A0A087XVQ2_POEFO Loading...

Paired amphipathic helix protein Sin3b

Acts as a transcriptional repressor. Interacts with MXI1 to repress MYC responsive genes and antagonize MYC oncogenic activities. Interacts with MAD-MAX heterodimers by binding to MAD. The heterodimer then represses transcription by tethering SIN3B to DNA. Also forms a complex with FOXK1 which represses transcription. With FOXK1, regulates cell cycle progression probably by repressing cell cycle inhibitor genes expression. As part of the SIN3B complex represses transcription and counteracts the histone acetyltransferase activity of EP300 through the recognition H3K27ac marks by PHF12 and the activity of the histone deacetylase HDAC2. SIN3B complex is recruited downstream of the constitutively active genes transcriptional start sites through interaction with histones and mitigates histone acetylation and RNA polymerase II progression within transcribed regions contributing to the regulation of transcription.

AlphaFold DB , UniProt , Accession A0A087XVQ2, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,280 aa.

						>A0A087XVQ2_POEFO|A0A087XVQ2
MAKIQAHSTAKQINQIQDKPYVITQKQVQQQHFQKLKVEDALSYLDQVKIRFANDPGIYNKFLDIMKEFKSQSIDTPGVINRVSQLFHGHPDLVLGFNAFLPPGYRIEIPKNGMAFLQSPFTTQVSPGQPAKSLTTPAVAATSGSVPAAHSEAGPAQTSDTKAASSDNQSSTSAGPSEPPSKLSLPLTSKEGHSQATTSSISPPASETSPVEFDSAISYVNKIKNRFLDHPEIYRAFLEILHTYQKEQLEVKESRGGRGSSGMTEDEVFSKVASLFKGQEDLLAEFGQFLPDAKRSLFTGSSLTGGKEQVKKSEEEDPITKQNKKRPRPLLMHMSPLLKKKMKYPCAKDQSFASVGKHGVLREFSFFDKVRRLFKSQEVYENFLRCIALFNQEVVSGAELLQLVTPFLGKFPELYSQFKSFLGDKELSHAVSGLADRYMEGGGGREVDYASCKRLGSSYRALPKTYQQPKCSGRTALCKEVLNDTWVSFPSWSEDSTFVSSKKTPYEEQLHRCEDERFELDVVLETNLATIRVLESVQKKLSRLSPEDQERFRLDDCLGGTSEVIQRRAVYRIYGDKAPEIIEGLKKSPATAVPVVLKRLKAKEEEWREAQQGFNKIWREQYEKAYLKSLDHQGVNFKQNDMKALRSKSLLNEIESIYDERQEQSTEEGGVGHQSRNGSGSMSSSEPHMMFTYEDKQILEDASSLIIYHVKRQPTIHKDDKDHIKRIIQHFVPDLFFSRRGELSDTEEWTDEEAEPEDGAERGGGASVPTAAAGGGSGHLNSASGGSAAAAATATATGSQPPLQPAQNQNQNQSQLQQQLNGESRRRRCSPSQPTDTEPSSTSSSTNQPAVTTSSTPGSTPMEASSSAVGEKVDLRDPEAEHQKELDGVYNLFFVNNNWYFFLRLHQTLCSRLLRVYRQAERQLLEHRAEQSRERLLMAEGRREKACDLAMELRLKQPSEVELEEYYPAFLDMVRSLLDGNLDSTQYEDTLREMFTIHAYIGFTIDKVIHNIIRQLQHLVSDEVCLQVVDLYLAERKRGAAGGNLSSQCVRAAWETSYQWKAERIMAEENCFKVMFIQNKGQVTMTLELLDTEEAQADDPLDVQCLSSYMEQFVGTESSLCSQAEGYFFKPVFLPRNLRRFRRWQVRQVEAMRCRREWHRQLAVENAGSLECRFKLNTHKMVFVMNSEDYMYRRGALVKARKSQHQVAACQHERFDKWHQSWLANHVPASAERSVQNWLMGEEEEDFIPCKTTCLSTELKGQAVNRYQVHYSSSKAPSSP
					

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	28.5	Very low	26.1	Very low	239 Å²	239	152.2 Å²	152.2	100%	1.177	84%	0.84	S	S	*	*				0	175.7	0	-63.8	180	-178.4	0	0	108.6
2	A	29.1	Very low	26.1	Very low	110 Å²	110	152.9 Å²	152.9	91%	0.909	83%	0.833	S	S	*	*			trans	20.7	110.5	169.8	0	0	0	0	0	118.2
3	K	27.1	Very low	26.1	Very low	200 Å²	200	152.2 Å²	152.2	87%	0.87	83%	0.826	S	S	*	*			trans	-108.1	139.4	173.3	-70	-177.2	175.5	-176.7	0	111.2
4	I	29.4	Very low	25.9	Very low	169 Å²	169	151.7 Å²	151.7	87%	0.867	82%	0.822	S	S	*	*			trans	-168.5	117.3	132.8	-93.7	148.8	0	0	0	107
5	Q	24.1	Very low	25.8	Very low	190 Å²	190	151.9 Å²	151.9	89%	0.888	82%	0.815	S	S	*	*			trans	-174.9	163	149.7	-120.6	-174.4	-1.1	0	0	112.8
6	A	25.6	Very low	25.8	Very low	73 Å²	73	150.1 Å²	150.1	60%	0.603	80%	0.804	S	S	*	*			trans	73.4	108.8	151.1	0	0	0	0	0	120.8
7	H	25.1	Very low	25.7	Very low	184 Å²	184	151.1 Å²	151.1	85%	0.852	80%	0.803	S	S	*	*				49.2	132.4	128.9	-56.8	-67.9	0	0	0	121.8
8	S	23	Very low	25.7	Very low	122 Å²	122	150.9 Å²	150.9	85%	0.853	80%	0.802	S	S	*	*				-166.6	177.6	91.4	-157.7	0	0	0	0	112.5
9	T	24.4	Very low	25.5	Very low	124 Å²	124	152.5 Å²	152.5	76%	0.761	80%	0.801	S	S	*	*			trans	-118.3	150.3	-161.7	-25.1	0	0	0	0	113.6
10	A	24.2	Very low	25.6	Very low	82 Å²	82	151.3 Å²	151.3	68%	0.678	80%	0.803	S	S	*	*			trans	81.1	143.3	143	0	0	0	0	0	122.6
11	K	26.8	Very low	25.4	Very low	181 Å²	181	153.1 Å²	153.1	79%	0.787	80%	0.8	S	S	*	*			trans	81.4	101.8	145.9	-78.3	174.7	178.4	-178.8	0	122.7
12	Q	26.2	Very low	25.2	Very low	161 Å²	161	148.2 Å²	148.2	75%	0.752	78%	0.783	S	S	*	*				84.6	148.7	107	-140.9	176.7	-1.3	0	0	120.6
13	I	25.9	Very low	25.1	Very low	144 Å²	144	147.7 Å²	147.7	74%	0.738	76%	0.764	S	S	*	*			trans	82.8	90.6	163	-46.5	-178.1	0	0	0	119.1
14	N	24	Very low	25	Very low	145 Å²	145	144.6 Å²	144.6	78%	0.775	76%	0.762	S	S	*	*				50.2	137.9	112.8	-119.4	-18.6	0	0	0	124.1
15	Q	24.1	Very low	24.9	Very low	154 Å²	154	144.8 Å²	144.8	72%	0.72	76%	0.759	S	S	*	*			trans	94.7	108	150.1	-65.8	-168.1	8.3	0	0	124.1
16	I	26.1	Very low	24.8	Very low	124 Å²	124	145.6 Å²	145.6	64%	0.636	76%	0.76	S	S	*	*				78.6	131.8	118.7	-64.6	170.5	0	0	0	121.9
17	Q	24.3	Very low	24.8	Very low	167 Å²	167	151.1 Å²	151.1	78%	0.78	77%	0.773	S	S	*	*			trans	69.4	147	164.8	-81.4	155	-26.2	0	0	117.9
18	D	24	Very low	24.9	Very low	147 Å²	147	149.4 Å²	149.4	79%	0.786	78%	0.775	S	S	*	*			cis	-137.6	-179.9	16.8	-136	-31.3	0	0	0	116.2
19	K	22.7	Very low	25.1	Very low	182 Å²	182	152.5 Å²	152.5	79%	0.791	78%	0.776	S	S	*	*			trans	-109.5	154.7	-174.8	-97.1	175.6	-179.3	173	0	111.8
20	P	27.9	Very low	25.1	Very low	128 Å²	128	154.4 Å²	154.4	83%	0.831	78%	0.777	S	S	*	*				-152.7	155.5	80.4	38.9	-18.2	0	0	0	120.3
21	Y	22.1	Very low	25.4	Very low	189 Å²	189	159.2 Å²	159.2	74%	0.741	79%	0.785	S	S	*	*			trans	-20.7	140.7	154.6	-121.4	-123.4	0	0	0	120.1	I23	Y21-I23 HydrophobicContact CD1-CD1 4.47Å; Y21-I23 HydrophobicContact CE1-CD1 3.73Å; Y21-I23 HydrophobicContact CE1-CG1 4.48Å
22	V	23.7	Very low	25.4	Very low	137 Å²	137	155.8 Å²	155.8	83%	0.83	77%	0.772	S	S	*	*				-173.8	143.1	100	154.5	0	0	0	0	112.8
23	I	26.3	Very low	25.8	Very low	99 Å²	99	154.9 Å²	154.9	51%	0.508	77%	0.765	S	S	.	*			trans	-73.9	146.7	-171.4	-65.6	147.6	0	0	0	116.6	Y21 Q25	Y21-I23 HydrophobicContact CD1-CD1 4.47Å; Y21-I23 HydrophobicContact CE1-CD1 3.73Å; Y21-I23 HydrophobicContact CE1-CG1 4.48Å; I23-Q25 HydrophobicContact CG2-CG 4.05Å
24	T	26.1	Very low	26.3	Very low	135 Å²	135	155.2 Å²	155.2	83%	0.828	76%	0.764	S	S	*	*			trans	-165.7	97.4	131.9	15.5	0	0	0	0	110.9
25	Q	26.2	Very low	27.2	Very low	173 Å²	173	157.7 Å²	157.7	81%	0.808	77%	0.768	S	S	*	*				61.3	106.1	92.9	-81	-163.9	-10.2	0	0	118.1	I23	I23-Q25 HydrophobicContact CG2-CG 4.05Å
26	K	22.7	Very low	28.6	Very low	207 Å²	207	153.9 Å²	153.9	90%	0.9	75%	0.752	S	S	*	*				-164.8	163.9	120.8	-115.8	175.1	-178.4	178.3	0	113.1
27	Q	25.7	Very low	30.4	Very low	189 Å²	189	154.1 Å²	154.1	88%	0.883	75%	0.748	S	S	*	*			trans	59.3	92.2	173.2	-75.8	176.9	-36.9	0	0	118.2
28	V	27.1	Very low	32.3	Very low	148 Å²	148	151.1 Å²	151.1	90%	0.897	74%	0.741	S	S	*	*			trans	-103	164.2	142.8	175.2	0	0	0	0	106.9
29	Q	25.9	Very low	34.4	Very low	186 Å²	186	149 Å²	149	87%	0.869	73%	0.726	S	S	*	*			trans	93.4	77	158.5	-158.9	172.1	18.5	0	0	118.8
30	Q	26.3	Very low	37	Very low	165 Å²	165	143 Å²	143	77%	0.771	70%	0.703	S	S	*	*				-154.2	122.6	128.6	-128.6	167	-19.6	0	0	109.8
31	Q	28.5	Very low	39.4	Very low	182 Å²	182	138.7 Å²	138.7	85%	0.85	68%	0.678	S	S	*	*			trans	-111.5	102.5	167.1	-83.1	-175.2	-46.8	0	0	107.2
32	H	28.3	Very low	42	Very low	109 Å²	109	134.7 Å²	134.7	51%	0.505	67%	0.669	S	S	.	*			trans	-63.7	134.5	170.8	-173.8	-59.1	0	0	0	108.5	Q34 E253	H32-Q34 PolarHBondContact O-N 2.95Å; H32-E253 IonicContact CD2-OE1 2.69Å; H32-E253 IonicContact CD2-OE2 2.74Å; H32-E253 PolarHBondContact CD2-OE2 3.21Å; H32-E253 VanDerWaalsContact CD2-OE2 3.31Å; H32-E253 IonicContact CE1-OE1 3.49Å; H32-E253 IonicContact CG-OE1 3.18Å; H32-E253 IonicContact CG-OE2 2.61Å; H32-E253 IonicContact ND1-OE1 2.68Å; H32-E253 IonicContact NE2-OE1 3.46Å
33	F	34.1	Very low	44.7	Very low	142 Å²	142	131.1 Å²	131.1	62%	0.623	65%	0.65	S	S	*	*			trans	-71.7	106.7	176	-119.3	-92.3	0	0	0	108.3	E253	F33-E253 PolarHBondContact N-OE1 2.99Å
34	Q	37.1	Very low	47.5	Very low	152 Å²	152	127.1 Å²	127.1	71%	0.71	63%	0.629	S	S	*	*			trans	-69.4	141.8	168	-73.9	-167	-4.2	0	0	109.1	H32 L36	H32-Q34 PolarHBondContact O-N 2.95Å; Q34-L36 VanDerWaalsContact C-N 3.33Å; Q34-L36 PolarHBondContact O-N 3.17Å
35	K	42.3	Very low	50.2	Low	196 Å²	196	123.2 Å²	123.2	85%	0.852	60%	0.602	S	S	*	*			trans	-74.9	91.3	174.7	-174.9	-172.4	179.2	-169.6	0	107.7	K37	K35-K37 PolarHBondContact O-N 3.31Å
36	L	54.3	Low	52.7	Low	74 Å²	74	118.2 Å²	118.2	39%	0.387	58%	0.582	S	S	.	*			trans	-42.9	126.7	-177.3	-71.8	158.2	0	0	0	111.4	Q34 D40 A99 F100	Q34-L36 VanDerWaalsContact C-N 3.33Å; Q34-L36 PolarHBondContact O-N 3.17Å; L36-D40 WeakPolarHBondContact CA-OD2 3.38Å; L36-D40 HydrophobicContact CD2-CB 3.87Å; L36-A99 HydrophobicContact CD1-CB 4.39Å; L36-A99 WeakPolarHBondContact CD1-O 3.48Å; L36-A99 HydrophobicContact CD2-CB 4.31Å; L36-F100 HydrophobicContact CD1-CD1 4.29Å; L36-F100 HydrophobicContact CD1-CE1 4.5Å; L36-F100 HydrophobicContact CD2-CE1 4.27Å
37	K	62	Low	55.4	Low	129 Å²	129	112.9 Å²	112.9	56%	0.561	56%	0.56	S	S	*	*			trans	-91.7	177.5	178.3	-47.7	-171.5	-174	174.4	0	110.7	K35 E39 D40	K35-K37 PolarHBondContact O-N 3.31Å; K37-E39 VanDerWaalsContact C-N 3.3Å; K37-E39 VanDerWaalsContact CB-OE1 3.23Å; K37-E39 WeakPolarHBondContact CB-OE1 3.39Å; K37-E39 WeakPolarHBondContact CD-OE2 3.3Å; K37-E39 IonicContact NZ-OE2 3.31Å; K37-E39 PolarHBondContact NZ-OE2 2.94Å; K37-D40 PolarHBondContact N-OD2 3Å
38	V	64.2	Low	58.2	Low	104 Å²	104	103.9 Å²	103.9	63%	0.63	52%	0.518	S	S	*	.	H	α-helix	trans	-69.9	-37.9	176.1	-176.5	0	0	0	0	109.4	D40 A41 L42	V38-D40 VanDerWaalsContact C-N 3.3Å; V38-D40 PolarHBondContact O-N 3.02Å; V38-A41 PolarHBondContact O-N 3.36Å; V38-A41 VanDerWaalsContact O-N 3.09Å; V38-L42 HydrophobicContact CG1-CD1 4.07Å; V38-L42 HydrophobicContact CG1-CG 4.32Å; V38-L42 WeakPolarHBondContact O-CG 3.47Å; V38-L42 PolarHBondContact O-N 3.46Å
39	E	70.2	Confident	60.8	Low	102 Å²	102	100.7 Å²	100.7	48%	0.477	49%	0.492	S	S	.	.	H	α-helix	trans	-53.8	-40.9	175.3	-50.8	92.4	-80.3	0	0	112.8	K37 A41 L42 S43	K37-E39 VanDerWaalsContact C-N 3.3Å; K37-E39 VanDerWaalsContact CB-OE1 3.23Å; K37-E39 WeakPolarHBondContact CB-OE1 3.39Å; K37-E39 WeakPolarHBondContact CD-OE2 3.3Å; K37-E39 IonicContact NZ-OE2 3.31Å; K37-E39 PolarHBondContact NZ-OE2 2.94Å; E39-A41 PolarHBondContact O-N 3.49Å; E39-L42 PolarHBondContact O-N 3.1Å; E39-S43 WeakPolarHBondContact O-CB 3.5Å; E39-S43 PolarHBondContact O-N 3.26Å
40	D	76.8	Confident	63.4	Low	58 Å²	58	97 Å²	97	31%	0.31	48%	0.477	S	S	.	.	H	α-helix	trans	-66	-38.8	178.3	-59.5	-45.9	0	0	0	111.7	L36 K37 V38 Y44	L36-D40 WeakPolarHBondContact CA-OD2 3.38Å; L36-D40 HydrophobicContact CD2-CB 3.87Å; K37-D40 PolarHBondContact N-OD2 3Å; V38-D40 VanDerWaalsContact C-N 3.3Å; V38-D40 PolarHBondContact O-N 3.02Å; D40-Y44 PolarHBondContact O-N 3.07Å
41	A	77.2	Confident	65.8	Low	36 Å²	36	95.1 Å²	95.1	30%	0.298	46%	0.463	S	S	.	.	H	α-helix	trans	-72.5	-36.5	178.3	0	0	0	0	0	112.1	V38 E39 L45 F100	V38-A41 PolarHBondContact O-N 3.36Å; V38-A41 VanDerWaalsContact O-N 3.09Å; E39-A41 PolarHBondContact O-N 3.49Å; A41-L45 WeakPolarHBondContact O-CG 3.37Å; A41-L45 PolarHBondContact O-N 2.88Å; A41-F100 HydrophobicContact CB-CE1 3.84Å; A41-F100 HydrophobicContact CB-CZ 4.44Å
42	L	77.4	Confident	68.3	Low	106 Å²	106	87.2 Å²	87.2	56%	0.555	43%	0.425	S	S	*	.	H	α-helix	trans	-66.4	-45.8	173.1	-68.2	172.6	0	0	0	111	V38 E39 Y44 L45 D46	V38-L42 HydrophobicContact CG1-CD1 4.07Å; V38-L42 HydrophobicContact CG1-CG 4.32Å; V38-L42 WeakPolarHBondContact O-CG 3.47Å; V38-L42 PolarHBondContact O-N 3.46Å; E39-L42 PolarHBondContact O-N 3.1Å; L42-Y44 VanDerWaalsContact C-N 3.31Å; L42-Y44 PolarHBondContact O-N 3.11Å; L42-L45 WeakPolarHBondContact O-CB 3.2Å; L42-L45 PolarHBondContact O-N 3.11Å; L42-L45 VanDerWaalsContact O-N 3.16Å; L42-D46 PolarHBondContact O-N 3.2Å
43	S	80.5	Confident	70.4	Confident	62 Å²	62	85.1 Å²	85.1	43%	0.434	43%	0.427	S	S	.	.	H	α-helix	trans	-60.4	-38.7	175.6	-174.9	0	0	0	0	112.4	E39 D46 Q47	E39-S43 WeakPolarHBondContact O-CB 3.5Å; E39-S43 PolarHBondContact O-N 3.26Å; S43-D46 PolarHBondContact O-N 3.1Å; S43-Q47 WeakPolarHBondContact O-CB 3.47Å; S43-Q47 VanDerWaalsContact O-CG 3.22Å; S43-Q47 WeakPolarHBondContact O-CG 3.37Å; S43-Q47 PolarHBondContact O-N 3.13Å; S43-Q47 PolarHBondContact O-NE2 3.39Å; S43-Q47 PolarHBondContact OG-NE2 2.86Å; S43-Q47 VanDerWaalsContact OG-NE2 3.14Å
44	Y	84.9	Confident	72	Confident	15 Å²	15	86.1 Å²	86.1	6%	0.059	44%	0.439	C	S	.	.	H	α-helix	trans	-68.6	-39.5	174.7	178.5	-96.3	0	0	0	112.7	D40 L42 D46 Q47 V48 F62 L93 F97 F100	D40-Y44 PolarHBondContact O-N 3.07Å; L42-Y44 VanDerWaalsContact C-N 3.31Å; L42-Y44 PolarHBondContact O-N 3.11Å; Y44-D46 VanDerWaalsContact C-N 3.33Å; Y44-D46 PolarHBondContact O-N 2.87Å; Y44-Q47 PolarHBondContact O-N 2.89Å; Y44-V48 HydrophobicContact CD1-CG2 4.49Å; Y44-V48 HydrophobicContact CE1-CG2 3.94Å; Y44-V48 HydrophobicContact CE2-CG2 4.49Å; Y44-V48 WeakPolarHBondContact O-CG2 3.2Å; Y44-V48 PolarHBondContact O-N 2.78Å; Y44-V48 VanDerWaalsContact O-N 3.12Å; Y44-F62 HydrophobicContact CE1-CE1 4.44Å; Y44-F62 HydrophobicContact CE1-CZ 4Å; Y44-L93 PolarHBondContact OH-O 2.92Å; Y44-L93 VanDerWaalsContact OH-O 3.06Å; Y44-F97 AromaticContact CE1-CD2 3.88Å; Y44-F97 HydrophobicContact CE1-CD2 3.88Å; Y44-F100 HydrophobicContact CD1-CD2 4.26Å; Y44-F100 AromaticContact CD1-CE2 3.8Å; Y44-F100 HydrophobicContact CD1-CE2 3.8Å; Y44-F100 AromaticContact CD2-CE2 4Å; Y44-F100 HydrophobicContact CD2-CE2 4Å; Y44-F100 HydrophobicContact CG-CD2 4.33Å; Y44-F100 AromaticContact CG-CE2 3.48Å; Y44-F100 HydrophobicContact CG-CE2 3.48Å; Y44-F100 VanDerWaalsContact CG-CE2 3.48Å; Y44-F100 HydrophobicContact CG-CZ 4.13Å
45	L	83.6	Confident	73.6	Confident	52 Å²	52	82.4 Å²	82.4	27%	0.272	42%	0.424	S	S	.	.	H	α-helix	trans	-60.7	-42.7	173.5	-83.9	164	0	0	0	111.8	A41 L42 V48 K49 Y59 F62 L63	A41-L45 WeakPolarHBondContact O-CG 3.37Å; A41-L45 PolarHBondContact O-N 2.88Å; L42-L45 WeakPolarHBondContact O-CB 3.2Å; L42-L45 PolarHBondContact O-N 3.11Å; L42-L45 VanDerWaalsContact O-N 3.16Å; L45-V48 PolarHBondContact O-N 3.43Å; L45-K49 WeakPolarHBondContact O-CB 3.47Å; L45-K49 PolarHBondContact O-N 3Å; L45-Y59 HydrophobicContact CD2-CE2 4.48Å; L45-F62 HydrophobicContact CD2-CD1 4.28Å; L45-F62 HydrophobicContact CD2-CE1 3.85Å; L45-L63 HydrophobicContact CD2-CD2 4.04Å
46	D	78.8	Confident	75.3	Confident	69 Å²	69	76.9 Å²	76.9	37%	0.369	41%	0.408	S	S	.	.	H	α-helix	trans	-68.3	-39.3	177.6	-172.7	52.2	0	0	0	112.3	L42 S43 Y44 V48 K49 I50	L42-D46 PolarHBondContact O-N 3.2Å; S43-D46 PolarHBondContact O-N 3.1Å; Y44-D46 VanDerWaalsContact C-N 3.33Å; Y44-D46 PolarHBondContact O-N 2.87Å; D46-V48 PolarHBondContact O-N 3.44Å; D46-K49 WeakPolarHBondContact O-CB 3.32Å; D46-K49 PolarHBondContact O-N 2.97Å; D46-I50 WeakPolarHBondContact O-CB 3.37Å; D46-I50 WeakPolarHBondContact O-CG1 3.43Å; D46-I50 PolarHBondContact O-N 3.24Å; D46-I50 WeakPolarHBondContact OD2-CD1 3.5Å
47	Q	79.3	Confident	76.2	Confident	95 Å²	95	74.7 Å²	74.7	44%	0.444	40%	0.403	S	S	.	.	H	α-helix	trans	-57.6	-35.9	171	-74.6	167.4	57.4	0	0	112.7	S43 Y44 R51 L93	S43-Q47 WeakPolarHBondContact O-CB 3.47Å; S43-Q47 VanDerWaalsContact O-CG 3.22Å; S43-Q47 WeakPolarHBondContact O-CG 3.37Å; S43-Q47 PolarHBondContact O-N 3.13Å; S43-Q47 PolarHBondContact O-NE2 3.39Å; S43-Q47 PolarHBondContact OG-NE2 2.86Å; S43-Q47 VanDerWaalsContact OG-NE2 3.14Å; Y44-Q47 PolarHBondContact O-N 2.89Å; Q47-R51 VanDerWaalsContact O-CB 3.27Å; Q47-R51 WeakPolarHBondContact O-CB 3.44Å; Q47-R51 WeakPolarHBondContact O-CG 3.05Å; Q47-R51 PolarHBondContact O-N 2.98Å; Q47-L93 HydrophobicContact CB-CD2 4.34Å
48	V	83.8	Confident	77.2	Confident	0 Å²	0	70 Å²	70	0%	0	38%	0.384	C	S	.	.	H	α-helix	trans	-71.4	-44.7	172.2	177.4	0	0	0	0	111.1	Y44 L45 D46 R51 F52 Y59 F62 F87 L93	Y44-V48 HydrophobicContact CD1-CG2 4.49Å; Y44-V48 HydrophobicContact CE1-CG2 3.94Å; Y44-V48 HydrophobicContact CE2-CG2 4.49Å; Y44-V48 WeakPolarHBondContact O-CG2 3.2Å; Y44-V48 PolarHBondContact O-N 2.78Å; Y44-V48 VanDerWaalsContact O-N 3.12Å; L45-V48 PolarHBondContact O-N 3.43Å; D46-V48 PolarHBondContact O-N 3.44Å; V48-R51 PolarHBondContact O-N 3.13Å; V48-F52 HydrophobicContact CG1-CD2 3.88Å; V48-F52 HydrophobicContact CG1-CE2 4.29Å; V48-F52 WeakPolarHBondContact O-CD2 3.49Å; V48-F52 PolarHBondContact O-N 2.71Å; V48-Y59 HydrophobicContact CG1-CD2 4.1Å; V48-F62 HydrophobicContact CG1-CD1 4.41Å; V48-F87 HydrophobicContact CB-CZ 4.42Å; V48-F87 HydrophobicContact CG1-CE1 3.75Å; V48-F87 HydrophobicContact CG1-CZ 3.52Å; V48-F87 HydrophobicContact CG2-CE2 4.13Å; V48-F87 HydrophobicContact CG2-CZ 3.89Å; V48-L93 HydrophobicContact CG2-CD1 4.4Å; V48-L93 HydrophobicContact CG2-CD2 4.12Å
49	K	80.6	Confident	78	Confident	81 Å²	81	67.7 Å²	67.7	35%	0.352	37%	0.365	S	S	.	.	H	α-helix	trans	-57.4	-50.9	178.3	-175	-173.9	173.2	-168.6	0	111.5	L45 D46 F52 A53 Y59 E667	L45-K49 WeakPolarHBondContact O-CB 3.47Å; L45-K49 PolarHBondContact O-N 3Å; D46-K49 WeakPolarHBondContact O-CB 3.32Å; D46-K49 PolarHBondContact O-N 2.97Å; K49-F52 CarbonylContact O-C 3.22Å; K49-F52 PolarHBondContact O-N 3.4Å; K49-A53 WeakPolarHBondContact O-CA 3.36Å; K49-A53 PolarHBondContact O-N 3.39Å; K49-Y59 HydrophobicContact CB-CD2 4.14Å; K49-Y59 HydrophobicContact CB-CE2 3.89Å; K49-Y59 HydrophobicContact CG-CE2 4.47Å; K49-E667 IonicContact NZ-OE1 3.4Å; K49-E667 PolarHBondContact NZ-OE1 3.32Å
50	I	81.4	Confident	78.6	Confident	109 Å²	109	67.1 Å²	67.1	56%	0.559	37%	0.365	S	S	*	.	H	α-helix	trans	-61.9	-45.8	177.1	-68.4	171.3	0	0	0	111.2	D46 F52 A53	D46-I50 WeakPolarHBondContact O-CB 3.37Å; D46-I50 WeakPolarHBondContact O-CG1 3.43Å; D46-I50 PolarHBondContact O-N 3.24Å; D46-I50 WeakPolarHBondContact OD2-CD1 3.5Å; I50-F52 VanDerWaalsContact C-N 3.32Å; I50-F52 PolarHBondContact O-N 3.35Å; I50-A53 WeakPolarHBondContact O-CB 3.29Å; I50-A53 PolarHBondContact O-N 2.97Å
51	R	76.6	Confident	78.9	Confident	124 Å²	124	69.6 Å²	69.6	47%	0.468	37%	0.373	S	S	.	.	H	α-helix	trans	-69	-28.1	-177.4	-76.6	-64.6	-164.8	76.9	2.2	114.1	Q47 V48 D92 L93	Q47-R51 VanDerWaalsContact O-CB 3.27Å; Q47-R51 WeakPolarHBondContact O-CB 3.44Å; Q47-R51 WeakPolarHBondContact O-CG 3.05Å; Q47-R51 PolarHBondContact O-N 2.98Å; V48-R51 PolarHBondContact O-N 3.13Å; R51-D92 IonicContact CZ-OD2 3.51Å; R51-D92 IonicContact NH1-OD1 2.85Å; R51-D92 PolarHBondContact NH1-OD1 3.23Å; R51-D92 IonicContact NH1-OD2 3.46Å; R51-D92 PolarHBondContact NH1-OD2 2.79Å; R51-D92 IonicContact NH2-OD2 3.43Å; R51-D92 PolarHBondContact NH2-OD2 3.28Å; R51-L93 HydrophobicContact CB-CD1 3.93Å; R51-L93 HydrophobicContact CG-CD1 4.28Å; R51-L93 HydrophobicContact CG-CD2 4.48Å
52	F	81.1	Confident	79.4	Confident	16 Å²	16	68.1 Å²	68.1	7%	0.07	36%	0.36	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.4	22.9	175.6	-61.7	-68.9	0	0	0	113.4	V48 K49 I50 N54 D55 I58 F87 H90 L93	V48-F52 HydrophobicContact CG1-CD2 3.88Å; V48-F52 HydrophobicContact CG1-CE2 4.29Å; V48-F52 WeakPolarHBondContact O-CD2 3.49Å; V48-F52 PolarHBondContact O-N 2.71Å; K49-F52 CarbonylContact O-C 3.22Å; K49-F52 PolarHBondContact O-N 3.4Å; I50-F52 VanDerWaalsContact C-N 3.32Å; I50-F52 PolarHBondContact O-N 3.35Å; F52-N54 PolarHBondContact O-N 3.02Å; F52-D55 CarbonylContact O-C 3.55Å; F52-D55 PolarHBondContact O-N 3.1Å; F52-I58 HydrophobicContact CB-CB 4.26Å; F52-I58 HydrophobicContact CB-CG2 4.33Å; F52-I58 HydrophobicContact CD1-CB 4.1Å; F52-I58 HydrophobicContact CD1-CD1 3.66Å; F52-I58 HydrophobicContact CD1-CG1 4.48Å; F52-I58 HydrophobicContact CD1-CG2 3.78Å; F52-I58 HydrophobicContact CD2-CG2 3.75Å; F52-I58 HydrophobicContact CE1-CD1 3.86Å; F52-I58 HydrophobicContact CE1-CG2 3.95Å; F52-I58 HydrophobicContact CE2-CG2 3.91Å; F52-I58 HydrophobicContact CG-CB 4.07Å; F52-I58 HydrophobicContact CG-CD1 4.47Å; F52-I58 HydrophobicContact CG-CG2 3.68Å; F52-I58 HydrophobicContact CZ-CG2 4.01Å; F52-F87 HydrophobicContact CD2-CD1 4.32Å; F52-F87 HydrophobicContact CD2-CE1 4.16Å; F52-F87 AromaticContact CE2-CD1 3.34Å; F52-F87 HydrophobicContact CE2-CD1 3.34Å; F52-F87 AromaticContact CE2-CE1 3.57Å; F52-F87 HydrophobicContact CE2-CE1 3.57Å; F52-F87 HydrophobicContact CE2-CG 4.19Å; F52-F87 AromaticContact CZ-CD1 3.71Å; F52-F87 HydrophobicContact CZ-CD1 3.71Å; F52-F87 HydrophobicContact CZ-CE1 4.35Å; F52-F87 HydrophobicContact CZ-CG 4.42Å; F52-H90 AromaticContact CE1-CD2 3.56Å; F52-H90 AromaticContact CE1-NE2 3.75Å; F52-H90 HydrophobicContact CZ-CB 4.42Å; F52-H90 AromaticContact CZ-CD2 3.5Å; F52-H90 VanDerWaalsContact CZ-CD2 3.5Å; F52-H90 WeakPolarHBondContact CZ-CD2 3.39Å; F52-H90 AromaticContact CZ-CG 4Å; F52-L93 HydrophobicContact CD2-CD1 4.25Å; F52-L93 HydrophobicContact CE2-CD1 3.46Å; F52-L93 VanDerWaalsContact CE2-CD1 3.46Å; F52-L93 HydrophobicContact CZ-CD1 4.07Å
53	A	71.6	Confident	79.9	Confident	66 Å²	66	66.2 Å²	66.2	55%	0.545	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.3	-28.7	178	0	0	0	0	0	113.4	K49 I50	K49-A53 WeakPolarHBondContact O-CA 3.36Å; K49-A53 PolarHBondContact O-N 3.39Å; I50-A53 WeakPolarHBondContact O-CB 3.29Å; I50-A53 PolarHBondContact O-N 2.97Å
54	N	68.9	Low	80.1	Confident	162 Å²	162	67.1 Å²	67.1	87%	0.866	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.7	-9.4	176.7	-63	-31.8	0	0	0	114.5	F52	F52-N54 PolarHBondContact O-N 3.02Å
55	D	71	Confident	80.2	Confident	75 Å²	75	67.1 Å²	67.1	40%	0.401	35%	0.35	S	S	.	.			trans	-140.2	83.1	169.4	-175.2	-6.3	0	0	0	110.6	F52 G57 I58	F52-D55 CarbonylContact O-C 3.55Å; F52-D55 PolarHBondContact O-N 3.1Å; D55-G57 PolarHBondContact O-N 3.41Å; D55-G57 VanDerWaalsContact OD1-CA 3.29Å; D55-G57 WeakPolarHBondContact OD1-CA 3.45Å; D55-G57 PolarHBondContact OD1-N 3.32Å; D55-I58 HydrophobicContact CB-CD1 4.13Å; D55-I58 HydrophobicContact CB-CG1 4.36Å; D55-I58 PolarHBondContact O-N 3.18Å; D55-I58 WeakPolarHBondContact OD2-CD1 3.41Å
56	P	76.3	Confident	80.2	Confident	79 Å²	79	67.8 Å²	67.8	51%	0.513	35%	0.353	S	S	.	.	H	α-helix	trans	-58.3	-17.3	175.3	-25.1	35.1	0	0	0	113.9	I58 Y59 N60	P56-I58 PolarHBondContact O-N 3.4Å; P56-Y59 PolarHBondContact O-N 2.9Å; P56-N60 PolarHBondContact O-N 2.81Å; P56-N60 VanDerWaalsContact O-N 3.11Å; P56-N60 PolarHBondContact O-ND2 2.94Å
57	G	74.1	Confident	80.4	Confident	28 Å²	28	71.3 Å²	71.3	29%	0.289	37%	0.365	S	S	.	.	H	α-helix	trans	-67.8	-21.9	175.4	0	0	0	0	0	113.3	D55 K61	D55-G57 PolarHBondContact O-N 3.41Å; D55-G57 VanDerWaalsContact OD1-CA 3.29Å; D55-G57 WeakPolarHBondContact OD1-CA 3.45Å; D55-G57 PolarHBondContact OD1-N 3.32Å; G57-K61 WeakPolarHBondContact O-CD 3.26Å; G57-K61 VanDerWaalsContact O-CE 3.22Å; G57-K61 WeakPolarHBondContact O-CE 3.43Å; G57-K61 WeakPolarHBondContact O-CG 3.41Å
58	I	82	Confident	80.6	Confident	30 Å²	30	69.8 Å²	69.8	15%	0.154	36%	0.358	C	S	.	.	H	α-helix	trans	-79.1	-45.2	173.2	-66.8	172.9	0	0	0	110.4	F52 D55 P56 N60 K61 F62 L86 F87	F52-I58 HydrophobicContact CB-CB 4.26Å; F52-I58 HydrophobicContact CB-CG2 4.33Å; F52-I58 HydrophobicContact CD1-CB 4.1Å; F52-I58 HydrophobicContact CD1-CD1 3.66Å; F52-I58 HydrophobicContact CD1-CG1 4.48Å; F52-I58 HydrophobicContact CD1-CG2 3.78Å; F52-I58 HydrophobicContact CD2-CG2 3.75Å; F52-I58 HydrophobicContact CE1-CD1 3.86Å; F52-I58 HydrophobicContact CE1-CG2 3.95Å; F52-I58 HydrophobicContact CE2-CG2 3.91Å; F52-I58 HydrophobicContact CG-CB 4.07Å; F52-I58 HydrophobicContact CG-CD1 4.47Å; F52-I58 HydrophobicContact CG-CG2 3.68Å; F52-I58 HydrophobicContact CZ-CG2 4.01Å; D55-I58 HydrophobicContact CB-CD1 4.13Å; D55-I58 HydrophobicContact CB-CG1 4.36Å; D55-I58 PolarHBondContact O-N 3.18Å; D55-I58 WeakPolarHBondContact OD2-CD1 3.41Å; P56-I58 PolarHBondContact O-N 3.4Å; I58-N60 PolarHBondContact O-N 2.7Å; I58-K61 PolarHBondContact O-N 3.4Å; I58-F62 PolarHBondContact O-N 2.87Å; I58-L86 HydrophobicContact CB-CD1 4.45Å; I58-L86 HydrophobicContact CG2-CD1 3.9Å; I58-L86 HydrophobicContact CG2-CG 3.99Å; I58-F87 HydrophobicContact CG2-CD1 4.22Å; I58-F87 HydrophobicContact CG2-CE1 4.13Å
59	Y	82.6	Confident	80.5	Confident	57 Å²	57	73.4 Å²	73.4	22%	0.224	37%	0.374	C	S	.	.	H	α-helix	trans	-59.8	-45.3	177.9	-178.5	-104.4	0	0	0	112.2	L45 V48 K49 P56 K61 F62 L63	L45-Y59 HydrophobicContact CD2-CE2 4.48Å; V48-Y59 HydrophobicContact CG1-CD2 4.1Å; K49-Y59 HydrophobicContact CB-CD2 4.14Å; K49-Y59 HydrophobicContact CB-CE2 3.89Å; K49-Y59 HydrophobicContact CG-CE2 4.47Å; P56-Y59 PolarHBondContact O-N 2.9Å; Y59-K61 PolarHBondContact O-N 3.47Å; Y59-F62 WeakPolarHBondContact O-CB 3.17Å; Y59-F62 PolarHBondContact O-N 3.28Å; Y59-F62 VanDerWaalsContact O-N 3.13Å; Y59-L63 HydrophobicContact CD1-CD1 4.14Å; Y59-L63 HydrophobicContact CE1-CD1 3.58Å; Y59-L63 HydrophobicContact CE1-CG 4.2Å; Y59-L63 PolarHBondContact O-N 3.12Å; Y59-L63 VanDerWaalsContact O-N 3.1Å
60	N	81.9	Confident	80.3	Confident	89 Å²	89	78.6 Å²	78.6	48%	0.476	40%	0.397	S	S	.	.	H	α-helix	trans	-62.3	-43	177.3	-76.8	-78.8	0	0	0	112.4	P56 I58 F62 L63 D64	P56-N60 PolarHBondContact O-N 2.81Å; P56-N60 VanDerWaalsContact O-N 3.11Å; P56-N60 PolarHBondContact O-ND2 2.94Å; I58-N60 PolarHBondContact O-N 2.7Å; N60-F62 PolarHBondContact O-N 3.44Å; N60-L63 PolarHBondContact O-N 3.23Å; N60-L63 VanDerWaalsContact O-N 3.15Å; N60-D64 PolarHBondContact O-N 3.41Å
61	K	83.4	Confident	80.2	Confident	111 Å²	111	77.2 Å²	77.2	48%	0.483	40%	0.396	S	S	.	.	H	α-helix	trans	-61.4	-32.3	174.5	-71	164.8	-162.7	154.9	0	112.6	G57 I58 Y59 D64 I65 L86	G57-K61 WeakPolarHBondContact O-CD 3.26Å; G57-K61 VanDerWaalsContact O-CE 3.22Å; G57-K61 WeakPolarHBondContact O-CE 3.43Å; G57-K61 WeakPolarHBondContact O-CG 3.41Å; I58-K61 PolarHBondContact O-N 3.4Å; Y59-K61 PolarHBondContact O-N 3.47Å; K61-D64 PolarHBondContact O-N 2.93Å; K61-I65 WeakPolarHBondContact O-CD1 3.28Å; K61-I65 VanDerWaalsContact O-CG1 3.26Å; K61-I65 WeakPolarHBondContact O-CG1 3.37Å; K61-I65 PolarHBondContact O-N 3.38Å; K61-L86 HydrophobicContact CB-CD1 3.86Å; K61-L86 HydrophobicContact CB-CD2 3.89Å; K61-L86 HydrophobicContact CD-CD1 4.03Å
62	F	87.6	Confident	80.1	Confident	4 Å²	4	79.7 Å²	79.7	2%	0.018	41%	0.413	C	S	.	.	H	α-helix	trans	-67.7	-44.7	175.2	179.2	-112.5	0	0	0	110.9	Y44 L45 V48 I58 Y59 N60 D64 I65 M66 V83 L86 F87 F97	Y44-F62 HydrophobicContact CE1-CE1 4.44Å; Y44-F62 HydrophobicContact CE1-CZ 4Å; L45-F62 HydrophobicContact CD2-CD1 4.28Å; L45-F62 HydrophobicContact CD2-CE1 3.85Å; V48-F62 HydrophobicContact CG1-CD1 4.41Å; I58-F62 PolarHBondContact O-N 2.87Å; Y59-F62 WeakPolarHBondContact O-CB 3.17Å; Y59-F62 PolarHBondContact O-N 3.28Å; Y59-F62 VanDerWaalsContact O-N 3.13Å; N60-F62 PolarHBondContact O-N 3.44Å; F62-D64 VanDerWaalsContact C-N 3.33Å; F62-D64 PolarHBondContact O-N 3.39Å; F62-I65 PolarHBondContact O-N 2.83Å; F62-M66 HydrophobicContact CD1-CG 4.46Å; F62-M66 HydrophobicContact CD2-CG 4.42Å; F62-M66 HydrophobicContact CE1-CG 4.06Å; F62-M66 HydrophobicContact CE2-CG 4.02Å; F62-M66 HydrophobicContact CE2-SD 4.24Å; F62-M66 HydrophobicContact CZ-CG 3.82Å; F62-M66 HydrophobicContact CZ-SD 4.1Å; F62-M66 WeakPolarHBondContact O-CG 3.48Å; F62-M66 PolarHBondContact O-N 3.13Å; F62-V83 HydrophobicContact CD2-CG1 4.38Å; F62-V83 HydrophobicContact CD2-CG2 4.11Å; F62-V83 HydrophobicContact CE2-CG1 3.96Å; F62-V83 HydrophobicContact CE2-CG2 3.85Å; F62-L86 VanDerWaalsContact CA-CD2 3.5Å; F62-L86 HydrophobicContact CB-CD2 3.67Å; F62-L86 HydrophobicContact CD2-CD2 4.49Å; F62-L86 VanDerWaalsContact N-CD2 3.32Å; F62-F87 HydrophobicContact CB-CE1 4.25Å; F62-F87 HydrophobicContact CB-CZ 4Å; F62-F87 HydrophobicContact CD1-CZ 4.2Å; F62-F87 HydrophobicContact CD2-CE1 4.26Å; F62-F87 AromaticContact CD2-CE2 3.8Å; F62-F87 HydrophobicContact CD2-CE2 3.8Å; F62-F87 AromaticContact CD2-CZ 3.36Å; F62-F87 HydrophobicContact CD2-CZ 3.36Å; F62-F87 AromaticContact CE2-CE2 3.83Å; F62-F87 HydrophobicContact CE2-CE2 3.83Å; F62-F87 AromaticContact CE2-CZ 3.83Å; F62-F87 HydrophobicContact CE2-CZ 3.83Å; F62-F87 HydrophobicContact CG-CE1 4.32Å; F62-F87 HydrophobicContact CG-CE2 4.41Å; F62-F87 AromaticContact CG-CZ 3.58Å; F62-F87 HydrophobicContact CG-CZ 3.58Å; F62-F87 HydrophobicContact CZ-CE2 4.46Å; F62-F87 HydrophobicContact CZ-CZ 4.42Å; F62-F97 HydrophobicContact CE2-CD2 4.44Å; F62-F97 HydrophobicContact CE2-CE2 4.06Å; F62-F97 HydrophobicContact CZ-CD2 4.34Å; F62-F97 AromaticContact CZ-CE2 3.97Å; F62-F97 HydrophobicContact CZ-CE2 3.97Å
63	L	87.5	Confident	79.8	Confident	66 Å²	66	82.3 Å²	82.3	35%	0.346	43%	0.434	S	S	.	.	H	α-helix	trans	-61.5	-39.9	174.1	-64.5	-177.6	0	0	0	112.2	L45 Y59 N60 M66 K67	L45-L63 HydrophobicContact CD2-CD2 4.04Å; Y59-L63 HydrophobicContact CD1-CD1 4.14Å; Y59-L63 HydrophobicContact CE1-CD1 3.58Å; Y59-L63 HydrophobicContact CE1-CG 4.2Å; Y59-L63 PolarHBondContact O-N 3.12Å; Y59-L63 VanDerWaalsContact O-N 3.1Å; N60-L63 PolarHBondContact O-N 3.23Å; N60-L63 VanDerWaalsContact O-N 3.15Å; L63-M66 PolarHBondContact O-N 3.49Å; L63-K67 WeakPolarHBondContact O-CB 3.4Å; L63-K67 PolarHBondContact O-N 3.16Å
64	D	84.3	Confident	80.2	Confident	82 Å²	82	80.1 Å²	80.1	44%	0.439	41%	0.413	S	S	.	.	H	α-helix	trans	-63.7	-42.5	175.4	-75.8	-37.6	0	0	0	112.4	N60 K61 F62 M66 K67 E68	N60-D64 PolarHBondContact O-N 3.41Å; K61-D64 PolarHBondContact O-N 2.93Å; F62-D64 VanDerWaalsContact C-N 3.33Å; F62-D64 PolarHBondContact O-N 3.39Å; D64-M66 PolarHBondContact O-N 3.45Å; D64-K67 WeakPolarHBondContact O-CB 3.19Å; D64-K67 PolarHBondContact O-N 2.92Å; D64-E68 PolarHBondContact O-N 2.61Å
65	I	87.1	Confident	80.6	Confident	14 Å²	14	77 Å²	77	7%	0.072	40%	0.396	C	S	.	.	H	α-helix	trans	-61.9	-44.5	173.7	-67.2	159.3	0	0	0	111	K61 F62 K67 E68 F69 I74 V79 R82 V83 L86	K61-I65 WeakPolarHBondContact O-CD1 3.28Å; K61-I65 VanDerWaalsContact O-CG1 3.26Å; K61-I65 WeakPolarHBondContact O-CG1 3.37Å; K61-I65 PolarHBondContact O-N 3.38Å; F62-I65 PolarHBondContact O-N 2.83Å; I65-K67 VanDerWaalsContact C-N 3.28Å; I65-K67 PolarHBondContact O-N 3.13Å; I65-E68 PolarHBondContact O-N 2.88Å; I65-F69 PolarHBondContact O-N 2.61Å; I65-I74 HydrophobicContact CG2-CD1 3.9Å; I65-V79 HydrophobicContact CG2-CG1 4.26Å; I65-R82 HydrophobicContact CD1-CB 3.81Å; I65-R82 HydrophobicContact CG1-CB 4.17Å; I65-R82 HydrophobicContact CG2-CB 4.23Å; I65-V83 HydrophobicContact CG2-CG2 3.95Å; I65-L86 HydrophobicContact CD1-CB 4.45Å; I65-L86 HydrophobicContact CD1-CD2 3.8Å
66	M	83.9	Confident	80.8	Confident	67 Å²	67	75 Å²	75	33%	0.33	39%	0.386	S	S	.	.	H	α-helix	trans	-66.1	-31.4	177.8	-68.7	-61.4	-68.7	0	0	112.2	F62 L63 D64 K70 F97	F62-M66 HydrophobicContact CD1-CG 4.46Å; F62-M66 HydrophobicContact CD2-CG 4.42Å; F62-M66 HydrophobicContact CE1-CG 4.06Å; F62-M66 HydrophobicContact CE2-CG 4.02Å; F62-M66 HydrophobicContact CE2-SD 4.24Å; F62-M66 HydrophobicContact CZ-CG 3.82Å; F62-M66 HydrophobicContact CZ-SD 4.1Å; F62-M66 WeakPolarHBondContact O-CG 3.48Å; F62-M66 PolarHBondContact O-N 3.13Å; L63-M66 PolarHBondContact O-N 3.49Å; D64-M66 PolarHBondContact O-N 3.45Å; M66-K70 WeakPolarHBondContact O-CB 3.39Å; M66-K70 PolarHBondContact O-N 2.96Å; M66-F97 HydrophobicContact SD-CE2 4Å; M66-F97 HydrophobicContact SD-CZ 3.96Å
67	K	82.9	Confident	81	Confident	142 Å²	142	73 Å²	73	62%	0.617	37%	0.373	S	S	*	.	H	α-helix	trans	-71.6	-45.6	174.5	-175	-179.9	179.4	-176.4	0	111.8	L63 D64 I65 F69 K70 S71	L63-K67 WeakPolarHBondContact O-CB 3.4Å; L63-K67 PolarHBondContact O-N 3.16Å; D64-K67 WeakPolarHBondContact O-CB 3.19Å; D64-K67 PolarHBondContact O-N 2.92Å; I65-K67 VanDerWaalsContact C-N 3.28Å; I65-K67 PolarHBondContact O-N 3.13Å; K67-F69 VanDerWaalsContact C-N 3.3Å; K67-F69 PolarHBondContact O-N 2.73Å; K67-K70 PolarHBondContact O-N 3.34Å; K67-K70 VanDerWaalsContact O-N 3.14Å; K67-S71 PolarHBondContact O-N 3.47Å; K67-S71 PolarHBondContact O-OG 3.26Å; K67-S71 VanDerWaalsContact O-OG 3.07Å
68	E	84.1	Confident	81.2	Confident	63 Å²	63	72.5 Å²	72.5	29%	0.294	37%	0.369	S	S	.	.	H	α-helix	trans	-56.5	-43.4	172.5	-80.5	-172.1	-121.8	0	0	111.5	D64 I65 S71 Q72 S73 I74 R82	D64-E68 PolarHBondContact O-N 2.61Å; I65-E68 PolarHBondContact O-N 2.88Å; E68-S71 WeakPolarHBondContact CA-OG 3.4Å; E68-S71 CarbonylContact O-C 3.42Å; E68-S71 PolarHBondContact O-N 2.96Å; E68-S71 PolarHBondContact O-OG 2.91Å; E68-Q72 PolarHBondContact O-N 3.4Å; E68-Q72 VanDerWaalsContact O-N 3.16Å; E68-S73 VanDerWaalsContact CA-OG 3.31Å; E68-S73 WeakPolarHBondContact CA-OG 3.44Å; E68-S73 VanDerWaalsContact CB-OG 3.29Å; E68-S73 WeakPolarHBondContact CB-OG 3.35Å; E68-S73 PolarHBondContact O-N 2.9Å; E68-S73 PolarHBondContact O-OG 3.1Å; E68-I74 HydrophobicContact CB-CD1 3.79Å; E68-I74 HydrophobicContact CB-CG1 3.88Å; E68-I74 WeakPolarHBondContact OE2-CG2 3.27Å; E68-R82 IonicContact OE1-NH1 3.8Å; E68-R82 PolarHBondContact OE1-NH1 2.86Å; E68-R82 IonicContact OE2-CZ 3.01Å; E68-R82 IonicContact OE2-NH1 3.06Å; E68-R82 PolarHBondContact OE2-NH1 3.34Å; E68-R82 IonicContact OE2-NH2 2.88Å; E68-R82 PolarHBondContact OE2-NH2 2.93Å
69	F	81.7	Confident	81.4	Confident	77 Å²	77	71.3 Å²	71.3	34%	0.338	36%	0.362	S	S	.	.	H	α-helix	trans	-62.4	-44.4	174.4	-175.8	-131.5	0	0	0	112.3	I65 K67 S71 Q72 I74 V79	I65-F69 PolarHBondContact O-N 2.61Å; K67-F69 VanDerWaalsContact C-N 3.3Å; K67-F69 PolarHBondContact O-N 2.73Å; F69-S71 VanDerWaalsContact C-N 3.26Å; F69-S71 PolarHBondContact O-N 3.34Å; F69-Q72 WeakPolarHBondContact O-CA 3.35Å; F69-Q72 PolarHBondContact O-N 3.37Å; F69-I74 HydrophobicContact CB-CG1 4.22Å; F69-V79 HydrophobicContact CB-CG2 3.55Å; F69-V79 HydrophobicContact CD1-CG2 4.29Å; F69-V79 HydrophobicContact CD2-CG2 3.45Å; F69-V79 VanDerWaalsContact CD2-CG2 3.45Å; F69-V79 HydrophobicContact CE2-CG2 4.19Å; F69-V79 HydrophobicContact CG-CG2 3.51Å
70	K	76.1	Confident	81.3	Confident	190 Å²	190	68.7 Å²	68.7	83%	0.826	35%	0.352	S	S	*	.	H	α-helix	trans	-64.7	-28.7	177.8	-167.1	172.9	-177.8	177.2	0	112.7	M66 K67 Q72	M66-K70 WeakPolarHBondContact O-CB 3.39Å; M66-K70 PolarHBondContact O-N 2.96Å; K67-K70 PolarHBondContact O-N 3.34Å; K67-K70 VanDerWaalsContact O-N 3.14Å; K70-Q72 VanDerWaalsContact C-N 3.34Å
71	S	78.8	Confident	81.2	Confident	79 Å²	79	68.3 Å²	68.3	55%	0.552	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.5	5.9	169.9	52.7	0	0	0	0	114.8	K67 E68 F69 S73	K67-S71 PolarHBondContact O-N 3.47Å; K67-S71 PolarHBondContact O-OG 3.26Å; K67-S71 VanDerWaalsContact O-OG 3.07Å; E68-S71 WeakPolarHBondContact CA-OG 3.4Å; E68-S71 CarbonylContact O-C 3.42Å; E68-S71 PolarHBondContact O-N 2.96Å; E68-S71 PolarHBondContact O-OG 2.91Å; F69-S71 VanDerWaalsContact C-N 3.26Å; F69-S71 PolarHBondContact O-N 3.34Å; S71-S73 PolarHBondContact O-N 3.41Å; S71-S73 PolarHBondContact OG-OG 3.31Å
72	Q	74.9	Confident	81.3	Confident	176 Å²	176	67.7 Å²	67.7	82%	0.822	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.4	21.1	-177.7	-52.3	-178	8.7	0	0	114.7	E68 F69 K70 I74	E68-Q72 PolarHBondContact O-N 3.4Å; E68-Q72 VanDerWaalsContact O-N 3.16Å; F69-Q72 WeakPolarHBondContact O-CA 3.35Å; F69-Q72 PolarHBondContact O-N 3.37Å; K70-Q72 VanDerWaalsContact C-N 3.34Å; Q72-I74 VanDerWaalsContact C-N 3.32Å
73	S	74.3	Confident	81.1	Confident	72 Å²	72	67.5 Å²	67.5	50%	0.503	34%	0.344	S	S	.	.	S	Bend	trans	-82.7	-10.9	178	61.4	0	0	0	0	113.4	E68 S71	E68-S73 VanDerWaalsContact CA-OG 3.31Å; E68-S73 WeakPolarHBondContact CA-OG 3.44Å; E68-S73 VanDerWaalsContact CB-OG 3.29Å; E68-S73 WeakPolarHBondContact CB-OG 3.35Å; E68-S73 PolarHBondContact O-N 2.9Å; E68-S73 PolarHBondContact O-OG 3.1Å; S71-S73 PolarHBondContact O-N 3.41Å; S71-S73 PolarHBondContact OG-OG 3.31Å
74	I	81.2	Confident	80.8	Confident	20 Å²	20	65.1 Å²	65.1	10%	0.103	33%	0.333	C	S	.	.	S	Bend	trans	-135.8	152.1	167	57	-179	0	0	0	110.2	I65 E68 F69 Q72 V79	I65-I74 HydrophobicContact CG2-CD1 3.9Å; E68-I74 HydrophobicContact CB-CD1 3.79Å; E68-I74 HydrophobicContact CB-CG1 3.88Å; E68-I74 WeakPolarHBondContact OE2-CG2 3.27Å; F69-I74 HydrophobicContact CB-CG1 4.22Å; Q72-I74 VanDerWaalsContact C-N 3.32Å; I74-V79 HydrophobicContact CD1-CG2 3.61Å; I74-V79 HydrophobicContact CG1-CG2 3.75Å
75	D	76.7	Confident	80.6	Confident	95 Å²	95	68.1 Å²	68.1	51%	0.508	34%	0.344	S	S	.	.			trans	-94.7	171.5	-178.9	70.2	-19.2	0	0	0	112.4	P77 G78 V79	D75-P77 WeakPolarHBondContact OD2-CD 3.36Å; D75-G78 WeakPolarHBondContact O-CA 3.23Å; D75-G78 PolarHBondContact O-N 3.43Å; D75-G78 WeakPolarHBondContact OD1-CA 3.39Å; D75-G78 PolarHBondContact OD1-N 2.82Å; D75-V79 WeakPolarHBondContact O-CG2 3.45Å; D75-V79 PolarHBondContact O-N 3.39Å
76	T	75.8	Confident	80.5	Confident	33 Å²	33	69 Å²	69	20%	0.202	35%	0.349	C	S	.	.	H	α-helix	trans	-57.9	-43.7	-177.2	-46.8	0	0	0	0	113.2	I80 P102 Y105	T76-I80 HydrophobicContact CG2-CD1 4.1Å; T76-I80 WeakPolarHBondContact O-CD1 3.41Å; T76-I80 VanDerWaalsContact O-CG1 3.28Å; T76-I80 WeakPolarHBondContact O-CG1 3.21Å; T76-I80 PolarHBondContact O-N 2.93Å; T76-I80 VanDerWaalsContact O-N 3.08Å; T76-P102 HydrophobicContact CG2-CG 4.24Å; T76-Y105 HydrophobicContact CG2-CG 4.48Å
77	P	79.4	Confident	80.5	Confident	38 Å²	38	65.8 Å²	65.8	25%	0.247	33%	0.333	C	S	.	.	H	α-helix	trans	-59.6	-41.7	169.3	-25	34.5	0	0	0	114.3	D75 I80 N81 Y105 L117	D75-P77 WeakPolarHBondContact OD2-CD 3.36Å; P77-I80 PolarHBondContact O-N 2.68Å; P77-N81 PolarHBondContact O-N 3.12Å; P77-N81 PolarHBondContact O-ND2 3Å; P77-Y105 HydrophobicContact CG-CE1 4.15Å; P77-L117 HydrophobicContact CB-CD1 4.14Å
78	G	79.5	Confident	80	Confident	18 Å²	18	64.9 Å²	64.9	19%	0.186	33%	0.331	C	S	.	.	H	α-helix	trans	-62.4	-43.7	177.7	0	0	0	0	0	113	D75 R82	D75-G78 WeakPolarHBondContact O-CA 3.23Å; D75-G78 PolarHBondContact O-N 3.43Å; D75-G78 WeakPolarHBondContact OD1-CA 3.39Å; D75-G78 PolarHBondContact OD1-N 2.82Å; G78-R82 WeakPolarHBondContact O-CG 3.26Å; G78-R82 PolarHBondContact O-N 3.39Å
79	V	86.4	Confident	79.2	Confident	4 Å²	4	65 Å²	65	2%	0.024	35%	0.349	C	S	.	.	H	α-helix	trans	-58.6	-53.1	172.1	175.7	0	0	0	0	110.7	I65 F69 I74 D75 N81 R82 V83 F97	I65-V79 HydrophobicContact CG2-CG1 4.26Å; F69-V79 HydrophobicContact CB-CG2 3.55Å; F69-V79 HydrophobicContact CD1-CG2 4.29Å; F69-V79 HydrophobicContact CD2-CG2 3.45Å; F69-V79 VanDerWaalsContact CD2-CG2 3.45Å; F69-V79 HydrophobicContact CE2-CG2 4.19Å; F69-V79 HydrophobicContact CG-CG2 3.51Å; I74-V79 HydrophobicContact CD1-CG2 3.61Å; I74-V79 HydrophobicContact CG1-CG2 3.75Å; D75-V79 WeakPolarHBondContact O-CG2 3.45Å; D75-V79 PolarHBondContact O-N 3.39Å; V79-N81 VanDerWaalsContact C-N 3.29Å; V79-N81 PolarHBondContact O-N 3.32Å; V79-R82 PolarHBondContact O-N 3.04Å; V79-R82 VanDerWaalsContact O-N 3.15Å; V79-V83 HydrophobicContact CG1-CG2 3.93Å; V79-V83 WeakPolarHBondContact O-CB 3.26Å; V79-V83 WeakPolarHBondContact O-CG2 3.47Å; V79-V83 PolarHBondContact O-N 3.08Å; V79-F97 HydrophobicContact CG1-CE1 4.05Å; V79-F97 HydrophobicContact CG1-CZ 3.96Å
80	I	81	Confident	79	Confident	3 Å²	3	64.4 Å²	64.4	2%	0.015	35%	0.347	C	S	.	.	H	α-helix	trans	-55.5	-46	-177.7	-74.9	166.3	0	0	0	111	T76 P77 S84 L101 Y105 I107 L117	T76-I80 HydrophobicContact CG2-CD1 4.1Å; T76-I80 WeakPolarHBondContact O-CD1 3.41Å; T76-I80 VanDerWaalsContact O-CG1 3.28Å; T76-I80 WeakPolarHBondContact O-CG1 3.21Å; T76-I80 PolarHBondContact O-N 2.93Å; T76-I80 VanDerWaalsContact O-N 3.08Å; P77-I80 PolarHBondContact O-N 2.68Å; I80-S84 VanDerWaalsContact O-CB 3.24Å; I80-S84 WeakPolarHBondContact O-CB 3.48Å; I80-S84 PolarHBondContact O-N 3.21Å; I80-L101 HydrophobicContact CD1-CD1 3.76Å; I80-L101 HydrophobicContact CD1-CD2 3.87Å; I80-L101 HydrophobicContact CD1-CG 4.44Å; I80-L101 HydrophobicContact CG1-CD1 3.97Å; I80-L101 HydrophobicContact CG1-CD2 3.74Å; I80-Y105 HydrophobicContact CD1-CD1 4.24Å; I80-Y105 HydrophobicContact CD1-CG 4.46Å; I80-I107 HydrophobicContact CG1-CD1 4.4Å; I80-I107 HydrophobicContact CG2-CD1 3.79Å; I80-I107 HydrophobicContact CG2-CG1 3.68Å; I80-L117 HydrophobicContact CB-CD1 4.21Å; I80-L117 HydrophobicContact CD1-CD2 3.93Å; I80-L117 HydrophobicContact CG2-CD1 3.75Å; I80-L117 HydrophobicContact CG2-CD2 4.07Å; I80-L117 HydrophobicContact CG2-CG 3.74Å
81	N	79.2	Confident	78.8	Confident	80 Å²	80	58.6 Å²	58.6	43%	0.428	33%	0.329	S	S	.	.	H	α-helix	trans	-64.8	-45.3	177.5	-76.1	-38.4	0	0	0	112.5	P77 V79 S84 Q85	P77-N81 PolarHBondContact O-N 3.12Å; P77-N81 PolarHBondContact O-ND2 3Å; V79-N81 VanDerWaalsContact C-N 3.29Å; V79-N81 PolarHBondContact O-N 3.32Å; N81-S84 PolarHBondContact O-N 3.47Å; N81-Q85 WeakPolarHBondContact O-CB 3.42Å; N81-Q85 VanDerWaalsContact O-CG 3.32Å; N81-Q85 WeakPolarHBondContact O-CG 3.47Å; N81-Q85 PolarHBondContact O-N 3.31Å
82	R	84.2	Confident	78.6	Confident	98 Å²	98	58.4 Å²	58.4	37%	0.37	32%	0.321	S	S	.	.	H	α-helix	trans	-67.3	-41.9	179.4	-71.2	-171.1	-174.7	-179.8	11	112.4	I65 E68 G78 V79 Q85 L86	I65-R82 HydrophobicContact CD1-CB 3.81Å; I65-R82 HydrophobicContact CG1-CB 4.17Å; I65-R82 HydrophobicContact CG2-CB 4.23Å; E68-R82 IonicContact OE1-NH1 3.8Å; E68-R82 PolarHBondContact OE1-NH1 2.86Å; E68-R82 IonicContact OE2-CZ 3.01Å; E68-R82 IonicContact OE2-NH1 3.06Å; E68-R82 PolarHBondContact OE2-NH1 3.34Å; E68-R82 IonicContact OE2-NH2 2.88Å; E68-R82 PolarHBondContact OE2-NH2 2.93Å; G78-R82 WeakPolarHBondContact O-CG 3.26Å; G78-R82 PolarHBondContact O-N 3.39Å; V79-R82 PolarHBondContact O-N 3.04Å; V79-R82 VanDerWaalsContact O-N 3.15Å; R82-Q85 PolarHBondContact O-N 3.42Å; R82-L86 WeakPolarHBondContact O-CB 3.22Å; R82-L86 PolarHBondContact O-N 3.33Å
83	V	85.3	Confident	78.9	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-64.6	-42.8	176.1	174.9	0	0	0	0	110.8	F62 I65 V79 Q85 L86 F87 F97	F62-V83 HydrophobicContact CD2-CG1 4.38Å; F62-V83 HydrophobicContact CD2-CG2 4.11Å; F62-V83 HydrophobicContact CE2-CG1 3.96Å; F62-V83 HydrophobicContact CE2-CG2 3.85Å; I65-V83 HydrophobicContact CG2-CG2 3.95Å; V79-V83 HydrophobicContact CG1-CG2 3.93Å; V79-V83 WeakPolarHBondContact O-CB 3.26Å; V79-V83 WeakPolarHBondContact O-CG2 3.47Å; V79-V83 PolarHBondContact O-N 3.08Å; V83-Q85 VanDerWaalsContact C-N 3.28Å; V83-Q85 PolarHBondContact O-N 3.38Å; V83-L86 PolarHBondContact O-N 3.13Å; V83-F87 HydrophobicContact CG1-CD2 3.76Å; V83-F87 HydrophobicContact CG1-CE2 3.74Å; V83-F87 PolarHBondContact O-N 3.12Å; V83-F97 HydrophobicContact CB-CD1 4.49Å; V83-F97 HydrophobicContact CB-CE1 4.31Å; V83-F97 HydrophobicContact CG1-CD1 4.01Å; V83-F97 HydrophobicContact CG1-CD2 4.41Å; V83-F97 HydrophobicContact CG1-CE1 4.21Å; V83-F97 HydrophobicContact CG1-CG 4.11Å; V83-F97 HydrophobicContact CG2-CE1 4.14Å; V83-F97 HydrophobicContact CG2-CZ 4.1Å
84	S	80.1	Confident	79.3	Confident	16 Å²	16	47 Å²	47	11%	0.112	26%	0.261	C	S	.	.	H	α-helix	trans	-70.3	-20.1	176.9	-172.8	0	0	0	0	114.2	I80 N81 A115	I80-S84 VanDerWaalsContact O-CB 3.24Å; I80-S84 WeakPolarHBondContact O-CB 3.48Å; I80-S84 PolarHBondContact O-N 3.21Å; N81-S84 PolarHBondContact O-N 3.47Å; S84-A115 WeakPolarHBondContact OG-CB 3.41Å
85	Q	79.8	Confident	79.1	Confident	145 Å²	145	49.9 Å²	49.9	68%	0.678	28%	0.276	S	S	*	.	H	α-helix	trans	-84.2	-34	169.2	-74.8	177	4.3	0	0	112.1	N81 R82 V83 H88	N81-Q85 WeakPolarHBondContact O-CB 3.42Å; N81-Q85 VanDerWaalsContact O-CG 3.32Å; N81-Q85 WeakPolarHBondContact O-CG 3.47Å; N81-Q85 PolarHBondContact O-N 3.31Å; R82-Q85 PolarHBondContact O-N 3.42Å; V83-Q85 VanDerWaalsContact C-N 3.28Å; V83-Q85 PolarHBondContact O-N 3.38Å; Q85-H88 WeakPolarHBondContact O-CB 3.44Å; Q85-H88 PolarHBondContact O-N 3.45Å
86	L	84.6	Confident	79.3	Confident	32 Å²	32	46.8 Å²	46.8	17%	0.168	27%	0.266	C	S	.	.	H	α-helix	trans	-71.4	-37.3	179.5	-176.7	61.3	0	0	0	112.5	I58 K61 F62 I65 R82 V83 H88	I58-L86 HydrophobicContact CB-CD1 4.45Å; I58-L86 HydrophobicContact CG2-CD1 3.9Å; I58-L86 HydrophobicContact CG2-CG 3.99Å; K61-L86 HydrophobicContact CB-CD1 3.86Å; K61-L86 HydrophobicContact CB-CD2 3.89Å; K61-L86 HydrophobicContact CD-CD1 4.03Å; F62-L86 VanDerWaalsContact CA-CD2 3.5Å; F62-L86 HydrophobicContact CB-CD2 3.67Å; F62-L86 HydrophobicContact CD2-CD2 4.49Å; F62-L86 VanDerWaalsContact N-CD2 3.32Å; I65-L86 HydrophobicContact CD1-CB 4.45Å; I65-L86 HydrophobicContact CD1-CD2 3.8Å; R82-L86 WeakPolarHBondContact O-CB 3.22Å; R82-L86 PolarHBondContact O-N 3.33Å; V83-L86 PolarHBondContact O-N 3.13Å; L86-H88 VanDerWaalsContact C-N 3.34Å
87	F	85.6	Confident	79.7	Confident	1 Å²	1	45.6 Å²	45.6	0%	0.004	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98	27.4	176.3	-56	-27.1	0	0	0	112.7	V48 F52 I58 F62 V83 G89 H90 L93 V94	V48-F87 HydrophobicContact CB-CZ 4.42Å; V48-F87 HydrophobicContact CG1-CE1 3.75Å; V48-F87 HydrophobicContact CG1-CZ 3.52Å; V48-F87 HydrophobicContact CG2-CE2 4.13Å; V48-F87 HydrophobicContact CG2-CZ 3.89Å; F52-F87 HydrophobicContact CD2-CD1 4.32Å; F52-F87 HydrophobicContact CD2-CE1 4.16Å; F52-F87 AromaticContact CE2-CD1 3.34Å; F52-F87 HydrophobicContact CE2-CD1 3.34Å; F52-F87 AromaticContact CE2-CE1 3.57Å; F52-F87 HydrophobicContact CE2-CE1 3.57Å; F52-F87 HydrophobicContact CE2-CG 4.19Å; F52-F87 AromaticContact CZ-CD1 3.71Å; F52-F87 HydrophobicContact CZ-CD1 3.71Å; F52-F87 HydrophobicContact CZ-CE1 4.35Å; F52-F87 HydrophobicContact CZ-CG 4.42Å; I58-F87 HydrophobicContact CG2-CD1 4.22Å; I58-F87 HydrophobicContact CG2-CE1 4.13Å; F62-F87 HydrophobicContact CB-CE1 4.25Å; F62-F87 HydrophobicContact CB-CZ 4Å; F62-F87 HydrophobicContact CD1-CZ 4.2Å; F62-F87 HydrophobicContact CD2-CE1 4.26Å; F62-F87 AromaticContact CD2-CE2 3.8Å; F62-F87 HydrophobicContact CD2-CE2 3.8Å; F62-F87 AromaticContact CD2-CZ 3.36Å; F62-F87 HydrophobicContact CD2-CZ 3.36Å; F62-F87 AromaticContact CE2-CE2 3.83Å; F62-F87 HydrophobicContact CE2-CE2 3.83Å; F62-F87 AromaticContact CE2-CZ 3.83Å; F62-F87 HydrophobicContact CE2-CZ 3.83Å; F62-F87 HydrophobicContact CG-CE1 4.32Å; F62-F87 HydrophobicContact CG-CE2 4.41Å; F62-F87 AromaticContact CG-CZ 3.58Å; F62-F87 HydrophobicContact CG-CZ 3.58Å; F62-F87 HydrophobicContact CZ-CE2 4.46Å; F62-F87 HydrophobicContact CZ-CZ 4.42Å; V83-F87 HydrophobicContact CG1-CD2 3.76Å; V83-F87 HydrophobicContact CG1-CE2 3.74Å; V83-F87 PolarHBondContact O-N 3.12Å; F87-G89 PolarHBondContact O-N 2.85Å; F87-G89 VanDerWaalsContact O-N 3.15Å; F87-H90 PolarHBondContact O-N 2.82Å; F87-L93 HydrophobicContact CD2-CB 4.09Å; F87-L93 HydrophobicContact CG-CB 4.46Å; F87-V94 HydrophobicContact CB-CG2 3.65Å
88	H	70.6	Confident	79.7	Confident	123 Å²	123	45 Å²	45	57%	0.569	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	115.9	-178.4	-160.4	80.6	0	0	0	110.9	Q85 L86 G113	Q85-H88 WeakPolarHBondContact O-CB 3.44Å; Q85-H88 PolarHBondContact O-N 3.45Å; L86-H88 VanDerWaalsContact C-N 3.34Å; H88-G113 PolarHBondContact CE1-O 2.83Å
89	G	68.9	Low	79.7	Confident	65 Å²	65	46.1 Å²	46.1	67%	0.67	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	107.2	-14.1	-171	0	0	0	0	0	114.8	F87 P91	F87-G89 PolarHBondContact O-N 2.85Å; F87-G89 VanDerWaalsContact O-N 3.15Å; G89-P91 WeakPolarHBondContact O-CD 3.32Å
90	H	77.1	Confident	79.5	Confident	65 Å²	65	49.2 Å²	49.2	30%	0.301	27%	0.273	S	S	.	.			trans	-113.3	76.4	176.9	-66.2	-76.8	0	0	0	110.8	F52 F87 D92 L93 V94	F52-H90 AromaticContact CE1-CD2 3.56Å; F52-H90 AromaticContact CE1-NE2 3.75Å; F52-H90 HydrophobicContact CZ-CB 4.42Å; F52-H90 AromaticContact CZ-CD2 3.5Å; F52-H90 VanDerWaalsContact CZ-CD2 3.5Å; F52-H90 WeakPolarHBondContact CZ-CD2 3.39Å; F52-H90 AromaticContact CZ-CG 4Å; F87-H90 PolarHBondContact O-N 2.82Å; H90-D92 PolarHBondContact O-N 3.44Å; H90-L93 HydrophobicContact CB-CB 4.44Å; H90-L93 HydrophobicContact CB-CD1 4.13Å; H90-L93 HydrophobicContact CB-CG 4.38Å; H90-L93 PolarHBondContact O-N 2.8Å; H90-V94 PolarHBondContact O-N 3.12Å
91	P	70.6	Confident	79.3	Confident	68 Å²	68	49.8 Å²	49.8	44%	0.442	28%	0.276	S	S	.	.	H	α-helix	trans	-66.7	-23.5	-172.9	29.2	-36.8	0	0	0	112.9	G89 L95 I109	G89-P91 WeakPolarHBondContact O-CD 3.32Å; P91-L95 WeakPolarHBondContact O-CB 3.47Å; P91-L95 WeakPolarHBondContact O-CD1 3.4Å; P91-L95 WeakPolarHBondContact O-CG 3.34Å; P91-L95 PolarHBondContact O-N 2.58Å; P91-I109 HydrophobicContact CB-CD1 3.59Å
92	D	75.3	Confident	78.8	Confident	74 Å²	74	48.8 Å²	48.8	40%	0.396	27%	0.274	S	S	.	.	H	α-helix	trans	-68.9	-43.3	176.4	50.6	-6.5	0	0	0	112.4	R51 H90 L95 G96	R51-D92 IonicContact CZ-OD2 3.51Å; R51-D92 IonicContact NH1-OD1 2.85Å; R51-D92 PolarHBondContact NH1-OD1 3.23Å; R51-D92 IonicContact NH1-OD2 3.46Å; R51-D92 PolarHBondContact NH1-OD2 2.79Å; R51-D92 IonicContact NH2-OD2 3.43Å; R51-D92 PolarHBondContact NH2-OD2 3.28Å; H90-D92 PolarHBondContact O-N 3.44Å; D92-L95 PolarHBondContact O-N 3.07Å; D92-G96 PolarHBondContact O-N 2.66Å
93	L	82.7	Confident	77.2	Confident	5 Å²	5	50.1 Å²	50.1	3%	0.026	30%	0.296	C	S	.	.	H	α-helix	trans	-66.3	-46.5	173	-62.7	178.2	0	0	0	111.3	Y44 Q47 V48 R51 F52 F87 H90 L95 G96 F97	Y44-L93 PolarHBondContact OH-O 2.92Å; Y44-L93 VanDerWaalsContact OH-O 3.06Å; Q47-L93 HydrophobicContact CB-CD2 4.34Å; V48-L93 HydrophobicContact CG2-CD1 4.4Å; V48-L93 HydrophobicContact CG2-CD2 4.12Å; R51-L93 HydrophobicContact CB-CD1 3.93Å; R51-L93 HydrophobicContact CG-CD1 4.28Å; R51-L93 HydrophobicContact CG-CD2 4.48Å; F52-L93 HydrophobicContact CD2-CD1 4.25Å; F52-L93 HydrophobicContact CE2-CD1 3.46Å; F52-L93 VanDerWaalsContact CE2-CD1 3.46Å; F52-L93 HydrophobicContact CZ-CD1 4.07Å; F87-L93 HydrophobicContact CD2-CB 4.09Å; F87-L93 HydrophobicContact CG-CB 4.46Å; H90-L93 HydrophobicContact CB-CB 4.44Å; H90-L93 HydrophobicContact CB-CD1 4.13Å; H90-L93 HydrophobicContact CB-CG 4.38Å; H90-L93 PolarHBondContact O-N 2.8Å; L93-L95 VanDerWaalsContact C-N 3.28Å; L93-L95 PolarHBondContact O-N 3.18Å; L93-G96 PolarHBondContact O-N 2.96Å; L93-G96 VanDerWaalsContact O-N 3.12Å; L93-F97 PolarHBondContact O-N 3.18Å
94	V	81.4	Confident	75.9	Confident	4 Å²	4	52.6 Å²	52.6	2%	0.024	32%	0.321	C	S	.	.	H	α-helix	trans	-59	-38.7	176.8	176.6	0	0	0	0	111.9	F87 H90 I107 I109	F87-V94 HydrophobicContact CB-CG2 3.65Å; H90-V94 PolarHBondContact O-N 3.12Å; V94-I107 HydrophobicContact CG1-CB 4.47Å; V94-I107 HydrophobicContact CG1-CD1 4.26Å; V94-I107 HydrophobicContact CG1-CG2 3.69Å; V94-I109 HydrophobicContact CB-CD1 4.12Å; V94-I109 HydrophobicContact CG1-CD1 3.96Å
95	L	77.4	Confident	75.3	Confident	81 Å²	81	55.6 Å²	55.6	42%	0.424	33%	0.331	S	S	.	.	H	α-helix	trans	-75.6	-32.3	175.7	-72	170.4	0	0	0	112.8	P91 D92 L93 F97 N98 I109	P91-L95 WeakPolarHBondContact O-CB 3.47Å; P91-L95 WeakPolarHBondContact O-CD1 3.4Å; P91-L95 WeakPolarHBondContact O-CG 3.34Å; P91-L95 PolarHBondContact O-N 2.58Å; D92-L95 PolarHBondContact O-N 3.07Å; L93-L95 VanDerWaalsContact C-N 3.28Å; L93-L95 PolarHBondContact O-N 3.18Å; L95-F97 VanDerWaalsContact C-N 3.32Å; L95-N98 VanDerWaalsContact O-CB 3.24Å; L95-N98 WeakPolarHBondContact O-CB 3.48Å; L95-N98 PolarHBondContact O-N 3.03Å; L95-N98 PolarHBondContact O-ND2 3.15Å; L95-N98 VanDerWaalsContact O-ND2 3.07Å; L95-I109 HydrophobicContact CD1-CD1 4.4Å; L95-I109 HydrophobicContact CD2-CD1 4.37Å; L95-I109 HydrophobicContact CD2-CG1 4.37Å; L95-I109 HydrophobicContact CG-CD1 3.98Å
96	G	80.3	Confident	74.7	Confident	29 Å²	29	55 Å²	55	30%	0.299	32%	0.322	S	S	.	.	H	α-helix	trans	-63.4	-36.3	173	0	0	0	0	0	112.7	D92 L93 N98 A99	D92-G96 PolarHBondContact O-N 2.66Å; L93-G96 PolarHBondContact O-N 2.96Å; L93-G96 VanDerWaalsContact O-N 3.12Å; G96-N98 PolarHBondContact O-N 3.5Å; G96-A99 WeakPolarHBondContact O-CB 3.41Å; G96-A99 PolarHBondContact O-N 3.24Å; G96-A99 VanDerWaalsContact O-N 3.1Å
97	F	85.4	Confident	74.2	Confident	8 Å²	8	53.5 Å²	53.5	4%	0.035	32%	0.315	C	S	.	.	G	3₁₀ helix	trans	-57.7	-23.9	175.8	-162	-117	0	0	0	113.5	Y44 F62 M66 V79 V83 L93 L95 A99 F100 L101 I107	Y44-F97 AromaticContact CE1-CD2 3.88Å; Y44-F97 HydrophobicContact CE1-CD2 3.88Å; F62-F97 HydrophobicContact CE2-CD2 4.44Å; F62-F97 HydrophobicContact CE2-CE2 4.06Å; F62-F97 HydrophobicContact CZ-CD2 4.34Å; F62-F97 AromaticContact CZ-CE2 3.97Å; F62-F97 HydrophobicContact CZ-CE2 3.97Å; M66-F97 HydrophobicContact SD-CE2 4Å; M66-F97 HydrophobicContact SD-CZ 3.96Å; V79-F97 HydrophobicContact CG1-CE1 4.05Å; V79-F97 HydrophobicContact CG1-CZ 3.96Å; V83-F97 HydrophobicContact CB-CD1 4.49Å; V83-F97 HydrophobicContact CB-CE1 4.31Å; V83-F97 HydrophobicContact CG1-CD1 4.01Å; V83-F97 HydrophobicContact CG1-CD2 4.41Å; V83-F97 HydrophobicContact CG1-CE1 4.21Å; V83-F97 HydrophobicContact CG1-CG 4.11Å; V83-F97 HydrophobicContact CG2-CE1 4.14Å; V83-F97 HydrophobicContact CG2-CZ 4.1Å; L93-F97 PolarHBondContact O-N 3.18Å; L95-F97 VanDerWaalsContact C-N 3.32Å; F97-A99 PolarHBondContact O-N 3.01Å; F97-A99 VanDerWaalsContact O-N 3.16Å; F97-F100 PolarHBondContact O-N 3.48Å; F97-L101 HydrophobicContact CD1-CD2 3.99Å; F97-L101 HydrophobicContact CD1-CG 4.4Å; F97-L101 HydrophobicContact CE1-CD2 3.73Å; F97-I107 HydrophobicContact CD1-CD1 4.16Å
98	N	79.3	Confident	73	Confident	27 Å²	27	57.8 Å²	57.8	14%	0.144	34%	0.335	C	S	.	.	G	3₁₀ helix	trans	-57.5	-26.4	175.5	-75	-53.6	0	0	0	114.2	L95 G96 F100 L101 R106 I107	L95-N98 VanDerWaalsContact O-CB 3.24Å; L95-N98 WeakPolarHBondContact O-CB 3.48Å; L95-N98 PolarHBondContact O-N 3.03Å; L95-N98 PolarHBondContact O-ND2 3.15Å; L95-N98 VanDerWaalsContact O-ND2 3.07Å; G96-N98 PolarHBondContact O-N 3.5Å; N98-F100 PolarHBondContact O-N 3.21Å; N98-L101 PolarHBondContact O-N 3.09Å; N98-R106 WeakPolarHBondContact OD1-CG 3.4Å; N98-I107 PolarHBondContact ND2-O 3.37Å; N98-I107 PolarHBondContact OD1-N 2.85Å
99	A	78.9	Confident	72.4	Confident	41 Å²	41	54.8 Å²	54.8	34%	0.339	32%	0.322	S	S	.	.	G	3₁₀ helix	trans	-58.7	-39.4	175.4	0	0	0	0	0	111	L36 G96 F97 L101	L36-A99 HydrophobicContact CD1-CB 4.39Å; L36-A99 WeakPolarHBondContact CD1-O 3.48Å; L36-A99 HydrophobicContact CD2-CB 4.31Å; G96-A99 WeakPolarHBondContact O-CB 3.41Å; G96-A99 PolarHBondContact O-N 3.24Å; G96-A99 VanDerWaalsContact O-N 3.1Å; F97-A99 PolarHBondContact O-N 3.01Å; F97-A99 VanDerWaalsContact O-N 3.16Å; A99-L101 VanDerWaalsContact C-N 3.34Å; A99-L101 PolarHBondContact O-N 3.3Å
100	F	81.3	Confident	71.2	Confident	68 Å²	68	55.1 Å²	55.1	30%	0.298	31%	0.312	S	S	.	.	G	3₁₀ helix	trans	-90.4	7.8	-173.2	-51.1	-77.8	0	0	0	113.8	L36 A41 Y44 F97 N98	L36-F100 HydrophobicContact CD1-CD1 4.29Å; L36-F100 HydrophobicContact CD1-CE1 4.5Å; L36-F100 HydrophobicContact CD2-CE1 4.27Å; A41-F100 HydrophobicContact CB-CE1 3.84Å; A41-F100 HydrophobicContact CB-CZ 4.44Å; Y44-F100 HydrophobicContact CD1-CD2 4.26Å; Y44-F100 AromaticContact CD1-CE2 3.8Å; Y44-F100 HydrophobicContact CD1-CE2 3.8Å; Y44-F100 AromaticContact CD2-CE2 4Å; Y44-F100 HydrophobicContact CD2-CE2 4Å; Y44-F100 HydrophobicContact CG-CD2 4.33Å; Y44-F100 AromaticContact CG-CE2 3.48Å; Y44-F100 HydrophobicContact CG-CE2 3.48Å; Y44-F100 VanDerWaalsContact CG-CE2 3.48Å; Y44-F100 HydrophobicContact CG-CZ 4.13Å; F97-F100 PolarHBondContact O-N 3.48Å; N98-F100 PolarHBondContact O-N 3.21Å
101	L	78.3	Confident	69.5	Low	15 Å²	15	62.3 Å²	62.3	8%	0.079	34%	0.343	C	S	.	.	S	Bend	trans	-92	143.3	-179.5	-65.3	-175.2	0	0	0	112.9	I80 F97 N98 A99 I107	I80-L101 HydrophobicContact CD1-CD1 3.76Å; I80-L101 HydrophobicContact CD1-CD2 3.87Å; I80-L101 HydrophobicContact CD1-CG 4.44Å; I80-L101 HydrophobicContact CG1-CD1 3.97Å; I80-L101 HydrophobicContact CG1-CD2 3.74Å; F97-L101 HydrophobicContact CD1-CD2 3.99Å; F97-L101 HydrophobicContact CD1-CG 4.4Å; F97-L101 HydrophobicContact CE1-CD2 3.73Å; N98-L101 PolarHBondContact O-N 3.09Å; A99-L101 VanDerWaalsContact C-N 3.34Å; A99-L101 PolarHBondContact O-N 3.3Å; L101-I107 HydrophobicContact CD1-CD1 4.11Å; L101-I107 HydrophobicContact CD1-CG1 3.82Å
102	P	68.1	Low	68.3	Low	59 Å²	59	66.5 Å²	66.5	38%	0.383	36%	0.361	S	S	.	.	P	Polyproline II helix	trans	-61	144.3	175.6	-24.1	34.5	0	0	0	113	T76 G104 Y105	T76-P102 HydrophobicContact CG2-CG 4.24Å; P102-G104 PolarHBondContact O-N 3Å; P102-Y105 PolarHBondContact O-N 3.04Å
103	P	50.2	Low	67	Low	126 Å²	126	64.9 Å²	64.9	82%	0.818	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.5	124.1	178.8	-29	35.6	0	0	0	113.1
104	G	58.5	Low	64.9	Low	52 Å²	52	71.9 Å²	71.9	54%	0.536	40%	0.396	S	S	.	.	T	Hydrogen-bonded Turn	trans	102.3	-5.8	-175.3	0	0	0	0	0	115	P102	P102-G104 PolarHBondContact O-N 3Å
105	Y	66.2	Low	63.1	Low	79 Å²	79	73.2 Å²	73.2	31%	0.31	41%	0.408	S	S	.	.			trans	-112.7	122.3	167.4	-70.5	-87.4	0	0	0	110.2	T76 P77 I80 P102 L117	T76-Y105 HydrophobicContact CG2-CG 4.48Å; P77-Y105 HydrophobicContact CG-CE1 4.15Å; I80-Y105 HydrophobicContact CD1-CD1 4.24Å; I80-Y105 HydrophobicContact CD1-CG 4.46Å; P102-Y105 PolarHBondContact O-N 3.04Å; Y105-L117 HydrophobicContact CD1-CD2 3.88Å
106	R	68.9	Low	61.5	Low	133 Å²	133	77.1 Å²	77.1	50%	0.502	42%	0.422	S	S	.	.			trans	-139.5	140.3	175.5	-162.4	-174.2	-164.7	-161.4	11.2	110.1	N98 E108	N98-R106 WeakPolarHBondContact OD1-CG 3.4Å; R106-E108 WeakPolarHBondContact CD-OE1 3.5Å; R106-E108 HydrophobicContact CG-CG 4.34Å; R106-E108 IonicContact CZ-OE1 3.91Å; R106-E108 IonicContact NE-OE1 3.26Å; R106-E108 IonicContact NH1-OE1 2.79Å; R106-E108 PolarHBondContact NH1-OE1 3.17Å
107	I	73.4	Confident	59.9	Low	1 Å²	1	77.8 Å²	77.8	1%	0.005	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	117.3	171.1	-45.7	176.2	0	0	0	107.7	I80 V94 F97 N98 L101 A115	I80-I107 HydrophobicContact CG1-CD1 4.4Å; I80-I107 HydrophobicContact CG2-CD1 3.79Å; I80-I107 HydrophobicContact CG2-CG1 3.68Å; V94-I107 HydrophobicContact CG1-CB 4.47Å; V94-I107 HydrophobicContact CG1-CD1 4.26Å; V94-I107 HydrophobicContact CG1-CG2 3.69Å; F97-I107 HydrophobicContact CD1-CD1 4.16Å; N98-I107 PolarHBondContact ND2-O 3.37Å; N98-I107 PolarHBondContact OD1-N 2.85Å; L101-I107 HydrophobicContact CD1-CD1 4.11Å; L101-I107 HydrophobicContact CD1-CG1 3.82Å; I107-A115 HydrophobicContact CG2-CB 3.78Å
108	E	59.6	Low	57.7	Low	91 Å²	91	84 Å²	84	43%	0.425	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	147	169.7	-61.4	-164.8	173.5	0	0	110	R106 P110 F116	R106-E108 WeakPolarHBondContact CD-OE1 3.5Å; R106-E108 HydrophobicContact CG-CG 4.34Å; R106-E108 IonicContact CZ-OE1 3.91Å; R106-E108 IonicContact NE-OE1 3.26Å; R106-E108 IonicContact NH1-OE1 2.79Å; R106-E108 PolarHBondContact NH1-OE1 3.17Å; E108-P110 WeakPolarHBondContact O-CD 3.35Å; E108-F116 PolarHBondContact O-N 2.67Å
109	I	58.4	Low	55.8	Low	60 Å²	60	86.4 Å²	86.4	31%	0.308	47%	0.466	S	S	.	.			trans	-118.2	96.7	-172.8	-53.3	177.1	0	0	0	109.3	P91 V94 L95	P91-I109 HydrophobicContact CB-CD1 3.59Å; V94-I109 HydrophobicContact CB-CD1 4.12Å; V94-I109 HydrophobicContact CG1-CD1 3.96Å; L95-I109 HydrophobicContact CD1-CD1 4.4Å; L95-I109 HydrophobicContact CD2-CD1 4.37Å; L95-I109 HydrophobicContact CD2-CG1 4.37Å; L95-I109 HydrophobicContact CG-CD1 3.98Å
110	P	44.3	Very low	53.5	Low	71 Å²	71	88.7 Å²	88.7	46%	0.461	48%	0.478	S	S	.	.			trans	-65.2	159.6	168.3	-19.1	32.8	0	0	0	111.4	E108 N112 G113	E108-P110 WeakPolarHBondContact O-CD 3.35Å; P110-N112 PolarHBondContact O-N 3.1Å; P110-G113 PolarHBondContact O-N 3.41Å
111	K	42.2	Very low	51.1	Low	217 Å²	217	94.3 Å²	94.3	94%	0.943	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	9.6	-174	-66.4	-174.7	175.9	-178.7	0	116.5
112	N	44.2	Very low	48.7	Very low	155 Å²	155	100.1 Å²	100.1	83%	0.829	54%	0.539	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.2	8.3	177.2	-77.5	41.3	0	0	0	113.9	P110 M114	P110-N112 PolarHBondContact O-N 3.1Å; N112-M114 PolarHBondContact O-N 3.39Å
113	G	47.4	Very low	46.7	Very low	40 Å²	40	103.8 Å²	103.8	41%	0.412	56%	0.56	S	S	.	*	S	Bend	trans	81.7	-5.8	162	0	0	0	0	0	117.6	H88 P110	H88-G113 PolarHBondContact CE1-O 2.83Å; P110-G113 PolarHBondContact O-N 3.41Å
114	M	40.3	Very low	45.5	Very low	152 Å²	152	106 Å²	106	75%	0.749	56%	0.56	S	S	*	*			trans	-100.6	128.2	166.1	-71.1	-171.5	-76.5	0	0	109.9	N112	N112-M114 PolarHBondContact O-N 3.39Å
115	A	43.7	Very low	44	Very low	32 Å²	32	109.5 Å²	109.5	26%	0.264	57%	0.57	S	S	.	*			trans	-71.8	149.5	177.8	0	0	0	0	0	111.3	S84 I107	S84-A115 WeakPolarHBondContact OG-CB 3.41Å; I107-A115 HydrophobicContact CG2-CB 3.78Å
116	F	42.5	Very low	42	Very low	163 Å²	163	111.1 Å²	111.1	72%	0.715	59%	0.593	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-121.9	140.7	178.5	-147.2	-90.1	0	0	0	110.9	E108	E108-F116 PolarHBondContact O-N 2.67Å
117	L	46.7	Very low	40.6	Very low	43 Å²	43	111 Å²	111	23%	0.225	61%	0.61	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-100	113.7	-177.5	-116	169.4	0	0	0	109.5	P77 I80 Y105 S119	P77-L117 HydrophobicContact CB-CD1 4.14Å; I80-L117 HydrophobicContact CB-CD1 4.21Å; I80-L117 HydrophobicContact CD1-CD2 3.93Å; I80-L117 HydrophobicContact CG2-CD1 3.75Å; I80-L117 HydrophobicContact CG2-CD2 4.07Å; I80-L117 HydrophobicContact CG2-CG 3.74Å; Y105-L117 HydrophobicContact CD1-CD2 3.88Å; L117-S119 PolarHBondContact O-N 3.37Å
118	Q	39.7	Very low	38.3	Very low	138 Å²	138	114.5 Å²	114.5	65%	0.645	65%	0.646	S	S	*	*			trans	-84.7	112.1	174.6	-164.5	170.6	17.4	0	0	110.3
119	S	39.1	Very low	36.8	Very low	78 Å²	78	119.6 Å²	119.6	55%	0.545	67%	0.669	S	S	.	*			trans	-91.8	143.7	174.9	174.8	0	0	0	0	110.9	L117 F121	L117-S119 PolarHBondContact O-N 3.37Å; S119-F121 PolarHBondContact O-N 3.21Å
120	P	30.6	Very low	35.8	Very low	90 Å²	90	122.5 Å²	122.5	58%	0.584	69%	0.692	S	S	*	*	S	Bend	trans	-75.3	33.9	-176	32.2	-37.7	0	0	0	115.3
121	F	30.7	Very low	34.7	Very low	186 Å²	186	123.4 Å²	123.4	82%	0.816	71%	0.706	S	S	*	*	S	Bend	trans	-153.5	86.4	167.2	-95.2	-68.7	0	0	0	112.7	S119	S119-F121 PolarHBondContact O-N 3.21Å
122	T	27.7	Very low	33.9	Very low	137 Å²	137	122.7 Å²	122.7	84%	0.84	70%	0.703	S	S	*	*			trans	173.9	127.6	136.9	23.9	0	0	0	0	111.4
123	T	27.3	Very low	32.9	Very low	136 Å²	136	119.7 Å²	119.7	83%	0.834	69%	0.694	S	S	*	*			trans	-176.1	127.4	133.8	-74	0	0	0	0	109.4
124	Q	25.1	Very low	31.8	Very low	172 Å²	172	125.1 Å²	125.1	80%	0.804	71%	0.713	S	S	*	*			trans	-142.5	160.4	154.9	-103.8	-69.4	-0.6	0	0	106.6
125	V	26.1	Very low	31	Very low	125 Å²	125	123.8 Å²	123.8	76%	0.758	71%	0.713	S	S	*	*			trans	74.3	90.6	-179.8	-165.4	0	0	0	0	116.6
126	S	25.2	Very low	30.2	Very low	113 Å²	113	128.4 Å²	128.4	79%	0.79	74%	0.738	S	S	*	*				16.7	159.2	127.4	-61.1	0	0	0	0	123.7
127	P	39.1	Very low	30	Very low	132 Å²	132	126.2 Å²	126.2	86%	0.857	74%	0.741	S	S	*	*			trans	-104.1	167.1	-156.4	40.7	-36.7	0	0	0	116.8
128	G	25.3	Very low	29	Very low	73 Å²	73	128.4 Å²	128.4	75%	0.753	76%	0.764	S	S	*	*			trans	-168.4	76.7	174.8	0	0	0	0	0	118.9
129	Q	28	Very low	28.6	Very low	198 Å²	198	129 Å²	129	93%	0.925	78%	0.777	S	S	*	*			trans	59.4	167	149.2	-77.3	-167.1	-19.7	0	0	121.6
130	P	35.9	Very low	28	Very low	121 Å²	121	129.7 Å²	129.7	79%	0.786	79%	0.788	S	S	*	*			trans	-128.6	160.8	-152	42.7	-29.7	0	0	0	118.4
131	A	22.4	Very low	28	Very low	90 Å²	90	129.3 Å²	129.3	74%	0.744	79%	0.792	S	S	*	*			trans	-165.3	138.8	149.7	0	0	0	0	0	114.9
132	K	25.3	Very low	27.8	Very low	203 Å²	203	127.1 Å²	127.1	88%	0.883	79%	0.794	S	S	*	*			trans	24.8	153.1	131.3	-58	176.1	-176	177.3	0	121.4
133	S	23.3	Very low	27.8	Very low	92 Å²	92	125.9 Å²	125.9	64%	0.643	79%	0.791	S	S	*	*			cis	173.8	160.3	-15.9	57.1	0	0	0	0	111
134	L	24.6	Very low	27.7	Very low	154 Å²	154	123 Å²	123	81%	0.806	79%	0.788	S	S	*	*			trans	70.3	158.9	168.9	-82	66.3	0	0	0	115.8
135	T	23	Very low	27.7	Very low	124 Å²	124	120.9 Å²	120.9	76%	0.761	79%	0.792	S	S	*	*			cis	-154.1	170.3	7.5	-9.6	0	0	0	0	114.1
136	T	26.6	Very low	27.7	Very low	129 Å²	129	121.6 Å²	121.6	79%	0.791	80%	0.797	S	S	*	*			trans	-76.5	-178	164.2	44.5	0	0	0	0	113
137	P	39.3	Very low	28.5	Very low	117 Å²	117	121.8 Å²	121.8	76%	0.76	80%	0.796	S	S	*	*			cis	-120.4	-171.5	11.5	40.6	-22.3	0	0	0	114.3
138	A	25.6	Very low	27.8	Very low	88 Å²	88	120.2 Å²	120.2	73%	0.727	79%	0.793	S	S	*	*			cis	103.5	144.2	4.7	0	0	0	0	0	119.7
139	V	29.7	Very low	27.9	Very low	150 Å²	150	120.8 Å²	120.8	91%	0.909	79%	0.791	S	S	*	*			trans	61.8	163.4	-179.6	-108.6	0	0	0	0	117.4
140	A	27.2	Very low	27.7	Very low	93 Å²	93	120.2 Å²	120.2	77%	0.769	79%	0.788	S	S	*	*			cis	-165.1	179.2	-0.2	0	0	0	0	0	108.9
141	A	30.1	Very low	27.3	Very low	82 Å²	82	119.3 Å²	119.3	68%	0.678	79%	0.785	S	S	*	*			cis	-174.3	176	-35.1	0	0	0	0	0	110.7
142	T	26.3	Very low	27.3	Very low	140 Å²	140	124.1 Å²	124.1	86%	0.859	79%	0.792	S	S	*	*			trans	65.5	153.9	165	42.5	0	0	0	0	120.2
143	S	28.5	Very low	27.3	Very low	111 Å²	111	119.3 Å²	119.3	78%	0.776	79%	0.79	S	S	*	*			cis	-173	144.1	-8.7	48.5	0	0	0	0	115.9
144	G	25.3	Very low	27.3	Very low	75 Å²	75	118.3 Å²	118.3	77%	0.773	79%	0.794	S	S	*	*			trans	75.3	166.6	152.8	0	0	0	0	0	120.4
145	S	25.3	Very low	27.8	Very low	128 Å²	128	117.1 Å²	117.1	90%	0.895	80%	0.796	S	S	*	*			cis	-166.8	164.4	-19	-83.8	0	0	0	0	112.4
146	V	26.8	Very low	27.8	Very low	141 Å²	141	115.3 Å²	115.3	86%	0.855	79%	0.793	S	S	*	*			trans	-79.2	177.9	-176.4	-112.2	0	0	0	0	114.9
147	P	40.5	Very low	27.6	Very low	117 Å²	117	117.6 Å²	117.6	76%	0.76	80%	0.795	S	S	*	*			cis	-151.8	-179.5	32	45.3	-23.6	0	0	0	121.6
148	A	24.8	Very low	26.7	Very low	98 Å²	98	117.5 Å²	117.5	81%	0.81	79%	0.792	S	S	*	*			trans	69.1	158.9	149.1	0	0	0	0	0	122.3
149	A	26.4	Very low	26.6	Very low	85 Å²	85	118.2 Å²	118.2	70%	0.702	79%	0.792	S	S	*	*			cis	-170.4	149.6	-30.9	0	0	0	0	0	113.9
150	H	25.8	Very low	26.2	Very low	186 Å²	186	117.7 Å²	117.7	86%	0.861	78%	0.784	S	S	*	*			trans	60.7	128.3	154.6	-79.6	-71.7	0	0	0	125.8
151	S	25.5	Very low	26	Very low	102 Å²	102	117.9 Å²	117.9	71%	0.713	78%	0.776	S	S	*	*			trans	110.1	122.2	133.3	-68.4	0	0	0	0	123.9
152	E	23.6	Very low	25.7	Very low	191 Å²	191	123.1 Å²	123.1	89%	0.893	78%	0.783	S	S	*	*			trans	69.3	149.1	145.2	-71	-165	108.7	0	0	125.7
153	A	25.8	Very low	25.6	Very low	103 Å²	103	120.6 Å²	120.6	85%	0.851	78%	0.777	S	S	*	*			trans	67.4	133.5	162.5	0	0	0	0	0	121.3
154	G	21.9	Very low	25.4	Very low	71 Å²	71	119.8 Å²	119.8	73%	0.732	78%	0.776	S	S	*	*			trans	-108.5	-166.3	155.8	0	0	0	0	0	110.7
155	P	36	Very low	25.3	Very low	128 Å²	128	120.9 Å²	120.9	83%	0.831	77%	0.773	S	S	*	*			cis	-138	-173.2	19.6	43.4	-25.9	0	0	0	116.2
156	A	22.6	Very low	25.3	Very low	86 Å²	86	119.1 Å²	119.1	71%	0.711	76%	0.76	S	S	*	*			trans	76.1	112.2	149.1	0	0	0	0	0	122.3
157	Q	22.4	Very low	25.2	Very low	178 Å²	178	119.4 Å²	119.4	83%	0.832	76%	0.757	S	S	*	*			trans	79.3	125.3	134.8	-69.9	-170.6	-10.6	0	0	123.5
158	T	20.9	Very low	24.4	Very low	114 Å²	114	119.5 Å²	119.5	70%	0.699	75%	0.751	S	S	*	*			trans	67.8	123.8	141.3	54.6	0	0	0	0	122.3
159	S	22.1	Very low	24.3	Very low	103 Å²	103	121.7 Å²	121.7	72%	0.72	74%	0.744	S	S	*	*			trans	59.3	144.8	140	63.4	0	0	0	0	119.6
160	D	22.6	Very low	24.2	Very low	140 Å²	140	122.3 Å²	122.3	75%	0.749	74%	0.744	S	S	*	*			cis	-164.6	-171.6	-5.8	-122.3	-101.3	0	0	0	106.8
161	T	23.3	Very low	24	Very low	97 Å²	97	114.4 Å²	114.4	60%	0.595	71%	0.709	S	S	*	*			cis	-156.6	165.9	14.1	-8.4	0	0	0	0	110.6
162	K	23.4	Very low	23.9	Very low	192 Å²	192	113.1 Å²	113.1	84%	0.835	70%	0.697	S	S	*	*			trans	73.7	158	147.4	-76.7	161.7	-175.5	168.2	0	118.2
163	A	24.2	Very low	24	Very low	87 Å²	87	108.7 Å²	108.7	72%	0.719	69%	0.687	S	S	*	*			cis	-136.2	145.1	14.5	0	0	0	0	0	116
164	A	23.9	Very low	24.3	Very low	93 Å²	93	108.4 Å²	108.4	77%	0.769	69%	0.685	S	S	*	*			trans	68	141.6	141.7	0	0	0	0	0	120.2
165	S	24.2	Very low	24.5	Very low	99 Å²	99	108.7 Å²	108.7	69%	0.692	69%	0.688	S	S	*	*			cis	-167.5	166.7	-14.3	51.2	0	0	0	0	111
166	S	25	Very low	25.2	Very low	90 Å²	90	108.5 Å²	108.5	63%	0.629	69%	0.686	S	S	*	*			trans	60.8	133.6	147.5	52.5	0	0	0	0	120.1
167	D	24.4	Very low	25.2	Very low	147 Å²	147	109.8 Å²	109.8	79%	0.786	69%	0.69	S	S	*	*			cis	-157.1	155	-7.7	-103.2	-34.7	0	0	0	113.3
168	N	23.5	Very low	25.2	Very low	119 Å²	119	107.7 Å²	107.7	64%	0.636	68%	0.68	S	S	*	*			trans	8	147.4	167	-77.6	27.5	0	0	0	125.9	D448	N168-D448 PolarHBondContact ND2-OD2 2.86Å
169	Q	22.7	Very low	26.4	Very low	145 Å²	145	104.1 Å²	104.1	68%	0.678	66%	0.659	S	S	*	*			trans	-84.4	-178.4	159.3	-59.6	153	-6	0	0	110.6	A450	Q169-A450 HydrophobicContact CB-CB 4.3Å
170	S	23.7	Very low	27.1	Very low	98 Å²	98	101.3 Å²	101.3	69%	0.685	64%	0.639	S	S	*	*			trans	-178.6	-172.4	148.5	38.2	0	0	0	0	111.9
171	S	22.6	Very low	27.2	Very low	20 Å²	20	98 Å²	98	14%	0.14	63%	0.626	C	S	.	*				-163.7	121.9	-125.9	58.5	0	0	0	0	118.3	V447 Y449	S171-V447 PolarHBondContact OG-O 3.29Å; S171-Y449 PolarHBondContact OG-N 3.07Å
172	T	22.8	Very low	27.2	Very low	75 Å²	75	96.7 Å²	96.7	46%	0.46	61%	0.612	S	S	.	*			trans	52.9	113.7	132.7	63.8	0	0	0	0	121.4
173	S	26.9	Very low	27	Very low	98 Å²	98	92.5 Å²	92.5	69%	0.685	60%	0.599	S	S	*	*				51.9	155.7	127.9	66	0	0	0	0	124.2
174	A	31	Very low	26.8	Very low	96 Å²	96	93 Å²	93	79%	0.793	60%	0.597	S	S	*	*			cis	-177.4	153.7	-24.6	0	0	0	0	0	111.8
175	G	25.4	Very low	26.6	Very low	77 Å²	77	96.6 Å²	96.6	79%	0.794	60%	0.602	S	S	*	*			trans	68.3	-169.5	161.5	0	0	0	0	0	118.7
176	P	50.7	Low	26.8	Very low	124 Å²	124	96.4 Å²	96.4	81%	0.805	60%	0.599	S	S	*	*			cis	-144.3	176.8	-23.9	41.4	-24.4	0	0	0	116.5
177	S	23.8	Very low	26.7	Very low	114 Å²	114	97.5 Å²	97.5	80%	0.797	60%	0.597	S	S	*	*			trans	151.4	143.1	133	60.5	0	0	0	0	119.2
178	E	23	Very low	26.6	Very low	133 Å²	133	94 Å²	94	62%	0.621	58%	0.581	S	S	*	*			trans	-93.8	-148.7	-176.8	-141.2	-132.2	143	0	0	112.4	R568	E178-R568 PolarHBondContact O-NH2 2.97Å
179	P	45.6	Very low	26.5	Very low	39 Å²	39	91.8 Å²	91.8	25%	0.253	58%	0.575	S	S	.	*			cis	-126.5	-167.6	-14.1	49.5	-34.6	0	0	0	114.4	R568	P179-R568 VanDerWaalsContact CD-CZ 3.4Å; P179-R568 HydrophobicContact CG-CG 4.11Å
180	P	36.2	Very low	26.6	Very low	45 Å²	45	92.2 Å²	92.2	29%	0.292	57%	0.574	S	S	.	*			cis	-152.2	-178.1	22.1	44.5	-21.5	0	0	0	122.5	R572	P180-R572 HydrophobicContact CB-CB 3.83Å; P180-R572 HydrophobicContact CB-CG 3.95Å; P180-R572 VanDerWaalsContact CB-CZ 3.48Å; P180-R572 VanDerWaalsContact CB-NE 3.35Å; P180-R572 HydrophobicContact CG-CB 3.85Å; P180-R572 HydrophobicContact CG-CG 4.48Å
181	S	24.7	Very low	26.4	Very low	70 Å²	70	94.8 Å²	94.8	49%	0.49	58%	0.575	S	S	.	*			trans	-83.1	-165.2	174.8	-7.6	0	0	0	0	115.3	R572	S181-R572 WeakPolarHBondContact O-CA 3.12Å; S181-R572 PolarHBondContact OG-NH1 3.36Å
182	K	22.6	Very low	26.4	Very low	69 Å²	69	96.8 Å²	96.8	30%	0.3	60%	0.599	S	S	.	*				-177.9	146.2	53.6	-128.1	-167.2	173.4	-176.6	0	113.6	V523 R572 W607	K182-V523 HydrophobicContact CD-CG1 4.48Å; K182-R572 HydrophobicContact CB-CG 4.3Å; K182-R572 HydrophobicContact CD-CG 4.46Å; K182-W607 HydrophobicContact CD-CH2 4.32Å; K182-W607 HydrophobicContact CD-CZ2 3.79Å
183	L	20.6	Very low	26.4	Very low	105 Å²	105	102.8 Å²	102.8	55%	0.55	62%	0.622	S	S	.	*			trans	76.1	154	147.8	-60	178.6	0	0	0	123.3	E606	L183-E606 WeakPolarHBondContact CD1-OE1 3.19Å
184	S	20.2	Very low	26.1	Very low	97 Å²	97	103 Å²	103	68%	0.678	62%	0.624	S	S	*	*			cis	-171.5	-166.4	-13	57	0	0	0	0	115.9
185	L	19.7	Very low	25.7	Very low	169 Å²	169	108.1 Å²	108.1	89%	0.885	63%	0.631	S	S	*	*			trans	-128.7	150.6	-159	-60.3	168	0	0	0	117.5
186	P	28.5	Very low	25.5	Very low	95 Å²	95	108.7 Å²	108.7	62%	0.617	63%	0.628	S	S	*	*			trans	-155	-176.1	136.9	37.5	-18.6	0	0	0	116.8
187	L	22.3	Very low	24.2	Very low	112 Å²	112	109.7 Å²	109.7	59%	0.586	63%	0.632	S	S	*	*			cis	-166.8	167.2	-44.5	-93.3	171.4	0	0	0	111	P336 L337	L187-P336 CarbonylContact O-C 3.58Å; L187-P336 WeakPolarHBondContact O-CA 3.45Å; L187-P336 WeakPolarHBondContact O-CB 3.42Å; L187-L337 VanDerWaalsContact C-CG 3.48Å; L187-L337 HydrophobicContact CD2-CD1 4.19Å; L187-L337 PolarHBondContact O-N 3.1Å
188	T	21.8	Very low	24.1	Very low	74 Å²	74	110.3 Å²	110.3	45%	0.454	63%	0.631	S	S	.	*			trans	67.4	152.1	162.6	83.5	0	0	0	0	131.2	P336 L337	T188-P336 CarbonylContact O-C 3.53Å; T188-P336 WeakPolarHBondContact O-CB 3.31Å; T188-P336 WeakPolarHBondContact O-CG 3.5Å; T188-P336 WeakPolarHBondContact OG1-CB 3.38Å; T188-L337 VanDerWaalsContact N-CB 3.35Å; T188-L337 WeakPolarHBondContact O-CA 3.34Å; T188-L337 PolarHBondContact O-N 3.13Å
189	S	21.9	Very low	24	Very low	72 Å²	72	109.1 Å²	109.1	50%	0.503	64%	0.638	S	S	.	*			trans	73.5	137.8	146.3	-56.5	0	0	0	0	123.8
190	K	24.1	Very low	23	Very low	154 Å²	154	113 Å²	113	67%	0.67	67%	0.665	S	S	*	*			cis	-161	-176	-2.9	-122.6	179.7	171	-77.5	0	113.7
191	E	20.9	Very low	22.4	Very low	152 Å²	152	118.8 Å²	118.8	71%	0.71	69%	0.692	S	S	*	*			trans	-51.5	167.7	-171.3	-56.1	101.7	-177.3	0	0	118.4
192	G	21	Very low	22.3	Very low	62 Å²	62	120.8 Å²	120.8	64%	0.639	71%	0.706	S	S	*	*			cis	130.1	122.9	-6.8	0	0	0	0	0	115.4
193	H	23.8	Very low	22.6	Very low	201 Å²	201	123.1 Å²	123.1	93%	0.931	73%	0.729	S	S	*	*			trans	-166.7	163.9	160.5	-115.1	72.4	0	0	0	115.2
194	S	20.5	Very low	23	Very low	104 Å²	104	124 Å²	124	73%	0.727	74%	0.741	S	S	*	*			trans	-100.7	152.5	-163.1	-37.5	0	0	0	0	116.2
195	Q	22.6	Very low	23.2	Very low	203 Å²	203	124.6 Å²	124.6	95%	0.949	75%	0.751	S	S	*	*				-170.7	178.2	114.8	-119	175.4	-7.6	0	0	111.4
196	A	21.2	Very low	23.7	Very low	89 Å²	89	121.6 Å²	121.6	74%	0.736	74%	0.744	S	S	*	*			trans	-135.7	151.5	-164	0	0	0	0	0	114.2
197	T	22.6	Very low	23.6	Very low	145 Å²	145	125.6 Å²	125.6	89%	0.89	76%	0.755	S	S	*	*			trans	-163.9	145.5	136.9	17.2	0	0	0	0	113.4
198	T	21.6	Very low	23.9	Very low	127 Å²	127	127.6 Å²	127.6	78%	0.779	77%	0.772	S	S	*	*			trans	-40.5	137.8	176.5	50.3	0	0	0	0	119.3
199	S	22.6	Very low	24.2	Very low	108 Å²	108	127.7 Å²	127.7	76%	0.755	78%	0.776	S	S	*	*				162.9	162.4	108.3	55.1	0	0	0	0	113.9
200	S	23.4	Very low	24.8	Very low	119 Å²	119	129.1 Å²	129.1	83%	0.832	78%	0.783	S	S	*	*			trans	66.3	133	177.6	75.5	0	0	0	0	117.9
201	I	23.3	Very low	25.6	Very low	167 Å²	167	126.4 Å²	126.4	86%	0.856	78%	0.779	S	S	*	*			trans	-132.2	147.9	175.9	-69.4	174.9	0	0	0	108.1
202	S	23.4	Very low	27.3	Very low	112 Å²	112	125.8 Å²	125.8	78%	0.783	78%	0.776	S	S	*	*			trans	-147.9	156.5	171.1	-76.6	0	0	0	0	110.8
203	P	29.4	Very low	28.6	Very low	119 Å²	119	130 Å²	130	77%	0.773	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-87.3	165.8	-145.6	-13.9	31.8	0	0	0	116
204	P	27.8	Very low	30.1	Very low	124 Å²	124	125.2 Å²	125.2	81%	0.805	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-71.7	158.8	171	31.9	-35.6	0	0	0	112.6
205	A	25.7	Very low	32.6	Very low	108 Å²	108	123.2 Å²	123.2	89%	0.893	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-71.9	141.2	-178.4	0	0	0	0	0	112.9
206	S	28.7	Very low	34.9	Very low	106 Å²	106	115.1 Å²	115.1	74%	0.741	71%	0.713	S	S	*	*	P	Polyproline II helix	trans	-95.1	164	-177.6	65.1	0	0	0	0	113.7
207	E	26.5	Very low	37.5	Very low	180 Å²	180	114.4 Å²	114.4	84%	0.841	70%	0.696	S	S	*	*	P	Polyproline II helix	trans	-61.4	159.7	159.2	-58	174.3	136.7	0	0	110.6	S209	E207-S209 PolarHBondContact O-N 3.38Å
208	T	29.9	Very low	39.9	Very low	154 Å²	154	111.2 Å²	111.2	95%	0.945	68%	0.679	S	S	*	*	P	Polyproline II helix	trans	-73.9	118.4	179.5	48.2	0	0	0	0	111.4
209	S	26.5	Very low	42.9	Very low	76 Å²	76	105.7 Å²	105.7	53%	0.531	64%	0.644	S	S	.	*			trans	-133.8	178.8	-170	75.5	0	0	0	0	111.4	E207 V211	E207-S209 PolarHBondContact O-N 3.38Å; S209-V211 PolarHBondContact O-N 3.36Å
210	P	34.8	Very low	45.7	Very low	102 Å²	102	102.6 Å²	102.6	66%	0.662	62%	0.62	S	S	*	*	S	Bend	trans	-79.6	30.1	-155.7	34.4	-38.3	0	0	0	116.8	E212 F213	P210-E212 VanDerWaalsContact C-N 3.27Å; P210-E212 PolarHBondContact O-N 3.01Å; P210-F213 PolarHBondContact O-N 3.34Å
211	V	41.6	Very low	48.2	Very low	97 Å²	97	100.3 Å²	100.3	59%	0.588	60%	0.599	S	S	*	*	H	α-helix	trans	-58.2	-26.3	-165.4	-176.3	0	0	0	0	115.3	S209 F213 S215	S209-V211 PolarHBondContact O-N 3.36Å; V211-F213 VanDerWaalsContact C-N 3.3Å; V211-F213 PolarHBondContact O-N 3.34Å; V211-S215 PolarHBondContact O-N 3.5Å
212	E	56.3	Low	51	Low	139 Å²	139	95.7 Å²	95.7	65%	0.65	57%	0.573	S	S	*	*	H	α-helix	trans	-68.2	-25.8	-177.1	-59.1	-155.3	142.6	0	0	113.7	P210 A216 K294	P210-E212 VanDerWaalsContact C-N 3.27Å; P210-E212 PolarHBondContact O-N 3.01Å; E212-A216 PolarHBondContact O-N 3.16Å; E212-K294 IonicContact OE1-NZ 2.85Å; E212-K294 PolarHBondContact OE1-NZ 2.99Å; E212-K294 IonicContact OE2-NZ 3.27Å
213	F	48.8	Very low	53.9	Low	150 Å²	150	90.3 Å²	90.3	66%	0.658	54%	0.535	S	S	*	.	H	α-helix	trans	-78.3	-44.7	-178.7	-168.6	-115.7	0	0	0	112.2	P210 V211 S215 A216 I217	P210-F213 PolarHBondContact O-N 3.34Å; V211-F213 VanDerWaalsContact C-N 3.3Å; V211-F213 PolarHBondContact O-N 3.34Å; F213-S215 VanDerWaalsContact C-N 3.27Å; F213-S215 PolarHBondContact O-N 2.87Å; F213-A216 PolarHBondContact O-N 3.34Å; F213-A216 VanDerWaalsContact O-N 3.14Å; F213-I217 HydrophobicContact CD1-CD1 3.73Å; F213-I217 HydrophobicContact CE1-CD1 3.54Å; F213-I217 HydrophobicContact CG-CD1 4.47Å; F213-I217 HydrophobicContact CZ-CD1 4.11Å; F213-I217 PolarHBondContact O-N 3.42Å
214	D	55.4	Low	56.3	Low	100 Å²	100	89.5 Å²	89.5	54%	0.535	52%	0.519	S	S	.	.	H	α-helix	trans	-64.2	-34	177.7	-60.8	-35.9	0	0	0	111.7	I217 S218	D214-I217 PolarHBondContact O-N 2.9Å; D214-S218 WeakPolarHBondContact O-CB 3.47Å; D214-S218 PolarHBondContact O-N 3.16Å
215	S	72.3	Confident	58.9	Low	62 Å²	62	88.5 Å²	88.5	43%	0.434	51%	0.507	S	S	.	.	H	α-helix	trans	-60	-46.1	172.3	-174	0	0	0	0	112.1	V211 F213 S218 Y219	V211-S215 PolarHBondContact O-N 3.5Å; F213-S215 VanDerWaalsContact C-N 3.27Å; F213-S215 PolarHBondContact O-N 2.87Å; S215-S218 PolarHBondContact O-N 2.82Å; S215-Y219 WeakPolarHBondContact O-CB 3.46Å; S215-Y219 PolarHBondContact O-N 3.14Å
216	A	72.1	Confident	61.4	Low	34 Å²	34	88.7 Å²	88.7	28%	0.281	49%	0.485	S	S	.	.	H	α-helix	trans	-65.8	-40.7	177.5	0	0	0	0	0	112.3	E212 F213 Y219 V220 F289	E212-A216 PolarHBondContact O-N 3.16Å; F213-A216 PolarHBondContact O-N 3.34Å; F213-A216 VanDerWaalsContact O-N 3.14Å; A216-Y219 PolarHBondContact O-N 3.19Å; A216-V220 WeakPolarHBondContact O-CG2 3.36Å; A216-V220 PolarHBondContact O-N 2.85Å; A216-F289 HydrophobicContact CB-CE1 3.96Å
217	I	74.3	Confident	64	Low	73 Å²	73	84.8 Å²	84.8	37%	0.374	46%	0.455	S	S	.	.	H	α-helix	trans	-62.8	-45	175.4	-68.8	171	0	0	0	110.9	F213 D214 Y219 V220 N221	F213-I217 HydrophobicContact CD1-CD1 3.73Å; F213-I217 HydrophobicContact CE1-CD1 3.54Å; F213-I217 HydrophobicContact CG-CD1 4.47Å; F213-I217 HydrophobicContact CZ-CD1 4.11Å; F213-I217 PolarHBondContact O-N 3.42Å; D214-I217 PolarHBondContact O-N 2.9Å; I217-Y219 VanDerWaalsContact C-N 3.35Å; I217-Y219 PolarHBondContact O-N 3.3Å; I217-V220 PolarHBondContact O-N 3.35Å; I217-N221 WeakPolarHBondContact O-CB 3.47Å; I217-N221 PolarHBondContact O-N 3.32Å; I217-N221 PolarHBondContact O-ND2 3.01Å
218	S	74	Confident	66.2	Low	78 Å²	78	81.9 Å²	81.9	55%	0.545	44%	0.444	S	S	.	.	H	α-helix	trans	-59	-45.9	176.4	-172.8	0	0	0	0	111.5	D214 S215 N221 K222	D214-S218 WeakPolarHBondContact O-CB 3.47Å; D214-S218 PolarHBondContact O-N 3.16Å; S215-S218 PolarHBondContact O-N 2.82Å; S218-N221 PolarHBondContact O-N 3.38Å; S218-K222 WeakPolarHBondContact O-CB 3.36Å; S218-K222 PolarHBondContact O-N 2.9Å
219	Y	83.4	Confident	68.1	Low	12 Å²	12	81.5 Å²	81.5	5%	0.047	44%	0.436	C	S	.	.	H	α-helix	trans	-63	-45.2	177.7	178.9	-107.7	0	0	0	113.2	S215 A216 I217 N221 K222 I223 F237 L282 E285 F286 F289	S215-Y219 WeakPolarHBondContact O-CB 3.46Å; S215-Y219 PolarHBondContact O-N 3.14Å; A216-Y219 PolarHBondContact O-N 3.19Å; I217-Y219 VanDerWaalsContact C-N 3.35Å; I217-Y219 PolarHBondContact O-N 3.3Å; Y219-N221 PolarHBondContact O-N 3.45Å; Y219-K222 WeakPolarHBondContact O-CB 3.31Å; Y219-K222 PolarHBondContact O-N 2.58Å; Y219-I223 HydrophobicContact CD1-CD1 3.96Å; Y219-I223 HydrophobicContact CE1-CD1 3.4Å; Y219-I223 VanDerWaalsContact CE1-CD1 3.4Å; Y219-I223 HydrophobicContact CE1-CG1 4.39Å; Y219-I223 HydrophobicContact CE2-CD1 4.26Å; Y219-I223 HydrophobicContact CE2-CG1 4.45Å; Y219-I223 WeakPolarHBondContact O-CG1 3.43Å; Y219-I223 PolarHBondContact O-N 3.33Å; Y219-F237 HydrophobicContact CE1-CZ 4.09Å; Y219-L282 HydrophobicContact CE2-CD2 4.1Å; Y219-L282 WeakPolarHBondContact CE2-O 3.33Å; Y219-L282 PolarHBondContact OH-O 2.77Å; Y219-E285 HydrophobicContact CD2-CB 3.69Å; Y219-E285 HydrophobicContact CE2-CB 3.48Å; Y219-E285 VanDerWaalsContact CE2-CB 3.48Å; Y219-F286 HydrophobicContact CE1-CD2 4.14Å; Y219-F286 WeakPolarHBondContact OH-CB 3.31Å; Y219-F289 HydrophobicContact CD1-CD2 4.35Å; Y219-F289 AromaticContact CD1-CE2 3.71Å; Y219-F289 HydrophobicContact CD1-CE2 3.71Å; Y219-F289 HydrophobicContact CD1-CZ 4.34Å; Y219-F289 HydrophobicContact CD2-CE2 4.27Å; Y219-F289 HydrophobicContact CE1-CE2 4.24Å; Y219-F289 AromaticContact CG-CE2 3.73Å; Y219-F289 HydrophobicContact CG-CE2 3.73Å; Y219-F289 HydrophobicContact CG-CZ 4.19Å
