 4.4Å
1624	L	96.7	Very high	94.2	Very high	0 Å²	0	8.8 Å²	8.8	0%	0	4%	0.042	C	C	.	.	H	α-helix	trans	-68.3	-45.4	177.6	-165.4	160.7	0	0	0	111.4	I1528 L1548 T1550 V1553 Y1598 S1620 L1621 G1622 Y1626 A1627 L1628	I1528-L1624 HydrophobicContact CD1-CD1 4.41Å; I1528-L1624 HydrophobicContact CD1-CD2 3.54Å; L1548-L1624 HydrophobicContact CD1-CD1 4.26Å; L1548-L1624 HydrophobicContact CG-CD1 3.97Å; T1550-L1624 HydrophobicContact CG2-CG 4.08Å; V1553-L1624 HydrophobicContact CG2-CD1 3.97Å; Y1598-L1624 HydrophobicContact CE1-CB 4.28Å; S1620-L1624 WeakPolarHBondContact O-CB 3.32Å; S1620-L1624 PolarHBondContact O-N 3.32Å; L1621-L1624 PolarHBondContact O-N 3.42Å; G1622-L1624 VanDerWaalsContact C-N 3.29Å; G1622-L1624 PolarHBondContact O-N 3.49Å; L1624-Y1626 VanDerWaalsContact C-N 3.32Å; L1624-Y1626 PolarHBondContact O-N 2.69Å; L1624-A1627 CarbonylContact O-C 3.55Å; L1624-A1627 PolarHBondContact O-N 3.15Å; L1624-A1627 VanDerWaalsContact O-N 3.13Å; L1624-L1628 HydrophobicContact CD2-CD1 3.7Å; L1624-L1628 HydrophobicContact CD2-CG 4.01Å; L1624-L1628 PolarHBondContact O-N 2.85Å
1625	L	97.1	Very high	93.8	Very high	0 Å²	0	8.3 Å²	8.3	0%	0	4%	0.04	C	C	.	.	H	α-helix	trans	-62.3	-41.2	175.4	-175.7	56.2	0	0	0	111.7	V1521 F1525 L1621 G1622 A1627 L1628 C1629 M1666 L1669 I1670 M1673	V1521-L1625 HydrophobicContact CG1-CD1 3.62Å; F1525-L1625 HydrophobicContact CB-CD1 4.15Å; F1525-L1625 HydrophobicContact CD1-CD1 4.3Å; F1525-L1625 HydrophobicContact CD1-CD2 4.3Å; F1525-L1625 HydrophobicContact CD2-CB 3.96Å; F1525-L1625 HydrophobicContact CD2-CD1 3.78Å; F1525-L1625 HydrophobicContact CD2-CD2 4.43Å; F1525-L1625 HydrophobicContact CD2-CG 4.26Å; F1525-L1625 HydrophobicContact CE1-CD2 4.03Å; F1525-L1625 HydrophobicContact CE2-CB 3.67Å; F1525-L1625 HydrophobicContact CE2-CD1 4.25Å; F1525-L1625 HydrophobicContact CE2-CD2 4.15Å; F1525-L1625 HydrophobicContact CE2-CG 4.23Å; F1525-L1625 HydrophobicContact CG-CD1 3.81Å; F1525-L1625 HydrophobicContact CZ-CB 4.24Å; F1525-L1625 HydrophobicContact CZ-CD2 3.96Å; L1621-L1625 PolarHBondContact O-N 3.42Å; G1622-L1625 PolarHBondContact O-N 3.25Å; L1625-A1627 VanDerWaalsContact C-N 3.32Å; L1625-A1627 PolarHBondContact O-N 2.78Å; L1625-L1628 WeakPolarHBondContact O-CB 3.37Å; L1625-L1628 PolarHBondContact O-N 3.34Å; L1625-C1629 PolarHBondContact O-N 3.37Å; L1625-M1666 HydrophobicContact CD1-SD 3.84Å; L1625-M1666 HydrophobicContact CD2-SD 3.88Å; L1625-M1666 HydrophobicContact CG-SD 4.11Å; L1625-L1669 HydrophobicContact CD2-CD2 3.92Å; L1625-L1669 HydrophobicContact CD2-CG 3.99Å; L1625-I1670 HydrophobicContact CB-CG1 4.2Å; L1625-I1670 HydrophobicContact CD2-CG1 3.65Å; L1625-I1670 HydrophobicContact CG-CD1 4.26Å; L1625-I1670 HydrophobicContact CG-CG1 3.67Å; L1625-M1673 HydrophobicContact CB-CE 4.14Å; L1625-M1673 HydrophobicContact CD2-CE 3.54Å; L1625-M1673 HydrophobicContact CG-CE 4.5Å
1626	Y	95.3	Very high	93	Very high	23 Å²	23	8.3 Å²	8.3	9%	0.09	4%	0.041	C	C	.	.	H	α-helix	trans	-58.5	-43.9	172.4	-178.3	-78.9	0	0	0	111.3	G1622 L1624 C1629 F1630 V1632 P1634 V1655 I1656 I1670	G1622-Y1626 WeakPolarHBondContact O-CB 3.17Å; G1622-Y1626 PolarHBondContact O-N 3.2Å; L1624-Y1626 VanDerWaalsContact C-N 3.32Å; L1624-Y1626 PolarHBondContact O-N 2.69Å; Y1626-C1629 CarbonylContact O-C 3.54Å; Y1626-C1629 PolarHBondContact O-N 2.94Å; Y1626-C1629 VanDerWaalsContact O-N 3.16Å; Y1626-F1630 HydrophobicContact CD1-CB 4.35Å; Y1626-F1630 HydrophobicContact CD1-CD2 4.04Å; Y1626-F1630 AromaticContact CD2-CD2 3.56Å; Y1626-F1630 HydrophobicContact CD2-CD2 3.56Å; Y1626-F1630 AromaticContact CD2-CE2 3.88Å; Y1626-F1630 HydrophobicContact CD2-CE2 3.88Å; Y1626-F1630 HydrophobicContact CE1-CB 3.88Å; Y1626-F1630 AromaticContact CE1-CD2 3.94Å; Y1626-F1630 HydrophobicContact CE1-CD2 3.94Å; Y1626-F1630 HydrophobicContact CE1-CG 4.32Å; Y1626-F1630 AromaticContact CE2-CD2 3.44Å; Y1626-F1630 HydrophobicContact CE2-CD2 3.44Å; Y1626-F1630 VanDerWaalsContact CE2-CD2 3.44Å; Y1626-F1630 AromaticContact CE2-CE2 3.84Å; Y1626-F1630 HydrophobicContact CE2-CE2 3.84Å; Y1626-F1630 HydrophobicContact CE2-CG 4.32Å; Y1626-F1630 AromaticContact CG-CD2 3.86Å; Y1626-F1630 HydrophobicContact CG-CD2 3.86Å; Y1626-F1630 AromaticContact CZ-CD2 3.64Å; Y1626-F1630 VanDerWaalsContact O-CD2 3.32Å; Y1626-F1630 WeakPolarHBondContact O-CD2 3.5Å; Y1626-F1630 PolarHBondContact O-N 2.99Å; Y1626-V1632 WeakPolarHBondContact CD1-O 3.39Å; Y1626-V1632 WeakPolarHBondContact CE1-O 3.25Å; Y1626-P1634 HydrophobicContact CD1-CB 3.77Å; Y1626-P1634 VanDerWaalsContact CD1-CD 3.45Å; Y1626-P1634 HydrophobicContact CD1-CG 4.07Å; Y1626-P1634 HydrophobicContact CD2-CB 4.04Å; Y1626-P1634 HydrophobicContact CE1-CB 3.87Å; Y1626-P1634 HydrophobicContact CE2-CB 4.14Å; Y1626-P1634 HydrophobicContact CG-CB 3.87Å; Y1626-P1634 HydrophobicContact CG-CG 4.04Å; Y1626-V1655 HydrophobicContact CD2-CG1 4.01Å; Y1626-V1655 HydrophobicContact CE2-CG1 3.64Å; Y1626-V1655 VanDerWaalsContact CE2-O 3.32Å; Y1626-V1655 WeakPolarHBondContact CE2-O 3.33Å; Y1626-V1655 PolarHBondContact OH-O 2.65Å; Y1626-V1655 VanDerWaalsContact OH-O 3.09Å; Y1626-I1656 HydrophobicContact CD2-CD1 3.96Å; Y1626-I1656 HydrophobicContact CE2-CD1 4.04Å; Y1626-I1670 HydrophobicContact CD2-CG2 4.32Å
1627	A	95.2	Very high	91.8	Very high	0 Å²	0	13.4 Å²	13.4	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-68.1	-33.6	177	0	0	0	0	0	113.4	L1506 T1550 Y1598 C1623 L1624 L1625 C1629 W1631 V1632	L1506-A1627 HydrophobicContact CD1-CB 4.37Å; L1506-A1627 WeakPolarHBondContact CD1-O 3.43Å; T1550-A1627 HydrophobicContact CG2-CB 3.7Å; Y1598-A1627 WeakPolarHBondContact OH-CB 3.43Å; C1623-A1627 WeakPolarHBondContact O-CB 3.41Å; C1623-A1627 PolarHBondContact O-N 3.21Å; L1624-A1627 CarbonylContact O-C 3.55Å; L1624-A1627 PolarHBondContact O-N 3.15Å; L1624-A1627 VanDerWaalsContact O-N 3.13Å; L1625-A1627 VanDerWaalsContact C-N 3.32Å; L1625-A1627 PolarHBondContact O-N 2.78Å; A1627-C1629 VanDerWaalsContact C-N 3.26Å; A1627-C1629 PolarHBondContact O-N 2.59Å; A1627-W1631 CarbonylContact O-C 3.53Å; A1627-W1631 WeakPolarHBondContact O-CA 3.33Å; A1627-W1631 PolarHBondContact O-N 3.28Å; A1627-V1632 WeakPolarHBondContact CA-O 3.35Å
1628	L	96.2	Very high	90.4	Very high	0 Å²	0	13.8 Å²	13.8	0%	0	7%	0.068	C	C	.	.	H	α-helix	trans	-61.5	-36.2	169.5	-79.1	172.4	0	0	0	112.1	I1502 I1516 V1521 F1525 I1528 L1624 L1625	I1502-L1628 HydrophobicContact CD1-CD2 4.27Å; I1502-L1628 HydrophobicContact CG2-CD2 3.6Å; I1516-L1628 HydrophobicContact CD1-CD2 3.99Å; V1521-L1628 HydrophobicContact CG1-CB 4.22Å; F1525-L1628 HydrophobicContact CB-CD1 4.42Å; I1528-L1628 HydrophobicContact CD1-CD1 4.35Å; L1624-L1628 HydrophobicContact CD2-CD1 3.7Å; L1624-L1628 HydrophobicContact CD2-CG 4.01Å; L1624-L1628 PolarHBondContact O-N 2.85Å; L1625-L1628 WeakPolarHBondContact O-CB 3.37Å; L1625-L1628 PolarHBondContact O-N 3.34Å