220	V	81.6	Confident	70.3	Confident	42 Å²	42	82.3 Å²	82.3	26%	0.255	43%	0.432	S	S	.	.	H	α-helix	trans	-63.9	-41.3	176.7	172.2	0	0	0	0	111.5	A216 I217 K222 I223 K224 Y234	A216-V220 WeakPolarHBondContact O-CG2 3.36Å; A216-V220 PolarHBondContact O-N 2.85Å; I217-V220 PolarHBondContact O-N 3.35Å; V220-K222 VanDerWaalsContact C-N 3.32Å; V220-K222 PolarHBondContact O-N 2.98Å; V220-I223 PolarHBondContact O-N 3.27Å; V220-K224 WeakPolarHBondContact O-CB 3.42Å; V220-K224 PolarHBondContact O-N 2.74Å; V220-Y234 HydrophobicContact CG1-CE2 4.08Å; V220-Y234 WeakPolarHBondContact CG1-OH 3.49Å
221	N	75.9	Confident	72.3	Confident	72 Å²	72	80.4 Å²	80.4	39%	0.385	42%	0.419	S	S	.	.	H	α-helix	trans	-65.3	-34.4	173.9	-76.3	-36.5	0	0	0	112.5	I217 S218 Y219 K224 N225	I217-N221 WeakPolarHBondContact O-CB 3.47Å; I217-N221 PolarHBondContact O-N 3.32Å; I217-N221 PolarHBondContact O-ND2 3.01Å; S218-N221 PolarHBondContact O-N 3.38Å; Y219-N221 PolarHBondContact O-N 3.45Å; N221-K224 PolarHBondContact O-N 2.7Å; N221-N225 WeakPolarHBondContact O-CB 3.24Å; N221-N225 VanDerWaalsContact O-CG 3.26Å; N221-N225 PolarHBondContact O-N 2.88Å
222	K	83.8	Confident	74.1	Confident	69 Å²	69	80.7 Å²	80.7	30%	0.3	41%	0.414	S	S	.	.	H	α-helix	trans	-65.7	-41.9	175.5	-173.2	179.4	174.9	-179.1	0	112.1	S218 Y219 V220 R226 L282 E285	S218-K222 WeakPolarHBondContact O-CB 3.36Å; S218-K222 PolarHBondContact O-N 2.9Å; Y219-K222 WeakPolarHBondContact O-CB 3.31Å; Y219-K222 PolarHBondContact O-N 2.58Å; V220-K222 VanDerWaalsContact C-N 3.32Å; V220-K222 PolarHBondContact O-N 2.98Å; K222-R226 WeakPolarHBondContact O-CB 3.24Å; K222-R226 PolarHBondContact O-N 3.44Å; K222-L282 HydrophobicContact CD-CD2 4.17Å; K222-L282 HydrophobicContact CG-CD2 4.12Å; K222-E285 IonicContact NZ-OE1 3.73Å; K222-E285 PolarHBondContact NZ-OE1 3.19Å; K222-E285 IonicContact NZ-OE2 2.8Å; K222-E285 PolarHBondContact NZ-OE2 3.43Å
223	I	82.4	Confident	75.3	Confident	0 Å²	0	75.8 Å²	75.8	0%	0	39%	0.392	C	S	.	.	H	α-helix	trans	-63.1	-50.3	170.9	-62.2	163.4	0	0	0	110	Y219 V220 N225 R226 F227 Y234 F237 F276 L282	Y219-I223 HydrophobicContact CD1-CD1 3.96Å; Y219-I223 HydrophobicContact CE1-CD1 3.4Å; Y219-I223 VanDerWaalsContact CE1-CD1 3.4Å; Y219-I223 HydrophobicContact CE1-CG1 4.39Å; Y219-I223 HydrophobicContact CE2-CD1 4.26Å; Y219-I223 HydrophobicContact CE2-CG1 4.45Å; Y219-I223 WeakPolarHBondContact O-CG1 3.43Å; Y219-I223 PolarHBondContact O-N 3.33Å; V220-I223 PolarHBondContact O-N 3.27Å; I223-N225 PolarHBondContact O-N 2.81Å; I223-R226 PolarHBondContact O-N 3.06Å; I223-R226 VanDerWaalsContact O-N 3.17Å; I223-F227 HydrophobicContact CG2-CD2 3.77Å; I223-F227 HydrophobicContact CG2-CE2 4.17Å; I223-F227 WeakPolarHBondContact O-CD2 3.39Å; I223-F227 PolarHBondContact O-N 3.21Å; I223-Y234 HydrophobicContact CG2-CD2 4.02Å; I223-F237 HydrophobicContact CD1-CD1 4.04Å; I223-F237 HydrophobicContact CD1-CD2 4.47Å; I223-F237 HydrophobicContact CD1-CE1 3.52Å; I223-F237 HydrophobicContact CD1-CE2 4Å; I223-F237 HydrophobicContact CD1-CG 4.49Å; I223-F237 HydrophobicContact CD1-CZ 3.49Å; I223-F237 VanDerWaalsContact CD1-CZ 3.49Å; I223-F276 HydrophobicContact CD1-CE2 4.08Å; I223-F276 HydrophobicContact CD1-CZ 3.76Å; I223-F276 HydrophobicContact CG1-CE2 4.43Å; I223-F276 HydrophobicContact CG1-CZ 4.02Å; I223-F276 HydrophobicContact CG2-CE1 3.99Å; I223-F276 HydrophobicContact CG2-CZ 3.84Å; I223-L282 HydrophobicContact CG1-CD1 4.42Å; I223-L282 HydrophobicContact CG1-CD2 4.1Å
224	K	80.3	Confident	76.9	Confident	101 Å²	101	71.1 Å²	71.1	44%	0.439	37%	0.371	S	S	.	.	H	α-helix	trans	-54.3	-40.5	-179.5	-171	-176.8	175.8	-171.5	0	112.1	V220 N221 L228 Y234	V220-K224 WeakPolarHBondContact O-CB 3.42Å; V220-K224 PolarHBondContact O-N 2.74Å; N221-K224 PolarHBondContact O-N 2.7Å; K224-L228 PolarHBondContact O-N 3.12Å; K224-Y234 HydrophobicContact CB-CD2 4.01Å; K224-Y234 HydrophobicContact CB-CE2 3.67Å; K224-Y234 HydrophobicContact CG-CD2 4.44Å; K224-Y234 HydrophobicContact CG-CE2 4.14Å
225	N	81.9	Confident	78	Confident	103 Å²	103	74.6 Å²	74.6	55%	0.551	38%	0.376	S	S	*	.	H	α-helix	trans	-79.8	-35.1	178.8	-68.7	-4.5	0	0	0	113.4	N221 I223 F227	N221-N225 WeakPolarHBondContact O-CB 3.24Å; N221-N225 VanDerWaalsContact O-CG 3.26Å; N221-N225 PolarHBondContact O-N 2.88Å; I223-N225 PolarHBondContact O-N 2.81Å; N225-F227 VanDerWaalsContact C-N 3.3Å; N225-F227 PolarHBondContact O-N 3.18Å
226	R	79	Confident	78.5	Confident	113 Å²	113	73 Å²	73	43%	0.426	37%	0.367	S	S	.	.	H	α-helix	trans	-66.4	-29.4	174.7	-89.5	-81.4	-175.3	76.6	12.3	113.2	K222 I223 D281 L282	K222-R226 WeakPolarHBondContact O-CB 3.24Å; K222-R226 PolarHBondContact O-N 3.44Å; I223-R226 PolarHBondContact O-N 3.06Å; I223-R226 VanDerWaalsContact O-N 3.17Å; R226-D281 IonicContact CZ-OD2 3.17Å; R226-D281 VanDerWaalsContact CZ-OD2 3.26Å; R226-D281 IonicContact NH1-OD1 3.99Å; R226-D281 PolarHBondContact NH1-OD1 2.87Å; R226-D281 VanDerWaalsContact NH1-OD1 3.14Å; R226-D281 IonicContact NH1-OD2 2.7Å; R226-D281 PolarHBondContact NH1-OD2 2.81Å; R226-D281 IonicContact NH2-OD2 2.78Å; R226-D281 PolarHBondContact NH2-OD2 3.03Å; R226-L282 HydrophobicContact CB-CD1 4.44Å; R226-L282 HydrophobicContact CG-CD1 4.47Å
227	F	82.4	Confident	79.2	Confident	24 Å²	24	71.5 Å²	71.5	11%	0.105	35%	0.354	C	S	.	.	T	Hydrogen-bonded Turn	trans	-116.4	33.7	-179.3	-58.5	-71.5	0	0	0	112.6	I223 N225 D229 H230 I233 F276 Q279 L282	I223-F227 HydrophobicContact CG2-CD2 3.77Å; I223-F227 HydrophobicContact CG2-CE2 4.17Å; I223-F227 WeakPolarHBondContact O-CD2 3.39Å; I223-F227 PolarHBondContact O-N 3.21Å; N225-F227 VanDerWaalsContact C-N 3.3Å; N225-F227 PolarHBondContact O-N 3.18Å; F227-D229 VanDerWaalsContact C-N 3.26Å; F227-D229 PolarHBondContact O-N 3.2Å; F227-H230 HydrophobicContact CB-CB 4.35Å; F227-H230 CarbonylContact O-C 3.49Å; F227-H230 VanDerWaalsContact O-C 3.22Å; F227-H230 PolarHBondContact O-N 2.87Å; F227-I233 HydrophobicContact CB-CB 4.36Å; F227-I233 HydrophobicContact CB-CG2 4.45Å; F227-I233 HydrophobicContact CD1-CB 4.24Å; F227-I233 HydrophobicContact CD1-CD1 3.68Å; F227-I233 HydrophobicContact CD1-CG2 3.92Å; F227-I233 HydrophobicContact CD2-CG2 3.9Å; F227-I233 HydrophobicContact CE1-CD1 3.87Å; F227-I233 HydrophobicContact CE1-CG2 4.05Å; F227-I233 HydrophobicContact CE2-CG2 4.03Å; F227-I233 HydrophobicContact CG-CB 4.19Å; F227-I233 HydrophobicContact CG-CD1 4.48Å; F227-I233 HydrophobicContact CG-CG2 3.83Å; F227-I233 HydrophobicContact CZ-CG2 4.1Å; F227-F276 HydrophobicContact CD2-CE1 4.37Å; F227-F276 AromaticContact CE2-CD1 3.64Å; F227-F276 HydrophobicContact CE2-CD1 3.64Å; F227-F276 AromaticContact CE2-CE1 3.68Å; F227-F276 HydrophobicContact CE2-CE1 3.68Å; F227-F276 AromaticContact CZ-CD1 3.85Å; F227-F276 HydrophobicContact CZ-CD1 3.85Å; F227-F276 HydrophobicContact CZ-CE1 4.33Å; F227-Q279 HydrophobicContact CZ-CG 4.18Å; F227-L282 HydrophobicContact CE2-CD1 3.7Å; F227-L282 HydrophobicContact CZ-CD1 4.23Å
228	L	74.4	Confident	79.7	Confident	118 Å²	118	71.2 Å²	71.2	62%	0.618	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.2	-42.5	175.6	-98.8	164	0	0	0	112.4	K224 H230	K224-L228 PolarHBondContact O-N 3.12Å; L228-H230 VanDerWaalsContact C-N 3.27Å; L228-H230 PolarHBondContact O-N 3.35Å
229	D	69.4	Low	80.1	Confident	146 Å²	146	73.9 Å²	73.9	78%	0.781	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.3	-6.9	178.8	-53.9	-53.2	0	0	0	113.6	F227	F227-D229 VanDerWaalsContact C-N 3.26Å; F227-D229 PolarHBondContact O-N 3.2Å
230	H	73.3	Confident	80.1	Confident	94 Å²	94	74.6 Å²	74.6	44%	0.435	36%	0.361	S	S	.	.			trans	-132.4	62.6	-175	-75.8	-66	0	0	0	112.1	F227 L228 E232 I233	F227-H230 HydrophobicContact CB-CB 4.35Å; F227-H230 CarbonylContact O-C 3.49Å; F227-H230 VanDerWaalsContact O-C 3.22Å; F227-H230 PolarHBondContact O-N 2.87Å; L228-H230 VanDerWaalsContact C-N 3.27Å; L228-H230 PolarHBondContact O-N 3.35Å; H230-E232 IonicContact CE1-OE1 2.65Å; H230-E232 IonicContact CG-OE1 2.73Å; H230-E232 IonicContact ND1-OE1 2.65Å; H230-E232 PolarHBondContact ND1-OE1 3.25Å; H230-E232 PolarHBondContact O-N 3.18Å; H230-E232 VanDerWaalsContact O-N 3.1Å; H230-I233 HydrophobicContact CB-CB 4.49Å; H230-I233 HydrophobicContact CB-CD1 3.79Å; H230-I233 HydrophobicContact CB-CG1 4.09Å; H230-I233 WeakPolarHBondContact O-CB 3.48Å; H230-I233 PolarHBondContact O-N 2.99Å
231	P	76.5	Confident	80.1	Confident	62 Å²	62	75.5 Å²	75.5	40%	0.403	36%	0.364	S	S	.	.	H	α-helix	trans	-62.1	-19.7	-175.1	27.1	-36.6	0	0	0	114.2	I233 Y234 R235	P231-I233 VanDerWaalsContact C-N 3.34Å; P231-Y234 PolarHBondContact O-N 3.28Å; P231-R235 WeakPolarHBondContact O-CG 3.45Å; P231-R235 PolarHBondContact O-N 3.23Å
232	E	78.1	Confident	80.1	Confident	103 Å²	103	78.5 Å²	78.5	48%	0.481	38%	0.375	S	S	.	.	H	α-helix	trans	-62.4	-36.2	170.4	64.1	-75.7	177.6	0	0	113	H230 R235 A236	H230-E232 IonicContact CE1-OE1 2.65Å; H230-E232 IonicContact CG-OE1 2.73Å; H230-E232 IonicContact ND1-OE1 2.65Å; H230-E232 PolarHBondContact ND1-OE1 3.25Å; H230-E232 PolarHBondContact O-N 3.18Å; H230-E232 VanDerWaalsContact O-N 3.1Å; E232-R235 PolarHBondContact O-N 3.16Å; E232-A236 WeakPolarHBondContact O-CB 3.4Å; E232-A236 PolarHBondContact O-N 3.3Å
233	I	81.8	Confident	79.7	Confident	35 Å²	35	77.5 Å²	77.5	18%	0.179	38%	0.375	C	S	.	.	H	α-helix	trans	-67.8	-45.3	177.1	-63.2	179.8	0	0	0	109.7	F227 H230 P231 R235 A236 F237 L275 F276	F227-I233 HydrophobicContact CB-CB 4.36Å; F227-I233 HydrophobicContact CB-CG2 4.45Å; F227-I233 HydrophobicContact CD1-CB 4.24Å; F227-I233 HydrophobicContact CD1-CD1 3.68Å; F227-I233 HydrophobicContact CD1-CG2 3.92Å; F227-I233 HydrophobicContact CD2-CG2 3.9Å; F227-I233 HydrophobicContact CE1-CD1 3.87Å; F227-I233 HydrophobicContact CE1-CG2 4.05Å; F227-I233 HydrophobicContact CE2-CG2 4.03Å; F227-I233 HydrophobicContact CG-CB 4.19Å; F227-I233 HydrophobicContact CG-CD1 4.48Å; F227-I233 HydrophobicContact CG-CG2 3.83Å; F227-I233 HydrophobicContact CZ-CG2 4.1Å; H230-I233 HydrophobicContact CB-CB 4.49Å; H230-I233 HydrophobicContact CB-CD1 3.79Å; H230-I233 HydrophobicContact CB-CG1 4.09Å; H230-I233 WeakPolarHBondContact O-CB 3.48Å; H230-I233 PolarHBondContact O-N 2.99Å; P231-I233 VanDerWaalsContact C-N 3.34Å; I233-R235 PolarHBondContact O-N 3.47Å; I233-A236 PolarHBondContact O-N 2.89Å; I233-F237 WeakPolarHBondContact O-CB 3.49Å; I233-F237 PolarHBondContact O-N 3.48Å; I233-L275 HydrophobicContact CG2-CD1 4.43Å; I233-L275 HydrophobicContact CG2-CD2 4.45Å; I233-L275 HydrophobicContact CG2-CG 4.09Å; I233-F276 HydrophobicContact CG2-CD1 4.3Å; I233-F276 HydrophobicContact CG2-CE1 4.14Å
234	Y	82.8	Confident	79.4	Confident	53 Å²	53	79.2 Å²	79.2	21%	0.208	38%	0.382	C	S	.	.	H	α-helix	trans	-63.8	-39.2	176.6	-176.8	-101.5	0	0	0	112.4	V220 I223 K224 P231 L238	V220-Y234 HydrophobicContact CG1-CE2 4.08Å; V220-Y234 WeakPolarHBondContact CG1-OH 3.49Å; I223-Y234 HydrophobicContact CG2-CD2 4.02Å; K224-Y234 HydrophobicContact CB-CD2 4.01Å; K224-Y234 HydrophobicContact CB-CE2 3.67Å; K224-Y234 HydrophobicContact CG-CD2 4.44Å; K224-Y234 HydrophobicContact CG-CE2 4.14Å; P231-Y234 PolarHBondContact O-N 3.28Å; Y234-L238 HydrophobicContact CD1-CD1 4.08Å; Y234-L238 HydrophobicContact CE1-CD1 3.5Å; Y234-L238 HydrophobicContact CE1-CG 4.34Å; Y234-L238 WeakPolarHBondContact O-CG 3.39Å; Y234-L238 PolarHBondContact O-N 3.4Å
235	R	79.3	Confident	79	Confident	173 Å²	173	80.1 Å²	80.1	65%	0.653	39%	0.388	S	S	*	.	H	α-helix	trans	-64	-48.5	173.7	-76.8	-172.7	-178.7	104.7	-3.5	112.4	P231 E232 I233 F237 L238 E239	P231-R235 WeakPolarHBondContact O-CG 3.45Å; P231-R235 PolarHBondContact O-N 3.23Å; E232-R235 PolarHBondContact O-N 3.16Å; I233-R235 PolarHBondContact O-N 3.47Å; R235-F237 VanDerWaalsContact C-N 3.29Å; R235-F237 PolarHBondContact O-N 3.28Å; R235-L238 PolarHBondContact O-N 3.33Å; R235-E239 WeakPolarHBondContact O-CB 3.45Å; R235-E239 PolarHBondContact O-N 3.45Å
236	A	81.6	Confident	78.6	Confident	28 Å²	28	81 Å²	81	23%	0.231	39%	0.387	C	S	.	.	H	α-helix	trans	-63.6	-34.3	180	0	0	0	0	0	112.4	E232 I233 E239 I240 L275	E232-A236 WeakPolarHBondContact O-CB 3.4Å; E232-A236 PolarHBondContact O-N 3.3Å; I233-A236 PolarHBondContact O-N 2.89Å; A236-E239 PolarHBondContact O-N 3.5Å; A236-I240 WeakPolarHBondContact O-CD1 3.45Å; A236-I240 VanDerWaalsContact O-CG1 3.28Å; A236-I240 WeakPolarHBondContact O-CG1 3.48Å; A236-I240 PolarHBondContact O-N 3.07Å; A236-L275 HydrophobicContact CB-CD1 3.75Å; A236-L275 HydrophobicContact CB-CD2 4.29Å
237	F	86.7	Confident	78.1	Confident	3 Å²	3	77.8 Å²	77.8	1%	0.013	38%	0.376	C	S	.	.	H	α-helix	trans	-60.7	-49.4	172.2	172.8	-107.3	0	0	0	111.7	Y219 I223 I233 R235 E239 I240 L241 V272 L275 F276 F286	Y219-F237 HydrophobicContact CE1-CZ 4.09Å; I223-F237 HydrophobicContact CD1-CD1 4.04Å; I223-F237 HydrophobicContact CD1-CD2 4.47Å; I223-F237 HydrophobicContact CD1-CE1 3.52Å; I223-F237 HydrophobicContact CD1-CE2 4Å; I223-F237 HydrophobicContact CD1-CG 4.49Å; I223-F237 HydrophobicContact CD1-CZ 3.49Å; I223-F237 VanDerWaalsContact CD1-CZ 3.49Å; I233-F237 WeakPolarHBondContact O-CB 3.49Å; I233-F237 PolarHBondContact O-N 3.48Å; R235-F237 VanDerWaalsContact C-N 3.29Å; R235-F237 PolarHBondContact O-N 3.28Å; F237-E239 VanDerWaalsContact C-N 3.33Å; F237-E239 PolarHBondContact O-N 3.23Å; F237-I240 PolarHBondContact O-N 2.67Å; F237-L241 HydrophobicContact CD1-CD1 4.31Å; F237-L241 HydrophobicContact CE1-CD1 3.62Å; F237-L241 HydrophobicContact CE2-CD1 4.03Å; F237-L241 HydrophobicContact CZ-CD1 3.46Å; F237-L241 VanDerWaalsContact CZ-CD1 3.46Å; F237-L241 PolarHBondContact O-N 2.9Å; F237-L241 VanDerWaalsContact O-N 3.13Å; F237-V272 HydrophobicContact CD2-CG1 4.35Å; F237-V272 HydrophobicContact CD2-CG2 4.44Å; F237-V272 HydrophobicContact CE2-CG1 4.32Å; F237-L275 HydrophobicContact CB-CD2 3.64Å; F237-F276 HydrophobicContact CB-CE1 4.46Å; F237-F276 HydrophobicContact CB-CZ 4.23Å; F237-F276 HydrophobicContact CD2-CE1 4.32Å; F237-F276 AromaticContact CD2-CE2 3.87Å; F237-F276 HydrophobicContact CD2-CE2 3.87Å; F237-F276 AromaticContact CD2-CZ 3.39Å; F237-F276 HydrophobicContact CD2-CZ 3.39Å; F237-F276 AromaticContact CE2-CE2 3.93Å; F237-F276 HydrophobicContact CE2-CE2 3.93Å; F237-F276 AromaticContact CE2-CZ 3.83Å; F237-F276 HydrophobicContact CE2-CZ 3.83Å; F237-F276 AromaticContact CG-CZ 3.84Å; F237-F276 HydrophobicContact CG-CZ 3.84Å; F237-F286 HydrophobicContact CE2-CD2 4.04Å; F237-F286 AromaticContact CE2-CE2 3.85Å; F237-F286 HydrophobicContact CE2-CE2 3.85Å; F237-F286 HydrophobicContact CZ-CD2 4.44Å; F237-F286 HydrophobicContact CZ-CE2 4.27Å
238	L	84.7	Confident	77	Confident	67 Å²	67	80.6 Å²	80.6	35%	0.351	39%	0.39	S	S	.	.	H	α-helix	trans	-63.9	-37.3	176.4	-68.7	178.8	0	0	0	112.1	Y234 R235 L241 H242	Y234-L238 HydrophobicContact CD1-CD1 4.08Å; Y234-L238 HydrophobicContact CE1-CD1 3.5Å; Y234-L238 HydrophobicContact CE1-CG 4.34Å; Y234-L238 WeakPolarHBondContact O-CG 3.39Å; Y234-L238 PolarHBondContact O-N 3.4Å; R235-L238 PolarHBondContact O-N 3.33Å; L238-L241 PolarHBondContact O-N 3.23Å; L238-H242 WeakPolarHBondContact O-CB 3.43Å; L238-H242 PolarHBondContact O-N 2.73Å
239	E	82.9	Confident	76.1	Confident	134 Å²	134	79.1 Å²	79.1	63%	0.626	38%	0.382	S	S	*	.	H	α-helix	trans	-64.5	-42.5	178	-173.1	175.8	-174.6	0	0	112.7	R235 A236 F237 H242 T243	R235-E239 WeakPolarHBondContact O-CB 3.45Å; R235-E239 PolarHBondContact O-N 3.45Å; A236-E239 PolarHBondContact O-N 3.5Å; F237-E239 VanDerWaalsContact C-N 3.33Å; F237-E239 PolarHBondContact O-N 3.23Å; E239-H242 PolarHBondContact O-N 2.93Å; E239-T243 WeakPolarHBondContact O-CB 3.27Å; E239-T243 PolarHBondContact O-N 3.47Å; E239-T243 PolarHBondContact O-OG1 2.75Å
240	I	83.6	Confident	75.4	Confident	27 Å²	27	76.8 Å²	76.8	14%	0.138	37%	0.366	C	S	.	.	H	α-helix	trans	-61.1	-46.2	173.1	-67.9	159.7	0	0	0	110.3	A236 F237 T243 Y244 V268 K271 V272 L275	A236-I240 WeakPolarHBondContact O-CD1 3.45Å; A236-I240 VanDerWaalsContact O-CG1 3.28Å; A236-I240 WeakPolarHBondContact O-CG1 3.48Å; A236-I240 PolarHBondContact O-N 3.07Å; F237-I240 PolarHBondContact O-N 2.67Å; I240-T243 PolarHBondContact O-N 3.21Å; I240-Y244 WeakPolarHBondContact O-CB 3.45Å; I240-Y244 PolarHBondContact O-N 3.37Å; I240-V268 HydrophobicContact CG2-CG1 4.09Å; I240-K271 HydrophobicContact CD1-CB 3.96Å; I240-K271 HydrophobicContact CG1-CB 4.45Å; I240-K271 HydrophobicContact CG2-CB 4.47Å; I240-V272 HydrophobicContact CG2-CG2 4.07Å; I240-L275 HydrophobicContact CD1-CD2 4.22Å
241	L	81	Confident	74.8	Confident	61 Å²	61	76 Å²	76	32%	0.319	37%	0.368	S	S	.	.	H	α-helix	trans	-61.7	-46	177	-101.1	165.3	0	0	0	112.4	F237 L238 T243 Y244 Q245	F237-L241 HydrophobicContact CD1-CD1 4.31Å; F237-L241 HydrophobicContact CE1-CD1 3.62Å; F237-L241 HydrophobicContact CE2-CD1 4.03Å; F237-L241 HydrophobicContact CZ-CD1 3.46Å; F237-L241 VanDerWaalsContact CZ-CD1 3.46Å; F237-L241 PolarHBondContact O-N 2.9Å; F237-L241 VanDerWaalsContact O-N 3.13Å; L238-L241 PolarHBondContact O-N 3.23Å; L241-T243 VanDerWaalsContact C-N 3.31Å; L241-T243 PolarHBondContact O-N 2.85Å; L241-Y244 PolarHBondContact O-N 3.02Å; L241-Q245 VanDerWaalsContact O-CB 3.3Å; L241-Q245 WeakPolarHBondContact O-CB 3.42Å; L241-Q245 PolarHBondContact O-N 2.84Å
242	H	75.4	Confident	73.4	Confident	134 Å²	134	81.2 Å²	81.2	62%	0.62	38%	0.384	S	S	*	.	H	α-helix	trans	-65.7	-36	179.9	-126.2	-74.1	0	0	0	112.1	L238 E239 K246	L238-H242 WeakPolarHBondContact O-CB 3.43Å; L238-H242 PolarHBondContact O-N 2.73Å; E239-H242 PolarHBondContact O-N 2.93Å; H242-K246 WeakPolarHBondContact O-CB 3.12Å; H242-K246 PolarHBondContact O-N 3.27Å
243	T	76.7	Confident	72	Confident	48 Å²	48	80.4 Å²	80.4	29%	0.294	38%	0.381	S	S	.	.	H	α-helix	trans	-68.8	-48.5	176.8	-57.7	0	0	0	0	110.4	E239 I240 L241 Q245 K246 E247 M263	E239-T243 WeakPolarHBondContact O-CB 3.27Å; E239-T243 PolarHBondContact O-N 3.47Å; E239-T243 PolarHBondContact O-OG1 2.75Å; I240-T243 PolarHBondContact O-N 3.21Å; L241-T243 VanDerWaalsContact C-N 3.31Å; L241-T243 PolarHBondContact O-N 2.85Å; T243-Q245 PolarHBondContact O-N 2.98Å; T243-K246 PolarHBondContact O-N 3.07Å; T243-E247 HydrophobicContact CG2-CG 4.49Å; T243-E247 WeakPolarHBondContact CG2-OE1 3.19Å; T243-E247 WeakPolarHBondContact O-CG 3.43Å; T243-E247 PolarHBondContact O-N 3.18Å; T243-M263 HydrophobicContact CG2-CE 3.52Å
244	Y	75.3	Confident	70.3	Confident	37 Å²	37	82.5 Å²	82.5	15%	0.145	40%	0.398	C	S	.	.	H	α-helix	trans	-60.4	-44	175.7	176.2	-124.2	0	0	0	112.7	I240 L241 K246 E247 Q248 E265 V268	I240-Y244 WeakPolarHBondContact O-CB 3.45Å; I240-Y244 PolarHBondContact O-N 3.37Å; L241-Y244 PolarHBondContact O-N 3.02Å; Y244-K246 VanDerWaalsContact C-N 3.32Å; Y244-K246 PolarHBondContact O-N 3.29Å; Y244-E247 PolarHBondContact O-N 3.31Å; Y244-Q248 HydrophobicContact CD2-CG 4.04Å; Y244-Q248 HydrophobicContact CE1-CG 4.38Å; Y244-Q248 HydrophobicContact CE2-CG 3.56Å; Y244-Q248 WeakPolarHBondContact O-CB 3.25Å; Y244-Q248 WeakPolarHBondContact O-CG 3.17Å; Y244-Q248 PolarHBondContact O-N 3.13Å; Y244-Q248 PolarHBondContact OH-NE2 3.44Å; Y244-E265 HydrophobicContact CE2-CG 4.46Å; Y244-E265 WeakPolarHBondContact OH-CG 3.44Å; Y244-E265 PolarHBondContact OH-OE1 2.9Å; Y244-V268 HydrophobicContact CD1-CG1 4.47Å; Y244-V268 HydrophobicContact CD1-CG2 4.4Å; Y244-V268 HydrophobicContact CD2-CG2 3.59Å; Y244-V268 HydrophobicContact CE2-CG2 4.23Å; Y244-V268 HydrophobicContact CG-CG1 4.44Å; Y244-V268 HydrophobicContact CG-CG2 3.69Å
245	Q	71.8	Confident	68.1	Low	120 Å²	120	91.4 Å²	91.4	56%	0.561	43%	0.431	S	S	*	.	H	α-helix	trans	-64.7	-36.6	178.1	-169	176.1	24.2	0	0	112	L241 T243 L249	L241-Q245 VanDerWaalsContact O-CB 3.3Å; L241-Q245 WeakPolarHBondContact O-CB 3.42Å; L241-Q245 PolarHBondContact O-N 2.84Å; T243-Q245 PolarHBondContact O-N 2.98Å; Q245-L249 WeakPolarHBondContact O-CG 3.17Å; Q245-L249 PolarHBondContact O-N 3.08Å
246	K	74.1	Confident	66.4	Low	122 Å²	122	87.2 Å²	87.2	53%	0.53	44%	0.443	S	S	.	.	H	α-helix	trans	-68	-47.3	174.3	-176.4	-172.6	169.7	-155.4	0	111.8	H242 T243 Y244 Q248 L249 E250	H242-K246 WeakPolarHBondContact O-CB 3.12Å; H242-K246 PolarHBondContact O-N 3.27Å; T243-K246 PolarHBondContact O-N 3.07Å; Y244-K246 VanDerWaalsContact C-N 3.32Å; Y244-K246 PolarHBondContact O-N 3.29Å; K246-Q248 VanDerWaalsContact C-N 3.35Å; K246-Q248 PolarHBondContact O-N 2.87Å; K246-L249 WeakPolarHBondContact O-CB 3.28Å; K246-L249 PolarHBondContact O-N 3.44Å; K246-E250 WeakPolarHBondContact CE-OE1 3.14Å; K246-E250 IonicContact NZ-OE1 2.67Å; K246-E250 PolarHBondContact NZ-OE1 3.5Å; K246-E250 PolarHBondContact O-N 3.5Å
247	E	67.3	Low	64	Low	45 Å²	45	89.4 Å²	89.4	21%	0.21	47%	0.468	C	S	.	.	H	α-helix	trans	-64.9	-37.6	179.1	-71.7	177.8	-166	0	0	111.8	T243 Y244 L249 E250 V251 G262 M263	T243-E247 HydrophobicContact CG2-CG 4.49Å; T243-E247 WeakPolarHBondContact CG2-OE1 3.19Å; T243-E247 WeakPolarHBondContact O-CG 3.43Å; T243-E247 PolarHBondContact O-N 3.18Å; Y244-E247 PolarHBondContact O-N 3.31Å; E247-L249 VanDerWaalsContact C-N 3.28Å; E247-L249 PolarHBondContact O-N 2.87Å; E247-E250 PolarHBondContact O-N 3.43Å; E247-V251 WeakPolarHBondContact O-CB 3.35Å; E247-V251 VanDerWaalsContact O-CG2 3.29Å; E247-V251 WeakPolarHBondContact O-CG2 3.41Å; E247-V251 PolarHBondContact O-N 2.82Å; E247-G262 WeakPolarHBondContact OE2-CA 3.33Å; E247-M263 PolarHBondContact OE2-N 3.29Å
248	Q	60	Low	61.8	Low	82 Å²	82	101.8 Å²	101.8	38%	0.383	51%	0.514	S	S	.	.	H	α-helix	trans	-61.5	-32.4	170.6	-81	-77.1	11.3	0	0	113.1	Y244 K246 K252	Y244-Q248 HydrophobicContact CD2-CG 4.04Å; Y244-Q248 HydrophobicContact CE1-CG 4.38Å; Y244-Q248 HydrophobicContact CE2-CG 3.56Å; Y244-Q248 WeakPolarHBondContact O-CB 3.25Å; Y244-Q248 WeakPolarHBondContact O-CG 3.17Å; Y244-Q248 PolarHBondContact O-N 3.13Å; Y244-Q248 PolarHBondContact OH-NE2 3.44Å; K246-Q248 VanDerWaalsContact C-N 3.35Å; K246-Q248 PolarHBondContact O-N 2.87Å; Q248-K252 VanDerWaalsContact O-CB 3.23Å; Q248-K252 WeakPolarHBondContact O-CB 3.49Å; Q248-K252 PolarHBondContact O-N 2.94Å
249	L	56.5	Low	60	Low	87 Å²	87	102.5 Å²	102.5	46%	0.455	54%	0.538	S	S	.	.	H	α-helix	trans	-73	-45.1	173.2	-73.1	165	0	0	0	111.6	Q245 K246 E247 V251 K252 E253	Q245-L249 WeakPolarHBondContact O-CG 3.17Å; Q245-L249 PolarHBondContact O-N 3.08Å; K246-L249 WeakPolarHBondContact O-CB 3.28Å; K246-L249 PolarHBondContact O-N 3.44Å; E247-L249 VanDerWaalsContact C-N 3.28Å; E247-L249 PolarHBondContact O-N 2.87Å; L249-V251 VanDerWaalsContact C-N 3.34Å; L249-V251 PolarHBondContact O-N 3.29Å; L249-K252 WeakPolarHBondContact O-CA 3.45Å; L249-K252 WeakPolarHBondContact O-CB 3.34Å; L249-K252 PolarHBondContact O-N 2.92Å; L249-E253 PolarHBondContact O-N 3.15Å
250	E	54.7	Low	57.7	Low	97 Å²	97	102.1 Å²	102.1	45%	0.453	55%	0.55	S	S	.	*	H	α-helix	trans	-61.9	-38.9	177.7	-70.1	-179.1	178.5	0	0	112.2	K246 E247 K252 S254	K246-E250 WeakPolarHBondContact CE-OE1 3.14Å; K246-E250 IonicContact NZ-OE1 2.67Å; K246-E250 PolarHBondContact NZ-OE1 3.5Å; K246-E250 PolarHBondContact O-N 3.5Å; E247-E250 PolarHBondContact O-N 3.43Å; E250-K252 VanDerWaalsContact C-N 3.3Å; E250-K252 PolarHBondContact O-N 3.36Å; E250-S254 WeakPolarHBondContact O-CB 3.24Å; E250-S254 PolarHBondContact O-N 2.82Å; E250-S254 PolarHBondContact O-OG 3.15Å
251	V	59.4	Low	56	Low	78 Å²	78	106.3 Å²	106.3	47%	0.473	58%	0.582	S	S	.	*	H	α-helix	trans	-67.3	-28.5	172.7	169.5	0	0	0	0	112.4	E247 L249	E247-V251 WeakPolarHBondContact O-CB 3.35Å; E247-V251 VanDerWaalsContact O-CG2 3.29Å; E247-V251 WeakPolarHBondContact O-CG2 3.41Å; E247-V251 PolarHBondContact O-N 2.82Å; L249-V251 VanDerWaalsContact C-N 3.34Å; L249-V251 PolarHBondContact O-N 3.29Å
252	K	48.5	Very low	54.9	Low	171 Å²	171	105 Å²	105	74%	0.743	58%	0.583	S	S	*	*	H	α-helix	trans	-82.2	-32.1	179.9	-171.5	172.6	-178.8	177.9	0	113.1	Q248 L249 E250	Q248-K252 VanDerWaalsContact O-CB 3.23Å; Q248-K252 WeakPolarHBondContact O-CB 3.49Å; Q248-K252 PolarHBondContact O-N 2.94Å; L249-K252 WeakPolarHBondContact O-CA 3.45Å; L249-K252 WeakPolarHBondContact O-CB 3.34Å; L249-K252 PolarHBondContact O-N 2.92Å; E250-K252 VanDerWaalsContact C-N 3.3Å; E250-K252 PolarHBondContact O-N 3.36Å
253	E	48.2	Very low	54.1	Low	87 Å²	87	100.5 Å²	100.5	41%	0.407	56%	0.563	S	S	.	*	H	α-helix	trans	-75.4	-29.8	168.2	-68.6	-155.1	122.2	0	0	112.2	H32 F33 L249 R255	H32-E253 IonicContact CD2-OE1 2.69Å; H32-E253 IonicContact CD2-OE2 2.74Å; H32-E253 PolarHBondContact CD2-OE2 3.21Å; H32-E253 VanDerWaalsContact CD2-OE2 3.31Å; H32-E253 IonicContact CE1-OE1 3.49Å; H32-E253 IonicContact CG-OE1 3.18Å; H32-E253 IonicContact CG-OE2 2.61Å; H32-E253 IonicContact ND1-OE1 2.68Å; H32-E253 IonicContact NE2-OE1 3.46Å; F33-E253 PolarHBondContact N-OE1 2.99Å; L249-E253 PolarHBondContact O-N 3.15Å; E253-R255 PolarHBondContact O-N 3Å
254	S	45.6	Very low	53.9	Low	78 Å²	78	101.4 Å²	101.4	55%	0.545	57%	0.568	S	S	.	*			trans	-101.8	73.1	-170.2	-57.1	0	0	0	0	115.4	E250	E250-S254 WeakPolarHBondContact O-CB 3.24Å; E250-S254 PolarHBondContact O-N 2.82Å; E250-S254 PolarHBondContact O-OG 3.15Å
255	R	37.6	Very low	53.7	Low	240 Å²	240	102.9 Å²	102.9	91%	0.906	58%	0.576	S	S	*	*			trans	-112	70.2	165.3	-80.6	-166.3	169.7	-163.6	-2.2	113.4	E253	E253-R255 PolarHBondContact O-N 3Å
256	G	42.4	Very low	53.5	Low	86 Å²	86	103.1 Å²	103.1	89%	0.887	58%	0.582	S	S	*	*	S	Bend	trans	-154.3	8.8	178.9	0	0	0	0	0	116.8
257	G	32.5	Very low	53.6	Low	74 Å²	74	102 Å²	102	76%	0.763	58%	0.578	S	S	*	*			trans	-162.1	163.2	-177.4	0	0	0	0	0	113.2
258	R	39.9	Very low	54.3	Low	263 Å²	263	99.9 Å²	99.9	99%	0.992	57%	0.569	S	S	*	*			trans	-97.6	138.3	176.2	-74.2	-176.8	171.6	-165.7	-2.4	111
259	G	46	Very low	55.3	Low	82 Å²	82	99.7 Å²	99.7	85%	0.845	57%	0.567	S	S	*	*			trans	112.8	59.6	147.7	0	0	0	0	0	118.2
260	S	35.8	Very low	56.4	Low	126 Å²	126	99.1 Å²	99.1	88%	0.881	57%	0.57	S	S	*	*			trans	-153.4	154.4	147.9	-163.5	0	0	0	0	109.3
261	S	46.7	Very low	57.5	Low	114 Å²	114	98.9 Å²	98.9	80%	0.797	57%	0.567	S	S	*	*			trans	-112.4	116.8	178	52.8	0	0	0	0	110.5
262	G	58	Low	58.7	Low	34 Å²	34	95.2 Å²	95.2	35%	0.351	55%	0.545	S	S	.	.	P	Polyproline II helix	trans	-78.3	169.2	157.8	0	0	0	0	0	110.8	E247	E247-G262 WeakPolarHBondContact OE2-CA 3.33Å
263	M	59.8	Low	60.2	Low	40 Å²	40	88.6 Å²	88.6	20%	0.197	52%	0.522	C	S	.	.	P	Polyproline II helix	trans	-59.5	139.5	-179.5	-67.1	-172.3	-141.4	0	0	111.9	T243 E247 E267 V268 K271	T243-M263 HydrophobicContact CG2-CE 3.52Å; E247-M263 PolarHBondContact OE2-N 3.29Å; M263-E267 HydrophobicContact CB-CB 4.37Å; M263-V268 HydrophobicContact CB-CG2 4.13Å; M263-V268 HydrophobicContact SD-CG2 4.47Å; M263-K271 VanDerWaalsContact CE-NZ 3.27Å; M263-K271 HydrophobicContact SD-CD 4.1Å; M263-K271 PolarHBondContact SD-NZ 2.89Å
264	T	70.9	Confident	61.8	Low	67 Å²	67	88.8 Å²	88.8	41%	0.411	53%	0.533	S	S	.	.	P	Polyproline II helix	trans	-80.8	161.1	170	62.7	0	0	0	0	110.9	D266 E267 V268	T264-D266 PolarHBondContact O-N 2.96Å; T264-E267 PolarHBondContact O-N 3.43Å; T264-E267 WeakPolarHBondContact OG1-CG 3.42Å; T264-E267 PolarHBondContact OG1-N 3.18Å; T264-V268 PolarHBondContact O-N 2.89Å
265	E	71.4	Confident	63.6	Low	67 Å²	67	87 Å²	87	31%	0.313	52%	0.517	S	S	.	.	H	α-helix	trans	-60.2	-33.7	175.5	-64.9	-175.1	-158.2	0	0	111.5	Y244 V268 F269	Y244-E265 HydrophobicContact CE2-CG 4.46Å; Y244-E265 WeakPolarHBondContact OH-CG 3.44Å; Y244-E265 PolarHBondContact OH-OE1 2.9Å; E265-V268 PolarHBondContact O-N 3.25Å; E265-F269 WeakPolarHBondContact O-CB 3.21Å; E265-F269 PolarHBondContact O-N 2.77Å
266	D	68.1	Low	65.9	Low	126 Å²	126	75.6 Å²	75.6	67%	0.674	47%	0.474	S	S	*	.	H	α-helix	trans	-64.7	-37.6	172.4	-65.1	-47.8	0	0	0	113.2	T264 S270	T264-D266 PolarHBondContact O-N 2.96Å; D266-S270 WeakPolarHBondContact O-CB 3.28Å; D266-S270 PolarHBondContact O-N 2.85Å; D266-S270 PolarHBondContact O-OG 3Å
267	E	77.3	Confident	67.3	Low	97 Å²	97	80 Å²	80	45%	0.453	47%	0.469	S	S	.	.	H	α-helix	trans	-70.4	-39.3	176.6	-78.9	176.9	-165.8	0	0	111.9	M263 T264 S270 K271	M263-E267 HydrophobicContact CB-CB 4.37Å; T264-E267 PolarHBondContact O-N 3.43Å; T264-E267 WeakPolarHBondContact OG1-CG 3.42Å; T264-E267 PolarHBondContact OG1-N 3.18Å; E267-S270 PolarHBondContact O-N 3.07Å; E267-K271 WeakPolarHBondContact O-CB 3.49Å; E267-K271 WeakPolarHBondContact O-CG 3.32Å; E267-K271 PolarHBondContact O-N 3.19Å
268	V	80.9	Confident	69.1	Low	2 Å²	2	79.6 Å²	79.6	1%	0.012	46%	0.464	C	S	.	.	H	α-helix	trans	-63.6	-49	174	176	0	0	0	0	110.1	I240 Y244 M263 T264 E265 S270 K271 V272 F286	I240-V268 HydrophobicContact CG2-CG1 4.09Å; Y244-V268 HydrophobicContact CD1-CG1 4.47Å; Y244-V268 HydrophobicContact CD1-CG2 4.4Å; Y244-V268 HydrophobicContact CD2-CG2 3.59Å; Y244-V268 HydrophobicContact CE2-CG2 4.23Å; Y244-V268 HydrophobicContact CG-CG1 4.44Å; Y244-V268 HydrophobicContact CG-CG2 3.69Å; M263-V268 HydrophobicContact CB-CG2 4.13Å; M263-V268 HydrophobicContact SD-CG2 4.47Å; T264-V268 PolarHBondContact O-N 2.89Å; E265-V268 PolarHBondContact O-N 3.25Å; V268-S270 VanDerWaalsContact C-N 3.32Å; V268-S270 PolarHBondContact O-N 2.87Å; V268-K271 PolarHBondContact O-N 2.95Å; V268-V272 WeakPolarHBondContact O-CG2 3.42Å; V268-V272 PolarHBondContact O-N 3.4Å; V268-F286 HydrophobicContact CG1-CE1 4.5Å; V268-F286 HydrophobicContact CG1-CZ 4.31Å
269	F	81	Confident	70.7	Confident	78 Å²	78	70 Å²	70	34%	0.342	43%	0.431	S	S	.	.	H	α-helix	trans	-59.5	-42.5	175.6	-172.6	-94.3	0	0	0	111.7	E265 K271 V272 A273 F286 L290	E265-F269 WeakPolarHBondContact O-CB 3.21Å; E265-F269 PolarHBondContact O-N 2.77Å; F269-K271 PolarHBondContact O-N 3.38Å; F269-V272 PolarHBondContact O-N 3.21Å; F269-A273 VanDerWaalsContact O-CB 3.22Å; F269-A273 WeakPolarHBondContact O-CB 3.32Å; F269-A273 PolarHBondContact O-N 2.89Å; F269-F286 AromaticContact CD2-CD1 3.96Å; F269-F286 HydrophobicContact CD2-CD1 3.96Å; F269-F286 HydrophobicContact CD2-CE1 4.42Å; F269-F286 HydrophobicContact CE2-CD1 4.39Å; F269-L290 HydrophobicContact CB-CD1 4.47Å; F269-L290 HydrophobicContact CD2-CD1 3.99Å
270	S	78.9	Confident	71.9	Confident	74 Å²	74	73.9 Å²	73.9	52%	0.517	43%	0.427	S	S	.	.	H	α-helix	trans	-63.9	-38.8	177.5	-62.8	0	0	0	0	113	D266 E267 V268 A273 S274	D266-S270 WeakPolarHBondContact O-CB 3.28Å; D266-S270 PolarHBondContact O-N 2.85Å; D266-S270 PolarHBondContact O-OG 3Å; E267-S270 PolarHBondContact O-N 3.07Å; V268-S270 VanDerWaalsContact C-N 3.32Å; V268-S270 PolarHBondContact O-N 2.87Å; S270-A273 PolarHBondContact O-N 3.46Å; S270-S274 PolarHBondContact O-N 3.17Å
271	K	79.3	Confident	74	Confident	93 Å²	93	70.5 Å²	70.5	40%	0.404	40%	0.399	S	S	.	.	H	α-helix	trans	-67.9	-44.2	175.4	-75.1	176.9	-178.8	176.6	0	111.6	I240 M263 E267 V268 F269 A273 S274 L275	I240-K271 HydrophobicContact CD1-CB 3.96Å; I240-K271 HydrophobicContact CG1-CB 4.45Å; I240-K271 HydrophobicContact CG2-CB 4.47Å; M263-K271 VanDerWaalsContact CE-NZ 3.27Å; M263-K271 HydrophobicContact SD-CD 4.1Å; M263-K271 PolarHBondContact SD-NZ 2.89Å; E267-K271 WeakPolarHBondContact O-CB 3.49Å; E267-K271 WeakPolarHBondContact O-CG 3.32Å; E267-K271 PolarHBondContact O-N 3.19Å; V268-K271 PolarHBondContact O-N 2.95Å; F269-K271 PolarHBondContact O-N 3.38Å; K271-A273 VanDerWaalsContact C-N 3.34Å; K271-A273 PolarHBondContact O-N 2.89Å; K271-S274 PolarHBondContact O-N 3.42Å; K271-L275 WeakPolarHBondContact O-CB 3.5Å; K271-L275 PolarHBondContact O-N 2.92Å
272	V	83.5	Confident	75.7	Confident	1 Å²	1	65.1 Å²	65.1	1%	0.006	36%	0.361	C	S	.	.	H	α-helix	trans	-65.8	-36.6	175.5	178.8	0	0	0	0	111.2	F237 I240 V268 F269 S274 L275 F276 L283 F286	F237-V272 HydrophobicContact CD2-CG1 4.35Å; F237-V272 HydrophobicContact CD2-CG2 4.44Å; F237-V272 HydrophobicContact CE2-CG1 4.32Å; I240-V272 HydrophobicContact CG2-CG2 4.07Å; V268-V272 WeakPolarHBondContact O-CG2 3.42Å; V268-V272 PolarHBondContact O-N 3.4Å; F269-V272 PolarHBondContact O-N 3.21Å; V272-S274 PolarHBondContact O-N 3.1Å; V272-L275 WeakPolarHBondContact O-CB 3.49Å; V272-L275 PolarHBondContact O-N 2.92Å; V272-L275 VanDerWaalsContact O-N 3.1Å; V272-F276 HydrophobicContact CG1-CD2 3.58Å; V272-F276 HydrophobicContact CG1-CE2 3.56Å; V272-F276 HydrophobicContact CG1-CG 4.44Å; V272-F276 HydrophobicContact CG1-CZ 4.41Å; V272-F276 PolarHBondContact O-N 2.96Å; V272-L283 HydrophobicContact CG1-CD2 3.9Å; V272-F286 HydrophobicContact CB-CD1 4.32Å; V272-F286 HydrophobicContact CB-CE1 4.13Å; V272-F286 HydrophobicContact CB-CZ 4.46Å; V272-F286 HydrophobicContact CG1-CD1 4.03Å; V272-F286 HydrophobicContact CG1-CD2 4.3Å; V272-F286 HydrophobicContact CG1-CE1 4.22Å; V272-F286 HydrophobicContact CG1-CE2 4.48Å; V272-F286 HydrophobicContact CG1-CG 4.08Å; V272-F286 HydrophobicContact CG1-CZ 4.45Å; V272-F286 HydrophobicContact CG2-CE1 3.99Å; V272-F286 HydrophobicContact CG2-CE2 4.4Å; V272-F286 HydrophobicContact CG2-CZ 3.88Å
273	A	80.5	Confident	76.7	Confident	32 Å²	32	64.7 Å²	64.7	26%	0.264	35%	0.351	S	S	.	.	H	α-helix	trans	-65.8	-35	173.5	0	0	0	0	0	113.5	F269 S270 K271 L275 K277 L283	F269-A273 VanDerWaalsContact O-CB 3.22Å; F269-A273 WeakPolarHBondContact O-CB 3.32Å; F269-A273 PolarHBondContact O-N 2.89Å; S270-A273 PolarHBondContact O-N 3.46Å; K271-A273 VanDerWaalsContact C-N 3.34Å; K271-A273 PolarHBondContact O-N 2.89Å; A273-L275 VanDerWaalsContact C-N 3.31Å; A273-K277 PolarHBondContact O-N 2.99Å; A273-L283 HydrophobicContact CB-CD1 4.21Å; A273-L283 HydrophobicContact CB-CD2 4.14Å
274	S	81.6	Confident	77.3	Confident	90 Å²	90	65.9 Å²	65.9	63%	0.629	37%	0.367	S	S	*	.	H	α-helix	trans	-71.8	-26.3	170.7	-170.8	0	0	0	0	112.8	S270 K271 V272	S270-S274 PolarHBondContact O-N 3.17Å; K271-S274 PolarHBondContact O-N 3.42Å; V272-S274 PolarHBondContact O-N 3.1Å
275	L	83.2	Confident	77.8	Confident	41 Å²	41	65.4 Å²	65.4	22%	0.215	36%	0.36	C	S	.	.	H	α-helix	trans	-81.5	-41.9	-179	-168.2	74.3	0	0	0	112.1	I233 A236 F237 I240 K271 V272 A273 K277	I233-L275 HydrophobicContact CG2-CD1 4.43Å; I233-L275 HydrophobicContact CG2-CD2 4.45Å; I233-L275 HydrophobicContact CG2-CG 4.09Å; A236-L275 HydrophobicContact CB-CD1 3.75Å; A236-L275 HydrophobicContact CB-CD2 4.29Å; F237-L275 HydrophobicContact CB-CD2 3.64Å; I240-L275 HydrophobicContact CD1-CD2 4.22Å; K271-L275 WeakPolarHBondContact O-CB 3.5Å; K271-L275 PolarHBondContact O-N 2.92Å; V272-L275 WeakPolarHBondContact O-CB 3.49Å; V272-L275 PolarHBondContact O-N 2.92Å; V272-L275 VanDerWaalsContact O-N 3.1Å; A273-L275 VanDerWaalsContact C-N 3.31Å; L275-K277 VanDerWaalsContact C-N 3.31Å; L275-K277 PolarHBondContact O-N 3.28Å
276	F	85.3	Confident	78.1	Confident	1 Å²	1	62.8 Å²	62.8	0%	0.004	35%	0.348	C	S	.	.	S	Bend	trans	-95.7	33.3	176.2	-58.7	-25.7	0	0	0	112.3	I223 F227 I233 F237 V272 G278 Q279 L282 L283	I223-F276 HydrophobicContact CD1-CE2 4.08Å; I223-F276 HydrophobicContact CD1-CZ 3.76Å; I223-F276 HydrophobicContact CG1-CE2 4.43Å; I223-F276 HydrophobicContact CG1-CZ 4.02Å; I223-F276 HydrophobicContact CG2-CE1 3.99Å; I223-F276 HydrophobicContact CG2-CZ 3.84Å; F227-F276 HydrophobicContact CD2-CE1 4.37Å; F227-F276 AromaticContact CE2-CD1 3.64Å; F227-F276 HydrophobicContact CE2-CD1 3.64Å; F227-F276 AromaticContact CE2-CE1 3.68Å; F227-F276 HydrophobicContact CE2-CE1 3.68Å; F227-F276 AromaticContact CZ-CD1 3.85Å; F227-F276 HydrophobicContact CZ-CD1 3.85Å; F227-F276 HydrophobicContact CZ-CE1 4.33Å; I233-F276 HydrophobicContact CG2-CD1 4.3Å; I233-F276 HydrophobicContact CG2-CE1 4.14Å; F237-F276 HydrophobicContact CB-CE1 4.46Å; F237-F276 HydrophobicContact CB-CZ 4.23Å; F237-F276 HydrophobicContact CD2-CE1 4.32Å; F237-F276 AromaticContact CD2-CE2 3.87Å; F237-F276 HydrophobicContact CD2-CE2 3.87Å; F237-F276 AromaticContact CD2-CZ 3.39Å; F237-F276 HydrophobicContact CD2-CZ 3.39Å; F237-F276 AromaticContact CE2-CE2 3.93Å; F237-F276 HydrophobicContact CE2-CE2 3.93Å; F237-F276 AromaticContact CE2-CZ 3.83Å; F237-F276 HydrophobicContact CE2-CZ 3.83Å; F237-F276 AromaticContact CG-CZ 3.84Å; F237-F276 HydrophobicContact CG-CZ 3.84Å; V272-F276 HydrophobicContact CG1-CD2 3.58Å; V272-F276 HydrophobicContact CG1-CE2 3.56Å; V272-F276 HydrophobicContact CG1-CG 4.44Å; V272-F276 HydrophobicContact CG1-CZ 4.41Å; V272-F276 PolarHBondContact O-N 2.96Å; F276-G278 PolarHBondContact O-N 3.34Å; F276-Q279 HydrophobicContact CB-CB 4.35Å; F276-Q279 PolarHBondContact O-N 3.09Å; F276-L282 HydrophobicContact CD2-CB 4.04Å; F276-L282 HydrophobicContact CE2-CB 4.44Å; F276-L283 HydrophobicContact CB-CD1 4.28Å; F276-L283 HydrophobicContact CB-CD2 4.11Å; F276-L283 HydrophobicContact CB-CG 4.02Å; F276-L283 HydrophobicContact CD2-CD2 3.98Å; F276-L283 HydrophobicContact CD2-CG 4.39Å
277	K	71.6	Confident	78.2	Confident	179 Å²	179	57.5 Å²	57.5	78%	0.778	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	106.9	-174.7	-174.8	177.6	-179.3	179	0	111.3	A273 L275	A273-K277 PolarHBondContact O-N 2.99Å; L275-K277 VanDerWaalsContact C-N 3.31Å; L275-K277 PolarHBondContact O-N 3.28Å
278	G	71.1	Confident	77.9	Confident	64 Å²	64	58.4 Å²	58.4	66%	0.66	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	102.2	8.5	-173.9	0	0	0	0	0	114.8	F276	F276-G278 PolarHBondContact O-N 3.34Å
279	Q	74.6	Confident	77.3	Confident	61 Å²	61	62.3 Å²	62.3	29%	0.285	34%	0.344	S	S	.	.			trans	-124.6	72.8	174	-61.5	-70.6	-92.4	0	0	109.6	F227 F276 D281 L282 L283	F227-Q279 HydrophobicContact CZ-CG 4.18Å; F276-Q279 HydrophobicContact CB-CB 4.35Å; F276-Q279 PolarHBondContact O-N 3.09Å; Q279-D281 PolarHBondContact O-N 3.33Å; Q279-L282 HydrophobicContact CB-CB 4.41Å; Q279-L282 HydrophobicContact CB-CD1 4.15Å; Q279-L282 HydrophobicContact CB-CG 4.43Å; Q279-L282 PolarHBondContact O-N 3.12Å; Q279-L283 PolarHBondContact O-N 3.25Å
280	E	71.1	Confident	76.5	Confident	165 Å²	165	60 Å²	60	77%	0.771	34%	0.335	S	S	*	.	H	α-helix	trans	-65.1	-25.1	-176.7	-61.4	-173.9	159.8	0	0	112.9	L283 A284	E280-L283 PolarHBondContact O-N 2.8Å; E280-A284 WeakPolarHBondContact O-CB 3.29Å; E280-A284 PolarHBondContact O-N 2.82Å
281	D	79.9	Confident	75.2	Confident	55 Å²	55	60.5 Å²	60.5	29%	0.294	34%	0.337	S	S	.	.	H	α-helix	trans	-64.5	-46.9	175.4	63.8	-27.7	0	0	0	112	R226 Q279 L283 A284 E285	R226-D281 IonicContact CZ-OD2 3.17Å; R226-D281 VanDerWaalsContact CZ-OD2 3.26Å; R226-D281 IonicContact NH1-OD1 3.99Å; R226-D281 PolarHBondContact NH1-OD1 2.87Å; R226-D281 VanDerWaalsContact NH1-OD1 3.14Å; R226-D281 IonicContact NH1-OD2 2.7Å; R226-D281 PolarHBondContact NH1-OD2 2.81Å; R226-D281 IonicContact NH2-OD2 2.78Å; R226-D281 PolarHBondContact NH2-OD2 3.03Å; Q279-D281 PolarHBondContact O-N 3.33Å; D281-L283 VanDerWaalsContact C-N 3.26Å; D281-L283 PolarHBondContact O-N 2.96Å; D281-A284 PolarHBondContact O-N 3.48Å; D281-E285 PolarHBondContact O-N 2.89Å
282	L	82.1	Confident	73.4	Confident	0 Å²	0	61 Å²	61	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-65.6	-29.2	176.2	-66.9	177.8	0	0	0	112.5	Y219 K222 I223 R226 F227 F276 Q279 F286	Y219-L282 HydrophobicContact CE2-CD2 4.1Å; Y219-L282 WeakPolarHBondContact CE2-O 3.33Å; Y219-L282 PolarHBondContact OH-O 2.77Å; K222-L282 HydrophobicContact CD-CD2 4.17Å; K222-L282 HydrophobicContact CG-CD2 4.12Å; I223-L282 HydrophobicContact CG1-CD1 4.42Å; I223-L282 HydrophobicContact CG1-CD2 4.1Å; R226-L282 HydrophobicContact CB-CD1 4.44Å; R226-L282 HydrophobicContact CG-CD1 4.47Å; F227-L282 HydrophobicContact CE2-CD1 3.7Å; F227-L282 HydrophobicContact CZ-CD1 4.23Å; F276-L282 HydrophobicContact CD2-CB 4.04Å; F276-L282 HydrophobicContact CE2-CB 4.44Å; Q279-L282 HydrophobicContact CB-CB 4.41Å; Q279-L282 HydrophobicContact CB-CD1 4.15Å; Q279-L282 HydrophobicContact CB-CG 4.43Å; Q279-L282 PolarHBondContact O-N 3.12Å; L282-F286 WeakPolarHBondContact O-CB 3.19Å; L282-F286 PolarHBondContact O-N 2.85Å
283	L	78.2	Confident	71.4	Confident	25 Å²	25	62.8 Å²	62.8	13%	0.131	36%	0.359	C	S	.	.	H	α-helix	trans	-79.5	-37.7	177.5	-69	168.3	0	0	0	112.9	V272 A273 F276 Q279 E280 D281 E285 F286 G287	V272-L283 HydrophobicContact CG1-CD2 3.9Å; A273-L283 HydrophobicContact CB-CD1 4.21Å; A273-L283 HydrophobicContact CB-CD2 4.14Å; F276-L283 HydrophobicContact CB-CD1 4.28Å; F276-L283 HydrophobicContact CB-CD2 4.11Å; F276-L283 HydrophobicContact CB-CG 4.02Å; F276-L283 HydrophobicContact CD2-CD2 3.98Å; F276-L283 HydrophobicContact CD2-CG 4.39Å; Q279-L283 PolarHBondContact O-N 3.25Å; E280-L283 PolarHBondContact O-N 2.8Å; D281-L283 VanDerWaalsContact C-N 3.26Å; D281-L283 PolarHBondContact O-N 2.96Å; L283-E285 VanDerWaalsContact C-N 3.28Å; L283-E285 PolarHBondContact O-N 3.22Å; L283-F286 PolarHBondContact O-N 2.97Å; L283-G287 PolarHBondContact O-N 3.05Å
284	A	72.8	Confident	69.3	Low	66 Å²	66	67.8 Å²	67.8	55%	0.545	37%	0.374	S	S	.	.	H	α-helix	trans	-65.7	-31.3	172.3	0	0	0	0	0	112.3	E280 D281 Q288	E280-A284 WeakPolarHBondContact O-CB 3.29Å; E280-A284 PolarHBondContact O-N 2.82Å; D281-A284 PolarHBondContact O-N 3.48Å; A284-Q288 PolarHBondContact O-NE2 2.74Å; A284-Q288 VanDerWaalsContact O-NE2 3.16Å
285	E	80.7	Confident	67.1	Low	57 Å²	57	73.5 Å²	73.5	27%	0.266	38%	0.382	S	S	.	.	H	α-helix	trans	-75.8	-41.1	170.3	-76.2	167.3	-154.5	0	0	112.1	Y219 K222 D281 L283 G287 Q288 F289	Y219-E285 HydrophobicContact CD2-CB 3.69Å; Y219-E285 HydrophobicContact CE2-CB 3.48Å; Y219-E285 VanDerWaalsContact CE2-CB 3.48Å; K222-E285 IonicContact NZ-OE1 3.73Å; K222-E285 PolarHBondContact NZ-OE1 3.19Å; K222-E285 IonicContact NZ-OE2 2.8Å; K222-E285 PolarHBondContact NZ-OE2 3.43Å; D281-E285 PolarHBondContact O-N 2.89Å; L283-E285 VanDerWaalsContact C-N 3.28Å; L283-E285 PolarHBondContact O-N 3.22Å; E285-G287 VanDerWaalsContact C-N 3.27Å; E285-G287 PolarHBondContact O-N 3.46Å; E285-Q288 WeakPolarHBondContact O-CB 3.39Å; E285-Q288 PolarHBondContact O-N 3.4Å; E285-Q288 VanDerWaalsContact O-N 3.12Å; E285-F289 VanDerWaalsContact O-CD2 3.24Å; E285-F289 WeakPolarHBondContact O-CD2 3.24Å; E285-F289 WeakPolarHBondContact O-CE2 3.24Å
286	F	79.1	Confident	64.5	Low	12 Å²	12	76.2 Å²	76.2	5%	0.053	41%	0.405	C	S	.	.	H	α-helix	trans	-54.6	-44.3	174.8	-168.8	-112.6	0	0	0	112.1	Y219 F237 V268 F269 V272 L282 L283 Q288 F289	Y219-F286 HydrophobicContact CE1-CD2 4.14Å; Y219-F286 WeakPolarHBondContact OH-CB 3.31Å; F237-F286 HydrophobicContact CE2-CD2 4.04Å; F237-F286 AromaticContact CE2-CE2 3.85Å; F237-F286 HydrophobicContact CE2-CE2 3.85Å; F237-F286 HydrophobicContact CZ-CD2 4.44Å; F237-F286 HydrophobicContact CZ-CE2 4.27Å; V268-F286 HydrophobicContact CG1-CE1 4.5Å; V268-F286 HydrophobicContact CG1-CZ 4.31Å; F269-F286 AromaticContact CD2-CD1 3.96Å; F269-F286 HydrophobicContact CD2-CD1 3.96Å; F269-F286 HydrophobicContact CD2-CE1 4.42Å; F269-F286 HydrophobicContact CE2-CD1 4.39Å; V272-F286 HydrophobicContact CB-CD1 4.32Å; V272-F286 HydrophobicContact CB-CE1 4.13Å; V272-F286 HydrophobicContact CB-CZ 4.46Å; V272-F286 HydrophobicContact CG1-CD1 4.03Å; V272-F286 HydrophobicContact CG1-CD2 4.3Å; V272-F286 HydrophobicContact CG1-CE1 4.22Å; V272-F286 HydrophobicContact CG1-CE2 4.48Å; V272-F286 HydrophobicContact CG1-CG 4.08Å; V272-F286 HydrophobicContact CG1-CZ 4.45Å; V272-F286 HydrophobicContact CG2-CE1 3.99Å; V272-F286 HydrophobicContact CG2-CE2 4.4Å; V272-F286 HydrophobicContact CG2-CZ 3.88Å; L282-F286 WeakPolarHBondContact O-CB 3.19Å; L282-F286 PolarHBondContact O-N 2.85Å; L283-F286 PolarHBondContact O-N 2.97Å; F286-Q288 PolarHBondContact O-N 2.7Å; F286-F289 PolarHBondContact O-N 3.06Å; F286-F289 VanDerWaalsContact O-N 3.13Å
287	G	68.8	Low	61.8	Low	14 Å²	14	83.6 Å²	83.6	14%	0.144	44%	0.443	C	S	.	.	H	α-helix	trans	-55.4	-35.4	179.7	0	0	0	0	0	113.4	L283 E285 F289 L290 A293	L283-G287 PolarHBondContact O-N 3.05Å; E285-G287 VanDerWaalsContact C-N 3.27Å; E285-G287 PolarHBondContact O-N 3.46Å; G287-F289 PolarHBondContact O-N 3.34Å; G287-F289 VanDerWaalsContact O-N 3.15Å; G287-L290 WeakPolarHBondContact O-CB 3.21Å; G287-L290 PolarHBondContact O-N 2.83Å; G287-A293 WeakPolarHBondContact O-CB 3.46Å
288	Q	71.7	Confident	59.7	Low	116 Å²	116	84.1 Å²	84.1	54%	0.542	45%	0.446	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-18.4	-177.3	-64.8	171	53.3	0	0	113.8	A284 E285 F286 K294	A284-Q288 PolarHBondContact O-NE2 2.74Å; A284-Q288 VanDerWaalsContact O-NE2 3.16Å; E285-Q288 WeakPolarHBondContact O-CB 3.39Å; E285-Q288 PolarHBondContact O-N 3.4Å; E285-Q288 VanDerWaalsContact O-N 3.12Å; F286-Q288 PolarHBondContact O-N 2.7Å; Q288-K294 WeakPolarHBondContact O-CE 3.31Å
289	F	68.4	Low	57.5	Low	84 Å²	84	86.4 Å²	86.4	37%	0.368	45%	0.447	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.1	-9.6	175.2	-58.1	-77.5	0	0	0	113.2	A216 Y219 E285 F286 G287	A216-F289 HydrophobicContact CB-CE1 3.96Å; Y219-F289 HydrophobicContact CD1-CD2 4.35Å; Y219-F289 AromaticContact CD1-CE2 3.71Å; Y219-F289 HydrophobicContact CD1-CE2 3.71Å; Y219-F289 HydrophobicContact CD1-CZ 4.34Å; Y219-F289 HydrophobicContact CD2-CE2 4.27Å; Y219-F289 HydrophobicContact CE1-CE2 4.24Å; Y219-F289 AromaticContact CG-CE2 3.73Å; Y219-F289 HydrophobicContact CG-CE2 3.73Å; Y219-F289 HydrophobicContact CG-CZ 4.19Å; E285-F289 VanDerWaalsContact O-CD2 3.24Å; E285-F289 WeakPolarHBondContact O-CD2 3.24Å; E285-F289 WeakPolarHBondContact O-CE2 3.24Å; F286-F289 PolarHBondContact O-N 3.06Å; F286-F289 VanDerWaalsContact O-N 3.13Å; G287-F289 PolarHBondContact O-N 3.34Å; G287-F289 VanDerWaalsContact O-N 3.15Å
290	L	64.9	Low	55.1	Low	29 Å²	29	87.5 Å²	87.5	15%	0.152	48%	0.475	C	S	.	.	S	Bend	trans	-82.6	140.8	174.5	-62.7	177.6	0	0	0	111.4	F269 G287 D292 A293	F269-L290 HydrophobicContact CB-CD1 4.47Å; F269-L290 HydrophobicContact CD2-CD1 3.99Å; G287-L290 WeakPolarHBondContact O-CB 3.21Å; G287-L290 PolarHBondContact O-N 2.83Å; L290-D292 PolarHBondContact O-N 3.36Å; L290-A293 PolarHBondContact O-N 2.92Å
291	P	51.4	Low	53	Low	86 Å²	86	85.5 Å²	85.5	56%	0.558	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.3	-42.2	-174.1	-26.7	34.8	0	0	0	114.8
292	D	41.3	Very low	50.4	Low	103 Å²	103	87.6 Å²	87.6	55%	0.551	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81	-15.9	-174.7	-87.4	-22	0	0	0	114.2	L290 K294 R295 S296	L290-D292 PolarHBondContact O-N 3.36Å; D292-K294 VanDerWaalsContact C-N 3.3Å; D292-K294 PolarHBondContact O-N 2.84Å; D292-R295 WeakPolarHBondContact O-CA 3.37Å; D292-R295 VanDerWaalsContact O-CB 3.29Å; D292-R295 WeakPolarHBondContact O-CB 3.44Å; D292-R295 PolarHBondContact O-N 3.34Å; D292-S296 PolarHBondContact O-N 3.34Å
293	A	41.4	Very low	47.7	Very low	39 Å²	39	94.9 Å²	94.9	32%	0.322	54%	0.536	S	S	.	.	G	3₁₀ helix	trans	-64.6	-36.7	172.6	0	0	0	0	0	111.8	G287 L290 R295 S296	G287-A293 WeakPolarHBondContact O-CB 3.46Å; L290-A293 PolarHBondContact O-N 2.92Å; A293-R295 PolarHBondContact O-N 3.47Å; A293-S296 PolarHBondContact O-N 3.3Å; A293-S296 VanDerWaalsContact O-N 3.1Å
294	K	37	Very low	45.1	Very low	136 Å²	136	100 Å²	100	59%	0.591	57%	0.568	S	S	*	*	G	3₁₀ helix	trans	-65.5	-5.5	171.7	-64.9	-175.1	-177.3	176.8	0	113.1	E212 Q288 D292	E212-K294 IonicContact OE1-NZ 2.85Å; E212-K294 PolarHBondContact OE1-NZ 2.99Å; E212-K294 IonicContact OE2-NZ 3.27Å; Q288-K294 WeakPolarHBondContact O-CE 3.31Å; D292-K294 VanDerWaalsContact C-N 3.3Å; D292-K294 PolarHBondContact O-N 2.84Å
295	R	34.3	Very low	42.6	Very low	210 Å²	210	101 Å²	101	79%	0.792	59%	0.585	S	S	*	*	G	3₁₀ helix	trans	-104.9	-17.9	172.7	-113.9	177	178.4	159.7	1.3	114.6	D292 A293	D292-R295 WeakPolarHBondContact O-CA 3.37Å; D292-R295 VanDerWaalsContact O-CB 3.29Å; D292-R295 WeakPolarHBondContact O-CB 3.44Å; D292-R295 PolarHBondContact O-N 3.34Å; A293-R295 PolarHBondContact O-N 3.47Å
296	S	28.7	Very low	39.8	Very low	98 Å²	98	102 Å²	102	69%	0.685	61%	0.611	S	S	*	*	S	Bend	trans	-100.4	19.8	-169.5	-165.4	0	0	0	0	115.4	D292 A293	D292-S296 PolarHBondContact O-N 3.34Å; A293-S296 PolarHBondContact O-N 3.3Å; A293-S296 VanDerWaalsContact O-N 3.1Å
297	L	28.9	Very low	37.2	Very low	157 Å²	157	110.3 Å²	110.3	82%	0.822	65%	0.647	S	S	*	*	S	Bend	trans	-123	43.4	172.1	-75.8	179.8	0	0	0	113.9
298	F	27.7	Very low	34.9	Very low	190 Å²	190	116.7 Å²	116.7	83%	0.833	67%	0.674	S	S	*	*	S	Bend	trans	-160.1	127.3	139	-102.6	-63.7	0	0	0	113.2
299	T	25.2	Very low	32.5	Very low	111 Å²	111	119 Å²	119	68%	0.681	68%	0.684	S	S	*	*			trans	64.3	73.3	166	54.9	0	0	0	0	118.5
300	G	23.2	Very low	30.3	Very low	84 Å²	84	120.2 Å²	120.2	87%	0.866	70%	0.698	S	S	*	*			trans	-81.9	145.4	133.4	0	0	0	0	0	109.8
301	S	26.9	Very low	28.3	Very low	123 Å²	123	127.8 Å²	127.8	86%	0.86	73%	0.73	S	S	*	*			trans	-135.2	159.2	174.7	-165.9	0	0	0	0	111
302	S	26.2	Very low	26.9	Very low	100 Å²	100	131 Å²	131	70%	0.699	74%	0.735	S	S	*	*			trans	-49.7	153.4	-172.3	-174.1	0	0	0	0	115.6
303	L	24.8	Very low	25.9	Very low	153 Å²	153	129.9 Å²	129.9	80%	0.801	74%	0.736	S	S	*	*				-168.6	129.5	121.2	-97.8	176	0	0	0	113.4
304	T	23.3	Very low	25	Very low	131 Å²	131	134.2 Å²	134.2	80%	0.804	75%	0.749	S	S	*	*			trans	51.1	131.6	148.6	54.1	0	0	0	0	122.5
305	G	21.1	Very low	24.4	Very low	87 Å²	87	136.1 Å²	136.1	90%	0.897	76%	0.76	S	S	*	*			trans	171.1	12.3	161.6	0	0	0	0	0	121.4
306	G	21.6	Very low	23.9	Very low	79 Å²	79	134.5 Å²	134.5	81%	0.814	76%	0.762	S	S	*	*			trans	-121.9	148.9	-175.7	0	0	0	0	0	114.5
307	K	23.7	Very low	23.7	Very low	186 Å²	186	135.9 Å²	135.9	81%	0.809	76%	0.761	S	S	*	*			trans	-94.7	142.6	-172.1	-71.5	-174	174.3	-169.3	0	114.9
308	E	20.7	Very low	23.9	Very low	149 Å²	149	133.3 Å²	133.3	70%	0.696	75%	0.754	S	S	*	*			trans	59.9	137.7	136.7	-70.1	-176.7	79.9	0	0	123.5
309	Q	20.8	Very low	23.9	Very low	164 Å²	164	129.8 Å²	129.8	77%	0.766	74%	0.743	S	S	*	*			trans	83.8	112	147.8	-75.2	-169.5	52.7	0	0	123.5
310	V	23.4	Very low	23.9	Very low	110 Å²	110	130 Å²	130	67%	0.667	74%	0.744	S	S	*	*				101.6	114.5	115.3	166.5	0	0	0	0	122.6
311	K	22.2	Very low	24	Very low	187 Å²	187	134.2 Å²	134.2	81%	0.813	74%	0.739	S	S	*	*			trans	85	134.5	142.4	-90.8	173.9	-176.9	175	0	124.7
312	K	21.9	Very low	23.9	Very low	153 Å²	153	137.1 Å²	137.1	67%	0.665	74%	0.739	S	S	*	*			trans	58.3	124	148.3	-81.3	-161.6	139.4	-91.9	0	118.4	E314	K312-E314 IonicContact NZ-OE1 2.71Å; K312-E314 PolarHBondContact NZ-OE1 3.16Å; K312-E314 IonicContact NZ-OE2 3.14Å; K312-E314 PolarHBondContact NZ-OE2 3.47Å
313	S	21.3	Very low	23.7	Very low	81 Å²	81	138.3 Å²	138.3	57%	0.566	74%	0.737	S	S	*	*				78.5	150.1	60.8	83.6	0	0	0	0	113.1
314	E	23	Very low	23.7	Very low	130 Å²	130	139.3 Å²	139.3	61%	0.607	74%	0.735	S	S	*	*			cis	-139	163.9	12.3	-104.7	101.1	-175.1	0	0	111.5	K312	K312-E314 IonicContact NZ-OE1 2.71Å; K312-E314 PolarHBondContact NZ-OE1 3.16Å; K312-E314 IonicContact NZ-OE2 3.14Å; K312-E314 PolarHBondContact NZ-OE2 3.47Å
315	E	24.1	Very low	23.7	Very low	175 Å²	175	143.1 Å²	143.1	82%	0.818	74%	0.74	S	S	*	*			trans	58	158.7	146.1	-69.2	165	159	0	0	120.8
316	E	23.6	Very low	23.8	Very low	177 Å²	177	150.5 Å²	150.5	83%	0.827	74%	0.741	S	S	*	*			cis	-143.8	167.1	0.6	-142.8	-176.1	173.9	0	0	111.6
317	D	23.3	Very low	24.2	Very low	126 Å²	126	152.6 Å²	152.6	67%	0.674	74%	0.741	S	S	*	*			trans	-119.5	144.7	171.1	-175.8	3.4	0	0	0	107	I319	D317-I319 PolarHBondContact OD1-N 3.39Å
318	P	34.1	Very low	24.3	Very low	104 Å²	104	155 Å²	155	68%	0.675	74%	0.744	S	S	*	*				-152.2	127.1	110.9	33.2	-13.3	0	0	0	118.1
319	I	27.9	Very low	24.9	Very low	116 Å²	116	152.9 Å²	152.9	60%	0.595	74%	0.744	S	S	*	*				63.8	126.3	118.1	-55.6	163.5	0	0	0	116.5	D317	D317-I319 PolarHBondContact OD1-N 3.39Å
320	T	24	Very low	25	Very low	115 Å²	115	152.3 Å²	152.3	71%	0.706	75%	0.745	S	S	*	*				-168.8	117.9	82.1	-53.1	0	0	0	0	114.8
321	K	25.3	Very low	25	Very low	173 Å²	173	153.5 Å²	153.5	75%	0.752	75%	0.747	S	S	*	*			trans	37.4	150.8	133.5	-49.9	165.7	-169.2	160.5	0	119.9
322	Q	24.9	Very low	24.9	Very low	184 Å²	184	151.7 Å²	151.7	86%	0.86	74%	0.743	S	S	*	*			cis	-160.4	-173.1	36.3	-147.7	172.8	49.7	0	0	115
323	N	22.4	Very low	25	Very low	124 Å²	124	151.8 Å²	151.8	66%	0.663	75%	0.746	S	S	*	*			trans	-90.5	150	-153.8	-95.4	-62.6	0	0	0	119
324	K	24.9	Very low	25	Very low	174 Å²	174	154.2 Å²	154.2	76%	0.757	75%	0.75	S	S	*	*			trans	57.1	127.2	135.7	-60.6	164.5	-177.1	174.7	0	121.6
325	K	23.9	Very low	25.4	Very low	211 Å²	211	151.3 Å²	151.3	92%	0.917	74%	0.744	S	S	*	*				173.6	158.4	103.3	-91.7	175.4	-172.6	178.2	0	113.7
326	R	23.1	Very low	25.7	Very low	242 Å²	242	146.9 Å²	146.9	91%	0.913	73%	0.73	S	S	*	*			trans	-100.7	167.6	161.4	-95.7	-175.1	178.6	-178	1.5	108.5
327	P	28.9	Very low	26	Very low	124 Å²	124	142.6 Å²	142.6	81%	0.805	71%	0.712	S	S	*	*			cis	-139.4	-164	25.7	41.3	-19.8	0	0	0	116.7
328	R	26.9	Very low	26.1	Very low	235 Å²	235	143.2 Å²	143.2	89%	0.887	72%	0.715	S	S	*	*			trans	-67.3	172.7	167.4	-77.7	-178.1	176.3	176.8	-1.8	112
329	P	33.1	Very low	26.2	Very low	105 Å²	105	147.6 Å²	147.6	68%	0.682	72%	0.724	S	S	*	*			cis	-150.8	-168	29.6	44.9	-23.2	0	0	0	118.9
330	L	22.7	Very low	26.1	Very low	153 Å²	153	150.8 Å²	150.8	80%	0.801	73%	0.733	S	S	*	*			trans	69.6	155.1	162.5	-64.6	171.2	0	0	0	117.1
331	L	23	Very low	26.6	Very low	135 Å²	135	155.5 Å²	155.5	71%	0.707	74%	0.744	S	S	*	*			cis	-165.9	160.3	-21	-175.8	74.7	0	0	0	109.2
332	M	21.5	Very low	26.5	Very low	148 Å²	148	153.4 Å²	153.4	73%	0.729	74%	0.738	S	S	*	*			trans	84.7	151.5	160.6	-82.1	-50.9	105.9	0	0	123.3
333	H	23	Very low	27.1	Very low	155 Å²	155	154.2 Å²	154.2	72%	0.718	74%	0.739	S	S	*	*			trans	-29	161.9	166	-84.5	1.8	0	0	0	119.8
334	M	22	Very low	27.2	Very low	132 Å²	132	157.2 Å²	157.2	65%	0.65	74%	0.742	S	S	*	*			cis	-151.9	175.9	0.8	-124.9	-70.8	100.2	0	0	111.8
335	S	30.1	Very low	27.3	Very low	69 Å²	69	154.4 Å²	154.4	48%	0.483	74%	0.742	S	S	.	*			trans	-61.5	170.8	-177.2	-43.6	0	0	0	0	115.1
336	P	31	Very low	27.2	Very low	82 Å²	82	150.3 Å²	150.3	53%	0.532	74%	0.738	S	S	.	*				-146.3	178.5	86.8	44.5	-25.9	0	0	0	117.1	L187 T188	L187-P336 CarbonylContact O-C 3.58Å; L187-P336 WeakPolarHBondContact O-CA 3.45Å; L187-P336 WeakPolarHBondContact O-CB 3.42Å; T188-P336 CarbonylContact O-C 3.53Å; T188-P336 WeakPolarHBondContact O-CB 3.31Å; T188-P336 WeakPolarHBondContact O-CG 3.5Å; T188-P336 WeakPolarHBondContact OG1-CB 3.38Å
337	L	29.4	Very low	27.5	Very low	87 Å²	87	143 Å²	143	46%	0.455	73%	0.729	S	S	.	*			trans	-52.3	150.7	-167.4	-97.1	178.5	0	0	0	120.3	L187 T188	L187-L337 VanDerWaalsContact C-CG 3.48Å; L187-L337 HydrophobicContact CD2-CD1 4.19Å; L187-L337 PolarHBondContact O-N 3.1Å; T188-L337 VanDerWaalsContact N-CB 3.35Å; T188-L337 WeakPolarHBondContact O-CA 3.34Å; T188-L337 PolarHBondContact O-N 3.13Å
338	L	27	Very low	27.5	Very low	139 Å²	139	145.3 Å²	145.3	73%	0.728	73%	0.727	S	S	*	*				-160.6	172	112	-113.2	174.8	0	0	0	114.5
339	K	34.5	Very low	27.6	Very low	197 Å²	197	141.4 Å²	141.4	86%	0.857	72%	0.724	S	S	*	*			trans	-70.6	133.8	-174.4	-60.8	172.5	-178.8	175	0	112.8
340	K	25.6	Very low	27.3	Very low	183 Å²	183	144.9 Å²	144.9	80%	0.796	73%	0.73	S	S	*	*			trans	-154.4	121	154.2	-154.5	167.2	-172.2	173.8	0	112.4	M342	K340-M342 PolarHBondContact O-N 3Å
341	K	34.6	Very low	27.7	Very low	214 Å²	214	142 Å²	142	93%	0.93	72%	0.723	S	S	*	*			trans	-66.2	108.4	159.9	-93.9	-173.6	173.9	-180	0	107.1
342	M	24.3	Very low	28.3	Very low	129 Å²	129	144.3 Å²	144.3	64%	0.635	73%	0.728	S	S	*	*			trans	-100	110.8	172.7	-162	124.5	78.2	0	0	109.3	K340 Y344	K340-M342 PolarHBondContact O-N 3Å; M342-Y344 HydrophobicContact CE-CE2 4.07Å; M342-Y344 HydrophobicContact CG-CD2 4.1Å; M342-Y344 HydrophobicContact CG-CE2 3.76Å; M342-Y344 HydrophobicContact SD-CE2 4.44Å
343	K	37.7	Very low	29.1	Very low	200 Å²	200	141 Å²	141	87%	0.87	72%	0.724	S	S	*	*			trans	-67.6	133	169.5	-61.9	176.7	178.7	-179.1	0	108.4
344	Y	23.8	Very low	29.6	Very low	188 Å²	188	136.1 Å²	136.1	74%	0.737	71%	0.707	S	S	*	*			trans	-131.7	155.2	161	-88.9	-60.1	0	0	0	108.6	M342	M342-Y344 HydrophobicContact CE-CE2 4.07Å; M342-Y344 HydrophobicContact CG-CD2 4.1Å; M342-Y344 HydrophobicContact CG-CE2 3.76Å; M342-Y344 HydrophobicContact SD-CE2 4.44Å
345	P	26.8	Very low	30.4	Very low	114 Å²	114	134.5 Å²	134.5	74%	0.74	70%	0.704	S	S	*	*	P	Polyproline II helix		-103.4	132.7	-129.9	0.3	22	0	0	0	110.8	A347	P345-A347 PolarHBondContact O-N 3.3Å
346	C	23.2	Very low	30.8	Very low	126 Å²	126	134.5 Å²	134.5	85%	0.851	72%	0.716	S	S	*	*	P	Polyproline II helix	trans	-61.2	123.3	159.8	-165.7	0	0	0	0	107.8
347	A	28	Very low	31.2	Very low	87 Å²	87	139 Å²	139	72%	0.719	73%	0.727	S	S	*	*	P	Polyproline II helix	trans	-64.4	139.5	172.6	0	0	0	0	0	108.8	P345	P345-A347 PolarHBondContact O-N 3.3Å
348	K	29.6	Very low	31.8	Very low	174 Å²	174	142.6 Å²	142.6	76%	0.757	74%	0.741	S	S	*	*	P	Polyproline II helix	trans	-61.4	143	-178.2	-71.5	-172.4	173.3	-170.7	0	111.1	Q350	K348-Q350 PolarHBondContact O-N 3.28Å
349	D	28.9	Very low	32.5	Very low	153 Å²	153	138.4 Å²	138.4	82%	0.818	73%	0.731	S	S	*	*	P	Polyproline II helix	trans	-50	133.9	-179.1	-63.7	-84.7	0	0	0	113.8	S351	D349-S351 PolarHBondContact O-N 3.49Å; D349-S351 VanDerWaalsContact O-N 3.16Å
350	Q	26.2	Very low	33.5	Very low	177 Å²	177	133.1 Å²	133.1	83%	0.827	72%	0.716	S	S	*	*			trans	-75.2	103.3	173.5	-130.2	174.1	24.8	0	0	108.7	K348 F352	K348-Q350 PolarHBondContact O-N 3.28Å; Q350-F352 PolarHBondContact O-N 3.43Å
351	S	31.2	Very low	34.6	Very low	92 Å²	92	132 Å²	132	64%	0.643	72%	0.717	S	S	*	*			trans	-57.7	133.9	-174.7	-178.2	0	0	0	0	112.8	D349 A353 S354	D349-S351 PolarHBondContact O-N 3.49Å; D349-S351 VanDerWaalsContact O-N 3.16Å; S351-A353 PolarHBondContact O-N 3.48Å; S351-S354 PolarHBondContact O-N 3.33Å; S351-S354 PolarHBondContact O-OG 3.11Å
352	F	36.4	Very low	35.8	Very low	185 Å²	185	129.7 Å²	129.7	81%	0.811	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-51.4	-17.6	-173.1	-158.6	-104.3	0	0	0	115.3	Q350 S354	Q350-F352 PolarHBondContact O-N 3.43Å; F352-S354 VanDerWaalsContact C-N 3.33Å; F352-S354 PolarHBondContact O-N 2.83Å
353	A	37.6	Very low	37.9	Very low	77 Å²	77	126.6 Å²	126.6	64%	0.636	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.2	-11.4	179.7	0	0	0	0	0	115.4	S351	S351-A353 PolarHBondContact O-N 3.48Å
354	S	33.4	Very low	39.2	Very low	53 Å²	53	124.5 Å²	124.5	37%	0.371	68%	0.678	S	S	.	*	T	Hydrogen-bonded Turn	trans	-84.6	-38.1	178.1	60.9	0	0	0	0	113.4	S351 F352 G356 K357	S351-S354 PolarHBondContact O-N 3.33Å; S351-S354 PolarHBondContact O-OG 3.11Å; F352-S354 VanDerWaalsContact C-N 3.33Å; F352-S354 PolarHBondContact O-N 2.83Å; S354-G356 VanDerWaalsContact C-N 3.35Å; S354-G356 PolarHBondContact O-N 3.36Å; S354-K357 PolarHBondContact O-N 3.04Å
355	V	38.2	Very low	41.5	Very low	98 Å²	98	117.7 Å²	117.7	59%	0.594	66%	0.658	S	S	*	*	G	3₁₀ helix	trans	-66.6	-37.6	-176.9	-175.7	0	0	0	0	111.2	K357 H358	V355-K357 PolarHBondContact O-N 3.12Å; V355-H358 PolarHBondContact O-N 2.85Å; V355-H358 VanDerWaalsContact O-N 3.1Å
356	G	38.5	Very low	44.2	Very low	70 Å²	70	112.2 Å²	112.2	72%	0.722	62%	0.622	S	S	*	*	G	3₁₀ helix	trans	-62	-3.1	177.3	0	0	0	0	0	115.9	S354	S354-G356 VanDerWaalsContact C-N 3.35Å; S354-G356 PolarHBondContact O-N 3.36Å
357	K	39.9	Very low	47	Very low	175 Å²	175	109.3 Å²	109.3	76%	0.761	60%	0.595	S	S	*	*	G	3₁₀ helix	trans	-92.6	-5.9	174.6	-62.9	-170.9	178.5	-176.5	0	114.5	S354 V355	S354-K357 PolarHBondContact O-N 3.04Å; V355-K357 PolarHBondContact O-N 3.12Å
358	H	42.9	Very low	49.3	Very low	163 Å²	163	108.1 Å²	108.1	76%	0.755	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	-121.7	-12.2	-177.3	-61	98.2	0	0	0	114.3	V355 V360	V355-H358 PolarHBondContact O-N 2.85Å; V355-H358 VanDerWaalsContact O-N 3.1Å; H358-V360 PolarHBondContact O-N 3.28Å
359	G	41.9	Very low	51.8	Low	51 Å²	51	104 Å²	104	53%	0.526	56%	0.559	S	S	.	*			trans	-68.6	125.3	-177.5	0	0	0	0	0	113.3	E363	G359-E363 VanDerWaalsContact CA-OE2 3.32Å; G359-E363 WeakPolarHBondContact CA-OE2 3.47Å
360	V	55.8	Low	54.4	Low	87 Å²	87	96.7 Å²	96.7	53%	0.527	52%	0.52	S	S	.	.			trans	-71.9	146.4	172.7	-176.6	0	0	0	0	109.1	H358 R362 E363 F364	H358-V360 PolarHBondContact O-N 3.28Å; V360-R362 HydrophobicContact CG1-CB 4.33Å; V360-R362 PolarHBondContact O-N 3.4Å; V360-E363 PolarHBondContact N-OE2 3.44Å; V360-E363 WeakPolarHBondContact O-CB 3.41Å; V360-E363 PolarHBondContact O-N 3.16Å; V360-F364 PolarHBondContact O-N 3.1Å
361	L	48.8	Very low	57	Low	159 Å²	159	94.4 Å²	94.4	83%	0.832	50%	0.503	S	S	*	.	H	α-helix	trans	-49.5	-29.6	-178.9	-154.1	81	0	0	0	113.7	S365	L361-S365 PolarHBondContact O-N 3.37Å
362	R	57.9	Low	59.2	Low	166 Å²	166	97.5 Å²	97.5	63%	0.626	50%	0.501	S	S	*	.	H	α-helix	trans	-65	-42.9	176.5	-156.4	-178.8	-160.8	-155	4.9	112.7	V360 S365 F366	V360-R362 HydrophobicContact CG1-CB 4.33Å; V360-R362 PolarHBondContact O-N 3.4Å; R362-S365 PolarHBondContact O-N 3.41Å; R362-S365 PolarHBondContact O-OG 3.31Å; R362-F366 PolarHBondContact O-N 3.27Å; R362-F366 VanDerWaalsContact O-N 3.13Å
363	E	69	Low	61.1	Low	63 Å²	63	92 Å²	92	29%	0.294	48%	0.48	S	S	.	.	H	α-helix	trans	-71.4	-42.9	-177.9	-67.1	151.1	-174.3	0	0	111	G359 V360 S365 F366 F367 F421	G359-E363 VanDerWaalsContact CA-OE2 3.32Å; G359-E363 WeakPolarHBondContact CA-OE2 3.47Å; V360-E363 PolarHBondContact N-OE2 3.44Å; V360-E363 WeakPolarHBondContact O-CB 3.41Å; V360-E363 PolarHBondContact O-N 3.16Å; E363-S365 VanDerWaalsContact C-N 3.27Å; E363-S365 PolarHBondContact O-N 3.13Å; E363-F366 WeakPolarHBondContact O-CA 3.2Å; E363-F366 WeakPolarHBondContact O-CB 3.41Å; E363-F366 PolarHBondContact O-N 3.47Å; E363-F367 WeakPolarHBondContact O-CD2 3.33Å; E363-F367 PolarHBondContact O-N 3.07Å; E363-F421 HydrophobicContact CG-CD1 3.79Å; E363-F421 HydrophobicContact CG-CE1 3.53Å; E363-F421 HydrophobicContact CG-CZ 4.06Å
364	F	64.4	Low	63.2	Low	157 Å²	157	89.6 Å²	89.6	69%	0.689	46%	0.455	S	S	*	.	H	α-helix	trans	-57.3	-42.9	172.7	-169.3	-89.3	0	0	0	111.3	V360 F366 F367 D368	V360-F364 PolarHBondContact O-N 3.1Å; F364-F366 PolarHBondContact O-N 3.25Å; F364-F367 PolarHBondContact O-N 2.9Å; F364-D368 WeakPolarHBondContact O-CB 3.46Å; F364-D368 PolarHBondContact O-N 3.22Å; F364-D368 VanDerWaalsContact O-N 3.12Å
365	S	72.8	Confident	64.9	Low	44 Å²	44	96.2 Å²	96.2	31%	0.308	48%	0.477	S	S	.	.	H	α-helix	trans	-65.9	-23.8	175.5	87	0	0	0	0	114	L361 R362 E363 K369	L361-S365 PolarHBondContact O-N 3.37Å; R362-S365 PolarHBondContact O-N 3.41Å; R362-S365 PolarHBondContact O-OG 3.31Å; E363-S365 VanDerWaalsContact C-N 3.27Å; E363-S365 PolarHBondContact O-N 3.13Å; S365-K369 WeakPolarHBondContact O-CD 3.18Å; S365-K369 WeakPolarHBondContact O-CG 3.23Å; S365-K369 PolarHBondContact O-N 3.04Å
366	F	83.3	Confident	66.7	Low	0 Å²	0	93.9 Å²	93.9	0%	0	47%	0.465	C	S	.	.	H	α-helix	trans	-78.3	-51.7	175.2	164.4	-94	0	0	0	111.1	R362 E363 F364 D368 K369 V370 F383 L408 L414 Q417 F418 F421	R362-F366 PolarHBondContact O-N 3.27Å; R362-F366 VanDerWaalsContact O-N 3.13Å; E363-F366 WeakPolarHBondContact O-CA 3.2Å; E363-F366 WeakPolarHBondContact O-CB 3.41Å; E363-F366 PolarHBondContact O-N 3.47Å; F364-F366 PolarHBondContact O-N 3.25Å; F366-D368 VanDerWaalsContact C-N 3.28Å; F366-D368 PolarHBondContact O-N 2.97Å; F366-K369 WeakPolarHBondContact O-CB 3.41Å; F366-K369 PolarHBondContact O-N 3.32Å; F366-K369 VanDerWaalsContact O-N 3.08Å; F366-V370 HydrophobicContact CD1-CG2 4.4Å; F366-V370 HydrophobicContact CD2-CG2 4.22Å; F366-V370 HydrophobicContact CE1-CG2 3.95Å; F366-V370 HydrophobicContact CE2-CG2 3.74Å; F366-V370 HydrophobicContact CZ-CG2 3.58Å; F366-V370 WeakPolarHBondContact O-CG2 3.33Å; F366-V370 PolarHBondContact O-N 2.94Å; F366-F383 HydrophobicContact CE1-CZ 4.34Å; F366-F383 HydrophobicContact CZ-CZ 4.5Å; F366-L408 HydrophobicContact CZ-CD1 3.95Å; F366-L414 HydrophobicContact CD2-CD2 3.66Å; F366-L414 HydrophobicContact CE2-CB 4.13Å; F366-L414 HydrophobicContact CE2-CD2 3.85Å; F366-L414 WeakPolarHBondContact CE2-O 3.4Å; F366-Q417 HydrophobicContact CD2-CB 4.03Å; F366-Q417 HydrophobicContact CE2-CB 4.23Å; F366-F418 AromaticContact CE1-CD2 3.84Å; F366-F418 HydrophobicContact CE1-CD2 3.84Å; F366-F418 HydrophobicContact CE2-CB 4.19Å; F366-F418 HydrophobicContact CZ-CB 3.8Å; F366-F418 AromaticContact CZ-CD2 3.65Å; F366-F418 HydrophobicContact CZ-CD2 3.65Å; F366-F418 HydrophobicContact CZ-CG 4.15Å; F366-F421 HydrophobicContact CB-CE2 3.73Å; F366-F421 HydrophobicContact CB-CZ 4.09Å; F366-F421 HydrophobicContact CD1-CD2 4.3Å; F366-F421 AromaticContact CD1-CE2 3.9Å; F366-F421 HydrophobicContact CD1-CE2 3.9Å; F366-F421 AromaticContact CD2-CE2 3.89Å; F366-F421 HydrophobicContact CD2-CE2 3.89Å; F366-F421 HydrophobicContact CG-CD2 4.35Å; F366-F421 AromaticContact CG-CE2 3.56Å; F366-F421 HydrophobicContact CG-CE2 3.56Å; F366-F421 HydrophobicContact CG-CZ 4.4Å
367	F	82.4	Confident	68.5	Low	65 Å²	65	94.6 Å²	94.6	29%	0.285	45%	0.449	S	S	.	.	H	α-helix	trans	-60.9	-37.8	-180	-79.7	-75.2	0	0	0	112.3	E363 F364 V370 R371 F383 L384 I387	E363-F367 WeakPolarHBondContact O-CD2 3.33Å; E363-F367 PolarHBondContact O-N 3.07Å; F364-F367 PolarHBondContact O-N 2.9Å; F367-V370 PolarHBondContact O-N 2.9Å; F367-R371 WeakPolarHBondContact O-CB 3.43Å; F367-R371 PolarHBondContact O-N 3.44Å; F367-F383 HydrophobicContact CD1-CE1 4.09Å; F367-F383 AromaticContact CE1-CE1 3.85Å; F367-F383 HydrophobicContact CE1-CE1 3.85Å; F367-F383 HydrophobicContact CE1-CZ 4.23Å; F367-L384 HydrophobicContact CD1-CD2 4.41Å; F367-L384 HydrophobicContact CE1-CD2 4.25Å; F367-I387 HydrophobicContact CE1-CD1 3.72Å; F367-I387 HydrophobicContact CZ-CD1 4.03Å
368	D	77.4	Confident	70.4	Confident	61 Å²	61	93.1 Å²	93.1	33%	0.326	45%	0.446	S	S	.	.	H	α-helix	trans	-65.7	-39	174.2	-178.2	22.8	0	0	0	112.5	F364 F366 R372	F364-D368 WeakPolarHBondContact O-CB 3.46Å; F364-D368 PolarHBondContact O-N 3.22Å; F364-D368 VanDerWaalsContact O-N 3.12Å; F366-D368 VanDerWaalsContact C-N 3.28Å; F366-D368 PolarHBondContact O-N 2.97Å; D368-R372 VanDerWaalsContact CG-NE 3.34Å; D368-R372 VanDerWaalsContact CG-NH2 3.26Å; D368-R372 WeakPolarHBondContact O-CB 3.45Å; D368-R372 WeakPolarHBondContact O-CG 3.43Å; D368-R372 PolarHBondContact O-N 3.04Å; D368-R372 PolarHBondContact O-NE 3Å; D368-R372 IonicContact OD1-CZ 3.46Å; D368-R372 IonicContact OD1-NE 3.43Å; D368-R372 PolarHBondContact OD1-NE 3.4Å; D368-R372 IonicContact OD1-NH2 2.68Å; D368-R372 IonicContact OD2-CZ 2.61Å; D368-R372 IonicContact OD2-NE 3.6Å; D368-R372 PolarHBondContact OD2-NE 3.37Å; D368-R372 IonicContact OD2-NH2 3.63Å; D368-R372 PolarHBondContact OD2-NH2 2.87Å
369	K	81.5	Confident	72.2	Confident	87 Å²	87	87.6 Å²	87.6	38%	0.378	42%	0.423	S	S	.	.	H	α-helix	trans	-62.1	-46.2	170.8	-74.9	169	-172	178.8	0	112	S365 F366 R372 L373 L414	S365-K369 WeakPolarHBondContact O-CD 3.18Å; S365-K369 WeakPolarHBondContact O-CG 3.23Å; S365-K369 PolarHBondContact O-N 3.04Å; F366-K369 WeakPolarHBondContact O-CB 3.41Å; F366-K369 PolarHBondContact O-N 3.32Å; F366-K369 VanDerWaalsContact O-N 3.08Å; K369-R372 PolarHBondContact O-N 3.35Å; K369-L373 WeakPolarHBondContact O-CG 3.42Å; K369-L373 PolarHBondContact O-N 3.06Å; K369-L414 HydrophobicContact CB-CD2 4.3Å; K369-L414 HydrophobicContact CD-CD2 4.2Å
370	V	82	Confident	74.3	Confident	0 Å²	0	86.3 Å²	86.3	0%	0	40%	0.403	C	S	.	.	H	α-helix	trans	-62	-45.8	179.2	174.9	0	0	0	0	110.7	F366 F367 R372 L373 F374 Y380 F383 L408 L414	F366-V370 HydrophobicContact CD1-CG2 4.4Å; F366-V370 HydrophobicContact CD2-CG2 4.22Å; F366-V370 HydrophobicContact CE1-CG2 3.95Å; F366-V370 HydrophobicContact CE2-CG2 3.74Å; F366-V370 HydrophobicContact CZ-CG2 3.58Å; F366-V370 WeakPolarHBondContact O-CG2 3.33Å; F366-V370 PolarHBondContact O-N 2.94Å; F367-V370 PolarHBondContact O-N 2.9Å; V370-R372 VanDerWaalsContact C-N 3.33Å; V370-R372 PolarHBondContact O-N 2.95Å; V370-L373 PolarHBondContact O-N 3.34Å; V370-L373 VanDerWaalsContact O-N 3.13Å; V370-F374 HydrophobicContact CG1-CD2 3.86Å; V370-F374 HydrophobicContact CG1-CE1 4.09Å; V370-F374 HydrophobicContact CG1-CE2 3.36Å; V370-F374 HydrophobicContact CG1-CG 4.42Å; V370-F374 HydrophobicContact CG1-CZ 3.49Å; V370-F374 VanDerWaalsContact CG1-CZ 3.49Å; V370-F374 PolarHBondContact O-N 3.06Å; V370-F374 VanDerWaalsContact O-N 3.12Å; V370-Y380 HydrophobicContact CG1-CD2 4.28Å; V370-Y380 HydrophobicContact CG1-CE2 4.23Å; V370-F383 HydrophobicContact CG1-CD1 4.02Å; V370-F383 HydrophobicContact CG1-CE1 3.7Å; V370-F383 HydrophobicContact CG1-CZ 4.08Å; V370-L408 HydrophobicContact CG1-CD2 4.13Å; V370-L408 HydrophobicContact CG2-CD2 3.95Å; V370-L414 HydrophobicContact CG2-CD1 4.38Å
371	R	81	Confident	75.6	Confident	129 Å²	129	85.9 Å²	85.9	49%	0.487	40%	0.395	S	S	.	.	H	α-helix	trans	-58.3	-43.5	175.9	-166.7	177.1	-174.7	178	4.7	112.3	F367 L373 Y380	F367-R371 WeakPolarHBondContact O-CB 3.43Å; F367-R371 PolarHBondContact O-N 3.44Å; R371-L373 VanDerWaalsContact C-N 3.3Å; R371-L373 PolarHBondContact O-N 3.14Å; R371-Y380 HydrophobicContact CB-CD2 3.92Å; R371-Y380 HydrophobicContact CB-CE1 4.28Å; R371-Y380 HydrophobicContact CB-CE2 3.54Å; R371-Y380 HydrophobicContact CB-CG 4.45Å; R371-Y380 HydrophobicContact CG-CD1 4.05Å; R371-Y380 HydrophobicContact CG-CD2 4.12Å; R371-Y380 HydrophobicContact CG-CE1 3.94Å; R371-Y380 HydrophobicContact CG-CE2 4.02Å; R371-Y380 HydrophobicContact CG-CG 4.14Å
372	R	77.7	Confident	77.1	Confident	158 Å²	158	81.1 Å²	81.1	60%	0.596	37%	0.37	S	S	*	.	H	α-helix	trans	-70.6	-21.7	178.3	-74.4	-174.2	-87.8	134.3	-14.7	113.9	D368 K369 V370	D368-R372 VanDerWaalsContact CG-NE 3.34Å; D368-R372 VanDerWaalsContact CG-NH2 3.26Å; D368-R372 WeakPolarHBondContact O-CB 3.45Å; D368-R372 WeakPolarHBondContact O-CG 3.43Å; D368-R372 PolarHBondContact O-N 3.04Å; D368-R372 PolarHBondContact O-NE 3Å; D368-R372 IonicContact OD1-CZ 3.46Å; D368-R372 IonicContact OD1-NE 3.43Å; D368-R372 PolarHBondContact OD1-NE 3.4Å; D368-R372 IonicContact OD1-NH2 2.68Å; D368-R372 IonicContact OD2-CZ 2.61Å; D368-R372 IonicContact OD2-NE 3.6Å; D368-R372 PolarHBondContact OD2-NE 3.37Å; D368-R372 IonicContact OD2-NH2 3.63Å; D368-R372 PolarHBondContact OD2-NH2 2.87Å; K369-R372 PolarHBondContact O-N 3.35Å; V370-R372 VanDerWaalsContact C-N 3.33Å; V370-R372 PolarHBondContact O-N 2.95Å
373	L	77.4	Confident	78.5	Confident	70 Å²	70	73.2 Å²	73.2	37%	0.366	34%	0.34	S	S	.	.	H	α-helix	trans	-87.8	-37.2	179.3	-79.1	167.2	0	0	0	114.3	K369 V370 R371 K375 F411 L414	K369-L373 WeakPolarHBondContact O-CG 3.42Å; K369-L373 PolarHBondContact O-N 3.06Å; V370-L373 PolarHBondContact O-N 3.34Å; V370-L373 VanDerWaalsContact O-N 3.13Å; R371-L373 VanDerWaalsContact C-N 3.3Å; R371-L373 PolarHBondContact O-N 3.14Å; L373-K375 VanDerWaalsContact C-N 3.3Å; L373-K375 PolarHBondContact O-N 3.17Å; L373-F411 HydrophobicContact CD1-CD1 4.38Å; L373-F411 HydrophobicContact CD2-CE1 4.06Å; L373-F411 HydrophobicContact CD2-CZ 4.34Å; L373-L414 HydrophobicContact CD1-CD1 3.19Å
374	F	81.5	Confident	79.3	Confident	25 Å²	25	72.2 Å²	72.2	11%	0.11	34%	0.337	C	S	.	.	H	α-helix	trans	-71.6	-22.3	-174.1	-69.7	-10.2	0	0	0	114.3	V370 S376 V379 Y380 F383 F407 L408	V370-F374 HydrophobicContact CG1-CD2 3.86Å; V370-F374 HydrophobicContact CG1-CE1 4.09Å; V370-F374 HydrophobicContact CG1-CE2 3.36Å; V370-F374 HydrophobicContact CG1-CG 4.42Å; V370-F374 HydrophobicContact CG1-CZ 3.49Å; V370-F374 VanDerWaalsContact CG1-CZ 3.49Å; V370-F374 PolarHBondContact O-N 3.06Å; V370-F374 VanDerWaalsContact O-N 3.12Å; F374-S376 PolarHBondContact O-N 3.13Å; F374-V379 HydrophobicContact CB-CB 4.36Å; F374-V379 HydrophobicContact CB-CG1 4.05Å; F374-V379 HydrophobicContact CD2-CG1 3.96Å; F374-V379 HydrophobicContact CG-CG1 3.99Å; F374-Y380 HydrophobicContact CD2-CD2 4.15Å; F374-F383 HydrophobicContact CD2-CB 4.5Å; F374-F383 HydrophobicContact CE2-CB 3.73Å; F374-F383 HydrophobicContact CE2-CD1 4.07Å; F374-F383 HydrophobicContact CE2-CD2 4.25Å; F374-F383 AromaticContact CE2-CG 3.77Å; F374-F383 HydrophobicContact CE2-CG 3.77Å; F374-F383 HydrophobicContact CZ-CG 4.46Å; F374-F407 HydrophobicContact CE1-CB 4.31Å; F374-F407 WeakPolarHBondContact CE1-O 3.42Å; F374-F407 HydrophobicContact CE2-CB 4.21Å; F374-F407 HydrophobicContact CZ-CB 3.66Å; F374-L408 HydrophobicContact CE1-CD2 3.85Å; F374-L408 HydrophobicContact CZ-CD2 3.59Å; F374-L408 HydrophobicContact CZ-CG 4.18Å
375	K	69.6	Low	80.2	Confident	193 Å²	193	71 Å²	71	84%	0.839	33%	0.328	S	S	*	.			trans	60.7	-44.2	176.7	-62.7	178.7	-179.1	-179.4	0	116.3	L373	L373-K375 VanDerWaalsContact C-N 3.3Å; L373-K375 PolarHBondContact O-N 3.17Å
376	S	75.6	Confident	80.7	Confident	48 Å²	48	69.7 Å²	69.7	34%	0.336	32%	0.318	S	S	.	.	S	Bend	trans	-78.4	129.1	166	172	0	0	0	0	110	F374 E378 V379 Y380	F374-S376 PolarHBondContact O-N 3.13Å; S376-E378 VanDerWaalsContact C-N 3.31Å; S376-E378 PolarHBondContact OG-N 3.14Å; S376-V379 PolarHBondContact O-N 3.3Å; S376-Y380 PolarHBondContact O-N 3.06Å
377	Q	75.5	Confident	80.6	Confident	85 Å²	85	70.7 Å²	70.7	40%	0.397	32%	0.323	S	S	.	.	H	α-helix	trans	-65	-36.3	174.1	-174.1	70.5	35.2	0	0	110.7	V379 Y380 E381	Q377-V379 VanDerWaalsContact C-N 3.32Å; Q377-V379 PolarHBondContact O-N 3.01Å; Q377-Y380 CarbonylContact O-C 3.58Å; Q377-Y380 WeakPolarHBondContact O-CA 3.21Å; Q377-Y380 WeakPolarHBondContact O-CB 3.44Å; Q377-Y380 PolarHBondContact O-N 3.5Å; Q377-E381 HydrophobicContact CG-CG 4.38Å; Q377-E381 PolarHBondContact NE2-OE1 3.04Å; Q377-E381 WeakPolarHBondContact O-CG 3.24Å; Q377-E381 PolarHBondContact O-N 3.25Å
378	E	79.9	Confident	80.4	Confident	145 Å²	145	69.3 Å²	69.3	68%	0.678	32%	0.324	S	S	*	.	H	α-helix	trans	-61.6	-37.8	179.5	-61.1	-179.2	149.8	0	0	112.8	S376 Y380 E381 N382	S376-E378 VanDerWaalsContact C-N 3.31Å; S376-E378 PolarHBondContact OG-N 3.14Å; E378-Y380 VanDerWaalsContact C-N 3.3Å; E378-Y380 PolarHBondContact O-N 3.46Å; E378-E381 PolarHBondContact O-N 3.13Å; E378-N382 WeakPolarHBondContact O-CB 3.17Å; E378-N382 PolarHBondContact O-N 3.33Å; E378-N382 PolarHBondContact O-ND2 3.45Å
379	V	81.1	Confident	80.5	Confident	47 Å²	47	69.5 Å²	69.5	29%	0.285	33%	0.325	S	S	.	.	H	α-helix	trans	-66.5	-35.9	176	178.7	0	0	0	0	110.6	F374 S376 Q377 F383 F407	F374-V379 HydrophobicContact CB-CB 4.36Å; F374-V379 HydrophobicContact CB-CG1 4.05Å; F374-V379 HydrophobicContact CD2-CG1 3.96Å; F374-V379 HydrophobicContact CG-CG1 3.99Å; S376-V379 PolarHBondContact O-N 3.3Å; Q377-V379 VanDerWaalsContact C-N 3.32Å; Q377-V379 PolarHBondContact O-N 3.01Å; V379-F383 PolarHBondContact O-N 3.5Å; V379-F383 VanDerWaalsContact O-N 3.11Å; V379-F407 HydrophobicContact CG1-CD1 3.71Å; V379-F407 HydrophobicContact CG1-CE1 3.99Å
380	Y	84.9	Confident	80.4	Confident	24 Å²	24	67.3 Å²	67.3	9%	0.094	32%	0.315	C	S	.	.	H	α-helix	trans	-70.9	-40.7	173.3	-172	-105.9	0	0	0	112.4	V370 R371 F374 S376 Q377 E378 N382 F383 L384	V370-Y380 HydrophobicContact CG1-CD2 4.28Å; V370-Y380 HydrophobicContact CG1-CE2 4.23Å; R371-Y380 HydrophobicContact CB-CD2 3.92Å; R371-Y380 HydrophobicContact CB-CE1 4.28Å; R371-Y380 HydrophobicContact CB-CE2 3.54Å; R371-Y380 HydrophobicContact CB-CG 4.45Å; R371-Y380 HydrophobicContact CG-CD1 4.05Å; R371-Y380 HydrophobicContact CG-CD2 4.12Å; R371-Y380 HydrophobicContact CG-CE1 3.94Å; R371-Y380 HydrophobicContact CG-CE2 4.02Å; R371-Y380 HydrophobicContact CG-CG 4.14Å; F374-Y380 HydrophobicContact CD2-CD2 4.15Å; S376-Y380 PolarHBondContact O-N 3.06Å; Q377-Y380 CarbonylContact O-C 3.58Å; Q377-Y380 WeakPolarHBondContact O-CA 3.21Å; Q377-Y380 WeakPolarHBondContact O-CB 3.44Å; Q377-Y380 PolarHBondContact O-N 3.5Å; E378-Y380 VanDerWaalsContact C-N 3.3Å; E378-Y380 PolarHBondContact O-N 3.46Å; Y380-N382 VanDerWaalsContact C-N 3.33Å; Y380-N382 PolarHBondContact O-N 2.96Å; Y380-F383 HydrophobicContact CD2-CD1 4.33Å; Y380-F383 HydrophobicContact CE2-CD1 4.35Å; Y380-F383 PolarHBondContact O-N 3.31Å; Y380-L384 HydrophobicContact CD1-CD1 3.93Å; Y380-L384 HydrophobicContact CD1-CG 4.32Å; Y380-L384 HydrophobicContact CE1-CD1 3.51Å; Y380-L384 HydrophobicContact CE1-CG 4.03Å; Y380-L384 WeakPolarHBondContact O-CG 3.49Å; Y380-L384 PolarHBondContact O-N 3.41Å
381	E	83.3	Confident	80.1	Confident	77 Å²	77	72.6 Å²	72.6	36%	0.36	34%	0.343	S	S	.	.	H	α-helix	trans	-64.7	-34.9	172.5	-63.1	-51.9	147.1	0	0	112.5	Q377 E378 R385	Q377-E381 HydrophobicContact CG-CG 4.38Å; Q377-E381 PolarHBondContact NE2-OE1 3.04Å; Q377-E381 WeakPolarHBondContact O-CG 3.24Å; Q377-E381 PolarHBondContact O-N 3.25Å; E378-E381 PolarHBondContact O-N 3.13Å; E381-R385 WeakPolarHBondContact O-CB 3.5Å; E381-R385 PolarHBondContact O-N 3.3Å; E381-R385 PolarHBondContact O-NE 3.49Å
382	N	82	Confident	79.9	Confident	59 Å²	59	72.6 Å²	72.6	32%	0.316	35%	0.349	S	S	.	.	H	α-helix	trans	-62.4	-49.6	173.3	-73.6	-23.4	0	0	0	110.6	E378 Y380 L384 R385 C386 F407	E378-N382 WeakPolarHBondContact O-CB 3.17Å; E378-N382 PolarHBondContact O-N 3.33Å; E378-N382 PolarHBondContact O-ND2 3.45Å; Y380-N382 VanDerWaalsContact C-N 3.33Å; Y380-N382 PolarHBondContact O-N 2.96Å; N382-L384 PolarHBondContact O-N 3Å; N382-R385 PolarHBondContact O-N 3.39Å; N382-R385 VanDerWaalsContact O-N 3.16Å; N382-R385 PolarHBondContact OD1-NH1 3Å; N382-R385 PolarHBondContact OD1-NH2 3.07Å; N382-C386 PolarHBondContact O-N 3.3Å; N382-C386 PolarHBondContact O-SG 2.93Å; N382-C386 VanDerWaalsContact O-SG 3.36Å; N382-F407 HydrophobicContact CB-CE1 3.97Å; N382-F407 HydrophobicContact CB-CZ 3.85Å
383	F	86.7	Confident	79.8	Confident	0 Å²	0	74 Å²	74	0%	0	36%	0.362	C	S	.	.	H	α-helix	trans	-60.9	-42.5	176.2	165.7	-103.3	0	0	0	112.9	F366 F367 V370 F374 V379 Y380 R385 C386 I387 V404 L408 F418	F366-F383 HydrophobicContact CE1-CZ 4.34Å; F366-F383 HydrophobicContact CZ-CZ 4.5Å; F367-F383 HydrophobicContact CD1-CE1 4.09Å; F367-F383 AromaticContact CE1-CE1 3.85Å; F367-F383 HydrophobicContact CE1-CE1 3.85Å; F367-F383 HydrophobicContact CE1-CZ 4.23Å; V370-F383 HydrophobicContact CG1-CD1 4.02Å; V370-F383 HydrophobicContact CG1-CE1 3.7Å; V370-F383 HydrophobicContact CG1-CZ 4.08Å; F374-F383 HydrophobicContact CD2-CB 4.5Å; F374-F383 HydrophobicContact CE2-CB 3.73Å; F374-F383 HydrophobicContact CE2-CD1 4.07Å; F374-F383 HydrophobicContact CE2-CD2 4.25Å; F374-F383 AromaticContact CE2-CG 3.77Å; F374-F383 HydrophobicContact CE2-CG 3.77Å; F374-F383 HydrophobicContact CZ-CG 4.46Å; V379-F383 PolarHBondContact O-N 3.5Å; V379-F383 VanDerWaalsContact O-N 3.11Å; Y380-F383 HydrophobicContact CD2-CD1 4.33Å; Y380-F383 HydrophobicContact CE2-CD1 4.35Å; Y380-F383 PolarHBondContact O-N 3.31Å; F383-R385 VanDerWaalsContact C-N 3.32Å; F383-R385 PolarHBondContact O-N 3.24Å; F383-C386 WeakPolarHBondContact O-CB 3.44Å; F383-C386 PolarHBondContact O-N 3.33Å; F383-I387 HydrophobicContact CD1-CD1 4.3Å; F383-I387 HydrophobicContact CD2-CD1 4.46Å; F383-I387 HydrophobicContact CE1-CD1 3.73Å; F383-I387 HydrophobicContact CE2-CD1 3.91Å; F383-I387 HydrophobicContact CZ-CD1 3.51Å; F383-I387 PolarHBondContact O-N 3.41Å; F383-V404 HydrophobicContact CD2-CG1 4.09Å; F383-V404 HydrophobicContact CD2-CG2 4.06Å; F383-V404 HydrophobicContact CE2-CG1 3.77Å; F383-V404 HydrophobicContact CE2-CG2 4.11Å; F383-L408 HydrophobicContact CE2-CD1 3.81Å; F383-L408 HydrophobicContact CE2-CG 4.22Å; F383-L408 HydrophobicContact CZ-CD1 4.24Å; F383-F418 HydrophobicContact CE2-CE2 4.19Å; F383-F418 HydrophobicContact CE2-CZ 4.44Å; F383-F418 HydrophobicContact CZ-CD2 4.44Å; F383-F418 HydrophobicContact CZ-CE2 4.17Å
384	L	85	Confident	79.8	Confident	42 Å²	42	75.2 Å²	75.2	22%	0.22	37%	0.372	C	S	.	.	H	α-helix	trans	-64.2	-35.9	173.8	-71.9	-176.5	0	0	0	112.2	F367 Y380 N382 I387 A388	F367-L384 HydrophobicContact CD1-CD2 4.41Å; F367-L384 HydrophobicContact CE1-CD2 4.25Å; Y380-L384 HydrophobicContact CD1-CD1 3.93Å; Y380-L384 HydrophobicContact CD1-CG 4.32Å; Y380-L384 HydrophobicContact CE1-CD1 3.51Å; Y380-L384 HydrophobicContact CE1-CG 4.03Å; Y380-L384 WeakPolarHBondContact O-CG 3.49Å; Y380-L384 PolarHBondContact O-N 3.41Å; N382-L384 PolarHBondContact O-N 3Å; L384-I387 PolarHBondContact O-N 3.16Å; L384-A388 WeakPolarHBondContact O-CB 3.42Å; L384-A388 PolarHBondContact O-N 3.03Å
385	R	83.3	Confident	79.5	Confident	133 Å²	133	75 Å²	75	50%	0.502	37%	0.373	S	S	.	.	H	α-helix	trans	-65.6	-36.4	173.5	-87.2	178.5	-85.6	110.3	0.3	112.8	E381 N382 F383 I387 A388 L389	E381-R385 WeakPolarHBondContact O-CB 3.5Å; E381-R385 PolarHBondContact O-N 3.3Å; E381-R385 PolarHBondContact O-NE 3.49Å; N382-R385 PolarHBondContact O-N 3.39Å; N382-R385 VanDerWaalsContact O-N 3.16Å; N382-R385 PolarHBondContact OD1-NH1 3Å; N382-R385 PolarHBondContact OD1-NH2 3.07Å; F383-R385 VanDerWaalsContact C-N 3.32Å; F383-R385 PolarHBondContact O-N 3.24Å; R385-I387 VanDerWaalsContact C-N 3.34Å; R385-I387 PolarHBondContact O-N 2.74Å; R385-A388 PolarHBondContact O-N 3.41Å; R385-L389 WeakPolarHBondContact O-CG 3.31Å; R385-L389 PolarHBondContact O-N 2.84Å