1629	C	94.9	Very high	88.6	Confident	0 Å²	0	16.1 Å²	16.1	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-76.9	-46	176.6	-74.9	0	0	0	0	113	F1515 L1625 Y1626 A1627 Y1662	F1515-C1629 WeakPolarHBondContact CD1-O 3.35Å; L1625-C1629 PolarHBondContact O-N 3.37Å; Y1626-C1629 CarbonylContact O-C 3.54Å; Y1626-C1629 PolarHBondContact O-N 2.94Å; Y1626-C1629 VanDerWaalsContact O-N 3.16Å; A1627-C1629 VanDerWaalsContact C-N 3.26Å; A1627-C1629 PolarHBondContact O-N 2.59Å; C1629-Y1662 WeakPolarHBondContact CA-OH 3.43Å; C1629-Y1662 HydrophobicContact CB-CD2 3.78Å; C1629-Y1662 HydrophobicContact CB-CE2 3.47Å; C1629-Y1662 VanDerWaalsContact CB-CE2 3.47Å; C1629-Y1662 HydrophobicContact CB-CG 4.45Å; C1629-Y1662 WeakPolarHBondContact O-CE2 3.44Å; C1629-Y1662 PolarHBondContact O-OH 3.03Å
1630	F	92.6	Very high	86.6	Confident	10 Å²	10	22.8 Å²	22.8	4%	0.044	12%	0.117	C	C	.	.	H	α-helix	trans	-125.6	24	-164.2	-49.8	-69.5	0	0	0	113.9	F1515 Y1626 V1632 I1656 P1657 S1660 Y1662 I1670	F1515-F1630 HydrophobicContact CE1-CD1 4.33Å; Y1626-F1630 HydrophobicContact CD1-CB 4.35Å; Y1626-F1630 HydrophobicContact CD1-CD2 4.04Å; Y1626-F1630 AromaticContact CD2-CD2 3.56Å; Y1626-F1630 HydrophobicContact CD2-CD2 3.56Å; Y1626-F1630 AromaticContact CD2-CE2 3.88Å; Y1626-F1630 HydrophobicContact CD2-CE2 3.88Å; Y1626-F1630 HydrophobicContact CE1-CB 3.88Å; Y1626-F1630 AromaticContact CE1-CD2 3.94Å; Y1626-F1630 HydrophobicContact CE1-CD2 3.94Å; Y1626-F1630 HydrophobicContact CE1-CG 4.32Å; Y1626-F1630 AromaticContact CE2-CD2 3.44Å; Y1626-F1630 HydrophobicContact CE2-CD2 3.44Å; Y1626-F1630 VanDerWaalsContact CE2-CD2 3.44Å; Y1626-F1630 AromaticContact CE2-CE2 3.84Å; Y1626-F1630 HydrophobicContact CE2-CE2 3.84Å; Y1626-F1630 HydrophobicContact CE2-CG 4.32Å; Y1626-F1630 AromaticContact CG-CD2 3.86Å; Y1626-F1630 HydrophobicContact CG-CD2 3.86Å; Y1626-F1630 AromaticContact CZ-CD2 3.64Å; Y1626-F1630 VanDerWaalsContact O-CD2 3.32Å; Y1626-F1630 WeakPolarHBondContact O-CD2 3.5Å; Y1626-F1630 PolarHBondContact O-N 2.99Å; F1630-V1632 PolarHBondContact O-N 2.85Å; F1630-I1656 HydrophobicContact CE2-CD1 3.69Å; F1630-I1656 HydrophobicContact CZ-CD1 4.19Å; F1630-I1656 HydrophobicContact CZ-CG2 4.08Å; F1630-P1657 HydrophobicContact CD1-CG 3.84Å; F1630-P1657 HydrophobicContact CE1-CG 4.02Å; F1630-P1657 HydrophobicContact CG-CG 4.24Å; F1630-S1660 VanDerWaalsContact CE1-OG 3.32Å; F1630-S1660 WeakPolarHBondContact CE1-OG 3.19Å; F1630-S1660 WeakPolarHBondContact CZ-OG 3.43Å; F1630-Y1662 AromaticContact CE1-CD2 4Å; F1630-Y1662 HydrophobicContact CE1-CD2 4Å; F1630-Y1662 HydrophobicContact CE1-CE2 4.15Å; F1630-Y1662 HydrophobicContact CZ-CD2 4.09Å; F1630-I1670 HydrophobicContact CE2-CD1 4.25Å
1631	W	91.8	Very high	84.2	Confident	41 Å²	41	31.1 Å²	31.1	16%	0.155	15%	0.147	C	C	.	.	S	Bend	trans	64.1	-25.4	173.4	-43	-81.8	0	0	0	118.5	R1509 L1510 D1514 F1515 A1627	R1509-W1631 VanDerWaalsContact CB-CD1 3.49Å; L1510-W1631 HydrophobicContact CB-CB 3.96Å; L1510-W1631 HydrophobicContact CB-CG 4.18Å; L1510-W1631 HydrophobicContact CD1-CB 4.08Å; L1510-W1631 HydrophobicContact CD1-CD2 4.34Å; L1510-W1631 HydrophobicContact CD1-CE3 4.18Å; L1510-W1631 HydrophobicContact CD1-CG 4.33Å; L1510-W1631 HydrophobicContact CG-CB 4.47Å; D1514-W1631 PolarHBondContact O-NE1 2.84Å; F1515-W1631 AromaticContact CD1-CH2 3.73Å; F1515-W1631 HydrophobicContact CD1-CH2 3.73Å; F1515-W1631 AromaticContact CD1-CZ2 3.55Å; F1515-W1631 HydrophobicContact CD1-CZ2 3.55Å; F1515-W1631 HydrophobicContact CD1-CZ3 4.5Å; F1515-W1631 HydrophobicContact CD2-CH2 4.03Å; F1515-W1631 AromaticContact CD2-CZ2 3.86Å; F1515-W1631 HydrophobicContact CD2-CZ2 3.86Å; F1515-W1631 AromaticContact CE1-CH2 3.27Å; F1515-W1631 HydrophobicContact CE1-CH2 3.27Å; F1515-W1631 AromaticContact CE1-CZ2 3.64Å; F1515-W1631 HydrophobicContact CE1-CZ2 3.64Å; F1515-W1631 AromaticContact CE1-CZ3 3.84Å; F1515-W1631 HydrophobicContact CE1-CZ3 3.84Å; F1515-W1631 AromaticContact CE2-CH2 3.6Å; F1515-W1631 HydrophobicContact CE2-CH2 3.6Å; F1515-W1631 AromaticContact CE2-CZ2 3.94Å; F1515-W1631 HydrophobicContact CE2-CZ2 3.94Å; F1515-W1631 HydrophobicContact CG-CH2 4.11Å; F1515-W1631 AromaticContact CG-CZ2 3.7Å; F1515-W1631 HydrophobicContact CG-CZ2 3.7Å; F1515-W1631 AromaticContact CZ-CH2 3.22Å; F1515-W1631 HydrophobicContact CZ-CH2 3.22Å; F1515-W1631 AromaticContact CZ-CZ2 3.86Å; F1515-W1631 HydrophobicContact CZ-CZ2 3.86Å; F1515-W1631 AromaticContact CZ-CZ3 3.98Å; F1515-W1631 HydrophobicContact CZ-CZ3 3.98Å; A1627-W1631 CarbonylContact O-C 3.53Å; A1627-W1631 WeakPolarHBondContact O-CA 3.33Å; A1627-W1631 PolarHBondContact O-N 3.28Å
1632	V	89.2	Confident	81.4	Confident	28 Å²	28	34 Å²	34	17%	0.17	18%	0.177	C	C	.	.	S	Bend	trans	-128.8	160.2	179.8	-65.6	0	0	0	0	110.7	L1510 Y1626 A1627 F1630 E1636	L1510-V1632 HydrophobicContact CD2-CG1 4.19Å; Y1626-V1632 WeakPolarHBondContact CD1-O 3.39Å; Y1626-V1632 WeakPolarHBondContact CE1-O 3.25Å; A1627-V1632 WeakPolarHBondContact CA-O 3.35Å; F1630-V1632 PolarHBondContact O-N 2.85Å; V1632-E1636 WeakPolarHBondContact CB-OE2 3.42Å
1633	S	89	Confident	79.3	Confident	2 Å²	2	37.6 Å²	37.6	1%	0.014	20%	0.197	C	C	.	.			trans	-66.7	153.2	175.4	125.3	0	0	0	0	111.5	Y1597 F1635 E1636	Y1597-S1633 PolarHBondContact O-OG 2.64Å; S1633-F1635 PolarHBondContact O-N 3.14Å; S1633-F1635 VanDerWaalsContact O-N 3.09Å; S1633-F1635 PolarHBondContact OG-N 3.41Å; S1633-E1636 PolarHBondContact N-OE2 2.81Å; S1633-E1636 PolarHBondContact O-N 3.42Å; S1633-E1636 PolarHBondContact OG-N 3.28Å
1634	P	86.5	Confident	77.5	Confident	25 Å²	25	39.3 Å²	39.3	16%	0.162	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-16.8	-178.4	25.7	-31.9	0	0	0	113.5	C1623 Y1626 V1655 L1674	C1623-P1634 HydrophobicContact CB-CG 4.4Å; Y1626-P1634 HydrophobicContact CD1-CB 3.77Å; Y1626-P1634 VanDerWaalsContact CD1-CD 3.45Å; Y1626-P1634 HydrophobicContact CD1-CG 4.07Å; Y1626-P1634 HydrophobicContact CD2-CB 4.04Å; Y1626-P1634 HydrophobicContact CE1-CB 3.87Å; Y1626-P1634 HydrophobicContact CE2-CB 4.14Å; Y1626-P1634 HydrophobicContact CG-CB 3.87Å; Y1626-P1634 HydrophobicContact CG-CG 4.04Å; P1634-V1655 HydrophobicContact CB-CG1 3.48Å; P1634-V1655 VanDerWaalsContact CB-CG1 3.48Å; P1634-L1674 HydrophobicContact CG-CD1 4.21Å