386	C	82.8	Confident	80	Confident	15 Å²	15	68.2 Å²	68.2	10%	0.101	35%	0.35	C	S	.	.	H	α-helix	trans	-59	-45.6	171.1	-60.6	0	0	0	0	111.6	N382 F383 L389 F390 L400 L403 V404	N382-C386 PolarHBondContact O-N 3.3Å; N382-C386 PolarHBondContact O-SG 2.93Å; N382-C386 VanDerWaalsContact O-SG 3.36Å; F383-C386 WeakPolarHBondContact O-CB 3.44Å; F383-C386 PolarHBondContact O-N 3.33Å; C386-L389 PolarHBondContact O-N 2.88Å; C386-F390 PolarHBondContact O-N 2.9Å; C386-L400 HydrophobicContact CB-CD1 4Å; C386-L400 WeakPolarHBondContact O-CD1 3.17Å; C386-L403 HydrophobicContact CB-CB 4.31Å; C386-V404 HydrophobicContact CB-CG2 4.18Å
387	I	81.8	Confident	80	Confident	21 Å²	21	66.2 Å²	66.2	11%	0.108	34%	0.336	C	S	.	.	H	α-helix	trans	-67.8	-36.6	177.5	-64.7	169	0	0	0	111.5	F367 F383 L384 R385 F390 N391 L400 F418	F367-I387 HydrophobicContact CE1-CD1 3.72Å; F367-I387 HydrophobicContact CZ-CD1 4.03Å; F383-I387 HydrophobicContact CD1-CD1 4.3Å; F383-I387 HydrophobicContact CD2-CD1 4.46Å; F383-I387 HydrophobicContact CE1-CD1 3.73Å; F383-I387 HydrophobicContact CE2-CD1 3.91Å; F383-I387 HydrophobicContact CZ-CD1 3.51Å; F383-I387 PolarHBondContact O-N 3.41Å; L384-I387 PolarHBondContact O-N 3.16Å; R385-I387 VanDerWaalsContact C-N 3.34Å; R385-I387 PolarHBondContact O-N 2.74Å; I387-F390 PolarHBondContact O-N 3.39Å; I387-N391 WeakPolarHBondContact O-CB 3.39Å; I387-N391 VanDerWaalsContact O-CG 3.26Å; I387-N391 PolarHBondContact O-N 2.84Å; I387-L400 HydrophobicContact CG1-CD1 4.22Å; I387-F418 HydrophobicContact CD1-CE2 3.79Å; I387-F418 HydrophobicContact CD1-CZ 4.15Å; I387-F418 HydrophobicContact CG1-CE2 4.19Å; I387-F418 HydrophobicContact CG1-CZ 4.06Å
388	A	77.9	Confident	79.9	Confident	37 Å²	37	63.9 Å²	63.9	31%	0.306	33%	0.332	S	S	.	.	H	α-helix	trans	-64.4	-38.7	176	0	0	0	0	0	112.4	L384 R385 N391 Q392	L384-A388 WeakPolarHBondContact O-CB 3.42Å; L384-A388 PolarHBondContact O-N 3.03Å; R385-A388 PolarHBondContact O-N 3.41Å; A388-N391 PolarHBondContact O-N 3.4Å; A388-Q392 WeakPolarHBondContact O-CB 3.44Å; A388-Q392 WeakPolarHBondContact O-CG 3.2Å; A388-Q392 PolarHBondContact O-N 3.35Å; A388-Q392 VanDerWaalsContact O-N 3.1Å
389	L	80.4	Confident	79.9	Confident	65 Å²	65	61.8 Å²	61.8	34%	0.34	32%	0.322	S	S	.	.	H	α-helix	trans	-64.1	-40.3	174.6	-71.4	166.5	0	0	0	112.1	R385 C386 Q392 E393 V394 V395	R385-L389 WeakPolarHBondContact O-CG 3.31Å; R385-L389 PolarHBondContact O-N 2.84Å; C386-L389 PolarHBondContact O-N 2.88Å; L389-Q392 PolarHBondContact O-N 3.1Å; L389-E393 PolarHBondContact O-N 3.39Å; L389-V394 HydrophobicContact CB-CB 4.46Å; L389-V394 HydrophobicContact CD2-CB 4.19Å; L389-V394 HydrophobicContact CD2-CG1 4.02Å; L389-V394 WeakPolarHBondContact O-CB 3.09Å; L389-V394 PolarHBondContact O-N 2.96Å; L389-V395 HydrophobicContact CB-CB 4.3Å; L389-V395 HydrophobicContact CB-CG2 3.78Å; L389-V395 HydrophobicContact CD1-CG2 4.48Å
390	F	79.7	Confident	80	Confident	41 Å²	41	59.6 Å²	59.6	18%	0.18	31%	0.309	C	S	.	.	H	α-helix	trans	-64.3	-47	172.9	168	-97.5	0	0	0	112.2	C386 I387 Q392 E393 V395 L400 L422 E426	C386-F390 PolarHBondContact O-N 2.9Å; I387-F390 PolarHBondContact O-N 3.39Å; F390-Q392 PolarHBondContact O-N 3.02Å; F390-Q392 VanDerWaalsContact O-N 3.07Å; F390-E393 PolarHBondContact O-N 2.86Å; F390-V395 WeakPolarHBondContact CA-O 3.39Å; F390-V395 WeakPolarHBondContact CD2-O 3.26Å; F390-L400 HydrophobicContact CB-CB 4.24Å; F390-L400 HydrophobicContact CB-CD1 4.17Å; F390-L400 HydrophobicContact CB-CD2 3.71Å; F390-L400 HydrophobicContact CB-CG 4.25Å; F390-L400 HydrophobicContact CD1-CD2 3.79Å; F390-L400 HydrophobicContact CD2-CB 4.23Å; F390-L400 HydrophobicContact CD2-CD2 3.89Å; F390-L400 HydrophobicContact CE1-CD2 4.4Å; F390-L400 HydrophobicContact CE2-CD2 4.49Å; F390-L400 HydrophobicContact CG-CB 4.41Å; F390-L400 HydrophobicContact CG-CD2 3.51Å; F390-L400 HydrophobicContact CG-CG 4.44Å; F390-L422 HydrophobicContact CD1-CD2 4.5Å; F390-L422 HydrophobicContact CE1-CD2 3.88Å; F390-L422 HydrophobicContact CE2-CD2 4.39Å; F390-L422 HydrophobicContact CZ-CD2 3.83Å; F390-E426 VanDerWaalsContact CE2-OE2 3.23Å; F390-E426 WeakPolarHBondContact CE2-OE2 3.43Å; F390-E426 VanDerWaalsContact CZ-OE2 3.27Å; F390-E426 WeakPolarHBondContact CZ-OE2 3.46Å
391	N	75.8	Confident	79.9	Confident	110 Å²	110	59 Å²	59	59%	0.588	31%	0.307	S	S	*	.	H	α-helix	trans	-63.9	-12.8	176.1	-69.7	-11.7	0	0	0	113.8	I387 A388	I387-N391 WeakPolarHBondContact O-CB 3.39Å; I387-N391 VanDerWaalsContact O-CG 3.26Å; I387-N391 PolarHBondContact O-N 2.84Å; A388-N391 PolarHBondContact O-N 3.4Å
392	Q	77.1	Confident	79.7	Confident	129 Å²	129	62.5 Å²	62.5	60%	0.603	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.6	8.5	174.5	-70.5	171.5	17.7	0	0	112.6	A388 L389 F390 V394	A388-Q392 WeakPolarHBondContact O-CB 3.44Å; A388-Q392 WeakPolarHBondContact O-CG 3.2Å; A388-Q392 PolarHBondContact O-N 3.35Å; A388-Q392 VanDerWaalsContact O-N 3.1Å; L389-Q392 PolarHBondContact O-N 3.1Å; F390-Q392 PolarHBondContact O-N 3.02Å; F390-Q392 VanDerWaalsContact O-N 3.07Å; Q392-V394 HydrophobicContact CB-CG2 3.83Å; Q392-V394 PolarHBondContact O-N 3.32Å; Q392-V394 VanDerWaalsContact O-N 3.13Å
393	E	75.3	Confident	79.7	Confident	189 Å²	189	63.3 Å²	63.3	88%	0.883	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.9	16.6	-175.4	-57.4	-179.6	179.9	0	0	114.2	L389 F390 V395	L389-E393 PolarHBondContact O-N 3.39Å; F390-E393 PolarHBondContact O-N 2.86Å; E393-V395 VanDerWaalsContact C-N 3.34Å
394	V	77.4	Confident	79.6	Confident	94 Å²	94	63.3 Å²	63.3	57%	0.57	33%	0.328	S	S	*	.	S	Bend	trans	-79	-21.2	178.7	-175.8	0	0	0	0	111.7	L389 Q392	L389-V394 HydrophobicContact CB-CB 4.46Å; L389-V394 HydrophobicContact CD2-CB 4.19Å; L389-V394 HydrophobicContact CD2-CG1 4.02Å; L389-V394 WeakPolarHBondContact O-CB 3.09Å; L389-V394 PolarHBondContact O-N 2.96Å; Q392-V394 HydrophobicContact CB-CG2 3.83Å; Q392-V394 PolarHBondContact O-N 3.32Å; Q392-V394 VanDerWaalsContact O-N 3.13Å
395	V	75.7	Confident	79.5	Confident	20 Å²	20	64.1 Å²	64.1	12%	0.121	33%	0.334	C	S	.	.	S	Bend	trans	-140.5	130.3	-174.3	172	0	0	0	0	108	L389 F390 E393 E399 L400 L403	L389-V395 HydrophobicContact CB-CB 4.3Å; L389-V395 HydrophobicContact CB-CG2 3.78Å; L389-V395 HydrophobicContact CD1-CG2 4.48Å; F390-V395 WeakPolarHBondContact CA-O 3.39Å; F390-V395 WeakPolarHBondContact CD2-O 3.26Å; E393-V395 VanDerWaalsContact C-N 3.34Å; V395-E399 HydrophobicContact CG1-CB 3.59Å; V395-L400 HydrophobicContact CG1-CB 4.2Å; V395-L403 HydrophobicContact CG1-CD1 3.95Å; V395-L403 HydrophobicContact CG2-CD1 4.22Å
396	S	79.2	Confident	79.4	Confident	52 Å²	52	62.3 Å²	62.3	36%	0.364	34%	0.34	S	S	.	.			trans	-75.1	162.1	177.3	68.9	0	0	0	0	112.8	A398 E399 L400	S396-A398 PolarHBondContact O-N 3.28Å; S396-A398 VanDerWaalsContact O-N 3.12Å; S396-E399 WeakPolarHBondContact CB-OE2 3.5Å; S396-E399 PolarHBondContact N-OE2 3Å; S396-E399 PolarHBondContact O-N 3.03Å; S396-E399 WeakPolarHBondContact OG-CG 3.29Å; S396-E399 PolarHBondContact OG-N 3.39Å; S396-E399 PolarHBondContact OG-OE2 2.87Å; S396-L400 WeakPolarHBondContact O-CB 3.22Å; S396-L400 PolarHBondContact O-N 3.47Å
397	G	74.8	Confident	79.3	Confident	5 Å²	5	63.9 Å²	63.9	5%	0.052	35%	0.345	C	S	.	.	H	α-helix	trans	-58.1	-27.2	178.3	0	0	0	0	0	114.4	L401	G397-L401 WeakPolarHBondContact O-CG 3.43Å; G397-L401 PolarHBondContact O-N 2.82Å
398	A	74.8	Confident	79.3	Confident	36 Å²	36	62.9 Å²	62.9	30%	0.298	34%	0.34	S	S	.	.	H	α-helix	trans	-74.4	-42.1	174.4	0	0	0	0	0	112.4	S396 L401 Q402	S396-A398 PolarHBondContact O-N 3.28Å; S396-A398 VanDerWaalsContact O-N 3.12Å; A398-L401 PolarHBondContact O-N 3.43Å; A398-Q402 PolarHBondContact O-N 3.48Å
399	E	79	Confident	79.1	Confident	101 Å²	101	62.9 Å²	62.9	47%	0.472	34%	0.343	S	S	.	.	H	α-helix	trans	-70.9	-36.4	175.9	-66.9	161.1	126.1	0	0	111.2	V395 S396 L401 Q402 L403	V395-E399 HydrophobicContact CG1-CB 3.59Å; S396-E399 WeakPolarHBondContact CB-OE2 3.5Å; S396-E399 PolarHBondContact N-OE2 3Å; S396-E399 PolarHBondContact O-N 3.03Å; S396-E399 WeakPolarHBondContact OG-CG 3.29Å; S396-E399 PolarHBondContact OG-N 3.39Å; S396-E399 PolarHBondContact OG-OE2 2.87Å; E399-L401 VanDerWaalsContact C-N 3.31Å; E399-L401 PolarHBondContact O-N 3.22Å; E399-Q402 WeakPolarHBondContact O-CB 3.5Å; E399-Q402 PolarHBondContact O-N 2.87Å; E399-Q402 VanDerWaalsContact O-N 3.09Å; E399-L403 WeakPolarHBondContact O-CG 3.3Å; E399-L403 PolarHBondContact O-N 2.82Å
400	L	83.4	Confident	78.8	Confident	1 Å²	1	68.2 Å²	68.2	1%	0.005	36%	0.364	C	S	.	.	H	α-helix	trans	-57.5	-44.1	171.3	174.4	64.5	0	0	0	111	C386 I387 F390 V395 S396 Q402 L403 V404 F418 L422	C386-L400 HydrophobicContact CB-CD1 4Å; C386-L400 WeakPolarHBondContact O-CD1 3.17Å; I387-L400 HydrophobicContact CG1-CD1 4.22Å; F390-L400 HydrophobicContact CB-CB 4.24Å; F390-L400 HydrophobicContact CB-CD1 4.17Å; F390-L400 HydrophobicContact CB-CD2 3.71Å; F390-L400 HydrophobicContact CB-CG 4.25Å; F390-L400 HydrophobicContact CD1-CD2 3.79Å; F390-L400 HydrophobicContact CD2-CB 4.23Å; F390-L400 HydrophobicContact CD2-CD2 3.89Å; F390-L400 HydrophobicContact CE1-CD2 4.4Å; F390-L400 HydrophobicContact CE2-CD2 4.49Å; F390-L400 HydrophobicContact CG-CB 4.41Å; F390-L400 HydrophobicContact CG-CD2 3.51Å; F390-L400 HydrophobicContact CG-CG 4.44Å; V395-L400 HydrophobicContact CG1-CB 4.2Å; S396-L400 WeakPolarHBondContact O-CB 3.22Å; S396-L400 PolarHBondContact O-N 3.47Å; L400-Q402 VanDerWaalsContact C-N 3.32Å; L400-Q402 PolarHBondContact O-N 3.39Å; L400-L403 PolarHBondContact O-N 3.37Å; L400-V404 HydrophobicContact CD1-CG2 3.72Å; L400-V404 HydrophobicContact CG-CG2 4.29Å; L400-V404 VanDerWaalsContact O-CB 3.26Å; L400-V404 WeakPolarHBondContact O-CB 3.48Å; L400-V404 VanDerWaalsContact O-CG2 3.26Å; L400-V404 WeakPolarHBondContact O-CG2 3.12Å; L400-V404 PolarHBondContact O-N 3.11Å; L400-F418 HydrophobicContact CD1-CZ 4.39Å; L400-F418 HydrophobicContact CD2-CE1 4.28Å; L400-F418 HydrophobicContact CD2-CZ 3.94Å; L400-F418 HydrophobicContact CG-CE1 4.19Å; L400-F418 HydrophobicContact CG-CZ 4.13Å; L400-L422 HydrophobicContact CD2-CD1 3.93Å; L400-L422 HydrophobicContact CD2-CD2 3.69Å; L400-L422 HydrophobicContact CD2-CG 4.44Å
401	L	81.8	Confident	78.9	Confident	13 Å²	13	69.7 Å²	69.7	7%	0.068	37%	0.37	C	S	.	.	H	α-helix	trans	-61.7	-38.8	175.1	-78.1	168.8	0	0	0	111.9	G397 A398 E399 V404 T405 Y415 F418 K419 L422 L427	G397-L401 WeakPolarHBondContact O-CG 3.43Å; G397-L401 PolarHBondContact O-N 2.82Å; A398-L401 PolarHBondContact O-N 3.43Å; E399-L401 VanDerWaalsContact C-N 3.31Å; E399-L401 PolarHBondContact O-N 3.22Å; L401-V404 PolarHBondContact O-N 2.87Å; L401-T405 WeakPolarHBondContact O-CB 3.4Å; L401-T405 PolarHBondContact O-N 3.41Å; L401-T405 PolarHBondContact O-OG1 2.96Å; L401-Y415 HydrophobicContact CD2-CE2 4.11Å; L401-F418 HydrophobicContact CD2-CD1 4Å; L401-F418 HydrophobicContact CD2-CE1 4.31Å; L401-K419 HydrophobicContact CD1-CG 4.29Å; L401-K419 HydrophobicContact CD2-CB 4.2Å; L401-K419 HydrophobicContact CD2-CG 4.43Å; L401-L422 HydrophobicContact CD1-CD1 4.35Å; L401-L422 HydrophobicContact CD2-CD1 3.97Å; L401-L422 HydrophobicContact CG-CD1 3.84Å; L401-L427 HydrophobicContact CD1-CD1 4.25Å; L401-L427 HydrophobicContact CD1-CD2 3.86Å; L401-L427 HydrophobicContact CD1-CG 4.26Å
402	Q	79.8	Confident	78.8	Confident	150 Å²	150	69 Å²	69	70%	0.701	37%	0.372	S	S	*	.	H	α-helix	trans	-65	-49	173.2	-67.6	-168.9	3.2	0	0	112	A398 E399 L400 V404 T405 P406	A398-Q402 PolarHBondContact O-N 3.48Å; E399-Q402 WeakPolarHBondContact O-CB 3.5Å; E399-Q402 PolarHBondContact O-N 2.87Å; E399-Q402 VanDerWaalsContact O-N 3.09Å; L400-Q402 VanDerWaalsContact C-N 3.32Å; L400-Q402 PolarHBondContact O-N 3.39Å; Q402-V404 VanDerWaalsContact C-N 3.25Å; Q402-V404 PolarHBondContact O-N 3.04Å; Q402-T405 WeakPolarHBondContact O-CB 3.5Å; Q402-T405 PolarHBondContact O-N 3.47Å; Q402-P406 WeakPolarHBondContact O-CD 3.36Å
403	L	82.6	Confident	78.8	Confident	76 Å²	76	70.3 Å²	70.3	40%	0.398	38%	0.378	S	S	.	.	H	α-helix	trans	-60.7	-33.1	177.5	-68.4	179	0	0	0	112.8	C386 V395 E399 L400 F407	C386-L403 HydrophobicContact CB-CB 4.31Å; V395-L403 HydrophobicContact CG1-CD1 3.95Å; V395-L403 HydrophobicContact CG2-CD1 4.22Å; E399-L403 WeakPolarHBondContact O-CG 3.3Å; E399-L403 PolarHBondContact O-N 2.82Å; L400-L403 PolarHBondContact O-N 3.37Å; L403-F407 VanDerWaalsContact O-CD2 3.25Å; L403-F407 WeakPolarHBondContact O-CD2 3.26Å; L403-F407 VanDerWaalsContact O-CE2 3.27Å; L403-F407 WeakPolarHBondContact O-CE2 3.35Å
404	V	84.6	Confident	79	Confident	0 Å²	0	61.9 Å²	61.9	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-84.6	-20	179.4	171.1	0	0	0	0	112.9	F383 C386 L400 L401 Q402 F407 L408 F418	F383-V404 HydrophobicContact CD2-CG1 4.09Å; F383-V404 HydrophobicContact CD2-CG2 4.06Å; F383-V404 HydrophobicContact CE2-CG1 3.77Å; F383-V404 HydrophobicContact CE2-CG2 4.11Å; C386-V404 HydrophobicContact CB-CG2 4.18Å; L400-V404 HydrophobicContact CD1-CG2 3.72Å; L400-V404 HydrophobicContact CG-CG2 4.29Å; L400-V404 VanDerWaalsContact O-CB 3.26Å; L400-V404 WeakPolarHBondContact O-CB 3.48Å; L400-V404 VanDerWaalsContact O-CG2 3.26Å; L400-V404 WeakPolarHBondContact O-CG2 3.12Å; L400-V404 PolarHBondContact O-N 3.11Å; L401-V404 PolarHBondContact O-N 2.87Å; Q402-V404 VanDerWaalsContact C-N 3.25Å; Q402-V404 PolarHBondContact O-N 3.04Å; V404-F407 PolarHBondContact O-N 3.28Å; V404-L408 HydrophobicContact CG1-CB 4.02Å; V404-L408 HydrophobicContact CG1-CD1 3.59Å; V404-L408 HydrophobicContact CG1-CG 3.81Å; V404-L408 PolarHBondContact O-N 3.02Å; V404-F418 HydrophobicContact CB-CD1 4.42Å; V404-F418 HydrophobicContact CB-CE1 3.86Å; V404-F418 HydrophobicContact CB-CZ 4.45Å; V404-F418 HydrophobicContact CG1-CD1 3.78Å; V404-F418 HydrophobicContact CG1-CE1 3.64Å; V404-F418 HydrophobicContact CG1-CG 4.46Å; V404-F418 HydrophobicContact CG1-CZ 4.2Å; V404-F418 HydrophobicContact CG2-CE1 3.8Å; V404-F418 HydrophobicContact CG2-CZ 3.92Å
405	T	83	Confident	79.2	Confident	58 Å²	58	60.5 Å²	60.5	36%	0.356	32%	0.324	S	S	.	.	H	α-helix	trans	-57.3	-44	-178.9	-70	0	0	0	0	113.8	L401 Q402 F407 G409 Y415	L401-T405 WeakPolarHBondContact O-CB 3.4Å; L401-T405 PolarHBondContact O-N 3.41Å; L401-T405 PolarHBondContact O-OG1 2.96Å; Q402-T405 WeakPolarHBondContact O-CB 3.5Å; Q402-T405 PolarHBondContact O-N 3.47Å; T405-F407 PolarHBondContact O-N 2.96Å; T405-G409 VanDerWaalsContact O-CA 3.26Å; T405-G409 WeakPolarHBondContact O-CA 3.44Å; T405-G409 PolarHBondContact O-N 3.16Å; T405-Y415 WeakPolarHBondContact OG1-CE2 3.44Å; T405-Y415 PolarHBondContact OG1-OH 3.03Å; T405-Y415 VanDerWaalsContact OG1-OH 3.12Å
406	P	80.8	Confident	79.4	Confident	96 Å²	96	63.3 Å²	63.3	62%	0.623	34%	0.344	S	S	*	.	H	α-helix	trans	-56.8	-29.9	174	-28.5	35.8	0	0	0	114.6	Q402	Q402-P406 WeakPolarHBondContact O-CD 3.36Å
407	F	80.3	Confident	79.2	Confident	48 Å²	48	63.4 Å²	63.4	21%	0.211	34%	0.339	C	S	.	.	H	α-helix	trans	-89.3	-49	-177.1	-56.7	-81.5	0	0	0	112.6	F374 V379 N382 L403 V404 T405	F374-F407 HydrophobicContact CE1-CB 4.31Å; F374-F407 WeakPolarHBondContact CE1-O 3.42Å; F374-F407 HydrophobicContact CE2-CB 4.21Å; F374-F407 HydrophobicContact CZ-CB 3.66Å; V379-F407 HydrophobicContact CG1-CD1 3.71Å; V379-F407 HydrophobicContact CG1-CE1 3.99Å; N382-F407 HydrophobicContact CB-CE1 3.97Å; N382-F407 HydrophobicContact CB-CZ 3.85Å; L403-F407 VanDerWaalsContact O-CD2 3.25Å; L403-F407 WeakPolarHBondContact O-CD2 3.26Å; L403-F407 VanDerWaalsContact O-CE2 3.27Å; L403-F407 WeakPolarHBondContact O-CE2 3.35Å; V404-F407 PolarHBondContact O-N 3.28Å; T405-F407 PolarHBondContact O-N 2.96Å
408	L	82.1	Confident	79.6	Confident	0 Å²	0	63.6 Å²	63.6	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-100.1	-15.8	-175	-69.5	-175.2	0	0	0	114.8	F366 V370 F374 F383 V404 K410 F411 L414 Y415 F418	F366-L408 HydrophobicContact CZ-CD1 3.95Å; V370-L408 HydrophobicContact CG1-CD2 4.13Å; V370-L408 HydrophobicContact CG2-CD2 3.95Å; F374-L408 HydrophobicContact CE1-CD2 3.85Å; F374-L408 HydrophobicContact CZ-CD2 3.59Å; F374-L408 HydrophobicContact CZ-CG 4.18Å; F383-L408 HydrophobicContact CE2-CD1 3.81Å; F383-L408 HydrophobicContact CE2-CG 4.22Å; F383-L408 HydrophobicContact CZ-CD1 4.24Å; V404-L408 HydrophobicContact CG1-CB 4.02Å; V404-L408 HydrophobicContact CG1-CD1 3.59Å; V404-L408 HydrophobicContact CG1-CG 3.81Å; V404-L408 PolarHBondContact O-N 3.02Å; L408-K410 PolarHBondContact O-N 3.22Å; L408-K410 VanDerWaalsContact O-N 3.13Å; L408-F411 CarbonylContact O-C 3.59Å; L408-F411 WeakPolarHBondContact O-CA 3.32Å; L408-F411 PolarHBondContact O-N 3.48Å; L408-L414 HydrophobicContact CD2-CB 4.34Å; L408-Y415 HydrophobicContact CB-CD2 4.06Å; L408-F418 HydrophobicContact CD1-CB 3.85Å; L408-F418 HydrophobicContact CD1-CD1 4.38Å; L408-F418 HydrophobicContact CD1-CD2 4.3Å; L408-F418 HydrophobicContact CD1-CG 3.92Å
409	G	72.8	Confident	79.8	Confident	37 Å²	37	66.1 Å²	66.1	38%	0.381	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-24.1	-175.5	0	0	0	0	0	114.5	T405 F411	T405-G409 VanDerWaalsContact O-CA 3.26Å; T405-G409 WeakPolarHBondContact O-CA 3.44Å; T405-G409 PolarHBondContact O-N 3.16Å; G409-F411 PolarHBondContact O-N 3.31Å
410	K	76.1	Confident	79.7	Confident	177 Å²	177	64.9 Å²	64.9	77%	0.77	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.8	-9.3	171.8	-61.7	-176.4	-178.3	-179.9	0	113.7	L408	L408-K410 PolarHBondContact O-N 3.22Å; L408-K410 VanDerWaalsContact O-N 3.13Å
411	F	79.9	Confident	79.5	Confident	72 Å²	72	68 Å²	68	32%	0.316	36%	0.359	S	S	.	.			trans	-126.2	74.7	-177.1	-57.6	-71.5	0	0	0	109.9	L373 L408 G409 E413 L414 Y415	L373-F411 HydrophobicContact CD1-CD1 4.38Å; L373-F411 HydrophobicContact CD2-CE1 4.06Å; L373-F411 HydrophobicContact CD2-CZ 4.34Å; L408-F411 CarbonylContact O-C 3.59Å; L408-F411 WeakPolarHBondContact O-CA 3.32Å; L408-F411 PolarHBondContact O-N 3.48Å; G409-F411 PolarHBondContact O-N 3.31Å; F411-E413 VanDerWaalsContact C-N 3.26Å; F411-E413 PolarHBondContact O-N 3.49Å; F411-E413 VanDerWaalsContact O-N 3.1Å; F411-L414 HydrophobicContact CB-CB 4.22Å; F411-L414 HydrophobicContact CB-CD1 4.32Å; F411-L414 PolarHBondContact O-N 3.06Å; F411-Y415 PolarHBondContact O-N 2.79Å
412	P	74.4	Confident	78.9	Confident	96 Å²	96	68.9 Å²	68.9	62%	0.623	36%	0.364	S	S	*	.	H	α-helix	trans	-57.2	-33	-168	19.7	-32.6	0	0	0	114.4	L414 S416	P412-L414 VanDerWaalsContact C-N 3.35Å; P412-L414 PolarHBondContact O-N 2.78Å; P412-S416 WeakPolarHBondContact O-CB 3.4Å; P412-S416 PolarHBondContact O-N 2.7Å
413	E	76.6	Confident	78	Confident	156 Å²	156	63 Å²	63	73%	0.729	34%	0.343	S	S	*	.	H	α-helix	trans	-62.3	-39.1	174.1	-64.5	-174.2	-177.6	0	0	113.2	F411 Q417	F411-E413 VanDerWaalsContact C-N 3.26Å; F411-E413 PolarHBondContact O-N 3.49Å; F411-E413 VanDerWaalsContact O-N 3.1Å; E413-Q417 WeakPolarHBondContact O-CB 3.29Å; E413-Q417 VanDerWaalsContact O-CG 3.3Å; E413-Q417 WeakPolarHBondContact O-CG 3.41Å; E413-Q417 PolarHBondContact O-N 3.03Å; E413-Q417 PolarHBondContact O-NE2 2.84Å
414	L	80.3	Confident	76.5	Confident	12 Å²	12	65.4 Å²	65.4	6%	0.063	36%	0.357	C	S	.	.	H	α-helix	trans	-82.3	-35.1	179.8	-70.8	173.5	0	0	0	111.5	F366 K369 V370 L373 L408 F411 P412 S416 Q417 F418	F366-L414 HydrophobicContact CD2-CD2 3.66Å; F366-L414 HydrophobicContact CE2-CB 4.13Å; F366-L414 HydrophobicContact CE2-CD2 3.85Å; F366-L414 WeakPolarHBondContact CE2-O 3.4Å; K369-L414 HydrophobicContact CB-CD2 4.3Å; K369-L414 HydrophobicContact CD-CD2 4.2Å; V370-L414 HydrophobicContact CG2-CD1 4.38Å; L373-L414 HydrophobicContact CD1-CD1 3.19Å; L408-L414 HydrophobicContact CD2-CB 4.34Å; F411-L414 HydrophobicContact CB-CB 4.22Å; F411-L414 HydrophobicContact CB-CD1 4.32Å; F411-L414 PolarHBondContact O-N 3.06Å; P412-L414 VanDerWaalsContact C-N 3.35Å; P412-L414 PolarHBondContact O-N 2.78Å; L414-S416 VanDerWaalsContact C-N 3.3Å; L414-S416 PolarHBondContact O-N 2.73Å; L414-Q417 PolarHBondContact O-N 3.48Å; L414-F418 VanDerWaalsContact O-CB 3.29Å; L414-F418 WeakPolarHBondContact O-CB 3.36Å; L414-F418 PolarHBondContact O-N 3.44Å
415	Y	81.5	Confident	74.9	Confident	65 Å²	65	74.1 Å²	74.1	26%	0.255	39%	0.394	S	S	.	.	H	α-helix	trans	-61.6	-40.6	169.8	-172.3	-111	0	0	0	111.5	L401 T405 L408 F411 F418 K419	L401-Y415 HydrophobicContact CD2-CE2 4.11Å; T405-Y415 WeakPolarHBondContact OG1-CE2 3.44Å; T405-Y415 PolarHBondContact OG1-OH 3.03Å; T405-Y415 VanDerWaalsContact OG1-OH 3.12Å; L408-Y415 HydrophobicContact CB-CD2 4.06Å; F411-Y415 PolarHBondContact O-N 2.79Å; Y415-F418 PolarHBondContact O-N 3.12Å; Y415-K419 WeakPolarHBondContact O-CB 3.47Å; Y415-K419 PolarHBondContact O-N 3.13Å
416	S	78.8	Confident	73.3	Confident	78 Å²	78	75.7 Å²	75.7	55%	0.545	40%	0.398	S	S	.	.	H	α-helix	trans	-66.8	-42.7	174	-174.8	0	0	0	0	112.4	P412 L414 K419 S420	P412-S416 WeakPolarHBondContact O-CB 3.4Å; P412-S416 PolarHBondContact O-N 2.7Å; L414-S416 VanDerWaalsContact C-N 3.3Å; L414-S416 PolarHBondContact O-N 2.73Å; S416-K419 PolarHBondContact O-N 2.94Å; S416-S420 WeakPolarHBondContact O-CB 3.49Å; S416-S420 PolarHBondContact O-N 3.45Å
417	Q	76.7	Confident	71.8	Confident	54 Å²	54	72.6 Å²	72.6	25%	0.252	38%	0.376	S	S	.	.	H	α-helix	trans	-60.5	-43.5	172.1	-78.9	161.5	66.4	0	0	111.8	F366 E413 L414 S420 F421	F366-Q417 HydrophobicContact CD2-CB 4.03Å; F366-Q417 HydrophobicContact CE2-CB 4.23Å; E413-Q417 WeakPolarHBondContact O-CB 3.29Å; E413-Q417 VanDerWaalsContact O-CG 3.3Å; E413-Q417 WeakPolarHBondContact O-CG 3.41Å; E413-Q417 PolarHBondContact O-N 3.03Å; E413-Q417 PolarHBondContact O-NE2 2.84Å; L414-Q417 PolarHBondContact O-N 3.48Å; Q417-S420 CarbonylContact O-C 3.59Å; Q417-S420 WeakPolarHBondContact O-CB 3.23Å; Q417-S420 PolarHBondContact O-N 3.41Å; Q417-S420 VanDerWaalsContact O-N 3.17Å; Q417-F421 HydrophobicContact CB-CE2 4.23Å; Q417-F421 WeakPolarHBondContact O-CD2 3.1Å; Q417-F421 WeakPolarHBondContact O-CE2 3.38Å; Q417-F421 WeakPolarHBondContact O-CG 3.48Å; Q417-F421 PolarHBondContact O-N 3.4Å; Q417-F421 VanDerWaalsContact O-N 3.1Å
418	F	81.8	Confident	70	Confident	9 Å²	9	73.9 Å²	73.9	4%	0.039	39%	0.39	C	S	.	.	H	α-helix	trans	-61.9	-48.2	177.4	-171.2	-108.7	0	0	0	112.3	F366 F383 I387 L400 L401 V404 L408 L414 Y415 S420 F421 L422	F366-F418 AromaticContact CE1-CD2 3.84Å; F366-F418 HydrophobicContact CE1-CD2 3.84Å; F366-F418 HydrophobicContact CE2-CB 4.19Å; F366-F418 HydrophobicContact CZ-CB 3.8Å; F366-F418 AromaticContact CZ-CD2 3.65Å; F366-F418 HydrophobicContact CZ-CD2 3.65Å; F366-F418 HydrophobicContact CZ-CG 4.15Å; F383-F418 HydrophobicContact CE2-CE2 4.19Å; F383-F418 HydrophobicContact CE2-CZ 4.44Å; F383-F418 HydrophobicContact CZ-CD2 4.44Å; F383-F418 HydrophobicContact CZ-CE2 4.17Å; I387-F418 HydrophobicContact CD1-CE2 3.79Å; I387-F418 HydrophobicContact CD1-CZ 4.15Å; I387-F418 HydrophobicContact CG1-CE2 4.19Å; I387-F418 HydrophobicContact CG1-CZ 4.06Å; L400-F418 HydrophobicContact CD1-CZ 4.39Å; L400-F418 HydrophobicContact CD2-CE1 4.28Å; L400-F418 HydrophobicContact CD2-CZ 3.94Å; L400-F418 HydrophobicContact CG-CE1 4.19Å; L400-F418 HydrophobicContact CG-CZ 4.13Å; L401-F418 HydrophobicContact CD2-CD1 4Å; L401-F418 HydrophobicContact CD2-CE1 4.31Å; V404-F418 HydrophobicContact CB-CD1 4.42Å; V404-F418 HydrophobicContact CB-CE1 3.86Å; V404-F418 HydrophobicContact CB-CZ 4.45Å; V404-F418 HydrophobicContact CG1-CD1 3.78Å; V404-F418 HydrophobicContact CG1-CE1 3.64Å; V404-F418 HydrophobicContact CG1-CG 4.46Å; V404-F418 HydrophobicContact CG1-CZ 4.2Å; V404-F418 HydrophobicContact CG2-CE1 3.8Å; V404-F418 HydrophobicContact CG2-CZ 3.92Å; L408-F418 HydrophobicContact CD1-CB 3.85Å; L408-F418 HydrophobicContact CD1-CD1 4.38Å; L408-F418 HydrophobicContact CD1-CD2 4.3Å; L408-F418 HydrophobicContact CD1-CG 3.92Å; L414-F418 VanDerWaalsContact O-CB 3.29Å; L414-F418 WeakPolarHBondContact O-CB 3.36Å; L414-F418 PolarHBondContact O-N 3.44Å; Y415-F418 PolarHBondContact O-N 3.12Å; F418-S420 PolarHBondContact O-N 3.02Å; F418-F421 PolarHBondContact O-N 3.46Å; F418-L422 HydrophobicContact CD1-CD1 4.31Å; F418-L422 HydrophobicContact CE1-CD1 3.92Å; F418-L422 HydrophobicContact CZ-CD1 4.44Å; F418-L422 PolarHBondContact O-N 3.42Å
419	K	80.3	Confident	68.1	Low	89 Å²	89	82.2 Å²	82.2	39%	0.387	43%	0.429	S	S	.	.	H	α-helix	trans	-58.4	-37.2	173.2	-171.7	179.1	179.1	-177.6	0	112	L401 Y415 S416 F421 L422 G423	L401-K419 HydrophobicContact CD1-CG 4.29Å; L401-K419 HydrophobicContact CD2-CB 4.2Å; L401-K419 HydrophobicContact CD2-CG 4.43Å; Y415-K419 WeakPolarHBondContact O-CB 3.47Å; Y415-K419 PolarHBondContact O-N 3.13Å; S416-K419 PolarHBondContact O-N 2.94Å; K419-F421 VanDerWaalsContact C-N 3.29Å; K419-F421 PolarHBondContact O-N 3.1Å; K419-L422 PolarHBondContact O-N 3.15Å; K419-G423 PolarHBondContact O-N 3.46Å
420	S	77.2	Confident	66.7	Low	76 Å²	76	83.5 Å²	83.5	53%	0.531	44%	0.436	S	S	.	.	H	α-helix	trans	-69.6	-18.3	175.4	-176.9	0	0	0	0	114.4	S416 Q417 F418	S416-S420 WeakPolarHBondContact O-CB 3.49Å; S416-S420 PolarHBondContact O-N 3.45Å; Q417-S420 CarbonylContact O-C 3.59Å; Q417-S420 WeakPolarHBondContact O-CB 3.23Å; Q417-S420 PolarHBondContact O-N 3.41Å; Q417-S420 VanDerWaalsContact O-N 3.17Å; F418-S420 PolarHBondContact O-N 3.02Å
421	F	77.5	Confident	64.8	Low	65 Å²	65	78.5 Å²	78.5	29%	0.285	42%	0.42	S	S	.	.	H	α-helix	trans	-85.1	-30	173.8	-65.4	-55.4	0	0	0	112.5	E363 F366 Q417 F418 K419	E363-F421 HydrophobicContact CG-CD1 3.79Å; E363-F421 HydrophobicContact CG-CE1 3.53Å; E363-F421 HydrophobicContact CG-CZ 4.06Å; F366-F421 HydrophobicContact CB-CE2 3.73Å; F366-F421 HydrophobicContact CB-CZ 4.09Å; F366-F421 HydrophobicContact CD1-CD2 4.3Å; F366-F421 AromaticContact CD1-CE2 3.9Å; F366-F421 HydrophobicContact CD1-CE2 3.9Å; F366-F421 AromaticContact CD2-CE2 3.89Å; F366-F421 HydrophobicContact CD2-CE2 3.89Å; F366-F421 HydrophobicContact CG-CD2 4.35Å; F366-F421 AromaticContact CG-CE2 3.56Å; F366-F421 HydrophobicContact CG-CE2 3.56Å; F366-F421 HydrophobicContact CG-CZ 4.4Å; Q417-F421 HydrophobicContact CB-CE2 4.23Å; Q417-F421 WeakPolarHBondContact O-CD2 3.1Å; Q417-F421 WeakPolarHBondContact O-CE2 3.38Å; Q417-F421 WeakPolarHBondContact O-CG 3.48Å; Q417-F421 PolarHBondContact O-N 3.4Å; Q417-F421 VanDerWaalsContact O-N 3.1Å; F418-F421 PolarHBondContact O-N 3.46Å; K419-F421 VanDerWaalsContact C-N 3.29Å; K419-F421 PolarHBondContact O-N 3.1Å
422	L	70.5	Confident	62.9	Low	32 Å²	32	80.4 Å²	80.4	17%	0.168	44%	0.443	C	S	.	.	H	α-helix	trans	-74.2	-36	174.2	-64.7	170	0	0	0	112.2	F390 L400 L401 F418 K419	F390-L422 HydrophobicContact CD1-CD2 4.5Å; F390-L422 HydrophobicContact CE1-CD2 3.88Å; F390-L422 HydrophobicContact CE2-CD2 4.39Å; F390-L422 HydrophobicContact CZ-CD2 3.83Å; L400-L422 HydrophobicContact CD2-CD1 3.93Å; L400-L422 HydrophobicContact CD2-CD2 3.69Å; L400-L422 HydrophobicContact CD2-CG 4.44Å; L401-L422 HydrophobicContact CD1-CD1 4.35Å; L401-L422 HydrophobicContact CD2-CD1 3.97Å; L401-L422 HydrophobicContact CG-CD1 3.84Å; F418-L422 HydrophobicContact CD1-CD1 4.31Å; F418-L422 HydrophobicContact CE1-CD1 3.92Å; F418-L422 HydrophobicContact CZ-CD1 4.44Å; F418-L422 PolarHBondContact O-N 3.42Å; K419-L422 PolarHBondContact O-N 3.15Å
423	G	59.9	Low	61.2	Low	26 Å²	26	79.1 Å²	79.1	27%	0.268	45%	0.447	S	S	.	.			trans	78.8	148.2	172.6	0	0	0	0	0	114.7	K419 K425 L427	K419-G423 PolarHBondContact O-N 3.46Å; G423-K425 PolarHBondContact O-N 2.83Å; G423-L427 WeakPolarHBondContact O-CD1 3.18Å
424	D	52.5	Low	59.5	Low	128 Å²	128	79.1 Å²	79.1	68%	0.684	45%	0.451	S	S	*	.	H	α-helix	trans	-65.4	-14.5	-168.7	-63.6	-54.3	0	0	0	115.1	S428	D424-S428 WeakPolarHBondContact O-CB 3.27Å; D424-S428 PolarHBondContact O-N 3.03Å; D424-S428 VanDerWaalsContact O-N 3.1Å
425	K	50	Low	57.1	Low	182 Å²	182	81.3 Å²	81.3	79%	0.791	47%	0.471	S	S	*	.	H	α-helix	trans	-69.1	-41.8	-177.5	-71.8	-170.9	176.5	-177.1	0	113.1	G423 S428	G423-K425 PolarHBondContact O-N 2.83Å; K425-S428 PolarHBondContact O-N 3.31Å; K425-S428 PolarHBondContact O-OG 3.28Å
426	E	49.8	Very low	54.6	Low	92 Å²	92	82.7 Å²	82.7	43%	0.43	48%	0.483	S	S	.	.	H	α-helix	trans	-69.2	-40.4	176.7	-69	-165.7	163.4	0	0	112	F390 S428 H429	F390-E426 VanDerWaalsContact CE2-OE2 3.23Å; F390-E426 WeakPolarHBondContact CE2-OE2 3.43Å; F390-E426 VanDerWaalsContact CZ-OE2 3.27Å; F390-E426 WeakPolarHBondContact CZ-OE2 3.46Å; E426-S428 PolarHBondContact O-N 3.09Å; E426-H429 PolarHBondContact O-N 2.96Å
427	L	47.9	Very low	52.5	Low	31 Å²	31	90.3 Å²	90.3	16%	0.162	50%	0.5	C	S	.	.	H	α-helix	trans	-61.6	-31.9	177.1	-75.5	86.8	0	0	0	111.9	L401 G423 H429	L401-L427 HydrophobicContact CD1-CD1 4.25Å; L401-L427 HydrophobicContact CD1-CD2 3.86Å; L401-L427 HydrophobicContact CD1-CG 4.26Å; G423-L427 WeakPolarHBondContact O-CD1 3.18Å; L427-H429 VanDerWaalsContact C-N 3.31Å; L427-H429 PolarHBondContact O-N 3.24Å
428	S	43.3	Very low	50.7	Low	74 Å²	74	97.8 Å²	97.8	52%	0.517	53%	0.527	S	S	.	.	H	α-helix	trans	-66.8	-27.1	-178.8	74.8	0	0	0	0	114.4	D424 K425 E426	D424-S428 WeakPolarHBondContact O-CB 3.27Å; D424-S428 PolarHBondContact O-N 3.03Å; D424-S428 VanDerWaalsContact O-N 3.1Å; K425-S428 PolarHBondContact O-N 3.31Å; K425-S428 PolarHBondContact O-OG 3.28Å; E426-S428 PolarHBondContact O-N 3.09Å
429	H	43.2	Very low	48.4	Very low	175 Å²	175	105.1 Å²	105.1	81%	0.81	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89	-11.2	-170.3	-103.2	-78.6	0	0	0	115.6	E426 L427	E426-H429 PolarHBondContact O-N 2.96Å; L427-H429 VanDerWaalsContact C-N 3.31Å; L427-H429 PolarHBondContact O-N 3.24Å
430	A	42.2	Very low	46.2	Very low	65 Å²	65	109.8 Å²	109.8	54%	0.537	59%	0.587	S	S	.	*	T	Hydrogen-bonded Turn	trans	-105	-23.4	-175.6	0	0	0	0	0	115
431	V	36.4	Very low	44.2	Very low	71 Å²	71	109.2 Å²	109.2	43%	0.43	59%	0.592	S	S	.	*	G	3₁₀ helix	trans	-86.8	-32	-163.7	-179.2	0	0	0	0	114	G433	V431-G433 PolarHBondContact O-N 3.06Å
432	S	40.9	Very low	42.3	Very low	112 Å²	112	109.2 Å²	109.2	78%	0.783	61%	0.611	S	S	*	*	G	3₁₀ helix	trans	-67.7	1.4	-171.8	-172.5	0	0	0	0	116
433	G	38.4	Very low	40.7	Very low	69 Å²	69	111.8 Å²	111.8	71%	0.711	65%	0.645	S	S	*	*	G	3₁₀ helix	trans	-91.8	-49	-170	0	0	0	0	0	115.9	V431	V431-G433 PolarHBondContact O-N 3.06Å
434	L	40.4	Very low	39.7	Very low	156 Å²	156	114.1 Å²	114.1	82%	0.817	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-148.1	-20.5	-163.3	-158.4	62.3	0	0	0	115.9
435	A	30.2	Very low	39.4	Very low	59 Å²	59	119.1 Å²	119.1	49%	0.488	68%	0.679	S	S	.	*	T	Hydrogen-bonded Turn	trans	-79.3	-45	-172.7	0	0	0	0	0	114.1	R437 Y438	A435-R437 VanDerWaalsContact C-N 3.26Å; A435-R437 PolarHBondContact O-N 3.41Å; A435-R437 VanDerWaalsContact O-N 3.13Å; A435-Y438 PolarHBondContact O-N 3.02Å; A435-Y438 VanDerWaalsContact O-N 3.13Å
436	D	28.4	Very low	39.7	Very low	94 Å²	94	118.3 Å²	118.3	50%	0.503	68%	0.678	S	S	.	*	G	3₁₀ helix	trans	-56.7	-36.7	-169.8	-76.1	-27.4	0	0	0	113.8	Y438 M439 E440	D436-Y438 PolarHBondContact O-N 2.87Å; D436-M439 PolarHBondContact O-N 2.81Å; D436-M439 VanDerWaalsContact O-N 3.11Å; D436-E440 PolarHBondContact O-N 3.11Å; D436-E440 VanDerWaalsContact O-N 3.11Å
437	R	35.3	Very low	40.6	Very low	237 Å²	237	114.7 Å²	114.7	89%	0.894	66%	0.662	S	S	*	*	G	3₁₀ helix	trans	-67.8	-8.9	-176.5	-63	-167.5	-174.3	-165.5	3.4	114.9	A435	A435-R437 VanDerWaalsContact C-N 3.26Å; A435-R437 PolarHBondContact O-N 3.41Å; A435-R437 VanDerWaalsContact O-N 3.13Å
438	Y	38.2	Very low	41.7	Very low	211 Å²	211	114.3 Å²	114.3	83%	0.827	66%	0.66	S	S	*	*	G	3₁₀ helix	trans	-108.4	-6.2	174.6	-95	-87	0	0	0	114.3	A435 D436	A435-Y438 PolarHBondContact O-N 3.02Å; A435-Y438 VanDerWaalsContact O-N 3.13Å; D436-Y438 PolarHBondContact O-N 2.87Å
439	M	34	Very low	43.1	Very low	164 Å²	164	113.2 Å²	113.2	81%	0.808	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.8	-19.4	179.9	-70.8	-65.3	-73.2	0	0	114.1	D436 G441	D436-M439 PolarHBondContact O-N 2.81Å; D436-M439 VanDerWaalsContact O-N 3.11Å; M439-G441 PolarHBondContact O-N 2.92Å
440	E	34.2	Very low	44.5	Very low	187 Å²	187	106.6 Å²	106.6	87%	0.874	62%	0.621	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.3	38.8	173.1	-154.4	171.8	-152.2	0	0	112.7	D436	D436-E440 PolarHBondContact O-N 3.11Å; D436-E440 VanDerWaalsContact O-N 3.11Å
441	G	35.4	Very low	46	Very low	63 Å²	63	107 Å²	107	65%	0.649	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-124.4	7.4	-167.3	0	0	0	0	0	116.2	M439	M439-G441 PolarHBondContact O-N 2.92Å
442	G	36.4	Very low	48.1	Very low	66 Å²	66	104 Å²	104	68%	0.68	60%	0.601	S	S	*	*			trans	100	141.3	-176.1	0	0	0	0	0	113.1	G444	G442-G444 PolarHBondContact O-N 2.7Å
443	G	37.8	Very low	50.2	Low	85 Å²	85	106 Å²	106	88%	0.876	60%	0.596	S	S	*	*			trans	-70.1	86	-170.8	0	0	0	0	0	114.1	R445	G443-R445 PolarHBondContact O-N 3.03Å
444	G	38.2	Very low	52.5	Low	76 Å²	76	111 Å²	111	78%	0.784	59%	0.593	S	S	*	*			trans	-63.3	111.8	167.9	0	0	0	0	0	110.6	G442	G442-G444 PolarHBondContact O-N 2.7Å
445	R	47.2	Very low	54.3	Low	233 Å²	233	108.3 Å²	108.3	88%	0.879	58%	0.579	S	S	*	*			trans	-65.3	136.5	163.8	-67.4	-175.4	177.8	-158	-1.7	108.5	G443 V447	G443-R445 PolarHBondContact O-N 3.03Å; R445-V447 PolarHBondContact O-N 3.47Å
446	E	56.7	Low	56.6	Low	164 Å²	164	108.6 Å²	108.6	77%	0.766	59%	0.587	S	S	*	*			trans	-53.6	130.1	165.8	-167.7	167.2	-150.7	0	0	108.9	D448	E446-D448 PolarHBondContact O-N 3.21Å
447	V	67.4	Low	58.6	Low	17 Å²	17	107.8 Å²	107.8	10%	0.103	59%	0.59	C	S	.	*			trans	-84	111.8	-170.8	175.9	0	0	0	0	109.3	S171 R445 Y449 P463 Y466	S171-V447 PolarHBondContact OG-O 3.29Å; R445-V447 PolarHBondContact O-N 3.47Å; V447-Y449 HydrophobicContact CB-CE1 4.13Å; V447-Y449 HydrophobicContact CB-CE2 4.36Å; V447-Y449 HydrophobicContact CG1-CD1 3.91Å; V447-Y449 HydrophobicContact CG1-CE1 3.71Å; V447-Y449 HydrophobicContact CG1-CG 4.45Å; V447-Y449 WeakPolarHBondContact O-CD2 3.34Å; V447-Y449 PolarHBondContact O-N 3.44Å; V447-P463 HydrophobicContact CG1-CG 4.03Å; V447-Y466 HydrophobicContact CG2-CD2 3.52Å; V447-Y466 HydrophobicContact CG2-CE2 3.85Å; V447-Y466 HydrophobicContact CG2-CG 4.49Å
448	D	71.7	Confident	60.5	Low	23 Å²	23	98.5 Å²	98.5	12%	0.123	56%	0.561	C	S	.	*			trans	-63.2	92.6	169.2	178.3	-9.3	0	0	0	110.3	N168 E446 A450 S451 C452	N168-D448 PolarHBondContact ND2-OD2 2.86Å; E446-D448 PolarHBondContact O-N 3.21Å; D448-A450 PolarHBondContact O-N 2.83Å; D448-A450 WeakPolarHBondContact OD1-CA 3.41Å; D448-A450 WeakPolarHBondContact OD1-CB 3.41Å; D448-A450 PolarHBondContact OD1-N 2.89Å; D448-S451 PolarHBondContact O-N 3.45Å; D448-S451 PolarHBondContact O-OG 3.49Å; D448-S451 PolarHBondContact OD1-N 3.15Å; D448-S451 WeakPolarHBondContact OD2-CB 3.36Å; D448-C452 PolarHBondContact O-N 3.42Å; D448-C452 PolarHBondContact O-SG 3.29Å
449	Y	72.8	Confident	62.7	Low	51 Å²	51	94 Å²	94	20%	0.2	54%	0.543	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-9.3	178.3	-65.4	-66.7	0	0	0	113.6	S171 V447 R460 L462 V487 F489	S171-Y449 PolarHBondContact OG-N 3.07Å; V447-Y449 HydrophobicContact CB-CE1 4.13Å; V447-Y449 HydrophobicContact CB-CE2 4.36Å; V447-Y449 HydrophobicContact CG1-CD1 3.91Å; V447-Y449 HydrophobicContact CG1-CE1 3.71Å; V447-Y449 HydrophobicContact CG1-CG 4.45Å; V447-Y449 WeakPolarHBondContact O-CD2 3.34Å; V447-Y449 PolarHBondContact O-N 3.44Å; Y449-R460 WeakPolarHBondContact O-CD 3.33Å; Y449-L462 HydrophobicContact CE1-CD2 4.02Å; Y449-V487 HydrophobicContact CD1-CG2 4.21Å; Y449-V487 HydrophobicContact CE1-CG2 3.88Å; Y449-F489 HydrophobicContact CD2-CE2 4.47Å; Y449-F489 HydrophobicContact CG-CD2 4.16Å; Y449-F489 HydrophobicContact CG-CE2 4.29Å
450	A	71.9	Confident	65.2	Low	36 Å²	36	87.4 Å²	87.4	30%	0.298	51%	0.509	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.8	-36.6	172.6	0	0	0	0	0	111.4	Q169 D448 C452	Q169-A450 HydrophobicContact CB-CB 4.3Å; D448-A450 PolarHBondContact O-N 2.83Å; D448-A450 WeakPolarHBondContact OD1-CA 3.41Å; D448-A450 WeakPolarHBondContact OD1-CB 3.41Å; D448-A450 PolarHBondContact OD1-N 2.89Å; A450-C452 VanDerWaalsContact C-N 3.3Å
451	S	73.4	Confident	67.8	Low	74 Å²	74	79.1 Å²	79.1	52%	0.517	47%	0.473	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-24.4	171.6	77.4	0	0	0	0	113.9	D448	D448-S451 PolarHBondContact O-N 3.45Å; D448-S451 PolarHBondContact O-OG 3.49Å; D448-S451 PolarHBondContact OD1-N 3.15Å; D448-S451 WeakPolarHBondContact OD2-CB 3.36Å
452	C	82.3	Confident	70.1	Confident	6 Å²	6	77.6 Å²	77.6	4%	0.041	45%	0.45	C	S	.	.	S	Bend	trans	-63.3	138.7	-177.8	-76.2	0	0	0	0	113	D448 A450 R454 R460 A461	D448-C452 PolarHBondContact O-N 3.42Å; D448-C452 PolarHBondContact O-SG 3.29Å; A450-C452 VanDerWaalsContact C-N 3.3Å; C452-R454 WeakPolarHBondContact O-CG 3.42Å; C452-R454 PolarHBondContact O-N 2.91Å; C452-R460 HydrophobicContact CB-CB 3.95Å; C452-A461 VanDerWaalsContact CB-O 3.24Å; C452-A461 WeakPolarHBondContact CB-O 3.38Å; C452-A461 PolarHBondContact SG-O 2.91Å; C452-A461 VanDerWaalsContact SG-O 3.33Å
453	K	84.4	Confident	72.3	Confident	155 Å²	155	76.5 Å²	76.5	67%	0.674	43%	0.431	S	S	*	.	P	Polyproline II helix	trans	-57	127.7	178.4	-179.1	-177.1	178	179.7	0	109.8	R460 A461 W486	K453-R460 CarbonylContact O-C 3.58Å; K453-R460 WeakPolarHBondContact O-CA 3.21Å; K453-A461 HydrophobicContact CB-CB 4.12Å; K453-A461 PolarHBondContact O-N 2.83Å; K453-W486 HydrophobicContact CD-CH2 4.2Å; K453-W486 HydrophobicContact CG-CH2 4.14Å; K453-W486 VanDerWaalsContact O-CZ3 3.23Å; K453-W486 WeakPolarHBondContact O-CZ3 3.42Å
454	R	86.1	Confident	74.2	Confident	174 Å²	174	83.1 Å²	83.1	66%	0.657	44%	0.435	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.9	147.5	-173.4	-51.6	-167.8	-79.1	-159.7	-4.6	111.7	C452	C452-R454 WeakPolarHBondContact O-CG 3.42Å; C452-R454 PolarHBondContact O-N 2.91Å
455	L	78.8	Confident	76	Confident	100 Å²	100	85.6 Å²	85.6	52%	0.524	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	111	170	-174.7	146.3	0	0	0	108.4	Y459 W486	L455-Y459 PolarHBondContact N-O 3.32Å; L455-Y459 WeakPolarHBondContact O-CB 3.41Å; L455-Y459 PolarHBondContact O-N 2.86Å; L455-W486 HydrophobicContact CB-CE3 4Å; L455-W486 HydrophobicContact CB-CH2 3.62Å; L455-W486 HydrophobicContact CB-CZ2 4.46Å; L455-W486 HydrophobicContact CB-CZ3 3.34Å; L455-W486 HydrophobicContact CD1-CH2 4.1Å; L455-W486 HydrophobicContact CD1-CZ2 4.2Å
456	G	78	Confident	77.5	Confident	64 Å²	64	79 Å²	79	66%	0.66	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.8	-168.5	-164.6	0	0	0	0	0	113.2
457	S	71.4	Confident	78.4	Confident	78 Å²	78	79.3 Å²	79.3	55%	0.545	41%	0.413	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-41.6	172.6	47.5	0	0	0	0	112	R460	S457-R460 VanDerWaalsContact O-CZ 3.3Å; S457-R460 PolarHBondContact O-NH1 3.02Å; S457-R460 PolarHBondContact O-NH2 2.7Å
458	S	74.2	Confident	78.4	Confident	41 Å²	41	82.9 Å²	82.9	29%	0.287	43%	0.428	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.5	3.1	-159.8	-50.1	0	0	0	0	117.1	S488 F489 S491	S458-S488 CarbonylContact O-C 3.59Å; S458-S488 WeakPolarHBondContact O-CA 3.22Å; S458-F489 CarbonylContact C-O 3.58Å; S458-F489 WeakPolarHBondContact CA-O 3.4Å; S458-F489 PolarHBondContact O-N 2.65Å; S458-S491 PolarHBondContact OG-OG 2.8Å
459	Y	84.8	Confident	78.4	Confident	118 Å²	118	86.7 Å²	86.7	46%	0.463	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	144.2	176.2	-64.1	-81.9	0	0	0	113.9	L455 V487	L455-Y459 PolarHBondContact N-O 3.32Å; L455-Y459 WeakPolarHBondContact O-CB 3.41Å; L455-Y459 PolarHBondContact O-N 2.86Å; Y459-V487 WeakPolarHBondContact CA-O 3.41Å
460	R	86.8	Confident	78	Confident	24 Å²	24	94.4 Å²	94.4	9%	0.091	49%	0.489	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	134.7	177.8	-55.9	-65.5	175.6	-88.6	-11.8	109.8	Y449 C452 K453 S457 W486 V487 F489	Y449-R460 WeakPolarHBondContact O-CD 3.33Å; C452-R460 HydrophobicContact CB-CB 3.95Å; K453-R460 CarbonylContact O-C 3.58Å; K453-R460 WeakPolarHBondContact O-CA 3.21Å; S457-R460 VanDerWaalsContact O-CZ 3.3Å; S457-R460 PolarHBondContact O-NH1 3.02Å; S457-R460 PolarHBondContact O-NH2 2.7Å; R460-W486 VanDerWaalsContact C-CE3 3.4Å; R460-W486 CarbonylContact O-C 3.57Å; R460-W486 WeakPolarHBondContact O-CA 3.13Å; R460-V487 HydrophobicContact CB-CG2 4.21Å; R460-V487 PolarHBondContact N-O 2.66Å; R460-V487 PolarHBondContact O-N 2.64Å; R460-F489 HydrophobicContact CG-CB 3.56Å; R460-F489 HydrophobicContact CG-CD2 4.21Å; R460-F489 HydrophobicContact CG-CG 4.01Å
461	A	88.5	Confident	77.7	Confident	14 Å²	14	96.8 Å²	96.8	12%	0.116	50%	0.502	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	126.7	173.1	0	0	0	0	0	110.1	C452 K453 T485 W486	C452-A461 VanDerWaalsContact CB-O 3.24Å; C452-A461 WeakPolarHBondContact CB-O 3.38Å; C452-A461 PolarHBondContact SG-O 2.91Å; C452-A461 VanDerWaalsContact SG-O 3.33Å; K453-A461 HydrophobicContact CB-CB 4.12Å; K453-A461 PolarHBondContact O-N 2.83Å; A461-T485 CarbonylContact C-O 3.58Å; A461-T485 VanDerWaalsContact CA-O 3.24Å; A461-T485 WeakPolarHBondContact CA-O 3.38Å; A461-T485 HydrophobicContact CB-CG2 4.47Å; A461-W486 HydrophobicContact CB-CD2 3.86Å; A461-W486 HydrophobicContact CB-CE3 3.77Å; A461-W486 HydrophobicContact CB-CH2 3.89Å; A461-W486 HydrophobicContact CB-CZ2 3.99Å; A461-W486 HydrophobicContact CB-CZ3 3.77Å; A461-W486 VanDerWaalsContact N-CE3 3.26Å
462	L	83.4	Confident	77	Confident	30 Å²	30	99.5 Å²	99.5	16%	0.157	52%	0.521	C	S	.	.	P	Polyproline II helix	trans	-59.5	144.9	174.5	-68.3	171.6	0	0	0	110.7	Y449 Y466 T485 V487	Y449-L462 HydrophobicContact CE1-CD2 4.02Å; L462-Y466 HydrophobicContact CD1-CD1 3.94Å; L462-Y466 HydrophobicContact CD1-CE1 4.08Å; L462-T485 PolarHBondContact N-O 3.21Å; L462-V487 HydrophobicContact CD1-CG1 3.92Å; L462-V487 HydrophobicContact CD2-CG1 3.96Å; L462-V487 HydrophobicContact CD2-CG2 4.12Å; L462-V487 HydrophobicContact CG-CG1 3.92Å; L462-V487 HydrophobicContact CG-CG2 4.44Å
463	P	82.2	Confident	76.2	Confident	44 Å²	44	102.1 Å²	102.1	29%	0.286	55%	0.549	S	S	.	.	P	Polyproline II helix	trans	-61.5	143.2	175.6	-22.1	34.5	0	0	0	111.1	V447 T465 Y466	V447-P463 HydrophobicContact CG1-CG 4.03Å; P463-T465 PolarHBondContact O-N 3.06Å; P463-Y466 VanDerWaalsContact O-CB 3.28Å; P463-Y466 WeakPolarHBondContact O-CB 3.4Å; P463-Y466 PolarHBondContact O-N 3.3Å
464	K	77.1	Confident	75.7	Confident	223 Å²	223	97.5 Å²	97.5	97%	0.97	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-11.8	175.4	-66.3	-173.3	177.5	-175.6	0	114.1
465	T	77.6	Confident	75.3	Confident	129 Å²	129	92.9 Å²	92.9	79%	0.791	52%	0.519	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.3	-8.6	175.5	46.9	0	0	0	0	113.6	P463 Q467	P463-T465 PolarHBondContact O-N 3.06Å; T465-Q467 PolarHBondContact O-N 2.75Å
466	Y	77.3	Confident	75.4	Confident	95 Å²	95	91.4 Å²	91.4	37%	0.373	52%	0.521	S	S	.	.			trans	-72.4	121.6	176.8	-178.4	-102.8	0	0	0	110.5	V447 L462 P463 Q468	V447-Y466 HydrophobicContact CG2-CD2 3.52Å; V447-Y466 HydrophobicContact CG2-CE2 3.85Å; V447-Y466 HydrophobicContact CG2-CG 4.49Å; L462-Y466 HydrophobicContact CD1-CD1 3.94Å; L462-Y466 HydrophobicContact CD1-CE1 4.08Å; P463-Y466 VanDerWaalsContact O-CB 3.28Å; P463-Y466 WeakPolarHBondContact O-CB 3.4Å; P463-Y466 PolarHBondContact O-N 3.3Å; Y466-Q468 HydrophobicContact CD1-CG 4.4Å; Y466-Q468 PolarHBondContact O-N 3.07Å
467	Q	75.4	Confident	75.5	Confident	170 Å²	170	93.7 Å²	93.7	79%	0.794	52%	0.517	S	S	*	.			trans	-79.5	111.3	175.5	-66	-166.2	15.2	0	0	110	T465	T465-Q467 PolarHBondContact O-N 2.75Å
468	Q	69.3	Low	75.8	Confident	92 Å²	92	92 Å²	92	43%	0.43	51%	0.505	S	S	.	.			trans	-66.9	136.6	176	-69.8	166.3	0.4	0	0	111.2	Y466 K470 D484	Y466-Q468 HydrophobicContact CD1-CG 4.4Å; Y466-Q468 PolarHBondContact O-N 3.07Å; Q468-K470 PolarHBondContact O-N 3.29Å; Q468-D484 PolarHBondContact NE2-O 3.49Å
469	P	70.8	Confident	76	Confident	102 Å²	102	96.7 Å²	96.7	66%	0.662	52%	0.52	S	S	*	.			trans	-56.7	134.9	173.5	-26.8	35.4	0	0	0	112.9	C471	P469-C471 PolarHBondContact O-N 2.91Å
470	K	63.5	Low	75.8	Confident	213 Å²	213	98.4 Å²	98.4	93%	0.926	53%	0.532	S	S	*	.			trans	-76.3	85.6	-178.3	-68.1	178	-178	170.9	0	111.6	Q468 S472	Q468-K470 PolarHBondContact O-N 3.29Å; K470-S472 PolarHBondContact O-N 3.38Å
471	C	65.4	Low	75.4	Confident	86 Å²	86	102.2 Å²	102.2	58%	0.581	56%	0.558	S	S	*	*			trans	-70.1	112	172	-177.5	0	0	0	0	111.3	P469 G473 R474	P469-C471 PolarHBondContact O-N 2.91Å; C471-G473 VanDerWaalsContact C-N 3.34Å; C471-G473 PolarHBondContact O-N 3.37Å; C471-R474 HydrophobicContact CB-CB 4.42Å; C471-R474 WeakPolarHBondContact O-CB 3.19Å
472	S	59.7	Low	74.9	Confident	131 Å²	131	106 Å²	106	92%	0.916	58%	0.576	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.3	-25.5	-177.4	51.1	0	0	0	0	114.3	K470 R474	K470-S472 PolarHBondContact O-N 3.38Å; S472-R474 VanDerWaalsContact C-N 3.3Å; S472-R474 PolarHBondContact O-N 2.87Å
473	G	66.1	Low	74.9	Confident	61 Å²	61	109.4 Å²	109.4	63%	0.629	59%	0.594	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.2	4.2	179.4	0	0	0	0	0	115.5	C471 T475	C471-G473 VanDerWaalsContact C-N 3.34Å; C471-G473 PolarHBondContact O-N 3.37Å; G473-T475 PolarHBondContact O-N 2.91Å
474	R	72.5	Confident	74.7	Confident	58 Å²	58	109.5 Å²	109.5	22%	0.219	59%	0.592	C	S	.	*			trans	-83.5	99.7	-166.9	-156.8	177.1	-162.1	148.9	9	113.2	C471 S472 C478 K479 L482 D484	C471-R474 HydrophobicContact CB-CB 4.42Å; C471-R474 WeakPolarHBondContact O-CB 3.19Å; S472-R474 VanDerWaalsContact C-N 3.3Å; S472-R474 PolarHBondContact O-N 2.87Å; R474-C478 HydrophobicContact CG-CB 3.63Å; R474-C478 PolarHBondContact NE-O 3.46Å; R474-C478 PolarHBondContact NH2-O 3.42Å; R474-K479 HydrophobicContact CG-CG 4.04Å; R474-L482 VanDerWaalsContact NH2-CB 3.34Å; R474-D484 VanDerWaalsContact CZ-CG 3.45Å; R474-D484 IonicContact CZ-OD1 2.69Å; R474-D484 IonicContact CZ-OD2 2.67Å; R474-D484 IonicContact NE-OD2 2.7Å; R474-D484 VanDerWaalsContact NH1-CG 3.27Å; R474-D484 IonicContact NH1-OD1 2.76Å; R474-D484 PolarHBondContact NH1-OD1 3.48Å; R474-D484 IonicContact NH1-OD2 2.74Å; R474-D484 PolarHBondContact NH1-OD2 3.43Å; R474-D484 IonicContact NH2-OD1 3.13Å; R474-D484 PolarHBondContact NH2-OD1 3.41Å; R474-D484 IonicContact NH2-OD2 3.11Å; R474-D484 PolarHBondContact NH2-OD2 2.89Å
475	T	79.5	Confident	75	Confident	78 Å²	78	102.6 Å²	102.6	48%	0.479	57%	0.569	S	S	.	*			trans	-62.7	170.7	173.9	75.8	0	0	0	0	112.7	G473 C478 K479	G473-T475 PolarHBondContact O-N 2.91Å; T475-C478 WeakPolarHBondContact O-CB 3.31Å; T475-C478 PolarHBondContact O-N 3.24Å; T475-C478 PolarHBondContact OG1-N 2.97Å; T475-C478 PolarHBondContact OG1-SG 3.07Å; T475-K479 PolarHBondContact O-N 2.78Å
476	A	80.2	Confident	75.4	Confident	68 Å²	68	99.7 Å²	99.7	56%	0.562	54%	0.544	S	S	*	.	S	Bend	trans	-58.2	-49.7	175.7	0	0	0	0	0	112.3	C478 K479 E480	A476-C478 PolarHBondContact O-N 3.32Å; A476-K479 WeakPolarHBondContact O-CA 3.21Å; A476-K479 WeakPolarHBondContact O-CB 3.32Å; A476-K479 PolarHBondContact O-N 3.18Å; A476-E480 PolarHBondContact O-N 3.36Å
477	L	79.3	Confident	75.7	Confident	112 Å²	112	97.3 Å²	97.3	59%	0.586	54%	0.539	S	S	*	.	H	α-helix	trans	-57.8	-37.1	176	-173.8	68.3	0	0	0	112	K479 E480 V481	L477-K479 PolarHBondContact O-N 3.14Å; L477-E480 PolarHBondContact O-N 3.06Å; L477-E480 VanDerWaalsContact O-N 3.16Å; L477-V481 HydrophobicContact CD1-CG2 3.7Å; L477-V481 HydrophobicContact CG-CG2 4.11Å; L477-V481 PolarHBondContact O-N 3.22Å
478	C	78.7	Confident	75.9	Confident	42 Å²	42	93.6 Å²	93.6	28%	0.284	53%	0.532	S	S	.	.	H	α-helix	trans	-70	-6	175.1	-62.6	0	0	0	0	114.3	R474 T475 A476 L482	R474-C478 HydrophobicContact CG-CB 3.63Å; R474-C478 PolarHBondContact NE-O 3.46Å; R474-C478 PolarHBondContact NH2-O 3.42Å; T475-C478 WeakPolarHBondContact O-CB 3.31Å; T475-C478 PolarHBondContact O-N 3.24Å; T475-C478 PolarHBondContact OG1-N 2.97Å; T475-C478 PolarHBondContact OG1-SG 3.07Å; A476-C478 PolarHBondContact O-N 3.32Å; C478-L482 HydrophobicContact CB-CD1 3.87Å; C478-L482 HydrophobicContact CB-CG 4.4Å; C478-L482 WeakPolarHBondContact O-CB 3.18Å; C478-L482 WeakPolarHBondContact O-CD1 3.49Å; C478-L482 WeakPolarHBondContact O-CG 3.44Å
479	K	78.5	Confident	75.7	Confident	141 Å²	141	91.6 Å²	91.6	61%	0.613	52%	0.522	S	S	*	.	H	α-helix	trans	-100.1	-20.2	170.3	-62.7	172.9	-174.3	177.5	0	112.7	R474 T475 A476 L477	R474-K479 HydrophobicContact CG-CG 4.04Å; T475-K479 PolarHBondContact O-N 2.78Å; A476-K479 WeakPolarHBondContact O-CA 3.21Å; A476-K479 WeakPolarHBondContact O-CB 3.32Å; A476-K479 PolarHBondContact O-N 3.18Å; L477-K479 PolarHBondContact O-N 3.14Å
480	E	79	Confident	75	Confident	153 Å²	153	90.9 Å²	90.9	72%	0.715	52%	0.517	S	S	*	.	H	α-helix	trans	-87.7	-38.7	177.5	-67.4	168.9	-179.7	0	0	112	A476 L477	A476-E480 PolarHBondContact O-N 3.36Å; L477-E480 PolarHBondContact O-N 3.06Å; L477-E480 VanDerWaalsContact O-N 3.16Å
481	V	79.8	Confident	74.3	Confident	105 Å²	105	83 Å²	83	64%	0.636	49%	0.489	S	S	*	.	S	Bend	trans	-101.2	-28.2	-169	-177.1	0	0	0	0	113.7	L477	L477-V481 HydrophobicContact CD1-CG2 3.7Å; L477-V481 HydrophobicContact CG-CG2 4.11Å; L477-V481 PolarHBondContact O-N 3.22Å
482	L	78.4	Confident	73.5	Confident	93 Å²	93	89.3 Å²	89.3	49%	0.487	50%	0.501	S	S	.	.	S	Bend	trans	-84.9	132.7	-176.1	-63.3	-177.8	0	0	0	111.7	R474 C478 D484	R474-L482 VanDerWaalsContact NH2-CB 3.34Å; C478-L482 HydrophobicContact CB-CD1 3.87Å; C478-L482 HydrophobicContact CB-CG 4.4Å; C478-L482 WeakPolarHBondContact O-CB 3.18Å; C478-L482 WeakPolarHBondContact O-CD1 3.49Å; C478-L482 WeakPolarHBondContact O-CG 3.44Å; L482-D484 PolarHBondContact O-N 2.95Å; L482-D484 VanDerWaalsContact O-N 3.12Å
483	N	81.9	Confident	72.5	Confident	101 Å²	101	85.8 Å²	85.8	54%	0.54	48%	0.476	S	S	.	.			trans	-70.7	105.2	-179.5	172.6	26.2	0	0	0	112.3	T485 W486	N483-T485 PolarHBondContact OD1-N 2.97Å; N483-W486 PolarHBondContact ND2-O 3.49Å; N483-W486 PolarHBondContact OD1-N 3.02Å; N483-W486 PolarHBondContact OD1-O 3.09Å
484	D	79	Confident	71.3	Confident	46 Å²	46	89.7 Å²	89.7	25%	0.246	48%	0.478	C	S	.	.	S	Bend	trans	-99.8	-4.9	176.7	-89.7	-25.9	0	0	0	114.2	Q468 R474 L482	Q468-D484 PolarHBondContact NE2-O 3.49Å; R474-D484 VanDerWaalsContact CZ-CG 3.45Å; R474-D484 IonicContact CZ-OD1 2.69Å; R474-D484 IonicContact CZ-OD2 2.67Å; R474-D484 IonicContact NE-OD2 2.7Å; R474-D484 VanDerWaalsContact NH1-CG 3.27Å; R474-D484 IonicContact NH1-OD1 2.76Å; R474-D484 PolarHBondContact NH1-OD1 3.48Å; R474-D484 IonicContact NH1-OD2 2.74Å; R474-D484 PolarHBondContact NH1-OD2 3.43Å; R474-D484 IonicContact NH2-OD1 3.13Å; R474-D484 PolarHBondContact NH2-OD1 3.41Å; R474-D484 IonicContact NH2-OD2 3.11Å; R474-D484 PolarHBondContact NH2-OD2 2.89Å; L482-D484 PolarHBondContact O-N 2.95Å; L482-D484 VanDerWaalsContact O-N 3.12Å
485	T	83.1	Confident	69.5	Low	78 Å²	78	94.3 Å²	94.3	48%	0.479	51%	0.507	S	S	.	.	S	Bend	trans	-111.4	-32.5	-168	-58.6	0	0	0	0	113.1	A461 L462 N483	A461-T485 CarbonylContact C-O 3.58Å; A461-T485 VanDerWaalsContact CA-O 3.24Å; A461-T485 WeakPolarHBondContact CA-O 3.38Å; A461-T485 HydrophobicContact CB-CG2 4.47Å; L462-T485 PolarHBondContact N-O 3.21Å; N483-T485 PolarHBondContact OD1-N 2.97Å
486	W	85.8	Confident	67.5	Low	68 Å²	68	93.3 Å²	93.3	26%	0.258	50%	0.503	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	134.6	-176.9	-62.9	86.9	0	0	0	111.2	K453 L455 R460 A461 N483	K453-W486 HydrophobicContact CD-CH2 4.2Å; K453-W486 HydrophobicContact CG-CH2 4.14Å; K453-W486 VanDerWaalsContact O-CZ3 3.23Å; K453-W486 WeakPolarHBondContact O-CZ3 3.42Å; L455-W486 HydrophobicContact CB-CE3 4Å; L455-W486 HydrophobicContact CB-CH2 3.62Å; L455-W486 HydrophobicContact CB-CZ2 4.46Å; L455-W486 HydrophobicContact CB-CZ3 3.34Å; L455-W486 HydrophobicContact CD1-CH2 4.1Å; L455-W486 HydrophobicContact CD1-CZ2 4.2Å; R460-W486 VanDerWaalsContact C-CE3 3.4Å; R460-W486 CarbonylContact O-C 3.57Å; R460-W486 WeakPolarHBondContact O-CA 3.13Å; A461-W486 HydrophobicContact CB-CD2 3.86Å; A461-W486 HydrophobicContact CB-CE3 3.77Å; A461-W486 HydrophobicContact CB-CH2 3.89Å; A461-W486 HydrophobicContact CB-CZ2 3.99Å; A461-W486 HydrophobicContact CB-CZ3 3.77Å; A461-W486 VanDerWaalsContact N-CE3 3.26Å; N483-W486 PolarHBondContact ND2-O 3.49Å; N483-W486 PolarHBondContact OD1-N 3.02Å; N483-W486 PolarHBondContact OD1-O 3.09Å
487	V	83.5	Confident	65.5	Low	45 Å²	45	96.5 Å²	96.5	27%	0.273	52%	0.516	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	146	169	-68.3	0	0	0	0	110.4	Y449 Y459 R460 L462 F489	Y449-V487 HydrophobicContact CD1-CG2 4.21Å; Y449-V487 HydrophobicContact CE1-CG2 3.88Å; Y459-V487 WeakPolarHBondContact CA-O 3.41Å; R460-V487 HydrophobicContact CB-CG2 4.21Å; R460-V487 PolarHBondContact N-O 2.66Å; R460-V487 PolarHBondContact O-N 2.64Å; L462-V487 HydrophobicContact CD1-CG1 3.92Å; L462-V487 HydrophobicContact CD2-CG1 3.96Å; L462-V487 HydrophobicContact CD2-CG2 4.12Å; L462-V487 HydrophobicContact CG-CG1 3.92Å; L462-V487 HydrophobicContact CG-CG2 4.44Å; V487-F489 PolarHBondContact O-N 3.2Å
488	S	79	Confident	63.6	Low	92 Å²	92	99.5 Å²	99.5	64%	0.643	52%	0.524	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.1	118	166.4	50.5	0	0	0	0	109.1	S458	S458-S488 CarbonylContact O-C 3.59Å; S458-S488 WeakPolarHBondContact O-CA 3.22Å
489	F	65.9	Low	62	Low	51 Å²	51	103.7 Å²	103.7	22%	0.224	55%	0.548	C	S	.	.	P	Polyproline II helix	trans	-103	117.4	172.2	-175.4	-83	0	0	0	107.8	Y449 S458 R460 V487 S491	Y449-F489 HydrophobicContact CD2-CE2 4.47Å; Y449-F489 HydrophobicContact CG-CD2 4.16Å; Y449-F489 HydrophobicContact CG-CE2 4.29Å; S458-F489 CarbonylContact C-O 3.58Å; S458-F489 WeakPolarHBondContact CA-O 3.4Å; S458-F489 PolarHBondContact O-N 2.65Å; R460-F489 HydrophobicContact CG-CB 3.56Å; R460-F489 HydrophobicContact CG-CD2 4.21Å; R460-F489 HydrophobicContact CG-CG 4.01Å; V487-F489 PolarHBondContact O-N 3.2Å; F489-S491 PolarHBondContact O-N 3.35Å; F489-S491 VanDerWaalsContact O-N 3.11Å
490	P	56	Low	60.3	Low	86 Å²	86	100.2 Å²	100.2	56%	0.558	54%	0.542	S	S	*	.	P	Polyproline II helix	trans	-56.9	118.4	179.1	-24.5	34.3	0	0	0	110.8
491	S	48.1	Very low	59	Low	49 Å²	49	97.1 Å²	97.1	34%	0.343	54%	0.537	S	S	.	.	S	Bend	trans	-80.4	-4.6	170.7	43.6	0	0	0	0	112.7	S458 F489	S458-S491 PolarHBondContact OG-OG 2.8Å; F489-S491 PolarHBondContact O-N 3.35Å; F489-S491 VanDerWaalsContact O-N 3.11Å
492	W	48.8	Very low	57.8	Low	218 Å²	218	100.4 Å²	100.4	83%	0.826	54%	0.543	S	S	*	.	S	Bend	trans	-141.8	71.6	-178.6	-56.4	97.7	0	0	0	109.4
493	S	39.6	Very low	57.3	Low	57 Å²	57	100.4 Å²	100.4	40%	0.399	54%	0.539	S	S	.	.			trans	-77.8	141.7	168.2	53.4	0	0	0	0	110.1	D495 S496	S493-D495 PolarHBondContact O-N 3.25Å; S493-S496 WeakPolarHBondContact O-CB 3.35Å; S493-S496 PolarHBondContact O-N 3.25Å
494	E	40.2	Very low	57.2	Low	143 Å²	143	96.2 Å²	96.2	67%	0.668	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-24.7	177.8	-61.4	-175.3	125.9	0	0	112.3	S496 K503	E494-S496 PolarHBondContact O-N 3.12Å; E494-K503 WeakPolarHBondContact OE1-CE 3.34Å; E494-K503 IonicContact OE1-NZ 2.73Å; E494-K503 PolarHBondContact OE1-NZ 3.07Å
495	D	35.9	Very low	57.5	Low	155 Å²	155	98.2 Å²	98.2	83%	0.829	53%	0.532	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.7	-1.6	171.7	-53	-67.1	0	0	0	114.5	S493 T497	S493-D495 PolarHBondContact O-N 3.25Å; D495-T497 PolarHBondContact O-N 3.49Å
496	S	36.9	Very low	57.6	Low	56 Å²	56	98.6 Å²	98.6	39%	0.392	53%	0.525	S	S	.	.			trans	-73.8	115.7	177	-174.5	0	0	0	0	110.3	S493 E494 F498	S493-S496 WeakPolarHBondContact O-CB 3.35Å; S493-S496 PolarHBondContact O-N 3.25Å; E494-S496 PolarHBondContact O-N 3.12Å; S496-F498 PolarHBondContact O-N 3.39Å
497	T	38.6	Very low	57.7	Low	136 Å²	136	97.7 Å²	97.7	83%	0.834	52%	0.524	S	S	*	.	S	Bend	trans	-65.3	-7.9	179.3	51.8	0	0	0	0	114.2	D495 V499	D495-T497 PolarHBondContact O-N 3.49Å; T497-V499 PolarHBondContact O-N 2.91Å
498	F	38.1	Very low	57.8	Low	175 Å²	175	101.5 Å²	101.5	77%	0.768	54%	0.539	S	S	*	.	S	Bend	trans	-86.9	84.9	168.8	-84.5	-90.4	0	0	0	111.4	S496 S500	S496-F498 PolarHBondContact O-N 3.39Å; F498-S500 PolarHBondContact O-N 2.9Å
499	V	45.3	Very low	58.1	Low	129 Å²	129	100.5 Å²	100.5	78%	0.782	52%	0.524	S	S	*	.			trans	26.5	83.8	156.4	-169	0	0	0	0	114.2	T497	T497-V499 PolarHBondContact O-N 2.91Å
500	S	43.4	Very low	59.1	Low	69 Å²	69	99 Å²	99	48%	0.483	52%	0.518	S	S	.	.			trans	-56.6	150.2	146.6	54.8	0	0	0	0	108.9	F498 K502	F498-S500 PolarHBondContact O-N 2.9Å; S500-K502 PolarHBondContact O-N 3.16Å; S500-K502 VanDerWaalsContact O-N 3.14Å
501	S	51	Low	60.7	Low	87 Å²	87	99.1 Å²	99.1	61%	0.608	51%	0.511	S	S	*	.			trans	-52.5	123	155.9	44.9	0	0	0	0	107.1	K503	S501-K503 PolarHBondContact O-N 3.03Å
502	K	55.9	Low	62.6	Low	174 Å²	174	103.6 Å²	103.6	76%	0.757	52%	0.521	S	S	*	.			trans	-56.3	105.1	173.9	-75.1	-175.2	177.9	-179.5	0	107.2	S500 T504	S500-K502 PolarHBondContact O-N 3.16Å; S500-K502 VanDerWaalsContact O-N 3.14Å; K502-T504 PolarHBondContact O-N 3.35Å
503	K	67.4	Low	64.5	Low	94 Å²	94	93.3 Å²	93.3	41%	0.409	48%	0.482	S	S	.	.			trans	-50.9	129.2	-178.2	-69	-172.8	166.6	170.9	0	108.2	E494 S501 E507	E494-K503 WeakPolarHBondContact OE1-CE 3.34Å; E494-K503 IonicContact OE1-NZ 2.73Å; E494-K503 PolarHBondContact OE1-NZ 3.07Å; S501-K503 PolarHBondContact O-N 3.03Å; K503-E507 VanDerWaalsContact CA-OE2 3.26Å; K503-E507 WeakPolarHBondContact CA-OE2 3Å; K503-E507 WeakPolarHBondContact CG-OE1 3.41Å
504	T	80.6	Confident	66.9	Low	12 Å²	12	93.6 Å²	93.6	7%	0.074	48%	0.477	C	S	.	.			trans	-68	150.3	179.9	66.4	0	0	0	0	108.8	K502 Y506 E507 E508 S629 H632	K502-T504 PolarHBondContact O-N 3.35Å; T504-Y506 PolarHBondContact O-N 3.38Å; T504-E507 PolarHBondContact N-OE2 3.29Å; T504-E507 WeakPolarHBondContact O-CA 3.22Å; T504-E507 WeakPolarHBondContact O-CB 3.42Å; T504-E507 PolarHBondContact O-N 3.36Å; T504-E507 VanDerWaalsContact OG1-CB 3.22Å; T504-E507 WeakPolarHBondContact OG1-CB 3.38Å; T504-E507 PolarHBondContact OG1-N 2.98Å; T504-E508 PolarHBondContact O-N 3.03Å; T504-S629 WeakPolarHBondContact OG1-CA 3.29Å; T504-H632 HydrophobicContact CG2-CB 4.43Å
505	P	83.4	Confident	69.3	Low	88 Å²	88	91.8 Å²	91.8	57%	0.571	47%	0.472	S	S	*	.	H	α-helix	trans	-56.8	-24.3	174.4	-26.7	35.8	0	0	0	113.1	Q509	P505-Q509 WeakPolarHBondContact O-CB 3.36Å; P505-Q509 PolarHBondContact O-N 3.11Å
506	Y	86.9	Confident	71.9	Confident	86 Å²	86	88.1 Å²	88.1	34%	0.337	45%	0.45	S	S	.	.	H	α-helix	trans	-76.9	-38.3	174.9	-52	-67.8	0	0	0	112.5	T504 Q509 L510 K628	T504-Y506 PolarHBondContact O-N 3.38Å; Y506-Q509 PolarHBondContact O-N 2.65Å; Y506-L510 WeakPolarHBondContact O-CD1 3.41Å; Y506-L510 VanDerWaalsContact O-CG 3.3Å; Y506-L510 WeakPolarHBondContact O-CG 3.41Å; Y506-L510 PolarHBondContact O-N 3.34Å; Y506-K628 HydrophobicContact CD1-CB 3.83Å; Y506-K628 HydrophobicContact CD1-CD 3.88Å; Y506-K628 HydrophobicContact CD2-CB 3.46Å; Y506-K628 VanDerWaalsContact CD2-CB 3.46Å; Y506-K628 WeakPolarHBondContact CD2-O 3.33Å; Y506-K628 HydrophobicContact CE1-CB 4.16Å; Y506-K628 HydrophobicContact CE1-CD 3.59Å; Y506-K628 HydrophobicContact CE2-CB 3.82Å; Y506-K628 HydrophobicContact CE2-CD 4.34Å; Y506-K628 HydrophobicContact CG-CB 3.46Å; Y506-K628 VanDerWaalsContact CG-CB 3.46Å; Y506-K628 HydrophobicContact CG-CD 4.38Å
507	E	86.5	Confident	74.4	Confident	49 Å²	49	90.3 Å²	90.3	23%	0.229	45%	0.449	C	S	.	.	H	α-helix	trans	-65.8	-42.1	171.5	-176.2	-166	159.3	0	0	111.5	K503 T504 Q509 L510 H511	K503-E507 VanDerWaalsContact CA-OE2 3.26Å; K503-E507 WeakPolarHBondContact CA-OE2 3Å; K503-E507 WeakPolarHBondContact CG-OE1 3.41Å; T504-E507 PolarHBondContact N-OE2 3.29Å; T504-E507 WeakPolarHBondContact O-CA 3.22Å; T504-E507 WeakPolarHBondContact O-CB 3.42Å; T504-E507 PolarHBondContact O-N 3.36Å; T504-E507 VanDerWaalsContact OG1-CB 3.22Å; T504-E507 WeakPolarHBondContact OG1-CB 3.38Å; T504-E507 PolarHBondContact OG1-N 2.98Å; E507-Q509 VanDerWaalsContact C-N 3.34Å; E507-L510 PolarHBondContact O-N 3.26Å; E507-H511 PolarHBondContact O-N 3.36Å; E507-H511 PolarHBondContact O-ND1 3.28Å; E507-H511 IonicContact OE1-CE1 2.77Å
508	E	85.6	Confident	77	Confident	126 Å²	126	89.7 Å²	89.7	59%	0.589	44%	0.435	S	S	*	.	H	α-helix	trans	-61	-43	172.3	-169.2	-173.2	159	0	0	111.3	T504 L510 H511 R512	T504-E508 PolarHBondContact O-N 3.03Å; E508-L510 VanDerWaalsContact C-N 3.34Å; E508-L510 PolarHBondContact O-N 3.11Å; E508-H511 PolarHBondContact O-N 2.96Å; E508-R512 WeakPolarHBondContact O-CB 3.48Å; E508-R512 PolarHBondContact O-N 3.18Å
509	Q	85.7	Confident	79.5	Confident	70 Å²	70	85.5 Å²	85.5	33%	0.327	42%	0.418	S	S	.	.	H	α-helix	trans	-63.6	-36.2	175.3	-179.6	58.7	82.6	0	0	112.8	P505 Y506 E507 C513	P505-Q509 WeakPolarHBondContact O-CB 3.36Å; P505-Q509 PolarHBondContact O-N 3.11Å; Y506-Q509 PolarHBondContact O-N 2.65Å; E507-Q509 VanDerWaalsContact C-N 3.34Å; Q509-C513 PolarHBondContact NE2-SG 3.38Å; Q509-C513 PolarHBondContact O-N 2.94Å; Q509-C513 PolarHBondContact O-SG 3.47Å
510	L	87.6	Confident	81.7	Confident	19 Å²	19	80.1 Å²	80.1	10%	0.099	39%	0.385	C	S	.	.	H	α-helix	trans	-67.9	-47.5	175.5	-75.6	160	0	0	0	111.8	Y506 E507 E508 R512 C513 E514 Y622 A625 S629	Y506-L510 WeakPolarHBondContact O-CD1 3.41Å; Y506-L510 VanDerWaalsContact O-CG 3.3Å; Y506-L510 WeakPolarHBondContact O-CG 3.41Å; Y506-L510 PolarHBondContact O-N 3.34Å; E507-L510 PolarHBondContact O-N 3.26Å; E508-L510 VanDerWaalsContact C-N 3.34Å; E508-L510 PolarHBondContact O-N 3.11Å; L510-R512 VanDerWaalsContact C-N 3.29Å; L510-R512 PolarHBondContact O-N 3.38Å; L510-C513 WeakPolarHBondContact O-CB 3.39Å; L510-C513 PolarHBondContact O-N 3.24Å; L510-C513 VanDerWaalsContact O-N 3.16Å; L510-E514 PolarHBondContact O-N 3.19Å; L510-Y622 HydrophobicContact CD2-CD1 3.4Å; L510-Y622 HydrophobicContact CD2-CD2 3.96Å; L510-Y622 HydrophobicContact CD2-CE1 3.59Å; L510-Y622 HydrophobicContact CD2-CE2 4.13Å; L510-Y622 HydrophobicContact CD2-CG 3.6Å; L510-A625 HydrophobicContact CD1-CB 4.13Å; L510-A625 HydrophobicContact CD2-CB 4.05Å; L510-A625 HydrophobicContact CG-CB 3.81Å; L510-S629 WeakPolarHBondContact CD1-OG 3.33Å
511	H	88.6	Confident	84	Confident	89 Å²	89	80.1 Å²	80.1	41%	0.412	38%	0.379	S	S	.	.	H	α-helix	trans	-57.1	-44.7	174.3	-69.5	124.6	0	0	0	111.3	E507 E508 C513 E514 D515	E507-H511 PolarHBondContact O-N 3.36Å; E507-H511 PolarHBondContact O-ND1 3.28Å; E507-H511 IonicContact OE1-CE1 2.77Å; E508-H511 PolarHBondContact O-N 2.96Å; H511-C513 VanDerWaalsContact C-N 3.34Å; H511-C513 PolarHBondContact O-N 3.35Å; H511-E514 WeakPolarHBondContact O-CB 3.48Å; H511-E514 PolarHBondContact O-N 2.88Å; H511-D515 PolarHBondContact O-N 2.93Å
512	R	88.6	Confident	85.9	Confident	144 Å²	144	78.5 Å²	78.5	54%	0.543	37%	0.366	S	S	.	.	H	α-helix	trans	-59.5	-40.6	175.7	-171.3	-173.6	-171.9	108.9	11.7	113.2	E508 L510 E514 D515 E516	E508-R512 WeakPolarHBondContact O-CB 3.48Å; E508-R512 PolarHBondContact O-N 3.18Å; L510-R512 VanDerWaalsContact C-N 3.29Å; L510-R512 PolarHBondContact O-N 3.38Å; R512-E514 VanDerWaalsContact C-N 3.3Å; R512-D515 PolarHBondContact O-N 3.04Å; R512-E516 IonicContact NE-OE1 2.75Å; R512-E516 PolarHBondContact NE-OE1 2.68Å; R512-E516 WeakPolarHBondContact O-CB 3.5Å; R512-E516 WeakPolarHBondContact O-CG 3.48Å; R512-E516 PolarHBondContact O-N 3.45Å
513	C	89.2	Confident	87.7	Confident	1 Å²	1	70.4 Å²	70.4	1%	0.007	33%	0.331	C	S	.	.	H	α-helix	trans	-64.6	-35.3	175	-71	0	0	0	0	112.1	Q509 L510 H511 R517 Q621 Y622	Q509-C513 PolarHBondContact NE2-SG 3.38Å; Q509-C513 PolarHBondContact O-N 2.94Å; Q509-C513 PolarHBondContact O-SG 3.47Å; L510-C513 WeakPolarHBondContact O-CB 3.39Å; L510-C513 PolarHBondContact O-N 3.24Å; L510-C513 VanDerWaalsContact O-N 3.16Å; H511-C513 VanDerWaalsContact C-N 3.34Å; H511-C513 PolarHBondContact O-N 3.35Å; C513-R517 WeakPolarHBondContact O-CB 3.44Å; C513-R517 PolarHBondContact O-N 3.12Å; C513-R517 VanDerWaalsContact O-N 3.1Å; C513-Q621 PolarHBondContact SG-OE1 2.74Å; C513-Q621 VanDerWaalsContact SG-OE1 3.36Å; C513-Y622 HydrophobicContact CB-CD2 4.09Å; C513-Y622 HydrophobicContact CB-CE2 3.74Å
514	E	89.9	Confident	88.9	Confident	63 Å²	63	66.1 Å²	66.1	29%	0.294	31%	0.313	S	S	.	.	H	α-helix	trans	-71.4	-41.6	176	-168.8	59.4	-137.7	0	0	111.9	L510 H511 R512 R517 F518 Y622	L510-E514 PolarHBondContact O-N 3.19Å; H511-E514 WeakPolarHBondContact O-CB 3.48Å; H511-E514 PolarHBondContact O-N 2.88Å; R512-E514 VanDerWaalsContact C-N 3.3Å; E514-R517 WeakPolarHBondContact O-CB 3.42Å; E514-R517 PolarHBondContact O-N 3.26Å; E514-R517 IonicContact OE1-CZ 2.67Å; E514-R517 VanDerWaalsContact OE1-CZ 3.23Å; E514-R517 IonicContact OE1-NE 3.92Å; E514-R517 PolarHBondContact OE1-NE 3.23Å; E514-R517 IonicContact OE1-NH2 3.26Å; E514-R517 PolarHBondContact OE1-NH2 3.14Å; E514-R517 IonicContact OE2-CZ 2.7Å; E514-R517 IonicContact OE2-NE 3.36Å; E514-R517 PolarHBondContact OE2-NE 3.3Å; E514-R517 IonicContact OE2-NH2 3.78Å; E514-R517 PolarHBondContact OE2-NH2 2.87Å; E514-F518 WeakPolarHBondContact O-CB 3.33Å; E514-F518 PolarHBondContact O-N 2.96Å; E514-Y622 PolarHBondContact OE2-OH 3.23Å
515	D	90.7	Very high	89.5	Confident	106 Å²	106	69.9 Å²	69.9	57%	0.567	33%	0.329	S	S	*	.	H	α-helix	trans	-60.7	-45.7	174	-69.8	-28.9	0	0	0	111.6	H511 R512 R517 F518 E519	H511-D515 PolarHBondContact O-N 2.93Å; R512-D515 PolarHBondContact O-N 3.04Å; D515-R517 VanDerWaalsContact C-N 3.28Å; D515-R517 PolarHBondContact O-N 2.7Å; D515-F518 PolarHBondContact O-N 2.79Å; D515-E519 PolarHBondContact O-N 2.98Å
516	E	90.4	Very high	90	Very high	78 Å²	78	67 Å²	67	36%	0.364	31%	0.31	S	S	.	.	H	α-helix	trans	-61.6	-35.2	175.7	-75.4	177.7	-167.3	0	0	112.3	R512 L520 W618	R512-E516 IonicContact NE-OE1 2.75Å; R512-E516 PolarHBondContact NE-OE1 2.68Å; R512-E516 WeakPolarHBondContact O-CB 3.5Å; R512-E516 WeakPolarHBondContact O-CG 3.48Å; R512-E516 PolarHBondContact O-N 3.45Å; E516-L520 PolarHBondContact O-N 3.41Å; E516-W618 VanDerWaalsContact C-CZ2 3.5Å; E516-W618 HydrophobicContact CB-CZ2 3.86Å; E516-W618 WeakPolarHBondContact O-CZ2 3.48Å; E516-W618 PolarHBondContact OE2-NE1 3.15Å
517	R	89.7	Confident	90.3	Very high	101 Å²	101	63 Å²	63	38%	0.381	30%	0.295	S	S	.	.	H	α-helix	trans	-70	-48.9	174.6	-175.7	174.7	75.7	166.3	2.6	111.8	C513 E514 D515 E519 L520 D521 W618	C513-R517 WeakPolarHBondContact O-CB 3.44Å; C513-R517 PolarHBondContact O-N 3.12Å; C513-R517 VanDerWaalsContact O-N 3.1Å; E514-R517 WeakPolarHBondContact O-CB 3.42Å; E514-R517 PolarHBondContact O-N 3.26Å; E514-R517 IonicContact OE1-CZ 2.67Å; E514-R517 VanDerWaalsContact OE1-CZ 3.23Å; E514-R517 IonicContact OE1-NE 3.92Å; E514-R517 PolarHBondContact OE1-NE 3.23Å; E514-R517 IonicContact OE1-NH2 3.26Å; E514-R517 PolarHBondContact OE1-NH2 3.14Å; E514-R517 IonicContact OE2-CZ 2.7Å; E514-R517 IonicContact OE2-NE 3.36Å; E514-R517 PolarHBondContact OE2-NE 3.3Å; E514-R517 IonicContact OE2-NH2 3.78Å; E514-R517 PolarHBondContact OE2-NH2 2.87Å; D515-R517 VanDerWaalsContact C-N 3.28Å; D515-R517 PolarHBondContact O-N 2.7Å; R517-E519 PolarHBondContact O-N 3.41Å; R517-L520 PolarHBondContact O-N 2.86Å; R517-D521 PolarHBondContact O-N 3.41Å; R517-W618 HydrophobicContact CB-CD2 4.39Å; R517-W618 HydrophobicContact CB-CE3 4.08Å; R517-W618 HydrophobicContact CB-CH2 4.14Å; R517-W618 HydrophobicContact CB-CZ2 4.45Å; R517-W618 HydrophobicContact CB-CZ3 3.95Å; R517-W618 HydrophobicContact CG-CE3 4.16Å; R517-W618 HydrophobicContact CG-CH2 4.48Å; R517-W618 HydrophobicContact CG-CZ3 3.92Å
518	F	91.9	Very high	90.7	Very high	124 Å²	124	62.6 Å²	62.6	54%	0.544	29%	0.294	S	S	.	.	H	α-helix	trans	-58.5	-46.5	179.1	175.7	-100.3	0	0	0	111.6	E514 D515 L520 D521 V522	E514-F518 WeakPolarHBondContact O-CB 3.33Å; E514-F518 PolarHBondContact O-N 2.96Å; D515-F518 PolarHBondContact O-N 2.79Å; F518-L520 VanDerWaalsContact C-N 3.32Å; F518-L520 PolarHBondContact O-N 2.77Å; F518-D521 PolarHBondContact O-N 2.93Å; F518-V522 HydrophobicContact CD1-CG2 4.11Å; F518-V522 HydrophobicContact CD2-CG2 4.27Å; F518-V522 HydrophobicContact CE1-CG2 3.69Å; F518-V522 HydrophobicContact CE2-CG2 3.87Å; F518-V522 HydrophobicContact CG-CG2 4.38Å; F518-V522 HydrophobicContact CZ-CG2 3.56Å; F518-V522 WeakPolarHBondContact O-CB 3.43Å; F518-V522 VanDerWaalsContact O-CG2 3.31Å; F518-V522 WeakPolarHBondContact O-CG2 3.43Å; F518-V522 PolarHBondContact O-N 3.47Å
519	E	91.1	Very high	91.1	Very high	87 Å²	87	57.9 Å²	57.9	41%	0.407	28%	0.276	S	S	.	.	H	α-helix	trans	-60.3	-38.9	176.1	-88.2	-62.8	131.2	0	0	112.6	D515 R517 V523	D515-E519 PolarHBondContact O-N 2.98Å; R517-E519 PolarHBondContact O-N 3.41Å; E519-V523 WeakPolarHBondContact O-CB 3.2Å; E519-V523 WeakPolarHBondContact O-CG2 3.43Å; E519-V523 PolarHBondContact O-N 3.25Å; E519-V523 VanDerWaalsContact O-N 3.11Å
520	L	90.9	Very high	91.5	Very high	16 Å²	16	54.6 Å²	54.6	8%	0.084	26%	0.261	C	S	.	.	H	α-helix	trans	-66.7	-41.8	176.3	-176.2	57.7	0	0	0	112.2	E516 R517 F518 V523 L524 Q611 F614 W618	E516-L520 PolarHBondContact O-N 3.41Å; R517-L520 PolarHBondContact O-N 2.86Å; F518-L520 VanDerWaalsContact C-N 3.32Å; F518-L520 PolarHBondContact O-N 2.77Å; L520-V523 WeakPolarHBondContact O-CB 3.47Å; L520-V523 PolarHBondContact O-N 3.45Å; L520-L524 HydrophobicContact CG-CD1 4.21Å; L520-L524 WeakPolarHBondContact O-CG 3.49Å; L520-L524 PolarHBondContact O-N 2.96Å; L520-Q611 HydrophobicContact CD2-CB 3.9Å; L520-Q611 HydrophobicContact CD2-CG 3.84Å; L520-F614 HydrophobicContact CD2-CD2 3.74Å; L520-F614 HydrophobicContact CD2-CE2 4.48Å; L520-W618 HydrophobicContact CB-CH2 4.01Å; L520-W618 HydrophobicContact CD2-CH2 3.64Å; L520-W618 HydrophobicContact CD2-CZ3 4.17Å; L520-W618 HydrophobicContact CG-CH2 4.48Å
521	D	92.6	Very high	91.8	Very high	68 Å²	68	54.1 Å²	54.1	36%	0.364	26%	0.258	S	S	.	.	H	α-helix	trans	-70.9	-39	-179.5	-75.4	-7.9	0	0	0	112.1	R517 F518 V523 L524 E525 Q611	R517-D521 PolarHBondContact O-N 3.41Å; F518-D521 PolarHBondContact O-N 2.93Å; D521-V523 VanDerWaalsContact C-N 3.25Å; D521-V523 PolarHBondContact O-N 3.45Å; D521-L524 PolarHBondContact O-N 2.88Å; D521-E525 PolarHBondContact O-N 3.45Å; D521-Q611 PolarHBondContact OD1-NE2 2.92Å
522	V	91.1	Very high	92.1	Very high	53 Å²	53	56.1 Å²	56.1	32%	0.321	26%	0.262	S	S	.	.	H	α-helix	trans	-56.4	-41.1	169.4	166.3	0	0	0	0	111	F518 T526	F518-V522 HydrophobicContact CD1-CG2 4.11Å; F518-V522 HydrophobicContact CD2-CG2 4.27Å; F518-V522 HydrophobicContact CE1-CG2 3.69Å; F518-V522 HydrophobicContact CE2-CG2 3.87Å; F518-V522 HydrophobicContact CG-CG2 4.38Å; F518-V522 HydrophobicContact CZ-CG2 3.56Å; F518-V522 WeakPolarHBondContact O-CB 3.43Å; F518-V522 VanDerWaalsContact O-CG2 3.31Å; F518-V522 WeakPolarHBondContact O-CG2 3.43Å; F518-V522 PolarHBondContact O-N 3.47Å; V522-T526 WeakPolarHBondContact O-CB 3.46Å; V522-T526 PolarHBondContact O-N 3.42Å; V522-T526 PolarHBondContact O-OG1 3.32Å
523	V	92.5	Very high	92.3	Very high	5 Å²	5	50.6 Å²	50.6	3%	0.03	24%	0.244	C	C	.	.	H	α-helix	trans	-69	-40.9	178.1	167.2	0	0	0	0	112.5	K182 E519 L520 D521 N527 W607	K182-V523 HydrophobicContact CD-CG1 4.48Å; E519-V523 WeakPolarHBondContact O-CB 3.2Å; E519-V523 WeakPolarHBondContact O-CG2 3.43Å; E519-V523 PolarHBondContact O-N 3.25Å; E519-V523 VanDerWaalsContact O-N 3.11Å; L520-V523 WeakPolarHBondContact O-CB 3.47Å; L520-V523 PolarHBondContact O-N 3.45Å; D521-V523 VanDerWaalsContact C-N 3.25Å; D521-V523 PolarHBondContact O-N 3.45Å; V523-N527 WeakPolarHBondContact O-CB 3.34Å; V523-N527 PolarHBondContact O-N 3Å; V523-N527 VanDerWaalsContact O-N 3.12Å; V523-W607 HydrophobicContact CG1-CE3 3.9Å; V523-W607 HydrophobicContact CG1-CZ3 3.83Å
524	L	92.7	Very high	92.5	Very high	4 Å²	4	50.6 Å²	50.6	2%	0.021	25%	0.245	C	C	.	.	H	α-helix	trans	-65.3	-50.1	176.7	-75	167	0	0	0	111.5	L520 D521 T526 N527 L528 W607 R608 Q611	L520-L524 HydrophobicContact CG-CD1 4.21Å; L520-L524 WeakPolarHBondContact O-CG 3.49Å; L520-L524 PolarHBondContact O-N 2.96Å; D521-L524 PolarHBondContact O-N 2.88Å; L524-T526 PolarHBondContact O-N 3.21Å; L524-N527 PolarHBondContact O-N 2.88Å; L524-L528 WeakPolarHBondContact O-CB 3.43Å; L524-L528 PolarHBondContact O-N 3.32Å; L524-W607 HydrophobicContact CD2-CB 3.73Å; L524-R608 HydrophobicContact CD2-CG 3.87Å; L524-Q611 HydrophobicContact CD1-CB 4.28Å; L524-Q611 HydrophobicContact CD1-CG 4.04Å
525	E	94.4	Very high	92.7	Very high	90 Å²	90	49.9 Å²	49.9	42%	0.421	24%	0.241	S	C	.	.	H	α-helix	trans	-70.6	-31.7	-178.5	-168.2	59.9	-159.4	0	0	112.2	D521 N527 L528 A529 R532	D521-E525 PolarHBondContact O-N 3.45Å; E525-N527 VanDerWaalsContact C-N 3.33Å; E525-N527 PolarHBondContact O-N 3.44Å; E525-L528 PolarHBondContact O-N 3.29Å; E525-A529 WeakPolarHBondContact O-CB 3.37Å; E525-A529 PolarHBondContact O-N 3.28Å; E525-R532 IonicContact OE1-CZ 3.13Å; E525-R532 VanDerWaalsContact OE1-CZ 3.28Å; E525-R532 IonicContact OE1-NH1 2.85Å; E525-R532 PolarHBondContact OE1-NH1 3.42Å; E525-R532 IonicContact OE1-NH2 2.73Å; E525-R532 PolarHBondContact OE1-NH2 3.1Å; E525-R532 IonicContact OE2-NH2 3.11Å; E525-R532 PolarHBondContact OE2-NH2 3.06Å
526	T	92.9	Very high	92.7	Very high	29 Å²	29	47.5 Å²	47.5	18%	0.178	23%	0.233	C	C	.	.	H	α-helix	trans	-61.1	-41.3	170.9	-64.6	0	0	0	0	111.9	V522 L524 T530 I565 R568 A569	V522-T526 WeakPolarHBondContact O-CB 3.46Å; V522-T526 PolarHBondContact O-N 3.42Å; V522-T526 PolarHBondContact O-OG1 3.32Å; L524-T526 PolarHBondContact O-N 3.21Å; T526-T530 PolarHBondContact O-N 2.94Å; T526-T530 PolarHBondContact O-OG1 2.9Å; T526-I565 HydrophobicContact CG2-CG2 4.08Å; T526-R568 HydrophobicContact CG2-CB 4.34Å; T526-A569 HydrophobicContact CG2-CB 4.17Å
527	N	94.8	Very high	92.8	Very high	2 Å²	2	43.9 Å²	43.9	1%	0.011	22%	0.216	C	C	.	.	H	α-helix	trans	-69.1	-47.1	176.5	-166.7	57.9	0	0	0	111.1	V523 L524 E525 A529 T530 I531 L600 E604 W607	V523-N527 WeakPolarHBondContact O-CB 3.34Å; V523-N527 PolarHBondContact O-N 3Å; V523-N527 VanDerWaalsContact O-N 3.12Å; L524-N527 PolarHBondContact O-N 2.88Å; E525-N527 VanDerWaalsContact C-N 3.33Å; E525-N527 PolarHBondContact O-N 3.44Å; N527-A529 PolarHBondContact O-N 3.14Å; N527-T530 WeakPolarHBondContact O-CB 3.4Å; N527-T530 PolarHBondContact O-N 3.4Å; N527-T530 VanDerWaalsContact O-N 3.15Å; N527-I531 WeakPolarHBondContact O-CG1 3.32Å; N527-I531 PolarHBondContact O-N 3.07Å; N527-L600 PolarHBondContact ND2-O 3.11Å; N527-L600 WeakPolarHBondContact OD1-CD2 3.05Å; N527-E604 PolarHBondContact ND2-OE2 3.31Å; N527-W607 HydrophobicContact CB-CE3 4.46Å; N527-W607 HydrophobicContact CB-CZ3 4.01Å
528	L	94.8	Very high	92.9	Very high	40 Å²	40	42.4 Å²	42.4	21%	0.209	21%	0.213	C	C	.	.	H	α-helix	trans	-64.6	-40.1	-179.5	-172	56.1	0	0	0	112.8	L524 E525 T530 I531 R532	L524-L528 WeakPolarHBondContact O-CB 3.43Å; L524-L528 PolarHBondContact O-N 3.32Å; E525-L528 PolarHBondContact O-N 3.29Å; L528-T530 VanDerWaalsContact C-N 3.31Å; L528-T530 PolarHBondContact O-N 2.99Å; L528-I531 WeakPolarHBondContact O-CB 3.38Å; L528-I531 PolarHBondContact O-N 3.06Å; L528-R532 WeakPolarHBondContact O-CG 3.35Å; L528-R532 PolarHBondContact O-N 2.59Å
529	A	93.1	Very high	92.9	Very high	26 Å²	26	42 Å²	42	22%	0.215	21%	0.212	C	C	.	.	H	α-helix	trans	-60.4	-40.8	172.2	0	0	0	0	0	111.9	E525 N527 R532 V533 I565	E525-A529 WeakPolarHBondContact O-CB 3.37Å; E525-A529 PolarHBondContact O-N 3.28Å; N527-A529 PolarHBondContact O-N 3.14Å; A529-R532 PolarHBondContact O-N 2.82Å; A529-V533 WeakPolarHBondContact O-CG2 3.5Å; A529-V533 PolarHBondContact O-N 2.94Å; A529-V533 VanDerWaalsContact O-N 3.1Å; A529-I565 HydrophobicContact CB-CG2 4.26Å
530	T	93.1	Very high	92.7	Very high	1 Å²	1	43.1 Å²	43.1	1%	0.006	22%	0.215	C	C	.	.	H	α-helix	trans	-67.3	-40.1	176.5	-56	0	0	0	0	111.7	T526 N527 L528 V533 L534 Q566 A569 L600	T526-T530 PolarHBondContact O-N 2.94Å; T526-T530 PolarHBondContact O-OG1 2.9Å; N527-T530 WeakPolarHBondContact O-CB 3.4Å; N527-T530 PolarHBondContact O-N 3.4Å; N527-T530 VanDerWaalsContact O-N 3.15Å; L528-T530 VanDerWaalsContact C-N 3.31Å; L528-T530 PolarHBondContact O-N 2.99Å; T530-V533 PolarHBondContact O-N 3.47Å; T530-L534 HydrophobicContact CG2-CD1 4.14Å; T530-L534 PolarHBondContact O-N 3.08Å; T530-Q566 HydrophobicContact CG2-CB 4.3Å; T530-Q566 HydrophobicContact CG2-CG 4.29Å; T530-A569 HydrophobicContact CG2-CB 3.93Å; T530-A569 WeakPolarHBondContact OG1-CB 3.41Å; T530-L600 HydrophobicContact CG2-CD1 4.01Å; T530-L600 HydrophobicContact CG2-CD2 4.36Å
531	I	94.4	Very high	92.6	Very high	9 Å²	9	42.7 Å²	42.7	5%	0.046	21%	0.213	C	C	.	.	H	α-helix	trans	-59	-50.3	172.1	-71.2	165.7	0	0	0	110.7	N527 L528 V533 L534 E535 L597 L600 K601 E604	N527-I531 WeakPolarHBondContact O-CG1 3.32Å; N527-I531 PolarHBondContact O-N 3.07Å; L528-I531 WeakPolarHBondContact O-CB 3.38Å; L528-I531 PolarHBondContact O-N 3.06Å; I531-V533 VanDerWaalsContact C-N 3.29Å; I531-V533 PolarHBondContact O-N 3.1Å; I531-L534 PolarHBondContact O-N 3.01Å; I531-E535 HydrophobicContact CG2-CG 4.45Å; I531-E535 WeakPolarHBondContact O-CB 3.21Å; I531-E535 WeakPolarHBondContact O-CG 3.4Å; I531-E535 PolarHBondContact O-N 3.41Å; I531-L597 HydrophobicContact CB-CD1 4.3Å; I531-L597 HydrophobicContact CG1-CD1 4.34Å; I531-L597 HydrophobicContact CG2-CD1 3.98Å; I531-L600 HydrophobicContact CD1-CB 4.13Å; I531-L600 HydrophobicContact CG1-CB 3.69Å; I531-K601 HydrophobicContact CD1-CG 4.13Å; I531-K601 HydrophobicContact CG1-CG 4.36Å; I531-K601 HydrophobicContact CG2-CG 4.15Å; I531-E604 HydrophobicContact CD1-CB 3.9Å; I531-E604 HydrophobicContact CD1-CG 4.18Å
532	R	94.9	Very high	92.5	Very high	131 Å²	131	43.8 Å²	43.8	49%	0.494	23%	0.226	S	C	.	.	H	α-helix	trans	-57.1	-40.7	179	-69.9	173.5	-167.2	145.2	15.3	112	E525 L528 A529 S536	E525-R532 IonicContact OE1-CZ 3.13Å; E525-R532 VanDerWaalsContact OE1-CZ 3.28Å; E525-R532 IonicContact OE1-NH1 2.85Å; E525-R532 PolarHBondContact OE1-NH1 3.42Å; E525-R532 IonicContact OE1-NH2 2.73Å; E525-R532 PolarHBondContact OE1-NH2 3.1Å; E525-R532 IonicContact OE2-NH2 3.11Å; E525-R532 PolarHBondContact OE2-NH2 3.06Å; L528-R532 WeakPolarHBondContact O-CG 3.35Å; L528-R532 PolarHBondContact O-N 2.59Å; A529-R532 PolarHBondContact O-N 2.82Å; R532-S536 PolarHBondContact O-N 3.38Å
533	V	93.6	Very high	92.4	Very high	28 Å²	28	51.6 Å²	51.6	17%	0.17	25%	0.249	C	C	.	.	H	α-helix	trans	-69.4	-49.8	177.6	167.9	0	0	0	0	111.9	A529 T530 I531 E535 S536 V537 Q566	A529-V533 WeakPolarHBondContact O-CG2 3.5Å; A529-V533 PolarHBondContact O-N 2.94Å; A529-V533 VanDerWaalsContact O-N 3.1Å; T530-V533 PolarHBondContact O-N 3.47Å; I531-V533 VanDerWaalsContact C-N 3.29Å; I531-V533 PolarHBondContact O-N 3.1Å; V533-E535 VanDerWaalsContact C-N 3.31Å; V533-E535 PolarHBondContact O-N 2.98Å; V533-S536 WeakPolarHBondContact O-CA 3.33Å; V533-S536 VanDerWaalsContact O-CB 3.3Å; V533-S536 WeakPolarHBondContact O-CB 3.45Å; V533-S536 PolarHBondContact O-N 3.21Å; V533-V537 PolarHBondContact O-N 2.87Å; V533-Q566 HydrophobicContact CG1-CG 4.47Å
534	L	92.4	Very high	92.2	Very high	2 Å²	2	54.3 Å²	54.3	1%	0.01	26%	0.264	C	S	.	.	H	α-helix	trans	-68.9	-28	-179.2	-69.8	-179.6	0	0	0	112.9	T530 I531 V537 Q538 V593 V596 L597 L600	T530-L534 HydrophobicContact CG2-CD1 4.14Å; T530-L534 PolarHBondContact O-N 3.08Å; I531-L534 PolarHBondContact O-N 3.01Å; L534-V537 PolarHBondContact O-N 3.19Å; L534-Q538 WeakPolarHBondContact O-CB 2.92Å; L534-Q538 PolarHBondContact O-N 2.66Å; L534-V593 HydrophobicContact CB-CG1 4.22Å; L534-V593 HydrophobicContact CD2-CG1 4.36Å; L534-V593 HydrophobicContact CD2-CG2 4.34Å; L534-V596 HydrophobicContact CD1-CG1 4.32Å; L534-L597 HydrophobicContact CB-CD1 4.14Å; L534-L600 HydrophobicContact CD1-CD1 3.56Å
535	E	94.4	Very high	92	Very high	48 Å²	48	56.4 Å²	56.4	22%	0.224	28%	0.278	C	S	.	.	H	α-helix	trans	-62.3	-42.7	165.8	-81.5	-162.6	179.4	0	0	112.7	I531 V533 V537 Q538 K539 L597 K601	I531-E535 HydrophobicContact CG2-CG 4.45Å; I531-E535 WeakPolarHBondContact O-CB 3.21Å; I531-E535 WeakPolarHBondContact O-CG 3.4Å; I531-E535 PolarHBondContact O-N 3.41Å; V533-E535 VanDerWaalsContact C-N 3.31Å; V533-E535 PolarHBondContact O-N 2.98Å; E535-V537 VanDerWaalsContact C-N 3.32Å; E535-Q538 PolarHBondContact O-N 3.03Å; E535-K539 WeakPolarHBondContact O-CB 3.4Å; E535-K539 WeakPolarHBondContact O-CD 3.2Å; E535-K539 VanDerWaalsContact O-CG 3.26Å; E535-K539 WeakPolarHBondContact O-CG 3.23Å; E535-K539 PolarHBondContact O-N 3.46Å; E535-K539 IonicContact OE2-NZ 3.58Å; E535-K539 PolarHBondContact OE2-NZ 2.87Å; E535-L597 HydrophobicContact CG-CD1 4.18Å; E535-L597 HydrophobicContact CG-CD2 3.97Å; E535-K601 WeakPolarHBondContact OE1-CE 3.3Å; E535-K601 IonicContact OE1-NZ 3.54Å; E535-K601 PolarHBondContact OE1-NZ 3.39Å