1635	F	85.5	Confident	75.8	Confident	4 Å²	4	39.4 Å²	39.4	2%	0.018	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-114.7	-4.3	-178.7	-46.5	-65	0	0	0	113.6	W1619 S1633 Q1637 A1638 V1639 L1645 M1648 H1649 L1652	W1619-F1635 AromaticContact CE2-CE2 3.99Å; W1619-F1635 HydrophobicContact CH2-CE2 4.19Å; W1619-F1635 AromaticContact CH2-CZ 3.92Å; W1619-F1635 HydrophobicContact CH2-CZ 3.92Å; W1619-F1635 HydrophobicContact CZ2-CD2 4.44Å; W1619-F1635 AromaticContact CZ2-CE2 3.4Å; W1619-F1635 HydrophobicContact CZ2-CE2 3.4Å; W1619-F1635 AromaticContact CZ2-CZ 3.57Å; W1619-F1635 HydrophobicContact CZ2-CZ 3.57Å; S1633-F1635 PolarHBondContact O-N 3.14Å; S1633-F1635 VanDerWaalsContact O-N 3.09Å; S1633-F1635 PolarHBondContact OG-N 3.41Å; F1635-Q1637 PolarHBondContact O-N 2.99Å; F1635-A1638 WeakPolarHBondContact O-CB 3.46Å; F1635-A1638 PolarHBondContact O-N 3.36Å; F1635-A1638 VanDerWaalsContact O-N 3.08Å; F1635-V1639 PolarHBondContact O-N 3.26Å; F1635-L1645 HydrophobicContact CB-CD2 3.49Å; F1635-L1645 VanDerWaalsContact CB-CD2 3.49Å; F1635-L1645 HydrophobicContact CG-CD2 4.08Å; F1635-M1648 HydrophobicContact CD1-CB 4.47Å; F1635-H1649 AromaticContact CD1-CD2 3.88Å; F1635-H1649 AromaticContact CD2-CD2 3.85Å; F1635-H1649 AromaticContact CD2-NE2 3.57Å; F1635-H1649 AromaticContact CE1-CD2 3.78Å; F1635-H1649 AromaticContact CE2-CD2 3.75Å; F1635-H1649 AromaticContact CE2-NE2 3.79Å; F1635-H1649 AromaticContact CG-CD2 3.92Å; F1635-H1649 AromaticContact CG-NE2 3.86Å; F1635-H1649 AromaticContact CZ-CD2 3.71Å; F1635-L1652 HydrophobicContact CE1-CD2 4.1Å; F1635-L1652 HydrophobicContact CZ-CD2 3.87Å
1636	E	79	Confident	73.9	Confident	33 Å²	33	41.3 Å²	41.3	15%	0.154	22%	0.221	C	C	.	.	H	α-helix	trans	-61.1	-41.8	-176.7	-170.3	169.7	172.8	0	0	112.1	Y1597 V1632 S1633 A1638 V1639 L1640	Y1597-E1636 HydrophobicContact CD2-CB 3.91Å; Y1597-E1636 HydrophobicContact CD2-CG 4.01Å; Y1597-E1636 HydrophobicContact CE2-CB 4.26Å; Y1597-E1636 HydrophobicContact CE2-CG 3.86Å; Y1597-E1636 HydrophobicContact CG-CB 4.28Å; Y1597-E1636 HydrophobicContact CG-CG 4.43Å; V1632-E1636 WeakPolarHBondContact CB-OE2 3.42Å; S1633-E1636 PolarHBondContact N-OE2 2.81Å; S1633-E1636 PolarHBondContact O-N 3.42Å; S1633-E1636 PolarHBondContact OG-N 3.28Å; E1636-A1638 VanDerWaalsContact C-N 3.29Å; E1636-A1638 PolarHBondContact O-N 2.95Å; E1636-V1639 PolarHBondContact O-N 3.48Å; E1636-L1640 WeakPolarHBondContact O-CG 3.48Å; E1636-L1640 PolarHBondContact O-N 3.34Å; E1636-L1640 VanDerWaalsContact O-N 3.15Å
1637	Q	68.4	Low	71.9	Confident	109 Å²	109	45.8 Å²	45.8	51%	0.509	25%	0.246	S	C	.	.	H	α-helix	trans	-65.5	-29.3	175.3	-66.2	-168.1	11.2	0	0	113.6	F1635 L1640 R1641	F1635-Q1637 PolarHBondContact O-N 2.99Å; Q1637-L1640 PolarHBondContact O-N 2.85Å; Q1637-R1641 WeakPolarHBondContact O-CG 3.4Å; Q1637-R1641 PolarHBondContact O-N 3.49Å; Q1637-R1641 VanDerWaalsContact O-N 3.15Å
1638	A	65.8	Low	70.3	Confident	8 Å²	8	48.7 Å²	48.7	7%	0.066	26%	0.261	C	S	.	.	H	α-helix	trans	-69.6	-42.6	177.9	0	0	0	0	0	110.7	F1635 E1636 L1640 R1641 G1642 D1643 M1648	F1635-A1638 WeakPolarHBondContact O-CB 3.46Å; F1635-A1638 PolarHBondContact O-N 3.36Å; F1635-A1638 VanDerWaalsContact O-N 3.08Å; E1636-A1638 VanDerWaalsContact C-N 3.29Å; E1636-A1638 PolarHBondContact O-N 2.95Å; A1638-L1640 VanDerWaalsContact C-N 3.33Å; A1638-L1640 PolarHBondContact O-N 3.01Å; A1638-R1641 CarbonylContact O-C 3.49Å; A1638-R1641 PolarHBondContact O-N 3.16Å; A1638-R1641 VanDerWaalsContact O-N 3.1Å; A1638-G1642 PolarHBondContact O-N 2.89Å; A1638-D1643 HydrophobicContact CB-CB 4.07Å; A1638-D1643 PolarHBondContact O-N 3.42Å; A1638-M1648 HydrophobicContact CB-CG 4.14Å; A1638-M1648 HydrophobicContact CB-SD 3.46Å; A1638-M1648 WeakPolarHBondContact CB-SD 3.05Å
1639	V	59.6	Low	68.6	Low	49 Å²	49	48.8 Å²	48.8	30%	0.297	26%	0.261	S	S	.	.	H	α-helix	trans	-61.2	-42.2	173.7	-176.5	0	0	0	0	111.3	M1596 Y1597 F1635 E1636 R1641 G1642 L1645	M1596-V1639 HydrophobicContact SD-CG1 4.47Å; Y1597-V1639 HydrophobicContact CD1-CG2 4.26Å; F1635-V1639 PolarHBondContact O-N 3.26Å; E1636-V1639 PolarHBondContact O-N 3.48Å; V1639-R1641 PolarHBondContact O-N 3.1Å; V1639-G1642 PolarHBondContact O-N 2.85Å; V1639-L1645 HydrophobicContact CG2-CD1 3.36Å; V1639-L1645 HydrophobicContact CG2-CD2 4.26Å; V1639-L1645 HydrophobicContact CG2-CG 3.74Å
1640	L	52.3	Low	66.9	Low	141 Å²	141	55.1 Å²	55.1	74%	0.738	29%	0.294	S	S	*	.	H	α-helix	trans	-65.5	-21.8	176.7	-67.6	171.3	0	0	0	113.4	E1636 Q1637 A1638	E1636-L1640 WeakPolarHBondContact O-CG 3.48Å; E1636-L1640 PolarHBondContact O-N 3.34Å; E1636-L1640 VanDerWaalsContact O-N 3.15Å; Q1637-L1640 PolarHBondContact O-N 2.85Å; A1638-L1640 VanDerWaalsContact C-N 3.33Å; A1638-L1640 PolarHBondContact O-N 3.01Å
1641	R	45.5	Very low	65.3	Low	180 Å²	180	57.4 Å²	57.4	68%	0.679	31%	0.312	S	S	*	.	H	α-helix	trans	-89	-13.9	171.7	-70	173.5	-169.3	166.6	8.9	113.8	Q1637 A1638 V1639	Q1637-R1641 WeakPolarHBondContact O-CG 3.4Å; Q1637-R1641 PolarHBondContact O-N 3.49Å; Q1637-R1641 VanDerWaalsContact O-N 3.15Å; A1638-R1641 CarbonylContact O-C 3.49Å; A1638-R1641 PolarHBondContact O-N 3.16Å; A1638-R1641 VanDerWaalsContact O-N 3.1Å; V1639-R1641 PolarHBondContact O-N 3.1Å
1642	G	38.6	Very low	64	Low	61 Å²	61	57 Å²	57	63%	0.629	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.2	13.6	-174.7	0	0	0	0	0	114.6	A1638 V1639	A1638-G1642 PolarHBondContact O-N 2.89Å; V1639-G1642 PolarHBondContact O-N 2.85Å
1643	D	50.6	Low	62.5	Low	75 Å²	75	65 Å²	65	40%	0.401	35%	0.345	S	S	.	.			trans	-69.5	149.3	179.4	-67.8	-46.4	0	0	0	112	A1638 L1645 M1648	A1638-D1643 HydrophobicContact CB-CB 4.07Å; A1638-D1643 PolarHBondContact O-N 3.42Å; D1643-L1645 PolarHBondContact O-N 3.28Å; D1643-M1648 HydrophobicContact CB-CG 4.36Å; D1643-M1648 HydrophobicContact CB-SD 4.42Å
1644	S	57.1	Low	61.1	Low	36 Å²	36	74 Å²	74	25%	0.252	39%	0.386	S	S	.	.			trans	-71.8	101.2	177.1	179.2	0	0	0	0	111.4	L1647 M1648	S1644-L1647 WeakPolarHBondContact O-CB 3.43Å; S1644-L1647 PolarHBondContact O-N 2.9Å; S1644-M1648 PolarHBondContact O-N 2.95Å
1645	L	61.1	Low	60.4	Low	3 Å²	3	73.9 Å²	73.9	2%	0.016	39%	0.385	C	S	.	.	H	α-helix	trans	-44.3	-49.9	173.4	-98.9	165.3	0	0	0	114.1	M1596 F1604 F1635 V1639 D1643 L1647 M1648 H1649	M1596-L1645 HydrophobicContact CB-CD1 4.22Å; M1596-L1645 HydrophobicContact CE-CD1 3.81Å; M1596-L1645 HydrophobicContact CG-CD1 3.51Å; M1596-L1645 HydrophobicContact SD-CD1 3.66Å; F1604-L1645 HydrophobicContact CE1-CB 4.38Å; F1604-L1645 HydrophobicContact CZ-CB 4.43Å; F1604-L1645 HydrophobicContact CZ-CD1 4.41Å; F1635-L1645 HydrophobicContact CB-CD2 3.49Å; F1635-L1645 VanDerWaalsContact CB-CD2 3.49Å; F1635-L1645 HydrophobicContact CG-CD2 4.08Å; V1639-L1645 HydrophobicContact CG2-CD1 3.36Å; V1639-L1645 HydrophobicContact CG2-CD2 4.26Å; V1639-L1645 HydrophobicContact CG2-CG 3.74Å; D1643-L1645 PolarHBondContact O-N 3.28Å; L1645-L1647 PolarHBondContact O-N 2.92Å; L1645-M1648 PolarHBondContact O-N 3.36Å; L1645-M1648 VanDerWaalsContact O-N 3.1Å; L1645-H1649 VanDerWaalsContact CD2-NE2 3.32Å; L1645-H1649 WeakPolarHBondContact CD2-NE2 3.13Å; L1645-H1649 PolarHBondContact O-CD2 2.96Å; L1645-H1649 VanDerWaalsContact O-CG 3.24Å; L1645-H1649 PolarHBondContact O-N 2.93Å
1646	P	58.4	Low	60.2	Low	39 Å²	39	75 Å²	75	25%	0.253	39%	0.391	S	S	.	.	H	α-helix	trans	-56.8	-34.3	177.6	-27.9	35.8	0	0	0	114.3	F1604	F1604-P1646 HydrophobicContact CB-CG 4.45Å; F1604-P1646 HydrophobicContact CD1-CG 3.96Å; F1604-P1646 HydrophobicContact CE1-CG 4.48Å; F1604-P1646 HydrophobicContact CG-CG 4.28Å
1647	L	53	Low	60.3	Low	117 Å²	117	76 Å²	76	61%	0.613	40%	0.401	S	S	*	.	H	α-helix	trans	-75.9	-40.7	175.2	-64.1	178.3	0	0	0	111.6	S1644 L1645 H1649 L1650 S1651	S1644-L1647 WeakPolarHBondContact O-CB 3.43Å; S1644-L1647 PolarHBondContact O-N 2.9Å; L1645-L1647 PolarHBondContact O-N 2.92Å; L1647-H1649 VanDerWaalsContact C-N 3.29Å; L1647-H1649 PolarHBondContact O-N 2.68Å; L1647-L1650 WeakPolarHBondContact O-CB 3.5Å; L1647-L1650 PolarHBondContact O-N 3.4Å; L1647-L1650 VanDerWaalsContact O-N 3.08Å; L1647-S1651 PolarHBondContact O-N 3.25Å
1648	M	60.4	Low	60.8	Low	62 Å²	62	78.4 Å²	78.4	31%	0.305	42%	0.415	S	S	.	.	H	α-helix	trans	-60.9	-37.2	176.2	-72.4	-112	61.9	0	0	112.5	F1635 A1638 D1643 S1644 L1645 L1650 S1651	F1635-M1648 HydrophobicContact CD1-CB 4.47Å; A1638-M1648 HydrophobicContact CB-CG 4.14Å; A1638-M1648 HydrophobicContact CB-SD 3.46Å; A1638-M1648 WeakPolarHBondContact CB-SD 3.05Å; D1643-M1648 HydrophobicContact CB-CG 4.36Å; D1643-M1648 HydrophobicContact CB-SD 4.42Å; S1644-M1648 PolarHBondContact O-N 2.95Å; L1645-M1648 PolarHBondContact O-N 3.36Å; L1645-M1648 VanDerWaalsContact O-N 3.1Å; M1648-L1650 PolarHBondContact O-N 3.38Å; M1648-S1651 CarbonylContact O-C 3.35Å; M1648-S1651 PolarHBondContact O-N 2.91Å; M1648-S1651 PolarHBondContact O-OG 3.43Å
1649	H	61.8	Low	61.4	Low	2 Å²	2	86.2 Å²	86.2	1%	0.009	45%	0.45	C	S	.	.	H	α-helix	trans	-60.7	-31.3	174.7	-67.5	177	0	0	0	112.7	P1601 F1604 W1619 F1635 L1645 L1647 S1651 P1676	P1601-H1649 HydrophobicContact CG-CB 4.14Å; F1604-H1649 AromaticContact CE2-CE1 3.56Å; F1604-H1649 AromaticContact CE2-ND1 3.99Å; F1604-H1649 AromaticContact CZ-CE1 3.91Å; W1619-H1649 HydrophobicContact CH2-CB 4.05Å; W1619-H1649 HydrophobicContact CZ2-CB 4.13Å; W1619-H1649 AromaticContact CZ2-CD2 3.57Å; W1619-H1649 AromaticContact CZ2-CE1 3.98Å; W1619-H1649 AromaticContact CZ2-CG 3.65Å; W1619-H1649 AromaticContact CZ2-ND1 3.93Å; W1619-H1649 AromaticContact CZ2-NE2 3.79Å; F1635-H1649 AromaticContact CD1-CD2 3.88Å; F1635-H1649 AromaticContact CD2-CD2 3.85Å; F1635-H1649 AromaticContact CD2-NE2 3.57Å; F1635-H1649 AromaticContact CE1-CD2 3.78Å; F1635-H1649 AromaticContact CE2-CD2 3.75Å; F1635-H1649 AromaticContact CE2-NE2 3.79Å; F1635-H1649 AromaticContact CG-CD2 3.92Å; F1635-H1649 AromaticContact CG-NE2 3.86Å; F1635-H1649 AromaticContact CZ-CD2 3.71Å; L1645-H1649 VanDerWaalsContact CD2-NE2 3.32Å; L1645-H1649 WeakPolarHBondContact CD2-NE2 3.13Å; L1645-H1649 PolarHBondContact O-CD2 2.96Å; L1645-H1649 VanDerWaalsContact O-CG 3.24Å; L1645-H1649 PolarHBondContact O-N 2.93Å; L1647-H1649 VanDerWaalsContact C-N 3.29Å; L1647-H1649 PolarHBondContact O-N 2.68Å; H1649-S1651 VanDerWaalsContact C-N 3.34Å; H1649-P1676 WeakPolarHBondContact O-CG 3.34Å
1650	L	59.3	Low	62.7	Low	133 Å²	133	85.1 Å²	85.1	70%	0.696	45%	0.445	S	S	*	.	H	α-helix	trans	-80.5	-15.1	175.9	-62.1	170.6	0	0	0	112.8	L1647 M1648 P1676	L1647-L1650 WeakPolarHBondContact O-CB 3.5Å; L1647-L1650 PolarHBondContact O-N 3.4Å; L1647-L1650 VanDerWaalsContact O-N 3.08Å; M1648-L1650 PolarHBondContact O-N 3.38Å; L1650-P1676 HydrophobicContact CD2-CB 4.48Å
1651	S	59.3	Low	64.4	Low	58 Å²	58	82.1 Å²	82.1	41%	0.406	43%	0.433	S	S	.	.			trans	-115	53.9	-173.4	71.7	0	0	0	0	113.6	L1647 M1648 H1649 K1653	L1647-S1651 PolarHBondContact O-N 3.25Å; M1648-S1651 CarbonylContact O-C 3.35Å; M1648-S1651 PolarHBondContact O-N 2.91Å; M1648-S1651 PolarHBondContact O-OG 3.43Å; H1649-S1651 VanDerWaalsContact C-N 3.34Å; S1651-K1653 PolarHBondContact O-N 2.93Å
1652	L	64.2	Low	66.6	Low	31 Å²	31	74.2 Å²	74.2	16%	0.162	40%	0.404	C	S	.	.			trans	-66.3	14.1	179.8	-66.6	164.2	0	0	0	115.9	F1635 Q1654 V1655 L1674 P1676	F1635-L1652 HydrophobicContact CE1-CD2 4.1Å; F1635-L1652 HydrophobicContact CZ-CD2 3.87Å; L1652-Q1654 PolarHBondContact O-N 3.37Å; L1652-V1655 HydrophobicContact CB-CG2 4.33Å; L1652-V1655 HydrophobicContact CD2-CG2 3.94Å; L1652-L1674 WeakPolarHBondContact CD1-O 3.49Å; L1652-L1674 HydrophobicContact CD2-CB 4.44Å; L1652-P1676 HydrophobicContact CD1-CG 3.62Å
1653	K	56.9	Low	69.1	Low	198 Å²	198	72.8 Å²	72.8	86%	0.861	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74	116.4	179.4	-69.4	-178.9	178.5	176.6	0	109.2	S1651	S1651-K1653 PolarHBondContact O-N 2.93Å
1654	Q	59.1	Low	71	Confident	190 Å²	190	75.7 Å²	75.7	89%	0.888	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.9	38.4	178.7	-53.6	179.4	-17.3	0	0	116.4	L1652	L1652-Q1654 PolarHBondContact O-N 3.37Å
1655	V	71.9	Confident	72.6	Confident	23 Å²	23	78.9 Å²	78.9	14%	0.139	40%	0.404	C	S	.	.			trans	-68.9	-36.3	173.7	175.2	0	0	0	0	113.1	Y1626 P1634 L1652 M1671	Y1626-V1655 HydrophobicContact CD2-CG1 4.01Å; Y1626-V1655 HydrophobicContact CE2-CG1 3.64Å; Y1626-V1655 VanDerWaalsContact CE2-O 3.32Å; Y1626-V1655 WeakPolarHBondContact CE2-O 3.33Å; Y1626-V1655 PolarHBondContact OH-O 2.65Å; Y1626-V1655 VanDerWaalsContact OH-O 3.09Å; P1634-V1655 HydrophobicContact CB-CG1 3.48Å; P1634-V1655 VanDerWaalsContact CB-CG1 3.48Å; L1652-V1655 HydrophobicContact CB-CG2 4.33Å; L1652-V1655 HydrophobicContact CD2-CG2 3.94Å; V1655-M1671 HydrophobicContact CB-CE 4.36Å
1656	I	82.7	Confident	74.2	Confident	27 Å²	27	78.8 Å²	78.8	14%	0.138	40%	0.403	C	S	.	.	S	Bend	trans	-82.3	130.7	-178.4	-60.9	-72.7	0	0	0	110.7	Y1626 F1630 H1667 I1670 M1671	Y1626-I1656 HydrophobicContact CD2-CD1 3.96Å; Y1626-I1656 HydrophobicContact CE2-CD1 4.04Å; F1630-I1656 HydrophobicContact CE2-CD1 3.69Å; F1630-I1656 HydrophobicContact CZ-CD1 4.19Å; F1630-I1656 HydrophobicContact CZ-CG2 4.08Å; I1656-H1667 HydrophobicContact CG1-CB 4.49Å; I1656-I1670 HydrophobicContact CD1-CD1 4.04Å; I1656-I1670 HydrophobicContact CD1-CG2 4.24Å; I1656-M1671 HydrophobicContact CG1-CE 3.75Å
1657	P	81.2	Confident	75.8	Confident	55 Å²	55	78.8 Å²	78.8	36%	0.357	40%	0.4	S	S	.	.			trans	-60	139.7	176.2	-25.7	35	0	0	0	114	F1630 H1659 S1660	F1630-P1657 HydrophobicContact CD1-CG 3.84Å; F1630-P1657 HydrophobicContact CE1-CG 4.02Å; F1630-P1657 HydrophobicContact CG-CG 4.24Å; P1657-H1659 PolarHBondContact O-N 3.46Å; P1657-H1659 VanDerWaalsContact O-N 3.15Å; P1657-S1660 PolarHBondContact O-N 3.47Å
1658	I	78.2	Confident	77.7	Confident	159 Å²	159	77.1 Å²	77.1	82%	0.815	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-30.2	-177.9	-60.9	172.3	0	0	0	112.6
1659	H	79.1	Confident	79.3	Confident	171 Å²	171	74.3 Å²	74.3	79%	0.792	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109	43.5	-179.6	-58.8	-57.1	0	0	0	112.2	P1657	P1657-H1659 PolarHBondContact O-N 3.46Å; P1657-H1659 VanDerWaalsContact O-N 3.15Å