536	S	91.6	Very high	91.5	Very high	55 Å²	55	57 Å²	57	39%	0.385	29%	0.29	S	S	.	.	H	α-helix	trans	-63.1	-41	177.5	-171.6	0	0	0	0	110.9	R532 V533 K540	R532-S536 PolarHBondContact O-N 3.38Å; V533-S536 WeakPolarHBondContact O-CA 3.33Å; V533-S536 VanDerWaalsContact O-CB 3.3Å; V533-S536 WeakPolarHBondContact O-CB 3.45Å; V533-S536 PolarHBondContact O-N 3.21Å; S536-K540 VanDerWaalsContact O-CG 3.31Å; S536-K540 WeakPolarHBondContact O-CG 3.44Å; S536-K540 PolarHBondContact O-N 2.99Å; S536-K540 VanDerWaalsContact O-N 3.12Å
537	V	91	Very high	91	Very high	2 Å²	2	62.4 Å²	62.4	1%	0.012	31%	0.313	C	S	.	.	H	α-helix	trans	-62.3	-47.3	171.6	173.6	0	0	0	0	111.5	V533 L534 E535 K539 K540 L541 F552 L554 V593	V533-V537 PolarHBondContact O-N 2.87Å; L534-V537 PolarHBondContact O-N 3.19Å; E535-V537 VanDerWaalsContact C-N 3.32Å; V537-K539 VanDerWaalsContact C-N 3.35Å; V537-K539 PolarHBondContact O-N 3.18Å; V537-K540 WeakPolarHBondContact O-CB 3.45Å; V537-K540 PolarHBondContact O-N 2.66Å; V537-K540 VanDerWaalsContact O-N 3.1Å; V537-L541 HydrophobicContact CG1-CD1 3.88Å; V537-L541 HydrophobicContact CG1-CG 4.46Å; V537-L541 PolarHBondContact O-N 3.31Å; V537-F552 HydrophobicContact CG1-CE1 4.33Å; V537-L554 HydrophobicContact CG1-CD1 4.18Å; V537-L554 HydrophobicContact CG1-CD2 3.92Å; V537-L554 HydrophobicContact CG1-CG 4.49Å; V537-L554 HydrophobicContact CG2-CD2 3.95Å; V537-V593 HydrophobicContact CG1-CG1 4.42Å; V537-V593 HydrophobicContact CG1-CG2 4.07Å
538	Q	91.8	Very high	90.6	Very high	71 Å²	71	66 Å²	66	33%	0.332	33%	0.332	S	S	.	.	H	α-helix	trans	-61.8	-41.4	179.2	-165.2	-177	33.5	0	0	112.2	L534 E535 K540 L541 S542 V593 L597	L534-Q538 WeakPolarHBondContact O-CB 2.92Å; L534-Q538 PolarHBondContact O-N 2.66Å; E535-Q538 PolarHBondContact O-N 3.03Å; Q538-K540 VanDerWaalsContact C-N 3.26Å; Q538-K540 PolarHBondContact O-N 2.82Å; Q538-L541 PolarHBondContact O-N 2.69Å; Q538-S542 WeakPolarHBondContact O-CB 3.34Å; Q538-S542 PolarHBondContact O-N 3.5Å; Q538-S542 PolarHBondContact O-OG 2.75Å; Q538-V593 HydrophobicContact CB-CG1 4.18Å; Q538-L597 HydrophobicContact CB-CD2 4.49Å; Q538-L597 VanDerWaalsContact OE1-CD2 3.25Å
539	K	92.2	Very high	90.1	Very high	116 Å²	116	66.9 Å²	66.9	50%	0.504	34%	0.335	S	S	.	.	H	α-helix	trans	-67.3	-20.9	175.5	-72.8	162.3	178.9	159.6	0	113.4	E535 V537 R543	E535-K539 WeakPolarHBondContact O-CB 3.4Å; E535-K539 WeakPolarHBondContact O-CD 3.2Å; E535-K539 VanDerWaalsContact O-CG 3.26Å; E535-K539 WeakPolarHBondContact O-CG 3.23Å; E535-K539 PolarHBondContact O-N 3.46Å; E535-K539 IonicContact OE2-NZ 3.58Å; E535-K539 PolarHBondContact OE2-NZ 2.87Å; V537-K539 VanDerWaalsContact C-N 3.35Å; V537-K539 PolarHBondContact O-N 3.18Å; K539-R543 VanDerWaalsContact O-CD 3.32Å; K539-R543 WeakPolarHBondContact O-CD 2.92Å; K539-R543 WeakPolarHBondContact O-CG 3.19Å; K539-R543 PolarHBondContact O-NE 3.14Å
540	K	88.4	Confident	89.5	Confident	110 Å²	110	73 Å²	73	48%	0.478	36%	0.36	S	S	.	.	H	α-helix	trans	-81.1	-49.2	169.7	-71.1	168	-176	178.8	0	110.8	S536 V537 Q538 S542 R543	S536-K540 VanDerWaalsContact O-CG 3.31Å; S536-K540 WeakPolarHBondContact O-CG 3.44Å; S536-K540 PolarHBondContact O-N 2.99Å; S536-K540 VanDerWaalsContact O-N 3.12Å; V537-K540 WeakPolarHBondContact O-CB 3.45Å; V537-K540 PolarHBondContact O-N 2.66Å; V537-K540 VanDerWaalsContact O-N 3.1Å; Q538-K540 VanDerWaalsContact C-N 3.26Å; Q538-K540 PolarHBondContact O-N 2.82Å; K540-S542 VanDerWaalsContact C-N 3.31Å; K540-S542 PolarHBondContact O-N 3.49Å; K540-R543 WeakPolarHBondContact O-CB 3.41Å; K540-R543 PolarHBondContact O-N 2.76Å
541	L	88.6	Confident	89.1	Confident	7 Å²	7	81.9 Å²	81.9	4%	0.037	39%	0.393	C	S	.	.	H	α-helix	trans	-54	-45.6	176.8	-77.1	162.9	0	0	0	111.9	V537 Q538 R543 L544 Q549 F552 P589 A590 V593	V537-L541 HydrophobicContact CG1-CD1 3.88Å; V537-L541 HydrophobicContact CG1-CG 4.46Å; V537-L541 PolarHBondContact O-N 3.31Å; Q538-L541 PolarHBondContact O-N 2.69Å; L541-R543 PolarHBondContact O-N 3.06Å; L541-L544 PolarHBondContact O-N 2.97Å; L541-L544 VanDerWaalsContact O-N 3.09Å; L541-Q549 HydrophobicContact CD2-CG 4.39Å; L541-Q549 WeakPolarHBondContact O-CG 3.4Å; L541-Q549 PolarHBondContact O-NE2 3.27Å; L541-F552 HydrophobicContact CD2-CB 4.09Å; L541-F552 HydrophobicContact CD2-CD1 3.62Å; L541-F552 HydrophobicContact CD2-CE1 4.3Å; L541-F552 HydrophobicContact CD2-CG 3.97Å; L541-F552 HydrophobicContact CG-CD1 4.27Å; L541-F552 HydrophobicContact CG-CE1 4.48Å; L541-P589 HydrophobicContact CD1-CB 4.32Å; L541-A590 HydrophobicContact CD2-CB 4.36Å; L541-V593 HydrophobicContact CD1-CB 4.49Å
542	S	89	Confident	88.7	Confident	91 Å²	91	84.2 Å²	84.2	64%	0.636	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.3	4.2	179.3	74.8	0	0	0	0	115.1	Q538 K540	Q538-S542 WeakPolarHBondContact O-CB 3.34Å; Q538-S542 PolarHBondContact O-N 3.5Å; Q538-S542 PolarHBondContact O-OG 2.75Å; K540-S542 VanDerWaalsContact C-N 3.31Å; K540-S542 PolarHBondContact O-N 3.49Å
543	R	90.2	Very high	88.4	Confident	216 Å²	216	84.1 Å²	84.1	82%	0.815	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.8	-6.2	174.4	-65.2	174.6	177.8	-171.7	-2.1	113	K539 K540 L541	K539-R543 VanDerWaalsContact O-CD 3.32Å; K539-R543 WeakPolarHBondContact O-CD 2.92Å; K539-R543 WeakPolarHBondContact O-CG 3.19Å; K539-R543 PolarHBondContact O-NE 3.14Å; K540-R543 WeakPolarHBondContact O-CB 3.41Å; K540-R543 PolarHBondContact O-N 2.76Å; L541-R543 PolarHBondContact O-N 3.06Å
544	L	88.4	Confident	88.1	Confident	63 Å²	63	83.7 Å²	83.7	33%	0.33	40%	0.399	S	S	.	.	S	Bend	trans	-91	155.7	178.1	-69.5	175.1	0	0	0	110.6	L541 D548 Q549 F552	L541-L544 PolarHBondContact O-N 2.97Å; L541-L544 VanDerWaalsContact O-N 3.09Å; L544-D548 HydrophobicContact CB-CB 3.97Å; L544-D548 HydrophobicContact CD2-CB 4.29Å; L544-Q549 HydrophobicContact CB-CG 3.88Å; L544-Q549 PolarHBondContact O-NE2 3.44Å; L544-F552 HydrophobicContact CD1-CB 4.32Å; L544-F552 HydrophobicContact CD1-CD2 3.75Å; L544-F552 HydrophobicContact CD1-CE2 4.4Å; L544-F552 HydrophobicContact CD1-CG 4.2Å
545	S	88.8	Confident	87.7	Confident	47 Å²	47	87.5 Å²	87.5	33%	0.329	42%	0.42	S	S	.	.			trans	-65.5	161.7	172.2	80.7	0	0	0	0	111.1	E547 D548 Q549	S545-E547 VanDerWaalsContact C-N 3.25Å; S545-E547 PolarHBondContact O-N 3.5Å; S545-D548 WeakPolarHBondContact CB-OD2 3.33Å; S545-D548 PolarHBondContact O-N 2.79Å; S545-D548 PolarHBondContact OG-N 3.01Å; S545-D548 VanDerWaalsContact OG-N 3.14Å; S545-D548 PolarHBondContact OG-OD2 3.36Å; S545-Q549 VanDerWaalsContact O-CG 3.31Å; S545-Q549 WeakPolarHBondContact O-CG 3.45Å; S545-Q549 PolarHBondContact O-N 3.46Å
546	P	83.3	Confident	87	Confident	104 Å²	104	89.6 Å²	89.6	68%	0.675	43%	0.433	S	S	*	.	H	α-helix	trans	-56.7	-39.6	176.6	-24.9	35.2	0	0	0	112.8	Q549 E550	P546-Q549 PolarHBondContact O-N 3.01Å; P546-E550 PolarHBondContact O-N 2.95Å; P546-E550 VanDerWaalsContact O-N 3.16Å
547	E	82.7	Confident	86.6	Confident	141 Å²	141	88.6 Å²	88.6	66%	0.659	43%	0.425	S	S	*	.	H	α-helix	trans	-68.4	-36.7	179.1	-60.9	177.6	-151.4	0	0	112.1	S545 R551	S545-E547 VanDerWaalsContact C-N 3.25Å; S545-E547 PolarHBondContact O-N 3.5Å; E547-R551 WeakPolarHBondContact O-CG 3.43Å; E547-R551 PolarHBondContact O-N 3.13Å
548	D	86	Confident	86.2	Confident	77 Å²	77	88.6 Å²	88.6	41%	0.412	43%	0.425	S	S	.	.	H	α-helix	trans	-72	-35.3	174.3	-64.9	-52.6	0	0	0	111.9	L544 S545 R551 F552	L544-D548 HydrophobicContact CB-CB 3.97Å; L544-D548 HydrophobicContact CD2-CB 4.29Å; S545-D548 WeakPolarHBondContact CB-OD2 3.33Å; S545-D548 PolarHBondContact O-N 2.79Å; S545-D548 PolarHBondContact OG-N 3.01Å; S545-D548 VanDerWaalsContact OG-N 3.14Å; S545-D548 PolarHBondContact OG-OD2 3.36Å; D548-R551 CarbonylContact O-C 3.56Å; D548-R551 PolarHBondContact O-N 3.47Å; D548-R551 VanDerWaalsContact O-N 3.16Å; D548-F552 WeakPolarHBondContact O-CB 3.35Å; D548-F552 PolarHBondContact O-N 2.83Å
549	Q	83.8	Confident	85.4	Confident	59 Å²	59	86.8 Å²	86.8	28%	0.276	43%	0.426	S	S	.	.	H	α-helix	trans	-63.8	-38.5	176.1	-73.3	176	47.7	0	0	111.9	L541 L544 S545 P546 R551 F552 A590	L541-Q549 HydrophobicContact CD2-CG 4.39Å; L541-Q549 WeakPolarHBondContact O-CG 3.4Å; L541-Q549 PolarHBondContact O-NE2 3.27Å; L544-Q549 HydrophobicContact CB-CG 3.88Å; L544-Q549 PolarHBondContact O-NE2 3.44Å; S545-Q549 VanDerWaalsContact O-CG 3.31Å; S545-Q549 WeakPolarHBondContact O-CG 3.45Å; S545-Q549 PolarHBondContact O-N 3.46Å; P546-Q549 PolarHBondContact O-N 3.01Å; Q549-R551 VanDerWaalsContact C-N 3.28Å; Q549-R551 PolarHBondContact O-N 3.04Å; Q549-F552 PolarHBondContact O-N 3.32Å; Q549-A590 HydrophobicContact CB-CB 4.33Å
550	E	81.1	Confident	84.9	Confident	156 Å²	156	82.2 Å²	82.2	73%	0.729	41%	0.411	S	S	*	.	H	α-helix	trans	-67.8	-26.7	173.4	-73.6	-159.5	146.6	0	0	113.2	P546 R553	P546-E550 PolarHBondContact O-N 2.95Å; P546-E550 VanDerWaalsContact O-N 3.16Å; E550-R553 VanDerWaalsContact O-CZ 3.26Å; E550-R553 PolarHBondContact O-NH1 3.38Å; E550-R553 PolarHBondContact O-NH2 3Å
551	R	83.9	Confident	84.3	Confident	186 Å²	186	83.9 Å²	83.9	70%	0.702	43%	0.431	S	S	*	.	H	α-helix	trans	-88.2	-22.6	177.9	-67.5	175.3	-174.4	-168	5	113.6	E547 D548 Q549 R553	E547-R551 WeakPolarHBondContact O-CG 3.43Å; E547-R551 PolarHBondContact O-N 3.13Å; D548-R551 CarbonylContact O-C 3.56Å; D548-R551 PolarHBondContact O-N 3.47Å; D548-R551 VanDerWaalsContact O-N 3.16Å; Q549-R551 VanDerWaalsContact C-N 3.28Å; Q549-R551 PolarHBondContact O-N 3.04Å; R551-R553 PolarHBondContact O-N 3.28Å
552	F	86.6	Confident	83.7	Confident	58 Å²	58	85.2 Å²	85.2	25%	0.254	44%	0.44	S	S	.	.			trans	-64.5	130.9	-177.7	-170.2	-93.8	0	0	0	112.2	V537 L541 L544 D548 Q549 L554 P589	V537-F552 HydrophobicContact CG1-CE1 4.33Å; L541-F552 HydrophobicContact CD2-CB 4.09Å; L541-F552 HydrophobicContact CD2-CD1 3.62Å; L541-F552 HydrophobicContact CD2-CE1 4.3Å; L541-F552 HydrophobicContact CD2-CG 3.97Å; L541-F552 HydrophobicContact CG-CD1 4.27Å; L541-F552 HydrophobicContact CG-CE1 4.48Å; L544-F552 HydrophobicContact CD1-CB 4.32Å; L544-F552 HydrophobicContact CD1-CD2 3.75Å; L544-F552 HydrophobicContact CD1-CE2 4.4Å; L544-F552 HydrophobicContact CD1-CG 4.2Å; D548-F552 WeakPolarHBondContact O-CB 3.35Å; D548-F552 PolarHBondContact O-N 2.83Å; Q549-F552 PolarHBondContact O-N 3.32Å; F552-L554 HydrophobicContact CE1-CD2 3.73Å; F552-L554 HydrophobicContact CE1-CG 4.35Å; F552-L554 HydrophobicContact CZ-CD2 4.25Å; F552-P589 HydrophobicContact CD1-CB 4.38Å; F552-P589 HydrophobicContact CD1-CG 3.78Å; F552-P589 HydrophobicContact CE1-CG 4.5Å; F552-P589 WeakPolarHBondContact O-CD 3.48Å; F552-P589 WeakPolarHBondContact O-CG 3.39Å
553	R	87.8	Confident	83	Confident	129 Å²	129	84.3 Å²	84.3	49%	0.487	43%	0.426	S	S	.	.			trans	-128.8	150.8	178.8	-61.9	-67.1	172.7	-90.9	-0.5	109.8	E550 R551 K586 K587	E550-R553 VanDerWaalsContact O-CZ 3.26Å; E550-R553 PolarHBondContact O-NH1 3.38Å; E550-R553 PolarHBondContact O-NH2 3Å; R551-R553 PolarHBondContact O-N 3.28Å; R553-K586 WeakPolarHBondContact CD-O 3.41Å; R553-K587 WeakPolarHBondContact CD-O 3.48Å; R553-K587 PolarHBondContact NE-O 2.94Å; R553-K587 VanDerWaalsContact NE-O 3.07Å; R553-K587 PolarHBondContact NH1-O 2.86Å
554	L	86.9	Confident	82.8	Confident	19 Å²	19	77.5 Å²	77.5	10%	0.099	41%	0.408	C	S	.	.			trans	-97.9	152.5	172.1	-67.8	177.4	0	0	0	111.4	V537 F552 L558 L585 K586 P589 V593	V537-L554 HydrophobicContact CG1-CD1 4.18Å; V537-L554 HydrophobicContact CG1-CD2 3.92Å; V537-L554 HydrophobicContact CG1-CG 4.49Å; V537-L554 HydrophobicContact CG2-CD2 3.95Å; F552-L554 HydrophobicContact CE1-CD2 3.73Å; F552-L554 HydrophobicContact CE1-CG 4.35Å; F552-L554 HydrophobicContact CZ-CD2 4.25Å; L554-L558 HydrophobicContact CB-CD2 4.35Å; L554-L558 HydrophobicContact CD1-CB 4.49Å; L554-L558 HydrophobicContact CD1-CD2 4.34Å; L554-L585 WeakPolarHBondContact CD1-O 3.22Å; L554-K586 PolarHBondContact N-O 3.15Å; L554-P589 HydrophobicContact CD1-CB 4.19Å; L554-P589 HydrophobicContact CG-CB 4.12Å; L554-V593 HydrophobicContact CD1-CG2 4.27Å
555	D	84.1	Confident	82.8	Confident	82 Å²	82	77.6 Å²	77.6	44%	0.439	41%	0.409	S	S	.	.			trans	-82.2	-178.5	173.8	63.5	-20.5	0	0	0	112.1	C557 L558 G559	D555-C557 PolarHBondContact O-N 3.13Å; D555-C557 WeakPolarHBondContact OD2-CB 3.47Å; D555-L558 PolarHBondContact O-N 3.19Å; D555-L558 PolarHBondContact OD1-N 3.06Å; D555-L558 VanDerWaalsContact OD1-N 3.16Å; D555-G559 PolarHBondContact OD1-N 3.12Å
556	D	81.4	Confident	82.8	Confident	93 Å²	93	75.7 Å²	75.7	50%	0.497	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-27.5	177.4	-62.8	-54.2	0	0	0	113	L558 K586	D556-L558 PolarHBondContact O-N 2.64Å; D556-K586 IonicContact OD1-NZ 3.5Å; D556-K586 PolarHBondContact OD1-NZ 3.17Å
557	C	82.6	Confident	83.1	Confident	34 Å²	34	74.5 Å²	74.5	23%	0.23	38%	0.377	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-3	171.8	-61.1	0	0	0	0	114.4	D555 G559 G560 S562	D555-C557 PolarHBondContact O-N 3.13Å; D555-C557 WeakPolarHBondContact OD2-CB 3.47Å; C557-G559 PolarHBondContact O-N 3.43Å; C557-G559 VanDerWaalsContact O-N 3.17Å; C557-G560 WeakPolarHBondContact CB-O 3.39Å; C557-G560 PolarHBondContact O-N 3.32Å; C557-S562 WeakPolarHBondContact CA-O 3.43Å
558	L	82.4	Confident	83.5	Confident	2 Å²	2	72 Å²	72	1%	0.01	36%	0.361	C	S	.	.	T	Hydrogen-bonded Turn	trans	52.4	34.7	-177.3	-60.6	174.9	0	0	0	113.4	L554 D555 D556 Q566 L585 K586	L554-L558 HydrophobicContact CB-CD2 4.35Å; L554-L558 HydrophobicContact CD1-CB 4.49Å; L554-L558 HydrophobicContact CD1-CD2 4.34Å; D555-L558 PolarHBondContact O-N 3.19Å; D555-L558 PolarHBondContact OD1-N 3.06Å; D555-L558 VanDerWaalsContact OD1-N 3.16Å; D556-L558 PolarHBondContact O-N 2.64Å; L558-Q566 HydrophobicContact CB-CB 4.44Å; L558-Q566 HydrophobicContact CD1-CB 4.08Å; L558-L585 HydrophobicContact CD1-CD1 4.31Å; L558-L585 HydrophobicContact CD2-CB 3.97Å; L558-K586 HydrophobicContact CD2-CG 3.75Å
559	G	75.1	Confident	83.8	Confident	33 Å²	33	68.4 Å²	68.4	34%	0.34	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.8	8.5	-175.9	0	0	0	0	0	115.7	D555 C557	D555-G559 PolarHBondContact OD1-N 3.12Å; C557-G559 PolarHBondContact O-N 3.43Å; C557-G559 VanDerWaalsContact O-N 3.17Å
560	G	81.4	Confident	84.1	Confident	19 Å²	19	65.6 Å²	65.6	20%	0.196	33%	0.329	C	S	.	.	S	Bend	trans	-97.2	-165.1	173.9	0	0	0	0	0	114	C557	C557-G560 WeakPolarHBondContact CB-O 3.39Å; C557-G560 PolarHBondContact O-N 3.32Å
561	T	76.1	Confident	84.7	Confident	145 Å²	145	61.4 Å²	61.4	89%	0.89	31%	0.307	S	S	*	.	S	Bend	trans	-103.4	2.8	176.7	51	0	0	0	0	113.7
562	S	75.4	Confident	85.1	Confident	35 Å²	35	53.5 Å²	53.5	25%	0.245	28%	0.278	C	S	.	.			trans	-145.8	151	-179.6	-173.1	0	0	0	0	108.7	C557 V564 Q566	C557-S562 WeakPolarHBondContact CA-O 3.43Å; S562-V564 PolarHBondContact OG-N 3.21Å; S562-Q566 PolarHBondContact O-OE1 3.49Å
563	E	75.8	Confident	85.4	Confident	73 Å²	73	52.2 Å²	52.2	34%	0.341	27%	0.273	S	S	.	.	S	Bend	trans	-82.3	-31.5	166.8	174.1	172.8	-164.2	0	0	111.6	R567	E563-R567 VanDerWaalsContact CG-CD 3.47Å; E563-R567 HydrophobicContact CG-CG 4.32Å; E563-R567 WeakPolarHBondContact O-CB 3.31Å; E563-R567 WeakPolarHBondContact O-CG 3.47Å; E563-R567 PolarHBondContact O-N 3.27Å; E563-R567 IonicContact OE1-CZ 2.82Å; E563-R567 IonicContact OE1-NH1 3.7Å; E563-R567 PolarHBondContact OE1-NH1 3.22Å
564	V	85.4	Confident	85.5	Confident	72 Å²	72	48.7 Å²	48.7	44%	0.436	26%	0.26	S	S	.	.	H	α-helix	trans	-78.6	-42.7	-162.1	-179.9	0	0	0	0	112.5	S562 R568	S562-V564 PolarHBondContact OG-N 3.21Å; V564-R568 HydrophobicContact CG1-CG 4.14Å; V564-R568 VanDerWaalsContact O-CB 3.31Å; V564-R568 WeakPolarHBondContact O-CB 3.36Å; V564-R568 VanDerWaalsContact O-CG 3.24Å; V564-R568 WeakPolarHBondContact O-CG 3.49Å; V564-R568 PolarHBondContact O-N 3.01Å
565	I	88	Confident	85.6	Confident	66 Å²	66	49.5 Å²	49.5	34%	0.338	27%	0.273	S	S	.	.	H	α-helix	trans	-65.1	-49	-172.4	-57.1	173.8	0	0	0	110.5	T526 A529 R568 A569	T526-I565 HydrophobicContact CG2-CG2 4.08Å; A529-I565 HydrophobicContact CB-CG2 4.26Å; I565-R568 PolarHBondContact O-N 2.91Å; I565-A569 PolarHBondContact O-N 2.99Å
566	Q	88.4	Confident	86	Confident	7 Å²	7	53.4 Å²	53.4	3%	0.033	29%	0.294	C	S	.	.	H	α-helix	trans	-66.1	-44.1	-178.5	-67.8	73.3	2.5	0	0	110.8	T530 V533 L558 S562 A569 V570	T530-Q566 HydrophobicContact CG2-CB 4.3Å; T530-Q566 HydrophobicContact CG2-CG 4.29Å; V533-Q566 HydrophobicContact CG1-CG 4.47Å; L558-Q566 HydrophobicContact CB-CB 4.44Å; L558-Q566 HydrophobicContact CD1-CB 4.08Å; S562-Q566 PolarHBondContact O-OE1 3.49Å; Q566-A569 PolarHBondContact O-N 3.04Å; Q566-V570 WeakPolarHBondContact O-CG2 3.22Å; Q566-V570 PolarHBondContact O-N 3.43Å; Q566-V570 VanDerWaalsContact O-N 3.14Å
567	R	89.8	Confident	86.5	Confident	79 Å²	79	55.4 Å²	55.4	30%	0.298	30%	0.298	S	S	.	.	H	α-helix	trans	-62.5	-47.1	174.6	-68.9	-176.9	71.9	-176.2	-5.7	110.8	E563 A569 V570 Y571 I582	E563-R567 VanDerWaalsContact CG-CD 3.47Å; E563-R567 HydrophobicContact CG-CG 4.32Å; E563-R567 WeakPolarHBondContact O-CB 3.31Å; E563-R567 WeakPolarHBondContact O-CG 3.47Å; E563-R567 PolarHBondContact O-N 3.27Å; E563-R567 IonicContact OE1-CZ 2.82Å; E563-R567 IonicContact OE1-NH1 3.7Å; E563-R567 PolarHBondContact OE1-NH1 3.22Å; R567-A569 VanDerWaalsContact C-N 3.33Å; R567-A569 PolarHBondContact O-N 3.43Å; R567-V570 PolarHBondContact O-N 3.24Å; R567-V570 VanDerWaalsContact O-N 3.13Å; R567-Y571 HydrophobicContact CB-CD2 4.33Å; R567-Y571 HydrophobicContact CB-CE2 4.32Å; R567-Y571 PolarHBondContact NH2-OH 3.21Å; R567-Y571 WeakPolarHBondContact O-CD2 3.28Å; R567-Y571 PolarHBondContact O-N 3.45Å; R567-I582 HydrophobicContact CB-CD1 4.19Å; R567-I582 HydrophobicContact CG-CD1 3.92Å
568	R	91.2	Very high	86.9	Confident	87 Å²	87	53.8 Å²	53.8	33%	0.328	29%	0.287	S	S	.	.	H	α-helix	trans	-55.1	-43.2	176.5	-78.8	177.8	176.2	-173.8	-6.3	112.5	E178 P179 T526 V564 I565 R572	E178-R568 PolarHBondContact O-NH2 2.97Å; P179-R568 VanDerWaalsContact CD-CZ 3.4Å; P179-R568 HydrophobicContact CG-CG 4.11Å; T526-R568 HydrophobicContact CG2-CB 4.34Å; V564-R568 HydrophobicContact CG1-CG 4.14Å; V564-R568 VanDerWaalsContact O-CB 3.31Å; V564-R568 WeakPolarHBondContact O-CB 3.36Å; V564-R568 VanDerWaalsContact O-CG 3.24Å; V564-R568 WeakPolarHBondContact O-CG 3.49Å; V564-R568 PolarHBondContact O-N 3.01Å; I565-R568 PolarHBondContact O-N 2.91Å; R568-R572 VanDerWaalsContact O-CB 3.31Å; R568-R572 WeakPolarHBondContact O-CB 3.41Å; R568-R572 PolarHBondContact O-N 3.04Å
569	A	92.5	Very high	87.4	Confident	3 Å²	3	56.5 Å²	56.5	3%	0.025	31%	0.305	C	S	.	.	H	α-helix	trans	-63.6	-42.3	176.3	0	0	0	0	0	112.9	T526 T530 I565 Q566 R567 R572 I573 L600	T526-A569 HydrophobicContact CG2-CB 4.17Å; T530-A569 HydrophobicContact CG2-CB 3.93Å; T530-A569 WeakPolarHBondContact OG1-CB 3.41Å; I565-A569 PolarHBondContact O-N 2.99Å; Q566-A569 PolarHBondContact O-N 3.04Å; R567-A569 VanDerWaalsContact C-N 3.33Å; R567-A569 PolarHBondContact O-N 3.43Å; A569-R572 PolarHBondContact O-N 3.39Å; A569-I573 PolarHBondContact O-N 3.16Å; A569-L600 HydrophobicContact CB-CD2 4.4Å
570	V	91.1	Very high	88.2	Confident	0 Å²	0	61.2 Å²	61.2	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-70	-43.5	178.5	179.3	0	0	0	0	111.4	Q566 R567 R572 I573 Y574 A578 I581 I582 L585	Q566-V570 WeakPolarHBondContact O-CG2 3.22Å; Q566-V570 PolarHBondContact O-N 3.43Å; Q566-V570 VanDerWaalsContact O-N 3.14Å; R567-V570 PolarHBondContact O-N 3.24Å; R567-V570 VanDerWaalsContact O-N 3.13Å; V570-R572 VanDerWaalsContact C-N 3.29Å; V570-R572 PolarHBondContact O-N 2.96Å; V570-I573 PolarHBondContact O-N 2.99Å; V570-I573 VanDerWaalsContact O-N 3.17Å; V570-Y574 HydrophobicContact CG1-CD2 3.82Å; V570-Y574 HydrophobicContact CG1-CE2 4.44Å; V570-Y574 WeakPolarHBondContact O-CD2 3.47Å; V570-Y574 PolarHBondContact O-N 2.87Å; V570-A578 HydrophobicContact CG1-CB 4.03Å; V570-I581 HydrophobicContact CG1-CB 4.2Å; V570-I581 HydrophobicContact CG1-CG2 3.81Å; V570-I582 HydrophobicContact CB-CG1 4.3Å; V570-I582 HydrophobicContact CG1-CD1 4.44Å; V570-I582 HydrophobicContact CG1-CG1 4Å; V570-L585 HydrophobicContact CG2-CD1 4.39Å
571	Y	93.3	Very high	88.7	Confident	68 Å²	68	62.6 Å²	62.6	27%	0.267	32%	0.32	S	S	.	.	H	α-helix	trans	-55.8	-43.5	171.4	-81	-75.6	0	0	0	111.6	R567 I573 Y574 G575 A578 P579 I582	R567-Y571 HydrophobicContact CB-CD2 4.33Å; R567-Y571 HydrophobicContact CB-CE2 4.32Å; R567-Y571 PolarHBondContact NH2-OH 3.21Å; R567-Y571 WeakPolarHBondContact O-CD2 3.28Å; R567-Y571 PolarHBondContact O-N 3.45Å; Y571-I573 PolarHBondContact O-N 3.27Å; Y571-Y574 PolarHBondContact O-N 2.95Å; Y571-G575 WeakPolarHBondContact O-CA 3.4Å; Y571-G575 PolarHBondContact O-N 3.49Å; Y571-A578 HydrophobicContact CD1-CB 3.42Å; Y571-A578 VanDerWaalsContact CD1-CB 3.42Å; Y571-A578 HydrophobicContact CD2-CB 4.37Å; Y571-A578 HydrophobicContact CE1-CB 3.78Å; Y571-A578 HydrophobicContact CG-CB 3.74Å; Y571-P579 HydrophobicContact CE1-CG 4.11Å; Y571-I582 HydrophobicContact CD2-CD1 4.26Å; Y571-I582 HydrophobicContact CE2-CD1 3.82Å
572	R	92.8	Very high	89.5	Confident	20 Å²	20	56 Å²	56	8%	0.075	28%	0.279	C	S	.	.	H	α-helix	trans	-67.2	-7.3	-179.1	-163.6	173.1	-75.7	-99	20.5	115	P180 S181 K182 R568 A569 V570 W607	P180-R572 HydrophobicContact CB-CB 3.83Å; P180-R572 HydrophobicContact CB-CG 3.95Å; P180-R572 VanDerWaalsContact CB-CZ 3.48Å; P180-R572 VanDerWaalsContact CB-NE 3.35Å; P180-R572 HydrophobicContact CG-CB 3.85Å; P180-R572 HydrophobicContact CG-CG 4.48Å; S181-R572 WeakPolarHBondContact O-CA 3.12Å; S181-R572 PolarHBondContact OG-NH1 3.36Å; K182-R572 HydrophobicContact CB-CG 4.3Å; K182-R572 HydrophobicContact CD-CG 4.46Å; R568-R572 VanDerWaalsContact O-CB 3.31Å; R568-R572 WeakPolarHBondContact O-CB 3.41Å; R568-R572 PolarHBondContact O-N 3.04Å; A569-R572 PolarHBondContact O-N 3.39Å; V570-R572 VanDerWaalsContact C-N 3.29Å; V570-R572 PolarHBondContact O-N 2.96Å; R572-W607 HydrophobicContact CG-CH2 4.49Å
573	I	92	Very high	90.2	Very high	30 Å²	30	58.9 Å²	58.9	15%	0.154	29%	0.289	C	S	.	.	H	α-helix	trans	-116.4	-32.6	176.6	-66.4	-177	0	0	0	112.9	A569 V570 Y571 R599 L600 K603 W607	A569-I573 PolarHBondContact O-N 3.16Å; V570-I573 PolarHBondContact O-N 2.99Å; V570-I573 VanDerWaalsContact O-N 3.17Å; Y571-I573 PolarHBondContact O-N 3.27Å; I573-R599 HydrophobicContact CG2-CG 3.88Å; I573-L600 HydrophobicContact CD1-CD2 3.66Å; I573-L600 HydrophobicContact CD1-CG 4.32Å; I573-K603 HydrophobicContact CD1-CB 3.87Å; I573-K603 HydrophobicContact CD1-CG 3.94Å; I573-K603 HydrophobicContact CG1-CG 4.28Å; I573-K603 HydrophobicContact CG2-CG 4.48Å; I573-W607 HydrophobicContact CD1-CH2 4.07Å; I573-W607 HydrophobicContact CG1-CH2 3.74Å; I573-W607 HydrophobicContact CG1-CZ2 4.2Å
574	Y	89.3	Confident	90.9	Very high	56 Å²	56	56.4 Å²	56.4	22%	0.22	28%	0.283	C	S	.	.	H	α-helix	trans	-111.8	-8	-171.9	-66.9	-89	0	0	0	114.3	V570 Y571 D576 K577 I581 V596 R599	V570-Y574 HydrophobicContact CG1-CD2 3.82Å; V570-Y574 HydrophobicContact CG1-CE2 4.44Å; V570-Y574 WeakPolarHBondContact O-CD2 3.47Å; V570-Y574 PolarHBondContact O-N 2.87Å; Y571-Y574 PolarHBondContact O-N 2.95Å; Y574-D576 PolarHBondContact O-N 3.2Å; Y574-K577 PolarHBondContact O-N 3.35Å; Y574-K577 VanDerWaalsContact O-N 3.13Å; Y574-I581 HydrophobicContact CD1-CD1 4.21Å; Y574-I581 HydrophobicContact CD1-CG1 3.78Å; Y574-I581 HydrophobicContact CD2-CG2 4.37Å; Y574-I581 HydrophobicContact CE1-CD1 4.16Å; Y574-I581 HydrophobicContact CE1-CG1 4.15Å; Y574-I581 HydrophobicContact CE2-CG2 4.31Å; Y574-I581 HydrophobicContact CG-CG1 4.04Å; Y574-V596 HydrophobicContact CE2-CG1 4.21Å; Y574-R599 WeakPolarHBondContact OH-CB 3.44Å
575	G	90.7	Very high	91.2	Very high	36 Å²	36	53 Å²	53	37%	0.371	26%	0.262	S	S	.	.	G	3₁₀ helix	trans	54	-130.9	178.5	0	0	0	0	0	112.1	Y571 K577 A578	Y571-G575 WeakPolarHBondContact O-CA 3.4Å; Y571-G575 PolarHBondContact O-N 3.49Å; G575-K577 PolarHBondContact O-N 3.21Å; G575-A578 WeakPolarHBondContact O-CB 3.48Å; G575-A578 PolarHBondContact O-N 2.9Å
576	D	91.3	Very high	91.4	Very high	163 Å²	163	51.8 Å²	51.8	87%	0.872	26%	0.255	S	S	*	.	G	3₁₀ helix	trans	-57.7	-21.3	-179.4	-44.3	-45.6	0	0	0	114	Y574 P579	Y574-D576 PolarHBondContact O-N 3.2Å; D576-P579 WeakPolarHBondContact O-CD 3.48Å
577	K	92.1	Very high	91.5	Very high	135 Å²	135	57.4 Å²	57.4	59%	0.587	28%	0.279	S	S	*	.	G	3₁₀ helix	trans	-87.4	-7.9	178	-58.5	-167.3	177.1	-166.2	0	113.7	Y574 G575 P579 E580 I581	Y574-K577 PolarHBondContact O-N 3.35Å; Y574-K577 VanDerWaalsContact O-N 3.13Å; G575-K577 PolarHBondContact O-N 3.21Å; K577-P579 VanDerWaalsContact C-N 3.33Å; K577-E580 WeakPolarHBondContact O-CB 3.33Å; K577-E580 PolarHBondContact O-N 3.26Å; K577-I581 WeakPolarHBondContact O-CG1 3.09Å; K577-I581 PolarHBondContact O-N 3.23Å; K577-I581 VanDerWaalsContact O-N 3.13Å
578	A	91.2	Very high	91.4	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-56.7	-34.5	178.3	0	0	0	0	0	114.8	V570 Y571 G575 E580 I581 I582	V570-A578 HydrophobicContact CG1-CB 4.03Å; Y571-A578 HydrophobicContact CD1-CB 3.42Å; Y571-A578 VanDerWaalsContact CD1-CB 3.42Å; Y571-A578 HydrophobicContact CD2-CB 4.37Å; Y571-A578 HydrophobicContact CE1-CB 3.78Å; Y571-A578 HydrophobicContact CG-CB 3.74Å; G575-A578 WeakPolarHBondContact O-CB 3.48Å; G575-A578 PolarHBondContact O-N 2.9Å; A578-E580 PolarHBondContact O-N 3.32Å; A578-I581 PolarHBondContact O-N 3.42Å; A578-I582 HydrophobicContact CB-CD1 4.45Å; A578-I582 WeakPolarHBondContact O-CB 3.26Å; A578-I582 WeakPolarHBondContact O-CD1 3.38Å; A578-I582 WeakPolarHBondContact O-CG1 3.49Å; A578-I582 PolarHBondContact O-N 3.46Å
579	P	92.1	Very high	91.3	Very high	60 Å²	60	52.2 Å²	52.2	39%	0.39	27%	0.268	S	S	.	.	H	α-helix	trans	-58.1	-47.2	173.2	-22.8	34.3	0	0	0	112.5	Y571 D576 K577 I581 I582 E583	Y571-P579 HydrophobicContact CE1-CG 4.11Å; D576-P579 WeakPolarHBondContact O-CD 3.48Å; K577-P579 VanDerWaalsContact C-N 3.33Å; P579-I581 VanDerWaalsContact C-N 3.33Å; P579-I581 PolarHBondContact O-N 3.06Å; P579-I582 PolarHBondContact O-N 3.31Å; P579-E583 WeakPolarHBondContact O-CB 3.3Å; P579-E583 PolarHBondContact O-N 3.13Å
580	E	92.2	Very high	91.1	Very high	132 Å²	132	53.7 Å²	53.7	62%	0.617	28%	0.28	S	S	*	.	H	α-helix	trans	-61.1	-41.3	177.1	-56	176.5	169.8	0	0	111.3	K577 A578 E583 G584	K577-E580 WeakPolarHBondContact O-CB 3.33Å; K577-E580 PolarHBondContact O-N 3.26Å; A578-E580 PolarHBondContact O-N 3.32Å; E580-E583 PolarHBondContact O-N 2.92Å; E580-G584 PolarHBondContact O-N 3.02Å
581	I	92.1	Very high	90.9	Very high	47 Å²	47	58.7 Å²	58.7	24%	0.241	31%	0.311	C	S	.	.	H	α-helix	trans	-69.5	-39.8	178.6	-61.5	-64.9	0	0	0	111.5	V570 Y574 K577 A578 P579 G584 L585 V596	V570-I581 HydrophobicContact CG1-CB 4.2Å; V570-I581 HydrophobicContact CG1-CG2 3.81Å; Y574-I581 HydrophobicContact CD1-CD1 4.21Å; Y574-I581 HydrophobicContact CD1-CG1 3.78Å; Y574-I581 HydrophobicContact CD2-CG2 4.37Å; Y574-I581 HydrophobicContact CE1-CD1 4.16Å; Y574-I581 HydrophobicContact CE1-CG1 4.15Å; Y574-I581 HydrophobicContact CE2-CG2 4.31Å; Y574-I581 HydrophobicContact CG-CG1 4.04Å; K577-I581 WeakPolarHBondContact O-CG1 3.09Å; K577-I581 PolarHBondContact O-N 3.23Å; K577-I581 VanDerWaalsContact O-N 3.13Å; A578-I581 PolarHBondContact O-N 3.42Å; P579-I581 VanDerWaalsContact C-N 3.33Å; P579-I581 PolarHBondContact O-N 3.06Å; I581-G584 PolarHBondContact O-N 3.42Å; I581-L585 HydrophobicContact CG2-CD1 4.33Å; I581-L585 VanDerWaalsContact O-CG 3.28Å; I581-L585 WeakPolarHBondContact O-CG 3.5Å; I581-L585 PolarHBondContact O-N 3.45Å; I581-V596 HydrophobicContact CG2-CG2 3.58Å
582	I	92.3	Very high	90.8	Very high	6 Å²	6	56.3 Å²	56.3	3%	0.031	31%	0.306	C	S	.	.	H	α-helix	trans	-65.5	-40.7	174.6	-70.1	159.9	0	0	0	110.2	R567 V570 Y571 A578 P579 L585 K586	R567-I582 HydrophobicContact CB-CD1 4.19Å; R567-I582 HydrophobicContact CG-CD1 3.92Å; V570-I582 HydrophobicContact CB-CG1 4.3Å; V570-I582 HydrophobicContact CG1-CD1 4.44Å; V570-I582 HydrophobicContact CG1-CG1 4Å; Y571-I582 HydrophobicContact CD2-CD1 4.26Å; Y571-I582 HydrophobicContact CE2-CD1 3.82Å; A578-I582 HydrophobicContact CB-CD1 4.45Å; A578-I582 WeakPolarHBondContact O-CB 3.26Å; A578-I582 WeakPolarHBondContact O-CD1 3.38Å; A578-I582 WeakPolarHBondContact O-CG1 3.49Å; A578-I582 PolarHBondContact O-N 3.46Å; P579-I582 PolarHBondContact O-N 3.31Å; I582-L585 PolarHBondContact O-N 3.04Å; I582-K586 HydrophobicContact CG2-CD 4.45Å; I582-K586 WeakPolarHBondContact O-CG 3.46Å; I582-K586 PolarHBondContact O-N 2.88Å; I582-K586 VanDerWaalsContact O-N 3.1Å
583	E	91.7	Very high	90.7	Very high	96 Å²	96	55.4 Å²	55.4	45%	0.449	30%	0.302	S	S	.	.	H	α-helix	trans	-65	-42.4	174.8	-169.9	-178.1	162.9	0	0	111.6	P579 E580 K586 K587	P579-E583 WeakPolarHBondContact O-CB 3.3Å; P579-E583 PolarHBondContact O-N 3.13Å; E580-E583 PolarHBondContact O-N 2.92Å; E583-K586 PolarHBondContact O-N 3.01Å; E583-K586 VanDerWaalsContact O-N 3.17Å; E583-K587 HydrophobicContact CG-CD 3.94Å; E583-K587 HydrophobicContact CG-CG 4.32Å; E583-K587 WeakPolarHBondContact O-CB 3.49Å; E583-K587 PolarHBondContact O-N 3.07Å; E583-K587 WeakPolarHBondContact OE1-CE 3.44Å; E583-K587 IonicContact OE1-NZ 2.61Å; E583-K587 PolarHBondContact OE1-NZ 3.1Å
584	G	90.3	Very high	90.7	Very high	21 Å²	21	56.3 Å²	56.3	22%	0.216	31%	0.31	C	S	.	.	H	α-helix	trans	-61.4	-40.3	172.9	0	0	0	0	0	113.2	E580 I581 K586 S588 A592	E580-G584 PolarHBondContact O-N 3.02Å; I581-G584 PolarHBondContact O-N 3.42Å; G584-K586 VanDerWaalsContact C-N 3.29Å; G584-K586 PolarHBondContact O-N 3.45Å; G584-S588 CarbonylContact O-C 3.57Å; G584-S588 WeakPolarHBondContact O-CA 3.37Å; G584-S588 PolarHBondContact O-N 2.92Å; G584-S588 PolarHBondContact O-OG 3.4Å; G584-A592 WeakPolarHBondContact O-CB 3.45Å
585	L	91.1	Very high	90.9	Very high	0 Å²	0	58.1 Å²	58.1	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-62	-35.8	173.1	-73.5	165.4	0	0	0	112.3	L554 L558 V570 I581 I582 P589 A592 V593 V596	L554-L585 WeakPolarHBondContact CD1-O 3.22Å; L558-L585 HydrophobicContact CD1-CD1 4.31Å; L558-L585 HydrophobicContact CD2-CB 3.97Å; V570-L585 HydrophobicContact CG2-CD1 4.39Å; I581-L585 HydrophobicContact CG2-CD1 4.33Å; I581-L585 VanDerWaalsContact O-CG 3.28Å; I581-L585 WeakPolarHBondContact O-CG 3.5Å; I581-L585 PolarHBondContact O-N 3.45Å; I582-L585 PolarHBondContact O-N 3.04Å; L585-P589 WeakPolarHBondContact O-CB 3.47Å; L585-A592 HydrophobicContact CD2-CB 3.94Å; L585-A592 HydrophobicContact CG-CB 4.26Å; L585-V593 HydrophobicContact CD2-CB 4.35Å; L585-V593 HydrophobicContact CD2-CG2 3.67Å; L585-V596 HydrophobicContact CD1-CG1 4.32Å; L585-V596 HydrophobicContact CD1-CG2 4.37Å; L585-V596 HydrophobicContact CD2-CB 4.23Å; L585-V596 HydrophobicContact CD2-CG2 4.12Å; L585-V596 HydrophobicContact CG-CG2 4.34Å
586	K	91.5	Very high	91	Very high	41 Å²	41	56.7 Å²	56.7	18%	0.178	31%	0.311	C	S	.	.	H	α-helix	trans	-75.1	-46.9	176.2	-68.7	173.4	-174.9	-175.9	0	112.8	R553 L554 D556 L558 I582 E583 G584	R553-K586 WeakPolarHBondContact CD-O 3.41Å; L554-K586 PolarHBondContact N-O 3.15Å; D556-K586 IonicContact OD1-NZ 3.5Å; D556-K586 PolarHBondContact OD1-NZ 3.17Å; L558-K586 HydrophobicContact CD2-CG 3.75Å; I582-K586 HydrophobicContact CG2-CD 4.45Å; I582-K586 WeakPolarHBondContact O-CG 3.46Å; I582-K586 PolarHBondContact O-N 2.88Å; I582-K586 VanDerWaalsContact O-N 3.1Å; E583-K586 PolarHBondContact O-N 3.01Å; E583-K586 VanDerWaalsContact O-N 3.17Å; G584-K586 VanDerWaalsContact C-N 3.29Å; G584-K586 PolarHBondContact O-N 3.45Å
587	K	90.8	Very high	91.1	Very high	126 Å²	126	49.1 Å²	49.1	55%	0.548	27%	0.27	S	S	.	.	H	α-helix	trans	-82.6	-32.1	-172.8	-72.4	-172.8	174.6	176.6	0	114.8	R553 E583	R553-K587 WeakPolarHBondContact CD-O 3.48Å; R553-K587 PolarHBondContact NE-O 2.94Å; R553-K587 VanDerWaalsContact NE-O 3.07Å; R553-K587 PolarHBondContact NH1-O 2.86Å; E583-K587 HydrophobicContact CG-CD 3.94Å; E583-K587 HydrophobicContact CG-CG 4.32Å; E583-K587 WeakPolarHBondContact O-CB 3.49Å; E583-K587 PolarHBondContact O-N 3.07Å; E583-K587 WeakPolarHBondContact OE1-CE 3.44Å; E583-K587 IonicContact OE1-NZ 2.61Å; E583-K587 PolarHBondContact OE1-NZ 3.1Å
588	S	88.6	Confident	91.2	Very high	55 Å²	55	50.6 Å²	50.6	39%	0.385	28%	0.277	S	S	.	.			trans	-141.6	56.4	-176.7	48.2	0	0	0	0	112.7	G584 A590 T591 A592	G584-S588 CarbonylContact O-C 3.57Å; G584-S588 WeakPolarHBondContact O-CA 3.37Å; G584-S588 PolarHBondContact O-N 2.92Å; G584-S588 PolarHBondContact O-OG 3.4Å; S588-A590 VanDerWaalsContact C-N 3.29Å; S588-A590 PolarHBondContact O-N 3.42Å; S588-T591 PolarHBondContact O-N 3.35Å; S588-A592 WeakPolarHBondContact O-CB 3.43Å; S588-A592 PolarHBondContact O-N 3.2Å
589	P	89.3	Confident	91.3	Very high	1 Å²	1	56.1 Å²	56.1	1%	0.006	30%	0.298	C	S	.	.	H	α-helix	trans	-57.8	-34.6	-173.6	21	-32.8	0	0	0	114.2	L541 F552 L554 L585 T591 A592 V593	L541-P589 HydrophobicContact CD1-CB 4.32Å; F552-P589 HydrophobicContact CD1-CB 4.38Å; F552-P589 HydrophobicContact CD1-CG 3.78Å; F552-P589 HydrophobicContact CE1-CG 4.5Å; F552-P589 WeakPolarHBondContact O-CD 3.48Å; F552-P589 WeakPolarHBondContact O-CG 3.39Å; L554-P589 HydrophobicContact CD1-CB 4.19Å; L554-P589 HydrophobicContact CG-CB 4.12Å; L585-P589 WeakPolarHBondContact O-CB 3.47Å; P589-T591 PolarHBondContact O-N 3.19Å; P589-A592 PolarHBondContact O-N 3.38Å; P589-V593 HydrophobicContact CB-CG2 3.91Å; P589-V593 WeakPolarHBondContact O-CB 3.44Å; P589-V593 VanDerWaalsContact O-CG2 3.24Å; P589-V593 WeakPolarHBondContact O-CG2 3.41Å; P589-V593 PolarHBondContact O-N 3.37Å
590	A	87.4	Confident	91.4	Very high	34 Å²	34	53.3 Å²	53.3	28%	0.281	28%	0.279	S	S	.	.	H	α-helix	trans	-56.3	-36.5	177.3	0	0	0	0	0	113	L541 Q549 S588 P594	L541-A590 HydrophobicContact CD2-CB 4.36Å; Q549-A590 HydrophobicContact CB-CB 4.33Å; S588-A590 VanDerWaalsContact C-N 3.29Å; S588-A590 PolarHBondContact O-N 3.42Å; A590-P594 WeakPolarHBondContact O-CD 3.33Å; A590-P594 WeakPolarHBondContact O-CG 3.46Å
591	T	87.6	Confident	91.5	Very high	106 Å²	106	51.2 Å²	51.2	65%	0.65	27%	0.268	S	S	*	.	H	α-helix	trans	-91.9	-40.7	178.2	-40.7	0	0	0	0	112.1	S588 P589	S588-T591 PolarHBondContact O-N 3.35Å; P589-T591 PolarHBondContact O-N 3.19Å
592	A	89.9	Confident	91.6	Very high	18 Å²	18	51.1 Å²	51.1	15%	0.149	27%	0.274	C	S	.	.	H	α-helix	trans	-76.9	-42.5	-173.1	0	0	0	0	0	113.5	G584 L585 S588 P589 V595 V596	G584-A592 WeakPolarHBondContact O-CB 3.45Å; L585-A592 HydrophobicContact CD2-CB 3.94Å; L585-A592 HydrophobicContact CG-CB 4.26Å; S588-A592 WeakPolarHBondContact O-CB 3.43Å; S588-A592 PolarHBondContact O-N 3.2Å; P589-A592 PolarHBondContact O-N 3.38Å; A592-V595 PolarHBondContact O-N 3.4Å; A592-V596 WeakPolarHBondContact O-CG2 3.37Å; A592-V596 PolarHBondContact O-N 2.7Å
593	V	91.8	Very high	91.6	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-60	-46.9	-174.5	174.8	0	0	0	0	112.3	L534 V537 Q538 L541 L554 L585 P589 V595 V596 L597	L534-V593 HydrophobicContact CB-CG1 4.22Å; L534-V593 HydrophobicContact CD2-CG1 4.36Å; L534-V593 HydrophobicContact CD2-CG2 4.34Å; V537-V593 HydrophobicContact CG1-CG1 4.42Å; V537-V593 HydrophobicContact CG1-CG2 4.07Å; Q538-V593 HydrophobicContact CB-CG1 4.18Å; L541-V593 HydrophobicContact CD1-CB 4.49Å; L554-V593 HydrophobicContact CD1-CG2 4.27Å; L585-V593 HydrophobicContact CD2-CB 4.35Å; L585-V593 HydrophobicContact CD2-CG2 3.67Å; P589-V593 HydrophobicContact CB-CG2 3.91Å; P589-V593 WeakPolarHBondContact O-CB 3.44Å; P589-V593 VanDerWaalsContact O-CG2 3.24Å; P589-V593 WeakPolarHBondContact O-CG2 3.41Å; P589-V593 PolarHBondContact O-N 3.37Å; V593-V595 VanDerWaalsContact C-N 3.31Å; V593-V595 PolarHBondContact O-N 2.88Å; V593-V596 PolarHBondContact O-N 3.3Å; V593-L597 WeakPolarHBondContact O-CB 3.38Å; V593-L597 PolarHBondContact O-N 2.98Å
594	P	91.8	Very high	91.7	Very high	49 Å²	49	48.1 Å²	48.1	32%	0.318	26%	0.26	S	S	.	.	H	α-helix	trans	-60.9	-37.1	178.8	-24.1	35	0	0	0	113.7	A590 K598	A590-P594 WeakPolarHBondContact O-CD 3.33Å; A590-P594 WeakPolarHBondContact O-CG 3.46Å; P594-K598 WeakPolarHBondContact O-CB 2.95Å; P594-K598 PolarHBondContact O-N 3.06Å; P594-K598 VanDerWaalsContact O-N 3.09Å
595	V	92.4	Very high	91.9	Very high	95 Å²	95	53.6 Å²	53.6	58%	0.576	28%	0.28	S	S	*	.	H	α-helix	trans	-72.5	-48.7	-178.5	178.9	0	0	0	0	110.9	A592 V593 K598 R599	A592-V595 PolarHBondContact O-N 3.4Å; V593-V595 VanDerWaalsContact C-N 3.31Å; V593-V595 PolarHBondContact O-N 2.88Å; V595-K598 PolarHBondContact O-N 3.48Å; V595-R599 PolarHBondContact O-N 3.43Å; V595-R599 VanDerWaalsContact O-N 3.13Å
596	V	93.4	Very high	92.1	Very high	5 Å²	5	56.7 Å²	56.7	3%	0.03	29%	0.294	C	S	.	.	H	α-helix	trans	-66.2	-42.4	179	177.7	0	0	0	0	110.8	L534 Y574 I581 L585 A592 V593 K598 R599 L600	L534-V596 HydrophobicContact CD1-CG1 4.32Å; Y574-V596 HydrophobicContact CE2-CG1 4.21Å; I581-V596 HydrophobicContact CG2-CG2 3.58Å; L585-V596 HydrophobicContact CD1-CG1 4.32Å; L585-V596 HydrophobicContact CD1-CG2 4.37Å; L585-V596 HydrophobicContact CD2-CB 4.23Å; L585-V596 HydrophobicContact CD2-CG2 4.12Å; L585-V596 HydrophobicContact CG-CG2 4.34Å; A592-V596 WeakPolarHBondContact O-CG2 3.37Å; A592-V596 PolarHBondContact O-N 2.7Å; V593-V596 PolarHBondContact O-N 3.3Å; V596-K598 PolarHBondContact O-N 2.94Å; V596-R599 PolarHBondContact O-N 3.14Å; V596-R599 VanDerWaalsContact O-N 3.12Å; V596-L600 HydrophobicContact CG1-CD1 3.82Å; V596-L600 HydrophobicContact CG1-CG 4.22Å; V596-L600 WeakPolarHBondContact O-CG 3.24Å; V596-L600 PolarHBondContact O-N 3.05Å
597	L	93.9	Very high	92.2	Very high	4 Å²	4	55 Å²	55	2%	0.021	29%	0.286	C	S	.	.	H	α-helix	trans	-61.7	-41.6	176.6	-178.1	62	0	0	0	112.4	I531 L534 E535 Q538 V593 R599 L600 K601	I531-L597 HydrophobicContact CB-CD1 4.3Å; I531-L597 HydrophobicContact CG1-CD1 4.34Å; I531-L597 HydrophobicContact CG2-CD1 3.98Å; L534-L597 HydrophobicContact CB-CD1 4.14Å; E535-L597 HydrophobicContact CG-CD1 4.18Å; E535-L597 HydrophobicContact CG-CD2 3.97Å; Q538-L597 HydrophobicContact CB-CD2 4.49Å; Q538-L597 VanDerWaalsContact OE1-CD2 3.25Å; V593-L597 WeakPolarHBondContact O-CB 3.38Å; V593-L597 PolarHBondContact O-N 2.98Å; L597-R599 VanDerWaalsContact C-N 3.29Å; L597-R599 PolarHBondContact O-N 3.35Å; L597-L600 PolarHBondContact O-N 2.87Å; L597-K601 HydrophobicContact CD1-CG 4.47Å; L597-K601 WeakPolarHBondContact O-CG 3.47Å; L597-K601 PolarHBondContact O-N 3.47Å
598	K	93.6	Very high	92.3	Very high	167 Å²	167	53.3 Å²	53.3	73%	0.726	28%	0.277	S	S	*	.	H	α-helix	trans	-61.4	-38.1	174.2	-174.1	175.7	-179.2	178.7	0	111.6	P594 V595 V596 A602	P594-K598 WeakPolarHBondContact O-CB 2.95Å; P594-K598 PolarHBondContact O-N 3.06Å; P594-K598 VanDerWaalsContact O-N 3.09Å; V595-K598 PolarHBondContact O-N 3.48Å; V596-K598 PolarHBondContact O-N 2.94Å; K598-A602 WeakPolarHBondContact O-CB 3.06Å; K598-A602 PolarHBondContact O-N 3.16Å; K598-A602 VanDerWaalsContact O-N 3.11Å
599	R	93.6	Very high	92.4	Very high	116 Å²	116	57.1 Å²	57.1	44%	0.438	29%	0.288	S	S	.	.	H	α-helix	trans	-72.9	-41.1	177.9	-174.3	55.6	168.6	171.8	-4.6	113	I573 Y574 V595 V596 L597 K601 A602 K603	I573-R599 HydrophobicContact CG2-CG 3.88Å; Y574-R599 WeakPolarHBondContact OH-CB 3.44Å; V595-R599 PolarHBondContact O-N 3.43Å; V595-R599 VanDerWaalsContact O-N 3.13Å; V596-R599 PolarHBondContact O-N 3.14Å; V596-R599 VanDerWaalsContact O-N 3.12Å; L597-R599 VanDerWaalsContact C-N 3.29Å; L597-R599 PolarHBondContact O-N 3.35Å; R599-K601 VanDerWaalsContact C-N 3.34Å; R599-A602 PolarHBondContact O-N 3.27Å; R599-K603 PolarHBondContact O-N 2.91Å
600	L	93.4	Very high	92.5	Very high	0 Å²	0	58.9 Å²	58.9	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-57.5	-46.4	173.5	-74.4	160.7	0	0	0	111	N527 T530 I531 L534 A569 I573 V596 L597 K603 E604	N527-L600 PolarHBondContact ND2-O 3.11Å; N527-L600 WeakPolarHBondContact OD1-CD2 3.05Å; T530-L600 HydrophobicContact CG2-CD1 4.01Å; T530-L600 HydrophobicContact CG2-CD2 4.36Å; I531-L600 HydrophobicContact CD1-CB 4.13Å; I531-L600 HydrophobicContact CG1-CB 3.69Å; L534-L600 HydrophobicContact CD1-CD1 3.56Å; A569-L600 HydrophobicContact CB-CD2 4.4Å; I573-L600 HydrophobicContact CD1-CD2 3.66Å; I573-L600 HydrophobicContact CD1-CG 4.32Å; V596-L600 HydrophobicContact CG1-CD1 3.82Å; V596-L600 HydrophobicContact CG1-CG 4.22Å; V596-L600 WeakPolarHBondContact O-CG 3.24Å; V596-L600 PolarHBondContact O-N 3.05Å; L597-L600 PolarHBondContact O-N 2.87Å; L600-K603 PolarHBondContact O-N 3.28Å; L600-E604 PolarHBondContact O-N 3.11Å
601	K	95.6	Very high	92.6	Very high	88 Å²	88	58.9 Å²	58.9	38%	0.383	30%	0.297	S	S	.	.	H	α-helix	trans	-64.5	-43.4	177.2	-73.3	-176.3	174.3	-165.3	0	113.2	I531 E535 L597 R599 K603 E604 E605	I531-K601 HydrophobicContact CD1-CG 4.13Å; I531-K601 HydrophobicContact CG1-CG 4.36Å; I531-K601 HydrophobicContact CG2-CG 4.15Å; E535-K601 WeakPolarHBondContact OE1-CE 3.3Å; E535-K601 IonicContact OE1-NZ 3.54Å; E535-K601 PolarHBondContact OE1-NZ 3.39Å; L597-K601 HydrophobicContact CD1-CG 4.47Å; L597-K601 WeakPolarHBondContact O-CG 3.47Å; L597-K601 PolarHBondContact O-N 3.47Å; R599-K601 VanDerWaalsContact C-N 3.34Å; K601-K603 VanDerWaalsContact C-N 3.25Å; K601-K603 PolarHBondContact O-N 3.26Å; K601-E604 WeakPolarHBondContact O-CB 3.19Å; K601-E604 PolarHBondContact O-N 3.02Å; K601-E605 PolarHBondContact O-N 3.39Å; K601-E605 VanDerWaalsContact O-N 3.14Å
602	A	93.6	Very high	92.7	Very high	45 Å²	45	60.7 Å²	60.7	37%	0.372	30%	0.298	S	S	.	.	H	α-helix	trans	-64	-30.7	175.7	0	0	0	0	0	112.8	K598 R599 E606	K598-A602 WeakPolarHBondContact O-CB 3.06Å; K598-A602 PolarHBondContact O-N 3.16Å; K598-A602 VanDerWaalsContact O-N 3.11Å; R599-A602 PolarHBondContact O-N 3.27Å; A602-E606 PolarHBondContact O-N 2.74Å
603	K	92.9	Very high	92.7	Very high	23 Å²	23	61.7 Å²	61.7	10%	0.1	31%	0.31	C	S	.	.	H	α-helix	trans	-78.3	-31.6	172.4	-78.2	-55.1	-159.3	-178.5	0	113.4	I573 R599 L600 K601 E605 E606 W607	I573-K603 HydrophobicContact CD1-CB 3.87Å; I573-K603 HydrophobicContact CD1-CG 3.94Å; I573-K603 HydrophobicContact CG1-CG 4.28Å; I573-K603 HydrophobicContact CG2-CG 4.48Å; R599-K603 PolarHBondContact O-N 2.91Å; L600-K603 PolarHBondContact O-N 3.28Å; K601-K603 VanDerWaalsContact C-N 3.25Å; K601-K603 PolarHBondContact O-N 3.26Å; K603-E605 VanDerWaalsContact C-N 3.33Å; K603-E606 WeakPolarHBondContact CD-OE1 3.27Å; K603-E606 WeakPolarHBondContact CD-OE2 3.44Å; K603-E606 WeakPolarHBondContact CE-OE2 3.27Å; K603-E606 IonicContact NZ-OE1 3.5Å; K603-E606 PolarHBondContact NZ-OE1 2.84Å; K603-E606 IonicContact NZ-OE2 3.82Å; K603-E606 PolarHBondContact NZ-OE2 3.48Å; K603-W607 HydrophobicContact CB-CD2 4.36Å; K603-W607 HydrophobicContact CB-CH2 4.18Å; K603-W607 HydrophobicContact CB-CZ2 3.87Å; K603-W607 HydrophobicContact CD-CZ2 4.11Å; K603-W607 HydrophobicContact CG-CZ2 4.08Å; K603-W607 WeakPolarHBondContact O-CB 3.4Å; K603-W607 VanDerWaalsContact O-CD2 3.24Å; K603-W607 PolarHBondContact O-N 3.39Å
604	E	94.2	Very high	92.6	Very high	17 Å²	17	66 Å²	66	8%	0.079	33%	0.329	C	S	.	.	H	α-helix	trans	-58.6	-46	172.2	-174.6	68.8	-178.1	0	0	111.3	N527 I531 L600 K601 W607 R608	N527-E604 PolarHBondContact ND2-OE2 3.31Å; I531-E604 HydrophobicContact CD1-CB 3.9Å; I531-E604 HydrophobicContact CD1-CG 4.18Å; L600-E604 PolarHBondContact O-N 3.11Å; K601-E604 WeakPolarHBondContact O-CB 3.19Å; K601-E604 PolarHBondContact O-N 3.02Å; E604-W607 PolarHBondContact O-N 2.72Å; E604-R608 WeakPolarHBondContact O-CB 3.23Å; E604-R608 VanDerWaalsContact O-CG 3.31Å; E604-R608 WeakPolarHBondContact O-CG 3.36Å; E604-R608 PolarHBondContact O-N 3.16Å; E604-R608 IonicContact OE1-CZ 2.76Å; E604-R608 IonicContact OE1-NE 3.72Å; E604-R608 PolarHBondContact OE1-NE 3.34Å; E604-R608 IonicContact OE1-NH2 3.33Å; E604-R608 PolarHBondContact OE1-NH2 3.31Å
605	E	94.1	Very high	92.5	Very high	135 Å²	135	66.6 Å²	66.6	63%	0.631	33%	0.33	S	S	*	.	H	α-helix	trans	-63.4	-53.7	178	-168.3	163.7	-139	0	0	111.3	K601 K603 W607 R608 E609	K601-E605 PolarHBondContact O-N 3.39Å; K601-E605 VanDerWaalsContact O-N 3.14Å; K603-E605 VanDerWaalsContact C-N 3.33Å; E605-W607 PolarHBondContact O-N 2.79Å; E605-R608 PolarHBondContact O-N 3.16Å; E605-R608 VanDerWaalsContact O-N 3.08Å; E605-E609 PolarHBondContact O-N 2.89Å
606	E	93.8	Very high	92.3	Very high	65 Å²	65	68.2 Å²	68.2	30%	0.304	33%	0.329	S	S	.	.	H	α-helix	trans	-51.8	-39.7	174.2	-176.9	-164.8	103.8	0	0	112.8	L183 A602 K603 A610	L183-E606 WeakPolarHBondContact CD1-OE1 3.19Å; A602-E606 PolarHBondContact O-N 2.74Å; K603-E606 WeakPolarHBondContact CD-OE1 3.27Å; K603-E606 WeakPolarHBondContact CD-OE2 3.44Å; K603-E606 WeakPolarHBondContact CE-OE2 3.27Å; K603-E606 IonicContact NZ-OE1 3.5Å; K603-E606 PolarHBondContact NZ-OE1 2.84Å; K603-E606 IonicContact NZ-OE2 3.82Å; K603-E606 PolarHBondContact NZ-OE2 3.48Å; E606-A610 WeakPolarHBondContact O-CB 3.41Å; E606-A610 PolarHBondContact O-N 3.02Å; E606-A610 VanDerWaalsContact O-N 3.11Å
607	W	93.8	Very high	92.1	Very high	5 Å²	5	72.1 Å²	72.1	2%	0.019	35%	0.349	C	S	.	.	H	α-helix	trans	-80.4	-25.9	-178.4	-61.5	-11.8	0	0	0	113.1	K182 V523 L524 N527 R572 I573 K603 E604 E605 Q611	K182-W607 HydrophobicContact CD-CH2 4.32Å; K182-W607 HydrophobicContact CD-CZ2 3.79Å; V523-W607 HydrophobicContact CG1-CE3 3.9Å; V523-W607 HydrophobicContact CG1-CZ3 3.83Å; L524-W607 HydrophobicContact CD2-CB 3.73Å; N527-W607 HydrophobicContact CB-CE3 4.46Å; N527-W607 HydrophobicContact CB-CZ3 4.01Å; R572-W607 HydrophobicContact CG-CH2 4.49Å; I573-W607 HydrophobicContact CD1-CH2 4.07Å; I573-W607 HydrophobicContact CG1-CH2 3.74Å; I573-W607 HydrophobicContact CG1-CZ2 4.2Å; K603-W607 HydrophobicContact CB-CD2 4.36Å; K603-W607 HydrophobicContact CB-CH2 4.18Å; K603-W607 HydrophobicContact CB-CZ2 3.87Å; K603-W607 HydrophobicContact CD-CZ2 4.11Å; K603-W607 HydrophobicContact CG-CZ2 4.08Å; K603-W607 WeakPolarHBondContact O-CB 3.4Å; K603-W607 VanDerWaalsContact O-CD2 3.24Å; K603-W607 PolarHBondContact O-N 3.39Å; E604-W607 PolarHBondContact O-N 2.72Å; E605-W607 PolarHBondContact O-N 2.79Å; W607-Q611 WeakPolarHBondContact O-CB 3.22Å; W607-Q611 PolarHBondContact O-N 3Å
608	R	93.3	Very high	91.8	Very high	91 Å²	91	72.7 Å²	72.7	34%	0.343	35%	0.351	S	S	.	.	H	α-helix	trans	-77.5	-33.2	172.9	-73.4	179.3	-178.6	-71.4	-7.8	112.4	L524 E604 E605 Q611 Q612	L524-R608 HydrophobicContact CD2-CG 3.87Å; E604-R608 WeakPolarHBondContact O-CB 3.23Å; E604-R608 VanDerWaalsContact O-CG 3.31Å; E604-R608 WeakPolarHBondContact O-CG 3.36Å; E604-R608 PolarHBondContact O-N 3.16Å; E604-R608 IonicContact OE1-CZ 2.76Å; E604-R608 IonicContact OE1-NE 3.72Å; E604-R608 PolarHBondContact OE1-NE 3.34Å; E604-R608 IonicContact OE1-NH2 3.33Å; E604-R608 PolarHBondContact OE1-NH2 3.31Å; E605-R608 PolarHBondContact O-N 3.16Å; E605-R608 VanDerWaalsContact O-N 3.08Å; R608-Q611 PolarHBondContact O-N 2.84Å; R608-Q612 WeakPolarHBondContact O-CG 3.4Å; R608-Q612 PolarHBondContact O-N 2.83Å
609	E	91.8	Very high	91.5	Very high	135 Å²	135	72.3 Å²	72.3	63%	0.631	35%	0.345	S	S	*	.	H	α-helix	trans	-62.2	-46.5	166.1	-68.7	-175	158.5	0	0	110.8	E605 Q611 Q612 G613	E605-E609 PolarHBondContact O-N 2.89Å; E609-Q611 VanDerWaalsContact C-N 3.35Å; E609-Q611 PolarHBondContact O-N 3.5Å; E609-Q612 WeakPolarHBondContact O-CB 3.41Å; E609-Q612 PolarHBondContact O-N 3.38Å; E609-G613 PolarHBondContact O-N 3.08Å
610	A	90.1	Very high	91.2	Very high	38 Å²	38	70.1 Å²	70.1	31%	0.314	34%	0.34	S	S	.	.	H	α-helix	trans	-61.1	-40.5	175.6	0	0	0	0	0	112.6	E606 Q612 G613 F614	E606-A610 WeakPolarHBondContact O-CB 3.41Å; E606-A610 PolarHBondContact O-N 3.02Å; E606-A610 VanDerWaalsContact O-N 3.11Å; A610-Q612 VanDerWaalsContact C-N 3.29Å; A610-Q612 PolarHBondContact O-N 2.98Å; A610-G613 WeakPolarHBondContact O-CA 3.48Å; A610-G613 PolarHBondContact O-N 3.14Å; A610-F614 HydrophobicContact CB-CD2 4.27Å; A610-F614 HydrophobicContact CB-CE2 3.9Å; A610-F614 WeakPolarHBondContact O-CD2 3.06Å; A610-F614 PolarHBondContact O-N 3.32Å
611	Q	90.7	Very high	90.8	Very high	35 Å²	35	72.8 Å²	72.8	16%	0.164	35%	0.352	C	S	.	.	H	α-helix	trans	-58.1	-37.9	175.9	-165.4	-167.9	26.4	0	0	112	L520 D521 L524 W607 R608 E609 F614 N615	L520-Q611 HydrophobicContact CD2-CB 3.9Å; L520-Q611 HydrophobicContact CD2-CG 3.84Å; D521-Q611 PolarHBondContact OD1-NE2 2.92Å; L524-Q611 HydrophobicContact CD1-CB 4.28Å; L524-Q611 HydrophobicContact CD1-CG 4.04Å; W607-Q611 WeakPolarHBondContact O-CB 3.22Å; W607-Q611 PolarHBondContact O-N 3Å; R608-Q611 PolarHBondContact O-N 2.84Å; E609-Q611 VanDerWaalsContact C-N 3.35Å; E609-Q611 PolarHBondContact O-N 3.5Å; Q611-F614 PolarHBondContact O-N 3.31Å; Q611-N615 VanDerWaalsContact O-CB 3.22Å; Q611-N615 WeakPolarHBondContact O-CB 3.5Å; Q611-N615 PolarHBondContact O-N 2.89Å; Q611-N615 PolarHBondContact O-ND2 3.24Å
612	Q	89.9	Confident	90.4	Very high	143 Å²	143	71.2 Å²	71.2	67%	0.668	34%	0.344	S	S	*	.	H	α-helix	trans	-65	-39.5	174.4	-67.4	174.1	44	0	0	112.1	R608 E609 A610 K616	R608-Q612 WeakPolarHBondContact O-CG 3.4Å; R608-Q612 PolarHBondContact O-N 2.83Å; E609-Q612 WeakPolarHBondContact O-CB 3.41Å; E609-Q612 PolarHBondContact O-N 3.38Å; A610-Q612 VanDerWaalsContact C-N 3.29Å; A610-Q612 PolarHBondContact O-N 2.98Å; Q612-K616 PolarHBondContact O-N 3.39Å
613	G	88.6	Confident	89.9	Confident	39 Å²	39	72.6 Å²	72.6	40%	0.402	34%	0.343	S	S	.	.	H	α-helix	trans	-63.5	-49.3	173.9	0	0	0	0	0	112.8	E609 A610 K616 I617	E609-G613 PolarHBondContact O-N 3.08Å; A610-G613 WeakPolarHBondContact O-CA 3.48Å; A610-G613 PolarHBondContact O-N 3.14Å; G613-K616 WeakPolarHBondContact O-CB 3.2Å; G613-K616 PolarHBondContact O-N 3.36Å; G613-I617 PolarHBondContact O-N 3.18Å
614	F	90.4	Very high	89.5	Confident	91 Å²	91	77.7 Å²	77.7	40%	0.399	37%	0.365	S	S	.	.	H	α-helix	trans	-65.2	-39.9	178.3	-63.8	-55.8	0	0	0	112.4	L520 A610 Q611 K616 I617 W618	L520-F614 HydrophobicContact CD2-CD2 3.74Å; L520-F614 HydrophobicContact CD2-CE2 4.48Å; A610-F614 HydrophobicContact CB-CD2 4.27Å; A610-F614 HydrophobicContact CB-CE2 3.9Å; A610-F614 WeakPolarHBondContact O-CD2 3.06Å; A610-F614 PolarHBondContact O-N 3.32Å; Q611-F614 PolarHBondContact O-N 3.31Å; F614-K616 PolarHBondContact O-N 3.35Å; F614-K616 VanDerWaalsContact O-N 3.15Å; F614-I617 HydrophobicContact CD1-CD1 4.42Å; F614-I617 PolarHBondContact O-N 2.98Å; F614-W618 HydrophobicContact CB-CD2 4.07Å; F614-W618 HydrophobicContact CB-CE3 3.88Å; F614-W618 HydrophobicContact CB-CH2 3.59Å; F614-W618 HydrophobicContact CB-CZ2 3.78Å; F614-W618 HydrophobicContact CB-CZ3 3.64Å; F614-W618 HydrophobicContact CG-CH2 4.28Å; F614-W618 HydrophobicContact CG-CZ2 4.28Å; F614-W618 PolarHBondContact O-N 2.99Å
615	N	88.7	Confident	89.3	Confident	62 Å²	62	77.1 Å²	77.1	33%	0.332	36%	0.363	S	S	.	.	H	α-helix	trans	-58.8	-26.7	174.8	-82.1	-29.5	0	0	0	113.8	Q611 R619	Q611-N615 VanDerWaalsContact O-CB 3.22Å; Q611-N615 WeakPolarHBondContact O-CB 3.5Å; Q611-N615 PolarHBondContact O-N 2.89Å; Q611-N615 PolarHBondContact O-ND2 3.24Å; N615-R619 WeakPolarHBondContact O-CB 3.24Å; N615-R619 PolarHBondContact O-N 3.15Å
616	K	88.8	Confident	88.9	Confident	129 Å²	129	73.7 Å²	73.7	56%	0.561	35%	0.345	S	S	*	.	H	α-helix	trans	-73.3	-47	170.2	-173.3	176.6	-173.6	-81.5	0	111.3	Q612 G613 F614 R619 E620	Q612-K616 PolarHBondContact O-N 3.39Å; G613-K616 WeakPolarHBondContact O-CB 3.2Å; G613-K616 PolarHBondContact O-N 3.36Å; F614-K616 PolarHBondContact O-N 3.35Å; F614-K616 VanDerWaalsContact O-N 3.15Å; K616-R619 PolarHBondContact O-N 3.23Å; K616-E620 IonicContact NZ-OE1 3.84Å; K616-E620 PolarHBondContact NZ-OE1 3.35Å; K616-E620 WeakPolarHBondContact O-CG 3.49Å; K616-E620 PolarHBondContact O-N 2.81Å
617	I	89.4	Confident	88.5	Confident	87 Å²	87	71.8 Å²	71.8	45%	0.446	34%	0.337	S	S	.	.	H	α-helix	trans	-63	-49.4	-178.8	-62.6	168.4	0	0	0	110.8	G613 F614 R619 E620 Q621	G613-I617 PolarHBondContact O-N 3.18Å; F614-I617 HydrophobicContact CD1-CD1 4.42Å; F614-I617 PolarHBondContact O-N 2.98Å; I617-R619 VanDerWaalsContact C-N 3.32Å; I617-R619 PolarHBondContact O-N 3.39Å; I617-E620 PolarHBondContact O-N 3.32Å; I617-Q621 WeakPolarHBondContact O-CG 3.45Å; I617-Q621 PolarHBondContact O-N 3.36Å
618	W	88.6	Confident	88.2	Confident	16 Å²	16	73.1 Å²	73.1	6%	0.061	34%	0.343	C	S	.	.	H	α-helix	trans	-61.9	-37.7	177.6	-64.4	-40.4	0	0	0	112	E516 R517 L520 F614 Q621 Y622	E516-W618 VanDerWaalsContact C-CZ2 3.5Å; E516-W618 HydrophobicContact CB-CZ2 3.86Å; E516-W618 WeakPolarHBondContact O-CZ2 3.48Å; E516-W618 PolarHBondContact OE2-NE1 3.15Å; R517-W618 HydrophobicContact CB-CD2 4.39Å; R517-W618 HydrophobicContact CB-CE3 4.08Å; R517-W618 HydrophobicContact CB-CH2 4.14Å; R517-W618 HydrophobicContact CB-CZ2 4.45Å; R517-W618 HydrophobicContact CB-CZ3 3.95Å; R517-W618 HydrophobicContact CG-CE3 4.16Å; R517-W618 HydrophobicContact CG-CH2 4.48Å; R517-W618 HydrophobicContact CG-CZ3 3.92Å; L520-W618 HydrophobicContact CB-CH2 4.01Å; L520-W618 HydrophobicContact CD2-CH2 3.64Å; L520-W618 HydrophobicContact CD2-CZ3 4.17Å; L520-W618 HydrophobicContact CG-CH2 4.48Å; F614-W618 HydrophobicContact CB-CD2 4.07Å; F614-W618 HydrophobicContact CB-CE3 3.88Å; F614-W618 HydrophobicContact CB-CH2 3.59Å; F614-W618 HydrophobicContact CB-CZ2 3.78Å; F614-W618 HydrophobicContact CB-CZ3 3.64Å; F614-W618 HydrophobicContact CG-CH2 4.28Å; F614-W618 HydrophobicContact CG-CZ2 4.28Å; F614-W618 PolarHBondContact O-N 2.99Å; W618-Q621 PolarHBondContact O-N 2.98Å; W618-Y622 WeakPolarHBondContact O-CB 3.42Å; W618-Y622 WeakPolarHBondContact O-CD2 3.37Å; W618-Y622 PolarHBondContact O-N 3.26Å
619	R	86.6	Confident	87.9	Confident	159 Å²	159	69.7 Å²	69.7	60%	0.6	33%	0.333	S	S	*	.	H	α-helix	trans	-62.7	-47.7	172.9	-174.1	-175.9	-60.4	152.7	4.3	111.7	N615 K616 I617 Q621 Y622 E623	N615-R619 WeakPolarHBondContact O-CB 3.24Å; N615-R619 PolarHBondContact O-N 3.15Å; K616-R619 PolarHBondContact O-N 3.23Å; I617-R619 VanDerWaalsContact C-N 3.32Å; I617-R619 PolarHBondContact O-N 3.39Å; R619-Q621 PolarHBondContact O-N 3.48Å; R619-Y622 PolarHBondContact O-N 2.84Å; R619-E623 WeakPolarHBondContact O-CB 3.32Å; R619-E623 PolarHBondContact O-N 3.45Å
620	E	86.4	Confident	87.6	Confident	69 Å²	69	66.7 Å²	66.7	32%	0.322	32%	0.321	S	S	.	.	H	α-helix	trans	-62.8	-28.3	176.9	-76.1	-175.4	-139.5	0	0	113.1	K616 I617 K624	K616-E620 IonicContact NZ-OE1 3.84Å; K616-E620 PolarHBondContact NZ-OE1 3.35Å; K616-E620 WeakPolarHBondContact O-CG 3.49Å; K616-E620 PolarHBondContact O-N 2.81Å; I617-E620 PolarHBondContact O-N 3.32Å; E620-K624 WeakPolarHBondContact O-CB 3.44Å; E620-K624 WeakPolarHBondContact O-CD 3.49Å; E620-K624 WeakPolarHBondContact O-CE 3.45Å; E620-K624 WeakPolarHBondContact O-CG 3.44Å; E620-K624 IonicContact OE2-NZ 3.82Å; E620-K624 PolarHBondContact OE2-NZ 2.83Å
621	Q	85.3	Confident	87.4	Confident	56 Å²	56	65.2 Å²	65.2	26%	0.262	31%	0.308	S	S	.	.	H	α-helix	trans	-76.6	-44.6	172.8	-72.9	170.1	-53.7	0	0	111.5	C513 I617 W618 R619 K624 A625	C513-Q621 PolarHBondContact SG-OE1 2.74Å; C513-Q621 VanDerWaalsContact SG-OE1 3.36Å; I617-Q621 WeakPolarHBondContact O-CG 3.45Å; I617-Q621 PolarHBondContact O-N 3.36Å; W618-Q621 PolarHBondContact O-N 2.98Å; R619-Q621 PolarHBondContact O-N 3.48Å; Q621-K624 PolarHBondContact O-N 2.84Å; Q621-A625 VanDerWaalsContact O-CB 3.23Å; Q621-A625 WeakPolarHBondContact O-CB 3.36Å; Q621-A625 PolarHBondContact O-N 3.5Å
622	Y	86.8	Confident	86.9	Confident	56 Å²	56	68.4 Å²	68.4	22%	0.22	32%	0.322	C	S	.	.	H	α-helix	trans	-57.4	-51.9	175.7	-102.8	-100.1	0	0	0	111.4	L510 C513 E514 W618 R619 K624 A625 Y626 L955	L510-Y622 HydrophobicContact CD2-CD1 3.4Å; L510-Y622 HydrophobicContact CD2-CD2 3.96Å; L510-Y622 HydrophobicContact CD2-CE1 3.59Å; L510-Y622 HydrophobicContact CD2-CE2 4.13Å; L510-Y622 HydrophobicContact CD2-CG 3.6Å; C513-Y622 HydrophobicContact CB-CD2 4.09Å; C513-Y622 HydrophobicContact CB-CE2 3.74Å; E514-Y622 PolarHBondContact OE2-OH 3.23Å; W618-Y622 WeakPolarHBondContact O-CB 3.42Å; W618-Y622 WeakPolarHBondContact O-CD2 3.37Å; W618-Y622 PolarHBondContact O-N 3.26Å; R619-Y622 PolarHBondContact O-N 2.84Å; Y622-K624 VanDerWaalsContact C-N 3.32Å; Y622-K624 PolarHBondContact O-N 3.3Å; Y622-A625 PolarHBondContact O-N 3.47Å; Y622-Y626 WeakPolarHBondContact O-CB 3.43Å; Y622-Y626 PolarHBondContact O-N 2.99Å; Y622-L955 HydrophobicContact CD1-CD2 3.99Å; Y622-L955 HydrophobicContact CG-CD2 4.43Å
623	E	84.4	Confident	86.7	Confident	74 Å²	74	65.3 Å²	65.3	35%	0.346	31%	0.308	S	S	.	.	H	α-helix	trans	-56.6	-44.2	179.5	-172.1	174.1	-168.7	0	0	111.8	R619 A625 Q957	R619-E623 WeakPolarHBondContact O-CB 3.32Å; R619-E623 PolarHBondContact O-N 3.45Å; E623-A625 PolarHBondContact O-N 3.08Å; E623-Q957 PolarHBondContact OE1-NE2 3.38Å
624	K	84.9	Confident	86.6	Confident	129 Å²	129	63.5 Å²	63.5	56%	0.561	29%	0.289	S	S	*	.	H	α-helix	trans	-75	-22.4	180	-67.7	168	-163.3	151.7	0	114.2	E620 Q621 Y622 K628	E620-K624 WeakPolarHBondContact O-CB 3.44Å; E620-K624 WeakPolarHBondContact O-CD 3.49Å; E620-K624 WeakPolarHBondContact O-CE 3.45Å; E620-K624 WeakPolarHBondContact O-CG 3.44Å; E620-K624 IonicContact OE2-NZ 3.82Å; E620-K624 PolarHBondContact OE2-NZ 2.83Å; Q621-K624 PolarHBondContact O-N 2.84Å; Y622-K624 VanDerWaalsContact C-N 3.32Å; Y622-K624 PolarHBondContact O-N 3.3Å; K624-K628 VanDerWaalsContact O-CD 3.32Å; K624-K628 WeakPolarHBondContact O-CD 3.42Å; K624-K628 WeakPolarHBondContact O-CE 3.33Å
625	A	88	Confident	86.2	Confident	5 Å²	5	63.4 Å²	63.4	4%	0.041	30%	0.296	C	S	.	.	H	α-helix	trans	-98.9	-29.9	-177.6	0	0	0	0	0	113.3	L510 Q621 Y622 E623 L627 K628 S629	L510-A625 HydrophobicContact CD1-CB 4.13Å; L510-A625 HydrophobicContact CD2-CB 4.05Å; L510-A625 HydrophobicContact CG-CB 3.81Å; Q621-A625 VanDerWaalsContact O-CB 3.23Å; Q621-A625 WeakPolarHBondContact O-CB 3.36Å; Q621-A625 PolarHBondContact O-N 3.5Å; Y622-A625 PolarHBondContact O-N 3.47Å; E623-A625 PolarHBondContact O-N 3.08Å; A625-L627 PolarHBondContact O-N 2.91Å; A625-K628 CarbonylContact O-C 3.55Å; A625-K628 WeakPolarHBondContact O-CA 3.4Å; A625-K628 PolarHBondContact O-N 2.86Å; A625-K628 VanDerWaalsContact O-N 3.08Å; A625-S629 PolarHBondContact O-N 3.39Å; A625-S629 PolarHBondContact O-OG 2.97Å
626	Y	87.1	Confident	86.1	Confident	63 Å²	63	64 Å²	64	25%	0.247	30%	0.299	C	S	.	.	H	α-helix	trans	-56.2	-56.2	-167.6	178.9	-108.4	0	0	0	114	Y622 K628 S629 L630 A950 L955	Y622-Y626 WeakPolarHBondContact O-CB 3.43Å; Y622-Y626 PolarHBondContact O-N 2.99Å; Y626-K628 PolarHBondContact O-N 3.48Å; Y626-S629 PolarHBondContact O-N 3.1Å; Y626-S629 PolarHBondContact O-OG 3.33Å; Y626-L630 HydrophobicContact CE1-CD1 4.33Å; Y626-L630 PolarHBondContact O-N 3.14Å; Y626-A950 HydrophobicContact CE1-CB 3.9Å; Y626-L955 HydrophobicContact CD1-CB 3.91Å; Y626-L955 WeakPolarHBondContact CD1-O 3.4Å; Y626-L955 HydrophobicContact CD2-CB 4.49Å; Y626-L955 HydrophobicContact CD2-CD1 4.35Å; Y626-L955 HydrophobicContact CE1-CB 4.14Å; Y626-L955 HydrophobicContact CE2-CD1 4.34Å; Y626-L955 HydrophobicContact CG-CB 4.1Å
627	L	85.2	Confident	86.3	Confident	26 Å²	26	60.3 Å²	60.3	14%	0.136	28%	0.283	C	S	.	.	H	α-helix	trans	-66.5	-27.7	179	-64.5	178.9	0	0	0	112.5	A625 L630 R992 E993	A625-L627 PolarHBondContact O-N 2.91Å; L627-L630 HydrophobicContact CD2-CD1 4.43Å; L627-R992 HydrophobicContact CB-CB 4.27Å; L627-E993 HydrophobicContact CD1-CB 4.32Å; L627-E993 HydrophobicContact CD1-CG 3.42Å; L627-E993 VanDerWaalsContact CD1-CG 3.42Å
628	K	87.9	Confident	86.3	Confident	32 Å²	32	58.5 Å²	58.5	14%	0.139	27%	0.272	C	S	.	.	H	α-helix	trans	-79.1	-24.2	178.8	-51.2	-177.3	-169.9	-112.2	0	112.8	Y506 K624 A625 Y626 D631 D989	Y506-K628 HydrophobicContact CD1-CB 3.83Å; Y506-K628 HydrophobicContact CD1-CD 3.88Å; Y506-K628 HydrophobicContact CD2-CB 3.46Å; Y506-K628 VanDerWaalsContact CD2-CB 3.46Å; Y506-K628 WeakPolarHBondContact CD2-O 3.33Å; Y506-K628 HydrophobicContact CE1-CB 4.16Å; Y506-K628 HydrophobicContact CE1-CD 3.59Å; Y506-K628 HydrophobicContact CE2-CB 3.82Å; Y506-K628 HydrophobicContact CE2-CD 4.34Å; Y506-K628 HydrophobicContact CG-CB 3.46Å; Y506-K628 VanDerWaalsContact CG-CB 3.46Å; Y506-K628 HydrophobicContact CG-CD 4.38Å; K624-K628 VanDerWaalsContact O-CD 3.32Å; K624-K628 WeakPolarHBondContact O-CD 3.42Å; K624-K628 WeakPolarHBondContact O-CE 3.33Å; A625-K628 CarbonylContact O-C 3.55Å; A625-K628 WeakPolarHBondContact O-CA 3.4Å; A625-K628 PolarHBondContact O-N 2.86Å; A625-K628 VanDerWaalsContact O-N 3.08Å; Y626-K628 PolarHBondContact O-N 3.48Å; K628-D631 PolarHBondContact O-N 3.48Å; K628-D989 WeakPolarHBondContact CE-OD1 3.06Å; K628-D989 IonicContact NZ-OD1 3.02Å; K628-D989 PolarHBondContact NZ-OD1 2.92Å; K628-D989 IonicContact NZ-OD2 2.66Å; K628-D989 PolarHBondContact NZ-OD2 2.83Å
629	S	86.5	Confident	86.4	Confident	20 Å²	20	63.8 Å²	63.8	14%	0.14	30%	0.298	C	S	.	.	H	α-helix	trans	-77.9	-25.4	175	60.6	0	0	0	0	113.6	T504 L510 A625 Y626 D631	T504-S629 WeakPolarHBondContact OG1-CA 3.29Å; L510-S629 WeakPolarHBondContact CD1-OG 3.33Å; A625-S629 PolarHBondContact O-N 3.39Å; A625-S629 PolarHBondContact O-OG 2.97Å; Y626-S629 PolarHBondContact O-N 3.1Å; Y626-S629 PolarHBondContact O-OG 3.33Å; S629-D631 VanDerWaalsContact C-N 3.28Å
630	L	84.9	Confident	86.7	Confident	71 Å²	71	60.5 Å²	60.5	37%	0.372	29%	0.292	S	S	.	.	H	α-helix	trans	-70.8	-28	172.3	-58.5	175	0	0	0	111.6	Y626 L627 H632 I997	Y626-L630 HydrophobicContact CE1-CD1 4.33Å; Y626-L630 PolarHBondContact O-N 3.14Å; L627-L630 HydrophobicContact CD2-CD1 4.43Å; L630-H632 VanDerWaalsContact C-N 3.31Å; L630-H632 PolarHBondContact O-N 3.3Å; L630-H632 PolarHBondContact O-ND1 3.01Å; L630-I997 HydrophobicContact CB-CG2 3.94Å
631	D	85.3	Confident	87.1	Confident	8 Å²	8	57.9 Å²	57.9	4%	0.043	28%	0.28	C	S	.	.			trans	-78.6	70.5	179.3	-176.4	17.7	0	0	0	112.8	K628 S629 Q633 G634 R992 F1003	K628-D631 PolarHBondContact O-N 3.48Å; S629-D631 VanDerWaalsContact C-N 3.28Å; D631-Q633 PolarHBondContact O-N 3.5Å; D631-G634 VanDerWaalsContact OD1-CA 3.31Å; D631-G634 WeakPolarHBondContact OD1-CA 3.32Å; D631-G634 PolarHBondContact OD1-N 2.93Å; D631-R992 IonicContact OD2-CZ 3.61Å; D631-R992 IonicContact OD2-NE 2.73Å; D631-R992 PolarHBondContact OD2-NE 3.45Å; D631-R992 IonicContact OD2-NH2 2.7Å; D631-R992 PolarHBondContact OD2-NH2 2.85Å; D631-F1003 WeakPolarHBondContact OD2-CE2 3.16Å; D631-F1003 WeakPolarHBondContact OD2-CZ 3.31Å
632	H	82.1	Confident	87.4	Confident	101 Å²	101	59.2 Å²	59.2	47%	0.468	29%	0.287	S	S	.	.	S	Bend	trans	-71.5	-11.7	176.5	68.2	-78.3	0	0	0	114.3	T504 L630	T504-H632 HydrophobicContact CG2-CB 4.43Å; L630-H632 VanDerWaalsContact C-N 3.31Å; L630-H632 PolarHBondContact O-N 3.3Å; L630-H632 PolarHBondContact O-ND1 3.01Å
633	Q	84.8	Confident	87.7	Confident	78 Å²	78	60.9 Å²	60.9	36%	0.364	30%	0.296	S	S	.	.	S	Bend	trans	-99.3	-42	-177.2	-66	-63.5	-22.1	0	0	112.9	D631 V635 N636 F637 Y1000	D631-Q633 PolarHBondContact O-N 3.5Å; Q633-V635 PolarHBondContact O-N 2.75Å; Q633-V635 VanDerWaalsContact O-N 3.14Å; Q633-N636 PolarHBondContact O-N 3.38Å; Q633-N636 VanDerWaalsContact O-N 3.08Å; Q633-F637 WeakPolarHBondContact O-CB 3.49Å; Q633-F637 PolarHBondContact O-N 2.63Å; Q633-Y1000 HydrophobicContact CB-CD1 3.75Å; Q633-Y1000 HydrophobicContact CB-CD2 4.43Å; Q633-Y1000 HydrophobicContact CB-CE1 3.97Å; Q633-Y1000 HydrophobicContact CB-CG 4Å; Q633-Y1000 HydrophobicContact CG-CD1 4.32Å; Q633-Y1000 HydrophobicContact CG-CE1 4.06Å
634	G	85.6	Confident	88.2	Confident	2 Å²	2	59.8 Å²	59.8	2%	0.021	30%	0.299	C	S	.	.	H	α-helix	trans	-49.5	-46.7	-163	0	0	0	0	0	115.9	D631 F637 K638	D631-G634 VanDerWaalsContact OD1-CA 3.31Å; D631-G634 WeakPolarHBondContact OD1-CA 3.32Å; D631-G634 PolarHBondContact OD1-N 2.93Å; G634-F637 PolarHBondContact O-N 3.48Å; G634-K638 VanDerWaalsContact O-CB 3.28Å; G634-K638 WeakPolarHBondContact O-CB 3.48Å; G634-K638 PolarHBondContact O-N 3.39Å
635	V	82.8	Confident	88.7	Confident	89 Å²	89	54 Å²	54	54%	0.539	28%	0.275	S	S	.	.	H	α-helix	trans	-64.4	-47.6	-178.8	-177.1	0	0	0	0	111.7	Q633 Q639	Q633-V635 PolarHBondContact O-N 2.75Å; Q633-V635 VanDerWaalsContact O-N 3.14Å; V635-Q639 PolarHBondContact O-N 3.39Å
636	N	87.1	Confident	89	Confident	73 Å²	73	61.1 Å²	61.1	39%	0.39	30%	0.3	S	S	.	.	H	α-helix	trans	-71.1	-39.8	179.7	-62.2	-69.8	0	0	0	111	Q633 N640	Q633-N636 PolarHBondContact O-N 3.38Å; Q633-N636 VanDerWaalsContact O-N 3.08Å; N636-N640 WeakPolarHBondContact O-CB 3.32Å; N636-N640 PolarHBondContact O-N 3.41Å; N636-N640 VanDerWaalsContact O-N 3.08Å; N636-N640 PolarHBondContact O-ND2 3.17Å
637	F	91.8	Very high	89.3	Confident	53 Å²	53	60.6 Å²	60.6	23%	0.232	31%	0.306	C	S	.	.	H	α-helix	trans	-58.4	-56.8	175.7	179.3	-98.5	0	0	0	110.6	Q633 G634 Q639 N640 D641 Y1000	Q633-F637 WeakPolarHBondContact O-CB 3.49Å; Q633-F637 PolarHBondContact O-N 2.63Å; G634-F637 PolarHBondContact O-N 3.48Å; F637-Q639 VanDerWaalsContact C-N 3.3Å; F637-Q639 PolarHBondContact O-N 2.98Å; F637-N640 PolarHBondContact O-N 2.96Å; F637-N640 VanDerWaalsContact O-N 3.14Å; F637-D641 HydrophobicContact CE1-CB 4.28Å; F637-D641 HydrophobicContact CZ-CB 4.29Å; F637-D641 WeakPolarHBondContact O-CB 3.45Å; F637-D641 PolarHBondContact O-N 3.48Å; F637-Y1000 HydrophobicContact CB-CD2 4.18Å; F637-Y1000 AromaticContact CD1-CD2 3.87Å; F637-Y1000 HydrophobicContact CD1-CD2 3.87Å; F637-Y1000 WeakPolarHBondContact CD1-O 3.35Å; F637-Y1000 AromaticContact CD2-CD2 3.83Å; F637-Y1000 HydrophobicContact CD2-CD2 3.83Å; F637-Y1000 HydrophobicContact CD2-CE2 4.07Å; F637-Y1000 HydrophobicContact CE1-CD2 4.21Å; F637-Y1000 WeakPolarHBondContact CE1-O 3.38Å; F637-Y1000 HydrophobicContact CE2-CD2 4.17Å; F637-Y1000 HydrophobicContact CE2-CE2 4.28Å; F637-Y1000 AromaticContact CG-CD2 3.67Å; F637-Y1000 HydrophobicContact CG-CD2 3.67Å; F637-Y1000 HydrophobicContact CG-CE2 4.36Å; F637-Y1000 HydrophobicContact CZ-CD2 4.36Å
638	K	91.1	Very high	89.8	Confident	49 Å²	49	66.7 Å²	66.7	21%	0.213	33%	0.331	C	S	.	.	H	α-helix	trans	-55.4	-42.2	-178.5	-171	167.6	-167.5	175.5	0	112.3	G634 M642 S984 E988 T1004	G634-K638 VanDerWaalsContact O-CB 3.28Å; G634-K638 WeakPolarHBondContact O-CB 3.48Å; G634-K638 PolarHBondContact O-N 3.39Å; K638-M642 WeakPolarHBondContact O-CB 3.28Å; K638-M642 VanDerWaalsContact O-CG 3.32Å; K638-M642 WeakPolarHBondContact O-CG 3.42Å; K638-M642 PolarHBondContact O-N 3.01Å; K638-S984 PolarHBondContact NZ-OG 3.48Å; K638-E988 IonicContact NZ-OE1 3.03Å; K638-E988 PolarHBondContact NZ-OE1 3.1Å; K638-T1004 HydrophobicContact CB-CG2 4.38Å; K638-T1004 HydrophobicContact CG-CG2 3.79Å
639	Q	89.4	Confident	90.1	Very high	127 Å²	127	67.5 Å²	67.5	59%	0.593	34%	0.341	S	S	*	.	H	α-helix	trans	-71.3	-35.7	179.9	-158.4	-163.6	46.3	0	0	113.6	V635 F637 K643	V635-Q639 PolarHBondContact O-N 3.39Å; F637-Q639 VanDerWaalsContact C-N 3.3Å; F637-Q639 PolarHBondContact O-N 2.98Å; Q639-K643 VanDerWaalsContact O-CE 3.31Å; Q639-K643 WeakPolarHBondContact O-CE 3.27Å; Q639-K643 WeakPolarHBondContact O-CG 3.28Å
640	N	92.6	Very high	90.6	Very high	89 Å²	89	67 Å²	67	48%	0.476	34%	0.337	S	S	.	.	H	α-helix	trans	-80.9	-37.4	179.2	-71.4	-21.6	0	0	0	112	N636 F637 K643 A644	N636-N640 WeakPolarHBondContact O-CB 3.32Å; N636-N640 PolarHBondContact O-N 3.41Å; N636-N640 VanDerWaalsContact O-N 3.08Å; N636-N640 PolarHBondContact O-ND2 3.17Å; F637-N640 PolarHBondContact O-N 2.96Å; F637-N640 VanDerWaalsContact O-N 3.14Å; N640-K643 WeakPolarHBondContact O-CA 3.36Å; N640-K643 WeakPolarHBondContact O-CB 3.32Å; N640-K643 PolarHBondContact O-N 2.98Å; N640-K643 PolarHBondContact OD1-NZ 3.39Å; N640-A644 PolarHBondContact O-N 2.91Å
641	D	94.8	Very high	91.1	Very high	14 Å²	14	65 Å²	65	8%	0.075	33%	0.327	C	S	.	.	H	α-helix	trans	-64.7	-41	178.2	-169.9	54.5	0	0	0	112	F637 K643 A644 L645 R912 T1004	F637-D641 HydrophobicContact CE1-CB 4.28Å; F637-D641 HydrophobicContact CZ-CB 4.29Å; F637-D641 WeakPolarHBondContact O-CB 3.45Å; F637-D641 PolarHBondContact O-N 3.48Å; D641-K643 PolarHBondContact O-N 2.88Å; D641-A644 PolarHBondContact O-N 3.22Å; D641-A644 VanDerWaalsContact O-N 3.12Å; D641-L645 WeakPolarHBondContact O-CB 3.35Å; D641-L645 VanDerWaalsContact O-CG 3.3Å; D641-L645 WeakPolarHBondContact O-CG 3.12Å; D641-L645 PolarHBondContact O-N 3.42Å; D641-L645 WeakPolarHBondContact OD2-CD1 3.31Å; D641-R912 IonicContact OD1-CZ 3.96Å; D641-R912 IonicContact OD1-NH1 2.74Å; D641-R912 PolarHBondContact OD1-NH1 3.38Å; D641-R912 IonicContact OD1-NH2 2.79Å; D641-R912 PolarHBondContact OD1-NH2 3.47Å; D641-R912 IonicContact OD2-CZ 3.44Å; D641-R912 IonicContact OD2-NH1 2.59Å; D641-R912 PolarHBondContact OD2-NH1 2.96Å; D641-R912 IonicContact OD2-NH2 3.45Å; D641-R912 PolarHBondContact OD2-NH2 3.01Å; D641-T1004 VanDerWaalsContact OD2-CB 3.25Å; D641-T1004 WeakPolarHBondContact OD2-CB 3.31Å; D641-T1004 PolarHBondContact OD2-OG1 3.44Å
642	M	92.3	Very high	91.5	Very high	85 Å²	85	68.1 Å²	68.1	42%	0.419	34%	0.343	S	S	.	.	H	α-helix	trans	-64.9	-6.2	170.5	-73.2	-174	68.5	0	0	114.7	K638 R646 T1004	K638-M642 WeakPolarHBondContact O-CB 3.28Å; K638-M642 VanDerWaalsContact O-CG 3.32Å; K638-M642 WeakPolarHBondContact O-CG 3.42Å; K638-M642 PolarHBondContact O-N 3.01Å; M642-R646 PolarHBondContact O-NE 3Å; M642-T1004 HydrophobicContact CG-CG2 4.44Å
643	K	94.1	Very high	92.2	Very high	90 Å²	90	66.9 Å²	66.9	39%	0.391	34%	0.338	S	S	.	.	H	α-helix	trans	-95.8	-48.7	166.6	-57.9	165.2	-165.7	158.9	0	110.1	Q639 N640 D641 L645 R646 S649	Q639-K643 VanDerWaalsContact O-CE 3.31Å; Q639-K643 WeakPolarHBondContact O-CE 3.27Å; Q639-K643 WeakPolarHBondContact O-CG 3.28Å; N640-K643 WeakPolarHBondContact O-CA 3.36Å; N640-K643 WeakPolarHBondContact O-CB 3.32Å; N640-K643 PolarHBondContact O-N 2.98Å; N640-K643 PolarHBondContact OD1-NZ 3.39Å; D641-K643 PolarHBondContact O-N 2.88Å; K643-L645 VanDerWaalsContact C-N 3.32Å; K643-L645 PolarHBondContact O-N 3.35Å; K643-R646 VanDerWaalsContact O-CB 3.31Å; K643-R646 WeakPolarHBondContact O-CB 3.47Å; K643-R646 WeakPolarHBondContact O-CD 3.32Å; K643-R646 VanDerWaalsContact O-CG 3.23Å; K643-R646 WeakPolarHBondContact O-CG 3.15Å; K643-R646 PolarHBondContact O-N 3.36Å; K643-S649 WeakPolarHBondContact O-CB 3.49Å; K643-S649 PolarHBondContact O-OG 3.36Å; K643-S649 VanDerWaalsContact O-OG 3.13Å
644	A	93.6	Very high	92.7	Very high	51 Å²	51	63.2 Å²	63.2	42%	0.421	32%	0.32	S	S	.	.	H	α-helix	trans	-57.7	-39.2	179.5	0	0	0	0	0	113.4	N640 D641 R646	N640-A644 PolarHBondContact O-N 2.91Å; D641-A644 PolarHBondContact O-N 3.22Å; D641-A644 VanDerWaalsContact O-N 3.12Å; A644-R646 PolarHBondContact O-N 3.04Å
645	L	94.9	Very high	93	Very high	9 Å²	9	65.5 Å²	65.5	5%	0.047	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.2	10.7	179.3	-66.2	174.8	0	0	0	115.1	D641 K643 L905 T908 V1008 N1011	D641-L645 WeakPolarHBondContact O-CB 3.35Å; D641-L645 VanDerWaalsContact O-CG 3.3Å; D641-L645 WeakPolarHBondContact O-CG 3.12Å; D641-L645 PolarHBondContact O-N 3.42Å; D641-L645 WeakPolarHBondContact OD2-CD1 3.31Å; K643-L645 VanDerWaalsContact C-N 3.32Å; K643-L645 PolarHBondContact O-N 3.35Å; L645-L905 HydrophobicContact CD2-CD2 3.95Å; L645-T908 HydrophobicContact CD2-CG2 3.88Å; L645-V1008 HydrophobicContact CD1-CG2 3.63Å; L645-V1008 HydrophobicContact CD2-CG2 3.86Å; L645-V1008 HydrophobicContact CG-CG2 4.42Å; L645-N1011 PolarHBondContact O-ND2 3.41Å
646	R	94.4	Very high	93.5	Very high	154 Å²	154	64 Å²	64	58%	0.581	32%	0.323	S	S	*	.	S	Bend	trans	-94.7	139.6	179	-61.9	173.9	-176.6	-156	-4	110.1	M642 K643 A644 K648 S649 L650	M642-R646 PolarHBondContact O-NE 3Å; K643-R646 VanDerWaalsContact O-CB 3.31Å; K643-R646 WeakPolarHBondContact O-CB 3.47Å; K643-R646 WeakPolarHBondContact O-CD 3.32Å; K643-R646 VanDerWaalsContact O-CG 3.23Å; K643-R646 WeakPolarHBondContact O-CG 3.15Å; K643-R646 PolarHBondContact O-N 3.36Å; A644-R646 PolarHBondContact O-N 3.04Å; R646-K648 VanDerWaalsContact C-N 3.3Å; R646-K648 PolarHBondContact O-N 3.19Å; R646-S649 WeakPolarHBondContact O-CA 3.21Å; R646-S649 WeakPolarHBondContact O-CB 3.39Å; R646-S649 PolarHBondContact O-N 3.03Å; R646-L650 PolarHBondContact O-N 3.48Å
647	S	94.4	Very high	93.8	Very high	52 Å²	52	63 Å²	63	36%	0.364	32%	0.318	S	S	.	.	H	α-helix	trans	-49.3	-47.2	-179.3	-42.5	0	0	0	0	113	S649 L650 L651 F901	S647-S649 VanDerWaalsContact C-N 3.34Å; S647-S649 PolarHBondContact O-N 3.03Å; S647-L650 PolarHBondContact O-N 3.13Å; S647-L651 WeakPolarHBondContact O-CB 3.25Å; S647-L651 PolarHBondContact O-N 2.95Å; S647-F901 WeakPolarHBondContact O-CE1 3.42Å
648	K	94.8	Very high	93.7	Very high	153 Å²	153	62.1 Å²	62.1	67%	0.665	31%	0.313	S	S	*	.	H	α-helix	trans	-60.3	-38.3	175.1	179	159.7	-176	151.9	0	113.5	R646 L651 N652	R646-K648 VanDerWaalsContact C-N 3.3Å; R646-K648 PolarHBondContact O-N 3.19Å; K648-L651 PolarHBondContact O-N 3.24Å; K648-N652 WeakPolarHBondContact CE-OD1 3.2Å; K648-N652 WeakPolarHBondContact CG-OD1 3.32Å; K648-N652 WeakPolarHBondContact O-CB 3.14Å; K648-N652 PolarHBondContact O-N 2.83Å; K648-N652 PolarHBondContact O-OD1 3.12Å
649	S	96	Very high	93.7	Very high	50 Å²	50	64.1 Å²	64.1	35%	0.35	33%	0.326	S	S	.	.	H	α-helix	trans	-71.9	-29.3	178.4	-66.5	0	0	0	0	113	K643 R646 S647 E653	K643-S649 WeakPolarHBondContact O-CB 3.49Å; K643-S649 PolarHBondContact O-OG 3.36Å; K643-S649 VanDerWaalsContact O-OG 3.13Å; R646-S649 WeakPolarHBondContact O-CA 3.21Å; R646-S649 WeakPolarHBondContact O-CB 3.39Å; R646-S649 PolarHBondContact O-N 3.03Å; S647-S649 VanDerWaalsContact C-N 3.34Å; S647-S649 PolarHBondContact O-N 3.03Å; S649-E653 PolarHBondContact O-N 2.99Å
650	L	95.8	Very high	93.6	Very high	8 Å²	8	62.9 Å²	62.9	4%	0.042	32%	0.321	C	S	.	.	H	α-helix	trans	-73.9	-39.1	171.1	-61.2	171.9	0	0	0	111.5	R646 S647 E653 I654 Y900 F901 R904 L905	R646-L650 PolarHBondContact O-N 3.48Å; S647-L650 PolarHBondContact O-N 3.13Å; L650-E653 WeakPolarHBondContact O-CB 3.29Å; L650-E653 PolarHBondContact O-N 3.05Å; L650-I654 PolarHBondContact O-N 3.29Å; L650-Y900 HydrophobicContact CB-CE1 4.16Å; L650-Y900 PolarHBondContact O-OH 3.11Å; L650-F901 HydrophobicContact CB-CD1 4.28Å; L650-F901 HydrophobicContact CD1-CD1 4.43Å; L650-R904 HydrophobicContact CD1-CB 4.05Å; L650-R904 HydrophobicContact CD2-CB 4.23Å; L650-L905 HydrophobicContact CD1-CD2 4.24Å; L650-L905 HydrophobicContact CD1-CG 4.17Å
651	L	95.1	Very high	93.2	Very high	31 Å²	31	62.3 Å²	62.3	16%	0.162	31%	0.312	C	S	.	.	H	α-helix	trans	-61.3	-54.1	174.7	-162.7	85	0	0	0	110.6	S647 K648 E653 I654 E655 N897 F901 F1072	S647-L651 WeakPolarHBondContact O-CB 3.25Å; S647-L651 PolarHBondContact O-N 2.95Å; K648-L651 PolarHBondContact O-N 3.24Å; L651-E653 PolarHBondContact O-N 2.8Å; L651-E653 VanDerWaalsContact O-N 3.11Å; L651-I654 VanDerWaalsContact O-CG2 3.28Å; L651-I654 WeakPolarHBondContact O-CG2 3.5Å; L651-I654 PolarHBondContact O-N 2.97Å; L651-I654 VanDerWaalsContact O-N 3.09Å; L651-E655 WeakPolarHBondContact CD2-OE1 3.45Å; L651-E655 HydrophobicContact CG-CG 4.32Å; L651-E655 WeakPolarHBondContact CG-OE1 3.44Å; L651-E655 WeakPolarHBondContact O-CG 3.41Å; L651-E655 PolarHBondContact O-N 3.32Å; L651-N897 WeakPolarHBondContact CD1-OD1 3.42Å; L651-F901 HydrophobicContact CB-CE1 4.21Å; L651-F901 HydrophobicContact CD1-CE1 4.14Å; L651-F901 HydrophobicContact CD1-CZ 4.08Å; L651-F1072 HydrophobicContact CD1-CZ 4.2Å
652	N	95.2	Very high	92.5	Very high	73 Å²	73	65.7 Å²	65.7	39%	0.39	33%	0.327	S	S	.	.	H	α-helix	trans	-60.6	-22.9	178.1	-79.8	119.8	0	0	0	113.8	K648 E655 S656	K648-N652 WeakPolarHBondContact CE-OD1 3.2Å; K648-N652 WeakPolarHBondContact CG-OD1 3.32Å; K648-N652 WeakPolarHBondContact O-CB 3.14Å; K648-N652 PolarHBondContact O-N 2.83Å; K648-N652 PolarHBondContact O-OD1 3.12Å; N652-E655 WeakPolarHBondContact CA-OE2 3.41Å; N652-E655 PolarHBondContact N-OE2 3.12Å; N652-E655 PolarHBondContact ND2-OE2 3.06Å; N652-S656 WeakPolarHBondContact O-CB 3.33Å; N652-S656 PolarHBondContact O-N 3.35Å
653	E	95.4	Very high	91.9	Very high	75 Å²	75	68.1 Å²	68.1	35%	0.35	34%	0.337	S	S	.	.	H	α-helix	trans	-69.7	-44.4	174.9	-172.9	-172.7	-163.6	0	0	111.4	S649 L650 L651 I657 M689 R904	S649-E653 PolarHBondContact O-N 2.99Å; L650-E653 WeakPolarHBondContact O-CB 3.29Å; L650-E653 PolarHBondContact O-N 3.05Å; L651-E653 PolarHBondContact O-N 2.8Å; L651-E653 VanDerWaalsContact O-N 3.11Å; E653-I657 VanDerWaalsContact O-CD1 3.28Å; E653-I657 WeakPolarHBondContact O-CD1 3.14Å; E653-I657 VanDerWaalsContact O-CG1 3.27Å; E653-I657 WeakPolarHBondContact O-CG1 3.37Å; E653-M689 VanDerWaalsContact CD-CE 3.44Å; E653-M689 HydrophobicContact CG-CE 3.78Å; E653-R904 VanDerWaalsContact CD-NH2 3.33Å; E653-R904 IonicContact OE1-NH2 2.89Å; E653-R904 PolarHBondContact OE1-NH2 3.08Å; E653-R904 IonicContact OE2-CZ 3.26Å; E653-R904 IonicContact OE2-NE 2.76Å; E653-R904 PolarHBondContact OE2-NE 3.14Å; E653-R904 IonicContact OE2-NH2 2.73Å; E653-R904 PolarHBondContact OE2-NH2 3.24Å
654	I	94.9	Very high	91.1	Very high	0 Å²	0	69.9 Å²	69.9	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-82.4	-32.8	178.9	-171	164.4	0	0	0	112.7	L650 L651 I657 Y658 H688 M689 Y900 F1072 L1087 L1089	L650-I654 PolarHBondContact O-N 3.29Å; L651-I654 VanDerWaalsContact O-CG2 3.28Å; L651-I654 WeakPolarHBondContact O-CG2 3.5Å; L651-I654 PolarHBondContact O-N 2.97Å; L651-I654 VanDerWaalsContact O-N 3.09Å; I654-I657 PolarHBondContact O-N 3.33Å; I654-Y658 WeakPolarHBondContact O-CB 3.41Å; I654-Y658 PolarHBondContact O-N 3.5Å; I654-H688 HydrophobicContact CD1-CB 4.3Å; I654-H688 HydrophobicContact CG1-CB 4.17Å; I654-M689 HydrophobicContact CB-SD 4.23Å; I654-M689 HydrophobicContact CD1-CG 4.18Å; I654-M689 HydrophobicContact CD1-SD 4.21Å; I654-M689 HydrophobicContact CG1-CG 4.42Å; I654-M689 HydrophobicContact CG1-SD 4.46Å; I654-Y900 HydrophobicContact CB-CE2 4.47Å; I654-Y900 HydrophobicContact CD1-CE2 3.79Å; I654-Y900 HydrophobicContact CG2-CE1 4.14Å; I654-Y900 HydrophobicContact CG2-CE2 4.07Å; I654-Y900 WeakPolarHBondContact CG2-OH 3.33Å; I654-F1072 HydrophobicContact CD1-CD1 4.1Å; I654-F1072 HydrophobicContact CD1-CE1 4.22Å; I654-F1072 HydrophobicContact CG2-CE1 3.93Å; I654-L1087 HydrophobicContact CD1-CB 4.47Å; I654-L1089 HydrophobicContact CD1-CB 4.24Å; I654-L1089 HydrophobicContact CG1-CB 4.23Å
655	E	93.1	Very high	89.8	Confident	51 Å²	51	71.1 Å²	71.1	24%	0.238	35%	0.353	C	S	.	.	H	α-helix	trans	-57.1	-50.7	170.6	-70	169.5	157	0	0	110.7	L651 N652 I657 Y658 D659	L651-E655 WeakPolarHBondContact CD2-OE1 3.45Å; L651-E655 HydrophobicContact CG-CG 4.32Å; L651-E655 WeakPolarHBondContact CG-OE1 3.44Å; L651-E655 WeakPolarHBondContact O-CG 3.41Å; L651-E655 PolarHBondContact O-N 3.32Å; N652-E655 WeakPolarHBondContact CA-OE2 3.41Å; N652-E655 PolarHBondContact N-OE2 3.12Å; N652-E655 PolarHBondContact ND2-OE2 3.06Å; E655-I657 VanDerWaalsContact C-N 3.28Å; E655-I657 PolarHBondContact O-N 3.19Å; E655-Y658 WeakPolarHBondContact O-CA 3.43Å; E655-Y658 WeakPolarHBondContact O-CB 3.46Å; E655-Y658 PolarHBondContact O-N 3.31Å; E655-D659 VanDerWaalsContact O-CG 3.29Å; E655-D659 PolarHBondContact O-N 2.83Å
656	S	93.8	Very high	88.5	Confident	56 Å²	56	75.1 Å²	75.1	39%	0.392	38%	0.378	S	S	.	.	H	α-helix	trans	-59.2	-37.4	179.1	-165.3	0	0	0	0	112.9	N652 Y658 E660	N652-S656 WeakPolarHBondContact O-CB 3.33Å; N652-S656 PolarHBondContact O-N 3.35Å; S656-Y658 VanDerWaalsContact C-N 3.35Å; S656-E660 VanDerWaalsContact O-CB 3.27Å; S656-E660 WeakPolarHBondContact O-CB 3.45Å; S656-E660 WeakPolarHBondContact O-CG 3.22Å; S656-E660 PolarHBondContact O-N 2.86Å; S656-E660 PolarHBondContact OG-OE1 2.97Å
657	I	92.6	Very high	86.8	Confident	53 Å²	53	73.6 Å²	73.6	27%	0.272	38%	0.377	S	S	.	.	H	α-helix	trans	-74.5	-28.6	178.6	-61.2	164.4	0	0	0	111.4	E653 I654 E655 R661 H688 M689	E653-I657 VanDerWaalsContact O-CD1 3.28Å; E653-I657 WeakPolarHBondContact O-CD1 3.14Å; E653-I657 VanDerWaalsContact O-CG1 3.27Å; E653-I657 WeakPolarHBondContact O-CG1 3.37Å; I654-I657 PolarHBondContact O-N 3.33Å; E655-I657 VanDerWaalsContact C-N 3.28Å; E655-I657 PolarHBondContact O-N 3.19Å; I657-R661 WeakPolarHBondContact O-CB 3.35Å; I657-R661 PolarHBondContact O-N 2.89Å; I657-H688 HydrophobicContact CG2-CB 4.2Å; I657-M689 HydrophobicContact CD1-CE 4.24Å
658	Y	90.4	Very high	84.9	Confident	35 Å²	35	79.3 Å²	79.3	14%	0.137	40%	0.398	C	S	.	.	H	α-helix	trans	-72.8	-49.6	174	176.7	-86.5	0	0	0	110.8	I654 E655 S656 R661 Q662 H688 L1089 D1091	I654-Y658 WeakPolarHBondContact O-CB 3.41Å; I654-Y658 PolarHBondContact O-N 3.5Å; E655-Y658 WeakPolarHBondContact O-CA 3.43Å; E655-Y658 WeakPolarHBondContact O-CB 3.46Å; E655-Y658 PolarHBondContact O-N 3.31Å; S656-Y658 VanDerWaalsContact C-N 3.35Å; Y658-R661 CarbonylContact O-C 3.55Å; Y658-R661 PolarHBondContact O-N 2.61Å; Y658-Q662 HydrophobicContact CD1-CG 4.34Å; Y658-Q662 HydrophobicContact CE1-CG 3.9Å; Y658-Q662 VanDerWaalsContact CE1-NE2 3.33Å; Y658-Q662 PolarHBondContact O-N 3.35Å; Y658-Q662 PolarHBondContact OH-NE2 3.23Å; Y658-H688 AromaticContact CD2-CE1 3.7Å; Y658-H688 AromaticContact CD2-NE2 3.6Å; Y658-L1089 HydrophobicContact CD1-CD2 4.34Å; Y658-L1089 HydrophobicContact CD2-CB 3.96Å; Y658-L1089 HydrophobicContact CD2-CD2 4.03Å; Y658-L1089 HydrophobicContact CD2-CG 3.99Å; Y658-L1089 HydrophobicContact CE2-CG 4.29Å; Y658-L1089 HydrophobicContact CG-CD2 3.91Å; Y658-L1089 HydrophobicContact CG-CG 4.39Å; Y658-D1091 VanDerWaalsContact OH-CB 3.3Å; Y658-D1091 WeakPolarHBondContact OH-CB 3.46Å; Y658-D1091 PolarHBondContact OH-OD2 2.79Å