1660	S	85.5	Confident	80.8	Confident	27 Å²	27	74.2 Å²	74.2	19%	0.189	38%	0.377	C	S	.	.			trans	-66.7	134.9	173.9	-178.8	0	0	0	0	112	F1630 P1657 Y1662 H1667	F1630-S1660 VanDerWaalsContact CE1-OG 3.32Å; F1630-S1660 WeakPolarHBondContact CE1-OG 3.19Å; F1630-S1660 WeakPolarHBondContact CZ-OG 3.43Å; P1657-S1660 PolarHBondContact O-N 3.47Å; S1660-Y1662 VanDerWaalsContact C-N 3.35Å; S1660-Y1662 PolarHBondContact OG-N 2.88Å; S1660-H1667 WeakPolarHBondContact CB-NE2 3.3Å; S1660-H1667 PolarHBondContact OG-NE2 2.97Å
1661	P	88	Confident	82.3	Confident	77 Å²	77	70.5 Å²	70.5	50%	0.5	36%	0.357	S	S	.	.			trans	-84.8	-4.1	174.3	34.7	-36	0	0	0	114.1	F1515	F1515-P1661 HydrophobicContact CB-CG 4.13Å; F1515-P1661 HydrophobicContact CD1-CG 3.52Å; F1515-P1661 HydrophobicContact CD2-CG 3.85Å; F1515-P1661 HydrophobicContact CE1-CG 3.68Å; F1515-P1661 HydrophobicContact CE2-CG 3.99Å; F1515-P1661 HydrophobicContact CG-CG 3.58Å; F1515-P1661 HydrophobicContact CZ-CG 3.89Å
1662	Y	91.9	Very high	83.9	Confident	15 Å²	15	69 Å²	69	6%	0.059	35%	0.346	C	S	.	.	S	Bend	trans	-89.9	155.8	-177.1	-55.9	-82.1	0	0	0	112.4	F1515 I1516 E1518 V1521 C1629 F1630 S1660 M1666 H1667	F1515-Y1662 AromaticContact CD1-CE2 3.78Å; F1515-Y1662 HydrophobicContact CD1-CE2 3.78Å; F1515-Y1662 HydrophobicContact CE1-CE2 4.29Å; I1516-Y1662 PolarHBondContact N-OH 2.71Å; I1516-Y1662 VanDerWaalsContact O-CE1 3.27Å; I1516-Y1662 WeakPolarHBondContact O-CE1 3.47Å; I1516-Y1662 PolarHBondContact O-OH 2.69Å; E1518-Y1662 HydrophobicContact CB-CD1 4.15Å; E1518-Y1662 HydrophobicContact CG-CD1 4.21Å; E1518-Y1662 WeakPolarHBondContact OE2-CA 3.32Å; V1521-Y1662 HydrophobicContact CG2-CE1 3.89Å; C1629-Y1662 WeakPolarHBondContact CA-OH 3.43Å; C1629-Y1662 HydrophobicContact CB-CD2 3.78Å; C1629-Y1662 HydrophobicContact CB-CE2 3.47Å; C1629-Y1662 VanDerWaalsContact CB-CE2 3.47Å; C1629-Y1662 HydrophobicContact CB-CG 4.45Å; C1629-Y1662 WeakPolarHBondContact O-CE2 3.44Å; C1629-Y1662 PolarHBondContact O-OH 3.03Å; F1630-Y1662 AromaticContact CE1-CD2 4Å; F1630-Y1662 HydrophobicContact CE1-CD2 4Å; F1630-Y1662 HydrophobicContact CE1-CE2 4.15Å; F1630-Y1662 HydrophobicContact CZ-CD2 4.09Å; S1660-Y1662 VanDerWaalsContact C-N 3.35Å; S1660-Y1662 PolarHBondContact OG-N 2.88Å; Y1662-M1666 HydrophobicContact CG-CG 4.48Å; Y1662-H1667 PolarHBondContact O-CE1 2.91Å; Y1662-H1667 PolarHBondContact O-NE2 3.4Å
1663	S	91.7	Very high	85.4	Confident	31 Å²	31	67.5 Å²	67.5	22%	0.217	34%	0.339	C	S	.	.			trans	-56.2	156.1	176.4	68.1	0	0	0	0	113.5	E1518 E1665 M1666 H1667	E1518-S1663 VanDerWaalsContact OE1-CB 3.26Å; E1518-S1663 WeakPolarHBondContact OE1-CB 3.25Å; E1518-S1663 PolarHBondContact OE1-OG 3.32Å; E1518-S1663 PolarHBondContact OE2-N 3.3Å; E1518-S1663 PolarHBondContact OE2-OG 2.68Å; S1663-E1665 PolarHBondContact O-N 3.32Å; S1663-M1666 WeakPolarHBondContact O-CB 3.28Å; S1663-M1666 PolarHBondContact O-N 2.75Å; S1663-M1666 WeakPolarHBondContact OG-CB 3.3Å; S1663-M1666 PolarHBondContact OG-N 2.98Å; S1663-M1666 VanDerWaalsContact OG-N 3.1Å; S1663-H1667 PolarHBondContact O-CD2 2.9Å; S1663-H1667 PolarHBondContact O-N 2.83Å
1664	K	89.4	Confident	87.1	Confident	136 Å²	136	58 Å²	58	59%	0.591	30%	0.298	S	S	*	.	H	α-helix	trans	-63	-36.2	173.5	-175.5	-169.7	168	-163.8	0	110.6	M1666 H1667 D1668	K1664-M1666 VanDerWaalsContact C-N 3.26Å; K1664-M1666 PolarHBondContact O-N 2.83Å; K1664-H1667 WeakPolarHBondContact O-CB 3.47Å; K1664-H1667 PolarHBondContact O-N 2.78Å; K1664-D1668 WeakPolarHBondContact CE-OD2 3.49Å; K1664-D1668 PolarHBondContact O-N 3.35Å
1665	E	91.5	Very high	88.5	Confident	102 Å²	102	52.2 Å²	52.2	48%	0.477	27%	0.27	S	S	.	.	H	α-helix	trans	-59.6	-37.7	177	-66.9	65.7	-151.4	0	0	111.2	S1663 L1669 M1694	S1663-E1665 PolarHBondContact O-N 3.32Å; E1665-L1669 WeakPolarHBondContact O-CB 3.48Å; E1665-L1669 PolarHBondContact O-N 3.2Å; E1665-M1694 HydrophobicContact CB-CE 3.98Å; E1665-M1694 HydrophobicContact CB-CG 3.98Å; E1665-M1694 HydrophobicContact CB-SD 4.15Å
1666	M	93.9	Very high	89.2	Confident	1 Å²	1	52.8 Å²	52.8	1%	0.005	28%	0.275	C	S	.	.	H	α-helix	trans	-65.5	-41.4	171.4	-174.3	63.2	76.1	0	0	112.2	E1518 V1521 L1625 Y1662 S1663 K1664 L1669 I1670 M1694	E1518-M1666 HydrophobicContact CG-CE 3.77Å; V1521-M1666 HydrophobicContact CB-CE 4.33Å; V1521-M1666 HydrophobicContact CG1-CE 3.82Å; V1521-M1666 HydrophobicContact CG1-SD 4.42Å; L1625-M1666 HydrophobicContact CD1-SD 3.84Å; L1625-M1666 HydrophobicContact CD2-SD 3.88Å; L1625-M1666 HydrophobicContact CG-SD 4.11Å; Y1662-M1666 HydrophobicContact CG-CG 4.48Å; S1663-M1666 WeakPolarHBondContact O-CB 3.28Å; S1663-M1666 PolarHBondContact O-N 2.75Å; S1663-M1666 WeakPolarHBondContact OG-CB 3.3Å; S1663-M1666 PolarHBondContact OG-N 2.98Å; S1663-M1666 VanDerWaalsContact OG-N 3.1Å; K1664-M1666 VanDerWaalsContact C-N 3.26Å; K1664-M1666 PolarHBondContact O-N 2.83Å; M1666-L1669 PolarHBondContact O-N 3.15Å; M1666-I1670 HydrophobicContact CG-CD1 4.39Å; M1666-I1670 WeakPolarHBondContact O-CG1 3.31Å; M1666-I1670 PolarHBondContact O-N 3.18Å; M1666-M1694 HydrophobicContact CB-CE 4.03Å; M1666-M1694 HydrophobicContact CE-CE 4.05Å; M1666-M1694 HydrophobicContact SD-CE 4.38Å
1667	H	93.2	Very high	89.5	Confident	40 Å²	40	55.2 Å²	55.2	19%	0.185	29%	0.288	C	S	.	.	H	α-helix	trans	-65.2	-44.2	176	-55.7	164.4	0	0	0	111.7	I1656 S1660 Y1662 S1663 K1664 L1669 I1670 M1671	I1656-H1667 HydrophobicContact CG1-CB 4.49Å; S1660-H1667 WeakPolarHBondContact CB-NE2 3.3Å; S1660-H1667 PolarHBondContact OG-NE2 2.97Å; Y1662-H1667 PolarHBondContact O-CE1 2.91Å; Y1662-H1667 PolarHBondContact O-NE2 3.4Å; S1663-H1667 PolarHBondContact O-CD2 2.9Å; S1663-H1667 PolarHBondContact O-N 2.83Å; K1664-H1667 WeakPolarHBondContact O-CB 3.47Å; K1664-H1667 PolarHBondContact O-N 2.78Å; H1667-L1669 VanDerWaalsContact C-N 3.26Å; H1667-L1669 PolarHBondContact O-N 3.34Å; H1667-I1670 PolarHBondContact O-N 3.44Å; H1667-M1671 WeakPolarHBondContact O-CB 3.49Å; H1667-M1671 WeakPolarHBondContact O-CG 3.47Å; H1667-M1671 PolarHBondContact O-N 3.06Å
1668	D	91.8	Very high	89.8	Confident	81 Å²	81	54.1 Å²	54.1	43%	0.433	28%	0.276	S	S	.	.	H	α-helix	trans	-63.9	-32	176.8	-72.7	-18.4	0	0	0	111.2	K1664 C1672	K1664-D1668 WeakPolarHBondContact CE-OD2 3.49Å; K1664-D1668 PolarHBondContact O-N 3.35Å; D1668-C1672 WeakPolarHBondContact O-CB 3.35Å; D1668-C1672 PolarHBondContact O-N 2.84Å; D1668-C1672 VanDerWaalsContact O-N 3.08Å