659	D	89.4	Confident	82.8	Confident	90 Å²	90	75.3 Å²	75.3	48%	0.481	40%	0.4	S	S	.	.	H	α-helix	trans	-58.8	-49.7	177	-64.5	-16.4	0	0	0	111.2	E655 R661 Q662 E663	E655-D659 VanDerWaalsContact O-CG 3.29Å; E655-D659 PolarHBondContact O-N 2.83Å; D659-R661 PolarHBondContact O-N 2.87Å; D659-R661 VanDerWaalsContact O-N 3.16Å; D659-Q662 PolarHBondContact O-N 2.79Å; D659-Q662 VanDerWaalsContact O-N 3.16Å; D659-E663 PolarHBondContact O-N 3.42Å
660	E	88.6	Confident	80.3	Confident	102 Å²	102	75.2 Å²	75.2	48%	0.477	41%	0.407	S	S	.	.	H	α-helix	trans	-56.7	-32.2	175.6	-78.2	172.8	-142.7	0	0	112.2	S656 Q664	S656-E660 VanDerWaalsContact O-CB 3.27Å; S656-E660 WeakPolarHBondContact O-CB 3.45Å; S656-E660 WeakPolarHBondContact O-CG 3.22Å; S656-E660 PolarHBondContact O-N 2.86Å; S656-E660 PolarHBondContact OG-OE1 2.97Å; E660-Q664 VanDerWaalsContact O-CG 3.27Å; E660-Q664 WeakPolarHBondContact O-CG 3.35Å; E660-Q664 PolarHBondContact O-N 3.09Å; E660-Q664 PolarHBondContact O-NE2 2.79Å
661	R	83.6	Confident	77.6	Confident	76 Å²	76	81.7 Å²	81.7	29%	0.287	45%	0.447	S	S	.	.	H	α-helix	trans	-82.9	-34.9	179.1	-169.2	176.3	-70.8	-94.9	9	112.1	I657 Y658 D659 S665 E686	I657-R661 WeakPolarHBondContact O-CB 3.35Å; I657-R661 PolarHBondContact O-N 2.89Å; Y658-R661 CarbonylContact O-C 3.55Å; Y658-R661 PolarHBondContact O-N 2.61Å; D659-R661 PolarHBondContact O-N 2.87Å; D659-R661 VanDerWaalsContact O-N 3.16Å; R661-S665 PolarHBondContact O-N 2.66Å; R661-S665 VanDerWaalsContact O-N 3.12Å; R661-E686 IonicContact CZ-OE2 3.28Å; R661-E686 IonicContact NH1-OE2 2.83Å; R661-E686 PolarHBondContact NH1-OE2 3.5Å; R661-E686 IonicContact NH2-OE2 2.7Å; R661-E686 PolarHBondContact NH2-OE2 3.17Å
662	Q	81.2	Confident	75.3	Confident	85 Å²	85	83.9 Å²	83.9	40%	0.397	48%	0.476	S	S	.	.	H	α-helix	trans	-60.3	-52.2	168.3	-82.4	-144.3	9	0	0	110.5	Y658 D659 Q664 S665 T666	Y658-Q662 HydrophobicContact CD1-CG 4.34Å; Y658-Q662 HydrophobicContact CE1-CG 3.9Å; Y658-Q662 VanDerWaalsContact CE1-NE2 3.33Å; Y658-Q662 PolarHBondContact O-N 3.35Å; Y658-Q662 PolarHBondContact OH-NE2 3.23Å; D659-Q662 PolarHBondContact O-N 2.79Å; D659-Q662 VanDerWaalsContact O-N 3.16Å; Q662-Q664 PolarHBondContact O-N 3.37Å; Q662-S665 PolarHBondContact O-N 2.66Å; Q662-S665 PolarHBondContact O-OG 2.77Å; Q662-T666 PolarHBondContact O-N 3.13Å
663	E	79.9	Confident	72.4	Confident	137 Å²	137	89.2 Å²	89.2	64%	0.64	50%	0.499	S	S	*	.	H	α-helix	trans	-53.5	-51.2	179.8	-74.1	-169.2	162.5	0	0	111.2	D659 S665 T666 E667	D659-E663 PolarHBondContact O-N 3.42Å; E663-S665 VanDerWaalsContact C-N 3.31Å; E663-S665 PolarHBondContact O-N 3.06Å; E663-T666 PolarHBondContact O-N 2.78Å; E663-T666 VanDerWaalsContact O-N 3.11Å; E663-T666 PolarHBondContact O-OG1 3.35Å; E663-E667 PolarHBondContact O-N 2.91Å
664	Q	75.4	Confident	69.7	Low	127 Å²	127	94.8 Å²	94.8	59%	0.593	53%	0.525	S	S	*	.	H	α-helix	trans	-56	-41.4	176	-76.1	169.1	71.5	0	0	113.1	E660 Q662 T666 E667 E668	E660-Q664 VanDerWaalsContact O-CG 3.27Å; E660-Q664 WeakPolarHBondContact O-CG 3.35Å; E660-Q664 PolarHBondContact O-N 3.09Å; E660-Q664 PolarHBondContact O-NE2 2.79Å; Q662-Q664 PolarHBondContact O-N 3.37Å; Q664-T666 VanDerWaalsContact C-N 3.34Å; Q664-T666 PolarHBondContact O-N 3.38Å; Q664-E667 PolarHBondContact O-N 3.28Å; Q664-E668 PolarHBondContact O-N 2.95Å
665	S	66.6	Low	66.7	Low	77 Å²	77	100.2 Å²	100.2	54%	0.538	56%	0.562	S	S	.	*	H	α-helix	trans	-67.3	-33.1	178.5	78.9	0	0	0	0	113.1	R661 Q662 E663 G669	R661-S665 PolarHBondContact O-N 2.66Å; R661-S665 VanDerWaalsContact O-N 3.12Å; Q662-S665 PolarHBondContact O-N 2.66Å; Q662-S665 PolarHBondContact O-OG 2.77Å; E663-S665 VanDerWaalsContact C-N 3.31Å; E663-S665 PolarHBondContact O-N 3.06Å; S665-G669 PolarHBondContact O-N 3.1Å
666	T	67.3	Low	64.3	Low	93 Å²	93	108.8 Å²	108.8	57%	0.571	59%	0.593	S	S	*	*	H	α-helix	trans	-77.6	-33.9	177.8	63.7	0	0	0	0	112.7	Q662 E663 Q664 G669 G670	Q662-T666 PolarHBondContact O-N 3.13Å; E663-T666 PolarHBondContact O-N 2.78Å; E663-T666 VanDerWaalsContact O-N 3.11Å; E663-T666 PolarHBondContact O-OG1 3.35Å; Q664-T666 VanDerWaalsContact C-N 3.34Å; Q664-T666 PolarHBondContact O-N 3.38Å; T666-G669 PolarHBondContact O-N 3.22Å; T666-G670 PolarHBondContact O-N 3.08Å
667	E	58.9	Low	61.3	Low	122 Å²	122	113.8 Å²	113.8	57%	0.57	62%	0.615	S	S	*	*	H	α-helix	trans	-64.6	-41.2	173.2	-68.4	-143.1	124.1	0	0	112.2	K49 E663 Q664 G669 G670	K49-E667 IonicContact NZ-OE1 3.4Å; K49-E667 PolarHBondContact NZ-OE1 3.32Å; E663-E667 PolarHBondContact O-N 2.91Å; Q664-E667 PolarHBondContact O-N 3.28Å; E667-G669 PolarHBondContact O-N 2.7Å; E667-G670 PolarHBondContact O-N 2.87Å; E667-G670 VanDerWaalsContact O-N 3.13Å
668	E	55.8	Low	58.5	Low	171 Å²	171	114.3 Å²	114.3	80%	0.799	63%	0.634	S	S	*	*	H	α-helix	trans	-66.8	-23.5	175.7	-71.6	-154.9	141.7	0	0	113.4	Q664 G670	Q664-E668 PolarHBondContact O-N 2.95Å; E668-G670 VanDerWaalsContact C-N 3.33Å
669	G	49.4	Very low	55.9	Low	69 Å²	69	118.9 Å²	118.9	71%	0.711	67%	0.67	S	S	*	*	H	α-helix	trans	-76	-15.9	173.1	0	0	0	0	0	114.6	S665 T666 E667	S665-G669 PolarHBondContact O-N 3.1Å; T666-G669 PolarHBondContact O-N 3.22Å; E667-G669 PolarHBondContact O-N 2.7Å
670	G	44.8	Very low	53.2	Low	48 Å²	48	118 Å²	118	50%	0.495	68%	0.683	S	S	.	*	S	Bend	trans	-99.3	94.9	-166.1	0	0	0	0	0	115.7	T666 E667 E668	T666-G670 PolarHBondContact O-N 3.08Å; E667-G670 PolarHBondContact O-N 2.87Å; E667-G670 VanDerWaalsContact O-N 3.13Å; E668-G670 VanDerWaalsContact C-N 3.33Å
671	V	38.6	Very low	50.6	Low	145 Å²	145	118.2 Å²	118.2	88%	0.879	70%	0.696	S	S	*	*			trans	67.5	109	168.2	-170.8	0	0	0	0	115.1	H673	V671-H673 PolarHBondContact O-N 3.16Å
672	G	46.6	Very low	48.2	Very low	76 Å²	76	123.9 Å²	123.9	78%	0.784	73%	0.728	S	S	*	*			trans	-72.3	122.9	-176.1	0	0	0	0	0	115.3
673	H	33.4	Very low	46	Very low	186 Å²	186	123.6 Å²	123.6	86%	0.861	74%	0.735	S	S	*	*			trans	-135.8	140.2	154.2	-130.4	-77.7	0	0	0	111.2	V671 S675	V671-H673 PolarHBondContact O-N 3.16Å; H673-S675 PolarHBondContact O-N 3.43Å
674	Q	40.4	Very low	44	Very low	191 Å²	191	123.1 Å²	123.1	89%	0.893	75%	0.747	S	S	*	*			trans	-77.6	121.4	-169.7	-63.1	175.6	1.7	0	0	112.8
675	S	32.1	Very low	43	Very low	114 Å²	114	121.4 Å²	121.4	80%	0.797	75%	0.749	S	S	*	*			trans	-138.5	49.2	166.3	-165.1	0	0	0	0	115.1	H673 N677	H673-S675 PolarHBondContact O-N 3.43Å; S675-N677 PolarHBondContact O-N 3.14Å; S675-N677 VanDerWaalsContact O-N 3.14Å
676	R	41.2	Very low	43.1	Very low	231 Å²	231	122.8 Å²	122.8	87%	0.872	75%	0.747	S	S	*	*			trans	23.3	80	139.3	-173.2	-178.6	169.5	170.4	-4.9	117.2
677	N	31.6	Very low	44	Very low	162 Å²	162	119.7 Å²	119.7	87%	0.866	73%	0.728	S	S	*	*			trans	-170.9	140.2	144.8	-98	-18	0	0	0	111.4	S675	S675-N677 PolarHBondContact O-N 3.14Å; S675-N677 VanDerWaalsContact O-N 3.14Å
678	G	33.6	Very low	45.4	Very low	64 Å²	64	115 Å²	115	66%	0.66	71%	0.707	S	S	*	*	S	Bend	trans	74.6	94.6	156.4	0	0	0	0	0	119.8	G680	G678-G680 VanDerWaalsContact C-N 3.34Å; G678-G680 PolarHBondContact O-N 2.69Å
679	S	36.1	Very low	47.3	Very low	130 Å²	130	107.6 Å²	107.6	91%	0.909	67%	0.672	S	S	*	*			trans	51.5	17.6	140.8	55	0	0	0	0	122.2	S681	S679-S681 PolarHBondContact O-N 2.76Å
680	G	32.7	Very low	49.4	Very low	73 Å²	73	109.3 Å²	109.3	75%	0.753	66%	0.663	S	S	*	*			trans	-68.3	87.2	174.1	0	0	0	0	0	114	G678	G678-G680 VanDerWaalsContact C-N 3.34Å; G678-G680 PolarHBondContact O-N 2.69Å
681	S	34	Very low	51.8	Low	105 Å²	105	108.8 Å²	108.8	73%	0.734	65%	0.647	S	S	*	*	S	Bend	trans	-164.2	36.1	171.8	-173.1	0	0	0	0	114.7	S679	S679-S681 PolarHBondContact O-N 2.76Å
682	M	33.7	Very low	54.4	Low	195 Å²	195	105.3 Å²	105.3	96%	0.961	63%	0.626	S	S	*	*	S	Bend	trans	-179.5	62	163.9	-105.5	166.8	67.7	0	0	111.2
683	S	34.7	Very low	56.6	Low	79 Å²	79	102.4 Å²	102.4	55%	0.552	59%	0.592	S	S	*	*			trans	-118.2	3	-170.2	39.2	0	0	0	0	115.8	S685	S683-S685 PolarHBondContact O-N 2.95Å
684	S	38.1	Very low	59	Low	127 Å²	127	97.4 Å²	97.4	89%	0.888	57%	0.569	S	S	*	*	S	Bend	trans	-91.1	20.4	-177.6	70.1	0	0	0	0	114.9
685	S	52.5	Low	61	Low	91 Å²	91	90.7 Å²	90.7	64%	0.636	54%	0.539	S	S	*	.			trans	-157.4	41.9	-171.1	-177.6	0	0	0	0	112.8	S683	S683-S685 PolarHBondContact O-N 2.95Å
686	E	70.3	Confident	63.6	Low	107 Å²	107	88.4 Å²	88.4	50%	0.5	51%	0.514	S	S	.	.			trans	-97.4	129.5	165.8	-178.9	-172.4	-129.8	0	0	108.7	R661	R661-E686 IonicContact CZ-OE2 3.28Å; R661-E686 IonicContact NH1-OE2 2.83Å; R661-E686 PolarHBondContact NH1-OE2 3.5Å; R661-E686 IonicContact NH2-OE2 2.7Å; R661-E686 PolarHBondContact NH2-OE2 3.17Å
687	P	84.5	Confident	65.9	Low	27 Å²	27	81.8 Å²	81.8	18%	0.175	49%	0.493	C	S	.	.			trans	-68	144.5	-174.6	28.2	-36.1	0	0	0	112.3	M689 M690 T1086	P687-M689 VanDerWaalsContact C-N 3.29Å; P687-M689 PolarHBondContact O-N 2.95Å; P687-M690 HydrophobicContact CG-CG 3.63Å; P687-M690 HydrophobicContact CG-SD 3.76Å; P687-T1086 HydrophobicContact CG-CG2 4.12Å
688	H	90.3	Very high	68.9	Low	25 Å²	25	74.3 Å²	74.3	12%	0.116	45%	0.453	C	S	.	.	S	Bend	trans	-59.8	-33.6	-177.5	-63.1	98.4	0	0	0	113.4	I654 I657 Y658 L1087 E1088 L1089	I654-H688 HydrophobicContact CD1-CB 4.3Å; I654-H688 HydrophobicContact CG1-CB 4.17Å; I657-H688 HydrophobicContact CG2-CB 4.2Å; Y658-H688 AromaticContact CD2-CE1 3.7Å; Y658-H688 AromaticContact CD2-NE2 3.6Å; H688-L1087 PolarHBondContact N-O 3.46Å; H688-L1087 VanDerWaalsContact N-O 3.08Å; H688-E1088 WeakPolarHBondContact ND1-CA 3.46Å; H688-L1089 PolarHBondContact ND1-N 3.48Å
689	M	94.1	Very high	71.6	Confident	14 Å²	14	71.9 Å²	71.9	7%	0.069	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	151.3	172.1	-32.5	-178.3	92.6	0	0	112.2	E653 I654 I657 P687 F691 T1086 L1087	E653-M689 VanDerWaalsContact CD-CE 3.44Å; E653-M689 HydrophobicContact CG-CE 3.78Å; I654-M689 HydrophobicContact CB-SD 4.23Å; I654-M689 HydrophobicContact CD1-CG 4.18Å; I654-M689 HydrophobicContact CD1-SD 4.21Å; I654-M689 HydrophobicContact CG1-CG 4.42Å; I654-M689 HydrophobicContact CG1-SD 4.46Å; I657-M689 HydrophobicContact CD1-CE 4.24Å; P687-M689 VanDerWaalsContact C-N 3.29Å; P687-M689 PolarHBondContact O-N 2.95Å; M689-F691 HydrophobicContact CB-CD2 4.43Å; M689-F691 HydrophobicContact CB-CE2 3.6Å; M689-F691 HydrophobicContact CB-CZ 4.02Å; M689-F691 HydrophobicContact CE-CE2 4.45Å; M689-F691 HydrophobicContact CE-CZ 4.01Å; M689-F691 HydrophobicContact CG-CE2 4.46Å; M689-F691 HydrophobicContact SD-CE2 4.05Å; M689-F691 HydrophobicContact SD-CZ 4.21Å; M689-T1086 CarbonylContact O-C 3.55Å; M689-T1086 VanDerWaalsContact O-CA 3.32Å; M689-T1086 WeakPolarHBondContact O-CA 3.4Å; M689-L1087 HydrophobicContact CB-CB 4.15Å; M689-L1087 HydrophobicContact CG-CB 4.33Å; M689-L1087 PolarHBondContact N-O 3.42Å; M689-L1087 PolarHBondContact O-N 2.88Å; M689-L1087 HydrophobicContact SD-CD1 4.37Å
690	M	93.7	Very high	74.3	Confident	106 Å²	106	71.4 Å²	71.4	52%	0.522	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	134.7	175.3	-63.3	-167.6	-83.6	0	0	111.8	P687 T1086	P687-M690 HydrophobicContact CG-CG 3.63Å; P687-M690 HydrophobicContact CG-SD 3.76Å; M690-T1086 HydrophobicContact CG-CG2 3.88Å; M690-T1086 HydrophobicContact SD-CG2 4.24Å
691	F	95	Very high	77.2	Confident	36 Å²	36	69 Å²	69	16%	0.158	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	118.8	-176.8	-59.7	-71.9	0	0	0	111.8	M689 Y693 Q907 T1084 M1085 L1087	M689-F691 HydrophobicContact CB-CD2 4.43Å; M689-F691 HydrophobicContact CB-CE2 3.6Å; M689-F691 HydrophobicContact CB-CZ 4.02Å; M689-F691 HydrophobicContact CE-CE2 4.45Å; M689-F691 HydrophobicContact CE-CZ 4.01Å; M689-F691 HydrophobicContact CG-CE2 4.46Å; M689-F691 HydrophobicContact SD-CE2 4.05Å; M689-F691 HydrophobicContact SD-CZ 4.21Å; F691-Y693 HydrophobicContact CB-CE2 4.42Å; F691-Q907 HydrophobicContact CB-CG 3.64Å; F691-Q907 HydrophobicContact CD1-CG 3.84Å; F691-Q907 HydrophobicContact CD2-CG 4.1Å; F691-Q907 HydrophobicContact CG-CG 3.58Å; F691-T1084 WeakPolarHBondContact O-CA 3.43Å; F691-M1085 HydrophobicContact CB-CE 4.35Å; F691-M1085 HydrophobicContact CD2-CE 3.8Å; F691-M1085 HydrophobicContact CG-CE 4.42Å; F691-M1085 PolarHBondContact N-O 2.82Å; F691-M1085 PolarHBondContact O-N 3.21Å; F691-L1087 HydrophobicContact CD2-CD1 4.12Å; F691-L1087 HydrophobicContact CE2-CD1 3.88Å
692	T	93.3	Very high	80.2	Confident	72 Å²	72	64 Å²	64	44%	0.442	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	132.3	179.3	-51.8	0	0	0	0	111.8	E694 Q1082	T692-E694 HydrophobicContact CG2-CG 4.13Å; T692-Q1082 HydrophobicContact CG2-CB 4.21Å
693	Y	92.7	Very high	83.1	Confident	16 Å²	16	55.8 Å²	55.8	6%	0.063	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	109.6	172.4	-65.1	-106.6	0	0	0	107.7	F691 L699 F736 Q907 C910 Q1082 V1083 M1085	F691-Y693 HydrophobicContact CB-CE2 4.42Å; Y693-L699 HydrophobicContact CD1-CD2 3.73Å; Y693-L699 HydrophobicContact CD1-CG 4.47Å; Y693-L699 HydrophobicContact CE1-CD2 3.95Å; Y693-F736 AromaticContact CD1-CE1 3.93Å; Y693-F736 HydrophobicContact CD1-CE1 3.93Å; Y693-F736 HydrophobicContact CD1-CZ 4.41Å; Y693-F736 AromaticContact CD2-CE1 3.6Å; Y693-F736 HydrophobicContact CD2-CE1 3.6Å; Y693-F736 HydrophobicContact CD2-CZ 4.32Å; Y693-F736 AromaticContact CE1-CE1 3.88Å; Y693-F736 HydrophobicContact CE1-CE1 3.88Å; Y693-F736 AromaticContact CE1-CZ 3.9Å; Y693-F736 HydrophobicContact CE1-CZ 3.9Å; Y693-F736 AromaticContact CE2-CE1 3.55Å; Y693-F736 HydrophobicContact CE2-CE1 3.55Å; Y693-F736 AromaticContact CE2-CZ 3.81Å; Y693-F736 HydrophobicContact CE2-CZ 3.81Å; Y693-F736 HydrophobicContact CG-CD1 4.47Å; Y693-F736 AromaticContact CG-CE1 3.77Å; Y693-F736 HydrophobicContact CG-CE1 3.77Å; Y693-F736 AromaticContact CZ-CE1 3.66Å; Y693-F736 AromaticContact CZ-CZ 3.53Å; Y693-Q907 HydrophobicContact CE2-CG 4.41Å; Y693-Q907 VanDerWaalsContact OH-CA 3.29Å; Y693-Q907 WeakPolarHBondContact OH-CA 3.39Å; Y693-Q907 VanDerWaalsContact OH-CB 3.27Å; Y693-Q907 WeakPolarHBondContact OH-CB 3.46Å; Y693-C910 HydrophobicContact CD1-CB 4.19Å; Y693-C910 HydrophobicContact CE1-CB 3.92Å; Y693-Q1082 WeakPolarHBondContact O-CA 3.4Å; Y693-V1083 PolarHBondContact N-O 3.29Å; Y693-V1083 PolarHBondContact O-N 2.76Å; Y693-M1085 HydrophobicContact CD2-CB 4.49Å; Y693-M1085 HydrophobicContact CE2-CB 3.84Å; Y693-M1085 HydrophobicContact CE2-CE 4.43Å; Y693-M1085 HydrophobicContact CE2-SD 4.44Å
694	E	85	Confident	86	Confident	80 Å²	80	54.5 Å²	54.5	37%	0.374	30%	0.297	S	S	.	.			trans	-91.7	-27	-169.6	-58.7	-176.3	-111.2	0	0	113.8	T692 L914 R918 Q1082	T692-E694 HydrophobicContact CG2-CG 4.13Å; E694-L914 HydrophobicContact CB-CD2 4.4Å; E694-R918 IonicContact OE1-CZ 2.66Å; E694-R918 IonicContact OE1-NH1 3.03Å; E694-R918 PolarHBondContact OE1-NH1 3.22Å; E694-R918 IonicContact OE1-NH2 3.23Å; E694-R918 PolarHBondContact OE1-NH2 2.76Å; E694-R918 VanDerWaalsContact OE1-NH2 3.11Å; E694-R918 IonicContact OE2-CZ 3.31Å; E694-R918 IonicContact OE2-NH1 2.76Å; E694-R918 IonicContact OE2-NH2 2.66Å; E694-R918 PolarHBondContact OE2-NH2 3.39Å; E694-Q1082 PolarHBondContact OE2-NE2 2.72Å
695	D	82.6	Confident	88.7	Confident	50 Å²	50	48.5 Å²	48.5	27%	0.267	25%	0.254	S	S	.	.			trans	-129.2	136.7	-172.3	-171.3	-11.3	0	0	0	110.2	Q697 I698 L914	D695-Q697 PolarHBondContact OD1-N 3.03Å; D695-I698 HydrophobicContact CB-CG1 3.98Å; D695-L914 HydrophobicContact CB-CD1 4.41Å
696	K	85.1	Confident	90.8	Very high	66 Å²	66	44.1 Å²	44.1	29%	0.287	22%	0.224	S	C	.	.	S	Bend	trans	-86.5	-26.6	-179.6	-57.4	-162	176.4	-156.1	0	112.2	I698 L699 E700 F737 G1081	K696-I698 VanDerWaalsContact C-N 3.29Å; K696-I698 PolarHBondContact O-N 2.89Å; K696-L699 WeakPolarHBondContact O-CB 3.31Å; K696-L699 PolarHBondContact O-N 3.24Å; K696-E700 PolarHBondContact O-N 3.26Å; K696-F737 PolarHBondContact NZ-O 2.89Å; K696-G1081 WeakPolarHBondContact CE-O 3.09Å
697	Q	90.3	Very high	92	Very high	92 Å²	92	39.9 Å²	39.9	43%	0.43	21%	0.205	S	C	.	.	H	α-helix	trans	-62	-39.7	174.7	-176.6	177.6	-23.3	0	0	111	D695 L699 E700 D701	D695-Q697 PolarHBondContact OD1-N 3.03Å; Q697-L699 VanDerWaalsContact C-N 3.26Å; Q697-L699 PolarHBondContact O-N 3.17Å; Q697-E700 PolarHBondContact O-N 3.46Å; Q697-D701 PolarHBondContact O-N 3.03Å
698	I	93.9	Very high	92.5	Very high	5 Å²	5	41.3 Å²	41.3	3%	0.026	21%	0.207	C	C	.	.	H	α-helix	trans	-62.7	-30.3	178.5	-58.5	-60.5	0	0	0	112.7	D695 K696 A702 C910 L913 L914 Y917 Y967	D695-I698 HydrophobicContact CB-CG1 3.98Å; K696-I698 VanDerWaalsContact C-N 3.29Å; K696-I698 PolarHBondContact O-N 2.89Å; I698-A702 VanDerWaalsContact O-CB 3.28Å; I698-A702 WeakPolarHBondContact O-CB 3.3Å; I698-A702 PolarHBondContact O-N 3.09Å; I698-C910 HydrophobicContact CG2-CB 4.09Å; I698-C910 WeakPolarHBondContact CG2-O 3.48Å; I698-L913 HydrophobicContact CD1-CB 4.46Å; I698-L913 HydrophobicContact CG2-CB 3.78Å; I698-L914 HydrophobicContact CG1-CB 4.24Å; I698-L914 HydrophobicContact CG1-CD1 4.16Å; I698-L914 HydrophobicContact CG2-CB 4.31Å; I698-Y917 HydrophobicContact CD1-CG 4.33Å; I698-Y967 WeakPolarHBondContact CD1-OH 3.22Å
699	L	91.5	Very high	92.6	Very high	14 Å²	14	40.4 Å²	40.4	7%	0.073	20%	0.203	C	C	.	.	H	α-helix	trans	-70.9	-38.8	173	-69.8	169.4	0	0	0	111.5	Y693 K696 Q697 S703 F736	Y693-L699 HydrophobicContact CD1-CD2 3.73Å; Y693-L699 HydrophobicContact CD1-CG 4.47Å; Y693-L699 HydrophobicContact CE1-CD2 3.95Å; K696-L699 WeakPolarHBondContact O-CB 3.31Å; K696-L699 PolarHBondContact O-N 3.24Å; Q697-L699 VanDerWaalsContact C-N 3.26Å; Q697-L699 PolarHBondContact O-N 3.17Å; L699-S703 VanDerWaalsContact O-CB 3.32Å; L699-S703 WeakPolarHBondContact O-CB 3.46Å; L699-S703 PolarHBondContact O-N 2.79Å; L699-S703 PolarHBondContact O-OG 3.15Å; L699-F736 HydrophobicContact CD1-CB 4.15Å; L699-F736 HydrophobicContact CD1-CD1 4.11Å; L699-F736 HydrophobicContact CD1-CG 4.18Å; L699-F736 HydrophobicContact CD2-CD1 4.45Å
700	E	91.8	Very high	92.6	Very high	119 Å²	119	39.9 Å²	39.9	56%	0.556	20%	0.2	S	C	*	.	H	α-helix	trans	-69.8	-41.5	177.2	-66.5	176.5	-171.1	0	0	111.3	K696 Q697 S703 S704	K696-E700 PolarHBondContact O-N 3.26Å; Q697-E700 PolarHBondContact O-N 3.46Å; E700-S703 PolarHBondContact O-N 3.44Å; E700-S704 VanDerWaalsContact O-CB 3.27Å; E700-S704 WeakPolarHBondContact O-CB 3.33Å; E700-S704 PolarHBondContact O-N 3.34Å
701	D	94.8	Very high	92.5	Very high	24 Å²	24	40.8 Å²	40.8	13%	0.128	20%	0.201	C	C	.	.	H	α-helix	trans	-62.8	-45.6	173.5	-76	-33.8	0	0	0	112.2	Q697 S703 S704 L705 Y967 L971	Q697-D701 PolarHBondContact O-N 3.03Å; D701-S703 PolarHBondContact O-N 3Å; D701-S704 WeakPolarHBondContact O-CB 3.23Å; D701-S704 PolarHBondContact O-N 3.44Å; D701-L705 WeakPolarHBondContact O-CG 3.38Å; D701-L705 PolarHBondContact O-N 2.85Å; D701-Y967 VanDerWaalsContact OD2-CE1 3.24Å; D701-Y967 WeakPolarHBondContact OD2-CE1 3.44Å; D701-Y967 PolarHBondContact OD2-OH 3.27Å; D701-L971 HydrophobicContact CB-CD1 4.4Å
702	A	96	Very high	92.3	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-59.7	-46.1	175.2	0	0	0	0	0	111.6	I698 S704 L705 I706 L909 C910 L913	I698-A702 VanDerWaalsContact O-CB 3.28Å; I698-A702 WeakPolarHBondContact O-CB 3.3Å; I698-A702 PolarHBondContact O-N 3.09Å; A702-S704 VanDerWaalsContact C-N 3.34Å; A702-S704 PolarHBondContact O-N 3.25Å; A702-L705 PolarHBondContact O-N 2.74Å; A702-I706 WeakPolarHBondContact O-CD1 3.34Å; A702-I706 VanDerWaalsContact O-CG1 3.27Å; A702-I706 WeakPolarHBondContact O-CG1 3.42Å; A702-I706 PolarHBondContact O-N 3.31Å; A702-L909 HydrophobicContact CB-CD2 3.93Å; A702-L909 HydrophobicContact CB-CG 4.23Å; A702-C910 VanDerWaalsContact CB-SG 3.56Å; A702-L913 HydrophobicContact CB-CD1 3.88Å
703	S	94.6	Very high	92	Very high	21 Å²	21	43.1 Å²	43.1	15%	0.147	20%	0.203	C	C	.	.	H	α-helix	trans	-61.5	-42.3	176.5	-59.5	0	0	0	0	111.7	L699 E700 D701 I706 I707	L699-S703 VanDerWaalsContact O-CB 3.32Å; L699-S703 WeakPolarHBondContact O-CB 3.46Å; L699-S703 PolarHBondContact O-N 2.79Å; L699-S703 PolarHBondContact O-OG 3.15Å; E700-S703 PolarHBondContact O-N 3.44Å; D701-S703 PolarHBondContact O-N 3Å; S703-I706 PolarHBondContact O-N 3.47Å; S703-I707 WeakPolarHBondContact O-CB 3.3Å; S703-I707 VanDerWaalsContact O-CG1 3.3Å; S703-I707 WeakPolarHBondContact O-CG1 3.46Å; S703-I707 PolarHBondContact O-N 3.17Å
704	S	95.1	Very high	91.6	Very high	53 Å²	53	47.9 Å²	47.9	37%	0.371	24%	0.235	S	C	.	.	H	α-helix	trans	-60	-47.3	176.6	-175.5	0	0	0	0	111.8	E700 D701 A702 Y708	E700-S704 VanDerWaalsContact O-CB 3.27Å; E700-S704 WeakPolarHBondContact O-CB 3.33Å; E700-S704 PolarHBondContact O-N 3.34Å; D701-S704 WeakPolarHBondContact O-CB 3.23Å; D701-S704 PolarHBondContact O-N 3.44Å; A702-S704 VanDerWaalsContact C-N 3.34Å; A702-S704 PolarHBondContact O-N 3.25Å; S704-Y708 WeakPolarHBondContact O-CB 3.28Å; S704-Y708 PolarHBondContact O-N 2.96Å
705	L	96.6	Very high	91.7	Very high	0 Å²	0	49 Å²	49	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-63.5	-42	176.8	-71.3	176.2	0	0	0	112.9	D701 A702 H709 L913 L971 V974 R975 I1009	D701-L705 WeakPolarHBondContact O-CG 3.38Å; D701-L705 PolarHBondContact O-N 2.85Å; A702-L705 PolarHBondContact O-N 2.74Å; L705-H709 PolarHBondContact O-N 3.23Å; L705-L913 HydrophobicContact CD1-CD1 4.34Å; L705-L913 HydrophobicContact CD1-CD2 4.18Å; L705-L971 HydrophobicContact CD1-CD2 3.92Å; L705-L971 HydrophobicContact CG-CD2 4.48Å; L705-V974 HydrophobicContact CD1-CG1 4.12Å; L705-V974 HydrophobicContact CD2-CB 4.4Å; L705-V974 HydrophobicContact CD2-CG1 3.96Å; L705-R975 HydrophobicContact CD2-CG 3.76Å; L705-I1009 HydrophobicContact CB-CD1 4.12Å; L705-I1009 HydrophobicContact CD1-CD1 4.18Å
706	I	96.2	Very high	92	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-62.1	-54.4	176.9	-66.9	161.3	0	0	0	109.9	A702 S703 Y708 H709 V710 I728 L909 I1012 L1016	A702-I706 WeakPolarHBondContact O-CD1 3.34Å; A702-I706 VanDerWaalsContact O-CG1 3.27Å; A702-I706 WeakPolarHBondContact O-CG1 3.42Å; A702-I706 PolarHBondContact O-N 3.31Å; S703-I706 PolarHBondContact O-N 3.47Å; I706-Y708 VanDerWaalsContact C-N 3.31Å; I706-Y708 PolarHBondContact O-N 3.01Å; I706-H709 PolarHBondContact O-N 2.91Å; I706-V710 HydrophobicContact CG2-CG2 4.11Å; I706-V710 VanDerWaalsContact O-CG2 3.28Å; I706-V710 WeakPolarHBondContact O-CG2 3.42Å; I706-V710 PolarHBondContact O-N 3.42Å; I706-I728 HydrophobicContact CD1-CD1 4.26Å; I706-I728 HydrophobicContact CG2-CD1 4.23Å; I706-I728 HydrophobicContact CG2-CG1 4.07Å; I706-L909 HydrophobicContact CD1-CD2 4.2Å; I706-L909 HydrophobicContact CG1-CD2 4.29Å; I706-I1012 HydrophobicContact CD1-CD1 4.43Å; I706-I1012 HydrophobicContact CD1-CG2 3.85Å; I706-I1012 HydrophobicContact CG1-CG2 4Å; I706-I1012 HydrophobicContact CG2-CG2 4.38Å; I706-L1016 HydrophobicContact CG2-CD1 3.64Å
707	I	94.6	Very high	92.2	Very high	18 Å²	18	50.4 Å²	50.4	9%	0.092	25%	0.254	C	S	.	.	H	α-helix	trans	-61.1	-38.9	-179.6	-66.8	-64.3	0	0	0	112	S703 H709 K711 K725 I728 Q729	S703-I707 WeakPolarHBondContact O-CB 3.3Å; S703-I707 VanDerWaalsContact O-CG1 3.3Å; S703-I707 WeakPolarHBondContact O-CG1 3.46Å; S703-I707 PolarHBondContact O-N 3.17Å; I707-H709 VanDerWaalsContact C-N 3.29Å; I707-H709 PolarHBondContact O-N 3.31Å; I707-K711 HydrophobicContact CG2-CD 4.02Å; I707-K711 HydrophobicContact CG2-CG 4.35Å; I707-K711 WeakPolarHBondContact O-CB 3.43Å; I707-K711 WeakPolarHBondContact O-CG 3.13Å; I707-K711 PolarHBondContact O-N 3.4Å; I707-K725 HydrophobicContact CD1-CB 4.2Å; I707-K725 HydrophobicContact CD1-CG 4.48Å; I707-I728 HydrophobicContact CD1-CB 4.01Å; I707-I728 HydrophobicContact CD1-CG2 4.03Å; I707-I728 HydrophobicContact CG1-CB 4.39Å; I707-I728 HydrophobicContact CG1-CG2 3.85Å; I707-Q729 HydrophobicContact CD1-CG 4.39Å; I707-Q729 HydrophobicContact CG1-CG 4.41Å
708	Y	94.4	Very high	92.2	Very high	56 Å²	56	51.3 Å²	51.3	22%	0.22	26%	0.257	C	S	.	.	H	α-helix	trans	-56.9	-42.5	178.4	179.3	-84.6	0	0	0	112.3	S704 I706 R712 R975 D979	S704-Y708 WeakPolarHBondContact O-CB 3.28Å; S704-Y708 PolarHBondContact O-N 2.96Å; I706-Y708 VanDerWaalsContact C-N 3.31Å; I706-Y708 PolarHBondContact O-N 3.01Å; Y708-R712 VanDerWaalsContact CD2-NH1 3.33Å; Y708-R712 VanDerWaalsContact CE2-CZ 3.46Å; Y708-R712 VanDerWaalsContact CE2-NH2 3.25Å; Y708-R712 WeakPolarHBondContact O-CD 3.25Å; Y708-R712 PolarHBondContact O-NH1 3.36Å; Y708-R712 PolarHBondContact OH-NH2 2.83Å; Y708-R975 HydrophobicContact CD1-CB 4.25Å; Y708-R975 HydrophobicContact CD1-CG 3.83Å; Y708-R975 VanDerWaalsContact CD2-CD 3.47Å; Y708-R975 HydrophobicContact CD2-CG 4.04Å; Y708-R975 HydrophobicContact CE1-CB 3.63Å; Y708-R975 HydrophobicContact CE1-CG 3.71Å; Y708-R975 HydrophobicContact CE2-CB 4.2Å; Y708-R975 HydrophobicContact CE2-CG 3.91Å; Y708-R975 HydrophobicContact CG-CG 4Å; Y708-D979 VanDerWaalsContact CE1-OD1 3.23Å; Y708-D979 WeakPolarHBondContact CE1-OD1 3.42Å; Y708-D979 PolarHBondContact OH-OD2 3.05Å
709	H	94	Very high	92	Very high	7 Å²	7	54.2 Å²	54.2	3%	0.032	27%	0.272	C	S	.	.	H	α-helix	trans	-84.8	-38.9	-179	-168.7	51	0	0	0	112.2	L705 I706 I707 K711 R712 Q713 L978 H1010 I1013	L705-H709 PolarHBondContact O-N 3.23Å; I706-H709 PolarHBondContact O-N 2.91Å; I707-H709 VanDerWaalsContact C-N 3.29Å; I707-H709 PolarHBondContact O-N 3.31Å; H709-K711 VanDerWaalsContact C-N 3.32Å; H709-K711 PolarHBondContact O-N 2.88Å; H709-R712 PolarHBondContact O-N 3.21Å; H709-R712 VanDerWaalsContact O-N 3.08Å; H709-Q713 PolarHBondContact CE1-NE2 2.95Å; H709-Q713 PolarHBondContact NE2-NE2 3.27Å; H709-Q713 WeakPolarHBondContact O-CG 3.34Å; H709-Q713 PolarHBondContact O-N 3.18Å; H709-Q713 VanDerWaalsContact O-N 3.08Å; H709-L978 HydrophobicContact CB-CB 4.49Å; H709-L978 HydrophobicContact CB-CD1 4.28Å; H709-L978 PolarHBondContact CE1-O 3.44Å; H709-L978 PolarHBondContact ND1-O 3.34Å; H709-H1010 AromaticContact NE2-CD2 4Å; H709-H1010 AromaticContact NE2-CE1 3.71Å; H709-H1010 AromaticContact NE2-NE2 3.65Å; H709-I1013 HydrophobicContact CB-CD1 3.84Å; H709-I1013 WeakPolarHBondContact CD2-CD1 3.21Å
710	V	94.2	Very high	92	Very high	3 Å²	3	55.2 Å²	55.2	2%	0.018	28%	0.278	C	S	.	.	H	α-helix	trans	-54.4	-45.5	173.7	169.5	0	0	0	0	111.7	I706 R712 Q713 I716 K721 I724 I1013	I706-V710 HydrophobicContact CG2-CG2 4.11Å; I706-V710 VanDerWaalsContact O-CG2 3.28Å; I706-V710 WeakPolarHBondContact O-CG2 3.42Å; I706-V710 PolarHBondContact O-N 3.42Å; V710-R712 PolarHBondContact O-N 2.89Å; V710-Q713 PolarHBondContact O-N 2.89Å; V710-I716 HydrophobicContact CG1-CD1 4.4Å; V710-K721 HydrophobicContact CG1-CB 4.34Å; V710-K721 HydrophobicContact CG1-CG 4.02Å; V710-K721 VanDerWaalsContact O-CE 3.3Å; V710-K721 WeakPolarHBondContact O-CE 3.5Å; V710-I724 HydrophobicContact CG1-CB 4.39Å; V710-I724 HydrophobicContact CG1-CG2 3.97Å; V710-I724 HydrophobicContact CG2-CG2 3.89Å; V710-I1013 HydrophobicContact CB-CD1 4.49Å; V710-I1013 HydrophobicContact CG2-CD1 3.6Å; V710-I1013 HydrophobicContact CG2-CG1 3.68Å; V710-I1013 HydrophobicContact CG2-CG2 4.25Å
711	K	91.4	Very high	92	Very high	124 Å²	124	51.9 Å²	51.9	54%	0.539	26%	0.261	S	S	.	.	H	α-helix	trans	-56.4	-40.2	178.5	-78	178	175.1	-178.8	0	112.2	I707 H709 K721	I707-K711 HydrophobicContact CG2-CD 4.02Å; I707-K711 HydrophobicContact CG2-CG 4.35Å; I707-K711 WeakPolarHBondContact O-CB 3.43Å; I707-K711 WeakPolarHBondContact O-CG 3.13Å; I707-K711 PolarHBondContact O-N 3.4Å; H709-K711 VanDerWaalsContact C-N 3.32Å; H709-K711 PolarHBondContact O-N 2.88Å; K711-K721 PolarHBondContact O-NZ 3.44Å
712	R	89.4	Confident	91.8	Very high	114 Å²	114	52.2 Å²	52.2	43%	0.43	26%	0.263	S	S	.	.	H	α-helix	trans	-83.2	-24.6	-174	-69.7	171.9	167.5	68.1	1.7	114.9	Y708 H709 V710 P714 D979	Y708-R712 VanDerWaalsContact CD2-NH1 3.33Å; Y708-R712 VanDerWaalsContact CE2-CZ 3.46Å; Y708-R712 VanDerWaalsContact CE2-NH2 3.25Å; Y708-R712 WeakPolarHBondContact O-CD 3.25Å; Y708-R712 PolarHBondContact O-NH1 3.36Å; Y708-R712 PolarHBondContact OH-NH2 2.83Å; H709-R712 PolarHBondContact O-N 3.21Å; H709-R712 VanDerWaalsContact O-N 3.08Å; V710-R712 PolarHBondContact O-N 2.89Å; R712-P714 WeakPolarHBondContact O-CD 3.44Å; R712-D979 VanDerWaalsContact CD-CG 3.49Å; R712-D979 WeakPolarHBondContact CD-OD1 3.15Å; R712-D979 WeakPolarHBondContact CD-OD2 3.31Å; R712-D979 IonicContact CZ-OD1 3.52Å; R712-D979 IonicContact CZ-OD2 2.64Å; R712-D979 VanDerWaalsContact NE-CG 3.28Å; R712-D979 IonicContact NE-OD1 3.67Å; R712-D979 PolarHBondContact NE-OD1 2.89Å; R712-D979 IonicContact NE-OD2 3.4Å; R712-D979 PolarHBondContact NE-OD2 3.39Å; R712-D979 IonicContact NH2-OD2 2.75Å
713	Q	87.9	Confident	91.6	Very high	44 Å²	44	55.3 Å²	55.3	21%	0.206	28%	0.277	C	S	.	.			trans	-62.4	119	178.9	-76.4	-68	-6.9	0	0	110.7	H709 V710 T715 I716 K721	H709-Q713 PolarHBondContact CE1-NE2 2.95Å; H709-Q713 PolarHBondContact NE2-NE2 3.27Å; H709-Q713 WeakPolarHBondContact O-CG 3.34Å; H709-Q713 PolarHBondContact O-N 3.18Å; H709-Q713 VanDerWaalsContact O-N 3.08Å; V710-Q713 PolarHBondContact O-N 2.89Å; Q713-T715 VanDerWaalsContact C-N 3.27Å; Q713-T715 PolarHBondContact O-N 2.93Å; Q713-I716 HydrophobicContact CB-CD1 3.79Å; Q713-I716 HydrophobicContact CB-CG1 3.98Å; Q713-I716 HydrophobicContact CG-CD1 4.37Å; Q713-K721 WeakPolarHBondContact O-CE 3.3Å; Q713-K721 PolarHBondContact O-NZ 3.06Å
714	P	84.7	Confident	91.6	Very high	115 Å²	115	54.3 Å²	54.3	75%	0.747	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.7	-9.2	-178.7	33.5	-35.7	0	0	0	113	R712	R712-P714 WeakPolarHBondContact O-CD 3.44Å
715	T	86.6	Confident	91.4	Very high	104 Å²	104	53 Å²	53	64%	0.638	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88	-4.7	-176.2	50.1	0	0	0	0	114.5	Q713	Q713-T715 VanDerWaalsContact C-N 3.27Å; Q713-T715 PolarHBondContact O-N 2.93Å
716	I	89.6	Confident	91.2	Very high	10 Å²	10	58.1 Å²	58.1	5%	0.051	28%	0.277	C	S	.	.	S	Bend	trans	-103.7	132	-179.4	-50.6	179.8	0	0	0	107.8	V710 Q713 D720 K721 I724 I1013 Q1017	V710-I716 HydrophobicContact CG1-CD1 4.4Å; Q713-I716 HydrophobicContact CB-CD1 3.79Å; Q713-I716 HydrophobicContact CB-CG1 3.98Å; Q713-I716 HydrophobicContact CG-CD1 4.37Å; I716-D720 HydrophobicContact CG2-CB 3.53Å; I716-K721 HydrophobicContact CB-CG 4Å; I716-K721 HydrophobicContact CG2-CG 3.7Å; I716-K721 WeakPolarHBondContact O-CE 3.25Å; I716-I724 HydrophobicContact CG2-CD1 4.28Å; I716-I1013 HydrophobicContact CD1-CG2 3.74Å; I716-Q1017 HydrophobicContact CD1-CG 4.26Å; I716-Q1017 HydrophobicContact CG1-CG 4.28Å; I716-Q1017 VanDerWaalsContact CG1-NE2 3.32Å
717	H	89.2	Confident	91.1	Very high	136 Å²	136	59 Å²	59	63%	0.63	28%	0.282	S	S	*	.			trans	-65.1	163.8	177.7	-72	-95.2	0	0	0	111.3	D720 K721	H717-D720 HydrophobicContact CB-CB 4.34Å; H717-D720 WeakPolarHBondContact CB-OD2 3.23Å; H717-D720 IonicContact CD2-OD2 3.54Å; H717-D720 PolarHBondContact N-OD2 2.61Å; H717-K721 WeakPolarHBondContact O-CG 3.37Å; H717-K721 PolarHBondContact O-N 3.27Å
718	K	90.1	Very high	91.1	Very high	111 Å²	111	58.2 Å²	58.2	48%	0.483	28%	0.277	S	S	.	.	H	α-helix	trans	-62.4	-50	-176.1	-171	-174.7	-179.5	-171.7	0	111	K721 D722 E747	K718-K721 WeakPolarHBondContact O-CB 3.16Å; K718-K721 PolarHBondContact O-N 2.69Å; K718-K721 VanDerWaalsContact O-N 3.07Å; K718-D722 PolarHBondContact O-N 3.46Å; K718-D722 VanDerWaalsContact O-N 3.14Å; K718-E747 WeakPolarHBondContact CE-OE1 3.2Å; K718-E747 WeakPolarHBondContact CE-OE2 3.46Å; K718-E747 IonicContact NZ-OE1 2.77Å; K718-E747 PolarHBondContact NZ-OE1 3.09Å; K718-E747 IonicContact NZ-OE2 3.78Å; K718-E747 PolarHBondContact NZ-OE2 2.99Å; K718-E747 VanDerWaalsContact NZ-OE2 3.07Å
719	D	89	Confident	90.9	Very high	66 Å²	66	57.3 Å²	57.3	35%	0.353	28%	0.275	S	S	.	.	H	α-helix	trans	-69.5	-38.8	-174.8	-42.6	-73	0	0	0	110.7	K721 D722 H723 W749	D719-K721 VanDerWaalsContact C-N 3.33Å; D719-K721 PolarHBondContact O-N 3.16Å; D719-D722 PolarHBondContact O-N 3.47Å; D719-D722 VanDerWaalsContact O-N 3.17Å; D719-H723 WeakPolarHBondContact O-CB 3.37Å; D719-H723 PolarHBondContact O-CD2 3.43Å; D719-H723 PolarHBondContact O-N 3.01Å; D719-W749 WeakPolarHBondContact OD1-CZ2 3.37Å
720	D	91.4	Very high	90.6	Very high	35 Å²	35	59.2 Å²	59.2	19%	0.187	28%	0.284	C	S	.	.	H	α-helix	trans	-53.2	-46.1	167.2	-68.2	-21.1	0	0	0	111.9	I716 H717 D722 H723 I724 V1020	I716-D720 HydrophobicContact CG2-CB 3.53Å; H717-D720 HydrophobicContact CB-CB 4.34Å; H717-D720 WeakPolarHBondContact CB-OD2 3.23Å; H717-D720 IonicContact CD2-OD2 3.54Å; H717-D720 PolarHBondContact N-OD2 2.61Å; D720-D722 VanDerWaalsContact C-N 3.33Å; D720-D722 PolarHBondContact O-N 3.22Å; D720-H723 PolarHBondContact O-N 3.34Å; D720-I724 WeakPolarHBondContact O-CB 3.46Å; D720-I724 VanDerWaalsContact O-CG1 3.22Å; D720-I724 WeakPolarHBondContact O-CG1 3.36Å; D720-I724 PolarHBondContact O-N 2.9Å; D720-V1020 HydrophobicContact CB-CG2 3.99Å
721	K	91.9	Very high	90.5	Very high	49 Å²	49	59.9 Å²	59.9	21%	0.213	29%	0.287	C	S	.	.	H	α-helix	trans	-62.5	-40.3	178.7	-73.8	176.5	-177.7	-174.9	0	111.6	V710 K711 Q713 I716 H717 K718 D719 K725	V710-K721 HydrophobicContact CG1-CB 4.34Å; V710-K721 HydrophobicContact CG1-CG 4.02Å; V710-K721 VanDerWaalsContact O-CE 3.3Å; V710-K721 WeakPolarHBondContact O-CE 3.5Å; K711-K721 PolarHBondContact O-NZ 3.44Å; Q713-K721 WeakPolarHBondContact O-CE 3.3Å; Q713-K721 PolarHBondContact O-NZ 3.06Å; I716-K721 HydrophobicContact CB-CG 4Å; I716-K721 HydrophobicContact CG2-CG 3.7Å; I716-K721 WeakPolarHBondContact O-CE 3.25Å; H717-K721 WeakPolarHBondContact O-CG 3.37Å; H717-K721 PolarHBondContact O-N 3.27Å; K718-K721 WeakPolarHBondContact O-CB 3.16Å; K718-K721 PolarHBondContact O-N 2.69Å; K718-K721 VanDerWaalsContact O-N 3.07Å; D719-K721 VanDerWaalsContact C-N 3.33Å; D719-K721 PolarHBondContact O-N 3.16Å; K721-K725 WeakPolarHBondContact O-CB 3.42Å; K721-K725 PolarHBondContact O-N 3.13Å
722	D	91.1	Very high	90.6	Very high	31 Å²	31	54.1 Å²	54.1	17%	0.166	26%	0.262	C	S	.	.	H	α-helix	trans	-72.6	-31.1	176.2	-79.1	-64.3	0	0	0	112.7	K718 D719 D720 K725 R726	K718-D722 PolarHBondContact O-N 3.46Å; K718-D722 VanDerWaalsContact O-N 3.14Å; D719-D722 PolarHBondContact O-N 3.47Å; D719-D722 VanDerWaalsContact O-N 3.17Å; D720-D722 VanDerWaalsContact C-N 3.33Å; D720-D722 PolarHBondContact O-N 3.22Å; D722-K725 PolarHBondContact O-N 2.69Å; D722-K725 WeakPolarHBondContact OD1-CD 3.18Å; D722-K725 IonicContact OD1-NZ 2.66Å; D722-K725 PolarHBondContact OD1-NZ 3.39Å; D722-R726 VanDerWaalsContact O-CG 3.29Å; D722-R726 WeakPolarHBondContact O-CG 3.39Å; D722-R726 PolarHBondContact O-N 2.95Å
723	H	91.1	Very high	90.6	Very high	65 Å²	65	49.4 Å²	49.4	30%	0.301	25%	0.246	S	C	.	.	H	α-helix	trans	-66.6	-47.5	172	-74.2	-151.6	0	0	0	110.7	D719 D720 K725 R726 I727 V1020	D719-H723 WeakPolarHBondContact O-CB 3.37Å; D719-H723 PolarHBondContact O-CD2 3.43Å; D719-H723 PolarHBondContact O-N 3.01Å; D720-H723 PolarHBondContact O-N 3.34Å; H723-K725 VanDerWaalsContact C-N 3.31Å; H723-K725 PolarHBondContact O-N 3.18Å; H723-R726 PolarHBondContact CD2-NH1 3.46Å; H723-R726 PolarHBondContact CD2-NH2 2.94Å; H723-R726 VanDerWaalsContact CD2-NH2 3.33Å; H723-R726 PolarHBondContact NE2-NH1 2.56Å; H723-R726 PolarHBondContact NE2-NH2 2.73Å; H723-R726 PolarHBondContact O-N 2.85Å; H723-I727 WeakPolarHBondContact O-CG1 3.48Å; H723-I727 PolarHBondContact O-N 2.68Å; H723-V1020 HydrophobicContact CB-CB 4.06Å; H723-V1020 HydrophobicContact CB-CG1 3.61Å
724	I	94.3	Very high	90.6	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-59.9	-40.5	173.5	-67.3	171.5	0	0	0	111.2	V710 I716 D720 I727 I728 L1016 V1020	V710-I724 HydrophobicContact CG1-CB 4.39Å; V710-I724 HydrophobicContact CG1-CG2 3.97Å; V710-I724 HydrophobicContact CG2-CG2 3.89Å; I716-I724 HydrophobicContact CG2-CD1 4.28Å; D720-I724 WeakPolarHBondContact O-CB 3.46Å; D720-I724 VanDerWaalsContact O-CG1 3.22Å; D720-I724 WeakPolarHBondContact O-CG1 3.36Å; D720-I724 PolarHBondContact O-N 2.9Å; I724-I727 PolarHBondContact O-N 3.24Å; I724-I728 HydrophobicContact CG2-CG1 4.44Å; I724-I728 WeakPolarHBondContact O-CG1 3.23Å; I724-I728 PolarHBondContact O-N 3.18Å; I724-L1016 HydrophobicContact CD1-CB 4.02Å; I724-L1016 HydrophobicContact CG1-CB 4.04Å; I724-L1016 HydrophobicContact CG2-CB 4.11Å; I724-L1016 HydrophobicContact CG2-CD1 3.96Å; I724-L1016 HydrophobicContact CG2-CD2 4.28Å; I724-L1016 HydrophobicContact CG2-CG 4.35Å; I724-V1020 HydrophobicContact CD1-CG2 4.28Å; I724-V1020 HydrophobicContact CG1-CG1 3.78Å; I724-V1020 HydrophobicContact CG1-CG2 4.11Å
725	K	92.8	Very high	90.9	Very high	25 Å²	25	42.7 Å²	42.7	11%	0.109	21%	0.205	C	C	.	.	H	α-helix	trans	-62.7	-44.9	175.2	176.8	-163.4	171.1	-169.1	0	111.8	I707 K721 D722 H723 I728 Q729 L743	I707-K725 HydrophobicContact CD1-CB 4.2Å; I707-K725 HydrophobicContact CD1-CG 4.48Å; K721-K725 WeakPolarHBondContact O-CB 3.42Å; K721-K725 PolarHBondContact O-N 3.13Å; D722-K725 PolarHBondContact O-N 2.69Å; D722-K725 WeakPolarHBondContact OD1-CD 3.18Å; D722-K725 IonicContact OD1-NZ 2.66Å; D722-K725 PolarHBondContact OD1-NZ 3.39Å; H723-K725 VanDerWaalsContact C-N 3.31Å; H723-K725 PolarHBondContact O-N 3.18Å; K725-I728 PolarHBondContact O-N 3.49Å; K725-Q729 VanDerWaalsContact O-CB 3.26Å; K725-Q729 WeakPolarHBondContact O-CB 3.4Å; K725-Q729 WeakPolarHBondContact O-CG 3.48Å; K725-Q729 PolarHBondContact O-N 3.08Å; K725-L743 HydrophobicContact CD-CD2 4.03Å; K725-L743 HydrophobicContact CG-CD2 3.82Å
726	R	91.4	Very high	91.1	Very high	108 Å²	108	37.8 Å²	37.8	41%	0.408	18%	0.175	S	C	.	.	H	α-helix	trans	-62	-41.5	172.8	-70.5	176.7	-135.8	144.6	5.2	111.8	D722 H723 H730 F731	D722-R726 VanDerWaalsContact O-CG 3.29Å; D722-R726 WeakPolarHBondContact O-CG 3.39Å; D722-R726 PolarHBondContact O-N 2.95Å; H723-R726 PolarHBondContact CD2-NH1 3.46Å; H723-R726 PolarHBondContact CD2-NH2 2.94Å; H723-R726 VanDerWaalsContact CD2-NH2 3.33Å; H723-R726 PolarHBondContact NE2-NH1 2.56Å; H723-R726 PolarHBondContact NE2-NH2 2.73Å; H723-R726 PolarHBondContact O-N 2.85Å; R726-H730 WeakPolarHBondContact O-CA 3.13Å; R726-H730 WeakPolarHBondContact O-CB 3.4Å; R726-H730 PolarHBondContact O-N 3.06Å; R726-F731 PolarHBondContact O-N 3.02Å
727	I	93.7	Very high	90.9	Very high	18 Å²	18	37.7 Å²	37.7	9%	0.092	17%	0.174	C	C	.	.	I	π-helix	trans	-59.6	-52.7	176.3	-71.6	167.8	0	0	0	110.7	H723 I724 F731 V732 W899 L1016 V1020	H723-I727 WeakPolarHBondContact O-CG1 3.48Å; H723-I727 PolarHBondContact O-N 2.68Å; I724-I727 PolarHBondContact O-N 3.24Å; I727-F731 WeakPolarHBondContact O-CB 3.42Å; I727-F731 PolarHBondContact O-N 3.24Å; I727-F731 VanDerWaalsContact O-N 3.15Å; I727-V732 HydrophobicContact CG2-CG2 4.19Å; I727-V732 PolarHBondContact O-N 3.36Å; I727-W899 HydrophobicContact CG2-CH2 3.94Å; I727-L1016 HydrophobicContact CG2-CD2 4.04Å; I727-V1020 HydrophobicContact CD1-CG1 3.68Å
728	I	94.4	Very high	90.5	Very high	1 Å²	1	32 Å²	32	1%	0.005	15%	0.15	C	C	.	.	I	π-helix	trans	-75.9	-34.8	-174.5	-63.9	-65.4	0	0	0	112.9	I706 I707 I724 K725 P733 F902 L1016	I706-I728 HydrophobicContact CD1-CD1 4.26Å; I706-I728 HydrophobicContact CG2-CD1 4.23Å; I706-I728 HydrophobicContact CG2-CG1 4.07Å; I707-I728 HydrophobicContact CD1-CB 4.01Å; I707-I728 HydrophobicContact CD1-CG2 4.03Å; I707-I728 HydrophobicContact CG1-CB 4.39Å; I707-I728 HydrophobicContact CG1-CG2 3.85Å; I724-I728 HydrophobicContact CG2-CG1 4.44Å; I724-I728 WeakPolarHBondContact O-CG1 3.23Å; I724-I728 PolarHBondContact O-N 3.18Å; K725-I728 PolarHBondContact O-N 3.49Å; I728-P733 WeakPolarHBondContact O-CD 3.02Å; I728-F902 HydrophobicContact CD1-CE2 3.95Å; I728-F902 HydrophobicContact CD1-CZ 3.7Å; I728-L1016 HydrophobicContact CD1-CD1 4.06Å; I728-L1016 HydrophobicContact CD1-CD2 4.08Å; I728-L1016 HydrophobicContact CG1-CD1 4.2Å; I728-L1016 HydrophobicContact CG1-CD2 4.27Å
729	Q	90.7	Very high	89.8	Confident	37 Å²	37	34.6 Å²	34.6	17%	0.173	16%	0.157	C	C	.	.	I	π-helix	trans	-92	-15.5	-178	-59.7	-166.2	-90	0	0	114.5	I707 K725 R740 G741 E742 L743	I707-Q729 HydrophobicContact CD1-CG 4.39Å; I707-Q729 HydrophobicContact CG1-CG 4.41Å; K725-Q729 VanDerWaalsContact O-CB 3.26Å; K725-Q729 WeakPolarHBondContact O-CB 3.4Å; K725-Q729 WeakPolarHBondContact O-CG 3.48Å; K725-Q729 PolarHBondContact O-N 3.08Å; Q729-R740 CarbonylContact O-C 3.59Å; Q729-R740 WeakPolarHBondContact O-CA 3.49Å; Q729-G741 PolarHBondContact O-N 2.9Å; Q729-E742 PolarHBondContact NE2-O 3.28Å; Q729-E742 PolarHBondContact OE1-O 2.94Å; Q729-L743 HydrophobicContact CB-CD2 4.47Å
730	H	88.6	Confident	89.4	Confident	47 Å²	47	35.9 Å²	35.9	22%	0.218	16%	0.157	C	C	.	.	I	π-helix	trans	-126.6	-57.1	178	-62.1	-20.4	0	0	0	113.6	R726 P733 D734 R740 G741 L743	R726-H730 WeakPolarHBondContact O-CA 3.13Å; R726-H730 WeakPolarHBondContact O-CB 3.4Å; R726-H730 PolarHBondContact O-N 3.06Å; H730-P733 WeakPolarHBondContact O-CD 3.38Å; H730-D734 WeakPolarHBondContact O-CB 3.36Å; H730-D734 PolarHBondContact O-N 3.15Å; H730-R740 HydrophobicContact CB-CG 4.38Å; H730-G741 PolarHBondContact CE1-O 2.95Å; H730-G741 VanDerWaalsContact CE1-O 3.22Å; H730-L743 VanDerWaalsContact NE2-CD1 3.31Å; H730-L743 WeakPolarHBondContact NE2-CD1 3.41Å; H730-L743 WeakPolarHBondContact NE2-CG 3.49Å
731	F	92.1	Very high	88.3	Confident	17 Å²	17	35.6 Å²	35.6	8%	0.075	16%	0.163	C	C	.	.	I	π-helix	trans	-65.4	-47	-170.2	-171.4	-104	0	0	0	112.8	R726 I727 D734 L735 F893 W899 V1029 Y1032 L1033	R726-F731 PolarHBondContact O-N 3.02Å; I727-F731 WeakPolarHBondContact O-CB 3.42Å; I727-F731 PolarHBondContact O-N 3.24Å; I727-F731 VanDerWaalsContact O-N 3.15Å; F731-D734 PolarHBondContact O-N 3.13Å; F731-L735 HydrophobicContact CD1-CD1 4Å; F731-L735 HydrophobicContact CE1-CD1 3.69Å; F731-L735 HydrophobicContact CE1-CG 4.39Å; F731-L735 HydrophobicContact CZ-CD1 4.35Å; F731-L735 WeakPolarHBondContact O-CG 3.44Å; F731-L735 PolarHBondContact O-N 3.48Å; F731-L735 VanDerWaalsContact O-N 3.13Å; F731-F893 HydrophobicContact CE1-CD1 4.47Å; F731-F893 AromaticContact CE1-CE1 3.66Å; F731-F893 HydrophobicContact CE1-CE1 3.66Å; F731-F893 AromaticContact CE1-CZ 3.79Å; F731-F893 HydrophobicContact CE1-CZ 3.79Å; F731-F893 AromaticContact CZ-CE1 3.86Å; F731-F893 HydrophobicContact CZ-CE1 3.86Å; F731-F893 HydrophobicContact CZ-CE2 4.15Å; F731-F893 AromaticContact CZ-CZ 3.65Å; F731-F893 HydrophobicContact CZ-CZ 3.65Å; F731-W899 AromaticContact CD1-CH2 3.64Å; F731-W899 HydrophobicContact CD1-CH2 3.64Å; F731-W899 HydrophobicContact CD1-CZ2 4.44Å; F731-W899 HydrophobicContact CD1-CZ3 4.13Å; F731-W899 AromaticContact CE1-CH2 3.6Å; F731-W899 HydrophobicContact CE1-CH2 3.6Å; F731-W899 HydrophobicContact CE1-CZ2 4.13Å; F731-W899 AromaticContact CE1-CZ3 3.96Å; F731-W899 HydrophobicContact CE1-CZ3 3.96Å; F731-V1029 HydrophobicContact CD2-CG1 4.14Å; F731-V1029 HydrophobicContact CE1-CG2 4.2Å; F731-V1029 HydrophobicContact CE2-CB 4.5Å; F731-V1029 HydrophobicContact CE2-CG1 3.72Å; F731-V1029 HydrophobicContact CE2-CG2 4.34Å; F731-V1029 HydrophobicContact CZ-CB 4.47Å; F731-V1029 HydrophobicContact CZ-CG1 4.16Å; F731-V1029 HydrophobicContact CZ-CG2 3.94Å; F731-Y1032 AromaticContact CE2-CD1 3.56Å; F731-Y1032 HydrophobicContact CE2-CD1 3.56Å; F731-Y1032 AromaticContact CE2-CE1 3.73Å; F731-Y1032 HydrophobicContact CE2-CE1 3.73Å; F731-Y1032 AromaticContact CZ-CD1 3.77Å; F731-Y1032 HydrophobicContact CZ-CD1 3.77Å; F731-Y1032 HydrophobicContact CZ-CE1 4.04Å; F731-L1033 HydrophobicContact CE2-CD2 4.42Å
732	V	92.5	Very high	86.6	Confident	4 Å²	4	41.8 Å²	41.8	2%	0.024	19%	0.192	C	C	.	.	H	α-helix	trans	-65.5	-48.5	177	174	0	0	0	0	111.2	I727 D734 L735 F736 F902	I727-V732 HydrophobicContact CG2-CG2 4.19Å; I727-V732 PolarHBondContact O-N 3.36Å; V732-D734 VanDerWaalsContact C-N 3.32Å; V732-D734 PolarHBondContact O-N 2.82Å; V732-L735 WeakPolarHBondContact O-CB 3.44Å; V732-L735 PolarHBondContact O-N 3Å; V732-L735 VanDerWaalsContact O-N 3.12Å; V732-F736 HydrophobicContact CG1-CD2 3.78Å; V732-F736 HydrophobicContact CG1-CE2 3.95Å; V732-F736 WeakPolarHBondContact O-CD2 3.25Å; V732-F736 PolarHBondContact O-N 3.41Å; V732-F736 VanDerWaalsContact O-N 3.08Å; V732-F902 HydrophobicContact CG2-CE1 3.84Å; V732-F902 HydrophobicContact CG2-CZ 4.01Å
733	P	89.9	Confident	85	Confident	15 Å²	15	43.2 Å²	43.2	10%	0.097	20%	0.199	C	C	.	.	H	α-helix	trans	-56.6	-36.9	172.8	-31.1	37.1	0	0	0	115.4	I728 H730 F736 F737 S738 R739	I728-P733 WeakPolarHBondContact O-CD 3.02Å; H730-P733 WeakPolarHBondContact O-CD 3.38Å; P733-F736 CarbonylContact O-C 3.53Å; P733-F736 PolarHBondContact O-N 3.02Å; P733-F737 PolarHBondContact O-N 3.07Å; P733-F737 VanDerWaalsContact O-N 3.14Å; P733-S738 PolarHBondContact O-N 2.81Å; P733-R739 WeakPolarHBondContact CB-O 3.28Å
734	D	88.2	Confident	82.7	Confident	16 Å²	16	43.2 Å²	43.2	9%	0.086	21%	0.207	C	C	.	.	H	α-helix	trans	-61	-46.2	173.1	-90.4	33.1	0	0	0	111.2	H730 F731 V732 F736 F737 R740 N891 R1036	H730-D734 WeakPolarHBondContact O-CB 3.36Å; H730-D734 PolarHBondContact O-N 3.15Å; F731-D734 PolarHBondContact O-N 3.13Å; V732-D734 VanDerWaalsContact C-N 3.32Å; V732-D734 PolarHBondContact O-N 2.82Å; D734-F736 VanDerWaalsContact C-N 3.27Å; D734-F736 PolarHBondContact O-N 3.46Å; D734-F737 PolarHBondContact O-N 2.86Å; D734-R740 WeakPolarHBondContact OD1-CG 3.37Å; D734-R740 IonicContact OD1-CZ 3.08Å; D734-R740 IonicContact OD1-NE 2.86Å; D734-R740 PolarHBondContact OD1-NE 3.29Å; D734-R740 IonicContact OD1-NH2 3.4Å; D734-R740 PolarHBondContact OD1-NH2 3.49Å; D734-R740 IonicContact OD2-CZ 3.37Å; D734-R740 IonicContact OD2-NE 3.94Å; D734-R740 IonicContact OD2-NH2 3.32Å; D734-R740 PolarHBondContact OD2-NH2 3.22Å; D734-N891 PolarHBondContact O-ND2 3.34Å; D734-R1036 IonicContact OD2-CZ 3.14Å; D734-R1036 IonicContact OD2-NH1 3.31Å; D734-R1036 PolarHBondContact OD2-NH1 2.91Å; D734-R1036 IonicContact OD2-NH2 2.63Å; D734-R1036 PolarHBondContact OD2-NH2 3.39Å
735	L	90.5	Very high	79.9	Confident	1 Å²	1	51.2 Å²	51.2	1%	0.005	25%	0.25	C	C	.	.	H	α-helix	trans	-59.9	-36.4	176.1	-70.5	170.6	0	0	0	112.3	F731 V732 N891 F893 Y1032 F1076	F731-L735 HydrophobicContact CD1-CD1 4Å; F731-L735 HydrophobicContact CE1-CD1 3.69Å; F731-L735 HydrophobicContact CE1-CG 4.39Å; F731-L735 HydrophobicContact CZ-CD1 4.35Å; F731-L735 WeakPolarHBondContact O-CG 3.44Å; F731-L735 PolarHBondContact O-N 3.48Å; F731-L735 VanDerWaalsContact O-N 3.13Å; V732-L735 WeakPolarHBondContact O-CB 3.44Å; V732-L735 PolarHBondContact O-N 3Å; V732-L735 VanDerWaalsContact O-N 3.12Å; L735-N891 HydrophobicContact CD2-CB 4.45Å; L735-N891 PolarHBondContact O-ND2 3.21Å; L735-F893 HydrophobicContact CD1-CD1 4.07Å; L735-F893 HydrophobicContact CD1-CE1 4.29Å; L735-F893 HydrophobicContact CD2-CB 4.3Å; L735-F893 HydrophobicContact CD2-CD1 4.17Å; L735-F893 HydrophobicContact CD2-CG 4.44Å; L735-Y1032 HydrophobicContact CD2-CE1 4.2Å; L735-Y1032 HydrophobicContact CD2-CE2 4.22Å; L735-Y1032 WeakPolarHBondContact CD2-OH 3.3Å; L735-F1076 HydrophobicContact CB-CD1 4.47Å; L735-F1076 HydrophobicContact CB-CD2 4.23Å; L735-F1076 HydrophobicContact CB-CE1 4.47Å; L735-F1076 HydrophobicContact CB-CE2 4.23Å; L735-F1076 HydrophobicContact CB-CG 4.36Å; L735-F1076 HydrophobicContact CB-CZ 4.35Å; L735-F1076 HydrophobicContact CD1-CE2 4.1Å; L735-F1076 HydrophobicContact CD1-CZ 4.12Å; L735-F1076 HydrophobicContact CD2-CD2 4.03Å; L735-F1076 HydrophobicContact CD2-CE2 3.9Å; L735-F1076 HydrophobicContact CG-CE2 4.32Å; L735-F1076 VanDerWaalsContact O-CB 3.31Å; L735-F1076 WeakPolarHBondContact O-CB 2.99Å
736	F	90.1	Very high	77.4	Confident	2 Å²	2	54.6 Å²	54.6	1%	0.009	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.2	12.1	-178	-78.1	-81.2	0	0	0	115.1	Y693 L699 V732 P733 D734 S738 H906 F1076 V1083	Y693-F736 AromaticContact CD1-CE1 3.93Å; Y693-F736 HydrophobicContact CD1-CE1 3.93Å; Y693-F736 HydrophobicContact CD1-CZ 4.41Å; Y693-F736 AromaticContact CD2-CE1 3.6Å; Y693-F736 HydrophobicContact CD2-CE1 3.6Å; Y693-F736 HydrophobicContact CD2-CZ 4.32Å; Y693-F736 AromaticContact CE1-CE1 3.88Å; Y693-F736 HydrophobicContact CE1-CE1 3.88Å; Y693-F736 AromaticContact CE1-CZ 3.9Å; Y693-F736 HydrophobicContact CE1-CZ 3.9Å; Y693-F736 AromaticContact CE2-CE1 3.55Å; Y693-F736 HydrophobicContact CE2-CE1 3.55Å; Y693-F736 AromaticContact CE2-CZ 3.81Å; Y693-F736 HydrophobicContact CE2-CZ 3.81Å; Y693-F736 HydrophobicContact CG-CD1 4.47Å; Y693-F736 AromaticContact CG-CE1 3.77Å; Y693-F736 HydrophobicContact CG-CE1 3.77Å; Y693-F736 AromaticContact CZ-CE1 3.66Å; Y693-F736 AromaticContact CZ-CZ 3.53Å; L699-F736 HydrophobicContact CD1-CB 4.15Å; L699-F736 HydrophobicContact CD1-CD1 4.11Å; L699-F736 HydrophobicContact CD1-CG 4.18Å; L699-F736 HydrophobicContact CD2-CD1 4.45Å; V732-F736 HydrophobicContact CG1-CD2 3.78Å; V732-F736 HydrophobicContact CG1-CE2 3.95Å; V732-F736 WeakPolarHBondContact O-CD2 3.25Å; V732-F736 PolarHBondContact O-N 3.41Å; V732-F736 VanDerWaalsContact O-N 3.08Å; P733-F736 CarbonylContact O-C 3.53Å; P733-F736 PolarHBondContact O-N 3.02Å; D734-F736 VanDerWaalsContact C-N 3.27Å; D734-F736 PolarHBondContact O-N 3.46Å; F736-S738 PolarHBondContact O-N 3.41Å; F736-S738 VanDerWaalsContact O-N 3.14Å; F736-S738 PolarHBondContact O-OG 2.84Å; F736-H906 AromaticContact CE2-CE1 3.83Å; F736-F1076 HydrophobicContact CD1-CD1 4.31Å; F736-F1076 HydrophobicContact CD2-CD1 4.47Å; F736-F1076 HydrophobicContact CD2-CE1 4.38Å; F736-F1076 AromaticContact CE1-CD1 3.93Å; F736-F1076 HydrophobicContact CE1-CD1 3.93Å; F736-F1076 HydrophobicContact CE1-CE1 4.14Å; F736-F1076 HydrophobicContact CE2-CD1 4.12Å; F736-F1076 AromaticContact CE2-CE1 3.7Å; F736-F1076 HydrophobicContact CE2-CE1 3.7Å; F736-F1076 AromaticContact CZ-CD1 3.83Å; F736-F1076 HydrophobicContact CZ-CD1 3.83Å; F736-F1076 AromaticContact CZ-CE1 3.55Å; F736-F1076 HydrophobicContact CZ-CE1 3.55Å; F736-V1083 HydrophobicContact CD1-CB 4.14Å; F736-V1083 HydrophobicContact CD1-CG1 3.81Å; F736-V1083 HydrophobicContact CE1-CG1 4.26Å
737	F	86.7	Confident	74.9	Confident	7 Å²	7	54.8 Å²	54.8	3%	0.031	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	53.4	32.6	-179.4	-48.9	-86.1	0	0	0	113.8	K696 P733 D734 K884 V889 N891 F1076 Q1078 V1083	K696-F737 PolarHBondContact NZ-O 2.89Å; P733-F737 PolarHBondContact O-N 3.07Å; P733-F737 VanDerWaalsContact O-N 3.14Å; D734-F737 PolarHBondContact O-N 2.86Å; F737-K884 WeakPolarHBondContact O-CE 3.41Å; F737-V889 HydrophobicContact CE1-CB 4.4Å; F737-V889 HydrophobicContact CE1-CG1 3.64Å; F737-V889 HydrophobicContact CZ-CG1 4.01Å; F737-N891 WeakPolarHBondContact CE1-ND2 3.47Å; F737-N891 HydrophobicContact CZ-CB 4.34Å; F737-N891 VanDerWaalsContact CZ-ND2 3.25Å; F737-N891 WeakPolarHBondContact CZ-ND2 3.49Å; F737-F1076 HydrophobicContact CE2-CB 4.48Å; F737-F1076 WeakPolarHBondContact CE2-O 3.48Å; F737-Q1078 HydrophobicContact CD2-CB 3.62Å; F737-Q1078 HydrophobicContact CD2-CG 4.4Å; F737-Q1078 HydrophobicContact CE2-CB 3.78Å; F737-Q1078 HydrophobicContact CG-CB 4.11Å; F737-Q1078 HydrophobicContact CZ-CB 4.41Å; F737-V1083 HydrophobicContact CD2-CG2 4.29Å
738	S	80.8	Confident	71.9	Confident	18 Å²	18	63.1 Å²	63.1	13%	0.126	32%	0.317	C	S	.	.			trans	-101.5	-179	-176.5	-72.3	0	0	0	0	110.7	P733 F736	P733-S738 PolarHBondContact O-N 2.81Å; F736-S738 PolarHBondContact O-N 3.41Å; F736-S738 VanDerWaalsContact O-N 3.14Å; F736-S738 PolarHBondContact O-OG 2.84Å
739	R	74.6	Confident	68.6	Low	164 Å²	164	72.2 Å²	72.2	62%	0.619	35%	0.351	S	S	*	.	P	Polyproline II helix	trans	-81.1	137.5	171.4	-78.1	-165.9	164.3	144.4	-4.5	109.9	P733 G741 E881	P733-R739 WeakPolarHBondContact CB-O 3.28Å; R739-G741 PolarHBondContact O-N 2.87Å; R739-E881 IonicContact CZ-OE1 2.94Å; R739-E881 IonicContact CZ-OE2 2.71Å; R739-E881 IonicContact NE-OE1 3.82Å; R739-E881 PolarHBondContact NE-OE1 3.43Å; R739-E881 IonicContact NE-OE2 2.66Å; R739-E881 IonicContact NH2-OE1 3.07Å; R739-E881 PolarHBondContact NH2-OE1 3.04Å; R739-E881 VanDerWaalsContact NH2-OE1 3.08Å; R739-E881 IonicContact NH2-OE2 3.13Å; R739-E881 PolarHBondContact NH2-OE2 3.09Å
740	R	80.9	Confident	65.8	Low	93 Å²	93	76.1 Å²	76.1	35%	0.351	38%	0.378	S	S	.	.	P	Polyproline II helix	trans	-57.3	130.5	161.8	-69.5	-174.4	177.4	-176.3	-4.8	108.6	Q729 H730 D734 L875	Q729-R740 CarbonylContact O-C 3.59Å; Q729-R740 WeakPolarHBondContact O-CA 3.49Å; H730-R740 HydrophobicContact CB-CG 4.38Å; D734-R740 WeakPolarHBondContact OD1-CG 3.37Å; D734-R740 IonicContact OD1-CZ 3.08Å; D734-R740 IonicContact OD1-NE 2.86Å; D734-R740 PolarHBondContact OD1-NE 3.29Å; D734-R740 IonicContact OD1-NH2 3.4Å; D734-R740 PolarHBondContact OD1-NH2 3.49Å; D734-R740 IonicContact OD2-CZ 3.37Å; D734-R740 IonicContact OD2-NE 3.94Å; D734-R740 IonicContact OD2-NH2 3.32Å; D734-R740 PolarHBondContact OD2-NH2 3.22Å; R740-L875 PolarHBondContact NH1-O 3.39Å
741	G	69	Low	63.1	Low	30 Å²	30	81.2 Å²	81.2	31%	0.309	41%	0.407	S	S	.	.	P	Polyproline II helix	trans	-76.8	161.7	173.2	0	0	0	0	0	111.9	Q729 H730 R739 L743	Q729-G741 PolarHBondContact O-N 2.9Å; H730-G741 PolarHBondContact CE1-O 2.95Å; H730-G741 VanDerWaalsContact CE1-O 3.22Å; R739-G741 PolarHBondContact O-N 2.87Å; G741-L743 PolarHBondContact O-N 3.07Å
742	E	56.3	Low	60.2	Low	179 Å²	179	89.3 Å²	89.3	84%	0.836	44%	0.444	S	S	*	.	P	Polyproline II helix	trans	-72.6	120.5	179.6	-64.6	175.3	171	0	0	111.2	Q729 S744	Q729-E742 PolarHBondContact NE2-O 3.28Å; Q729-E742 PolarHBondContact OE1-O 2.94Å; E742-S744 PolarHBondContact O-N 2.84Å
743	L	56.8	Low	57.2	Low	60 Å²	60	97.5 Å²	97.5	31%	0.314	48%	0.483	S	S	.	.	P	Polyproline II helix	trans	-72.7	121.3	158.9	-62	177.4	0	0	0	107.2	K725 Q729 H730 G741 D745	K725-L743 HydrophobicContact CD-CD2 4.03Å; K725-L743 HydrophobicContact CG-CD2 3.82Å; Q729-L743 HydrophobicContact CB-CD2 4.47Å; H730-L743 VanDerWaalsContact NE2-CD1 3.31Å; H730-L743 WeakPolarHBondContact NE2-CD1 3.41Å; H730-L743 WeakPolarHBondContact NE2-CG 3.49Å; G741-L743 PolarHBondContact O-N 3.07Å; L743-D745 PolarHBondContact O-N 2.82Å
744	S	42.7	Very low	54.4	Low	66 Å²	66	101.7 Å²	101.7	46%	0.462	52%	0.519	S	S	.	.	P	Polyproline II helix	trans	-55.8	129.1	170.1	-176.8	0	0	0	0	110.1	E742 T746	E742-S744 PolarHBondContact O-N 2.84Å; S744-T746 PolarHBondContact O-N 3.25Å; S744-T746 PolarHBondContact OG-OG1 3.14Å; S744-T746 VanDerWaalsContact OG-OG1 3.11Å
745	D	36.2	Very low	51.4	Low	167 Å²	167	108.9 Å²	108.9	89%	0.893	55%	0.551	S	S	*	*	S	Bend	trans	-64.2	15.9	-175	-63.3	-56.5	0	0	0	115.6	L743	L743-D745 PolarHBondContact O-N 2.82Å
746	T	39.8	Very low	48.7	Very low	97 Å²	97	114.1 Å²	114.1	60%	0.595	59%	0.586	S	S	*	*			trans	-104.4	76.2	176.9	21.6	0	0	0	0	109.6	S744	S744-T746 PolarHBondContact O-N 3.25Å; S744-T746 PolarHBondContact OG-OG1 3.14Å; S744-T746 VanDerWaalsContact OG-OG1 3.11Å
747	E	38.8	Very low	45.8	Very low	111 Å²	111	123.5 Å²	123.5	52%	0.519	63%	0.63	S	S	.	*				172.3	115.8	121.1	-89	155	165.4	0	0	111.5	K718 W749	K718-E747 WeakPolarHBondContact CE-OE1 3.2Å; K718-E747 WeakPolarHBondContact CE-OE2 3.46Å; K718-E747 IonicContact NZ-OE1 2.77Å; K718-E747 PolarHBondContact NZ-OE1 3.09Å; K718-E747 IonicContact NZ-OE2 3.78Å; K718-E747 PolarHBondContact NZ-OE2 2.99Å; K718-E747 VanDerWaalsContact NZ-OE2 3.07Å; E747-W749 PolarHBondContact O-N 3.47Å
748	E	31.3	Very low	43	Very low	193 Å²	193	131.2 Å²	131.2	90%	0.902	67%	0.671	S	S	*	*			trans	-70.4	122.5	169.3	-67.4	177	123.9	0	0	109.3
749	W	25	Very low	40.6	Very low	192 Å²	192	133.8 Å²	133.8	73%	0.727	70%	0.7	S	S	*	*			trans	-89.8	124.2	158.1	-102.8	69	0	0	0	108	D719 E747 D751	D719-W749 WeakPolarHBondContact OD1-CZ2 3.37Å; E747-W749 PolarHBondContact O-N 3.47Å; W749-D751 PolarHBondContact O-N 3.47Å
750	T	31.3	Very low	38.4	Very low	120 Å²	120	130.7 Å²	130.7	74%	0.736	71%	0.71	S	S	*	*			trans	-80.6	111.9	170.7	45.8	0	0	0	0	109.3	E752	T750-E752 PolarHBondContact O-N 3.25Å
751	D	30.8	Very low	35.9	Very low	154 Å²	154	134.1 Å²	134.1	82%	0.824	73%	0.73	S	S	*	*			trans	-69.2	111	164.8	-98.9	-29	0	0	0	109.3	W749	W749-D751 PolarHBondContact O-N 3.47Å
752	E	31.1	Very low	33.9	Very low	186 Å²	186	143.2 Å²	143.2	87%	0.869	76%	0.755	S	S	*	*			trans	-118.4	104.8	155.6	-74.8	-162.5	150.5	0	0	108	T750 A754	T750-E752 PolarHBondContact O-N 3.25Å; E752-A754 PolarHBondContact O-N 3.3Å
753	E	31.2	Very low	32.4	Very low	177 Å²	177	138.7 Å²	138.7	83%	0.827	76%	0.756	S	S	*	*			trans	-67	120.9	176.5	-67.8	-178.8	126.3	0	0	110.4	E755	E753-E755 PolarHBondContact O-N 2.82Å
754	A	30.3	Very low	31	Very low	103 Å²	103	139.8 Å²	139.8	85%	0.851	78%	0.782	S	S	*	*			trans	-85.6	83.3	172	0	0	0	0	0	110.5	E752	E752-A754 PolarHBondContact O-N 3.3Å
755	E	26.3	Very low	30.2	Very low	166 Å²	166	140.5 Å²	140.5	78%	0.776	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-59.2	144.9	168.6	-84.9	-78.6	107.9	0	0	111.5	E753	E753-E755 PolarHBondContact O-N 2.82Å
756	P	33.4	Very low	29.7	Very low	112 Å²	112	137.2 Å²	137.2	73%	0.727	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-82.7	143.3	-169.3	32.1	-35.7	0	0	0	114.5
757	E	28.6	Very low	29	Very low	199 Å²	199	137.2 Å²	137.2	93%	0.93	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-77.7	134.2	163.7	-82.8	-160.6	123.3	0	0	111.8
758	D	28.6	Very low	28.5	Very low	169 Å²	169	138.1 Å²	138.1	90%	0.904	81%	0.813	S	S	*	*			trans	-155.6	153.9	152	-154.1	-7.6	0	0	0	112.1
759	G	29.3	Very low	29.1	Very low	71 Å²	71	134 Å²	134	73%	0.732	80%	0.803	S	S	*	*			trans	79.3	54.6	149.8	0	0	0	0	0	121.8
760	A	28.3	Very low	29.1	Very low	99 Å²	99	130.7 Å²	130.7	82%	0.818	80%	0.804	S	S	*	*			trans	-7	140.5	158.2	0	0	0	0	0	122.4
761	E	27.9	Very low	28.8	Very low	166 Å²	166	129.3 Å²	129.3	78%	0.776	80%	0.804	S	S	*	*				-160.8	144.2	121.3	-103.1	-134.7	115.6	0	0	116.4
762	R	27.7	Very low	28.5	Very low	220 Å²	220	126.2 Å²	126.2	83%	0.83	80%	0.801	S	S	*	*			trans	6.8	114.8	159.4	-66.1	178.2	163.8	167.2	-8.4	123.2
763	G	25.9	Very low	28.2	Very low	84 Å²	84	122.7 Å²	122.7	87%	0.866	80%	0.803	S	S	*	*				77.6	158.3	127.1	0	0	0	0	0	118.6
764	G	25.9	Very low	27.9	Very low	84 Å²	84	117.8 Å²	117.8	87%	0.866	80%	0.8	S	S	*	*			cis	172.5	136.1	-6.6	0	0	0	0	0	111
765	G	26.3	Very low	27.5	Very low	80 Å²	80	117 Å²	117	83%	0.825	80%	0.802	S	S	*	*			trans	169.7	93.4	-177.6	0	0	0	0	0	114.6
766	A	24.9	Very low	27.4	Very low	99 Å²	99	112.9 Å²	112.9	82%	0.818	80%	0.804	S	S	*	*			trans	-72.7	166.8	153.5	0	0	0	0	0	108.3
767	S	25.2	Very low	27.1	Very low	96 Å²	96	113.8 Å²	113.8	67%	0.671	81%	0.813	S	S	*	*			cis	-177.3	150.5	35.8	61.4	0	0	0	0	112.8
768	V	29	Very low	26.9	Very low	130 Å²	130	107.9 Å²	107.9	79%	0.788	81%	0.805	S	S	*	*				68.9	148.5	125	162.5	0	0	0	0	119.8
769	P	44.4	Very low	26.7	Very low	107 Å²	107	107.8 Å²	107.8	70%	0.695	80%	0.799	S	S	*	*			cis	-114.1	-147.9	-16	24.5	0.5	0	0	0	110.7
770	T	24.7	Very low	26.6	Very low	123 Å²	123	110.4 Å²	110.4	76%	0.755	80%	0.796	S	S	*	*			cis	-158.2	156.6	8.1	-20.4	0	0	0	0	113.5
771	A	24.8	Very low	26.4	Very low	90 Å²	90	112.9 Å²	112.9	74%	0.744	80%	0.795	S	S	*	*			trans	9.2	154.3	142.1	0	0	0	0	0	123.3
772	A	25.3	Very low	26.4	Very low	90 Å²	90	110.2 Å²	110.2	74%	0.744	80%	0.795	S	S	*	*			cis	-177.4	160.4	-16.5	0	0	0	0	0	110.4
773	A	24.9	Very low	26.3	Very low	111 Å²	111	104.3 Å²	104.3	92%	0.917	79%	0.793	S	S	*	*			trans	52.5	149	157.2	0	0	0	0	0	119.9
774	G	23.4	Very low	26.3	Very low	74 Å²	74	106.1 Å²	106.1	76%	0.763	79%	0.792	S	S	*	*			cis	-172.6	-154.3	3.4	0	0	0	0	0	110.9
775	G	23	Very low	26.2	Very low	88 Å²	88	105.7 Å²	105.7	91%	0.907	79%	0.788	S	S	*	*			trans	-71.1	175.6	177	0	0	0	0	0	114.3
776	G	22.9	Very low	26.1	Very low	78 Å²	78	105.3 Å²	105.3	80%	0.804	78%	0.784	S	S	*	*			cis	180	-150.8	7.9	0	0	0	0	0	112.7
777	S	28.1	Very low	26.3	Very low	132 Å²	132	106.6 Å²	106.6	92%	0.923	79%	0.787	S	S	*	*			trans	-51.3	144.5	-171	-172.1	0	0	0	0	116.9
778	G	24.1	Very low	26.6	Very low	74 Å²	74	106.6 Å²	106.6	76%	0.763	79%	0.793	S	S	*	*			trans	-156.9	148.7	169.8	0	0	0	0	0	111.9
779	H	24.8	Very low	26.5	Very low	168 Å²	168	105.1 Å²	105.1	78%	0.778	79%	0.794	S	S	*	*			trans	-146.9	147.1	-163.9	-165.9	48.4	0	0	0	113.1
780	L	26.1	Very low	25.6	Very low	126 Å²	126	104.8 Å²	104.8	66%	0.66	80%	0.801	S	S	*	*			trans	61	113	164.9	-69.3	168.4	0	0	0	121.1
781	N	25.5	Very low	25.6	Very low	150 Å²	150	103.7 Å²	103.7	80%	0.802	80%	0.804	S	S	*	*				149.6	152.7	116	-81.2	-37.8	0	0	0	111
782	S	27.3	Very low	25.7	Very low	110 Å²	110	104.4 Å²	104.4	77%	0.769	81%	0.81	S	S	*	*			cis	156	117.3	-15.9	174	0	0	0	0	105.4
783	A	24.9	Very low	25.7	Very low	96 Å²	96	106.6 Å²	106.6	79%	0.793	81%	0.814	S	S	*	*			trans	-161.9	138.9	164.2	0	0	0	0	0	113
784	S	26.2	Very low	25.7	Very low	122 Å²	122	106.1 Å²	106.1	85%	0.853	81%	0.81	S	S	*	*			trans	-26.5	153.4	170.2	51.4	0	0	0	0	120.5
785	G	24.3	Very low	25.7	Very low	76 Å²	76	109.5 Å²	109.5	78%	0.784	82%	0.817	S	S	*	*			cis	155.4	172.5	-3.2	0	0	0	0	0	114.8
786	G	24.7	Very low	25.9	Very low	71 Å²	71	109.2 Å²	109.2	73%	0.732	81%	0.806	S	S	*	*			trans	90.3	106.5	174.9	0	0	0	0	0	114.2
787	S	29.2	Very low	25.9	Very low	127 Å²	127	112.3 Å²	112.3	89%	0.888	81%	0.809	S	S	*	*				74.7	135.6	51.5	-56.8	0	0	0	0	113.8
788	A	30.3	Very low	25.7	Very low	96 Å²	96	109.9 Å²	109.9	79%	0.793	80%	0.804	S	S	*	*			cis	-163.2	178.7	-15.3	0	0	0	0	0	106.8
789	A	28	Very low	25.7	Very low	98 Å²	98	112.1 Å²	112.1	81%	0.81	81%	0.808	S	S	*	*			cis	-149.7	-164.9	7.2	0	0	0	0	0	107.6
790	A	24.5	Very low	25.6	Very low	101 Å²	101	113.3 Å²	113.3	84%	0.835	81%	0.814	S	S	*	*			cis	-150.1	166.9	3.4	0	0	0	0	0	110.4
791	A	26.4	Very low	26.7	Very low	99 Å²	99	112.6 Å²	112.6	82%	0.818	82%	0.817	S	S	*	*			trans	-133.6	163.3	-179.4	0	0	0	0	0	112.3
792	A	25.8	Very low	27	Very low	105 Å²	105	111.5 Å²	111.5	87%	0.868	82%	0.818	S	S	*	*			trans	-143	82.4	172.9	0	0	0	0	0	111.5
793	T	24.5	Very low	26.8	Very low	136 Å²	136	113.9 Å²	113.9	83%	0.834	82%	0.822	S	S	*	*			trans	-92.2	152	167.1	46.5	0	0	0	0	111.2
794	A	25.1	Very low	26.9	Very low	102 Å²	102	117.7 Å²	117.7	84%	0.843	82%	0.823	S	S	*	*			trans	-148.4	135.4	155.4	0	0	0	0	0	111.5
795	T	24.4	Very low	27.2	Very low	145 Å²	145	117.6 Å²	117.6	89%	0.89	82%	0.82	S	S	*	*			trans	-128.7	161.5	172.9	43.4	0	0	0	0	109.7
796	A	26.5	Very low	27.1	Very low	82 Å²	82	118 Å²	118	68%	0.678	82%	0.816	S	S	*	*			trans	133.7	131.5	138.7	0	0	0	0	0	116.9
797	T	23.4	Very low	27	Very low	143 Å²	143	123.2 Å²	123.2	88%	0.877	82%	0.821	S	S	*	*			trans	50.3	128.4	140.5	57.7	0	0	0	0	122.2
798	G	23.3	Very low	26.7	Very low	80 Å²	80	122.7 Å²	122.7	83%	0.825	81%	0.808	S	S	*	*			trans	171.3	93.3	159.2	0	0	0	0	0	118.9
799	S	24.1	Very low	26.4	Very low	121 Å²	121	124.5 Å²	124.5	85%	0.846	80%	0.8	S	S	*	*			trans	-0.4	126.3	153.7	-49.7	0	0	0	0	123.7
800	Q	23.6	Very low	26.2	Very low	194 Å²	194	125.3 Å²	125.3	91%	0.907	79%	0.791	S	S	*	*			trans	55.3	160.1	135.1	-86.9	-164.5	-15.5	0	0	123.4
801	P	48.6	Very low	26.1	Very low	110 Å²	110	127.5 Å²	127.5	71%	0.714	78%	0.784	S	S	*	*			trans	-97.3	171.1	-164.8	40.9	-38.6	0	0	0	114.6
802	P	32.3	Very low	26	Very low	128 Å²	128	129.1 Å²	129.1	83%	0.831	78%	0.779	S	S	*	*				-150	-174.3	100.6	41.5	-24.3	0	0	0	117.3
803	L	22.4	Very low	25.9	Very low	160 Å²	160	132.7 Å²	132.7	84%	0.838	78%	0.777	S	S	*	*			trans	-62.7	163.8	-169.8	-63.6	150.8	0	0	0	119.7
804	Q	27.9	Very low	25.9	Very low	176 Å²	176	131 Å²	131	82%	0.822	77%	0.771	S	S	*	*			trans	-15.1	147	151.5	-60.6	177.3	-0	0	0	118.4
805	P	31.6	Very low	25.8	Very low	120 Å²	120	135.3 Å²	135.3	78%	0.779	77%	0.774	S	S	*	*				-134.2	161.1	69.6	20.6	2.4	0	0	0	114.2
806	A	21.8	Very low	25.6	Very low	85 Å²	85	136 Å²	136	70%	0.702	77%	0.771	S	S	*	*			cis	99	134.6	33.3	0	0	0	0	0	114.8
807	Q	24.3	Very low	25.5	Very low	179 Å²	179	139.2 Å²	139.2	84%	0.836	77%	0.772	S	S	*	*			trans	69.8	153.3	176.2	-63.5	-178.9	4.8	0	0	115.7
808	N	22.9	Very low	25.6	Very low	117 Å²	117	141.3 Å²	141.3	63%	0.626	77%	0.772	S	S	*	*			cis	-163	163.9	1.5	-115.9	-25.1	0	0	0	107.1
809	Q	23.6	Very low	25.6	Very low	133 Å²	133	145 Å²	145	62%	0.621	77%	0.768	S	S	*	*			cis	-170	166.1	-10.9	-155.8	178.3	94.9	0	0	109.1
810	N	22.3	Very low	25.6	Very low	116 Å²	116	146.4 Å²	146.4	62%	0.62	77%	0.765	S	S	*	*			trans	70	157.4	157.3	-72.3	-20.1	0	0	0	118.8
811	Q	23.6	Very low	25.6	Very low	146 Å²	146	144.5 Å²	144.5	68%	0.682	76%	0.761	S	S	*	*			cis	-155.9	165.8	4.2	-130.9	166.4	44.1	0	0	114.4
812	N	24	Very low	24.5	Very low	133 Å²	133	142.6 Å²	142.6	71%	0.711	76%	0.761	S	S	*	*			trans	53	100.8	150.2	-67.3	-9.5	0	0	0	123.1
813	Q	23.5	Very low	24	Very low	180 Å²	180	145.1 Å²	145.1	84%	0.841	76%	0.762	S	S	*	*				13	134.2	114.3	-141.8	-178.3	59	0	0	120.7
814	S	23.7	Very low	24.1	Very low	100 Å²	100	141.6 Å²	141.6	70%	0.699	75%	0.751	S	S	*	*			trans	107.8	149.6	133.8	82.9	0	0	0	0	122.2
815	Q	23.5	Very low	23.9	Very low	193 Å²	193	143.8 Å²	143.8	90%	0.902	75%	0.751	S	S	*	*			trans	83.6	162.2	160.5	-64.7	-160.8	3.8	0	0	121.2
816	L	21.7	Very low	23.4	Very low	159 Å²	159	148.8 Å²	148.8	83%	0.832	76%	0.755	S	S	*	*			trans	-120.7	148	-155.1	-92.8	153	0	0	0	111.2
817	Q	24.5	Very low	23.5	Very low	151 Å²	151	156.3 Å²	156.3	71%	0.706	77%	0.765	S	S	*	*			trans	64.3	100.9	136.6	-172.5	171	67.9	0	0	120
818	Q	24.5	Very low	23.3	Very low	186 Å²	186	158.8 Å²	158.8	87%	0.869	77%	0.767	S	S	*	*			trans	-151.6	130.3	130.2	-104.2	159.9	45.6	0	0	107.1
819	Q	23.4	Very low	23.1	Very low	157 Å²	157	158.2 Å²	158.2	73%	0.734	77%	0.771	S	S	*	*			cis	76.3	105.2	25	-164.7	-176.5	86.9	0	0	114.8
820	L	23.8	Very low	23	Very low	151 Å²	151	156.8 Å²	156.8	79%	0.791	78%	0.775	S	S	*	*			trans	-154.4	119.7	155.3	-106	174.6	0	0	0	110.2
821	N	24.8	Very low	23.8	Very low	155 Å²	155	156.1 Å²	156.1	83%	0.829	78%	0.777	S	S	*	*			trans	52.1	147.4	160.9	-56.9	-5	0	0	0	119.6
822	G	24.5	Very low	23.7	Very low	69 Å²	69	154.6 Å²	154.6	71%	0.711	78%	0.783	S	S	*	*			cis	128.1	132.7	7.7	0	0	0	0	0	109.7
823	E	22.1	Very low	23.8	Very low	182 Å²	182	157.1 Å²	157.1	85%	0.85	79%	0.79	S	S	*	*			cis	-150.5	164.4	9.1	-63.4	-169.8	73.2	0	0	114.4
824	S	23.4	Very low	24.4	Very low	86 Å²	86	153.4 Å²	153.4	60%	0.601	78%	0.782	S	S	*	*			trans	51.9	121.2	132.4	-71.3	0	0	0	0	124.3
825	R	23.8	Very low	24.2	Very low	221 Å²	221	154.3 Å²	154.3	83%	0.834	78%	0.784	S	S	*	*				89.6	108.9	123.4	-74.5	176.6	170.7	-170.8	-1.4	122.6
826	R	22.1	Very low	24.2	Very low	226 Å²	226	151.7 Å²	151.7	85%	0.853	78%	0.776	S	S	*	*				47.2	114	114.1	-65.2	-176.6	174.7	-164.2	-0.6	120.3
827	R	22.9	Very low	24.3	Very low	242 Å²	242	149.4 Å²	149.4	91%	0.913	77%	0.769	S	S	*	*				174.8	124.6	112.2	-90.4	166.8	-165.1	-145.4	6.2	106.4
828	R	20.3	Very low	24.3	Very low	231 Å²	231	149.6 Å²	149.6	87%	0.872	77%	0.77	S	S	*	*				67.8	107.4	58	-173.3	173.3	-85.8	-139.3	0.8	114.6
829	C	20.2	Very low	25	Very low	105 Å²	105	145.7 Å²	145.7	71%	0.709	76%	0.76	S	S	*	*			trans	84.9	117.3	153.5	-72.7	0	0	0	0	122.3
830	S	20.2	Very low	25	Very low	103 Å²	103	142.5 Å²	142.5	72%	0.72	76%	0.755	S	S	*	*			trans	81.6	177.7	135	-47.8	0	0	0	0	117
831	P	39.4	Very low	25	Very low	102 Å²	102	140 Å²	140	66%	0.662	75%	0.751	S	S	*	*				-137.2	-173.3	-91.7	40.6	-21.4	0	0	0	115.8
832	S	21.2	Very low	24.9	Very low	115 Å²	115	138.8 Å²	138.8	80%	0.804	75%	0.749	S	S	*	*			trans	78.1	154	160.9	21.3	0	0	0	0	120
833	Q	25.8	Very low	24.9	Very low	185 Å²	185	140.5 Å²	140.5	86%	0.864	75%	0.75	S	S	*	*			trans	-54.9	168.2	173.3	-80.8	179.5	-7.7	0	0	113.9
834	P	35.8	Very low	25	Very low	102 Å²	102	136.9 Å²	136.9	66%	0.662	75%	0.745	S	S	*	*			cis	-150.4	-177.5	37.1	39.1	-15.5	0	0	0	119.1
835	T	20.7	Very low	25	Very low	120 Å²	120	138 Å²	138	74%	0.736	75%	0.752	S	S	*	*			trans	54.6	151.1	146.1	47.3	0	0	0	0	120.6
836	D	22.7	Very low	25.1	Very low	138 Å²	138	133.2 Å²	133.2	74%	0.738	75%	0.748	S	S	*	*			cis	-165.5	175.7	17.2	-136.2	-36.3	0	0	0	114.6
837	T	24.4	Very low	25.2	Very low	111 Å²	111	128.2 Å²	128.2	68%	0.681	74%	0.738	S	S	*	*			trans	74.9	101.7	148.4	-56.9	0	0	0	0	122.6
838	E	24	Very low	25.3	Very low	155 Å²	155	124.2 Å²	124.2	72%	0.724	73%	0.73	S	S	*	*				58	166.8	128.3	-76.2	-73.5	101.3	0	0	122.5	S840	E838-S840 PolarHBondContact OE2-N 3.12Å
839	P	38.5	Very low	26.3	Very low	103 Å²	103	118.1 Å²	118.1	67%	0.669	72%	0.72	S	S	*	*			cis	-128.9	144.4	7.5	38	-20.8	0	0	0	119.5
840	S	24.6	Very low	26.4	Very low	91 Å²	91	117.2 Å²	117.2	64%	0.636	72%	0.72	S	S	*	*			trans	51.3	141.2	142.6	78.4	0	0	0	0	121.3	E838	E838-S840 PolarHBondContact OE2-N 3.12Å
841	S	23.5	Very low	26.5	Very low	99 Å²	99	118.8 Å²	118.8	69%	0.692	73%	0.725	S	S	*	*			cis	-162.8	140.1	39.6	49.6	0	0	0	0	115.1
842	T	22.5	Very low	25.7	Very low	128 Å²	128	119.3 Å²	119.3	79%	0.785	73%	0.727	S	S	*	*			trans	38.8	138.4	145.1	53.1	0	0	0	0	122.5
843	S	25.6	Very low	25.8	Very low	106 Å²	106	120.3 Å²	120.3	74%	0.741	73%	0.728	S	S	*	*			cis	-173.9	178.5	0.8	53.9	0	0	0	0	113.4
844	S	24	Very low	25.6	Very low	106 Å²	106	116.5 Å²	116.5	74%	0.741	72%	0.722	S	S	*	*			trans	98	83	155.7	72.8	0	0	0	0	121.5
845	S	23.9	Very low	24.9	Very low	109 Å²	109	116.9 Å²	116.9	76%	0.762	73%	0.727	S	S	*	*				66.6	96.6	115.3	-55.4	0	0	0	0	124.7
846	T	23.9	Very low	25.2	Very low	120 Å²	120	117.6 Å²	117.6	74%	0.736	73%	0.731	S	S	*	*				74.7	120.1	105.2	-56.6	0	0	0	0	123.2
847	N	25.1	Very low	25.8	Very low	122 Å²	122	117.1 Å²	117.1	65%	0.652	74%	0.736	S	S	*	*			trans	81.9	113.8	145.3	-82.6	-16	0	0	0	124
848	Q	24.1	Very low	25.6	Very low	157 Å²	157	114.8 Å²	114.8	73%	0.734	73%	0.734	S	S	*	*				63.1	165.6	116.1	-71.1	-171.6	66.6	0	0	121.3
849	P	42.8	Very low	25.6	Very low	103 Å²	103	112.6 Å²	112.6	67%	0.669	74%	0.735	S	S	*	*			cis	-140.1	-172.7	-43.9	40.1	-23.3	0	0	0	113.7
850	A	21.7	Very low	24.7	Very low	86 Å²	86	114 Å²	114	71%	0.711	74%	0.743	S	S	*	*			trans	85.7	141.7	138	0	0	0	0	0	123.3
851	V	23.5	Very low	25.1	Very low	137 Å²	137	114.7 Å²	114.7	83%	0.83	75%	0.745	S	S	*	*			trans	83	137.1	144.9	165.7	0	0	0	0	121
852	T	22.6	Very low	25	Very low	112 Å²	112	117.1 Å²	117.1	69%	0.687	75%	0.747	S	S	*	*			trans	-66.3	157.9	-179.9	51.7	0	0	0	0	115.6
853	T	21.4	Very low	25	Very low	136 Å²	136	119 Å²	119	83%	0.834	75%	0.747	S	S	*	*				-177.3	171.2	110.9	25	0	0	0	0	113.9
854	S	22.1	Very low	24.9	Very low	105 Å²	105	118.3 Å²	118.3	73%	0.734	75%	0.747	S	S	*	*			trans	-53.8	161.8	168.6	51.2	0	0	0	0	113.7
855	S	22	Very low	24.8	Very low	111 Å²	111	118.3 Å²	118.3	78%	0.776	75%	0.747	S	S	*	*				-179.3	156.9	58.1	49.7	0	0	0	0	115
856	T	25.8	Very low	24.7	Very low	134 Å²	134	117.9 Å²	117.9	82%	0.822	74%	0.744	S	S	*	*			trans	-74.5	168.1	152.9	18.5	0	0	0	0	111
857	P	35.3	Very low	24.7	Very low	129 Å²	129	117.9 Å²	117.9	84%	0.838	75%	0.749	S	S	*	*			cis	-127.1	-164.2	18.2	42.4	-24.2	0	0	0	112.8
858	G	21.7	Very low	24.7	Very low	61 Å²	61	116.6 Å²	116.6	63%	0.629	76%	0.756	S	S	*	*			cis	161.4	176.6	-7.3	0	0	0	0	0	112.1
859	S	22.6	Very low	24.8	Very low	109 Å²	109	116.4 Å²	116.4	76%	0.762	77%	0.765	S	S	*	*			trans	61.4	112.9	171.7	33.7	0	0	0	0	118.1
860	T	20.7	Very low	24	Very low	134 Å²	134	115.2 Å²	115.2	82%	0.822	77%	0.771	S	S	*	*				65.7	149.5	76.3	62.8	0	0	0	0	115.2
861	P	33.2	Very low	24.3	Very low	104 Å²	104	120.1 Å²	120.1	68%	0.675	78%	0.779	S	S	*	*			cis	-141.1	-178.2	16.6	44.9	-27.4	0	0	0	117.5
862	M	21.4	Very low	24.5	Very low	151 Å²	151	123.4 Å²	123.4	74%	0.744	78%	0.783	S	S	*	*			trans	62.4	156	149.9	-73.4	161.2	77.1	0	0	119.4
863	E	22.6	Very low	24.7	Very low	168 Å²	168	124.1 Å²	124.1	79%	0.785	79%	0.786	S	S	*	*			cis	-144.9	-172.4	-2.7	-140	167.6	-178.5	0	0	112
864	A	23.3	Very low	25	Very low	91 Å²	91	122.7 Å²	122.7	75%	0.752	77%	0.774	S	S	*	*			trans	-78.3	174.6	178.1	0	0	0	0	0	112.2
865	S	21.5	Very low	25.9	Very low	105 Å²	105	124.4 Å²	124.4	73%	0.734	77%	0.774	S	S	*	*			cis	-167.8	159.7	28.9	53.5	0	0	0	0	115.4
866	S	22.7	Very low	26.6	Very low	101 Å²	101	128.5 Å²	128.5	71%	0.706	77%	0.772	S	S	*	*			trans	69.6	135.6	143.7	67.2	0	0	0	0	123.4
867	S	22	Very low	27.6	Very low	120 Å²	120	124.8 Å²	124.8	84%	0.839	75%	0.747	S	S	*	*			trans	74.2	152.5	155.5	76	0	0	0	0	120.2
868	A	25.2	Very low	27.8	Very low	95 Å²	95	123.1 Å²	123.1	79%	0.785	74%	0.737	S	S	*	*			cis	-175.8	120.9	-45.8	0	0	0	0	0	109.7
869	V	27.6	Very low	28.8	Very low	153 Å²	153	123.9 Å²	123.9	93%	0.927	72%	0.724	S	S	*	*			trans	-144	138.6	159.8	-177.7	0	0	0	0	107.3
870	G	26.1	Very low	29.9	Very low	78 Å²	78	120 Å²	120	80%	0.804	70%	0.698	S	S	*	*			trans	-78.1	153.2	-173.5	0	0	0	0	0	114.6
871	E	26.6	Very low	31.1	Very low	188 Å²	188	118 Å²	118	88%	0.879	68%	0.679	S	S	*	*			trans	-126	145.1	177.4	-171.4	166.5	-142.9	0	0	109.2
872	K	27.5	Very low	31.7	Very low	207 Å²	207	120.3 Å²	120.3	90%	0.9	68%	0.681	S	S	*	*			trans	-67.9	133.6	-179.2	-78.7	-167.7	171.5	-165.9	0	110.5	D874	K872-D874 PolarHBondContact O-N 2.94Å
873	V	27.9	Very low	33	Very low	126 Å²	126	115.6 Å²	115.6	76%	0.764	66%	0.657	S	S	*	*			trans	-75	109.8	178.7	-177.5	0	0	0	0	110.5	L875	V873-L875 HydrophobicContact CG1-CD2 4.24Å
874	D	28.3	Very low	34.3	Very low	106 Å²	106	110.9 Å²	110.9	57%	0.567	63%	0.634	S	S	*	*			trans	-79.4	118.2	169.9	-172.2	7.4	0	0	0	109.8	K872 R876	K872-D874 PolarHBondContact O-N 2.94Å; D874-R876 PolarHBondContact O-N 2.97Å; D874-R876 WeakPolarHBondContact OD1-CG 3.37Å; D874-R876 IonicContact OD1-NE 2.83Å; D874-R876 PolarHBondContact OD1-NE 2.99Å; D874-R876 VanDerWaalsContact OD1-NE 3.13Å; D874-R876 WeakPolarHBondContact OD2-CD 3.2Å; D874-R876 IonicContact OD2-CZ 3.23Å; D874-R876 IonicContact OD2-NE 2.7Å; D874-R876 PolarHBondContact OD2-NE 3.48Å
875	L	39.8	Very low	35.5	Very low	142 Å²	142	115.3 Å²	115.3	74%	0.743	64%	0.639	S	S	*	*			trans	-80.7	26.4	-173.4	-69.6	173.6	0	0	0	114.2	R740 V873 D877	R740-L875 PolarHBondContact NH1-O 3.39Å; V873-L875 HydrophobicContact CG1-CD2 4.24Å; L875-D877 PolarHBondContact O-N 3.19Å
876	R	37.6	Very low	37.2	Very low	196 Å²	196	114.6 Å²	114.6	74%	0.74	63%	0.627	S	S	*	*			trans	-80.4	109.7	172.2	-67.3	173.6	-148.4	-124.3	-5.7	109.9	D874 P878	D874-R876 PolarHBondContact O-N 2.97Å; D874-R876 WeakPolarHBondContact OD1-CG 3.37Å; D874-R876 IonicContact OD1-NE 2.83Å; D874-R876 PolarHBondContact OD1-NE 2.99Å; D874-R876 VanDerWaalsContact OD1-NE 3.13Å; D874-R876 WeakPolarHBondContact OD2-CD 3.2Å; D874-R876 IonicContact OD2-CZ 3.23Å; D874-R876 IonicContact OD2-NE 2.7Å; D874-R876 PolarHBondContact OD2-NE 3.48Å; R876-P878 WeakPolarHBondContact O-CD 3.45Å
877	D	45.4	Very low	39.5	Very low	56 Å²	56	114 Å²	114	30%	0.299	62%	0.616	S	S	.	*			trans	-75.2	107	168.3	-175.7	-15.7	0	0	0	109.3	L875 E879 A880 R1036	L875-D877 PolarHBondContact O-N 3.19Å; D877-E879 PolarHBondContact O-N 3.24Å; D877-E879 VanDerWaalsContact OD1-CB 3.32Å; D877-E879 WeakPolarHBondContact OD1-CB 3.44Å; D877-E879 PolarHBondContact OD1-N 3.18Å; D877-A880 PolarHBondContact O-N 3.27Å; D877-R1036 IonicContact OD2-NH2 2.75Å; D877-R1036 PolarHBondContact OD2-NH2 2.76Å
878	P	41	Very low	42.2	Very low	94 Å²	94	108.8 Å²	108.8	61%	0.61	58%	0.581	S	S	*	*	H	α-helix	trans	-72.6	-11	-176	32.8	-36.7	0	0	0	112.7	R876 H882	R876-P878 WeakPolarHBondContact O-CD 3.45Å; P878-H882 PolarHBondContact O-N 3.28Å; P878-H882 PolarHBondContact O-ND1 3.25Å
879	E	42.9	Very low	45.2	Very low	77 Å²	77	104.5 Å²	104.5	36%	0.36	55%	0.545	S	S	.	.	H	α-helix	trans	-73.5	-33.6	177.1	-52.3	-144.3	155.3	0	0	111.6	D877 E881 H882 Q883 R1155	D877-E879 PolarHBondContact O-N 3.24Å; D877-E879 VanDerWaalsContact OD1-CB 3.32Å; D877-E879 WeakPolarHBondContact OD1-CB 3.44Å; D877-E879 PolarHBondContact OD1-N 3.18Å; E879-E881 PolarHBondContact O-N 3.5Å; E879-H882 PolarHBondContact O-N 2.88Å; E879-Q883 VanDerWaalsContact O-CG 3.31Å; E879-Q883 WeakPolarHBondContact O-CG 3.05Å; E879-Q883 PolarHBondContact O-N 3.04Å; E879-R1155 IonicContact OE1-CZ 2.79Å; E879-R1155 IonicContact OE1-NH1 3.49Å; E879-R1155 PolarHBondContact OE1-NH1 3.35Å; E879-R1155 IonicContact OE1-NH2 2.89Å; E879-R1155 IonicContact OE2-CZ 2.75Å; E879-R1155 IonicContact OE2-NH1 3.82Å; E879-R1155 PolarHBondContact OE2-NH1 3.27Å; E879-R1155 IonicContact OE2-NH2 2.75Å; E879-R1155 PolarHBondContact OE2-NH2 2.96Å
880	A	45.1	Very low	48.3	Very low	27 Å²	27	97.2 Å²	97.2	22%	0.223	50%	0.501	C	S	.	.	H	α-helix	trans	-66.9	-32.5	-178.8	0	0	0	0	0	113.4	D877	D877-A880 PolarHBondContact O-N 3.27Å
881	E	45.8	Very low	51.5	Low	92 Å²	92	94.2 Å²	94.2	43%	0.43	47%	0.466	S	S	.	.	H	α-helix	trans	-75.3	-37.4	172.3	-68.7	-105.8	99.5	0	0	111.4	R739 E879 Q883 K884	R739-E881 IonicContact CZ-OE1 2.94Å; R739-E881 IonicContact CZ-OE2 2.71Å; R739-E881 IonicContact NE-OE1 3.82Å; R739-E881 PolarHBondContact NE-OE1 3.43Å; R739-E881 IonicContact NE-OE2 2.66Å; R739-E881 IonicContact NH2-OE1 3.07Å; R739-E881 PolarHBondContact NH2-OE1 3.04Å; R739-E881 VanDerWaalsContact NH2-OE1 3.08Å; R739-E881 IonicContact NH2-OE2 3.13Å; R739-E881 PolarHBondContact NH2-OE2 3.09Å; E879-E881 PolarHBondContact O-N 3.5Å; E881-Q883 VanDerWaalsContact C-N 3.32Å; E881-Q883 PolarHBondContact O-N 3.49Å; E881-K884 PolarHBondContact O-N 3.11Å; E881-K884 IonicContact OE1-NZ 2.61Å; E881-K884 PolarHBondContact OE1-NZ 3.22Å
882	H	45.8	Very low	54.7	Low	153 Å²	153	85.4 Å²	85.4	71%	0.708	43%	0.425	S	S	*	.	H	α-helix	trans	-68.3	-25.7	177.9	-94.5	78.5	0	0	0	114.1	P878 E879 K884	P878-H882 PolarHBondContact O-N 3.28Å; P878-H882 PolarHBondContact O-ND1 3.25Å; E879-H882 PolarHBondContact O-N 2.88Å; H882-K884 PolarHBondContact O-N 3.28Å
883	Q	48.8	Very low	58	Low	52 Å²	52	75.6 Å²	75.6	24%	0.243	38%	0.382	C	S	.	.	G	3₁₀ helix	trans	-70.7	-17.9	179.1	-74.9	171.4	30.1	0	0	113.5	E879 E881 E885 L886	E879-Q883 VanDerWaalsContact O-CG 3.31Å; E879-Q883 WeakPolarHBondContact O-CG 3.05Å; E879-Q883 PolarHBondContact O-N 3.04Å; E881-Q883 VanDerWaalsContact C-N 3.32Å; E881-Q883 PolarHBondContact O-N 3.49Å; Q883-E885 VanDerWaalsContact C-N 3.27Å; Q883-E885 PolarHBondContact O-N 3.24Å; Q883-L886 PolarHBondContact O-N 3.37Å; Q883-L886 VanDerWaalsContact O-N 3.17Å
884	K	48.9	Very low	61.2	Low	70 Å²	70	69.7 Å²	69.7	30%	0.304	35%	0.346	S	S	.	.	G	3₁₀ helix	trans	-68.2	-19.1	-175.6	-68	174.6	-175.5	168.9	0	114.8	F737 E881 H882	F737-K884 WeakPolarHBondContact O-CE 3.41Å; E881-K884 PolarHBondContact O-N 3.11Å; E881-K884 IonicContact OE1-NZ 2.61Å; E881-K884 PolarHBondContact OE1-NZ 3.22Å; H882-K884 PolarHBondContact O-N 3.28Å
885	E	49.5	Very low	64.5	Low	183 Å²	183	64.6 Å²	64.6	86%	0.855	32%	0.319	S	S	*	.	G	3₁₀ helix	trans	-91.5	-0.8	176.8	-61.4	-166.6	152.3	0	0	113.5	Q883	Q883-E885 VanDerWaalsContact C-N 3.27Å; Q883-E885 PolarHBondContact O-N 3.24Å
886	L	56.2	Low	67	Low	91 Å²	91	57.9 Å²	57.9	48%	0.476	28%	0.284	S	S	.	.			trans	-105.7	106.4	-172.8	-62.5	178.7	0	0	0	111.9	Q883 V889	Q883-L886 PolarHBondContact O-N 3.37Å; Q883-L886 VanDerWaalsContact O-N 3.17Å; L886-V889 HydrophobicContact CB-CG2 3.59Å; L886-V889 HydrophobicContact CD1-CG2 4.42Å
887	D	70.8	Confident	69.8	Low	89 Å²	89	49.8 Å²	49.8	48%	0.476	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.6	132.8	170.8	-158.4	22.1	0	0	0	110.5	N1079 K1080	D887-N1079 VanDerWaalsContact OD1-CA 3.31Å; D887-N1079 WeakPolarHBondContact OD1-CA 3.43Å; D887-K1080 PolarHBondContact OD1-N 3.37Å
888	G	79.6	Confident	72.2	Confident	10 Å²	10	48.5 Å²	48.5	10%	0.103	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	80.1	41.8	179.4	0	0	0	0	0	115.1	L1045 Q1078	G888-L1045 PolarHBondContact O-N 2.71Å; G888-Q1078 PolarHBondContact N-O 3.03Å
889	V	88.4	Confident	74.8	Confident	5 Å²	5	44.1 Å²	44.1	3%	0.03	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	143.8	168.8	179.4	0	0	0	0	109.6	F737 L886 G1043 I1077 Q1078	F737-V889 HydrophobicContact CE1-CB 4.4Å; F737-V889 HydrophobicContact CE1-CG1 3.64Å; F737-V889 HydrophobicContact CZ-CG1 4.01Å; L886-V889 HydrophobicContact CB-CG2 3.59Å; L886-V889 HydrophobicContact CD1-CG2 4.42Å; V889-G1043 CarbonylContact C-O 3.18Å; V889-G1043 WeakPolarHBondContact CA-O 3.43Å; V889-I1077 CarbonylContact O-C 3.51Å; V889-I1077 WeakPolarHBondContact O-CA 3.45Å; V889-Q1078 PolarHBondContact O-N 2.8Å