1669	L	94.1	Very high	90.4	Very high	3 Å²	3	53.7 Å²	53.7	2%	0.016	27%	0.271	C	S	.	.	H	α-helix	trans	-69	-46.4	172.9	-175.9	61.3	0	0	0	112.3	F1525 L1625 E1665 M1666 H1667 C1672 M1673 V1687 K1690 L1691 M1694	F1525-L1669 HydrophobicContact CE1-CD2 4.25Å; L1625-L1669 HydrophobicContact CD2-CD2 3.92Å; L1625-L1669 HydrophobicContact CD2-CG 3.99Å; E1665-L1669 WeakPolarHBondContact O-CB 3.48Å; E1665-L1669 PolarHBondContact O-N 3.2Å; M1666-L1669 PolarHBondContact O-N 3.15Å; H1667-L1669 VanDerWaalsContact C-N 3.26Å; H1667-L1669 PolarHBondContact O-N 3.34Å; L1669-C1672 PolarHBondContact O-N 2.82Å; L1669-C1672 PolarHBondContact O-SG 3.08Å; L1669-M1673 HydrophobicContact CG-CE 4.27Å; L1669-M1673 WeakPolarHBondContact O-CE 3.32Å; L1669-V1687 HydrophobicContact CD1-CG1 4.14Å; L1669-K1690 HydrophobicContact CD1-CB 3.89Å; L1669-K1690 HydrophobicContact CD1-CD 3.96Å; L1669-L1691 HydrophobicContact CD2-CD1 4.07Å; L1669-M1694 HydrophobicContact CB-SD 4.32Å; L1669-M1694 HydrophobicContact CD2-SD 3.86Å
1670	I	93.8	Very high	91	Very high	0 Å²	0	49 Å²	49	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-58.8	-51.3	174.5	-68.3	164.9	0	0	0	110.2	L1625 Y1626 F1630 I1656 M1666 H1667 C1672 M1673 L1674	L1625-I1670 HydrophobicContact CB-CG1 4.2Å; L1625-I1670 HydrophobicContact CD2-CG1 3.65Å; L1625-I1670 HydrophobicContact CG-CD1 4.26Å; L1625-I1670 HydrophobicContact CG-CG1 3.67Å; Y1626-I1670 HydrophobicContact CD2-CG2 4.32Å; F1630-I1670 HydrophobicContact CE2-CD1 4.25Å; I1656-I1670 HydrophobicContact CD1-CD1 4.04Å; I1656-I1670 HydrophobicContact CD1-CG2 4.24Å; M1666-I1670 HydrophobicContact CG-CD1 4.39Å; M1666-I1670 WeakPolarHBondContact O-CG1 3.31Å; M1666-I1670 PolarHBondContact O-N 3.18Å; H1667-I1670 PolarHBondContact O-N 3.44Å; I1670-C1672 VanDerWaalsContact C-N 3.3Å; I1670-C1672 PolarHBondContact O-N 2.9Å; I1670-M1673 PolarHBondContact O-N 3.35Å; I1670-M1673 VanDerWaalsContact O-N 3.15Å; I1670-L1674 HydrophobicContact CG2-CD1 3.75Å; I1670-L1674 HydrophobicContact CG2-CG 4.35Å; I1670-L1674 PolarHBondContact O-N 3.08Å; I1670-L1674 VanDerWaalsContact O-N 3.08Å
1671	M	91.9	Very high	91.4	Very high	55 Å²	55	48 Å²	48	27%	0.271	25%	0.249	S	C	.	.	H	α-helix	trans	-64.4	-31.8	-176.8	-69.6	-59.8	-159	0	0	113	V1655 I1656 H1667 M1673 Q1675	V1655-M1671 HydrophobicContact CB-CE 4.36Å; I1656-M1671 HydrophobicContact CG1-CE 3.75Å; H1667-M1671 WeakPolarHBondContact O-CB 3.49Å; H1667-M1671 WeakPolarHBondContact O-CG 3.47Å; H1667-M1671 PolarHBondContact O-N 3.06Å; M1671-M1673 VanDerWaalsContact C-N 3.28Å; M1671-M1673 PolarHBondContact O-N 2.93Å; M1671-Q1675 PolarHBondContact O-NE2 3.05Å
1672	C	92.3	Very high	91.7	Very high	26 Å²	26	45.4 Å²	45.4	18%	0.176	23%	0.233	C	C	.	.	H	α-helix	trans	-71.8	-21.3	178.1	83.3	0	0	0	0	113.6	D1668 L1669 I1670 P1682	D1668-C1672 WeakPolarHBondContact O-CB 3.35Å; D1668-C1672 PolarHBondContact O-N 2.84Å; D1668-C1672 VanDerWaalsContact O-N 3.08Å; L1669-C1672 PolarHBondContact O-N 2.82Å; L1669-C1672 PolarHBondContact O-SG 3.08Å; I1670-C1672 VanDerWaalsContact C-N 3.3Å; I1670-C1672 PolarHBondContact O-N 2.9Å; C1672-P1682 WeakPolarHBondContact O-CD 3.35Å
1673	M	95.1	Very high	91.8	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-88.1	-37.2	173.7	-67.6	-174.7	-74.1	0	0	112.5	F1525 I1618 L1621 L1625 L1669 I1670 M1671 Q1675 P1682 V1687	F1525-M1673 HydrophobicContact CE1-CE 4.29Å; F1525-M1673 HydrophobicContact CE2-CE 4.31Å; F1525-M1673 HydrophobicContact CZ-CE 3.59Å; F1525-M1673 HydrophobicContact CZ-SD 3.82Å; I1618-M1673 HydrophobicContact CG2-CB 4.04Å; I1618-M1673 HydrophobicContact CG2-CG 3.87Å; I1618-M1673 HydrophobicContact CG2-SD 4.49Å; L1621-M1673 HydrophobicContact CB-SD 4.39Å; L1621-M1673 HydrophobicContact CD2-SD 3.88Å; L1621-M1673 HydrophobicContact CG-SD 3.96Å; L1625-M1673 HydrophobicContact CB-CE 4.14Å; L1625-M1673 HydrophobicContact CD2-CE 3.54Å; L1625-M1673 HydrophobicContact CG-CE 4.5Å; L1669-M1673 HydrophobicContact CG-CE 4.27Å; L1669-M1673 WeakPolarHBondContact O-CE 3.32Å; I1670-M1673 PolarHBondContact O-N 3.35Å; I1670-M1673 VanDerWaalsContact O-N 3.15Å; M1671-M1673 VanDerWaalsContact C-N 3.28Å; M1671-M1673 PolarHBondContact O-N 2.93Å; M1673-Q1675 PolarHBondContact O-N 3.18Å; M1673-P1682 HydrophobicContact CG-CG 4.5Å; M1673-V1687 HydrophobicContact CG-CG2 4.15Å; M1673-V1687 HydrophobicContact SD-CG1 3.82Å; M1673-V1687 HydrophobicContact SD-CG2 4.19Å
1674	L	92.2	Very high	92	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	24%	0.239	C	C	.	.			trans	-77	58.7	174	-62.6	-179.2	0	0	0	111.4	W1619 P1634 L1652 I1670	W1619-L1674 HydrophobicContact CD2-CD2 4.28Å; W1619-L1674 HydrophobicContact CE3-CD2 4.37Å; W1619-L1674 HydrophobicContact CZ3-CB 4.49Å; P1634-L1674 HydrophobicContact CG-CD1 4.21Å; L1652-L1674 WeakPolarHBondContact CD1-O 3.49Å; L1652-L1674 HydrophobicContact CD2-CB 4.44Å; I1670-L1674 HydrophobicContact CG2-CD1 3.75Å; I1670-L1674 HydrophobicContact CG2-CG 4.35Å; I1670-L1674 PolarHBondContact O-N 3.08Å; I1670-L1674 VanDerWaalsContact O-N 3.08Å
1675	Q	90.1	Very high	92.2	Very high	68 Å²	68	45.4 Å²	45.4	32%	0.318	24%	0.239	S	C	.	.			trans	-103.2	121.7	170.9	-66.4	-60.4	-56.6	0	0	109.5	M1671 M1673 D1677 R1681	M1671-Q1675 PolarHBondContact O-NE2 3.05Å; M1673-Q1675 PolarHBondContact O-N 3.18Å; Q1675-D1677 PolarHBondContact O-N 3.13Å; Q1675-R1681 HydrophobicContact CB-CG 3.84Å; Q1675-R1681 WeakPolarHBondContact O-CG 3.46Å; Q1675-R1681 PolarHBondContact O-NE 3.05Å
1676	P	86.6	Confident	92.3	Very high	35 Å²	35	43.1 Å²	43.1	23%	0.227	23%	0.234	C	C	.	.	S	Bend	trans	-65.3	-44.8	-173	-23.9	36	0	0	0	111.6	W1619 H1649 L1650 L1652 R1678 R1681	W1619-P1676 HydrophobicContact CZ3-CB 4.44Å; W1619-P1676 HydrophobicContact CZ3-CG 4.25Å; H1649-P1676 WeakPolarHBondContact O-CG 3.34Å; L1650-P1676 HydrophobicContact CD2-CB 4.48Å; L1652-P1676 HydrophobicContact CD1-CG 3.62Å; P1676-R1678 PolarHBondContact O-N 3.03Å; P1676-R1681 PolarHBondContact O-NH2 3.2Å
1677	D	87.4	Confident	92.4	Very high	77 Å²	77	43 Å²	43	41%	0.412	23%	0.234	S	C	.	.	S	Bend	trans	-63.9	121.8	166.4	166.3	42.4	0	0	0	110.6	Q1675 Q1679 S1680 R1681	Q1675-D1677 PolarHBondContact O-N 3.13Å; D1677-Q1679 VanDerWaalsContact C-N 3.3Å; D1677-Q1679 PolarHBondContact O-N 3.02Å; D1677-Q1679 WeakPolarHBondContact OD1-CB 3.41Å; D1677-Q1679 PolarHBondContact OD1-N 3.48Å; D1677-Q1679 WeakPolarHBondContact OD2-CB 3.23Å; D1677-Q1679 PolarHBondContact OD2-N 2.85Å; D1677-S1680 PolarHBondContact O-N 2.86Å; D1677-S1680 VanDerWaalsContact OD2-CB 3.28Å; D1677-S1680 WeakPolarHBondContact OD2-CB 3.42Å; D1677-S1680 PolarHBondContact OD2-N 3.39Å; D1677-S1680 PolarHBondContact OD2-OG 2.94Å; D1677-R1681 PolarHBondContact O-N 3.02Å
1678	R	89.2	Confident	92.4	Very high	32 Å²	32	42.3 Å²	42.3	12%	0.121	23%	0.231	C	C	.	.	S	Bend	trans	-66.1	-29.4	177.1	-174.4	178	57.7	95.4	0.1	112.7	K1611 D1613 R1615 P1676 S1680 R1681	K1611-R1678 PolarHBondContact O-NH1 3.14Å; K1611-R1678 PolarHBondContact O-NH2 3.01Å; D1613-R1678 IonicContact OD1-CZ 4Å; D1613-R1678 IonicContact OD1-NH1 3.73Å; D1613-R1678 PolarHBondContact OD1-NH1 2.94Å; D1613-R1678 IonicContact OD2-NH1 2.79Å; D1613-R1678 PolarHBondContact OD2-NH1 3.49Å; R1615-R1678 HydrophobicContact CB-CG 3.95Å; R1615-R1678 PolarHBondContact NH1-O 3.05Å; P1676-R1678 PolarHBondContact O-N 3.03Å; R1678-S1680 VanDerWaalsContact C-N 3.28Å; R1678-S1680 PolarHBondContact O-N 3.14Å; R1678-R1681 PolarHBondContact O-N 2.96Å