890	Y	91.7	Very high	77.4	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	146.6	176	68.9	-78.6	0	0	0	113	L892 G1042 G1043 L1045 Q1048 R1051 E1055 M1075 F1076	Y890-L892 HydrophobicContact CD2-CB 4.33Å; Y890-L892 HydrophobicContact CE2-CB 4.23Å; Y890-G1042 CarbonylContact O-C 3.11Å; Y890-G1042 VanDerWaalsContact O-C 3.27Å; Y890-G1042 VanDerWaalsContact O-CA 3.3Å; Y890-G1042 WeakPolarHBondContact O-CA 3.43Å; Y890-G1043 WeakPolarHBondContact CD1-O 3.27Å; Y890-G1043 WeakPolarHBondContact CE1-O 3.42Å; Y890-G1043 PolarHBondContact N-O 2.72Å; Y890-G1043 PolarHBondContact O-N 2.89Å; Y890-L1045 HydrophobicContact CD1-CB 4.47Å; Y890-L1045 HydrophobicContact CD1-CD2 3.69Å; Y890-L1045 HydrophobicContact CD1-CG 3.81Å; Y890-L1045 HydrophobicContact CE1-CD2 4.06Å; Y890-L1045 HydrophobicContact CE1-CG 4.34Å; Y890-L1045 HydrophobicContact CG-CD2 4.38Å; Y890-Q1048 HydrophobicContact CE1-CB 4.38Å; Y890-Q1048 WeakPolarHBondContact OH-CB 3.42Å; Y890-Q1048 WeakPolarHBondContact OH-CG 3.45Å; Y890-R1051 VanDerWaalsContact CZ-NH2 3.26Å; Y890-R1051 PolarHBondContact OH-NH2 3.04Å; Y890-E1055 PolarHBondContact OH-OE1 2.91Å; Y890-M1075 HydrophobicContact CD2-CE 3.42Å; Y890-M1075 VanDerWaalsContact CD2-CE 3.42Å; Y890-M1075 HydrophobicContact CE2-CE 3.68Å; Y890-M1075 HydrophobicContact CG-CE 3.96Å; Y890-F1076 CarbonylContact C-O 3.51Å; Y890-F1076 WeakPolarHBondContact CA-O 3.46Å
891	N	93.6	Very high	79.9	Confident	14 Å²	14	40.1 Å²	40.1	8%	0.075	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	140.5	162	-65.9	-42	0	0	0	108.2	D734 L735 F737 M1075 F1076	D734-N891 PolarHBondContact O-ND2 3.34Å; L735-N891 HydrophobicContact CD2-CB 4.45Å; L735-N891 PolarHBondContact O-ND2 3.21Å; F737-N891 WeakPolarHBondContact CE1-ND2 3.47Å; F737-N891 HydrophobicContact CZ-CB 4.34Å; F737-N891 VanDerWaalsContact CZ-ND2 3.25Å; F737-N891 WeakPolarHBondContact CZ-ND2 3.49Å; N891-M1075 CarbonylContact O-C 3.46Å; N891-M1075 VanDerWaalsContact O-CA 3.29Å; N891-M1075 WeakPolarHBondContact O-CA 3.42Å; N891-F1076 HydrophobicContact CB-CB 4.4Å; N891-F1076 PolarHBondContact N-O 2.91Å; N891-F1076 PolarHBondContact O-N 3.38Å
892	L	94.6	Very high	82.3	Confident	4 Å²	4	35.7 Å²	35.7	2%	0.021	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	124.7	175.8	171.6	66.1	0	0	0	108.5	Y890 F894 Y1032 A1041 E1055 Y1058 K1073 M1075	Y890-L892 HydrophobicContact CD2-CB 4.33Å; Y890-L892 HydrophobicContact CE2-CB 4.23Å; L892-F894 HydrophobicContact CD1-CE2 4.26Å; L892-F894 HydrophobicContact CD1-CZ 4.09Å; L892-F894 HydrophobicContact CD2-CE2 3.92Å; L892-F894 HydrophobicContact CD2-CZ 4.15Å; L892-F894 HydrophobicContact CG-CE2 4.05Å; L892-F894 HydrophobicContact CG-CZ 4.34Å; L892-Y1032 WeakPolarHBondContact O-CD2 3.37Å; L892-Y1032 VanDerWaalsContact O-CE2 3.3Å; L892-Y1032 WeakPolarHBondContact O-CE2 3.49Å; L892-A1041 PolarHBondContact N-O 2.86Å; L892-E1055 HydrophobicContact CD2-CB 3.95Å; L892-E1055 HydrophobicContact CD2-CG 3.81Å; L892-Y1058 HydrophobicContact CD2-CD1 4.38Å; L892-Y1058 HydrophobicContact CG-CE1 4.37Å; L892-K1073 HydrophobicContact CD1-CG 4.13Å; L892-M1075 HydrophobicContact CD1-CG 3.8Å
893	F	96.5	Very high	84.8	Confident	0 Å²	0	28.4 Å²	28.4	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	119.8	-178.3	-174.5	-153.4	0	0	0	108.9	F731 L735 V895 W899 V1028 V1029 Y1032 V1074	F731-F893 HydrophobicContact CE1-CD1 4.47Å; F731-F893 AromaticContact CE1-CE1 3.66Å; F731-F893 HydrophobicContact CE1-CE1 3.66Å; F731-F893 AromaticContact CE1-CZ 3.79Å; F731-F893 HydrophobicContact CE1-CZ 3.79Å; F731-F893 AromaticContact CZ-CE1 3.86Å; F731-F893 HydrophobicContact CZ-CE1 3.86Å; F731-F893 HydrophobicContact CZ-CE2 4.15Å; F731-F893 AromaticContact CZ-CZ 3.65Å; F731-F893 HydrophobicContact CZ-CZ 3.65Å; L735-F893 HydrophobicContact CD1-CD1 4.07Å; L735-F893 HydrophobicContact CD1-CE1 4.29Å; L735-F893 HydrophobicContact CD2-CB 4.3Å; L735-F893 HydrophobicContact CD2-CD1 4.17Å; L735-F893 HydrophobicContact CD2-CG 4.44Å; F893-V895 HydrophobicContact CB-CG1 4.38Å; F893-V895 HydrophobicContact CD1-CG1 3.32Å; F893-V895 HydrophobicContact CD2-CG1 3.84Å; F893-V895 HydrophobicContact CE1-CG1 3.36Å; F893-V895 HydrophobicContact CE2-CG1 3.9Å; F893-V895 HydrophobicContact CG-CG1 3.56Å; F893-V895 HydrophobicContact CZ-CG1 3.66Å; F893-W899 HydrophobicContact CE1-CD2 4.13Å; F893-W899 HydrophobicContact CE1-CE3 4.05Å; F893-W899 HydrophobicContact CE1-CZ3 4.4Å; F893-W899 HydrophobicContact CZ-CD2 4.18Å; F893-V1028 HydrophobicContact CE2-CG1 3.66Å; F893-V1028 HydrophobicContact CZ-CG1 4.03Å; F893-V1029 HydrophobicContact CZ-CG2 4.36Å; F893-Y1032 HydrophobicContact CB-CD2 4.07Å; F893-Y1032 HydrophobicContact CB-CE2 4.23Å; F893-Y1032 AromaticContact CD2-CD2 3.76Å; F893-Y1032 HydrophobicContact CD2-CD2 3.76Å; F893-Y1032 AromaticContact CD2-CG 3.73Å; F893-Y1032 HydrophobicContact CD2-CG 3.73Å; F893-Y1032 HydrophobicContact CE2-CG 4.09Å; F893-Y1032 HydrophobicContact CG-CD2 4.16Å; F893-Y1032 HydrophobicContact CG-CG 4.42Å; F893-V1074 PolarHBondContact N-O 2.82Å; F893-V1074 WeakPolarHBondContact O-CA 3.22Å; F893-V1074 VanDerWaalsContact O-CB 3.31Å; F893-V1074 WeakPolarHBondContact O-CB 3.22Å; F893-V1074 WeakPolarHBondContact O-CG2 3.31Å; F893-V1074 PolarHBondContact O-N 3.49Å
894	F	96.1	Very high	87.1	Confident	2 Å²	2	26.6 Å²	26.6	1%	0.009	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	135.5	169.5	-64.3	-78.3	0	0	0	109.2	L892 V1028 Y1058 Q1059 A1062 M1066 F1072 K1073 L1090	L892-F894 HydrophobicContact CD1-CE2 4.26Å; L892-F894 HydrophobicContact CD1-CZ 4.09Å; L892-F894 HydrophobicContact CD2-CE2 3.92Å; L892-F894 HydrophobicContact CD2-CZ 4.15Å; L892-F894 HydrophobicContact CG-CE2 4.05Å; L892-F894 HydrophobicContact CG-CZ 4.34Å; F894-V1028 VanDerWaalsContact O-CG1 3.25Å; F894-V1028 WeakPolarHBondContact O-CG1 3.41Å; F894-Y1058 AromaticContact CD2-CD1 3.72Å; F894-Y1058 HydrophobicContact CD2-CD1 3.72Å; F894-Y1058 HydrophobicContact CD2-CD2 4.04Å; F894-Y1058 AromaticContact CD2-CE1 3.57Å; F894-Y1058 HydrophobicContact CD2-CE1 3.57Å; F894-Y1058 AromaticContact CD2-CE2 3.88Å; F894-Y1058 HydrophobicContact CD2-CE2 3.88Å; F894-Y1058 AromaticContact CD2-CG 3.93Å; F894-Y1058 HydrophobicContact CD2-CG 3.93Å; F894-Y1058 AromaticContact CD2-CZ 3.63Å; F894-Y1058 AromaticContact CE2-CD1 3.67Å; F894-Y1058 HydrophobicContact CE2-CD1 3.67Å; F894-Y1058 AromaticContact CE2-CE1 3.91Å; F894-Y1058 HydrophobicContact CE2-CE1 3.91Å; F894-Y1058 AromaticContact CE2-CG 3.98Å; F894-Y1058 HydrophobicContact CE2-CG 3.98Å; F894-Y1058 PolarHBondContact N-OH 3.14Å; F894-Q1059 HydrophobicContact CD1-CG 4.32Å; F894-Q1059 HydrophobicContact CE1-CB 3.89Å; F894-Q1059 HydrophobicContact CE1-CG 3.66Å; F894-Q1059 HydrophobicContact CE2-CB 3.81Å; F894-Q1059 HydrophobicContact CE2-CG 4.47Å; F894-Q1059 HydrophobicContact CZ-CB 3.45Å; F894-Q1059 VanDerWaalsContact CZ-CB 3.45Å; F894-Q1059 HydrophobicContact CZ-CG 3.77Å; F894-A1062 HydrophobicContact CB-CB 3.44Å; F894-A1062 VanDerWaalsContact CB-CB 3.44Å; F894-A1062 HydrophobicContact CD2-CB 4.23Å; F894-A1062 HydrophobicContact CG-CB 3.98Å; F894-M1066 HydrophobicContact CB-CE 4.39Å; F894-F1072 CarbonylContact C-O 3.56Å; F894-F1072 WeakPolarHBondContact CA-O 3.48Å; F894-K1073 HydrophobicContact CD1-CB 3.87Å; F894-K1073 HydrophobicContact CD1-CG 4.29Å; F894-K1073 HydrophobicContact CE1-CB 3.69Å; F894-K1073 HydrophobicContact CE1-CD 4.02Å; F894-K1073 HydrophobicContact CE1-CG 3.7Å; F894-K1073 HydrophobicContact CZ-CG 4.4Å; F894-L1090 HydrophobicContact CD1-CD1 4.01Å; F894-L1090 HydrophobicContact CE1-CD1 4Å
895	V	95.9	Very high	89.4	Confident	0 Å²	0	23.5 Å²	23.5	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	156.9	-167.4	-51.2	0	0	0	0	113.2	F893 W899 F1072 V1074	F893-V895 HydrophobicContact CB-CG1 4.38Å; F893-V895 HydrophobicContact CD1-CG1 3.32Å; F893-V895 HydrophobicContact CD2-CG1 3.84Å; F893-V895 HydrophobicContact CE1-CG1 3.36Å; F893-V895 HydrophobicContact CE2-CG1 3.9Å; F893-V895 HydrophobicContact CG-CG1 3.56Å; F893-V895 HydrophobicContact CZ-CG1 3.66Å; V895-W899 HydrophobicContact CB-CB 3.58Å; V895-W899 HydrophobicContact CB-CG 4.28Å; V895-W899 HydrophobicContact CG1-CB 4.12Å; V895-W899 HydrophobicContact CG1-CG 4.49Å; V895-W899 HydrophobicContact CG2-CB 4.05Å; V895-F1072 HydrophobicContact CG2-CB 3.84Å; V895-F1072 PolarHBondContact N-O 2.84Å; V895-F1072 PolarHBondContact O-N 2.84Å; V895-V1074 HydrophobicContact CB-CG2 4.36Å; V895-V1074 HydrophobicContact CG1-CG2 3.89Å; V895-V1074 HydrophobicContact CG2-CG2 3.53Å
896	N	94.1	Very high	91.7	Very high	0 Å²	0	14.8 Å²	14.8	0%	0	8%	0.079	C	C	.	.			trans	-91.7	-179.1	175.7	76.3	-21.4	0	0	0	113	N898 W899 Y900 C1025 M1066 E1069	N896-N898 VanDerWaalsContact C-N 3.3Å; N896-N898 PolarHBondContact O-N 3.09Å; N896-N898 PolarHBondContact OD1-N 2.96Å; N896-W899 PolarHBondContact O-N 3.14Å; N896-W899 PolarHBondContact OD1-N 3.38Å; N896-Y900 WeakPolarHBondContact O-CB 3.32Å; N896-Y900 PolarHBondContact O-N 3.33Å; N896-C1025 PolarHBondContact ND2-SG 3.42Å; N896-C1025 PolarHBondContact OD1-SG 3.47Å; N896-M1066 HydrophobicContact CB-CG 4.11Å; N896-M1066 HydrophobicContact CB-SD 3.56Å; N896-M1066 VanDerWaalsContact CB-SD 3.56Å; N896-M1066 PolarHBondContact N-SD 3.38Å; N896-E1069 VanDerWaalsContact CB-OE2 3.25Å; N896-E1069 WeakPolarHBondContact CB-OE2 3Å; N896-E1069 PolarHBondContact ND2-OE2 3.33Å
897	N	94.9	Very high	93.6	Very high	26 Å²	26	11.7 Å²	11.7	14%	0.139	6%	0.062	C	C	.	.	H	α-helix	trans	-46.2	-48.4	173.3	-78.2	-47.6	0	0	0	113.3	L651 W899 Y900 F901 F1072	L651-N897 WeakPolarHBondContact CD1-OD1 3.42Å; N897-W899 PolarHBondContact O-N 3.02Å; N897-Y900 WeakPolarHBondContact O-CB 3.42Å; N897-Y900 PolarHBondContact O-N 3.09Å; N897-F901 HydrophobicContact CB-CE2 3.91Å; N897-F901 HydrophobicContact CB-CZ 4.14Å; N897-F901 WeakPolarHBondContact O-CD2 3.35Å; N897-F901 WeakPolarHBondContact O-CE2 3.32Å; N897-F901 WeakPolarHBondContact O-CG 3.44Å; N897-F901 PolarHBondContact O-N 2.9Å; N897-F1072 WeakPolarHBondContact OD1-CE2 3.42Å
898	N	95.7	Very high	94.8	Very high	30 Å²	30	8.3 Å²	8.3	16%	0.16	5%	0.045	C	C	.	.	H	α-helix	trans	-63.7	-43.2	-175.9	-79.2	-36.4	0	0	0	112.4	N896 F902 Q1015 L1019 D1022 C1025	N896-N898 VanDerWaalsContact C-N 3.3Å; N896-N898 PolarHBondContact O-N 3.09Å; N896-N898 PolarHBondContact OD1-N 2.96Å; N898-F902 PolarHBondContact O-N 2.98Å; N898-Q1015 VanDerWaalsContact CA-NE2 3.33Å; N898-Q1015 VanDerWaalsContact O-CG 3.25Å; N898-Q1015 WeakPolarHBondContact O-CG 3.48Å; N898-Q1015 PolarHBondContact O-NE2 3.17Å; N898-Q1015 PolarHBondContact OD1-NE2 3.43Å; N898-L1019 HydrophobicContact CB-CD2 3.96Å; N898-D1022 PolarHBondContact ND2-OD2 3.35Å; N898-C1025 WeakPolarHBondContact CB-SG 3.49Å
899	W	96.1	Very high	95.7	Very high	1 Å²	1	7.8 Å²	7.8	0%	0.004	4%	0.04	C	C	.	.	H	α-helix	trans	-69.3	-38.9	173.5	-88.5	107.4	0	0	0	112.8	I727 F731 F893 V895 N896 N897 F901 F902 L903 L1019 C1025 V1029	I727-W899 HydrophobicContact CG2-CH2 3.94Å; F731-W899 AromaticContact CD1-CH2 3.64Å; F731-W899 HydrophobicContact CD1-CH2 3.64Å; F731-W899 HydrophobicContact CD1-CZ2 4.44Å; F731-W899 HydrophobicContact CD1-CZ3 4.13Å; F731-W899 AromaticContact CE1-CH2 3.6Å; F731-W899 HydrophobicContact CE1-CH2 3.6Å; F731-W899 HydrophobicContact CE1-CZ2 4.13Å; F731-W899 AromaticContact CE1-CZ3 3.96Å; F731-W899 HydrophobicContact CE1-CZ3 3.96Å; F893-W899 HydrophobicContact CE1-CD2 4.13Å; F893-W899 HydrophobicContact CE1-CE3 4.05Å; F893-W899 HydrophobicContact CE1-CZ3 4.4Å; F893-W899 HydrophobicContact CZ-CD2 4.18Å; V895-W899 HydrophobicContact CB-CB 3.58Å; V895-W899 HydrophobicContact CB-CG 4.28Å; V895-W899 HydrophobicContact CG1-CB 4.12Å; V895-W899 HydrophobicContact CG1-CG 4.49Å; V895-W899 HydrophobicContact CG2-CB 4.05Å; N896-W899 PolarHBondContact O-N 3.14Å; N896-W899 PolarHBondContact OD1-N 3.38Å; N897-W899 PolarHBondContact O-N 3.02Å; W899-F901 PolarHBondContact O-N 2.79Å; W899-F902 AromaticContact CE3-CD1 3.94Å; W899-F902 HydrophobicContact CE3-CD1 3.94Å; W899-F902 AromaticContact CZ3-CD1 3.87Å; W899-F902 HydrophobicContact CZ3-CD1 3.87Å; W899-F902 HydrophobicContact CZ3-CE1 4.09Å; W899-F902 PolarHBondContact O-N 2.96Å; W899-L903 WeakPolarHBondContact O-CG 3.49Å; W899-L903 PolarHBondContact O-N 3.49Å; W899-L1019 HydrophobicContact CB-CD2 4.25Å; W899-L1019 HydrophobicContact CD2-CD1 3.92Å; W899-L1019 HydrophobicContact CD2-CD2 3.68Å; W899-L1019 HydrophobicContact CD2-CG 4.45Å; W899-L1019 HydrophobicContact CE3-CD1 3.81Å; W899-L1019 HydrophobicContact CE3-CD2 4.4Å; W899-L1019 HydrophobicContact CG-CD2 3.58Å; W899-L1019 HydrophobicContact CH2-CD1 3.99Å; W899-L1019 HydrophobicContact CZ2-CD1 4.08Å; W899-L1019 HydrophobicContact CZ2-CD2 4.35Å; W899-L1019 HydrophobicContact CZ3-CD1 3.86Å; W899-C1025 PolarHBondContact NE1-O 3.31Å; W899-C1025 VanDerWaalsContact NE1-O 3.13Å; W899-V1029 HydrophobicContact CH2-CG2 4.29Å; W899-V1029 HydrophobicContact CZ2-CG2 3.38Å
900	Y	96.8	Very high	96.1	Very high	0 Å²	0	7.8 Å²	7.8	0%	0	4%	0.04	C	C	.	.	H	α-helix	trans	-57.4	-48.7	174.3	171.4	-92.9	0	0	0	111.6	L650 I654 N896 N897 F902 L903 R904 F1072 L1087	L650-Y900 HydrophobicContact CB-CE1 4.16Å; L650-Y900 PolarHBondContact O-OH 3.11Å; I654-Y900 HydrophobicContact CB-CE2 4.47Å; I654-Y900 HydrophobicContact CD1-CE2 3.79Å; I654-Y900 HydrophobicContact CG2-CE1 4.14Å; I654-Y900 HydrophobicContact CG2-CE2 4.07Å; I654-Y900 WeakPolarHBondContact CG2-OH 3.33Å; N896-Y900 WeakPolarHBondContact O-CB 3.32Å; N896-Y900 PolarHBondContact O-N 3.33Å; N897-Y900 WeakPolarHBondContact O-CB 3.42Å; N897-Y900 PolarHBondContact O-N 3.09Å; Y900-F902 VanDerWaalsContact C-N 3.35Å; Y900-F902 PolarHBondContact O-N 3.04Å; Y900-L903 PolarHBondContact O-N 2.75Å; Y900-R904 HydrophobicContact CD1-CG 4.27Å; Y900-R904 HydrophobicContact CD2-CG 4.37Å; Y900-R904 HydrophobicContact CE1-CG 3.71Å; Y900-R904 HydrophobicContact CE2-CG 3.83Å; Y900-R904 VanDerWaalsContact CZ-CG 3.44Å; Y900-R904 WeakPolarHBondContact O-CG 3.38Å; Y900-R904 PolarHBondContact O-N 3.1Å; Y900-R904 WeakPolarHBondContact OH-CD 3.39Å; Y900-F1072 HydrophobicContact CD1-CE1 4.45Å; Y900-F1072 HydrophobicContact CD1-CZ 4.25Å; Y900-F1072 AromaticContact CD2-CD1 3.7Å; Y900-F1072 HydrophobicContact CD2-CD1 3.7Å; Y900-F1072 HydrophobicContact CD2-CD2 4.42Å; Y900-F1072 AromaticContact CD2-CE1 3.86Å; Y900-F1072 HydrophobicContact CD2-CE1 3.86Å; Y900-F1072 AromaticContact CD2-CG 3.99Å; Y900-F1072 HydrophobicContact CD2-CG 3.99Å; Y900-F1072 HydrophobicContact CD2-CZ 4.3Å; Y900-F1072 HydrophobicContact CE2-CD1 4.19Å; Y900-F1072 HydrophobicContact CE2-CE1 4.17Å; Y900-F1072 HydrophobicContact CG-CD1 4.17Å; Y900-F1072 HydrophobicContact CG-CD2 4.22Å; Y900-F1072 HydrophobicContact CG-CE1 4.04Å; Y900-F1072 HydrophobicContact CG-CE2 4.1Å; Y900-F1072 HydrophobicContact CG-CG 4.26Å; Y900-F1072 HydrophobicContact CG-CZ 4Å; Y900-L1087 HydrophobicContact CD2-CD2 4.05Å; Y900-L1087 HydrophobicContact CE2-CD1 4.24Å; Y900-L1087 HydrophobicContact CE2-CD2 4.3Å
901	F	97.4	Very high	96.3	Very high	20 Å²	20	10.1 Å²	10.1	9%	0.088	6%	0.056	C	C	.	.	H	α-helix	trans	-61	-42.6	177.3	-58.3	-39.3	0	0	0	111.9	S647 L650 L651 N897 W899 L903 R904 L905 Q1015	S647-F901 WeakPolarHBondContact O-CE1 3.42Å; L650-F901 HydrophobicContact CB-CD1 4.28Å; L650-F901 HydrophobicContact CD1-CD1 4.43Å; L651-F901 HydrophobicContact CB-CE1 4.21Å; L651-F901 HydrophobicContact CD1-CE1 4.14Å; L651-F901 HydrophobicContact CD1-CZ 4.08Å; N897-F901 HydrophobicContact CB-CE2 3.91Å; N897-F901 HydrophobicContact CB-CZ 4.14Å; N897-F901 WeakPolarHBondContact O-CD2 3.35Å; N897-F901 WeakPolarHBondContact O-CE2 3.32Å; N897-F901 WeakPolarHBondContact O-CG 3.44Å; N897-F901 PolarHBondContact O-N 2.9Å; W899-F901 PolarHBondContact O-N 2.79Å; F901-L903 PolarHBondContact O-N 2.98Å; F901-R904 PolarHBondContact O-N 2.78Å; F901-L905 WeakPolarHBondContact O-CB 3.32Å; F901-L905 WeakPolarHBondContact O-CD1 3.24Å; F901-L905 WeakPolarHBondContact O-CG 3.27Å; F901-L905 PolarHBondContact O-N 3.32Å; F901-Q1015 HydrophobicContact CB-CG 4.01Å
902	F	97.8	Very high	96.4	Very high	0 Å²	0	10.6 Å²	10.6	0%	0	6%	0.057	C	C	.	.	H	α-helix	trans	-59.7	-48	176.5	167.9	-104.5	0	0	0	111.3	I728 V732 N898 W899 Y900 L905 H906 I1012 Q1015 L1016 L1019	I728-F902 HydrophobicContact CD1-CE2 3.95Å; I728-F902 HydrophobicContact CD1-CZ 3.7Å; V732-F902 HydrophobicContact CG2-CE1 3.84Å; V732-F902 HydrophobicContact CG2-CZ 4.01Å; N898-F902 PolarHBondContact O-N 2.98Å; W899-F902 AromaticContact CE3-CD1 3.94Å; W899-F902 HydrophobicContact CE3-CD1 3.94Å; W899-F902 AromaticContact CZ3-CD1 3.87Å; W899-F902 HydrophobicContact CZ3-CD1 3.87Å; W899-F902 HydrophobicContact CZ3-CE1 4.09Å; W899-F902 PolarHBondContact O-N 2.96Å; Y900-F902 VanDerWaalsContact C-N 3.35Å; Y900-F902 PolarHBondContact O-N 3.04Å; F902-L905 PolarHBondContact O-N 3.02Å; F902-H906 HydrophobicContact CE2-CB 4.46Å; F902-H906 HydrophobicContact CZ-CB 4.35Å; F902-H906 VanDerWaalsContact O-CB 3.25Å; F902-H906 WeakPolarHBondContact O-CB 3.3Å; F902-H906 PolarHBondContact O-N 2.96Å; F902-I1012 HydrophobicContact CD2-CG2 4.19Å; F902-I1012 HydrophobicContact CE2-CG2 3.95Å; F902-Q1015 HydrophobicContact CB-CB 4.47Å; F902-Q1015 HydrophobicContact CB-CG 3.85Å; F902-L1016 HydrophobicContact CD2-CD2 3.95Å; F902-L1016 HydrophobicContact CD2-CG 3.93Å; F902-L1016 HydrophobicContact CE2-CD1 4.08Å; F902-L1016 HydrophobicContact CE2-CD2 3.7Å; F902-L1016 HydrophobicContact CE2-CG 3.88Å; F902-L1016 HydrophobicContact CZ-CD2 4.25Å; F902-L1019 HydrophobicContact CB-CD1 3.76Å; F902-L1019 HydrophobicContact CD1-CD1 4.04Å; F902-L1019 HydrophobicContact CD2-CD1 4.37Å; F902-L1019 HydrophobicContact CG-CD1 3.78Å
903	L	97.3	Very high	96.5	Very high	0 Å²	0	10.4 Å²	10.4	0%	0	6%	0.056	C	C	.	.	H	α-helix	trans	-65.6	-39.9	-179	-69.3	173.2	0	0	0	112.6	W899 Y900 F901 Q907 V1074 F1076 M1085	W899-L903 WeakPolarHBondContact O-CG 3.49Å; W899-L903 PolarHBondContact O-N 3.49Å; Y900-L903 PolarHBondContact O-N 2.75Å; F901-L903 PolarHBondContact O-N 2.98Å; L903-Q907 VanDerWaalsContact O-CB 3.22Å; L903-Q907 WeakPolarHBondContact O-CB 3.16Å; L903-Q907 PolarHBondContact O-N 3Å; L903-V1074 HydrophobicContact CD1-CG1 4.18Å; L903-V1074 HydrophobicContact CD1-CG2 4.15Å; L903-F1076 HydrophobicContact CD1-CZ 4.18Å; L903-F1076 HydrophobicContact CD2-CE1 4.4Å; L903-F1076 HydrophobicContact CD2-CZ 3.94Å; L903-M1085 HydrophobicContact CB-SD 4.18Å; L903-M1085 HydrophobicContact CD2-SD 4.31Å
904	R	97.4	Very high	96.4	Very high	13 Å²	13	11.4 Å²	11.4	5%	0.049	6%	0.061	C	C	.	.	H	α-helix	trans	-64.1	-42.5	173.5	-70.6	-68.3	-65.2	113.7	-6.1	112.2	L650 E653 Y900 F901 T908	L650-R904 HydrophobicContact CD1-CB 4.05Å; L650-R904 HydrophobicContact CD2-CB 4.23Å; E653-R904 VanDerWaalsContact CD-NH2 3.33Å; E653-R904 IonicContact OE1-NH2 2.89Å; E653-R904 PolarHBondContact OE1-NH2 3.08Å; E653-R904 IonicContact OE2-CZ 3.26Å; E653-R904 IonicContact OE2-NE 2.76Å; E653-R904 PolarHBondContact OE2-NE 3.14Å; E653-R904 IonicContact OE2-NH2 2.73Å; E653-R904 PolarHBondContact OE2-NH2 3.24Å; Y900-R904 HydrophobicContact CD1-CG 4.27Å; Y900-R904 HydrophobicContact CD2-CG 4.37Å; Y900-R904 HydrophobicContact CE1-CG 3.71Å; Y900-R904 HydrophobicContact CE2-CG 3.83Å; Y900-R904 VanDerWaalsContact CZ-CG 3.44Å; Y900-R904 WeakPolarHBondContact O-CG 3.38Å; Y900-R904 PolarHBondContact O-N 3.1Å; Y900-R904 WeakPolarHBondContact OH-CD 3.39Å; F901-R904 PolarHBondContact O-N 2.78Å; R904-T908 WeakPolarHBondContact O-CB 3.45Å; R904-T908 PolarHBondContact O-N 3.21Å; R904-T908 PolarHBondContact O-OG1 3.35Å
905	L	97.9	Very high	96.4	Very high	5 Å²	5	17.5 Å²	17.5	3%	0.026	8%	0.084	C	C	.	.	H	α-helix	trans	-70.2	-41.9	179.1	-69.7	168.3	0	0	0	112	L645 L650 F901 F902 T908 L909 N1011 I1012	L645-L905 HydrophobicContact CD2-CD2 3.95Å; L650-L905 HydrophobicContact CD1-CD2 4.24Å; L650-L905 HydrophobicContact CD1-CG 4.17Å; F901-L905 WeakPolarHBondContact O-CB 3.32Å; F901-L905 WeakPolarHBondContact O-CD1 3.24Å; F901-L905 WeakPolarHBondContact O-CG 3.27Å; F901-L905 PolarHBondContact O-N 3.32Å; F902-L905 PolarHBondContact O-N 3.02Å; L905-T908 WeakPolarHBondContact O-CB 3.47Å; L905-T908 PolarHBondContact O-N 3.02Å; L905-L909 PolarHBondContact O-N 3.5Å; L905-N1011 HydrophobicContact CD1-CB 3.89Å; L905-N1011 HydrophobicContact CD2-CB 4.2Å; L905-I1012 HydrophobicContact CB-CD1 4.33Å; L905-I1012 HydrophobicContact CB-CG1 3.59Å
906	H	96.7	Very high	96.3	Very high	1 Å²	1	17.9 Å²	17.9	1%	0.005	9%	0.086	C	C	.	.	H	α-helix	trans	-59.9	-47.4	173.1	175.1	-100.5	0	0	0	111.6	F736 F902 T908 L909 C910	F736-H906 AromaticContact CE2-CE1 3.83Å; F902-H906 HydrophobicContact CE2-CB 4.46Å; F902-H906 HydrophobicContact CZ-CB 4.35Å; F902-H906 VanDerWaalsContact O-CB 3.25Å; F902-H906 WeakPolarHBondContact O-CB 3.3Å; F902-H906 PolarHBondContact O-N 2.96Å; H906-T908 PolarHBondContact O-N 3.49Å; H906-L909 PolarHBondContact O-N 2.97Å; H906-L909 VanDerWaalsContact O-N 3.17Å; H906-C910 PolarHBondContact O-N 2.73Å; H906-C910 PolarHBondContact O-SG 2.88Å; H906-C910 VanDerWaalsContact O-SG 3.39Å
907	Q	96.1	Very high	96.4	Very high	25 Å²	25	21.1 Å²	21.1	12%	0.117	10%	0.099	C	C	.	.	H	α-helix	trans	-55.3	-42.5	172.8	-173.9	-81	-43	0	0	111.7	F691 Y693 L903 S911 M1085	F691-Q907 HydrophobicContact CB-CG 3.64Å; F691-Q907 HydrophobicContact CD1-CG 3.84Å; F691-Q907 HydrophobicContact CD2-CG 4.1Å; F691-Q907 HydrophobicContact CG-CG 3.58Å; Y693-Q907 HydrophobicContact CE2-CG 4.41Å; Y693-Q907 VanDerWaalsContact OH-CA 3.29Å; Y693-Q907 WeakPolarHBondContact OH-CA 3.39Å; Y693-Q907 VanDerWaalsContact OH-CB 3.27Å; Y693-Q907 WeakPolarHBondContact OH-CB 3.46Å; L903-Q907 VanDerWaalsContact O-CB 3.22Å; L903-Q907 WeakPolarHBondContact O-CB 3.16Å; L903-Q907 PolarHBondContact O-N 3Å; Q907-S911 VanDerWaalsContact O-CB 3.24Å; Q907-S911 WeakPolarHBondContact O-CB 3.46Å; Q907-S911 PolarHBondContact O-N 3.31Å; Q907-M1085 HydrophobicContact CB-CE 3.99Å; Q907-M1085 HydrophobicContact CG-CE 4.11Å
908	T	96.8	Very high	96.3	Very high	18 Å²	18	24.7 Å²	24.7	11%	0.11	11%	0.11	C	C	.	.	H	α-helix	trans	-66.8	-37.6	179.3	-62.3	0	0	0	0	112.5	L645 R904 L905 H906 R912 V1008	L645-T908 HydrophobicContact CD2-CG2 3.88Å; R904-T908 WeakPolarHBondContact O-CB 3.45Å; R904-T908 PolarHBondContact O-N 3.21Å; R904-T908 PolarHBondContact O-OG1 3.35Å; L905-T908 WeakPolarHBondContact O-CB 3.47Å; L905-T908 PolarHBondContact O-N 3.02Å; H906-T908 PolarHBondContact O-N 3.49Å; T908-R912 VanDerWaalsContact CG2-NE 3.31Å; T908-R912 VanDerWaalsContact O-CG 3.3Å; T908-R912 WeakPolarHBondContact O-CG 3.33Å; T908-R912 PolarHBondContact O-N 3.42Å; T908-V1008 HydrophobicContact CG2-CG2 4.4Å
909	L	97.4	Very high	96.2	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-64.2	-55.9	173.4	179	58.7	0	0	0	110.8	A702 I706 L905 H906 S911 R912 L913 I1005 V1008 I1009 I1012	A702-L909 HydrophobicContact CB-CD2 3.93Å; A702-L909 HydrophobicContact CB-CG 4.23Å; I706-L909 HydrophobicContact CD1-CD2 4.2Å; I706-L909 HydrophobicContact CG1-CD2 4.29Å; L905-L909 PolarHBondContact O-N 3.5Å; H906-L909 PolarHBondContact O-N 2.97Å; H906-L909 VanDerWaalsContact O-N 3.17Å; L909-S911 VanDerWaalsContact C-N 3.29Å; L909-S911 PolarHBondContact O-N 3.26Å; L909-R912 PolarHBondContact O-N 2.93Å; L909-L913 HydrophobicContact CD1-CD1 4.05Å; L909-L913 HydrophobicContact CD1-CG 4.09Å; L909-L913 HydrophobicContact CG-CD1 3.97Å; L909-L913 HydrophobicContact CG-CG 4.4Å; L909-L913 WeakPolarHBondContact O-CG 3.49Å; L909-L913 PolarHBondContact O-N 2.82Å; L909-I1005 HydrophobicContact CD1-CG2 3.93Å; L909-V1008 HydrophobicContact CB-CG1 3.84Å; L909-V1008 HydrophobicContact CD1-CG1 4.5Å; L909-I1009 HydrophobicContact CD1-CD1 4.18Å; L909-I1009 HydrophobicContact CD1-CG1 4.02Å; L909-I1009 HydrophobicContact CD2-CG1 3.98Å; L909-I1012 HydrophobicContact CB-CD1 3.96Å; L909-I1012 HydrophobicContact CD2-CD1 3.78Å
910	C	96.6	Very high	96	Very high	5 Å²	5	24.5 Å²	24.5	3%	0.034	11%	0.11	C	C	.	.	H	α-helix	trans	-59.3	-39.5	-178.6	-63.8	0	0	0	0	112	Y693 I698 A702 H906 R912 L913 L914	Y693-C910 HydrophobicContact CD1-CB 4.19Å; Y693-C910 HydrophobicContact CE1-CB 3.92Å; I698-C910 HydrophobicContact CG2-CB 4.09Å; I698-C910 WeakPolarHBondContact CG2-O 3.48Å; A702-C910 VanDerWaalsContact CB-SG 3.56Å; H906-C910 PolarHBondContact O-N 2.73Å; H906-C910 PolarHBondContact O-SG 2.88Å; H906-C910 VanDerWaalsContact O-SG 3.39Å; C910-R912 VanDerWaalsContact C-N 3.34Å; C910-R912 PolarHBondContact O-N 3.3Å; C910-L913 PolarHBondContact O-N 2.83Å; C910-L914 WeakPolarHBondContact O-CB 3.32Å; C910-L914 PolarHBondContact O-N 2.76Å
911	S	95.9	Very high	95.8	Very high	48 Å²	48	29.7 Å²	29.7	34%	0.336	13%	0.134	S	C	.	.	H	α-helix	trans	-62	-37.7	175.3	-172.6	0	0	0	0	112.9	Q907 L909 R915	Q907-S911 VanDerWaalsContact O-CB 3.24Å; Q907-S911 WeakPolarHBondContact O-CB 3.46Å; Q907-S911 PolarHBondContact O-N 3.31Å; L909-S911 VanDerWaalsContact C-N 3.29Å; L909-S911 PolarHBondContact O-N 3.26Å; S911-R915 WeakPolarHBondContact O-CB 3.44Å; S911-R915 VanDerWaalsContact O-CG 3.23Å; S911-R915 WeakPolarHBondContact O-CG 3.32Å; S911-R915 PolarHBondContact O-N 3.04Å; S911-R915 VanDerWaalsContact O-N 3.17Å
912	R	95.9	Very high	95.5	Very high	24 Å²	24	35.2 Å²	35.2	9%	0.091	15%	0.154	C	C	.	.	H	α-helix	trans	-73.4	-45.7	177	-69.4	170.9	-156.9	-138.7	-1.7	112	D641 T908 L909 C910 L914 R915 V916 I1001 T1004 I1005	D641-R912 IonicContact OD1-CZ 3.96Å; D641-R912 IonicContact OD1-NH1 2.74Å; D641-R912 PolarHBondContact OD1-NH1 3.38Å; D641-R912 IonicContact OD1-NH2 2.79Å; D641-R912 PolarHBondContact OD1-NH2 3.47Å; D641-R912 IonicContact OD2-CZ 3.44Å; D641-R912 IonicContact OD2-NH1 2.59Å; D641-R912 PolarHBondContact OD2-NH1 2.96Å; D641-R912 IonicContact OD2-NH2 3.45Å; D641-R912 PolarHBondContact OD2-NH2 3.01Å; T908-R912 VanDerWaalsContact CG2-NE 3.31Å; T908-R912 VanDerWaalsContact O-CG 3.3Å; T908-R912 WeakPolarHBondContact O-CG 3.33Å; T908-R912 PolarHBondContact O-N 3.42Å; L909-R912 PolarHBondContact O-N 2.93Å; C910-R912 VanDerWaalsContact C-N 3.34Å; C910-R912 PolarHBondContact O-N 3.3Å; R912-L914 VanDerWaalsContact C-N 3.33Å; R912-L914 PolarHBondContact O-N 3.17Å; R912-R915 PolarHBondContact O-N 3.17Å; R912-R915 VanDerWaalsContact O-N 3.07Å; R912-V916 WeakPolarHBondContact O-CG2 3.38Å; R912-V916 PolarHBondContact O-N 3.19Å; R912-I1001 HydrophobicContact CB-CG2 4.07Å; R912-I1001 HydrophobicContact CG-CG2 4.1Å; R912-T1004 PolarHBondContact NH1-OG1 3.24Å; R912-I1005 HydrophobicContact CB-CD1 3.99Å; R912-I1005 HydrophobicContact CB-CG1 4.27Å
913	L	96.8	Very high	95	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-56.8	-47	176.6	-66.8	176.9	0	0	0	110.9	I698 A702 L705 L909 C910 R915 V916 Y917 F970 L971	I698-L913 HydrophobicContact CD1-CB 4.46Å; I698-L913 HydrophobicContact CG2-CB 3.78Å; A702-L913 HydrophobicContact CB-CD1 3.88Å; L705-L913 HydrophobicContact CD1-CD1 4.34Å; L705-L913 HydrophobicContact CD1-CD2 4.18Å; L909-L913 HydrophobicContact CD1-CD1 4.05Å; L909-L913 HydrophobicContact CD1-CG 4.09Å; L909-L913 HydrophobicContact CG-CD1 3.97Å; L909-L913 HydrophobicContact CG-CG 4.4Å; L909-L913 WeakPolarHBondContact O-CG 3.49Å; L909-L913 PolarHBondContact O-N 2.82Å; C910-L913 PolarHBondContact O-N 2.83Å; L913-R915 VanDerWaalsContact C-N 3.32Å; L913-R915 PolarHBondContact O-N 2.91Å; L913-V916 PolarHBondContact O-N 3.07Å; L913-Y917 WeakPolarHBondContact O-CB 3.26Å; L913-Y917 PolarHBondContact O-N 2.96Å; L913-F970 HydrophobicContact CD2-CE1 3.68Å; L913-F970 HydrophobicContact CD2-CZ 4.05Å; L913-L971 HydrophobicContact CD2-CD2 4.06Å
914	L	95.4	Very high	94.5	Very high	21 Å²	21	37.8 Å²	37.8	11%	0.11	17%	0.167	C	C	.	.	H	α-helix	trans	-61.2	-36	175	-179.3	59.7	0	0	0	113	E694 D695 I698 C910 R912 R918	E694-L914 HydrophobicContact CB-CD2 4.4Å; D695-L914 HydrophobicContact CB-CD1 4.41Å; I698-L914 HydrophobicContact CG1-CB 4.24Å; I698-L914 HydrophobicContact CG1-CD1 4.16Å; I698-L914 HydrophobicContact CG2-CB 4.31Å; C910-L914 WeakPolarHBondContact O-CB 3.32Å; C910-L914 PolarHBondContact O-N 2.76Å; R912-L914 VanDerWaalsContact C-N 3.33Å; R912-L914 PolarHBondContact O-N 3.17Å; L914-R918 HydrophobicContact CD1-CG 4.26Å; L914-R918 WeakPolarHBondContact O-CB 3.39Å; L914-R918 VanDerWaalsContact O-CG 3.26Å; L914-R918 WeakPolarHBondContact O-CG 3.24Å; L914-R918 PolarHBondContact O-N 3.07Å
915	R	95.3	Very high	94.1	Very high	131 Å²	131	42.9 Å²	42.9	49%	0.494	19%	0.194	S	C	.	.	H	α-helix	trans	-72.1	-35.5	176.6	-74.5	175.2	75	177.3	2.9	112.8	S911 R912 L913 Q919 I1001	S911-R915 WeakPolarHBondContact O-CB 3.44Å; S911-R915 VanDerWaalsContact O-CG 3.23Å; S911-R915 WeakPolarHBondContact O-CG 3.32Å; S911-R915 PolarHBondContact O-N 3.04Å; S911-R915 VanDerWaalsContact O-N 3.17Å; R912-R915 PolarHBondContact O-N 3.17Å; R912-R915 VanDerWaalsContact O-N 3.07Å; L913-R915 VanDerWaalsContact C-N 3.32Å; L913-R915 PolarHBondContact O-N 2.91Å; R915-Q919 WeakPolarHBondContact O-CB 3.5Å; R915-Q919 PolarHBondContact O-N 3.24Å; R915-I1001 HydrophobicContact CB-CD1 4.28Å; R915-I1001 HydrophobicContact CB-CG2 4.21Å
916	V	94.8	Very high	93.6	Very high	8 Å²	8	48 Å²	48	5%	0.048	22%	0.218	C	C	.	.	H	α-helix	trans	-71	-44.4	173.7	176.5	0	0	0	0	110.6	R912 L913 R918 Q919 A920 Y967 F970 F995 I1001	R912-V916 WeakPolarHBondContact O-CG2 3.38Å; R912-V916 PolarHBondContact O-N 3.19Å; L913-V916 PolarHBondContact O-N 3.07Å; V916-R918 PolarHBondContact O-N 3.36Å; V916-Q919 WeakPolarHBondContact O-CB 3.31Å; V916-Q919 PolarHBondContact O-N 3.43Å; V916-Q919 VanDerWaalsContact O-N 3.07Å; V916-A920 PolarHBondContact O-N 2.86Å; V916-Y967 HydrophobicContact CG1-CD2 4.43Å; V916-F970 HydrophobicContact CB-CE1 4.38Å; V916-F970 HydrophobicContact CB-CZ 4.44Å; V916-F970 HydrophobicContact CG1-CD1 3.86Å; V916-F970 HydrophobicContact CG1-CD2 4.03Å; V916-F970 HydrophobicContact CG1-CE1 4Å; V916-F970 HydrophobicContact CG1-CE2 4.17Å; V916-F970 HydrophobicContact CG1-CG 3.88Å; V916-F970 HydrophobicContact CG1-CZ 4.17Å; V916-F970 HydrophobicContact CG2-CE2 4.44Å; V916-F970 HydrophobicContact CG2-CZ 4.28Å; V916-F995 HydrophobicContact CG1-CE1 4.11Å; V916-F995 HydrophobicContact CG1-CE2 4.06Å; V916-F995 HydrophobicContact CG1-CZ 3.75Å; V916-I1001 HydrophobicContact CG2-CB 4.45Å; V916-I1001 HydrophobicContact CG2-CG2 4.08Å
917	Y	94.5	Very high	93	Very high	68 Å²	68	51.2 Å²	51.2	27%	0.267	23%	0.233	S	C	.	.	H	α-helix	trans	-53.9	-52.5	173.3	178.8	-90.7	0	0	0	112	I698 L913 Q919 A920 E921 Y967	I698-Y917 HydrophobicContact CD1-CG 4.33Å; L913-Y917 WeakPolarHBondContact O-CB 3.26Å; L913-Y917 PolarHBondContact O-N 2.96Å; Y917-Q919 PolarHBondContact O-N 3.36Å; Y917-A920 WeakPolarHBondContact O-CB 3.42Å; Y917-A920 PolarHBondContact O-N 3.01Å; Y917-A920 VanDerWaalsContact O-N 3.15Å; Y917-E921 PolarHBondContact O-N 2.99Å; Y917-Y967 AromaticContact CD2-CD1 3.71Å; Y917-Y967 HydrophobicContact CD2-CD1 3.71Å; Y917-Y967 HydrophobicContact CD2-CD2 4.14Å; Y917-Y967 AromaticContact CD2-CE1 3.91Å; Y917-Y967 HydrophobicContact CD2-CE1 3.91Å; Y917-Y967 HydrophobicContact CD2-CE2 4.34Å; Y917-Y967 AromaticContact CD2-CG 3.82Å; Y917-Y967 HydrophobicContact CD2-CG 3.82Å; Y917-Y967 HydrophobicContact CE2-CD1 4.36Å
918	R	94.3	Very high	92.5	Very high	100 Å²	100	55.6 Å²	55.6	38%	0.377	25%	0.249	S	C	.	.	H	α-helix	trans	-63.4	-22.6	177.4	-75.6	174.2	166.5	171.7	-5.2	113.9	E694 L914 V916 R922	E694-R918 IonicContact OE1-CZ 2.66Å; E694-R918 IonicContact OE1-NH1 3.03Å; E694-R918 PolarHBondContact OE1-NH1 3.22Å; E694-R918 IonicContact OE1-NH2 3.23Å; E694-R918 PolarHBondContact OE1-NH2 2.76Å; E694-R918 VanDerWaalsContact OE1-NH2 3.11Å; E694-R918 IonicContact OE2-CZ 3.31Å; E694-R918 IonicContact OE2-NH1 2.76Å; E694-R918 IonicContact OE2-NH2 2.66Å; E694-R918 PolarHBondContact OE2-NH2 3.39Å; L914-R918 HydrophobicContact CD1-CG 4.26Å; L914-R918 WeakPolarHBondContact O-CB 3.39Å; L914-R918 VanDerWaalsContact O-CG 3.26Å; L914-R918 WeakPolarHBondContact O-CG 3.24Å; L914-R918 PolarHBondContact O-N 3.07Å; V916-R918 PolarHBondContact O-N 3.36Å; R918-R922 WeakPolarHBondContact O-CB 3.28Å; R918-R922 PolarHBondContact O-N 3.46Å
919	Q	93.4	Very high	92	Very high	20 Å²	20	57.4 Å²	57.4	9%	0.093	27%	0.266	C	S	.	.	H	α-helix	trans	-79.2	-42.9	173.6	-174.5	59.8	30	0	0	111.2	R915 V916 Y917 R922 Q923 F995 H998	R915-Q919 WeakPolarHBondContact O-CB 3.5Å; R915-Q919 PolarHBondContact O-N 3.24Å; V916-Q919 WeakPolarHBondContact O-CB 3.31Å; V916-Q919 PolarHBondContact O-N 3.43Å; V916-Q919 VanDerWaalsContact O-N 3.07Å; Y917-Q919 PolarHBondContact O-N 3.36Å; Q919-R922 PolarHBondContact O-N 3.11Å; Q919-Q923 WeakPolarHBondContact O-CG 3.13Å; Q919-Q923 PolarHBondContact O-N 2.75Å; Q919-Q923 PolarHBondContact O-OE1 2.7Å; Q919-F995 HydrophobicContact CB-CD1 4.5Å; Q919-F995 HydrophobicContact CG-CD1 4.07Å; Q919-H998 VanDerWaalsContact CD-CD2 3.5Å; Q919-H998 HydrophobicContact CG-CB 3.94Å; Q919-H998 PolarHBondContact NE2-CD2 2.74Å; Q919-H998 VanDerWaalsContact NE2-CD2 3.28Å
920	A	92.3	Very high	91.2	Very high	7 Å²	7	61.1 Å²	61.1	6%	0.058	28%	0.283	C	S	.	.	H	α-helix	trans	-59.8	-49.8	173.6	0	0	0	0	0	111.5	V916 Y917 R922 Q923 L924 F995	V916-A920 PolarHBondContact O-N 2.86Å; Y917-A920 WeakPolarHBondContact O-CB 3.42Å; Y917-A920 PolarHBondContact O-N 3.01Å; Y917-A920 VanDerWaalsContact O-N 3.15Å; A920-R922 VanDerWaalsContact C-N 3.28Å; A920-R922 PolarHBondContact O-N 2.93Å; A920-Q923 PolarHBondContact O-N 3.15Å; A920-L924 VanDerWaalsContact O-CB 3.31Å; A920-L924 WeakPolarHBondContact O-CB 3.4Å; A920-L924 PolarHBondContact O-N 3.34Å; A920-F995 HydrophobicContact CB-CE1 4.09Å
921	E	91.6	Very high	90.4	Very high	110 Å²	110	64.1 Å²	64.1	51%	0.514	30%	0.296	S	S	.	.	H	α-helix	trans	-56.3	-42.7	176.8	-175.9	-174.4	-147.6	0	0	111.7	Y917 L924 L925	Y917-E921 PolarHBondContact O-N 2.99Å; E921-L924 PolarHBondContact O-N 3.47Å; E921-L925 WeakPolarHBondContact O-CB 3.26Å; E921-L925 PolarHBondContact O-N 3.21Å
922	R	90.7	Very high	89.8	Confident	135 Å²	135	64.6 Å²	64.6	51%	0.509	30%	0.3	S	S	.	.	H	α-helix	trans	-64.3	-50.9	177.7	-176	-175.3	-54.7	-170	1.9	112.2	R918 Q919 A920 L924 L925 E926	R918-R922 WeakPolarHBondContact O-CB 3.28Å; R918-R922 PolarHBondContact O-N 3.46Å; Q919-R922 PolarHBondContact O-N 3.11Å; A920-R922 VanDerWaalsContact C-N 3.28Å; A920-R922 PolarHBondContact O-N 2.93Å; R922-L924 PolarHBondContact O-N 3.29Å; R922-L925 PolarHBondContact O-N 3.5Å; R922-L925 VanDerWaalsContact O-N 3.14Å; R922-E926 WeakPolarHBondContact CD-OE1 3.4Å; R922-E926 HydrophobicContact CG-CG 4.3Å; R922-E926 VanDerWaalsContact CG-OE1 3.23Å; R922-E926 WeakPolarHBondContact CG-OE1 3.45Å; R922-E926 WeakPolarHBondContact O-CB 3.41Å; R922-E926 WeakPolarHBondContact O-CG 3.37Å; R922-E926 PolarHBondContact O-N 3.3Å
923	Q	87.3	Confident	89	Confident	29 Å²	29	69.6 Å²	69.6	14%	0.136	32%	0.319	C	S	.	.	H	α-helix	trans	-59.8	-39	179.1	-70.9	174.4	-74	0	0	111.3	Q919 A920 H927 L963 M994	Q919-Q923 WeakPolarHBondContact O-CG 3.13Å; Q919-Q923 PolarHBondContact O-N 2.75Å; Q919-Q923 PolarHBondContact O-OE1 2.7Å; A920-Q923 PolarHBondContact O-N 3.15Å; Q923-H927 VanDerWaalsContact O-CB 3.28Å; Q923-H927 WeakPolarHBondContact O-CB 3.35Å; Q923-H927 PolarHBondContact O-N 2.95Å; Q923-L963 HydrophobicContact CB-CD2 3.86Å; Q923-M994 PolarHBondContact NE2-O 2.67Å
924	L	88	Confident	88	Confident	25 Å²	25	72.4 Å²	72.4	13%	0.131	33%	0.332	C	S	.	.	H	α-helix	trans	-63.7	-43.5	174.7	176.7	58.8	0	0	0	112.4	A920 E921 R922 R928 L963 E964	A920-L924 VanDerWaalsContact O-CB 3.31Å; A920-L924 WeakPolarHBondContact O-CB 3.4Å; A920-L924 PolarHBondContact O-N 3.34Å; E921-L924 PolarHBondContact O-N 3.47Å; R922-L924 PolarHBondContact O-N 3.29Å; L924-R928 HydrophobicContact CD1-CG 4.37Å; L924-R928 WeakPolarHBondContact O-CB 3.44Å; L924-R928 VanDerWaalsContact O-CG 3.26Å; L924-R928 WeakPolarHBondContact O-CG 3.38Å; L924-R928 PolarHBondContact O-N 3.32Å; L924-L963 HydrophobicContact CD1-CB 3.87Å; L924-E964 HydrophobicContact CD1-CG 4.06Å; L924-E964 WeakPolarHBondContact CD1-OE1 3.47Å; L924-E964 WeakPolarHBondContact CD1-OE2 3.48Å; L924-E964 HydrophobicContact CD2-CG 4.28Å
925	L	88.8	Confident	87.3	Confident	120 Å²	120	79.2 Å²	79.2	63%	0.628	36%	0.356	S	S	*	.	H	α-helix	trans	-68.6	-41.9	177.7	-172.1	65	0	0	0	112	E921 R922 R928 A929	E921-L925 WeakPolarHBondContact O-CB 3.26Å; E921-L925 PolarHBondContact O-N 3.21Å; R922-L925 PolarHBondContact O-N 3.5Å; R922-L925 VanDerWaalsContact O-N 3.14Å; L925-R928 PolarHBondContact O-N 2.93Å; L925-A929 WeakPolarHBondContact O-CB 3.39Å; L925-A929 PolarHBondContact O-N 2.84Å
926	E	87	Confident	86.6	Confident	113 Å²	113	78.7 Å²	78.7	53%	0.528	36%	0.363	S	S	.	.	H	α-helix	trans	-60.9	-46.3	174.4	-74.3	170.6	-177.7	0	0	111	R922 R928 A929 E930	R922-E926 WeakPolarHBondContact CD-OE1 3.4Å; R922-E926 HydrophobicContact CG-CG 4.3Å; R922-E926 VanDerWaalsContact CG-OE1 3.23Å; R922-E926 WeakPolarHBondContact CG-OE1 3.45Å; R922-E926 WeakPolarHBondContact O-CB 3.41Å; R922-E926 WeakPolarHBondContact O-CG 3.37Å; R922-E926 PolarHBondContact O-N 3.3Å; E926-R928 PolarHBondContact O-N 3.48Å; E926-A929 WeakPolarHBondContact O-CB 3.47Å; E926-A929 PolarHBondContact O-N 3.14Å; E926-E930 WeakPolarHBondContact O-CB 3.35Å; E926-E930 PolarHBondContact O-N 2.9Å
927	H	84	Confident	85.7	Confident	68 Å²	68	80.9 Å²	80.9	32%	0.315	37%	0.374	S	S	.	.	H	α-helix	trans	-61.7	-42.5	174.5	173.5	-131.9	0	0	0	113	Q923 A929 E930 Q931 L963	Q923-H927 VanDerWaalsContact O-CB 3.28Å; Q923-H927 WeakPolarHBondContact O-CB 3.35Å; Q923-H927 PolarHBondContact O-N 2.95Å; H927-A929 VanDerWaalsContact C-N 3.31Å; H927-A929 PolarHBondContact O-N 3.06Å; H927-E930 PolarHBondContact O-N 3.46Å; H927-Q931 PolarHBondContact CE1-NE2 3.35Å; H927-Q931 PolarHBondContact NE2-NE2 2.91Å; H927-Q931 WeakPolarHBondContact O-CG 3.23Å; H927-Q931 PolarHBondContact O-N 3.16Å; H927-L963 HydrophobicContact CB-CD1 3.64Å; H927-L963 VanDerWaalsContact CG-CD1 3.47Å; H927-L963 WeakPolarHBondContact ND1-CD1 3.45Å
928	R	84.9	Confident	84.4	Confident	117 Å²	117	83 Å²	83	44%	0.442	39%	0.388	S	S	.	.	H	α-helix	trans	-66.1	-33.1	175.7	-73.6	169.2	174.5	177.5	-1.4	112.1	L924 L925 E926 S932 E964	L924-R928 HydrophobicContact CD1-CG 4.37Å; L924-R928 WeakPolarHBondContact O-CB 3.44Å; L924-R928 VanDerWaalsContact O-CG 3.26Å; L924-R928 WeakPolarHBondContact O-CG 3.38Å; L924-R928 PolarHBondContact O-N 3.32Å; L925-R928 PolarHBondContact O-N 2.93Å; E926-R928 PolarHBondContact O-N 3.48Å; R928-S932 WeakPolarHBondContact O-CB 3.38Å; R928-S932 PolarHBondContact O-N 2.64Å; R928-S932 VanDerWaalsContact O-N 3.16Å; R928-S932 PolarHBondContact O-OG 3.27Å; R928-E964 IonicContact CZ-OE1 3.91Å; R928-E964 IonicContact NE-OE1 2.89Å; R928-E964 PolarHBondContact NE-OE1 3.32Å; R928-E964 IonicContact NH2-OE1 3.77Å; R928-E964 PolarHBondContact NH2-OE1 2.84Å
929	A	86.1	Confident	83.3	Confident	57 Å²	57	82.4 Å²	82.4	47%	0.471	40%	0.404	S	S	.	.	H	α-helix	trans	-70.4	-42.6	172	0	0	0	0	0	111.9	L925 E926 H927 S932 R933	L925-A929 WeakPolarHBondContact O-CB 3.39Å; L925-A929 PolarHBondContact O-N 2.84Å; E926-A929 WeakPolarHBondContact O-CB 3.47Å; E926-A929 PolarHBondContact O-N 3.14Å; H927-A929 VanDerWaalsContact C-N 3.31Å; H927-A929 PolarHBondContact O-N 3.06Å; A929-S932 CarbonylContact O-C 3.53Å; A929-S932 WeakPolarHBondContact O-CB 3.35Å; A929-S932 PolarHBondContact O-N 2.97Å; A929-S932 VanDerWaalsContact O-N 3.14Å; A929-R933 WeakPolarHBondContact O-CB 3.49Å; A929-R933 PolarHBondContact O-N 3.48Å
930	E	82.3	Confident	82.4	Confident	78 Å²	78	87.9 Å²	87.9	36%	0.364	43%	0.429	S	S	.	.	H	α-helix	trans	-60.2	-50.1	175.8	-168.2	73.5	-74.1	0	0	111.3	E926 H927 S932 R933 E934	E926-E930 WeakPolarHBondContact O-CB 3.35Å; E926-E930 PolarHBondContact O-N 2.9Å; H927-E930 PolarHBondContact O-N 3.46Å; E930-S932 PolarHBondContact O-N 3.35Å; E930-R933 CarbonylContact O-C 3.47Å; E930-R933 WeakPolarHBondContact O-CA 3.33Å; E930-R933 WeakPolarHBondContact O-CB 3.32Å; E930-R933 PolarHBondContact O-N 2.81Å; E930-R933 IonicContact OE1-CZ 3.98Å; E930-R933 IonicContact OE1-NE 3.67Å; E930-R933 PolarHBondContact OE1-NE 2.73Å; E930-R933 IonicContact OE1-NH2 2.64Å; E930-R933 PolarHBondContact OE1-NH2 3.43Å; E930-R933 IonicContact OE2-NH2 3.49Å; E930-E934 PolarHBondContact O-N 2.98Å
931	Q	79.3	Confident	80.9	Confident	67 Å²	67	90.5 Å²	90.5	31%	0.313	46%	0.457	S	S	.	.	H	α-helix	trans	-58	-36	173.2	-73.1	-166.7	16.2	0	0	112.5	H927 R935	H927-Q931 PolarHBondContact CE1-NE2 3.35Å; H927-Q931 PolarHBondContact NE2-NE2 2.91Å; H927-Q931 WeakPolarHBondContact O-CG 3.23Å; H927-Q931 PolarHBondContact O-N 3.16Å; Q931-R935 WeakPolarHBondContact O-CB 3.42Å; Q931-R935 WeakPolarHBondContact O-CD 3.44Å; Q931-R935 WeakPolarHBondContact O-CG 3.49Å; Q931-R935 PolarHBondContact O-N 3.1Å
932	S	82.9	Confident	79.3	Confident	59 Å²	59	93.5 Å²	93.5	41%	0.413	46%	0.464	S	S	.	.	H	α-helix	trans	-70.5	-37.3	177.1	-60.5	0	0	0	0	111.6	R928 A929 E930 R935 L936	R928-S932 WeakPolarHBondContact O-CB 3.38Å; R928-S932 PolarHBondContact O-N 2.64Å; R928-S932 VanDerWaalsContact O-N 3.16Å; R928-S932 PolarHBondContact O-OG 3.27Å; A929-S932 CarbonylContact O-C 3.53Å; A929-S932 WeakPolarHBondContact O-CB 3.35Å; A929-S932 PolarHBondContact O-N 2.97Å; A929-S932 VanDerWaalsContact O-N 3.14Å; E930-S932 PolarHBondContact O-N 3.35Å; S932-R935 PolarHBondContact O-N 2.81Å; S932-L936 WeakPolarHBondContact O-CG 3.43Å; S932-L936 PolarHBondContact O-N 3.24Å; S932-L936 VanDerWaalsContact O-N 3.12Å
933	R	79.8	Confident	77.4	Confident	128 Å²	128	97.6 Å²	97.6	48%	0.483	48%	0.479	S	S	.	.	H	α-helix	trans	-66.3	-46.3	173.9	-170.4	175	74.4	113.8	-6.8	111.6	A929 E930 R935 L936 L937	A929-R933 WeakPolarHBondContact O-CB 3.49Å; A929-R933 PolarHBondContact O-N 3.48Å; E930-R933 CarbonylContact O-C 3.47Å; E930-R933 WeakPolarHBondContact O-CA 3.33Å; E930-R933 WeakPolarHBondContact O-CB 3.32Å; E930-R933 PolarHBondContact O-N 2.81Å; E930-R933 IonicContact OE1-CZ 3.98Å; E930-R933 IonicContact OE1-NE 3.67Å; E930-R933 PolarHBondContact OE1-NE 2.73Å; E930-R933 IonicContact OE1-NH2 2.64Å; E930-R933 PolarHBondContact OE1-NH2 3.43Å; E930-R933 IonicContact OE2-NH2 3.49Å; R933-R935 PolarHBondContact O-N 3.17Å; R933-L936 PolarHBondContact O-N 2.96Å; R933-L937 HydrophobicContact CG-CD1 4.19Å; R933-L937 WeakPolarHBondContact O-CG 3.44Å; R933-L937 PolarHBondContact O-N 3.36Å
934	E	76.3	Confident	75.9	Confident	60 Å²	60	104 Å²	104	28%	0.28	51%	0.509	S	S	.	.	H	α-helix	trans	-59.8	-44	173.3	-75	-151.8	132.2	0	0	111.7	E930 L936 L937 M938 A946	E930-E934 PolarHBondContact O-N 2.98Å; E934-L936 VanDerWaalsContact C-N 3.25Å; E934-L936 PolarHBondContact O-N 2.93Å; E934-L937 PolarHBondContact O-N 3.08Å; E934-M938 VanDerWaalsContact O-CB 3.28Å; E934-M938 WeakPolarHBondContact O-CB 3.25Å; E934-M938 WeakPolarHBondContact O-CG 3.48Å; E934-M938 PolarHBondContact O-N 3.17Å; E934-A946 PolarHBondContact OE1-N 3.43Å
935	R	78.9	Confident	74.2	Confident	164 Å²	164	110 Å²	110	62%	0.619	53%	0.534	S	S	*	.	H	α-helix	trans	-60.5	-33.2	176.6	-74.4	166	-168.8	176.1	7.3	112.7	Q931 S932 R933 A939	Q931-R935 WeakPolarHBondContact O-CB 3.42Å; Q931-R935 WeakPolarHBondContact O-CD 3.44Å; Q931-R935 WeakPolarHBondContact O-CG 3.49Å; Q931-R935 PolarHBondContact O-N 3.1Å; S932-R935 PolarHBondContact O-N 2.81Å; R933-R935 PolarHBondContact O-N 3.17Å; R935-A939 WeakPolarHBondContact O-CB 3.49Å; R935-A939 PolarHBondContact O-N 2.89Å
936	L	81.5	Confident	72.3	Confident	120 Å²	120	107 Å²	107	63%	0.628	53%	0.526	S	S	*	.	H	α-helix	trans	-72.7	-47.9	173.6	-71	166.2	0	0	0	111.7	S932 R933 E934 M938 A939 E940	S932-L936 WeakPolarHBondContact O-CG 3.43Å; S932-L936 PolarHBondContact O-N 3.24Å; S932-L936 VanDerWaalsContact O-N 3.12Å; R933-L936 PolarHBondContact O-N 2.96Å; E934-L936 VanDerWaalsContact C-N 3.25Å; E934-L936 PolarHBondContact O-N 2.93Å; L936-M938 VanDerWaalsContact C-N 3.32Å; L936-M938 PolarHBondContact O-N 3.42Å; L936-A939 CarbonylContact O-C 3.39Å; L936-A939 WeakPolarHBondContact O-CA 3.18Å; L936-A939 WeakPolarHBondContact O-CB 3.46Å; L936-A939 PolarHBondContact O-N 3.05Å; L936-E940 PolarHBondContact O-N 3.22Å
937	L	75.1	Confident	70.6	Confident	53 Å²	53	105.1 Å²	105.1	28%	0.277	53%	0.525	S	S	.	.	H	α-helix	trans	-62.6	-37.4	178	-68.4	168.4	0	0	0	112.6	R933 E934 A939 E940 G941 R942	R933-L937 HydrophobicContact CG-CD1 4.19Å; R933-L937 WeakPolarHBondContact O-CG 3.44Å; R933-L937 PolarHBondContact O-N 3.36Å; E934-L937 PolarHBondContact O-N 3.08Å; L937-A939 VanDerWaalsContact C-N 3.31Å; L937-A939 PolarHBondContact O-N 2.75Å; L937-E940 CarbonylContact O-C 3.53Å; L937-E940 PolarHBondContact O-N 3.04Å; L937-G941 PolarHBondContact O-N 3.21Å; L937-R942 PolarHBondContact O-N 3.08Å; L937-R942 VanDerWaalsContact O-N 3.15Å
938	M	68.3	Low	69.6	Low	114 Å²	114	105 Å²	105	56%	0.562	53%	0.527	S	S	*	.	H	α-helix	trans	-62.1	-36.7	170.7	-67.7	-99.4	-168.6	0	0	112	E934 L936 G941	E934-M938 VanDerWaalsContact O-CB 3.28Å; E934-M938 WeakPolarHBondContact O-CB 3.25Å; E934-M938 WeakPolarHBondContact O-CG 3.48Å; E934-M938 PolarHBondContact O-N 3.17Å; L936-M938 VanDerWaalsContact C-N 3.32Å; L936-M938 PolarHBondContact O-N 3.42Å; M938-G941 PolarHBondContact O-N 3.26Å
939	A	71	Confident	68.5	Low	86 Å²	86	104.7 Å²	104.7	71%	0.711	53%	0.533	S	S	*	.	H	α-helix	trans	-73.4	-28.2	176	0	0	0	0	0	112.8	R935 L936 L937 G941	R935-A939 WeakPolarHBondContact O-CB 3.49Å; R935-A939 PolarHBondContact O-N 2.89Å; L936-A939 CarbonylContact O-C 3.39Å; L936-A939 WeakPolarHBondContact O-CA 3.18Å; L936-A939 WeakPolarHBondContact O-CB 3.46Å; L936-A939 PolarHBondContact O-N 3.05Å; L937-A939 VanDerWaalsContact C-N 3.31Å; L937-A939 PolarHBondContact O-N 2.75Å; A939-G941 PolarHBondContact O-N 3.48Å
940	E	74.4	Confident	67.3	Low	136 Å²	136	102.3 Å²	102.3	64%	0.636	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.1	-1	170.3	-66.5	-172.8	166.9	0	0	113.5	L936 L937 R942	L936-E940 PolarHBondContact O-N 3.22Å; L937-E940 CarbonylContact O-C 3.53Å; L937-E940 PolarHBondContact O-N 3.04Å; E940-R942 PolarHBondContact O-N 2.82Å
941	G	60.3	Low	66.4	Low	62 Å²	62	102.1 Å²	102.1	64%	0.639	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.9	4	178	0	0	0	0	0	115	L937 M938 A939 R943	L937-G941 PolarHBondContact O-N 3.21Å; M938-G941 PolarHBondContact O-N 3.26Å; A939-G941 PolarHBondContact O-N 3.48Å; G941-R943 PolarHBondContact O-N 3.36Å; G941-R943 VanDerWaalsContact O-N 3.17Å
942	R	58.4	Low	65.7	Low	172 Å²	172	105.7 Å²	105.7	65%	0.649	53%	0.53	S	S	*	.			trans	-81.7	93.5	175.8	-68.1	-171.6	-177.4	-169.6	4.5	109.7	L937 E940 E944	L937-R942 PolarHBondContact O-N 3.08Å; L937-R942 VanDerWaalsContact O-N 3.15Å; E940-R942 PolarHBondContact O-N 2.82Å; R942-E944 PolarHBondContact O-N 3.24Å
943	R	50.7	Low	64.8	Low	222 Å²	222	107.9 Å²	107.9	84%	0.838	54%	0.537	S	S	*	.			trans	-81.4	54.1	-176.9	-158.8	-171	-174.8	-170.7	1.9	113.2	G941	G941-R943 PolarHBondContact O-N 3.36Å; G941-R943 VanDerWaalsContact O-N 3.17Å
944	E	55.1	Low	64	Low	163 Å²	163	111 Å²	111	76%	0.762	55%	0.549	S	S	*	.			trans	-88	112.3	163.8	-70.9	178	163.3	0	0	107.8	R942 A946	R942-E944 PolarHBondContact O-N 3.24Å; E944-A946 PolarHBondContact O-N 2.85Å
945	K	53.4	Low	63.3	Low	150 Å²	150	109.6 Å²	109.6	65%	0.652	54%	0.543	S	S	*	.			trans	-75.2	119.8	166.8	-82	-171.3	166	-162.8	0	107.8	C947	K945-C947 PolarHBondContact O-N 3.11Å
946	A	48	Very low	62.6	Low	57 Å²	57	105.1 Å²	105.1	47%	0.471	53%	0.528	S	S	.	.			trans	-81.2	57.8	171.5	0	0	0	0	0	110.3	E934 E944 D948	E934-A946 PolarHBondContact OE1-N 3.43Å; E944-A946 PolarHBondContact O-N 2.85Å; A946-D948 PolarHBondContact O-N 2.93Å
947	C	51.7	Low	61.7	Low	75 Å²	75	105.7 Å²	105.7	51%	0.507	53%	0.527	S	S	.	.			trans	-66.8	130.8	174.5	-74.3	0	0	0	0	109.9	K945 L949	K945-C947 PolarHBondContact O-N 3.11Å; C947-L949 PolarHBondContact O-N 2.85Å; C947-L949 VanDerWaalsContact O-N 3.14Å
948	D	62.4	Low	60.9	Low	64 Å²	64	107.6 Å²	107.6	34%	0.342	54%	0.543	S	S	.	.			trans	-56.7	117.6	169.7	-180	-9.7	0	0	0	109	A946 A950 M951 E952 K956	A946-D948 PolarHBondContact O-N 2.93Å; D948-A950 PolarHBondContact O-N 3.48Å; D948-A950 VanDerWaalsContact O-N 3.16Å; D948-A950 WeakPolarHBondContact OD1-CB 3.48Å; D948-A950 PolarHBondContact OD1-N 3.11Å; D948-M951 HydrophobicContact CB-CB 4.31Å; D948-M951 HydrophobicContact CB-CG 3.92Å; D948-M951 HydrophobicContact CB-SD 4.08Å; D948-M951 WeakPolarHBondContact O-CA 3.36Å; D948-M951 WeakPolarHBondContact O-CB 3.36Å; D948-M951 PolarHBondContact O-N 2.87Å; D948-E952 PolarHBondContact O-N 3.28Å; D948-E952 VanDerWaalsContact O-N 3.1Å; D948-K956 WeakPolarHBondContact OD2-CD 3.25Å; D948-K956 IonicContact OD2-NZ 3.6Å; D948-K956 PolarHBondContact OD2-NZ 2.99Å
949	L	62.4	Low	60.7	Low	112 Å²	112	104.8 Å²	104.8	59%	0.586	53%	0.534	S	S	*	.	H	α-helix	trans	-58.8	-29.4	-177.1	-176.8	62.8	0	0	0	111.6	C947 M951 E952 L953	C947-L949 PolarHBondContact O-N 2.85Å; C947-L949 VanDerWaalsContact O-N 3.14Å; L949-M951 VanDerWaalsContact C-N 3.31Å; L949-M951 PolarHBondContact O-N 3.02Å; L949-E952 PolarHBondContact O-N 3.31Å; L949-L953 HydrophobicContact CD1-CD1 4.18Å; L949-L953 HydrophobicContact CD1-CG 4.2Å; L949-L953 HydrophobicContact CG-CD1 3.94Å; L949-L953 HydrophobicContact CG-CG 4.37Å; L949-L953 WeakPolarHBondContact O-CB 3.32Å; L949-L953 VanDerWaalsContact O-CG 3.24Å; L949-L953 WeakPolarHBondContact O-CG 3.47Å; L949-L953 PolarHBondContact O-N 2.76Å
950	A	60.4	Low	60.4	Low	6 Å²	6	110.3 Å²	110.3	5%	0.05	55%	0.545	C	S	.	.	H	α-helix	trans	-67.2	-32.1	174.2	0	0	0	0	0	112.3	Y626 D948 R954 L955 K956	Y626-A950 HydrophobicContact CE1-CB 3.9Å; D948-A950 PolarHBondContact O-N 3.48Å; D948-A950 VanDerWaalsContact O-N 3.16Å; D948-A950 WeakPolarHBondContact OD1-CB 3.48Å; D948-A950 PolarHBondContact OD1-N 3.11Å; A950-R954 PolarHBondContact O-N 2.84Å; A950-L955 HydrophobicContact CB-CB 4.44Å; A950-L955 WeakPolarHBondContact O-CA 3.37Å; A950-L955 PolarHBondContact O-N 3.43Å; A950-K956 HydrophobicContact CB-CB 3.85Å; A950-K956 HydrophobicContact CB-CD 4.35Å; A950-K956 PolarHBondContact O-N 2.95Å; A950-K956 VanDerWaalsContact O-N 3.13Å
951	M	64.6	Low	60.4	Low	74 Å²	74	106 Å²	106	37%	0.365	53%	0.528	S	S	.	.	H	α-helix	trans	-77	-39.5	175.8	-61.6	-176.5	73	0	0	111.8	D948 L949 R954 K956 P958	D948-M951 HydrophobicContact CB-CB 4.31Å; D948-M951 HydrophobicContact CB-CG 3.92Å; D948-M951 HydrophobicContact CB-SD 4.08Å; D948-M951 WeakPolarHBondContact O-CA 3.36Å; D948-M951 WeakPolarHBondContact O-CB 3.36Å; D948-M951 PolarHBondContact O-N 2.87Å; L949-M951 VanDerWaalsContact C-N 3.31Å; L949-M951 PolarHBondContact O-N 3.02Å; M951-R954 PolarHBondContact O-N 3.33Å; M951-R954 VanDerWaalsContact O-N 3.08Å; M951-K956 HydrophobicContact CG-CB 4.3Å; M951-K956 HydrophobicContact CG-CD 4.16Å; M951-K956 HydrophobicContact CG-CG 4.19Å; M951-P958 HydrophobicContact CE-CB 3.88Å; M951-P958 HydrophobicContact CE-CG 3.79Å
952	E	63.8	Low	61.3	Low	143 Å²	143	109.4 Å²	109.4	67%	0.668	53%	0.528	S	S	*	.	H	α-helix	trans	-65	-39.8	175.9	-174.2	164.9	-144.5	0	0	111.9	D948 L949 R954	D948-E952 PolarHBondContact O-N 3.28Å; D948-E952 VanDerWaalsContact O-N 3.1Å; L949-E952 PolarHBondContact O-N 3.31Å; E952-R954 PolarHBondContact O-N 3.28Å
953	L	64.1	Low	62.3	Low	105 Å²	105	102.7 Å²	102.7	55%	0.55	50%	0.504	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.6	-5.5	172.6	-65.7	174.5	0	0	0	114	L949 L955	L949-L953 HydrophobicContact CD1-CD1 4.18Å; L949-L953 HydrophobicContact CD1-CG 4.2Å; L949-L953 HydrophobicContact CG-CD1 3.94Å; L949-L953 HydrophobicContact CG-CG 4.37Å; L949-L953 WeakPolarHBondContact O-CB 3.32Å; L949-L953 VanDerWaalsContact O-CG 3.24Å; L949-L953 WeakPolarHBondContact O-CG 3.47Å; L949-L953 PolarHBondContact O-N 2.76Å; L953-L955 HydrophobicContact CB-CD1 4Å; L953-L955 HydrophobicContact CB-CG 3.93Å; L953-L955 HydrophobicContact CD1-CD1 4.07Å; L953-L955 PolarHBondContact O-N 3.22Å
954	R	63.3	Low	63.8	Low	193 Å²	193	96.4 Å²	96.4	73%	0.728	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	57	32.7	-174.4	-50	-177.9	-174.5	-177.2	-0.4	114.3	A950 M951 E952	A950-R954 PolarHBondContact O-N 2.84Å; M951-R954 PolarHBondContact O-N 3.33Å; M951-R954 VanDerWaalsContact O-N 3.08Å; E952-R954 PolarHBondContact O-N 3.28Å
955	L	62	Low	65.4	Low	31 Å²	31	93.9 Å²	93.9	16%	0.162	47%	0.473	C	S	.	.	S	Bend	trans	-85.9	-14.1	170.5	-61.2	174.9	0	0	0	112.3	Y622 Y626 A950 L953	Y622-L955 HydrophobicContact CD1-CD2 3.99Å; Y622-L955 HydrophobicContact CG-CD2 4.43Å; Y626-L955 HydrophobicContact CD1-CB 3.91Å; Y626-L955 WeakPolarHBondContact CD1-O 3.4Å; Y626-L955 HydrophobicContact CD2-CB 4.49Å; Y626-L955 HydrophobicContact CD2-CD1 4.35Å; Y626-L955 HydrophobicContact CE1-CB 4.14Å; Y626-L955 HydrophobicContact CE2-CD1 4.34Å; Y626-L955 HydrophobicContact CG-CB 4.1Å; A950-L955 HydrophobicContact CB-CB 4.44Å; A950-L955 WeakPolarHBondContact O-CA 3.37Å; A950-L955 PolarHBondContact O-N 3.43Å; L953-L955 HydrophobicContact CB-CD1 4Å; L953-L955 HydrophobicContact CB-CG 3.93Å; L953-L955 HydrophobicContact CD1-CD1 4.07Å; L953-L955 PolarHBondContact O-N 3.22Å
956	K	64.3	Low	67.2	Low	69 Å²	69	87.6 Å²	87.6	30%	0.3	45%	0.445	S	S	.	.	S	Bend	trans	-137.4	119.8	177.7	175	179.5	168.6	-170.5	0	108	D948 A950 M951	D948-K956 WeakPolarHBondContact OD2-CD 3.25Å; D948-K956 IonicContact OD2-NZ 3.6Å; D948-K956 PolarHBondContact OD2-NZ 2.99Å; A950-K956 HydrophobicContact CB-CB 3.85Å; A950-K956 HydrophobicContact CB-CD 4.35Å; A950-K956 PolarHBondContact O-N 2.95Å; A950-K956 VanDerWaalsContact O-N 3.13Å; M951-K956 HydrophobicContact CG-CB 4.3Å; M951-K956 HydrophobicContact CG-CD 4.16Å; M951-K956 HydrophobicContact CG-CG 4.19Å
957	Q	61.6	Low	69.4	Low	132 Å²	132	85.5 Å²	85.5	62%	0.617	43%	0.425	S	S	*	.	P	Polyproline II helix	trans	-77.4	155	174.5	-56.1	-159.3	22.2	0	0	109.9	E623	E623-Q957 PolarHBondContact OE1-NE2 3.38Å
958	P	58	Low	71.4	Confident	93 Å²	93	85.1 Å²	85.1	60%	0.604	42%	0.422	S	S	*	.	P	Polyproline II helix	trans	-62.1	136.9	170.2	-15.6	29.7	0	0	0	109.9	M951 E960	M951-P958 HydrophobicContact CE-CB 3.88Å; M951-P958 HydrophobicContact CE-CG 3.79Å; P958-E960 PolarHBondContact O-N 3.47Å
959	S	64.2	Low	72.9	Confident	55 Å²	55	83.2 Å²	83.2	39%	0.385	42%	0.415	S	S	.	.	P	Polyproline II helix	trans	-59.1	128.8	169.8	176.1	0	0	0	0	109.7	V961 Y966	S959-V961 VanDerWaalsContact C-N 3.27Å; S959-V961 PolarHBondContact OG-N 3.08Å; S959-V961 PolarHBondContact OG-O 3.47Å; S959-Y966 WeakPolarHBondContact CB-OH 3.44Å; S959-Y966 PolarHBondContact OG-OH 2.76Å
960	E	64.5	Low	74.5	Confident	202 Å²	202	78 Å²	78	94%	0.944	39%	0.387	S	S	*	.	S	Bend	trans	-73.7	-22.8	171.7	-61.1	-167.6	150.4	0	0	112	P958	P958-E960 PolarHBondContact O-N 3.47Å
961	V	76.1	Confident	76.2	Confident	46 Å²	46	78 Å²	78	28%	0.279	39%	0.387	S	S	.	.	S	Bend	trans	-86.6	138.8	175.7	-171.9	0	0	0	0	109.8	S959 E965 Y966 A969	S959-V961 VanDerWaalsContact C-N 3.27Å; S959-V961 PolarHBondContact OG-N 3.08Å; S959-V961 PolarHBondContact OG-O 3.47Å; V961-E965 HydrophobicContact CG1-CB 3.82Å; V961-Y966 HydrophobicContact CB-CD1 4.34Å; V961-Y966 HydrophobicContact CB-CE1 4.27Å; V961-Y966 HydrophobicContact CG1-CD1 4.01Å; V961-Y966 HydrophobicContact CG1-CE1 4.42Å; V961-A969 HydrophobicContact CG1-CB 3.82Å; V961-A969 HydrophobicContact CG2-CB 4.42Å
962	E	78.3	Confident	77.6	Confident	133 Å²	133	78.7 Å²	78.7	62%	0.621	39%	0.392	S	S	*	.			trans	-74.1	148.1	171.8	-63.8	-160.4	157.1	0	0	111.4	E964 E965 Y966	E962-E964 PolarHBondContact O-N 2.81Å; E962-E965 WeakPolarHBondContact O-CA 3.45Å; E962-E965 PolarHBondContact O-N 2.9Å; E962-Y966 VanDerWaalsContact O-CD1 3.23Å; E962-Y966 WeakPolarHBondContact O-CD1 3.25Å; E962-Y966 PolarHBondContact O-N 2.95Å
963	L	79.6	Confident	79.1	Confident	31 Å²	31	73.2 Å²	73.2	16%	0.162	37%	0.367	C	S	.	.	G	3₁₀ helix	trans	-61.8	-30.3	-176	-87.7	155.5	0	0	0	113.4	Q923 L924 H927 E965 Y966	Q923-L963 HydrophobicContact CB-CD2 3.86Å; L924-L963 HydrophobicContact CD1-CB 3.87Å; H927-L963 HydrophobicContact CB-CD1 3.64Å; H927-L963 VanDerWaalsContact CG-CD1 3.47Å; H927-L963 WeakPolarHBondContact ND1-CD1 3.45Å; L963-E965 PolarHBondContact O-N 3.26Å; L963-Y966 HydrophobicContact CD2-CD1 4.41Å; L963-Y966 HydrophobicContact CD2-CD2 3.78Å; L963-Y966 HydrophobicContact CD2-CE1 4.07Å; L963-Y966 HydrophobicContact CD2-CE2 3.4Å; L963-Y966 HydrophobicContact CD2-CG 4.27Å; L963-Y966 HydrophobicContact CG-CE1 4.09Å; L963-Y966 HydrophobicContact CG-CE2 4.27Å; L963-Y966 PolarHBondContact O-N 3.28Å
964	E	81.7	Confident	80.7	Confident	91 Å²	91	68.2 Å²	68.2	43%	0.425	34%	0.34	S	S	.	.	G	3₁₀ helix	trans	-58.2	-28.3	169.2	-79.6	76.4	178.9	0	0	113.6	L924 R928 E962	L924-E964 HydrophobicContact CD1-CG 4.06Å; L924-E964 WeakPolarHBondContact CD1-OE1 3.47Å; L924-E964 WeakPolarHBondContact CD1-OE2 3.48Å; L924-E964 HydrophobicContact CD2-CG 4.28Å; R928-E964 IonicContact CZ-OE1 3.91Å; R928-E964 IonicContact NE-OE1 2.89Å; R928-E964 PolarHBondContact NE-OE1 3.32Å; R928-E964 IonicContact NH2-OE1 3.77Å; R928-E964 PolarHBondContact NH2-OE1 2.84Å; E962-E964 PolarHBondContact O-N 2.81Å
965	E	89	Confident	82.2	Confident	109 Å²	109	61 Å²	61	51%	0.509	31%	0.313	S	S	.	.	G	3₁₀ helix	trans	-101.9	-0.4	-175	-60.4	-170.5	151.3	0	0	113.8	V961 E962 L963 Y967 P968 A969	V961-E965 HydrophobicContact CG1-CB 3.82Å; E962-E965 WeakPolarHBondContact O-CA 3.45Å; E962-E965 PolarHBondContact O-N 2.9Å; L963-E965 PolarHBondContact O-N 3.26Å; E965-Y967 VanDerWaalsContact C-N 3.32Å; E965-Y967 PolarHBondContact O-N 2.96Å; E965-P968 VanDerWaalsContact O-CD 3.3Å; E965-P968 WeakPolarHBondContact O-CD 3.35Å; E965-A969 VanDerWaalsContact O-CB 3.28Å; E965-A969 WeakPolarHBondContact O-CB 3.41Å; E965-A969 PolarHBondContact O-N 3.49Å
966	Y	90.9	Very high	83.8	Confident	18 Å²	18	61.4 Å²	61.4	7%	0.071	32%	0.319	C	S	.	.	H	α-helix	trans	-56	-39.1	-173.9	-89.8	27.5	0	0	0	114.4	S959 V961 E962 L963 F970 M994 F995	S959-Y966 WeakPolarHBondContact CB-OH 3.44Å; S959-Y966 PolarHBondContact OG-OH 2.76Å; V961-Y966 HydrophobicContact CB-CD1 4.34Å; V961-Y966 HydrophobicContact CB-CE1 4.27Å; V961-Y966 HydrophobicContact CG1-CD1 4.01Å; V961-Y966 HydrophobicContact CG1-CE1 4.42Å; E962-Y966 VanDerWaalsContact O-CD1 3.23Å; E962-Y966 WeakPolarHBondContact O-CD1 3.25Å; E962-Y966 PolarHBondContact O-N 2.95Å; L963-Y966 HydrophobicContact CD2-CD1 4.41Å; L963-Y966 HydrophobicContact CD2-CD2 3.78Å; L963-Y966 HydrophobicContact CD2-CE1 4.07Å; L963-Y966 HydrophobicContact CD2-CE2 3.4Å; L963-Y966 HydrophobicContact CD2-CG 4.27Å; L963-Y966 HydrophobicContact CG-CE1 4.09Å; L963-Y966 HydrophobicContact CG-CE2 4.27Å; L963-Y966 PolarHBondContact O-N 3.28Å; Y966-F970 WeakPolarHBondContact O-CB 3.39Å; Y966-F970 PolarHBondContact O-N 3.48Å; Y966-F970 VanDerWaalsContact O-N 3.1Å; Y966-M994 HydrophobicContact CD1-CE 4.17Å; Y966-M994 HydrophobicContact CD2-CB 4.26Å; Y966-M994 HydrophobicContact CD2-CE 4.49Å; Y966-M994 HydrophobicContact CE2-CB 4.11Å; Y966-M994 WeakPolarHBondContact CE2-O 3.47Å; Y966-M994 HydrophobicContact CG-CE 4Å; Y966-M994 WeakPolarHBondContact O-CE 3.23Å; Y966-F995 HydrophobicContact CD2-CE1 4.12Å
967	Y	94.3	Very high	85.2	Confident	13 Å²	13	59 Å²	59	5%	0.051	31%	0.309	C	S	.	.	H	α-helix	trans	-77.7	-46.9	179	179.5	-101.5	0	0	0	113	I698 D701 V916 Y917 E965 A969 F970 L971	I698-Y967 WeakPolarHBondContact CD1-OH 3.22Å; D701-Y967 VanDerWaalsContact OD2-CE1 3.24Å; D701-Y967 WeakPolarHBondContact OD2-CE1 3.44Å; D701-Y967 PolarHBondContact OD2-OH 3.27Å; V916-Y967 HydrophobicContact CG1-CD2 4.43Å; Y917-Y967 AromaticContact CD2-CD1 3.71Å; Y917-Y967 HydrophobicContact CD2-CD1 3.71Å; Y917-Y967 HydrophobicContact CD2-CD2 4.14Å; Y917-Y967 AromaticContact CD2-CE1 3.91Å; Y917-Y967 HydrophobicContact CD2-CE1 3.91Å; Y917-Y967 HydrophobicContact CD2-CE2 4.34Å; Y917-Y967 AromaticContact CD2-CG 3.82Å; Y917-Y967 HydrophobicContact CD2-CG 3.82Å; Y917-Y967 HydrophobicContact CE2-CD1 4.36Å; E965-Y967 VanDerWaalsContact C-N 3.32Å; E965-Y967 PolarHBondContact O-N 2.96Å; Y967-A969 PolarHBondContact O-N 3.43Å; Y967-F970 HydrophobicContact CD2-CD1 4.02Å; Y967-F970 HydrophobicContact CE2-CD1 4.14Å; Y967-F970 HydrophobicContact CE2-CE1 4.26Å; Y967-F970 WeakPolarHBondContact O-CB 3.46Å; Y967-F970 PolarHBondContact O-N 3.23Å; Y967-L971 HydrophobicContact CD1-CD1 4.21Å; Y967-L971 HydrophobicContact CE1-CD1 3.66Å; Y967-L971 HydrophobicContact CE1-CG 4.22Å; Y967-L971 HydrophobicContact CE2-CD2 4.41Å; Y967-L971 HydrophobicContact CE2-CG 4.49Å; Y967-L971 PolarHBondContact O-N 2.9Å
968	P	94.1	Very high	86.8	Confident	68 Å²	68	53.2 Å²	53.2	44%	0.442	28%	0.282	S	S	.	.	H	α-helix	trans	-52.5	-49.6	168.3	-29.7	35.3	0	0	0	114	E965 F970 L971 D972	E965-P968 VanDerWaalsContact O-CD 3.3Å; E965-P968 WeakPolarHBondContact O-CD 3.35Å; P968-F970 VanDerWaalsContact C-N 3.31Å; P968-F970 PolarHBondContact O-N 3.46Å; P968-L971 WeakPolarHBondContact O-CB 3.43Å; P968-L971 PolarHBondContact O-N 3.29Å; P968-L971 VanDerWaalsContact O-N 3.09Å; P968-D972 PolarHBondContact O-N 3.45Å; P968-D972 VanDerWaalsContact O-N 3.08Å
969	A	93.9	Very high	88.4	Confident	24 Å²	24	51.3 Å²	51.3	20%	0.198	27%	0.267	C	S	.	.	H	α-helix	trans	-61.6	-39.4	178.8	0	0	0	0	0	112	V961 E965 Y967 L971 D972 M973 M994	V961-A969 HydrophobicContact CG1-CB 3.82Å; V961-A969 HydrophobicContact CG2-CB 4.42Å; E965-A969 VanDerWaalsContact O-CB 3.28Å; E965-A969 WeakPolarHBondContact O-CB 3.41Å; E965-A969 PolarHBondContact O-N 3.49Å; Y967-A969 PolarHBondContact O-N 3.43Å; A969-L971 PolarHBondContact O-N 3.26Å; A969-D972 PolarHBondContact O-N 2.97Å; A969-M973 WeakPolarHBondContact O-CG 3.33Å; A969-M973 PolarHBondContact O-N 3.28Å; A969-M994 HydrophobicContact CB-CE 4.22Å
970	F	95.8	Very high	89.6	Confident	1 Å²	1	51.7 Å²	51.7	0%	0.004	28%	0.279	C	S	.	.	H	α-helix	trans	-59.5	-43.3	172.2	157	-94.2	0	0	0	112.6	L913 V916 Y966 Y967 P968 D972 M973 V974 L991 F995 I1005	L913-F970 HydrophobicContact CD2-CE1 3.68Å; L913-F970 HydrophobicContact CD2-CZ 4.05Å; V916-F970 HydrophobicContact CB-CE1 4.38Å; V916-F970 HydrophobicContact CB-CZ 4.44Å; V916-F970 HydrophobicContact CG1-CD1 3.86Å; V916-F970 HydrophobicContact CG1-CD2 4.03Å; V916-F970 HydrophobicContact CG1-CE1 4Å; V916-F970 HydrophobicContact CG1-CE2 4.17Å; V916-F970 HydrophobicContact CG1-CG 3.88Å; V916-F970 HydrophobicContact CG1-CZ 4.17Å; V916-F970 HydrophobicContact CG2-CE2 4.44Å; V916-F970 HydrophobicContact CG2-CZ 4.28Å; Y966-F970 WeakPolarHBondContact O-CB 3.39Å; Y966-F970 PolarHBondContact O-N 3.48Å; Y966-F970 VanDerWaalsContact O-N 3.1Å; Y967-F970 HydrophobicContact CD2-CD1 4.02Å; Y967-F970 HydrophobicContact CE2-CD1 4.14Å; Y967-F970 HydrophobicContact CE2-CE1 4.26Å; Y967-F970 WeakPolarHBondContact O-CB 3.46Å; Y967-F970 PolarHBondContact O-N 3.23Å; P968-F970 VanDerWaalsContact C-N 3.31Å; P968-F970 PolarHBondContact O-N 3.46Å; F970-D972 VanDerWaalsContact C-N 3.32Å; F970-D972 PolarHBondContact O-N 2.98Å; F970-M973 WeakPolarHBondContact O-CB 3.36Å; F970-M973 PolarHBondContact O-N 3.49Å; F970-V974 HydrophobicContact CD2-CG2 4.36Å; F970-V974 HydrophobicContact CE1-CG2 4.39Å; F970-V974 HydrophobicContact CE2-CG2 3.8Å; F970-V974 HydrophobicContact CZ-CG2 3.81Å; F970-V974 WeakPolarHBondContact O-CG2 3.29Å; F970-V974 PolarHBondContact O-N 3.24Å; F970-L991 HydrophobicContact CD2-CD2 3.78Å; F970-L991 HydrophobicContact CE2-CD2 4.45Å; F970-F995 HydrophobicContact CB-CE2 4.13Å; F970-F995 HydrophobicContact CB-CZ 4.17Å; F970-F995 HydrophobicContact CD2-CE2 4.26Å; F970-F995 HydrophobicContact CG-CE2 4.42Å; F970-I1005 HydrophobicContact CE2-CD1 4.24Å; F970-I1005 HydrophobicContact CZ-CD1 3.68Å
971	L	95.8	Very high	90.9	Very high	7 Å²	7	48 Å²	48	4%	0.037	27%	0.266	C	S	.	.	H	α-helix	trans	-63.8	-38	176.8	-67.3	174.8	0	0	0	111.8	D701 L705 L913 Y967 P968 A969 V974 R975	D701-L971 HydrophobicContact CB-CD1 4.4Å; L705-L971 HydrophobicContact CD1-CD2 3.92Å; L705-L971 HydrophobicContact CG-CD2 4.48Å; L913-L971 HydrophobicContact CD2-CD2 4.06Å; Y967-L971 HydrophobicContact CD1-CD1 4.21Å; Y967-L971 HydrophobicContact CE1-CD1 3.66Å; Y967-L971 HydrophobicContact CE1-CG 4.22Å; Y967-L971 HydrophobicContact CE2-CD2 4.41Å; Y967-L971 HydrophobicContact CE2-CG 4.49Å; Y967-L971 PolarHBondContact O-N 2.9Å; P968-L971 WeakPolarHBondContact O-CB 3.43Å; P968-L971 PolarHBondContact O-N 3.29Å; P968-L971 VanDerWaalsContact O-N 3.09Å; A969-L971 PolarHBondContact O-N 3.26Å; L971-V974 PolarHBondContact O-N 2.98Å; L971-R975 WeakPolarHBondContact O-CG 3.29Å; L971-R975 PolarHBondContact O-N 3.48Å
972	D	95	Very high	91.7	Very high	88 Å²	88	47.5 Å²	47.5	47%	0.471	26%	0.262	S	S	.	.	H	α-helix	trans	-75.2	-31	178	-71.4	-17.8	0	0	0	112.8	P968 A969 F970 R975 S976	P968-D972 PolarHBondContact O-N 3.45Å; P968-D972 VanDerWaalsContact O-N 3.08Å; A969-D972 PolarHBondContact O-N 2.97Å; F970-D972 VanDerWaalsContact C-N 3.32Å; F970-D972 PolarHBondContact O-N 2.98Å; D972-R975 PolarHBondContact O-N 2.93Å; D972-R975 IonicContact OD1-CZ 2.58Å; D972-R975 IonicContact OD1-NE 3.26Å; D972-R975 PolarHBondContact OD1-NE 2.75Å; D972-R975 IonicContact OD1-NH2 3.83Å; D972-R975 PolarHBondContact OD1-NH2 2.86Å; D972-S976 WeakPolarHBondContact O-CB 3.44Å; D972-S976 PolarHBondContact O-N 3.34Å
973	M	94.9	Very high	92.4	Very high	28 Å²	28	45.3 Å²	45.3	14%	0.138	25%	0.254	C	S	.	.	H	α-helix	trans	-62.1	-42.7	165.8	-74.9	173.6	62.3	0	0	111.9	A969 F970 S976 L977 L982 Y987 T990 L991 M994	A969-M973 WeakPolarHBondContact O-CG 3.33Å; A969-M973 PolarHBondContact O-N 3.28Å; F970-M973 WeakPolarHBondContact O-CB 3.36Å; F970-M973 PolarHBondContact O-N 3.49Å; M973-S976 PolarHBondContact O-N 2.96Å; M973-L977 WeakPolarHBondContact O-CB 3.5Å; M973-L977 PolarHBondContact O-N 2.85Å; M973-L982 HydrophobicContact CB-CD2 4.45Å; M973-Y987 HydrophobicContact CB-CD2 4.08Å; M973-Y987 HydrophobicContact CB-CE2 4.06Å; M973-Y987 HydrophobicContact CE-CD2 3.91Å; M973-Y987 HydrophobicContact CE-CE2 4.36Å; M973-T990 HydrophobicContact CE-CG2 3.63Å; M973-T990 HydrophobicContact SD-CG2 3.9Å; M973-L991 HydrophobicContact CE-CD2 3.73Å; M973-L991 HydrophobicContact CE-CG 4.09Å; M973-L991 HydrophobicContact SD-CD2 4.37Å; M973-M994 HydrophobicContact SD-SD 3.71Å
974	V	96.8	Very high	93	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-62	-43.6	174	172.1	0	0	0	0	110.5	L705 F970 L971 S976 L977 L978 Y987 I1005 I1009	L705-V974 HydrophobicContact CD1-CG1 4.12Å; L705-V974 HydrophobicContact CD2-CB 4.4Å; L705-V974 HydrophobicContact CD2-CG1 3.96Å; F970-V974 HydrophobicContact CD2-CG2 4.36Å; F970-V974 HydrophobicContact CE1-CG2 4.39Å; F970-V974 HydrophobicContact CE2-CG2 3.8Å; F970-V974 HydrophobicContact CZ-CG2 3.81Å; F970-V974 WeakPolarHBondContact O-CG2 3.29Å; F970-V974 PolarHBondContact O-N 3.24Å; L971-V974 PolarHBondContact O-N 2.98Å; V974-S976 PolarHBondContact O-N 3.15Å; V974-L977 PolarHBondContact O-N 2.83Å; V974-L978 HydrophobicContact CG1-CD1 3.82Å; V974-L978 HydrophobicContact CG1-CG 4.32Å; V974-L978 WeakPolarHBondContact O-CB 3.2Å; V974-L978 VanDerWaalsContact O-CG 3.23Å; V974-L978 WeakPolarHBondContact O-CG 3.33Å; V974-L978 PolarHBondContact O-N 3.17Å; V974-Y987 HydrophobicContact CG2-CE2 4.01Å; V974-Y987 WeakPolarHBondContact CG2-OH 3.37Å; V974-I1005 HydrophobicContact CG1-CG2 4.1Å; V974-I1005 HydrophobicContact CG2-CG2 4.26Å; V974-I1009 HydrophobicContact CG1-CD1 4Å
975	R	95.6	Very high	93.5	Very high	42 Å²	42	45 Å²	45	16%	0.158	26%	0.261	C	S	.	.	H	α-helix	trans	-58.8	-45.4	173.8	-77.2	-172.8	-96.4	-100.1	3.2	112.3	L705 Y708 L971 D972 L977 L978 D979	L705-R975 HydrophobicContact CD2-CG 3.76Å; Y708-R975 HydrophobicContact CD1-CB 4.25Å; Y708-R975 HydrophobicContact CD1-CG 3.83Å; Y708-R975 VanDerWaalsContact CD2-CD 3.47Å; Y708-R975 HydrophobicContact CD2-CG 4.04Å; Y708-R975 HydrophobicContact CE1-CB 3.63Å; Y708-R975 HydrophobicContact CE1-CG 3.71Å; Y708-R975 HydrophobicContact CE2-CB 4.2Å; Y708-R975 HydrophobicContact CE2-CG 3.91Å; Y708-R975 HydrophobicContact CG-CG 4Å; L971-R975 WeakPolarHBondContact O-CG 3.29Å; L971-R975 PolarHBondContact O-N 3.48Å; D972-R975 PolarHBondContact O-N 2.93Å; D972-R975 IonicContact OD1-CZ 2.58Å; D972-R975 IonicContact OD1-NE 3.26Å; D972-R975 PolarHBondContact OD1-NE 2.75Å; D972-R975 IonicContact OD1-NH2 3.83Å; D972-R975 PolarHBondContact OD1-NH2 2.86Å; R975-L977 PolarHBondContact O-N 2.94Å; R975-L978 PolarHBondContact O-N 2.96Å; R975-D979 PolarHBondContact O-N 3.31Å
976	S	94.8	Very high	93.6	Very high	39 Å²	39	45.3 Å²	45.3	27%	0.273	26%	0.263	S	S	.	.	H	α-helix	trans	-63.7	-38.4	177.7	-166.2	0	0	0	0	113.1	D972 M973 V974 D979 G980 N981 L982	D972-S976 WeakPolarHBondContact O-CB 3.44Å; D972-S976 PolarHBondContact O-N 3.34Å; M973-S976 PolarHBondContact O-N 2.96Å; V974-S976 PolarHBondContact O-N 3.15Å; S976-D979 PolarHBondContact O-N 3.01Å; S976-G980 PolarHBondContact O-N 3Å; S976-N981 PolarHBondContact O-N 3.42Å; S976-L982 PolarHBondContact O-N 3.5Å
977	L	95.3	Very high	93.8	Very high	18 Å²	18	44.4 Å²	44.4	9%	0.094	26%	0.259	C	S	.	.	H	α-helix	trans	-66.5	-40.3	173.9	178	65.4	0	0	0	112.3	M973 V974 R975 D979 G980 L982 Y987 D1006	M973-L977 WeakPolarHBondContact O-CB 3.5Å; M973-L977 PolarHBondContact O-N 2.85Å; V974-L977 PolarHBondContact O-N 2.83Å; R975-L977 PolarHBondContact O-N 2.94Å; L977-D979 VanDerWaalsContact C-N 3.33Å; L977-G980 PolarHBondContact O-N 2.92Å; L977-G980 VanDerWaalsContact O-N 3.15Å; L977-L982 WeakPolarHBondContact CD1-O 3.43Å; L977-Y987 HydrophobicContact CB-CD2 4.32Å; L977-Y987 HydrophobicContact CD2-CD1 3.62Å; L977-Y987 HydrophobicContact CD2-CD2 3.92Å; L977-Y987 HydrophobicContact CD2-CE1 3.71Å; L977-Y987 HydrophobicContact CD2-CE2 4.03Å; L977-Y987 HydrophobicContact CD2-CG 3.71Å; L977-D1006 HydrophobicContact CD2-CB 3.74Å; L977-D1006 HydrophobicContact CG-CB 4.18Å
978	L	93.8	Very high	93.7	Very high	11 Å²	11	44.9 Å²	44.9	6%	0.058	26%	0.262	C	S	.	.	H	α-helix	trans	-69.2	-29.2	177.2	-70.4	169.2	0	0	0	113	H709 V974 R975 G980 D1006 I1009	H709-L978 HydrophobicContact CB-CB 4.49Å; H709-L978 HydrophobicContact CB-CD1 4.28Å; H709-L978 PolarHBondContact CE1-O 3.44Å; H709-L978 PolarHBondContact ND1-O 3.34Å; V974-L978 HydrophobicContact CG1-CD1 3.82Å; V974-L978 HydrophobicContact CG1-CG 4.32Å; V974-L978 WeakPolarHBondContact O-CB 3.2Å; V974-L978 VanDerWaalsContact O-CG 3.23Å; V974-L978 WeakPolarHBondContact O-CG 3.33Å; V974-L978 PolarHBondContact O-N 3.17Å; R975-L978 PolarHBondContact O-N 2.96Å; L978-G980 VanDerWaalsContact C-N 3.28Å; L978-D1006 HydrophobicContact CD2-CB 4.29Å; L978-I1009 HydrophobicContact CD1-CD1 3.88Å; L978-I1009 HydrophobicContact CD1-CG2 4.14Å; L978-I1009 HydrophobicContact CD2-CB 4.22Å; L978-I1009 HydrophobicContact CD2-CG2 3.97Å
979	D	91.2	Very high	93.6	Very high	54 Å²	54	43.6 Å²	43.6	29%	0.289	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.4	-6	172.1	-78.8	20.2	0	0	0	112.8	Y708 R712 R975 S976 L977 N981	Y708-D979 VanDerWaalsContact CE1-OD1 3.23Å; Y708-D979 WeakPolarHBondContact CE1-OD1 3.42Å; Y708-D979 PolarHBondContact OH-OD2 3.05Å; R712-D979 VanDerWaalsContact CD-CG 3.49Å; R712-D979 WeakPolarHBondContact CD-OD1 3.15Å; R712-D979 WeakPolarHBondContact CD-OD2 3.31Å; R712-D979 IonicContact CZ-OD1 3.52Å; R712-D979 IonicContact CZ-OD2 2.64Å; R712-D979 VanDerWaalsContact NE-CG 3.28Å; R712-D979 IonicContact NE-OD1 3.67Å; R712-D979 PolarHBondContact NE-OD1 2.89Å; R712-D979 IonicContact NE-OD2 3.4Å; R712-D979 PolarHBondContact NE-OD2 3.39Å; R712-D979 IonicContact NH2-OD2 2.75Å; R975-D979 PolarHBondContact O-N 3.31Å; S976-D979 PolarHBondContact O-N 3.01Å; L977-D979 VanDerWaalsContact C-N 3.33Å; D979-N981 VanDerWaalsContact C-N 3.25Å; D979-N981 WeakPolarHBondContact CB-ND2 3.27Å; D979-N981 PolarHBondContact O-N 3.01Å
980	G	90.4	Very high	93.4	Very high	62 Å²	62	45 Å²	45	64%	0.639	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.2	11	-177.7	0	0	0	0	0	114.6	S976 L977 L978 L982	S976-G980 PolarHBondContact O-N 3Å; L977-G980 PolarHBondContact O-N 2.92Å; L977-G980 VanDerWaalsContact O-N 3.15Å; L978-G980 VanDerWaalsContact C-N 3.28Å; G980-L982 VanDerWaalsContact C-N 3.31Å
981	N	91.2	Very high	93.2	Very high	126 Å²	126	45 Å²	45	67%	0.674	26%	0.257	S	S	*	.	S	Bend	trans	-77.8	-16.3	178.2	-67.5	-46.9	0	0	0	113	S976 D979	S976-N981 PolarHBondContact O-N 3.42Å; D979-N981 VanDerWaalsContact C-N 3.25Å; D979-N981 WeakPolarHBondContact CB-ND2 3.27Å; D979-N981 PolarHBondContact O-N 3.01Å
982	L	92.9	Very high	93	Very high	34 Å²	34	45 Å²	45	18%	0.178	26%	0.257	C	S	.	.	S	Bend	trans	-124.8	129.3	-179.6	-176.8	62.6	0	0	0	110.2	M973 S976 L977 G980 Q986 Y987	M973-L982 HydrophobicContact CB-CD2 4.45Å; S976-L982 PolarHBondContact O-N 3.5Å; L977-L982 WeakPolarHBondContact CD1-O 3.43Å; G980-L982 VanDerWaalsContact C-N 3.31Å; L982-Q986 HydrophobicContact CD1-CB 3.78Å; L982-Y987 HydrophobicContact CD2-CD2 3.99Å; L982-Y987 HydrophobicContact CD2-CG 4.4Å
983	D	94	Very high	92.6	Very high	88 Å²	88	45.9 Å²	45.9	47%	0.471	26%	0.258	S	S	.	.			trans	-70.5	142.3	177.5	-173.4	99.7	0	0	0	110.9	T985 Q986 Y987	D983-T985 PolarHBondContact O-N 3.36Å; D983-T985 VanDerWaalsContact O-N 3.1Å; D983-T985 WeakPolarHBondContact OD2-CA 3.35Å; D983-T985 WeakPolarHBondContact OD2-CB 3.36Å; D983-T985 PolarHBondContact OD2-N 3.45Å; D983-T985 PolarHBondContact OD2-OG1 3.28Å; D983-Q986 HydrophobicContact CB-CB 4.34Å; D983-Q986 HydrophobicContact CB-CG 4.11Å; D983-Q986 PolarHBondContact O-N 3.34Å; D983-Y987 PolarHBondContact O-N 3.09Å
984	S	92.1	Very high	92.3	Very high	35 Å²	35	44.8 Å²	44.8	25%	0.245	25%	0.253	C	S	.	.	H	α-helix	trans	-53.3	-33.7	177.7	177	0	0	0	0	112.8	K638 E988	K638-S984 PolarHBondContact NZ-OG 3.48Å; S984-E988 VanDerWaalsContact O-CG 3.32Å; S984-E988 WeakPolarHBondContact O-CG 3.35Å; S984-E988 PolarHBondContact O-N 3.04Å; S984-E988 VanDerWaalsContact O-N 3.09Å
985	T	91.2	Very high	92	Very high	79 Å²	79	45 Å²	45	49%	0.485	25%	0.254	S	S	.	.	H	α-helix	trans	-70.7	-43.6	179.2	-37.5	0	0	0	0	111.1	D983 E988 D989	D983-T985 PolarHBondContact O-N 3.36Å; D983-T985 VanDerWaalsContact O-N 3.1Å; D983-T985 WeakPolarHBondContact OD2-CA 3.35Å; D983-T985 WeakPolarHBondContact OD2-CB 3.36Å; D983-T985 PolarHBondContact OD2-N 3.45Å; D983-T985 PolarHBondContact OD2-OG1 3.28Å; T985-E988 PolarHBondContact O-N 2.85Å; T985-D989 WeakPolarHBondContact O-CB 3.3Å; T985-D989 PolarHBondContact O-N 3.47Å
986	Q	91.9	Very high	91.6	Very high	116 Å²	116	45.1 Å²	45.1	54%	0.542	26%	0.259	S	S	.	.	H	α-helix	trans	-67.6	-44.4	178.7	-67.2	173.8	-6.4	0	0	110.6	L982 D983 E988 D989 T990	L982-Q986 HydrophobicContact CD1-CB 3.78Å; D983-Q986 HydrophobicContact CB-CB 4.34Å; D983-Q986 HydrophobicContact CB-CG 4.11Å; D983-Q986 PolarHBondContact O-N 3.34Å; Q986-E988 PolarHBondContact O-N 2.97Å; Q986-D989 PolarHBondContact O-N 3.2Å; Q986-T990 PolarHBondContact O-N 2.81Å; Q986-T990 PolarHBondContact O-OG1 2.81Å
987	Y	94.6	Very high	91.2	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-54.6	-52.5	172.7	171.5	-99.8	0	0	0	112	M973 V974 L977 L982 D983 D989 T990 L991 G1002	M973-Y987 HydrophobicContact CB-CD2 4.08Å; M973-Y987 HydrophobicContact CB-CE2 4.06Å; M973-Y987 HydrophobicContact CE-CD2 3.91Å; M973-Y987 HydrophobicContact CE-CE2 4.36Å; V974-Y987 HydrophobicContact CG2-CE2 4.01Å; V974-Y987 WeakPolarHBondContact CG2-OH 3.37Å; L977-Y987 HydrophobicContact CB-CD2 4.32Å; L977-Y987 HydrophobicContact CD2-CD1 3.62Å; L977-Y987 HydrophobicContact CD2-CD2 3.92Å; L977-Y987 HydrophobicContact CD2-CE1 3.71Å; L977-Y987 HydrophobicContact CD2-CE2 4.03Å; L977-Y987 HydrophobicContact CD2-CG 3.71Å; L982-Y987 HydrophobicContact CD2-CD2 3.99Å; L982-Y987 HydrophobicContact CD2-CG 4.4Å; D983-Y987 PolarHBondContact O-N 3.09Å; Y987-D989 VanDerWaalsContact C-N 3.3Å; Y987-D989 PolarHBondContact O-N 2.87Å; Y987-T990 PolarHBondContact O-N 2.93Å; Y987-L991 HydrophobicContact CD1-CD1 4.15Å; Y987-L991 HydrophobicContact CE1-CD1 3.52Å; Y987-L991 HydrophobicContact CE1-CG 4.31Å; Y987-L991 HydrophobicContact CE2-CD1 4.08Å; Y987-L991 HydrophobicContact CE2-CD2 4.42Å; Y987-L991 HydrophobicContact CE2-CG 4.27Å; Y987-L991 VanDerWaalsContact CZ-CD1 3.48Å; Y987-L991 WeakPolarHBondContact O-CG 3.37Å; Y987-L991 PolarHBondContact O-N 2.77Å; Y987-G1002 WeakPolarHBondContact CE1-O 3.43Å; Y987-G1002 PolarHBondContact OH-O 2.82Å
988	E	92.9	Very high	91	Very high	23 Å²	23	48.9 Å²	48.9	11%	0.107	27%	0.274	C	S	.	.	H	α-helix	trans	-61.3	-37.7	178.7	-71.6	-175.8	-158.8	0	0	113	K638 S984 T985 Q986 L991 R992 F1003	K638-E988 IonicContact NZ-OE1 3.03Å; K638-E988 PolarHBondContact NZ-OE1 3.1Å; S984-E988 VanDerWaalsContact O-CG 3.32Å; S984-E988 WeakPolarHBondContact O-CG 3.35Å; S984-E988 PolarHBondContact O-N 3.04Å; S984-E988 VanDerWaalsContact O-N 3.09Å; T985-E988 PolarHBondContact O-N 2.85Å; Q986-E988 PolarHBondContact O-N 2.97Å; E988-L991 PolarHBondContact O-N 2.75Å; E988-R992 VanDerWaalsContact CB-NH1 3.28Å; E988-R992 WeakPolarHBondContact O-CG 3.18Å; E988-R992 PolarHBondContact O-N 3.27Å; E988-R992 IonicContact OE2-CZ 3.39Å; E988-R992 IonicContact OE2-NH1 3.73Å; E988-R992 PolarHBondContact OE2-NH1 3.38Å; E988-R992 VanDerWaalsContact OE2-NH1 3.13Å; E988-R992 IonicContact OE2-NH2 3.15Å; E988-R992 PolarHBondContact OE2-NH2 3.21Å; E988-F1003 HydrophobicContact CB-CD1 3.99Å; E988-F1003 HydrophobicContact CB-CE1 3.86Å; E988-F1003 HydrophobicContact CB-CZ 4.32Å; E988-F1003 HydrophobicContact CG-CB 4.14Å; E988-F1003 HydrophobicContact CG-CD1 3.57Å; E988-F1003 HydrophobicContact CG-CD2 4.22Å; E988-F1003 HydrophobicContact CG-CE1 3.95Å; E988-F1003 HydrophobicContact CG-CG 3.72Å; E988-F1003 HydrophobicContact CG-CZ 4.46Å
989	D	90.6	Very high	90.9	Very high	41 Å²	41	48.5 Å²	48.5	22%	0.219	27%	0.272	C	S	.	.	H	α-helix	trans	-69.8	-44.8	-178.3	-71.9	-16.9	0	0	0	112	K628 T985 Q986 Y987 L991 R992 E993	K628-D989 WeakPolarHBondContact CE-OD1 3.06Å; K628-D989 IonicContact NZ-OD1 3.02Å; K628-D989 PolarHBondContact NZ-OD1 2.92Å; K628-D989 IonicContact NZ-OD2 2.66Å; K628-D989 PolarHBondContact NZ-OD2 2.83Å; T985-D989 WeakPolarHBondContact O-CB 3.3Å; T985-D989 PolarHBondContact O-N 3.47Å; Q986-D989 PolarHBondContact O-N 3.2Å; Y987-D989 VanDerWaalsContact C-N 3.3Å; Y987-D989 PolarHBondContact O-N 2.87Å; D989-L991 VanDerWaalsContact C-N 3.3Å; D989-L991 PolarHBondContact O-N 3.5Å; D989-R992 WeakPolarHBondContact O-CA 3.44Å; D989-R992 WeakPolarHBondContact O-CB 3.35Å; D989-R992 PolarHBondContact O-N 2.77Å; D989-R992 IonicContact OD1-CZ 3.53Å; D989-R992 IonicContact OD1-NH1 3.51Å; D989-R992 PolarHBondContact OD1-NH1 3.36Å; D989-E993 PolarHBondContact O-N 2.91Å
990	T	90.8	Very high	91	Very high	53 Å²	53	47.9 Å²	47.9	33%	0.325	27%	0.266	S	S	.	.	H	α-helix	trans	-64.9	-33.1	172.5	-58.1	0	0	0	0	111.8	M973 Q986 Y987 R992 E993 M994	M973-T990 HydrophobicContact CE-CG2 3.63Å; M973-T990 HydrophobicContact SD-CG2 3.9Å; Q986-T990 PolarHBondContact O-N 2.81Å; Q986-T990 PolarHBondContact O-OG1 2.81Å; Y987-T990 PolarHBondContact O-N 2.93Å; T990-R992 VanDerWaalsContact C-N 3.33Å; T990-R992 PolarHBondContact O-N 3.49Å; T990-E993 WeakPolarHBondContact O-CB 3.48Å; T990-E993 PolarHBondContact O-N 3.07Å; T990-M994 HydrophobicContact CG2-SD 4.31Å; T990-M994 WeakPolarHBondContact O-CG 3.28Å; T990-M994 PolarHBondContact O-N 2.87Å
991	L	91.8	Very high	91.1	Very high	1 Å²	1	45.5 Å²	45.5	1%	0.005	24%	0.238	C	C	.	.	H	α-helix	trans	-64.5	-35.2	169.4	-69.9	-168.1	0	0	0	112.8	F970 M973 Y987 E988 D989 E993 M994 F995 A999 F1003	F970-L991 HydrophobicContact CD2-CD2 3.78Å; F970-L991 HydrophobicContact CE2-CD2 4.45Å; M973-L991 HydrophobicContact CE-CD2 3.73Å; M973-L991 HydrophobicContact CE-CG 4.09Å; M973-L991 HydrophobicContact SD-CD2 4.37Å; Y987-L991 HydrophobicContact CD1-CD1 4.15Å; Y987-L991 HydrophobicContact CE1-CD1 3.52Å; Y987-L991 HydrophobicContact CE1-CG 4.31Å; Y987-L991 HydrophobicContact CE2-CD1 4.08Å; Y987-L991 HydrophobicContact CE2-CD2 4.42Å; Y987-L991 HydrophobicContact CE2-CG 4.27Å; Y987-L991 VanDerWaalsContact CZ-CD1 3.48Å; Y987-L991 WeakPolarHBondContact O-CG 3.37Å; Y987-L991 PolarHBondContact O-N 2.77Å; E988-L991 PolarHBondContact O-N 2.75Å; D989-L991 VanDerWaalsContact C-N 3.3Å; D989-L991 PolarHBondContact O-N 3.5Å; L991-E993 VanDerWaalsContact C-N 3.31Å; L991-M994 PolarHBondContact O-N 2.83Å; L991-F995 HydrophobicContact CD2-CD2 3.97Å; L991-F995 HydrophobicContact CD2-CE2 3.9Å; L991-F995 PolarHBondContact O-N 2.99Å; L991-A999 VanDerWaalsContact C-CB 3.48Å; L991-A999 HydrophobicContact CB-CB 3.99Å; L991-A999 VanDerWaalsContact O-CB 3.25Å; L991-A999 WeakPolarHBondContact O-CB 3.31Å; L991-F1003 HydrophobicContact CB-CE1 4.24Å; L991-F1003 HydrophobicContact CD1-CD1 4.18Å; L991-F1003 HydrophobicContact CD1-CE1 4.47Å