1679	Q	90.2	Very high	92.5	Very high	150 Å²	150	43.4 Å²	43.4	70%	0.701	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67	-34.2	178.4	-58.7	-167.9	10.4	0	0	111.6	R1615 D1677	R1615-Q1679 PolarHBondContact NH1-O 3.4Å; R1615-Q1679 VanDerWaalsContact NH1-O 3.14Å; D1677-Q1679 VanDerWaalsContact C-N 3.3Å; D1677-Q1679 PolarHBondContact O-N 3.02Å; D1677-Q1679 WeakPolarHBondContact OD1-CB 3.41Å; D1677-Q1679 PolarHBondContact OD1-N 3.48Å; D1677-Q1679 WeakPolarHBondContact OD2-CB 3.23Å; D1677-Q1679 PolarHBondContact OD2-N 2.85Å
1680	S	91.6	Very high	92.4	Very high	73 Å²	73	47.5 Å²	47.5	51%	0.51	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.3	-11.6	175.7	-60.5	0	0	0	0	114.7	D1677 R1678	D1677-S1680 PolarHBondContact O-N 2.86Å; D1677-S1680 VanDerWaalsContact OD2-CB 3.28Å; D1677-S1680 WeakPolarHBondContact OD2-CB 3.42Å; D1677-S1680 PolarHBondContact OD2-N 3.39Å; D1677-S1680 PolarHBondContact OD2-OG 2.94Å; R1678-S1680 VanDerWaalsContact C-N 3.28Å; R1678-S1680 PolarHBondContact O-N 3.14Å
1681	R	94	Very high	92.3	Very high	5 Å²	5	47.5 Å²	47.5	2%	0.019	25%	0.251	C	S	.	.	S	Bend	trans	-75	139.7	174.3	-75.7	-179	-121.8	146.7	3.9	111.7	E1602 R1615 Q1675 P1676 D1677 R1678	E1602-R1681 IonicContact OE1-CZ 3.62Å; E1602-R1681 IonicContact OE1-NH1 2.7Å; E1602-R1681 PolarHBondContact OE1-NH1 3.2Å; E1602-R1681 IonicContact OE1-NH2 2.9Å; E1602-R1681 IonicContact OE2-CZ 3.91Å; E1602-R1681 IonicContact OE2-NH1 3.84Å; E1602-R1681 PolarHBondContact OE2-NH1 3.27Å; E1602-R1681 IonicContact OE2-NH2 3.27Å; E1602-R1681 PolarHBondContact OE2-NH2 2.86Å; R1615-R1681 HydrophobicContact CB-CB 4.31Å; R1615-R1681 VanDerWaalsContact CD-O 3.22Å; R1615-R1681 WeakPolarHBondContact CD-O 3.32Å; R1615-R1681 PolarHBondContact O-NH1 3.43Å; Q1675-R1681 HydrophobicContact CB-CG 3.84Å; Q1675-R1681 WeakPolarHBondContact O-CG 3.46Å; Q1675-R1681 PolarHBondContact O-NE 3.05Å; P1676-R1681 PolarHBondContact O-NH2 3.2Å; D1677-R1681 PolarHBondContact O-N 3.02Å; R1678-R1681 PolarHBondContact O-N 2.96Å
1682	P	94.4	Very high	92.1	Very high	23 Å²	23	48.1 Å²	48.1	15%	0.149	26%	0.256	C	S	.	.	P	Polyproline II helix	trans	-68.9	156.2	172.9	30.4	-35.4	0	0	0	111.3	I1618 C1672 M1673 V1687	I1618-P1682 HydrophobicContact CG2-CG 4.24Å; C1672-P1682 WeakPolarHBondContact O-CD 3.35Å; M1673-P1682 HydrophobicContact CG-CG 4.5Å; P1682-V1687 HydrophobicContact CB-CG2 4.2Å; P1682-V1687 HydrophobicContact CG-CG2 3.76Å
1683	F	94.4	Very high	91.9	Very high	85 Å²	85	52.5 Å²	52.5	37%	0.373	27%	0.272	S	S	.	.	P	Polyproline II helix	trans	-79.1	155.8	161	-72.3	-89	0	0	0	110.3	R1615 P1685 S1686 V1687	R1615-F1683 HydrophobicContact CG-CD1 3.93Å; R1615-F1683 HydrophobicContact CG-CE1 3.89Å; R1615-F1683 HydrophobicContact CG-CG 4.26Å; R1615-F1683 HydrophobicContact CG-CZ 4.19Å; F1683-P1685 VanDerWaalsContact C-N 3.34Å; F1683-S1686 WeakPolarHBondContact O-CB 3.44Å; F1683-S1686 PolarHBondContact O-N 3.21Å; F1683-V1687 PolarHBondContact O-N 3.43Å
1684	L	94.9	Very high	91.5	Very high	6 Å²	6	53.4 Å²	53.4	3%	0.031	28%	0.276	C	S	.	.	H	α-helix	trans	-51.1	-39	-176.3	-169.2	58.5	0	0	0	115.2	C1529 L1532 S1533 I1618 L1621 S1686 V1687 L1688	C1529-L1684 HydrophobicContact CB-CD1 4.05Å; L1532-L1684 HydrophobicContact CB-CD2 3.92Å; L1532-L1684 HydrophobicContact CD2-CD1 4.17Å; L1532-L1684 HydrophobicContact CD2-CD2 4.07Å; L1532-L1684 HydrophobicContact CG-CD2 3.94Å; S1533-L1684 VanDerWaalsContact N-CD2 3.32Å; I1618-L1684 HydrophobicContact CD1-CB 3.97Å; I1618-L1684 HydrophobicContact CD1-CD1 3.94Å; L1621-L1684 HydrophobicContact CD2-CD1 3.76Å; L1684-S1686 VanDerWaalsContact C-N 3.27Å; L1684-S1686 PolarHBondContact O-N 2.92Å; L1684-V1687 WeakPolarHBondContact O-CB 3.2Å; L1684-V1687 PolarHBondContact O-N 3.37Å; L1684-V1687 VanDerWaalsContact O-N 3.09Å; L1684-L1688 PolarHBondContact O-N 3.46Å
1685	P	94.1	Very high	90.9	Very high	91 Å²	91	57.1 Å²	57.1	59%	0.591	29%	0.293	S	S	*	.	H	α-helix	trans	-59.9	-33.4	176.4	-25.9	36.9	0	0	0	113.9	F1683 L1688 E1689	F1683-P1685 VanDerWaalsContact C-N 3.34Å; P1685-L1688 PolarHBondContact O-N 3.5Å; P1685-E1689 WeakPolarHBondContact O-CB 3.37Å; P1685-E1689 PolarHBondContact O-N 2.77Å
1686	S	93.7	Very high	90.3	Very high	54 Å²	54	60.3 Å²	60.3	38%	0.378	31%	0.307	S	S	.	.	H	α-helix	trans	-74.9	-26.4	176.8	-55.5	0	0	0	0	112.8	F1683 L1684 K1690	F1683-S1686 WeakPolarHBondContact O-CB 3.44Å; F1683-S1686 PolarHBondContact O-N 3.21Å; L1684-S1686 VanDerWaalsContact C-N 3.27Å; L1684-S1686 PolarHBondContact O-N 2.92Å; S1686-K1690 WeakPolarHBondContact O-CG 3.36Å; S1686-K1690 PolarHBondContact O-N 2.88Å
1687	V	95.3	Very high	89.5	Confident	0 Å²	0	62.2 Å²	62.2	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-70.1	-45.8	171.5	-179.5	0	0	0	0	109.7	F1525 L1669 M1673 P1682 F1683 L1684 K1690 L1691	F1525-V1687 HydrophobicContact CE1-CG1 3.83Å; F1525-V1687 HydrophobicContact CZ-CG1 4.08Å; L1669-V1687 HydrophobicContact CD1-CG1 4.14Å; M1673-V1687 HydrophobicContact CG-CG2 4.15Å; M1673-V1687 HydrophobicContact SD-CG1 3.82Å; M1673-V1687 HydrophobicContact SD-CG2 4.19Å; P1682-V1687 HydrophobicContact CB-CG2 4.2Å; P1682-V1687 HydrophobicContact CG-CG2 3.76Å; F1683-V1687 PolarHBondContact O-N 3.43Å; L1684-V1687 WeakPolarHBondContact O-CB 3.2Å; L1684-V1687 PolarHBondContact O-N 3.37Å; L1684-V1687 VanDerWaalsContact O-N 3.09Å; V1687-K1690 PolarHBondContact O-N 2.93Å; V1687-L1691 PolarHBondContact O-N 2.82Å
1688	L	93.8	Very high	88.3	Confident	25 Å²	25	61.3 Å²	61.3	13%	0.131	32%	0.324	C	S	.	.	H	α-helix	trans	-60.2	-44.2	173.6	-75.1	168.2	0	0	0	112.1	R1526 C1529 L1684 P1685 K1690 L1691 D1692	R1526-L1688 HydrophobicContact CG-CD2 4.44Å; C1529-L1688 HydrophobicContact CB-CD2 3.56Å; C1529-L1688 HydrophobicContact CB-CG 4.08Å; L1684-L1688 PolarHBondContact O-N 3.46Å; P1685-L1688 PolarHBondContact O-N 3.5Å; L1688-K1690 VanDerWaalsContact C-N 3.31Å; L1688-K1690 PolarHBondContact O-N 3.01Å; L1688-L1691 WeakPolarHBondContact O-CB 3.2Å; L1688-L1691 PolarHBondContact O-N 3.48Å; L1688-L1691 VanDerWaalsContact O-N 3.13Å; L1688-D1692 PolarHBondContact O-N 2.86Å
1689	E	92.8	Very high	86.6	Confident	103 Å²	103	63.9 Å²	63.9	48%	0.481	35%	0.352	S	S	.	.	H	α-helix	trans	-62.2	-35.9	177.8	-162.4	-157.6	158	0	0	112.7	P1685 K1693	P1685-E1689 WeakPolarHBondContact O-CB 3.37Å; P1685-E1689 PolarHBondContact O-N 2.77Å; E1689-K1693 VanDerWaalsContact O-CG 3.31Å; E1689-K1693 WeakPolarHBondContact O-CG 3.44Å; E1689-K1693 PolarHBondContact O-N 3.04Å; E1689-K1693 VanDerWaalsContact O-N 3.15Å; E1689-K1693 WeakPolarHBondContact OE1-CE 3.47Å; E1689-K1693 IonicContact OE1-NZ 3.78Å; E1689-K1693 PolarHBondContact OE1-NZ 3.32Å