992	R	91	Very high	91.3	Very high	8 Å²	8	39.6 Å²	39.6	3%	0.03	21%	0.207	C	C	.	.	H	α-helix	trans	-68	-30.4	173.3	-70.3	169.8	-176.5	106.7	12.8	111.9	L627 D631 E988 D989 T990 T996 A999 F1003	L627-R992 HydrophobicContact CB-CB 4.27Å; D631-R992 IonicContact OD2-CZ 3.61Å; D631-R992 IonicContact OD2-NE 2.73Å; D631-R992 PolarHBondContact OD2-NE 3.45Å; D631-R992 IonicContact OD2-NH2 2.7Å; D631-R992 PolarHBondContact OD2-NH2 2.85Å; E988-R992 VanDerWaalsContact CB-NH1 3.28Å; E988-R992 WeakPolarHBondContact O-CG 3.18Å; E988-R992 PolarHBondContact O-N 3.27Å; E988-R992 IonicContact OE2-CZ 3.39Å; E988-R992 IonicContact OE2-NH1 3.73Å; E988-R992 PolarHBondContact OE2-NH1 3.38Å; E988-R992 VanDerWaalsContact OE2-NH1 3.13Å; E988-R992 IonicContact OE2-NH2 3.15Å; E988-R992 PolarHBondContact OE2-NH2 3.21Å; D989-R992 WeakPolarHBondContact O-CA 3.44Å; D989-R992 WeakPolarHBondContact O-CB 3.35Å; D989-R992 PolarHBondContact O-N 2.77Å; D989-R992 IonicContact OD1-CZ 3.53Å; D989-R992 IonicContact OD1-NH1 3.51Å; D989-R992 PolarHBondContact OD1-NH1 3.36Å; T990-R992 VanDerWaalsContact C-N 3.33Å; T990-R992 PolarHBondContact O-N 3.49Å; R992-T996 WeakPolarHBondContact O-CA 3.48Å; R992-T996 PolarHBondContact O-N 3.26Å; R992-T996 VanDerWaalsContact O-N 3.07Å; R992-A999 HydrophobicContact CB-CB 4.49Å; R992-A999 HydrophobicContact CG-CB 4.03Å; R992-F1003 HydrophobicContact CG-CE1 4.49Å; R992-F1003 HydrophobicContact CG-CZ 4.03Å; R992-F1003 VanDerWaalsContact NH2-CZ 3.29Å
993	E	87.8	Confident	91.4	Very high	105 Å²	105	38 Å²	38	49%	0.491	20%	0.198	S	C	.	.	H	α-helix	trans	-68.8	-46	172.9	-69.4	165.6	167.4	0	0	111.7	L627 D989 T990 L991	L627-E993 HydrophobicContact CD1-CB 4.32Å; L627-E993 HydrophobicContact CD1-CG 3.42Å; L627-E993 VanDerWaalsContact CD1-CG 3.42Å; D989-E993 PolarHBondContact O-N 2.91Å; T990-E993 WeakPolarHBondContact O-CB 3.48Å; T990-E993 PolarHBondContact O-N 3.07Å; L991-E993 VanDerWaalsContact C-N 3.31Å
994	M	87.8	Confident	91.4	Very high	6 Å²	6	33.8 Å²	33.8	3%	0.03	18%	0.176	C	C	.	.	H	α-helix	trans	-72.3	-55.6	179.3	-63.3	170	76.8	0	0	112.8	Q923 Y966 A969 M973 T990 L991	Q923-M994 PolarHBondContact NE2-O 2.67Å; Y966-M994 HydrophobicContact CD1-CE 4.17Å; Y966-M994 HydrophobicContact CD2-CB 4.26Å; Y966-M994 HydrophobicContact CD2-CE 4.49Å; Y966-M994 HydrophobicContact CE2-CB 4.11Å; Y966-M994 WeakPolarHBondContact CE2-O 3.47Å; Y966-M994 HydrophobicContact CG-CE 4Å; Y966-M994 WeakPolarHBondContact O-CE 3.23Å; A969-M994 HydrophobicContact CB-CE 4.22Å; M973-M994 HydrophobicContact SD-SD 3.71Å; T990-M994 HydrophobicContact CG2-SD 4.31Å; T990-M994 WeakPolarHBondContact O-CG 3.28Å; T990-M994 PolarHBondContact O-N 2.87Å; L991-M994 PolarHBondContact O-N 2.83Å
995	F	89.3	Confident	91.6	Very high	5 Å²	5	32.1 Å²	32.1	2%	0.022	16%	0.164	C	C	.	.	H	α-helix	trans	-106.9	-2.2	-166.9	-57.6	-67.5	0	0	0	114.2	V916 Q919 A920 Y966 F970 L991 I997 H998 A999	V916-F995 HydrophobicContact CG1-CE1 4.11Å; V916-F995 HydrophobicContact CG1-CE2 4.06Å; V916-F995 HydrophobicContact CG1-CZ 3.75Å; Q919-F995 HydrophobicContact CB-CD1 4.5Å; Q919-F995 HydrophobicContact CG-CD1 4.07Å; A920-F995 HydrophobicContact CB-CE1 4.09Å; Y966-F995 HydrophobicContact CD2-CE1 4.12Å; F970-F995 HydrophobicContact CB-CE2 4.13Å; F970-F995 HydrophobicContact CB-CZ 4.17Å; F970-F995 HydrophobicContact CD2-CE2 4.26Å; F970-F995 HydrophobicContact CG-CE2 4.42Å; L991-F995 HydrophobicContact CD2-CD2 3.97Å; L991-F995 HydrophobicContact CD2-CE2 3.9Å; L991-F995 PolarHBondContact O-N 2.99Å; F995-I997 PolarHBondContact O-N 3.12Å; F995-H998 PolarHBondContact O-N 3.13Å; F995-H998 VanDerWaalsContact O-N 3.09Å; F995-A999 HydrophobicContact CB-CB 4.25Å
996	T	87.8	Confident	91.8	Very high	44 Å²	44	28.7 Å²	28.7	27%	0.27	14%	0.143	S	C	.	.	G	3₁₀ helix	trans	53	-127	176.6	71	0	0	0	0	112.7	R992 H998 A999	R992-T996 WeakPolarHBondContact O-CA 3.48Å; R992-T996 PolarHBondContact O-N 3.26Å; R992-T996 VanDerWaalsContact O-N 3.07Å; T996-H998 PolarHBondContact O-N 2.83Å; T996-A999 WeakPolarHBondContact O-CB 3.34Å; T996-A999 PolarHBondContact O-N 3.24Å; T996-A999 VanDerWaalsContact O-N 3.13Å
997	I	87.7	Confident	92	Very high	71 Å²	71	26.6 Å²	26.6	36%	0.364	13%	0.132	S	C	.	.	G	3₁₀ helix	trans	-65.5	-8	-179.2	65.2	173.2	0	0	0	114.3	L630 F995 Y1000	L630-I997 HydrophobicContact CB-CG2 3.94Å; F995-I997 PolarHBondContact O-N 3.12Å; I997-Y1000 VanDerWaalsContact O-CD1 3.25Å; I997-Y1000 WeakPolarHBondContact O-CD1 3.41Å; I997-Y1000 VanDerWaalsContact O-CE1 3.29Å; I997-Y1000 WeakPolarHBondContact O-CE1 3.39Å
998	H	89.8	Confident	92.1	Very high	65 Å²	65	26.6 Å²	26.6	30%	0.301	13%	0.132	S	C	.	.	G	3₁₀ helix	trans	-99.3	-5.7	177.7	-61.2	-67.5	0	0	0	113.3	Q919 F995 T996 Y1000 I1001	Q919-H998 VanDerWaalsContact CD-CD2 3.5Å; Q919-H998 HydrophobicContact CG-CB 3.94Å; Q919-H998 PolarHBondContact NE2-CD2 2.74Å; Q919-H998 VanDerWaalsContact NE2-CD2 3.28Å; F995-H998 PolarHBondContact O-N 3.13Å; F995-H998 VanDerWaalsContact O-N 3.09Å; T996-H998 PolarHBondContact O-N 2.83Å; H998-Y1000 PolarHBondContact O-N 2.82Å; H998-Y1000 VanDerWaalsContact O-N 3.15Å; H998-I1001 PolarHBondContact O-N 3.08Å
999	A	92.4	Very high	92.3	Very high	2 Å²	2	25.5 Å²	25.5	2%	0.017	13%	0.127	C	C	.	.	G	3₁₀ helix	trans	-55.9	-31.5	-178.2	0	0	0	0	0	114.2	L991 R992 F995 T996 I1001 G1002 F1003	L991-A999 VanDerWaalsContact C-CB 3.48Å; L991-A999 HydrophobicContact CB-CB 3.99Å; L991-A999 VanDerWaalsContact O-CB 3.25Å; L991-A999 WeakPolarHBondContact O-CB 3.31Å; R992-A999 HydrophobicContact CB-CB 4.49Å; R992-A999 HydrophobicContact CG-CB 4.03Å; F995-A999 HydrophobicContact CB-CB 4.25Å; T996-A999 WeakPolarHBondContact O-CB 3.34Å; T996-A999 PolarHBondContact O-N 3.24Å; T996-A999 VanDerWaalsContact O-N 3.13Å; A999-I1001 PolarHBondContact O-N 3.46Å; A999-G1002 PolarHBondContact O-N 3.49Å; A999-F1003 VanDerWaalsContact C-CE1 3.45Å; A999-F1003 HydrophobicContact CB-CE1 3.67Å; A999-F1003 HydrophobicContact CB-CZ 3.87Å; A999-F1003 VanDerWaalsContact O-CD1 3.3Å; A999-F1003 WeakPolarHBondContact O-CD1 3.4Å; A999-F1003 VanDerWaalsContact O-CE1 3.31Å; A999-F1003 WeakPolarHBondContact O-CE1 3.46Å
1000	Y	92.9	Very high	92.5	Very high	42 Å²	42	27 Å²	27	17%	0.165	13%	0.133	C	C	.	.	G	3₁₀ helix	trans	-56.8	-26.3	-175	70.7	-96	0	0	0	114.5	Q633 F637 I997 H998 G1002 F1003	Q633-Y1000 HydrophobicContact CB-CD1 3.75Å; Q633-Y1000 HydrophobicContact CB-CD2 4.43Å; Q633-Y1000 HydrophobicContact CB-CE1 3.97Å; Q633-Y1000 HydrophobicContact CB-CG 4Å; Q633-Y1000 HydrophobicContact CG-CD1 4.32Å; Q633-Y1000 HydrophobicContact CG-CE1 4.06Å; F637-Y1000 HydrophobicContact CB-CD2 4.18Å; F637-Y1000 AromaticContact CD1-CD2 3.87Å; F637-Y1000 HydrophobicContact CD1-CD2 3.87Å; F637-Y1000 WeakPolarHBondContact CD1-O 3.35Å; F637-Y1000 AromaticContact CD2-CD2 3.83Å; F637-Y1000 HydrophobicContact CD2-CD2 3.83Å; F637-Y1000 HydrophobicContact CD2-CE2 4.07Å; F637-Y1000 HydrophobicContact CE1-CD2 4.21Å; F637-Y1000 WeakPolarHBondContact CE1-O 3.38Å; F637-Y1000 HydrophobicContact CE2-CD2 4.17Å; F637-Y1000 HydrophobicContact CE2-CE2 4.28Å; F637-Y1000 AromaticContact CG-CD2 3.67Å; F637-Y1000 HydrophobicContact CG-CD2 3.67Å; F637-Y1000 HydrophobicContact CG-CE2 4.36Å; F637-Y1000 HydrophobicContact CZ-CD2 4.36Å; I997-Y1000 VanDerWaalsContact O-CD1 3.25Å; I997-Y1000 WeakPolarHBondContact O-CD1 3.41Å; I997-Y1000 VanDerWaalsContact O-CE1 3.29Å; I997-Y1000 WeakPolarHBondContact O-CE1 3.39Å; H998-Y1000 PolarHBondContact O-N 2.82Å; H998-Y1000 VanDerWaalsContact O-N 3.15Å; Y1000-G1002 PolarHBondContact O-N 3.28Å; Y1000-F1003 PolarHBondContact O-N 2.88Å
1001	I	93.2	Very high	92.8	Very high	12 Å²	12	26.8 Å²	26.8	6%	0.062	13%	0.129	C	C	.	.	G	3₁₀ helix	trans	-59.5	-28.1	177.7	-58.9	174.9	0	0	0	111.1	R912 R915 V916 H998 A999	R912-I1001 HydrophobicContact CB-CG2 4.07Å; R912-I1001 HydrophobicContact CG-CG2 4.1Å; R915-I1001 HydrophobicContact CB-CD1 4.28Å; R915-I1001 HydrophobicContact CB-CG2 4.21Å; V916-I1001 HydrophobicContact CG2-CB 4.45Å; V916-I1001 HydrophobicContact CG2-CG2 4.08Å; H998-I1001 PolarHBondContact O-N 3.08Å; A999-I1001 PolarHBondContact O-N 3.46Å
1002	G	93.7	Very high	93.1	Very high	1 Å²	1	26.8 Å²	26.8	1%	0.01	13%	0.129	C	C	.	.	G	3₁₀ helix	trans	-89.6	-17.9	-180	0	0	0	0	0	116.4	Y987 A999 Y1000 T1004 I1005	Y987-G1002 WeakPolarHBondContact CE1-O 3.43Å; Y987-G1002 PolarHBondContact OH-O 2.82Å; A999-G1002 PolarHBondContact O-N 3.49Å; Y1000-G1002 PolarHBondContact O-N 3.28Å; G1002-T1004 PolarHBondContact O-N 3.39Å; G1002-I1005 PolarHBondContact O-N 2.95Å
1003	F	95.1	Very high	93.3	Very high	1 Å²	1	26.6 Å²	26.6	0%	0.004	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-12.6	-165.1	-65.7	-7.4	0	0	0	116.2	D631 E988 L991 R992 A999 Y1000	D631-F1003 WeakPolarHBondContact OD2-CE2 3.16Å; D631-F1003 WeakPolarHBondContact OD2-CZ 3.31Å; E988-F1003 HydrophobicContact CB-CD1 3.99Å; E988-F1003 HydrophobicContact CB-CE1 3.86Å; E988-F1003 HydrophobicContact CB-CZ 4.32Å; E988-F1003 HydrophobicContact CG-CB 4.14Å; E988-F1003 HydrophobicContact CG-CD1 3.57Å; E988-F1003 HydrophobicContact CG-CD2 4.22Å; E988-F1003 HydrophobicContact CG-CE1 3.95Å; E988-F1003 HydrophobicContact CG-CG 3.72Å; E988-F1003 HydrophobicContact CG-CZ 4.46Å; L991-F1003 HydrophobicContact CB-CE1 4.24Å; L991-F1003 HydrophobicContact CD1-CD1 4.18Å; L991-F1003 HydrophobicContact CD1-CE1 4.47Å; R992-F1003 HydrophobicContact CG-CE1 4.49Å; R992-F1003 HydrophobicContact CG-CZ 4.03Å; R992-F1003 VanDerWaalsContact NH2-CZ 3.29Å; A999-F1003 VanDerWaalsContact C-CE1 3.45Å; A999-F1003 HydrophobicContact CB-CE1 3.67Å; A999-F1003 HydrophobicContact CB-CZ 3.87Å; A999-F1003 VanDerWaalsContact O-CD1 3.3Å; A999-F1003 WeakPolarHBondContact O-CD1 3.4Å; A999-F1003 VanDerWaalsContact O-CE1 3.31Å; A999-F1003 WeakPolarHBondContact O-CE1 3.46Å; Y1000-F1003 PolarHBondContact O-N 2.88Å
1004	T	95.5	Very high	93.6	Very high	0 Å²	0	29 Å²	29	0%	0	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	-130.6	11	-177.1	47.5	0	0	0	0	112.7	K638 D641 M642 R912 G1002 D1006 K1007 V1008	K638-T1004 HydrophobicContact CB-CG2 4.38Å; K638-T1004 HydrophobicContact CG-CG2 3.79Å; D641-T1004 VanDerWaalsContact OD2-CB 3.25Å; D641-T1004 WeakPolarHBondContact OD2-CB 3.31Å; D641-T1004 PolarHBondContact OD2-OG1 3.44Å; M642-T1004 HydrophobicContact CG-CG2 4.44Å; R912-T1004 PolarHBondContact NH1-OG1 3.24Å; G1002-T1004 PolarHBondContact O-N 3.39Å; T1004-D1006 PolarHBondContact O-N 3.02Å; T1004-K1007 WeakPolarHBondContact O-CA 3.49Å; T1004-K1007 WeakPolarHBondContact O-CB 3.3Å; T1004-K1007 PolarHBondContact O-N 3.28Å; T1004-V1008 WeakPolarHBondContact O-CG2 3.47Å; T1004-V1008 PolarHBondContact O-N 2.79Å
1005	I	96.1	Very high	94	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-61.3	-32.6	177.7	-75.2	178.4	0	0	0	111.2	L909 R912 F970 V974 G1002 K1007 V1008 I1009	L909-I1005 HydrophobicContact CD1-CG2 3.93Å; R912-I1005 HydrophobicContact CB-CD1 3.99Å; R912-I1005 HydrophobicContact CB-CG1 4.27Å; F970-I1005 HydrophobicContact CE2-CD1 4.24Å; F970-I1005 HydrophobicContact CZ-CD1 3.68Å; V974-I1005 HydrophobicContact CG1-CG2 4.1Å; V974-I1005 HydrophobicContact CG2-CG2 4.26Å; G1002-I1005 PolarHBondContact O-N 2.95Å; I1005-K1007 PolarHBondContact O-N 2.83Å; I1005-V1008 PolarHBondContact O-N 3.02Å; I1005-I1009 HydrophobicContact CG2-CD1 3.8Å; I1005-I1009 WeakPolarHBondContact O-CG1 3.33Å; I1005-I1009 PolarHBondContact O-N 2.98Å
1006	D	95.4	Very high	94.3	Very high	6 Å²	6	28.9 Å²	28.9	3%	0.032	13%	0.133	C	C	.	.	H	α-helix	trans	-58.6	-45.7	169.6	73.8	-43.5	0	0	0	111.6	L977 L978 T1004 I1009 H1010	L977-D1006 HydrophobicContact CD2-CB 3.74Å; L977-D1006 HydrophobicContact CG-CB 4.18Å; L978-D1006 HydrophobicContact CD2-CB 4.29Å; T1004-D1006 PolarHBondContact O-N 3.02Å; D1006-I1009 PolarHBondContact O-N 3.22Å; D1006-H1010 PolarHBondContact O-N 2.8Å; D1006-H1010 PolarHBondContact O-ND1 3.06Å
1007	K	95.8	Very high	94.6	Very high	73 Å²	73	29.4 Å²	29.4	32%	0.317	13%	0.132	S	C	.	.	H	α-helix	trans	-67.5	-35.7	179	-52.6	-45.6	176.4	-150.8	0	112.1	T1004 I1005 N1011	T1004-K1007 WeakPolarHBondContact O-CA 3.49Å; T1004-K1007 WeakPolarHBondContact O-CB 3.3Å; T1004-K1007 PolarHBondContact O-N 3.28Å; I1005-K1007 PolarHBondContact O-N 2.83Å; K1007-N1011 WeakPolarHBondContact O-CB 3.45Å; K1007-N1011 VanDerWaalsContact O-CG 3.29Å; K1007-N1011 PolarHBondContact O-N 2.95Å
1008	V	97.4	Very high	94.8	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-59.4	-50.2	170.8	-179.5	0	0	0	0	110	L645 T908 L909 T1004 I1005 N1011 I1012	L645-V1008 HydrophobicContact CD1-CG2 3.63Å; L645-V1008 HydrophobicContact CD2-CG2 3.86Å; L645-V1008 HydrophobicContact CG-CG2 4.42Å; T908-V1008 HydrophobicContact CG2-CG2 4.4Å; L909-V1008 HydrophobicContact CB-CG1 3.84Å; L909-V1008 HydrophobicContact CD1-CG1 4.5Å; T1004-V1008 WeakPolarHBondContact O-CG2 3.47Å; T1004-V1008 PolarHBondContact O-N 2.79Å; I1005-V1008 PolarHBondContact O-N 3.02Å; V1008-N1011 PolarHBondContact O-N 3.2Å; V1008-I1012 HydrophobicContact CG1-CD1 3.87Å; V1008-I1012 HydrophobicContact CG1-CG1 4.46Å; V1008-I1012 WeakPolarHBondContact O-CG1 3.09Å; V1008-I1012 PolarHBondContact O-N 3.22Å
1009	I	96.7	Very high	95.1	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-66.3	-40.7	-178.3	-66.7	166.1	0	0	0	111.9	L705 L909 V974 L978 I1005 D1006 N1011 I1012 I1013	L705-I1009 HydrophobicContact CB-CD1 4.12Å; L705-I1009 HydrophobicContact CD1-CD1 4.18Å; L909-I1009 HydrophobicContact CD1-CD1 4.18Å; L909-I1009 HydrophobicContact CD1-CG1 4.02Å; L909-I1009 HydrophobicContact CD2-CG1 3.98Å; V974-I1009 HydrophobicContact CG1-CD1 4Å; L978-I1009 HydrophobicContact CD1-CD1 3.88Å; L978-I1009 HydrophobicContact CD1-CG2 4.14Å; L978-I1009 HydrophobicContact CD2-CB 4.22Å; L978-I1009 HydrophobicContact CD2-CG2 3.97Å; I1005-I1009 HydrophobicContact CG2-CD1 3.8Å; I1005-I1009 WeakPolarHBondContact O-CG1 3.33Å; I1005-I1009 PolarHBondContact O-N 2.98Å; D1006-I1009 PolarHBondContact O-N 3.22Å; I1009-N1011 VanDerWaalsContact C-N 3.34Å; I1009-N1011 PolarHBondContact O-N 3.3Å; I1009-I1012 PolarHBondContact O-N 3.45Å; I1009-I1013 HydrophobicContact CG2-CD1 4.34Å; I1009-I1013 WeakPolarHBondContact O-CG1 3.31Å; I1009-I1013 PolarHBondContact O-N 2.83Å
1010	H	95	Very high	95.2	Very high	73 Å²	73	27.4 Å²	27.4	34%	0.338	12%	0.122	S	C	.	.	H	α-helix	trans	-61	-41	173.9	-77.7	78.4	0	0	0	112.1	H709 D1006 I1013 R1014	H709-H1010 AromaticContact NE2-CD2 4Å; H709-H1010 AromaticContact NE2-CE1 3.71Å; H709-H1010 AromaticContact NE2-NE2 3.65Å; D1006-H1010 PolarHBondContact O-N 2.8Å; D1006-H1010 PolarHBondContact O-ND1 3.06Å; H1010-I1013 PolarHBondContact O-N 3.49Å; H1010-R1014 PolarHBondContact O-N 3.01Å; H1010-R1014 VanDerWaalsContact O-N 3.08Å
1011	N	96.5	Very high	95.1	Very high	48 Å²	48	29.5 Å²	29.5	26%	0.257	14%	0.142	S	C	.	.	H	α-helix	trans	-68.7	-39.7	176	-73.2	-3.3	0	0	0	111.7	L645 L905 K1007 V1008 I1009 I1013 R1014 Q1015	L645-N1011 PolarHBondContact O-ND2 3.41Å; L905-N1011 HydrophobicContact CD1-CB 3.89Å; L905-N1011 HydrophobicContact CD2-CB 4.2Å; K1007-N1011 WeakPolarHBondContact O-CB 3.45Å; K1007-N1011 VanDerWaalsContact O-CG 3.29Å; K1007-N1011 PolarHBondContact O-N 2.95Å; V1008-N1011 PolarHBondContact O-N 3.2Å; I1009-N1011 VanDerWaalsContact C-N 3.34Å; I1009-N1011 PolarHBondContact O-N 3.3Å; N1011-I1013 VanDerWaalsContact C-N 3.34Å; N1011-I1013 PolarHBondContact O-N 3.08Å; N1011-R1014 PolarHBondContact O-N 2.94Å; N1011-Q1015 WeakPolarHBondContact O-CB 3.36Å; N1011-Q1015 PolarHBondContact O-N 3.36Å
1012	I	97.4	Very high	95.1	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-57.8	-46.2	173.5	-72.4	168.8	0	0	0	110.8	I706 F902 L905 L909 V1008 I1009 Q1015 L1016	I706-I1012 HydrophobicContact CD1-CD1 4.43Å; I706-I1012 HydrophobicContact CD1-CG2 3.85Å; I706-I1012 HydrophobicContact CG1-CG2 4Å; I706-I1012 HydrophobicContact CG2-CG2 4.38Å; F902-I1012 HydrophobicContact CD2-CG2 4.19Å; F902-I1012 HydrophobicContact CE2-CG2 3.95Å; L905-I1012 HydrophobicContact CB-CD1 4.33Å; L905-I1012 HydrophobicContact CB-CG1 3.59Å; L909-I1012 HydrophobicContact CB-CD1 3.96Å; L909-I1012 HydrophobicContact CD2-CD1 3.78Å; V1008-I1012 HydrophobicContact CG1-CD1 3.87Å; V1008-I1012 HydrophobicContact CG1-CG1 4.46Å; V1008-I1012 WeakPolarHBondContact O-CG1 3.09Å; V1008-I1012 PolarHBondContact O-N 3.22Å; I1009-I1012 PolarHBondContact O-N 3.45Å; I1012-Q1015 PolarHBondContact O-N 2.99Å; I1012-L1016 HydrophobicContact CG2-CD1 3.6Å; I1012-L1016 HydrophobicContact CG2-CG 4.31Å; I1012-L1016 WeakPolarHBondContact O-CB 3.32Å; I1012-L1016 WeakPolarHBondContact O-CG 3.43Å; I1012-L1016 PolarHBondContact O-N 3.35Å
1013	I	95.3	Very high	95	Very high	5 Å²	5	37 Å²	37	3%	0.026	18%	0.178	C	C	.	.	H	α-helix	trans	-68.1	-39.3	-179.2	-68	-179.2	0	0	0	112.1	H709 V710 I716 I1009 H1010 N1011 Q1015 L1016 Q1017	H709-I1013 HydrophobicContact CB-CD1 3.84Å; H709-I1013 WeakPolarHBondContact CD2-CD1 3.21Å; V710-I1013 HydrophobicContact CB-CD1 4.49Å; V710-I1013 HydrophobicContact CG2-CD1 3.6Å; V710-I1013 HydrophobicContact CG2-CG1 3.68Å; V710-I1013 HydrophobicContact CG2-CG2 4.25Å; I716-I1013 HydrophobicContact CD1-CG2 3.74Å; I1009-I1013 HydrophobicContact CG2-CD1 4.34Å; I1009-I1013 WeakPolarHBondContact O-CG1 3.31Å; I1009-I1013 PolarHBondContact O-N 2.83Å; H1010-I1013 PolarHBondContact O-N 3.49Å; N1011-I1013 VanDerWaalsContact C-N 3.34Å; N1011-I1013 PolarHBondContact O-N 3.08Å; I1013-Q1015 VanDerWaalsContact C-N 3.28Å; I1013-Q1015 PolarHBondContact O-N 3.02Å; I1013-L1016 PolarHBondContact O-N 3.4Å; I1013-Q1017 WeakPolarHBondContact O-CG 3.24Å; I1013-Q1017 PolarHBondContact O-N 2.89Å
1014	R	94.8	Very high	94.9	Very high	154 Å²	154	38.7 Å²	38.7	58%	0.581	19%	0.188	S	C	*	.	H	α-helix	trans	-59.5	-42.7	171.6	-175.3	-178.9	-61.9	179.1	1	111.2	H1010 N1011 Q1017 H1018	H1010-R1014 PolarHBondContact O-N 3.01Å; H1010-R1014 VanDerWaalsContact O-N 3.08Å; N1011-R1014 PolarHBondContact O-N 2.94Å; R1014-Q1017 WeakPolarHBondContact O-CB 3.32Å; R1014-Q1017 PolarHBondContact O-N 3.18Å; R1014-H1018 PolarHBondContact O-CD2 2.93Å; R1014-H1018 PolarHBondContact O-N 3.17Å
1015	Q	95.8	Very high	94.8	Very high	10 Å²	10	38.7 Å²	38.7	5%	0.047	19%	0.188	C	C	.	.	H	α-helix	trans	-68	-36.8	178.5	-160.7	58.9	62.7	0	0	112	N898 F901 F902 N1011 I1012 I1013 Q1017 H1018 L1019	N898-Q1015 VanDerWaalsContact CA-NE2 3.33Å; N898-Q1015 VanDerWaalsContact O-CG 3.25Å; N898-Q1015 WeakPolarHBondContact O-CG 3.48Å; N898-Q1015 PolarHBondContact O-NE2 3.17Å; N898-Q1015 PolarHBondContact OD1-NE2 3.43Å; F901-Q1015 HydrophobicContact CB-CG 4.01Å; F902-Q1015 HydrophobicContact CB-CB 4.47Å; F902-Q1015 HydrophobicContact CB-CG 3.85Å; N1011-Q1015 WeakPolarHBondContact O-CB 3.36Å; N1011-Q1015 PolarHBondContact O-N 3.36Å; I1012-Q1015 PolarHBondContact O-N 2.99Å; I1013-Q1015 VanDerWaalsContact C-N 3.28Å; I1013-Q1015 PolarHBondContact O-N 3.02Å; Q1015-Q1017 VanDerWaalsContact C-N 3.34Å; Q1015-Q1017 PolarHBondContact O-N 3.21Å; Q1015-H1018 WeakPolarHBondContact O-CB 3.49Å; Q1015-H1018 PolarHBondContact O-N 3.49Å; Q1015-L1019 WeakPolarHBondContact O-CG 3.23Å; Q1015-L1019 PolarHBondContact O-N 2.83Å
1016	L	96	Very high	94.6	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-65	-32.7	173.4	-76.5	163	0	0	0	113.1	I706 I724 I727 I728 F902 I1012 I1013 L1019 V1020	I706-L1016 HydrophobicContact CG2-CD1 3.64Å; I724-L1016 HydrophobicContact CD1-CB 4.02Å; I724-L1016 HydrophobicContact CG1-CB 4.04Å; I724-L1016 HydrophobicContact CG2-CB 4.11Å; I724-L1016 HydrophobicContact CG2-CD1 3.96Å; I724-L1016 HydrophobicContact CG2-CD2 4.28Å; I724-L1016 HydrophobicContact CG2-CG 4.35Å; I727-L1016 HydrophobicContact CG2-CD2 4.04Å; I728-L1016 HydrophobicContact CD1-CD1 4.06Å; I728-L1016 HydrophobicContact CD1-CD2 4.08Å; I728-L1016 HydrophobicContact CG1-CD1 4.2Å; I728-L1016 HydrophobicContact CG1-CD2 4.27Å; F902-L1016 HydrophobicContact CD2-CD2 3.95Å; F902-L1016 HydrophobicContact CD2-CG 3.93Å; F902-L1016 HydrophobicContact CE2-CD1 4.08Å; F902-L1016 HydrophobicContact CE2-CD2 3.7Å; F902-L1016 HydrophobicContact CE2-CG 3.88Å; F902-L1016 HydrophobicContact CZ-CD2 4.25Å; I1012-L1016 HydrophobicContact CG2-CD1 3.6Å; I1012-L1016 HydrophobicContact CG2-CG 4.31Å; I1012-L1016 WeakPolarHBondContact O-CB 3.32Å; I1012-L1016 WeakPolarHBondContact O-CG 3.43Å; I1012-L1016 PolarHBondContact O-N 3.35Å; I1013-L1016 PolarHBondContact O-N 3.4Å; L1016-L1019 HydrophobicContact CD2-CD1 4.24Å; L1016-L1019 PolarHBondContact O-N 3.27Å; L1016-V1020 PolarHBondContact O-N 3.16Å
1017	Q	93.7	Very high	94.4	Very high	54 Å²	54	45.1 Å²	45.1	25%	0.252	22%	0.22	S	C	.	.	H	α-helix	trans	-61.8	-49.8	169.3	-68.6	159.2	-2.1	0	0	110.2	I716 I1013 R1014 Q1015 L1019 V1020 S1021	I716-Q1017 HydrophobicContact CD1-CG 4.26Å; I716-Q1017 HydrophobicContact CG1-CG 4.28Å; I716-Q1017 VanDerWaalsContact CG1-NE2 3.32Å; I1013-Q1017 WeakPolarHBondContact O-CG 3.24Å; I1013-Q1017 PolarHBondContact O-N 2.89Å; R1014-Q1017 WeakPolarHBondContact O-CB 3.32Å; R1014-Q1017 PolarHBondContact O-N 3.18Å; Q1015-Q1017 VanDerWaalsContact C-N 3.34Å; Q1015-Q1017 PolarHBondContact O-N 3.21Å; Q1017-L1019 VanDerWaalsContact C-N 3.31Å; Q1017-L1019 PolarHBondContact O-N 3.07Å; Q1017-V1020 WeakPolarHBondContact O-CG2 3.42Å; Q1017-V1020 PolarHBondContact O-N 3.09Å; Q1017-V1020 VanDerWaalsContact O-N 3.16Å; Q1017-S1021 PolarHBondContact O-N 3.42Å; Q1017-S1021 PolarHBondContact O-OG 2.86Å
1018	H	93.4	Very high	94.3	Very high	88 Å²	88	41.7 Å²	41.7	41%	0.407	21%	0.205	S	C	.	.	H	α-helix	trans	-58	-41.9	175	-65.3	-58	0	0	0	112	R1014 Q1015 V1020 S1021 D1022	R1014-H1018 PolarHBondContact O-CD2 2.93Å; R1014-H1018 PolarHBondContact O-N 3.17Å; Q1015-H1018 WeakPolarHBondContact O-CB 3.49Å; Q1015-H1018 PolarHBondContact O-N 3.49Å; H1018-V1020 PolarHBondContact O-N 3.3Å; H1018-S1021 PolarHBondContact O-N 3.38Å; H1018-D1022 WeakPolarHBondContact O-CB 3.37Å; H1018-D1022 PolarHBondContact O-N 3.35Å
1019	L	94.8	Very high	94.1	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-62.7	-20	178.2	-71.1	-174.8	0	0	0	115.5	N898 W899 F902 Q1015 L1016 Q1017 C1025	N898-L1019 HydrophobicContact CB-CD2 3.96Å; W899-L1019 HydrophobicContact CB-CD2 4.25Å; W899-L1019 HydrophobicContact CD2-CD1 3.92Å; W899-L1019 HydrophobicContact CD2-CD2 3.68Å; W899-L1019 HydrophobicContact CD2-CG 4.45Å; W899-L1019 HydrophobicContact CE3-CD1 3.81Å; W899-L1019 HydrophobicContact CE3-CD2 4.4Å; W899-L1019 HydrophobicContact CG-CD2 3.58Å; W899-L1019 HydrophobicContact CH2-CD1 3.99Å; W899-L1019 HydrophobicContact CZ2-CD1 4.08Å; W899-L1019 HydrophobicContact CZ2-CD2 4.35Å; W899-L1019 HydrophobicContact CZ3-CD1 3.86Å; F902-L1019 HydrophobicContact CB-CD1 3.76Å; F902-L1019 HydrophobicContact CD1-CD1 4.04Å; F902-L1019 HydrophobicContact CD2-CD1 4.37Å; F902-L1019 HydrophobicContact CG-CD1 3.78Å; Q1015-L1019 WeakPolarHBondContact O-CG 3.23Å; Q1015-L1019 PolarHBondContact O-N 2.83Å; L1016-L1019 HydrophobicContact CD2-CD1 4.24Å; L1016-L1019 PolarHBondContact O-N 3.27Å; Q1017-L1019 VanDerWaalsContact C-N 3.31Å; Q1017-L1019 PolarHBondContact O-N 3.07Å; L1019-C1025 HydrophobicContact CD2-CB 3.98Å; L1019-C1025 VanDerWaalsContact CD2-SG 3.5Å
1020	V	94.1	Very high	93.9	Very high	9 Å²	9	47.9 Å²	47.9	6%	0.055	24%	0.239	C	C	.	.	H	α-helix	trans	-105.7	-18.2	177.7	-58.1	0	0	0	0	113.8	D720 H723 I724 I727 L1016 Q1017 H1018	D720-V1020 HydrophobicContact CB-CG2 3.99Å; H723-V1020 HydrophobicContact CB-CB 4.06Å; H723-V1020 HydrophobicContact CB-CG1 3.61Å; I724-V1020 HydrophobicContact CD1-CG2 4.28Å; I724-V1020 HydrophobicContact CG1-CG1 3.78Å; I724-V1020 HydrophobicContact CG1-CG2 4.11Å; I727-V1020 HydrophobicContact CD1-CG1 3.68Å; L1016-V1020 PolarHBondContact O-N 3.16Å; Q1017-V1020 WeakPolarHBondContact O-CG2 3.42Å; Q1017-V1020 PolarHBondContact O-N 3.09Å; Q1017-V1020 VanDerWaalsContact O-N 3.16Å; H1018-V1020 PolarHBondContact O-N 3.3Å
1021	S	91.2	Very high	93.9	Very high	86 Å²	86	45.6 Å²	45.6	60%	0.601	23%	0.229	S	C	*	.	H	α-helix	trans	-96.6	-15.9	175.6	-51.7	0	0	0	0	114.3	Q1017 H1018	Q1017-S1021 PolarHBondContact O-N 3.42Å; Q1017-S1021 PolarHBondContact O-OG 2.86Å; H1018-S1021 PolarHBondContact O-N 3.38Å
1022	D	92.6	Very high	93.8	Very high	36 Å²	36	43.4 Å²	43.4	19%	0.193	22%	0.217	C	C	.	.			trans	-91.3	119	178.4	177	5.3	0	0	0	110.8	N898 H1018 V1024 C1025 L1026	N898-D1022 PolarHBondContact ND2-OD2 3.35Å; H1018-D1022 WeakPolarHBondContact O-CB 3.37Å; H1018-D1022 PolarHBondContact O-N 3.35Å; D1022-V1024 VanDerWaalsContact C-N 3.3Å; D1022-V1024 PolarHBondContact O-N 2.89Å; D1022-V1024 WeakPolarHBondContact OD1-CB 3.34Å; D1022-V1024 PolarHBondContact OD1-N 2.8Å; D1022-C1025 HydrophobicContact CB-CB 4.02Å; D1022-C1025 WeakPolarHBondContact O-CB 3.37Å; D1022-C1025 PolarHBondContact O-N 2.99Å; D1022-C1025 PolarHBondContact OD2-SG 3.48Å; D1022-L1026 PolarHBondContact O-N 2.98Å
1023	E	91.7	Very high	93.5	Very high	133 Å²	133	46 Å²	46	62%	0.621	23%	0.231	S	C	*	.	H	α-helix	trans	-62	-36.7	-179.5	-160.5	-170.8	144.1	0	0	112.1	C1025 L1026 Q1027	E1023-C1025 VanDerWaalsContact C-N 3.3Å; E1023-C1025 PolarHBondContact O-N 2.87Å; E1023-L1026 PolarHBondContact O-N 2.99Å; E1023-L1026 VanDerWaalsContact O-N 3.16Å; E1023-Q1027 HydrophobicContact CG-CG 4.46Å; E1023-Q1027 WeakPolarHBondContact O-CG 3.18Å; E1023-Q1027 PolarHBondContact O-N 3.34Å; E1023-Q1027 PolarHBondContact OE1-NE2 3.48Å
1024	V	92.9	Very high	93.3	Very high	37 Å²	37	47.9 Å²	47.9	22%	0.224	25%	0.247	C	C	.	.	H	α-helix	trans	-63.7	-40.4	178.8	-177.8	0	0	0	0	110.1	D1022 L1026 Q1027 V1028 I1065 M1066	D1022-V1024 VanDerWaalsContact C-N 3.3Å; D1022-V1024 PolarHBondContact O-N 2.89Å; D1022-V1024 WeakPolarHBondContact OD1-CB 3.34Å; D1022-V1024 PolarHBondContact OD1-N 2.8Å; V1024-L1026 VanDerWaalsContact C-N 3.28Å; V1024-L1026 PolarHBondContact O-N 3.26Å; V1024-Q1027 PolarHBondContact O-N 3.22Å; V1024-V1028 HydrophobicContact CG1-CG2 4.43Å; V1024-V1028 VanDerWaalsContact O-CB 3.32Å; V1024-V1028 WeakPolarHBondContact O-CB 3.49Å; V1024-V1028 VanDerWaalsContact O-CG2 3.24Å; V1024-V1028 WeakPolarHBondContact O-CG2 3.17Å; V1024-V1028 PolarHBondContact O-N 3.24Å; V1024-I1065 HydrophobicContact CG1-CG2 4.15Å; V1024-M1066 HydrophobicContact CG1-CG 4.01Å
1025	C	93.4	Very high	93.1	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-62.9	-32.5	176.6	-73.3	0	0	0	0	113.5	N896 N898 W899 L1019 D1022 E1023 V1029	N896-C1025 PolarHBondContact ND2-SG 3.42Å; N896-C1025 PolarHBondContact OD1-SG 3.47Å; N898-C1025 WeakPolarHBondContact CB-SG 3.49Å; W899-C1025 PolarHBondContact NE1-O 3.31Å; W899-C1025 VanDerWaalsContact NE1-O 3.13Å; L1019-C1025 HydrophobicContact CD2-CB 3.98Å; L1019-C1025 VanDerWaalsContact CD2-SG 3.5Å; D1022-C1025 HydrophobicContact CB-CB 4.02Å; D1022-C1025 WeakPolarHBondContact O-CB 3.37Å; D1022-C1025 PolarHBondContact O-N 2.99Å; D1022-C1025 PolarHBondContact OD2-SG 3.48Å; E1023-C1025 VanDerWaalsContact C-N 3.3Å; E1023-C1025 PolarHBondContact O-N 2.87Å; C1025-V1029 WeakPolarHBondContact O-CG2 3.34Å
1026	L	92.3	Very high	92.7	Very high	65 Å²	65	43.4 Å²	43.4	34%	0.34	23%	0.23	S	C	.	.	H	α-helix	trans	-77.2	-49.5	176.6	-62.2	175.4	0	0	0	111.1	D1022 E1023 V1024 V1028 V1029 D1030	D1022-L1026 PolarHBondContact O-N 2.98Å; E1023-L1026 PolarHBondContact O-N 2.99Å; E1023-L1026 VanDerWaalsContact O-N 3.16Å; V1024-L1026 VanDerWaalsContact C-N 3.28Å; V1024-L1026 PolarHBondContact O-N 3.26Å; L1026-V1028 PolarHBondContact O-N 3.04Å; L1026-V1029 WeakPolarHBondContact O-CB 3.48Å; L1026-V1029 PolarHBondContact O-N 2.94Å; L1026-D1030 PolarHBondContact O-N 3.13Å
1027	Q	92.6	Very high	92.2	Very high	77 Å²	77	52.2 Å²	52.2	36%	0.36	27%	0.268	S	S	.	.	H	α-helix	trans	-56.1	-37.3	176.9	-69.2	-175.7	21.3	0	0	112.3	E1023 V1024 D1030 L1031 I1065	E1023-Q1027 HydrophobicContact CG-CG 4.46Å; E1023-Q1027 WeakPolarHBondContact O-CG 3.18Å; E1023-Q1027 PolarHBondContact O-N 3.34Å; E1023-Q1027 PolarHBondContact OE1-NE2 3.48Å; V1024-Q1027 PolarHBondContact O-N 3.22Å; Q1027-D1030 PolarHBondContact O-N 3.26Å; Q1027-L1031 WeakPolarHBondContact O-CB 3.39Å; Q1027-L1031 PolarHBondContact O-N 3.24Å; Q1027-I1065 HydrophobicContact CB-CD1 4.49Å; Q1027-I1065 HydrophobicContact CB-CG2 4.21Å
1028	V	93.3	Very high	91.5	Very high	1 Å²	1	54.9 Å²	54.9	1%	0.006	28%	0.276	C	S	.	.	H	α-helix	trans	-64.5	-38.6	175.3	160.4	0	0	0	0	112.7	F893 F894 V1024 L1026 Y1032 I1065 M1066	F893-V1028 HydrophobicContact CE2-CG1 3.66Å; F893-V1028 HydrophobicContact CZ-CG1 4.03Å; F894-V1028 VanDerWaalsContact O-CG1 3.25Å; F894-V1028 WeakPolarHBondContact O-CG1 3.41Å; V1024-V1028 HydrophobicContact CG1-CG2 4.43Å; V1024-V1028 VanDerWaalsContact O-CB 3.32Å; V1024-V1028 WeakPolarHBondContact O-CB 3.49Å; V1024-V1028 VanDerWaalsContact O-CG2 3.24Å; V1024-V1028 WeakPolarHBondContact O-CG2 3.17Å; V1024-V1028 PolarHBondContact O-N 3.24Å; L1026-V1028 PolarHBondContact O-N 3.04Å; V1028-Y1032 PolarHBondContact O-N 3.28Å; V1028-Y1032 VanDerWaalsContact O-N 3.08Å; V1028-I1065 HydrophobicContact CG2-CG2 4.16Å; V1028-M1066 HydrophobicContact CG2-CE 4.18Å; V1028-M1066 HydrophobicContact CG2-CG 4.14Å; V1028-M1066 HydrophobicContact CG2-SD 3.89Å
1029	V	93.3	Very high	91	Very high	23 Å²	23	51.9 Å²	51.9	14%	0.139	27%	0.269	C	S	.	.	H	α-helix	trans	-66.5	-45.2	174.4	167.5	0	0	0	0	111	F731 F893 W899 C1025 L1026 Y1032 L1033	F731-V1029 HydrophobicContact CD2-CG1 4.14Å; F731-V1029 HydrophobicContact CE1-CG2 4.2Å; F731-V1029 HydrophobicContact CE2-CB 4.5Å; F731-V1029 HydrophobicContact CE2-CG1 3.72Å; F731-V1029 HydrophobicContact CE2-CG2 4.34Å; F731-V1029 HydrophobicContact CZ-CB 4.47Å; F731-V1029 HydrophobicContact CZ-CG1 4.16Å; F731-V1029 HydrophobicContact CZ-CG2 3.94Å; F893-V1029 HydrophobicContact CZ-CG2 4.36Å; W899-V1029 HydrophobicContact CH2-CG2 4.29Å; W899-V1029 HydrophobicContact CZ2-CG2 3.38Å; C1025-V1029 WeakPolarHBondContact O-CG2 3.34Å; L1026-V1029 WeakPolarHBondContact O-CB 3.48Å; L1026-V1029 PolarHBondContact O-N 2.94Å; V1029-Y1032 WeakPolarHBondContact O-CB 3.23Å; V1029-Y1032 PolarHBondContact O-N 3.25Å; V1029-L1033 HydrophobicContact CG1-CD1 3.97Å; V1029-L1033 HydrophobicContact CG1-CG 4.41Å; V1029-L1033 WeakPolarHBondContact O-CG 3.25Å; V1029-L1033 PolarHBondContact O-N 2.97Å
1030	D	93	Very high	90.5	Very high	106 Å²	106	51.9 Å²	51.9	57%	0.567	27%	0.269	S	S	*	.	H	α-helix	trans	-67.8	-38	-179.6	-74.3	-34.5	0	0	0	112.3	L1026 Q1027 L1033 A1034	L1026-D1030 PolarHBondContact O-N 3.13Å; Q1027-D1030 PolarHBondContact O-N 3.26Å; D1030-L1033 PolarHBondContact O-N 2.89Å; D1030-A1034 WeakPolarHBondContact O-CB 3.45Å; D1030-A1034 PolarHBondContact O-N 3.33Å
1031	L	93.6	Very high	90.2	Very high	26 Å²	26	51.5 Å²	51.5	14%	0.136	27%	0.267	C	S	.	.	H	α-helix	trans	-59.8	-45.9	171.1	-178.9	66.5	0	0	0	111.1	Q1027 L1033 A1034 E1035 Y1058 K1061 A1062 I1065	Q1027-L1031 WeakPolarHBondContact O-CB 3.39Å; Q1027-L1031 PolarHBondContact O-N 3.24Å; L1031-L1033 PolarHBondContact O-N 3.29Å; L1031-A1034 PolarHBondContact O-N 3.31Å; L1031-E1035 HydrophobicContact CD1-CG 3.94Å; L1031-E1035 HydrophobicContact CG-CG 4.38Å; L1031-E1035 WeakPolarHBondContact O-CB 3.48Å; L1031-E1035 WeakPolarHBondContact O-CG 3.48Å; L1031-E1035 PolarHBondContact O-N 2.86Å; L1031-Y1058 HydrophobicContact CD2-CD2 3.97Å; L1031-Y1058 HydrophobicContact CD2-CE2 3.8Å; L1031-Y1058 HydrophobicContact CG-CD2 3.99Å; L1031-Y1058 HydrophobicContact CG-CE2 3.76Å; L1031-K1061 HydrophobicContact CD1-CB 4.05Å; L1031-K1061 HydrophobicContact CD1-CD 4.1Å; L1031-K1061 HydrophobicContact CD2-CB 3.88Å; L1031-A1062 HydrophobicContact CD2-CB 3.98Å; L1031-I1065 HydrophobicContact CB-CD1 4.34Å; L1031-I1065 HydrophobicContact CD2-CD1 3.9Å
1032	Y	94.4	Very high	89.9	Confident	1 Å²	1	48.1 Å²	48.1	0%	0.004	25%	0.245	C	C	.	.	H	α-helix	trans	-59.4	-45.2	174.5	167.3	-99.4	0	0	0	112.1	F731 L735 L892 F893 V1028 V1029 A1034 E1035 R1036 A1041 Y1058	F731-Y1032 AromaticContact CE2-CD1 3.56Å; F731-Y1032 HydrophobicContact CE2-CD1 3.56Å; F731-Y1032 AromaticContact CE2-CE1 3.73Å; F731-Y1032 HydrophobicContact CE2-CE1 3.73Å; F731-Y1032 AromaticContact CZ-CD1 3.77Å; F731-Y1032 HydrophobicContact CZ-CD1 3.77Å; F731-Y1032 HydrophobicContact CZ-CE1 4.04Å; L735-Y1032 HydrophobicContact CD2-CE1 4.2Å; L735-Y1032 HydrophobicContact CD2-CE2 4.22Å; L735-Y1032 WeakPolarHBondContact CD2-OH 3.3Å; L892-Y1032 WeakPolarHBondContact O-CD2 3.37Å; L892-Y1032 VanDerWaalsContact O-CE2 3.3Å; L892-Y1032 WeakPolarHBondContact O-CE2 3.49Å; F893-Y1032 HydrophobicContact CB-CD2 4.07Å; F893-Y1032 HydrophobicContact CB-CE2 4.23Å; F893-Y1032 AromaticContact CD2-CD2 3.76Å; F893-Y1032 HydrophobicContact CD2-CD2 3.76Å; F893-Y1032 AromaticContact CD2-CG 3.73Å; F893-Y1032 HydrophobicContact CD2-CG 3.73Å; F893-Y1032 HydrophobicContact CE2-CG 4.09Å; F893-Y1032 HydrophobicContact CG-CD2 4.16Å; F893-Y1032 HydrophobicContact CG-CG 4.42Å; V1028-Y1032 PolarHBondContact O-N 3.28Å; V1028-Y1032 VanDerWaalsContact O-N 3.08Å; V1029-Y1032 WeakPolarHBondContact O-CB 3.23Å; V1029-Y1032 PolarHBondContact O-N 3.25Å; Y1032-A1034 VanDerWaalsContact C-N 3.34Å; Y1032-A1034 PolarHBondContact O-N 3.04Å; Y1032-E1035 PolarHBondContact O-N 3.38Å; Y1032-R1036 WeakPolarHBondContact O-CB 3.47Å; Y1032-R1036 PolarHBondContact O-N 3.37Å; Y1032-A1041 HydrophobicContact CD2-CB 3.68Å; Y1032-A1041 HydrophobicContact CE2-CB 3.71Å; Y1032-Y1058 WeakPolarHBondContact CB-OH 3.49Å
1033	L	91.6	Very high	89.5	Confident	54 Å²	54	47.2 Å²	47.2	28%	0.283	24%	0.244	S	C	.	.	H	α-helix	trans	-67	-33.7	179.4	-68.8	174.8	0	0	0	112.6	F731 V1029 D1030 L1031 K1037	F731-L1033 HydrophobicContact CE2-CD2 4.42Å; V1029-L1033 HydrophobicContact CG1-CD1 3.97Å; V1029-L1033 HydrophobicContact CG1-CG 4.41Å; V1029-L1033 WeakPolarHBondContact O-CG 3.25Å; V1029-L1033 PolarHBondContact O-N 2.97Å; D1030-L1033 PolarHBondContact O-N 2.89Å; L1031-L1033 PolarHBondContact O-N 3.29Å; L1033-K1037 WeakPolarHBondContact O-CG 3.42Å; L1033-K1037 PolarHBondContact O-N 2.96Å
1034	A	90.8	Very high	89.1	Confident	45 Å²	45	43.4 Å²	43.4	37%	0.372	23%	0.228	S	C	.	.	H	α-helix	trans	-69.5	-49.7	173	0	0	0	0	0	111.9	D1030 L1031 Y1032 R1036 K1037 R1038	D1030-A1034 WeakPolarHBondContact O-CB 3.45Å; D1030-A1034 PolarHBondContact O-N 3.33Å; L1031-A1034 PolarHBondContact O-N 3.31Å; Y1032-A1034 VanDerWaalsContact C-N 3.34Å; Y1032-A1034 PolarHBondContact O-N 3.04Å; A1034-R1036 VanDerWaalsContact C-N 3.3Å; A1034-R1036 PolarHBondContact O-N 3.48Å; A1034-K1037 WeakPolarHBondContact O-CB 3.33Å; A1034-K1037 PolarHBondContact O-N 3.49Å; A1034-K1037 VanDerWaalsContact O-N 3.14Å; A1034-R1038 WeakPolarHBondContact O-CG 3.44Å; A1034-R1038 PolarHBondContact O-N 2.88Å; A1034-R1038 VanDerWaalsContact O-N 3.12Å
1035	E	90.6	Very high	88.6	Confident	5 Å²	5	44.6 Å²	44.6	2%	0.023	23%	0.233	C	C	.	.	H	α-helix	trans	-72.3	-23.2	-179	-67.2	-62.7	166.4	0	0	112.3	L1031 Y1032 R1038 G1039 A1040 A1041 Y1058 K1061	L1031-E1035 HydrophobicContact CD1-CG 3.94Å; L1031-E1035 HydrophobicContact CG-CG 4.38Å; L1031-E1035 WeakPolarHBondContact O-CB 3.48Å; L1031-E1035 WeakPolarHBondContact O-CG 3.48Å; L1031-E1035 PolarHBondContact O-N 2.86Å; Y1032-E1035 PolarHBondContact O-N 3.38Å; E1035-R1038 VanDerWaalsContact CD-NH1 3.27Å; E1035-R1038 CarbonylContact O-C 3.57Å; E1035-R1038 PolarHBondContact O-N 3.34Å; E1035-R1038 IonicContact OE1-CZ 3.66Å; E1035-R1038 IonicContact OE1-NH1 2.83Å; E1035-R1038 PolarHBondContact OE1-NH1 2.82Å; E1035-R1038 WeakPolarHBondContact OE2-CD 3.31Å; E1035-R1038 IonicContact OE2-CZ 3.16Å; E1035-R1038 IonicContact OE2-NE 3.39Å; E1035-R1038 IonicContact OE2-NH1 2.73Å; E1035-R1038 PolarHBondContact OE2-NH1 3.23Å; E1035-G1039 PolarHBondContact O-N 2.95Å; E1035-A1040 HydrophobicContact CB-CB 4.14Å; E1035-A1040 PolarHBondContact O-N 3.01Å; E1035-A1041 HydrophobicContact CB-CB 4.48Å; E1035-A1041 PolarHBondContact O-N 3.49Å; E1035-Y1058 HydrophobicContact CB-CD1 4.18Å; E1035-Y1058 HydrophobicContact CB-CD2 3.95Å; E1035-Y1058 HydrophobicContact CB-CE2 4.36Å; E1035-Y1058 HydrophobicContact CB-CG 3.89Å; E1035-Y1058 HydrophobicContact CG-CD2 3.7Å; E1035-Y1058 HydrophobicContact CG-CE2 4.37Å; E1035-Y1058 HydrophobicContact CG-CG 3.92Å; E1035-K1061 IonicContact OE1-NZ 3.39Å; E1035-K1061 PolarHBondContact OE1-NZ 3.03Å
1036	R	86.8	Confident	87.9	Confident	65 Å²	65	49.4 Å²	49.4	25%	0.245	27%	0.266	C	S	.	.	H	α-helix	trans	-63.2	-45.7	165.6	-177.1	177	129.3	-179.1	3.7	111.7	D734 D877 Y1032 A1034 R1038 G1039 A1041	D734-R1036 IonicContact OD2-CZ 3.14Å; D734-R1036 IonicContact OD2-NH1 3.31Å; D734-R1036 PolarHBondContact OD2-NH1 2.91Å; D734-R1036 IonicContact OD2-NH2 2.63Å; D734-R1036 PolarHBondContact OD2-NH2 3.39Å; D877-R1036 IonicContact OD2-NH2 2.75Å; D877-R1036 PolarHBondContact OD2-NH2 2.76Å; Y1032-R1036 WeakPolarHBondContact O-CB 3.47Å; Y1032-R1036 PolarHBondContact O-N 3.37Å; A1034-R1036 VanDerWaalsContact C-N 3.3Å; A1034-R1036 PolarHBondContact O-N 3.48Å; R1036-R1038 PolarHBondContact O-N 3.04Å; R1036-G1039 PolarHBondContact O-N 2.97Å; R1036-A1041 HydrophobicContact CB-CB 3.93Å
1037	K	85.6	Confident	87.2	Confident	185 Å²	185	47.8 Å²	47.8	80%	0.804	26%	0.261	S	S	*	.	H	α-helix	trans	-62.8	-30.1	174.1	-68	164.8	-176.7	171.8	0	112.2	L1033 A1034 G1039	L1033-K1037 WeakPolarHBondContact O-CG 3.42Å; L1033-K1037 PolarHBondContact O-N 2.96Å; A1034-K1037 WeakPolarHBondContact O-CB 3.33Å; A1034-K1037 PolarHBondContact O-N 3.49Å; A1034-K1037 VanDerWaalsContact O-N 3.14Å; K1037-G1039 VanDerWaalsContact C-N 3.34Å
1038	R	80.8	Confident	86.5	Confident	111 Å²	111	47.3 Å²	47.3	42%	0.419	26%	0.258	S	S	.	.	H	α-helix	trans	-81	-10.1	174.8	-61.5	173	86.6	-133.4	15.8	113.5	A1034 E1035 R1036 E1111	A1034-R1038 WeakPolarHBondContact O-CG 3.44Å; A1034-R1038 PolarHBondContact O-N 2.88Å; A1034-R1038 VanDerWaalsContact O-N 3.12Å; E1035-R1038 VanDerWaalsContact CD-NH1 3.27Å; E1035-R1038 CarbonylContact O-C 3.57Å; E1035-R1038 PolarHBondContact O-N 3.34Å; E1035-R1038 IonicContact OE1-CZ 3.66Å; E1035-R1038 IonicContact OE1-NH1 2.83Å; E1035-R1038 PolarHBondContact OE1-NH1 2.82Å; E1035-R1038 WeakPolarHBondContact OE2-CD 3.31Å; E1035-R1038 IonicContact OE2-CZ 3.16Å; E1035-R1038 IonicContact OE2-NE 3.39Å; E1035-R1038 IonicContact OE2-NH1 2.73Å; E1035-R1038 PolarHBondContact OE2-NH1 3.23Å; R1036-R1038 PolarHBondContact O-N 3.04Å; R1038-E1111 IonicContact CZ-OE1 3.64Å; R1038-E1111 VanDerWaalsContact CZ-OE1 3.26Å; R1038-E1111 IonicContact NH1-OE1 2.77Å; R1038-E1111 PolarHBondContact NH1-OE1 3.24Å; R1038-E1111 IonicContact NH2-OE1 3.53Å; R1038-E1111 PolarHBondContact NH2-OE1 3.31Å; R1038-E1111 IonicContact NH2-OE2 2.81Å; R1038-E1111 PolarHBondContact NH2-OE2 2.78Å
1039	G	81.4	Confident	85.5	Confident	24 Å²	24	52.4 Å²	52.4	25%	0.247	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	79.9	14.5	-179	0	0	0	0	0	114.8	E1035 R1036 K1037 R1051	E1035-G1039 PolarHBondContact O-N 2.95Å; R1036-G1039 PolarHBondContact O-N 2.97Å; K1037-G1039 VanDerWaalsContact C-N 3.34Å; G1039-R1051 PolarHBondContact O-NH1 2.96Å
1040	A	85.3	Confident	84.5	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	30%	0.301	C	S	.	.			trans	-90	-27.8	178.2	0	0	0	0	0	112.9	E1035 G1042 W1054 E1055	E1035-A1040 HydrophobicContact CB-CB 4.14Å; E1035-A1040 PolarHBondContact O-N 3.01Å; A1040-G1042 PolarHBondContact O-N 3.38Å; A1040-W1054 HydrophobicContact CB-CB 3.82Å; A1040-E1055 WeakPolarHBondContact O-CG 3.32Å
1041	A	88.3	Confident	83.8	Confident	2 Å²	2	49.5 Å²	49.5	2%	0.017	28%	0.277	C	S	.	.	S	Bend	trans	-83.1	38	-179.6	0	0	0	0	0	114.6	L892 Y1032 E1035 R1036 Y1058	L892-A1041 PolarHBondContact N-O 2.86Å; Y1032-A1041 HydrophobicContact CD2-CB 3.68Å; Y1032-A1041 HydrophobicContact CE2-CB 3.71Å; E1035-A1041 HydrophobicContact CB-CB 4.48Å; E1035-A1041 PolarHBondContact O-N 3.49Å; R1036-A1041 HydrophobicContact CB-CB 3.93Å; A1041-Y1058 HydrophobicContact CB-CD1 4.32Å; A1041-Y1058 HydrophobicContact CB-CE1 3.85Å
1042	G	84.1	Confident	83	Confident	14 Å²	14	50.2 Å²	50.2	14%	0.144	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	100.9	175	176.8	0	0	0	0	0	116.1	Y890 A1040 R1051	Y890-G1042 CarbonylContact O-C 3.11Å; Y890-G1042 VanDerWaalsContact O-C 3.27Å; Y890-G1042 VanDerWaalsContact O-CA 3.3Å; Y890-G1042 WeakPolarHBondContact O-CA 3.43Å; A1040-G1042 PolarHBondContact O-N 3.38Å; G1042-R1051 VanDerWaalsContact C-NH2 3.32Å; G1042-R1051 PolarHBondContact O-NH1 3.28Å
1043	G	84.3	Confident	82.2	Confident	17 Å²	17	52 Å²	52	18%	0.175	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	159.7	-142.8	-174.7	0	0	0	0	0	111.4	V889 Y890 R1051	V889-G1043 CarbonylContact C-O 3.18Å; V889-G1043 WeakPolarHBondContact CA-O 3.43Å; Y890-G1043 WeakPolarHBondContact CD1-O 3.27Å; Y890-G1043 WeakPolarHBondContact CE1-O 3.42Å; Y890-G1043 PolarHBondContact N-O 2.72Å; Y890-G1043 PolarHBondContact O-N 2.89Å; G1043-R1051 VanDerWaalsContact CA-NH2 3.3Å
1044	N	83.8	Confident	81.7	Confident	53 Å²	53	52.8 Å²	52.8	28%	0.283	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	133.1	179.8	-168.1	-73.2	0	0	0	112.5	S1046 S1047	N1044-S1046 PolarHBondContact O-N 3.03Å; N1044-S1046 WeakPolarHBondContact OD1-CB 3.48Å; N1044-S1046 PolarHBondContact OD1-N 2.73Å; N1044-S1046 PolarHBondContact OD1-OG 3.08Å; N1044-S1047 PolarHBondContact O-N 2.84Å; N1044-S1047 PolarHBondContact O-OG 3.28Å
1045	L	82.3	Confident	81.6	Confident	63 Å²	63	51.4 Å²	51.4	33%	0.33	29%	0.287	S	S	.	.	G	3₁₀ helix	trans	-51.5	-40.4	177.4	-81.7	168.6	0	0	0	112.9	G888 Y890 S1047 Q1048 I1077	G888-L1045 PolarHBondContact O-N 2.71Å; Y890-L1045 HydrophobicContact CD1-CB 4.47Å; Y890-L1045 HydrophobicContact CD1-CD2 3.69Å; Y890-L1045 HydrophobicContact CD1-CG 3.81Å; Y890-L1045 HydrophobicContact CE1-CD2 4.06Å; Y890-L1045 HydrophobicContact CE1-CG 4.34Å; Y890-L1045 HydrophobicContact CG-CD2 4.38Å; L1045-S1047 PolarHBondContact O-N 2.9Å; L1045-S1047 VanDerWaalsContact O-N 3.14Å; L1045-Q1048 WeakPolarHBondContact O-CB 3.44Å; L1045-Q1048 PolarHBondContact O-N 3.34Å; L1045-Q1048 VanDerWaalsContact O-N 3.12Å; L1045-I1077 HydrophobicContact CD1-CG2 3.88Å
1046	S	77.4	Confident	81.3	Confident	100 Å²	100	53.5 Å²	53.5	70%	0.699	30%	0.3	S	S	*	.	G	3₁₀ helix	trans	-66.8	-13.1	-179.8	68.8	0	0	0	0	114.5	N1044	N1044-S1046 PolarHBondContact O-N 3.03Å; N1044-S1046 WeakPolarHBondContact OD1-CB 3.48Å; N1044-S1046 PolarHBondContact OD1-N 2.73Å; N1044-S1046 PolarHBondContact OD1-OG 3.08Å
1047	S	78	Confident	81.2	Confident	32 Å²	32	50.6 Å²	50.6	22%	0.224	29%	0.29	C	S	.	.	G	3₁₀ helix	trans	-100.9	-2	174.9	70.1	0	0	0	0	114.2	N1044 L1045 C1049 V1050 R1051	N1044-S1047 PolarHBondContact O-N 2.84Å; N1044-S1047 PolarHBondContact O-OG 3.28Å; L1045-S1047 PolarHBondContact O-N 2.9Å; L1045-S1047 VanDerWaalsContact O-N 3.14Å; S1047-C1049 VanDerWaalsContact C-N 3.34Å; S1047-C1049 PolarHBondContact O-N 2.83Å; S1047-V1050 WeakPolarHBondContact O-CB 3.46Å; S1047-V1050 PolarHBondContact O-N 2.69Å; S1047-R1051 PolarHBondContact O-N 2.89Å; S1047-R1051 PolarHBondContact OG-NE 3.32Å
1048	Q	77.8	Confident	81.5	Confident	66 Å²	66	41.9 Å²	41.9	31%	0.308	25%	0.252	S	S	.	.	H	α-helix	trans	-53.1	-47.6	-177.5	-174.8	168.5	29.5	0	0	112.6	Y890 L1045 V1050 R1051 A1052 E1055	Y890-Q1048 HydrophobicContact CE1-CB 4.38Å; Y890-Q1048 WeakPolarHBondContact OH-CB 3.42Å; Y890-Q1048 WeakPolarHBondContact OH-CG 3.45Å; L1045-Q1048 WeakPolarHBondContact O-CB 3.44Å; L1045-Q1048 PolarHBondContact O-N 3.34Å; L1045-Q1048 VanDerWaalsContact O-N 3.12Å; Q1048-V1050 PolarHBondContact O-N 3.1Å; Q1048-V1050 VanDerWaalsContact O-N 3.1Å; Q1048-R1051 CarbonylContact O-C 3.5Å; Q1048-R1051 WeakPolarHBondContact O-CA 3.35Å; Q1048-R1051 PolarHBondContact O-N 3.14Å; Q1048-A1052 PolarHBondContact O-N 3.18Å; Q1048-E1055 WeakPolarHBondContact CG-OE2 3.3Å; Q1048-E1055 PolarHBondContact NE2-OE2 2.51Å
1049	C	72.8	Confident	82	Confident	109 Å²	109	38.7 Å²	38.7	74%	0.736	24%	0.242	S	C	*	.	H	α-helix	trans	-63.5	-18.9	-179.5	64.8	0	0	0	0	114.9	S1047	S1047-C1049 VanDerWaalsContact C-N 3.34Å; S1047-C1049 PolarHBondContact O-N 2.83Å
1050	V	71.9	Confident	82.2	Confident	51 Å²	51	40.6 Å²	40.6	31%	0.309	24%	0.241	S	C	.	.	H	α-helix	trans	-85.1	-24.5	174	-176.5	0	0	0	0	111.1	S1047 Q1048 W1144	S1047-V1050 WeakPolarHBondContact O-CB 3.46Å; S1047-V1050 PolarHBondContact O-N 2.69Å; Q1048-V1050 PolarHBondContact O-N 3.1Å; Q1048-V1050 VanDerWaalsContact O-N 3.1Å; V1050-W1144 HydrophobicContact CG2-CH2 4.36Å
1051	R	79.4	Confident	82.4	Confident	17 Å²	17	42.6 Å²	42.6	6%	0.064	25%	0.25	C	S	.	.	H	α-helix	trans	-104.4	-8.7	-175.4	-58.9	-174.4	-58.8	169.6	4.9	114	Y890 G1039 G1042 G1043 S1047 Q1048 A1053 W1054 E1055	Y890-R1051 VanDerWaalsContact CZ-NH2 3.26Å; Y890-R1051 PolarHBondContact OH-NH2 3.04Å; G1039-R1051 PolarHBondContact O-NH1 2.96Å; G1042-R1051 VanDerWaalsContact C-NH2 3.32Å; G1042-R1051 PolarHBondContact O-NH1 3.28Å; G1043-R1051 VanDerWaalsContact CA-NH2 3.3Å; S1047-R1051 PolarHBondContact O-N 2.89Å; S1047-R1051 PolarHBondContact OG-NE 3.32Å; Q1048-R1051 CarbonylContact O-C 3.5Å; Q1048-R1051 WeakPolarHBondContact O-CA 3.35Å; Q1048-R1051 PolarHBondContact O-N 3.14Å; R1051-A1053 PolarHBondContact O-N 3.27Å; R1051-W1054 HydrophobicContact CG-CE3 4.47Å; R1051-W1054 CarbonylContact O-C 3.57Å; R1051-W1054 WeakPolarHBondContact O-CA 3.46Å; R1051-W1054 WeakPolarHBondContact O-CB 3.28Å; R1051-W1054 PolarHBondContact O-N 3.39Å; R1051-E1055 IonicContact NH2-OE1 3.36Å; R1051-E1055 PolarHBondContact O-N 3.45Å
1052	A	76.8	Confident	82.5	Confident	41 Å²	41	42.5 Å²	42.5	34%	0.339	25%	0.25	S	C	.	.	H	α-helix	trans	-45.7	-40.8	179.5	0	0	0	0	0	113.4	Q1048 W1054 E1055 T1056	Q1048-A1052 PolarHBondContact O-N 3.18Å; A1052-W1054 VanDerWaalsContact C-N 3.33Å; A1052-W1054 PolarHBondContact O-N 2.84Å; A1052-E1055 PolarHBondContact O-N 3.08Å; A1052-T1056 WeakPolarHBondContact O-CB 3.43Å; A1052-T1056 PolarHBondContact O-N 3.09Å; A1052-T1056 PolarHBondContact O-OG1 2.91Å
1053	A	75.9	Confident	82.8	Confident	38 Å²	38	43 Å²	43	31%	0.314	25%	0.248	S	C	.	.	H	α-helix	trans	-66.9	-28.5	176.5	0	0	0	0	0	114.4	R1051 S1057 M1110 V1114	R1051-A1053 PolarHBondContact O-N 3.27Å; A1053-S1057 WeakPolarHBondContact O-CB 3.43Å; A1053-S1057 PolarHBondContact O-N 3.3Å; A1053-M1110 WeakPolarHBondContact O-CE 3.4Å; A1053-V1114 HydrophobicContact CB-CG2 4.19Å
1054	W	81.7	Confident	82.9	Confident	71 Å²	71	49.1 Å²	49.1	27%	0.269	27%	0.266	S	S	.	.	H	α-helix	trans	-79.6	-38.2	170.5	-64.3	-15.8	0	0	0	111.3	A1040 R1051 A1052 S1057 Y1058 V1114 M1152	A1040-W1054 HydrophobicContact CB-CB 3.82Å; R1051-W1054 HydrophobicContact CG-CE3 4.47Å; R1051-W1054 CarbonylContact O-C 3.57Å; R1051-W1054 WeakPolarHBondContact O-CA 3.46Å; R1051-W1054 WeakPolarHBondContact O-CB 3.28Å; R1051-W1054 PolarHBondContact O-N 3.39Å; A1052-W1054 VanDerWaalsContact C-N 3.33Å; A1052-W1054 PolarHBondContact O-N 2.84Å; W1054-S1057 PolarHBondContact O-N 3.02Å; W1054-Y1058 PolarHBondContact O-N 3.29Å; W1054-V1114 VanDerWaalsContact NE1-CG1 3.27Å; W1054-M1152 HydrophobicContact CH2-CE 4.38Å; W1054-M1152 HydrophobicContact CZ3-CE 4.45Å
1055	E	88.2	Confident	83.1	Confident	16 Å²	16	48.7 Å²	48.7	8%	0.075	26%	0.263	C	S	.	.	H	α-helix	trans	-62.6	-42.8	175.1	-65	-174.9	166.4	0	0	111.5	Y890 L892 A1040 Q1048 R1051 A1052 Y1058 Q1059	Y890-E1055 PolarHBondContact OH-OE1 2.91Å; L892-E1055 HydrophobicContact CD2-CB 3.95Å; L892-E1055 HydrophobicContact CD2-CG 3.81Å; A1040-E1055 WeakPolarHBondContact O-CG 3.32Å; Q1048-E1055 WeakPolarHBondContact CG-OE2 3.3Å; Q1048-E1055 PolarHBondContact NE2-OE2 2.51Å; R1051-E1055 IonicContact NH2-OE1 3.36Å; R1051-E1055 PolarHBondContact O-N 3.45Å; A1052-E1055 PolarHBondContact O-N 3.08Å; E1055-Y1058 PolarHBondContact O-N 3.12Å; E1055-Q1059 WeakPolarHBondContact O-CB 3.49Å; E1055-Q1059 PolarHBondContact O-N 2.98Å
1056	T	84.9	Confident	83.4	Confident	49 Å²	49	45.8 Å²	45.8	30%	0.301	25%	0.248	S	C	.	.	H	α-helix	trans	-65.3	-37.9	172.2	-56.1	0	0	0	0	112.5	A1052 Y1058 Q1059 W1060 M1110	A1052-T1056 WeakPolarHBondContact O-CB 3.43Å; A1052-T1056 PolarHBondContact O-N 3.09Å; A1052-T1056 PolarHBondContact O-OG1 2.91Å; T1056-Y1058 VanDerWaalsContact C-N 3.35Å; T1056-Q1059 WeakPolarHBondContact O-CB 3.38Å; T1056-Q1059 PolarHBondContact O-N 2.92Å; T1056-W1060 HydrophobicContact CG2-CD2 4.12Å; T1056-W1060 HydrophobicContact CG2-CH2 4.34Å; T1056-W1060 HydrophobicContact CG2-CZ2 3.76Å; T1056-W1060 PolarHBondContact O-N 2.92Å; T1056-M1110 HydrophobicContact CG2-CE 4.2Å
1057	S	84.6	Confident	83.6	Confident	4 Å²	4	43.2 Å²	43.2	3%	0.028	23%	0.233	C	C	.	.	H	α-helix	trans	-66.4	-36.7	174.7	-176.9	0	0	0	0	112.1	A1053 W1054 K1061 E1111	A1053-S1057 WeakPolarHBondContact O-CB 3.43Å; A1053-S1057 PolarHBondContact O-N 3.3Å; W1054-S1057 PolarHBondContact O-N 3.02Å; S1057-K1061 VanDerWaalsContact O-CG 3.29Å; S1057-K1061 WeakPolarHBondContact O-CG 3.35Å; S1057-K1061 PolarHBondContact O-N 3.19Å; S1057-E1111 PolarHBondContact OG-OE1 3.35Å
1058	Y	92.6	Very high	83.8	Confident	1 Å²	1	50.9 Å²	50.9	0%	0.004	27%	0.265	C	S	.	.	H	α-helix	trans	-66.7	-43.5	171.6	173.4	-152.2	0	0	0	111.1	L892 F894 L1031 Y1032 E1035 A1041 W1054 E1055 T1056 K1061 A1062	L892-Y1058 HydrophobicContact CD2-CD1 4.38Å; L892-Y1058 HydrophobicContact CG-CE1 4.37Å; F894-Y1058 AromaticContact CD2-CD1 3.72Å; F894-Y1058 HydrophobicContact CD2-CD1 3.72Å; F894-Y1058 HydrophobicContact CD2-CD2 4.04Å; F894-Y1058 AromaticContact CD2-CE1 3.57Å; F894-Y1058 HydrophobicContact CD2-CE1 3.57Å; F894-Y1058 AromaticContact CD2-CE2 3.88Å; F894-Y1058 HydrophobicContact CD2-CE2 3.88Å; F894-Y1058 AromaticContact CD2-CG 3.93Å; F894-Y1058 HydrophobicContact CD2-CG 3.93Å; F894-Y1058 AromaticContact CD2-CZ 3.63Å; F894-Y1058 AromaticContact CE2-CD1 3.67Å; F894-Y1058 HydrophobicContact CE2-CD1 3.67Å; F894-Y1058 AromaticContact CE2-CE1 3.91Å; F894-Y1058 HydrophobicContact CE2-CE1 3.91Å; F894-Y1058 AromaticContact CE2-CG 3.98Å; F894-Y1058 HydrophobicContact CE2-CG 3.98Å; F894-Y1058 PolarHBondContact N-OH 3.14Å; L1031-Y1058 HydrophobicContact CD2-CD2 3.97Å; L1031-Y1058 HydrophobicContact CD2-CE2 3.8Å; L1031-Y1058 HydrophobicContact CG-CD2 3.99Å; L1031-Y1058 HydrophobicContact CG-CE2 3.76Å; Y1032-Y1058 WeakPolarHBondContact CB-OH 3.49Å; E1035-Y1058 HydrophobicContact CB-CD1 4.18Å; E1035-Y1058 HydrophobicContact CB-CD2 3.95Å; E1035-Y1058 HydrophobicContact CB-CE2 4.36Å; E1035-Y1058 HydrophobicContact CB-CG 3.89Å; E1035-Y1058 HydrophobicContact CG-CD2 3.7Å; E1035-Y1058 HydrophobicContact CG-CE2 4.37Å; E1035-Y1058 HydrophobicContact CG-CG 3.92Å; A1041-Y1058 HydrophobicContact CB-CD1 4.32Å; A1041-Y1058 HydrophobicContact CB-CE1 3.85Å; W1054-Y1058 PolarHBondContact O-N 3.29Å; E1055-Y1058 PolarHBondContact O-N 3.12Å; T1056-Y1058 VanDerWaalsContact C-N 3.35Å; Y1058-K1061 PolarHBondContact O-N 2.85Å; Y1058-A1062 PolarHBondContact O-N 2.78Å
1059	Q	90.5	Very high	84.3	Confident	45 Å²	45	50.4 Å²	50.4	21%	0.21	26%	0.263	C	S	.	.	H	α-helix	trans	-54.4	-55.1	175.4	-175.4	175.2	-30.1	0	0	111.7	F894 E1055 T1056 K1061 A1062 E1063 L1090	F894-Q1059 HydrophobicContact CD1-CG 4.32Å; F894-Q1059 HydrophobicContact CE1-CB 3.89Å; F894-Q1059 HydrophobicContact CE1-CG 3.66Å; F894-Q1059 HydrophobicContact CE2-CB 3.81Å; F894-Q1059 HydrophobicContact CE2-CG 4.47Å; F894-Q1059 HydrophobicContact CZ-CB 3.45Å; F894-Q1059 VanDerWaalsContact CZ-CB 3.45Å; F894-Q1059 HydrophobicContact CZ-CG 3.77Å; E1055-Q1059 WeakPolarHBondContact O-CB 3.49Å; E1055-Q1059 PolarHBondContact O-N 2.98Å; T1056-Q1059 WeakPolarHBondContact O-CB 3.38Å; T1056-Q1059 PolarHBondContact O-N 2.92Å; Q1059-K1061 VanDerWaalsContact C-N 3.27Å; Q1059-K1061 PolarHBondContact O-N 2.77Å; Q1059-A1062 WeakPolarHBondContact O-CA 3.35Å; Q1059-A1062 WeakPolarHBondContact O-CB 3.31Å; Q1059-A1062 PolarHBondContact O-N 3.03Å; Q1059-E1063 HydrophobicContact CG-CG 4.35Å; Q1059-E1063 WeakPolarHBondContact CG-OE1 3.24Å; Q1059-E1063 PolarHBondContact NE2-OE1 2.91Å; Q1059-E1063 WeakPolarHBondContact O-CG 3.46Å; Q1059-E1063 PolarHBondContact O-N 2.89Å; Q1059-L1090 HydrophobicContact CG-CD1 4.04Å
1060	W	85.6	Confident	85.2	Confident	63 Å²	63	47.5 Å²	47.5	24%	0.239	24%	0.24	C	C	.	.	H	α-helix	trans	-60.2	-33.2	179.1	-65.5	-20.5	0	0	0	113.6	T1056 E1063 R1064 L1106 M1110	T1056-W1060 HydrophobicContact CG2-CD2 4.12Å; T1056-W1060 HydrophobicContact CG2-CH2 4.34Å; T1056-W1060 HydrophobicContact CG2-CZ2 3.76Å; T1056-W1060 PolarHBondContact O-N 2.92Å; W1060-E1063 WeakPolarHBondContact CA-OE2 3.39Å; W1060-R1064 WeakPolarHBondContact O-CB 3.48Å; W1060-R1064 PolarHBondContact O-N 2.75Å; W1060-R1064 VanDerWaalsContact O-N 3.08Å; W1060-L1106 HydrophobicContact CH2-CD2 3.57Å; W1060-L1106 HydrophobicContact CH2-CG 3.77Å; W1060-L1106 HydrophobicContact CZ2-CD2 4.17Å; W1060-L1106 HydrophobicContact CZ3-CD2 4.07Å; W1060-L1106 HydrophobicContact CZ3-CG 3.86Å; W1060-M1110 HydrophobicContact CE3-CE 4.21Å; W1060-M1110 HydrophobicContact CH2-CE 3.97Å; W1060-M1110 HydrophobicContact CH2-SD 3.44Å; W1060-M1110 WeakPolarHBondContact CH2-SD 3.3Å; W1060-M1110 HydrophobicContact CZ3-CE 3.63Å; W1060-M1110 HydrophobicContact CZ3-CG 4.49Å; W1060-M1110 HydrophobicContact CZ3-SD 3.44Å; W1060-M1110 WeakPolarHBondContact CZ3-SD 3.4Å
1061	K	89.5	Confident	86.2	Confident	42 Å²	42	45 Å²	45	18%	0.183	23%	0.225	C	C	.	.	H	α-helix	trans	-68.4	-38.1	173.9	-71.8	174	-166.3	-173	0	111.8	L1031 E1035 S1057 Y1058 Q1059 I1065 E1111	L1031-K1061 HydrophobicContact CD1-CB 4.05Å; L1031-K1061 HydrophobicContact CD1-CD 4.1Å; L1031-K1061 HydrophobicContact CD2-CB 3.88Å; E1035-K1061 IonicContact OE1-NZ 3.39Å; E1035-K1061 PolarHBondContact OE1-NZ 3.03Å; S1057-K1061 VanDerWaalsContact O-CG 3.29Å; S1057-K1061 WeakPolarHBondContact O-CG 3.35Å; S1057-K1061 PolarHBondContact O-N 3.19Å; Y1058-K1061 PolarHBondContact O-N 2.85Å; Q1059-K1061 VanDerWaalsContact C-N 3.27Å; Q1059-K1061 PolarHBondContact O-N 2.77Å; K1061-I1065 WeakPolarHBondContact O-CG1 3.5Å; K1061-I1065 PolarHBondContact O-N 2.8Å; K1061-E1111 WeakPolarHBondContact CE-OE1 3.1Å; K1061-E1111 IonicContact NZ-OE1 2.77Å; K1061-E1111 PolarHBondContact NZ-OE1 2.92Å; K1061-E1111 IonicContact NZ-OE2 3.43Å
1062	A	91.6	Very high	87	Confident	1 Å²	1	44.2 Å²	44.2	1%	0.008	22%	0.222	C	C	.	.	H	α-helix	trans	-70.8	-48	178.7	0	0	0	0	0	111.1	F894 L1031 Y1058 Q1059 R1064 I1065 M1066	F894-A1062 HydrophobicContact CB-CB 3.44Å; F894-A1062 VanDerWaalsContact CB-CB 3.44Å; F894-A1062 HydrophobicContact CD2-CB 4.23Å; F894-A1062 HydrophobicContact CG-CB 3.98Å; L1031-A1062 HydrophobicContact CD2-CB 3.98Å; Y1058-A1062 PolarHBondContact O-N 2.78Å; Q1059-A1062 WeakPolarHBondContact O-CA 3.35Å; Q1059-A1062 WeakPolarHBondContact O-CB 3.31Å; Q1059-A1062 PolarHBondContact O-N 3.03Å; A1062-R1064 VanDerWaalsContact C-N 3.26Å; A1062-R1064 PolarHBondContact O-N 2.9Å; A1062-I1065 PolarHBondContact O-N 2.83Å; A1062-M1066 VanDerWaalsContact C-CE 3.49Å; A1062-M1066 HydrophobicContact CB-CE 3.62Å; A1062-M1066 WeakPolarHBondContact O-CE 3.25Å; A1062-M1066 PolarHBondContact O-N 3.35Å
1063	E	89.1	Confident	87.9	Confident	23 Å²	23	44.1 Å²	44.1	11%	0.107	21%	0.214	C	C	.	.	H	α-helix	trans	-55.7	-39.4	173.9	-71.2	162.2	169.4	0	0	111.6	Q1059 W1060 M1066 A1067 C1071 L1090	Q1059-E1063 HydrophobicContact CG-CG 4.35Å; Q1059-E1063 WeakPolarHBondContact CG-OE1 3.24Å; Q1059-E1063 PolarHBondContact NE2-OE1 2.91Å; Q1059-E1063 WeakPolarHBondContact O-CG 3.46Å; Q1059-E1063 PolarHBondContact O-N 2.89Å; W1060-E1063 WeakPolarHBondContact CA-OE2 3.39Å; E1063-M1066 CarbonylContact O-C 3.47Å; E1063-M1066 PolarHBondContact O-N 2.62Å; E1063-A1067 VanDerWaalsContact O-CA 3.32Å; E1063-A1067 WeakPolarHBondContact O-CA 3.33Å; E1063-A1067 PolarHBondContact O-N 3.14Å; E1063-C1071 HydrophobicContact CG-CB 4.3Å; E1063-L1090 HydrophobicContact CG-CD1 4.48Å; E1063-L1090 WeakPolarHBondContact OE1-CD1 3.32Å
1064	R	86	Confident	88.9	Confident	147 Å²	147	42.3 Å²	42.3	56%	0.555	20%	0.199	S	C	*	.	H	α-helix	trans	-70	-31.1	175.9	-164.5	-171	69.2	164.1	3.6	114.1	W1060 A1062	W1060-R1064 WeakPolarHBondContact O-CB 3.48Å; W1060-R1064 PolarHBondContact O-N 2.75Å; W1060-R1064 VanDerWaalsContact O-N 3.08Å; A1062-R1064 VanDerWaalsContact C-N 3.26Å; A1062-R1064 PolarHBondContact O-N 2.9Å
1065	I	88.6	Confident	89.5	Confident	44 Å²	44	39.8 Å²	39.8	23%	0.226	19%	0.19	C	C	.	.	H	α-helix	trans	-72.6	-35.5	172.8	-71	175.7	0	0	0	110.2	V1024 Q1027 V1028 L1031 K1061 A1062	V1024-I1065 HydrophobicContact CG1-CG2 4.15Å; Q1027-I1065 HydrophobicContact CB-CD1 4.49Å; Q1027-I1065 HydrophobicContact CB-CG2 4.21Å; V1028-I1065 HydrophobicContact CG2-CG2 4.16Å; L1031-I1065 HydrophobicContact CB-CD1 4.34Å; L1031-I1065 HydrophobicContact CD2-CD1 3.9Å; K1061-I1065 WeakPolarHBondContact O-CG1 3.5Å; K1061-I1065 PolarHBondContact O-N 2.8Å; A1062-I1065 PolarHBondContact O-N 2.83Å
1066	M	89.5	Confident	89.8	Confident	1 Å²	1	39 Å²	39	1%	0.005	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.7	31.4	-179.4	-64	173.4	-76	0	0	112.2	F894 N896 V1024 V1028 A1062 E1063 E1068 E1069 C1071	F894-M1066 HydrophobicContact CB-CE 4.39Å; N896-M1066 HydrophobicContact CB-CG 4.11Å; N896-M1066 HydrophobicContact CB-SD 3.56Å; N896-M1066 VanDerWaalsContact CB-SD 3.56Å; N896-M1066 PolarHBondContact N-SD 3.38Å; V1024-M1066 HydrophobicContact CG1-CG 4.01Å; V1028-M1066 HydrophobicContact CG2-CE 4.18Å; V1028-M1066 HydrophobicContact CG2-CG 4.14Å; V1028-M1066 HydrophobicContact CG2-SD 3.89Å; A1062-M1066 VanDerWaalsContact C-CE 3.49Å; A1062-M1066 HydrophobicContact CB-CE 3.62Å; A1062-M1066 WeakPolarHBondContact O-CE 3.25Å; A1062-M1066 PolarHBondContact O-N 3.35Å; E1063-M1066 CarbonylContact O-C 3.47Å; E1063-M1066 PolarHBondContact O-N 2.62Å; M1066-E1068 PolarHBondContact O-N 3.47Å; M1066-E1068 VanDerWaalsContact O-N 3.11Å; M1066-E1069 HydrophobicContact CB-CB 4.42Å; M1066-E1069 CarbonylContact O-C 3.59Å; M1066-E1069 PolarHBondContact O-N 2.88Å; M1066-C1071 HydrophobicContact CE-CB 4.2Å; M1066-C1071 WeakPolarHBondContact CE-SG 3.37Å
1067	A	80.8	Confident	90.1	Very high	47 Å²	47	37.8 Å²	37.8	39%	0.388	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-22.7	-170.1	0	0	0	0	0	114.3	E1063 Q1096	E1063-A1067 VanDerWaalsContact O-CA 3.32Å; E1063-A1067 WeakPolarHBondContact O-CA 3.33Å; E1063-A1067 PolarHBondContact O-N 3.14Å; A1067-Q1096 PolarHBondContact O-NE2 2.91Å
1068	E	83.2	Confident	90.3	Very high	193 Å²	193	38.1 Å²	38.1	90%	0.902	18%	0.179	S	C	*	.	T	Hydrogen-bonded Turn	trans	-103	6.6	175.6	-59.9	-173.7	-176.8	0	0	113	M1066	M1066-E1068 PolarHBondContact O-N 3.47Å; M1066-E1068 VanDerWaalsContact O-N 3.11Å
1069	E	87.9	Confident	90	Very high	55 Å²	55	40.9 Å²	40.9	26%	0.257	19%	0.194	S	C	.	.	S	Bend	trans	-130.5	166.9	-177.4	-65.3	-152.1	115.4	0	0	113.2	N896 M1066 C1071	N896-E1069 VanDerWaalsContact CB-OE2 3.25Å; N896-E1069 WeakPolarHBondContact CB-OE2 3Å; N896-E1069 PolarHBondContact ND2-OE2 3.33Å; M1066-E1069 HydrophobicContact CB-CB 4.42Å; M1066-E1069 CarbonylContact O-C 3.59Å; M1066-E1069 PolarHBondContact O-N 2.88Å; E1069-C1071 PolarHBondContact O-N 3.1Å
1070	N	90.8	Very high	89.4	Confident	48 Å²	48	47.4 Å²	47.4	26%	0.257	22%	0.222	S	C	.	.			trans	-73.7	121.4	173.8	-62.9	10.7	0	0	0	109.8	F1072 L1089	N1070-F1072 HydrophobicContact CB-CE2 3.66Å; N1070-F1072 HydrophobicContact CB-CZ 3.83Å; N1070-F1072 WeakPolarHBondContact O-CD2 3.35Å; N1070-F1072 WeakPolarHBondContact O-CE2 3.47Å; N1070-L1089 HydrophobicContact CB-CD1 4.17Å
1071	C	94.1	Very high	88.9	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	23%	0.233	C	C	.	.			trans	-92	124.4	174.5	-176.4	0	0	0	0	111.1	E1063 M1066 E1069 L1090 T1092	E1063-C1071 HydrophobicContact CG-CB 4.3Å; M1066-C1071 HydrophobicContact CE-CB 4.2Å; M1066-C1071 WeakPolarHBondContact CE-SG 3.37Å; E1069-C1071 PolarHBondContact O-N 3.1Å; C1071-L1090 HydrophobicContact CB-CD1 4.47Å; C1071-L1090 WeakPolarHBondContact O-CB 3.48Å; C1071-L1090 PolarHBondContact O-N 2.71Å; C1071-L1090 VanDerWaalsContact O-N 3.09Å; C1071-T1092 HydrophobicContact CB-CG2 3.97Å
1072	F	95.5	Very high	88.8	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	133.7	177.2	-55.3	-93.4	0	0	0	110.8	L651 I654 F894 V895 N897 Y900 N1070 E1088 L1089	L651-F1072 HydrophobicContact CD1-CZ 4.2Å; I654-F1072 HydrophobicContact CD1-CD1 4.1Å; I654-F1072 HydrophobicContact CD1-CE1 4.22Å; I654-F1072 HydrophobicContact CG2-CE1 3.93Å; F894-F1072 CarbonylContact C-O 3.56Å; F894-F1072 WeakPolarHBondContact CA-O 3.48Å; V895-F1072 HydrophobicContact CG2-CB 3.84Å; V895-F1072 PolarHBondContact N-O 2.84Å; V895-F1072 PolarHBondContact O-N 2.84Å; N897-F1072 WeakPolarHBondContact OD1-CE2 3.42Å; Y900-F1072 HydrophobicContact CD1-CE1 4.45Å; Y900-F1072 HydrophobicContact CD1-CZ 4.25Å; Y900-F1072 AromaticContact CD2-CD1 3.7Å; Y900-F1072 HydrophobicContact CD2-CD1 3.7Å; Y900-F1072 HydrophobicContact CD2-CD2 4.42Å; Y900-F1072 AromaticContact CD2-CE1 3.86Å; Y900-F1072 HydrophobicContact CD2-CE1 3.86Å; Y900-F1072 AromaticContact CD2-CG 3.99Å; Y900-F1072 HydrophobicContact CD2-CG 3.99Å; Y900-F1072 HydrophobicContact CD2-CZ 4.3Å; Y900-F1072 HydrophobicContact CE2-CD1 4.19Å; Y900-F1072 HydrophobicContact CE2-CE1 4.17Å; Y900-F1072 HydrophobicContact CG-CD1 4.17Å; Y900-F1072 HydrophobicContact CG-CD2 4.22Å; Y900-F1072 HydrophobicContact CG-CE1 4.04Å; Y900-F1072 HydrophobicContact CG-CE2 4.1Å; Y900-F1072 HydrophobicContact CG-CG 4.26Å; Y900-F1072 HydrophobicContact CG-CZ 4Å; N1070-F1072 HydrophobicContact CB-CE2 3.66Å; N1070-F1072 HydrophobicContact CB-CZ 3.83Å; N1070-F1072 WeakPolarHBondContact O-CD2 3.35Å; N1070-F1072 WeakPolarHBondContact O-CE2 3.47Å; F1072-E1088 CarbonylContact C-O 3.54Å; F1072-E1088 WeakPolarHBondContact CA-O 3.33Å; F1072-L1089 HydrophobicContact CD1-CB 4.18Å; F1072-L1089 HydrophobicContact CD1-CD1 3.98Å; F1072-L1089 HydrophobicContact CE1-CB 4.25Å; F1072-L1089 HydrophobicContact CE1-CD1 3.71Å; F1072-L1089 HydrophobicContact CE1-CG 4.46Å; F1072-L1089 HydrophobicContact CZ-CD1 4.16Å
1073	K	95.1	Very high	88.8	Confident	38 Å²	38	48.4 Å²	48.4	17%	0.165	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	120.3	173	171.5	179.1	160.5	-151.2	0	109.3	L892 F894 E1088 L1090	L892-K1073 HydrophobicContact CD1-CG 4.13Å; F894-K1073 HydrophobicContact CD1-CB 3.87Å; F894-K1073 HydrophobicContact CD1-CG 4.29Å; F894-K1073 HydrophobicContact CE1-CB 3.69Å; F894-K1073 HydrophobicContact CE1-CD 4.02Å; F894-K1073 HydrophobicContact CE1-CG 3.7Å; F894-K1073 HydrophobicContact CZ-CG 4.4Å; K1073-E1088 HydrophobicContact CB-CB 4.19Å; K1073-E1088 WeakPolarHBondContact CD-OE2 3.27Å; K1073-E1088 WeakPolarHBondContact CE-OE2 3.43Å; K1073-E1088 PolarHBondContact N-O 3.09Å; K1073-E1088 IonicContact NZ-OE1 2.83Å; K1073-E1088 PolarHBondContact NZ-OE1 3.37Å; K1073-E1088 IonicContact NZ-OE2 3.13Å; K1073-E1088 PolarHBondContact NZ-OE2 3.24Å; K1073-E1088 PolarHBondContact O-N 2.85Å; K1073-L1090 HydrophobicContact CB-CD1 4.26Å; K1073-L1090 HydrophobicContact CB-CD2 3.91Å; K1073-L1090 HydrophobicContact CB-CG 4.16Å; K1073-L1090 HydrophobicContact CD-CD2 4.05Å
1074	V	96.6	Very high	89.1	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	132.4	-179.9	-159.8	0	0	0	0	109.9	F893 V895 L903 F1076 M1085 T1086 L1087	F893-V1074 PolarHBondContact N-O 2.82Å; F893-V1074 WeakPolarHBondContact O-CA 3.22Å; F893-V1074 VanDerWaalsContact O-CB 3.31Å; F893-V1074 WeakPolarHBondContact O-CB 3.22Å; F893-V1074 WeakPolarHBondContact O-CG2 3.31Å; F893-V1074 PolarHBondContact O-N 3.49Å; V895-V1074 HydrophobicContact CB-CG2 4.36Å; V895-V1074 HydrophobicContact CG1-CG2 3.89Å; V895-V1074 HydrophobicContact CG2-CG2 3.53Å; L903-V1074 HydrophobicContact CD1-CG1 4.18Å; L903-V1074 HydrophobicContact CD1-CG2 4.15Å; V1074-F1076 HydrophobicContact CB-CE2 4.19Å; V1074-F1076 HydrophobicContact CG1-CD2 4.24Å; V1074-F1076 HydrophobicContact CG1-CE2 3.54Å; V1074-F1076 HydrophobicContact CG1-CZ 3.75Å; V1074-M1085 HydrophobicContact CG1-CG 3.95Å; V1074-T1086 WeakPolarHBondContact CA-O 3.23Å; V1074-T1086 WeakPolarHBondContact CG1-O 3.28Å; V1074-L1087 HydrophobicContact CB-CD2 4.33Å; V1074-L1087 HydrophobicContact CG1-CD2 3.87Å; V1074-L1087 HydrophobicContact CG1-CG 4.45Å; V1074-L1087 HydrophobicContact CG2-CD2 3.78Å
1075	M	94.5	Very high	89.5	Confident	18 Å²	18	41.5 Å²	41.5	9%	0.089	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	130.4	170.7	-56.1	172.9	68	0	0	110.7	Y890 N891 L892 I1077 M1085 T1086	Y890-M1075 HydrophobicContact CD2-CE 3.42Å; Y890-M1075 VanDerWaalsContact CD2-CE 3.42Å; Y890-M1075 HydrophobicContact CE2-CE 3.68Å; Y890-M1075 HydrophobicContact CG-CE 3.96Å; N891-M1075 CarbonylContact O-C 3.46Å; N891-M1075 VanDerWaalsContact O-CA 3.29Å; N891-M1075 WeakPolarHBondContact O-CA 3.42Å; L892-M1075 HydrophobicContact CD1-CG 3.8Å; M1075-I1077 HydrophobicContact CB-CG1 4.31Å; M1075-M1085 CarbonylContact O-C 3.27Å; M1075-M1085 WeakPolarHBondContact O-CA 3.32Å; M1075-T1086 WeakPolarHBondContact CB-OG1 3.39Å; M1075-T1086 PolarHBondContact N-O 3.46Å; M1075-T1086 PolarHBondContact O-N 3.05Å
1076	F	94.1	Very high	89.9	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	110.2	174.4	-60.1	-97.2	0	0	0	108.1	L735 F736 F737 Y890 N891 L903 V1074 V1083 M1085	L735-F1076 HydrophobicContact CB-CD1 4.47Å; L735-F1076 HydrophobicContact CB-CD2 4.23Å; L735-F1076 HydrophobicContact CB-CE1 4.47Å; L735-F1076 HydrophobicContact CB-CE2 4.23Å; L735-F1076 HydrophobicContact CB-CG 4.36Å; L735-F1076 HydrophobicContact CB-CZ 4.35Å; L735-F1076 HydrophobicContact CD1-CE2 4.1Å; L735-F1076 HydrophobicContact CD1-CZ 4.12Å; L735-F1076 HydrophobicContact CD2-CD2 4.03Å; L735-F1076 HydrophobicContact CD2-CE2 3.9Å; L735-F1076 HydrophobicContact CG-CE2 4.32Å; L735-F1076 VanDerWaalsContact O-CB 3.31Å; L735-F1076 WeakPolarHBondContact O-CB 2.99Å; F736-F1076 HydrophobicContact CD1-CD1 4.31Å; F736-F1076 HydrophobicContact CD2-CD1 4.47Å; F736-F1076 HydrophobicContact CD2-CE1 4.38Å; F736-F1076 AromaticContact CE1-CD1 3.93Å; F736-F1076 HydrophobicContact CE1-CD1 3.93Å; F736-F1076 HydrophobicContact CE1-CE1 4.14Å; F736-F1076 HydrophobicContact CE2-CD1 4.12Å; F736-F1076 AromaticContact CE2-CE1 3.7Å; F736-F1076 HydrophobicContact CE2-CE1 3.7Å; F736-F1076 AromaticContact CZ-CD1 3.83Å; F736-F1076 HydrophobicContact CZ-CD1 3.83Å; F736-F1076 AromaticContact CZ-CE1 3.55Å; F736-F1076 HydrophobicContact CZ-CE1 3.55Å; F737-F1076 HydrophobicContact CE2-CB 4.48Å; F737-F1076 WeakPolarHBondContact CE2-O 3.48Å; Y890-F1076 CarbonylContact C-O 3.51Å; Y890-F1076 WeakPolarHBondContact CA-O 3.46Å; N891-F1076 HydrophobicContact CB-CB 4.4Å; N891-F1076 PolarHBondContact N-O 2.91Å; N891-F1076 PolarHBondContact O-N 3.38Å; L903-F1076 HydrophobicContact CD1-CZ 4.18Å; L903-F1076 HydrophobicContact CD2-CE1 4.4Å; L903-F1076 HydrophobicContact CD2-CZ 3.94Å; V1074-F1076 HydrophobicContact CB-CE2 4.19Å; V1074-F1076 HydrophobicContact CG1-CD2 4.24Å; V1074-F1076 HydrophobicContact CG1-CE2 3.54Å; V1074-F1076 HydrophobicContact CG1-CZ 3.75Å; F1076-V1083 HydrophobicContact CB-CG1 4.24Å; F1076-M1085 HydrophobicContact CD1-CB 4.07Å; F1076-M1085 HydrophobicContact CD1-CG 3.94Å; F1076-M1085 HydrophobicContact CD1-SD 4.44Å; F1076-M1085 HydrophobicContact CE1-CB 4.16Å; F1076-M1085 HydrophobicContact CE1-CG 3.61Å; F1076-M1085 HydrophobicContact CE1-SD 3.59Å; F1076-M1085 VanDerWaalsContact CE1-SD 3.59Å; F1076-M1085 HydrophobicContact CZ-CG 4.1Å; F1076-M1085 HydrophobicContact CZ-SD 4.03Å
1077	I	92.3	Very high	90.2	Very high	24 Å²	24	39.8 Å²	39.8	12%	0.123	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	114.6	-169.9	-47.6	178.2	0	0	0	110.4	V889 L1045 M1075 N1079 V1083 T1084 T1086	V889-I1077 CarbonylContact O-C 3.51Å; V889-I1077 WeakPolarHBondContact O-CA 3.45Å; L1045-I1077 HydrophobicContact CD1-CG2 3.88Å; M1075-I1077 HydrophobicContact CB-CG1 4.31Å; I1077-N1079 WeakPolarHBondContact CG2-ND2 3.42Å; I1077-N1079 PolarHBondContact O-N 3.26Å; I1077-V1083 CarbonylContact O-C 3.51Å; I1077-V1083 WeakPolarHBondContact O-CA 3.28Å; I1077-T1084 PolarHBondContact N-O 3.37Å; I1077-T1084 PolarHBondContact O-N 3.44Å; I1077-T1086 HydrophobicContact CD1-CG2 4.21Å
1078	Q	89.3	Confident	90.8	Very high	10 Å²	10	39.1 Å²	39.1	5%	0.047	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	110.5	175.1	179.3	75.3	108.5	0	0	110.3	F737 G888 V889 G1081 Q1082	F737-Q1078 HydrophobicContact CD2-CB 3.62Å; F737-Q1078 HydrophobicContact CD2-CG 4.4Å; F737-Q1078 HydrophobicContact CE2-CB 3.78Å; F737-Q1078 HydrophobicContact CG-CB 4.11Å; F737-Q1078 HydrophobicContact CZ-CB 4.41Å; G888-Q1078 PolarHBondContact N-O 3.03Å; V889-Q1078 PolarHBondContact O-N 2.8Å; Q1078-G1081 PolarHBondContact NE2-O 3.37Å; Q1078-Q1082 PolarHBondContact NE2-O 2.85Å
1079	N	84.8	Confident	91.3	Very high	59 Å²	59	30.8 Å²	30.8	32%	0.316	16%	0.16	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	122.6	175.2	-67.6	-46.3	0	0	0	110.1	D887 I1077 G1081 Q1082	D887-N1079 VanDerWaalsContact OD1-CA 3.31Å; D887-N1079 WeakPolarHBondContact OD1-CA 3.43Å; I1077-N1079 WeakPolarHBondContact CG2-ND2 3.42Å; I1077-N1079 PolarHBondContact O-N 3.26Å; N1079-G1081 PolarHBondContact O-N 3.35Å; N1079-Q1082 PolarHBondContact N-O 3.28Å; N1079-Q1082 PolarHBondContact O-N 3.1Å
1080	K	79.3	Confident	91.3	Very high	183 Å²	183	29 Å²	29	80%	0.796	15%	0.152	S	C	*	.	T	Hydrogen-bonded Turn	trans	50	36.2	171.9	-57.7	176.4	-175.8	169.2	0	114.9	D887 Q1082	D887-K1080 PolarHBondContact OD1-N 3.37Å; K1080-Q1082 VanDerWaalsContact C-N 3.35Å
1081	G	74.9	Confident	90.9	Very high	45 Å²	45	29.7 Å²	29.7	46%	0.464	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	91.5	-22	-178.2	0	0	0	0	0	115	K696 Q1078 N1079	K696-G1081 WeakPolarHBondContact CE-O 3.09Å; Q1078-G1081 PolarHBondContact NE2-O 3.37Å; N1079-G1081 PolarHBondContact O-N 3.35Å
1082	Q	86.9	Confident	89.7	Confident	77 Å²	77	31 Å²	31	36%	0.36	16%	0.163	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	149.9	175.9	-55.2	-171.1	-30.1	0	0	111.5	T692 Y693 E694 Q1078 N1079 K1080	T692-Q1082 HydrophobicContact CG2-CB 4.21Å; Y693-Q1082 WeakPolarHBondContact O-CA 3.4Å; E694-Q1082 PolarHBondContact OE2-NE2 2.72Å; Q1078-Q1082 PolarHBondContact NE2-O 2.85Å; N1079-Q1082 PolarHBondContact N-O 3.28Å; N1079-Q1082 PolarHBondContact O-N 3.1Å; K1080-Q1082 VanDerWaalsContact C-N 3.35Å
1083	V	91.9	Very high	88	Confident	4 Å²	4	38.8 Å²	38.8	2%	0.024	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	126.3	176.1	-177.4	0	0	0	0	109.8	Y693 F736 F737 F1076 I1077	Y693-V1083 PolarHBondContact N-O 3.29Å; Y693-V1083 PolarHBondContact O-N 2.76Å; F736-V1083 HydrophobicContact CD1-CB 4.14Å; F736-V1083 HydrophobicContact CD1-CG1 3.81Å; F736-V1083 HydrophobicContact CE1-CG1 4.26Å; F737-V1083 HydrophobicContact CD2-CG2 4.29Å; F1076-V1083 HydrophobicContact CB-CG1 4.24Å; I1077-V1083 CarbonylContact O-C 3.51Å; I1077-V1083 WeakPolarHBondContact O-CA 3.28Å
1084	T	94.3	Very high	86	Confident	26 Å²	26	44.7 Å²	44.7	16%	0.16	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	116.6	174.4	-53.3	0	0	0	0	109.5	F691 I1077 T1086	F691-T1084 WeakPolarHBondContact O-CA 3.43Å; I1077-T1084 PolarHBondContact N-O 3.37Å; I1077-T1084 PolarHBondContact O-N 3.44Å; T1084-T1086 HydrophobicContact CG2-CG2 4.21Å
1085	M	95.7	Very high	83.7	Confident	0 Å²	0	47 Å²	47	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	120.1	170.4	-176.1	-178.2	74.8	0	0	108.8	F691 Y693 L903 Q907 V1074 M1075 F1076 L1087	F691-M1085 HydrophobicContact CB-CE 4.35Å; F691-M1085 HydrophobicContact CD2-CE 3.8Å; F691-M1085 HydrophobicContact CG-CE 4.42Å; F691-M1085 PolarHBondContact N-O 2.82Å; F691-M1085 PolarHBondContact O-N 3.21Å; Y693-M1085 HydrophobicContact CD2-CB 4.49Å; Y693-M1085 HydrophobicContact CE2-CB 3.84Å; Y693-M1085 HydrophobicContact CE2-CE 4.43Å; Y693-M1085 HydrophobicContact CE2-SD 4.44Å; L903-M1085 HydrophobicContact CB-SD 4.18Å; L903-M1085 HydrophobicContact CD2-SD 4.31Å; Q907-M1085 HydrophobicContact CB-CE 3.99Å; Q907-M1085 HydrophobicContact CG-CE 4.11Å; V1074-M1085 HydrophobicContact CG1-CG 3.95Å; M1075-M1085 CarbonylContact O-C 3.27Å; M1075-M1085 WeakPolarHBondContact O-CA 3.32Å; F1076-M1085 HydrophobicContact CD1-CB 4.07Å; F1076-M1085 HydrophobicContact CD1-CG 3.94Å; F1076-M1085 HydrophobicContact CD1-SD 4.44Å; F1076-M1085 HydrophobicContact CE1-CB 4.16Å; F1076-M1085 HydrophobicContact CE1-CG 3.61Å; F1076-M1085 HydrophobicContact CE1-SD 3.59Å; F1076-M1085 VanDerWaalsContact CE1-SD 3.59Å; F1076-M1085 HydrophobicContact CZ-CG 4.1Å; F1076-M1085 HydrophobicContact CZ-SD 4.03Å; M1085-L1087 HydrophobicContact CE-CD1 3.85Å
1086	T	95.6	Very high	81.6	Confident	9 Å²	9	52.6 Å²	52.6	6%	0.055	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	145.6	172.9	73.8	0	0	0	0	110	P687 M689 M690 V1074 M1075 I1077 T1084	P687-T1086 HydrophobicContact CG-CG2 4.12Å; M689-T1086 CarbonylContact O-C 3.55Å; M689-T1086 VanDerWaalsContact O-CA 3.32Å; M689-T1086 WeakPolarHBondContact O-CA 3.4Å; M690-T1086 HydrophobicContact CG-CG2 3.88Å; M690-T1086 HydrophobicContact SD-CG2 4.24Å; V1074-T1086 WeakPolarHBondContact CA-O 3.23Å; V1074-T1086 WeakPolarHBondContact CG1-O 3.28Å; M1075-T1086 WeakPolarHBondContact CB-OG1 3.39Å; M1075-T1086 PolarHBondContact N-O 3.46Å; M1075-T1086 PolarHBondContact O-N 3.05Å; I1077-T1086 HydrophobicContact CD1-CG2 4.21Å; T1084-T1086 HydrophobicContact CG2-CG2 4.21Å
1087	L	95.8	Very high	79.3	Confident	0 Å²	0	56.7 Å²	56.7	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	137.5	-176.9	-74.9	159.1	0	0	0	109.9	I654 H688 M689 F691 Y900 V1074 M1085	I654-L1087 HydrophobicContact CD1-CB 4.47Å; H688-L1087 PolarHBondContact N-O 3.46Å; H688-L1087 VanDerWaalsContact N-O 3.08Å; M689-L1087 HydrophobicContact CB-CB 4.15Å; M689-L1087 HydrophobicContact CG-CB 4.33Å; M689-L1087 PolarHBondContact N-O 3.42Å; M689-L1087 PolarHBondContact O-N 2.88Å; M689-L1087 HydrophobicContact SD-CD1 4.37Å; F691-L1087 HydrophobicContact CD2-CD1 4.12Å; F691-L1087 HydrophobicContact CE2-CD1 3.88Å; Y900-L1087 HydrophobicContact CD2-CD2 4.05Å; Y900-L1087 HydrophobicContact CE2-CD1 4.24Å; Y900-L1087 HydrophobicContact CE2-CD2 4.3Å; V1074-L1087 HydrophobicContact CB-CD2 4.33Å; V1074-L1087 HydrophobicContact CG1-CD2 3.87Å; V1074-L1087 HydrophobicContact CG1-CG 4.45Å; V1074-L1087 HydrophobicContact CG2-CD2 3.78Å; M1085-L1087 HydrophobicContact CE-CD1 3.85Å
1088	E	93.8	Very high	77.4	Confident	33 Å²	33	60.7 Å²	60.7	15%	0.154	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	118.5	-174.7	-174.9	-177.4	154.2	0	0	108.8	H688 F1072 K1073	H688-E1088 WeakPolarHBondContact ND1-CA 3.46Å; F1072-E1088 CarbonylContact C-O 3.54Å; F1072-E1088 WeakPolarHBondContact CA-O 3.33Å; K1073-E1088 HydrophobicContact CB-CB 4.19Å; K1073-E1088 WeakPolarHBondContact CD-OE2 3.27Å; K1073-E1088 WeakPolarHBondContact CE-OE2 3.43Å; K1073-E1088 PolarHBondContact N-O 3.09Å; K1073-E1088 IonicContact NZ-OE1 2.83Å; K1073-E1088 PolarHBondContact NZ-OE1 3.37Å; K1073-E1088 IonicContact NZ-OE2 3.13Å; K1073-E1088 PolarHBondContact NZ-OE2 3.24Å; K1073-E1088 PolarHBondContact O-N 2.85Å
1089	L	93.4	Very high	75.6	Confident	17 Å²	17	64 Å²	64	9%	0.089	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	137	169.6	175.7	60.2	0	0	0	108.7	I654 Y658 H688 N1070 F1072	I654-L1089 HydrophobicContact CD1-CB 4.24Å; I654-L1089 HydrophobicContact CG1-CB 4.23Å; Y658-L1089 HydrophobicContact CD1-CD2 4.34Å; Y658-L1089 HydrophobicContact CD2-CB 3.96Å; Y658-L1089 HydrophobicContact CD2-CD2 4.03Å; Y658-L1089 HydrophobicContact CD2-CG 3.99Å; Y658-L1089 HydrophobicContact CE2-CG 4.29Å; Y658-L1089 HydrophobicContact CG-CD2 3.91Å; Y658-L1089 HydrophobicContact CG-CG 4.39Å; H688-L1089 PolarHBondContact ND1-N 3.48Å; N1070-L1089 HydrophobicContact CB-CD1 4.17Å; F1072-L1089 HydrophobicContact CD1-CB 4.18Å; F1072-L1089 HydrophobicContact CD1-CD1 3.98Å; F1072-L1089 HydrophobicContact CE1-CB 4.25Å; F1072-L1089 HydrophobicContact CE1-CD1 3.71Å; F1072-L1089 HydrophobicContact CE1-CG 4.46Å; F1072-L1089 HydrophobicContact CZ-CD1 4.16Å
1090	L	89.4	Confident	74	Confident	17 Å²	17	66.1 Å²	66.1	9%	0.089	36%	0.364	C	S	.	.	P	Polyproline II helix	trans	-99.4	150	176.4	-56.8	-178.9	0	0	0	110.4	F894 Q1059 E1063 C1071 K1073 T1092	F894-L1090 HydrophobicContact CD1-CD1 4.01Å; F894-L1090 HydrophobicContact CE1-CD1 4Å; Q1059-L1090 HydrophobicContact CG-CD1 4.04Å; E1063-L1090 HydrophobicContact CG-CD1 4.48Å; E1063-L1090 WeakPolarHBondContact OE1-CD1 3.32Å; C1071-L1090 HydrophobicContact CB-CD1 4.47Å; C1071-L1090 WeakPolarHBondContact O-CB 3.48Å; C1071-L1090 PolarHBondContact O-N 2.71Å; C1071-L1090 VanDerWaalsContact O-N 3.09Å; K1073-L1090 HydrophobicContact CB-CD1 4.26Å; K1073-L1090 HydrophobicContact CB-CD2 3.91Å; K1073-L1090 HydrophobicContact CB-CG 4.16Å; K1073-L1090 HydrophobicContact CD-CD2 4.05Å; L1090-T1092 PolarHBondContact O-N 3.38Å
1091	D	80.9	Confident	72.9	Confident	64 Å²	64	63.6 Å²	63.6	34%	0.342	36%	0.358	S	S	.	.	P	Polyproline II helix	trans	-74.9	118.9	167.3	-163	-41.7	0	0	0	109.1	Y658 E1093 E1094	Y658-D1091 VanDerWaalsContact OH-CB 3.3Å; Y658-D1091 WeakPolarHBondContact OH-CB 3.46Å; Y658-D1091 PolarHBondContact OH-OD2 2.79Å; D1091-E1093 PolarHBondContact OD1-N 2.94Å; D1091-E1094 PolarHBondContact OD1-N 3.18Å
1092	T	70.5	Confident	71.8	Confident	26 Å²	26	66.6 Å²	66.6	16%	0.16	36%	0.364	C	S	.	.			trans	-108.7	-3.6	174	52.2	0	0	0	0	112.8	C1071 L1090 Q1096	C1071-T1092 HydrophobicContact CB-CG2 3.97Å; L1090-T1092 PolarHBondContact O-N 3.38Å; T1092-Q1096 PolarHBondContact O-N 3.46Å
1093	E	59.8	Low	70.3	Confident	164 Å²	164	64.9 Å²	64.9	77%	0.766	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.2	-40.7	-179.6	-64.9	-159.4	163.9	0	0	111.5	D1091 A1095 Q1096	D1091-E1093 PolarHBondContact OD1-N 2.94Å; E1093-A1095 VanDerWaalsContact C-N 3.29Å; E1093-A1095 PolarHBondContact O-N 3.33Å; E1093-Q1096 PolarHBondContact O-N 3.05Å
1094	E	51.2	Low	68.3	Low	162 Å²	162	69.6 Å²	69.6	76%	0.757	38%	0.38	S	S	*	.	G	3₁₀ helix	trans	-63.2	-36	171.5	-75.1	-157.5	140	0	0	111.8	D1091 Q1096 A1097	D1091-E1094 PolarHBondContact OD1-N 3.18Å; E1094-Q1096 VanDerWaalsContact C-N 3.29Å; E1094-Q1096 PolarHBondContact O-N 3.39Å; E1094-A1097 WeakPolarHBondContact O-CB 3.37Å; E1094-A1097 PolarHBondContact O-N 3.16Å; E1094-A1097 VanDerWaalsContact O-N 3.14Å
1095	A	49.7	Very low	66.4	Low	50 Å²	50	72.2 Å²	72.2	41%	0.413	40%	0.399	S	S	.	.	G	3₁₀ helix	trans	-69.6	-21.6	-176.9	0	0	0	0	0	114	E1093 A1097	E1093-A1095 VanDerWaalsContact C-N 3.29Å; E1093-A1095 PolarHBondContact O-N 3.33Å; A1095-A1097 VanDerWaalsContact C-N 3.32Å
1096	Q	49.3	Very low	64	Low	134 Å²	134	76.1 Å²	76.1	63%	0.626	42%	0.419	S	S	*	.	G	3₁₀ helix	trans	-80.8	-8.1	173.8	-72.3	-175.3	3.8	0	0	113.6	A1067 T1092 E1093 E1094	A1067-Q1096 PolarHBondContact O-NE2 2.91Å; T1092-Q1096 PolarHBondContact O-N 3.46Å; E1093-Q1096 PolarHBondContact O-N 3.05Å; E1094-Q1096 VanDerWaalsContact C-N 3.29Å; E1094-Q1096 PolarHBondContact O-N 3.39Å
1097	A	47	Very low	61.8	Low	86 Å²	86	76.7 Å²	76.7	71%	0.711	42%	0.423	S	S	*	.	S	Bend	trans	-84.6	-21.6	-176.3	0	0	0	0	0	114.4	E1094 A1095	E1094-A1097 WeakPolarHBondContact O-CB 3.37Å; E1094-A1097 PolarHBondContact O-N 3.16Å; E1094-A1097 VanDerWaalsContact O-N 3.14Å; A1095-A1097 VanDerWaalsContact C-N 3.32Å
1098	D	51.6	Low	59.8	Low	109 Å²	109	79.3 Å²	79.3	58%	0.583	44%	0.442	S	S	*	.	S	Bend	trans	-87.9	150.1	177.5	-80.3	-25.8	0	0	0	111.9	V1103	D1098-V1103 HydrophobicContact CB-CG2 3.73Å
1099	D	51.8	Low	58	Low	80 Å²	80	83.8 Å²	83.8	43%	0.428	46%	0.458	S	S	.	.			trans	-63.7	128.8	176.5	-171.6	-32.7	0	0	0	110.1	L1101 D1102 V1103	D1099-L1101 PolarHBondContact O-N 2.74Å; D1099-L1101 WeakPolarHBondContact OD1-CB 3.34Å; D1099-L1101 PolarHBondContact OD1-N 3.32Å; D1099-D1102 HydrophobicContact CB-CB 4.3Å; D1099-D1102 WeakPolarHBondContact O-CA 3.42Å; D1099-D1102 PolarHBondContact O-N 3.34Å; D1099-V1103 PolarHBondContact O-N 3.16Å
1100	P	52.3	Low	56	Low	102 Å²	102	84.8 Å²	84.8	66%	0.662	46%	0.463	S	S	*	.	H	α-helix	trans	-50.5	-28.3	173.6	-29.8	36.4	0	0	0	114.6	Q1104	P1100-Q1104 VanDerWaalsContact O-CB 3.23Å; P1100-Q1104 WeakPolarHBondContact O-CB 3.43Å; P1100-Q1104 PolarHBondContact O-N 3.08Å
1101	L	54.8	Low	54.3	Low	130 Å²	130	87.1 Å²	87.1	68%	0.681	47%	0.473	S	S	*	.	H	α-helix	trans	-69.6	-40.7	172.6	-74.4	153	0	0	0	112.6	D1099 C1105	D1099-L1101 PolarHBondContact O-N 2.74Å; D1099-L1101 WeakPolarHBondContact OD1-CB 3.34Å; D1099-L1101 PolarHBondContact OD1-N 3.32Å; L1101-C1105 WeakPolarHBondContact O-CB 3.38Å; L1101-C1105 PolarHBondContact O-N 3.08Å