1690	K	92.5	Very high	84.1	Confident	89 Å²	89	65.9 Å²	65.9	39%	0.387	37%	0.368	S	S	.	.	H	α-helix	trans	-65.9	-44.6	172.6	-78.5	166.5	168	-82	0	111.3	L1669 S1686 V1687 L1688 D1692 K1693 M1694	L1669-K1690 HydrophobicContact CD1-CB 3.89Å; L1669-K1690 HydrophobicContact CD1-CD 3.96Å; S1686-K1690 WeakPolarHBondContact O-CG 3.36Å; S1686-K1690 PolarHBondContact O-N 2.88Å; V1687-K1690 PolarHBondContact O-N 2.93Å; L1688-K1690 VanDerWaalsContact C-N 3.31Å; L1688-K1690 PolarHBondContact O-N 3.01Å; K1690-D1692 PolarHBondContact O-N 3.05Å; K1690-K1693 WeakPolarHBondContact O-CB 3.29Å; K1690-K1693 PolarHBondContact O-N 3.09Å; K1690-M1694 WeakPolarHBondContact O-CG 3.45Å; K1690-M1694 PolarHBondContact O-N 3.05Å
1691	L	91.3	Very high	83.8	Confident	1 Å²	1	65.6 Å²	65.6	1%	0.005	36%	0.36	C	S	.	.	H	α-helix	trans	-63.8	-39.6	179.2	-166.8	66.6	0	0	0	112.2	C1522 F1525 R1526 L1669 V1687 L1688 K1693 M1694 E1695	C1522-L1691 HydrophobicContact CB-CD1 4.1Å; F1525-L1691 HydrophobicContact CD1-CD1 4.2Å; F1525-L1691 HydrophobicContact CD1-CD2 3.96Å; R1526-L1691 HydrophobicContact CB-CD2 3.68Å; R1526-L1691 HydrophobicContact CG-CD2 4.35Å; L1669-L1691 HydrophobicContact CD2-CD1 4.07Å; V1687-L1691 PolarHBondContact O-N 2.82Å; L1688-L1691 WeakPolarHBondContact O-CB 3.2Å; L1688-L1691 PolarHBondContact O-N 3.48Å; L1688-L1691 VanDerWaalsContact O-N 3.13Å; L1691-K1693 VanDerWaalsContact C-N 3.34Å; L1691-K1693 PolarHBondContact O-N 3.37Å; L1691-M1694 PolarHBondContact O-N 3.03Å; L1691-E1695 PolarHBondContact O-N 2.8Å
1692	D	89.2	Confident	83.2	Confident	67 Å²	67	68.7 Å²	68.7	36%	0.358	38%	0.378	S	S	.	.	H	α-helix	trans	-66.9	-33	174.5	-76	-3.2	0	0	0	112.8	R1526 L1688 K1690 K1696	R1526-D1692 IonicContact NE-OD1 3.43Å; L1688-D1692 PolarHBondContact O-N 2.86Å; K1690-D1692 PolarHBondContact O-N 3.05Å; D1692-K1696 WeakPolarHBondContact O-CD 3.46Å; D1692-K1696 VanDerWaalsContact O-CG 3.28Å; D1692-K1696 WeakPolarHBondContact O-CG 3.13Å; D1692-K1696 PolarHBondContact O-N 2.67Å; D1692-K1696 VanDerWaalsContact O-N 3.14Å
1693	K	88.1	Confident	82.6	Confident	119 Å²	119	71.3 Å²	71.3	52%	0.517	39%	0.391	S	S	.	.	H	α-helix	trans	-68	-43	172.3	-75	168.7	-172.9	169	0	111	E1689 K1690 L1691 E1695 K1696 S1697	E1689-K1693 VanDerWaalsContact O-CG 3.31Å; E1689-K1693 WeakPolarHBondContact O-CG 3.44Å; E1689-K1693 PolarHBondContact O-N 3.04Å; E1689-K1693 VanDerWaalsContact O-N 3.15Å; E1689-K1693 WeakPolarHBondContact OE1-CE 3.47Å; E1689-K1693 IonicContact OE1-NZ 3.78Å; E1689-K1693 PolarHBondContact OE1-NZ 3.32Å; K1690-K1693 WeakPolarHBondContact O-CB 3.29Å; K1690-K1693 PolarHBondContact O-N 3.09Å; L1691-K1693 VanDerWaalsContact C-N 3.34Å; L1691-K1693 PolarHBondContact O-N 3.37Å; K1693-E1695 PolarHBondContact O-N 3.47Å; K1693-K1696 PolarHBondContact O-N 3.24Å; K1693-S1697 PolarHBondContact O-N 3.47Å; K1693-S1697 PolarHBondContact O-OG 3.08Å; K1693-S1697 VanDerWaalsContact O-OG 3.05Å
1694	M	86.5	Confident	81.9	Confident	19 Å²	19	70.5 Å²	70.5	9%	0.094	39%	0.392	C	S	.	.	H	α-helix	trans	-59.3	-43.7	176.6	-72	172.8	64.6	0	0	112.3	E1665 M1666 L1669 K1690 L1691 S1697 A1698	E1665-M1694 HydrophobicContact CB-CE 3.98Å; E1665-M1694 HydrophobicContact CB-CG 3.98Å; E1665-M1694 HydrophobicContact CB-SD 4.15Å; M1666-M1694 HydrophobicContact CB-CE 4.03Å; M1666-M1694 HydrophobicContact CE-CE 4.05Å; M1666-M1694 HydrophobicContact SD-CE 4.38Å; L1669-M1694 HydrophobicContact CB-SD 4.32Å; L1669-M1694 HydrophobicContact CD2-SD 3.86Å; K1690-M1694 WeakPolarHBondContact O-CG 3.45Å; K1690-M1694 PolarHBondContact O-N 3.05Å; L1691-M1694 PolarHBondContact O-N 3.03Å; M1694-S1697 WeakPolarHBondContact CA-OG 3.36Å; M1694-S1697 PolarHBondContact O-N 3.44Å; M1694-S1697 PolarHBondContact O-OG 3.04Å; M1694-A1698 WeakPolarHBondContact O-CB 3.38Å; M1694-A1698 PolarHBondContact O-N 3.44Å
1695	E	78.3	Confident	81.1	Confident	77 Å²	77	74.5 Å²	74.5	36%	0.36	42%	0.415	S	S	.	.	H	α-helix	trans	-67.4	-39	175.3	-83.3	-168.4	-176.7	0	0	113.2	R1526 L1691 K1693 S1697 A1698 A1699	R1526-E1695 VanDerWaalsContact CZ-CD 3.49Å; R1526-E1695 IonicContact CZ-OE1 3.36Å; R1526-E1695 IonicContact CZ-OE2 3.33Å; R1526-E1695 IonicContact NH1-OE1 3.85Å; R1526-E1695 PolarHBondContact NH1-OE1 3.14Å; R1526-E1695 IonicContact NH1-OE2 3.1Å; R1526-E1695 PolarHBondContact NH1-OE2 3.38Å; R1526-E1695 IonicContact NH2-OE1 3.97Å; R1526-E1695 PolarHBondContact NH2-OE1 3.2Å; R1526-E1695 IonicContact NH2-OE2 1.78Å; R1526-E1695 PolarHBondContact NH2-OE2 3.08Å; L1691-E1695 PolarHBondContact O-N 2.8Å; K1693-E1695 PolarHBondContact O-N 3.47Å; E1695-S1697 VanDerWaalsContact C-N 3.3Å; E1695-S1697 PolarHBondContact O-N 3.28Å; E1695-A1698 CarbonylContact O-C 3.19Å; E1695-A1698 PolarHBondContact O-N 2.6Å; E1695-A1698 VanDerWaalsContact O-N 3.1Å; E1695-A1699 WeakPolarHBondContact O-CB 3.48Å; E1695-A1699 PolarHBondContact O-N 3.04Å
1696	K	77.8	Confident	80.2	Confident	136 Å²	136	73.4 Å²	73.4	59%	0.591	40%	0.403	S	S	*	.	H	α-helix	trans	-64.4	-34.6	174.9	-73	166.9	-173.3	164.6	0	112.2	D1692 K1693 A1698 N1700	D1692-K1696 WeakPolarHBondContact O-CD 3.46Å; D1692-K1696 VanDerWaalsContact O-CG 3.28Å; D1692-K1696 WeakPolarHBondContact O-CG 3.13Å; D1692-K1696 PolarHBondContact O-N 2.67Å; D1692-K1696 VanDerWaalsContact O-N 3.14Å; K1693-K1696 PolarHBondContact O-N 3.24Å; K1696-A1698 VanDerWaalsContact C-N 3.33Å; K1696-N1700 PolarHBondContact O-N 3.12Å; K1696-N1700 PolarHBondContact O-ND2 3.4Å
1697	S	70.8	Confident	79.3	Confident	74 Å²	74	74.8 Å²	74.8	52%	0.517	41%	0.405	S	S	.	.	H	α-helix	trans	-75.3	-16.9	172.3	50.1	0	0	0	0	114.5	K1693 M1694 E1695	K1693-S1697 PolarHBondContact O-N 3.47Å; K1693-S1697 PolarHBondContact O-OG 3.08Å; K1693-S1697 VanDerWaalsContact O-OG 3.05Å; M1694-S1697 WeakPolarHBondContact CA-OG 3.36Å; M1694-S1697 PolarHBondContact O-N 3.44Å; M1694-S1697 PolarHBondContact O-OG 3.04Å; E1695-S1697 VanDerWaalsContact C-N 3.3Å; E1695-S1697 PolarHBondContact O-N 3.28Å
1698	A	61.6	Low	78	Confident	59 Å²	59	80.5 Å²	80.5	49%	0.488	44%	0.436	S	S	.	.	H	α-helix	trans	-98.8	-4.5	175.6	0	0	0	0	0	113.8	M1694 E1695 K1696	M1694-A1698 WeakPolarHBondContact O-CB 3.38Å; M1694-A1698 PolarHBondContact O-N 3.44Å; E1695-A1698 CarbonylContact O-C 3.19Å; E1695-A1698 PolarHBondContact O-N 2.6Å; E1695-A1698 VanDerWaalsContact O-N 3.1Å; K1696-A1698 VanDerWaalsContact C-N 3.33Å
1699	A	53.1	Low	76.7	Confident	86 Å²	86	85.2 Å²	85.2	71%	0.711	46%	0.461	S	S	*	.	H	α-helix	trans	-104.4	-16.4	173.5	0	0	0	0	0	113.2	E1695	E1695-A1699 WeakPolarHBondContact O-CB 3.48Å; E1695-A1699 PolarHBondContact O-N 3.04Å
1700	N	38.6	Very low	75.2	Confident	192 Å²	192	83.5 Å²	83.5	100%	1.027	46%	0.46	S	S	*	.			trans	-88.7	0	165	-69.2	-27.9	0	0	0	110.7	K1696	K1696-N1700 PolarHBondContact O-N 3.12Å; K1696-N1700 PolarHBondContact O-ND2 3.4Å

Retrieved 1,700 of 1,700 residues in 2340.4 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).