1102	D	52.9	Low	53	Low	109 Å²	109	91.1 Å²	91.1	58%	0.583	49%	0.49	S	S	*	.	H	α-helix	trans	-72.1	-40.9	177.8	-83.8	-30.8	0	0	0	111.2	D1099 Q1104 C1105 L1106	D1099-D1102 HydrophobicContact CB-CB 4.3Å; D1099-D1102 WeakPolarHBondContact O-CA 3.42Å; D1099-D1102 PolarHBondContact O-N 3.34Å; D1102-Q1104 PolarHBondContact O-N 3.43Å; D1102-C1105 PolarHBondContact O-N 3.36Å; D1102-L1106 WeakPolarHBondContact O-CB 3.4Å; D1102-L1106 PolarHBondContact O-N 3.27Å
1103	V	53.8	Low	51.9	Low	41 Å²	41	94.3 Å²	94.3	25%	0.248	50%	0.502	C	S	.	.	H	α-helix	trans	-62.3	-43.2	173.2	-178.5	0	0	0	0	110.8	D1098 D1099 L1106 S1107	D1098-V1103 HydrophobicContact CB-CG2 3.73Å; D1099-V1103 PolarHBondContact O-N 3.16Å; V1103-L1106 PolarHBondContact O-N 2.91Å; V1103-S1107 WeakPolarHBondContact O-CB 3.09Å; V1103-S1107 PolarHBondContact O-N 3.42Å
1104	Q	51	Low	51.5	Low	103 Å²	103	87.8 Å²	87.8	48%	0.481	47%	0.473	S	S	.	.	H	α-helix	trans	-70	-31.9	175.8	-174.5	157.2	-27.1	0	0	112.5	P1100 D1102 S1108	P1100-Q1104 VanDerWaalsContact O-CB 3.23Å; P1100-Q1104 WeakPolarHBondContact O-CB 3.43Å; P1100-Q1104 PolarHBondContact O-N 3.08Å; D1102-Q1104 PolarHBondContact O-N 3.43Å; Q1104-S1108 VanDerWaalsContact O-CB 3.25Å; Q1104-S1108 WeakPolarHBondContact O-CB 3.3Å; Q1104-S1108 PolarHBondContact O-N 2.99Å; Q1104-S1108 PolarHBondContact O-OG 3.32Å
1105	C	53.8	Low	51.2	Low	80 Å²	80	81.7 Å²	81.7	54%	0.541	45%	0.453	S	S	.	.	H	α-helix	trans	-66.4	-42.6	171.5	-170.6	0	0	0	0	111.3	L1101 D1102 S1108 Y1109	L1101-C1105 WeakPolarHBondContact O-CB 3.38Å; L1101-C1105 PolarHBondContact O-N 3.08Å; D1102-C1105 PolarHBondContact O-N 3.36Å; C1105-S1108 PolarHBondContact O-N 2.69Å; C1105-Y1109 WeakPolarHBondContact O-CB 3.22Å; C1105-Y1109 PolarHBondContact O-N 2.95Å
1106	L	46.6	Very low	50.7	Low	83 Å²	83	82.2 Å²	82.2	44%	0.435	45%	0.452	S	S	.	.	H	α-helix	trans	-67.5	-41.5	178.1	-174.7	63.2	0	0	0	112.1	W1060 D1102 V1103 Y1109 M1110	W1060-L1106 HydrophobicContact CH2-CD2 3.57Å; W1060-L1106 HydrophobicContact CH2-CG 3.77Å; W1060-L1106 HydrophobicContact CZ2-CD2 4.17Å; W1060-L1106 HydrophobicContact CZ3-CD2 4.07Å; W1060-L1106 HydrophobicContact CZ3-CG 3.86Å; D1102-L1106 WeakPolarHBondContact O-CB 3.4Å; D1102-L1106 PolarHBondContact O-N 3.27Å; V1103-L1106 PolarHBondContact O-N 2.91Å; L1106-Y1109 PolarHBondContact O-N 3.08Å; L1106-M1110 PolarHBondContact O-N 3.21Å
1107	S	48.7	Very low	50.2	Low	20 Å²	20	82.8 Å²	82.8	14%	0.14	45%	0.454	C	S	.	.	H	α-helix	trans	-62.6	-49.2	173.3	-174.5	0	0	0	0	111.3	V1103 Y1109 M1110 E1111	V1103-S1107 WeakPolarHBondContact O-CB 3.09Å; V1103-S1107 PolarHBondContact O-N 3.42Å; S1107-Y1109 VanDerWaalsContact C-N 3.3Å; S1107-Y1109 PolarHBondContact O-N 2.94Å; S1107-M1110 PolarHBondContact O-N 3.33Å; S1107-M1110 VanDerWaalsContact O-N 3.13Å; S1107-E1111 PolarHBondContact O-N 2.92Å
1108	S	53.8	Low	49.5	Very low	55 Å²	55	83.8 Å²	83.8	39%	0.385	46%	0.456	S	S	.	.	H	α-helix	trans	-60	-39.8	175.1	-57.2	0	0	0	0	112.1	Q1104 C1105 E1111 Q1112	Q1104-S1108 VanDerWaalsContact O-CB 3.25Å; Q1104-S1108 WeakPolarHBondContact O-CB 3.3Å; Q1104-S1108 PolarHBondContact O-N 2.99Å; Q1104-S1108 PolarHBondContact O-OG 3.32Å; C1105-S1108 PolarHBondContact O-N 2.69Å; S1108-E1111 PolarHBondContact O-N 3.04Å; S1108-Q1112 WeakPolarHBondContact O-CB 3.25Å; S1108-Q1112 WeakPolarHBondContact O-CG 3.43Å; S1108-Q1112 PolarHBondContact O-N 3.36Å
1109	Y	56.2	Low	48.8	Very low	128 Å²	128	82.9 Å²	82.9	50%	0.502	46%	0.459	S	S	.	.	H	α-helix	trans	-63.9	-43.1	174.7	176.1	-93.9	0	0	0	111.6	C1105 L1106 S1107 Q1112 F1113	C1105-Y1109 WeakPolarHBondContact O-CB 3.22Å; C1105-Y1109 PolarHBondContact O-N 2.95Å; L1106-Y1109 PolarHBondContact O-N 3.08Å; S1107-Y1109 VanDerWaalsContact C-N 3.3Å; S1107-Y1109 PolarHBondContact O-N 2.94Å; Y1109-Q1112 PolarHBondContact O-N 3.03Å; Y1109-F1113 HydrophobicContact CE1-CB 4.32Å; Y1109-F1113 AromaticContact CE1-CD2 3.75Å; Y1109-F1113 HydrophobicContact CE1-CD2 3.75Å; Y1109-F1113 HydrophobicContact CE1-CE2 4.35Å; Y1109-F1113 HydrophobicContact CE1-CG 4.32Å; Y1109-F1113 AromaticContact CZ-CD2 3.67Å; Y1109-F1113 WeakPolarHBondContact O-CB 3.29Å; Y1109-F1113 PolarHBondContact O-N 3.22Å; Y1109-F1113 WeakPolarHBondContact OH-CD2 3.38Å
1110	M	50.7	Low	48.4	Very low	37 Å²	37	87.5 Å²	87.5	18%	0.182	48%	0.482	C	S	.	.	H	α-helix	trans	-65.3	-40.8	176.1	-99	177.3	38.3	0	0	112.2	A1053 T1056 W1060 L1106 S1107 F1113 V1114	A1053-M1110 WeakPolarHBondContact O-CE 3.4Å; T1056-M1110 HydrophobicContact CG2-CE 4.2Å; W1060-M1110 HydrophobicContact CE3-CE 4.21Å; W1060-M1110 HydrophobicContact CH2-CE 3.97Å; W1060-M1110 HydrophobicContact CH2-SD 3.44Å; W1060-M1110 WeakPolarHBondContact CH2-SD 3.3Å; W1060-M1110 HydrophobicContact CZ3-CE 3.63Å; W1060-M1110 HydrophobicContact CZ3-CG 4.49Å; W1060-M1110 HydrophobicContact CZ3-SD 3.44Å; W1060-M1110 WeakPolarHBondContact CZ3-SD 3.4Å; L1106-M1110 PolarHBondContact O-N 3.21Å; S1107-M1110 PolarHBondContact O-N 3.33Å; S1107-M1110 VanDerWaalsContact O-N 3.13Å; M1110-F1113 PolarHBondContact O-N 2.76Å; M1110-V1114 WeakPolarHBondContact O-CB 3.45Å; M1110-V1114 WeakPolarHBondContact O-CG2 3.43Å; M1110-V1114 PolarHBondContact O-N 3.07Å
1111	E	53	Low	47.2	Very low	67 Å²	67	89.2 Å²	89.2	31%	0.313	50%	0.495	S	S	.	.	H	α-helix	trans	-65.4	-38.4	174.4	-61.9	-150.2	143.6	0	0	112.1	R1038 S1057 K1061 S1107 S1108 G1115	R1038-E1111 IonicContact CZ-OE1 3.64Å; R1038-E1111 VanDerWaalsContact CZ-OE1 3.26Å; R1038-E1111 IonicContact NH1-OE1 2.77Å; R1038-E1111 PolarHBondContact NH1-OE1 3.24Å; R1038-E1111 IonicContact NH2-OE1 3.53Å; R1038-E1111 PolarHBondContact NH2-OE1 3.31Å; R1038-E1111 IonicContact NH2-OE2 2.81Å; R1038-E1111 PolarHBondContact NH2-OE2 2.78Å; S1057-E1111 PolarHBondContact OG-OE1 3.35Å; K1061-E1111 WeakPolarHBondContact CE-OE1 3.1Å; K1061-E1111 IonicContact NZ-OE1 2.77Å; K1061-E1111 PolarHBondContact NZ-OE1 2.92Å; K1061-E1111 IonicContact NZ-OE2 3.43Å; S1107-E1111 PolarHBondContact O-N 2.92Å; S1108-E1111 PolarHBondContact O-N 3.04Å; E1111-G1115 VanDerWaalsContact O-CA 3.29Å; E1111-G1115 WeakPolarHBondContact O-CA 3.28Å; E1111-G1115 PolarHBondContact O-N 3.36Å
1112	Q	54.2	Low	46	Very low	147 Å²	147	88.3 Å²	88.3	69%	0.687	50%	0.5	S	S	*	.	H	α-helix	trans	-71.3	-31.5	172.4	-73.2	-176.6	3.2	0	0	114	S1108 Y1109	S1108-Q1112 WeakPolarHBondContact O-CB 3.25Å; S1108-Q1112 WeakPolarHBondContact O-CG 3.43Å; S1108-Q1112 PolarHBondContact O-N 3.36Å; Y1109-Q1112 PolarHBondContact O-N 3.03Å
1113	F	48.3	Very low	45.3	Very low	94 Å²	94	92.5 Å²	92.5	41%	0.412	52%	0.516	S	S	.	.	H	α-helix	trans	-77.7	-30	-177.9	-176.8	-79.2	0	0	0	112.4	Y1109 M1110	Y1109-F1113 HydrophobicContact CE1-CB 4.32Å; Y1109-F1113 AromaticContact CE1-CD2 3.75Å; Y1109-F1113 HydrophobicContact CE1-CD2 3.75Å; Y1109-F1113 HydrophobicContact CE1-CE2 4.35Å; Y1109-F1113 HydrophobicContact CE1-CG 4.32Å; Y1109-F1113 AromaticContact CZ-CD2 3.67Å; Y1109-F1113 WeakPolarHBondContact O-CB 3.29Å; Y1109-F1113 PolarHBondContact O-N 3.22Å; Y1109-F1113 WeakPolarHBondContact OH-CD2 3.38Å; M1110-F1113 PolarHBondContact O-N 2.76Å
1114	V	49.9	Very low	44.5	Very low	26 Å²	26	94.5 Å²	94.5	16%	0.158	54%	0.537	C	S	.	.	H	α-helix	trans	-101.7	-26.1	179.8	-171.9	0	0	0	0	112.1	A1053 W1054 M1110	A1053-V1114 HydrophobicContact CB-CG2 4.19Å; W1054-V1114 VanDerWaalsContact NE1-CG1 3.27Å; M1110-V1114 WeakPolarHBondContact O-CB 3.45Å; M1110-V1114 WeakPolarHBondContact O-CG2 3.43Å; M1110-V1114 PolarHBondContact O-N 3.07Å
1115	G	44.9	Very low	43.8	Very low	34 Å²	34	99 Å²	99	35%	0.351	56%	0.558	S	S	.	*			trans	-68.1	136.3	177.3	0	0	0	0	0	113.7	E1111 E1117	E1111-G1115 VanDerWaalsContact O-CA 3.29Å; E1111-G1115 WeakPolarHBondContact O-CA 3.28Å; E1111-G1115 PolarHBondContact O-N 3.36Å; G1115-E1117 PolarHBondContact O-N 3.31Å
1116	T	40.2	Very low	42.7	Very low	61 Å²	61	98.3 Å²	98.3	37%	0.374	56%	0.564	S	S	.	*	S	Bend	trans	-74.6	-5.1	-177.5	-11.1	0	0	0	0	114.5	S1118 V1146	T1116-S1118 VanDerWaalsContact C-N 3.33Å; T1116-S1118 PolarHBondContact O-N 2.92Å; T1116-V1146 HydrophobicContact CG2-CG1 4.16Å
1117	E	39.1	Very low	42.1	Very low	146 Å²	146	104 Å²	104	68%	0.682	58%	0.581	S	S	*	*			trans	-90.4	50.1	-173.2	-57.9	-69.3	142.6	0	0	112.2	G1115 S1119	G1115-E1117 PolarHBondContact O-N 3.31Å; E1117-S1119 VanDerWaalsContact C-N 3.26Å; E1117-S1119 PolarHBondContact O-N 3.35Å; E1117-S1119 VanDerWaalsContact O-N 3.16Å
1118	S	31.7	Very low	41.3	Very low	108 Å²	108	112 Å²	112	76%	0.755	61%	0.614	S	S	*	*			trans	-86.8	55.2	175.7	-74.4	0	0	0	0	112.6	T1116	T1116-S1118 VanDerWaalsContact C-N 3.33Å; T1116-S1118 PolarHBondContact O-N 2.92Å
1119	S	37	Very low	40.4	Very low	90 Å²	90	119 Å²	119	63%	0.629	64%	0.638	S	S	*	*			trans	-108.3	107	174.7	51.5	0	0	0	0	111.9	E1117	E1117-S1119 VanDerWaalsContact C-N 3.26Å; E1117-S1119 PolarHBondContact O-N 3.35Å; E1117-S1119 VanDerWaalsContact O-N 3.16Å
1120	L	43.8	Very low	39.1	Very low	177 Å²	177	120.5 Å²	120.5	93%	0.927	65%	0.647	S	S	*	*			trans	69.3	83.1	165.3	-50.9	176.6	0	0	0	117.1
1121	C	27.6	Very low	38.3	Very low	138 Å²	138	123.8 Å²	123.8	93%	0.932	67%	0.671	S	S	*	*			trans	-135.2	162.1	145.8	-160.5	0	0	0	0	110.2
1122	S	29.2	Very low	37.6	Very low	111 Å²	111	127.6 Å²	127.6	78%	0.776	70%	0.699	S	S	*	*			trans	-79	159	-154.7	-161.7	0	0	0	0	116	A1124	S1122-A1124 PolarHBondContact O-N 3.13Å
1123	Q	38.2	Very low	36.8	Very low	196 Å²	196	128 Å²	128	92%	0.916	70%	0.698	S	S	*	*			trans	-84.5	98.9	166.9	-72.2	-175.9	-13.6	0	0	111.3
1124	A	37.4	Very low	36.2	Very low	84 Å²	84	130 Å²	130	69%	0.694	71%	0.713	S	S	*	*			trans	-162	156.5	150.1	0	0	0	0	0	109.9	S1122	S1122-A1124 PolarHBondContact O-N 3.13Å
1125	E	34.8	Very low	35.8	Very low	198 Å²	198	132.9 Å²	132.9	93%	0.925	73%	0.732	S	S	*	*			trans	52.5	100.4	160.4	-64.9	175.9	-169.2	0	0	117.6
1126	G	30.7	Very low	35.6	Very low	65 Å²	65	141.6 Å²	141.6	67%	0.67	75%	0.754	S	S	*	*			trans	169.9	47.5	-177.5	0	0	0	0	0	113
1127	Y	34.2	Very low	35.5	Very low	201 Å²	201	144 Å²	144	79%	0.788	77%	0.765	S	S	*	*			trans	-120.8	31.9	-169.2	-96	-71.3	0	0	0	115.1
1128	F	33.6	Very low	35.7	Very low	190 Å²	190	140.9 Å²	140.9	83%	0.833	75%	0.752	S	S	*	*	S	Bend	trans	-117	145.3	164.6	-75	-83.3	0	0	0	110.9
1129	F	34.3	Very low	36.2	Very low	202 Å²	202	144.3 Å²	144.3	89%	0.886	75%	0.749	S	S	*	*			trans	52.9	91.1	-178.4	-62.9	-79	0	0	0	117.5
1130	K	28.8	Very low	36.6	Very low	158 Å²	158	149.6 Å²	149.6	69%	0.687	76%	0.755	S	S	*	*			trans	-113.2	120.5	158.6	-92.8	172.8	178.5	141.9	0	110.3
1131	P	33.2	Very low	36.6	Very low	106 Å²	106	146.7 Å²	146.7	69%	0.688	74%	0.735	S	S	*	*			trans	-59.9	136.3	165.3	-23.5	34.6	0	0	0	111.2	F1133	P1131-F1133 HydrophobicContact CB-CD2 4.07Å; P1131-F1133 HydrophobicContact CB-CE2 4.03Å; P1131-F1133 PolarHBondContact O-N 3.44Å
1132	V	39.7	Very low	37.5	Very low	148 Å²	148	145.3 Å²	145.3	90%	0.897	71%	0.71	S	S	*	*			trans	-83.2	83.3	-172.1	-174.6	0	0	0	0	111.2
1133	F	37.3	Very low	38.5	Very low	154 Å²	154	147.6 Å²	147.6	68%	0.675	70%	0.702	S	S	*	*			trans	-113.5	135.7	169.9	-68.6	-68.1	0	0	0	112.4	P1131 P1135 L1138	P1131-F1133 HydrophobicContact CB-CD2 4.07Å; P1131-F1133 HydrophobicContact CB-CE2 4.03Å; P1131-F1133 PolarHBondContact O-N 3.44Å; F1133-P1135 VanDerWaalsContact O-CD 3.27Å; F1133-P1135 WeakPolarHBondContact O-CD 3.35Å; F1133-L1138 HydrophobicContact CB-CD1 4.09Å
1134	L	35.3	Very low	39.3	Very low	138 Å²	138	144 Å²	144	72%	0.723	68%	0.68	S	S	*	*			trans	-59.8	115.5	-177.1	-77.1	164.9	0	0	0	111.8	R1136 N1137	L1134-R1136 PolarHBondContact O-N 3.01Å; L1134-N1137 PolarHBondContact O-N 2.76Å; L1134-N1137 VanDerWaalsContact O-N 3.08Å
1135	P	40.1	Very low	39.5	Very low	85 Å²	85	142 Å²	142	55%	0.552	66%	0.656	S	S	*	*	H	α-helix	trans	-59.6	-18.2	-171.2	-28.8	36.3	0	0	0	115.7	F1133 N1137 R1139	F1133-P1135 VanDerWaalsContact O-CD 3.27Å; F1133-P1135 WeakPolarHBondContact O-CD 3.35Å; P1135-N1137 VanDerWaalsContact C-N 3.32Å; P1135-N1137 PolarHBondContact O-N 3.45Å; P1135-R1139 WeakPolarHBondContact O-CB 3.49Å; P1135-R1139 VanDerWaalsContact O-CG 3.32Å; P1135-R1139 WeakPolarHBondContact O-CG 3.47Å; P1135-R1139 PolarHBondContact O-N 2.93Å; P1135-R1139 VanDerWaalsContact O-N 3.09Å
1136	R	42.4	Very low	40.3	Very low	217 Å²	217	135.4 Å²	135.4	82%	0.819	63%	0.629	S	S	*	*	H	α-helix	trans	-60.3	-37.2	175.8	180	170.7	170.1	163.5	-5	112.7	L1134	L1134-R1136 PolarHBondContact O-N 3.01Å
1137	N	36.8	Very low	41.1	Very low	112 Å²	112	140 Å²	140	60%	0.599	63%	0.626	S	S	*	*	H	α-helix	trans	-84.5	-43.6	-177.9	-69.7	-8.3	0	0	0	111.5	L1134 P1135 R1139 R1140 F1141	L1134-N1137 PolarHBondContact O-N 2.76Å; L1134-N1137 VanDerWaalsContact O-N 3.08Å; P1135-N1137 VanDerWaalsContact C-N 3.32Å; P1135-N1137 PolarHBondContact O-N 3.45Å; N1137-R1139 VanDerWaalsContact C-N 3.28Å; N1137-R1139 PolarHBondContact O-N 2.73Å; N1137-R1140 WeakPolarHBondContact O-CA 3.46Å; N1137-R1140 PolarHBondContact O-N 2.89Å; N1137-F1141 PolarHBondContact O-N 2.74Å
1138	L	43	Very low	41.4	Very low	80 Å²	80	132.2 Å²	132.2	42%	0.419	60%	0.597	S	S	.	*	H	α-helix	trans	-55.8	-41.3	173.1	-104.9	74.5	0	0	0	112.2	F1133 R1140 F1141 R1142	F1133-L1138 HydrophobicContact CB-CD1 4.09Å; L1138-R1140 PolarHBondContact O-N 3.45Å; L1138-F1141 PolarHBondContact O-N 2.8Å; L1138-R1142 WeakPolarHBondContact O-CB 3.37Å; L1138-R1142 PolarHBondContact O-N 3.44Å
1139	R	43.8	Very low	42	Very low	181 Å²	181	124.2 Å²	124.2	68%	0.683	56%	0.564	S	S	*	*	H	α-helix	trans	-68.7	-13.5	175.6	-73.5	-179.5	178.9	-164	0.6	114.2	P1135 N1137 R1143	P1135-R1139 WeakPolarHBondContact O-CB 3.49Å; P1135-R1139 VanDerWaalsContact O-CG 3.32Å; P1135-R1139 WeakPolarHBondContact O-CG 3.47Å; P1135-R1139 PolarHBondContact O-N 2.93Å; P1135-R1139 VanDerWaalsContact O-N 3.09Å; N1137-R1139 VanDerWaalsContact C-N 3.28Å; N1137-R1139 PolarHBondContact O-N 2.73Å; R1139-R1143 PolarHBondContact O-NE 2.83Å; R1139-R1143 PolarHBondContact O-NH2 2.89Å
1140	R	45.3	Very low	42.4	Very low	201 Å²	201	119.5 Å²	119.5	76%	0.758	54%	0.544	S	S	*	.	H	α-helix	trans	-91.9	-42.4	170.8	-163	178.4	-172.4	-173.9	2	110.6	N1137 L1138 R1143 W1144	N1137-R1140 WeakPolarHBondContact O-CA 3.46Å; N1137-R1140 PolarHBondContact O-N 2.89Å; L1138-R1140 PolarHBondContact O-N 3.45Å; R1140-R1143 PolarHBondContact O-N 3.34Å; R1140-W1144 WeakPolarHBondContact O-CB 2.86Å; R1140-W1144 PolarHBondContact O-N 2.87Å; R1140-W1144 VanDerWaalsContact O-N 3.12Å
1141	F	42.8	Very low	43.1	Very low	115 Å²	115	113 Å²	113	50%	0.504	52%	0.52	S	S	.	.	H	α-helix	trans	-62.5	-52.2	175.6	-170.8	-97.4	0	0	0	112	N1137 L1138 R1143 W1144 Q1145	N1137-F1141 PolarHBondContact O-N 2.74Å; L1138-F1141 PolarHBondContact O-N 2.8Å; F1141-R1143 VanDerWaalsContact C-N 3.32Å; F1141-R1143 PolarHBondContact O-N 3.49Å; F1141-W1144 HydrophobicContact CD2-CE3 4.29Å; F1141-W1144 HydrophobicContact CE2-CE3 4.08Å; F1141-W1144 AromaticContact CE2-CZ3 3.95Å; F1141-W1144 HydrophobicContact CE2-CZ3 3.95Å; F1141-W1144 HydrophobicContact CZ-CZ3 4.28Å; F1141-W1144 CarbonylContact O-C 3.56Å; F1141-W1144 WeakPolarHBondContact O-CA 3.23Å; F1141-W1144 WeakPolarHBondContact O-CB 3.08Å; F1141-W1144 PolarHBondContact O-N 2.91Å; F1141-Q1145 HydrophobicContact CE1-CB 4.48Å; F1141-Q1145 WeakPolarHBondContact O-CB 3.35Å; F1141-Q1145 PolarHBondContact O-N 2.89Å
1142	R	47	Very low	43.3	Very low	109 Å²	109	112.1 Å²	112.1	41%	0.411	51%	0.508	S	S	.	.	H	α-helix	trans	-58.8	-38.5	176.9	-73	-172.5	173.8	-160.7	-3.3	113.2	L1138 W1144 Q1145 V1146	L1138-R1142 WeakPolarHBondContact O-CB 3.37Å; L1138-R1142 PolarHBondContact O-N 3.44Å; R1142-W1144 PolarHBondContact O-N 3.46Å; R1142-Q1145 PolarHBondContact O-N 2.96Å; R1142-V1146 WeakPolarHBondContact O-CB 3.45Å; R1142-V1146 VanDerWaalsContact O-CG2 3.3Å; R1142-V1146 WeakPolarHBondContact O-CG2 3.35Å; R1142-V1146 PolarHBondContact O-N 3.25Å
1143	R	49.2	Very low	43.7	Very low	160 Å²	160	114 Å²	114	60%	0.604	50%	0.499	S	S	*	.	H	α-helix	trans	-78.4	-0.3	174.9	-73.6	-173.4	-63	172.4	1.4	114.5	R1139 R1140 F1141 R1147	R1139-R1143 PolarHBondContact O-NE 2.83Å; R1139-R1143 PolarHBondContact O-NH2 2.89Å; R1140-R1143 PolarHBondContact O-N 3.34Å; F1141-R1143 VanDerWaalsContact C-N 3.32Å; F1141-R1143 PolarHBondContact O-N 3.49Å; R1143-R1147 WeakPolarHBondContact O-CD 3.36Å; R1143-R1147 WeakPolarHBondContact O-CG 3.46Å; R1143-R1147 PolarHBondContact O-NH1 3.31Å
1144	W	55.4	Low	44	Very low	121 Å²	121	110.9 Å²	110.9	46%	0.458	50%	0.495	S	S	.	.	H	α-helix	trans	-100.1	-46.3	166	171.8	86.9	0	0	0	109.6	V1050 R1140 F1141 R1142 R1147 Q1148	V1050-W1144 HydrophobicContact CG2-CH2 4.36Å; R1140-W1144 WeakPolarHBondContact O-CB 2.86Å; R1140-W1144 PolarHBondContact O-N 2.87Å; R1140-W1144 VanDerWaalsContact O-N 3.12Å; F1141-W1144 HydrophobicContact CD2-CE3 4.29Å; F1141-W1144 HydrophobicContact CE2-CE3 4.08Å; F1141-W1144 AromaticContact CE2-CZ3 3.95Å; F1141-W1144 HydrophobicContact CE2-CZ3 3.95Å; F1141-W1144 HydrophobicContact CZ-CZ3 4.28Å; F1141-W1144 CarbonylContact O-C 3.56Å; F1141-W1144 WeakPolarHBondContact O-CA 3.23Å; F1141-W1144 WeakPolarHBondContact O-CB 3.08Å; F1141-W1144 PolarHBondContact O-N 2.91Å; R1142-W1144 PolarHBondContact O-N 3.46Å; W1144-R1147 CarbonylContact O-C 3.22Å; W1144-R1147 WeakPolarHBondContact O-CB 3.36Å; W1144-R1147 PolarHBondContact O-N 3.15Å; W1144-Q1148 HydrophobicContact CD2-CG 4.06Å; W1144-Q1148 HydrophobicContact CE3-CG 4.38Å; W1144-Q1148 HydrophobicContact CH2-CG 4.3Å; W1144-Q1148 HydrophobicContact CZ2-CG 3.97Å; W1144-Q1148 HydrophobicContact CZ3-CG 4.49Å; W1144-Q1148 VanDerWaalsContact O-CG 3.29Å; W1144-Q1148 WeakPolarHBondContact O-CG 3.48Å; W1144-Q1148 PolarHBondContact O-N 2.9Å
1145	Q	42.8	Very low	44.5	Very low	42 Å²	42	111.5 Å²	111.5	20%	0.196	49%	0.488	C	S	.	.	H	α-helix	trans	-59.8	-49.9	176.8	-171.1	178.9	10.7	0	0	112.6	F1141 R1142 R1147 Q1148 V1149	F1141-Q1145 HydrophobicContact CE1-CB 4.48Å; F1141-Q1145 WeakPolarHBondContact O-CB 3.35Å; F1141-Q1145 PolarHBondContact O-N 2.89Å; R1142-Q1145 PolarHBondContact O-N 2.96Å; Q1145-R1147 VanDerWaalsContact C-N 3.29Å; Q1145-R1147 PolarHBondContact O-N 3.05Å; Q1145-Q1148 WeakPolarHBondContact O-CB 3.44Å; Q1145-Q1148 PolarHBondContact O-N 3.12Å; Q1145-V1149 WeakPolarHBondContact O-CG2 3.14Å; Q1145-V1149 PolarHBondContact O-N 3.4Å
1146	V	50.9	Low	44.4	Very low	58 Å²	58	119.1 Å²	119.1	35%	0.352	51%	0.506	S	S	.	.	H	α-helix	trans	-57.8	-43.3	173.9	170.1	0	0	0	0	110.5	T1116 R1142 Q1148 V1149 E1150	T1116-V1146 HydrophobicContact CG2-CG1 4.16Å; R1142-V1146 WeakPolarHBondContact O-CB 3.45Å; R1142-V1146 VanDerWaalsContact O-CG2 3.3Å; R1142-V1146 WeakPolarHBondContact O-CG2 3.35Å; R1142-V1146 PolarHBondContact O-N 3.25Å; V1146-Q1148 VanDerWaalsContact C-N 3.31Å; V1146-Q1148 PolarHBondContact O-N 3.24Å; V1146-V1149 PolarHBondContact O-N 3.05Å; V1146-E1150 HydrophobicContact CG1-CG 4.22Å; V1146-E1150 WeakPolarHBondContact O-CB 3.42Å; V1146-E1150 VanDerWaalsContact O-CG 3.24Å; V1146-E1150 WeakPolarHBondContact O-CG 3.38Å; V1146-E1150 PolarHBondContact O-N 2.86Å
1147	R	46.6	Very low	44.2	Very low	161 Å²	161	115.9 Å²	115.9	61%	0.608	50%	0.5	S	S	*	.	H	α-helix	trans	-66.7	-27.9	175.6	-74.8	-171.4	178.1	109.2	-8.5	114.2	R1143 W1144 Q1145 E1150 A1151	R1143-R1147 WeakPolarHBondContact O-CD 3.36Å; R1143-R1147 WeakPolarHBondContact O-CG 3.46Å; R1143-R1147 PolarHBondContact O-NH1 3.31Å; W1144-R1147 CarbonylContact O-C 3.22Å; W1144-R1147 WeakPolarHBondContact O-CB 3.36Å; W1144-R1147 PolarHBondContact O-N 3.15Å; Q1145-R1147 VanDerWaalsContact C-N 3.29Å; Q1145-R1147 PolarHBondContact O-N 3.05Å; R1147-E1150 WeakPolarHBondContact CA-OE2 3.15Å; R1147-A1151 WeakPolarHBondContact O-CB 3.38Å; R1147-A1151 PolarHBondContact O-N 2.7Å
1148	Q	42.1	Very low	44.3	Very low	38 Å²	38	115.4 Å²	115.4	18%	0.178	49%	0.49	C	S	.	.	H	α-helix	trans	-73.9	-38.8	172.9	-70.2	-78.3	63.5	0	0	110.8	W1144 Q1145 V1146 A1151 M1152	W1144-Q1148 HydrophobicContact CD2-CG 4.06Å; W1144-Q1148 HydrophobicContact CE3-CG 4.38Å; W1144-Q1148 HydrophobicContact CH2-CG 4.3Å; W1144-Q1148 HydrophobicContact CZ2-CG 3.97Å; W1144-Q1148 HydrophobicContact CZ3-CG 4.49Å; W1144-Q1148 VanDerWaalsContact O-CG 3.29Å; W1144-Q1148 WeakPolarHBondContact O-CG 3.48Å; W1144-Q1148 PolarHBondContact O-N 2.9Å; Q1145-Q1148 WeakPolarHBondContact O-CB 3.44Å; Q1145-Q1148 PolarHBondContact O-N 3.12Å; V1146-Q1148 VanDerWaalsContact C-N 3.31Å; V1146-Q1148 PolarHBondContact O-N 3.24Å; Q1148-A1151 PolarHBondContact O-N 3.13Å; Q1148-M1152 WeakPolarHBondContact O-CB 3.3Å; Q1148-M1152 WeakPolarHBondContact O-CG 3.46Å; Q1148-M1152 PolarHBondContact O-N 3.31Å
1149	V	46.3	Very low	44.3	Very low	23 Å²	23	119.5 Å²	119.5	14%	0.139	51%	0.506	C	S	.	.	H	α-helix	trans	-67.5	-44.4	174.5	173.9	0	0	0	0	111.1	Q1145 V1146 M1152 R1153	Q1145-V1149 WeakPolarHBondContact O-CG2 3.14Å; Q1145-V1149 PolarHBondContact O-N 3.4Å; V1146-V1149 PolarHBondContact O-N 3.05Å; V1149-M1152 PolarHBondContact O-N 2.95Å; V1149-R1153 PolarHBondContact O-N 3.08Å; V1149-R1153 VanDerWaalsContact O-N 3.16Å
1150	E	42.3	Very low	44.3	Very low	103 Å²	103	121.6 Å²	121.6	48%	0.481	51%	0.514	S	S	.	.	H	α-helix	trans	-59.7	-44.9	171.3	-70	167.1	156.4	0	0	111.4	V1146 R1147 R1153 C1154	V1146-E1150 HydrophobicContact CG1-CG 4.22Å; V1146-E1150 WeakPolarHBondContact O-CB 3.42Å; V1146-E1150 VanDerWaalsContact O-CG 3.24Å; V1146-E1150 WeakPolarHBondContact O-CG 3.38Å; V1146-E1150 PolarHBondContact O-N 2.86Å; R1147-E1150 WeakPolarHBondContact CA-OE2 3.15Å; E1150-R1153 PolarHBondContact O-N 2.83Å; E1150-C1154 PolarHBondContact O-N 3.37Å
1151	A	43.3	Very low	44.3	Very low	21 Å²	21	118.9 Å²	118.9	17%	0.174	51%	0.51	C	S	.	.	H	α-helix	trans	-67.1	-34	176.8	0	0	0	0	0	113.2	R1147 Q1148 R1153 C1154 W1158	R1147-A1151 WeakPolarHBondContact O-CB 3.38Å; R1147-A1151 PolarHBondContact O-N 2.7Å; Q1148-A1151 PolarHBondContact O-N 3.13Å; A1151-R1153 VanDerWaalsContact C-N 3.32Å; A1151-R1153 PolarHBondContact O-N 3.32Å; A1151-C1154 CarbonylContact O-C 3.38Å; A1151-C1154 WeakPolarHBondContact O-CA 3.36Å; A1151-C1154 PolarHBondContact O-N 3.18Å; A1151-W1158 HydrophobicContact CB-CG 4.43Å
1152	M	38	Very low	44.4	Very low	87 Å²	87	117.8 Å²	117.8	43%	0.429	51%	0.509	S	S	.	.	H	α-helix	trans	-66.4	-31.6	174.1	-79.6	-160.2	-68.7	0	0	112.4	W1054 Q1148 V1149 C1154	W1054-M1152 HydrophobicContact CH2-CE 4.38Å; W1054-M1152 HydrophobicContact CZ3-CE 4.45Å; Q1148-M1152 WeakPolarHBondContact O-CB 3.3Å; Q1148-M1152 WeakPolarHBondContact O-CG 3.46Å; Q1148-M1152 PolarHBondContact O-N 3.31Å; V1149-M1152 PolarHBondContact O-N 2.95Å; M1152-C1154 PolarHBondContact O-N 2.91Å
1153	R	47.3	Very low	44.3	Very low	188 Å²	188	114.7 Å²	114.7	71%	0.709	51%	0.506	S	S	*	.	H	α-helix	trans	-64.4	-23.2	168.6	-74.8	-173.9	172.1	179.2	-1.2	112.6	V1149 E1150 A1151	V1149-R1153 PolarHBondContact O-N 3.08Å; V1149-R1153 VanDerWaalsContact O-N 3.16Å; E1150-R1153 PolarHBondContact O-N 2.83Å; A1151-R1153 VanDerWaalsContact C-N 3.32Å; A1151-R1153 PolarHBondContact O-N 3.32Å
1154	C	42.6	Very low	44.1	Very low	89 Å²	89	111 Å²	111	60%	0.601	50%	0.501	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.3	53.1	178.7	-67.1	0	0	0	0	113.5	E1150 A1151 M1152 R1156 E1157	E1150-C1154 PolarHBondContact O-N 3.37Å; A1151-C1154 CarbonylContact O-C 3.38Å; A1151-C1154 WeakPolarHBondContact O-CA 3.36Å; A1151-C1154 PolarHBondContact O-N 3.18Å; M1152-C1154 PolarHBondContact O-N 2.91Å; C1154-R1156 PolarHBondContact O-N 3.34Å; C1154-E1157 PolarHBondContact O-N 3.14Å
1155	R	46.1	Very low	43.7	Very low	150 Å²	150	108.3 Å²	108.3	57%	0.566	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47.7	-21.1	-168.9	-122.5	-172.4	-165.5	-162.4	14.7	118.9	E879	E879-R1155 IonicContact OE1-CZ 2.79Å; E879-R1155 IonicContact OE1-NH1 3.49Å; E879-R1155 PolarHBondContact OE1-NH1 3.35Å; E879-R1155 IonicContact OE1-NH2 2.89Å; E879-R1155 IonicContact OE2-CZ 2.75Å; E879-R1155 IonicContact OE2-NH1 3.82Å; E879-R1155 PolarHBondContact OE2-NH1 3.27Å; E879-R1155 IonicContact OE2-NH2 2.75Å; E879-R1155 PolarHBondContact OE2-NH2 2.96Å
1156	R	39.2	Very low	43.9	Very low	246 Å²	246	110.7 Å²	110.7	93%	0.928	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.4	-27.1	-170.7	-71	-173.2	177.5	-178.9	0.3	115.5	C1154	C1154-R1156 PolarHBondContact O-N 3.34Å
1157	E	38	Very low	44	Very low	148 Å²	148	110.5 Å²	110.5	69%	0.692	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.4	-38.8	-172	-153.2	78.1	-126	0	0	112.6	C1154	C1154-E1157 PolarHBondContact O-N 3.14Å
1158	W	39.2	Very low	43.9	Very low	103 Å²	103	105.4 Å²	105.4	39%	0.39	51%	0.51	S	S	.	.	G	3₁₀ helix	trans	-77.4	-30.4	-160.1	-158.4	91.9	0	0	0	115.1	A1151 R1160 Q1161 L1162	A1151-W1158 HydrophobicContact CB-CG 4.43Å; W1158-R1160 PolarHBondContact O-N 3.3Å; W1158-Q1161 PolarHBondContact O-N 3.47Å; W1158-Q1161 VanDerWaalsContact O-N 3.16Å; W1158-L1162 HydrophobicContact CD2-CB 4.43Å; W1158-L1162 HydrophobicContact CH2-CB 3.59Å; W1158-L1162 HydrophobicContact CZ2-CB 3.46Å; W1158-L1162 VanDerWaalsContact CZ2-CB 3.46Å; W1158-L1162 HydrophobicContact CZ2-CD1 3.62Å; W1158-L1162 HydrophobicContact CZ2-CG 4.14Å; W1158-L1162 HydrophobicContact CZ3-CB 4.14Å
1159	H	43.1	Very low	44.6	Very low	166 Å²	166	107.7 Å²	107.7	77%	0.769	53%	0.53	S	S	*	.	G	3₁₀ helix	trans	-54.1	-20.4	179.4	-78.4	151.9	0	0	0	114.1
1160	R	43.7	Very low	44.9	Very low	225 Å²	225	110.4 Å²	110.4	85%	0.849	54%	0.544	S	S	*	.	G	3₁₀ helix	trans	-86.1	-9	-175.8	-162.6	172.2	-74.1	-179.3	-2.1	114.7	W1158	W1158-R1160 PolarHBondContact O-N 3.3Å
1161	Q	44	Very low	45.5	Very low	144 Å²	144	110.4 Å²	110.4	67%	0.673	54%	0.544	S	S	*	.	T	Hydrogen-bonded Turn	trans	-129.3	-24.6	-162.2	-65.6	-168.8	3.9	0	0	119.4	W1158	W1158-Q1161 PolarHBondContact O-N 3.47Å; W1158-Q1161 VanDerWaalsContact O-N 3.16Å
1162	L	44.6	Very low	46	Very low	92 Å²	92	112 Å²	112	48%	0.482	55%	0.553	S	S	.	*			trans	-128.1	6.7	-164.3	-98.3	165.1	0	0	0	118.6	W1158	W1158-L1162 HydrophobicContact CD2-CB 4.43Å; W1158-L1162 HydrophobicContact CH2-CB 3.59Å; W1158-L1162 HydrophobicContact CZ2-CB 3.46Å; W1158-L1162 VanDerWaalsContact CZ2-CB 3.46Å; W1158-L1162 HydrophobicContact CZ2-CD1 3.62Å; W1158-L1162 HydrophobicContact CZ2-CG 4.14Å; W1158-L1162 HydrophobicContact CZ3-CB 4.14Å
1163	A	44.6	Very low	46.5	Very low	43 Å²	43	115.7 Å²	115.7	36%	0.355	56%	0.562	S	S	.	*			trans	-67	136.4	167.6	0	0	0	0	0	111.4	R1194	A1163-R1194 HydrophobicContact CB-CB 3.8Å; A1163-R1194 HydrophobicContact CB-CG 4.34Å; A1163-R1194 WeakPolarHBondContact O-CB 3.5Å; A1163-R1194 PolarHBondContact O-N 2.88Å
1164	V	46.7	Very low	46.4	Very low	83 Å²	83	112.8 Å²	112.8	50%	0.503	56%	0.555	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-118.1	131.8	172.9	175.9	0	0	0	0	107.4	M1191 Y1192 R1193	V1164-M1191 HydrophobicContact CG1-CB 4.04Å; V1164-Y1192 WeakPolarHBondContact CA-O 3.38Å; V1164-R1193 HydrophobicContact CG2-CG 4.26Å
1165	E	47.2	Very low	46.7	Very low	64 Å²	64	114.3 Å²	114.3	30%	0.299	55%	0.551	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-102.4	140.6	175.2	-69.9	169.8	167.9	0	0	108.1	Y1192 R1194	E1165-Y1192 HydrophobicContact CB-CD2 4.34Å; E1165-Y1192 HydrophobicContact CB-CE1 4.49Å; E1165-Y1192 HydrophobicContact CB-CE2 3.64Å; E1165-Y1192 PolarHBondContact N-O 2.94Å; E1165-Y1192 PolarHBondContact O-N 3.29Å; E1165-Y1192 VanDerWaalsContact O-N 3.12Å; E1165-Y1192 VanDerWaalsContact OE2-CE2 3.31Å; E1165-Y1192 WeakPolarHBondContact OE2-CE2 3.36Å; E1165-R1194 HydrophobicContact CG-CG 4.42Å; E1165-R1194 WeakPolarHBondContact OE1-CD 3.49Å; E1165-R1194 WeakPolarHBondContact OE1-CG 3.17Å; E1165-R1194 IonicContact OE1-CZ 3.06Å; E1165-R1194 IonicContact OE1-NE 2.93Å; E1165-R1194 PolarHBondContact OE1-NE 2.83Å; E1165-R1194 IonicContact OE1-NH2 2.72Å
1166	N	46.5	Very low	46.7	Very low	93 Å²	93	114.1 Å²	114.1	50%	0.497	56%	0.56	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-115.9	135	178.5	-171.1	24.6	0	0	0	109.5
1167	A	52.5	Low	46.7	Very low	54 Å²	54	109.2 Å²	109.2	45%	0.446	55%	0.553	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-127.1	96.7	171.1	0	0	0	0	0	107.3	Y1192	A1167-Y1192 HydrophobicContact CB-CE1 4.5Å
1168	G	45.3	Very low	47.5	Very low	54 Å²	54	105.9 Å²	105.9	56%	0.557	54%	0.543	S	S	*	.			trans	-94	136.6	-171.5	0	0	0	0	0	113.5	D1189	G1168-D1189 WeakPolarHBondContact CA-OD1 3.29Å
1169	S	55.8	Low	47.8	Very low	85 Å²	85	109 Å²	109	59%	0.594	56%	0.561	S	S	*	*			trans	-153.2	18.5	168.4	69.9	0	0	0	0	113.6	E1171 S1187 D1189	S1169-E1171 PolarHBondContact O-N 3.34Å; S1169-S1187 WeakPolarHBondContact O-CB 3.42Å; S1169-D1189 PolarHBondContact N-OD1 3.41Å
1170	L	54	Low	47.5	Very low	81 Å²	81	108.4 Å²	108.4	42%	0.424	56%	0.557	S	S	.	*			trans	-65	112.2	175.6	-173.9	75.2	0	0	0	111.9	F1183 S1187 D1189	L1170-F1183 HydrophobicContact CD1-CD1 4.02Å; L1170-F1183 HydrophobicContact CD2-CD1 4.24Å; L1170-F1183 HydrophobicContact CD2-CE1 3.95Å; L1170-F1183 HydrophobicContact CG-CD1 4.14Å; L1170-F1183 HydrophobicContact CG-CE1 4.35Å; L1170-S1187 WeakPolarHBondContact CD1-O 3.5Å; L1170-D1189 HydrophobicContact CB-CB 4.05Å; L1170-D1189 WeakPolarHBondContact CB-OD1 3.27Å; L1170-D1189 PolarHBondContact N-OD1 2.76Å
1171	E	54.1	Low	47.8	Very low	102 Å²	102	102.1 Å²	102.1	48%	0.477	54%	0.538	S	S	.	.			trans	-97.6	138.3	171.7	-82.6	-160.9	-176.6	0	0	111.1	S1169 R1173 V1184 S1187	S1169-E1171 PolarHBondContact O-N 3.34Å; E1171-R1173 IonicContact OE2-NE 3.91Å; E1171-R1173 IonicContact OE2-NH2 3.68Å; E1171-R1173 PolarHBondContact OE2-NH2 2.79Å; E1171-V1184 HydrophobicContact CB-CB 3.95Å; E1171-V1184 HydrophobicContact CB-CG2 3.65Å; E1171-V1184 PolarHBondContact O-N 2.86Å; E1171-S1187 PolarHBondContact N-OG 3.41Å; E1171-S1187 PolarHBondContact O-OG 3.37Å
1172	C	54.2	Low	48.1	Very low	54 Å²	54	98.3 Å²	98.3	37%	0.365	52%	0.524	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	147.5	167.9	72.7	0	0	0	0	111.4	M1181 F1183	C1172-M1181 HydrophobicContact CB-CG 4.06Å; C1172-M1181 HydrophobicContact CB-SD 4.27Å; C1172-F1183 HydrophobicContact CB-CD1 3.85Å; C1172-F1183 HydrophobicContact CB-CE1 4.07Å
1173	R	47.8	Very low	48.8	Very low	165 Å²	165	99 Å²	99	62%	0.623	52%	0.524	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-127.1	128	176.3	-66.8	-174.7	-176.7	-175.8	1.7	110.1	E1171 V1182 V1184	E1171-R1173 IonicContact OE2-NE 3.91Å; E1171-R1173 IonicContact OE2-NH2 3.68Å; E1171-R1173 PolarHBondContact OE2-NH2 2.79Å; R1173-V1182 PolarHBondContact N-O 3.27Å; R1173-V1182 PolarHBondContact O-N 2.92Å; R1173-V1184 HydrophobicContact CG-CG2 4.02Å
1174	F	45.7	Very low	49.6	Very low	127 Å²	127	99.2 Å²	99.2	56%	0.557	52%	0.52	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.6	121.4	178.6	-65.7	-92.1	0	0	0	109.9	L1176 M1181	F1174-L1176 PolarHBondContact O-N 3.44Å; F1174-M1181 HydrophobicContact CD1-CB 3.87Å; F1174-M1181 HydrophobicContact CD1-CG 4.16Å; F1174-M1181 HydrophobicContact CE1-CB 3.63Å; F1174-M1181 HydrophobicContact CE1-CG 3.67Å; F1174-M1181 HydrophobicContact CE1-SD 3.93Å; F1174-M1181 HydrophobicContact CE2-CG 4.46Å; F1174-M1181 HydrophobicContact CZ-CB 4.31Å; F1174-M1181 HydrophobicContact CZ-CG 3.83Å; F1174-M1181 HydrophobicContact CZ-SD 3.75Å
1175	K	48.6	Very low	49.5	Very low	121 Å²	121	103.1 Å²	103.1	53%	0.526	54%	0.535	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	91.8	171.1	-71.7	-171.8	176.7	-177.3	0	108.7	N1177 T1178 H1179 K1180 V1182	K1175-N1177 PolarHBondContact O-N 2.78Å; K1175-T1178 WeakPolarHBondContact CB-OG1 3.42Å; K1175-T1178 PolarHBondContact O-N 3.18Å; K1175-H1179 PolarHBondContact O-N 2.83Å; K1175-K1180 PolarHBondContact N-O 3.3Å; K1175-V1182 HydrophobicContact CD-CG2 4.16Å; K1175-V1182 HydrophobicContact CG-CG2 4.25Å
1176	L	45.7	Very low	49.6	Very low	146 Å²	146	107.4 Å²	107.4	76%	0.764	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	-50.1	-27.8	-175.1	-67.6	167.5	0	0	0	114.4	F1174	F1174-L1176 PolarHBondContact O-N 3.44Å
1177	N	39	Very low	50	Low	143 Å²	143	103.8 Å²	103.8	77%	0.765	54%	0.542	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.9	-5.5	178.9	54.2	-9.1	0	0	0	115	K1175	K1175-N1177 PolarHBondContact O-N 2.78Å
1178	T	54.7	Low	49.9	Very low	78 Å²	78	106 Å²	106	48%	0.479	54%	0.543	S	S	.	.	T	Hydrogen-bonded Turn	trans	-130.9	-1.9	175.3	64.8	0	0	0	0	114.2	K1175 K1180	K1175-T1178 WeakPolarHBondContact CB-OG1 3.42Å; K1175-T1178 PolarHBondContact O-N 3.18Å; T1178-K1180 PolarHBondContact O-N 3.34Å
1179	H	46	Very low	50.4	Low	170 Å²	170	106.9 Å²	106.9	79%	0.787	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.1	16.5	-177.3	-62.1	82.1	0	0	0	114.8	K1175	K1175-H1179 PolarHBondContact O-N 2.83Å
1180	K	37.7	Very low	50.3	Low	153 Å²	153	109.3 Å²	109.3	67%	0.665	53%	0.532	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.1	121.9	173.7	-67.9	-172.1	178.4	-175.8	0	110.2	K1175 T1178	K1175-K1180 PolarHBondContact N-O 3.3Å; T1178-K1180 PolarHBondContact O-N 3.34Å
1181	M	49	Very low	50.1	Low	92 Å²	92	112.4 Å²	112.4	45%	0.453	55%	0.546	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.4	135.3	163.4	-173.1	177.5	65.7	0	0	109	C1172 F1174 F1183	C1172-M1181 HydrophobicContact CB-CG 4.06Å; C1172-M1181 HydrophobicContact CB-SD 4.27Å; F1174-M1181 HydrophobicContact CD1-CB 3.87Å; F1174-M1181 HydrophobicContact CD1-CG 4.16Å; F1174-M1181 HydrophobicContact CE1-CB 3.63Å; F1174-M1181 HydrophobicContact CE1-CG 3.67Å; F1174-M1181 HydrophobicContact CE1-SD 3.93Å; F1174-M1181 HydrophobicContact CE2-CG 4.46Å; F1174-M1181 HydrophobicContact CZ-CB 4.31Å; F1174-M1181 HydrophobicContact CZ-CG 3.83Å; F1174-M1181 HydrophobicContact CZ-SD 3.75Å; M1181-F1183 HydrophobicContact CE-CE1 4.26Å; M1181-F1183 HydrophobicContact CE-CE2 3.84Å; M1181-F1183 HydrophobicContact CE-CZ 3.48Å; M1181-F1183 VanDerWaalsContact CE-CZ 3.48Å; M1181-F1183 HydrophobicContact SD-CZ 4.33Å
1182	V	49.7	Very low	50.4	Low	64 Å²	64	110.3 Å²	110.3	39%	0.388	53%	0.534	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	124.2	175.1	-166	0	0	0	0	107.9	R1173 K1175	R1173-V1182 PolarHBondContact N-O 3.27Å; R1173-V1182 PolarHBondContact O-N 2.92Å; K1175-V1182 HydrophobicContact CD-CG2 4.16Å; K1175-V1182 HydrophobicContact CG-CG2 4.25Å
1183	F	60	Low	50.7	Low	108 Å²	108	116.2 Å²	116.2	47%	0.474	55%	0.549	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	147.9	175	-63.9	-77.6	0	0	0	110.8	L1170 C1172 M1181 M1185	L1170-F1183 HydrophobicContact CD1-CD1 4.02Å; L1170-F1183 HydrophobicContact CD2-CD1 4.24Å; L1170-F1183 HydrophobicContact CD2-CE1 3.95Å; L1170-F1183 HydrophobicContact CG-CD1 4.14Å; L1170-F1183 HydrophobicContact CG-CE1 4.35Å; C1172-F1183 HydrophobicContact CB-CD1 3.85Å; C1172-F1183 HydrophobicContact CB-CE1 4.07Å; M1181-F1183 HydrophobicContact CE-CE1 4.26Å; M1181-F1183 HydrophobicContact CE-CE2 3.84Å; M1181-F1183 HydrophobicContact CE-CZ 3.48Å; M1181-F1183 VanDerWaalsContact CE-CZ 3.48Å; M1181-F1183 HydrophobicContact SD-CZ 4.33Å; F1183-M1185 PolarHBondContact O-N 3.12Å
1184	V	62.2	Low	50.7	Low	47 Å²	47	116.8 Å²	116.8	29%	0.285	55%	0.551	S	S	.	*	P	Polyproline II helix	trans	-75	120.7	172.7	179.8	0	0	0	0	107.7	E1171 R1173 N1186 S1187	E1171-V1184 HydrophobicContact CB-CB 3.95Å; E1171-V1184 HydrophobicContact CB-CG2 3.65Å; E1171-V1184 PolarHBondContact O-N 2.86Å; R1173-V1184 HydrophobicContact CG-CG2 4.02Å; V1184-N1186 PolarHBondContact O-N 3.36Å; V1184-S1187 WeakPolarHBondContact O-CB 3.43Å; V1184-S1187 PolarHBondContact O-N 3.17Å; V1184-S1187 PolarHBondContact O-OG 2.87Å
1185	M	44.4	Very low	51.4	Low	165 Å²	165	112.2 Å²	112.2	81%	0.813	54%	0.54	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.5	136.8	176.4	-73.9	-70.3	-64.9	0	0	110.1	F1183 S1187	F1183-M1185 PolarHBondContact O-N 3.12Å; M1185-S1187 VanDerWaalsContact C-N 3.26Å; M1185-S1187 PolarHBondContact O-N 3.25Å
1186	N	48.8	Very low	52.3	Low	153 Å²	153	108.4 Å²	108.4	82%	0.818	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	68	14.7	-174.1	-48.6	-3.5	0	0	0	115.2	V1184	V1184-N1186 PolarHBondContact O-N 3.36Å
1187	S	55.9	Low	52.9	Low	17 Å²	17	105.9 Å²	105.9	12%	0.119	52%	0.518	C	S	.	.			trans	-98.7	127.9	158.3	73.1	0	0	0	0	109.1	S1169 L1170 E1171 V1184 M1185	S1169-S1187 WeakPolarHBondContact O-CB 3.42Å; L1170-S1187 WeakPolarHBondContact CD1-O 3.5Å; E1171-S1187 PolarHBondContact N-OG 3.41Å; E1171-S1187 PolarHBondContact O-OG 3.37Å; V1184-S1187 WeakPolarHBondContact O-CB 3.43Å; V1184-S1187 PolarHBondContact O-N 3.17Å; V1184-S1187 PolarHBondContact O-OG 2.87Å; M1185-S1187 VanDerWaalsContact C-N 3.26Å; M1185-S1187 PolarHBondContact O-N 3.25Å
1188	E	50.2	Low	54.2	Low	101 Å²	101	103.1 Å²	103.1	47%	0.472	51%	0.506	S	S	.	.			trans	-147.3	139.9	-174.8	-70.5	-175.2	-148.6	0	0	110	Y1190	E1188-Y1190 HydrophobicContact CB-CE1 4.26Å; E1188-Y1190 HydrophobicContact CB-CE2 3.94Å; E1188-Y1190 VanDerWaalsContact CD-OH 3.28Å; E1188-Y1190 WeakPolarHBondContact OE2-CE1 3.35Å; E1188-Y1190 VanDerWaalsContact OE2-CZ 3.31Å; E1188-Y1190 PolarHBondContact OE2-OH 3.31Å
1189	D	54.4	Low	54.8	Low	73 Å²	73	107.2 Å²	107.2	39%	0.39	52%	0.517	S	S	.	.			trans	-101.7	127.3	176.7	-103.1	27.7	0	0	0	110.2	G1168 S1169 L1170	G1168-D1189 WeakPolarHBondContact CA-OD1 3.29Å; S1169-D1189 PolarHBondContact N-OD1 3.41Å; L1170-D1189 HydrophobicContact CB-CB 4.05Å; L1170-D1189 WeakPolarHBondContact CB-OD1 3.27Å; L1170-D1189 PolarHBondContact N-OD1 2.76Å
1190	Y	54.6	Low	55.8	Low	136 Å²	136	101.2 Å²	101.2	53%	0.533	50%	0.497	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	113.2	-176.9	-59.7	-70.5	0	0	0	112.7	E1188	E1188-Y1190 HydrophobicContact CB-CE1 4.26Å; E1188-Y1190 HydrophobicContact CB-CE2 3.94Å; E1188-Y1190 VanDerWaalsContact CD-OH 3.28Å; E1188-Y1190 WeakPolarHBondContact OE2-CE1 3.35Å; E1188-Y1190 VanDerWaalsContact OE2-CZ 3.31Å; E1188-Y1190 PolarHBondContact OE2-OH 3.31Å
1191	M	48.5	Very low	57.3	Low	145 Å²	145	103.5 Å²	103.5	71%	0.714	50%	0.501	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.4	124.3	168.9	-64.6	-176.4	-177.2	0	0	110.7	V1164	V1164-M1191 HydrophobicContact CG1-CB 4.04Å
1192	Y	62.1	Low	58.4	Low	58 Å²	58	107.2 Å²	107.2	23%	0.227	52%	0.515	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	146.7	178.2	61	-93	0	0	0	112.1	V1164 E1165 A1167 A1196 L1197	V1164-Y1192 WeakPolarHBondContact CA-O 3.38Å; E1165-Y1192 HydrophobicContact CB-CD2 4.34Å; E1165-Y1192 HydrophobicContact CB-CE1 4.49Å; E1165-Y1192 HydrophobicContact CB-CE2 3.64Å; E1165-Y1192 PolarHBondContact N-O 2.94Å; E1165-Y1192 PolarHBondContact O-N 3.29Å; E1165-Y1192 VanDerWaalsContact O-N 3.12Å; E1165-Y1192 VanDerWaalsContact OE2-CE2 3.31Å; E1165-Y1192 WeakPolarHBondContact OE2-CE2 3.36Å; A1167-Y1192 HydrophobicContact CB-CE1 4.5Å; Y1192-A1196 HydrophobicContact CD2-CB 4.36Å; Y1192-L1197 HydrophobicContact CD1-CD1 4.36Å; Y1192-L1197 HydrophobicContact CD1-CG 4.34Å; Y1192-L1197 HydrophobicContact CD2-CD1 4.38Å; Y1192-L1197 HydrophobicContact CD2-CG 3.94Å; Y1192-L1197 HydrophobicContact CE1-CD1 3.71Å; Y1192-L1197 HydrophobicContact CE1-CG 4.16Å; Y1192-L1197 HydrophobicContact CE2-CB 4.41Å; Y1192-L1197 HydrophobicContact CE2-CD1 3.73Å; Y1192-L1197 HydrophobicContact CE2-CG 3.73Å; Y1192-L1197 HydrophobicContact CG-CG 4.26Å
1193	R	59.7	Low	59.5	Low	178 Å²	178	106.5 Å²	106.5	67%	0.672	51%	0.513	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-65.5	140.4	176.2	-84.3	-177.5	-89.2	-160.7	-6	110.4	V1164 G1195 A1196	V1164-R1193 HydrophobicContact CG2-CG 4.26Å; R1193-G1195 PolarHBondContact O-N 3.14Å; R1193-A1196 WeakPolarHBondContact O-CA 3.41Å; R1193-A1196 WeakPolarHBondContact O-CB 3.42Å; R1193-A1196 PolarHBondContact O-N 3.06Å
1194	R	48	Very low	60.1	Low	177 Å²	177	107.2 Å²	107.2	67%	0.668	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53	130.3	-176.8	-169.2	158.9	-151.5	-155.6	4.2	111.5	A1163 E1165 A1196	A1163-R1194 HydrophobicContact CB-CB 3.8Å; A1163-R1194 HydrophobicContact CB-CG 4.34Å; A1163-R1194 WeakPolarHBondContact O-CB 3.5Å; A1163-R1194 PolarHBondContact O-N 2.88Å; E1165-R1194 HydrophobicContact CG-CG 4.42Å; E1165-R1194 WeakPolarHBondContact OE1-CD 3.49Å; E1165-R1194 WeakPolarHBondContact OE1-CG 3.17Å; E1165-R1194 IonicContact OE1-CZ 3.06Å; E1165-R1194 IonicContact OE1-NE 2.93Å; E1165-R1194 PolarHBondContact OE1-NE 2.83Å; E1165-R1194 IonicContact OE1-NH2 2.72Å; R1194-A1196 VanDerWaalsContact C-N 3.29Å; R1194-A1196 PolarHBondContact O-N 3.15Å
1195	G	61.3	Low	60.7	Low	32 Å²	32	112.4 Å²	112.4	33%	0.33	54%	0.538	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.8	-1.3	-173.4	0	0	0	0	0	115.9	R1193 V1198 K1199	R1193-G1195 PolarHBondContact O-N 3.14Å; G1195-V1198 WeakPolarHBondContact O-CB 3.45Å; G1195-V1198 PolarHBondContact O-N 2.99Å; G1195-V1198 VanDerWaalsContact O-N 3.14Å; G1195-K1199 PolarHBondContact O-N 2.89Å
1196	A	65.6	Low	62.2	Low	40 Å²	40	111.2 Å²	111.2	33%	0.331	53%	0.531	S	S	.	.	H	α-helix	trans	-62.5	-41.2	173.6	0	0	0	0	0	111.8	Y1192 R1193 R1194 V1198 K1199 A1200	Y1192-A1196 HydrophobicContact CD2-CB 4.36Å; R1193-A1196 WeakPolarHBondContact O-CA 3.41Å; R1193-A1196 WeakPolarHBondContact O-CB 3.42Å; R1193-A1196 PolarHBondContact O-N 3.06Å; R1194-A1196 VanDerWaalsContact C-N 3.29Å; R1194-A1196 PolarHBondContact O-N 3.15Å; A1196-V1198 VanDerWaalsContact C-N 3.27Å; A1196-V1198 PolarHBondContact O-N 3.39Å; A1196-K1199 PolarHBondContact O-N 3.45Å; A1196-A1200 VanDerWaalsContact O-CB 3.27Å; A1196-A1200 WeakPolarHBondContact O-CB 3.5Å; A1196-A1200 PolarHBondContact O-N 2.95Å
1197	L	58.8	Low	63.6	Low	93 Å²	93	107.5 Å²	107.5	49%	0.487	51%	0.513	S	S	.	.	H	α-helix	trans	-63.5	-31.1	172.6	-71.4	-176.6	0	0	0	113	Y1192 A1200 R1201	Y1192-L1197 HydrophobicContact CD1-CD1 4.36Å; Y1192-L1197 HydrophobicContact CD1-CG 4.34Å; Y1192-L1197 HydrophobicContact CD2-CD1 4.38Å; Y1192-L1197 HydrophobicContact CD2-CG 3.94Å; Y1192-L1197 HydrophobicContact CE1-CD1 3.71Å; Y1192-L1197 HydrophobicContact CE1-CG 4.16Å; Y1192-L1197 HydrophobicContact CE2-CB 4.41Å; Y1192-L1197 HydrophobicContact CE2-CD1 3.73Å; Y1192-L1197 HydrophobicContact CE2-CG 3.73Å; Y1192-L1197 HydrophobicContact CG-CG 4.26Å; L1197-A1200 PolarHBondContact O-N 3.34Å; L1197-R1201 WeakPolarHBondContact O-CB 3.39Å; L1197-R1201 PolarHBondContact O-N 2.89Å
1198	V	65.6	Low	64.5	Low	86 Å²	86	109.3 Å²	109.3	52%	0.521	53%	0.529	S	S	.	.	H	α-helix	trans	-72.5	-41.1	176.5	-178.1	0	0	0	0	110.8	G1195 A1196 K1202	G1195-V1198 WeakPolarHBondContact O-CB 3.45Å; G1195-V1198 PolarHBondContact O-N 2.99Å; G1195-V1198 VanDerWaalsContact O-N 3.14Å; A1196-V1198 VanDerWaalsContact C-N 3.27Å; A1196-V1198 PolarHBondContact O-N 3.39Å; V1198-K1202 WeakPolarHBondContact O-CG 3.38Å; V1198-K1202 PolarHBondContact O-N 2.94Å; V1198-K1202 VanDerWaalsContact O-N 3.14Å
1199	K	68	Low	65.7	Low	164 Å²	164	106.7 Å²	106.7	71%	0.713	53%	0.525	S	S	*	.	H	α-helix	trans	-63.5	-44.7	169.3	-78.7	-172.4	174.2	-178.1	0	111.3	G1195 A1196 K1202 S1203	G1195-K1199 PolarHBondContact O-N 2.89Å; A1196-K1199 PolarHBondContact O-N 3.45Å; K1199-K1202 PolarHBondContact O-N 3.33Å; K1199-K1202 VanDerWaalsContact O-N 3.15Å; K1199-S1203 PolarHBondContact O-N 3.06Å; K1199-S1203 PolarHBondContact O-OG 2.84Å; K1199-S1203 VanDerWaalsContact O-OG 3.06Å
1200	A	66.9	Low	67	Low	43 Å²	43	107 Å²	107	36%	0.355	53%	0.532	S	S	.	.	H	α-helix	trans	-56.6	-53.4	178.3	0	0	0	0	0	110.8	A1196 L1197 K1202 S1203 Q1204	A1196-A1200 VanDerWaalsContact O-CB 3.27Å; A1196-A1200 WeakPolarHBondContact O-CB 3.5Å; A1196-A1200 PolarHBondContact O-N 2.95Å; L1197-A1200 PolarHBondContact O-N 3.34Å; A1200-K1202 VanDerWaalsContact C-N 3.32Å; A1200-K1202 PolarHBondContact O-N 3.37Å; A1200-S1203 WeakPolarHBondContact CA-OG 3.27Å; A1200-S1203 CarbonylContact O-C 3.44Å; A1200-S1203 PolarHBondContact O-N 3.36Å; A1200-S1203 VanDerWaalsContact O-N 3.1Å; A1200-S1203 PolarHBondContact O-OG 2.93Å; A1200-Q1204 WeakPolarHBondContact O-CA 3.5Å; A1200-Q1204 VanDerWaalsContact O-CB 3.28Å; A1200-Q1204 WeakPolarHBondContact O-CB 3.46Å; A1200-Q1204 PolarHBondContact O-N 2.58Å
1201	R	69.7	Low	68.2	Low	202 Å²	202	106.9 Å²	106.9	76%	0.762	54%	0.536	S	S	*	.	H	α-helix	trans	-55.6	-41.2	174.4	-81.8	-176.5	170.4	175.5	-1.8	113	L1197 Q1204	L1197-R1201 WeakPolarHBondContact O-CB 3.39Å; L1197-R1201 PolarHBondContact O-N 2.89Å; R1201-Q1204 WeakPolarHBondContact O-CB 3.49Å; R1201-Q1204 PolarHBondContact O-N 3.1Å
1202	K	72.6	Confident	69.6	Low	170 Å²	170	105.7 Å²	105.7	74%	0.739	53%	0.529	S	S	*	.	H	α-helix	trans	-66	-38.3	176	-73.9	-178.4	177.7	-171.2	0	112.7	V1198 K1199 A1200	V1198-K1202 WeakPolarHBondContact O-CG 3.38Å; V1198-K1202 PolarHBondContact O-N 2.94Å; V1198-K1202 VanDerWaalsContact O-N 3.14Å; K1199-K1202 PolarHBondContact O-N 3.33Å; K1199-K1202 VanDerWaalsContact O-N 3.15Å; A1200-K1202 VanDerWaalsContact C-N 3.32Å; A1200-K1202 PolarHBondContact O-N 3.37Å
1203	S	73	Confident	70.8	Confident	49 Å²	49	107.7 Å²	107.7	34%	0.343	54%	0.54	S	S	.	.	H	α-helix	trans	-79.7	-20.1	173.8	55.1	0	0	0	0	114.2	K1199 A1200 H1205 Q1206 V1207	K1199-S1203 PolarHBondContact O-N 3.06Å; K1199-S1203 PolarHBondContact O-OG 2.84Å; K1199-S1203 VanDerWaalsContact O-OG 3.06Å; A1200-S1203 WeakPolarHBondContact CA-OG 3.27Å; A1200-S1203 CarbonylContact O-C 3.44Å; A1200-S1203 PolarHBondContact O-N 3.36Å; A1200-S1203 VanDerWaalsContact O-N 3.1Å; A1200-S1203 PolarHBondContact O-OG 2.93Å; S1203-H1205 VanDerWaalsContact C-N 3.27Å; S1203-H1205 PolarHBondContact O-N 2.83Å; S1203-Q1206 PolarHBondContact O-N 3.17Å; S1203-V1207 WeakPolarHBondContact O-CG2 3.37Å; S1203-V1207 PolarHBondContact O-N 3.39Å
1204	Q	72	Confident	72	Confident	122 Å²	122	109 Å²	109	57%	0.57	55%	0.545	S	S	*	.	H	α-helix	trans	-59.6	-39	-169.8	-177.2	175	-0.7	0	0	111.4	A1200 R1201 V1207 A1208	A1200-Q1204 WeakPolarHBondContact O-CA 3.5Å; A1200-Q1204 VanDerWaalsContact O-CB 3.28Å; A1200-Q1204 WeakPolarHBondContact O-CB 3.46Å; A1200-Q1204 PolarHBondContact O-N 2.58Å; R1201-Q1204 WeakPolarHBondContact O-CB 3.49Å; R1201-Q1204 PolarHBondContact O-N 3.1Å; Q1204-V1207 PolarHBondContact O-N 3.24Å; Q1204-A1208 WeakPolarHBondContact O-CB 3.23Å; Q1204-A1208 PolarHBondContact O-N 3.44Å
1205	H	73.6	Confident	73.7	Confident	156 Å²	156	105.8 Å²	105.8	72%	0.722	54%	0.536	S	S	*	.	H	α-helix	trans	-64.7	-38.7	176.3	-165.5	-62	0	0	0	112.6	S1203 A1209	S1203-H1205 VanDerWaalsContact C-N 3.27Å; S1203-H1205 PolarHBondContact O-N 2.83Å; H1205-A1209 VanDerWaalsContact O-CB 3.23Å; H1205-A1209 WeakPolarHBondContact O-CB 3.44Å; H1205-A1209 PolarHBondContact O-N 3.07Å
1206	Q	77.4	Confident	74.7	Confident	141 Å²	141	107 Å²	107	66%	0.659	54%	0.535	S	S	*	.	H	α-helix	trans	-73.2	-43.1	176.8	-71.7	-179.2	-26.4	0	0	111.6	S1203 A1209 C1210	S1203-Q1206 PolarHBondContact O-N 3.17Å; Q1206-A1209 PolarHBondContact O-N 3.06Å; Q1206-C1210 PolarHBondContact O-N 2.92Å; Q1206-C1210 PolarHBondContact O-SG 3.46Å; Q1206-C1210 VanDerWaalsContact O-SG 3.39Å
1207	V	77.5	Confident	75.8	Confident	75 Å²	75	111.5 Å²	111.5	46%	0.455	55%	0.547	S	S	.	.	H	α-helix	trans	-66.4	-41.2	178.4	176	0	0	0	0	111.1	S1203 Q1204 Q1211	S1203-V1207 WeakPolarHBondContact O-CG2 3.37Å; S1203-V1207 PolarHBondContact O-N 3.39Å; Q1204-V1207 PolarHBondContact O-N 3.24Å; V1207-Q1211 WeakPolarHBondContact O-CB 3.4Å; V1207-Q1211 WeakPolarHBondContact O-CG 3.5Å; V1207-Q1211 PolarHBondContact O-N 2.86Å
1208	A	74.6	Confident	77.3	Confident	55 Å²	55	113.9 Å²	113.9	46%	0.455	55%	0.55	S	S	.	.	H	α-helix	trans	-65.5	-42	174.7	0	0	0	0	0	111.6	Q1204 Q1211 H1212	Q1204-A1208 WeakPolarHBondContact O-CB 3.23Å; Q1204-A1208 PolarHBondContact O-N 3.44Å; A1208-Q1211 PolarHBondContact O-N 3.27Å; A1208-H1212 VanDerWaalsContact O-CB 3.23Å; A1208-H1212 WeakPolarHBondContact O-CB 3.44Å; A1208-H1212 PolarHBondContact O-N 3.14Å
1209	A	76.2	Confident	78.1	Confident	46 Å²	46	112.9 Å²	112.9	38%	0.38	54%	0.539	S	S	.	.	H	α-helix	trans	-60.6	-48.6	174.6	0	0	0	0	0	111.9	H1205 Q1206 Q1211 H1212 E1213	H1205-A1209 VanDerWaalsContact O-CB 3.23Å; H1205-A1209 WeakPolarHBondContact O-CB 3.44Å; H1205-A1209 PolarHBondContact O-N 3.07Å; Q1206-A1209 PolarHBondContact O-N 3.06Å; A1209-Q1211 PolarHBondContact O-N 3.23Å; A1209-H1212 PolarHBondContact O-N 2.87Å; A1209-E1213 WeakPolarHBondContact O-CB 3.36Å; A1209-E1213 PolarHBondContact O-N 3.39Å
1210	C	80.4	Confident	78.8	Confident	78 Å²	78	110.9 Å²	110.9	53%	0.527	53%	0.532	S	S	.	.	H	α-helix	trans	-66.3	-33.5	177.8	-68.4	0	0	0	0	113.3	Q1206 R1214	Q1206-C1210 PolarHBondContact O-N 2.92Å; Q1206-C1210 PolarHBondContact O-SG 3.46Å; Q1206-C1210 VanDerWaalsContact O-SG 3.39Å; C1210-R1214 VanDerWaalsContact O-CB 3.28Å; C1210-R1214 WeakPolarHBondContact O-CB 3.36Å; C1210-R1214 PolarHBondContact O-N 3.42Å; C1210-R1214 VanDerWaalsContact O-N 3.1Å
1211	Q	80.5	Confident	79.7	Confident	134 Å²	134	112.1 Å²	112.1	63%	0.626	54%	0.538	S	S	*	.	H	α-helix	trans	-72.4	-39	173.3	-76.6	-164.8	48.1	0	0	112	V1207 A1208 A1209 R1214 F1215	V1207-Q1211 WeakPolarHBondContact O-CB 3.4Å; V1207-Q1211 WeakPolarHBondContact O-CG 3.5Å; V1207-Q1211 PolarHBondContact O-N 2.86Å; A1208-Q1211 PolarHBondContact O-N 3.27Å; A1209-Q1211 PolarHBondContact O-N 3.23Å; Q1211-R1214 PolarHBondContact O-N 2.87Å; Q1211-F1215 WeakPolarHBondContact O-CB 3.29Å; Q1211-F1215 PolarHBondContact O-N 3.12Å
1212	H	79.1	Confident	80.6	Confident	121 Å²	121	107.7 Å²	107.7	56%	0.56	52%	0.522	S	S	*	.	H	α-helix	trans	-62.8	-49.1	174	179	48.7	0	0	0	110.7	A1208 A1209 R1214 F1215 D1216	A1208-H1212 VanDerWaalsContact O-CB 3.23Å; A1208-H1212 WeakPolarHBondContact O-CB 3.44Å; A1208-H1212 PolarHBondContact O-N 3.14Å; A1209-H1212 PolarHBondContact O-N 2.87Å; H1212-R1214 VanDerWaalsContact C-N 3.26Å; H1212-R1214 PolarHBondContact O-N 3.26Å; H1212-F1215 CarbonylContact O-C 3.51Å; H1212-F1215 PolarHBondContact O-N 3.14Å; H1212-F1215 VanDerWaalsContact O-N 3.13Å; H1212-D1216 WeakPolarHBondContact O-CB 3.41Å; H1212-D1216 PolarHBondContact O-N 2.92Å
1213	E	85.6	Confident	80.9	Confident	100 Å²	100	102 Å²	102	47%	0.467	50%	0.499	S	S	.	.	H	α-helix	trans	-58.1	-37.6	175.6	-167.5	-161.9	155.3	0	0	112.3	A1209 K1217	A1209-E1213 WeakPolarHBondContact O-CB 3.36Å; A1209-E1213 PolarHBondContact O-N 3.39Å; E1213-K1217 HydrophobicContact CG-CD 4.47Å; E1213-K1217 WeakPolarHBondContact O-CB 3.46Å; E1213-K1217 WeakPolarHBondContact O-CD 3.36Å; E1213-K1217 VanDerWaalsContact O-CG 3.27Å; E1213-K1217 WeakPolarHBondContact O-CG 3.36Å; E1213-K1217 PolarHBondContact O-N 2.84Å; E1213-K1217 WeakPolarHBondContact OE1-CE 3.35Å; E1213-K1217 IonicContact OE1-NZ 3.87Å; E1213-K1217 PolarHBondContact OE1-NZ 2.95Å
1214	R	86.4	Confident	81.2	Confident	204 Å²	204	103.6 Å²	103.6	77%	0.77	52%	0.515	S	S	*	.	H	α-helix	trans	-73	-37	176.5	-172.6	174.8	-178.5	175.6	0.3	112.8	C1210 Q1211 H1212 W1218	C1210-R1214 VanDerWaalsContact O-CB 3.28Å; C1210-R1214 WeakPolarHBondContact O-CB 3.36Å; C1210-R1214 PolarHBondContact O-N 3.42Å; C1210-R1214 VanDerWaalsContact O-N 3.1Å; Q1211-R1214 PolarHBondContact O-N 2.87Å; H1212-R1214 VanDerWaalsContact C-N 3.26Å; H1212-R1214 PolarHBondContact O-N 3.26Å; R1214-W1218 PolarHBondContact O-N 2.84Å
1215	F	82.3	Confident	81.8	Confident	111 Å²	111	103.4 Å²	103.4	49%	0.487	52%	0.518	S	S	.	.	H	α-helix	trans	-67.3	-42.4	172	175.3	-95.2	0	0	0	111	Q1211 H1212 K1217 W1218 H1219	Q1211-F1215 WeakPolarHBondContact O-CB 3.29Å; Q1211-F1215 PolarHBondContact O-N 3.12Å; H1212-F1215 CarbonylContact O-C 3.51Å; H1212-F1215 PolarHBondContact O-N 3.14Å; H1212-F1215 VanDerWaalsContact O-N 3.13Å; F1215-K1217 PolarHBondContact O-N 3.42Å; F1215-W1218 AromaticContact CD2-CE3 3.98Å; F1215-W1218 HydrophobicContact CD2-CE3 3.98Å; F1215-W1218 HydrophobicContact CD2-CZ3 4.38Å; F1215-W1218 AromaticContact CE2-CE3 3.67Å; F1215-W1218 HydrophobicContact CE2-CE3 3.67Å; F1215-W1218 AromaticContact CE2-CZ3 3.61Å; F1215-W1218 HydrophobicContact CE2-CZ3 3.61Å; F1215-W1218 HydrophobicContact CZ-CE3 4.24Å; F1215-W1218 HydrophobicContact CZ-CZ3 4Å; F1215-W1218 CarbonylContact O-C 3.47Å; F1215-W1218 WeakPolarHBondContact O-CA 3.48Å; F1215-W1218 WeakPolarHBondContact O-CB 3.4Å; F1215-W1218 PolarHBondContact O-N 3.48Å; F1215-W1218 VanDerWaalsContact O-N 3.08Å; F1215-H1219 HydrophobicContact CD1-CB 4.4Å; F1215-H1219 HydrophobicContact CE1-CB 4.05Å; F1215-H1219 HydrophobicContact CZ-CB 4.38Å; F1215-H1219 VanDerWaalsContact O-CB 3.31Å; F1215-H1219 WeakPolarHBondContact O-CB 3.14Å; F1215-H1219 PolarHBondContact O-N 2.93Å
1216	D	83.3	Confident	82.1	Confident	56 Å²	56	101.7 Å²	101.7	30%	0.299	51%	0.51	S	S	.	.	H	α-helix	trans	-69	-37	-176.7	-154.6	47.8	0	0	0	111.3	H1212 W1218 H1219 Q1220	H1212-D1216 WeakPolarHBondContact O-CB 3.41Å; H1212-D1216 PolarHBondContact O-N 2.92Å; D1216-W1218 VanDerWaalsContact C-N 3.34Å; D1216-W1218 PolarHBondContact O-N 3.25Å; D1216-H1219 PolarHBondContact O-N 3.06Å; D1216-H1219 IonicContact OD1-ND1 2.69Å; D1216-Q1220 WeakPolarHBondContact O-CB 3.29Å; D1216-Q1220 WeakPolarHBondContact O-CG 3.42Å; D1216-Q1220 PolarHBondContact O-N 3.33Å; D1216-Q1220 PolarHBondContact OD2-NE2 3.21Å
1217	K	87.6	Confident	82.3	Confident	135 Å²	135	97.2 Å²	97.2	59%	0.587	49%	0.492	S	S	*	.	H	α-helix	trans	-61.4	-38.1	168	-76.2	168.5	177.7	174	0	113.2	E1213 F1215 S1221	E1213-K1217 HydrophobicContact CG-CD 4.47Å; E1213-K1217 WeakPolarHBondContact O-CB 3.46Å; E1213-K1217 WeakPolarHBondContact O-CD 3.36Å; E1213-K1217 VanDerWaalsContact O-CG 3.27Å; E1213-K1217 WeakPolarHBondContact O-CG 3.36Å; E1213-K1217 PolarHBondContact O-N 2.84Å; E1213-K1217 WeakPolarHBondContact OE1-CE 3.35Å; E1213-K1217 IonicContact OE1-NZ 3.87Å; E1213-K1217 PolarHBondContact OE1-NZ 2.95Å; F1215-K1217 PolarHBondContact O-N 3.42Å; K1217-S1221 VanDerWaalsContact O-CB 3.3Å; K1217-S1221 WeakPolarHBondContact O-CB 3.43Å; K1217-S1221 PolarHBondContact O-N 2.75Å
1218	W	91.3	Very high	82.4	Confident	144 Å²	144	97.5 Å²	97.5	55%	0.545	50%	0.496	S	S	.	.	H	α-helix	trans	-69.5	-42.5	172.4	170.5	83.8	0	0	0	111.5	R1214 F1215 D1216 S1221 W1222	R1214-W1218 PolarHBondContact O-N 2.84Å; F1215-W1218 AromaticContact CD2-CE3 3.98Å; F1215-W1218 HydrophobicContact CD2-CE3 3.98Å; F1215-W1218 HydrophobicContact CD2-CZ3 4.38Å; F1215-W1218 AromaticContact CE2-CE3 3.67Å; F1215-W1218 HydrophobicContact CE2-CE3 3.67Å; F1215-W1218 AromaticContact CE2-CZ3 3.61Å; F1215-W1218 HydrophobicContact CE2-CZ3 3.61Å; F1215-W1218 HydrophobicContact CZ-CE3 4.24Å; F1215-W1218 HydrophobicContact CZ-CZ3 4Å; F1215-W1218 CarbonylContact O-C 3.47Å; F1215-W1218 WeakPolarHBondContact O-CA 3.48Å; F1215-W1218 WeakPolarHBondContact O-CB 3.4Å; F1215-W1218 PolarHBondContact O-N 3.48Å; F1215-W1218 VanDerWaalsContact O-N 3.08Å; D1216-W1218 VanDerWaalsContact C-N 3.34Å; D1216-W1218 PolarHBondContact O-N 3.25Å; W1218-S1221 CarbonylContact O-C 3.56Å; W1218-S1221 PolarHBondContact O-N 3.06Å; W1218-W1222 HydrophobicContact CH2-CG 4.35Å; W1218-W1222 HydrophobicContact CZ2-CB 4.38Å; W1218-W1222 AromaticContact CZ2-CD1 3.97Å; W1218-W1222 HydrophobicContact CZ2-CG 4.27Å; W1218-W1222 WeakPolarHBondContact O-CB 3.26Å; W1218-W1222 PolarHBondContact O-N 3.35Å
1219	H	82.8	Confident	82.4	Confident	64 Å²	64	97.1 Å²	97.1	30%	0.296	49%	0.492	S	S	.	.	H	α-helix	trans	-66.5	-47.2	-177	178.2	-127.1	0	0	0	111.6	F1215 D1216 S1221 W1222 L1223	F1215-H1219 HydrophobicContact CD1-CB 4.4Å; F1215-H1219 HydrophobicContact CE1-CB 4.05Å; F1215-H1219 HydrophobicContact CZ-CB 4.38Å; F1215-H1219 VanDerWaalsContact O-CB 3.31Å; F1215-H1219 WeakPolarHBondContact O-CB 3.14Å; F1215-H1219 PolarHBondContact O-N 2.93Å; D1216-H1219 PolarHBondContact O-N 3.06Å; D1216-H1219 IonicContact OD1-ND1 2.69Å; H1219-S1221 VanDerWaalsContact C-N 3.32Å; H1219-S1221 PolarHBondContact O-N 3.4Å; H1219-W1222 CarbonylContact O-C 3.54Å; H1219-W1222 WeakPolarHBondContact O-CA 3.4Å; H1219-W1222 WeakPolarHBondContact O-CB 3.3Å; H1219-W1222 PolarHBondContact O-N 2.77Å; H1219-L1223 WeakPolarHBondContact O-CG 3.42Å; H1219-L1223 PolarHBondContact O-N 2.73Å
1220	Q	82.2	Confident	82.5	Confident	123 Å²	123	99.1 Å²	99.1	58%	0.575	50%	0.504	S	S	*	.	H	α-helix	trans	-63.6	-37.4	172.9	-68	-169.9	18.4	0	0	112	D1216 W1222 L1223 A1224	D1216-Q1220 WeakPolarHBondContact O-CB 3.29Å; D1216-Q1220 WeakPolarHBondContact O-CG 3.42Å; D1216-Q1220 PolarHBondContact O-N 3.33Å; D1216-Q1220 PolarHBondContact OD2-NE2 3.21Å; Q1220-W1222 VanDerWaalsContact C-N 3.25Å; Q1220-W1222 PolarHBondContact O-N 2.83Å; Q1220-L1223 PolarHBondContact O-N 3.36Å; Q1220-A1224 VanDerWaalsContact O-CB 3.31Å; Q1220-A1224 WeakPolarHBondContact O-CB 3.45Å; Q1220-A1224 PolarHBondContact O-N 2.72Å
1221	S	85.7	Confident	82.3	Confident	68 Å²	68	97.4 Å²	97.4	48%	0.476	50%	0.495	S	S	.	.	H	α-helix	trans	-67.1	-24.4	171.6	-174.7	0	0	0	0	113.2	K1217 W1218 H1219 N1225	K1217-S1221 VanDerWaalsContact O-CB 3.3Å; K1217-S1221 WeakPolarHBondContact O-CB 3.43Å; K1217-S1221 PolarHBondContact O-N 2.75Å; W1218-S1221 CarbonylContact O-C 3.56Å; W1218-S1221 PolarHBondContact O-N 3.06Å; H1219-S1221 VanDerWaalsContact C-N 3.32Å; H1219-S1221 PolarHBondContact O-N 3.4Å; S1221-N1225 VanDerWaalsContact O-CG 3.3Å; S1221-N1225 PolarHBondContact O-ND2 3.2Å
1222	W	88.1	Confident	82	Confident	110 Å²	110	96.2 Å²	96.2	42%	0.417	49%	0.489	S	S	.	.	H	α-helix	trans	-79.9	-47.6	174.4	-174.7	90.4	0	0	0	110.5	W1218 H1219 Q1220 A1224 N1225 H1226 V1227	W1218-W1222 HydrophobicContact CH2-CG 4.35Å; W1218-W1222 HydrophobicContact CZ2-CB 4.38Å; W1218-W1222 AromaticContact CZ2-CD1 3.97Å; W1218-W1222 HydrophobicContact CZ2-CG 4.27Å; W1218-W1222 WeakPolarHBondContact O-CB 3.26Å; W1218-W1222 PolarHBondContact O-N 3.35Å; H1219-W1222 CarbonylContact O-C 3.54Å; H1219-W1222 WeakPolarHBondContact O-CA 3.4Å; H1219-W1222 WeakPolarHBondContact O-CB 3.3Å; H1219-W1222 PolarHBondContact O-N 2.77Å; Q1220-W1222 VanDerWaalsContact C-N 3.25Å; Q1220-W1222 PolarHBondContact O-N 2.83Å; W1222-A1224 PolarHBondContact O-N 3.43Å; W1222-N1225 PolarHBondContact O-N 2.81Å; W1222-N1225 VanDerWaalsContact O-N 3.08Å; W1222-H1226 AromaticContact CD1-CD2 3.35Å; W1222-H1226 AromaticContact CD1-NE2 3.88Å; W1222-H1226 HydrophobicContact CD2-CB 4.23Å; W1222-H1226 AromaticContact CD2-CD2 3.89Å; W1222-H1226 AromaticContact CE2-CD2 3.59Å; W1222-H1226 AromaticContact CE2-CG 3.93Å; W1222-H1226 HydrophobicContact CE3-CB 4.42Å; W1222-H1226 AromaticContact CG-CD2 3.73Å; W1222-H1226 HydrophobicContact CH2-CB 4.12Å; W1222-H1226 HydrophobicContact CZ2-CB 3.91Å; W1222-H1226 HydrophobicContact CZ3-CB 4.37Å; W1222-H1226 AromaticContact NE1-CD2 3.24Å; W1222-H1226 PolarHBondContact NE1-CD2 3.32Å; W1222-H1226 AromaticContact NE1-CG 3.94Å; W1222-H1226 AromaticContact NE1-NE2 3.79Å; W1222-H1226 WeakPolarHBondContact O-CB 3.46Å; W1222-H1226 PolarHBondContact O-CD2 3.16Å; W1222-H1226 VanDerWaalsContact O-CD2 3.27Å; W1222-H1226 PolarHBondContact O-N 2.77Å; W1222-V1227 HydrophobicContact CZ3-CG2 4.01Å
1223	L	79.5	Confident	81.8	Confident	49 Å²	49	97.9 Å²	97.9	26%	0.257	49%	0.491	S	S	.	.	H	α-helix	trans	-54.1	-51.3	174.5	-69.6	174.7	0	0	0	111.1	H1219 Q1220 N1225 H1226 V1227	H1219-L1223 WeakPolarHBondContact O-CG 3.42Å; H1219-L1223 PolarHBondContact O-N 2.73Å; Q1220-L1223 PolarHBondContact O-N 3.36Å; L1223-N1225 PolarHBondContact O-N 2.82Å; L1223-N1225 VanDerWaalsContact O-N 3.1Å; L1223-H1226 PolarHBondContact O-N 3.37Å; L1223-H1226 VanDerWaalsContact O-N 3.17Å; L1223-V1227 HydrophobicContact CD2-CB 4.29Å; L1223-V1227 HydrophobicContact CD2-CG2 3.64Å; L1223-V1227 PolarHBondContact O-N 2.92Å
1224	A	78.8	Confident	81.4	Confident	83 Å²	83	95.6 Å²	95.6	69%	0.686	49%	0.486	S	S	*	.	H	α-helix	trans	-60.9	-22.5	179.5	0	0	0	0	0	114.4	Q1220 W1222	Q1220-A1224 VanDerWaalsContact O-CB 3.31Å; Q1220-A1224 WeakPolarHBondContact O-CB 3.45Å; Q1220-A1224 PolarHBondContact O-N 2.72Å; W1222-A1224 PolarHBondContact O-N 3.43Å
1225	N	84.9	Confident	80.8	Confident	119 Å²	119	90.4 Å²	90.4	64%	0.636	48%	0.477	S	S	*	.	H	α-helix	trans	-98.2	-18.9	179.3	-75.5	-29.5	0	0	0	113.8	S1221 W1222 L1223	S1221-N1225 VanDerWaalsContact O-CG 3.3Å; S1221-N1225 PolarHBondContact O-ND2 3.2Å; W1222-N1225 PolarHBondContact O-N 2.81Å; W1222-N1225 VanDerWaalsContact O-N 3.08Å; L1223-N1225 PolarHBondContact O-N 2.82Å; L1223-N1225 VanDerWaalsContact O-N 3.1Å
1226	H	80.8	Confident	80.2	Confident	120 Å²	120	90.2 Å²	90.2	56%	0.556	48%	0.477	S	S	*	.	H	α-helix	trans	-131.7	-13.6	-168.5	-63.3	-64.7	0	0	0	115.4	W1222 L1223	W1222-H1226 AromaticContact CD1-CD2 3.35Å; W1222-H1226 AromaticContact CD1-NE2 3.88Å; W1222-H1226 HydrophobicContact CD2-CB 4.23Å; W1222-H1226 AromaticContact CD2-CD2 3.89Å; W1222-H1226 AromaticContact CE2-CD2 3.59Å; W1222-H1226 AromaticContact CE2-CG 3.93Å; W1222-H1226 HydrophobicContact CE3-CB 4.42Å; W1222-H1226 AromaticContact CG-CD2 3.73Å; W1222-H1226 HydrophobicContact CH2-CB 4.12Å; W1222-H1226 HydrophobicContact CZ2-CB 3.91Å; W1222-H1226 HydrophobicContact CZ3-CB 4.37Å; W1222-H1226 AromaticContact NE1-CD2 3.24Å; W1222-H1226 PolarHBondContact NE1-CD2 3.32Å; W1222-H1226 AromaticContact NE1-CG 3.94Å; W1222-H1226 AromaticContact NE1-NE2 3.79Å; W1222-H1226 WeakPolarHBondContact O-CB 3.46Å; W1222-H1226 PolarHBondContact O-CD2 3.16Å; W1222-H1226 VanDerWaalsContact O-CD2 3.27Å; W1222-H1226 PolarHBondContact O-N 2.77Å; L1223-H1226 PolarHBondContact O-N 3.37Å; L1223-H1226 VanDerWaalsContact O-N 3.17Å
1227	V	80.5	Confident	79.5	Confident	46 Å²	46	90.2 Å²	90.2	28%	0.279	48%	0.477	S	S	.	.	S	Bend	trans	-115.4	117.3	178	-179.8	0	0	0	0	109.5	W1222 L1223 A1231 E1232	W1222-V1227 HydrophobicContact CZ3-CG2 4.01Å; L1223-V1227 HydrophobicContact CD2-CB 4.29Å; L1223-V1227 HydrophobicContact CD2-CG2 3.64Å; L1223-V1227 PolarHBondContact O-N 2.92Å; V1227-A1231 HydrophobicContact CG1-CB 4.15Å; V1227-E1232 HydrophobicContact CG1-CB 4.26Å
1228	P	80.4	Confident	78.8	Confident	81 Å²	81	91.1 Å²	91.1	53%	0.526	48%	0.477	S	S	.	.			trans	-72.2	143.3	175.1	30.1	-33.7	0	0	0	110.5	S1230 A1231 E1232	P1228-S1230 PolarHBondContact O-N 2.84Å; P1228-A1231 HydrophobicContact CG-CB 4.14Å; P1228-A1231 PolarHBondContact O-N 3.05Å; P1228-E1232 PolarHBondContact O-N 3.41Å
1229	A	74.7	Confident	77.6	Confident	47 Å²	47	90.1 Å²	90.1	39%	0.388	48%	0.482	S	S	.	.	H	α-helix	trans	-60.7	-8.5	-176.4	0	0	0	0	0	115.3	R1233	A1229-R1233 WeakPolarHBondContact O-CG 3.24Å; A1229-R1233 PolarHBondContact O-NH1 3.43Å
1230	S	78.1	Confident	76.9	Confident	89 Å²	89	91.7 Å²	91.7	62%	0.622	49%	0.49	S	S	*	.	H	α-helix	trans	-75.5	-42.8	167.8	47	0	0	0	0	112.3	P1228 S1234	P1228-S1230 PolarHBondContact O-N 2.84Å; S1230-S1234 PolarHBondContact O-N 2.83Å
1231	A	76.1	Confident	76	Confident	41 Å²	41	86.8 Å²	86.8	34%	0.339	47%	0.473	S	S	.	.	H	α-helix	trans	-70.6	-41	177.6	0	0	0	0	0	111.4	V1227 P1228 R1233 S1234 V1235	V1227-A1231 HydrophobicContact CG1-CB 4.15Å; P1228-A1231 HydrophobicContact CG-CB 4.14Å; P1228-A1231 PolarHBondContact O-N 3.05Å; A1231-R1233 VanDerWaalsContact C-N 3.3Å; A1231-R1233 PolarHBondContact O-N 3.03Å; A1231-S1234 PolarHBondContact O-N 2.81Å; A1231-V1235 WeakPolarHBondContact O-CG2 3.46Å; A1231-V1235 PolarHBondContact O-N 2.91Å
1232	E	74.1	Confident	75	Confident	109 Å²	109	90 Å²	90	51%	0.509	48%	0.481	S	S	.	.	H	α-helix	trans	-54.8	-44.7	173.7	-174.8	179.1	-144	0	0	111.8	V1227 P1228 Q1236	V1227-E1232 HydrophobicContact CG1-CB 4.26Å; P1228-E1232 PolarHBondContact O-N 3.41Å; E1232-Q1236 WeakPolarHBondContact O-CB 3.4Å; E1232-Q1236 PolarHBondContact O-N 2.96Å
1233	R	74.9	Confident	73.6	Confident	156 Å²	156	89.2 Å²	89.2	59%	0.589	48%	0.482	S	S	*	.	H	α-helix	trans	-66.9	-42.8	177.2	-74.7	-176.9	-168.5	94.1	-7	113.6	A1229 A1231 V1235 Q1236 N1237	A1229-R1233 WeakPolarHBondContact O-CG 3.24Å; A1229-R1233 PolarHBondContact O-NH1 3.43Å; A1231-R1233 VanDerWaalsContact C-N 3.3Å; A1231-R1233 PolarHBondContact O-N 3.03Å; R1233-V1235 VanDerWaalsContact C-N 3.35Å; R1233-V1235 PolarHBondContact O-N 3.44Å; R1233-Q1236 WeakPolarHBondContact O-CB 3.35Å; R1233-Q1236 PolarHBondContact O-N 2.75Å; R1233-N1237 WeakPolarHBondContact O-CB 3.46Å; R1233-N1237 PolarHBondContact O-N 3.22Å; R1233-N1237 PolarHBondContact O-ND2 3.5Å; R1233-N1237 PolarHBondContact O-OD1 3.44Å; R1233-N1237 VanDerWaalsContact O-OD1 3.08Å
1234	S	77	Confident	72.6	Confident	53 Å²	53	91.9 Å²	91.9	37%	0.371	49%	0.492	S	S	.	.	H	α-helix	trans	-65.5	-39.9	178.8	179.4	0	0	0	0	111.4	S1230 A1231 Q1236 N1237 W1238 E1243	S1230-S1234 PolarHBondContact O-N 2.83Å; A1231-S1234 PolarHBondContact O-N 2.81Å; S1234-Q1236 VanDerWaalsContact C-N 3.33Å; S1234-Q1236 PolarHBondContact O-N 3.16Å; S1234-N1237 PolarHBondContact O-N 3.08Å; S1234-W1238 VanDerWaalsContact O-CB 3.3Å; S1234-W1238 WeakPolarHBondContact O-CB 2.81Å; S1234-W1238 PolarHBondContact O-N 3.19Å; S1234-E1243 WeakPolarHBondContact CA-OE1 3.43Å; S1234-E1243 PolarHBondContact OG-OE1 2.87Å; S1234-E1243 VanDerWaalsContact OG-OE1 3.11Å; S1234-E1243 PolarHBondContact OG-OE2 3.16Å
1235	V	73	Confident	71.6	Confident	94 Å²	94	97.9 Å²	97.9	57%	0.57	51%	0.506	S	S	*	.	H	α-helix	trans	-61.5	-41	171.3	175.3	0	0	0	0	111.6	A1231 R1233 L1239	A1231-V1235 WeakPolarHBondContact O-CG2 3.46Å; A1231-V1235 PolarHBondContact O-N 2.91Å; R1233-V1235 VanDerWaalsContact C-N 3.35Å; R1233-V1235 PolarHBondContact O-N 3.44Å; V1235-L1239 VanDerWaalsContact O-CB 3.25Å; V1235-L1239 WeakPolarHBondContact O-CB 3.31Å; V1235-L1239 PolarHBondContact O-N 3.43Å
1236	Q	69.8	Low	70.4	Confident	107 Å²	107	99.8 Å²	99.8	50%	0.5	52%	0.517	S	S	.	.	H	α-helix	trans	-63.1	-46.8	176.1	-170.6	71.7	36.1	0	0	112	E1232 R1233 S1234 L1239 M1240	E1232-Q1236 WeakPolarHBondContact O-CB 3.4Å; E1232-Q1236 PolarHBondContact O-N 2.96Å; R1233-Q1236 WeakPolarHBondContact O-CB 3.35Å; R1233-Q1236 PolarHBondContact O-N 2.75Å; S1234-Q1236 VanDerWaalsContact C-N 3.33Å; S1234-Q1236 PolarHBondContact O-N 3.16Å; Q1236-L1239 PolarHBondContact O-N 3.22Å; Q1236-M1240 WeakPolarHBondContact O-CB 3.45Å; Q1236-M1240 VanDerWaalsContact O-CG 3.23Å; Q1236-M1240 WeakPolarHBondContact O-CG 3.09Å; Q1236-M1240 PolarHBondContact O-N 3.48Å
1237	N	70.2	Confident	69.4	Low	56 Å²	56	100.4 Å²	100.4	30%	0.299	52%	0.518	S	S	.	.	H	α-helix	trans	-64.3	-46.4	179.8	-60.2	-11	0	0	0	110.9	R1233 S1234 M1240 G1241 E1242 E1243	R1233-N1237 WeakPolarHBondContact O-CB 3.46Å; R1233-N1237 PolarHBondContact O-N 3.22Å; R1233-N1237 PolarHBondContact O-ND2 3.5Å; R1233-N1237 PolarHBondContact O-OD1 3.44Å; R1233-N1237 VanDerWaalsContact O-OD1 3.08Å; S1234-N1237 PolarHBondContact O-N 3.08Å; N1237-M1240 CarbonylContact O-C 3.58Å; N1237-M1240 PolarHBondContact O-N 3.42Å; N1237-G1241 PolarHBondContact O-N 3.02Å; N1237-G1241 VanDerWaalsContact O-N 3.09Å; N1237-E1242 HydrophobicContact CB-CB 4.3Å; N1237-E1242 PolarHBondContact O-N 3.38Å; N1237-E1243 HydrophobicContact CB-CG 3.76Å; N1237-E1243 WeakPolarHBondContact CB-OE1 3.18Å; N1237-E1243 PolarHBondContact ND2-OE1 2.9Å
1238	W	72.4	Confident	68.5	Low	154 Å²	154	101.6 Å²	101.6	58%	0.583	52%	0.522	S	S	*	.	H	α-helix	trans	-58.4	-47.4	175.5	178.9	78.3	0	0	0	111.7	S1234 M1240 G1241	S1234-W1238 VanDerWaalsContact O-CB 3.3Å; S1234-W1238 WeakPolarHBondContact O-CB 2.81Å; S1234-W1238 PolarHBondContact O-N 3.19Å; W1238-M1240 PolarHBondContact O-N 3.26Å; W1238-G1241 PolarHBondContact O-N 3.24Å
1239	L	66.3	Low	67.5	Low	123 Å²	123	100.1 Å²	100.1	64%	0.644	51%	0.512	S	S	*	.	H	α-helix	trans	-64.3	-28.2	178.9	-163.4	79.2	0	0	0	113	V1235 Q1236	V1235-L1239 VanDerWaalsContact O-CB 3.25Å; V1235-L1239 WeakPolarHBondContact O-CB 3.31Å; V1235-L1239 PolarHBondContact O-N 3.43Å; Q1236-L1239 PolarHBondContact O-N 3.22Å
1240	M	66.9	Low	66.9	Low	97 Å²	97	101.3 Å²	101.3	48%	0.478	52%	0.517	S	S	.	.	H	α-helix	trans	-86.3	-6.2	175.7	-68.2	-60.6	-55.8	0	0	113.7	Q1236 N1237 W1238 E1242	Q1236-M1240 WeakPolarHBondContact O-CB 3.45Å; Q1236-M1240 VanDerWaalsContact O-CG 3.23Å; Q1236-M1240 WeakPolarHBondContact O-CG 3.09Å; Q1236-M1240 PolarHBondContact O-N 3.48Å; N1237-M1240 CarbonylContact O-C 3.58Å; N1237-M1240 PolarHBondContact O-N 3.42Å; W1238-M1240 PolarHBondContact O-N 3.26Å; M1240-E1242 HydrophobicContact CB-CG 4.03Å
1241	G	63.5	Low	66.2	Low	20 Å²	20	104.6 Å²	104.6	21%	0.206	52%	0.52	C	S	.	.	T	Hydrogen-bonded Turn	trans	75.7	22.5	-176.3	0	0	0	0	0	114.2	N1237 W1238	N1237-G1241 PolarHBondContact O-N 3.02Å; N1237-G1241 VanDerWaalsContact O-N 3.09Å; W1238-G1241 PolarHBondContact O-N 3.24Å
1242	E	64.1	Low	65.7	Low	137 Å²	137	106.5 Å²	106.5	64%	0.64	53%	0.528	S	S	*	.			trans	-90.4	-3.7	-176.9	-61.6	-173.7	178.2	0	0	113.6	N1237 M1240	N1237-E1242 HydrophobicContact CB-CB 4.3Å; N1237-E1242 PolarHBondContact O-N 3.38Å; M1240-E1242 HydrophobicContact CB-CG 4.03Å
1243	E	59.3	Low	65.4	Low	93 Å²	93	103.6 Å²	103.6	44%	0.435	52%	0.517	S	S	.	.	S	Bend	trans	-106.1	-9.1	178.5	-76.9	-178.9	-177.7	0	0	115	S1234 N1237	S1234-E1243 WeakPolarHBondContact CA-OE1 3.43Å; S1234-E1243 PolarHBondContact OG-OE1 2.87Å; S1234-E1243 VanDerWaalsContact OG-OE1 3.11Å; S1234-E1243 PolarHBondContact OG-OE2 3.16Å; N1237-E1243 HydrophobicContact CB-CG 3.76Å; N1237-E1243 WeakPolarHBondContact CB-OE1 3.18Å; N1237-E1243 PolarHBondContact ND2-OE1 2.9Å
1244	E	58.7	Low	64.7	Low	104 Å²	104	99.2 Å²	99.2	49%	0.486	51%	0.51	S	S	.	.			trans	-127.5	120.3	180	-72	-173.5	138.2	0	0	111.8	D1246 F1247	E1244-D1246 PolarHBondContact O-N 3.28Å; E1244-D1246 VanDerWaalsContact O-N 3.09Å; E1244-F1247 HydrophobicContact CB-CD2 3.91Å; E1244-F1247 HydrophobicContact CB-CE2 4.46Å; E1244-F1247 PolarHBondContact O-N 3.48Å; E1244-F1247 WeakPolarHBondContact OE2-CE2 3.09Å
1245	E	58.2	Low	64.4	Low	209 Å²	209	101 Å²	101	98%	0.977	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-20.2	-168.4	-63.3	-167.7	133	0	0	115.7
1246	D	60.4	Low	64	Low	160 Å²	160	100.1 Å²	100.1	86%	0.856	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.3	-11.3	-177.8	-78.1	-42.9	0	0	0	114.1	E1244	E1244-D1246 PolarHBondContact O-N 3.28Å; E1244-D1246 VanDerWaalsContact O-N 3.09Å
1247	F	57.8	Low	63.9	Low	132 Å²	132	98.5 Å²	98.5	58%	0.579	51%	0.51	S	S	*	.			trans	-92.3	124.1	-179.8	-74.6	-82.4	0	0	0	112.1	E1244 P1249	E1244-F1247 HydrophobicContact CB-CD2 3.91Å; E1244-F1247 HydrophobicContact CB-CE2 4.46Å; E1244-F1247 PolarHBondContact O-N 3.48Å; E1244-F1247 WeakPolarHBondContact OE2-CE2 3.09Å; F1247-P1249 WeakPolarHBondContact O-CD 3.31Å
1248	I	61.9	Low	63.8	Low	71 Å²	71	102.7 Å²	102.7	36%	0.364	53%	0.528	S	S	.	.			trans	-98.6	113	177.3	-55.3	178.8	0	0	0	109.5	C1250 Y1271	I1248-C1250 PolarHBondContact O-N 3.49Å; I1248-Y1271 HydrophobicContact CG2-CD1 3.94Å; I1248-Y1271 HydrophobicContact CG2-CG 4.41Å
1249	P	60.8	Low	63.1	Low	50 Å²	50	101 Å²	101	33%	0.325	53%	0.53	S	S	.	.			trans	-60.1	131.9	176.9	-24.2	34.5	0	0	0	111.7	F1247 S1272	F1247-P1249 WeakPolarHBondContact O-CD 3.31Å; P1249-S1272 PolarHBondContact O-N 3.35Å; P1249-S1272 PolarHBondContact O-OG 3.01Å
1250	C	61.9	Low	62.3	Low	73 Å²	73	104.6 Å²	104.6	49%	0.493	54%	0.541	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	149.7	-178	81.7	0	0	0	0	111.9	I1248 V1269 H1270 Y1271	I1248-C1250 PolarHBondContact O-N 3.49Å; C1250-V1269 HydrophobicContact CB-CG1 3.66Å; C1250-H1270 CarbonylContact C-O 3.49Å; C1250-H1270 WeakPolarHBondContact CA-O 3.42Å; C1250-Y1271 HydrophobicContact CB-CD1 3.48Å; C1250-Y1271 VanDerWaalsContact CB-CD1 3.48Å; C1250-Y1271 HydrophobicContact CB-CE1 3.59Å; C1250-Y1271 HydrophobicContact CB-CG 4.34Å
1251	K	62.5	Low	62	Low	158 Å²	158	103 Å²	103	69%	0.687	55%	0.549	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-130.8	109.7	-177.1	-171.6	171	-174.3	171.6	0	109.8	H1270	K1251-H1270 PolarHBondContact N-O 3.36Å; K1251-H1270 PolarHBondContact O-N 2.75Å
1252	T	65.8	Low	60.9	Low	80 Å²	80	109.2 Å²	109.2	49%	0.491	57%	0.573	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-83.7	124	178.8	-49.6	0	0	0	0	110.7	Y1267 Q1268 V1269	T1252-Y1267 HydrophobicContact CG2-CD1 4.27Å; T1252-Q1268 CarbonylContact C-O 3.54Å; T1252-Q1268 WeakPolarHBondContact CA-O 3.21Å; T1252-V1269 HydrophobicContact CG2-CG2 4.29Å
1253	T	67.2	Low	60.7	Low	48 Å²	48	106 Å²	106	29%	0.294	57%	0.57	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-103.2	144.6	171.2	52	0	0	0	0	109.7	Y1267 Q1268 H1270	T1253-Y1267 CarbonylContact O-C 3.58Å; T1253-Y1267 WeakPolarHBondContact O-CA 3.32Å; T1253-Q1268 PolarHBondContact N-O 2.83Å; T1253-Q1268 PolarHBondContact O-N 3.46Å; T1253-Q1268 PolarHBondContact OG1-O 3.22Å; T1253-H1270 PolarHBondContact OG1-CD2 2.94Å; T1253-H1270 PolarHBondContact OG1-NE2 3.5Å; T1253-H1270 VanDerWaalsContact OG1-NE2 3.09Å
1254	C	61.2	Low	60.8	Low	64 Å²	64	105 Å²	105	43%	0.432	57%	0.57	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-107.9	119.6	177	-179.1	0	0	0	0	109.3	Y1267	C1254-Y1267 HydrophobicContact CB-CD1 3.79Å; C1254-Y1267 HydrophobicContact CB-CE1 3.61Å; C1254-Y1267 WeakPolarHBondContact SG-CE1 3.41Å
1255	L	70	Confident	61.5	Low	90 Å²	90	104 Å²	104	47%	0.471	57%	0.568	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-112.2	107.6	176	-60.6	176.3	0	0	0	108.4	R1266	L1255-R1266 PolarHBondContact N-O 3.13Å; L1255-R1266 PolarHBondContact O-N 2.8Å
1256	S	64.9	Low	61.8	Low	76 Å²	76	102.8 Å²	102.8	53%	0.531	55%	0.554	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-71	136.1	170	-174.8	0	0	0	0	109.5	N1265	S1256-N1265 WeakPolarHBondContact CB-OD1 3.2Å
1257	T	68.1	Low	62.2	Low	73 Å²	73	102 Å²	102	45%	0.448	54%	0.54	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	133	179.2	-61.2	0	0	0	0	109.2	V1264	T1257-V1264 PolarHBondContact N-O 3.35Å; T1257-V1264 PolarHBondContact O-N 2.71Å
1258	E	68.1	Low	62.6	Low	145 Å²	145	100.3 Å²	100.3	68%	0.678	53%	0.534	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.1	126.2	175.6	-64.7	-163	129.6	0	0	111.5	Q1262 A1263	E1258-Q1262 WeakPolarHBondContact CA-O 3.47Å; E1258-A1263 HydrophobicContact CG-CB 4.41Å
1259	L	57.8	Low	62.8	Low	117 Å²	117	99.8 Å²	99.8	61%	0.613	53%	0.534	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120.9	111.5	172.1	-86.1	164.4	0	0	0	108.5	G1261 Q1262 V1264	L1259-G1261 VanDerWaalsContact C-N 3.31Å; L1259-G1261 PolarHBondContact O-N 2.88Å; L1259-Q1262 PolarHBondContact N-O 3.07Å; L1259-Q1262 PolarHBondContact O-N 3.46Å; L1259-V1264 HydrophobicContact CB-CG2 4.48Å
1260	K	50	Low	62.9	Low	200 Å²	200	101.5 Å²	101.5	87%	0.87	54%	0.538	S	S	*	.	T	Hydrogen-bonded Turn	trans	56	37.7	-179.2	-55.8	-179.5	179.9	176.7	0	114.2
1261	G	58.8	Low	63.1	Low	64 Å²	64	102.9 Å²	102.9	66%	0.66	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.1	17.6	176.3	0	0	0	0	0	115	L1259	L1259-G1261 VanDerWaalsContact C-N 3.31Å; L1259-G1261 PolarHBondContact O-N 2.88Å
1262	Q	41.3	Very low	63	Low	149 Å²	149	99.9 Å²	99.9	70%	0.696	53%	0.532	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123	134.3	163.7	-70.3	-175.8	-19.3	0	0	109.5	E1258 L1259 V1264	E1258-Q1262 WeakPolarHBondContact CA-O 3.47Å; L1259-Q1262 PolarHBondContact N-O 3.07Å; L1259-Q1262 PolarHBondContact O-N 3.46Å; Q1262-V1264 PolarHBondContact O-N 3.11Å
1263	A	60.3	Low	62.7	Low	71 Å²	71	98.6 Å²	98.6	59%	0.587	53%	0.526	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.4	120.1	174.2	0	0	0	0	0	110.2	E1258	E1258-A1263 HydrophobicContact CG-CB 4.41Å
1264	V	61.9	Low	62.1	Low	70 Å²	70	102.3 Å²	102.3	42%	0.424	55%	0.554	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-119.6	124.8	-179.4	-176	0	0	0	0	109.2	T1257 L1259 Q1262 R1266	T1257-V1264 PolarHBondContact N-O 3.35Å; T1257-V1264 PolarHBondContact O-N 2.71Å; L1259-V1264 HydrophobicContact CB-CG2 4.48Å; Q1262-V1264 PolarHBondContact O-N 3.11Å; V1264-R1266 PolarHBondContact O-N 3.03Å
1265	N	72.9	Confident	62	Low	83 Å²	83	107.2 Å²	107.2	44%	0.444	57%	0.568	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-78.6	112.4	174.6	-73.2	-22.6	0	0	0	110.2	S1256 Y1267	S1256-N1265 WeakPolarHBondContact CB-OD1 3.2Å; N1265-Y1267 HydrophobicContact CB-CD2 4.5Å; N1265-Y1267 HydrophobicContact CB-CE2 3.65Å
1266	R	63.9	Low	61.3	Low	185 Å²	185	106.1 Å²	106.1	70%	0.698	57%	0.573	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-95.8	116.2	171	-174.2	174.2	-176.8	159.1	2.1	109.5	L1255 V1264	L1255-R1266 PolarHBondContact N-O 3.13Å; L1255-R1266 PolarHBondContact O-N 2.8Å; V1264-R1266 PolarHBondContact O-N 3.03Å
1267	Y	68.1	Low	60.8	Low	144 Å²	144	107 Å²	107	57%	0.565	58%	0.576	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-90	135	176.5	-60.3	-91.8	0	0	0	109.9	T1252 T1253 C1254 N1265	T1252-Y1267 HydrophobicContact CG2-CD1 4.27Å; T1253-Y1267 CarbonylContact O-C 3.58Å; T1253-Y1267 WeakPolarHBondContact O-CA 3.32Å; C1254-Y1267 HydrophobicContact CB-CD1 3.79Å; C1254-Y1267 HydrophobicContact CB-CE1 3.61Å; C1254-Y1267 WeakPolarHBondContact SG-CE1 3.41Å; N1265-Y1267 HydrophobicContact CB-CD2 4.5Å; N1265-Y1267 HydrophobicContact CB-CE2 3.65Å
1268	Q	66.9	Low	60.2	Low	95 Å²	95	109.2 Å²	109.2	44%	0.444	60%	0.595	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-125.4	128.9	176.9	-179.9	168.2	-2.1	0	0	109.6	T1252 T1253	T1252-Q1268 CarbonylContact C-O 3.54Å; T1252-Q1268 WeakPolarHBondContact CA-O 3.21Å; T1253-Q1268 PolarHBondContact N-O 2.83Å; T1253-Q1268 PolarHBondContact O-N 3.46Å; T1253-Q1268 PolarHBondContact OG1-O 3.22Å
1269	V	65.9	Low	59	Low	61 Å²	61	107.4 Å²	107.4	37%	0.37	60%	0.598	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-94.7	123.8	178.1	-174.8	0	0	0	0	109.1	C1250 T1252 Y1271	C1250-V1269 HydrophobicContact CB-CG1 3.66Å; T1252-V1269 HydrophobicContact CG2-CG2 4.29Å; V1269-Y1271 HydrophobicContact CB-CE2 4.43Å; V1269-Y1271 HydrophobicContact CG1-CE1 4.01Å; V1269-Y1271 HydrophobicContact CG1-CE2 3.95Å
1270	H	63	Low	58.2	Low	86 Å²	86	110.8 Å²	110.8	40%	0.398	63%	0.627	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-105.1	121.5	171.2	-59.7	-90.1	0	0	0	109.3	C1250 K1251 T1253	C1250-H1270 CarbonylContact C-O 3.49Å; C1250-H1270 WeakPolarHBondContact CA-O 3.42Å; K1251-H1270 PolarHBondContact N-O 3.36Å; K1251-H1270 PolarHBondContact O-N 2.75Å; T1253-H1270 PolarHBondContact OG1-CD2 2.94Å; T1253-H1270 PolarHBondContact OG1-NE2 3.5Å; T1253-H1270 VanDerWaalsContact OG1-NE2 3.09Å
1271	Y	66.5	Low	58.6	Low	102 Å²	102	106.3 Å²	106.3	40%	0.4	62%	0.615	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-87.1	143.6	172.7	-59.5	-82.4	0	0	0	109.8	I1248 C1250 V1269 S1273 A1276	I1248-Y1271 HydrophobicContact CG2-CD1 3.94Å; I1248-Y1271 HydrophobicContact CG2-CG 4.41Å; C1250-Y1271 HydrophobicContact CB-CD1 3.48Å; C1250-Y1271 VanDerWaalsContact CB-CD1 3.48Å; C1250-Y1271 HydrophobicContact CB-CE1 3.59Å; C1250-Y1271 HydrophobicContact CB-CG 4.34Å; V1269-Y1271 HydrophobicContact CB-CE2 4.43Å; V1269-Y1271 HydrophobicContact CG1-CE1 4.01Å; V1269-Y1271 HydrophobicContact CG1-CE2 3.95Å; Y1271-S1273 VanDerWaalsContact C-N 3.29Å; Y1271-A1276 HydrophobicContact CD2-CB 4.43Å
1272	S	60.9	Low	58.6	Low	94 Å²	94	108.5 Å²	108.5	66%	0.657	61%	0.613	S	S	*	*	S	Bend	trans	-73.9	-20.8	178.4	59.2	0	0	0	0	113.5	P1249	P1249-S1272 PolarHBondContact O-N 3.35Å; P1249-S1272 PolarHBondContact O-OG 3.01Å
1273	S	58.3	Low	59.6	Low	53 Å²	53	106.3 Å²	106.3	37%	0.371	61%	0.608	S	S	.	*	S	Bend	trans	-98.5	146.9	179.7	178.6	0	0	0	0	112.1	Y1271 K1275	Y1271-S1273 VanDerWaalsContact C-N 3.29Å; S1273-K1275 PolarHBondContact O-N 3.3Å; S1273-K1275 PolarHBondContact OG-N 3.5Å
1274	S	55.8	Low	59.6	Low	127 Å²	127	108.4 Å²	108.4	89%	0.888	61%	0.609	S	S	*	*	S	Bend	trans	-71.2	-7.1	176.6	55.8	0	0	0	0	114.4	A1276	S1274-A1276 PolarHBondContact O-N 3.27Å
1275	K	58.4	Low	59.4	Low	166 Å²	166	110.8 Å²	110.8	72%	0.722	62%	0.621	S	S	*	*			trans	-90.9	74.7	172.2	-66.9	-177.4	-178.5	175.5	0	111.2	S1273	S1273-K1275 PolarHBondContact O-N 3.3Å; S1273-K1275 PolarHBondContact OG-N 3.5Å
1276	A	55.9	Low	58.5	Low	68 Å²	68	112.6 Å²	112.6	56%	0.562	63%	0.632	S	S	*	*			trans	-73.7	135.5	165.9	0	0	0	0	0	110.1	Y1271 S1274	Y1271-A1276 HydrophobicContact CD2-CB 4.43Å; S1274-A1276 PolarHBondContact O-N 3.27Å
1277	P	55	Low	58.1	Low	93 Å²	93	107.4 Å²	107.4	60%	0.604	63%	0.628	S	S	*	*			trans	-68.1	137.4	173.1	28.3	-33.7	0	0	0	110.7	S1279	P1277-S1279 PolarHBondContact O-N 3.44Å
1278	S	54.3	Low	57.4	Low	120 Å²	120	104.6 Å²	104.6	84%	0.839	63%	0.633	S	S	*	*			trans	-70.7	113.6	173.2	53.1	0	0	0	0	110.2
1279	S	42.4	Very low	56.6	Low	108 Å²	108	105.4 Å²	105.4	76%	0.755	65%	0.648	S	S	*	*			trans	-62.1	147.4	175.1	-169.2	0	0	0	0	111.7	P1277	P1277-S1279 PolarHBondContact O-N 3.44Å
1280	P	42.5	Very low	55.7	Low	187 Å²	187	109.5 Å²	109.5	100%	1.214	67%	0.674	S	S	*	*			trans	-64.9	0	150.7	33.6	-35.9	0	0	0	111.5

Retrieved 1,280 of 1,280 residues in 608.9 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).